NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
24879 | 2k5c | 15828 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 8 HT1 MET 8 1.845 0.120 0.433 2 H2 MET 8 HT2 MET 8 0.469 0.368 -0.518 3 H3 MET 8 HT3 MET 8 1.447 1.679 -0.090 4 HA MET 8 HA MET 8 1.747 0.942 -2.408 5 HB2 MET 8 HB2 MET 8 3.981 0.987 -0.413 6 HB3 MET 8 HB1 MET 8 4.340 0.617 -2.093 7 HG2 MET 8 HG2 MET 8 3.347 2.747 -2.774 8 HG3 MET 8 HG1 MET 8 2.999 3.117 -1.087 9 HE1 MET 8 HE1 MET 8 4.582 5.574 -1.342 10 HE2 MET 8 HE2 MET 8 4.342 4.975 -2.983 11 HE3 MET 8 HE3 MET 8 5.953 5.447 -2.443 12 H ALA 9 HN ALA 9 2.119 -0.600 -3.850 13 HA ALA 9 HA ALA 9 2.430 -3.385 -2.927 14 HB1 ALA 9 HB1 ALA 9 0.366 -3.248 -4.041 15 HB2 ALA 9 HB2 ALA 9 1.466 -3.884 -5.266 16 HB3 ALA 9 HB3 ALA 9 1.012 -2.181 -5.288 17 H LYS 10 HN LYS 10 3.910 -4.743 -3.851 18 HA LYS 10 HA LYS 10 5.927 -3.593 -5.664 19 HB2 LYS 10 HB2 LYS 10 6.247 -4.534 -2.991 20 HB3 LYS 10 HB1 LYS 10 7.090 -5.646 -4.059 21 HG2 LYS 10 HG2 LYS 10 8.415 -3.861 -4.963 22 HG3 LYS 10 HG1 LYS 10 7.478 -2.663 -4.070 23 HD2 LYS 10 HD2 LYS 10 8.242 -3.692 -1.954 24 HD3 LYS 10 HD1 LYS 10 9.239 -4.812 -2.884 25 HE2 LYS 10 HE2 LYS 10 9.543 -1.834 -3.190 26 HE3 LYS 10 HE1 LYS 10 10.366 -2.698 -1.895 27 HZ1 LYS 10 HZ1 LYS 10 10.919 -4.134 -4.171 28 HZ2 LYS 10 HZ2 LYS 10 11.970 -3.084 -3.363 29 HZ3 LYS 10 HZ3 LYS 10 11.041 -2.517 -4.658 30 H CYS 11 HN CYS 11 6.610 -4.798 -7.337 31 HA CYS 11 HA CYS 11 5.134 -7.092 -8.210 32 HB2 CYS 11 HB2 CYS 11 6.138 -5.314 -9.733 33 HB3 CYS 11 HB1 CYS 11 7.690 -6.064 -9.456 34 HA PRO 12 HA PRO 12 7.965 -10.222 -6.313 35 HB2 PRO 12 HB2 PRO 12 6.670 -12.522 -7.004 36 HB3 PRO 12 HB1 PRO 12 6.133 -11.486 -5.679 37 HG2 PRO 12 HG2 PRO 12 5.061 -11.696 -8.482 38 HG3 PRO 12 HG1 PRO 12 4.168 -11.526 -6.955 39 HD2 PRO 12 HD2 PRO 12 4.661 -9.417 -8.652 40 HD3 PRO 12 HD1 PRO 12 4.459 -9.227 -6.903 41 H ILE 13 HN ILE 13 7.662 -9.568 -9.601 42 HA ILE 13 HA ILE 13 9.414 -11.721 -10.556 43 HB ILE 13 HB ILE 13 8.010 -9.665 -12.339 44 HG12 ILE 13 HG12 ILE 13 6.717 -12.214 -12.630 45 HG13 ILE 13 HG11 ILE 13 6.684 -11.787 -10.923 46 HG21 ILE 13 HG21 ILE 13 8.195 -11.508 -14.089 47 HG22 ILE 13 HG22 ILE 13 9.234 -12.376 -12.960 48 HG23 ILE 13 HG23 ILE 13 9.727 -10.799 -13.576 49 HD11 ILE 13 HD11 ILE 13 5.734 -9.980 -13.135 50 HD12 ILE 13 HD12 ILE 13 5.545 -9.738 -11.398 51 HD13 ILE 13 HD13 ILE 13 4.690 -11.054 -12.203 52 H CYS 14 HN CYS 14 9.068 -8.099 -10.752 53 HA CYS 14 HA CYS 14 11.937 -7.900 -11.371 54 HB2 CYS 14 HB2 CYS 14 11.466 -5.723 -12.357 55 HB3 CYS 14 HB1 CYS 14 10.463 -6.971 -13.068 56 H GLY 15 HN GLY 15 9.429 -6.536 -9.259 57 HA2 GLY 15 HA2 GLY 15 9.671 -5.911 -7.002 58 HA3 GLY 15 HA1 GLY 15 11.409 -5.858 -7.215 59 H SER 16 HN SER 16 9.028 -4.201 -9.268 60 HA SER 16 HA SER 16 10.245 -1.616 -8.608 61 HB2 SER 16 HB2 SER 16 8.784 -2.717 -10.929 62 HB3 SER 16 HB1 SER 16 8.515 -1.007 -10.590 63 HG SER 16 HG SER 16 11.071 -1.296 -10.369 64 HA PRO 17 HA PRO 17 6.675 -0.274 -6.053 65 HB2 PRO 17 HB2 PRO 17 6.922 2.521 -6.992 66 HB3 PRO 17 HB1 PRO 17 7.094 1.885 -5.351 67 HG2 PRO 17 HG2 PRO 17 9.246 2.726 -6.667 68 HG3 PRO 17 HG1 PRO 17 9.323 1.230 -5.709 69 HD2 PRO 17 HD2 PRO 17 8.896 1.526 -8.686 70 HD3 PRO 17 HD1 PRO 17 10.092 0.531 -7.830 71 H LEU 18 HN LEU 18 4.572 -0.110 -6.123 72 HA LEU 18 HA LEU 18 3.157 0.823 -8.536 73 HB2 LEU 18 HB2 LEU 18 2.671 -1.689 -6.932 74 HB3 LEU 18 HB1 LEU 18 1.435 -0.986 -7.961 75 HG LEU 18 HG LEU 18 4.007 -1.471 -9.320 76 HD11 LEU 18 HD11 LEU 18 2.387 -3.756 -8.216 77 HD12 LEU 18 HD12 LEU 18 4.082 -3.393 -7.896 78 HD13 LEU 18 HD13 LEU 18 3.580 -3.909 -9.505 79 HD21 LEU 18 HD21 LEU 18 1.811 -0.785 -10.370 80 HD22 LEU 18 HD22 LEU 18 1.222 -2.406 -10.003 81 HD23 LEU 18 HD23 LEU 18 2.591 -2.193 -11.094 82 H LYS 19 HN LYS 19 1.205 1.847 -8.218 83 HA LYS 19 HA LYS 19 0.655 2.832 -5.504 84 HB2 LYS 19 HB2 LYS 19 0.009 3.879 -8.253 85 HB3 LYS 19 HB1 LYS 19 -0.862 4.462 -6.847 86 HG2 LYS 19 HG2 LYS 19 1.202 5.296 -5.878 87 HG3 LYS 19 HG1 LYS 19 2.125 4.636 -7.231 88 HD2 LYS 19 HD2 LYS 19 0.868 6.093 -8.769 89 HD3 LYS 19 HD1 LYS 19 0.002 6.777 -7.392 90 HE2 LYS 19 HE2 LYS 19 2.087 7.622 -6.476 91 HE3 LYS 19 HE1 LYS 19 2.989 6.884 -7.799 92 HZ1 LYS 19 HZ1 LYS 19 0.845 8.844 -8.326 93 HZ2 LYS 19 HZ2 LYS 19 2.133 8.389 -9.324 94 HZ3 LYS 19 HZ3 LYS 19 2.418 9.351 -7.963 95 H TRP 20 HN TRP 20 -1.181 2.442 -4.438 96 HA TRP 20 HA TRP 20 -3.015 0.400 -5.221 97 HB2 TRP 20 HB2 TRP 20 -2.746 2.171 -2.837 98 HB3 TRP 20 HB1 TRP 20 -4.256 1.293 -3.074 99 HD1 TRP 20 HD1 TRP 20 -0.631 0.809 -2.108 100 HE1 TRP 20 HE1 TRP 20 -0.226 -1.604 -1.327 101 HE3 TRP 20 HE3 TRP 20 -5.157 -1.299 -3.410 102 HZ2 TRP 20 HZ2 TRP 20 -1.601 -4.066 -1.262 103 HZ3 TRP 20 HZ3 TRP 20 -5.504 -3.685 -2.935 104 HH2 TRP 20 HH2 TRP 20 -3.762 -5.034 -1.877 105 H GLU 21 HN GLU 21 -3.096 3.848 -5.548 106 HA GLU 21 HA GLU 21 -5.875 4.335 -5.994 107 HB2 GLU 21 HB2 GLU 21 -3.361 5.878 -6.573 108 HB3 GLU 21 HB1 GLU 21 -4.913 6.447 -7.167 109 HG2 GLU 21 HG2 GLU 21 -5.752 6.539 -4.866 110 HG3 GLU 21 HG1 GLU 21 -4.184 5.982 -4.281 111 H GLU 22 HN GLU 22 -3.230 3.319 -8.128 112 HA GLU 22 HA GLU 22 -4.509 3.819 -10.662 113 HB2 GLU 22 HB2 GLU 22 -2.029 2.360 -9.813 114 HB3 GLU 22 HB1 GLU 22 -2.622 2.205 -11.460 115 HG2 GLU 22 HG2 GLU 22 -2.462 4.638 -11.739 116 HG3 GLU 22 HG1 GLU 22 -1.851 4.779 -10.092 117 H LEU 23 HN LEU 23 -4.272 1.013 -8.527 118 HA LEU 23 HA LEU 23 -5.286 -1.030 -10.224 119 HB2 LEU 23 HB2 LEU 23 -4.901 -0.721 -7.271 120 HB3 LEU 23 HB1 LEU 23 -5.761 -2.115 -7.894 121 HG LEU 23 HG LEU 23 -3.230 -1.706 -9.269 122 HD11 LEU 23 HD11 LEU 23 -2.434 -0.789 -7.217 123 HD12 LEU 23 HD12 LEU 23 -1.845 -2.446 -7.329 124 HD13 LEU 23 HD13 LEU 23 -3.209 -2.064 -6.275 125 HD21 LEU 23 HD21 LEU 23 -4.651 -3.744 -9.307 126 HD22 LEU 23 HD22 LEU 23 -4.247 -4.007 -7.610 127 HD23 LEU 23 HD23 LEU 23 -2.980 -4.051 -8.836 128 H ILE 24 HN ILE 24 -6.905 1.114 -7.878 129 HA ILE 24 HA ILE 24 -9.547 -0.023 -8.086 130 HB ILE 24 HB ILE 24 -9.012 2.758 -6.972 131 HG12 ILE 24 HG12 ILE 24 -7.411 1.598 -5.620 132 HG13 ILE 24 HG11 ILE 24 -8.829 1.751 -4.615 133 HG21 ILE 24 HG21 ILE 24 -11.113 0.765 -6.095 134 HG22 ILE 24 HG22 ILE 24 -11.380 2.095 -7.220 135 HG23 ILE 24 HG23 ILE 24 -10.945 2.433 -5.542 136 HD11 ILE 24 HD11 ILE 24 -8.367 -0.391 -4.061 137 HD12 ILE 24 HD12 ILE 24 -7.375 -0.655 -5.494 138 HD13 ILE 24 HD13 ILE 24 -9.128 -0.801 -5.599 139 H GLU 25 HN GLU 25 -7.909 2.811 -9.536 140 HA GLU 25 HA GLU 25 -10.094 3.986 -10.916 141 HB2 GLU 25 HB2 GLU 25 -7.468 4.653 -10.384 142 HB3 GLU 25 HB1 GLU 25 -7.478 4.443 -12.126 143 HG2 GLU 25 HG2 GLU 25 -9.313 6.049 -12.308 144 HG3 GLU 25 HG1 GLU 25 -9.296 6.259 -10.558 145 H GLU 26 HN GLU 26 -7.726 1.518 -11.907 146 HA GLU 26 HA GLU 26 -8.483 1.363 -14.687 147 HB2 GLU 26 HB2 GLU 26 -6.669 -0.194 -12.881 148 HB3 GLU 26 HB1 GLU 26 -7.044 -0.762 -14.480 149 HG2 GLU 26 HG2 GLU 26 -6.124 1.295 -15.452 150 HG3 GLU 26 HG1 GLU 26 -5.715 1.857 -13.831 151 H MET 27 HN MET 27 -9.596 -0.098 -11.738 152 HA MET 27 HA MET 27 -10.869 -2.350 -13.108 153 HB2 MET 27 HB2 MET 27 -9.976 -1.948 -10.271 154 HB3 MET 27 HB1 MET 27 -11.204 -3.141 -10.644 155 HG2 MET 27 HG2 MET 27 -9.661 -4.290 -12.143 156 HG3 MET 27 HG1 MET 27 -8.427 -3.078 -11.810 157 HE1 MET 27 HE1 MET 27 -9.826 -6.498 -9.128 158 HE2 MET 27 HE2 MET 27 -9.405 -6.688 -10.829 159 HE3 MET 27 HE3 MET 27 -10.781 -5.687 -10.369 160 H LEU 28 HN LEU 28 -11.693 0.723 -12.292 161 HA LEU 28 HA LEU 28 -14.289 0.374 -11.064 162 HB2 LEU 28 HB2 LEU 28 -12.435 2.372 -11.093 163 HB3 LEU 28 HB1 LEU 28 -13.584 2.989 -12.261 164 HG LEU 28 HG LEU 28 -15.254 2.327 -10.201 165 HD11 LEU 28 HD11 LEU 28 -12.795 3.469 -8.885 166 HD12 LEU 28 HD12 LEU 28 -13.246 1.766 -8.798 167 HD13 LEU 28 HD13 LEU 28 -14.313 2.996 -8.120 168 HD21 LEU 28 HD21 LEU 28 -15.350 4.393 -11.397 169 HD22 LEU 28 HD22 LEU 28 -13.801 4.908 -10.730 170 HD23 LEU 28 HD23 LEU 28 -15.207 4.754 -9.677 171 H ILE 29 HN ILE 29 -13.573 -0.559 -13.970 172 HA ILE 29 HA ILE 29 -15.610 0.719 -15.613 173 HB ILE 29 HB ILE 29 -14.761 -0.873 -17.439 174 HG12 ILE 29 HG12 ILE 29 -12.038 -1.053 -16.559 175 HG13 ILE 29 HG11 ILE 29 -13.044 -1.877 -15.372 176 HG21 ILE 29 HG21 ILE 29 -12.992 1.277 -16.331 177 HG22 ILE 29 HG22 ILE 29 -14.317 1.471 -17.478 178 HG23 ILE 29 HG23 ILE 29 -12.856 0.608 -17.957 179 HD11 ILE 29 HD11 ILE 29 -12.869 -2.447 -18.322 180 HD12 ILE 29 HD12 ILE 29 -14.045 -3.187 -17.235 181 HD13 ILE 29 HD13 ILE 29 -12.320 -3.470 -16.994 182 H ILE 30 HN ILE 30 -15.585 -1.830 -13.484 183 HA ILE 30 HA ILE 30 -17.643 -3.471 -14.825 184 HB ILE 30 HB ILE 30 -16.448 -4.234 -12.120 185 HG12 ILE 30 HG12 ILE 30 -15.205 -5.823 -14.174 186 HG13 ILE 30 HG11 ILE 30 -14.885 -4.128 -14.517 187 HG21 ILE 30 HG21 ILE 30 -17.422 -6.076 -14.321 188 HG22 ILE 30 HG22 ILE 30 -18.461 -5.469 -13.032 189 HG23 ILE 30 HG23 ILE 30 -17.079 -6.490 -12.640 190 HD11 ILE 30 HD11 ILE 30 -14.212 -5.629 -11.994 191 HD12 ILE 30 HD12 ILE 30 -14.012 -3.887 -12.201 192 HD13 ILE 30 HD13 ILE 30 -13.090 -5.007 -13.204 193 H GLU 31 HN GLU 31 -19.700 -3.609 -14.107 194 HA GLU 31 HA GLU 31 -20.795 -1.568 -12.408 195 HB2 GLU 31 HB2 GLU 31 -21.989 -3.775 -14.032 196 HB3 GLU 31 HB1 GLU 31 -22.982 -2.924 -12.859 197 HG2 GLU 31 HG2 GLU 31 -22.468 -0.802 -13.983 198 HG3 GLU 31 HG1 GLU 31 -21.510 -1.680 -15.176 199 H ASN 32 HN ASN 32 -20.016 -4.937 -11.907 200 HA ASN 32 HA ASN 32 -21.503 -5.455 -9.519 201 HB2 ASN 32 HB2 ASN 32 -19.237 -6.792 -10.946 202 HB3 ASN 32 HB1 ASN 32 -19.629 -7.294 -9.305 203 HD21 ASN 32 HD21 ASN 32 -21.609 -8.265 -8.887 204 HD22 ASN 32 HD22 ASN 32 -22.580 -8.940 -10.146 205 H PHE 33 HN PHE 33 -18.479 -3.886 -10.131 206 HA PHE 33 HA PHE 33 -17.010 -4.031 -7.794 207 HB2 PHE 33 HB2 PHE 33 -16.679 -2.767 -10.166 208 HB3 PHE 33 HB1 PHE 33 -16.916 -1.401 -9.104 209 HD1 PHE 33 HD2 PHE 33 -14.718 -4.283 -9.840 210 HD2 PHE 33 HD1 PHE 33 -15.259 -0.786 -7.451 211 HE1 PHE 33 HE2 PHE 33 -12.384 -4.438 -9.082 212 HE2 PHE 33 HE1 PHE 33 -12.922 -0.940 -6.702 213 HZ PHE 33 HZ PHE 33 -11.480 -2.761 -7.520 214 H GLU 34 HN GLU 34 -19.712 -1.879 -8.450 215 HA GLU 34 HA GLU 34 -19.621 -0.140 -6.211 216 HB2 GLU 34 HB2 GLU 34 -21.866 -1.036 -8.002 217 HB3 GLU 34 HB1 GLU 34 -22.166 0.029 -6.640 218 HG2 GLU 34 HG2 GLU 34 -20.662 1.691 -7.579 219 HG3 GLU 34 HG1 GLU 34 -20.294 0.616 -8.927 220 H GLU 35 HN GLU 35 -20.774 -3.414 -6.558 221 HA GLU 35 HA GLU 35 -22.153 -3.600 -3.987 222 HB2 GLU 35 HB2 GLU 35 -21.762 -5.395 -6.343 223 HB3 GLU 35 HB1 GLU 35 -22.140 -6.133 -4.791 224 HG2 GLU 35 HG2 GLU 35 -23.864 -3.873 -5.642 225 HG3 GLU 35 HG1 GLU 35 -24.047 -5.388 -6.524 226 H ILE 36 HN ILE 36 -19.056 -4.577 -5.402 227 HA ILE 36 HA ILE 36 -18.119 -6.251 -3.247 228 HB ILE 36 HB ILE 36 -16.436 -5.047 -5.515 229 HG12 ILE 36 HG12 ILE 36 -16.959 -7.948 -5.606 230 HG13 ILE 36 HG11 ILE 36 -18.421 -6.990 -5.770 231 HG21 ILE 36 HG21 ILE 36 -14.576 -6.253 -4.832 232 HG22 ILE 36 HG22 ILE 36 -15.553 -7.620 -4.293 233 HG23 ILE 36 HG23 ILE 36 -15.380 -6.204 -3.259 234 HD11 ILE 36 HD11 ILE 36 -16.128 -6.252 -7.511 235 HD12 ILE 36 HD12 ILE 36 -17.859 -6.262 -7.849 236 HD13 ILE 36 HD13 ILE 36 -16.953 -7.772 -7.848 237 H VAL 37 HN VAL 37 -17.681 -2.807 -4.098 238 HA VAL 37 HA VAL 37 -15.699 -2.078 -2.227 239 HB VAL 37 HB VAL 37 -16.463 0.331 -2.501 240 HG11 VAL 37 HG11 VAL 37 -15.795 -1.240 -4.979 241 HG12 VAL 37 HG12 VAL 37 -14.659 -0.591 -3.794 242 HG13 VAL 37 HG13 VAL 37 -15.614 0.505 -4.794 243 HG21 VAL 37 HG21 VAL 37 -18.619 -0.929 -4.165 244 HG22 VAL 37 HG22 VAL 37 -17.860 0.536 -4.785 245 HG23 VAL 37 HG23 VAL 37 -18.665 0.560 -3.215 246 H LYS 38 HN LYS 38 -19.028 -2.656 -1.650 247 HA LYS 38 HA LYS 38 -19.268 -1.274 0.885 248 HB2 LYS 38 HB2 LYS 38 -21.052 -2.971 -0.812 249 HB3 LYS 38 HB1 LYS 38 -21.470 -2.734 0.881 250 HG2 LYS 38 HG2 LYS 38 -21.524 -0.319 0.538 251 HG3 LYS 38 HG1 LYS 38 -21.051 -0.540 -1.148 252 HD2 LYS 38 HD2 LYS 38 -23.107 -1.807 -1.556 253 HD3 LYS 38 HD1 LYS 38 -23.576 -1.590 0.132 254 HE2 LYS 38 HE2 LYS 38 -23.625 0.831 -0.192 255 HE3 LYS 38 HE1 LYS 38 -23.146 0.619 -1.876 256 HZ1 LYS 38 HZ1 LYS 38 -25.704 0.696 -0.909 257 HZ2 LYS 38 HZ2 LYS 38 -25.437 -0.944 -1.220 258 HZ3 LYS 38 HZ3 LYS 38 -25.232 0.194 -2.454 259 H ASP 39 HN ASP 39 -18.170 -4.432 -0.083 260 HA ASP 39 HA ASP 39 -18.111 -5.363 2.699 261 HB2 ASP 39 HB2 ASP 39 -19.015 -6.897 0.269 262 HB3 ASP 39 HB1 ASP 39 -18.332 -7.743 1.651 263 H ARG 40 HN ARG 40 -16.114 -5.203 3.272 264 HA ARG 40 HA ARG 40 -13.747 -5.429 1.839 265 HB2 ARG 40 HB2 ARG 40 -12.598 -5.775 4.096 266 HB3 ARG 40 HB1 ARG 40 -13.539 -4.316 3.898 267 HG2 ARG 40 HG2 ARG 40 -15.143 -6.407 5.134 268 HG3 ARG 40 HG1 ARG 40 -13.681 -6.081 6.070 269 HD2 ARG 40 HD2 ARG 40 -14.211 -3.721 6.131 270 HD3 ARG 40 HD1 ARG 40 -15.615 -3.981 5.098 271 HE ARG 40 HE ARG 40 -15.828 -5.580 7.413 272 HH11 ARG 40 HH11 ARG 40 -16.194 -2.102 6.603 273 HH12 ARG 40 HH12 ARG 40 -17.284 -1.831 7.920 274 HH21 ARG 40 HH21 ARG 40 -17.242 -5.121 9.077 275 HH22 ARG 40 HH22 ARG 40 -17.866 -3.520 9.300 276 H GLU 41 HN GLU 41 -15.495 -8.092 3.316 277 HA GLU 41 HA GLU 41 -13.504 -10.117 3.193 278 HB2 GLU 41 HB2 GLU 41 -16.036 -9.854 4.236 279 HB3 GLU 41 HB1 GLU 41 -16.262 -11.039 2.963 280 HG2 GLU 41 HG2 GLU 41 -14.541 -12.449 3.942 281 HG3 GLU 41 HG1 GLU 41 -14.239 -11.239 5.188 282 H ARG 42 HN ARG 42 -15.848 -8.961 0.818 283 HA ARG 42 HA ARG 42 -15.418 -11.066 -1.131 284 HB2 ARG 42 HB2 ARG 42 -17.038 -8.531 -1.156 285 HB3 ARG 42 HB1 ARG 42 -16.792 -9.468 -2.618 286 HG2 ARG 42 HG2 ARG 42 -17.868 -11.400 -1.579 287 HG3 ARG 42 HG1 ARG 42 -18.078 -10.489 -0.085 288 HD2 ARG 42 HD2 ARG 42 -20.176 -10.363 -1.158 289 HD3 ARG 42 HD1 ARG 42 -19.407 -8.815 -1.500 290 HE ARG 42 HE ARG 42 -18.986 -10.795 -3.555 291 HH11 ARG 42 HH11 ARG 42 -21.313 -8.240 -2.614 292 HH12 ARG 42 HH12 ARG 42 -21.916 -8.082 -4.230 293 HH21 ARG 42 HH21 ARG 42 -19.831 -10.513 -5.608 294 HH22 ARG 42 HH22 ARG 42 -21.085 -9.354 -5.900 295 H PHE 43 HN PHE 43 -14.272 -7.734 -0.632 296 HA PHE 43 HA PHE 43 -13.032 -7.321 -3.175 297 HB2 PHE 43 HB2 PHE 43 -13.766 -5.584 -1.306 298 HB3 PHE 43 HB1 PHE 43 -12.121 -5.808 -0.739 299 HD1 PHE 43 HD2 PHE 43 -10.191 -5.227 -2.322 300 HD2 PHE 43 HD1 PHE 43 -14.239 -4.142 -3.138 301 HE1 PHE 43 HE2 PHE 43 -9.420 -3.537 -3.933 302 HE2 PHE 43 HE1 PHE 43 -13.462 -2.457 -4.749 303 HZ PHE 43 HZ PHE 43 -11.055 -2.152 -5.144 304 H LEU 44 HN LEU 44 -11.712 -8.391 0.008 305 HA LEU 44 HA LEU 44 -8.952 -8.547 -0.765 306 HB2 LEU 44 HB2 LEU 44 -10.538 -9.411 1.609 307 HB3 LEU 44 HB1 LEU 44 -8.934 -10.076 1.387 308 HG LEU 44 HG LEU 44 -9.017 -7.151 1.159 309 HD11 LEU 44 HD11 LEU 44 -9.264 -6.779 3.570 310 HD12 LEU 44 HD12 LEU 44 -9.736 -8.465 3.774 311 HD13 LEU 44 HD13 LEU 44 -10.751 -7.371 2.833 312 HD21 LEU 44 HD21 LEU 44 -7.421 -8.983 2.948 313 HD22 LEU 44 HD22 LEU 44 -7.048 -7.312 2.526 314 HD23 LEU 44 HD23 LEU 44 -6.971 -8.571 1.294 315 H ALA 45 HN ALA 45 -11.594 -10.860 -0.661 316 HA ALA 45 HA ALA 45 -10.133 -13.267 -1.257 317 HB1 ALA 45 HB1 ALA 45 -13.082 -12.721 -1.550 318 HB2 ALA 45 HB2 ALA 45 -12.280 -13.285 -0.084 319 HB3 ALA 45 HB3 ALA 45 -12.308 -14.305 -1.522 320 H GLN 46 HN GLN 46 -11.679 -10.803 -3.227 321 HA GLN 46 HA GLN 46 -11.622 -12.199 -5.749 322 HB2 GLN 46 HB2 GLN 46 -12.880 -9.896 -4.736 323 HB3 GLN 46 HB1 GLN 46 -11.849 -9.350 -6.053 324 HG2 GLN 46 HG2 GLN 46 -12.897 -10.910 -7.571 325 HG3 GLN 46 HG1 GLN 46 -13.877 -11.568 -6.261 326 HE21 GLN 46 HE21 GLN 46 -13.634 -9.222 -8.682 327 HE22 GLN 46 HE22 GLN 46 -15.051 -8.313 -8.293 328 H VAL 47 HN VAL 47 -9.520 -9.838 -4.126 329 HA VAL 47 HA VAL 47 -7.751 -9.261 -6.322 330 HB VAL 47 HB VAL 47 -7.399 -8.743 -3.318 331 HG11 VAL 47 HG11 VAL 47 -5.139 -8.808 -4.525 332 HG12 VAL 47 HG12 VAL 47 -5.525 -7.310 -3.674 333 HG13 VAL 47 HG13 VAL 47 -5.699 -7.397 -5.425 334 HG21 VAL 47 HG21 VAL 47 -7.837 -6.403 -3.859 335 HG22 VAL 47 HG22 VAL 47 -9.177 -7.436 -4.359 336 HG23 VAL 47 HG23 VAL 47 -8.038 -6.826 -5.560 337 H GLU 48 HN GLU 48 -7.679 -11.648 -3.658 338 HA GLU 48 HA GLU 48 -5.108 -12.825 -4.137 339 HB2 GLU 48 HB2 GLU 48 -7.523 -13.753 -2.579 340 HB3 GLU 48 HB1 GLU 48 -6.060 -14.711 -2.697 341 HG2 GLU 48 HG2 GLU 48 -4.807 -12.831 -1.658 342 HG3 GLU 48 HG1 GLU 48 -6.341 -11.983 -1.456 343 H GLU 49 HN GLU 49 -8.370 -13.556 -5.289 344 HA GLU 49 HA GLU 49 -7.747 -16.091 -6.555 345 HB2 GLU 49 HB2 GLU 49 -10.193 -14.399 -6.246 346 HB3 GLU 49 HB1 GLU 49 -10.174 -15.660 -7.470 347 HG2 GLU 49 HG2 GLU 49 -9.329 -16.457 -4.741 348 HG3 GLU 49 HG1 GLU 49 -11.041 -16.098 -4.963 349 H PHE 50 HN PHE 50 -7.937 -12.758 -7.569 350 HA PHE 50 HA PHE 50 -7.862 -13.398 -10.445 351 HB2 PHE 50 HB2 PHE 50 -9.194 -11.389 -9.022 352 HB3 PHE 50 HB1 PHE 50 -7.853 -10.550 -9.784 353 HD1 PHE 50 HD2 PHE 50 -7.740 -10.329 -12.214 354 HD2 PHE 50 HD1 PHE 50 -10.997 -12.342 -10.337 355 HE1 PHE 50 HE2 PHE 50 -9.031 -10.188 -14.303 356 HE2 PHE 50 HE1 PHE 50 -12.288 -12.196 -12.425 357 HZ PHE 50 HZ PHE 50 -11.306 -11.121 -14.409 358 H VAL 51 HN VAL 51 -6.276 -12.457 -11.830 359 HA VAL 51 HA VAL 51 -3.713 -11.937 -10.512 360 HB VAL 51 HB VAL 51 -4.051 -14.083 -11.887 361 HG11 VAL 51 HG11 VAL 51 -5.012 -12.979 -13.954 362 HG12 VAL 51 HG12 VAL 51 -3.761 -14.197 -14.212 363 HG13 VAL 51 HG13 VAL 51 -3.357 -12.481 -14.331 364 HG21 VAL 51 HG21 VAL 51 -1.894 -13.608 -11.106 365 HG22 VAL 51 HG22 VAL 51 -1.667 -12.313 -12.281 366 HG23 VAL 51 HG23 VAL 51 -1.711 -13.991 -12.820 367 H PHE 52 HN PHE 52 -2.310 -10.311 -11.336 368 HA PHE 52 HA PHE 52 -3.609 -8.149 -12.882 369 HB2 PHE 52 HB2 PHE 52 -1.745 -7.793 -10.507 370 HB3 PHE 52 HB1 PHE 52 -2.402 -6.494 -11.480 371 HD1 PHE 52 HD2 PHE 52 -4.759 -5.823 -11.241 372 HD2 PHE 52 HD1 PHE 52 -3.068 -8.895 -8.822 373 HE1 PHE 52 HE2 PHE 52 -6.657 -5.640 -9.685 374 HE2 PHE 52 HE1 PHE 52 -4.959 -8.717 -7.266 375 HZ PHE 52 HZ PHE 52 -6.758 -7.085 -7.691 376 H LYS 53 HN LYS 53 -2.215 -6.796 -14.144 377 HA LYS 53 HA LYS 53 0.244 -8.125 -15.090 378 HB2 LYS 53 HB2 LYS 53 -1.688 -6.229 -16.413 379 HB3 LYS 53 HB1 LYS 53 -0.082 -6.487 -17.073 380 HG2 LYS 53 HG2 LYS 53 -0.560 -8.855 -17.375 381 HG3 LYS 53 HG1 LYS 53 -2.151 -8.641 -16.640 382 HD2 LYS 53 HD2 LYS 53 -2.751 -7.084 -18.453 383 HD3 LYS 53 HD1 LYS 53 -1.178 -7.371 -19.200 384 HE2 LYS 53 HE2 LYS 53 -1.717 -9.728 -19.471 385 HE3 LYS 53 HE1 LYS 53 -3.269 -9.481 -18.671 386 HZ1 LYS 53 HZ1 LYS 53 -2.398 -8.563 -21.336 387 HZ2 LYS 53 HZ2 LYS 53 -3.666 -7.785 -20.532 388 HZ3 LYS 53 HZ3 LYS 53 -3.789 -9.428 -20.912 389 H CYS 54 HN CYS 54 2.196 -7.098 -15.249 390 HA CYS 54 HA CYS 54 2.533 -4.623 -13.712 391 HB2 CYS 54 HB2 CYS 54 3.904 -6.672 -13.134 392 HB3 CYS 54 HB1 CYS 54 4.711 -6.497 -14.684 393 HA PRO 55 HA PRO 55 3.246 -2.481 -17.754 394 HB2 PRO 55 HB2 PRO 55 3.419 0.101 -16.888 395 HB3 PRO 55 HB1 PRO 55 1.880 -0.736 -17.109 396 HG2 PRO 55 HG2 PRO 55 3.389 -0.167 -14.575 397 HG3 PRO 55 HG1 PRO 55 1.637 -0.148 -14.863 398 HD2 PRO 55 HD2 PRO 55 2.978 -2.245 -13.647 399 HD3 PRO 55 HD1 PRO 55 1.438 -2.422 -14.504 400 H VAL 56 HN VAL 56 5.466 -2.773 -15.190 401 HA VAL 56 HA VAL 56 7.655 -1.220 -16.367 402 HB VAL 56 HB VAL 56 8.270 -2.973 -13.995 403 HG11 VAL 56 HG11 VAL 56 9.728 -1.179 -13.319 404 HG12 VAL 56 HG12 VAL 56 9.051 -0.107 -14.545 405 HG13 VAL 56 HG13 VAL 56 9.985 -1.521 -15.031 406 HG21 VAL 56 HG21 VAL 56 7.520 -0.592 -12.735 407 HG22 VAL 56 HG22 VAL 56 6.661 -2.128 -12.608 408 HG23 VAL 56 HG23 VAL 56 6.169 -0.937 -13.811 409 H CYS 57 HN CYS 57 7.043 -4.666 -15.510 410 HA CYS 57 HA CYS 57 9.232 -5.497 -17.267 411 HB2 CYS 57 HB2 CYS 57 9.172 -7.660 -16.127 412 HB3 CYS 57 HB1 CYS 57 9.375 -6.333 -15.000 413 H GLY 58 HN GLY 58 5.807 -6.447 -16.602 414 HA2 GLY 58 HA2 GLY 58 4.309 -6.438 -18.617 415 HA3 GLY 58 HA1 GLY 58 5.587 -7.312 -19.433 416 H GLU 59 HN GLU 59 5.868 -8.795 -16.642 417 HA GLU 59 HA GLU 59 4.185 -11.058 -17.302 418 HB2 GLU 59 HB2 GLU 59 6.489 -10.542 -15.511 419 HB3 GLU 59 HB1 GLU 59 5.394 -11.825 -15.014 420 HG2 GLU 59 HG2 GLU 59 5.697 -12.928 -17.168 421 HG3 GLU 59 HG1 GLU 59 6.781 -11.636 -17.680 422 H GLU 60 HN GLU 60 2.767 -12.169 -15.843 423 HA GLU 60 HA GLU 60 0.974 -10.414 -14.346 424 HB2 GLU 60 HB2 GLU 60 0.784 -13.211 -15.429 425 HB3 GLU 60 HB1 GLU 60 -0.391 -12.615 -14.270 426 HG2 GLU 60 HG2 GLU 60 -1.072 -10.861 -15.773 427 HG3 GLU 60 HG1 GLU 60 0.205 -11.287 -16.910 428 H PHE 61 HN PHE 61 0.487 -10.527 -12.219 429 HA PHE 61 HA PHE 61 1.840 -12.458 -10.483 430 HB2 PHE 61 HB2 PHE 61 2.361 -10.669 -8.822 431 HB3 PHE 61 HB1 PHE 61 3.228 -10.459 -10.326 432 HD1 PHE 61 HD2 PHE 61 2.747 -8.523 -11.775 433 HD2 PHE 61 HD1 PHE 61 0.722 -9.067 -8.071 434 HE1 PHE 61 HE2 PHE 61 1.965 -6.188 -11.856 435 HE2 PHE 61 HE1 PHE 61 -0.059 -6.735 -8.150 436 HZ PHE 61 HZ PHE 61 0.563 -5.295 -10.046 437 H TYR 62 HN TYR 62 0.686 -13.125 -8.672 438 HA TYR 62 HA TYR 62 -2.197 -12.602 -8.746 439 HB2 TYR 62 HB2 TYR 62 -0.532 -14.841 -7.584 440 HB3 TYR 62 HB1 TYR 62 -2.236 -14.667 -7.207 441 HD1 TYR 62 HD2 TYR 62 -3.945 -15.100 -8.957 442 HD2 TYR 62 HD1 TYR 62 0.206 -15.632 -9.747 443 HE1 TYR 62 HE2 TYR 62 -4.498 -16.413 -10.957 444 HE2 TYR 62 HE1 TYR 62 -0.342 -16.947 -11.751 445 HH TYR 62 HH TYR 62 -3.405 -18.168 -12.371 446 H GLY 63 HN GLY 63 -3.450 -12.205 -6.872 447 HA2 GLY 63 HA2 GLY 63 -2.288 -10.464 -4.875 448 HA3 GLY 63 HA1 GLY 63 -3.977 -10.905 -5.012 449 H LYS 64 HN LYS 64 -2.606 -13.783 -5.000 450 HA LYS 64 HA LYS 64 -2.947 -14.368 -2.158 451 HB2 LYS 64 HB2 LYS 64 -3.626 -15.772 -4.378 452 HB3 LYS 64 HB1 LYS 64 -2.089 -16.532 -3.999 453 HG2 LYS 64 HG2 LYS 64 -2.882 -17.174 -1.816 454 HG3 LYS 64 HG1 LYS 64 -4.380 -16.276 -2.050 455 HD2 LYS 64 HD2 LYS 64 -4.994 -17.762 -3.892 456 HD3 LYS 64 HD1 LYS 64 -3.482 -18.648 -3.689 457 HE2 LYS 64 HE2 LYS 64 -4.997 -19.992 -2.525 458 HE3 LYS 64 HE1 LYS 64 -4.326 -18.991 -1.240 459 HZ1 LYS 64 HZ1 LYS 64 -6.733 -19.150 -1.086 460 HZ2 LYS 64 HZ2 LYS 64 -6.901 -18.503 -2.640 461 HZ3 LYS 64 HZ3 LYS 64 -6.264 -17.553 -1.395 462 H THR 65 HN THR 65 -0.349 -13.780 -4.350 463 HA THR 65 HA THR 65 1.736 -14.989 -2.675 464 HB THR 65 HB THR 65 3.276 -14.255 -4.602 465 HG1 THR 65 HG1 THR 65 0.791 -13.491 -5.598 466 HG21 THR 65 HG21 THR 65 2.463 -16.606 -4.270 467 HG22 THR 65 HG22 THR 65 2.810 -16.189 -5.947 468 HG23 THR 65 HG23 THR 65 1.138 -16.245 -5.381 469 H LEU 66 HN LEU 66 0.111 -12.217 -2.445 470 HA LEU 66 HA LEU 66 2.256 -10.253 -2.244 471 HB2 LEU 66 HB2 LEU 66 -0.585 -10.141 -2.603 472 HB3 LEU 66 HB1 LEU 66 -0.209 -9.264 -1.136 473 HG LEU 66 HG LEU 66 1.597 -8.149 -2.859 474 HD11 LEU 66 HD11 LEU 66 0.648 -7.790 -4.982 475 HD12 LEU 66 HD12 LEU 66 -0.893 -8.502 -4.506 476 HD13 LEU 66 HD13 LEU 66 0.528 -9.529 -4.710 477 HD21 LEU 66 HD21 LEU 66 -0.085 -6.307 -3.043 478 HD22 LEU 66 HD22 LEU 66 0.213 -6.878 -1.401 479 HD23 LEU 66 HD23 LEU 66 -1.248 -7.374 -2.255 480 HA PRO 67 HA PRO 67 3.000 -10.718 2.259 481 HB2 PRO 67 HB2 PRO 67 3.013 -7.795 2.748 482 HB3 PRO 67 HB1 PRO 67 4.331 -8.957 2.948 483 HG2 PRO 67 HG2 PRO 67 4.412 -7.208 0.945 484 HG3 PRO 67 HG1 PRO 67 4.889 -8.898 0.663 485 HD2 PRO 67 HD2 PRO 67 2.228 -7.584 0.088 486 HD3 PRO 67 HD1 PRO 67 3.258 -8.528 -1.012 487 H ARG 68 HN ARG 68 2.150 -10.644 4.354 488 HA ARG 68 HA ARG 68 -0.676 -10.465 4.596 489 HB2 ARG 68 HB2 ARG 68 1.544 -11.214 6.428 490 HB3 ARG 68 HB1 ARG 68 -0.032 -10.867 7.128 491 HG2 ARG 68 HG2 ARG 68 -1.048 -12.565 5.687 492 HG3 ARG 68 HG1 ARG 68 0.531 -12.912 4.985 493 HD2 ARG 68 HD2 ARG 68 1.352 -13.636 7.163 494 HD3 ARG 68 HD1 ARG 68 -0.206 -13.242 7.892 495 HE ARG 68 HE ARG 68 -0.687 -15.011 5.795 496 HH11 ARG 68 HH11 ARG 68 0.912 -15.309 8.988 497 HH12 ARG 68 HH12 ARG 68 0.558 -17.001 9.092 498 HH21 ARG 68 HH21 ARG 68 -1.095 -17.194 6.032 499 HH22 ARG 68 HH22 ARG 68 -0.562 -18.048 7.442 500 H ARG 69 HN ARG 69 1.677 -7.969 5.070 501 HA ARG 69 HA ARG 69 0.193 -6.431 7.042 502 HB2 ARG 69 HB2 ARG 69 2.860 -6.289 5.765 503 HB3 ARG 69 HB1 ARG 69 2.128 -4.758 6.227 504 HG2 ARG 69 HG2 ARG 69 1.927 -5.480 8.515 505 HG3 ARG 69 HG1 ARG 69 2.496 -7.095 8.091 506 HD2 ARG 69 HD2 ARG 69 4.183 -4.639 7.644 507 HD3 ARG 69 HD1 ARG 69 4.186 -5.502 9.181 508 HE ARG 69 HE ARG 69 4.687 -7.438 7.301 509 HH11 ARG 69 HH11 ARG 69 6.480 -4.459 8.159 510 HH12 ARG 69 HH12 ARG 69 7.986 -5.112 7.606 511 HH21 ARG 69 HH21 ARG 69 6.677 -8.189 6.618 512 HH22 ARG 69 HH22 ARG 69 8.091 -7.197 6.744 513 H GLU 70 HN GLU 70 0.812 -6.451 3.540 514 HA GLU 70 HA GLU 70 -0.363 -3.958 2.832 515 HB2 GLU 70 HB2 GLU 70 0.520 -6.379 1.336 516 HB3 GLU 70 HB1 GLU 70 -0.504 -5.212 0.514 517 HG2 GLU 70 HG2 GLU 70 1.126 -3.445 1.029 518 HG3 GLU 70 HG1 GLU 70 2.159 -4.643 1.802 519 H ALA 71 HN ALA 71 -1.733 -7.165 3.292 520 HA ALA 71 HA ALA 71 -4.267 -6.928 2.057 521 HB1 ALA 71 HB1 ALA 71 -4.908 -8.853 3.373 522 HB2 ALA 71 HB2 ALA 71 -3.528 -8.612 4.446 523 HB3 ALA 71 HB3 ALA 71 -3.268 -9.059 2.760 524 H GLU 72 HN GLU 72 -3.124 -5.930 5.241 525 HA GLU 72 HA GLU 72 -5.616 -5.197 6.458 526 HB2 GLU 72 HB2 GLU 72 -2.735 -4.649 7.110 527 HB3 GLU 72 HB1 GLU 72 -4.016 -3.828 7.989 528 HG2 GLU 72 HG2 GLU 72 -4.921 -5.986 8.695 529 HG3 GLU 72 HG1 GLU 72 -3.647 -6.815 7.801 530 H LYS 73 HN LYS 73 -3.348 -3.544 4.353 531 HA LYS 73 HA LYS 73 -4.193 -0.833 4.622 532 HB2 LYS 73 HB2 LYS 73 -2.660 -2.293 2.484 533 HB3 LYS 73 HB1 LYS 73 -3.119 -0.611 2.282 534 HG2 LYS 73 HG2 LYS 73 -1.860 -0.036 4.316 535 HG3 LYS 73 HG1 LYS 73 -1.381 -1.727 4.480 536 HD2 LYS 73 HD2 LYS 73 -0.248 -1.620 2.318 537 HD3 LYS 73 HD1 LYS 73 -0.743 0.062 2.135 538 HE2 LYS 73 HE2 LYS 73 0.530 0.650 4.140 539 HE3 LYS 73 HE1 LYS 73 1.028 -1.032 4.317 540 HZ1 LYS 73 HZ1 LYS 73 2.282 0.951 2.850 541 HZ2 LYS 73 HZ2 LYS 73 1.625 -0.116 1.714 542 HZ3 LYS 73 HZ3 LYS 73 2.677 -0.693 2.905 543 H VAL 74 HN VAL 74 -5.401 -3.522 2.717 544 HA VAL 74 HA VAL 74 -7.070 -2.150 0.837 545 HB VAL 74 HB VAL 74 -7.701 -5.001 1.715 546 HG11 VAL 74 HG11 VAL 74 -9.277 -4.113 0.123 547 HG12 VAL 74 HG12 VAL 74 -8.276 -5.309 -0.702 548 HG13 VAL 74 HG13 VAL 74 -7.977 -3.587 -0.947 549 HG21 VAL 74 HG21 VAL 74 -5.627 -4.378 -0.397 550 HG22 VAL 74 HG22 VAL 74 -6.123 -5.968 0.185 551 HG23 VAL 74 HG23 VAL 74 -5.232 -4.879 1.248 552 H PHE 75 HN PHE 75 -7.742 -3.540 4.124 553 HA PHE 75 HA PHE 75 -10.443 -3.012 4.483 554 HB2 PHE 75 HB2 PHE 75 -8.101 -3.576 6.116 555 HB3 PHE 75 HB1 PHE 75 -9.193 -2.480 6.944 556 HD1 PHE 75 HD2 PHE 75 -11.420 -3.224 7.631 557 HD2 PHE 75 HD1 PHE 75 -8.704 -5.875 5.696 558 HE1 PHE 75 HE2 PHE 75 -12.771 -5.141 8.365 559 HE2 PHE 75 HE1 PHE 75 -10.053 -7.798 6.434 560 HZ PHE 75 HZ PHE 75 -12.089 -7.430 7.769 561 H GLU 76 HN GLU 76 -7.763 -0.745 4.481 562 HA GLU 76 HA GLU 76 -8.881 1.428 5.967 563 HB2 GLU 76 HB2 GLU 76 -6.379 0.739 5.399 564 HB3 GLU 76 HB1 GLU 76 -6.628 1.823 4.042 565 HG2 GLU 76 HG2 GLU 76 -7.132 3.648 5.551 566 HG3 GLU 76 HG1 GLU 76 -6.989 2.573 6.940 567 H LEU 77 HN LEU 77 -8.516 0.805 2.412 568 HA LEU 77 HA LEU 77 -9.645 3.250 1.524 569 HB2 LEU 77 HB2 LEU 77 -10.013 1.983 -0.674 570 HB3 LEU 77 HB1 LEU 77 -8.383 2.242 -0.168 571 HG LEU 77 HG LEU 77 -8.749 -0.268 0.759 572 HD11 LEU 77 HD11 LEU 77 -10.060 -1.586 -0.739 573 HD12 LEU 77 HD12 LEU 77 -10.377 -0.191 -1.773 574 HD13 LEU 77 HD13 LEU 77 -11.085 -0.270 -0.160 575 HD21 LEU 77 HD21 LEU 77 -7.757 -1.002 -1.460 576 HD22 LEU 77 HD22 LEU 77 -6.895 0.273 -0.598 577 HD23 LEU 77 HD23 LEU 77 -7.922 0.677 -1.972 578 H LEU 78 HN LEU 78 -11.086 0.116 2.213 579 HA LEU 78 HA LEU 78 -13.763 0.606 1.357 580 HB2 LEU 78 HB2 LEU 78 -12.397 -1.456 3.040 581 HB3 LEU 78 HB1 LEU 78 -14.146 -1.382 3.034 582 HG LEU 78 HG LEU 78 -13.164 -1.397 0.318 583 HD11 LEU 78 HD11 LEU 78 -11.205 -2.503 1.168 584 HD12 LEU 78 HD12 LEU 78 -12.220 -3.658 0.306 585 HD13 LEU 78 HD13 LEU 78 -12.198 -3.644 2.067 586 HD21 LEU 78 HD21 LEU 78 -14.602 -3.393 0.190 587 HD22 LEU 78 HD22 LEU 78 -15.409 -2.015 0.936 588 HD23 LEU 78 HD23 LEU 78 -14.814 -3.335 1.940 589 H ASN 79 HN ASN 79 -12.098 1.021 4.473 590 HA ASN 79 HA ASN 79 -14.442 1.664 6.041 591 HB2 ASN 79 HB2 ASN 79 -11.526 1.373 6.539 592 HB3 ASN 79 HB1 ASN 79 -12.456 2.341 7.678 593 HD21 ASN 79 HD21 ASN 79 -13.474 1.322 9.251 594 HD22 ASN 79 HD22 ASN 79 -13.769 -0.379 9.327 595 H ASP 80 HN ASP 80 -11.957 3.514 4.357 596 HA ASP 80 HA ASP 80 -12.853 6.050 5.527 597 HB2 ASP 80 HB2 ASP 80 -10.336 5.195 5.314 598 HB3 ASP 80 HB1 ASP 80 -10.475 5.915 3.716 599 H PHE 81 HN PHE 81 -14.759 5.233 4.154 600 HA PHE 81 HA PHE 81 -14.812 6.156 1.388 601 HB2 PHE 81 HB2 PHE 81 -16.214 4.177 2.849 602 HB3 PHE 81 HB1 PHE 81 -17.407 5.374 2.368 603 HD1 PHE 81 HD1 PHE 81 -14.959 2.895 1.129 604 HD2 PHE 81 HD2 PHE 81 -18.053 5.635 0.071 605 HE1 PHE 81 HE1 PHE 81 -15.090 1.884 -1.108 606 HE2 PHE 81 HE2 PHE 81 -18.179 4.624 -2.166 607 HZ PHE 81 HZ PHE 81 -16.700 2.748 -2.757 608 H LYS 82 HN LYS 82 -16.106 7.786 0.580 609 HA LYS 82 HA LYS 82 -17.230 9.733 0.349 610 HB2 LYS 82 HB2 LYS 82 -18.277 9.063 3.062 611 HB3 LYS 82 HB1 LYS 82 -18.359 10.754 2.591 612 HG2 LYS 82 HG2 LYS 82 -19.687 10.215 0.667 613 HG3 LYS 82 HG1 LYS 82 -19.478 8.486 0.959 614 HD2 LYS 82 HD2 LYS 82 -20.699 8.665 3.055 615 HD3 LYS 82 HD1 LYS 82 -20.853 10.410 2.838 616 HE2 LYS 82 HE2 LYS 82 -21.897 8.551 0.734 617 HE3 LYS 82 HE1 LYS 82 -22.855 8.851 2.184 618 HZ1 LYS 82 HZ1 LYS 82 -22.066 10.752 0.068 619 HZ2 LYS 82 HZ2 LYS 82 -22.473 11.309 1.612 620 HZ3 LYS 82 HZ3 LYS 82 -23.603 10.441 0.702 621 H GLY 83 HN GLY 83 -16.034 11.341 -0.140 622 HA2 GLY 83 HA2 GLY 83 -15.157 13.450 1.290 623 HA3 GLY 83 HA1 GLY 83 -13.866 12.287 1.541 624 H GLY 84 HN GLY 84 -12.885 11.334 -0.436 625 HA2 GLY 84 HA2 GLY 84 -12.700 13.311 -2.639 626 HA3 GLY 84 HA1 GLY 84 -11.311 12.461 -1.997 627 H ILE 85 HN ILE 85 -14.405 10.858 -2.636 628 HA ILE 85 HA ILE 85 -13.224 9.468 -4.971 629 HB ILE 85 HB ILE 85 -15.313 8.025 -3.295 630 HG12 ILE 85 HG12 ILE 85 -12.785 6.885 -2.622 631 HG13 ILE 85 HG11 ILE 85 -12.680 8.609 -2.276 632 HG21 ILE 85 HG21 ILE 85 -14.611 7.167 -5.557 633 HG22 ILE 85 HG22 ILE 85 -14.412 6.008 -4.242 634 HG23 ILE 85 HG23 ILE 85 -13.009 6.865 -4.881 635 HD11 ILE 85 HD11 ILE 85 -14.678 8.442 -0.880 636 HD12 ILE 85 HD12 ILE 85 -13.398 7.364 -0.324 637 HD13 ILE 85 HD13 ILE 85 -14.770 6.714 -1.222 638 H ASP 86 HN ASP 86 -14.247 9.892 -6.779 639 HA ASP 86 HA ASP 86 -17.123 10.546 -6.796 640 HB2 ASP 86 HB2 ASP 86 -14.845 11.943 -8.171 641 HB3 ASP 86 HB1 ASP 86 -16.448 11.965 -8.894 642 H TRP 87 HN TRP 87 -18.351 9.424 -8.112 643 HA TRP 87 HA TRP 87 -17.284 7.264 -9.721 644 HB2 TRP 87 HB2 TRP 87 -20.071 8.058 -8.923 645 HB3 TRP 87 HB1 TRP 87 -19.786 6.791 -10.114 646 HD1 TRP 87 HD1 TRP 87 -19.745 7.485 -6.425 647 HE1 TRP 87 HE1 TRP 87 -19.175 5.361 -5.101 648 HE3 TRP 87 HE3 TRP 87 -18.313 4.397 -10.304 649 HZ2 TRP 87 HZ2 TRP 87 -18.253 2.759 -5.596 650 HZ3 TRP 87 HZ3 TRP 87 -17.604 2.102 -9.759 651 HH2 TRP 87 HH2 TRP 87 -17.575 1.308 -7.453 652 H GLU 88 HN GLU 88 -18.821 10.362 -10.396 653 HA GLU 88 HA GLU 88 -19.262 9.941 -13.225 654 HB2 GLU 88 HB2 GLU 88 -19.558 12.308 -11.397 655 HB3 GLU 88 HB1 GLU 88 -19.668 12.505 -13.137 656 HG2 GLU 88 HG2 GLU 88 -21.544 10.955 -13.215 657 HG3 GLU 88 HG1 GLU 88 -21.414 10.696 -11.476 658 H ASN 89 HN ASN 89 -16.764 11.528 -11.281 659 HA ASN 89 HA ASN 89 -15.290 12.507 -13.611 660 HB2 ASN 89 HB2 ASN 89 -15.177 13.023 -10.665 661 HB3 ASN 89 HB1 ASN 89 -13.760 13.375 -11.649 662 HD21 ASN 89 HD21 ASN 89 -13.892 14.972 -13.249 663 HD22 ASN 89 HD22 ASN 89 -15.129 16.179 -13.222 664 H LYS 90 HN LYS 90 -15.254 9.736 -11.541 665 HA LYS 90 HA LYS 90 -13.974 7.939 -11.145 666 HB2 LYS 90 HB2 LYS 90 -13.089 8.602 -13.935 667 HB3 LYS 90 HB1 LYS 90 -12.300 7.286 -13.080 668 HG2 LYS 90 HG2 LYS 90 -14.440 6.172 -12.788 669 HG3 LYS 90 HG1 LYS 90 -15.259 7.512 -13.597 670 HD2 LYS 90 HD2 LYS 90 -14.024 7.054 -15.642 671 HD3 LYS 90 HD1 LYS 90 -13.142 5.753 -14.838 672 HE2 LYS 90 HE2 LYS 90 -15.244 4.548 -14.492 673 HE3 LYS 90 HE1 LYS 90 -16.123 5.849 -15.296 674 HZ1 LYS 90 HZ1 LYS 90 -13.954 4.827 -16.866 675 HZ2 LYS 90 HZ2 LYS 90 -15.576 5.060 -17.288 676 HZ3 LYS 90 HZ3 LYS 90 -15.103 3.640 -16.498 677 H ARG 91 HN ARG 91 -13.197 9.781 -9.556 678 HA ARG 91 HA ARG 91 -10.248 9.735 -9.415 679 HB2 ARG 91 HB2 ARG 91 -12.204 11.766 -8.325 680 HB3 ARG 91 HB1 ARG 91 -10.545 11.673 -7.762 681 HG2 ARG 91 HG2 ARG 91 -9.736 12.160 -10.014 682 HG3 ARG 91 HG1 ARG 91 -11.394 12.192 -10.613 683 HD2 ARG 91 HD2 ARG 91 -10.850 14.462 -10.328 684 HD3 ARG 91 HD1 ARG 91 -11.771 14.060 -8.880 685 HE ARG 91 HE ARG 91 -9.050 13.668 -8.321 686 HH11 ARG 91 HH11 ARG 91 -11.137 16.530 -8.883 687 HH12 ARG 91 HH12 ARG 91 -10.096 17.567 -7.966 688 HH21 ARG 91 HH21 ARG 91 -7.777 15.091 -7.158 689 HH22 ARG 91 HH22 ARG 91 -8.220 16.759 -7.004 690 H VAL 92 HN VAL 92 -9.301 8.687 -7.846 691 HA VAL 92 HA VAL 92 -10.812 7.810 -5.456 692 HB VAL 92 HB VAL 92 -8.581 6.030 -6.499 693 HG11 VAL 92 HG11 VAL 92 -11.101 5.079 -5.142 694 HG12 VAL 92 HG12 VAL 92 -9.770 5.759 -4.207 695 HG13 VAL 92 HG13 VAL 92 -9.511 4.313 -5.184 696 HG21 VAL 92 HG21 VAL 92 -10.481 6.377 -8.314 697 HG22 VAL 92 HG22 VAL 92 -11.379 5.269 -7.279 698 HG23 VAL 92 HG23 VAL 92 -9.849 4.761 -7.991 699 H LYS 93 HN LYS 93 -9.890 8.294 -3.556 700 HA LYS 93 HA LYS 93 -7.071 9.173 -3.455 701 HB2 LYS 93 HB2 LYS 93 -9.545 10.332 -2.223 702 HB3 LYS 93 HB1 LYS 93 -8.009 10.529 -1.398 703 HG2 LYS 93 HG2 LYS 93 -7.974 11.254 -4.259 704 HG3 LYS 93 HG1 LYS 93 -8.972 12.293 -3.242 705 HD2 LYS 93 HD2 LYS 93 -7.043 12.682 -1.765 706 HD3 LYS 93 HD1 LYS 93 -6.049 11.653 -2.800 707 HE2 LYS 93 HE2 LYS 93 -6.402 13.184 -4.668 708 HE3 LYS 93 HE1 LYS 93 -7.425 14.199 -3.653 709 HZ1 LYS 93 HZ1 LYS 93 -5.657 15.075 -2.592 710 HZ2 LYS 93 HZ2 LYS 93 -4.837 14.638 -4.005 711 HZ3 LYS 93 HZ3 LYS 93 -4.756 13.644 -2.640 712 H LEU 94 HN LEU 94 -5.788 8.401 -1.914 713 HA LEU 94 HA LEU 94 -6.839 6.619 0.176 714 HB2 LEU 94 HB2 LEU 94 -4.637 6.212 -1.785 715 HB3 LEU 94 HB1 LEU 94 -4.350 5.647 -0.155 716 HG LEU 94 HG LEU 94 -6.926 4.721 -1.180 717 HD11 LEU 94 HD11 LEU 94 -5.965 4.693 -3.341 718 HD12 LEU 94 HD12 LEU 94 -5.887 3.044 -2.725 719 HD13 LEU 94 HD13 LEU 94 -4.438 4.049 -2.733 720 HD21 LEU 94 HD21 LEU 94 -5.823 3.815 0.806 721 HD22 LEU 94 HD22 LEU 94 -4.462 3.285 -0.184 722 HD23 LEU 94 HD23 LEU 94 -6.051 2.566 -0.418 723 H LYS 95 HN LYS 95 -6.253 7.036 2.148 724 HA LYS 95 HA LYS 95 -4.275 9.146 2.707 725 HB2 LYS 95 HB2 LYS 95 -6.824 8.332 4.036 726 HB3 LYS 95 HB1 LYS 95 -5.562 9.062 5.017 727 HG2 LYS 95 HG2 LYS 95 -5.579 11.042 3.624 728 HG3 LYS 95 HG1 LYS 95 -6.771 10.305 2.552 729 HD2 LYS 95 HD2 LYS 95 -8.391 10.233 4.375 730 HD3 LYS 95 HD1 LYS 95 -7.194 10.910 5.482 731 HE2 LYS 95 HE2 LYS 95 -8.465 12.784 4.896 732 HE3 LYS 95 HE1 LYS 95 -7.103 12.879 3.782 733 HZ1 LYS 95 HZ1 LYS 95 -8.916 11.381 2.426 734 HZ2 LYS 95 HZ2 LYS 95 -8.663 13.040 2.213 735 HZ3 LYS 95 HZ3 LYS 95 -9.898 12.499 3.233 Start of MODEL 2 1 H1 MET 8 HT1 MET 8 2.382 0.660 0.108 2 H2 MET 8 HT2 MET 8 0.914 0.228 -0.612 3 H3 MET 8 HT3 MET 8 1.466 1.824 -0.713 4 HA MET 8 HA MET 8 1.876 0.857 -2.797 5 HB2 MET 8 HB2 MET 8 4.277 1.172 -1.030 6 HB3 MET 8 HB1 MET 8 4.491 0.638 -2.690 7 HG2 MET 8 HG2 MET 8 3.394 2.664 -3.494 8 HG3 MET 8 HG1 MET 8 3.150 3.198 -1.833 9 HE1 MET 8 HE1 MET 8 6.435 4.660 -0.739 10 HE2 MET 8 HE2 MET 8 5.411 3.360 -0.129 11 HE3 MET 8 HE3 MET 8 4.681 4.843 -0.743 12 H ALA 9 HN ALA 9 2.190 -0.827 -4.085 13 HA ALA 9 HA ALA 9 2.641 -3.479 -2.887 14 HB1 ALA 9 HB1 ALA 9 0.520 -3.506 -3.902 15 HB2 ALA 9 HB2 ALA 9 1.573 -4.251 -5.106 16 HB3 ALA 9 HB3 ALA 9 1.077 -2.571 -5.288 17 H LYS 10 HN LYS 10 4.167 -4.833 -3.628 18 HA LYS 10 HA LYS 10 6.169 -3.799 -5.511 19 HB2 LYS 10 HB2 LYS 10 6.333 -5.527 -3.076 20 HB3 LYS 10 HB1 LYS 10 7.529 -5.744 -4.344 21 HG2 LYS 10 HG2 LYS 10 8.228 -3.439 -4.133 22 HG3 LYS 10 HG1 LYS 10 6.964 -3.143 -2.935 23 HD2 LYS 10 HD2 LYS 10 7.999 -4.779 -1.437 24 HD3 LYS 10 HD1 LYS 10 9.254 -5.088 -2.637 25 HE2 LYS 10 HE2 LYS 10 9.997 -2.770 -2.466 26 HE3 LYS 10 HE1 LYS 10 8.728 -2.442 -1.287 27 HZ1 LYS 10 HZ1 LYS 10 10.168 -4.659 -0.397 28 HZ2 LYS 10 HZ2 LYS 10 10.096 -3.118 0.297 29 HZ3 LYS 10 HZ3 LYS 10 11.297 -3.478 -0.838 30 H CYS 11 HN CYS 11 6.777 -4.917 -7.256 31 HA CYS 11 HA CYS 11 5.171 -7.034 -8.307 32 HB2 CYS 11 HB2 CYS 11 6.237 -5.295 -9.755 33 HB3 CYS 11 HB1 CYS 11 7.799 -6.000 -9.403 34 HA PRO 12 HA PRO 12 7.766 -10.539 -6.628 35 HB2 PRO 12 HB2 PRO 12 6.342 -12.388 -8.428 36 HB3 PRO 12 HB1 PRO 12 6.384 -12.385 -6.662 37 HG2 PRO 12 HG2 PRO 12 4.145 -11.717 -7.983 38 HG3 PRO 12 HG1 PRO 12 4.619 -10.865 -6.498 39 HD2 PRO 12 HD2 PRO 12 5.031 -10.017 -9.364 40 HD3 PRO 12 HD1 PRO 12 4.348 -9.090 -8.013 41 H ILE 13 HN ILE 13 7.659 -9.559 -9.953 42 HA ILE 13 HA ILE 13 9.606 -11.496 -10.937 43 HB ILE 13 HB ILE 13 8.248 -9.296 -12.586 44 HG12 ILE 13 HG12 ILE 13 7.089 -11.838 -13.252 45 HG13 ILE 13 HG11 ILE 13 6.935 -11.627 -11.513 46 HG21 ILE 13 HG21 ILE 13 8.700 -10.704 -14.548 47 HG22 ILE 13 HG22 ILE 13 9.406 -11.953 -13.522 48 HG23 ILE 13 HG23 ILE 13 10.202 -10.387 -13.677 49 HD11 ILE 13 HD11 ILE 13 5.684 -9.628 -11.791 50 HD12 ILE 13 HD12 ILE 13 4.994 -10.835 -12.876 51 HD13 ILE 13 HD13 ILE 13 6.042 -9.569 -13.517 52 H CYS 14 HN CYS 14 9.219 -7.866 -10.767 53 HA CYS 14 HA CYS 14 12.126 -7.579 -11.151 54 HB2 CYS 14 HB2 CYS 14 11.686 -5.250 -11.813 55 HB3 CYS 14 HB1 CYS 14 10.806 -6.392 -12.819 56 H GLY 15 HN GLY 15 9.485 -6.543 -9.028 57 HA2 GLY 15 HA2 GLY 15 9.561 -6.082 -6.719 58 HA3 GLY 15 HA1 GLY 15 11.312 -5.989 -6.814 59 H SER 16 HN SER 16 9.059 -4.237 -8.900 60 HA SER 16 HA SER 16 10.203 -1.648 -8.140 61 HB2 SER 16 HB2 SER 16 9.118 -2.836 -10.518 62 HB3 SER 16 HB1 SER 16 8.261 -1.336 -10.164 63 HG SER 16 HG SER 16 10.680 -0.668 -9.778 64 HA PRO 17 HA PRO 17 6.524 -0.383 -5.679 65 HB2 PRO 17 HB2 PRO 17 6.572 2.360 -5.890 66 HB3 PRO 17 HB1 PRO 17 7.620 1.449 -4.801 67 HG2 PRO 17 HG2 PRO 17 8.245 2.589 -7.514 68 HG3 PRO 17 HG1 PRO 17 9.245 2.599 -6.046 69 HD2 PRO 17 HD2 PRO 17 9.684 0.830 -8.044 70 HD3 PRO 17 HD1 PRO 17 9.926 0.386 -6.345 71 H LEU 18 HN LEU 18 4.430 -0.295 -6.002 72 HA LEU 18 HA LEU 18 3.301 0.764 -8.513 73 HB2 LEU 18 HB2 LEU 18 2.548 -1.697 -6.944 74 HB3 LEU 18 HB1 LEU 18 1.435 -0.947 -8.074 75 HG LEU 18 HG LEU 18 4.099 -1.583 -9.190 76 HD11 LEU 18 HD11 LEU 18 3.491 -3.980 -9.467 77 HD12 LEU 18 HD12 LEU 18 2.215 -3.744 -8.273 78 HD13 LEU 18 HD13 LEU 18 3.904 -3.523 -7.815 79 HD21 LEU 18 HD21 LEU 18 2.082 -0.731 -10.458 80 HD22 LEU 18 HD22 LEU 18 1.338 -2.304 -10.171 81 HD23 LEU 18 HD23 LEU 18 2.826 -2.192 -11.109 82 H LYS 19 HN LYS 19 1.407 1.882 -8.445 83 HA LYS 19 HA LYS 19 0.642 3.055 -5.884 84 HB2 LYS 19 HB2 LYS 19 0.220 3.812 -8.758 85 HB3 LYS 19 HB1 LYS 19 -0.824 4.493 -7.521 86 HG2 LYS 19 HG2 LYS 19 1.072 5.489 -6.409 87 HG3 LYS 19 HG1 LYS 19 2.181 4.712 -7.541 88 HD2 LYS 19 HD2 LYS 19 1.145 5.973 -9.385 89 HD3 LYS 19 HD1 LYS 19 0.089 6.780 -8.222 90 HE2 LYS 19 HE2 LYS 19 2.031 7.735 -7.105 91 HE3 LYS 19 HE1 LYS 19 3.104 6.897 -8.226 92 HZ1 LYS 19 HZ1 LYS 19 2.031 8.162 -10.041 93 HZ2 LYS 19 HZ2 LYS 19 2.850 9.148 -8.937 94 HZ3 LYS 19 HZ3 LYS 19 1.163 9.043 -8.887 95 H TRP 20 HN TRP 20 -1.133 2.593 -4.807 96 HA TRP 20 HA TRP 20 -2.968 0.525 -5.524 97 HB2 TRP 20 HB2 TRP 20 -2.662 2.375 -3.201 98 HB3 TRP 20 HB1 TRP 20 -4.190 1.519 -3.389 99 HD1 TRP 20 HD1 TRP 20 -0.518 0.966 -2.542 100 HE1 TRP 20 HE1 TRP 20 -0.170 -1.413 -1.636 101 HE3 TRP 20 HE3 TRP 20 -5.204 -1.013 -3.441 102 HZ2 TRP 20 HZ2 TRP 20 -1.633 -3.789 -1.341 103 HZ3 TRP 20 HZ3 TRP 20 -5.614 -3.350 -2.793 104 HH2 TRP 20 HH2 TRP 20 -3.864 -4.704 -1.758 105 H GLU 21 HN GLU 21 -3.069 3.985 -5.920 106 HA GLU 21 HA GLU 21 -5.850 4.415 -6.403 107 HB2 GLU 21 HB2 GLU 21 -3.351 5.989 -6.930 108 HB3 GLU 21 HB1 GLU 21 -4.880 6.523 -7.612 109 HG2 GLU 21 HG2 GLU 21 -5.842 6.728 -5.408 110 HG3 GLU 21 HG1 GLU 21 -4.389 6.051 -4.676 111 H GLU 22 HN GLU 22 -3.142 3.461 -8.495 112 HA GLU 22 HA GLU 22 -4.484 3.742 -11.040 113 HB2 GLU 22 HB2 GLU 22 -1.857 2.637 -10.141 114 HB3 GLU 22 HB1 GLU 22 -2.451 2.225 -11.743 115 HG2 GLU 22 HG2 GLU 22 -2.612 4.614 -12.283 116 HG3 GLU 22 HG1 GLU 22 -1.973 5.003 -10.686 117 H LEU 23 HN LEU 23 -3.950 1.116 -8.748 118 HA LEU 23 HA LEU 23 -4.764 -1.144 -10.232 119 HB2 LEU 23 HB2 LEU 23 -3.481 -0.835 -7.949 120 HB3 LEU 23 HB1 LEU 23 -5.081 -0.936 -7.254 121 HG LEU 23 HG LEU 23 -4.891 -3.141 -8.946 122 HD11 LEU 23 HD11 LEU 23 -2.416 -3.001 -7.252 123 HD12 LEU 23 HD12 LEU 23 -2.435 -2.716 -8.994 124 HD13 LEU 23 HD13 LEU 23 -2.899 -4.291 -8.354 125 HD21 LEU 23 HD21 LEU 23 -4.595 -2.899 -5.962 126 HD22 LEU 23 HD22 LEU 23 -4.935 -4.399 -6.825 127 HD23 LEU 23 HD23 LEU 23 -6.100 -3.077 -6.863 128 H ILE 24 HN ILE 24 -6.609 1.044 -8.082 129 HA ILE 24 HA ILE 24 -9.156 -0.323 -8.304 130 HB ILE 24 HB ILE 24 -8.778 2.475 -7.166 131 HG12 ILE 24 HG12 ILE 24 -7.234 1.381 -5.733 132 HG13 ILE 24 HG11 ILE 24 -8.707 1.456 -4.805 133 HG21 ILE 24 HG21 ILE 24 -10.743 2.111 -5.789 134 HG22 ILE 24 HG22 ILE 24 -10.900 0.467 -6.405 135 HG23 ILE 24 HG23 ILE 24 -11.116 1.836 -7.492 136 HD11 ILE 24 HD11 ILE 24 -8.894 -1.084 -5.719 137 HD12 ILE 24 HD12 ILE 24 -8.046 -0.647 -4.235 138 HD13 ILE 24 HD13 ILE 24 -7.141 -0.888 -5.727 139 H GLU 25 HN GLU 25 -7.659 2.576 -9.787 140 HA GLU 25 HA GLU 25 -9.867 3.640 -11.204 141 HB2 GLU 25 HB2 GLU 25 -7.257 4.383 -10.723 142 HB3 GLU 25 HB1 GLU 25 -7.269 4.102 -12.457 143 HG2 GLU 25 HG2 GLU 25 -9.199 5.636 -12.650 144 HG3 GLU 25 HG1 GLU 25 -9.080 5.959 -10.923 145 H GLU 26 HN GLU 26 -7.480 1.179 -12.120 146 HA GLU 26 HA GLU 26 -8.258 0.856 -14.882 147 HB2 GLU 26 HB2 GLU 26 -6.400 -0.565 -13.004 148 HB3 GLU 26 HB1 GLU 26 -6.784 -1.238 -14.561 149 HG2 GLU 26 HG2 GLU 26 -5.904 0.788 -15.656 150 HG3 GLU 26 HG1 GLU 26 -5.465 1.420 -14.070 151 H MET 27 HN MET 27 -9.241 -0.447 -11.804 152 HA MET 27 HA MET 27 -10.585 -2.751 -12.977 153 HB2 MET 27 HB2 MET 27 -9.388 -2.176 -10.326 154 HB3 MET 27 HB1 MET 27 -10.830 -3.176 -10.326 155 HG2 MET 27 HG2 MET 27 -9.718 -4.701 -11.933 156 HG3 MET 27 HG1 MET 27 -8.257 -3.723 -11.783 157 HE1 MET 27 HE1 MET 27 -10.900 -5.791 -10.084 158 HE2 MET 27 HE2 MET 27 -10.061 -6.642 -8.789 159 HE3 MET 27 HE3 MET 27 -9.727 -7.049 -10.473 160 H LEU 28 HN LEU 28 -11.434 0.331 -12.593 161 HA LEU 28 HA LEU 28 -13.981 0.051 -11.217 162 HB2 LEU 28 HB2 LEU 28 -12.171 2.072 -11.324 163 HB3 LEU 28 HB1 LEU 28 -13.305 2.618 -12.542 164 HG LEU 28 HG LEU 28 -14.967 1.983 -10.420 165 HD11 LEU 28 HD11 LEU 28 -12.515 3.335 -9.303 166 HD12 LEU 28 HD12 LEU 28 -12.990 1.668 -8.978 167 HD13 LEU 28 HD13 LEU 28 -14.022 2.996 -8.450 168 HD21 LEU 28 HD21 LEU 28 -15.256 3.910 -11.779 169 HD22 LEU 28 HD22 LEU 28 -13.723 4.597 -11.240 170 HD23 LEU 28 HD23 LEU 28 -15.072 4.452 -10.112 171 H ILE 29 HN ILE 29 -13.259 -1.052 -14.043 172 HA ILE 29 HA ILE 29 -15.299 0.076 -15.783 173 HB ILE 29 HB ILE 29 -14.449 -1.684 -17.461 174 HG12 ILE 29 HG12 ILE 29 -11.717 -1.743 -16.562 175 HG13 ILE 29 HG11 ILE 29 -12.722 -2.493 -15.324 176 HG21 ILE 29 HG21 ILE 29 -12.730 0.601 -16.561 177 HG22 ILE 29 HG22 ILE 29 -14.035 0.639 -17.745 178 HG23 ILE 29 HG23 ILE 29 -12.544 -0.232 -18.104 179 HD11 ILE 29 HD11 ILE 29 -11.832 -4.103 -16.954 180 HD12 ILE 29 HD12 ILE 29 -12.698 -3.261 -18.239 181 HD13 ILE 29 HD13 ILE 29 -13.594 -4.059 -16.946 182 H ILE 30 HN ILE 30 -15.328 -2.234 -13.426 183 HA ILE 30 HA ILE 30 -17.297 -4.066 -14.634 184 HB ILE 30 HB ILE 30 -16.250 -4.496 -11.804 185 HG12 ILE 30 HG12 ILE 30 -14.777 -6.188 -13.638 186 HG13 ILE 30 HG11 ILE 30 -14.468 -4.501 -14.021 187 HG21 ILE 30 HG21 ILE 30 -18.124 -5.917 -12.755 188 HG22 ILE 30 HG22 ILE 30 -16.739 -6.818 -12.141 189 HG23 ILE 30 HG23 ILE 30 -16.944 -6.595 -13.878 190 HD11 ILE 30 HD11 ILE 30 -14.100 -5.757 -11.306 191 HD12 ILE 30 HD12 ILE 30 -13.701 -4.100 -11.759 192 HD13 ILE 30 HD13 ILE 30 -12.813 -5.445 -12.472 193 H GLU 31 HN GLU 31 -19.376 -4.255 -13.915 194 HA GLU 31 HA GLU 31 -20.577 -2.071 -12.434 195 HB2 GLU 31 HB2 GLU 31 -21.648 -4.374 -14.020 196 HB3 GLU 31 HB1 GLU 31 -22.721 -3.496 -12.943 197 HG2 GLU 31 HG2 GLU 31 -22.242 -1.423 -14.143 198 HG3 GLU 31 HG1 GLU 31 -21.139 -2.292 -15.210 199 H ASN 32 HN ASN 32 -19.554 -5.271 -11.643 200 HA ASN 32 HA ASN 32 -21.196 -5.727 -9.313 201 HB2 ASN 32 HB2 ASN 32 -18.898 -7.126 -10.613 202 HB3 ASN 32 HB1 ASN 32 -19.300 -7.528 -8.945 203 HD21 ASN 32 HD21 ASN 32 -21.231 -8.562 -8.495 204 HD22 ASN 32 HD22 ASN 32 -22.203 -9.294 -9.720 205 H PHE 33 HN PHE 33 -18.239 -4.048 -9.936 206 HA PHE 33 HA PHE 33 -16.814 -4.048 -7.544 207 HB2 PHE 33 HB2 PHE 33 -16.395 -2.902 -9.945 208 HB3 PHE 33 HB1 PHE 33 -16.828 -1.481 -9.028 209 HD1 PHE 33 HD1 PHE 33 -14.334 -4.169 -9.398 210 HD2 PHE 33 HD2 PHE 33 -15.364 -0.608 -7.287 211 HE1 PHE 33 HE1 PHE 33 -12.056 -4.052 -8.483 212 HE2 PHE 33 HE2 PHE 33 -13.085 -0.493 -6.376 213 HZ PHE 33 HZ PHE 33 -11.428 -2.211 -6.973 214 H GLU 34 HN GLU 34 -19.559 -2.007 -8.423 215 HA GLU 34 HA GLU 34 -19.681 -0.200 -6.247 216 HB2 GLU 34 HB2 GLU 34 -21.742 -1.269 -8.152 217 HB3 GLU 34 HB1 GLU 34 -22.223 -0.230 -6.819 218 HG2 GLU 34 HG2 GLU 34 -20.707 1.519 -7.652 219 HG3 GLU 34 HG1 GLU 34 -20.270 0.473 -9.003 220 H GLU 35 HN GLU 35 -20.662 -3.540 -6.521 221 HA GLU 35 HA GLU 35 -22.085 -3.738 -3.971 222 HB2 GLU 35 HB2 GLU 35 -21.497 -5.667 -6.203 223 HB3 GLU 35 HB1 GLU 35 -22.022 -6.262 -4.638 224 HG2 GLU 35 HG2 GLU 35 -24.070 -4.910 -4.834 225 HG3 GLU 35 HG1 GLU 35 -23.542 -4.384 -6.434 226 H ILE 36 HN ILE 36 -18.903 -4.567 -5.316 227 HA ILE 36 HA ILE 36 -17.928 -6.185 -3.135 228 HB ILE 36 HB ILE 36 -16.252 -4.898 -5.370 229 HG12 ILE 36 HG12 ILE 36 -16.714 -7.839 -5.407 230 HG13 ILE 36 HG11 ILE 36 -18.134 -6.871 -5.760 231 HG21 ILE 36 HG21 ILE 36 -15.307 -7.420 -4.068 232 HG22 ILE 36 HG22 ILE 36 -15.176 -5.955 -3.098 233 HG23 ILE 36 HG23 ILE 36 -14.362 -6.052 -4.659 234 HD11 ILE 36 HD11 ILE 36 -17.393 -6.341 -7.833 235 HD12 ILE 36 HD12 ILE 36 -16.367 -7.758 -7.617 236 HD13 ILE 36 HD13 ILE 36 -15.720 -6.151 -7.305 237 H VAL 37 HN VAL 37 -17.615 -2.730 -3.970 238 HA VAL 37 HA VAL 37 -15.733 -1.846 -2.079 239 HB VAL 37 HB VAL 37 -16.754 0.482 -2.328 240 HG11 VAL 37 HG11 VAL 37 -14.869 -0.141 -3.654 241 HG12 VAL 37 HG12 VAL 37 -16.008 0.710 -4.697 242 HG13 VAL 37 HG13 VAL 37 -15.887 -1.047 -4.775 243 HG21 VAL 37 HG21 VAL 37 -19.059 0.029 -2.918 244 HG22 VAL 37 HG22 VAL 37 -18.561 -0.901 -4.326 245 HG23 VAL 37 HG23 VAL 37 -18.288 0.829 -4.275 246 H LYS 38 HN LYS 38 -19.069 -2.577 -1.554 247 HA LYS 38 HA LYS 38 -19.341 -1.314 1.047 248 HB2 LYS 38 HB2 LYS 38 -21.154 -2.904 -0.745 249 HB3 LYS 38 HB1 LYS 38 -21.592 -2.650 0.940 250 HG2 LYS 38 HG2 LYS 38 -21.545 -0.233 0.599 251 HG3 LYS 38 HG1 LYS 38 -21.055 -0.474 -1.079 252 HD2 LYS 38 HD2 LYS 38 -23.153 -1.683 -1.501 253 HD3 LYS 38 HD1 LYS 38 -23.642 -1.399 0.171 254 HE2 LYS 38 HE2 LYS 38 -23.580 1.014 -0.224 255 HE3 LYS 38 HE1 LYS 38 -23.085 0.730 -1.893 256 HZ1 LYS 38 HZ1 LYS 38 -25.594 1.100 -1.227 257 HZ2 LYS 38 HZ2 LYS 38 -25.533 -0.570 -0.971 258 HZ3 LYS 38 HZ3 LYS 38 -25.154 0.066 -2.492 259 H ASP 39 HN ASP 39 -18.168 -4.335 -0.092 260 HA ASP 39 HA ASP 39 -18.312 -5.552 2.569 261 HB2 ASP 39 HB2 ASP 39 -18.968 -6.743 -0.093 262 HB3 ASP 39 HB1 ASP 39 -18.215 -7.783 1.111 263 H ARG 40 HN ARG 40 -16.356 -5.182 3.341 264 HA ARG 40 HA ARG 40 -13.841 -5.185 2.202 265 HB2 ARG 40 HB2 ARG 40 -14.705 -5.861 5.009 266 HB3 ARG 40 HB1 ARG 40 -13.006 -5.775 4.560 267 HG2 ARG 40 HG2 ARG 40 -13.012 -3.486 4.570 268 HG3 ARG 40 HG1 ARG 40 -14.577 -3.418 3.762 269 HD2 ARG 40 HD2 ARG 40 -14.363 -4.180 6.665 270 HD3 ARG 40 HD1 ARG 40 -14.433 -2.494 6.159 271 HE ARG 40 HE ARG 40 -16.572 -3.616 4.906 272 HH11 ARG 40 HH11 ARG 40 -15.767 -3.507 8.399 273 HH12 ARG 40 HH12 ARG 40 -17.433 -3.628 8.860 274 HH21 ARG 40 HH21 ARG 40 -18.682 -3.772 5.610 275 HH22 ARG 40 HH22 ARG 40 -19.055 -3.778 7.302 276 H GLU 41 HN GLU 41 -15.623 -8.016 3.345 277 HA GLU 41 HA GLU 41 -13.591 -10.004 3.208 278 HB2 GLU 41 HB2 GLU 41 -16.198 -9.810 4.117 279 HB3 GLU 41 HB1 GLU 41 -16.311 -10.946 2.786 280 HG2 GLU 41 HG2 GLU 41 -14.584 -12.331 3.833 281 HG3 GLU 41 HG1 GLU 41 -14.481 -11.181 5.166 282 H ARG 42 HN ARG 42 -15.859 -8.699 0.832 283 HA ARG 42 HA ARG 42 -15.362 -10.659 -1.239 284 HB2 ARG 42 HB2 ARG 42 -16.996 -8.132 -1.127 285 HB3 ARG 42 HB1 ARG 42 -16.681 -8.930 -2.657 286 HG2 ARG 42 HG2 ARG 42 -17.751 -10.981 -1.784 287 HG3 ARG 42 HG1 ARG 42 -18.107 -10.129 -0.282 288 HD2 ARG 42 HD2 ARG 42 -20.115 -9.958 -1.486 289 HD3 ARG 42 HD1 ARG 42 -19.321 -8.415 -1.802 290 HE ARG 42 HE ARG 42 -18.606 -10.231 -3.831 291 HH11 ARG 42 HH11 ARG 42 -21.572 -8.410 -2.956 292 HH12 ARG 42 HH12 ARG 42 -22.174 -8.462 -4.581 293 HH21 ARG 42 HH21 ARG 42 -19.479 -10.241 -5.888 294 HH22 ARG 42 HH22 ARG 42 -21.003 -9.484 -6.211 295 H PHE 43 HN PHE 43 -14.177 -7.379 -0.453 296 HA PHE 43 HA PHE 43 -12.857 -6.826 -2.940 297 HB2 PHE 43 HB2 PHE 43 -13.635 -5.201 -0.973 298 HB3 PHE 43 HB1 PHE 43 -11.978 -5.429 -0.437 299 HD1 PHE 43 HD2 PHE 43 -10.078 -4.660 -1.908 300 HD2 PHE 43 HD1 PHE 43 -14.158 -3.800 -2.842 301 HE1 PHE 43 HE2 PHE 43 -9.359 -2.869 -3.436 302 HE2 PHE 43 HE1 PHE 43 -13.431 -2.010 -4.363 303 HZ PHE 43 HZ PHE 43 -11.029 -1.544 -4.662 304 H LEU 44 HN LEU 44 -11.654 -8.056 0.218 305 HA LEU 44 HA LEU 44 -8.876 -8.253 -0.459 306 HB2 LEU 44 HB2 LEU 44 -10.593 -9.219 1.788 307 HB3 LEU 44 HB1 LEU 44 -8.986 -9.889 1.606 308 HG LEU 44 HG LEU 44 -9.030 -6.956 1.529 309 HD11 LEU 44 HD11 LEU 44 -10.837 -7.247 3.123 310 HD12 LEU 44 HD12 LEU 44 -9.376 -6.693 3.939 311 HD13 LEU 44 HD13 LEU 44 -9.859 -8.385 4.052 312 HD21 LEU 44 HD21 LEU 44 -7.125 -7.211 2.963 313 HD22 LEU 44 HD22 LEU 44 -7.011 -8.403 1.668 314 HD23 LEU 44 HD23 LEU 44 -7.530 -8.898 3.280 315 H ALA 45 HN ALA 45 -11.594 -10.429 -0.710 316 HA ALA 45 HA ALA 45 -10.129 -12.824 -1.436 317 HB1 ALA 45 HB1 ALA 45 -13.081 -12.266 -1.644 318 HB2 ALA 45 HB2 ALA 45 -12.270 -12.904 -0.216 319 HB3 ALA 45 HB3 ALA 45 -12.300 -13.846 -1.706 320 H GLN 46 HN GLN 46 -11.656 -10.163 -3.186 321 HA GLN 46 HA GLN 46 -11.692 -11.402 -5.795 322 HB2 GLN 46 HB2 GLN 46 -12.442 -8.752 -4.693 323 HB3 GLN 46 HB1 GLN 46 -11.932 -8.763 -6.375 324 HG2 GLN 46 HG2 GLN 46 -13.977 -10.768 -5.538 325 HG3 GLN 46 HG1 GLN 46 -14.483 -9.089 -5.697 326 HE21 GLN 46 HE21 GLN 46 -14.366 -8.083 -7.738 327 HE22 GLN 46 HE22 GLN 46 -14.321 -9.009 -9.195 328 H VAL 47 HN VAL 47 -9.510 -9.125 -4.106 329 HA VAL 47 HA VAL 47 -7.755 -8.531 -6.308 330 HB VAL 47 HB VAL 47 -7.238 -8.148 -3.297 331 HG11 VAL 47 HG11 VAL 47 -5.360 -6.768 -3.708 332 HG12 VAL 47 HG12 VAL 47 -5.742 -6.605 -5.421 333 HG13 VAL 47 HG13 VAL 47 -5.114 -8.131 -4.802 334 HG21 VAL 47 HG21 VAL 47 -7.757 -5.812 -3.615 335 HG22 VAL 47 HG22 VAL 47 -9.110 -6.795 -4.173 336 HG23 VAL 47 HG23 VAL 47 -8.010 -6.064 -5.343 337 H GLU 48 HN GLU 48 -7.694 -11.005 -3.725 338 HA GLU 48 HA GLU 48 -5.171 -12.234 -4.324 339 HB2 GLU 48 HB2 GLU 48 -7.541 -13.152 -2.693 340 HB3 GLU 48 HB1 GLU 48 -6.095 -14.123 -2.889 341 HG2 GLU 48 HG2 GLU 48 -4.792 -12.183 -1.917 342 HG3 GLU 48 HG1 GLU 48 -6.348 -11.449 -1.525 343 H GLU 49 HN GLU 49 -8.380 -12.633 -5.621 344 HA GLU 49 HA GLU 49 -7.781 -15.129 -7.045 345 HB2 GLU 49 HB2 GLU 49 -10.339 -13.637 -6.506 346 HB3 GLU 49 HB1 GLU 49 -10.265 -14.895 -7.728 347 HG2 GLU 49 HG2 GLU 49 -9.518 -16.487 -5.980 348 HG3 GLU 49 HG1 GLU 49 -9.719 -15.206 -4.785 349 H PHE 50 HN PHE 50 -7.814 -11.735 -7.679 350 HA PHE 50 HA PHE 50 -8.243 -11.952 -10.559 351 HB2 PHE 50 HB2 PHE 50 -8.509 -9.843 -8.586 352 HB3 PHE 50 HB1 PHE 50 -7.537 -9.306 -9.941 353 HD1 PHE 50 HD2 PHE 50 -8.521 -9.071 -12.163 354 HD2 PHE 50 HD1 PHE 50 -10.874 -10.350 -8.845 355 HE1 PHE 50 HE2 PHE 50 -10.569 -8.610 -13.440 356 HE2 PHE 50 HE1 PHE 50 -12.924 -9.883 -10.122 357 HZ PHE 50 HZ PHE 50 -12.773 -9.013 -12.421 358 H VAL 51 HN VAL 51 -6.799 -11.216 -12.117 359 HA VAL 51 HA VAL 51 -3.945 -11.481 -11.454 360 HB VAL 51 HB VAL 51 -5.364 -11.786 -14.162 361 HG11 VAL 51 HG11 VAL 51 -3.192 -12.584 -15.084 362 HG12 VAL 51 HG12 VAL 51 -2.406 -12.032 -13.605 363 HG13 VAL 51 HG13 VAL 51 -3.176 -10.865 -14.680 364 HG21 VAL 51 HG21 VAL 51 -5.334 -13.703 -12.391 365 HG22 VAL 51 HG22 VAL 51 -3.650 -13.878 -12.899 366 HG23 VAL 51 HG23 VAL 51 -4.948 -14.076 -14.077 367 H PHE 52 HN PHE 52 -2.492 -9.956 -11.935 368 HA PHE 52 HA PHE 52 -3.380 -7.317 -12.905 369 HB2 PHE 52 HB2 PHE 52 -1.557 -7.750 -10.512 370 HB3 PHE 52 HB1 PHE 52 -1.941 -6.195 -11.217 371 HD1 PHE 52 HD1 PHE 52 -4.234 -5.227 -10.930 372 HD2 PHE 52 HD2 PHE 52 -3.064 -8.848 -9.004 373 HE1 PHE 52 HE1 PHE 52 -6.160 -5.043 -9.408 374 HE2 PHE 52 HE2 PHE 52 -4.987 -8.658 -7.483 375 HZ PHE 52 HZ PHE 52 -6.535 -6.756 -7.686 376 H LYS 53 HN LYS 53 -1.867 -6.117 -14.007 377 HA LYS 53 HA LYS 53 0.415 -7.620 -15.108 378 HB2 LYS 53 HB2 LYS 53 -1.406 -5.536 -16.251 379 HB3 LYS 53 HB1 LYS 53 0.215 -5.713 -16.906 380 HG2 LYS 53 HG2 LYS 53 -0.236 -8.021 -17.490 381 HG3 LYS 53 HG1 LYS 53 -1.834 -7.919 -16.748 382 HD2 LYS 53 HD2 LYS 53 -2.483 -6.211 -18.373 383 HD3 LYS 53 HD1 LYS 53 -0.880 -6.291 -19.104 384 HE2 LYS 53 HE2 LYS 53 -1.266 -8.630 -19.700 385 HE3 LYS 53 HE1 LYS 53 -2.862 -8.561 -18.952 386 HZ1 LYS 53 HZ1 LYS 53 -3.470 -6.834 -20.560 387 HZ2 LYS 53 HZ2 LYS 53 -3.048 -8.285 -21.322 388 HZ3 LYS 53 HZ3 LYS 53 -1.959 -6.992 -21.306 389 H CYS 54 HN CYS 54 2.441 -6.791 -15.209 390 HA CYS 54 HA CYS 54 3.063 -4.549 -13.451 391 HB2 CYS 54 HB2 CYS 54 4.381 -6.575 -13.104 392 HB3 CYS 54 HB1 CYS 54 4.868 -6.602 -14.790 393 HA PRO 55 HA PRO 55 3.781 -1.762 -17.082 394 HB2 PRO 55 HB2 PRO 55 4.799 0.432 -15.818 395 HB3 PRO 55 HB1 PRO 55 3.077 0.044 -15.807 396 HG2 PRO 55 HG2 PRO 55 5.139 -0.414 -13.665 397 HG3 PRO 55 HG1 PRO 55 3.462 0.148 -13.494 398 HD2 PRO 55 HD2 PRO 55 4.234 -2.445 -13.024 399 HD3 PRO 55 HD1 PRO 55 2.609 -2.009 -13.582 400 H VAL 56 HN VAL 56 6.181 -3.102 -15.098 401 HA VAL 56 HA VAL 56 8.503 -2.024 -16.554 402 HB VAL 56 HB VAL 56 8.873 -3.807 -14.126 403 HG11 VAL 56 HG11 VAL 56 10.861 -3.109 -15.419 404 HG12 VAL 56 HG12 VAL 56 10.908 -2.549 -13.748 405 HG13 VAL 56 HG13 VAL 56 10.496 -1.424 -15.041 406 HG21 VAL 56 HG21 VAL 56 8.115 -0.888 -13.928 407 HG22 VAL 56 HG22 VAL 56 9.062 -1.698 -12.681 408 HG23 VAL 56 HG23 VAL 56 7.431 -2.259 -13.052 409 H CYS 57 HN CYS 57 7.200 -5.196 -15.380 410 HA CYS 57 HA CYS 57 8.881 -6.695 -17.231 411 HB2 CYS 57 HB2 CYS 57 6.863 -7.833 -15.270 412 HB3 CYS 57 HB1 CYS 57 8.156 -8.698 -16.081 413 H GLY 58 HN GLY 58 5.352 -6.576 -16.538 414 HA2 GLY 58 HA2 GLY 58 3.615 -6.276 -18.173 415 HA3 GLY 58 HA1 GLY 58 4.714 -6.871 -19.405 416 H GLU 59 HN GLU 59 4.997 -8.805 -16.689 417 HA GLU 59 HA GLU 59 3.561 -11.062 -17.795 418 HB2 GLU 59 HB2 GLU 59 5.621 -10.642 -15.658 419 HB3 GLU 59 HB1 GLU 59 4.669 -12.119 -15.619 420 HG2 GLU 59 HG2 GLU 59 5.417 -12.637 -17.904 421 HG3 GLU 59 HG1 GLU 59 6.402 -11.175 -17.900 422 H GLU 60 HN GLU 60 2.344 -12.559 -16.252 423 HA GLU 60 HA GLU 60 0.214 -11.104 -14.841 424 HB2 GLU 60 HB2 GLU 60 0.413 -13.945 -15.863 425 HB3 GLU 60 HB1 GLU 60 -0.919 -13.362 -14.878 426 HG2 GLU 60 HG2 GLU 60 -1.439 -11.686 -16.634 427 HG3 GLU 60 HG1 GLU 60 -0.159 -12.376 -17.629 428 H PHE 61 HN PHE 61 -0.178 -11.222 -12.755 429 HA PHE 61 HA PHE 61 1.048 -13.173 -10.996 430 HB2 PHE 61 HB2 PHE 61 1.931 -11.473 -9.384 431 HB3 PHE 61 HB1 PHE 61 2.774 -11.445 -10.916 432 HD1 PHE 61 HD2 PHE 61 2.508 -9.503 -12.439 433 HD2 PHE 61 HD1 PHE 61 0.722 -9.572 -8.575 434 HE1 PHE 61 HE2 PHE 61 2.158 -7.070 -12.551 435 HE2 PHE 61 HE1 PHE 61 0.385 -7.139 -8.682 436 HZ PHE 61 HZ PHE 61 1.107 -5.885 -10.672 437 H TYR 62 HN TYR 62 0.056 -13.304 -8.904 438 HA TYR 62 HA TYR 62 -2.754 -12.436 -8.893 439 HB2 TYR 62 HB2 TYR 62 -1.335 -14.909 -8.087 440 HB3 TYR 62 HB1 TYR 62 -2.653 -14.425 -7.038 441 HD1 TYR 62 HD1 TYR 62 -1.774 -15.584 -10.440 442 HD2 TYR 62 HD2 TYR 62 -4.954 -14.537 -7.802 443 HE1 TYR 62 HE1 TYR 62 -3.388 -16.628 -11.971 444 HE2 TYR 62 HE2 TYR 62 -6.570 -15.569 -9.336 445 HH TYR 62 HH TYR 62 -5.644 -16.696 -12.504 446 H GLY 63 HN GLY 63 -3.781 -11.796 -6.936 447 HA2 GLY 63 HA2 GLY 63 -2.234 -10.123 -5.164 448 HA3 GLY 63 HA1 GLY 63 -3.971 -10.347 -5.124 449 H LYS 64 HN LYS 64 -2.736 -13.364 -5.082 450 HA LYS 64 HA LYS 64 -3.043 -13.803 -2.210 451 HB2 LYS 64 HB2 LYS 64 -3.809 -15.310 -4.327 452 HB3 LYS 64 HB1 LYS 64 -2.284 -16.094 -3.948 453 HG2 LYS 64 HG2 LYS 64 -3.036 -16.587 -1.707 454 HG3 LYS 64 HG1 LYS 64 -4.517 -15.668 -1.956 455 HD2 LYS 64 HD2 LYS 64 -5.211 -17.258 -3.687 456 HD3 LYS 64 HD1 LYS 64 -3.723 -18.176 -3.438 457 HE2 LYS 64 HE2 LYS 64 -4.382 -18.597 -1.114 458 HE3 LYS 64 HE1 LYS 64 -5.868 -17.685 -1.371 459 HZ1 LYS 64 HZ1 LYS 64 -5.692 -19.636 -3.364 460 HZ2 LYS 64 HZ2 LYS 64 -6.817 -19.526 -2.106 461 HZ3 LYS 64 HZ3 LYS 64 -5.383 -20.395 -1.883 462 H THR 65 HN THR 65 -0.445 -13.331 -4.419 463 HA THR 65 HA THR 65 1.640 -14.541 -2.745 464 HB THR 65 HB THR 65 3.200 -13.779 -4.632 465 HG1 THR 65 HG1 THR 65 1.499 -12.300 -5.487 466 HG21 THR 65 HG21 THR 65 1.038 -15.710 -5.505 467 HG22 THR 65 HG22 THR 65 2.360 -16.127 -4.408 468 HG23 THR 65 HG23 THR 65 2.711 -15.647 -6.068 469 H LEU 66 HN LEU 66 -0.016 -11.753 -2.600 470 HA LEU 66 HA LEU 66 2.024 -9.709 -2.350 471 HB2 LEU 66 HB2 LEU 66 -0.827 -9.804 -2.617 472 HB3 LEU 66 HB1 LEU 66 -0.471 -8.936 -1.143 473 HG LEU 66 HG LEU 66 1.190 -7.701 -3.009 474 HD11 LEU 66 HD11 LEU 66 -0.124 -8.996 -4.761 475 HD12 LEU 66 HD12 LEU 66 -0.053 -7.245 -4.943 476 HD13 LEU 66 HD13 LEU 66 -1.506 -8.003 -4.297 477 HD21 LEU 66 HD21 LEU 66 -0.035 -6.586 -1.262 478 HD22 LEU 66 HD22 LEU 66 -1.568 -6.977 -2.042 479 HD23 LEU 66 HD23 LEU 66 -0.439 -5.867 -2.819 480 HA PRO 67 HA PRO 67 2.946 -10.254 2.160 481 HB2 PRO 67 HB2 PRO 67 2.830 -7.306 2.557 482 HB3 PRO 67 HB1 PRO 67 4.145 -8.425 2.939 483 HG2 PRO 67 HG2 PRO 67 4.401 -6.822 0.859 484 HG3 PRO 67 HG1 PRO 67 4.853 -8.534 0.694 485 HD2 PRO 67 HD2 PRO 67 2.298 -7.178 -0.166 486 HD3 PRO 67 HD1 PRO 67 3.358 -8.248 -1.105 487 H ARG 68 HN ARG 68 2.046 -10.368 4.178 488 HA ARG 68 HA ARG 68 -0.759 -10.172 4.506 489 HB2 ARG 68 HB2 ARG 68 1.504 -10.921 6.293 490 HB3 ARG 68 HB1 ARG 68 -0.066 -10.609 7.017 491 HG2 ARG 68 HG2 ARG 68 -1.067 -12.311 5.556 492 HG3 ARG 68 HG1 ARG 68 0.529 -12.644 4.876 493 HD2 ARG 68 HD2 ARG 68 1.343 -13.316 7.065 494 HD3 ARG 68 HD1 ARG 68 -0.217 -12.920 7.787 495 HE ARG 68 HE ARG 68 -0.358 -14.866 5.658 496 HH11 ARG 68 HH11 ARG 68 -0.015 -14.643 9.222 497 HH12 ARG 68 HH12 ARG 68 -0.506 -16.288 9.450 498 HH21 ARG 68 HH21 ARG 68 -0.980 -16.974 6.066 499 HH22 ARG 68 HH22 ARG 68 -1.045 -17.584 7.685 500 H ARG 69 HN ARG 69 1.600 -7.689 4.985 501 HA ARG 69 HA ARG 69 0.206 -6.168 7.036 502 HB2 ARG 69 HB2 ARG 69 2.758 -5.806 5.494 503 HB3 ARG 69 HB1 ARG 69 2.056 -4.461 6.378 504 HG2 ARG 69 HG2 ARG 69 2.235 -5.694 8.466 505 HG3 ARG 69 HG1 ARG 69 2.830 -7.111 7.601 506 HD2 ARG 69 HD2 ARG 69 4.756 -6.092 8.515 507 HD3 ARG 69 HD1 ARG 69 4.755 -5.628 6.815 508 HE ARG 69 HE ARG 69 3.449 -3.635 8.332 509 HH11 ARG 69 HH11 ARG 69 6.836 -4.702 7.838 510 HH12 ARG 69 HH12 ARG 69 7.465 -3.130 8.207 511 HH21 ARG 69 HH21 ARG 69 4.362 -1.651 8.787 512 HH22 ARG 69 HH22 ARG 69 6.078 -1.429 8.736 513 H GLU 70 HN GLU 70 0.681 -6.170 3.519 514 HA GLU 70 HA GLU 70 -0.565 -3.694 2.850 515 HB2 GLU 70 HB2 GLU 70 0.284 -6.116 1.313 516 HB3 GLU 70 HB1 GLU 70 -0.756 -4.934 0.538 517 HG2 GLU 70 HG2 GLU 70 0.945 -3.184 1.080 518 HG3 GLU 70 HG1 GLU 70 1.997 -4.467 1.669 519 H ALA 71 HN ALA 71 -1.827 -6.964 3.310 520 HA ALA 71 HA ALA 71 -4.433 -6.716 2.198 521 HB1 ALA 71 HB1 ALA 71 -4.937 -8.780 3.301 522 HB2 ALA 71 HB2 ALA 71 -3.616 -8.555 4.449 523 HB3 ALA 71 HB3 ALA 71 -3.265 -8.859 2.747 524 H GLU 72 HN GLU 72 -3.163 -6.039 5.453 525 HA GLU 72 HA GLU 72 -5.619 -5.395 6.785 526 HB2 GLU 72 HB2 GLU 72 -2.716 -5.010 7.433 527 HB3 GLU 72 HB1 GLU 72 -3.939 -4.214 8.411 528 HG2 GLU 72 HG2 GLU 72 -4.953 -6.416 8.881 529 HG3 GLU 72 HG1 GLU 72 -3.661 -7.180 7.956 530 H LYS 73 HN LYS 73 -3.434 -3.582 4.764 531 HA LYS 73 HA LYS 73 -4.269 -0.898 5.329 532 HB2 LYS 73 HB2 LYS 73 -2.437 -2.237 3.477 533 HB3 LYS 73 HB1 LYS 73 -3.219 -0.822 2.785 534 HG2 LYS 73 HG2 LYS 73 -2.392 0.564 4.583 535 HG3 LYS 73 HG1 LYS 73 -1.702 -0.847 5.388 536 HD2 LYS 73 HD2 LYS 73 -0.218 -1.208 3.454 537 HD3 LYS 73 HD1 LYS 73 -0.893 0.226 2.680 538 HE2 LYS 73 HE2 LYS 73 0.403 0.364 5.394 539 HE3 LYS 73 HE1 LYS 73 1.354 0.481 3.916 540 HZ1 LYS 73 HZ1 LYS 73 0.155 2.439 3.283 541 HZ2 LYS 73 HZ2 LYS 73 0.707 2.656 4.866 542 HZ3 LYS 73 HZ3 LYS 73 -0.917 2.281 4.583 543 H VAL 74 HN VAL 74 -5.420 -3.423 3.178 544 HA VAL 74 HA VAL 74 -7.023 -1.915 1.349 545 HB VAL 74 HB VAL 74 -7.620 -4.853 1.962 546 HG11 VAL 74 HG11 VAL 74 -7.884 -3.235 -0.588 547 HG12 VAL 74 HG12 VAL 74 -9.193 -3.877 0.405 548 HG13 VAL 74 HG13 VAL 74 -8.137 -4.977 -0.479 549 HG21 VAL 74 HG21 VAL 74 -5.123 -4.532 1.514 550 HG22 VAL 74 HG22 VAL 74 -5.583 -4.045 -0.116 551 HG23 VAL 74 HG23 VAL 74 -5.971 -5.666 0.459 552 H PHE 75 HN PHE 75 -7.846 -3.516 4.509 553 HA PHE 75 HA PHE 75 -10.603 -3.106 4.658 554 HB2 PHE 75 HB2 PHE 75 -8.706 -4.264 6.210 555 HB3 PHE 75 HB1 PHE 75 -9.009 -2.815 7.152 556 HD1 PHE 75 HD2 PHE 75 -11.177 -2.478 8.253 557 HD2 PHE 75 HD1 PHE 75 -10.360 -6.008 6.013 558 HE1 PHE 75 HE2 PHE 75 -13.111 -3.587 9.295 559 HE2 PHE 75 HE1 PHE 75 -12.288 -7.120 7.055 560 HZ PHE 75 HZ PHE 75 -13.666 -5.910 8.698 561 H GLU 76 HN GLU 76 -7.992 -0.775 5.170 562 HA GLU 76 HA GLU 76 -9.375 1.221 6.690 563 HB2 GLU 76 HB2 GLU 76 -6.763 0.707 6.272 564 HB3 GLU 76 HB1 GLU 76 -6.986 1.985 5.087 565 HG2 GLU 76 HG2 GLU 76 -7.866 3.442 6.869 566 HG3 GLU 76 HG1 GLU 76 -7.536 2.172 8.047 567 H LEU 77 HN LEU 77 -8.639 0.881 3.181 568 HA LEU 77 HA LEU 77 -9.710 3.373 2.362 569 HB2 LEU 77 HB2 LEU 77 -9.585 2.393 0.045 570 HB3 LEU 77 HB1 LEU 77 -8.094 2.467 0.912 571 HG LEU 77 HG LEU 77 -8.760 -0.105 1.394 572 HD11 LEU 77 HD11 LEU 77 -9.854 -1.149 -0.379 573 HD12 LEU 77 HD12 LEU 77 -9.673 0.259 -1.433 574 HD13 LEU 77 HD13 LEU 77 -10.811 0.307 -0.089 575 HD21 LEU 77 HD21 LEU 77 -6.628 0.427 0.574 576 HD22 LEU 77 HD22 LEU 77 -7.276 1.119 -0.913 577 HD23 LEU 77 HD23 LEU 77 -7.335 -0.624 -0.652 578 H LEU 78 HN LEU 78 -11.159 0.171 2.639 579 HA LEU 78 HA LEU 78 -13.696 0.801 1.413 580 HB2 LEU 78 HB2 LEU 78 -12.656 -1.560 2.955 581 HB3 LEU 78 HB1 LEU 78 -14.349 -1.426 2.522 582 HG LEU 78 HG LEU 78 -12.779 -0.987 0.161 583 HD11 LEU 78 HD11 LEU 78 -11.669 -3.097 -0.059 584 HD12 LEU 78 HD12 LEU 78 -12.198 -3.594 1.547 585 HD13 LEU 78 HD13 LEU 78 -11.044 -2.274 1.367 586 HD21 LEU 78 HD21 LEU 78 -14.578 -3.255 0.984 587 HD22 LEU 78 HD22 LEU 78 -14.074 -2.858 -0.657 588 HD23 LEU 78 HD23 LEU 78 -15.095 -1.740 0.242 589 H ASN 79 HN ASN 79 -12.365 1.045 4.654 590 HA ASN 79 HA ASN 79 -14.897 1.304 6.054 591 HB2 ASN 79 HB2 ASN 79 -12.049 1.091 6.814 592 HB3 ASN 79 HB1 ASN 79 -13.059 2.046 7.897 593 HD21 ASN 79 HD21 ASN 79 -14.675 1.057 9.061 594 HD22 ASN 79 HD22 ASN 79 -14.818 -0.659 9.192 595 H ASP 80 HN ASP 80 -12.825 3.465 4.350 596 HA ASP 80 HA ASP 80 -13.132 5.925 5.729 597 HB2 ASP 80 HB2 ASP 80 -12.278 5.132 2.983 598 HB3 ASP 80 HB1 ASP 80 -12.649 6.824 3.277 599 H PHE 81 HN PHE 81 -15.115 4.401 3.201 600 HA PHE 81 HA PHE 81 -17.115 4.696 2.224 601 HB2 PHE 81 HB2 PHE 81 -17.729 6.057 4.845 602 HB3 PHE 81 HB1 PHE 81 -18.935 6.005 3.572 603 HD1 PHE 81 HD2 PHE 81 -16.970 3.957 5.943 604 HD2 PHE 81 HD1 PHE 81 -20.138 3.995 3.088 605 HE1 PHE 81 HE2 PHE 81 -17.710 1.747 6.735 606 HE2 PHE 81 HE1 PHE 81 -20.880 1.789 3.887 607 HZ PHE 81 HZ PHE 81 -19.667 0.664 5.708 608 H LYS 82 HN LYS 82 -16.382 7.949 3.565 609 HA LYS 82 HA LYS 82 -16.778 9.165 0.911 610 HB2 LYS 82 HB2 LYS 82 -17.869 10.015 3.579 611 HB3 LYS 82 HB1 LYS 82 -17.510 11.233 2.368 612 HG2 LYS 82 HG2 LYS 82 -19.086 10.228 0.832 613 HG3 LYS 82 HG1 LYS 82 -19.382 8.904 1.962 614 HD2 LYS 82 HD2 LYS 82 -20.244 10.521 3.603 615 HD3 LYS 82 HD1 LYS 82 -19.982 11.824 2.443 616 HE2 LYS 82 HE2 LYS 82 -21.571 10.789 0.910 617 HE3 LYS 82 HE1 LYS 82 -21.811 9.457 2.042 618 HZ1 LYS 82 HZ1 LYS 82 -23.590 11.019 2.280 619 HZ2 LYS 82 HZ2 LYS 82 -22.514 12.308 2.482 620 HZ3 LYS 82 HZ3 LYS 82 -22.624 11.106 3.667 621 H GLY 83 HN GLY 83 -15.268 10.570 0.270 622 HA2 GLY 83 HA2 GLY 83 -13.481 12.054 1.905 623 HA3 GLY 83 HA1 GLY 83 -12.681 10.616 1.289 624 H GLY 84 HN GLY 84 -11.952 10.549 -0.730 625 HA2 GLY 84 HA2 GLY 84 -12.564 12.786 -2.578 626 HA3 GLY 84 HA1 GLY 84 -10.931 12.184 -2.348 627 H ILE 85 HN ILE 85 -13.999 10.406 -2.737 628 HA ILE 85 HA ILE 85 -12.987 9.139 -5.212 629 HB ILE 85 HB ILE 85 -15.009 7.631 -3.520 630 HG12 ILE 85 HG12 ILE 85 -12.505 6.403 -2.984 631 HG13 ILE 85 HG11 ILE 85 -12.326 8.106 -2.569 632 HG21 ILE 85 HG21 ILE 85 -12.795 6.601 -5.312 633 HG22 ILE 85 HG22 ILE 85 -14.479 6.812 -5.795 634 HG23 ILE 85 HG23 ILE 85 -14.061 5.636 -4.549 635 HD11 ILE 85 HD11 ILE 85 -14.350 7.914 -1.157 636 HD12 ILE 85 HD12 ILE 85 -13.018 6.886 -0.628 637 HD13 ILE 85 HD13 ILE 85 -14.381 6.185 -1.502 638 H ASP 86 HN ASP 86 -14.153 9.564 -6.928 639 HA ASP 86 HA ASP 86 -16.998 10.307 -6.720 640 HB2 ASP 86 HB2 ASP 86 -15.051 12.124 -7.331 641 HB3 ASP 86 HB1 ASP 86 -15.468 11.537 -8.937 642 H TRP 87 HN TRP 87 -18.319 9.186 -7.961 643 HA TRP 87 HA TRP 87 -17.381 7.103 -9.742 644 HB2 TRP 87 HB2 TRP 87 -20.113 7.870 -8.740 645 HB3 TRP 87 HB1 TRP 87 -19.897 6.639 -9.981 646 HD1 TRP 87 HD1 TRP 87 -19.671 7.219 -6.288 647 HE1 TRP 87 HE1 TRP 87 -18.987 5.074 -5.063 648 HE3 TRP 87 HE3 TRP 87 -18.401 4.258 -10.331 649 HZ2 TRP 87 HZ2 TRP 87 -18.049 2.538 -5.687 650 HZ3 TRP 87 HZ3 TRP 87 -17.623 1.960 -9.877 651 HH2 TRP 87 HH2 TRP 87 -17.457 1.123 -7.594 652 H GLU 88 HN GLU 88 -18.755 10.284 -10.186 653 HA GLU 88 HA GLU 88 -19.518 9.996 -12.963 654 HB2 GLU 88 HB2 GLU 88 -19.470 12.297 -11.031 655 HB3 GLU 88 HB1 GLU 88 -19.729 12.583 -12.743 656 HG2 GLU 88 HG2 GLU 88 -21.714 11.173 -12.702 657 HG3 GLU 88 HG1 GLU 88 -21.435 10.804 -11.003 658 H ASN 89 HN ASN 89 -16.751 11.422 -11.231 659 HA ASN 89 HA ASN 89 -15.427 12.237 -13.712 660 HB2 ASN 89 HB2 ASN 89 -15.101 12.950 -10.836 661 HB3 ASN 89 HB1 ASN 89 -13.711 13.130 -11.903 662 HD21 ASN 89 HD21 ASN 89 -13.867 14.564 -13.673 663 HD22 ASN 89 HD22 ASN 89 -15.003 15.865 -13.669 664 H LYS 90 HN LYS 90 -15.352 9.568 -11.539 665 HA LYS 90 HA LYS 90 -14.117 7.731 -11.151 666 HB2 LYS 90 HB2 LYS 90 -13.246 8.246 -13.998 667 HB3 LYS 90 HB1 LYS 90 -12.645 6.862 -13.102 668 HG2 LYS 90 HG2 LYS 90 -14.904 6.026 -12.830 669 HG3 LYS 90 HG1 LYS 90 -15.547 7.447 -13.654 670 HD2 LYS 90 HD2 LYS 90 -14.389 6.831 -15.691 671 HD3 LYS 90 HD1 LYS 90 -13.633 5.460 -14.878 672 HE2 LYS 90 HE2 LYS 90 -16.618 5.664 -14.940 673 HE3 LYS 90 HE1 LYS 90 -15.766 5.082 -16.370 674 HZ1 LYS 90 HZ1 LYS 90 -16.311 3.731 -13.918 675 HZ2 LYS 90 HZ2 LYS 90 -14.662 3.693 -14.285 676 HZ3 LYS 90 HZ3 LYS 90 -15.787 3.101 -15.398 677 H ARG 91 HN ARG 91 -13.196 9.461 -9.613 678 HA ARG 91 HA ARG 91 -10.249 9.408 -9.681 679 HB2 ARG 91 HB2 ARG 91 -12.121 11.500 -8.591 680 HB3 ARG 91 HB1 ARG 91 -10.473 11.367 -7.993 681 HG2 ARG 91 HG2 ARG 91 -9.609 11.748 -10.239 682 HG3 ARG 91 HG1 ARG 91 -11.255 11.835 -10.867 683 HD2 ARG 91 HD2 ARG 91 -11.686 13.802 -9.491 684 HD3 ARG 91 HD1 ARG 91 -10.054 13.703 -8.824 685 HE ARG 91 HE ARG 91 -10.127 13.867 -11.698 686 HH11 ARG 91 HH11 ARG 91 -9.977 15.999 -8.814 687 HH12 ARG 91 HH12 ARG 91 -9.341 17.320 -9.737 688 HH21 ARG 91 HH21 ARG 91 -9.312 15.625 -12.783 689 HH22 ARG 91 HH22 ARG 91 -8.971 17.106 -11.952 690 H VAL 92 HN VAL 92 -9.194 8.417 -8.152 691 HA VAL 92 HA VAL 92 -10.573 7.533 -5.691 692 HB VAL 92 HB VAL 92 -8.373 5.765 -6.801 693 HG11 VAL 92 HG11 VAL 92 -9.293 4.047 -5.473 694 HG12 VAL 92 HG12 VAL 92 -10.870 4.826 -5.398 695 HG13 VAL 92 HG13 VAL 92 -9.513 5.494 -4.491 696 HG21 VAL 92 HG21 VAL 92 -9.762 4.382 -8.146 697 HG22 VAL 92 HG22 VAL 92 -10.112 6.027 -8.665 698 HG23 VAL 92 HG23 VAL 92 -11.231 5.185 -7.596 699 H LYS 93 HN LYS 93 -9.609 8.115 -3.881 700 HA LYS 93 HA LYS 93 -6.801 9.024 -3.880 701 HB2 LYS 93 HB2 LYS 93 -9.162 10.451 -3.175 702 HB3 LYS 93 HB1 LYS 93 -8.252 10.168 -1.697 703 HG2 LYS 93 HG2 LYS 93 -6.309 11.241 -2.630 704 HG3 LYS 93 HG1 LYS 93 -7.109 11.404 -4.195 705 HD2 LYS 93 HD2 LYS 93 -8.786 12.875 -3.183 706 HD3 LYS 93 HD1 LYS 93 -7.988 12.708 -1.618 707 HE2 LYS 93 HE2 LYS 93 -5.962 13.722 -2.550 708 HE3 LYS 93 HE1 LYS 93 -6.768 13.893 -4.109 709 HZ1 LYS 93 HZ1 LYS 93 -6.703 15.874 -2.462 710 HZ2 LYS 93 HZ2 LYS 93 -7.991 15.075 -1.712 711 HZ3 LYS 93 HZ3 LYS 93 -8.122 15.555 -3.328 712 H LEU 94 HN LEU 94 -5.468 8.280 -2.335 713 HA LEU 94 HA LEU 94 -6.498 6.353 -0.377 714 HB2 LEU 94 HB2 LEU 94 -4.144 6.283 -2.182 715 HB3 LEU 94 HB1 LEU 94 -3.847 5.715 -0.565 716 HG LEU 94 HG LEU 94 -4.191 3.878 -2.145 717 HD11 LEU 94 HD11 LEU 94 -5.278 3.976 0.342 718 HD12 LEU 94 HD12 LEU 94 -5.103 2.529 -0.652 719 HD13 LEU 94 HD13 LEU 94 -6.626 3.414 -0.643 720 HD21 LEU 94 HD21 LEU 94 -5.721 3.778 -3.733 721 HD22 LEU 94 HD22 LEU 94 -6.314 5.361 -3.230 722 HD23 LEU 94 HD23 LEU 94 -7.025 3.897 -2.550 723 H LYS 95 HN LYS 95 -6.210 6.666 1.628 724 HA LYS 95 HA LYS 95 -4.420 8.779 2.641 725 HB2 LYS 95 HB2 LYS 95 -7.162 7.895 3.429 726 HB3 LYS 95 HB1 LYS 95 -6.100 8.519 4.683 727 HG2 LYS 95 HG2 LYS 95 -5.861 10.609 3.491 728 HG3 LYS 95 HG1 LYS 95 -6.829 9.984 2.155 729 HD2 LYS 95 HD2 LYS 95 -8.764 9.805 3.600 730 HD3 LYS 95 HD1 LYS 95 -7.807 10.321 4.990 731 HE2 LYS 95 HE2 LYS 95 -7.418 12.485 3.906 732 HE3 LYS 95 HE1 LYS 95 -8.391 11.965 2.529 733 HZ1 LYS 95 HZ1 LYS 95 -9.856 11.574 4.895 734 HZ2 LYS 95 HZ2 LYS 95 -10.208 12.598 3.596 735 HZ3 LYS 95 HZ3 LYS 95 -9.267 13.160 4.884 Start of MODEL 3 1 H1 MET 8 HT1 MET 8 1.869 0.858 0.363 2 H2 MET 8 HT2 MET 8 0.571 0.446 -0.640 3 H3 MET 8 HT3 MET 8 1.086 2.054 -0.544 4 HA MET 8 HA MET 8 1.988 1.383 -2.522 5 HB2 MET 8 HB2 MET 8 3.886 1.217 -0.232 6 HB3 MET 8 HB1 MET 8 4.479 0.728 -1.814 7 HG2 MET 8 HG2 MET 8 3.165 3.384 -1.303 8 HG3 MET 8 HG1 MET 8 4.905 3.126 -1.182 9 HE1 MET 8 HE1 MET 8 4.154 5.240 -4.371 10 HE2 MET 8 HE2 MET 8 5.671 4.881 -3.546 11 HE3 MET 8 HE3 MET 8 4.230 5.277 -2.610 12 H ALA 9 HN ALA 9 2.296 -0.132 -3.974 13 HA ALA 9 HA ALA 9 2.314 -2.969 -3.169 14 HB1 ALA 9 HB1 ALA 9 0.377 -2.619 -4.455 15 HB2 ALA 9 HB2 ALA 9 1.534 -3.273 -5.615 16 HB3 ALA 9 HB3 ALA 9 1.209 -1.540 -5.573 17 H LYS 10 HN LYS 10 3.812 -4.358 -3.945 18 HA LYS 10 HA LYS 10 5.982 -3.361 -5.666 19 HB2 LYS 10 HB2 LYS 10 6.198 -4.791 -3.029 20 HB3 LYS 10 HB1 LYS 10 7.468 -4.950 -4.228 21 HG2 LYS 10 HG2 LYS 10 7.836 -2.541 -4.181 22 HG3 LYS 10 HG1 LYS 10 6.528 -2.358 -3.008 23 HD2 LYS 10 HD2 LYS 10 7.751 -3.736 -1.411 24 HD3 LYS 10 HD1 LYS 10 9.047 -3.966 -2.586 25 HE2 LYS 10 HE2 LYS 10 9.489 -1.560 -2.567 26 HE3 LYS 10 HE1 LYS 10 8.189 -1.328 -1.398 27 HZ1 LYS 10 HZ1 LYS 10 10.493 -3.107 -0.856 28 HZ2 LYS 10 HZ2 LYS 10 9.387 -2.461 0.248 29 HZ3 LYS 10 HZ3 LYS 10 10.528 -1.455 -0.490 30 H CYS 11 HN CYS 11 6.728 -4.701 -7.202 31 HA CYS 11 HA CYS 11 5.273 -7.053 -7.952 32 HB2 CYS 11 HB2 CYS 11 6.349 -5.460 -9.604 33 HB3 CYS 11 HB1 CYS 11 7.902 -6.113 -9.136 34 HA PRO 12 HA PRO 12 7.964 -9.973 -5.547 35 HB2 PRO 12 HB2 PRO 12 6.739 -12.343 -6.141 36 HB3 PRO 12 HB1 PRO 12 6.116 -11.217 -4.931 37 HG2 PRO 12 HG2 PRO 12 5.220 -11.639 -7.774 38 HG3 PRO 12 HG1 PRO 12 4.232 -11.383 -6.319 39 HD2 PRO 12 HD2 PRO 12 4.776 -9.387 -8.112 40 HD3 PRO 12 HD1 PRO 12 4.519 -9.079 -6.385 41 H ILE 13 HN ILE 13 7.760 -9.722 -8.937 42 HA ILE 13 HA ILE 13 9.595 -11.906 -9.584 43 HB ILE 13 HB ILE 13 8.299 -10.032 -11.625 44 HG12 ILE 13 HG12 ILE 13 6.968 -12.606 -11.629 45 HG13 ILE 13 HG11 ILE 13 6.836 -11.894 -10.025 46 HG21 ILE 13 HG21 ILE 13 9.402 -12.858 -11.891 47 HG22 ILE 13 HG22 ILE 13 10.076 -11.384 -12.586 48 HG23 ILE 13 HG23 ILE 13 8.537 -12.011 -13.174 49 HD11 ILE 13 HD11 ILE 13 5.701 -10.001 -10.858 50 HD12 ILE 13 HD12 ILE 13 4.961 -11.401 -11.632 51 HD13 ILE 13 HD13 ILE 13 6.103 -10.401 -12.528 52 H CYS 14 HN CYS 14 9.300 -8.302 -10.134 53 HA CYS 14 HA CYS 14 12.199 -8.209 -10.632 54 HB2 CYS 14 HB2 CYS 14 11.840 -6.120 -11.831 55 HB3 CYS 14 HB1 CYS 14 10.834 -7.396 -12.491 56 H GLY 15 HN GLY 15 9.628 -6.608 -8.776 57 HA2 GLY 15 HA2 GLY 15 9.818 -5.842 -6.540 58 HA3 GLY 15 HA1 GLY 15 11.560 -5.785 -6.721 59 H SER 16 HN SER 16 9.192 -4.336 -8.929 60 HA SER 16 HA SER 16 10.351 -1.682 -8.463 61 HB2 SER 16 HB2 SER 16 9.159 -3.045 -10.754 62 HB3 SER 16 HB1 SER 16 8.575 -1.394 -10.548 63 HG SER 16 HG SER 16 11.020 -2.288 -11.357 64 HA PRO 17 HA PRO 17 6.574 -0.241 -6.234 65 HB2 PRO 17 HB2 PRO 17 6.928 2.492 -7.328 66 HB3 PRO 17 HB1 PRO 17 6.923 1.968 -5.640 67 HG2 PRO 17 HG2 PRO 17 9.207 2.715 -6.765 68 HG3 PRO 17 HG1 PRO 17 9.170 1.266 -5.732 69 HD2 PRO 17 HD2 PRO 17 9.036 1.415 -8.750 70 HD3 PRO 17 HD1 PRO 17 10.143 0.468 -7.732 71 H LEU 18 HN LEU 18 4.487 -0.159 -6.555 72 HA LEU 18 HA LEU 18 3.339 0.618 -9.157 73 HB2 LEU 18 HB2 LEU 18 2.699 -1.754 -7.415 74 HB3 LEU 18 HB1 LEU 18 1.520 -1.112 -8.547 75 HG LEU 18 HG LEU 18 4.159 -1.704 -9.732 76 HD11 LEU 18 HD11 LEU 18 3.690 -4.143 -9.806 77 HD12 LEU 18 HD12 LEU 18 2.437 -3.895 -8.590 78 HD13 LEU 18 HD13 LEU 18 4.122 -3.545 -8.204 79 HD21 LEU 18 HD21 LEU 18 1.410 -2.656 -10.527 80 HD22 LEU 18 HD22 LEU 18 2.839 -2.484 -11.545 81 HD23 LEU 18 HD23 LEU 18 2.016 -1.050 -10.931 82 H LYS 19 HN LYS 19 1.375 1.660 -9.145 83 HA LYS 19 HA LYS 19 0.621 2.978 -6.645 84 HB2 LYS 19 HB2 LYS 19 0.156 3.590 -9.552 85 HB3 LYS 19 HB1 LYS 19 -0.865 4.329 -8.328 86 HG2 LYS 19 HG2 LYS 19 1.061 5.377 -7.305 87 HG3 LYS 19 HG1 LYS 19 2.139 4.562 -8.441 88 HD2 LYS 19 HD2 LYS 19 1.092 5.750 -10.298 89 HD3 LYS 19 HD1 LYS 19 -0.017 6.543 -9.178 90 HE2 LYS 19 HE2 LYS 19 1.871 7.619 -8.065 91 HE3 LYS 19 HE1 LYS 19 2.988 6.810 -9.163 92 HZ1 LYS 19 HZ1 LYS 19 1.378 9.156 -9.584 93 HZ2 LYS 19 HZ2 LYS 19 1.271 8.039 -10.849 94 HZ3 LYS 19 HZ3 LYS 19 2.780 8.648 -10.385 95 H TRP 20 HN TRP 20 -1.065 2.427 -5.495 96 HA TRP 20 HA TRP 20 -2.948 0.379 -6.178 97 HB2 TRP 20 HB2 TRP 20 -2.557 2.175 -3.816 98 HB3 TRP 20 HB1 TRP 20 -4.090 1.325 -3.989 99 HD1 TRP 20 HD1 TRP 20 -0.375 0.695 -3.334 100 HE1 TRP 20 HE1 TRP 20 -0.049 -1.695 -2.459 101 HE3 TRP 20 HE3 TRP 20 -5.167 -1.135 -3.957 102 HZ2 TRP 20 HZ2 TRP 20 -1.567 -4.027 -2.081 103 HZ3 TRP 20 HZ3 TRP 20 -5.612 -3.459 -3.290 104 HH2 TRP 20 HH2 TRP 20 -3.848 -4.871 -2.363 105 H GLU 21 HN GLU 21 -2.986 3.833 -6.504 106 HA GLU 21 HA GLU 21 -5.771 4.337 -6.875 107 HB2 GLU 21 HB2 GLU 21 -3.270 5.870 -7.524 108 HB3 GLU 21 HB1 GLU 21 -4.830 6.433 -8.101 109 HG2 GLU 21 HG2 GLU 21 -5.642 6.561 -5.802 110 HG3 GLU 21 HG1 GLU 21 -4.084 5.981 -5.218 111 H GLU 22 HN GLU 22 -3.166 3.299 -9.058 112 HA GLU 22 HA GLU 22 -4.592 3.661 -11.553 113 HB2 GLU 22 HB2 GLU 22 -1.989 2.408 -10.771 114 HB3 GLU 22 HB1 GLU 22 -2.667 2.073 -12.358 115 HG2 GLU 22 HG2 GLU 22 -2.714 4.487 -12.822 116 HG3 GLU 22 HG1 GLU 22 -1.971 4.785 -11.251 117 H LEU 23 HN LEU 23 -4.094 1.008 -9.284 118 HA LEU 23 HA LEU 23 -5.045 -1.206 -10.759 119 HB2 LEU 23 HB2 LEU 23 -3.678 -0.987 -8.527 120 HB3 LEU 23 HB1 LEU 23 -5.253 -0.992 -7.770 121 HG LEU 23 HG LEU 23 -5.219 -3.200 -9.491 122 HD11 LEU 23 HD11 LEU 23 -2.742 -3.153 -7.790 123 HD12 LEU 23 HD12 LEU 23 -2.757 -2.947 -9.543 124 HD13 LEU 23 HD13 LEU 23 -3.297 -4.466 -8.828 125 HD21 LEU 23 HD21 LEU 23 -6.439 -3.065 -7.413 126 HD22 LEU 23 HD22 LEU 23 -4.930 -2.994 -6.503 127 HD23 LEU 23 HD23 LEU 23 -5.363 -4.462 -7.381 128 H ILE 24 HN ILE 24 -6.726 1.054 -8.560 129 HA ILE 24 HA ILE 24 -9.337 -0.202 -8.727 130 HB ILE 24 HB ILE 24 -8.843 2.565 -7.573 131 HG12 ILE 24 HG12 ILE 24 -7.250 1.355 -6.252 132 HG13 ILE 24 HG11 ILE 24 -8.654 1.569 -5.238 133 HG21 ILE 24 HG21 ILE 24 -11.198 2.014 -7.827 134 HG22 ILE 24 HG22 ILE 24 -10.783 2.170 -6.118 135 HG23 ILE 24 HG23 ILE 24 -10.994 0.571 -6.834 136 HD11 ILE 24 HD11 ILE 24 -7.576 -0.984 -6.442 137 HD12 ILE 24 HD12 ILE 24 -9.209 -0.886 -5.785 138 HD13 ILE 24 HD13 ILE 24 -7.821 -0.582 -4.741 139 H GLU 25 HN GLU 25 -7.747 2.647 -10.196 140 HA GLU 25 HA GLU 25 -9.966 3.822 -11.521 141 HB2 GLU 25 HB2 GLU 25 -7.321 4.477 -11.079 142 HB3 GLU 25 HB1 GLU 25 -7.397 4.271 -12.821 143 HG2 GLU 25 HG2 GLU 25 -9.246 5.874 -12.926 144 HG3 GLU 25 HG1 GLU 25 -9.159 6.078 -11.178 145 H GLU 26 HN GLU 26 -7.656 1.337 -12.568 146 HA GLU 26 HA GLU 26 -8.493 1.144 -15.321 147 HB2 GLU 26 HB2 GLU 26 -6.669 -0.415 -13.524 148 HB3 GLU 26 HB1 GLU 26 -7.105 -1.026 -15.093 149 HG2 GLU 26 HG2 GLU 26 -6.164 0.976 -16.158 150 HG3 GLU 26 HG1 GLU 26 -5.697 1.582 -14.571 151 H MET 27 HN MET 27 -9.531 -0.192 -12.309 152 HA MET 27 HA MET 27 -10.984 -2.403 -13.542 153 HB2 MET 27 HB2 MET 27 -9.653 -2.040 -10.911 154 HB3 MET 27 HB1 MET 27 -11.131 -2.989 -10.915 155 HG2 MET 27 HG2 MET 27 -10.154 -4.456 -12.638 156 HG3 MET 27 HG1 MET 27 -8.658 -3.527 -12.544 157 HE1 MET 27 HE1 MET 27 -7.286 -5.855 -12.022 158 HE2 MET 27 HE2 MET 27 -8.853 -6.625 -12.272 159 HE3 MET 27 HE3 MET 27 -7.895 -7.020 -10.845 160 H LEU 28 HN LEU 28 -11.627 0.682 -12.978 161 HA LEU 28 HA LEU 28 -14.149 0.453 -11.524 162 HB2 LEU 28 HB2 LEU 28 -12.216 2.321 -11.391 163 HB3 LEU 28 HB1 LEU 28 -13.240 3.080 -12.593 164 HG LEU 28 HG LEU 28 -15.063 2.418 -10.642 165 HD11 LEU 28 HD11 LEU 28 -12.588 3.385 -9.221 166 HD12 LEU 28 HD12 LEU 28 -13.190 1.728 -9.154 167 HD13 LEU 28 HD13 LEU 28 -14.166 3.048 -8.511 168 HD21 LEU 28 HD21 LEU 28 -14.980 4.816 -10.068 169 HD22 LEU 28 HD22 LEU 28 -14.999 4.515 -11.806 170 HD23 LEU 28 HD23 LEU 28 -13.492 4.960 -11.005 171 H ILE 29 HN ILE 29 -13.763 -0.624 -14.294 172 HA ILE 29 HA ILE 29 -15.661 0.883 -15.935 173 HB ILE 29 HB ILE 29 -15.054 -0.868 -17.735 174 HG12 ILE 29 HG12 ILE 29 -12.312 -1.216 -16.950 175 HG13 ILE 29 HG11 ILE 29 -13.339 -1.927 -15.710 176 HG21 ILE 29 HG21 ILE 29 -13.042 0.445 -18.381 177 HG22 ILE 29 HG22 ILE 29 -13.122 1.220 -16.798 178 HG23 ILE 29 HG23 ILE 29 -14.450 1.415 -17.941 179 HD11 ILE 29 HD11 ILE 29 -14.489 -3.218 -17.495 180 HD12 ILE 29 HD12 ILE 29 -12.780 -3.612 -17.304 181 HD13 ILE 29 HD13 ILE 29 -13.306 -2.591 -18.642 182 H ILE 30 HN ILE 30 -16.094 -1.182 -13.593 183 HA ILE 30 HA ILE 30 -18.197 -2.865 -14.816 184 HB ILE 30 HB ILE 30 -17.034 -3.451 -12.047 185 HG12 ILE 30 HG12 ILE 30 -16.001 -5.345 -13.984 186 HG13 ILE 30 HG11 ILE 30 -15.518 -3.722 -14.455 187 HG21 ILE 30 HG21 ILE 30 -18.038 -5.569 -12.177 188 HG22 ILE 30 HG22 ILE 30 -18.041 -5.576 -13.939 189 HG23 ILE 30 HG23 ILE 30 -19.201 -4.581 -13.065 190 HD11 ILE 30 HD11 ILE 30 -15.023 -4.953 -11.752 191 HD12 ILE 30 HD12 ILE 30 -14.458 -3.376 -12.311 192 HD13 ILE 30 HD13 ILE 30 -13.845 -4.849 -13.060 193 H GLU 31 HN GLU 31 -20.235 -2.790 -14.088 194 HA GLU 31 HA GLU 31 -21.121 -0.585 -12.402 195 HB2 GLU 31 HB2 GLU 31 -22.522 -2.541 -14.199 196 HB3 GLU 31 HB1 GLU 31 -23.443 -1.608 -13.030 197 HG2 GLU 31 HG2 GLU 31 -22.651 0.465 -14.042 198 HG3 GLU 31 HG1 GLU 31 -21.695 -0.458 -15.201 199 H ASN 32 HN ASN 32 -20.586 -3.982 -12.050 200 HA ASN 32 HA ASN 32 -22.194 -4.329 -9.638 201 HB2 ASN 32 HB2 ASN 32 -20.697 -6.165 -11.486 202 HB3 ASN 32 HB1 ASN 32 -21.082 -6.718 -9.859 203 HD21 ASN 32 HD21 ASN 32 -23.301 -6.820 -9.233 204 HD22 ASN 32 HD22 ASN 32 -24.535 -7.024 -10.425 205 H PHE 33 HN PHE 33 -19.807 -2.536 -9.728 206 HA PHE 33 HA PHE 33 -17.655 -3.719 -8.155 207 HB2 PHE 33 HB2 PHE 33 -17.450 -1.879 -10.028 208 HB3 PHE 33 HB1 PHE 33 -17.748 -0.782 -8.710 209 HD1 PHE 33 HD2 PHE 33 -15.355 -3.224 -10.095 210 HD2 PHE 33 HD1 PHE 33 -16.085 -0.415 -6.971 211 HE1 PHE 33 HE2 PHE 33 -12.987 -3.334 -9.442 212 HE2 PHE 33 HE1 PHE 33 -13.714 -0.532 -6.319 213 HZ PHE 33 HZ PHE 33 -12.166 -1.987 -7.553 214 H GLU 34 HN GLU 34 -20.343 -1.485 -7.717 215 HA GLU 34 HA GLU 34 -19.975 -0.428 -5.162 216 HB2 GLU 34 HB2 GLU 34 -22.406 -1.019 -6.784 217 HB3 GLU 34 HB1 GLU 34 -22.592 -0.467 -5.127 218 HG2 GLU 34 HG2 GLU 34 -21.256 1.535 -5.677 219 HG3 GLU 34 HG1 GLU 34 -21.171 0.989 -7.350 220 H GLU 35 HN GLU 35 -20.921 -3.682 -5.967 221 HA GLU 35 HA GLU 35 -21.913 -4.451 -3.343 222 HB2 GLU 35 HB2 GLU 35 -21.483 -5.913 -5.938 223 HB3 GLU 35 HB1 GLU 35 -21.775 -6.810 -4.460 224 HG2 GLU 35 HG2 GLU 35 -23.922 -5.688 -4.194 225 HG3 GLU 35 HG1 GLU 35 -23.623 -4.759 -5.663 226 H ILE 36 HN ILE 36 -18.957 -5.038 -5.306 227 HA ILE 36 HA ILE 36 -17.584 -6.687 -3.374 228 HB ILE 36 HB ILE 36 -16.304 -5.319 -5.807 229 HG12 ILE 36 HG12 ILE 36 -16.719 -8.189 -6.110 230 HG13 ILE 36 HG11 ILE 36 -18.254 -7.362 -5.880 231 HG21 ILE 36 HG21 ILE 36 -15.019 -6.650 -3.769 232 HG22 ILE 36 HG22 ILE 36 -14.363 -6.502 -5.401 233 HG23 ILE 36 HG23 ILE 36 -15.255 -7.953 -4.931 234 HD11 ILE 36 HD11 ILE 36 -16.258 -6.448 -7.933 235 HD12 ILE 36 HD12 ILE 36 -17.983 -6.092 -7.838 236 HD13 ILE 36 HD13 ILE 36 -17.440 -7.713 -8.271 237 H VAL 37 HN VAL 37 -17.393 -3.225 -4.269 238 HA VAL 37 HA VAL 37 -15.207 -2.525 -2.599 239 HB VAL 37 HB VAL 37 -16.002 -1.402 -4.759 240 HG11 VAL 37 HG11 VAL 37 -18.311 -0.701 -3.506 241 HG12 VAL 37 HG12 VAL 37 -17.669 0.138 -4.919 242 HG13 VAL 37 HG13 VAL 37 -17.370 0.773 -3.303 243 HG21 VAL 37 HG21 VAL 37 -14.979 0.194 -2.427 244 HG22 VAL 37 HG22 VAL 37 -15.049 0.833 -4.068 245 HG23 VAL 37 HG23 VAL 37 -14.057 -0.583 -3.716 246 H LYS 38 HN LYS 38 -18.523 -2.941 -1.809 247 HA LYS 38 HA LYS 38 -18.471 -1.437 0.695 248 HB2 LYS 38 HB2 LYS 38 -20.573 -2.893 -0.860 249 HB3 LYS 38 HB1 LYS 38 -20.838 -2.587 0.850 250 HG2 LYS 38 HG2 LYS 38 -20.606 -0.196 0.477 251 HG3 LYS 38 HG1 LYS 38 -20.274 -0.483 -1.233 252 HD2 LYS 38 HD2 LYS 38 -22.499 -1.517 -1.463 253 HD3 LYS 38 HD1 LYS 38 -22.825 -1.155 0.233 254 HE2 LYS 38 HE2 LYS 38 -22.617 1.222 -0.212 255 HE3 LYS 38 HE1 LYS 38 -22.213 0.891 -1.897 256 HZ1 LYS 38 HZ1 LYS 38 -24.510 1.486 -1.746 257 HZ2 LYS 38 HZ2 LYS 38 -24.796 0.325 -0.549 258 HZ3 LYS 38 HZ3 LYS 38 -24.418 -0.161 -2.124 259 H ASP 39 HN ASP 39 -17.795 -4.645 -0.351 260 HA ASP 39 HA ASP 39 -17.791 -5.667 2.396 261 HB2 ASP 39 HB2 ASP 39 -18.912 -6.874 -0.085 262 HB3 ASP 39 HB1 ASP 39 -18.056 -7.969 0.995 263 H ARG 40 HN ARG 40 -15.736 -5.449 2.928 264 HA ARG 40 HA ARG 40 -13.393 -5.850 1.512 265 HB2 ARG 40 HB2 ARG 40 -12.256 -6.316 3.767 266 HB3 ARG 40 HB1 ARG 40 -13.070 -4.786 3.587 267 HG2 ARG 40 HG2 ARG 40 -13.819 -5.305 5.699 268 HG3 ARG 40 HG1 ARG 40 -15.040 -6.206 4.796 269 HD2 ARG 40 HD2 ARG 40 -13.518 -8.204 4.928 270 HD3 ARG 40 HD1 ARG 40 -12.511 -7.276 6.040 271 HE ARG 40 HE ARG 40 -15.078 -7.152 7.048 272 HH11 ARG 40 HH11 ARG 40 -12.795 -9.873 6.562 273 HH12 ARG 40 HH12 ARG 40 -13.513 -10.802 7.835 274 HH21 ARG 40 HH21 ARG 40 -15.929 -8.428 8.663 275 HH22 ARG 40 HH22 ARG 40 -15.264 -9.990 9.006 276 H GLU 41 HN GLU 41 -15.328 -8.368 2.984 277 HA GLU 41 HA GLU 41 -13.567 -10.591 2.806 278 HB2 GLU 41 HB2 GLU 41 -16.085 -10.061 3.834 279 HB3 GLU 41 HB1 GLU 41 -16.391 -11.232 2.566 280 HG2 GLU 41 HG2 GLU 41 -14.796 -12.767 3.581 281 HG3 GLU 41 HG1 GLU 41 -14.451 -11.579 4.838 282 H ARG 42 HN ARG 42 -15.862 -9.164 0.521 283 HA ARG 42 HA ARG 42 -15.635 -11.196 -1.526 284 HB2 ARG 42 HB2 ARG 42 -17.081 -8.580 -1.303 285 HB3 ARG 42 HB1 ARG 42 -16.881 -9.329 -2.879 286 HG2 ARG 42 HG2 ARG 42 -18.038 -11.329 -2.076 287 HG3 ARG 42 HG1 ARG 42 -18.232 -10.579 -0.490 288 HD2 ARG 42 HD2 ARG 42 -19.570 -8.804 -1.468 289 HD3 ARG 42 HD1 ARG 42 -19.330 -9.482 -3.077 290 HE ARG 42 HE ARG 42 -20.453 -11.480 -1.496 291 HH11 ARG 42 HH11 ARG 42 -21.645 -8.351 -2.777 292 HH12 ARG 42 HH12 ARG 42 -23.293 -8.883 -2.760 293 HH21 ARG 42 HH21 ARG 42 -22.606 -12.069 -1.519 294 HH22 ARG 42 HH22 ARG 42 -23.825 -10.962 -2.056 295 H PHE 43 HN PHE 43 -14.246 -7.967 -0.920 296 HA PHE 43 HA PHE 43 -12.938 -7.620 -3.456 297 HB2 PHE 43 HB2 PHE 43 -13.655 -5.846 -1.589 298 HB3 PHE 43 HB1 PHE 43 -12.011 -6.113 -1.037 299 HD1 PHE 43 HD2 PHE 43 -10.082 -5.552 -2.592 300 HD2 PHE 43 HD1 PHE 43 -14.113 -4.474 -3.481 301 HE1 PHE 43 HE2 PHE 43 -9.286 -3.912 -4.243 302 HE2 PHE 43 HE1 PHE 43 -13.313 -2.838 -5.132 303 HZ PHE 43 HZ PHE 43 -10.902 -2.560 -5.513 304 H LEU 44 HN LEU 44 -11.741 -8.640 -0.211 305 HA LEU 44 HA LEU 44 -8.997 -8.999 -0.937 306 HB2 LEU 44 HB2 LEU 44 -10.651 -9.783 1.417 307 HB3 LEU 44 HB1 LEU 44 -9.084 -10.533 1.205 308 HG LEU 44 HG LEU 44 -9.077 -7.586 1.012 309 HD11 LEU 44 HD11 LEU 44 -9.171 -7.288 3.450 310 HD12 LEU 44 HD12 LEU 44 -9.660 -8.974 3.624 311 HD13 LEU 44 HD13 LEU 44 -10.708 -7.834 2.782 312 HD21 LEU 44 HD21 LEU 44 -7.401 -9.425 2.715 313 HD22 LEU 44 HD22 LEU 44 -7.017 -7.790 2.178 314 HD23 LEU 44 HD23 LEU 44 -7.059 -9.113 1.013 315 H ALA 45 HN ALA 45 -11.781 -11.052 -1.134 316 HA ALA 45 HA ALA 45 -10.421 -13.561 -1.658 317 HB1 ALA 45 HB1 ALA 45 -12.635 -13.442 -0.555 318 HB2 ALA 45 HB2 ALA 45 -12.620 -14.489 -1.973 319 HB3 ALA 45 HB3 ALA 45 -13.325 -12.876 -2.077 320 H GLN 46 HN GLN 46 -11.763 -10.935 -3.594 321 HA GLN 46 HA GLN 46 -11.692 -12.266 -6.157 322 HB2 GLN 46 HB2 GLN 46 -13.009 -10.052 -5.190 323 HB3 GLN 46 HB1 GLN 46 -11.761 -9.334 -6.200 324 HG2 GLN 46 HG2 GLN 46 -12.511 -10.673 -8.099 325 HG3 GLN 46 HG1 GLN 46 -13.748 -11.420 -7.094 326 HE21 GLN 46 HE21 GLN 46 -15.687 -10.558 -7.163 327 HE22 GLN 46 HE22 GLN 46 -16.080 -8.965 -7.707 328 H VAL 47 HN VAL 47 -9.568 -9.965 -4.421 329 HA VAL 47 HA VAL 47 -7.667 -9.483 -6.529 330 HB VAL 47 HB VAL 47 -7.263 -9.023 -3.516 331 HG11 VAL 47 HG11 VAL 47 -5.768 -7.478 -5.631 332 HG12 VAL 47 HG12 VAL 47 -5.129 -8.995 -5.003 333 HG13 VAL 47 HG13 VAL 47 -5.396 -7.633 -3.914 334 HG21 VAL 47 HG21 VAL 47 -8.087 -7.009 -5.614 335 HG22 VAL 47 HG22 VAL 47 -7.770 -6.669 -3.913 336 HG23 VAL 47 HG23 VAL 47 -9.132 -7.690 -4.367 337 H GLU 48 HN GLU 48 -7.769 -11.789 -3.794 338 HA GLU 48 HA GLU 48 -5.241 -13.077 -4.131 339 HB2 GLU 48 HB2 GLU 48 -7.761 -13.904 -2.693 340 HB3 GLU 48 HB1 GLU 48 -6.349 -14.942 -2.755 341 HG2 GLU 48 HG2 GLU 48 -5.038 -13.083 -1.699 342 HG3 GLU 48 HG1 GLU 48 -6.556 -12.213 -1.504 343 H GLU 49 HN GLU 49 -8.357 -13.618 -5.643 344 HA GLU 49 HA GLU 49 -7.646 -16.181 -6.853 345 HB2 GLU 49 HB2 GLU 49 -10.149 -14.577 -6.595 346 HB3 GLU 49 HB1 GLU 49 -10.035 -15.742 -7.905 347 HG2 GLU 49 HG2 GLU 49 -9.310 -16.701 -5.189 348 HG3 GLU 49 HG1 GLU 49 -11.019 -16.398 -5.501 349 H PHE 50 HN PHE 50 -7.845 -12.813 -7.780 350 HA PHE 50 HA PHE 50 -7.583 -13.361 -10.659 351 HB2 PHE 50 HB2 PHE 50 -8.873 -11.325 -9.170 352 HB3 PHE 50 HB1 PHE 50 -7.541 -10.547 -10.007 353 HD1 PHE 50 HD1 PHE 50 -7.517 -10.402 -12.449 354 HD2 PHE 50 HD2 PHE 50 -10.764 -12.239 -10.383 355 HE1 PHE 50 HE1 PHE 50 -8.896 -10.251 -14.479 356 HE2 PHE 50 HE2 PHE 50 -12.139 -12.094 -12.417 357 HZ PHE 50 HZ PHE 50 -11.206 -11.099 -14.466 358 H VAL 51 HN VAL 51 -5.882 -12.576 -11.916 359 HA VAL 51 HA VAL 51 -3.389 -12.075 -10.464 360 HB VAL 51 HB VAL 51 -3.734 -14.151 -12.011 361 HG11 VAL 51 HG11 VAL 51 -3.167 -14.114 -14.288 362 HG12 VAL 51 HG12 VAL 51 -2.638 -12.431 -14.220 363 HG13 VAL 51 HG13 VAL 51 -4.357 -12.823 -14.096 364 HG21 VAL 51 HG21 VAL 51 -1.244 -12.487 -11.971 365 HG22 VAL 51 HG22 VAL 51 -1.291 -14.119 -12.637 366 HG23 VAL 51 HG23 VAL 51 -1.673 -13.848 -10.936 367 H PHE 52 HN PHE 52 -1.867 -10.535 -11.244 368 HA PHE 52 HA PHE 52 -3.018 -8.262 -12.741 369 HB2 PHE 52 HB2 PHE 52 -1.242 -8.149 -10.289 370 HB3 PHE 52 HB1 PHE 52 -1.649 -6.753 -11.264 371 HD1 PHE 52 HD2 PHE 52 -3.897 -5.767 -11.160 372 HD2 PHE 52 HD1 PHE 52 -2.860 -9.146 -8.776 373 HE1 PHE 52 HE2 PHE 52 -5.906 -5.417 -9.781 374 HE2 PHE 52 HE1 PHE 52 -4.865 -8.796 -7.404 375 HZ PHE 52 HZ PHE 52 -6.392 -6.930 -7.904 376 H LYS 53 HN LYS 53 -1.688 -7.135 -14.077 377 HA LYS 53 HA LYS 53 0.742 -8.506 -14.999 378 HB2 LYS 53 HB2 LYS 53 -1.183 -6.596 -16.291 379 HB3 LYS 53 HB1 LYS 53 0.432 -6.791 -16.952 380 HG2 LYS 53 HG2 LYS 53 0.026 -9.151 -17.332 381 HG3 LYS 53 HG1 LYS 53 -1.565 -9.020 -16.581 382 HD2 LYS 53 HD2 LYS 53 -2.236 -7.420 -18.327 383 HD3 LYS 53 HD1 LYS 53 -0.656 -7.608 -19.090 384 HE2 LYS 53 HE2 LYS 53 -1.107 -9.973 -19.466 385 HE3 LYS 53 HE1 LYS 53 -2.669 -9.814 -18.664 386 HZ1 LYS 53 HZ1 LYS 53 -1.930 -9.168 -21.353 387 HZ2 LYS 53 HZ2 LYS 53 -2.714 -7.882 -20.583 388 HZ3 LYS 53 HZ3 LYS 53 -3.468 -9.393 -20.682 389 H CYS 54 HN CYS 54 2.726 -7.602 -15.069 390 HA CYS 54 HA CYS 54 3.119 -5.070 -13.673 391 HB2 CYS 54 HB2 CYS 54 4.379 -7.106 -12.901 392 HB3 CYS 54 HB1 CYS 54 5.270 -7.057 -14.419 393 HA PRO 55 HA PRO 55 3.913 -3.215 -17.916 394 HB2 PRO 55 HB2 PRO 55 4.186 -0.672 -16.403 395 HB3 PRO 55 HB1 PRO 55 3.140 -1.032 -17.781 396 HG2 PRO 55 HG2 PRO 55 2.063 -0.755 -15.381 397 HG3 PRO 55 HG1 PRO 55 1.528 -2.091 -16.426 398 HD2 PRO 55 HD2 PRO 55 3.543 -2.166 -14.174 399 HD3 PRO 55 HD1 PRO 55 2.113 -3.192 -14.432 400 H VAL 56 HN VAL 56 5.939 -3.363 -15.198 401 HA VAL 56 HA VAL 56 8.226 -1.844 -16.195 402 HB VAL 56 HB VAL 56 8.501 -3.597 -13.743 403 HG11 VAL 56 HG11 VAL 56 9.995 -1.905 -12.916 404 HG12 VAL 56 HG12 VAL 56 9.532 -0.794 -14.205 405 HG13 VAL 56 HG13 VAL 56 10.427 -2.263 -14.589 406 HG21 VAL 56 HG21 VAL 56 6.314 -1.972 -13.712 407 HG22 VAL 56 HG22 VAL 56 7.540 -0.859 -13.113 408 HG23 VAL 56 HG23 VAL 56 7.237 -2.374 -12.262 409 H CYS 57 HN CYS 57 7.546 -5.290 -15.371 410 HA CYS 57 HA CYS 57 9.889 -6.121 -16.927 411 HB2 CYS 57 HB2 CYS 57 9.766 -8.270 -15.707 412 HB3 CYS 57 HB1 CYS 57 9.979 -6.889 -14.646 413 H GLY 58 HN GLY 58 6.443 -7.060 -16.455 414 HA2 GLY 58 HA2 GLY 58 5.085 -7.260 -18.542 415 HA3 GLY 58 HA1 GLY 58 6.428 -8.162 -19.215 416 H GLU 59 HN GLU 59 6.521 -9.337 -16.240 417 HA GLU 59 HA GLU 59 4.896 -11.695 -16.767 418 HB2 GLU 59 HB2 GLU 59 7.035 -11.016 -14.771 419 HB3 GLU 59 HB1 GLU 59 5.990 -12.400 -14.491 420 HG2 GLU 59 HG2 GLU 59 6.683 -13.325 -16.678 421 HG3 GLU 59 HG1 GLU 59 7.789 -11.967 -16.871 422 H GLU 60 HN GLU 60 3.318 -12.561 -15.397 423 HA GLU 60 HA GLU 60 1.666 -10.615 -13.982 424 HB2 GLU 60 HB2 GLU 60 1.189 -13.383 -15.048 425 HB3 GLU 60 HB1 GLU 60 0.052 -12.628 -13.949 426 HG2 GLU 60 HG2 GLU 60 -0.300 -10.801 -15.522 427 HG3 GLU 60 HG1 GLU 60 0.898 -11.488 -16.611 428 H PHE 61 HN PHE 61 1.093 -10.652 -11.892 429 HA PHE 61 HA PHE 61 2.230 -12.671 -10.086 430 HB2 PHE 61 HB2 PHE 61 2.550 -10.872 -8.364 431 HB3 PHE 61 HB1 PHE 61 3.591 -10.692 -9.760 432 HD1 PHE 61 HD1 PHE 61 3.276 -8.793 -11.300 433 HD2 PHE 61 HD2 PHE 61 0.875 -9.230 -7.814 434 HE1 PHE 61 HE1 PHE 61 2.548 -6.450 -11.509 435 HE2 PHE 61 HE2 PHE 61 0.146 -6.889 -8.017 436 HZ PHE 61 HZ PHE 61 0.982 -5.497 -9.868 437 H TYR 62 HN TYR 62 0.955 -13.316 -8.334 438 HA TYR 62 HA TYR 62 -1.917 -12.838 -8.647 439 HB2 TYR 62 HB2 TYR 62 -0.322 -15.031 -7.325 440 HB3 TYR 62 HB1 TYR 62 -2.046 -14.869 -7.050 441 HD1 TYR 62 HD2 TYR 62 -3.648 -15.277 -8.949 442 HD2 TYR 62 HD1 TYR 62 0.545 -15.897 -9.388 443 HE1 TYR 62 HE2 TYR 62 -4.060 -16.613 -10.967 444 HE2 TYR 62 HE1 TYR 62 0.137 -17.230 -11.409 445 HH TYR 62 HH TYR 62 -1.517 -18.401 -12.539 446 H GLY 63 HN GLY 63 -3.333 -12.439 -6.904 447 HA2 GLY 63 HA2 GLY 63 -2.435 -10.558 -4.917 448 HA3 GLY 63 HA1 GLY 63 -4.072 -11.132 -5.138 449 H LYS 64 HN LYS 64 -2.558 -13.907 -4.862 450 HA LYS 64 HA LYS 64 -3.020 -14.303 -2.008 451 HB2 LYS 64 HB2 LYS 64 -3.511 -15.880 -4.185 452 HB3 LYS 64 HB1 LYS 64 -2.012 -16.577 -3.592 453 HG2 LYS 64 HG2 LYS 64 -3.004 -17.028 -1.446 454 HG3 LYS 64 HG1 LYS 64 -4.480 -16.178 -1.904 455 HD2 LYS 64 HD2 LYS 64 -4.894 -17.834 -3.652 456 HD3 LYS 64 HD1 LYS 64 -3.411 -18.680 -3.208 457 HE2 LYS 64 HE2 LYS 64 -4.322 -19.101 -0.976 458 HE3 LYS 64 HE1 LYS 64 -5.801 -18.249 -1.417 459 HZ1 LYS 64 HZ1 LYS 64 -5.564 -20.091 -3.378 460 HZ2 LYS 64 HZ2 LYS 64 -6.529 -20.261 -1.999 461 HZ3 LYS 64 HZ3 LYS 64 -4.979 -20.936 -2.034 462 H THR 65 HN THR 65 -0.337 -13.733 -4.092 463 HA THR 65 HA THR 65 1.693 -14.764 -2.230 464 HB THR 65 HB THR 65 3.318 -14.126 -4.111 465 HG1 THR 65 HG1 THR 65 2.156 -12.830 -5.436 466 HG21 THR 65 HG21 THR 65 1.269 -16.229 -4.829 467 HG22 THR 65 HG22 THR 65 2.582 -16.463 -3.669 468 HG23 THR 65 HG23 THR 65 2.949 -16.155 -5.367 469 H LEU 66 HN LEU 66 -0.022 -11.996 -2.466 470 HA LEU 66 HA LEU 66 1.955 -9.908 -2.353 471 HB2 LEU 66 HB2 LEU 66 -0.860 -10.086 -2.680 472 HB3 LEU 66 HB1 LEU 66 -0.594 -9.127 -1.246 473 HG LEU 66 HG LEU 66 1.100 -7.917 -3.064 474 HD11 LEU 66 HD11 LEU 66 -0.037 -9.417 -4.806 475 HD12 LEU 66 HD12 LEU 66 0.031 -7.686 -5.128 476 HD13 LEU 66 HD13 LEU 66 -1.463 -8.412 -4.539 477 HD21 LEU 66 HD21 LEU 66 -0.291 -6.739 -1.516 478 HD22 LEU 66 HD22 LEU 66 -1.753 -7.314 -2.317 479 HD23 LEU 66 HD23 LEU 66 -0.681 -6.184 -3.144 480 HA PRO 67 HA PRO 67 2.843 -9.963 2.190 481 HB2 PRO 67 HB2 PRO 67 2.703 -6.991 2.274 482 HB3 PRO 67 HB1 PRO 67 4.036 -8.051 2.748 483 HG2 PRO 67 HG2 PRO 67 4.243 -6.657 0.516 484 HG3 PRO 67 HG1 PRO 67 4.720 -8.371 0.514 485 HD2 PRO 67 HD2 PRO 67 2.121 -7.149 -0.424 486 HD3 PRO 67 HD1 PRO 67 3.198 -8.271 -1.281 487 H ARG 68 HN ARG 68 1.953 -9.784 4.239 488 HA ARG 68 HA ARG 68 -0.870 -9.595 4.496 489 HB2 ARG 68 HB2 ARG 68 1.367 -10.081 6.411 490 HB3 ARG 68 HB1 ARG 68 -0.238 -9.740 7.041 491 HG2 ARG 68 HG2 ARG 68 -1.140 -11.638 5.793 492 HG3 ARG 68 HG1 ARG 68 0.467 -11.977 5.147 493 HD2 ARG 68 HD2 ARG 68 1.302 -12.387 7.394 494 HD3 ARG 68 HD1 ARG 68 -0.275 -11.985 8.071 495 HE ARG 68 HE ARG 68 -0.595 -14.062 6.209 496 HH11 ARG 68 HH11 ARG 68 0.785 -13.760 9.503 497 HH12 ARG 68 HH12 ARG 68 0.507 -15.432 9.859 498 HH21 ARG 68 HH21 ARG 68 -0.911 -16.205 6.769 499 HH22 ARG 68 HH22 ARG 68 -0.440 -16.793 8.329 500 H ARG 69 HN ARG 69 1.523 -7.087 4.782 501 HA ARG 69 HA ARG 69 0.069 -5.313 6.555 502 HB2 ARG 69 HB2 ARG 69 2.645 -5.150 5.028 503 HB3 ARG 69 HB1 ARG 69 1.913 -3.685 5.665 504 HG2 ARG 69 HG2 ARG 69 2.019 -4.564 7.914 505 HG3 ARG 69 HG1 ARG 69 2.641 -6.101 7.312 506 HD2 ARG 69 HD2 ARG 69 4.649 -5.017 6.519 507 HD3 ARG 69 HD1 ARG 69 4.020 -3.440 6.997 508 HE ARG 69 HE ARG 69 4.004 -5.057 9.261 509 HH11 ARG 69 HH11 ARG 69 6.607 -3.657 7.236 510 HH12 ARG 69 HH12 ARG 69 7.727 -3.634 8.557 511 HH21 ARG 69 HH21 ARG 69 5.516 -4.985 10.894 512 HH22 ARG 69 HH22 ARG 69 7.112 -4.379 10.602 513 H GLU 70 HN GLU 70 0.561 -5.722 3.067 514 HA GLU 70 HA GLU 70 -0.683 -3.346 2.104 515 HB2 GLU 70 HB2 GLU 70 0.211 -5.927 0.915 516 HB3 GLU 70 HB1 GLU 70 -0.883 -4.924 -0.019 517 HG2 GLU 70 HG2 GLU 70 0.737 -3.038 0.233 518 HG3 GLU 70 HG1 GLU 70 1.845 -4.166 1.007 519 H ALA 71 HN ALA 71 -1.945 -6.513 2.972 520 HA ALA 71 HA ALA 71 -4.542 -6.452 1.831 521 HB1 ALA 71 HB1 ALA 71 -3.476 -7.943 4.223 522 HB2 ALA 71 HB2 ALA 71 -3.578 -8.523 2.561 523 HB3 ALA 71 HB3 ALA 71 -5.051 -8.233 3.486 524 H GLU 72 HN GLU 72 -3.263 -5.143 4.846 525 HA GLU 72 HA GLU 72 -5.694 -4.453 6.187 526 HB2 GLU 72 HB2 GLU 72 -2.815 -3.722 6.558 527 HB3 GLU 72 HB1 GLU 72 -4.056 -2.852 7.449 528 HG2 GLU 72 HG2 GLU 72 -4.844 -4.972 8.401 529 HG3 GLU 72 HG1 GLU 72 -3.572 -5.825 7.528 530 H LYS 73 HN LYS 73 -3.762 -2.835 3.758 531 HA LYS 73 HA LYS 73 -4.742 -0.164 3.923 532 HB2 LYS 73 HB2 LYS 73 -3.117 -1.743 2.037 533 HB3 LYS 73 HB1 LYS 73 -3.977 -0.382 1.330 534 HG2 LYS 73 HG2 LYS 73 -2.940 1.135 2.895 535 HG3 LYS 73 HG1 LYS 73 -2.139 -0.210 3.708 536 HD2 LYS 73 HD2 LYS 73 -0.903 -0.717 1.656 537 HD3 LYS 73 HD1 LYS 73 -1.716 0.618 0.834 538 HE2 LYS 73 HE2 LYS 73 0.307 1.602 1.446 539 HE3 LYS 73 HE1 LYS 73 -0.731 2.046 2.800 540 HZ1 LYS 73 HZ1 LYS 73 1.270 1.265 3.720 541 HZ2 LYS 73 HZ2 LYS 73 1.324 -0.086 2.705 542 HZ3 LYS 73 HZ3 LYS 73 0.166 0.001 3.935 543 H VAL 74 HN VAL 74 -5.966 -3.050 2.381 544 HA VAL 74 HA VAL 74 -7.886 -1.983 0.557 545 HB VAL 74 HB VAL 74 -8.250 -4.753 1.777 546 HG11 VAL 74 HG11 VAL 74 -9.152 -5.388 -0.378 547 HG12 VAL 74 HG12 VAL 74 -8.725 -3.819 -1.063 548 HG13 VAL 74 HG13 VAL 74 -9.972 -3.928 0.179 549 HG21 VAL 74 HG21 VAL 74 -5.851 -4.574 1.084 550 HG22 VAL 74 HG22 VAL 74 -6.397 -4.217 -0.554 551 HG23 VAL 74 HG23 VAL 74 -6.766 -5.779 0.176 552 H PHE 75 HN PHE 75 -8.109 -2.827 4.057 553 HA PHE 75 HA PHE 75 -10.841 -2.489 4.535 554 HB2 PHE 75 HB2 PHE 75 -8.343 -2.366 6.182 555 HB3 PHE 75 HB1 PHE 75 -9.862 -1.867 6.907 556 HD1 PHE 75 HD2 PHE 75 -7.978 -4.718 5.523 557 HD2 PHE 75 HD1 PHE 75 -11.548 -3.475 7.490 558 HE1 PHE 75 HE2 PHE 75 -8.481 -7.058 6.084 559 HE2 PHE 75 HE1 PHE 75 -12.048 -5.813 8.057 560 HZ PHE 75 HZ PHE 75 -10.517 -7.607 7.354 561 H GLU 76 HN GLU 76 -8.313 -0.082 4.124 562 HA GLU 76 HA GLU 76 -9.465 2.157 5.472 563 HB2 GLU 76 HB2 GLU 76 -6.983 1.614 4.618 564 HB3 GLU 76 HB1 GLU 76 -7.517 2.589 3.258 565 HG2 GLU 76 HG2 GLU 76 -8.083 4.410 4.807 566 HG3 GLU 76 HG1 GLU 76 -7.478 3.440 6.151 567 H LEU 77 HN LEU 77 -9.542 1.077 2.062 568 HA LEU 77 HA LEU 77 -10.916 3.354 1.030 569 HB2 LEU 77 HB2 LEU 77 -11.259 1.901 -1.008 570 HB3 LEU 77 HB1 LEU 77 -9.614 2.223 -0.581 571 HG LEU 77 HG LEU 77 -9.965 -0.209 0.583 572 HD11 LEU 77 HD11 LEU 77 -12.273 -0.327 -0.322 573 HD12 LEU 77 HD12 LEU 77 -11.226 -1.647 -0.857 574 HD13 LEU 77 HD13 LEU 77 -11.587 -0.308 -1.949 575 HD21 LEU 77 HD21 LEU 77 -8.926 -1.114 -1.547 576 HD22 LEU 77 HD22 LEU 77 -8.089 0.231 -0.775 577 HD23 LEU 77 HD23 LEU 77 -9.087 0.516 -2.200 578 H LEU 78 HN LEU 78 -11.990 0.328 2.426 579 HA LEU 78 HA LEU 78 -14.755 0.448 1.654 580 HB2 LEU 78 HB2 LEU 78 -13.069 -1.491 2.672 581 HB3 LEU 78 HB1 LEU 78 -14.122 -1.153 4.023 582 HG LEU 78 HG LEU 78 -15.902 -1.490 1.916 583 HD11 LEU 78 HD11 LEU 78 -14.142 -2.317 0.477 584 HD12 LEU 78 HD12 LEU 78 -15.255 -3.618 0.903 585 HD13 LEU 78 HD13 LEU 78 -13.682 -3.512 1.685 586 HD21 LEU 78 HD21 LEU 78 -16.368 -3.662 3.025 587 HD22 LEU 78 HD22 LEU 78 -16.302 -2.286 4.126 588 HD23 LEU 78 HD23 LEU 78 -14.943 -3.402 4.030 589 H ASN 79 HN ASN 79 -12.880 1.675 4.351 590 HA ASN 79 HA ASN 79 -15.234 2.333 5.982 591 HB2 ASN 79 HB2 ASN 79 -12.303 2.115 6.540 592 HB3 ASN 79 HB1 ASN 79 -13.305 3.112 7.590 593 HD21 ASN 79 HD21 ASN 79 -12.219 0.011 6.912 594 HD22 ASN 79 HD22 ASN 79 -13.269 -0.865 7.968 595 H ASP 80 HN ASP 80 -13.005 3.886 3.826 596 HA ASP 80 HA ASP 80 -13.837 6.550 4.734 597 HB2 ASP 80 HB2 ASP 80 -11.283 5.670 4.647 598 HB3 ASP 80 HB1 ASP 80 -11.422 6.347 3.029 599 H PHE 81 HN PHE 81 -15.714 5.648 3.451 600 HA PHE 81 HA PHE 81 -15.820 5.783 0.601 601 HB2 PHE 81 HB2 PHE 81 -17.797 5.497 2.781 602 HB3 PHE 81 HB1 PHE 81 -18.416 6.211 1.299 603 HD1 PHE 81 HD1 PHE 81 -18.488 4.899 -0.783 604 HD2 PHE 81 HD2 PHE 81 -17.147 3.170 2.877 605 HE1 PHE 81 HE1 PHE 81 -18.758 2.654 -1.745 606 HE2 PHE 81 HE2 PHE 81 -17.411 0.925 1.906 607 HZ PHE 81 HZ PHE 81 -18.216 0.667 -0.404 608 H LYS 82 HN LYS 82 -16.386 8.204 3.102 609 HA LYS 82 HA LYS 82 -16.861 10.320 1.111 610 HB2 LYS 82 HB2 LYS 82 -17.576 10.079 4.031 611 HB3 LYS 82 HB1 LYS 82 -17.462 11.660 3.276 612 HG2 LYS 82 HG2 LYS 82 -19.204 11.048 1.692 613 HG3 LYS 82 HG1 LYS 82 -19.293 9.431 2.397 614 HD2 LYS 82 HD2 LYS 82 -19.948 10.425 4.548 615 HD3 LYS 82 HD1 LYS 82 -19.895 12.028 3.814 616 HE2 LYS 82 HE2 LYS 82 -21.653 11.381 2.254 617 HE3 LYS 82 HE1 LYS 82 -21.692 9.763 2.955 618 HZ1 LYS 82 HZ1 LYS 82 -23.387 10.747 4.086 619 HZ2 LYS 82 HZ2 LYS 82 -22.692 12.289 4.049 620 HZ3 LYS 82 HZ3 LYS 82 -22.116 11.127 5.135 621 H GLY 83 HN GLY 83 -15.219 11.555 0.600 622 HA2 GLY 83 HA2 GLY 83 -13.443 13.074 1.000 623 HA3 GLY 83 HA1 GLY 83 -13.142 12.291 2.541 624 H GLY 84 HN GLY 84 -12.708 12.069 -0.940 625 HA2 GLY 84 HA2 GLY 84 -10.284 11.436 -1.464 626 HA3 GLY 84 HA1 GLY 84 -10.700 9.941 -0.645 627 H ILE 85 HN ILE 85 -12.997 9.126 -1.548 628 HA ILE 85 HA ILE 85 -12.691 8.841 -4.480 629 HB ILE 85 HB ILE 85 -14.259 6.807 -2.832 630 HG12 ILE 85 HG12 ILE 85 -11.900 5.466 -3.320 631 HG13 ILE 85 HG11 ILE 85 -11.323 7.061 -2.844 632 HG21 ILE 85 HG21 ILE 85 -14.533 6.621 -5.243 633 HG22 ILE 85 HG22 ILE 85 -13.636 5.229 -4.640 634 HG23 ILE 85 HG23 ILE 85 -12.787 6.533 -5.466 635 HD11 ILE 85 HD11 ILE 85 -13.178 5.308 -1.253 636 HD12 ILE 85 HD12 ILE 85 -12.605 6.908 -0.776 637 HD13 ILE 85 HD13 ILE 85 -11.463 5.572 -0.938 638 H ASP 86 HN ASP 86 -14.190 9.668 -5.701 639 HA ASP 86 HA ASP 86 -16.880 10.266 -4.652 640 HB2 ASP 86 HB2 ASP 86 -15.037 11.873 -6.389 641 HB3 ASP 86 HB1 ASP 86 -16.776 12.049 -6.593 642 H TRP 87 HN TRP 87 -18.578 9.501 -5.729 643 HA TRP 87 HA TRP 87 -18.236 7.659 -7.934 644 HB2 TRP 87 HB2 TRP 87 -20.613 8.438 -6.264 645 HB3 TRP 87 HB1 TRP 87 -20.783 7.415 -7.686 646 HD1 TRP 87 HD1 TRP 87 -19.930 7.303 -4.069 647 HE1 TRP 87 HE1 TRP 87 -19.237 4.938 -3.351 648 HE3 TRP 87 HE3 TRP 87 -19.391 5.107 -8.706 649 HZ2 TRP 87 HZ2 TRP 87 -18.557 2.487 -4.550 650 HZ3 TRP 87 HZ3 TRP 87 -18.713 2.744 -8.801 651 HH2 TRP 87 HH2 TRP 87 -18.307 1.470 -6.771 652 H GLU 88 HN GLU 88 -19.444 10.936 -7.605 653 HA GLU 88 HA GLU 88 -20.695 11.110 -10.217 654 HB2 GLU 88 HB2 GLU 88 -20.229 13.072 -7.988 655 HB3 GLU 88 HB1 GLU 88 -20.748 13.630 -9.571 656 HG2 GLU 88 HG2 GLU 88 -22.756 12.270 -9.418 657 HG3 GLU 88 HG1 GLU 88 -22.226 11.637 -7.861 658 H ASN 89 HN ASN 89 -17.606 12.090 -8.789 659 HA ASN 89 HA ASN 89 -16.664 13.439 -11.206 660 HB2 ASN 89 HB2 ASN 89 -15.681 13.226 -8.384 661 HB3 ASN 89 HB1 ASN 89 -14.563 13.703 -9.658 662 HD21 ASN 89 HD21 ASN 89 -16.972 14.710 -7.531 663 HD22 ASN 89 HD22 ASN 89 -17.175 16.319 -8.126 664 H LYS 90 HN LYS 90 -16.427 10.281 -9.781 665 HA LYS 90 HA LYS 90 -15.321 8.353 -10.125 666 HB2 LYS 90 HB2 LYS 90 -15.506 9.518 -12.831 667 HB3 LYS 90 HB1 LYS 90 -14.296 8.254 -12.676 668 HG2 LYS 90 HG2 LYS 90 -15.968 6.701 -11.886 669 HG3 LYS 90 HG1 LYS 90 -17.190 7.973 -11.894 670 HD2 LYS 90 HD2 LYS 90 -17.001 8.194 -14.298 671 HD3 LYS 90 HD1 LYS 90 -15.689 7.013 -14.331 672 HE2 LYS 90 HE2 LYS 90 -18.338 6.237 -13.176 673 HE3 LYS 90 HE1 LYS 90 -18.134 6.259 -14.927 674 HZ1 LYS 90 HZ1 LYS 90 -17.186 4.356 -13.013 675 HZ2 LYS 90 HZ2 LYS 90 -15.939 4.918 -14.008 676 HZ3 LYS 90 HZ3 LYS 90 -17.317 4.221 -14.696 677 H ARG 91 HN ARG 91 -13.849 9.973 -8.634 678 HA ARG 91 HA ARG 91 -11.029 9.616 -9.454 679 HB2 ARG 91 HB2 ARG 91 -12.329 11.752 -7.774 680 HB3 ARG 91 HB1 ARG 91 -10.609 11.423 -7.643 681 HG2 ARG 91 HG2 ARG 91 -11.600 11.844 -10.396 682 HG3 ARG 91 HG1 ARG 91 -11.658 13.265 -9.352 683 HD2 ARG 91 HD2 ARG 91 -9.153 11.613 -9.543 684 HD3 ARG 91 HD1 ARG 91 -9.514 12.830 -10.766 685 HE ARG 91 HE ARG 91 -9.784 14.153 -8.385 686 HH11 ARG 91 HH11 ARG 91 -6.976 12.426 -9.794 687 HH12 ARG 91 HH12 ARG 91 -5.839 13.440 -8.969 688 HH21 ARG 91 HH21 ARG 91 -8.231 15.410 -7.373 689 HH22 ARG 91 HH22 ARG 91 -6.544 15.103 -7.620 690 H VAL 92 HN VAL 92 -9.631 8.604 -8.176 691 HA VAL 92 HA VAL 92 -10.582 7.434 -5.625 692 HB VAL 92 HB VAL 92 -8.388 6.016 -7.164 693 HG11 VAL 92 HG11 VAL 92 -10.556 4.538 -5.732 694 HG12 VAL 92 HG12 VAL 92 -9.417 5.459 -4.754 695 HG13 VAL 92 HG13 VAL 92 -8.830 4.182 -5.820 696 HG21 VAL 92 HG21 VAL 92 -11.313 5.475 -7.753 697 HG22 VAL 92 HG22 VAL 92 -9.950 4.514 -8.318 698 HG23 VAL 92 HG23 VAL 92 -10.145 6.172 -8.876 699 H LYS 93 HN LYS 93 -9.470 7.937 -3.885 700 HA LYS 93 HA LYS 93 -6.707 8.959 -4.058 701 HB2 LYS 93 HB2 LYS 93 -8.987 10.427 -3.292 702 HB3 LYS 93 HB1 LYS 93 -8.149 10.058 -1.795 703 HG2 LYS 93 HG2 LYS 93 -6.145 11.111 -2.602 704 HG3 LYS 93 HG1 LYS 93 -6.876 11.359 -4.188 705 HD2 LYS 93 HD2 LYS 93 -8.552 12.830 -3.186 706 HD3 LYS 93 HD1 LYS 93 -7.830 12.576 -1.598 707 HE2 LYS 93 HE2 LYS 93 -5.743 13.577 -2.388 708 HE3 LYS 93 HE1 LYS 93 -6.462 13.825 -3.979 709 HZ1 LYS 93 HZ1 LYS 93 -7.558 15.009 -1.490 710 HZ2 LYS 93 HZ2 LYS 93 -7.997 15.375 -3.082 711 HZ3 LYS 93 HZ3 LYS 93 -6.468 15.814 -2.504 712 H LEU 94 HN LEU 94 -5.290 7.992 -2.767 713 HA LEU 94 HA LEU 94 -6.189 6.344 -0.503 714 HB2 LEU 94 HB2 LEU 94 -4.255 5.676 -2.698 715 HB3 LEU 94 HB1 LEU 94 -4.097 4.917 -1.127 716 HG LEU 94 HG LEU 94 -6.820 4.731 -2.151 717 HD11 LEU 94 HD11 LEU 94 -5.954 4.617 -4.332 718 HD12 LEU 94 HD12 LEU 94 -6.187 2.943 -3.830 719 HD13 LEU 94 HD13 LEU 94 -4.572 3.646 -3.824 720 HD21 LEU 94 HD21 LEU 94 -5.906 3.450 -0.253 721 HD22 LEU 94 HD22 LEU 94 -4.809 2.626 -1.359 722 HD23 LEU 94 HD23 LEU 94 -6.552 2.408 -1.522 723 H LYS 95 HN LYS 95 -5.196 6.613 1.330 724 HA LYS 95 HA LYS 95 -2.923 8.470 1.544 725 HB2 LYS 95 HB2 LYS 95 -5.272 7.877 3.278 726 HB3 LYS 95 HB1 LYS 95 -3.777 8.361 4.066 727 HG2 LYS 95 HG2 LYS 95 -3.744 10.433 2.844 728 HG3 LYS 95 HG1 LYS 95 -5.149 9.937 1.899 729 HD2 LYS 95 HD2 LYS 95 -6.501 9.882 3.944 730 HD3 LYS 95 HD1 LYS 95 -5.098 10.382 4.887 731 HE2 LYS 95 HE2 LYS 95 -6.100 12.051 2.597 732 HE3 LYS 95 HE1 LYS 95 -6.821 12.191 4.198 733 HZ1 LYS 95 HZ1 LYS 95 -4.919 13.098 5.074 734 HZ2 LYS 95 HZ2 LYS 95 -4.864 13.732 3.506 735 HZ3 LYS 95 HZ3 LYS 95 -3.899 12.404 3.914 Start of MODEL 4 1 H1 MET 8 HT1 MET 8 1.041 0.070 -0.365 2 H2 MET 8 HT2 MET 8 1.687 1.626 -0.220 3 H3 MET 8 HT3 MET 8 2.453 0.319 0.533 4 HA MET 8 HA MET 8 2.218 0.834 -2.371 5 HB2 MET 8 HB2 MET 8 4.439 0.977 -0.366 6 HB3 MET 8 HB1 MET 8 4.822 0.544 -2.025 7 HG2 MET 8 HG2 MET 8 3.324 3.041 -1.264 8 HG3 MET 8 HG1 MET 8 5.073 2.976 -1.468 9 HE1 MET 8 HE1 MET 8 4.921 4.959 -3.842 10 HE2 MET 8 HE2 MET 8 3.597 4.999 -2.677 11 HE3 MET 8 HE3 MET 8 3.249 4.926 -4.404 12 H ALA 9 HN ALA 9 2.483 -0.778 -3.742 13 HA ALA 9 HA ALA 9 2.927 -3.511 -2.720 14 HB1 ALA 9 HB1 ALA 9 1.773 -4.203 -4.867 15 HB2 ALA 9 HB2 ALA 9 1.368 -2.502 -5.096 16 HB3 ALA 9 HB3 ALA 9 0.759 -3.371 -3.688 17 H LYS 10 HN LYS 10 4.436 -4.802 -3.586 18 HA LYS 10 HA LYS 10 6.339 -3.675 -5.523 19 HB2 LYS 10 HB2 LYS 10 6.699 -5.412 -3.111 20 HB3 LYS 10 HB1 LYS 10 7.840 -5.550 -4.438 21 HG2 LYS 10 HG2 LYS 10 8.418 -3.205 -4.223 22 HG3 LYS 10 HG1 LYS 10 7.218 -3.010 -2.943 23 HD2 LYS 10 HD2 LYS 10 8.440 -4.652 -1.575 24 HD3 LYS 10 HD1 LYS 10 9.653 -4.792 -2.848 25 HE2 LYS 10 HE2 LYS 10 10.209 -2.432 -2.589 26 HE3 LYS 10 HE1 LYS 10 8.975 -2.268 -1.341 27 HZ1 LYS 10 HZ1 LYS 10 11.645 -3.263 -1.131 28 HZ2 LYS 10 HZ2 LYS 10 10.519 -4.354 -0.495 29 HZ3 LYS 10 HZ3 LYS 10 10.582 -2.768 0.089 30 H CYS 11 HN CYS 11 6.912 -4.783 -7.285 31 HA CYS 11 HA CYS 11 5.315 -6.935 -8.281 32 HB2 CYS 11 HB2 CYS 11 6.328 -5.182 -9.763 33 HB3 CYS 11 HB1 CYS 11 7.903 -5.874 -9.455 34 HA PRO 12 HA PRO 12 7.942 -10.395 -6.742 35 HB2 PRO 12 HB2 PRO 12 6.751 -12.531 -7.941 36 HB3 PRO 12 HB1 PRO 12 6.052 -11.716 -6.538 37 HG2 PRO 12 HG2 PRO 12 5.312 -11.472 -9.443 38 HG3 PRO 12 HG1 PRO 12 4.250 -11.517 -8.023 39 HD2 PRO 12 HD2 PRO 12 4.958 -9.189 -9.326 40 HD3 PRO 12 HD1 PRO 12 4.512 -9.251 -7.614 41 H ILE 13 HN ILE 13 7.841 -9.356 -10.024 42 HA ILE 13 HA ILE 13 9.749 -11.321 -11.042 43 HB ILE 13 HB ILE 13 8.354 -9.148 -12.691 44 HG12 ILE 13 HG12 ILE 13 7.187 -11.718 -13.280 45 HG13 ILE 13 HG11 ILE 13 7.040 -11.434 -11.551 46 HG21 ILE 13 HG21 ILE 13 10.267 -10.208 -13.824 47 HG22 ILE 13 HG22 ILE 13 8.759 -10.637 -14.631 48 HG23 ILE 13 HG23 ILE 13 9.554 -11.803 -13.573 49 HD11 ILE 13 HD11 ILE 13 6.084 -9.558 -13.706 50 HD12 ILE 13 HD12 ILE 13 5.868 -9.354 -11.968 51 HD13 ILE 13 HD13 ILE 13 5.072 -10.687 -12.804 52 H CYS 14 HN CYS 14 9.312 -7.692 -10.920 53 HA CYS 14 HA CYS 14 12.206 -7.374 -11.348 54 HB2 CYS 14 HB2 CYS 14 11.700 -5.024 -11.936 55 HB3 CYS 14 HB1 CYS 14 10.852 -6.172 -12.963 56 H GLY 15 HN GLY 15 9.599 -6.402 -9.152 57 HA2 GLY 15 HA2 GLY 15 9.720 -5.978 -6.841 58 HA3 GLY 15 HA1 GLY 15 11.468 -5.880 -6.965 59 H SER 16 HN SER 16 9.177 -4.099 -8.987 60 HA SER 16 HA SER 16 10.329 -1.527 -8.174 61 HB2 SER 16 HB2 SER 16 9.372 -2.623 -10.598 62 HB3 SER 16 HB1 SER 16 8.309 -1.275 -10.184 63 HG SER 16 HG SER 16 10.148 -0.621 -11.403 64 HA PRO 17 HA PRO 17 6.672 -0.323 -5.678 65 HB2 PRO 17 HB2 PRO 17 6.677 2.423 -5.874 66 HB3 PRO 17 HB1 PRO 17 7.755 1.521 -4.806 67 HG2 PRO 17 HG2 PRO 17 8.317 2.685 -7.527 68 HG3 PRO 17 HG1 PRO 17 9.339 2.707 -6.075 69 HD2 PRO 17 HD2 PRO 17 9.777 0.951 -8.087 70 HD3 PRO 17 HD1 PRO 17 10.050 0.505 -6.391 71 H LEU 18 HN LEU 18 4.578 -0.295 -5.999 72 HA LEU 18 HA LEU 18 3.416 0.776 -8.491 73 HB2 LEU 18 HB2 LEU 18 2.702 -1.702 -6.928 74 HB3 LEU 18 HB1 LEU 18 1.572 -0.955 -8.044 75 HG LEU 18 HG LEU 18 4.211 -1.501 -9.223 76 HD11 LEU 18 HD11 LEU 18 3.768 -3.932 -9.441 77 HD12 LEU 18 HD12 LEU 18 2.499 -3.768 -8.226 78 HD13 LEU 18 HD13 LEU 18 4.176 -3.424 -7.803 79 HD21 LEU 18 HD21 LEU 18 2.873 -2.277 -11.068 80 HD22 LEU 18 HD22 LEU 18 2.168 -0.778 -10.461 81 HD23 LEU 18 HD23 LEU 18 1.428 -2.327 -10.059 82 H LYS 19 HN LYS 19 1.546 1.917 -8.388 83 HA LYS 19 HA LYS 19 0.816 3.049 -5.797 84 HB2 LYS 19 HB2 LYS 19 0.299 3.867 -8.647 85 HB3 LYS 19 HB1 LYS 19 -0.653 4.552 -7.340 86 HG2 LYS 19 HG2 LYS 19 1.350 5.455 -6.315 87 HG3 LYS 19 HG1 LYS 19 2.348 4.706 -7.564 88 HD2 LYS 19 HD2 LYS 19 1.252 6.068 -9.266 89 HD3 LYS 19 HD1 LYS 19 0.223 6.800 -8.031 90 HE2 LYS 19 HE2 LYS 19 2.199 7.722 -6.931 91 HE3 LYS 19 HE1 LYS 19 3.232 6.979 -8.152 92 HZ1 LYS 19 HZ1 LYS 19 2.386 9.470 -8.319 93 HZ2 LYS 19 HZ2 LYS 19 1.101 8.715 -9.117 94 HZ3 LYS 19 HZ3 LYS 19 2.682 8.521 -9.688 95 H TRP 20 HN TRP 20 -0.969 2.652 -4.722 96 HA TRP 20 HA TRP 20 -2.820 0.586 -5.408 97 HB2 TRP 20 HB2 TRP 20 -2.493 2.464 -3.112 98 HB3 TRP 20 HB1 TRP 20 -4.040 1.641 -3.300 99 HD1 TRP 20 HD1 TRP 20 -0.394 1.015 -2.405 100 HE1 TRP 20 HE1 TRP 20 -0.116 -1.367 -1.478 101 HE3 TRP 20 HE3 TRP 20 -5.110 -0.874 -3.369 102 HZ2 TRP 20 HZ2 TRP 20 -1.629 -3.691 -1.191 103 HZ3 TRP 20 HZ3 TRP 20 -5.575 -3.198 -2.710 104 HH2 TRP 20 HH2 TRP 20 -3.865 -4.578 -1.637 105 H GLU 21 HN GLU 21 -2.872 4.031 -5.879 106 HA GLU 21 HA GLU 21 -5.653 4.493 -6.344 107 HB2 GLU 21 HB2 GLU 21 -3.158 6.031 -7.025 108 HB3 GLU 21 HB1 GLU 21 -4.730 6.562 -7.598 109 HG2 GLU 21 HG2 GLU 21 -5.511 6.709 -5.267 110 HG3 GLU 21 HG1 GLU 21 -3.910 6.222 -4.718 111 H GLU 22 HN GLU 22 -2.963 3.482 -8.434 112 HA GLU 22 HA GLU 22 -4.341 3.694 -10.968 113 HB2 GLU 22 HB2 GLU 22 -1.690 2.619 -10.091 114 HB3 GLU 22 HB1 GLU 22 -2.306 2.207 -11.685 115 HG2 GLU 22 HG2 GLU 22 -2.495 4.606 -12.205 116 HG3 GLU 22 HG1 GLU 22 -1.803 4.980 -10.627 117 H LEU 23 HN LEU 23 -3.737 1.111 -8.631 118 HA LEU 23 HA LEU 23 -4.521 -1.169 -10.099 119 HB2 LEU 23 HB2 LEU 23 -3.276 -0.796 -7.775 120 HB3 LEU 23 HB1 LEU 23 -4.888 -1.021 -7.137 121 HG LEU 23 HG LEU 23 -4.516 -3.170 -8.869 122 HD11 LEU 23 HD11 LEU 23 -2.095 -2.562 -8.862 123 HD12 LEU 23 HD12 LEU 23 -2.455 -4.185 -8.275 124 HD13 LEU 23 HD13 LEU 23 -2.087 -2.896 -7.129 125 HD21 LEU 23 HD21 LEU 23 -4.289 -2.970 -5.879 126 HD22 LEU 23 HD22 LEU 23 -4.501 -4.474 -6.776 127 HD23 LEU 23 HD23 LEU 23 -5.760 -3.239 -6.813 128 H ILE 24 HN ILE 24 -6.394 1.004 -7.967 129 HA ILE 24 HA ILE 24 -8.913 -0.417 -8.205 130 HB ILE 24 HB ILE 24 -8.585 2.359 -7.012 131 HG12 ILE 24 HG12 ILE 24 -7.027 1.196 -5.630 132 HG13 ILE 24 HG11 ILE 24 -8.487 1.315 -4.684 133 HG21 ILE 24 HG21 ILE 24 -10.568 1.909 -5.644 134 HG22 ILE 24 HG22 ILE 24 -10.718 0.314 -6.382 135 HG23 ILE 24 HG23 ILE 24 -10.912 1.761 -7.369 136 HD11 ILE 24 HD11 ILE 24 -7.914 -0.816 -4.139 137 HD12 ILE 24 HD12 ILE 24 -7.003 -1.072 -5.626 138 HD13 ILE 24 HD13 ILE 24 -8.761 -1.212 -5.637 139 H GLU 25 HN GLU 25 -7.454 2.513 -9.656 140 HA GLU 25 HA GLU 25 -9.695 3.529 -11.063 141 HB2 GLU 25 HB2 GLU 25 -7.110 4.340 -10.572 142 HB3 GLU 25 HB1 GLU 25 -7.120 4.081 -12.310 143 HG2 GLU 25 HG2 GLU 25 -9.065 5.563 -12.504 144 HG3 GLU 25 HG1 GLU 25 -9.014 5.837 -10.764 145 H GLU 26 HN GLU 26 -7.240 1.138 -11.980 146 HA GLU 26 HA GLU 26 -7.987 0.828 -14.752 147 HB2 GLU 26 HB2 GLU 26 -6.103 -0.546 -12.872 148 HB3 GLU 26 HB1 GLU 26 -6.462 -1.237 -14.427 149 HG2 GLU 26 HG2 GLU 26 -5.636 0.790 -15.539 150 HG3 GLU 26 HG1 GLU 26 -5.247 1.475 -13.961 151 H MET 27 HN MET 27 -8.969 -0.528 -11.703 152 HA MET 27 HA MET 27 -10.269 -2.828 -12.931 153 HB2 MET 27 HB2 MET 27 -8.880 -2.380 -10.396 154 HB3 MET 27 HB1 MET 27 -10.431 -3.176 -10.176 155 HG2 MET 27 HG2 MET 27 -8.801 -4.885 -10.380 156 HG3 MET 27 HG1 MET 27 -9.690 -4.861 -11.901 157 HE1 MET 27 HE1 MET 27 -6.499 -5.668 -13.690 158 HE2 MET 27 HE2 MET 27 -8.240 -5.508 -13.918 159 HE3 MET 27 HE3 MET 27 -7.611 -6.443 -12.562 160 H LEU 28 HN LEU 28 -11.177 0.178 -12.578 161 HA LEU 28 HA LEU 28 -13.701 -0.147 -11.153 162 HB2 LEU 28 HB2 LEU 28 -11.934 1.896 -11.197 163 HB3 LEU 28 HB1 LEU 28 -13.035 2.445 -12.445 164 HG LEU 28 HG LEU 28 -14.743 1.747 -10.375 165 HD11 LEU 28 HD11 LEU 28 -12.692 1.512 -8.947 166 HD12 LEU 28 HD12 LEU 28 -13.896 2.656 -8.360 167 HD13 LEU 28 HD13 LEU 28 -12.436 3.244 -9.155 168 HD21 LEU 28 HD21 LEU 28 -15.054 3.658 -11.750 169 HD22 LEU 28 HD22 LEU 28 -13.565 4.399 -11.165 170 HD23 LEU 28 HD23 LEU 28 -14.942 4.209 -10.079 171 H ILE 29 HN ILE 29 -13.023 -1.275 -13.927 172 HA ILE 29 HA ILE 29 -15.016 -0.127 -15.705 173 HB ILE 29 HB ILE 29 -14.210 -1.964 -17.324 174 HG12 ILE 29 HG12 ILE 29 -11.488 -2.079 -16.394 175 HG13 ILE 29 HG11 ILE 29 -12.529 -2.761 -15.148 176 HG21 ILE 29 HG21 ILE 29 -12.443 0.302 -16.476 177 HG22 ILE 29 HG22 ILE 29 -13.740 0.338 -17.670 178 HG23 ILE 29 HG23 ILE 29 -12.265 -0.577 -17.993 179 HD11 ILE 29 HD11 ILE 29 -13.518 -4.243 -16.885 180 HD12 ILE 29 HD12 ILE 29 -11.804 -4.525 -16.581 181 HD13 ILE 29 HD13 ILE 29 -12.310 -3.635 -18.017 182 H ILE 30 HN ILE 30 -15.189 -2.306 -13.277 183 HA ILE 30 HA ILE 30 -17.177 -4.136 -14.460 184 HB ILE 30 HB ILE 30 -16.175 -4.487 -11.602 185 HG12 ILE 30 HG12 ILE 30 -14.718 -6.285 -13.348 186 HG13 ILE 30 HG11 ILE 30 -14.381 -4.625 -13.819 187 HG21 ILE 30 HG21 ILE 30 -16.750 -6.794 -11.846 188 HG22 ILE 30 HG22 ILE 30 -16.859 -6.662 -13.602 189 HG23 ILE 30 HG23 ILE 30 -18.076 -5.892 -12.584 190 HD11 ILE 30 HD11 ILE 30 -12.779 -5.607 -12.179 191 HD12 ILE 30 HD12 ILE 30 -14.092 -5.646 -11.002 192 HD13 ILE 30 HD13 ILE 30 -13.536 -4.103 -11.654 193 H GLU 31 HN GLU 31 -19.256 -4.239 -13.766 194 HA GLU 31 HA GLU 31 -20.407 -1.976 -12.360 195 HB2 GLU 31 HB2 GLU 31 -21.550 -4.281 -13.902 196 HB3 GLU 31 HB1 GLU 31 -22.595 -3.312 -12.875 197 HG2 GLU 31 HG2 GLU 31 -21.963 -1.305 -14.135 198 HG3 GLU 31 HG1 GLU 31 -20.935 -2.292 -15.175 199 H ASN 32 HN ASN 32 -19.471 -5.175 -11.484 200 HA ASN 32 HA ASN 32 -21.185 -5.525 -9.179 201 HB2 ASN 32 HB2 ASN 32 -18.943 -7.067 -10.421 202 HB3 ASN 32 HB1 ASN 32 -19.399 -7.419 -8.756 203 HD21 ASN 32 HD21 ASN 32 -21.494 -8.193 -8.323 204 HD22 ASN 32 HD22 ASN 32 -22.444 -8.945 -9.554 205 H PHE 33 HN PHE 33 -18.220 -3.914 -9.789 206 HA PHE 33 HA PHE 33 -16.767 -3.916 -7.431 207 HB2 PHE 33 HB2 PHE 33 -16.393 -2.722 -9.800 208 HB3 PHE 33 HB1 PHE 33 -16.867 -1.324 -8.873 209 HD1 PHE 33 HD1 PHE 33 -15.447 -0.480 -7.039 210 HD2 PHE 33 HD2 PHE 33 -14.264 -3.865 -9.355 211 HE1 PHE 33 HE1 PHE 33 -13.173 -0.319 -6.115 212 HE2 PHE 33 HE2 PHE 33 -11.990 -3.695 -8.435 213 HZ PHE 33 HZ PHE 33 -11.443 -1.927 -6.818 214 H GLU 34 HN GLU 34 -19.587 -1.944 -8.203 215 HA GLU 34 HA GLU 34 -19.727 -0.217 -5.967 216 HB2 GLU 34 HB2 GLU 34 -21.762 -1.241 -7.903 217 HB3 GLU 34 HB1 GLU 34 -22.283 -0.319 -6.500 218 HG2 GLU 34 HG2 GLU 34 -20.822 1.533 -7.204 219 HG3 GLU 34 HG1 GLU 34 -20.377 0.613 -8.639 220 H GLU 35 HN GLU 35 -20.697 -3.560 -6.373 221 HA GLU 35 HA GLU 35 -22.063 -3.865 -3.814 222 HB2 GLU 35 HB2 GLU 35 -21.520 -5.604 -6.182 223 HB3 GLU 35 HB1 GLU 35 -21.859 -6.384 -4.644 224 HG2 GLU 35 HG2 GLU 35 -23.741 -4.258 -5.516 225 HG3 GLU 35 HG1 GLU 35 -23.798 -5.791 -6.386 226 H ILE 36 HN ILE 36 -18.906 -4.657 -5.227 227 HA ILE 36 HA ILE 36 -17.862 -6.266 -3.071 228 HB ILE 36 HB ILE 36 -16.259 -4.997 -5.367 229 HG12 ILE 36 HG12 ILE 36 -16.851 -7.926 -5.371 230 HG13 ILE 36 HG11 ILE 36 -18.200 -6.870 -5.735 231 HG21 ILE 36 HG21 ILE 36 -14.962 -5.831 -3.297 232 HG22 ILE 36 HG22 ILE 36 -14.428 -6.434 -4.871 233 HG23 ILE 36 HG23 ILE 36 -15.408 -7.457 -3.818 234 HD11 ILE 36 HD11 ILE 36 -17.352 -6.261 -7.776 235 HD12 ILE 36 HD12 ILE 36 -16.668 -7.880 -7.640 236 HD13 ILE 36 HD13 ILE 36 -15.676 -6.470 -7.269 237 H VAL 37 HN VAL 37 -17.611 -2.820 -3.953 238 HA VAL 37 HA VAL 37 -15.669 -1.974 -2.097 239 HB VAL 37 HB VAL 37 -16.475 -0.891 -4.263 240 HG11 VAL 37 HG11 VAL 37 -18.915 -0.552 -3.273 241 HG12 VAL 37 HG12 VAL 37 -18.227 0.554 -4.452 242 HG13 VAL 37 HG13 VAL 37 -18.226 0.985 -2.752 243 HG21 VAL 37 HG21 VAL 37 -15.806 1.414 -3.511 244 HG22 VAL 37 HG22 VAL 37 -14.688 0.111 -3.099 245 HG23 VAL 37 HG23 VAL 37 -15.761 0.778 -1.866 246 H LYS 38 HN LYS 38 -18.980 -2.721 -1.519 247 HA LYS 38 HA LYS 38 -19.270 -1.299 1.000 248 HB2 LYS 38 HB2 LYS 38 -21.045 -3.056 -0.662 249 HB3 LYS 38 HB1 LYS 38 -21.467 -2.724 1.012 250 HG2 LYS 38 HG2 LYS 38 -21.518 -0.336 0.546 251 HG3 LYS 38 HG1 LYS 38 -21.028 -0.640 -1.123 252 HD2 LYS 38 HD2 LYS 38 -23.081 -1.904 -1.503 253 HD3 LYS 38 HD1 LYS 38 -23.567 -1.634 0.172 254 HE2 LYS 38 HE2 LYS 38 -23.619 0.777 -0.232 255 HE3 LYS 38 HE1 LYS 38 -23.120 0.512 -1.903 256 HZ1 LYS 38 HZ1 LYS 38 -25.225 -0.993 -1.940 257 HZ2 LYS 38 HZ2 LYS 38 -25.378 0.682 -2.119 258 HZ3 LYS 38 HZ3 LYS 38 -25.706 -0.041 -0.626 259 H ASP 39 HN ASP 39 -18.131 -4.418 0.022 260 HA ASP 39 HA ASP 39 -18.138 -5.411 2.779 261 HB2 ASP 39 HB2 ASP 39 -19.003 -6.769 0.274 262 HB3 ASP 39 HB1 ASP 39 -18.104 -7.744 1.432 263 H ARG 40 HN ARG 40 -16.158 -5.150 3.462 264 HA ARG 40 HA ARG 40 -13.700 -5.244 2.180 265 HB2 ARG 40 HB2 ARG 40 -14.358 -5.884 5.059 266 HB3 ARG 40 HB1 ARG 40 -12.711 -5.757 4.464 267 HG2 ARG 40 HG2 ARG 40 -12.855 -3.565 5.064 268 HG3 ARG 40 HG1 ARG 40 -13.864 -3.381 3.631 269 HD2 ARG 40 HD2 ARG 40 -15.834 -4.021 5.063 270 HD3 ARG 40 HD1 ARG 40 -14.765 -3.876 6.457 271 HE ARG 40 HE ARG 40 -14.587 -1.515 4.980 272 HH11 ARG 40 HH11 ARG 40 -17.128 -3.067 6.980 273 HH12 ARG 40 HH12 ARG 40 -17.880 -1.549 7.338 274 HH21 ARG 40 HH21 ARG 40 -15.638 0.369 5.480 275 HH22 ARG 40 HH22 ARG 40 -17.033 0.373 6.501 276 H GLU 41 HN GLU 41 -15.495 -7.985 3.493 277 HA GLU 41 HA GLU 41 -13.530 -10.031 3.277 278 HB2 GLU 41 HB2 GLU 41 -16.083 -9.754 4.309 279 HB3 GLU 41 HB1 GLU 41 -16.288 -10.907 3.003 280 HG2 GLU 41 HG2 GLU 41 -14.561 -12.327 3.975 281 HG3 GLU 41 HG1 GLU 41 -14.333 -11.159 5.275 282 H ARG 42 HN ARG 42 -15.865 -8.691 0.997 283 HA ARG 42 HA ARG 42 -15.500 -10.672 -1.083 284 HB2 ARG 42 HB2 ARG 42 -17.113 -8.162 -0.831 285 HB3 ARG 42 HB1 ARG 42 -16.818 -8.838 -2.425 286 HG2 ARG 42 HG2 ARG 42 -17.834 -10.962 -1.680 287 HG3 ARG 42 HG1 ARG 42 -18.189 -10.216 -0.120 288 HD2 ARG 42 HD2 ARG 42 -19.577 -8.541 -1.231 289 HD3 ARG 42 HD1 ARG 42 -19.205 -9.261 -2.795 290 HE ARG 42 HE ARG 42 -20.367 -11.128 -0.952 291 HH11 ARG 42 HH11 ARG 42 -21.367 -8.672 -3.364 292 HH12 ARG 42 HH12 ARG 42 -22.924 -9.399 -3.578 293 HH21 ARG 42 HH21 ARG 42 -22.404 -11.991 -1.303 294 HH22 ARG 42 HH22 ARG 42 -23.499 -11.253 -2.423 295 H PHE 43 HN PHE 43 -14.238 -7.418 -0.342 296 HA PHE 43 HA PHE 43 -12.941 -6.895 -2.845 297 HB2 PHE 43 HB2 PHE 43 -13.640 -5.249 -0.871 298 HB3 PHE 43 HB1 PHE 43 -11.999 -5.554 -0.329 299 HD1 PHE 43 HD1 PHE 43 -10.059 -4.932 -1.874 300 HD2 PHE 43 HD2 PHE 43 -14.081 -3.704 -2.628 301 HE1 PHE 43 HE1 PHE 43 -9.243 -3.167 -3.376 302 HE2 PHE 43 HE2 PHE 43 -13.254 -1.947 -4.141 303 HZ PHE 43 HZ PHE 43 -10.837 -1.678 -4.512 304 H LEU 44 HN LEU 44 -11.717 -8.174 0.286 305 HA LEU 44 HA LEU 44 -8.970 -8.476 -0.472 306 HB2 LEU 44 HB2 LEU 44 -10.644 -9.458 1.807 307 HB3 LEU 44 HB1 LEU 44 -9.044 -10.130 1.559 308 HG LEU 44 HG LEU 44 -9.097 -7.195 1.556 309 HD11 LEU 44 HD11 LEU 44 -9.318 -7.066 4.027 310 HD12 LEU 44 HD12 LEU 44 -9.897 -8.731 4.019 311 HD13 LEU 44 HD13 LEU 44 -10.818 -7.473 3.194 312 HD21 LEU 44 HD21 LEU 44 -7.511 -9.181 3.185 313 HD22 LEU 44 HD22 LEU 44 -7.145 -7.472 2.943 314 HD23 LEU 44 HD23 LEU 44 -7.048 -8.596 1.587 315 H ALA 45 HN ALA 45 -11.793 -10.490 -0.754 316 HA ALA 45 HA ALA 45 -10.471 -12.943 -1.565 317 HB1 ALA 45 HB1 ALA 45 -13.390 -12.242 -1.754 318 HB2 ALA 45 HB2 ALA 45 -12.618 -12.898 -0.310 319 HB3 ALA 45 HB3 ALA 45 -12.677 -13.853 -1.792 320 H GLN 46 HN GLN 46 -11.881 -10.139 -3.186 321 HA GLN 46 HA GLN 46 -12.070 -11.276 -5.833 322 HB2 GLN 46 HB2 GLN 46 -12.660 -8.663 -4.591 323 HB3 GLN 46 HB1 GLN 46 -12.128 -8.577 -6.263 324 HG2 GLN 46 HG2 GLN 46 -14.300 -10.504 -5.567 325 HG3 GLN 46 HG1 GLN 46 -14.686 -8.793 -5.676 326 HE21 GLN 46 HE21 GLN 46 -14.231 -11.655 -7.373 327 HE22 GLN 46 HE22 GLN 46 -14.281 -11.016 -8.977 328 H VAL 47 HN VAL 47 -9.712 -9.192 -4.151 329 HA VAL 47 HA VAL 47 -7.987 -8.658 -6.388 330 HB VAL 47 HB VAL 47 -7.277 -8.387 -3.410 331 HG11 VAL 47 HG11 VAL 47 -5.295 -8.364 -5.048 332 HG12 VAL 47 HG12 VAL 47 -5.438 -6.981 -3.960 333 HG13 VAL 47 HG13 VAL 47 -5.951 -6.838 -5.639 334 HG21 VAL 47 HG21 VAL 47 -9.200 -6.967 -4.060 335 HG22 VAL 47 HG22 VAL 47 -8.184 -6.193 -5.277 336 HG23 VAL 47 HG23 VAL 47 -7.786 -6.034 -3.567 337 H GLU 48 HN GLU 48 -7.986 -11.160 -3.826 338 HA GLU 48 HA GLU 48 -5.547 -12.504 -4.490 339 HB2 GLU 48 HB2 GLU 48 -7.945 -13.342 -2.851 340 HB3 GLU 48 HB1 GLU 48 -6.547 -14.376 -3.078 341 HG2 GLU 48 HG2 GLU 48 -5.152 -12.527 -2.067 342 HG3 GLU 48 HG1 GLU 48 -6.661 -11.721 -1.663 343 H GLU 49 HN GLU 49 -8.824 -12.765 -5.698 344 HA GLU 49 HA GLU 49 -8.417 -15.268 -7.156 345 HB2 GLU 49 HB2 GLU 49 -10.796 -13.502 -6.675 346 HB3 GLU 49 HB1 GLU 49 -10.828 -14.698 -7.963 347 HG2 GLU 49 HG2 GLU 49 -10.348 -16.456 -6.296 348 HG3 GLU 49 HG1 GLU 49 -10.413 -15.232 -5.029 349 H PHE 50 HN PHE 50 -8.408 -11.831 -7.788 350 HA PHE 50 HA PHE 50 -8.446 -12.125 -10.708 351 HB2 PHE 50 HB2 PHE 50 -9.319 -10.093 -8.906 352 HB3 PHE 50 HB1 PHE 50 -8.033 -9.407 -9.884 353 HD1 PHE 50 HD2 PHE 50 -8.326 -9.136 -12.312 354 HD2 PHE 50 HD1 PHE 50 -11.458 -10.682 -9.865 355 HE1 PHE 50 HE2 PHE 50 -9.942 -8.721 -14.118 356 HE2 PHE 50 HE1 PHE 50 -13.075 -10.262 -11.672 357 HZ PHE 50 HZ PHE 50 -12.317 -9.282 -13.799 358 H VAL 51 HN VAL 51 -6.786 -11.503 -12.036 359 HA VAL 51 HA VAL 51 -4.134 -11.390 -10.813 360 HB VAL 51 HB VAL 51 -4.897 -13.260 -12.456 361 HG11 VAL 51 HG11 VAL 51 -4.028 -11.326 -14.584 362 HG12 VAL 51 HG12 VAL 51 -5.668 -11.947 -14.351 363 HG13 VAL 51 HG13 VAL 51 -4.360 -13.046 -14.791 364 HG21 VAL 51 HG21 VAL 51 -2.691 -13.195 -11.582 365 HG22 VAL 51 HG22 VAL 51 -2.219 -11.946 -12.730 366 HG23 VAL 51 HG23 VAL 51 -2.605 -13.568 -13.304 367 H PHE 52 HN PHE 52 -2.505 -9.968 -11.614 368 HA PHE 52 HA PHE 52 -3.444 -7.474 -12.881 369 HB2 PHE 52 HB2 PHE 52 -1.658 -7.667 -10.436 370 HB3 PHE 52 HB1 PHE 52 -1.967 -6.187 -11.315 371 HD1 PHE 52 HD1 PHE 52 -4.187 -5.091 -11.171 372 HD2 PHE 52 HD2 PHE 52 -3.272 -8.581 -8.903 373 HE1 PHE 52 HE1 PHE 52 -6.141 -4.671 -9.737 374 HE2 PHE 52 HE2 PHE 52 -5.223 -8.166 -7.473 375 HZ PHE 52 HZ PHE 52 -6.662 -6.208 -7.885 376 H LYS 53 HN LYS 53 -1.972 -6.378 -14.117 377 HA LYS 53 HA LYS 53 0.352 -7.922 -15.066 378 HB2 LYS 53 HB2 LYS 53 -1.396 -5.851 -16.375 379 HB3 LYS 53 HB1 LYS 53 0.198 -6.214 -17.017 380 HG2 LYS 53 HG2 LYS 53 -0.448 -8.532 -17.372 381 HG3 LYS 53 HG1 LYS 53 -2.034 -8.212 -16.668 382 HD2 LYS 53 HD2 LYS 53 -2.476 -6.580 -18.455 383 HD3 LYS 53 HD1 LYS 53 -0.906 -6.951 -19.168 384 HE2 LYS 53 HE2 LYS 53 -1.608 -9.268 -19.509 385 HE3 LYS 53 HE1 LYS 53 -3.174 -8.903 -18.783 386 HZ1 LYS 53 HZ1 LYS 53 -2.136 -7.521 -21.192 387 HZ2 LYS 53 HZ2 LYS 53 -3.705 -7.460 -20.567 388 HZ3 LYS 53 HZ3 LYS 53 -3.130 -8.889 -21.263 389 H CYS 54 HN CYS 54 2.393 -7.079 -15.214 390 HA CYS 54 HA CYS 54 2.970 -4.737 -13.602 391 HB2 CYS 54 HB2 CYS 54 4.348 -6.724 -13.191 392 HB3 CYS 54 HB1 CYS 54 4.889 -6.714 -14.864 393 HA PRO 55 HA PRO 55 3.486 -2.122 -17.468 394 HB2 PRO 55 HB2 PRO 55 4.484 -0.048 -15.586 395 HB3 PRO 55 HB1 PRO 55 3.172 0.072 -16.763 396 HG2 PRO 55 HG2 PRO 55 2.591 -0.025 -14.184 397 HG3 PRO 55 HG1 PRO 55 1.636 -0.993 -15.331 398 HD2 PRO 55 HD2 PRO 55 3.936 -1.885 -13.584 399 HD3 PRO 55 HD1 PRO 55 2.314 -2.596 -13.753 400 H VAL 56 HN VAL 56 5.833 -3.101 -15.214 401 HA VAL 56 HA VAL 56 8.177 -1.871 -16.483 402 HB VAL 56 HB VAL 56 8.505 -3.685 -14.086 403 HG11 VAL 56 HG11 VAL 56 9.909 -1.088 -14.732 404 HG12 VAL 56 HG12 VAL 56 10.490 -2.689 -15.187 405 HG13 VAL 56 HG13 VAL 56 10.350 -2.255 -13.484 406 HG21 VAL 56 HG21 VAL 56 8.270 -1.739 -12.509 407 HG22 VAL 56 HG22 VAL 56 6.751 -2.334 -13.168 408 HG23 VAL 56 HG23 VAL 56 7.470 -0.855 -13.804 409 H CYS 57 HN CYS 57 7.033 -5.170 -15.496 410 HA CYS 57 HA CYS 57 9.015 -6.473 -17.200 411 HB2 CYS 57 HB2 CYS 57 6.956 -7.791 -15.403 412 HB3 CYS 57 HB1 CYS 57 8.316 -8.581 -16.182 413 H GLY 58 HN GLY 58 5.446 -6.639 -16.829 414 HA2 GLY 58 HA2 GLY 58 3.943 -6.395 -18.750 415 HA3 GLY 58 HA1 GLY 58 5.154 -7.211 -19.726 416 H GLU 59 HN GLU 59 5.336 -8.914 -16.988 417 HA GLU 59 HA GLU 59 3.614 -11.111 -17.806 418 HB2 GLU 59 HB2 GLU 59 5.833 -10.771 -15.807 419 HB3 GLU 59 HB1 GLU 59 4.748 -12.144 -15.661 420 HG2 GLU 59 HG2 GLU 59 5.343 -12.804 -17.972 421 HG3 GLU 59 HG1 GLU 59 6.509 -11.482 -18.012 422 H GLU 60 HN GLU 60 2.100 -12.186 -16.411 423 HA GLU 60 HA GLU 60 0.537 -10.392 -14.716 424 HB2 GLU 60 HB2 GLU 60 -0.007 -13.062 -15.995 425 HB3 GLU 60 HB1 GLU 60 -1.071 -12.419 -14.759 426 HG2 GLU 60 HG2 GLU 60 -1.639 -10.532 -16.119 427 HG3 GLU 60 HG1 GLU 60 -0.391 -10.939 -17.295 428 H PHE 61 HN PHE 61 0.143 -10.604 -12.629 429 HA PHE 61 HA PHE 61 1.305 -12.777 -11.045 430 HB2 PHE 61 HB2 PHE 61 2.073 -11.135 -9.316 431 HB3 PHE 61 HB1 PHE 61 2.937 -10.977 -10.829 432 HD1 PHE 61 HD1 PHE 61 2.646 -8.946 -12.215 433 HD2 PHE 61 HD2 PHE 61 0.693 -9.359 -8.455 434 HE1 PHE 61 HE1 PHE 61 2.172 -6.529 -12.196 435 HE2 PHE 61 HE2 PHE 61 0.219 -6.946 -8.431 436 HZ PHE 61 HZ PHE 61 0.956 -5.527 -10.303 437 H TYR 62 HN TYR 62 0.150 -13.315 -9.171 438 HA TYR 62 HA TYR 62 -2.657 -12.521 -9.202 439 HB2 TYR 62 HB2 TYR 62 -1.172 -14.840 -7.968 440 HB3 TYR 62 HB1 TYR 62 -2.852 -14.528 -7.596 441 HD1 TYR 62 HD2 TYR 62 -4.563 -14.610 -9.571 442 HD2 TYR 62 HD1 TYR 62 -0.547 -16.016 -9.923 443 HE1 TYR 62 HE2 TYR 62 -5.197 -15.929 -11.540 444 HE2 TYR 62 HE1 TYR 62 -1.184 -17.328 -11.895 445 HH TYR 62 HH TYR 62 -4.124 -18.189 -12.671 446 H GLY 63 HN GLY 63 -3.875 -12.027 -7.313 447 HA2 GLY 63 HA2 GLY 63 -2.619 -10.232 -5.450 448 HA3 GLY 63 HA1 GLY 63 -4.325 -10.613 -5.528 449 H LYS 64 HN LYS 64 -2.952 -13.508 -5.380 450 HA LYS 64 HA LYS 64 -3.331 -13.957 -2.523 451 HB2 LYS 64 HB2 LYS 64 -3.943 -15.481 -4.690 452 HB3 LYS 64 HB1 LYS 64 -2.423 -16.219 -4.200 453 HG2 LYS 64 HG2 LYS 64 -3.302 -16.703 -2.010 454 HG3 LYS 64 HG1 LYS 64 -4.787 -15.825 -2.366 455 HD2 LYS 64 HD2 LYS 64 -5.323 -17.446 -4.118 456 HD3 LYS 64 HD1 LYS 64 -3.835 -18.325 -3.757 457 HE2 LYS 64 HE2 LYS 64 -4.635 -18.722 -1.474 458 HE3 LYS 64 HE1 LYS 64 -6.125 -17.858 -1.851 459 HZ1 LYS 64 HZ1 LYS 64 -5.286 -20.534 -2.621 460 HZ2 LYS 64 HZ2 LYS 64 -6.129 -19.652 -3.792 461 HZ3 LYS 64 HZ3 LYS 64 -6.833 -19.939 -2.281 462 H THR 65 HN THR 65 -0.684 -13.314 -4.596 463 HA THR 65 HA THR 65 1.369 -14.501 -2.867 464 HB THR 65 HB THR 65 2.991 -13.663 -4.645 465 HG1 THR 65 HG1 THR 65 2.063 -12.235 -5.916 466 HG21 THR 65 HG21 THR 65 0.878 -15.555 -5.699 467 HG22 THR 65 HG22 THR 65 2.167 -16.016 -4.578 468 HG23 THR 65 HG23 THR 65 2.569 -15.459 -6.202 469 H LEU 66 HN LEU 66 -0.402 -11.804 -2.634 470 HA LEU 66 HA LEU 66 1.469 -9.642 -2.329 471 HB2 LEU 66 HB2 LEU 66 -1.435 -10.019 -1.724 472 HB3 LEU 66 HB1 LEU 66 -0.605 -8.663 -1.005 473 HG LEU 66 HG LEU 66 -0.447 -8.983 -3.981 474 HD11 LEU 66 HD11 LEU 66 -2.793 -7.672 -2.614 475 HD12 LEU 66 HD12 LEU 66 -2.872 -9.270 -3.346 476 HD13 LEU 66 HD13 LEU 66 -2.526 -7.861 -4.344 477 HD21 LEU 66 HD21 LEU 66 0.789 -7.191 -2.700 478 HD22 LEU 66 HD22 LEU 66 -0.782 -6.504 -2.294 479 HD23 LEU 66 HD23 LEU 66 -0.274 -6.604 -3.979 480 HA PRO 67 HA PRO 67 2.783 -10.352 2.069 481 HB2 PRO 67 HB2 PRO 67 2.649 -7.419 2.547 482 HB3 PRO 67 HB1 PRO 67 4.019 -8.514 2.770 483 HG2 PRO 67 HG2 PRO 67 4.032 -6.828 0.733 484 HG3 PRO 67 HG1 PRO 67 4.536 -8.514 0.473 485 HD2 PRO 67 HD2 PRO 67 1.863 -7.239 -0.119 486 HD3 PRO 67 HD1 PRO 67 2.883 -8.238 -1.176 487 H ARG 68 HN ARG 68 2.004 -10.452 4.174 488 HA ARG 68 HA ARG 68 -0.790 -10.302 4.622 489 HB2 ARG 68 HB2 ARG 68 1.539 -10.948 6.380 490 HB3 ARG 68 HB1 ARG 68 -0.063 -10.758 7.080 491 HG2 ARG 68 HG2 ARG 68 -0.918 -12.519 5.603 492 HG3 ARG 68 HG1 ARG 68 0.690 -12.708 4.904 493 HD2 ARG 68 HD2 ARG 68 0.531 -14.441 6.493 494 HD3 ARG 68 HD1 ARG 68 1.477 -13.189 7.295 495 HE ARG 68 HE ARG 68 -1.263 -12.860 7.923 496 HH11 ARG 68 HH11 ARG 68 1.389 -15.067 8.880 497 HH12 ARG 68 HH12 ARG 68 0.640 -15.439 10.396 498 HH21 ARG 68 HH21 ARG 68 -2.147 -13.402 9.907 499 HH22 ARG 68 HH22 ARG 68 -1.335 -14.506 10.965 500 H ARG 69 HN ARG 69 1.565 -7.802 5.008 501 HA ARG 69 HA ARG 69 0.190 -6.267 7.065 502 HB2 ARG 69 HB2 ARG 69 2.729 -5.906 5.500 503 HB3 ARG 69 HB1 ARG 69 2.019 -4.550 6.364 504 HG2 ARG 69 HG2 ARG 69 2.208 -5.732 8.460 505 HG3 ARG 69 HG1 ARG 69 2.800 -7.170 7.628 506 HD2 ARG 69 HD2 ARG 69 4.773 -5.954 6.896 507 HD3 ARG 69 HD1 ARG 69 4.171 -4.485 7.668 508 HE ARG 69 HE ARG 69 4.255 -6.429 9.638 509 HH11 ARG 69 HH11 ARG 69 6.796 -4.824 7.689 510 HH12 ARG 69 HH12 ARG 69 7.990 -5.042 8.925 511 HH21 ARG 69 HH21 ARG 69 5.862 -6.662 11.165 512 HH22 ARG 69 HH22 ARG 69 7.463 -6.072 10.867 513 H GLU 70 HN GLU 70 0.626 -6.273 3.541 514 HA GLU 70 HA GLU 70 -0.615 -3.791 2.895 515 HB2 GLU 70 HB2 GLU 70 0.205 -6.202 1.330 516 HB3 GLU 70 HB1 GLU 70 -0.836 -5.009 0.577 517 HG2 GLU 70 HG2 GLU 70 0.883 -3.270 1.146 518 HG3 GLU 70 HG1 GLU 70 1.938 -4.581 1.663 519 H ALA 71 HN ALA 71 -1.921 -7.028 3.380 520 HA ALA 71 HA ALA 71 -4.512 -6.772 2.254 521 HB1 ALA 71 HB1 ALA 71 -3.538 -8.561 4.469 522 HB2 ALA 71 HB2 ALA 71 -3.575 -8.931 2.745 523 HB3 ALA 71 HB3 ALA 71 -5.083 -8.727 3.636 524 H GLU 72 HN GLU 72 -3.236 -5.913 5.436 525 HA GLU 72 HA GLU 72 -5.698 -5.229 6.758 526 HB2 GLU 72 HB2 GLU 72 -2.795 -4.825 7.394 527 HB3 GLU 72 HB1 GLU 72 -4.022 -3.996 8.339 528 HG2 GLU 72 HG2 GLU 72 -5.028 -6.153 8.920 529 HG3 GLU 72 HG1 GLU 72 -3.787 -6.979 7.981 530 H LYS 73 HN LYS 73 -3.430 -3.472 4.738 531 HA LYS 73 HA LYS 73 -4.280 -0.776 5.196 532 HB2 LYS 73 HB2 LYS 73 -2.629 -2.107 3.077 533 HB3 LYS 73 HB1 LYS 73 -3.146 -0.440 2.871 534 HG2 LYS 73 HG2 LYS 73 -2.026 0.160 4.965 535 HG3 LYS 73 HG1 LYS 73 -1.497 -1.514 5.153 536 HD2 LYS 73 HD2 LYS 73 -0.230 -1.365 3.083 537 HD3 LYS 73 HD1 LYS 73 -0.796 0.290 2.839 538 HE2 LYS 73 HE2 LYS 73 0.314 0.970 4.908 539 HE3 LYS 73 HE1 LYS 73 0.884 -0.682 5.146 540 HZ1 LYS 73 HZ1 LYS 73 1.634 1.185 2.969 541 HZ2 LYS 73 HZ2 LYS 73 2.031 -0.459 2.961 542 HZ3 LYS 73 HZ3 LYS 73 2.639 0.550 4.174 543 H VAL 74 HN VAL 74 -5.445 -3.342 3.146 544 HA VAL 74 HA VAL 74 -6.982 -1.933 1.202 545 HB VAL 74 HB VAL 74 -7.717 -4.770 2.055 546 HG11 VAL 74 HG11 VAL 74 -8.204 -5.084 -0.371 547 HG12 VAL 74 HG12 VAL 74 -7.842 -3.377 -0.633 548 HG13 VAL 74 HG13 VAL 74 -9.206 -3.843 0.384 549 HG21 VAL 74 HG21 VAL 74 -5.192 -4.566 1.636 550 HG22 VAL 74 HG22 VAL 74 -5.617 -4.255 -0.045 551 HG23 VAL 74 HG23 VAL 74 -6.060 -5.788 0.703 552 H PHE 75 HN PHE 75 -7.875 -3.205 4.468 553 HA PHE 75 HA PHE 75 -10.611 -2.671 4.563 554 HB2 PHE 75 HB2 PHE 75 -8.448 -3.203 6.459 555 HB3 PHE 75 HB1 PHE 75 -9.691 -2.164 7.138 556 HD1 PHE 75 HD1 PHE 75 -8.950 -5.519 5.830 557 HD2 PHE 75 HD2 PHE 75 -11.916 -3.004 7.578 558 HE1 PHE 75 HE1 PHE 75 -10.334 -7.491 6.320 559 HE2 PHE 75 HE2 PHE 75 -13.301 -4.977 8.062 560 HZ PHE 75 HZ PHE 75 -12.511 -7.222 7.435 561 H GLU 76 HN GLU 76 -7.940 -0.391 4.780 562 HA GLU 76 HA GLU 76 -9.184 1.766 6.166 563 HB2 GLU 76 HB2 GLU 76 -6.614 1.149 5.574 564 HB3 GLU 76 HB1 GLU 76 -6.924 2.364 4.340 565 HG2 GLU 76 HG2 GLU 76 -6.192 3.777 5.980 566 HG3 GLU 76 HG1 GLU 76 -7.875 3.668 6.495 567 H LEU 77 HN LEU 77 -8.703 1.108 2.665 568 HA LEU 77 HA LEU 77 -9.820 3.533 1.707 569 HB2 LEU 77 HB2 LEU 77 -9.856 2.336 -0.512 570 HB3 LEU 77 HB1 LEU 77 -8.302 2.463 0.234 571 HG LEU 77 HG LEU 77 -9.072 -0.035 1.028 572 HD11 LEU 77 HD11 LEU 77 -10.009 0.161 -1.812 573 HD12 LEU 77 HD12 LEU 77 -11.106 0.277 -0.437 574 HD13 LEU 77 HD13 LEU 77 -10.166 -1.198 -0.692 575 HD21 LEU 77 HD21 LEU 77 -6.910 0.367 0.175 576 HD22 LEU 77 HD22 LEU 77 -7.537 0.848 -1.403 577 HD23 LEU 77 HD23 LEU 77 -7.640 -0.837 -0.887 578 H LEU 78 HN LEU 78 -11.205 0.380 2.395 579 HA LEU 78 HA LEU 78 -13.838 0.838 1.311 580 HB2 LEU 78 HB2 LEU 78 -12.602 -1.320 2.996 581 HB3 LEU 78 HB1 LEU 78 -14.332 -1.267 2.711 582 HG LEU 78 HG LEU 78 -12.968 -1.058 0.193 583 HD11 LEU 78 HD11 LEU 78 -11.114 -2.177 1.297 584 HD12 LEU 78 HD12 LEU 78 -11.904 -3.234 0.132 585 HD13 LEU 78 HD13 LEU 78 -12.204 -3.440 1.856 586 HD21 LEU 78 HD21 LEU 78 -14.285 -3.023 -0.323 587 HD22 LEU 78 HD22 LEU 78 -15.252 -1.809 0.510 588 HD23 LEU 78 HD23 LEU 78 -14.675 -3.226 1.382 589 H ASN 79 HN ASN 79 -12.272 1.487 4.382 590 HA ASN 79 HA ASN 79 -14.712 1.845 5.927 591 HB2 ASN 79 HB2 ASN 79 -11.842 1.657 6.511 592 HB3 ASN 79 HB1 ASN 79 -12.701 2.832 7.508 593 HD21 ASN 79 HD21 ASN 79 -11.964 -0.413 7.063 594 HD22 ASN 79 HD22 ASN 79 -13.070 -1.087 8.205 595 H ASP 80 HN ASP 80 -12.963 3.783 3.765 596 HA ASP 80 HA ASP 80 -13.208 6.401 4.867 597 HB2 ASP 80 HB2 ASP 80 -12.565 5.269 2.182 598 HB3 ASP 80 HB1 ASP 80 -12.968 6.979 2.294 599 H PHE 81 HN PHE 81 -15.359 4.474 2.798 600 HA PHE 81 HA PHE 81 -17.445 4.601 1.979 601 HB2 PHE 81 HB2 PHE 81 -17.744 6.025 4.578 602 HB3 PHE 81 HB1 PHE 81 -19.072 6.210 3.444 603 HD1 PHE 81 HD1 PHE 81 -17.238 3.868 5.592 604 HD2 PHE 81 HD2 PHE 81 -20.505 4.353 2.902 605 HE1 PHE 81 HE1 PHE 81 -18.202 1.747 6.377 606 HE2 PHE 81 HE2 PHE 81 -21.463 2.226 3.680 607 HZ PHE 81 HZ PHE 81 -20.313 0.920 5.420 608 H LYS 82 HN LYS 82 -17.160 8.044 2.979 609 HA LYS 82 HA LYS 82 -17.496 8.933 0.192 610 HB2 LYS 82 HB2 LYS 82 -18.989 9.784 2.653 611 HB3 LYS 82 HB1 LYS 82 -18.698 10.962 1.383 612 HG2 LYS 82 HG2 LYS 82 -19.894 9.579 -0.213 613 HG3 LYS 82 HG1 LYS 82 -20.122 8.329 1.012 614 HD2 LYS 82 HD2 LYS 82 -21.439 9.876 2.361 615 HD3 LYS 82 HD1 LYS 82 -21.185 11.151 1.168 616 HE2 LYS 82 HE2 LYS 82 -22.379 9.822 -0.503 617 HE3 LYS 82 HE1 LYS 82 -22.626 8.543 0.687 618 HZ1 LYS 82 HZ1 LYS 82 -23.520 11.063 1.664 619 HZ2 LYS 82 HZ2 LYS 82 -24.372 9.609 1.514 620 HZ3 LYS 82 HZ3 LYS 82 -24.284 10.675 0.205 621 H GLY 83 HN GLY 83 -16.169 10.492 -0.461 622 HA2 GLY 83 HA2 GLY 83 -14.778 12.433 -0.182 623 HA3 GLY 83 HA1 GLY 83 -14.425 11.904 1.457 624 H GLY 84 HN GLY 84 -13.253 12.126 -1.621 625 HA2 GLY 84 HA2 GLY 84 -10.936 11.618 -2.053 626 HA3 GLY 84 HA1 GLY 84 -11.149 10.124 -1.158 627 H ILE 85 HN ILE 85 -13.532 9.188 -2.332 628 HA ILE 85 HA ILE 85 -12.639 8.493 -5.069 629 HB ILE 85 HB ILE 85 -14.688 6.766 -3.623 630 HG12 ILE 85 HG12 ILE 85 -12.294 5.340 -3.341 631 HG13 ILE 85 HG11 ILE 85 -11.898 6.963 -2.784 632 HG21 ILE 85 HG21 ILE 85 -13.832 4.957 -5.014 633 HG22 ILE 85 HG22 ILE 85 -12.557 6.004 -5.636 634 HG23 ILE 85 HG23 ILE 85 -14.241 6.345 -6.023 635 HD11 ILE 85 HD11 ILE 85 -13.920 6.828 -1.303 636 HD12 ILE 85 HD12 ILE 85 -12.596 5.735 -0.893 637 HD13 ILE 85 HD13 ILE 85 -14.020 5.120 -1.733 638 H ASP 86 HN ASP 86 -13.786 9.202 -6.682 639 HA ASP 86 HA ASP 86 -16.563 10.117 -6.309 640 HB2 ASP 86 HB2 ASP 86 -14.443 11.698 -7.019 641 HB3 ASP 86 HB1 ASP 86 -15.066 11.228 -8.598 642 H TRP 87 HN TRP 87 -18.068 9.166 -7.471 643 HA TRP 87 HA TRP 87 -17.472 7.031 -9.335 644 HB2 TRP 87 HB2 TRP 87 -20.086 8.073 -8.246 645 HB3 TRP 87 HB1 TRP 87 -19.990 6.767 -9.422 646 HD1 TRP 87 HD1 TRP 87 -19.796 7.476 -5.776 647 HE1 TRP 87 HE1 TRP 87 -19.244 5.355 -4.444 648 HE3 TRP 87 HE3 TRP 87 -18.501 4.315 -9.650 649 HZ2 TRP 87 HZ2 TRP 87 -18.395 2.754 -4.928 650 HZ3 TRP 87 HZ3 TRP 87 -17.830 2.010 -9.089 651 HH2 TRP 87 HH2 TRP 87 -17.781 1.245 -6.773 652 H GLU 88 HN GLU 88 -18.743 10.300 -9.607 653 HA GLU 88 HA GLU 88 -19.524 10.138 -12.392 654 HB2 GLU 88 HB2 GLU 88 -19.456 12.347 -10.359 655 HB3 GLU 88 HB1 GLU 88 -19.707 12.716 -12.058 656 HG2 GLU 88 HG2 GLU 88 -21.696 11.315 -12.088 657 HG3 GLU 88 HG1 GLU 88 -21.432 10.883 -10.400 658 H ASN 89 HN ASN 89 -16.740 11.395 -10.600 659 HA ASN 89 HA ASN 89 -15.406 12.423 -12.986 660 HB2 ASN 89 HB2 ASN 89 -15.346 13.032 -10.187 661 HB3 ASN 89 HB1 ASN 89 -13.714 12.638 -10.726 662 HD21 ASN 89 HD21 ASN 89 -12.621 14.050 -11.945 663 HD22 ASN 89 HD22 ASN 89 -13.238 15.572 -12.480 664 H LYS 90 HN LYS 90 -15.415 9.487 -11.149 665 HA LYS 90 HA LYS 90 -14.248 7.560 -11.033 666 HB2 LYS 90 HB2 LYS 90 -13.756 8.419 -13.846 667 HB3 LYS 90 HB1 LYS 90 -12.792 7.079 -13.248 668 HG2 LYS 90 HG2 LYS 90 -14.790 5.825 -12.739 669 HG3 LYS 90 HG1 LYS 90 -15.800 7.196 -13.214 670 HD2 LYS 90 HD2 LYS 90 -14.921 7.061 -15.486 671 HD3 LYS 90 HD1 LYS 90 -13.895 5.705 -15.016 672 HE2 LYS 90 HE2 LYS 90 -15.863 4.375 -14.502 673 HE3 LYS 90 HE1 LYS 90 -16.907 5.736 -14.916 674 HZ1 LYS 90 HZ1 LYS 90 -15.371 5.457 -17.121 675 HZ2 LYS 90 HZ2 LYS 90 -16.931 4.830 -16.938 676 HZ3 LYS 90 HZ3 LYS 90 -15.586 3.849 -16.637 677 H ARG 91 HN ARG 91 -13.098 9.438 -9.520 678 HA ARG 91 HA ARG 91 -10.178 9.045 -9.721 679 HB2 ARG 91 HB2 ARG 91 -11.755 11.351 -8.585 680 HB3 ARG 91 HB1 ARG 91 -10.074 11.081 -8.148 681 HG2 ARG 91 HG2 ARG 91 -9.400 11.325 -10.466 682 HG3 ARG 91 HG1 ARG 91 -11.085 11.502 -10.959 683 HD2 ARG 91 HD2 ARG 91 -11.259 13.543 -9.628 684 HD3 ARG 91 HD1 ARG 91 -9.577 13.362 -9.125 685 HE ARG 91 HE ARG 91 -9.648 13.354 -11.920 686 HH11 ARG 91 HH11 ARG 91 -10.198 15.839 -9.395 687 HH12 ARG 91 HH12 ARG 91 -9.764 17.131 -10.464 688 HH21 ARG 91 HH21 ARG 91 -9.112 15.089 -13.213 689 HH22 ARG 91 HH22 ARG 91 -9.159 16.707 -12.597 690 H VAL 92 HN VAL 92 -9.068 8.203 -8.121 691 HA VAL 92 HA VAL 92 -10.458 7.373 -5.643 692 HB VAL 92 HB VAL 92 -8.139 5.700 -6.667 693 HG11 VAL 92 HG11 VAL 92 -9.252 5.418 -4.360 694 HG12 VAL 92 HG12 VAL 92 -8.991 3.958 -5.312 695 HG13 VAL 92 HG13 VAL 92 -10.594 4.683 -5.235 696 HG21 VAL 92 HG21 VAL 92 -10.902 4.773 -7.412 697 HG22 VAL 92 HG22 VAL 92 -9.351 4.305 -8.104 698 HG23 VAL 92 HG23 VAL 92 -10.047 5.876 -8.486 699 H LYS 93 HN LYS 93 -9.590 8.073 -3.839 700 HA LYS 93 HA LYS 93 -6.819 9.091 -3.759 701 HB2 LYS 93 HB2 LYS 93 -9.227 10.514 -3.350 702 HB3 LYS 93 HB1 LYS 93 -8.500 10.321 -1.763 703 HG2 LYS 93 HG2 LYS 93 -6.478 11.384 -2.516 704 HG3 LYS 93 HG1 LYS 93 -7.099 11.465 -4.165 705 HD2 LYS 93 HD2 LYS 93 -8.894 12.945 -3.434 706 HD3 LYS 93 HD1 LYS 93 -8.316 12.837 -1.769 707 HE2 LYS 93 HE2 LYS 93 -7.387 14.858 -2.473 708 HE3 LYS 93 HE1 LYS 93 -6.073 13.724 -2.782 709 HZ1 LYS 93 HZ1 LYS 93 -7.203 13.589 -5.116 710 HZ2 LYS 93 HZ2 LYS 93 -6.154 14.864 -4.746 711 HZ3 LYS 93 HZ3 LYS 93 -7.828 15.103 -4.688 712 H LEU 94 HN LEU 94 -5.557 8.384 -2.190 713 HA LEU 94 HA LEU 94 -6.655 6.784 0.017 714 HB2 LEU 94 HB2 LEU 94 -4.329 6.268 -1.800 715 HB3 LEU 94 HB1 LEU 94 -4.285 5.657 -0.159 716 HG LEU 94 HG LEU 94 -6.786 4.960 -1.474 717 HD11 LEU 94 HD11 LEU 94 -5.575 4.973 -3.526 718 HD12 LEU 94 HD12 LEU 94 -5.774 3.297 -3.018 719 HD13 LEU 94 HD13 LEU 94 -4.223 4.103 -2.797 720 HD21 LEU 94 HD21 LEU 94 -6.145 2.711 -0.741 721 HD22 LEU 94 HD22 LEU 94 -5.970 3.891 0.558 722 HD23 LEU 94 HD23 LEU 94 -4.545 3.307 -0.302 723 H LYS 95 HN LYS 95 -6.134 7.350 1.949 724 HA LYS 95 HA LYS 95 -4.067 9.394 2.438 725 HB2 LYS 95 HB2 LYS 95 -6.824 9.084 3.355 726 HB3 LYS 95 HB1 LYS 95 -5.698 9.371 4.674 727 HG2 LYS 95 HG2 LYS 95 -4.934 11.408 3.642 728 HG3 LYS 95 HG1 LYS 95 -5.928 11.096 2.218 729 HD2 LYS 95 HD2 LYS 95 -7.947 11.258 3.589 730 HD3 LYS 95 HD1 LYS 95 -6.956 11.559 5.018 731 HE2 LYS 95 HE2 LYS 95 -6.092 13.603 3.987 732 HE3 LYS 95 HE1 LYS 95 -7.080 13.300 2.557 733 HZ1 LYS 95 HZ1 LYS 95 -7.832 14.776 4.692 734 HZ2 LYS 95 HZ2 LYS 95 -8.573 13.290 5.015 735 HZ3 LYS 95 HZ3 LYS 95 -8.890 14.094 3.561 Start of MODEL 5 1 H1 MET 8 HT1 MET 8 2.701 0.608 0.261 2 H2 MET 8 HT2 MET 8 1.744 -0.762 0.003 3 H3 MET 8 HT3 MET 8 1.190 0.760 -0.484 4 HA MET 8 HA MET 8 1.988 0.336 -2.477 5 HB2 MET 8 HB2 MET 8 4.468 0.720 -0.847 6 HB3 MET 8 HB1 MET 8 4.627 0.260 -2.535 7 HG2 MET 8 HG2 MET 8 3.355 2.237 -3.197 8 HG3 MET 8 HG1 MET 8 3.188 2.696 -1.503 9 HE1 MET 8 HE1 MET 8 3.941 4.950 -2.429 10 HE2 MET 8 HE2 MET 8 4.720 4.623 -3.977 11 HE3 MET 8 HE3 MET 8 5.625 5.411 -2.683 12 H ALA 9 HN ALA 9 2.262 -1.242 -3.881 13 HA ALA 9 HA ALA 9 3.025 -3.923 -2.930 14 HB1 ALA 9 HB1 ALA 9 1.835 -4.651 -5.083 15 HB2 ALA 9 HB2 ALA 9 1.221 -3.000 -5.157 16 HB3 ALA 9 HB3 ALA 9 0.824 -4.024 -3.780 17 H LYS 10 HN LYS 10 4.576 -5.088 -3.903 18 HA LYS 10 HA LYS 10 6.248 -3.792 -5.942 19 HB2 LYS 10 HB2 LYS 10 6.893 -5.522 -3.591 20 HB3 LYS 10 HB1 LYS 10 7.938 -5.598 -5.003 21 HG2 LYS 10 HG2 LYS 10 8.385 -3.220 -4.830 22 HG3 LYS 10 HG1 LYS 10 7.284 -3.097 -3.456 23 HD2 LYS 10 HD2 LYS 10 8.710 -4.618 -2.177 24 HD3 LYS 10 HD1 LYS 10 9.806 -4.754 -3.554 25 HE2 LYS 10 HE2 LYS 10 10.270 -2.358 -3.423 26 HE3 LYS 10 HE1 LYS 10 9.167 -2.216 -2.055 27 HZ1 LYS 10 HZ1 LYS 10 11.454 -4.077 -1.955 28 HZ2 LYS 10 HZ2 LYS 10 10.603 -3.370 -0.675 29 HZ3 LYS 10 HZ3 LYS 10 11.665 -2.435 -1.601 30 H CYS 11 HN CYS 11 6.776 -4.839 -7.777 31 HA CYS 11 HA CYS 11 5.221 -7.021 -8.722 32 HB2 CYS 11 HB2 CYS 11 6.104 -5.247 -10.231 33 HB3 CYS 11 HB1 CYS 11 7.723 -5.870 -9.981 34 HA PRO 12 HA PRO 12 8.038 -10.417 -7.213 35 HB2 PRO 12 HB2 PRO 12 6.583 -12.330 -8.911 36 HB3 PRO 12 HB1 PRO 12 6.728 -12.309 -7.150 37 HG2 PRO 12 HG2 PRO 12 4.392 -11.735 -8.352 38 HG3 PRO 12 HG1 PRO 12 4.910 -10.868 -6.890 39 HD2 PRO 12 HD2 PRO 12 5.120 -9.992 -9.773 40 HD3 PRO 12 HD1 PRO 12 4.493 -9.102 -8.369 41 H ILE 13 HN ILE 13 7.649 -9.504 -10.537 42 HA ILE 13 HA ILE 13 9.600 -11.357 -11.640 43 HB ILE 13 HB ILE 13 8.069 -9.168 -13.147 44 HG12 ILE 13 HG12 ILE 13 6.950 -11.754 -13.750 45 HG13 ILE 13 HG11 ILE 13 6.921 -11.540 -12.005 46 HG21 ILE 13 HG21 ILE 13 9.208 -11.763 -14.252 47 HG22 ILE 13 HG22 ILE 13 9.978 -10.183 -14.401 48 HG23 ILE 13 HG23 ILE 13 8.421 -10.480 -15.173 49 HD11 ILE 13 HD11 ILE 13 5.588 -9.585 -12.188 50 HD12 ILE 13 HD12 ILE 13 4.855 -10.824 -13.206 51 HD13 ILE 13 HD13 ILE 13 5.801 -9.528 -13.938 52 H CYS 14 HN CYS 14 9.174 -7.729 -11.390 53 HA CYS 14 HA CYS 14 12.052 -7.401 -11.961 54 HB2 CYS 14 HB2 CYS 14 11.530 -5.093 -12.616 55 HB3 CYS 14 HB1 CYS 14 10.603 -6.255 -13.553 56 H GLY 15 HN GLY 15 9.501 -6.407 -9.704 57 HA2 GLY 15 HA2 GLY 15 9.728 -5.988 -7.392 58 HA3 GLY 15 HA1 GLY 15 11.457 -5.777 -7.610 59 H SER 16 HN SER 16 8.855 -4.177 -9.435 60 HA SER 16 HA SER 16 9.947 -1.544 -8.826 61 HB2 SER 16 HB2 SER 16 8.404 -0.791 -10.651 62 HB3 SER 16 HB1 SER 16 9.552 -2.033 -11.140 63 HG SER 16 HG SER 16 6.862 -2.553 -10.380 64 HA PRO 17 HA PRO 17 6.539 -0.470 -5.860 65 HB2 PRO 17 HB2 PRO 17 6.845 2.385 -6.616 66 HB3 PRO 17 HB1 PRO 17 6.989 1.642 -5.018 67 HG2 PRO 17 HG2 PRO 17 9.168 2.505 -6.261 68 HG3 PRO 17 HG1 PRO 17 9.197 0.943 -5.411 69 HD2 PRO 17 HD2 PRO 17 8.836 1.465 -8.368 70 HD3 PRO 17 HD1 PRO 17 9.958 0.352 -7.558 71 H LEU 18 HN LEU 18 4.420 -0.369 -5.986 72 HA LEU 18 HA LEU 18 3.100 0.687 -8.408 73 HB2 LEU 18 HB2 LEU 18 2.462 -1.744 -6.752 74 HB3 LEU 18 HB1 LEU 18 1.267 -1.001 -7.800 75 HG LEU 18 HG LEU 18 3.777 -1.584 -9.187 76 HD11 LEU 18 HD11 LEU 18 2.216 -3.852 -7.962 77 HD12 LEU 18 HD12 LEU 18 3.905 -3.443 -7.659 78 HD13 LEU 18 HD13 LEU 18 3.410 -4.025 -9.249 79 HD21 LEU 18 HD21 LEU 18 1.558 -0.955 -10.189 80 HD22 LEU 18 HD22 LEU 18 0.967 -2.547 -9.710 81 HD23 LEU 18 HD23 LEU 18 2.294 -2.409 -10.865 82 H LYS 19 HN LYS 19 1.263 1.843 -8.205 83 HA LYS 19 HA LYS 19 0.678 2.974 -5.573 84 HB2 LYS 19 HB2 LYS 19 0.248 3.872 -8.398 85 HB3 LYS 19 HB1 LYS 19 -0.770 4.537 -7.130 86 HG2 LYS 19 HG2 LYS 19 1.188 5.382 -5.968 87 HG3 LYS 19 HG1 LYS 19 2.241 4.653 -7.184 88 HD2 LYS 19 HD2 LYS 19 1.253 6.075 -8.903 89 HD3 LYS 19 HD1 LYS 19 0.175 6.790 -7.703 90 HE2 LYS 19 HE2 LYS 19 2.109 7.651 -6.480 91 HE3 LYS 19 HE1 LYS 19 3.187 6.932 -7.675 92 HZ1 LYS 19 HZ1 LYS 19 2.941 9.198 -8.237 93 HZ2 LYS 19 HZ2 LYS 19 1.258 9.145 -8.079 94 HZ3 LYS 19 HZ3 LYS 19 2.012 8.339 -9.361 95 H TRP 20 HN TRP 20 -1.117 2.632 -4.489 96 HA TRP 20 HA TRP 20 -3.051 0.650 -5.187 97 HB2 TRP 20 HB2 TRP 20 -2.674 2.518 -2.880 98 HB3 TRP 20 HB1 TRP 20 -4.213 1.680 -3.063 99 HD1 TRP 20 HD1 TRP 20 -0.552 1.063 -2.199 100 HE1 TRP 20 HE1 TRP 20 -0.280 -1.318 -1.263 101 HE3 TRP 20 HE3 TRP 20 -5.282 -0.792 -3.119 102 HZ2 TRP 20 HZ2 TRP 20 -1.812 -3.631 -0.965 103 HZ3 TRP 20 HZ3 TRP 20 -5.763 -3.107 -2.457 104 HH2 TRP 20 HH2 TRP 20 -4.058 -4.499 -1.401 105 H GLU 21 HN GLU 21 -2.992 4.120 -5.551 106 HA GLU 21 HA GLU 21 -5.756 4.666 -6.032 107 HB2 GLU 21 HB2 GLU 21 -3.205 6.153 -6.604 108 HB3 GLU 21 HB1 GLU 21 -4.744 6.753 -7.197 109 HG2 GLU 21 HG2 GLU 21 -5.587 6.864 -4.890 110 HG3 GLU 21 HG1 GLU 21 -4.039 6.265 -4.300 111 H GLU 22 HN GLU 22 -3.063 3.654 -8.122 112 HA GLU 22 HA GLU 22 -4.410 3.968 -10.658 113 HB2 GLU 22 HB2 GLU 22 -1.800 2.816 -9.773 114 HB3 GLU 22 HB1 GLU 22 -2.414 2.404 -11.368 115 HG2 GLU 22 HG2 GLU 22 -2.535 4.805 -11.916 116 HG3 GLU 22 HG1 GLU 22 -1.853 5.182 -10.335 117 H LEU 23 HN LEU 23 -3.960 1.314 -8.347 118 HA LEU 23 HA LEU 23 -4.809 -0.903 -9.889 119 HB2 LEU 23 HB2 LEU 23 -3.563 -0.704 -7.574 120 HB3 LEU 23 HB1 LEU 23 -5.181 -0.766 -6.915 121 HG LEU 23 HG LEU 23 -5.036 -2.925 -8.670 122 HD11 LEU 23 HD11 LEU 23 -2.600 -2.928 -6.920 123 HD12 LEU 23 HD12 LEU 23 -2.569 -2.605 -8.653 124 HD13 LEU 23 HD13 LEU 23 -3.108 -4.175 -8.059 125 HD21 LEU 23 HD21 LEU 23 -5.154 -4.261 -6.591 126 HD22 LEU 23 HD22 LEU 23 -6.292 -2.913 -6.617 127 HD23 LEU 23 HD23 LEU 23 -4.807 -2.795 -5.674 128 H ILE 24 HN ILE 24 -6.625 1.298 -7.730 129 HA ILE 24 HA ILE 24 -9.190 -0.008 -7.993 130 HB ILE 24 HB ILE 24 -8.803 2.809 -6.907 131 HG12 ILE 24 HG12 ILE 24 -7.250 1.669 -5.484 132 HG13 ILE 24 HG11 ILE 24 -8.697 1.895 -4.537 133 HG21 ILE 24 HG21 ILE 24 -11.135 2.203 -7.235 134 HG22 ILE 24 HG22 ILE 24 -10.786 2.429 -5.520 135 HG23 ILE 24 HG23 ILE 24 -10.937 0.806 -6.182 136 HD11 ILE 24 HD11 ILE 24 -7.773 -0.221 -3.959 137 HD12 ILE 24 HD12 ILE 24 -7.595 -0.691 -5.650 138 HD13 ILE 24 HD13 ILE 24 -9.192 -0.549 -4.942 139 H GLU 25 HN GLU 25 -7.620 2.849 -9.486 140 HA GLU 25 HA GLU 25 -9.809 3.893 -10.957 141 HB2 GLU 25 HB2 GLU 25 -7.183 4.639 -10.417 142 HB3 GLU 25 HB1 GLU 25 -7.231 4.446 -12.160 143 HG2 GLU 25 HG2 GLU 25 -9.203 5.947 -12.221 144 HG3 GLU 25 HG1 GLU 25 -9.008 6.204 -10.489 145 H GLU 26 HN GLU 26 -7.287 1.537 -11.825 146 HA GLU 26 HA GLU 26 -8.034 1.180 -14.582 147 HB2 GLU 26 HB2 GLU 26 -6.123 -0.172 -12.708 148 HB3 GLU 26 HB1 GLU 26 -6.452 -0.826 -14.284 149 HG2 GLU 26 HG2 GLU 26 -5.653 1.224 -15.350 150 HG3 GLU 26 HG1 GLU 26 -5.330 1.920 -13.764 151 H MET 27 HN MET 27 -9.063 -0.182 -11.543 152 HA MET 27 HA MET 27 -10.296 -2.510 -12.821 153 HB2 MET 27 HB2 MET 27 -9.102 -2.053 -10.156 154 HB3 MET 27 HB1 MET 27 -10.589 -2.988 -10.144 155 HG2 MET 27 HG2 MET 27 -8.788 -4.526 -10.224 156 HG3 MET 27 HG1 MET 27 -9.522 -4.523 -11.826 157 HE1 MET 27 HE1 MET 27 -7.178 -5.878 -12.347 158 HE2 MET 27 HE2 MET 27 -6.135 -4.906 -13.386 159 HE3 MET 27 HE3 MET 27 -7.873 -4.965 -13.686 160 H LEU 28 HN LEU 28 -11.225 0.501 -12.449 161 HA LEU 28 HA LEU 28 -13.785 0.128 -11.089 162 HB2 LEU 28 HB2 LEU 28 -12.027 2.177 -10.995 163 HB3 LEU 28 HB1 LEU 28 -13.092 2.775 -12.251 164 HG LEU 28 HG LEU 28 -14.858 1.987 -10.267 165 HD11 LEU 28 HD11 LEU 28 -14.081 2.886 -8.196 166 HD12 LEU 28 HD12 LEU 28 -12.562 3.398 -8.930 167 HD13 LEU 28 HD13 LEU 28 -12.917 1.680 -8.745 168 HD21 LEU 28 HD21 LEU 28 -13.663 4.691 -10.823 169 HD22 LEU 28 HD22 LEU 28 -15.127 4.405 -9.883 170 HD23 LEU 28 HD23 LEU 28 -15.079 3.977 -11.593 171 H ILE 29 HN ILE 29 -12.935 -0.763 -13.969 172 HA ILE 29 HA ILE 29 -14.938 0.394 -15.720 173 HB ILE 29 HB ILE 29 -14.021 -1.350 -17.401 174 HG12 ILE 29 HG12 ILE 29 -11.342 -1.445 -16.334 175 HG13 ILE 29 HG11 ILE 29 -12.433 -2.214 -15.189 176 HG21 ILE 29 HG21 ILE 29 -12.330 0.905 -16.375 177 HG22 ILE 29 HG22 ILE 29 -13.566 0.973 -17.631 178 HG23 ILE 29 HG23 ILE 29 -12.064 0.093 -17.917 179 HD11 ILE 29 HD11 ILE 29 -13.258 -3.652 -17.024 180 HD12 ILE 29 HD12 ILE 29 -11.545 -3.867 -16.660 181 HD13 ILE 29 HD13 ILE 29 -12.036 -2.941 -18.079 182 H ILE 30 HN ILE 30 -15.265 -1.762 -13.355 183 HA ILE 30 HA ILE 30 -17.171 -3.593 -14.690 184 HB ILE 30 HB ILE 30 -16.136 -4.195 -11.890 185 HG12 ILE 30 HG12 ILE 30 -14.673 -5.832 -13.753 186 HG13 ILE 30 HG11 ILE 30 -14.371 -4.143 -14.143 187 HG21 ILE 30 HG21 ILE 30 -16.873 -6.143 -14.086 188 HG22 ILE 30 HG22 ILE 30 -18.025 -5.526 -12.900 189 HG23 ILE 30 HG23 ILE 30 -16.645 -6.489 -12.371 190 HD11 ILE 30 HD11 ILE 30 -13.702 -3.761 -11.799 191 HD12 ILE 30 HD12 ILE 30 -12.684 -4.933 -12.633 192 HD13 ILE 30 HD13 ILE 30 -13.908 -5.486 -11.489 193 H GLU 31 HN GLU 31 -19.248 -3.753 -13.978 194 HA GLU 31 HA GLU 31 -20.385 -1.593 -12.419 195 HB2 GLU 31 HB2 GLU 31 -21.520 -3.799 -14.093 196 HB3 GLU 31 HB1 GLU 31 -22.571 -2.936 -12.981 197 HG2 GLU 31 HG2 GLU 31 -22.011 -0.825 -14.083 198 HG3 GLU 31 HG1 GLU 31 -20.946 -1.688 -15.193 199 H ASN 32 HN ASN 32 -19.493 -4.856 -11.740 200 HA ASN 32 HA ASN 32 -21.165 -5.311 -9.428 201 HB2 ASN 32 HB2 ASN 32 -18.908 -6.755 -10.759 202 HB3 ASN 32 HB1 ASN 32 -19.357 -7.202 -9.117 203 HD21 ASN 32 HD21 ASN 32 -20.015 -7.589 -12.390 204 HD22 ASN 32 HD22 ASN 32 -21.496 -8.469 -12.251 205 H PHE 33 HN PHE 33 -18.096 -3.789 -9.999 206 HA PHE 33 HA PHE 33 -16.710 -3.919 -7.591 207 HB2 PHE 33 HB2 PHE 33 -16.194 -2.761 -9.964 208 HB3 PHE 33 HB1 PHE 33 -16.537 -1.333 -9.014 209 HD1 PHE 33 HD1 PHE 33 -14.216 -4.159 -9.462 210 HD2 PHE 33 HD2 PHE 33 -15.035 -0.620 -7.226 211 HE1 PHE 33 HE1 PHE 33 -11.931 -4.202 -8.555 212 HE2 PHE 33 HE2 PHE 33 -12.759 -0.679 -6.314 213 HZ PHE 33 HZ PHE 33 -11.200 -2.463 -6.981 214 H GLU 34 HN GLU 34 -19.318 -1.723 -8.476 215 HA GLU 34 HA GLU 34 -19.391 0.089 -6.320 216 HB2 GLU 34 HB2 GLU 34 -21.477 -0.957 -8.207 217 HB3 GLU 34 HB1 GLU 34 -21.938 0.119 -6.898 218 HG2 GLU 34 HG2 GLU 34 -20.357 1.804 -7.764 219 HG3 GLU 34 HG1 GLU 34 -19.968 0.725 -9.100 220 H GLU 35 HN GLU 35 -20.545 -3.219 -6.578 221 HA GLU 35 HA GLU 35 -21.935 -3.331 -4.000 222 HB2 GLU 35 HB2 GLU 35 -21.514 -5.277 -6.247 223 HB3 GLU 35 HB1 GLU 35 -22.025 -5.857 -4.672 224 HG2 GLU 35 HG2 GLU 35 -23.995 -4.386 -4.791 225 HG3 GLU 35 HG1 GLU 35 -23.490 -3.869 -6.398 226 H ILE 36 HN ILE 36 -18.843 -4.358 -5.392 227 HA ILE 36 HA ILE 36 -17.937 -6.056 -3.239 228 HB ILE 36 HB ILE 36 -16.185 -4.842 -5.450 229 HG12 ILE 36 HG12 ILE 36 -16.982 -7.717 -5.571 230 HG13 ILE 36 HG11 ILE 36 -18.245 -6.565 -5.950 231 HG21 ILE 36 HG21 ILE 36 -14.400 -6.145 -4.745 232 HG22 ILE 36 HG22 ILE 36 -15.449 -7.493 -4.301 233 HG23 ILE 36 HG23 ILE 36 -15.261 -6.126 -3.202 234 HD11 ILE 36 HD11 ILE 36 -17.400 -6.147 -7.997 235 HD12 ILE 36 HD12 ILE 36 -16.502 -7.643 -7.761 236 HD13 ILE 36 HD13 ILE 36 -15.734 -6.098 -7.413 237 H VAL 37 HN VAL 37 -17.510 -2.618 -4.025 238 HA VAL 37 HA VAL 37 -15.503 -1.915 -2.163 239 HB VAL 37 HB VAL 37 -16.320 0.497 -2.393 240 HG11 VAL 37 HG11 VAL 37 -14.497 -0.276 -3.726 241 HG12 VAL 37 HG12 VAL 37 -15.560 0.680 -4.760 242 HG13 VAL 37 HG13 VAL 37 -15.593 -1.081 -4.851 243 HG21 VAL 37 HG21 VAL 37 -17.831 1.060 -4.244 244 HG22 VAL 37 HG22 VAL 37 -18.679 0.139 -3.005 245 HG23 VAL 37 HG23 VAL 37 -18.168 -0.650 -4.495 246 H LYS 38 HN LYS 38 -18.794 -2.580 -1.579 247 HA LYS 38 HA LYS 38 -18.986 -1.305 1.040 248 HB2 LYS 38 HB2 LYS 38 -20.901 -2.752 -0.769 249 HB3 LYS 38 HB1 LYS 38 -21.291 -2.550 0.933 250 HG2 LYS 38 HG2 LYS 38 -21.176 -0.137 0.703 251 HG3 LYS 38 HG1 LYS 38 -20.692 -0.302 -0.984 252 HD2 LYS 38 HD2 LYS 38 -22.829 -1.366 -1.499 253 HD3 LYS 38 HD1 LYS 38 -23.313 -1.230 0.193 254 HE2 LYS 38 HE2 LYS 38 -23.165 1.209 0.032 255 HE3 LYS 38 HE1 LYS 38 -22.682 1.067 -1.658 256 HZ1 LYS 38 HZ1 LYS 38 -25.294 0.963 -0.499 257 HZ2 LYS 38 HZ2 LYS 38 -24.997 -0.366 -1.502 258 HZ3 LYS 38 HZ3 LYS 38 -24.840 1.204 -2.112 259 H ASP 39 HN ASP 39 -18.099 -4.396 -0.266 260 HA ASP 39 HA ASP 39 -18.252 -5.667 2.373 261 HB2 ASP 39 HB2 ASP 39 -18.969 -6.758 -0.326 262 HB3 ASP 39 HB1 ASP 39 -18.338 -7.857 0.893 263 H ARG 40 HN ARG 40 -16.269 -5.404 3.117 264 HA ARG 40 HA ARG 40 -13.789 -5.599 1.918 265 HB2 ARG 40 HB2 ARG 40 -12.853 -5.961 4.215 266 HB3 ARG 40 HB1 ARG 40 -13.977 -4.628 4.104 267 HG2 ARG 40 HG2 ARG 40 -15.716 -6.420 5.007 268 HG3 ARG 40 HG1 ARG 40 -14.258 -7.217 5.604 269 HD2 ARG 40 HD2 ARG 40 -14.852 -5.863 7.403 270 HD3 ARG 40 HD1 ARG 40 -13.703 -4.849 6.538 271 HE ARG 40 HE ARG 40 -16.306 -4.321 5.600 272 HH11 ARG 40 HH11 ARG 40 -14.392 -3.530 8.534 273 HH12 ARG 40 HH12 ARG 40 -15.344 -2.121 8.863 274 HH21 ARG 40 HH21 ARG 40 -17.462 -2.493 6.118 275 HH22 ARG 40 HH22 ARG 40 -17.058 -1.546 7.511 276 H GLU 41 HN GLU 41 -15.695 -8.268 3.186 277 HA GLU 41 HA GLU 41 -13.853 -10.405 3.038 278 HB2 GLU 41 HB2 GLU 41 -16.432 -9.968 3.919 279 HB3 GLU 41 HB1 GLU 41 -16.641 -11.111 2.608 280 HG2 GLU 41 HG2 GLU 41 -15.003 -12.605 3.704 281 HG3 GLU 41 HG1 GLU 41 -14.904 -11.457 5.041 282 H ARG 42 HN ARG 42 -16.049 -8.990 0.642 283 HA ARG 42 HA ARG 42 -15.603 -10.954 -1.445 284 HB2 ARG 42 HB2 ARG 42 -17.190 -8.417 -1.233 285 HB3 ARG 42 HB1 ARG 42 -16.848 -9.100 -2.814 286 HG2 ARG 42 HG2 ARG 42 -17.961 -11.182 -2.153 287 HG3 ARG 42 HG1 ARG 42 -18.310 -10.486 -0.569 288 HD2 ARG 42 HD2 ARG 42 -19.644 -8.733 -1.629 289 HD3 ARG 42 HD1 ARG 42 -19.278 -9.404 -3.217 290 HE ARG 42 HE ARG 42 -20.420 -11.432 -1.673 291 HH11 ARG 42 HH11 ARG 42 -21.653 -8.402 -3.141 292 HH12 ARG 42 HH12 ARG 42 -23.270 -9.015 -3.225 293 HH21 ARG 42 HH21 ARG 42 -22.534 -12.120 -1.831 294 HH22 ARG 42 HH22 ARG 42 -23.758 -11.089 -2.493 295 H PHE 43 HN PHE 43 -14.337 -7.753 -0.549 296 HA PHE 43 HA PHE 43 -13.020 -7.156 -3.026 297 HB2 PHE 43 HB2 PHE 43 -13.810 -5.531 -1.082 298 HB3 PHE 43 HB1 PHE 43 -12.191 -5.816 -0.465 299 HD1 PHE 43 HD1 PHE 43 -10.185 -5.188 -1.919 300 HD2 PHE 43 HD2 PHE 43 -14.184 -4.006 -2.865 301 HE1 PHE 43 HE1 PHE 43 -9.322 -3.444 -3.421 302 HE2 PHE 43 HE2 PHE 43 -13.306 -2.273 -4.374 303 HZ PHE 43 HZ PHE 43 -10.895 -2.007 -4.649 304 H LEU 44 HN LEU 44 -11.819 -8.390 0.148 305 HA LEU 44 HA LEU 44 -9.043 -8.521 -0.577 306 HB2 LEU 44 HB2 LEU 44 -10.684 -9.454 1.741 307 HB3 LEU 44 HB1 LEU 44 -9.032 -10.015 1.569 308 HG LEU 44 HG LEU 44 -9.246 -7.111 1.305 309 HD11 LEU 44 HD11 LEU 44 -9.655 -6.726 3.718 310 HD12 LEU 44 HD12 LEU 44 -10.163 -8.408 3.858 311 HD13 LEU 44 HD13 LEU 44 -11.072 -7.297 2.835 312 HD21 LEU 44 HD21 LEU 44 -7.152 -8.394 1.624 313 HD22 LEU 44 HD22 LEU 44 -7.708 -8.839 3.238 314 HD23 LEU 44 HD23 LEU 44 -7.398 -7.147 2.848 315 H ALA 45 HN ALA 45 -11.700 -10.803 -0.621 316 HA ALA 45 HA ALA 45 -10.238 -13.205 -1.235 317 HB1 ALA 45 HB1 ALA 45 -12.456 -13.195 -0.148 318 HB2 ALA 45 HB2 ALA 45 -12.393 -14.226 -1.578 319 HB3 ALA 45 HB3 ALA 45 -13.167 -12.644 -1.664 320 H GLN 46 HN GLN 46 -11.668 -10.643 -3.183 321 HA GLN 46 HA GLN 46 -11.527 -11.990 -5.732 322 HB2 GLN 46 HB2 GLN 46 -12.696 -9.570 -4.729 323 HB3 GLN 46 HB1 GLN 46 -11.750 -9.217 -6.170 324 HG2 GLN 46 HG2 GLN 46 -12.964 -10.930 -7.406 325 HG3 GLN 46 HG1 GLN 46 -13.894 -11.323 -5.965 326 HE21 GLN 46 HE21 GLN 46 -15.752 -10.353 -5.693 327 HE22 GLN 46 HE22 GLN 46 -16.306 -8.969 -6.554 328 H VAL 47 HN VAL 47 -9.472 -9.642 -3.990 329 HA VAL 47 HA VAL 47 -7.638 -9.034 -6.123 330 HB VAL 47 HB VAL 47 -7.209 -8.680 -3.095 331 HG11 VAL 47 HG11 VAL 47 -5.075 -8.567 -4.626 332 HG12 VAL 47 HG12 VAL 47 -5.335 -7.304 -3.423 333 HG13 VAL 47 HG13 VAL 47 -5.730 -7.004 -5.115 334 HG21 VAL 47 HG21 VAL 47 -9.086 -7.351 -3.910 335 HG22 VAL 47 HG22 VAL 47 -8.044 -6.609 -5.123 336 HG23 VAL 47 HG23 VAL 47 -7.738 -6.331 -3.409 337 H GLU 48 HN GLU 48 -7.641 -11.490 -3.519 338 HA GLU 48 HA GLU 48 -5.084 -12.689 -4.016 339 HB2 GLU 48 HB2 GLU 48 -7.511 -13.575 -2.452 340 HB3 GLU 48 HB1 GLU 48 -6.063 -14.556 -2.572 341 HG2 GLU 48 HG2 GLU 48 -4.794 -12.580 -1.605 342 HG3 GLU 48 HG1 GLU 48 -6.369 -11.858 -1.269 343 H GLU 49 HN GLU 49 -8.224 -13.114 -5.455 344 HA GLU 49 HA GLU 49 -7.590 -15.677 -6.745 345 HB2 GLU 49 HB2 GLU 49 -10.134 -14.113 -6.411 346 HB3 GLU 49 HB1 GLU 49 -10.012 -15.378 -7.623 347 HG2 GLU 49 HG2 GLU 49 -9.464 -16.997 -5.855 348 HG3 GLU 49 HG1 GLU 49 -9.639 -15.720 -4.653 349 H PHE 50 HN PHE 50 -7.878 -12.268 -7.486 350 HA PHE 50 HA PHE 50 -7.784 -12.697 -10.391 351 HB2 PHE 50 HB2 PHE 50 -9.022 -10.695 -8.768 352 HB3 PHE 50 HB1 PHE 50 -7.797 -9.909 -9.749 353 HD1 PHE 50 HD2 PHE 50 -8.011 -9.836 -12.200 354 HD2 PHE 50 HD1 PHE 50 -10.989 -11.681 -9.767 355 HE1 PHE 50 HE2 PHE 50 -9.571 -9.832 -14.102 356 HE2 PHE 50 HE1 PHE 50 -12.547 -11.672 -11.667 357 HZ PHE 50 HZ PHE 50 -11.840 -10.751 -13.837 358 H VAL 51 HN VAL 51 -6.221 -11.934 -11.675 359 HA VAL 51 HA VAL 51 -3.618 -11.460 -10.480 360 HB VAL 51 HB VAL 51 -2.851 -11.775 -12.947 361 HG11 VAL 51 HG11 VAL 51 -2.707 -14.236 -12.580 362 HG12 VAL 51 HG12 VAL 51 -3.769 -14.022 -11.189 363 HG13 VAL 51 HG13 VAL 51 -2.182 -13.251 -11.214 364 HG21 VAL 51 HG21 VAL 51 -5.297 -13.518 -13.166 365 HG22 VAL 51 HG22 VAL 51 -4.070 -13.206 -14.397 366 HG23 VAL 51 HG23 VAL 51 -5.191 -11.927 -13.926 367 H PHE 52 HN PHE 52 -2.179 -9.894 -11.282 368 HA PHE 52 HA PHE 52 -3.425 -7.512 -12.501 369 HB2 PHE 52 HB2 PHE 52 -1.455 -7.535 -10.191 370 HB3 PHE 52 HB1 PHE 52 -1.933 -6.090 -11.058 371 HD1 PHE 52 HD1 PHE 52 -4.230 -5.167 -10.783 372 HD2 PHE 52 HD2 PHE 52 -2.893 -8.546 -8.550 373 HE1 PHE 52 HE1 PHE 52 -6.131 -4.902 -9.239 374 HE2 PHE 52 HE2 PHE 52 -4.789 -8.274 -7.007 375 HZ PHE 52 HZ PHE 52 -6.408 -6.455 -7.353 376 H LYS 53 HN LYS 53 -2.130 -6.251 -13.803 377 HA LYS 53 HA LYS 53 0.136 -7.637 -15.059 378 HB2 LYS 53 HB2 LYS 53 -1.849 -5.608 -16.003 379 HB3 LYS 53 HB1 LYS 53 -0.291 -5.712 -16.808 380 HG2 LYS 53 HG2 LYS 53 -0.699 -8.031 -17.370 381 HG3 LYS 53 HG1 LYS 53 -2.225 -7.999 -16.485 382 HD2 LYS 53 HD2 LYS 53 -3.052 -6.263 -18.025 383 HD3 LYS 53 HD1 LYS 53 -1.538 -6.367 -18.928 384 HE2 LYS 53 HE2 LYS 53 -1.992 -8.705 -19.439 385 HE3 LYS 53 HE1 LYS 53 -3.487 -8.629 -18.509 386 HZ1 LYS 53 HZ1 LYS 53 -3.132 -8.033 -21.193 387 HZ2 LYS 53 HZ2 LYS 53 -3.450 -6.559 -20.425 388 HZ3 LYS 53 HZ3 LYS 53 -4.540 -7.843 -20.273 389 H CYS 54 HN CYS 54 2.129 -6.772 -15.320 390 HA CYS 54 HA CYS 54 2.836 -4.518 -13.620 391 HB2 CYS 54 HB2 CYS 54 4.208 -6.555 -13.435 392 HB3 CYS 54 HB1 CYS 54 4.618 -6.445 -15.137 393 HA PRO 55 HA PRO 55 3.206 -1.688 -17.240 394 HB2 PRO 55 HB2 PRO 55 4.308 0.493 -16.035 395 HB3 PRO 55 HB1 PRO 55 2.605 0.072 -15.845 396 HG2 PRO 55 HG2 PRO 55 4.903 -0.405 -13.955 397 HG3 PRO 55 HG1 PRO 55 3.252 0.139 -13.586 398 HD2 PRO 55 HD2 PRO 55 4.084 -2.456 -13.263 399 HD3 PRO 55 HD1 PRO 55 2.407 -2.019 -13.629 400 H VAL 56 HN VAL 56 5.782 -3.051 -15.533 401 HA VAL 56 HA VAL 56 7.948 -1.913 -17.171 402 HB VAL 56 HB VAL 56 8.546 -3.667 -14.773 403 HG11 VAL 56 HG11 VAL 56 10.391 -2.866 -16.247 404 HG12 VAL 56 HG12 VAL 56 10.573 -2.388 -14.559 405 HG13 VAL 56 HG13 VAL 56 10.017 -1.215 -15.752 406 HG21 VAL 56 HG21 VAL 56 7.047 -2.111 -13.708 407 HG22 VAL 56 HG22 VAL 56 7.823 -0.739 -14.497 408 HG23 VAL 56 HG23 VAL 56 8.694 -1.660 -13.281 409 H CYS 57 HN CYS 57 6.755 -5.095 -15.913 410 HA CYS 57 HA CYS 57 8.348 -6.572 -17.862 411 HB2 CYS 57 HB2 CYS 57 6.508 -7.756 -15.765 412 HB3 CYS 57 HB1 CYS 57 7.773 -8.581 -16.659 413 H GLY 58 HN GLY 58 4.873 -6.505 -16.929 414 HA2 GLY 58 HA2 GLY 58 3.052 -6.223 -18.495 415 HA3 GLY 58 HA1 GLY 58 4.072 -6.895 -19.753 416 H GLU 59 HN GLU 59 4.396 -8.662 -16.890 417 HA GLU 59 HA GLU 59 2.751 -10.896 -17.831 418 HB2 GLU 59 HB2 GLU 59 5.109 -10.618 -15.995 419 HB3 GLU 59 HB1 GLU 59 4.068 -12.024 -15.843 420 HG2 GLU 59 HG2 GLU 59 4.493 -12.561 -18.209 421 HG3 GLU 59 HG1 GLU 59 5.599 -11.189 -18.297 422 H GLU 60 HN GLU 60 1.398 -12.103 -16.397 423 HA GLU 60 HA GLU 60 -0.073 -10.511 -14.459 424 HB2 GLU 60 HB2 GLU 60 -0.552 -12.994 -16.020 425 HB3 GLU 60 HB1 GLU 60 -1.426 -12.816 -14.508 426 HG2 GLU 60 HG2 GLU 60 -2.560 -10.892 -15.258 427 HG3 GLU 60 HG1 GLU 60 -1.398 -10.618 -16.553 428 H PHE 61 HN PHE 61 -0.135 -10.752 -12.368 429 HA PHE 61 HA PHE 61 1.160 -13.003 -11.004 430 HB2 PHE 61 HB2 PHE 61 2.123 -11.413 -9.293 431 HB3 PHE 61 HB1 PHE 61 2.861 -11.284 -10.876 432 HD1 PHE 61 HD1 PHE 61 0.840 -9.589 -8.343 433 HD2 PHE 61 HD2 PHE 61 2.590 -9.246 -12.206 434 HE1 PHE 61 HE1 PHE 61 0.448 -7.162 -8.300 435 HE2 PHE 61 HE2 PHE 61 2.200 -6.816 -12.167 436 HZ PHE 61 HZ PHE 61 1.129 -5.773 -10.213 437 H TYR 62 HN TYR 62 0.309 -13.498 -8.914 438 HA TYR 62 HA TYR 62 -2.517 -12.799 -8.667 439 HB2 TYR 62 HB2 TYR 62 -0.812 -15.035 -7.626 440 HB3 TYR 62 HB1 TYR 62 -2.382 -14.725 -6.909 441 HD1 TYR 62 HD1 TYR 62 -4.462 -15.012 -8.327 442 HD2 TYR 62 HD2 TYR 62 -0.602 -16.070 -9.780 443 HE1 TYR 62 HE1 TYR 62 -5.503 -16.372 -10.086 444 HE2 TYR 62 HE2 TYR 62 -1.638 -17.426 -11.549 445 HH TYR 62 HH TYR 62 -5.141 -17.494 -12.004 446 H GLY 63 HN GLY 63 -3.543 -12.148 -6.764 447 HA2 GLY 63 HA2 GLY 63 -2.076 -10.320 -5.075 448 HA3 GLY 63 HA1 GLY 63 -3.807 -10.591 -5.046 449 H LYS 64 HN LYS 64 -2.458 -13.533 -4.861 450 HA LYS 64 HA LYS 64 -2.814 -13.892 -1.987 451 HB2 LYS 64 HB2 LYS 64 -3.440 -15.493 -4.078 452 HB3 LYS 64 HB1 LYS 64 -1.895 -16.193 -3.622 453 HG2 LYS 64 HG2 LYS 64 -2.702 -16.633 -1.385 454 HG3 LYS 64 HG1 LYS 64 -4.215 -15.801 -1.728 455 HD2 LYS 64 HD2 LYS 64 -4.750 -17.497 -3.422 456 HD3 LYS 64 HD1 LYS 64 -3.238 -18.332 -3.048 457 HE2 LYS 64 HE2 LYS 64 -3.993 -18.640 -0.736 458 HE3 LYS 64 HE1 LYS 64 -5.509 -17.831 -1.130 459 HZ1 LYS 64 HZ1 LYS 64 -5.859 -19.611 -2.823 460 HZ2 LYS 64 HZ2 LYS 64 -5.899 -20.144 -1.218 461 HZ3 LYS 64 HZ3 LYS 64 -4.528 -20.427 -2.168 462 H THR 65 HN THR 65 -0.178 -13.329 -4.108 463 HA THR 65 HA THR 65 1.918 -14.435 -2.391 464 HB THR 65 HB THR 65 3.488 -13.441 -4.146 465 HG1 THR 65 HG1 THR 65 1.416 -13.334 -5.981 466 HG21 THR 65 HG21 THR 65 2.844 -15.831 -4.154 467 HG22 THR 65 HG22 THR 65 3.132 -15.200 -5.776 468 HG23 THR 65 HG23 THR 65 1.478 -15.439 -5.206 469 H LEU 66 HN LEU 66 0.059 -11.748 -2.162 470 HA LEU 66 HA LEU 66 2.017 -9.664 -1.621 471 HB2 LEU 66 HB2 LEU 66 -0.984 -9.782 -1.430 472 HB3 LEU 66 HB1 LEU 66 -0.095 -8.424 -0.791 473 HG LEU 66 HG LEU 66 0.297 -9.151 -3.680 474 HD11 LEU 66 HD11 LEU 66 -1.590 -7.967 -4.420 475 HD12 LEU 66 HD12 LEU 66 -1.918 -7.312 -2.818 476 HD13 LEU 66 HD13 LEU 66 -2.217 -9.013 -3.150 477 HD21 LEU 66 HD21 LEU 66 1.678 -7.385 -2.586 478 HD22 LEU 66 HD22 LEU 66 0.200 -6.472 -2.279 479 HD23 LEU 66 HD23 LEU 66 0.715 -6.785 -3.937 480 HA PRO 67 HA PRO 67 2.464 -10.529 2.878 481 HB2 PRO 67 HB2 PRO 67 3.065 -8.038 3.884 482 HB3 PRO 67 HB1 PRO 67 4.240 -9.049 3.038 483 HG2 PRO 67 HG2 PRO 67 2.594 -6.758 1.967 484 HG3 PRO 67 HG1 PRO 67 4.323 -7.094 1.721 485 HD2 PRO 67 HD2 PRO 67 2.513 -7.723 -0.162 486 HD3 PRO 67 HD1 PRO 67 3.894 -8.787 0.162 487 H ARG 68 HN ARG 68 1.437 -10.262 4.946 488 HA ARG 68 HA ARG 68 -1.351 -9.765 4.943 489 HB2 ARG 68 HB2 ARG 68 0.615 -10.377 7.110 490 HB3 ARG 68 HB1 ARG 68 -1.034 -9.934 7.526 491 HG2 ARG 68 HG2 ARG 68 -1.892 -11.795 6.209 492 HG3 ARG 68 HG1 ARG 68 -0.252 -12.221 5.719 493 HD2 ARG 68 HD2 ARG 68 0.342 -12.698 8.015 494 HD3 ARG 68 HD1 ARG 68 -1.252 -12.184 8.563 495 HE ARG 68 HE ARG 68 -1.330 -14.320 6.635 496 HH11 ARG 68 HH11 ARG 68 -1.113 -13.777 10.168 497 HH12 ARG 68 HH12 ARG 68 -1.672 -15.375 10.529 498 HH21 ARG 68 HH21 ARG 68 -2.046 -16.364 7.209 499 HH22 ARG 68 HH22 ARG 68 -2.191 -16.815 8.875 500 H ARG 69 HN ARG 69 1.319 -7.700 6.015 501 HA ARG 69 HA ARG 69 0.054 -5.546 7.189 502 HB2 ARG 69 HB2 ARG 69 2.544 -5.667 5.493 503 HB3 ARG 69 HB1 ARG 69 2.016 -4.175 6.248 504 HG2 ARG 69 HG2 ARG 69 2.227 -5.202 8.455 505 HG3 ARG 69 HG1 ARG 69 2.712 -6.724 7.705 506 HD2 ARG 69 HD2 ARG 69 4.686 -5.664 6.776 507 HD3 ARG 69 HD1 ARG 69 4.191 -4.109 7.444 508 HE ARG 69 HE ARG 69 4.337 -5.942 9.548 509 HH11 ARG 69 HH11 ARG 69 6.752 -4.375 7.414 510 HH12 ARG 69 HH12 ARG 69 7.998 -4.492 8.613 511 HH21 ARG 69 HH21 ARG 69 6.010 -6.037 11.021 512 HH22 ARG 69 HH22 ARG 69 7.579 -5.420 10.625 513 H GLU 70 HN GLU 70 0.518 -6.046 3.638 514 HA GLU 70 HA GLU 70 -0.684 -3.615 2.763 515 HB2 GLU 70 HB2 GLU 70 0.182 -6.156 1.472 516 HB3 GLU 70 HB1 GLU 70 -0.892 -5.100 0.578 517 HG2 GLU 70 HG2 GLU 70 0.755 -3.247 0.930 518 HG3 GLU 70 HG1 GLU 70 1.851 -4.440 1.627 519 H ALA 71 HN ALA 71 -1.984 -6.778 3.557 520 HA ALA 71 HA ALA 71 -4.595 -6.620 2.434 521 HB1 ALA 71 HB1 ALA 71 -3.733 -8.228 4.828 522 HB2 ALA 71 HB2 ALA 71 -3.436 -8.700 3.156 523 HB3 ALA 71 HB3 ALA 71 -5.090 -8.556 3.750 524 H GLU 72 HN GLU 72 -3.233 -5.547 5.509 525 HA GLU 72 HA GLU 72 -5.645 -4.836 6.889 526 HB2 GLU 72 HB2 GLU 72 -2.728 -4.323 7.340 527 HB3 GLU 72 HB1 GLU 72 -3.920 -3.439 8.280 528 HG2 GLU 72 HG2 GLU 72 -4.861 -5.572 9.066 529 HG3 GLU 72 HG1 GLU 72 -3.626 -6.437 8.154 530 H LYS 73 HN LYS 73 -3.603 -3.190 4.576 531 HA LYS 73 HA LYS 73 -4.479 -0.480 4.931 532 HB2 LYS 73 HB2 LYS 73 -2.799 -1.968 3.006 533 HB3 LYS 73 HB1 LYS 73 -3.562 -0.510 2.389 534 HG2 LYS 73 HG2 LYS 73 -2.535 0.810 4.140 535 HG3 LYS 73 HG1 LYS 73 -1.831 -0.641 4.853 536 HD2 LYS 73 HD2 LYS 73 -0.525 -1.003 2.802 537 HD3 LYS 73 HD1 LYS 73 -1.225 0.459 2.105 538 HE2 LYS 73 HE2 LYS 73 -0.235 1.787 3.906 539 HE3 LYS 73 HE1 LYS 73 0.461 0.325 4.600 540 HZ1 LYS 73 HZ1 LYS 73 1.427 0.163 2.149 541 HZ2 LYS 73 HZ2 LYS 73 2.223 0.998 3.388 542 HZ3 LYS 73 HZ3 LYS 73 1.289 1.847 2.262 543 H VAL 74 HN VAL 74 -5.656 -3.216 3.080 544 HA VAL 74 HA VAL 74 -7.434 -1.940 1.240 545 HB VAL 74 HB VAL 74 -7.903 -4.804 2.176 546 HG11 VAL 74 HG11 VAL 74 -8.573 -5.223 -0.154 547 HG12 VAL 74 HG12 VAL 74 -8.252 -3.533 -0.552 548 HG13 VAL 74 HG13 VAL 74 -9.543 -3.944 0.578 549 HG21 VAL 74 HG21 VAL 74 -6.315 -5.715 0.631 550 HG22 VAL 74 HG22 VAL 74 -5.458 -4.546 1.639 551 HG23 VAL 74 HG23 VAL 74 -5.932 -4.113 -0.001 552 H PHE 75 HN PHE 75 -7.910 -3.176 4.598 553 HA PHE 75 HA PHE 75 -10.684 -2.822 4.902 554 HB2 PHE 75 HB2 PHE 75 -8.345 -2.936 6.793 555 HB3 PHE 75 HB1 PHE 75 -9.936 -2.519 7.407 556 HD1 PHE 75 HD1 PHE 75 -11.710 -4.157 7.473 557 HD2 PHE 75 HD2 PHE 75 -7.848 -5.198 6.023 558 HE1 PHE 75 HE1 PHE 75 -12.295 -6.543 7.648 559 HE2 PHE 75 HE2 PHE 75 -8.421 -7.582 6.202 560 HZ PHE 75 HZ PHE 75 -10.648 -8.257 7.009 561 H GLU 76 HN GLU 76 -8.073 -0.430 4.987 562 HA GLU 76 HA GLU 76 -9.271 1.665 6.502 563 HB2 GLU 76 HB2 GLU 76 -6.766 1.156 5.610 564 HB3 GLU 76 HB1 GLU 76 -7.265 2.364 4.437 565 HG2 GLU 76 HG2 GLU 76 -7.782 3.917 6.244 566 HG3 GLU 76 HG1 GLU 76 -7.270 2.713 7.430 567 H LEU 77 HN LEU 77 -9.167 1.006 2.972 568 HA LEU 77 HA LEU 77 -10.546 3.368 2.172 569 HB2 LEU 77 HB2 LEU 77 -10.723 2.186 -0.053 570 HB3 LEU 77 HB1 LEU 77 -9.112 2.460 0.517 571 HG LEU 77 HG LEU 77 -9.602 -0.125 1.344 572 HD11 LEU 77 HD11 LEU 77 -10.680 -1.335 -0.371 573 HD12 LEU 77 HD12 LEU 77 -10.770 0.091 -1.410 574 HD13 LEU 77 HD13 LEU 77 -11.747 0.008 0.059 575 HD21 LEU 77 HD21 LEU 77 -7.538 0.406 0.369 576 HD22 LEU 77 HD22 LEU 77 -8.284 0.954 -1.134 577 HD23 LEU 77 HD23 LEU 77 -8.273 -0.762 -0.727 578 H LEU 78 HN LEU 78 -11.552 0.132 3.024 579 HA LEU 78 HA LEU 78 -14.320 0.349 2.221 580 HB2 LEU 78 HB2 LEU 78 -12.636 -1.710 3.582 581 HB3 LEU 78 HB1 LEU 78 -14.380 -1.844 3.660 582 HG LEU 78 HG LEU 78 -13.438 -1.425 0.929 583 HD11 LEU 78 HD11 LEU 78 -12.588 -3.787 0.723 584 HD12 LEU 78 HD12 LEU 78 -12.385 -3.774 2.474 585 HD13 LEU 78 HD13 LEU 78 -11.495 -2.627 1.474 586 HD21 LEU 78 HD21 LEU 78 -15.695 -2.133 1.500 587 HD22 LEU 78 HD22 LEU 78 -15.060 -3.611 2.221 588 HD23 LEU 78 HD23 LEU 78 -14.885 -3.328 0.489 589 H ASN 79 HN ASN 79 -12.471 1.077 5.107 590 HA ASN 79 HA ASN 79 -14.739 1.122 6.945 591 HB2 ASN 79 HB2 ASN 79 -11.791 1.355 7.207 592 HB3 ASN 79 HB1 ASN 79 -12.754 2.210 8.408 593 HD21 ASN 79 HD21 ASN 79 -13.955 1.050 9.885 594 HD22 ASN 79 HD22 ASN 79 -13.783 -0.655 10.102 595 H ASP 80 HN ASP 80 -13.064 3.369 4.882 596 HA ASP 80 HA ASP 80 -13.952 5.810 6.167 597 HB2 ASP 80 HB2 ASP 80 -12.301 5.141 3.781 598 HB3 ASP 80 HB1 ASP 80 -13.084 6.716 3.811 599 H PHE 81 HN PHE 81 -15.031 3.801 3.433 600 HA PHE 81 HA PHE 81 -16.810 3.660 2.061 601 HB2 PHE 81 HB2 PHE 81 -18.154 5.187 4.285 602 HB3 PHE 81 HB1 PHE 81 -19.027 4.830 2.810 603 HD1 PHE 81 HD1 PHE 81 -17.411 3.362 5.788 604 HD2 PHE 81 HD2 PHE 81 -19.906 2.655 2.403 605 HE1 PHE 81 HE1 PHE 81 -18.095 1.204 6.744 606 HE2 PHE 81 HE2 PHE 81 -20.583 0.496 3.356 607 HZ PHE 81 HZ PHE 81 -19.680 -0.233 5.526 608 H LYS 82 HN LYS 82 -16.837 7.041 3.134 609 HA LYS 82 HA LYS 82 -16.913 8.017 0.361 610 HB2 LYS 82 HB2 LYS 82 -18.253 10.025 1.293 611 HB3 LYS 82 HB1 LYS 82 -19.124 8.519 1.118 612 HG2 LYS 82 HG2 LYS 82 -18.933 8.141 3.562 613 HG3 LYS 82 HG1 LYS 82 -18.077 9.669 3.722 614 HD2 LYS 82 HD2 LYS 82 -20.063 10.854 2.910 615 HD3 LYS 82 HD1 LYS 82 -20.914 9.311 2.758 616 HE2 LYS 82 HE2 LYS 82 -20.651 8.921 5.154 617 HE3 LYS 82 HE1 LYS 82 -19.773 10.441 5.315 618 HZ1 LYS 82 HZ1 LYS 82 -22.377 10.201 5.754 619 HZ2 LYS 82 HZ2 LYS 82 -22.415 10.615 4.115 620 HZ3 LYS 82 HZ3 LYS 82 -21.660 11.640 5.229 621 H GLY 83 HN GLY 83 -15.482 9.569 -0.165 622 HA2 GLY 83 HA2 GLY 83 -14.098 11.226 1.755 623 HA3 GLY 83 HA1 GLY 83 -13.085 9.964 1.065 624 H GLY 84 HN GLY 84 -12.031 10.403 -0.686 625 HA2 GLY 84 HA2 GLY 84 -12.871 12.648 -2.424 626 HA3 GLY 84 HA1 GLY 84 -11.198 12.180 -2.154 627 H ILE 85 HN ILE 85 -14.131 10.304 -2.953 628 HA ILE 85 HA ILE 85 -12.819 9.248 -5.390 629 HB ILE 85 HB ILE 85 -14.959 7.578 -4.014 630 HG12 ILE 85 HG12 ILE 85 -12.470 6.371 -3.351 631 HG13 ILE 85 HG11 ILE 85 -12.382 8.038 -2.793 632 HG21 ILE 85 HG21 ILE 85 -13.934 5.696 -5.126 633 HG22 ILE 85 HG22 ILE 85 -12.564 6.682 -5.631 634 HG23 ILE 85 HG23 ILE 85 -14.162 6.987 -6.307 635 HD11 ILE 85 HD11 ILE 85 -14.453 7.713 -1.532 636 HD12 ILE 85 HD12 ILE 85 -13.199 6.571 -1.045 637 HD13 ILE 85 HD13 ILE 85 -14.521 6.039 -2.085 638 H ASP 86 HN ASP 86 -13.786 9.773 -7.185 639 HA ASP 86 HA ASP 86 -16.642 10.498 -7.231 640 HB2 ASP 86 HB2 ASP 86 -14.279 11.738 -8.618 641 HB3 ASP 86 HB1 ASP 86 -15.878 11.835 -9.350 642 H TRP 87 HN TRP 87 -17.913 9.354 -8.488 643 HA TRP 87 HA TRP 87 -16.929 7.146 -10.087 644 HB2 TRP 87 HB2 TRP 87 -19.700 8.055 -9.320 645 HB3 TRP 87 HB1 TRP 87 -19.435 6.724 -10.442 646 HD1 TRP 87 HD1 TRP 87 -19.556 7.558 -6.802 647 HE1 TRP 87 HE1 TRP 87 -19.040 5.499 -5.361 648 HE3 TRP 87 HE3 TRP 87 -17.867 4.328 -10.458 649 HZ2 TRP 87 HZ2 TRP 87 -18.065 2.907 -5.691 650 HZ3 TRP 87 HZ3 TRP 87 -17.175 2.070 -9.771 651 HH2 TRP 87 HH2 TRP 87 -17.268 1.379 -7.437 652 H GLU 88 HN GLU 88 -18.199 10.331 -10.740 653 HA GLU 88 HA GLU 88 -18.718 9.978 -13.569 654 HB2 GLU 88 HB2 GLU 88 -18.838 12.294 -11.666 655 HB3 GLU 88 HB1 GLU 88 -18.897 12.582 -13.397 656 HG2 GLU 88 HG2 GLU 88 -20.891 11.183 -13.572 657 HG3 GLU 88 HG1 GLU 88 -20.818 10.852 -11.842 658 H ASN 89 HN ASN 89 -16.109 11.362 -11.599 659 HA ASN 89 HA ASN 89 -14.538 12.207 -13.919 660 HB2 ASN 89 HB2 ASN 89 -14.360 12.692 -10.968 661 HB3 ASN 89 HB1 ASN 89 -12.930 12.908 -11.965 662 HD21 ASN 89 HD21 ASN 89 -15.860 14.244 -10.914 663 HD22 ASN 89 HD22 ASN 89 -15.824 15.682 -11.870 664 H LYS 90 HN LYS 90 -14.753 9.452 -11.808 665 HA LYS 90 HA LYS 90 -13.579 7.586 -11.325 666 HB2 LYS 90 HB2 LYS 90 -12.702 8.045 -14.172 667 HB3 LYS 90 HB1 LYS 90 -12.024 6.712 -13.256 668 HG2 LYS 90 HG2 LYS 90 -14.192 5.720 -12.980 669 HG3 LYS 90 HG1 LYS 90 -14.973 7.122 -13.721 670 HD2 LYS 90 HD2 LYS 90 -13.819 6.667 -15.824 671 HD3 LYS 90 HD1 LYS 90 -12.981 5.303 -15.084 672 HE2 LYS 90 HE2 LYS 90 -14.719 4.264 -16.245 673 HE3 LYS 90 HE1 LYS 90 -15.385 4.412 -14.618 674 HZ1 LYS 90 HZ1 LYS 90 -16.038 5.975 -17.036 675 HZ2 LYS 90 HZ2 LYS 90 -16.362 6.598 -15.498 676 HZ3 LYS 90 HZ3 LYS 90 -17.084 5.150 -15.990 677 H ARG 91 HN ARG 91 -12.656 9.270 -9.789 678 HA ARG 91 HA ARG 91 -9.714 9.073 -9.782 679 HB2 ARG 91 HB2 ARG 91 -11.422 11.443 -9.044 680 HB3 ARG 91 HB1 ARG 91 -9.815 11.243 -8.364 681 HG2 ARG 91 HG2 ARG 91 -8.840 11.277 -10.589 682 HG3 ARG 91 HG1 ARG 91 -10.446 11.396 -11.309 683 HD2 ARG 91 HD2 ARG 91 -10.789 13.541 -10.212 684 HD3 ARG 91 HD1 ARG 91 -9.205 13.418 -9.449 685 HE ARG 91 HE ARG 91 -9.057 13.232 -12.301 686 HH11 ARG 91 HH11 ARG 91 -9.197 15.730 -9.737 687 HH12 ARG 91 HH12 ARG 91 -8.478 16.930 -10.759 688 HH21 ARG 91 HH21 ARG 91 -8.135 14.853 -13.536 689 HH22 ARG 91 HH22 ARG 91 -7.888 16.436 -12.879 690 H VAL 92 HN VAL 92 -8.831 8.176 -8.140 691 HA VAL 92 HA VAL 92 -10.381 7.665 -5.678 692 HB VAL 92 HB VAL 92 -8.194 5.717 -6.448 693 HG11 VAL 92 HG11 VAL 92 -9.534 5.745 -4.226 694 HG12 VAL 92 HG12 VAL 92 -9.263 4.193 -5.016 695 HG13 VAL 92 HG13 VAL 92 -10.823 4.999 -5.170 696 HG21 VAL 92 HG21 VAL 92 -10.448 6.015 -8.170 697 HG22 VAL 92 HG22 VAL 92 -10.709 4.543 -7.244 698 HG23 VAL 92 HG23 VAL 92 -9.246 4.726 -8.212 699 H LYS 93 HN LYS 93 -9.517 8.364 -3.888 700 HA LYS 93 HA LYS 93 -6.668 9.105 -3.766 701 HB2 LYS 93 HB2 LYS 93 -9.101 10.617 -2.891 702 HB3 LYS 93 HB1 LYS 93 -7.615 10.806 -1.975 703 HG2 LYS 93 HG2 LYS 93 -6.455 11.580 -3.958 704 HG3 LYS 93 HG1 LYS 93 -7.902 11.313 -4.932 705 HD2 LYS 93 HD2 LYS 93 -9.102 12.985 -3.613 706 HD3 LYS 93 HD1 LYS 93 -7.667 13.239 -2.619 707 HE2 LYS 93 HE2 LYS 93 -6.439 14.010 -4.586 708 HE3 LYS 93 HE1 LYS 93 -7.866 13.741 -5.588 709 HZ1 LYS 93 HZ1 LYS 93 -8.488 15.794 -5.096 710 HZ2 LYS 93 HZ2 LYS 93 -7.203 15.991 -4.014 711 HZ3 LYS 93 HZ3 LYS 93 -8.670 15.343 -3.475 712 H LEU 94 HN LEU 94 -5.533 8.319 -2.158 713 HA LEU 94 HA LEU 94 -6.851 6.956 0.086 714 HB2 LEU 94 HB2 LEU 94 -4.536 6.098 -1.619 715 HB3 LEU 94 HB1 LEU 94 -4.682 5.514 0.027 716 HG LEU 94 HG LEU 94 -7.150 5.165 -1.494 717 HD11 LEU 94 HD11 LEU 94 -4.608 3.925 -2.507 718 HD12 LEU 94 HD12 LEU 94 -5.822 4.828 -3.411 719 HD13 LEU 94 HD13 LEU 94 -6.198 3.219 -2.794 720 HD21 LEU 94 HD21 LEU 94 -7.022 2.928 -0.562 721 HD22 LEU 94 HD22 LEU 94 -6.670 4.124 0.685 722 HD23 LEU 94 HD23 LEU 94 -5.356 3.209 -0.055 723 H LYS 95 HN LYS 95 -6.238 7.492 2.017 724 HA LYS 95 HA LYS 95 -3.970 9.327 2.411 725 HB2 LYS 95 HB2 LYS 95 -6.690 9.484 3.209 726 HB3 LYS 95 HB1 LYS 95 -5.725 9.291 4.668 727 HG2 LYS 95 HG2 LYS 95 -4.404 11.221 4.111 728 HG3 LYS 95 HG1 LYS 95 -5.215 11.372 2.553 729 HD2 LYS 95 HD2 LYS 95 -7.332 11.807 3.693 730 HD3 LYS 95 HD1 LYS 95 -6.526 11.646 5.256 731 HE2 LYS 95 HE2 LYS 95 -5.086 13.547 4.706 732 HE3 LYS 95 HE1 LYS 95 -5.891 13.704 3.145 733 HZ1 LYS 95 HZ1 LYS 95 -8.004 13.901 4.601 734 HZ2 LYS 95 HZ2 LYS 95 -6.993 15.244 4.417 735 HZ3 LYS 95 HZ3 LYS 95 -6.919 14.319 5.830 Start of MODEL 6 1 H1 MET 8 HT1 MET 8 0.345 0.218 -0.143 2 H2 MET 8 HT2 MET 8 0.536 1.893 -0.275 3 H3 MET 8 HT3 MET 8 1.597 0.995 0.687 4 HA MET 8 HA MET 8 1.502 1.311 -2.206 5 HB2 MET 8 HB2 MET 8 3.631 1.132 -0.089 6 HB3 MET 8 HB1 MET 8 4.040 0.922 -1.782 7 HG2 MET 8 HG2 MET 8 3.197 3.148 -2.281 8 HG3 MET 8 HG1 MET 8 2.725 3.358 -0.595 9 HE1 MET 8 HE1 MET 8 4.798 5.646 -1.913 10 HE2 MET 8 HE2 MET 8 5.549 5.788 -0.324 11 HE3 MET 8 HE3 MET 8 3.816 5.491 -0.455 12 H ALA 9 HN ALA 9 1.897 -0.179 -3.662 13 HA ALA 9 HA ALA 9 2.101 -3.006 -2.845 14 HB1 ALA 9 HB1 ALA 9 1.337 -3.254 -5.375 15 HB2 ALA 9 HB2 ALA 9 0.736 -1.619 -5.112 16 HB3 ALA 9 HB3 ALA 9 0.152 -2.942 -4.103 17 H LYS 10 HN LYS 10 3.639 -4.307 -3.669 18 HA LYS 10 HA LYS 10 5.749 -3.140 -5.354 19 HB2 LYS 10 HB2 LYS 10 5.912 -4.739 -2.839 20 HB3 LYS 10 HB1 LYS 10 7.151 -4.992 -4.057 21 HG2 LYS 10 HG2 LYS 10 7.775 -2.664 -3.965 22 HG3 LYS 10 HG1 LYS 10 6.459 -2.327 -2.837 23 HD2 LYS 10 HD2 LYS 10 7.482 -3.846 -1.200 24 HD3 LYS 10 HD1 LYS 10 8.803 -4.164 -2.324 25 HE2 LYS 10 HE2 LYS 10 8.177 -1.362 -1.436 26 HE3 LYS 10 HE1 LYS 10 9.177 -2.418 -0.439 27 HZ1 LYS 10 HZ1 LYS 10 10.402 -2.708 -2.762 28 HZ2 LYS 10 HZ2 LYS 10 10.795 -1.471 -1.678 29 HZ3 LYS 10 HZ3 LYS 10 9.786 -1.150 -2.996 30 H CYS 11 HN CYS 11 6.470 -4.283 -7.048 31 HA CYS 11 HA CYS 11 5.012 -6.542 -8.049 32 HB2 CYS 11 HB2 CYS 11 6.014 -4.815 -9.562 33 HB3 CYS 11 HB1 CYS 11 7.608 -5.388 -9.121 34 HA PRO 12 HA PRO 12 7.702 -9.776 -6.160 35 HB2 PRO 12 HB2 PRO 12 6.692 -12.030 -7.305 36 HB3 PRO 12 HB1 PRO 12 5.869 -11.179 -5.996 37 HG2 PRO 12 HG2 PRO 12 5.308 -11.116 -8.952 38 HG3 PRO 12 HG1 PRO 12 4.157 -11.161 -7.599 39 HD2 PRO 12 HD2 PRO 12 4.806 -8.857 -8.960 40 HD3 PRO 12 HD1 PRO 12 4.281 -8.870 -7.268 41 H ILE 13 HN ILE 13 7.694 -8.969 -9.505 42 HA ILE 13 HA ILE 13 9.760 -10.859 -10.327 43 HB ILE 13 HB ILE 13 8.385 -8.802 -12.130 44 HG12 ILE 13 HG12 ILE 13 7.333 -11.461 -12.627 45 HG13 ILE 13 HG11 ILE 13 7.067 -11.044 -10.940 46 HG21 ILE 13 HG21 ILE 13 10.370 -9.823 -13.147 47 HG22 ILE 13 HG22 ILE 13 8.922 -10.385 -13.980 48 HG23 ILE 13 HG23 ILE 13 9.739 -11.440 -12.828 49 HD11 ILE 13 HD11 ILE 13 5.139 -10.424 -12.211 50 HD12 ILE 13 HD12 ILE 13 6.124 -9.510 -13.353 51 HD13 ILE 13 HD13 ILE 13 5.958 -8.953 -11.688 52 H CYS 14 HN CYS 14 9.197 -7.244 -10.363 53 HA CYS 14 HA CYS 14 12.100 -6.840 -10.637 54 HB2 CYS 14 HB2 CYS 14 11.562 -4.556 -11.398 55 HB3 CYS 14 HB1 CYS 14 10.800 -5.782 -12.399 56 H GLY 15 HN GLY 15 9.320 -5.831 -8.676 57 HA2 GLY 15 HA2 GLY 15 9.267 -5.249 -6.393 58 HA3 GLY 15 HA1 GLY 15 11.019 -5.104 -6.406 59 H SER 16 HN SER 16 8.718 -3.561 -8.625 60 HA SER 16 HA SER 16 9.843 -0.906 -8.148 61 HB2 SER 16 HB2 SER 16 8.744 -2.283 -10.352 62 HB3 SER 16 HB1 SER 16 7.676 -0.917 -10.033 63 HG SER 16 HG SER 16 10.246 -0.150 -9.855 64 HA PRO 17 HA PRO 17 6.390 0.560 -5.487 65 HB2 PRO 17 HB2 PRO 17 6.426 3.278 -5.888 66 HB3 PRO 17 HB1 PRO 17 7.583 2.435 -4.853 67 HG2 PRO 17 HG2 PRO 17 7.914 3.362 -7.701 68 HG3 PRO 17 HG1 PRO 17 9.057 3.500 -6.346 69 HD2 PRO 17 HD2 PRO 17 9.319 1.568 -8.218 70 HD3 PRO 17 HD1 PRO 17 9.715 1.263 -6.517 71 H LEU 18 HN LEU 18 4.327 0.386 -5.737 72 HA LEU 18 HA LEU 18 2.935 1.461 -8.106 73 HB2 LEU 18 HB2 LEU 18 2.507 -1.163 -6.674 74 HB3 LEU 18 HB1 LEU 18 1.297 -0.459 -7.729 75 HG LEU 18 HG LEU 18 3.980 -0.781 -8.940 76 HD11 LEU 18 HD11 LEU 18 2.299 -3.155 -8.161 77 HD12 LEU 18 HD12 LEU 18 3.952 -2.804 -7.655 78 HD13 LEU 18 HD13 LEU 18 3.611 -3.195 -9.340 79 HD21 LEU 18 HD21 LEU 18 2.734 -1.315 -10.880 80 HD22 LEU 18 HD22 LEU 18 1.816 -0.038 -10.080 81 HD23 LEU 18 HD23 LEU 18 1.295 -1.718 -9.942 82 H LYS 19 HN LYS 19 0.947 2.358 -7.837 83 HA LYS 19 HA LYS 19 0.230 3.228 -5.140 84 HB2 LYS 19 HB2 LYS 19 -0.355 4.215 -7.907 85 HB3 LYS 19 HB1 LYS 19 -1.462 4.638 -6.609 86 HG2 LYS 19 HG2 LYS 19 0.321 5.716 -5.389 87 HG3 LYS 19 HG1 LYS 19 1.496 5.209 -6.604 88 HD2 LYS 19 HD2 LYS 19 0.340 6.553 -8.287 89 HD3 LYS 19 HD1 LYS 19 -0.854 7.044 -7.084 90 HE2 LYS 19 HE2 LYS 19 0.908 8.118 -5.773 91 HE3 LYS 19 HE1 LYS 19 2.105 7.617 -6.966 92 HZ1 LYS 19 HZ1 LYS 19 1.677 9.471 -8.071 93 HZ2 LYS 19 HZ2 LYS 19 0.455 9.898 -6.982 94 HZ3 LYS 19 HZ3 LYS 19 0.088 8.952 -8.335 95 H TRP 20 HN TRP 20 -1.474 2.526 -4.052 96 HA TRP 20 HA TRP 20 -3.082 0.321 -4.879 97 HB2 TRP 20 HB2 TRP 20 -2.836 1.982 -2.450 98 HB3 TRP 20 HB1 TRP 20 -4.370 1.139 -2.667 99 HD1 TRP 20 HD1 TRP 20 -0.754 0.588 -1.774 100 HE1 TRP 20 HE1 TRP 20 -0.340 -1.870 -1.156 101 HE3 TRP 20 HE3 TRP 20 -5.278 -1.447 -3.198 102 HZ2 TRP 20 HZ2 TRP 20 -1.702 -4.326 -1.258 103 HZ3 TRP 20 HZ3 TRP 20 -5.610 -3.862 -2.884 104 HH2 TRP 20 HH2 TRP 20 -3.854 -5.269 -1.931 105 H GLU 21 HN GLU 21 -3.562 3.743 -4.960 106 HA GLU 21 HA GLU 21 -6.375 3.879 -5.448 107 HB2 GLU 21 HB2 GLU 21 -5.884 6.287 -6.111 108 HB3 GLU 21 HB1 GLU 21 -5.448 5.839 -4.479 109 HG2 GLU 21 HG2 GLU 21 -3.070 5.772 -5.130 110 HG3 GLU 21 HG1 GLU 21 -3.508 6.184 -6.786 111 H GLU 22 HN GLU 22 -3.556 3.597 -7.566 112 HA GLU 22 HA GLU 22 -4.839 4.200 -10.073 113 HB2 GLU 22 HB2 GLU 22 -2.169 3.094 -9.296 114 HB3 GLU 22 HB1 GLU 22 -2.689 3.018 -10.972 115 HG2 GLU 22 HG2 GLU 22 -2.983 5.461 -10.972 116 HG3 GLU 22 HG1 GLU 22 -2.402 5.516 -9.309 117 H LEU 23 HN LEU 23 -4.256 1.237 -8.267 118 HA LEU 23 HA LEU 23 -4.856 -0.736 -10.231 119 HB2 LEU 23 HB2 LEU 23 -4.698 -0.701 -7.241 120 HB3 LEU 23 HB1 LEU 23 -5.286 -2.129 -8.068 121 HG LEU 23 HG LEU 23 -2.763 -1.164 -9.166 122 HD11 LEU 23 HD11 LEU 23 -2.226 -0.463 -6.959 123 HD12 LEU 23 HD12 LEU 23 -1.440 -2.022 -7.200 124 HD13 LEU 23 HD13 LEU 23 -2.921 -1.921 -6.250 125 HD21 LEU 23 HD21 LEU 23 -3.515 -3.809 -7.929 126 HD22 LEU 23 HD22 LEU 23 -2.182 -3.487 -9.039 127 HD23 LEU 23 HD23 LEU 23 -3.848 -3.362 -9.602 128 H ILE 24 HN ILE 24 -6.869 0.949 -7.844 129 HA ILE 24 HA ILE 24 -9.308 -0.533 -8.287 130 HB ILE 24 HB ILE 24 -9.203 2.162 -6.887 131 HG12 ILE 24 HG12 ILE 24 -7.509 1.113 -5.574 132 HG13 ILE 24 HG11 ILE 24 -8.967 0.978 -4.627 133 HG21 ILE 24 HG21 ILE 24 -11.102 1.459 -5.581 134 HG22 ILE 24 HG22 ILE 24 -11.009 -0.151 -6.282 135 HG23 ILE 24 HG23 ILE 24 -11.438 1.216 -7.298 136 HD11 ILE 24 HD11 ILE 24 -7.122 -1.087 -5.544 137 HD12 ILE 24 HD12 ILE 24 -8.797 -1.486 -5.923 138 HD13 ILE 24 HD13 ILE 24 -8.330 -1.144 -4.258 139 H GLU 25 HN GLU 25 -7.854 2.371 -9.677 140 HA GLU 25 HA GLU 25 -10.137 3.548 -10.922 141 HB2 GLU 25 HB2 GLU 25 -7.502 4.263 -10.483 142 HB3 GLU 25 HB1 GLU 25 -7.598 4.099 -12.228 143 HG2 GLU 25 HG2 GLU 25 -9.486 5.654 -12.265 144 HG3 GLU 25 HG1 GLU 25 -9.371 5.822 -10.514 145 H GLU 26 HN GLU 26 -7.775 1.122 -11.987 146 HA GLU 26 HA GLU 26 -8.600 0.983 -14.753 147 HB2 GLU 26 HB2 GLU 26 -6.703 -0.555 -13.017 148 HB3 GLU 26 HB1 GLU 26 -7.103 -1.106 -14.616 149 HG2 GLU 26 HG2 GLU 26 -6.257 0.995 -15.574 150 HG3 GLU 26 HG1 GLU 26 -5.819 1.535 -13.954 151 H MET 27 HN MET 27 -9.580 -0.497 -11.770 152 HA MET 27 HA MET 27 -10.964 -2.717 -13.076 153 HB2 MET 27 HB2 MET 27 -9.792 -2.361 -10.349 154 HB3 MET 27 HB1 MET 27 -11.149 -3.457 -10.530 155 HG2 MET 27 HG2 MET 27 -9.882 -4.749 -12.178 156 HG3 MET 27 HG1 MET 27 -8.519 -3.645 -11.990 157 HE1 MET 27 HE1 MET 27 -9.649 -7.157 -10.869 158 HE2 MET 27 HE2 MET 27 -10.918 -6.072 -10.301 159 HE3 MET 27 HE3 MET 27 -9.908 -6.931 -9.140 160 H LEU 28 HN LEU 28 -11.824 0.285 -12.594 161 HA LEU 28 HA LEU 28 -14.306 -0.090 -11.095 162 HB2 LEU 28 HB2 LEU 28 -12.490 1.897 -10.977 163 HB3 LEU 28 HB1 LEU 28 -13.583 2.596 -12.153 164 HG LEU 28 HG LEU 28 -15.305 1.781 -10.155 165 HD11 LEU 28 HD11 LEU 28 -13.359 1.266 -8.713 166 HD12 LEU 28 HD12 LEU 28 -14.411 2.520 -8.057 167 HD13 LEU 28 HD13 LEU 28 -12.880 2.961 -8.814 168 HD21 LEU 28 HD21 LEU 28 -15.430 4.176 -9.600 169 HD22 LEU 28 HD22 LEU 28 -15.457 3.867 -11.336 170 HD23 LEU 28 HD23 LEU 28 -13.982 4.451 -10.568 171 H ILE 29 HN ILE 29 -13.887 -1.170 -13.827 172 HA ILE 29 HA ILE 29 -15.909 0.193 -15.480 173 HB ILE 29 HB ILE 29 -14.855 -2.142 -16.849 174 HG12 ILE 29 HG12 ILE 29 -12.566 -0.612 -17.243 175 HG13 ILE 29 HG11 ILE 29 -12.756 -0.588 -15.492 176 HG21 ILE 29 HG21 ILE 29 -14.643 0.785 -17.479 177 HG22 ILE 29 HG22 ILE 29 -15.997 -0.272 -17.872 178 HG23 ILE 29 HG23 ILE 29 -14.419 -0.549 -18.611 179 HD11 ILE 29 HD11 ILE 29 -11.398 -2.428 -15.904 180 HD12 ILE 29 HD12 ILE 29 -12.345 -2.933 -17.304 181 HD13 ILE 29 HD13 ILE 29 -13.002 -3.126 -15.678 182 H ILE 30 HN ILE 30 -16.004 -2.060 -13.144 183 HA ILE 30 HA ILE 30 -18.043 -3.845 -14.330 184 HB ILE 30 HB ILE 30 -16.820 -4.427 -11.601 185 HG12 ILE 30 HG12 ILE 30 -15.512 -6.102 -13.539 186 HG13 ILE 30 HG11 ILE 30 -15.234 -4.423 -13.986 187 HG21 ILE 30 HG21 ILE 30 -17.396 -6.718 -12.000 188 HG22 ILE 30 HG22 ILE 30 -17.736 -6.403 -13.702 189 HG23 ILE 30 HG23 ILE 30 -18.796 -5.745 -12.456 190 HD11 ILE 30 HD11 ILE 30 -14.619 -5.656 -11.308 191 HD12 ILE 30 HD12 ILE 30 -14.329 -3.977 -11.767 192 HD13 ILE 30 HD13 ILE 30 -13.450 -5.276 -12.574 193 H GLU 31 HN GLU 31 -20.070 -4.008 -13.486 194 HA GLU 31 HA GLU 31 -21.113 -1.837 -11.880 195 HB2 GLU 31 HB2 GLU 31 -22.380 -4.086 -13.406 196 HB3 GLU 31 HB1 GLU 31 -23.334 -3.152 -12.264 197 HG2 GLU 31 HG2 GLU 31 -22.809 -1.105 -13.495 198 HG3 GLU 31 HG1 GLU 31 -21.849 -2.041 -14.640 199 H ASN 32 HN ASN 32 -20.115 -5.056 -11.188 200 HA ASN 32 HA ASN 32 -21.635 -5.480 -8.757 201 HB2 ASN 32 HB2 ASN 32 -19.481 -6.957 -10.219 202 HB3 ASN 32 HB1 ASN 32 -19.815 -7.373 -8.542 203 HD21 ASN 32 HD21 ASN 32 -20.660 -7.869 -11.735 204 HD22 ASN 32 HD22 ASN 32 -22.141 -8.722 -11.486 205 H PHE 33 HN PHE 33 -18.692 -3.912 -9.598 206 HA PHE 33 HA PHE 33 -17.090 -4.000 -7.311 207 HB2 PHE 33 HB2 PHE 33 -16.746 -2.905 -9.732 208 HB3 PHE 33 HB1 PHE 33 -17.068 -1.449 -8.816 209 HD1 PHE 33 HD1 PHE 33 -15.522 -0.688 -7.073 210 HD2 PHE 33 HD2 PHE 33 -14.677 -4.184 -9.364 211 HE1 PHE 33 HE1 PHE 33 -13.222 -0.657 -6.267 212 HE2 PHE 33 HE2 PHE 33 -12.350 -4.145 -8.561 213 HZ PHE 33 HZ PHE 33 -11.614 -2.379 -7.009 214 H GLU 34 HN GLU 34 -19.777 -1.837 -8.027 215 HA GLU 34 HA GLU 34 -19.686 0.005 -5.893 216 HB2 GLU 34 HB2 GLU 34 -21.889 -1.050 -7.625 217 HB3 GLU 34 HB1 GLU 34 -22.277 0.008 -6.276 218 HG2 GLU 34 HG2 GLU 34 -20.791 1.724 -7.214 219 HG3 GLU 34 HG1 GLU 34 -20.441 0.660 -8.574 220 H GLU 35 HN GLU 35 -20.829 -3.300 -6.018 221 HA GLU 35 HA GLU 35 -22.040 -3.389 -3.356 222 HB2 GLU 35 HB2 GLU 35 -21.734 -5.368 -5.589 223 HB3 GLU 35 HB1 GLU 35 -22.114 -5.930 -3.970 224 HG2 GLU 35 HG2 GLU 35 -24.121 -4.535 -3.958 225 HG3 GLU 35 HG1 GLU 35 -23.742 -3.985 -5.591 226 H ILE 36 HN ILE 36 -19.012 -4.356 -4.918 227 HA ILE 36 HA ILE 36 -17.948 -6.005 -2.797 228 HB ILE 36 HB ILE 36 -16.399 -4.815 -5.167 229 HG12 ILE 36 HG12 ILE 36 -17.002 -7.734 -5.109 230 HG13 ILE 36 HG11 ILE 36 -18.386 -6.694 -5.390 231 HG21 ILE 36 HG21 ILE 36 -15.446 -7.357 -3.925 232 HG22 ILE 36 HG22 ILE 36 -15.211 -5.903 -2.961 233 HG23 ILE 36 HG23 ILE 36 -14.501 -6.011 -4.573 234 HD11 ILE 36 HD11 ILE 36 -16.052 -6.143 -7.112 235 HD12 ILE 36 HD12 ILE 36 -17.765 -6.264 -7.521 236 HD13 ILE 36 HD13 ILE 36 -16.798 -7.724 -7.332 237 H VAL 37 HN VAL 37 -17.582 -2.582 -3.712 238 HA VAL 37 HA VAL 37 -15.502 -1.789 -1.982 239 HB VAL 37 HB VAL 37 -16.370 0.600 -2.232 240 HG11 VAL 37 HG11 VAL 37 -15.757 0.720 -4.649 241 HG12 VAL 37 HG12 VAL 37 -15.753 -1.043 -4.679 242 HG13 VAL 37 HG13 VAL 37 -14.614 -0.176 -3.645 243 HG21 VAL 37 HG21 VAL 37 -18.381 -0.689 -4.091 244 HG22 VAL 37 HG22 VAL 37 -17.974 1.026 -4.113 245 HG23 VAL 37 HG23 VAL 37 -18.730 0.317 -2.687 246 H LYS 38 HN LYS 38 -18.784 -2.415 -1.176 247 HA LYS 38 HA LYS 38 -18.816 -1.049 1.394 248 HB2 LYS 38 HB2 LYS 38 -20.788 -2.607 -0.233 249 HB3 LYS 38 HB1 LYS 38 -21.078 -2.409 1.491 250 HG2 LYS 38 HG2 LYS 38 -21.069 -0.000 1.249 251 HG3 LYS 38 HG1 LYS 38 -20.674 -0.153 -0.464 252 HD2 LYS 38 HD2 LYS 38 -22.794 -1.301 -0.856 253 HD3 LYS 38 HD1 LYS 38 -23.186 -1.178 0.861 254 HE2 LYS 38 HE2 LYS 38 -23.143 1.266 0.687 255 HE3 LYS 38 HE1 LYS 38 -22.759 1.135 -1.028 256 HZ1 LYS 38 HZ1 LYS 38 -25.016 1.419 -1.080 257 HZ2 LYS 38 HZ2 LYS 38 -25.286 0.566 0.356 258 HZ3 LYS 38 HZ3 LYS 38 -24.928 -0.271 -1.070 259 H ASP 39 HN ASP 39 -17.911 -4.192 0.244 260 HA ASP 39 HA ASP 39 -17.842 -5.288 2.963 261 HB2 ASP 39 HB2 ASP 39 -18.933 -6.499 0.468 262 HB3 ASP 39 HB1 ASP 39 -18.044 -7.571 1.544 263 H ARG 40 HN ARG 40 -15.783 -5.123 3.518 264 HA ARG 40 HA ARG 40 -13.438 -5.376 2.065 265 HB2 ARG 40 HB2 ARG 40 -14.012 -5.907 4.973 266 HB3 ARG 40 HB1 ARG 40 -12.390 -6.065 4.319 267 HG2 ARG 40 HG2 ARG 40 -12.152 -3.872 4.844 268 HG3 ARG 40 HG1 ARG 40 -13.164 -3.545 3.448 269 HD2 ARG 40 HD2 ARG 40 -14.184 -2.339 5.172 270 HD3 ARG 40 HD1 ARG 40 -15.141 -3.817 5.084 271 HE ARG 40 HE ARG 40 -13.169 -4.305 6.954 272 HH11 ARG 40 HH11 ARG 40 -15.858 -1.936 6.855 273 HH12 ARG 40 HH12 ARG 40 -15.964 -1.872 8.583 274 HH21 ARG 40 HH21 ARG 40 -13.384 -4.152 9.160 275 HH22 ARG 40 HH22 ARG 40 -14.576 -3.114 9.869 276 H GLU 41 HN GLU 41 -15.312 -8.017 3.492 277 HA GLU 41 HA GLU 41 -13.523 -10.189 3.137 278 HB2 GLU 41 HB2 GLU 41 -15.987 -9.748 4.292 279 HB3 GLU 41 HB1 GLU 41 -16.356 -10.841 2.972 280 HG2 GLU 41 HG2 GLU 41 -14.687 -12.420 3.834 281 HG3 GLU 41 HG1 GLU 41 -14.348 -11.313 5.164 282 H ARG 42 HN ARG 42 -15.842 -8.648 0.967 283 HA ARG 42 HA ARG 42 -15.714 -10.606 -1.164 284 HB2 ARG 42 HB2 ARG 42 -17.118 -8.008 -0.743 285 HB3 ARG 42 HB1 ARG 42 -16.879 -8.560 -2.393 286 HG2 ARG 42 HG2 ARG 42 -18.047 -10.656 -1.840 287 HG3 ARG 42 HG1 ARG 42 -18.324 -10.049 -0.206 288 HD2 ARG 42 HD2 ARG 42 -19.636 -8.204 -1.085 289 HD3 ARG 42 HD1 ARG 42 -19.299 -8.721 -2.737 290 HE ARG 42 HE ARG 42 -20.583 -10.725 -1.100 291 HH11 ARG 42 HH11 ARG 42 -21.362 -8.075 -3.391 292 HH12 ARG 42 HH12 ARG 42 -22.942 -8.711 -3.706 293 HH21 ARG 42 HH21 ARG 42 -22.641 -11.456 -1.585 294 HH22 ARG 42 HH22 ARG 42 -23.649 -10.593 -2.698 295 H PHE 43 HN PHE 43 -14.178 -7.491 -0.388 296 HA PHE 43 HA PHE 43 -12.960 -6.982 -2.935 297 HB2 PHE 43 HB2 PHE 43 -13.500 -5.353 -0.887 298 HB3 PHE 43 HB1 PHE 43 -11.833 -5.715 -0.469 299 HD1 PHE 43 HD2 PHE 43 -9.979 -5.075 -2.048 300 HD2 PHE 43 HD1 PHE 43 -14.027 -3.878 -2.694 301 HE1 PHE 43 HE2 PHE 43 -9.226 -3.340 -3.619 302 HE2 PHE 43 HE1 PHE 43 -13.266 -2.154 -4.266 303 HZ PHE 43 HZ PHE 43 -10.866 -1.889 -4.722 304 H LEU 44 HN LEU 44 -11.709 -8.360 0.138 305 HA LEU 44 HA LEU 44 -9.007 -8.775 -0.690 306 HB2 LEU 44 HB2 LEU 44 -10.675 -9.769 1.588 307 HB3 LEU 44 HB1 LEU 44 -9.096 -10.470 1.293 308 HG LEU 44 HG LEU 44 -9.061 -7.540 1.357 309 HD11 LEU 44 HD11 LEU 44 -9.873 -9.074 3.816 310 HD12 LEU 44 HD12 LEU 44 -10.799 -7.819 2.991 311 HD13 LEU 44 HD13 LEU 44 -9.290 -7.409 3.807 312 HD21 LEU 44 HD21 LEU 44 -7.073 -9.059 1.369 313 HD22 LEU 44 HD22 LEU 44 -7.539 -9.565 2.992 314 HD23 LEU 44 HD23 LEU 44 -7.103 -7.885 2.684 315 H ALA 45 HN ALA 45 -11.918 -10.689 -0.937 316 HA ALA 45 HA ALA 45 -10.705 -13.170 -1.821 317 HB1 ALA 45 HB1 ALA 45 -12.834 -13.135 -0.588 318 HB2 ALA 45 HB2 ALA 45 -12.981 -13.947 -2.148 319 HB3 ALA 45 HB3 ALA 45 -13.589 -12.304 -1.949 320 H GLN 46 HN GLN 46 -11.956 -10.274 -3.389 321 HA GLN 46 HA GLN 46 -12.150 -11.317 -6.075 322 HB2 GLN 46 HB2 GLN 46 -12.601 -8.690 -4.772 323 HB3 GLN 46 HB1 GLN 46 -12.147 -8.643 -6.469 324 HG2 GLN 46 HG2 GLN 46 -14.364 -10.463 -5.643 325 HG3 GLN 46 HG1 GLN 46 -14.689 -8.734 -5.753 326 HE21 GLN 46 HE21 GLN 46 -14.535 -7.711 -7.794 327 HE22 GLN 46 HE22 GLN 46 -14.618 -8.618 -9.262 328 H VAL 47 HN VAL 47 -9.742 -9.388 -4.267 329 HA VAL 47 HA VAL 47 -7.943 -8.886 -6.469 330 HB VAL 47 HB VAL 47 -7.263 -8.626 -3.482 331 HG11 VAL 47 HG11 VAL 47 -5.426 -7.213 -4.029 332 HG12 VAL 47 HG12 VAL 47 -5.938 -7.068 -5.709 333 HG13 VAL 47 HG13 VAL 47 -5.284 -8.594 -5.120 334 HG21 VAL 47 HG21 VAL 47 -8.166 -6.412 -5.326 335 HG22 VAL 47 HG22 VAL 47 -7.747 -6.265 -3.620 336 HG23 VAL 47 HG23 VAL 47 -9.174 -7.183 -4.101 337 H GLU 48 HN GLU 48 -8.097 -11.384 -3.907 338 HA GLU 48 HA GLU 48 -5.659 -12.773 -4.461 339 HB2 GLU 48 HB2 GLU 48 -8.153 -13.518 -2.946 340 HB3 GLU 48 HB1 GLU 48 -6.835 -14.656 -3.155 341 HG2 GLU 48 HG2 GLU 48 -5.327 -12.996 -2.047 342 HG3 GLU 48 HG1 GLU 48 -6.747 -12.005 -1.735 343 H GLU 49 HN GLU 49 -8.835 -12.947 -5.904 344 HA GLU 49 HA GLU 49 -8.358 -15.466 -7.320 345 HB2 GLU 49 HB2 GLU 49 -10.751 -13.748 -6.830 346 HB3 GLU 49 HB1 GLU 49 -10.753 -14.812 -8.229 347 HG2 GLU 49 HG2 GLU 49 -10.003 -16.014 -5.617 348 HG3 GLU 49 HG1 GLU 49 -11.700 -15.599 -5.857 349 H PHE 50 HN PHE 50 -8.372 -12.018 -7.941 350 HA PHE 50 HA PHE 50 -8.319 -12.289 -10.854 351 HB2 PHE 50 HB2 PHE 50 -8.867 -10.099 -8.940 352 HB3 PHE 50 HB1 PHE 50 -8.034 -9.631 -10.405 353 HD1 PHE 50 HD2 PHE 50 -9.158 -9.761 -12.578 354 HD2 PHE 50 HD1 PHE 50 -11.174 -10.854 -8.981 355 HE1 PHE 50 HE2 PHE 50 -11.312 -9.674 -13.759 356 HE2 PHE 50 HE1 PHE 50 -13.329 -10.762 -10.165 357 HZ PHE 50 HZ PHE 50 -13.399 -10.175 -12.554 358 H VAL 51 HN VAL 51 -6.628 -11.666 -12.143 359 HA VAL 51 HA VAL 51 -4.021 -11.518 -10.833 360 HB VAL 51 HB VAL 51 -4.690 -13.398 -12.513 361 HG11 VAL 51 HG11 VAL 51 -5.301 -11.945 -14.449 362 HG12 VAL 51 HG12 VAL 51 -4.123 -13.209 -14.812 363 HG13 VAL 51 HG13 VAL 51 -3.589 -11.540 -14.607 364 HG21 VAL 51 HG21 VAL 51 -2.318 -13.644 -13.218 365 HG22 VAL 51 HG22 VAL 51 -2.560 -13.349 -11.495 366 HG23 VAL 51 HG23 VAL 51 -2.018 -12.041 -12.543 367 H PHE 52 HN PHE 52 -2.364 -10.113 -11.637 368 HA PHE 52 HA PHE 52 -3.300 -7.632 -12.921 369 HB2 PHE 52 HB2 PHE 52 -1.563 -7.742 -10.435 370 HB3 PHE 52 HB1 PHE 52 -1.952 -6.283 -11.323 371 HD1 PHE 52 HD2 PHE 52 -4.236 -5.332 -11.216 372 HD2 PHE 52 HD1 PHE 52 -3.135 -8.746 -8.919 373 HE1 PHE 52 HE2 PHE 52 -6.233 -5.034 -9.818 374 HE2 PHE 52 HE1 PHE 52 -5.135 -8.452 -7.520 375 HZ PHE 52 HZ PHE 52 -6.688 -6.595 -7.970 376 H LYS 53 HN LYS 53 -1.838 -6.502 -14.111 377 HA LYS 53 HA LYS 53 0.577 -7.953 -14.962 378 HB2 LYS 53 HB2 LYS 53 -1.519 -6.819 -16.426 379 HB3 LYS 53 HB1 LYS 53 -0.173 -5.709 -16.644 380 HG2 LYS 53 HG2 LYS 53 1.214 -7.481 -17.497 381 HG3 LYS 53 HG1 LYS 53 -0.039 -8.675 -17.152 382 HD2 LYS 53 HD2 LYS 53 -1.523 -7.592 -18.763 383 HD3 LYS 53 HD1 LYS 53 -0.282 -6.382 -19.099 384 HE2 LYS 53 HE2 LYS 53 1.211 -8.131 -19.917 385 HE3 LYS 53 HE1 LYS 53 -0.007 -9.353 -19.554 386 HZ1 LYS 53 HZ1 LYS 53 -1.474 -7.947 -21.116 387 HZ2 LYS 53 HZ2 LYS 53 -0.308 -8.968 -21.793 388 HZ3 LYS 53 HZ3 LYS 53 -0.009 -7.308 -21.675 389 H CYS 54 HN CYS 54 2.568 -7.017 -15.034 390 HA CYS 54 HA CYS 54 2.954 -4.588 -13.472 391 HB2 CYS 54 HB2 CYS 54 4.384 -6.517 -12.912 392 HB3 CYS 54 HB1 CYS 54 5.020 -6.534 -14.552 393 HA PRO 55 HA PRO 55 3.624 -2.113 -17.305 394 HB2 PRO 55 HB2 PRO 55 4.292 0.288 -16.204 395 HB3 PRO 55 HB1 PRO 55 2.629 -0.303 -16.242 396 HG2 PRO 55 HG2 PRO 55 4.598 -0.322 -13.963 397 HG3 PRO 55 HG1 PRO 55 2.863 0.063 -13.933 398 HD2 PRO 55 HD2 PRO 55 3.877 -2.376 -13.179 399 HD3 PRO 55 HD1 PRO 55 2.251 -2.173 -13.853 400 H VAL 56 HN VAL 56 5.967 -2.997 -15.051 401 HA VAL 56 HA VAL 56 8.287 -1.766 -16.375 402 HB VAL 56 HB VAL 56 8.619 -3.398 -13.847 403 HG11 VAL 56 HG11 VAL 56 10.436 -1.865 -13.345 404 HG12 VAL 56 HG12 VAL 56 10.006 -0.855 -14.725 405 HG13 VAL 56 HG13 VAL 56 10.614 -2.490 -14.985 406 HG21 VAL 56 HG21 VAL 56 7.426 -0.623 -13.872 407 HG22 VAL 56 HG22 VAL 56 8.392 -1.188 -12.510 408 HG23 VAL 56 HG23 VAL 56 6.909 -2.036 -12.950 409 H CYS 57 HN CYS 57 7.168 -5.006 -15.220 410 HA CYS 57 HA CYS 57 9.234 -6.385 -16.751 411 HB2 CYS 57 HB2 CYS 57 7.108 -7.618 -14.976 412 HB3 CYS 57 HB1 CYS 57 8.526 -8.424 -15.627 413 H GLY 58 HN GLY 58 5.641 -6.616 -16.541 414 HA2 GLY 58 HA2 GLY 58 4.253 -6.485 -18.577 415 HA3 GLY 58 HA1 GLY 58 5.541 -7.322 -19.427 416 H GLU 59 HN GLU 59 5.658 -8.943 -16.686 417 HA GLU 59 HA GLU 59 3.974 -11.174 -17.478 418 HB2 GLU 59 HB2 GLU 59 6.156 -10.745 -15.468 419 HB3 GLU 59 HB1 GLU 59 5.080 -12.118 -15.268 420 HG2 GLU 59 HG2 GLU 59 5.699 -12.904 -17.512 421 HG3 GLU 59 HG1 GLU 59 6.813 -11.546 -17.664 422 H GLU 60 HN GLU 60 2.452 -12.242 -16.079 423 HA GLU 60 HA GLU 60 0.840 -10.408 -14.476 424 HB2 GLU 60 HB2 GLU 60 0.294 -13.096 -15.716 425 HB3 GLU 60 HB1 GLU 60 -0.795 -12.391 -14.541 426 HG2 GLU 60 HG2 GLU 60 -1.195 -10.484 -15.981 427 HG3 GLU 60 HG1 GLU 60 -0.008 -11.075 -17.136 428 H PHE 61 HN PHE 61 0.365 -10.588 -12.400 429 HA PHE 61 HA PHE 61 1.491 -12.739 -10.762 430 HB2 PHE 61 HB2 PHE 61 2.107 -11.066 -9.002 431 HB3 PHE 61 HB1 PHE 61 3.040 -10.882 -10.471 432 HD1 PHE 61 HD1 PHE 61 2.768 -8.865 -11.865 433 HD2 PHE 61 HD2 PHE 61 0.604 -9.344 -8.231 434 HE1 PHE 61 HE1 PHE 61 2.206 -6.467 -11.885 435 HE2 PHE 61 HE2 PHE 61 0.040 -6.949 -8.246 436 HZ PHE 61 HZ PHE 61 0.839 -5.509 -10.076 437 H TYR 62 HN TYR 62 0.253 -13.331 -8.956 438 HA TYR 62 HA TYR 62 -2.577 -12.584 -9.108 439 HB2 TYR 62 HB2 TYR 62 -1.149 -14.975 -7.936 440 HB3 TYR 62 HB1 TYR 62 -2.851 -14.680 -7.641 441 HD1 TYR 62 HD2 TYR 62 -4.481 -14.790 -9.600 442 HD2 TYR 62 HD1 TYR 62 -0.381 -15.892 -10.002 443 HE1 TYR 62 HE2 TYR 62 -5.007 -15.985 -11.678 444 HE2 TYR 62 HE1 TYR 62 -0.907 -17.083 -12.083 445 HH TYR 62 HH TYR 62 -2.912 -16.791 -13.918 446 H GLY 63 HN GLY 63 -3.869 -12.139 -7.270 447 HA2 GLY 63 HA2 GLY 63 -2.686 -10.474 -5.233 448 HA3 GLY 63 HA1 GLY 63 -4.385 -10.871 -5.391 449 H LYS 64 HN LYS 64 -3.134 -13.781 -5.383 450 HA LYS 64 HA LYS 64 -3.478 -14.351 -2.544 451 HB2 LYS 64 HB2 LYS 64 -4.248 -15.715 -4.768 452 HB3 LYS 64 HB1 LYS 64 -2.773 -16.576 -4.353 453 HG2 LYS 64 HG2 LYS 64 -3.638 -17.103 -2.163 454 HG3 LYS 64 HG1 LYS 64 -5.068 -16.114 -2.446 455 HD2 LYS 64 HD2 LYS 64 -5.743 -17.619 -4.258 456 HD3 LYS 64 HD1 LYS 64 -4.311 -18.611 -3.961 457 HE2 LYS 64 HE2 LYS 64 -5.102 -19.037 -1.675 458 HE3 LYS 64 HE1 LYS 64 -6.540 -18.071 -2.002 459 HZ1 LYS 64 HZ1 LYS 64 -6.355 -20.734 -2.351 460 HZ2 LYS 64 HZ2 LYS 64 -6.077 -20.167 -3.920 461 HZ3 LYS 64 HZ3 LYS 64 -7.496 -19.738 -3.106 462 H THR 65 HN THR 65 -0.863 -13.939 -4.769 463 HA THR 65 HA THR 65 1.166 -15.236 -3.091 464 HB THR 65 HB THR 65 2.744 -14.516 -4.995 465 HG1 THR 65 HG1 THR 65 1.824 -13.902 -6.915 466 HG21 THR 65 HG21 THR 65 2.171 -16.384 -6.424 467 HG22 THR 65 HG22 THR 65 0.534 -16.428 -5.765 468 HG23 THR 65 HG23 THR 65 1.913 -16.835 -4.737 469 H LEU 66 HN LEU 66 -0.354 -12.382 -2.861 470 HA LEU 66 HA LEU 66 1.800 -10.451 -2.715 471 HB2 LEU 66 HB2 LEU 66 -1.049 -10.346 -2.881 472 HB3 LEU 66 HB1 LEU 66 -0.588 -9.525 -1.412 473 HG LEU 66 HG LEU 66 1.108 -8.368 -3.268 474 HD11 LEU 66 HD11 LEU 66 -0.353 -9.599 -5.011 475 HD12 LEU 66 HD12 LEU 66 -0.027 -7.881 -5.228 476 HD13 LEU 66 HD13 LEU 66 -1.581 -8.406 -4.581 477 HD21 LEU 66 HD21 LEU 66 -0.016 -7.179 -1.539 478 HD22 LEU 66 HD22 LEU 66 -1.594 -7.524 -2.248 479 HD23 LEU 66 HD23 LEU 66 -0.466 -6.456 -3.083 480 HA PRO 67 HA PRO 67 2.924 -10.981 1.734 481 HB2 PRO 67 HB2 PRO 67 2.921 -8.022 2.089 482 HB3 PRO 67 HB1 PRO 67 4.208 -9.182 2.444 483 HG2 PRO 67 HG2 PRO 67 4.431 -7.614 0.327 484 HG3 PRO 67 HG1 PRO 67 4.850 -9.336 0.186 485 HD2 PRO 67 HD2 PRO 67 2.316 -7.937 -0.671 486 HD3 PRO 67 HD1 PRO 67 3.314 -9.097 -1.571 487 H ARG 68 HN ARG 68 2.070 -11.093 3.757 488 HA ARG 68 HA ARG 68 -0.705 -10.771 4.193 489 HB2 ARG 68 HB2 ARG 68 1.587 -11.571 5.930 490 HB3 ARG 68 HB1 ARG 68 0.021 -11.260 6.663 491 HG2 ARG 68 HG2 ARG 68 -0.990 -12.968 5.230 492 HG3 ARG 68 HG1 ARG 68 0.584 -13.277 4.492 493 HD2 ARG 68 HD2 ARG 68 1.478 -13.950 6.655 494 HD3 ARG 68 HD1 ARG 68 -0.069 -13.601 7.419 495 HE ARG 68 HE ARG 68 -0.497 -15.459 5.363 496 HH11 ARG 68 HH11 ARG 68 1.059 -15.539 8.595 497 HH12 ARG 68 HH12 ARG 68 0.774 -17.238 8.776 498 HH21 ARG 68 HH21 ARG 68 -0.815 -17.652 5.705 499 HH22 ARG 68 HH22 ARG 68 -0.269 -18.411 7.163 500 H ARG 69 HN ARG 69 1.793 -8.421 4.610 501 HA ARG 69 HA ARG 69 0.522 -6.831 6.683 502 HB2 ARG 69 HB2 ARG 69 3.086 -6.691 5.150 503 HB3 ARG 69 HB1 ARG 69 2.475 -5.235 5.924 504 HG2 ARG 69 HG2 ARG 69 2.493 -6.335 8.086 505 HG3 ARG 69 HG1 ARG 69 3.007 -7.846 7.340 506 HD2 ARG 69 HD2 ARG 69 4.647 -5.334 7.101 507 HD3 ARG 69 HD1 ARG 69 4.802 -6.399 8.496 508 HE ARG 69 HE ARG 69 5.240 -8.167 6.625 509 HH11 ARG 69 HH11 ARG 69 6.577 -4.844 6.495 510 HH12 ARG 69 HH12 ARG 69 7.961 -5.354 5.588 511 HH21 ARG 69 HH21 ARG 69 7.060 -8.720 5.454 512 HH22 ARG 69 HH22 ARG 69 8.227 -7.521 5.008 513 H GLU 70 HN GLU 70 0.819 -6.905 3.167 514 HA GLU 70 HA GLU 70 -0.267 -4.330 2.554 515 HB2 GLU 70 HB2 GLU 70 0.615 -6.701 1.059 516 HB3 GLU 70 HB1 GLU 70 -0.649 -5.764 0.284 517 HG2 GLU 70 HG2 GLU 70 0.731 -3.752 0.458 518 HG3 GLU 70 HG1 GLU 70 2.001 -4.698 1.229 519 H ALA 71 HN ALA 71 -1.694 -7.497 3.109 520 HA ALA 71 HA ALA 71 -4.310 -7.175 2.063 521 HB1 ALA 71 HB1 ALA 71 -3.449 -9.360 2.571 522 HB2 ALA 71 HB2 ALA 71 -4.901 -9.074 3.531 523 HB3 ALA 71 HB3 ALA 71 -3.310 -8.947 4.281 524 H GLU 72 HN GLU 72 -2.885 -6.290 5.166 525 HA GLU 72 HA GLU 72 -5.268 -5.487 6.555 526 HB2 GLU 72 HB2 GLU 72 -2.335 -5.224 7.075 527 HB3 GLU 72 HB1 GLU 72 -3.463 -4.269 8.023 528 HG2 GLU 72 HG2 GLU 72 -4.607 -6.352 8.699 529 HG3 GLU 72 HG1 GLU 72 -3.398 -7.274 7.808 530 H LYS 73 HN LYS 73 -3.049 -3.906 4.365 531 HA LYS 73 HA LYS 73 -3.760 -1.161 4.787 532 HB2 LYS 73 HB2 LYS 73 -2.210 -2.633 2.699 533 HB3 LYS 73 HB1 LYS 73 -2.723 -0.983 2.377 534 HG2 LYS 73 HG2 LYS 73 -1.531 -0.208 4.351 535 HG3 LYS 73 HG1 LYS 73 -1.052 -1.863 4.728 536 HD2 LYS 73 HD2 LYS 73 0.171 -1.973 2.594 537 HD3 LYS 73 HD1 LYS 73 -0.286 -0.302 2.259 538 HE2 LYS 73 HE2 LYS 73 0.919 0.433 4.249 539 HE3 LYS 73 HE1 LYS 73 1.355 -1.237 4.611 540 HZ1 LYS 73 HZ1 LYS 73 2.067 -0.344 1.955 541 HZ2 LYS 73 HZ2 LYS 73 2.970 -1.230 3.078 542 HZ3 LYS 73 HZ3 LYS 73 2.882 0.454 3.205 543 H VAL 74 HN VAL 74 -5.101 -3.746 2.852 544 HA VAL 74 HA VAL 74 -6.674 -2.320 0.949 545 HB VAL 74 HB VAL 74 -7.479 -5.101 1.925 546 HG11 VAL 74 HG11 VAL 74 -9.034 -4.148 0.318 547 HG12 VAL 74 HG12 VAL 74 -8.148 -5.470 -0.444 548 HG13 VAL 74 HG13 VAL 74 -7.717 -3.797 -0.803 549 HG21 VAL 74 HG21 VAL 74 -4.985 -5.004 1.355 550 HG22 VAL 74 HG22 VAL 74 -5.490 -4.710 -0.305 551 HG23 VAL 74 HG23 VAL 74 -5.945 -6.214 0.497 552 H PHE 75 HN PHE 75 -7.435 -3.441 4.303 553 HA PHE 75 HA PHE 75 -10.126 -2.769 4.505 554 HB2 PHE 75 HB2 PHE 75 -7.891 -2.977 6.496 555 HB3 PHE 75 HB1 PHE 75 -9.474 -2.418 7.013 556 HD1 PHE 75 HD1 PHE 75 -11.368 -3.937 7.090 557 HD2 PHE 75 HD2 PHE 75 -7.528 -5.292 5.841 558 HE1 PHE 75 HE1 PHE 75 -12.099 -6.267 7.376 559 HE2 PHE 75 HE2 PHE 75 -8.255 -7.622 6.130 560 HZ PHE 75 HZ PHE 75 -10.543 -8.112 6.895 561 H GLU 76 HN GLU 76 -7.340 -0.623 4.579 562 HA GLU 76 HA GLU 76 -8.436 1.636 5.936 563 HB2 GLU 76 HB2 GLU 76 -5.928 0.875 5.266 564 HB3 GLU 76 HB1 GLU 76 -6.232 2.058 4.004 565 HG2 GLU 76 HG2 GLU 76 -6.716 3.748 5.671 566 HG3 GLU 76 HG1 GLU 76 -6.457 2.573 6.963 567 H LEU 77 HN LEU 77 -8.092 0.843 2.433 568 HA LEU 77 HA LEU 77 -9.172 3.271 1.441 569 HB2 LEU 77 HB2 LEU 77 -9.318 2.013 -0.743 570 HB3 LEU 77 HB1 LEU 77 -7.735 2.152 -0.063 571 HG LEU 77 HG LEU 77 -8.511 -0.330 0.821 572 HD11 LEU 77 HD11 LEU 77 -9.628 -1.514 -0.879 573 HD12 LEU 77 HD12 LEU 77 -9.496 -0.161 -2.006 574 HD13 LEU 77 HD13 LEU 77 -10.566 -0.040 -0.608 575 HD21 LEU 77 HD21 LEU 77 -6.968 0.529 -1.615 576 HD22 LEU 77 HD22 LEU 77 -7.146 -1.168 -1.169 577 HD23 LEU 77 HD23 LEU 77 -6.360 -0.045 -0.060 578 H LEU 78 HN LEU 78 -10.605 0.170 2.249 579 HA LEU 78 HA LEU 78 -13.251 0.721 1.230 580 HB2 LEU 78 HB2 LEU 78 -12.026 -1.521 2.801 581 HB3 LEU 78 HB1 LEU 78 -13.765 -1.400 2.625 582 HG LEU 78 HG LEU 78 -12.555 -1.162 0.027 583 HD11 LEU 78 HD11 LEU 78 -11.828 -3.690 1.482 584 HD12 LEU 78 HD12 LEU 78 -10.688 -2.416 1.056 585 HD13 LEU 78 HD13 LEU 78 -11.529 -3.307 -0.211 586 HD21 LEU 78 HD21 LEU 78 -14.270 -3.298 1.263 587 HD22 LEU 78 HD22 LEU 78 -13.996 -3.045 -0.457 588 HD23 LEU 78 HD23 LEU 78 -14.848 -1.825 0.487 589 H ASN 79 HN ASN 79 -11.569 1.302 4.255 590 HA ASN 79 HA ASN 79 -13.958 1.679 5.881 591 HB2 ASN 79 HB2 ASN 79 -11.040 1.625 6.400 592 HB3 ASN 79 HB1 ASN 79 -12.007 2.634 7.472 593 HD21 ASN 79 HD21 ASN 79 -12.932 1.687 9.141 594 HD22 ASN 79 HD22 ASN 79 -13.181 -0.012 9.337 595 H ASP 80 HN ASP 80 -12.075 3.644 3.765 596 HA ASP 80 HA ASP 80 -12.360 6.244 4.859 597 HB2 ASP 80 HB2 ASP 80 -11.709 5.151 2.160 598 HB3 ASP 80 HB1 ASP 80 -12.133 6.854 2.282 599 H PHE 81 HN PHE 81 -14.513 4.346 2.764 600 HA PHE 81 HA PHE 81 -16.599 4.487 1.924 601 HB2 PHE 81 HB2 PHE 81 -16.829 5.328 4.632 602 HB3 PHE 81 HB1 PHE 81 -17.921 6.338 3.701 603 HD1 PHE 81 HD2 PHE 81 -17.199 2.937 4.852 604 HD2 PHE 81 HD1 PHE 81 -19.878 5.402 2.640 605 HE1 PHE 81 HE2 PHE 81 -18.907 1.169 4.957 606 HE2 PHE 81 HE1 PHE 81 -21.592 3.640 2.752 607 HZ PHE 81 HZ PHE 81 -21.107 1.522 3.909 608 H LYS 82 HN LYS 82 -16.181 7.875 3.025 609 HA LYS 82 HA LYS 82 -16.642 8.899 0.304 610 HB2 LYS 82 HB2 LYS 82 -17.962 9.704 2.882 611 HB3 LYS 82 HB1 LYS 82 -17.707 10.912 1.635 612 HG2 LYS 82 HG2 LYS 82 -19.060 9.649 0.080 613 HG3 LYS 82 HG1 LYS 82 -19.239 8.343 1.253 614 HD2 LYS 82 HD2 LYS 82 -20.388 9.895 2.779 615 HD3 LYS 82 HD1 LYS 82 -20.238 11.176 1.576 616 HE2 LYS 82 HE2 LYS 82 -21.598 9.871 0.018 617 HE3 LYS 82 HE1 LYS 82 -21.731 8.578 1.209 618 HZ1 LYS 82 HZ1 LYS 82 -22.777 11.343 1.504 619 HZ2 LYS 82 HZ2 LYS 82 -22.862 10.142 2.692 620 HZ3 LYS 82 HZ3 LYS 82 -23.700 9.949 1.235 621 H GLY 83 HN GLY 83 -15.311 10.491 -0.320 622 HA2 GLY 83 HA2 GLY 83 -13.834 12.264 1.312 623 HA3 GLY 83 HA1 GLY 83 -12.814 10.898 0.874 624 H GLY 84 HN GLY 84 -11.806 10.906 -0.984 625 HA2 GLY 84 HA2 GLY 84 -12.474 12.956 -3.012 626 HA3 GLY 84 HA1 GLY 84 -10.860 12.340 -2.707 627 H ILE 85 HN ILE 85 -13.954 10.630 -3.159 628 HA ILE 85 HA ILE 85 -12.856 9.228 -5.525 629 HB ILE 85 HB ILE 85 -15.005 7.854 -3.872 630 HG12 ILE 85 HG12 ILE 85 -12.553 6.588 -3.171 631 HG13 ILE 85 HG11 ILE 85 -12.352 8.301 -2.817 632 HG21 ILE 85 HG21 ILE 85 -12.725 6.611 -5.426 633 HG22 ILE 85 HG22 ILE 85 -14.289 7.001 -6.138 634 HG23 ILE 85 HG23 ILE 85 -14.186 5.816 -4.836 635 HD11 ILE 85 HD11 ILE 85 -13.170 7.039 -0.889 636 HD12 ILE 85 HD12 ILE 85 -14.597 6.566 -1.811 637 HD13 ILE 85 HD13 ILE 85 -14.327 8.263 -1.413 638 H ASP 86 HN ASP 86 -13.882 9.633 -7.313 639 HA ASP 86 HA ASP 86 -16.710 10.463 -7.311 640 HB2 ASP 86 HB2 ASP 86 -14.373 11.575 -8.841 641 HB3 ASP 86 HB1 ASP 86 -15.995 11.669 -9.516 642 H TRP 87 HN TRP 87 -18.049 9.326 -8.508 643 HA TRP 87 HA TRP 87 -17.167 7.004 -10.000 644 HB2 TRP 87 HB2 TRP 87 -19.889 8.040 -9.237 645 HB3 TRP 87 HB1 TRP 87 -19.696 6.675 -10.330 646 HD1 TRP 87 HD1 TRP 87 -19.716 7.592 -6.708 647 HE1 TRP 87 HE1 TRP 87 -19.261 5.540 -5.236 648 HE3 TRP 87 HE3 TRP 87 -18.223 4.225 -10.328 649 HZ2 TRP 87 HZ2 TRP 87 -18.399 2.895 -5.529 650 HZ3 TRP 87 HZ3 TRP 87 -17.610 1.953 -9.608 651 HH2 TRP 87 HH2 TRP 87 -17.693 1.307 -7.260 652 H GLU 88 HN GLU 88 -18.376 10.190 -10.815 653 HA GLU 88 HA GLU 88 -18.894 9.682 -13.621 654 HB2 GLU 88 HB2 GLU 88 -19.008 12.107 -11.865 655 HB3 GLU 88 HB1 GLU 88 -19.047 12.292 -13.611 656 HG2 GLU 88 HG2 GLU 88 -21.044 10.891 -13.717 657 HG3 GLU 88 HG1 GLU 88 -20.997 10.685 -11.968 658 H ASN 89 HN ASN 89 -16.280 11.175 -11.732 659 HA ASN 89 HA ASN 89 -14.710 11.888 -14.094 660 HB2 ASN 89 HB2 ASN 89 -14.498 12.489 -11.167 661 HB3 ASN 89 HB1 ASN 89 -13.077 12.664 -12.186 662 HD21 ASN 89 HD21 ASN 89 -15.881 14.107 -11.059 663 HD22 ASN 89 HD22 ASN 89 -15.903 15.480 -12.107 664 H LYS 90 HN LYS 90 -14.924 9.238 -11.859 665 HA LYS 90 HA LYS 90 -13.775 7.376 -11.312 666 HB2 LYS 90 HB2 LYS 90 -13.011 7.715 -14.192 667 HB3 LYS 90 HB1 LYS 90 -12.203 6.468 -13.262 668 HG2 LYS 90 HG2 LYS 90 -14.282 5.356 -12.827 669 HG3 LYS 90 HG1 LYS 90 -15.193 6.680 -13.566 670 HD2 LYS 90 HD2 LYS 90 -14.117 6.232 -15.710 671 HD3 LYS 90 HD1 LYS 90 -13.175 4.935 -14.980 672 HE2 LYS 90 HE2 LYS 90 -15.206 3.683 -14.541 673 HE3 LYS 90 HE1 LYS 90 -16.183 5.001 -15.191 674 HZ1 LYS 90 HZ1 LYS 90 -14.426 3.118 -16.617 675 HZ2 LYS 90 HZ2 LYS 90 -14.734 4.640 -17.284 676 HZ3 LYS 90 HZ3 LYS 90 -16.014 3.578 -16.977 677 H ARG 91 HN ARG 91 -12.819 8.993 -9.802 678 HA ARG 91 HA ARG 91 -9.878 8.819 -9.821 679 HB2 ARG 91 HB2 ARG 91 -11.594 11.166 -9.027 680 HB3 ARG 91 HB1 ARG 91 -9.977 10.964 -8.371 681 HG2 ARG 91 HG2 ARG 91 -9.035 11.038 -10.614 682 HG3 ARG 91 HG1 ARG 91 -10.653 11.176 -11.303 683 HD2 ARG 91 HD2 ARG 91 -10.968 13.302 -10.147 684 HD3 ARG 91 HD1 ARG 91 -9.364 13.158 -9.429 685 HE ARG 91 HE ARG 91 -9.052 12.982 -12.190 686 HH11 ARG 91 HH11 ARG 91 -10.053 15.613 -9.966 687 HH12 ARG 91 HH12 ARG 91 -9.493 16.843 -11.050 688 HH21 ARG 91 HH21 ARG 91 -8.367 14.646 -13.509 689 HH22 ARG 91 HH22 ARG 91 -8.554 16.298 -13.026 690 H VAL 92 HN VAL 92 -8.989 7.899 -8.202 691 HA VAL 92 HA VAL 92 -10.478 7.409 -5.698 692 HB VAL 92 HB VAL 92 -8.417 5.365 -6.583 693 HG11 VAL 92 HG11 VAL 92 -9.408 5.289 -4.291 694 HG12 VAL 92 HG12 VAL 92 -9.638 3.807 -5.216 695 HG13 VAL 92 HG13 VAL 92 -10.974 4.939 -5.024 696 HG21 VAL 92 HG21 VAL 92 -11.215 4.596 -7.247 697 HG22 VAL 92 HG22 VAL 92 -9.714 4.160 -8.064 698 HG23 VAL 92 HG23 VAL 92 -10.451 5.733 -8.354 699 H LYS 93 HN LYS 93 -9.490 8.079 -3.933 700 HA LYS 93 HA LYS 93 -6.594 8.640 -3.936 701 HB2 LYS 93 HB2 LYS 93 -8.875 10.320 -2.959 702 HB3 LYS 93 HB1 LYS 93 -7.328 10.418 -2.132 703 HG2 LYS 93 HG2 LYS 93 -6.235 11.088 -4.191 704 HG3 LYS 93 HG1 LYS 93 -7.754 10.919 -5.074 705 HD2 LYS 93 HD2 LYS 93 -8.746 12.682 -3.705 706 HD3 LYS 93 HD1 LYS 93 -7.242 12.842 -2.802 707 HE2 LYS 93 HE2 LYS 93 -6.091 13.522 -4.849 708 HE3 LYS 93 HE1 LYS 93 -7.592 13.342 -5.756 709 HZ1 LYS 93 HZ1 LYS 93 -7.983 15.459 -5.269 710 HZ2 LYS 93 HZ2 LYS 93 -6.703 15.531 -4.165 711 HZ3 LYS 93 HZ3 LYS 93 -8.224 14.993 -3.659 712 H LEU 94 HN LEU 94 -5.433 7.917 -2.280 713 HA LEU 94 HA LEU 94 -6.774 6.506 -0.086 714 HB2 LEU 94 HB2 LEU 94 -4.636 5.676 -1.910 715 HB3 LEU 94 HB1 LEU 94 -4.186 5.475 -0.232 716 HG LEU 94 HG LEU 94 -6.672 4.272 -0.305 717 HD11 LEU 94 HD11 LEU 94 -6.759 2.850 -2.224 718 HD12 LEU 94 HD12 LEU 94 -5.248 3.514 -2.846 719 HD13 LEU 94 HD13 LEU 94 -6.691 4.523 -2.777 720 HD21 LEU 94 HD21 LEU 94 -3.919 3.120 -0.666 721 HD22 LEU 94 HD22 LEU 94 -5.353 2.160 -0.305 722 HD23 LEU 94 HD23 LEU 94 -4.788 3.372 0.845 723 H LYS 95 HN LYS 95 -6.394 7.101 1.857 724 HA LYS 95 HA LYS 95 -4.283 9.065 2.459 725 HB2 LYS 95 HB2 LYS 95 -7.081 9.018 3.026 726 HB3 LYS 95 HB1 LYS 95 -6.206 8.951 4.550 727 HG2 LYS 95 HG2 LYS 95 -5.024 10.971 4.027 728 HG3 LYS 95 HG1 LYS 95 -5.713 11.000 2.403 729 HD2 LYS 95 HD2 LYS 95 -7.958 11.252 3.367 730 HD3 LYS 95 HD1 LYS 95 -7.258 11.250 4.986 731 HE2 LYS 95 HE2 LYS 95 -6.414 13.264 2.915 732 HE3 LYS 95 HE1 LYS 95 -7.834 13.531 3.921 733 HZ1 LYS 95 HZ1 LYS 95 -6.493 13.503 5.872 734 HZ2 LYS 95 HZ2 LYS 95 -5.753 14.556 4.775 735 HZ3 LYS 95 HZ3 LYS 95 -5.122 13.005 5.013 Start of MODEL 7 1 H1 MET 8 HT1 MET 8 1.205 1.952 -0.252 2 H2 MET 8 HT2 MET 8 1.976 0.778 0.691 3 H3 MET 8 HT3 MET 8 0.703 0.338 -0.333 4 HA MET 8 HA MET 8 2.205 1.330 -2.170 5 HB2 MET 8 HB2 MET 8 4.021 0.910 0.163 6 HB3 MET 8 HB1 MET 8 4.624 0.511 -1.438 7 HG2 MET 8 HG2 MET 8 4.198 2.781 -2.188 8 HG3 MET 8 HG1 MET 8 3.527 3.192 -0.609 9 HE1 MET 8 HE1 MET 8 5.971 5.361 -0.200 10 HE2 MET 8 HE2 MET 8 5.174 4.944 -1.716 11 HE3 MET 8 HE3 MET 8 6.931 4.873 -1.596 12 H ALA 9 HN ALA 9 2.493 -0.131 -3.679 13 HA ALA 9 HA ALA 9 2.379 -3.001 -2.996 14 HB1 ALA 9 HB1 ALA 9 0.422 -2.546 -4.215 15 HB2 ALA 9 HB2 ALA 9 1.533 -3.182 -5.428 16 HB3 ALA 9 HB3 ALA 9 1.256 -1.446 -5.313 17 H LYS 10 HN LYS 10 3.792 -4.394 -3.864 18 HA LYS 10 HA LYS 10 5.977 -3.380 -5.551 19 HB2 LYS 10 HB2 LYS 10 6.088 -4.972 -3.022 20 HB3 LYS 10 HB1 LYS 10 7.291 -5.287 -4.264 21 HG2 LYS 10 HG2 LYS 10 7.996 -2.964 -4.202 22 HG3 LYS 10 HG1 LYS 10 6.758 -2.608 -2.995 23 HD2 LYS 10 HD2 LYS 10 7.822 -4.158 -1.435 24 HD3 LYS 10 HD1 LYS 10 9.045 -4.548 -2.647 25 HE2 LYS 10 HE2 LYS 10 9.790 -2.219 -2.639 26 HE3 LYS 10 HE1 LYS 10 8.570 -1.831 -1.427 27 HZ1 LYS 10 HZ1 LYS 10 9.822 -2.672 0.202 28 HZ2 LYS 10 HZ2 LYS 10 11.108 -2.555 -0.889 29 HZ3 LYS 10 HZ3 LYS 10 10.293 -4.025 -0.700 30 H CYS 11 HN CYS 11 6.646 -4.611 -7.217 31 HA CYS 11 HA CYS 11 5.022 -6.810 -8.120 32 HB2 CYS 11 HB2 CYS 11 6.056 -5.112 -9.704 33 HB3 CYS 11 HB1 CYS 11 7.609 -5.861 -9.399 34 HA PRO 12 HA PRO 12 7.739 -9.982 -6.138 35 HB2 PRO 12 HB2 PRO 12 6.391 -12.252 -6.811 36 HB3 PRO 12 HB1 PRO 12 5.855 -11.180 -5.513 37 HG2 PRO 12 HG2 PRO 12 4.843 -11.396 -8.340 38 HG3 PRO 12 HG1 PRO 12 3.914 -11.192 -6.840 39 HD2 PRO 12 HD2 PRO 12 4.497 -9.112 -8.536 40 HD3 PRO 12 HD1 PRO 12 4.269 -8.896 -6.794 41 H ILE 13 HN ILE 13 7.350 -9.445 -9.462 42 HA ILE 13 HA ILE 13 9.020 -11.653 -10.398 43 HB ILE 13 HB ILE 13 7.665 -9.606 -12.215 44 HG12 ILE 13 HG12 ILE 13 6.175 -12.109 -12.185 45 HG13 ILE 13 HG11 ILE 13 6.192 -11.404 -10.574 46 HG21 ILE 13 HG21 ILE 13 8.591 -12.458 -12.690 47 HG22 ILE 13 HG22 ILE 13 9.266 -10.980 -13.376 48 HG23 ILE 13 HG23 ILE 13 7.657 -11.518 -13.858 49 HD11 ILE 13 HD11 ILE 13 5.075 -9.473 -11.289 50 HD12 ILE 13 HD12 ILE 13 4.255 -10.802 -12.107 51 HD13 ILE 13 HD13 ILE 13 5.407 -9.803 -12.990 52 H CYS 14 HN CYS 14 8.813 -8.025 -10.675 53 HA CYS 14 HA CYS 14 11.645 -7.975 -11.459 54 HB2 CYS 14 HB2 CYS 14 11.247 -5.809 -12.454 55 HB3 CYS 14 HB1 CYS 14 10.070 -6.968 -13.034 56 H GLY 15 HN GLY 15 9.358 -6.550 -9.166 57 HA2 GLY 15 HA2 GLY 15 9.798 -5.975 -6.906 58 HA3 GLY 15 HA1 GLY 15 11.514 -5.929 -7.271 59 H SER 16 HN SER 16 9.118 -4.275 -9.258 60 HA SER 16 HA SER 16 10.354 -1.693 -8.685 61 HB2 SER 16 HB2 SER 16 8.456 -2.618 -10.839 62 HB3 SER 16 HB1 SER 16 8.935 -0.935 -10.630 63 HG SER 16 HG SER 16 10.721 -3.097 -11.073 64 HA PRO 17 HA PRO 17 6.818 -0.184 -6.114 65 HB2 PRO 17 HB2 PRO 17 7.208 2.560 -7.195 66 HB3 PRO 17 HB1 PRO 17 7.243 2.016 -5.513 67 HG2 PRO 17 HG2 PRO 17 9.511 2.680 -6.710 68 HG3 PRO 17 HG1 PRO 17 9.451 1.219 -5.698 69 HD2 PRO 17 HD2 PRO 17 9.249 1.427 -8.707 70 HD3 PRO 17 HD1 PRO 17 10.312 0.390 -7.732 71 H LEU 18 HN LEU 18 4.731 -0.123 -6.322 72 HA LEU 18 HA LEU 18 3.432 0.733 -8.827 73 HB2 LEU 18 HB2 LEU 18 2.883 -1.644 -7.065 74 HB3 LEU 18 HB1 LEU 18 1.634 -0.977 -8.103 75 HG LEU 18 HG LEU 18 4.134 -1.517 -9.527 76 HD11 LEU 18 HD11 LEU 18 3.769 -3.983 -9.535 77 HD12 LEU 18 HD12 LEU 18 2.673 -3.772 -8.168 78 HD13 LEU 18 HD13 LEU 18 4.375 -3.341 -8.008 79 HD21 LEU 18 HD21 LEU 18 2.622 -2.478 -11.142 80 HD22 LEU 18 HD22 LEU 18 1.935 -0.964 -10.550 81 HD23 LEU 18 HD23 LEU 18 1.314 -2.504 -9.958 82 H LYS 19 HN LYS 19 1.506 1.793 -8.708 83 HA LYS 19 HA LYS 19 0.875 3.086 -6.167 84 HB2 LYS 19 HB2 LYS 19 1.068 4.022 -8.792 85 HB3 LYS 19 HB1 LYS 19 -0.661 3.997 -8.469 86 HG2 LYS 19 HG2 LYS 19 -0.374 5.424 -6.555 87 HG3 LYS 19 HG1 LYS 19 1.382 5.353 -6.723 88 HD2 LYS 19 HD2 LYS 19 1.225 6.451 -8.899 89 HD3 LYS 19 HD1 LYS 19 -0.533 6.513 -8.745 90 HE2 LYS 19 HE2 LYS 19 -0.307 7.913 -6.754 91 HE3 LYS 19 HE1 LYS 19 1.448 7.848 -6.905 92 HZ1 LYS 19 HZ1 LYS 19 -0.394 9.558 -8.213 93 HZ2 LYS 19 HZ2 LYS 19 0.506 8.696 -9.355 94 HZ3 LYS 19 HZ3 LYS 19 1.297 9.631 -8.188 95 H TRP 20 HN TRP 20 -0.782 2.564 -4.977 96 HA TRP 20 HA TRP 20 -2.673 0.516 -5.597 97 HB2 TRP 20 HB2 TRP 20 -2.182 2.310 -3.270 98 HB3 TRP 20 HB1 TRP 20 -3.752 1.517 -3.390 99 HD1 TRP 20 HD1 TRP 20 -0.066 0.770 -2.759 100 HE1 TRP 20 HE1 TRP 20 0.183 -1.643 -1.912 101 HE3 TRP 20 HE3 TRP 20 -4.898 -0.918 -3.465 102 HZ2 TRP 20 HZ2 TRP 20 -1.402 -3.927 -1.591 103 HZ3 TRP 20 HZ3 TRP 20 -5.414 -3.240 -2.849 104 HH2 TRP 20 HH2 TRP 20 -3.697 -4.712 -1.922 105 H GLU 21 HN GLU 21 -2.745 3.971 -5.946 106 HA GLU 21 HA GLU 21 -5.542 4.445 -6.249 107 HB2 GLU 21 HB2 GLU 21 -3.066 5.983 -6.972 108 HB3 GLU 21 HB1 GLU 21 -4.642 6.538 -7.515 109 HG2 GLU 21 HG2 GLU 21 -5.400 6.687 -5.201 110 HG3 GLU 21 HG1 GLU 21 -3.834 6.099 -4.644 111 H GLU 22 HN GLU 22 -2.976 3.466 -8.491 112 HA GLU 22 HA GLU 22 -4.504 3.722 -10.930 113 HB2 GLU 22 HB2 GLU 22 -1.797 2.661 -10.232 114 HB3 GLU 22 HB1 GLU 22 -2.518 2.214 -11.773 115 HG2 GLU 22 HG2 GLU 22 -2.760 4.593 -12.333 116 HG3 GLU 22 HG1 GLU 22 -1.989 5.018 -10.807 117 H LEU 23 HN LEU 23 -3.803 1.113 -8.643 118 HA LEU 23 HA LEU 23 -4.689 -1.154 -10.088 119 HB2 LEU 23 HB2 LEU 23 -3.330 -0.814 -7.818 120 HB3 LEU 23 HB1 LEU 23 -4.916 -1.033 -7.111 121 HG LEU 23 HG LEU 23 -4.724 -3.177 -8.826 122 HD11 LEU 23 HD11 LEU 23 -2.321 -2.578 -9.165 123 HD12 LEU 23 HD12 LEU 23 -2.600 -4.201 -8.535 124 HD13 LEU 23 HD13 LEU 23 -2.067 -2.915 -7.453 125 HD21 LEU 23 HD21 LEU 23 -4.065 -2.966 -5.895 126 HD22 LEU 23 HD22 LEU 23 -4.349 -4.486 -6.742 127 HD23 LEU 23 HD23 LEU 23 -5.644 -3.294 -6.607 128 H ILE 24 HN ILE 24 -6.426 1.038 -7.851 129 HA ILE 24 HA ILE 24 -8.976 -0.337 -7.950 130 HB ILE 24 HB ILE 24 -8.544 2.471 -6.842 131 HG12 ILE 24 HG12 ILE 24 -6.922 1.263 -5.538 132 HG13 ILE 24 HG11 ILE 24 -8.304 1.521 -4.505 133 HG21 ILE 24 HG21 ILE 24 -10.925 1.514 -7.146 134 HG22 ILE 24 HG22 ILE 24 -10.544 2.300 -5.613 135 HG23 ILE 24 HG23 ILE 24 -10.562 0.545 -5.721 136 HD11 ILE 24 HD11 ILE 24 -7.304 -1.069 -5.683 137 HD12 ILE 24 HD12 ILE 24 -8.908 -0.923 -4.964 138 HD13 ILE 24 HD13 ILE 24 -7.472 -0.624 -3.983 139 H GLU 25 HN GLU 25 -7.537 2.549 -9.541 140 HA GLU 25 HA GLU 25 -9.854 3.531 -10.878 141 HB2 GLU 25 HB2 GLU 25 -7.255 4.395 -10.492 142 HB3 GLU 25 HB1 GLU 25 -7.343 4.121 -12.224 143 HG2 GLU 25 HG2 GLU 25 -9.282 5.594 -12.374 144 HG3 GLU 25 HG1 GLU 25 -9.228 5.849 -10.630 145 H GLU 26 HN GLU 26 -7.382 1.159 -11.816 146 HA GLU 26 HA GLU 26 -8.221 0.802 -14.557 147 HB2 GLU 26 HB2 GLU 26 -6.226 -0.523 -12.756 148 HB3 GLU 26 HB1 GLU 26 -6.650 -1.228 -14.289 149 HG2 GLU 26 HG2 GLU 26 -5.889 0.765 -15.469 150 HG3 GLU 26 HG1 GLU 26 -5.490 1.522 -13.928 151 H MET 27 HN MET 27 -9.093 -0.528 -11.459 152 HA MET 27 HA MET 27 -10.373 -2.881 -12.623 153 HB2 MET 27 HB2 MET 27 -8.724 -2.616 -10.378 154 HB3 MET 27 HB1 MET 27 -10.341 -2.814 -9.712 155 HG2 MET 27 HG2 MET 27 -9.449 -4.985 -9.848 156 HG3 MET 27 HG1 MET 27 -10.549 -4.856 -11.222 157 HE1 MET 27 HE1 MET 27 -9.097 -7.173 -11.719 158 HE2 MET 27 HE2 MET 27 -8.088 -6.969 -13.152 159 HE3 MET 27 HE3 MET 27 -9.740 -6.355 -13.142 160 H LEU 28 HN LEU 28 -11.340 0.097 -12.369 161 HA LEU 28 HA LEU 28 -13.855 -0.264 -10.907 162 HB2 LEU 28 HB2 LEU 28 -12.092 1.814 -10.899 163 HB3 LEU 28 HB1 LEU 28 -13.240 2.383 -12.093 164 HG LEU 28 HG LEU 28 -14.869 1.574 -9.993 165 HD11 LEU 28 HD11 LEU 28 -12.786 1.350 -8.629 166 HD12 LEU 28 HD12 LEU 28 -13.980 2.481 -7.990 167 HD13 LEU 28 HD13 LEU 28 -12.548 3.087 -8.823 168 HD21 LEU 28 HD21 LEU 28 -15.224 3.535 -11.323 169 HD22 LEU 28 HD22 LEU 28 -13.772 4.294 -10.665 170 HD23 LEU 28 HD23 LEU 28 -15.161 3.988 -9.622 171 H ILE 29 HN ILE 29 -13.094 -1.233 -13.748 172 HA ILE 29 HA ILE 29 -15.097 -0.040 -15.493 173 HB ILE 29 HB ILE 29 -14.160 -1.763 -17.190 174 HG12 ILE 29 HG12 ILE 29 -11.470 -1.789 -16.138 175 HG13 ILE 29 HG11 ILE 29 -12.533 -2.604 -14.998 176 HG21 ILE 29 HG21 ILE 29 -12.546 0.547 -16.166 177 HG22 ILE 29 HG22 ILE 29 -13.774 0.564 -17.430 178 HG23 ILE 29 HG23 ILE 29 -12.236 -0.256 -17.704 179 HD11 ILE 29 HD11 ILE 29 -11.556 -4.185 -16.560 180 HD12 ILE 29 HD12 ILE 29 -12.216 -3.274 -17.919 181 HD13 ILE 29 HD13 ILE 29 -13.302 -4.087 -16.793 182 H ILE 30 HN ILE 30 -15.401 -2.184 -13.119 183 HA ILE 30 HA ILE 30 -17.205 -4.105 -14.459 184 HB ILE 30 HB ILE 30 -16.390 -4.523 -11.556 185 HG12 ILE 30 HG12 ILE 30 -14.702 -6.164 -13.243 186 HG13 ILE 30 HG11 ILE 30 -14.414 -4.468 -13.612 187 HG21 ILE 30 HG21 ILE 30 -16.899 -6.560 -13.749 188 HG22 ILE 30 HG22 ILE 30 -18.127 -5.976 -12.626 189 HG23 ILE 30 HG23 ILE 30 -16.738 -6.879 -12.021 190 HD11 ILE 30 HD11 ILE 30 -12.908 -5.422 -11.878 191 HD12 ILE 30 HD12 ILE 30 -14.315 -5.612 -10.831 192 HD13 ILE 30 HD13 ILE 30 -13.813 -4.003 -11.352 193 H GLU 31 HN GLU 31 -19.302 -4.331 -13.862 194 HA GLU 31 HA GLU 31 -20.636 -2.130 -12.529 195 HB2 GLU 31 HB2 GLU 31 -21.602 -4.508 -14.093 196 HB3 GLU 31 HB1 GLU 31 -22.733 -3.561 -13.136 197 HG2 GLU 31 HG2 GLU 31 -22.125 -1.557 -14.388 198 HG3 GLU 31 HG1 GLU 31 -20.985 -2.499 -15.347 199 H ASN 32 HN ASN 32 -19.573 -5.242 -11.551 200 HA ASN 32 HA ASN 32 -21.382 -5.577 -9.296 201 HB2 ASN 32 HB2 ASN 32 -19.171 -7.183 -10.522 202 HB3 ASN 32 HB1 ASN 32 -19.644 -7.514 -8.859 203 HD21 ASN 32 HD21 ASN 32 -21.819 -8.147 -8.443 204 HD22 ASN 32 HD22 ASN 32 -22.748 -8.932 -9.669 205 H PHE 33 HN PHE 33 -18.463 -3.929 -9.900 206 HA PHE 33 HA PHE 33 -16.979 -3.983 -7.546 207 HB2 PHE 33 HB2 PHE 33 -16.518 -2.745 -9.807 208 HB3 PHE 33 HB1 PHE 33 -17.241 -1.374 -9.008 209 HD1 PHE 33 HD2 PHE 33 -14.343 -3.706 -8.918 210 HD2 PHE 33 HD1 PHE 33 -16.058 -0.139 -7.328 211 HE1 PHE 33 HE2 PHE 33 -12.215 -3.162 -7.816 212 HE2 PHE 33 HE1 PHE 33 -13.921 0.392 -6.234 213 HZ PHE 33 HZ PHE 33 -12.006 -1.124 -6.486 214 H GLU 34 HN GLU 34 -19.835 -2.003 -8.223 215 HA GLU 34 HA GLU 34 -19.964 -0.397 -5.893 216 HB2 GLU 34 HB2 GLU 34 -22.038 -1.408 -7.809 217 HB3 GLU 34 HB1 GLU 34 -22.522 -0.504 -6.382 218 HG2 GLU 34 HG2 GLU 34 -21.119 1.378 -7.117 219 HG3 GLU 34 HG1 GLU 34 -20.678 0.465 -8.559 220 H GLU 35 HN GLU 35 -20.853 -3.742 -6.429 221 HA GLU 35 HA GLU 35 -22.173 -4.175 -3.863 222 HB2 GLU 35 HB2 GLU 35 -21.590 -5.915 -6.239 223 HB3 GLU 35 HB1 GLU 35 -22.022 -6.645 -4.701 224 HG2 GLU 35 HG2 GLU 35 -24.129 -5.427 -4.699 225 HG3 GLU 35 HG1 GLU 35 -23.696 -4.664 -6.229 226 H ILE 36 HN ILE 36 -19.043 -4.917 -5.388 227 HA ILE 36 HA ILE 36 -17.982 -6.569 -3.275 228 HB ILE 36 HB ILE 36 -16.316 -5.309 -5.532 229 HG12 ILE 36 HG12 ILE 36 -17.010 -8.199 -5.694 230 HG13 ILE 36 HG11 ILE 36 -18.358 -7.109 -5.972 231 HG21 ILE 36 HG21 ILE 36 -15.288 -6.490 -3.339 232 HG22 ILE 36 HG22 ILE 36 -14.541 -6.709 -4.925 233 HG23 ILE 36 HG23 ILE 36 -15.614 -7.951 -4.277 234 HD11 ILE 36 HD11 ILE 36 -16.947 -8.001 -7.979 235 HD12 ILE 36 HD12 ILE 36 -15.821 -6.723 -7.520 236 HD13 ILE 36 HD13 ILE 36 -17.480 -6.320 -7.962 237 H VAL 37 HN VAL 37 -17.659 -3.118 -4.129 238 HA VAL 37 HA VAL 37 -15.657 -2.387 -2.268 239 HB VAL 37 HB VAL 37 -16.357 -1.252 -4.451 240 HG11 VAL 37 HG11 VAL 37 -17.856 0.565 -4.546 241 HG12 VAL 37 HG12 VAL 37 -18.180 0.500 -2.814 242 HG13 VAL 37 HG13 VAL 37 -18.747 -0.796 -3.867 243 HG21 VAL 37 HG21 VAL 37 -14.532 -0.338 -3.270 244 HG22 VAL 37 HG22 VAL 37 -15.584 0.404 -2.063 245 HG23 VAL 37 HG23 VAL 37 -15.578 1.010 -3.719 246 H LYS 38 HN LYS 38 -19.013 -2.943 -1.750 247 HA LYS 38 HA LYS 38 -19.293 -1.468 0.737 248 HB2 LYS 38 HB2 LYS 38 -21.116 -3.237 -0.875 249 HB3 LYS 38 HB1 LYS 38 -21.545 -2.778 0.765 250 HG2 LYS 38 HG2 LYS 38 -21.524 -0.440 0.159 251 HG3 LYS 38 HG1 LYS 38 -20.963 -0.840 -1.465 252 HD2 LYS 38 HD2 LYS 38 -23.040 -2.096 -1.855 253 HD3 LYS 38 HD1 LYS 38 -23.606 -1.638 -0.245 254 HE2 LYS 38 HE2 LYS 38 -23.504 0.716 -0.872 255 HE3 LYS 38 HE1 LYS 38 -22.907 0.274 -2.471 256 HZ1 LYS 38 HZ1 LYS 38 -25.584 0.328 -1.487 257 HZ2 LYS 38 HZ2 LYS 38 -25.206 -1.169 -2.176 258 HZ3 LYS 38 HZ3 LYS 38 -25.026 0.247 -3.082 259 H ASP 39 HN ASP 39 -18.211 -4.619 -0.139 260 HA ASP 39 HA ASP 39 -18.316 -5.571 2.630 261 HB2 ASP 39 HB2 ASP 39 -19.180 -6.946 0.133 262 HB3 ASP 39 HB1 ASP 39 -18.321 -7.928 1.313 263 H ARG 40 HN ARG 40 -16.321 -5.388 3.353 264 HA ARG 40 HA ARG 40 -13.859 -5.538 2.096 265 HB2 ARG 40 HB2 ARG 40 -14.686 -6.088 4.929 266 HB3 ARG 40 HB1 ARG 40 -13.000 -6.151 4.442 267 HG2 ARG 40 HG2 ARG 40 -12.876 -3.839 4.118 268 HG3 ARG 40 HG1 ARG 40 -14.607 -3.712 3.810 269 HD2 ARG 40 HD2 ARG 40 -13.728 -4.569 6.519 270 HD3 ARG 40 HD1 ARG 40 -13.602 -2.857 6.101 271 HE ARG 40 HE ARG 40 -16.146 -3.557 5.385 272 HH11 ARG 40 HH11 ARG 40 -14.483 -3.686 8.548 273 HH12 ARG 40 HH12 ARG 40 -15.968 -3.554 9.428 274 HH21 ARG 40 HH21 ARG 40 -18.012 -3.396 6.605 275 HH22 ARG 40 HH22 ARG 40 -17.942 -3.392 8.336 276 H GLU 41 HN GLU 41 -15.738 -8.244 3.410 277 HA GLU 41 HA GLU 41 -13.830 -10.331 3.173 278 HB2 GLU 41 HB2 GLU 41 -16.371 -9.967 4.205 279 HB3 GLU 41 HB1 GLU 41 -16.608 -11.139 2.923 280 HG2 GLU 41 HG2 GLU 41 -14.848 -12.548 3.941 281 HG3 GLU 41 HG1 GLU 41 -14.721 -11.379 5.255 282 H ARG 42 HN ARG 42 -16.116 -8.942 0.872 283 HA ARG 42 HA ARG 42 -15.845 -10.982 -1.170 284 HB2 ARG 42 HB2 ARG 42 -17.349 -8.407 -0.946 285 HB3 ARG 42 HB1 ARG 42 -17.057 -9.083 -2.540 286 HG2 ARG 42 HG2 ARG 42 -18.166 -11.162 -1.851 287 HG3 ARG 42 HG1 ARG 42 -18.488 -10.449 -0.268 288 HD2 ARG 42 HD2 ARG 42 -19.834 -8.699 -1.318 289 HD3 ARG 42 HD1 ARG 42 -19.481 -9.361 -2.909 290 HE ARG 42 HE ARG 42 -20.702 -11.266 -1.146 291 HH11 ARG 42 HH11 ARG 42 -21.617 -8.678 -3.453 292 HH12 ARG 42 HH12 ARG 42 -23.198 -9.344 -3.693 293 HH21 ARG 42 HH21 ARG 42 -22.770 -12.038 -1.532 294 HH22 ARG 42 HH22 ARG 42 -23.835 -11.213 -2.622 295 H PHE 43 HN PHE 43 -14.457 -7.778 -0.504 296 HA PHE 43 HA PHE 43 -13.133 -7.426 -3.031 297 HB2 PHE 43 HB2 PHE 43 -13.845 -5.599 -1.252 298 HB3 PHE 43 HB1 PHE 43 -12.248 -5.914 -0.587 299 HD1 PHE 43 HD1 PHE 43 -10.218 -5.372 -1.915 300 HD2 PHE 43 HD2 PHE 43 -14.117 -4.368 -3.304 301 HE1 PHE 43 HE1 PHE 43 -9.229 -3.819 -3.540 302 HE2 PHE 43 HE2 PHE 43 -13.123 -2.822 -4.950 303 HZ PHE 43 HZ PHE 43 -10.684 -2.546 -5.061 304 H LEU 44 HN LEU 44 -12.041 -8.601 0.187 305 HA LEU 44 HA LEU 44 -9.250 -8.820 -0.384 306 HB2 LEU 44 HB2 LEU 44 -11.055 -9.875 1.754 307 HB3 LEU 44 HB1 LEU 44 -9.437 -10.532 1.605 308 HG LEU 44 HG LEU 44 -9.577 -7.586 1.683 309 HD11 LEU 44 HD11 LEU 44 -10.380 -9.272 4.045 310 HD12 LEU 44 HD12 LEU 44 -11.302 -7.981 3.275 311 HD13 LEU 44 HD13 LEU 44 -9.829 -7.600 4.165 312 HD21 LEU 44 HD21 LEU 44 -7.944 -9.494 3.346 313 HD22 LEU 44 HD22 LEU 44 -7.618 -7.796 2.999 314 HD23 LEU 44 HD23 LEU 44 -7.484 -8.998 1.716 315 H ALA 45 HN ALA 45 -11.969 -10.961 -0.803 316 HA ALA 45 HA ALA 45 -10.485 -13.327 -1.608 317 HB1 ALA 45 HB1 ALA 45 -12.650 -14.341 -1.967 318 HB2 ALA 45 HB2 ALA 45 -13.440 -12.770 -1.839 319 HB3 ALA 45 HB3 ALA 45 -12.653 -13.478 -0.428 320 H GLN 46 HN GLN 46 -11.920 -10.548 -3.203 321 HA GLN 46 HA GLN 46 -12.010 -11.617 -5.882 322 HB2 GLN 46 HB2 GLN 46 -13.174 -9.454 -4.593 323 HB3 GLN 46 HB1 GLN 46 -11.994 -8.694 -5.652 324 HG2 GLN 46 HG2 GLN 46 -13.858 -8.731 -7.017 325 HG3 GLN 46 HG1 GLN 46 -13.087 -10.246 -7.478 326 HE21 GLN 46 HE21 GLN 46 -14.215 -12.075 -7.288 327 HE22 GLN 46 HE22 GLN 46 -15.765 -12.224 -6.538 328 H VAL 47 HN VAL 47 -9.727 -9.597 -4.040 329 HA VAL 47 HA VAL 47 -7.933 -8.949 -6.215 330 HB VAL 47 HB VAL 47 -7.307 -8.753 -3.209 331 HG11 VAL 47 HG11 VAL 47 -5.315 -8.579 -4.836 332 HG12 VAL 47 HG12 VAL 47 -5.521 -7.257 -3.687 333 HG13 VAL 47 HG13 VAL 47 -6.031 -7.053 -5.360 334 HG21 VAL 47 HG21 VAL 47 -7.905 -6.415 -3.284 335 HG22 VAL 47 HG22 VAL 47 -9.279 -7.380 -3.823 336 HG23 VAL 47 HG23 VAL 47 -8.285 -6.526 -5.004 337 H GLU 48 HN GLU 48 -8.004 -11.484 -3.696 338 HA GLU 48 HA GLU 48 -5.510 -12.773 -4.264 339 HB2 GLU 48 HB2 GLU 48 -7.949 -13.598 -2.684 340 HB3 GLU 48 HB1 GLU 48 -6.558 -14.653 -2.872 341 HG2 GLU 48 HG2 GLU 48 -5.151 -12.859 -1.842 342 HG3 GLU 48 HG1 GLU 48 -6.631 -11.957 -1.531 343 H GLU 49 HN GLU 49 -8.694 -13.043 -5.669 344 HA GLU 49 HA GLU 49 -8.158 -15.582 -7.039 345 HB2 GLU 49 HB2 GLU 49 -10.636 -13.923 -6.680 346 HB3 GLU 49 HB1 GLU 49 -10.553 -15.140 -7.943 347 HG2 GLU 49 HG2 GLU 49 -10.064 -16.844 -6.226 348 HG3 GLU 49 HG1 GLU 49 -10.250 -15.602 -4.986 349 H PHE 50 HN PHE 50 -8.216 -12.172 -7.706 350 HA PHE 50 HA PHE 50 -8.153 -12.540 -10.622 351 HB2 PHE 50 HB2 PHE 50 -9.213 -10.470 -8.889 352 HB3 PHE 50 HB1 PHE 50 -8.059 -9.784 -10.016 353 HD1 PHE 50 HD2 PHE 50 -8.524 -9.753 -12.415 354 HD2 PHE 50 HD1 PHE 50 -11.319 -11.391 -9.644 355 HE1 PHE 50 HE2 PHE 50 -10.265 -9.711 -14.149 356 HE2 PHE 50 HE1 PHE 50 -13.063 -11.344 -11.376 357 HZ PHE 50 HZ PHE 50 -12.537 -10.511 -13.633 358 H VAL 51 HN VAL 51 -6.512 -11.781 -11.880 359 HA VAL 51 HA VAL 51 -3.957 -11.402 -10.533 360 HB VAL 51 HB VAL 51 -4.459 -13.273 -12.311 361 HG11 VAL 51 HG11 VAL 51 -3.390 -11.281 -14.298 362 HG12 VAL 51 HG12 VAL 51 -5.099 -11.724 -14.198 363 HG13 VAL 51 HG13 VAL 51 -3.887 -12.951 -14.579 364 HG21 VAL 51 HG21 VAL 51 -2.362 -13.183 -11.261 365 HG22 VAL 51 HG22 VAL 51 -1.898 -11.723 -12.134 366 HG23 VAL 51 HG23 VAL 51 -2.034 -13.259 -12.993 367 H PHE 52 HN PHE 52 -2.407 -9.884 -11.345 368 HA PHE 52 HA PHE 52 -3.536 -7.460 -12.564 369 HB2 PHE 52 HB2 PHE 52 -1.711 -7.519 -10.137 370 HB3 PHE 52 HB1 PHE 52 -2.124 -6.066 -11.022 371 HD1 PHE 52 HD2 PHE 52 -4.383 -5.086 -10.841 372 HD2 PHE 52 HD1 PHE 52 -3.298 -8.569 -8.638 373 HE1 PHE 52 HE2 PHE 52 -6.368 -4.804 -9.414 374 HE2 PHE 52 HE1 PHE 52 -5.279 -8.292 -7.219 375 HZ PHE 52 HZ PHE 52 -6.821 -6.410 -7.603 376 H LYS 53 HN LYS 53 -2.248 -6.280 -13.802 377 HA LYS 53 HA LYS 53 0.073 -7.616 -14.981 378 HB2 LYS 53 HB2 LYS 53 -0.272 -5.905 -16.878 379 HB3 LYS 53 HB1 LYS 53 -1.500 -7.138 -16.699 380 HG2 LYS 53 HG2 LYS 53 -2.976 -5.474 -15.595 381 HG3 LYS 53 HG1 LYS 53 -1.738 -4.244 -15.825 382 HD2 LYS 53 HD2 LYS 53 -1.939 -4.493 -18.250 383 HD3 LYS 53 HD1 LYS 53 -3.161 -5.750 -18.021 384 HE2 LYS 53 HE2 LYS 53 -4.595 -4.154 -16.868 385 HE3 LYS 53 HE1 LYS 53 -3.376 -2.898 -17.074 386 HZ1 LYS 53 HZ1 LYS 53 -5.167 -2.778 -18.718 387 HZ2 LYS 53 HZ2 LYS 53 -4.745 -4.310 -19.295 388 HZ3 LYS 53 HZ3 LYS 53 -3.657 -3.022 -19.441 389 H CYS 54 HN CYS 54 2.094 -6.773 -15.125 390 HA CYS 54 HA CYS 54 2.628 -4.375 -13.541 391 HB2 CYS 54 HB2 CYS 54 3.912 -6.492 -13.006 392 HB3 CYS 54 HB1 CYS 54 4.738 -6.307 -14.554 393 HA PRO 55 HA PRO 55 3.204 -2.208 -17.563 394 HB2 PRO 55 HB2 PRO 55 3.400 0.355 -16.659 395 HB3 PRO 55 HB1 PRO 55 1.854 -0.489 -16.772 396 HG2 PRO 55 HG2 PRO 55 3.564 0.032 -14.356 397 HG3 PRO 55 HG1 PRO 55 1.795 0.080 -14.498 398 HD2 PRO 55 HD2 PRO 55 3.208 -2.056 -13.441 399 HD3 PRO 55 HD1 PRO 55 1.598 -2.205 -14.162 400 H VAL 56 HN VAL 56 5.440 -2.648 -15.126 401 HA VAL 56 HA VAL 56 7.662 -1.054 -16.155 402 HB VAL 56 HB VAL 56 8.089 -2.920 -13.813 403 HG11 VAL 56 HG11 VAL 56 9.523 -1.178 -12.976 404 HG12 VAL 56 HG12 VAL 56 8.943 -0.051 -14.202 405 HG13 VAL 56 HG13 VAL 56 9.897 -1.455 -14.679 406 HG21 VAL 56 HG21 VAL 56 6.291 -0.505 -13.663 407 HG22 VAL 56 HG22 VAL 56 7.293 -0.941 -12.285 408 HG23 VAL 56 HG23 VAL 56 6.093 -2.078 -12.891 409 H CYS 57 HN CYS 57 6.948 -4.528 -15.503 410 HA CYS 57 HA CYS 57 9.172 -5.297 -17.256 411 HB2 CYS 57 HB2 CYS 57 9.008 -7.548 -16.213 412 HB3 CYS 57 HB1 CYS 57 9.373 -6.266 -15.076 413 H GLY 58 HN GLY 58 5.745 -6.209 -16.630 414 HA2 GLY 58 HA2 GLY 58 4.227 -6.167 -18.619 415 HA3 GLY 58 HA1 GLY 58 5.505 -7.008 -19.476 416 H GLU 59 HN GLU 59 5.617 -8.321 -16.483 417 HA GLU 59 HA GLU 59 3.996 -10.650 -17.174 418 HB2 GLU 59 HB2 GLU 59 6.346 -10.173 -15.392 419 HB3 GLU 59 HB1 GLU 59 5.265 -11.501 -14.993 420 HG2 GLU 59 HG2 GLU 59 5.602 -12.419 -17.261 421 HG3 GLU 59 HG1 GLU 59 6.744 -11.116 -17.590 422 H GLU 60 HN GLU 60 2.495 -11.603 -15.815 423 HA GLU 60 HA GLU 60 0.989 -9.751 -14.136 424 HB2 GLU 60 HB2 GLU 60 0.335 -12.401 -15.407 425 HB3 GLU 60 HB1 GLU 60 -0.711 -11.677 -14.199 426 HG2 GLU 60 HG2 GLU 60 -1.067 -9.734 -15.605 427 HG3 GLU 60 HG1 GLU 60 0.076 -10.351 -16.790 428 H PHE 61 HN PHE 61 0.475 -9.994 -12.068 429 HA PHE 61 HA PHE 61 1.670 -12.156 -10.501 430 HB2 PHE 61 HB2 PHE 61 2.114 -10.491 -8.668 431 HB3 PHE 61 HB1 PHE 61 3.081 -10.227 -10.101 432 HD1 PHE 61 HD2 PHE 61 2.738 -8.213 -11.477 433 HD2 PHE 61 HD1 PHE 61 0.480 -8.866 -7.927 434 HE1 PHE 61 HE2 PHE 61 2.042 -5.854 -11.490 435 HE2 PHE 61 HE1 PHE 61 -0.223 -6.509 -7.938 436 HZ PHE 61 HZ PHE 61 0.562 -4.996 -9.717 437 H TYR 62 HN TYR 62 0.475 -12.863 -8.706 438 HA TYR 62 HA TYR 62 -2.401 -12.315 -8.861 439 HB2 TYR 62 HB2 TYR 62 -0.799 -14.633 -7.780 440 HB3 TYR 62 HB1 TYR 62 -2.503 -14.457 -7.410 441 HD1 TYR 62 HD2 TYR 62 -4.199 -14.667 -9.272 442 HD2 TYR 62 HD1 TYR 62 -0.051 -15.386 -9.930 443 HE1 TYR 62 HE2 TYR 62 -4.737 -15.836 -11.358 444 HE2 TYR 62 HE1 TYR 62 -0.586 -16.556 -12.022 445 HH TYR 62 HH TYR 62 -2.198 -17.006 -13.519 446 H GLY 63 HN GLY 63 -3.718 -11.991 -7.019 447 HA2 GLY 63 HA2 GLY 63 -2.630 -10.278 -4.962 448 HA3 GLY 63 HA1 GLY 63 -4.305 -10.762 -5.131 449 H LYS 64 HN LYS 64 -2.917 -13.606 -5.168 450 HA LYS 64 HA LYS 64 -3.246 -14.226 -2.342 451 HB2 LYS 64 HB2 LYS 64 -3.935 -15.605 -4.581 452 HB3 LYS 64 HB1 LYS 64 -2.416 -16.393 -4.180 453 HG2 LYS 64 HG2 LYS 64 -3.244 -17.005 -2.004 454 HG3 LYS 64 HG1 LYS 64 -4.724 -16.080 -2.261 455 HD2 LYS 64 HD2 LYS 64 -5.322 -17.564 -4.121 456 HD3 LYS 64 HD1 LYS 64 -3.850 -18.499 -3.847 457 HE2 LYS 64 HE2 LYS 64 -5.897 -18.098 -1.678 458 HE3 LYS 64 HE1 LYS 64 -6.045 -19.406 -2.849 459 HZ1 LYS 64 HZ1 LYS 64 -3.904 -20.259 -2.121 460 HZ2 LYS 64 HZ2 LYS 64 -4.963 -20.137 -0.808 461 HZ3 LYS 64 HZ3 LYS 64 -3.737 -18.989 -1.015 462 H THR 65 HN THR 65 -0.621 -13.631 -4.516 463 HA THR 65 HA THR 65 1.446 -14.895 -2.859 464 HB THR 65 HB THR 65 3.017 -13.985 -4.686 465 HG1 THR 65 HG1 THR 65 0.662 -13.815 -6.242 466 HG21 THR 65 HG21 THR 65 2.386 -16.349 -4.550 467 HG22 THR 65 HG22 THR 65 2.525 -15.823 -6.229 468 HG23 THR 65 HG23 THR 65 0.931 -16.017 -5.494 469 H LEU 66 HN LEU 66 -0.212 -12.088 -2.587 470 HA LEU 66 HA LEU 66 1.956 -10.189 -2.153 471 HB2 LEU 66 HB2 LEU 66 -0.928 -10.007 -2.580 472 HB3 LEU 66 HB1 LEU 66 -0.417 -9.029 -1.226 473 HG LEU 66 HG LEU 66 1.391 -8.306 -3.209 474 HD11 LEU 66 HD11 LEU 66 0.253 -7.951 -5.210 475 HD12 LEU 66 HD12 LEU 66 -1.316 -8.308 -4.490 476 HD13 LEU 66 HD13 LEU 66 -0.159 -9.608 -4.776 477 HD21 LEU 66 HD21 LEU 66 0.053 -6.228 -3.267 478 HD22 LEU 66 HD22 LEU 66 0.388 -6.799 -1.632 479 HD23 LEU 66 HD23 LEU 66 -1.206 -7.052 -2.345 480 HA PRO 67 HA PRO 67 2.309 -10.941 2.344 481 HB2 PRO 67 HB2 PRO 67 3.023 -8.475 3.333 482 HB3 PRO 67 HB1 PRO 67 4.149 -9.551 2.499 483 HG2 PRO 67 HG2 PRO 67 2.615 -7.195 1.401 484 HG3 PRO 67 HG1 PRO 67 4.327 -7.616 1.162 485 HD2 PRO 67 HD2 PRO 67 2.494 -8.178 -0.721 486 HD3 PRO 67 HD1 PRO 67 3.818 -9.307 -0.376 487 H ARG 68 HN ARG 68 1.296 -10.681 4.391 488 HA ARG 68 HA ARG 68 -1.457 -9.994 4.398 489 HB2 ARG 68 HB2 ARG 68 0.454 -10.835 6.530 490 HB3 ARG 68 HB1 ARG 68 -1.160 -10.294 6.971 491 HG2 ARG 68 HG2 ARG 68 -2.147 -12.040 5.587 492 HG3 ARG 68 HG1 ARG 68 -0.541 -12.552 5.064 493 HD2 ARG 68 HD2 ARG 68 0.029 -13.140 7.368 494 HD3 ARG 68 HD1 ARG 68 -1.561 -12.601 7.904 495 HE ARG 68 HE ARG 68 -2.073 -14.500 5.993 496 HH11 ARG 68 HH11 ARG 68 -0.287 -14.686 9.092 497 HH12 ARG 68 HH12 ARG 68 -0.689 -16.355 9.319 498 HH21 ARG 68 HH21 ARG 68 -2.537 -16.661 6.384 499 HH22 ARG 68 HH22 ARG 68 -1.942 -17.450 7.806 500 H ARG 69 HN ARG 69 1.351 -8.203 5.621 501 HA ARG 69 HA ARG 69 0.262 -6.006 6.843 502 HB2 ARG 69 HB2 ARG 69 2.717 -6.201 5.098 503 HB3 ARG 69 HB1 ARG 69 2.296 -4.723 5.948 504 HG2 ARG 69 HG2 ARG 69 2.467 -5.880 8.084 505 HG3 ARG 69 HG1 ARG 69 2.823 -7.391 7.246 506 HD2 ARG 69 HD2 ARG 69 4.869 -6.421 6.333 507 HD3 ARG 69 HD1 ARG 69 4.509 -4.889 7.129 508 HE ARG 69 HE ARG 69 4.520 -6.783 9.129 509 HH11 ARG 69 HH11 ARG 69 7.065 -5.650 6.884 510 HH12 ARG 69 HH12 ARG 69 8.329 -5.997 8.015 511 HH21 ARG 69 HH21 ARG 69 6.224 -7.197 10.517 512 HH22 ARG 69 HH22 ARG 69 7.855 -6.861 10.042 513 H GLU 70 HN GLU 70 0.609 -6.401 3.293 514 HA GLU 70 HA GLU 70 -0.466 -3.843 2.564 515 HB2 GLU 70 HB2 GLU 70 0.320 -6.316 1.086 516 HB3 GLU 70 HB1 GLU 70 -0.684 -5.126 0.279 517 HG2 GLU 70 HG2 GLU 70 1.025 -3.405 0.755 518 HG3 GLU 70 HG1 GLU 70 2.041 -4.659 1.463 519 H ALA 71 HN ALA 71 -1.825 -7.013 3.152 520 HA ALA 71 HA ALA 71 -4.408 -6.789 1.994 521 HB1 ALA 71 HB1 ALA 71 -4.978 -8.732 3.313 522 HB2 ALA 71 HB2 ALA 71 -3.543 -8.505 4.313 523 HB3 ALA 71 HB3 ALA 71 -3.372 -8.922 2.608 524 H GLU 72 HN GLU 72 -3.107 -5.835 5.133 525 HA GLU 72 HA GLU 72 -5.544 -5.162 6.485 526 HB2 GLU 72 HB2 GLU 72 -2.641 -4.672 7.023 527 HB3 GLU 72 HB1 GLU 72 -3.857 -3.820 7.963 528 HG2 GLU 72 HG2 GLU 72 -4.828 -5.989 8.628 529 HG3 GLU 72 HG1 GLU 72 -3.546 -6.808 7.736 530 H LYS 73 HN LYS 73 -3.455 -3.455 4.280 531 HA LYS 73 HA LYS 73 -4.354 -0.759 4.694 532 HB2 LYS 73 HB2 LYS 73 -2.759 -2.104 2.532 533 HB3 LYS 73 HB1 LYS 73 -3.324 -0.453 2.328 534 HG2 LYS 73 HG2 LYS 73 -2.108 0.225 4.329 535 HG3 LYS 73 HG1 LYS 73 -1.560 -1.437 4.564 536 HD2 LYS 73 HD2 LYS 73 -0.373 -1.350 2.422 537 HD3 LYS 73 HD1 LYS 73 -0.938 0.304 2.174 538 HE2 LYS 73 HE2 LYS 73 0.265 1.018 4.180 539 HE3 LYS 73 HE1 LYS 73 0.827 -0.633 4.436 540 HZ1 LYS 73 HZ1 LYS 73 1.864 1.383 2.701 541 HZ2 LYS 73 HZ2 LYS 73 1.547 -0.051 1.863 542 HZ3 LYS 73 HZ3 LYS 73 2.574 -0.069 3.207 543 H VAL 74 HN VAL 74 -5.530 -3.442 2.808 544 HA VAL 74 HA VAL 74 -7.189 -2.151 0.878 545 HB VAL 74 HB VAL 74 -7.803 -4.954 1.920 546 HG11 VAL 74 HG11 VAL 74 -8.073 -3.748 -0.846 547 HG12 VAL 74 HG12 VAL 74 -9.386 -4.164 0.259 548 HG13 VAL 74 HG13 VAL 74 -8.381 -5.437 -0.436 549 HG21 VAL 74 HG21 VAL 74 -6.167 -6.004 0.580 550 HG22 VAL 74 HG22 VAL 74 -5.304 -4.681 1.372 551 HG23 VAL 74 HG23 VAL 74 -5.817 -4.516 -0.305 552 H PHE 75 HN PHE 75 -7.862 -3.236 4.255 553 HA PHE 75 HA PHE 75 -10.614 -2.776 4.479 554 HB2 PHE 75 HB2 PHE 75 -8.305 -2.720 6.413 555 HB3 PHE 75 HB1 PHE 75 -9.919 -2.295 6.957 556 HD1 PHE 75 HD1 PHE 75 -7.788 -5.029 5.698 557 HD2 PHE 75 HD2 PHE 75 -11.605 -3.955 7.235 558 HE1 PHE 75 HE1 PHE 75 -8.308 -7.403 6.052 559 HE2 PHE 75 HE2 PHE 75 -12.144 -6.328 7.572 560 HZ PHE 75 HZ PHE 75 -10.494 -8.059 6.982 561 H GLU 76 HN GLU 76 -7.964 -0.445 4.441 562 HA GLU 76 HA GLU 76 -9.181 1.768 5.752 563 HB2 GLU 76 HB2 GLU 76 -6.627 1.180 5.013 564 HB3 GLU 76 HB1 GLU 76 -7.065 2.327 3.754 565 HG2 GLU 76 HG2 GLU 76 -6.241 3.814 5.281 566 HG3 GLU 76 HG1 GLU 76 -7.893 3.718 5.891 567 H LEU 77 HN LEU 77 -8.832 0.935 2.256 568 HA LEU 77 HA LEU 77 -10.083 3.264 1.228 569 HB2 LEU 77 HB2 LEU 77 -10.193 1.943 -0.916 570 HB3 LEU 77 HB1 LEU 77 -8.609 2.169 -0.264 571 HG LEU 77 HG LEU 77 -9.277 -0.310 0.712 572 HD11 LEU 77 HD11 LEU 77 -10.369 -1.603 -0.909 573 HD12 LEU 77 HD12 LEU 77 -10.256 -0.324 -2.124 574 HD13 LEU 77 HD13 LEU 77 -11.348 -0.140 -0.750 575 HD21 LEU 77 HD21 LEU 77 -7.778 0.514 -1.762 576 HD22 LEU 77 HD22 LEU 77 -7.877 -1.166 -1.231 577 HD23 LEU 77 HD23 LEU 77 -7.141 0.044 -0.183 578 H LEU 78 HN LEU 78 -11.318 0.142 2.208 579 HA LEU 78 HA LEU 78 -14.001 0.444 1.185 580 HB2 LEU 78 HB2 LEU 78 -12.585 -1.599 2.864 581 HB3 LEU 78 HB1 LEU 78 -14.330 -1.624 2.717 582 HG LEU 78 HG LEU 78 -13.123 -1.450 0.099 583 HD11 LEU 78 HD11 LEU 78 -12.269 -3.785 1.787 584 HD12 LEU 78 HD12 LEU 78 -11.217 -2.532 1.135 585 HD13 LEU 78 HD13 LEU 78 -12.056 -3.628 0.043 586 HD21 LEU 78 HD21 LEU 78 -14.445 -3.463 -0.285 587 HD22 LEU 78 HD22 LEU 78 -15.379 -2.179 0.481 588 HD23 LEU 78 HD23 LEU 78 -14.812 -3.541 1.434 589 H ASN 79 HN ASN 79 -12.354 1.428 4.067 590 HA ASN 79 HA ASN 79 -14.828 1.855 5.603 591 HB2 ASN 79 HB2 ASN 79 -11.966 1.495 6.359 592 HB3 ASN 79 HB1 ASN 79 -12.950 2.539 7.379 593 HD21 ASN 79 HD21 ASN 79 -12.054 -0.622 6.706 594 HD22 ASN 79 HD22 ASN 79 -13.228 -1.437 7.678 595 H ASP 80 HN ASP 80 -12.632 3.516 3.615 596 HA ASP 80 HA ASP 80 -13.361 6.152 4.653 597 HB2 ASP 80 HB2 ASP 80 -10.868 5.204 3.250 598 HB3 ASP 80 HB1 ASP 80 -11.344 6.893 3.154 599 H PHE 81 HN PHE 81 -15.368 5.495 3.590 600 HA PHE 81 HA PHE 81 -15.687 5.663 0.736 601 HB2 PHE 81 HB2 PHE 81 -17.519 5.452 3.053 602 HB3 PHE 81 HB1 PHE 81 -18.190 6.191 1.607 603 HD1 PHE 81 HD2 PHE 81 -18.440 4.870 -0.467 604 HD2 PHE 81 HD1 PHE 81 -17.005 3.105 3.138 605 HE1 PHE 81 HE2 PHE 81 -18.888 2.635 -1.386 606 HE2 PHE 81 HE1 PHE 81 -17.458 0.870 2.221 607 HZ PHE 81 HZ PHE 81 -18.398 0.632 -0.041 608 H LYS 82 HN LYS 82 -15.558 8.038 3.257 609 HA LYS 82 HA LYS 82 -16.386 10.244 1.494 610 HB2 LYS 82 HB2 LYS 82 -16.343 9.878 4.476 611 HB3 LYS 82 HB1 LYS 82 -16.222 11.500 3.811 612 HG2 LYS 82 HG2 LYS 82 -18.361 11.251 2.708 613 HG3 LYS 82 HG1 LYS 82 -18.463 9.571 3.240 614 HD2 LYS 82 HD2 LYS 82 -18.448 10.336 5.587 615 HD3 LYS 82 HD1 LYS 82 -18.421 12.008 5.025 616 HE2 LYS 82 HE2 LYS 82 -20.601 10.115 4.183 617 HE3 LYS 82 HE1 LYS 82 -20.697 10.990 5.710 618 HZ1 LYS 82 HZ1 LYS 82 -20.129 12.976 4.017 619 HZ2 LYS 82 HZ2 LYS 82 -21.704 12.524 4.436 620 HZ3 LYS 82 HZ3 LYS 82 -21.020 11.963 2.995 621 H GLY 83 HN GLY 83 -14.968 11.752 0.874 622 HA2 GLY 83 HA2 GLY 83 -12.747 12.839 1.933 623 HA3 GLY 83 HA1 GLY 83 -12.137 11.309 1.321 624 H GLY 84 HN GLY 84 -11.841 10.990 -0.824 625 HA2 GLY 84 HA2 GLY 84 -12.611 13.103 -2.729 626 HA3 GLY 84 HA1 GLY 84 -10.935 12.604 -2.627 627 H ILE 85 HN ILE 85 -14.018 10.802 -2.665 628 HA ILE 85 HA ILE 85 -13.101 9.286 -5.039 629 HB ILE 85 HB ILE 85 -15.061 7.995 -3.104 630 HG12 ILE 85 HG12 ILE 85 -12.683 6.708 -2.499 631 HG13 ILE 85 HG11 ILE 85 -12.214 8.406 -2.510 632 HG21 ILE 85 HG21 ILE 85 -14.683 6.957 -5.328 633 HG22 ILE 85 HG22 ILE 85 -14.233 5.888 -3.999 634 HG23 ILE 85 HG23 ILE 85 -12.982 6.732 -4.913 635 HD11 ILE 85 HD11 ILE 85 -14.164 8.822 -0.971 636 HD12 ILE 85 HD12 ILE 85 -12.826 7.889 -0.298 637 HD13 ILE 85 HD13 ILE 85 -14.299 7.070 -0.818 638 H ASP 86 HN ASP 86 -14.265 9.599 -6.744 639 HA ASP 86 HA ASP 86 -17.114 10.325 -6.573 640 HB2 ASP 86 HB2 ASP 86 -14.936 11.584 -8.223 641 HB3 ASP 86 HB1 ASP 86 -16.595 11.575 -8.809 642 H TRP 87 HN TRP 87 -18.476 9.218 -7.792 643 HA TRP 87 HA TRP 87 -17.597 6.912 -9.304 644 HB2 TRP 87 HB2 TRP 87 -20.291 7.946 -8.472 645 HB3 TRP 87 HB1 TRP 87 -20.147 6.626 -9.630 646 HD1 TRP 87 HD1 TRP 87 -20.102 7.371 -5.981 647 HE1 TRP 87 HE1 TRP 87 -19.644 5.249 -4.614 648 HE3 TRP 87 HE3 TRP 87 -18.637 4.186 -9.774 649 HZ2 TRP 87 HZ2 TRP 87 -18.796 2.635 -5.046 650 HZ3 TRP 87 HZ3 TRP 87 -18.010 1.882 -9.172 651 HH2 TRP 87 HH2 TRP 87 -18.086 1.124 -6.851 652 H GLU 88 HN GLU 88 -18.928 10.068 -10.068 653 HA GLU 88 HA GLU 88 -19.414 9.572 -12.879 654 HB2 GLU 88 HB2 GLU 88 -19.672 11.951 -11.072 655 HB3 GLU 88 HB1 GLU 88 -19.709 12.178 -12.815 656 HG2 GLU 88 HG2 GLU 88 -21.621 10.667 -12.978 657 HG3 GLU 88 HG1 GLU 88 -21.570 10.410 -11.234 658 H ASN 89 HN ASN 89 -16.878 11.154 -10.965 659 HA ASN 89 HA ASN 89 -15.346 11.980 -13.319 660 HB2 ASN 89 HB2 ASN 89 -15.401 12.749 -10.482 661 HB3 ASN 89 HB1 ASN 89 -13.790 12.664 -11.177 662 HD21 ASN 89 HD21 ASN 89 -13.314 13.989 -13.005 663 HD22 ASN 89 HD22 ASN 89 -14.195 15.450 -13.274 664 H LYS 90 HN LYS 90 -15.369 9.345 -11.048 665 HA LYS 90 HA LYS 90 -14.135 7.523 -10.589 666 HB2 LYS 90 HB2 LYS 90 -13.309 7.891 -13.474 667 HB3 LYS 90 HB1 LYS 90 -12.721 6.545 -12.515 668 HG2 LYS 90 HG2 LYS 90 -14.947 5.707 -12.221 669 HG3 LYS 90 HG1 LYS 90 -15.636 7.129 -13.004 670 HD2 LYS 90 HD2 LYS 90 -14.510 6.544 -15.086 671 HD3 LYS 90 HD1 LYS 90 -13.777 5.138 -14.313 672 HE2 LYS 90 HE2 LYS 90 -16.758 5.464 -14.357 673 HE3 LYS 90 HE1 LYS 90 -15.919 4.811 -15.763 674 HZ1 LYS 90 HZ1 LYS 90 -15.499 2.883 -14.722 675 HZ2 LYS 90 HZ2 LYS 90 -16.805 3.322 -13.741 676 HZ3 LYS 90 HZ3 LYS 90 -15.222 3.603 -13.216 677 H ARG 91 HN ARG 91 -13.160 9.301 -9.166 678 HA ARG 91 HA ARG 91 -10.220 9.270 -9.381 679 HB2 ARG 91 HB2 ARG 91 -12.056 11.380 -8.259 680 HB3 ARG 91 HB1 ARG 91 -10.360 11.302 -7.802 681 HG2 ARG 91 HG2 ARG 91 -9.696 11.594 -10.122 682 HG3 ARG 91 HG1 ARG 91 -11.390 11.606 -10.618 683 HD2 ARG 91 HD2 ARG 91 -11.769 13.606 -9.273 684 HD3 ARG 91 HD1 ARG 91 -10.078 13.596 -8.775 685 HE ARG 91 HE ARG 91 -10.414 13.642 -11.625 686 HH11 ARG 91 HH11 ARG 91 -10.195 15.870 -8.832 687 HH12 ARG 91 HH12 ARG 91 -9.761 17.213 -9.836 688 HH21 ARG 91 HH21 ARG 91 -9.844 15.427 -12.830 689 HH22 ARG 91 HH22 ARG 91 -9.566 16.959 -12.073 690 H VAL 92 HN VAL 92 -9.105 8.320 -7.908 691 HA VAL 92 HA VAL 92 -10.330 7.544 -5.335 692 HB VAL 92 HB VAL 92 -8.229 5.734 -6.573 693 HG11 VAL 92 HG11 VAL 92 -9.011 4.054 -5.123 694 HG12 VAL 92 HG12 VAL 92 -10.578 4.834 -4.910 695 HG13 VAL 92 HG13 VAL 92 -9.139 5.524 -4.158 696 HG21 VAL 92 HG21 VAL 92 -9.825 4.279 -7.649 697 HG22 VAL 92 HG22 VAL 92 -10.023 5.898 -8.312 698 HG23 VAL 92 HG23 VAL 92 -11.174 5.285 -7.125 699 H LYS 93 HN LYS 93 -9.300 8.277 -3.650 700 HA LYS 93 HA LYS 93 -6.428 8.928 -3.785 701 HB2 LYS 93 HB2 LYS 93 -8.714 10.452 -2.600 702 HB3 LYS 93 HB1 LYS 93 -7.145 10.546 -1.813 703 HG2 LYS 93 HG2 LYS 93 -6.139 11.370 -3.867 704 HG3 LYS 93 HG1 LYS 93 -7.693 11.230 -4.695 705 HD2 LYS 93 HD2 LYS 93 -8.662 12.876 -3.203 706 HD3 LYS 93 HD1 LYS 93 -7.160 12.972 -2.290 707 HE2 LYS 93 HE2 LYS 93 -6.016 13.821 -4.281 708 HE3 LYS 93 HE1 LYS 93 -7.528 13.731 -5.185 709 HZ1 LYS 93 HZ1 LYS 93 -8.491 15.331 -3.636 710 HZ2 LYS 93 HZ2 LYS 93 -7.129 15.970 -4.407 711 HZ3 LYS 93 HZ3 LYS 93 -7.020 15.436 -2.806 712 H LEU 94 HN LEU 94 -5.141 8.077 -2.338 713 HA LEU 94 HA LEU 94 -6.233 6.559 -0.074 714 HB2 LEU 94 HB2 LEU 94 -4.081 5.861 -2.039 715 HB3 LEU 94 HB1 LEU 94 -4.046 5.179 -0.427 716 HG LEU 94 HG LEU 94 -6.654 4.856 -1.693 717 HD11 LEU 94 HD11 LEU 94 -5.600 4.662 -3.771 718 HD12 LEU 94 HD12 LEU 94 -5.788 3.003 -3.205 719 HD13 LEU 94 HD13 LEU 94 -4.220 3.798 -3.093 720 HD21 LEU 94 HD21 LEU 94 -4.665 2.877 -0.575 721 HD22 LEU 94 HD22 LEU 94 -6.353 2.549 -0.957 722 HD23 LEU 94 HD23 LEU 94 -5.947 3.678 0.336 723 H LYS 95 HN LYS 95 -5.430 6.919 1.832 724 HA LYS 95 HA LYS 95 -3.164 8.767 2.167 725 HB2 LYS 95 HB2 LYS 95 -5.800 8.586 3.432 726 HB3 LYS 95 HB1 LYS 95 -4.479 8.774 4.578 727 HG2 LYS 95 HG2 LYS 95 -3.751 10.789 3.485 728 HG3 LYS 95 HG1 LYS 95 -4.953 10.572 2.212 729 HD2 LYS 95 HD2 LYS 95 -6.745 10.814 3.861 730 HD3 LYS 95 HD1 LYS 95 -5.544 11.019 5.139 731 HE2 LYS 95 HE2 LYS 95 -4.716 13.039 4.034 732 HE3 LYS 95 HE1 LYS 95 -5.912 12.831 2.754 733 HZ1 LYS 95 HZ1 LYS 95 -7.638 13.383 4.161 734 HZ2 LYS 95 HZ2 LYS 95 -6.416 14.426 4.690 735 HZ3 LYS 95 HZ3 LYS 95 -6.768 13.023 5.566 Start of MODEL 8 1 H1 MET 8 HT1 MET 8 1.142 1.185 -0.136 2 H2 MET 8 HT2 MET 8 2.245 0.191 0.674 3 H3 MET 8 HT3 MET 8 0.899 -0.488 -0.092 4 HA MET 8 HA MET 8 1.823 0.538 -2.211 5 HB2 MET 8 HB2 MET 8 4.074 0.823 -0.264 6 HB3 MET 8 HB1 MET 8 4.466 0.373 -1.918 7 HG2 MET 8 HG2 MET 8 4.681 2.725 -1.772 8 HG3 MET 8 HG1 MET 8 3.192 2.417 -2.662 9 HE1 MET 8 HE1 MET 8 1.582 4.255 -2.370 10 HE2 MET 8 HE2 MET 8 3.030 5.192 -1.999 11 HE3 MET 8 HE3 MET 8 1.589 5.361 -0.996 12 H ALA 9 HN ALA 9 2.119 -1.016 -3.618 13 HA ALA 9 HA ALA 9 2.795 -3.733 -2.698 14 HB1 ALA 9 HB1 ALA 9 0.561 -3.567 -3.620 15 HB2 ALA 9 HB2 ALA 9 1.581 -4.515 -4.700 16 HB3 ALA 9 HB3 ALA 9 1.194 -2.842 -5.099 17 H LYS 10 HN LYS 10 4.369 -4.881 -3.648 18 HA LYS 10 HA LYS 10 6.065 -3.582 -5.669 19 HB2 LYS 10 HB2 LYS 10 6.729 -5.173 -3.229 20 HB3 LYS 10 HB1 LYS 10 7.792 -5.303 -4.623 21 HG2 LYS 10 HG2 LYS 10 8.180 -2.911 -4.584 22 HG3 LYS 10 HG1 LYS 10 7.058 -2.734 -3.233 23 HD2 LYS 10 HD2 LYS 10 8.494 -4.094 -1.827 24 HD3 LYS 10 HD1 LYS 10 9.589 -4.378 -3.181 25 HE2 LYS 10 HE2 LYS 10 10.073 -1.981 -3.286 26 HE3 LYS 10 HE1 LYS 10 8.982 -1.701 -1.930 27 HZ1 LYS 10 HZ1 LYS 10 10.402 -2.981 -0.511 28 HZ2 LYS 10 HZ2 LYS 10 11.342 -1.806 -1.284 29 HZ3 LYS 10 HZ3 LYS 10 11.403 -3.415 -1.805 30 H CYS 11 HN CYS 11 6.673 -4.678 -7.447 31 HA CYS 11 HA CYS 11 5.201 -6.965 -8.311 32 HB2 CYS 11 HB2 CYS 11 6.107 -5.125 -9.839 33 HB3 CYS 11 HB1 CYS 11 7.674 -5.891 -9.692 34 HA PRO 12 HA PRO 12 8.153 -10.104 -6.646 35 HB2 PRO 12 HB2 PRO 12 6.939 -12.400 -7.476 36 HB3 PRO 12 HB1 PRO 12 6.386 -11.479 -6.074 37 HG2 PRO 12 HG2 PRO 12 5.273 -11.536 -8.870 38 HG3 PRO 12 HG1 PRO 12 4.400 -11.503 -7.325 39 HD2 PRO 12 HD2 PRO 12 4.790 -9.271 -8.881 40 HD3 PRO 12 HD1 PRO 12 4.619 -9.200 -7.119 41 H ILE 13 HN ILE 13 7.501 -9.541 -10.001 42 HA ILE 13 HA ILE 13 9.360 -11.492 -11.075 43 HB ILE 13 HB ILE 13 7.763 -9.415 -12.654 44 HG12 ILE 13 HG12 ILE 13 6.506 -11.953 -12.981 45 HG13 ILE 13 HG11 ILE 13 6.660 -11.691 -11.248 46 HG21 ILE 13 HG21 ILE 13 9.587 -10.656 -13.870 47 HG22 ILE 13 HG22 ILE 13 7.985 -10.862 -14.570 48 HG23 ILE 13 HG23 ILE 13 8.687 -12.149 -13.593 49 HD11 ILE 13 HD11 ILE 13 4.519 -10.908 -12.187 50 HD12 ILE 13 HD12 ILE 13 5.406 -9.742 -13.166 51 HD13 ILE 13 HD13 ILE 13 5.443 -9.623 -11.407 52 H CYS 14 HN CYS 14 8.991 -7.844 -11.062 53 HA CYS 14 HA CYS 14 11.785 -7.652 -11.962 54 HB2 CYS 14 HB2 CYS 14 11.261 -5.394 -12.770 55 HB3 CYS 14 HB1 CYS 14 10.209 -6.597 -13.492 56 H GLY 15 HN GLY 15 9.486 -6.353 -9.575 57 HA2 GLY 15 HA2 GLY 15 10.014 -5.976 -7.274 58 HA3 GLY 15 HA1 GLY 15 11.698 -5.772 -7.717 59 H SER 16 HN SER 16 9.129 -4.182 -9.486 60 HA SER 16 HA SER 16 10.163 -1.555 -8.797 61 HB2 SER 16 HB2 SER 16 9.296 -2.626 -11.127 62 HB3 SER 16 HB1 SER 16 7.859 -1.741 -10.612 63 HG SER 16 HG SER 16 10.217 -0.797 -11.577 64 HA PRO 17 HA PRO 17 6.672 -0.529 -5.928 65 HB2 PRO 17 HB2 PRO 17 6.936 2.335 -6.650 66 HB3 PRO 17 HB1 PRO 17 7.099 1.577 -5.061 67 HG2 PRO 17 HG2 PRO 17 9.261 2.494 -6.304 68 HG3 PRO 17 HG1 PRO 17 9.321 0.923 -5.471 69 HD2 PRO 17 HD2 PRO 17 8.911 1.467 -8.415 70 HD3 PRO 17 HD1 PRO 17 10.083 0.387 -7.634 71 H LEU 18 HN LEU 18 4.546 -0.388 -6.037 72 HA LEU 18 HA LEU 18 3.211 0.671 -8.445 73 HB2 LEU 18 HB2 LEU 18 2.610 -1.804 -6.834 74 HB3 LEU 18 HB1 LEU 18 1.391 -1.045 -7.845 75 HG LEU 18 HG LEU 18 3.871 -1.543 -9.297 76 HD11 LEU 18 HD11 LEU 18 3.577 -3.991 -9.407 77 HD12 LEU 18 HD12 LEU 18 2.411 -3.886 -8.088 78 HD13 LEU 18 HD13 LEU 18 4.094 -3.432 -7.816 79 HD21 LEU 18 HD21 LEU 18 1.659 -0.954 -10.268 80 HD22 LEU 18 HD22 LEU 18 1.055 -2.526 -9.743 81 HD23 LEU 18 HD23 LEU 18 2.352 -2.432 -10.935 82 H LYS 19 HN LYS 19 1.344 1.796 -8.205 83 HA LYS 19 HA LYS 19 0.786 2.897 -5.551 84 HB2 LYS 19 HB2 LYS 19 0.288 3.823 -8.359 85 HB3 LYS 19 HB1 LYS 19 -0.711 4.459 -7.062 86 HG2 LYS 19 HG2 LYS 19 1.249 5.325 -5.935 87 HG3 LYS 19 HG1 LYS 19 2.297 4.614 -7.164 88 HD2 LYS 19 HD2 LYS 19 1.270 6.030 -8.867 89 HD3 LYS 19 HD1 LYS 19 0.195 6.725 -7.651 90 HE2 LYS 19 HE2 LYS 19 2.130 7.602 -6.444 91 HE3 LYS 19 HE1 LYS 19 3.206 6.903 -7.653 92 HZ1 LYS 19 HZ1 LYS 19 1.887 8.305 -9.302 93 HZ2 LYS 19 HZ2 LYS 19 2.977 9.110 -8.290 94 HZ3 LYS 19 HZ3 LYS 19 1.320 9.155 -7.952 95 H TRP 20 HN TRP 20 -1.023 2.570 -4.442 96 HA TRP 20 HA TRP 20 -2.910 0.551 -5.135 97 HB2 TRP 20 HB2 TRP 20 -2.564 2.387 -2.815 98 HB3 TRP 20 HB1 TRP 20 -4.102 1.548 -3.011 99 HD1 TRP 20 HD1 TRP 20 -0.536 1.009 -1.938 100 HE1 TRP 20 HE1 TRP 20 -0.202 -1.410 -1.128 101 HE3 TRP 20 HE3 TRP 20 -5.031 -1.052 -3.431 102 HZ2 TRP 20 HZ2 TRP 20 -1.609 -3.835 -1.114 103 HZ3 TRP 20 HZ3 TRP 20 -5.424 -3.433 -2.966 104 HH2 TRP 20 HH2 TRP 20 -3.745 -4.793 -1.830 105 H GLU 21 HN GLU 21 -2.937 4.012 -5.526 106 HA GLU 21 HA GLU 21 -5.727 4.463 -6.013 107 HB2 GLU 21 HB2 GLU 21 -3.227 6.055 -6.511 108 HB3 GLU 21 HB1 GLU 21 -4.767 6.597 -7.158 109 HG2 GLU 21 HG2 GLU 21 -5.694 6.652 -4.889 110 HG3 GLU 21 HG1 GLU 21 -4.137 6.127 -4.250 111 H GLU 22 HN GLU 22 -3.001 3.532 -8.079 112 HA GLU 22 HA GLU 22 -4.268 3.927 -10.639 113 HB2 GLU 22 HB2 GLU 22 -1.721 2.642 -9.726 114 HB3 GLU 22 HB1 GLU 22 -2.296 2.357 -11.361 115 HG2 GLU 22 HG2 GLU 22 -2.290 4.771 -11.775 116 HG3 GLU 22 HG1 GLU 22 -1.685 5.042 -10.142 117 H LEU 23 HN LEU 23 -3.921 1.193 -8.425 118 HA LEU 23 HA LEU 23 -4.844 -0.935 -10.058 119 HB2 LEU 23 HB2 LEU 23 -4.510 -0.512 -7.121 120 HB3 LEU 23 HB1 LEU 23 -5.379 -1.925 -7.681 121 HG LEU 23 HG LEU 23 -2.817 -1.591 -9.029 122 HD11 LEU 23 HD11 LEU 23 -1.516 -2.349 -7.015 123 HD12 LEU 23 HD12 LEU 23 -2.887 -1.853 -6.022 124 HD13 LEU 23 HD13 LEU 23 -2.018 -0.661 -6.993 125 HD21 LEU 23 HD21 LEU 23 -2.622 -3.933 -8.526 126 HD22 LEU 23 HD22 LEU 23 -4.269 -3.604 -9.059 127 HD23 LEU 23 HD23 LEU 23 -3.929 -3.834 -7.344 128 H ILE 24 HN ILE 24 -6.597 1.245 -7.849 129 HA ILE 24 HA ILE 24 -9.172 -0.055 -8.115 130 HB ILE 24 HB ILE 24 -8.760 2.704 -6.918 131 HG12 ILE 24 HG12 ILE 24 -7.185 1.500 -5.570 132 HG13 ILE 24 HG11 ILE 24 -8.615 1.694 -4.592 133 HG21 ILE 24 HG21 ILE 24 -10.885 0.668 -6.205 134 HG22 ILE 24 HG22 ILE 24 -11.106 2.048 -7.278 135 HG23 ILE 24 HG23 ILE 24 -10.751 2.311 -5.571 136 HD11 ILE 24 HD11 ILE 24 -9.134 -0.717 -5.022 137 HD12 ILE 24 HD12 ILE 24 -7.637 -0.445 -4.144 138 HD13 ILE 24 HD13 ILE 24 -7.590 -0.856 -5.858 139 H GLU 25 HN GLU 25 -7.639 2.903 -9.485 140 HA GLU 25 HA GLU 25 -9.879 3.937 -10.899 141 HB2 GLU 25 HB2 GLU 25 -7.306 4.787 -10.330 142 HB3 GLU 25 HB1 GLU 25 -7.311 4.619 -12.079 143 HG2 GLU 25 HG2 GLU 25 -9.356 6.028 -12.156 144 HG3 GLU 25 HG1 GLU 25 -9.200 6.277 -10.418 145 H GLU 26 HN GLU 26 -7.265 1.716 -11.904 146 HA GLU 26 HA GLU 26 -8.056 1.424 -14.644 147 HB2 GLU 26 HB2 GLU 26 -6.148 -0.009 -12.831 148 HB3 GLU 26 HB1 GLU 26 -6.486 -0.606 -14.426 149 HG2 GLU 26 HG2 GLU 26 -5.701 1.504 -15.406 150 HG3 GLU 26 HG1 GLU 26 -5.333 2.096 -13.788 151 H MET 27 HN MET 27 -9.181 0.000 -11.687 152 HA MET 27 HA MET 27 -10.339 -2.323 -13.038 153 HB2 MET 27 HB2 MET 27 -9.350 -1.898 -10.254 154 HB3 MET 27 HB1 MET 27 -10.677 -3.016 -10.494 155 HG2 MET 27 HG2 MET 27 -9.280 -4.283 -12.086 156 HG3 MET 27 HG1 MET 27 -7.944 -3.188 -11.731 157 HE1 MET 27 HE1 MET 27 -10.574 -5.592 -9.957 158 HE2 MET 27 HE2 MET 27 -9.410 -6.696 -9.225 159 HE3 MET 27 HE3 MET 27 -9.456 -6.496 -10.976 160 H LEU 28 HN LEU 28 -11.348 0.625 -12.705 161 HA LEU 28 HA LEU 28 -13.884 0.195 -11.320 162 HB2 LEU 28 HB2 LEU 28 -12.106 2.350 -11.374 163 HB3 LEU 28 HB1 LEU 28 -13.442 2.910 -12.341 164 HG LEU 28 HG LEU 28 -13.646 3.747 -10.085 165 HD11 LEU 28 HD11 LEU 28 -15.832 3.666 -10.185 166 HD12 LEU 28 HD12 LEU 28 -15.832 2.017 -9.562 167 HD13 LEU 28 HD13 LEU 28 -15.730 2.302 -11.300 168 HD21 LEU 28 HD21 LEU 28 -13.248 2.679 -8.171 169 HD22 LEU 28 HD22 LEU 28 -12.526 1.421 -9.173 170 HD23 LEU 28 HD23 LEU 28 -14.201 1.271 -8.642 171 H ILE 29 HN ILE 29 -13.148 -0.780 -14.143 172 HA ILE 29 HA ILE 29 -15.232 0.431 -15.805 173 HB ILE 29 HB ILE 29 -14.001 -1.775 -17.200 174 HG12 ILE 29 HG12 ILE 29 -11.729 -0.244 -17.433 175 HG13 ILE 29 HG11 ILE 29 -12.018 -0.156 -15.697 176 HG21 ILE 29 HG21 ILE 29 -13.883 1.192 -17.639 177 HG22 ILE 29 HG22 ILE 29 -15.149 0.094 -18.191 178 HG23 ILE 29 HG23 ILE 29 -13.513 -0.045 -18.838 179 HD11 ILE 29 HD11 ILE 29 -12.129 -2.656 -15.685 180 HD12 ILE 29 HD12 ILE 29 -10.553 -1.981 -16.098 181 HD13 ILE 29 HD13 ILE 29 -11.599 -2.619 -17.367 182 H ILE 30 HN ILE 30 -15.625 -1.531 -13.447 183 HA ILE 30 HA ILE 30 -17.350 -3.555 -14.747 184 HB ILE 30 HB ILE 30 -16.291 -4.010 -11.921 185 HG12 ILE 30 HG12 ILE 30 -14.857 -5.706 -13.773 186 HG13 ILE 30 HG11 ILE 30 -14.573 -4.025 -14.201 187 HG21 ILE 30 HG21 ILE 30 -16.892 -6.286 -12.195 188 HG22 ILE 30 HG22 ILE 30 -16.922 -6.163 -13.953 189 HG23 ILE 30 HG23 ILE 30 -18.199 -5.411 -12.997 190 HD11 ILE 30 HD11 ILE 30 -12.865 -4.889 -12.687 191 HD12 ILE 30 HD12 ILE 30 -14.106 -5.238 -11.483 192 HD13 ILE 30 HD13 ILE 30 -13.774 -3.568 -11.953 193 H GLU 31 HN GLU 31 -19.420 -3.774 -14.068 194 HA GLU 31 HA GLU 31 -20.648 -1.622 -12.562 195 HB2 GLU 31 HB2 GLU 31 -21.632 -3.825 -14.325 196 HB3 GLU 31 HB1 GLU 31 -22.770 -3.091 -13.204 197 HG2 GLU 31 HG2 GLU 31 -21.163 -1.246 -14.880 198 HG3 GLU 31 HG1 GLU 31 -22.425 -2.168 -15.695 199 H ASN 32 HN ASN 32 -19.600 -4.811 -11.826 200 HA ASN 32 HA ASN 32 -21.358 -5.337 -9.579 201 HB2 ASN 32 HB2 ASN 32 -19.088 -6.762 -10.909 202 HB3 ASN 32 HB1 ASN 32 -19.548 -7.232 -9.274 203 HD21 ASN 32 HD21 ASN 32 -21.576 -8.139 -8.912 204 HD22 ASN 32 HD22 ASN 32 -22.525 -8.795 -10.197 205 H PHE 33 HN PHE 33 -18.410 -3.636 -10.063 206 HA PHE 33 HA PHE 33 -16.968 -3.804 -7.694 207 HB2 PHE 33 HB2 PHE 33 -16.618 -2.450 -9.992 208 HB3 PHE 33 HB1 PHE 33 -17.059 -1.126 -8.946 209 HD1 PHE 33 HD1 PHE 33 -14.520 -3.663 -9.672 210 HD2 PHE 33 HD2 PHE 33 -15.576 -0.428 -7.102 211 HE1 PHE 33 HE1 PHE 33 -12.227 -3.600 -8.810 212 HE2 PHE 33 HE2 PHE 33 -13.272 -0.372 -6.236 213 HZ PHE 33 HZ PHE 33 -11.596 -1.956 -7.102 214 H GLU 34 HN GLU 34 -19.779 -1.771 -8.358 215 HA GLU 34 HA GLU 34 -19.904 -0.147 -6.045 216 HB2 GLU 34 HB2 GLU 34 -21.962 -1.145 -7.988 217 HB3 GLU 34 HB1 GLU 34 -22.464 -0.237 -6.570 218 HG2 GLU 34 HG2 GLU 34 -21.048 1.636 -7.277 219 HG3 GLU 34 HG1 GLU 34 -20.566 0.725 -8.707 220 H GLU 35 HN GLU 35 -20.824 -3.491 -6.553 221 HA GLU 35 HA GLU 35 -22.194 -3.892 -3.998 222 HB2 GLU 35 HB2 GLU 35 -21.629 -5.629 -6.377 223 HB3 GLU 35 HB1 GLU 35 -22.086 -6.364 -4.849 224 HG2 GLU 35 HG2 GLU 35 -24.168 -5.067 -4.862 225 HG3 GLU 35 HG1 GLU 35 -23.711 -4.369 -6.416 226 H ILE 36 HN ILE 36 -19.034 -4.564 -5.426 227 HA ILE 36 HA ILE 36 -18.014 -6.347 -3.399 228 HB ILE 36 HB ILE 36 -16.363 -4.839 -5.503 229 HG12 ILE 36 HG12 ILE 36 -16.916 -7.754 -5.849 230 HG13 ILE 36 HG11 ILE 36 -18.275 -6.682 -6.134 231 HG21 ILE 36 HG21 ILE 36 -14.479 -6.082 -4.937 232 HG22 ILE 36 HG22 ILE 36 -15.428 -7.500 -4.496 233 HG23 ILE 36 HG23 ILE 36 -15.288 -6.152 -3.368 234 HD11 ILE 36 HD11 ILE 36 -16.457 -7.486 -8.009 235 HD12 ILE 36 HD12 ILE 36 -15.833 -5.899 -7.573 236 HD13 ILE 36 HD13 ILE 36 -17.494 -6.071 -8.151 237 H VAL 37 HN VAL 37 -17.780 -2.846 -3.983 238 HA VAL 37 HA VAL 37 -15.874 -2.095 -2.047 239 HB VAL 37 HB VAL 37 -16.856 0.253 -2.196 240 HG11 VAL 37 HG11 VAL 37 -14.974 -0.383 -3.542 241 HG12 VAL 37 HG12 VAL 37 -16.065 0.605 -4.513 242 HG13 VAL 37 HG13 VAL 37 -16.032 -1.144 -4.733 243 HG21 VAL 37 HG21 VAL 37 -18.713 -1.033 -4.215 244 HG22 VAL 37 HG22 VAL 37 -18.355 0.683 -4.192 245 HG23 VAL 37 HG23 VAL 37 -19.159 -0.055 -2.818 246 H LYS 38 HN LYS 38 -19.122 -3.028 -1.534 247 HA LYS 38 HA LYS 38 -19.519 -1.757 1.056 248 HB2 LYS 38 HB2 LYS 38 -21.180 -3.459 -0.765 249 HB3 LYS 38 HB1 LYS 38 -21.643 -3.309 0.926 250 HG2 LYS 38 HG2 LYS 38 -21.819 -0.895 0.679 251 HG3 LYS 38 HG1 LYS 38 -21.288 -1.018 -1.000 252 HD2 LYS 38 HD2 LYS 38 -23.257 -2.357 -1.534 253 HD3 LYS 38 HD1 LYS 38 -23.783 -2.268 0.149 254 HE2 LYS 38 HE2 LYS 38 -23.959 0.164 -0.037 255 HE3 LYS 38 HE1 LYS 38 -23.434 0.075 -1.718 256 HZ1 LYS 38 HZ1 LYS 38 -25.857 0.256 -1.476 257 HZ2 LYS 38 HZ2 LYS 38 -25.882 -1.216 -0.645 258 HZ3 LYS 38 HZ3 LYS 38 -25.398 -1.170 -2.264 259 H ASP 39 HN ASP 39 -18.224 -4.741 -0.104 260 HA ASP 39 HA ASP 39 -18.190 -5.914 2.579 261 HB2 ASP 39 HB2 ASP 39 -19.035 -7.161 0.000 262 HB3 ASP 39 HB1 ASP 39 -18.121 -8.169 1.115 263 H ARG 40 HN ARG 40 -16.186 -5.640 3.260 264 HA ARG 40 HA ARG 40 -13.757 -5.656 1.893 265 HB2 ARG 40 HB2 ARG 40 -14.347 -6.350 4.768 266 HB3 ARG 40 HB1 ARG 40 -12.712 -6.217 4.141 267 HG2 ARG 40 HG2 ARG 40 -12.836 -4.036 4.797 268 HG3 ARG 40 HG1 ARG 40 -13.870 -3.812 3.386 269 HD2 ARG 40 HD2 ARG 40 -15.820 -4.482 4.862 270 HD3 ARG 40 HD1 ARG 40 -14.716 -4.342 6.228 271 HE ARG 40 HE ARG 40 -14.431 -1.953 5.073 272 HH11 ARG 40 HH11 ARG 40 -17.508 -3.591 5.902 273 HH12 ARG 40 HH12 ARG 40 -18.340 -2.089 6.130 274 HH21 ARG 40 HH21 ARG 40 -15.599 -0.072 5.385 275 HH22 ARG 40 HH22 ARG 40 -17.268 -0.126 5.839 276 H GLU 41 HN GLU 41 -15.547 -8.423 3.147 277 HA GLU 41 HA GLU 41 -13.576 -10.452 2.896 278 HB2 GLU 41 HB2 GLU 41 -16.127 -10.206 3.926 279 HB3 GLU 41 HB1 GLU 41 -16.326 -11.337 2.601 280 HG2 GLU 41 HG2 GLU 41 -14.555 -12.745 3.555 281 HG3 GLU 41 HG1 GLU 41 -14.396 -11.611 4.895 282 H ARG 42 HN ARG 42 -15.931 -9.106 0.624 283 HA ARG 42 HA ARG 42 -15.550 -11.061 -1.476 284 HB2 ARG 42 HB2 ARG 42 -17.173 -8.558 -1.192 285 HB3 ARG 42 HB1 ARG 42 -16.883 -9.224 -2.791 286 HG2 ARG 42 HG2 ARG 42 -17.910 -11.333 -2.094 287 HG3 ARG 42 HG1 ARG 42 -18.220 -10.647 -0.497 288 HD2 ARG 42 HD2 ARG 42 -19.633 -8.918 -1.510 289 HD3 ARG 42 HD1 ARG 42 -19.306 -9.583 -3.109 290 HE ARG 42 HE ARG 42 -20.345 -11.650 -1.580 291 HH11 ARG 42 HH11 ARG 42 -21.706 -8.569 -2.802 292 HH12 ARG 42 HH12 ARG 42 -23.320 -9.194 -2.811 293 HH21 ARG 42 HH21 ARG 42 -22.463 -12.360 -1.631 294 HH22 ARG 42 HH22 ARG 42 -23.738 -11.313 -2.156 295 H PHE 43 HN PHE 43 -14.308 -7.836 -0.688 296 HA PHE 43 HA PHE 43 -13.088 -7.235 -3.208 297 HB2 PHE 43 HB2 PHE 43 -13.804 -5.639 -1.214 298 HB3 PHE 43 HB1 PHE 43 -12.158 -5.924 -0.670 299 HD1 PHE 43 HD2 PHE 43 -10.219 -5.253 -2.194 300 HD2 PHE 43 HD1 PHE 43 -14.256 -4.064 -2.938 301 HE1 PHE 43 HE2 PHE 43 -9.430 -3.465 -3.688 302 HE2 PHE 43 HE1 PHE 43 -13.454 -2.286 -4.433 303 HZ PHE 43 HZ PHE 43 -11.055 -1.994 -4.800 304 H LEU 44 HN LEU 44 -11.755 -8.515 -0.110 305 HA LEU 44 HA LEU 44 -9.001 -8.617 -0.936 306 HB2 LEU 44 HB2 LEU 44 -10.536 -9.602 1.438 307 HB3 LEU 44 HB1 LEU 44 -8.897 -10.161 1.173 308 HG LEU 44 HG LEU 44 -9.174 -7.246 1.021 309 HD11 LEU 44 HD11 LEU 44 -9.758 -8.672 3.608 310 HD12 LEU 44 HD12 LEU 44 -10.844 -7.605 2.720 311 HD13 LEU 44 HD13 LEU 44 -9.379 -6.957 3.451 312 HD21 LEU 44 HD21 LEU 44 -7.166 -7.274 2.299 313 HD22 LEU 44 HD22 LEU 44 -7.035 -8.548 1.088 314 HD23 LEU 44 HD23 LEU 44 -7.410 -8.960 2.761 315 H ALA 45 HN ALA 45 -11.665 -10.872 -0.906 316 HA ALA 45 HA ALA 45 -10.326 -13.317 -1.553 317 HB1 ALA 45 HB1 ALA 45 -12.585 -14.155 -2.119 318 HB2 ALA 45 HB2 ALA 45 -13.210 -12.517 -1.942 319 HB3 ALA 45 HB3 ALA 45 -12.527 -13.353 -0.549 320 H GLN 46 HN GLN 46 -11.691 -10.718 -3.554 321 HA GLN 46 HA GLN 46 -11.417 -12.052 -6.095 322 HB2 GLN 46 HB2 GLN 46 -12.491 -9.521 -5.132 323 HB3 GLN 46 HB1 GLN 46 -11.628 -9.352 -6.655 324 HG2 GLN 46 HG2 GLN 46 -13.014 -11.055 -7.666 325 HG3 GLN 46 HG1 GLN 46 -13.844 -11.318 -6.134 326 HE21 GLN 46 HE21 GLN 46 -13.700 -9.496 -8.991 327 HE22 GLN 46 HE22 GLN 46 -14.975 -8.388 -8.632 328 H VAL 47 HN VAL 47 -9.458 -9.704 -4.262 329 HA VAL 47 HA VAL 47 -7.506 -9.117 -6.288 330 HB VAL 47 HB VAL 47 -7.211 -8.742 -3.248 331 HG11 VAL 47 HG11 VAL 47 -5.018 -8.643 -4.665 332 HG12 VAL 47 HG12 VAL 47 -5.346 -7.316 -3.548 333 HG13 VAL 47 HG13 VAL 47 -5.661 -7.117 -5.270 334 HG21 VAL 47 HG21 VAL 47 -7.707 -6.366 -3.634 335 HG22 VAL 47 HG22 VAL 47 -9.062 -7.404 -4.071 336 HG23 VAL 47 HG23 VAL 47 -8.038 -6.716 -5.332 337 H GLU 48 HN GLU 48 -7.706 -11.584 -3.707 338 HA GLU 48 HA GLU 48 -5.083 -12.752 -4.013 339 HB2 GLU 48 HB2 GLU 48 -7.570 -13.615 -2.520 340 HB3 GLU 48 HB1 GLU 48 -6.105 -14.577 -2.549 341 HG2 GLU 48 HG2 GLU 48 -4.897 -12.588 -1.571 342 HG3 GLU 48 HG1 GLU 48 -6.476 -11.828 -1.374 343 H GLU 49 HN GLU 49 -8.216 -13.294 -5.502 344 HA GLU 49 HA GLU 49 -7.529 -15.905 -6.651 345 HB2 GLU 49 HB2 GLU 49 -10.069 -14.311 -6.499 346 HB3 GLU 49 HB1 GLU 49 -9.916 -15.620 -7.660 347 HG2 GLU 49 HG2 GLU 49 -9.445 -17.177 -5.815 348 HG3 GLU 49 HG1 GLU 49 -9.650 -15.851 -4.670 349 H PHE 50 HN PHE 50 -7.668 -12.569 -7.637 350 HA PHE 50 HA PHE 50 -7.477 -13.247 -10.483 351 HB2 PHE 50 HB2 PHE 50 -8.468 -10.819 -9.032 352 HB3 PHE 50 HB1 PHE 50 -7.837 -10.653 -10.651 353 HD1 PHE 50 HD1 PHE 50 -9.055 -11.563 -12.567 354 HD2 PHE 50 HD2 PHE 50 -10.569 -11.954 -8.601 355 HE1 PHE 50 HE1 PHE 50 -11.258 -12.168 -13.470 356 HE2 PHE 50 HE2 PHE 50 -12.773 -12.567 -9.505 357 HZ PHE 50 HZ PHE 50 -13.120 -12.676 -11.940 358 H VAL 51 HN VAL 51 -5.841 -12.557 -11.723 359 HA VAL 51 HA VAL 51 -3.370 -11.789 -10.428 360 HB VAL 51 HB VAL 51 -2.460 -12.102 -12.850 361 HG11 VAL 51 HG11 VAL 51 -2.125 -14.524 -12.393 362 HG12 VAL 51 HG12 VAL 51 -3.260 -14.359 -11.053 363 HG13 VAL 51 HG13 VAL 51 -1.744 -13.455 -11.042 364 HG21 VAL 51 HG21 VAL 51 -4.739 -12.492 -13.922 365 HG22 VAL 51 HG22 VAL 51 -4.725 -14.068 -13.127 366 HG23 VAL 51 HG23 VAL 51 -3.478 -13.665 -14.311 367 H PHE 52 HN PHE 52 -1.959 -10.179 -11.290 368 HA PHE 52 HA PHE 52 -3.313 -7.908 -12.591 369 HB2 PHE 52 HB2 PHE 52 -1.427 -7.725 -10.223 370 HB3 PHE 52 HB1 PHE 52 -2.011 -6.348 -11.134 371 HD1 PHE 52 HD2 PHE 52 -4.371 -5.631 -10.934 372 HD2 PHE 52 HD1 PHE 52 -2.811 -8.823 -8.588 373 HE1 PHE 52 HE2 PHE 52 -6.310 -5.482 -9.437 374 HE2 PHE 52 HE1 PHE 52 -4.754 -8.674 -7.089 375 HZ PHE 52 HZ PHE 52 -6.508 -7.002 -7.515 376 H LYS 53 HN LYS 53 -2.136 -6.669 -13.929 377 HA LYS 53 HA LYS 53 0.310 -7.844 -15.034 378 HB2 LYS 53 HB2 LYS 53 -1.817 -6.038 -16.109 379 HB3 LYS 53 HB1 LYS 53 -0.220 -5.992 -16.839 380 HG2 LYS 53 HG2 LYS 53 -0.360 -8.354 -17.363 381 HG3 LYS 53 HG1 LYS 53 -1.928 -8.458 -16.560 382 HD2 LYS 53 HD2 LYS 53 -2.865 -6.887 -18.181 383 HD3 LYS 53 HD1 LYS 53 -1.293 -6.765 -18.977 384 HE2 LYS 53 HE2 LYS 53 -1.376 -9.150 -19.505 385 HE3 LYS 53 HE1 LYS 53 -2.941 -9.276 -18.702 386 HZ1 LYS 53 HZ1 LYS 53 -4.001 -8.243 -20.401 387 HZ2 LYS 53 HZ2 LYS 53 -2.728 -8.914 -21.289 388 HZ3 LYS 53 HZ3 LYS 53 -2.671 -7.288 -20.826 389 H CYS 54 HN CYS 54 2.222 -6.813 -15.214 390 HA CYS 54 HA CYS 54 2.617 -4.479 -13.548 391 HB2 CYS 54 HB2 CYS 54 4.054 -6.501 -13.274 392 HB3 CYS 54 HB1 CYS 54 4.740 -6.170 -14.859 393 HA PRO 55 HA PRO 55 3.023 -1.800 -17.335 394 HB2 PRO 55 HB2 PRO 55 4.112 0.341 -15.632 395 HB3 PRO 55 HB1 PRO 55 2.615 0.340 -16.570 396 HG2 PRO 55 HG2 PRO 55 2.551 0.272 -13.887 397 HG3 PRO 55 HG1 PRO 55 1.390 -0.665 -14.853 398 HD2 PRO 55 HD2 PRO 55 3.942 -1.611 -13.545 399 HD3 PRO 55 HD1 PRO 55 2.308 -2.303 -13.454 400 H VAL 56 HN VAL 56 5.584 -2.853 -15.373 401 HA VAL 56 HA VAL 56 7.739 -1.425 -16.780 402 HB VAL 56 HB VAL 56 8.336 -3.214 -14.403 403 HG11 VAL 56 HG11 VAL 56 9.573 -0.566 -15.165 404 HG12 VAL 56 HG12 VAL 56 10.185 -2.139 -15.677 405 HG13 VAL 56 HG13 VAL 56 10.162 -1.718 -13.965 406 HG21 VAL 56 HG21 VAL 56 8.165 -1.075 -12.933 407 HG22 VAL 56 HG22 VAL 56 6.684 -1.973 -13.272 408 HG23 VAL 56 HG23 VAL 56 7.047 -0.498 -14.169 409 H CYS 57 HN CYS 57 6.951 -4.799 -15.706 410 HA CYS 57 HA CYS 57 8.703 -5.858 -17.801 411 HB2 CYS 57 HB2 CYS 57 8.542 -8.036 -16.607 412 HB3 CYS 57 HB1 CYS 57 9.205 -6.746 -15.621 413 H GLY 58 HN GLY 58 5.404 -6.529 -16.533 414 HA2 GLY 58 HA2 GLY 58 3.454 -6.460 -17.980 415 HA3 GLY 58 HA1 GLY 58 4.467 -7.009 -19.298 416 H GLU 59 HN GLU 59 4.757 -8.527 -16.178 417 HA GLU 59 HA GLU 59 3.500 -10.998 -17.159 418 HB2 GLU 59 HB2 GLU 59 5.870 -10.405 -15.551 419 HB3 GLU 59 HB1 GLU 59 4.854 -11.649 -14.838 420 HG2 GLU 59 HG2 GLU 59 4.945 -12.877 -17.008 421 HG3 GLU 59 HG1 GLU 59 6.102 -11.677 -17.581 422 H GLU 60 HN GLU 60 2.047 -12.165 -15.926 423 HA GLU 60 HA GLU 60 0.378 -10.695 -14.088 424 HB2 GLU 60 HB2 GLU 60 0.233 -13.249 -15.596 425 HB3 GLU 60 HB1 GLU 60 -0.782 -13.105 -14.171 426 HG2 GLU 60 HG2 GLU 60 -2.010 -11.318 -15.093 427 HG3 GLU 60 HG1 GLU 60 -0.758 -10.967 -16.278 428 H PHE 61 HN PHE 61 0.133 -10.892 -12.006 429 HA PHE 61 HA PHE 61 1.456 -12.999 -10.462 430 HB2 PHE 61 HB2 PHE 61 2.176 -11.299 -8.738 431 HB3 PHE 61 HB1 PHE 61 3.035 -11.178 -10.259 432 HD1 PHE 61 HD1 PHE 61 2.756 -9.203 -11.685 433 HD2 PHE 61 HD2 PHE 61 0.707 -9.530 -7.968 434 HE1 PHE 61 HE1 PHE 61 2.236 -6.798 -11.760 435 HE2 PHE 61 HE2 PHE 61 0.188 -7.124 -8.040 436 HZ PHE 61 HZ PHE 61 0.955 -5.755 -9.938 437 H TYR 62 HN TYR 62 0.484 -13.496 -8.461 438 HA TYR 62 HA TYR 62 -2.375 -12.886 -8.348 439 HB2 TYR 62 HB2 TYR 62 -0.682 -15.076 -7.152 440 HB3 TYR 62 HB1 TYR 62 -2.337 -14.819 -6.632 441 HD1 TYR 62 HD2 TYR 62 -4.217 -15.232 -8.250 442 HD2 TYR 62 HD1 TYR 62 -0.176 -16.103 -9.263 443 HE1 TYR 62 HE2 TYR 62 -4.995 -16.664 -10.086 444 HE2 TYR 62 HE1 TYR 62 -0.944 -17.538 -11.105 445 HH TYR 62 HH TYR 62 -2.897 -17.843 -12.509 446 H GLY 63 HN GLY 63 -3.485 -12.288 -6.490 447 HA2 GLY 63 HA2 GLY 63 -2.169 -10.413 -4.708 448 HA3 GLY 63 HA1 GLY 63 -3.881 -10.791 -4.737 449 H LYS 64 HN LYS 64 -2.742 -13.717 -4.550 450 HA LYS 64 HA LYS 64 -2.969 -14.074 -1.692 451 HB2 LYS 64 HB2 LYS 64 -3.685 -15.620 -3.800 452 HB3 LYS 64 HB1 LYS 64 -2.174 -16.399 -3.352 453 HG2 LYS 64 HG2 LYS 64 -2.990 -16.821 -1.125 454 HG3 LYS 64 HG1 LYS 64 -4.460 -15.903 -1.444 455 HD2 LYS 64 HD2 LYS 64 -5.094 -17.533 -3.163 456 HD3 LYS 64 HD1 LYS 64 -3.631 -18.458 -2.814 457 HE2 LYS 64 HE2 LYS 64 -4.395 -18.783 -0.508 458 HE3 LYS 64 HE1 LYS 64 -5.857 -17.867 -0.867 459 HZ1 LYS 64 HZ1 LYS 64 -6.290 -19.584 -2.636 460 HZ2 LYS 64 HZ2 LYS 64 -6.439 -20.119 -1.038 461 HZ3 LYS 64 HZ3 LYS 64 -5.059 -20.508 -1.935 462 H THR 65 HN THR 65 -0.302 -13.666 -3.859 463 HA THR 65 HA THR 65 1.716 -14.926 -2.151 464 HB THR 65 HB THR 65 3.347 -14.034 -3.933 465 HG1 THR 65 HG1 THR 65 2.085 -13.772 -6.012 466 HG21 THR 65 HG21 THR 65 2.639 -16.389 -3.836 467 HG22 THR 65 HG22 THR 65 2.867 -15.842 -5.498 468 HG23 THR 65 HG23 THR 65 1.237 -15.998 -4.837 469 H LEU 66 HN LEU 66 0.165 -11.937 -2.210 470 HA LEU 66 HA LEU 66 2.365 -10.197 -1.479 471 HB2 LEU 66 HB2 LEU 66 -0.521 -9.898 -2.070 472 HB3 LEU 66 HB1 LEU 66 0.098 -8.785 -0.870 473 HG LEU 66 HG LEU 66 1.915 -8.612 -3.017 474 HD11 LEU 66 HD11 LEU 66 -0.905 -8.449 -4.042 475 HD12 LEU 66 HD12 LEU 66 0.177 -9.806 -4.360 476 HD13 LEU 66 HD13 LEU 66 0.587 -8.192 -4.943 477 HD21 LEU 66 HD21 LEU 66 0.976 -6.358 -3.236 478 HD22 LEU 66 HD22 LEU 66 1.245 -6.791 -1.548 479 HD23 LEU 66 HD23 LEU 66 -0.385 -6.834 -2.219 480 HA PRO 67 HA PRO 67 2.175 -10.927 3.040 481 HB2 PRO 67 HB2 PRO 67 2.971 -8.510 4.083 482 HB3 PRO 67 HB1 PRO 67 4.093 -9.684 3.388 483 HG2 PRO 67 HG2 PRO 67 2.888 -7.230 2.115 484 HG3 PRO 67 HG1 PRO 67 4.573 -7.794 2.063 485 HD2 PRO 67 HD2 PRO 67 2.904 -8.227 -0.000 486 HD3 PRO 67 HD1 PRO 67 4.093 -9.452 0.481 487 H ARG 68 HN ARG 68 1.036 -10.426 5.042 488 HA ARG 68 HA ARG 68 -1.661 -9.631 4.774 489 HB2 ARG 68 HB2 ARG 68 0.043 -10.290 7.134 490 HB3 ARG 68 HB1 ARG 68 -1.572 -9.640 7.379 491 HG2 ARG 68 HG2 ARG 68 -2.528 -11.487 6.116 492 HG3 ARG 68 HG1 ARG 68 -0.911 -12.130 5.813 493 HD2 ARG 68 HD2 ARG 68 -0.579 -12.469 8.203 494 HD3 ARG 68 HD1 ARG 68 -2.161 -11.763 8.538 495 HE ARG 68 HE ARG 68 -2.533 -13.895 6.775 496 HH11 ARG 68 HH11 ARG 68 -1.574 -13.600 10.213 497 HH12 ARG 68 HH12 ARG 68 -2.175 -15.178 10.600 498 HH21 ARG 68 HH21 ARG 68 -3.277 -15.917 7.377 499 HH22 ARG 68 HH22 ARG 68 -3.125 -16.469 9.011 500 H ARG 69 HN ARG 69 1.128 -7.772 5.910 501 HA ARG 69 HA ARG 69 0.008 -5.460 6.929 502 HB2 ARG 69 HB2 ARG 69 2.563 -5.874 5.379 503 HB3 ARG 69 HB1 ARG 69 2.132 -4.309 6.046 504 HG2 ARG 69 HG2 ARG 69 2.148 -5.234 8.290 505 HG3 ARG 69 HG1 ARG 69 2.502 -6.838 7.642 506 HD2 ARG 69 HD2 ARG 69 4.618 -6.017 6.738 507 HD3 ARG 69 HD1 ARG 69 4.262 -4.402 7.348 508 HE ARG 69 HE ARG 69 4.134 -6.133 9.514 509 HH11 ARG 69 HH11 ARG 69 6.790 -5.048 7.374 510 HH12 ARG 69 HH12 ARG 69 7.985 -5.282 8.605 511 HH21 ARG 69 HH21 ARG 69 5.747 -6.402 11.031 512 HH22 ARG 69 HH22 ARG 69 7.397 -6.040 10.650 513 H GLU 70 HN GLU 70 0.586 -6.185 3.446 514 HA GLU 70 HA GLU 70 -0.487 -3.722 2.437 515 HB2 GLU 70 HB2 GLU 70 0.602 -6.252 1.308 516 HB3 GLU 70 HB1 GLU 70 -0.523 -5.373 0.292 517 HG2 GLU 70 HG2 GLU 70 1.429 -4.428 -0.453 518 HG3 GLU 70 HG1 GLU 70 1.141 -3.346 0.900 519 H ALA 71 HN ALA 71 -1.775 -6.920 3.156 520 HA ALA 71 HA ALA 71 -4.307 -6.791 1.841 521 HB1 ALA 71 HB1 ALA 71 -4.862 -8.779 3.023 522 HB2 ALA 71 HB2 ALA 71 -3.669 -8.444 4.275 523 HB3 ALA 71 HB3 ALA 71 -3.137 -8.878 2.651 524 H GLU 72 HN GLU 72 -3.180 -5.811 5.055 525 HA GLU 72 HA GLU 72 -5.685 -5.145 6.275 526 HB2 GLU 72 HB2 GLU 72 -2.815 -4.621 6.946 527 HB3 GLU 72 HB1 GLU 72 -4.077 -3.765 7.819 528 HG2 GLU 72 HG2 GLU 72 -5.062 -5.929 8.467 529 HG3 GLU 72 HG1 GLU 72 -3.743 -6.755 7.641 530 H LYS 73 HN LYS 73 -3.445 -3.370 4.229 531 HA LYS 73 HA LYS 73 -4.403 -0.702 4.545 532 HB2 LYS 73 HB2 LYS 73 -2.743 -2.077 2.457 533 HB3 LYS 73 HB1 LYS 73 -3.322 -0.440 2.184 534 HG2 LYS 73 HG2 LYS 73 -2.195 0.298 4.223 535 HG3 LYS 73 HG1 LYS 73 -1.610 -1.346 4.490 536 HD2 LYS 73 HD2 LYS 73 -0.363 -1.257 2.397 537 HD3 LYS 73 HD1 LYS 73 -0.979 0.370 2.087 538 HE2 LYS 73 HE2 LYS 73 0.120 1.169 4.122 539 HE3 LYS 73 HE1 LYS 73 0.742 -0.452 4.425 540 HZ1 LYS 73 HZ1 LYS 73 2.433 0.874 3.396 541 HZ2 LYS 73 HZ2 LYS 73 1.406 1.295 2.120 542 HZ3 LYS 73 HZ3 LYS 73 1.930 -0.304 2.290 543 H VAL 74 HN VAL 74 -5.493 -3.401 2.612 544 HA VAL 74 HA VAL 74 -7.181 -2.120 0.696 545 HB VAL 74 HB VAL 74 -7.727 -4.968 1.639 546 HG11 VAL 74 HG11 VAL 74 -8.279 -5.377 -0.755 547 HG12 VAL 74 HG12 VAL 74 -8.003 -3.665 -1.083 548 HG13 VAL 74 HG13 VAL 74 -9.312 -4.157 -0.007 549 HG21 VAL 74 HG21 VAL 74 -5.242 -4.701 1.160 550 HG22 VAL 74 HG22 VAL 74 -5.694 -4.369 -0.511 551 HG23 VAL 74 HG23 VAL 74 -6.080 -5.931 0.211 552 H PHE 75 HN PHE 75 -7.796 -3.300 4.029 553 HA PHE 75 HA PHE 75 -10.598 -2.963 4.215 554 HB2 PHE 75 HB2 PHE 75 -8.363 -3.467 6.018 555 HB3 PHE 75 HB1 PHE 75 -9.563 -2.420 6.763 556 HD1 PHE 75 HD2 PHE 75 -8.891 -5.774 5.447 557 HD2 PHE 75 HD1 PHE 75 -11.784 -3.252 7.296 558 HE1 PHE 75 HE2 PHE 75 -10.262 -7.743 5.984 559 HE2 PHE 75 HE1 PHE 75 -13.152 -5.220 7.844 560 HZ PHE 75 HZ PHE 75 -12.396 -7.469 7.182 561 H GLU 76 HN GLU 76 -8.012 -0.587 4.352 562 HA GLU 76 HA GLU 76 -9.314 1.538 5.746 563 HB2 GLU 76 HB2 GLU 76 -6.734 1.026 5.132 564 HB3 GLU 76 HB1 GLU 76 -7.110 2.183 3.864 565 HG2 GLU 76 HG2 GLU 76 -7.866 3.780 5.580 566 HG3 GLU 76 HG1 GLU 76 -7.379 2.634 6.831 567 H LEU 77 HN LEU 77 -8.883 0.828 2.241 568 HA LEU 77 HA LEU 77 -10.103 3.207 1.274 569 HB2 LEU 77 HB2 LEU 77 -10.178 1.961 -0.931 570 HB3 LEU 77 HB1 LEU 77 -8.611 2.226 -0.256 571 HG LEU 77 HG LEU 77 -9.140 -0.303 0.619 572 HD11 LEU 77 HD11 LEU 77 -11.268 -0.171 -0.782 573 HD12 LEU 77 HD12 LEU 77 -10.238 -1.591 -1.004 574 HD13 LEU 77 HD13 LEU 77 -10.203 -0.279 -2.185 575 HD21 LEU 77 HD21 LEU 77 -7.054 0.170 -0.338 576 HD22 LEU 77 HD22 LEU 77 -7.767 0.681 -1.868 577 HD23 LEU 77 HD23 LEU 77 -7.778 -1.022 -1.418 578 H LEU 78 HN LEU 78 -11.381 0.049 2.100 579 HA LEU 78 HA LEU 78 -14.031 0.405 1.000 580 HB2 LEU 78 HB2 LEU 78 -12.697 -1.694 2.677 581 HB3 LEU 78 HB1 LEU 78 -14.436 -1.704 2.453 582 HG LEU 78 HG LEU 78 -13.147 -1.463 -0.109 583 HD11 LEU 78 HD11 LEU 78 -11.246 -2.543 0.961 584 HD12 LEU 78 HD12 LEU 78 -12.035 -3.610 -0.196 585 HD13 LEU 78 HD13 LEU 78 -12.296 -3.832 1.534 586 HD21 LEU 78 HD21 LEU 78 -14.450 -3.427 -0.595 587 HD22 LEU 78 HD22 LEU 78 -15.412 -2.251 0.302 588 HD23 LEU 78 HD23 LEU 78 -14.767 -3.670 1.120 589 H ASN 79 HN ASN 79 -12.478 1.229 3.994 590 HA ASN 79 HA ASN 79 -14.987 1.660 5.463 591 HB2 ASN 79 HB2 ASN 79 -12.142 1.281 6.272 592 HB3 ASN 79 HB1 ASN 79 -13.159 2.282 7.305 593 HD21 ASN 79 HD21 ASN 79 -12.178 -0.830 6.608 594 HD22 ASN 79 HD22 ASN 79 -13.387 -1.695 7.488 595 H ASP 80 HN ASP 80 -12.679 3.384 3.624 596 HA ASP 80 HA ASP 80 -13.473 5.977 4.719 597 HB2 ASP 80 HB2 ASP 80 -10.912 5.092 3.401 598 HB3 ASP 80 HB1 ASP 80 -11.382 6.786 3.366 599 H PHE 81 HN PHE 81 -15.418 5.354 3.542 600 HA PHE 81 HA PHE 81 -15.673 5.589 0.700 601 HB2 PHE 81 HB2 PHE 81 -17.546 5.399 2.981 602 HB3 PHE 81 HB1 PHE 81 -18.178 6.204 1.553 603 HD1 PHE 81 HD1 PHE 81 -18.471 4.966 -0.554 604 HD2 PHE 81 HD2 PHE 81 -17.096 3.021 2.983 605 HE1 PHE 81 HE1 PHE 81 -18.979 2.782 -1.560 606 HE2 PHE 81 HE2 PHE 81 -17.600 0.837 1.973 607 HZ PHE 81 HZ PHE 81 -18.540 0.714 -0.299 608 H LYS 82 HN LYS 82 -15.670 7.954 3.272 609 HA LYS 82 HA LYS 82 -16.321 10.191 1.478 610 HB2 LYS 82 HB2 LYS 82 -16.418 9.804 4.451 611 HB3 LYS 82 HB1 LYS 82 -16.205 11.427 3.813 612 HG2 LYS 82 HG2 LYS 82 -18.294 11.256 2.599 613 HG3 LYS 82 HG1 LYS 82 -18.494 9.588 3.140 614 HD2 LYS 82 HD2 LYS 82 -18.604 10.345 5.458 615 HD3 LYS 82 HD1 LYS 82 -18.371 12.014 4.934 616 HE2 LYS 82 HE2 LYS 82 -20.459 11.905 3.667 617 HE3 LYS 82 HE1 LYS 82 -20.691 10.235 4.185 618 HZ1 LYS 82 HZ1 LYS 82 -21.310 12.647 5.559 619 HZ2 LYS 82 HZ2 LYS 82 -20.300 11.667 6.497 620 HZ3 LYS 82 HZ3 LYS 82 -21.770 11.059 5.922 621 H GLY 83 HN GLY 83 -14.856 11.677 0.933 622 HA2 GLY 83 HA2 GLY 83 -12.645 12.693 2.108 623 HA3 GLY 83 HA1 GLY 83 -12.048 11.181 1.441 624 H GLY 84 HN GLY 84 -11.764 10.934 -0.723 625 HA2 GLY 84 HA2 GLY 84 -12.396 13.173 -2.534 626 HA3 GLY 84 HA1 GLY 84 -10.749 12.583 -2.432 627 H ILE 85 HN ILE 85 -13.869 10.841 -2.534 628 HA ILE 85 HA ILE 85 -13.026 9.471 -5.023 629 HB ILE 85 HB ILE 85 -14.922 8.055 -3.114 630 HG12 ILE 85 HG12 ILE 85 -12.427 6.796 -2.747 631 HG13 ILE 85 HG11 ILE 85 -12.134 8.512 -2.482 632 HG21 ILE 85 HG21 ILE 85 -14.081 6.002 -4.146 633 HG22 ILE 85 HG22 ILE 85 -12.915 6.930 -5.084 634 HG23 ILE 85 HG23 ILE 85 -14.639 7.128 -5.384 635 HD11 ILE 85 HD11 ILE 85 -13.941 8.559 -0.841 636 HD12 ILE 85 HD12 ILE 85 -12.689 7.394 -0.410 637 HD13 ILE 85 HD13 ILE 85 -14.212 6.836 -1.102 638 H ASP 86 HN ASP 86 -14.271 9.871 -6.663 639 HA ASP 86 HA ASP 86 -17.101 10.609 -6.310 640 HB2 ASP 86 HB2 ASP 86 -14.980 11.898 -8.001 641 HB3 ASP 86 HB1 ASP 86 -16.654 11.925 -8.544 642 H TRP 87 HN TRP 87 -18.534 9.501 -7.434 643 HA TRP 87 HA TRP 87 -17.752 7.283 -9.120 644 HB2 TRP 87 HB2 TRP 87 -20.365 8.211 -7.980 645 HB3 TRP 87 HB1 TRP 87 -20.328 6.977 -9.238 646 HD1 TRP 87 HD1 TRP 87 -19.830 7.488 -5.568 647 HE1 TRP 87 HE1 TRP 87 -19.172 5.291 -4.418 648 HE3 TRP 87 HE3 TRP 87 -18.930 4.551 -9.721 649 HZ2 TRP 87 HZ2 TRP 87 -18.387 2.726 -5.134 650 HZ3 TRP 87 HZ3 TRP 87 -18.225 2.216 -9.356 651 HH2 TRP 87 HH2 TRP 87 -17.964 1.324 -7.101 652 H GLU 88 HN GLU 88 -19.053 10.474 -9.644 653 HA GLU 88 HA GLU 88 -19.855 10.104 -12.402 654 HB2 GLU 88 HB2 GLU 88 -19.784 12.451 -10.528 655 HB3 GLU 88 HB1 GLU 88 -20.036 12.702 -12.248 656 HG2 GLU 88 HG2 GLU 88 -22.017 11.264 -12.165 657 HG3 GLU 88 HG1 GLU 88 -21.762 11.018 -10.438 658 H ASN 89 HN ASN 89 -17.058 11.466 -10.702 659 HA ASN 89 HA ASN 89 -15.711 12.277 -13.172 660 HB2 ASN 89 HB2 ASN 89 -15.265 12.827 -10.265 661 HB3 ASN 89 HB1 ASN 89 -13.928 13.017 -11.392 662 HD21 ASN 89 HD21 ASN 89 -14.137 14.547 -13.096 663 HD22 ASN 89 HD22 ASN 89 -15.205 15.895 -12.937 664 H LYS 90 HN LYS 90 -15.714 9.570 -11.016 665 HA LYS 90 HA LYS 90 -14.558 7.671 -10.719 666 HB2 LYS 90 HB2 LYS 90 -13.951 8.178 -13.622 667 HB3 LYS 90 HB1 LYS 90 -13.243 6.794 -12.807 668 HG2 LYS 90 HG2 LYS 90 -15.406 5.885 -12.330 669 HG3 LYS 90 HG1 LYS 90 -16.203 7.346 -12.923 670 HD2 LYS 90 HD2 LYS 90 -15.297 6.924 -15.163 671 HD3 LYS 90 HD1 LYS 90 -14.512 5.459 -14.570 672 HE2 LYS 90 HE2 LYS 90 -17.473 5.813 -14.270 673 HE3 LYS 90 HE1 LYS 90 -16.802 5.266 -15.805 674 HZ1 LYS 90 HZ1 LYS 90 -16.243 3.928 -13.215 675 HZ2 LYS 90 HZ2 LYS 90 -15.889 3.360 -14.768 676 HZ3 LYS 90 HZ3 LYS 90 -17.496 3.464 -14.254 677 H ARG 91 HN ARG 91 -13.397 9.487 -9.332 678 HA ARG 91 HA ARG 91 -10.488 9.112 -9.613 679 HB2 ARG 91 HB2 ARG 91 -12.054 11.470 -8.623 680 HB3 ARG 91 HB1 ARG 91 -10.420 11.196 -8.033 681 HG2 ARG 91 HG2 ARG 91 -9.578 11.246 -10.331 682 HG3 ARG 91 HG1 ARG 91 -11.215 11.521 -10.925 683 HD2 ARG 91 HD2 ARG 91 -9.904 13.382 -8.957 684 HD3 ARG 91 HD1 ARG 91 -9.682 13.568 -10.694 685 HE ARG 91 HE ARG 91 -12.393 13.482 -10.389 686 HH11 ARG 91 HH11 ARG 91 -9.978 15.682 -8.913 687 HH12 ARG 91 HH12 ARG 91 -11.115 16.983 -8.802 688 HH21 ARG 91 HH21 ARG 91 -13.781 15.224 -10.202 689 HH22 ARG 91 HH22 ARG 91 -13.240 16.723 -9.522 690 H VAL 92 HN VAL 92 -9.405 8.163 -8.116 691 HA VAL 92 HA VAL 92 -10.651 7.533 -5.516 692 HB VAL 92 HB VAL 92 -8.660 5.591 -6.738 693 HG11 VAL 92 HG11 VAL 92 -10.964 4.644 -5.093 694 HG12 VAL 92 HG12 VAL 92 -9.743 5.608 -4.266 695 HG13 VAL 92 HG13 VAL 92 -9.282 4.112 -5.074 696 HG21 VAL 92 HG21 VAL 92 -11.615 5.074 -7.092 697 HG22 VAL 92 HG22 VAL 92 -10.260 4.252 -7.856 698 HG23 VAL 92 HG23 VAL 92 -10.675 5.892 -8.339 699 H LYS 93 HN LYS 93 -9.597 8.287 -3.875 700 HA LYS 93 HA LYS 93 -6.698 8.801 -4.020 701 HB2 LYS 93 HB2 LYS 93 -8.904 10.552 -2.984 702 HB3 LYS 93 HB1 LYS 93 -7.313 10.648 -2.247 703 HG2 LYS 93 HG2 LYS 93 -6.325 11.245 -4.375 704 HG3 LYS 93 HG1 LYS 93 -7.888 11.063 -5.176 705 HD2 LYS 93 HD2 LYS 93 -8.793 12.856 -3.753 706 HD3 LYS 93 HD1 LYS 93 -7.203 13.060 -3.020 707 HE2 LYS 93 HE2 LYS 93 -6.272 13.676 -5.177 708 HE3 LYS 93 HE1 LYS 93 -7.838 13.410 -5.945 709 HZ1 LYS 93 HZ1 LYS 93 -8.391 15.479 -5.454 710 HZ2 LYS 93 HZ2 LYS 93 -6.890 15.737 -4.718 711 HZ3 LYS 93 HZ3 LYS 93 -8.193 15.174 -3.801 712 H LEU 94 HN LEU 94 -5.504 8.023 -2.495 713 HA LEU 94 HA LEU 94 -6.696 6.783 -0.115 714 HB2 LEU 94 HB2 LEU 94 -4.422 5.959 -1.885 715 HB3 LEU 94 HB1 LEU 94 -4.406 5.489 -0.201 716 HG LEU 94 HG LEU 94 -6.958 4.786 -1.324 717 HD11 LEU 94 HD11 LEU 94 -4.562 3.865 -2.900 718 HD12 LEU 94 HD12 LEU 94 -5.998 4.694 -3.498 719 HD13 LEU 94 HD13 LEU 94 -6.119 3.038 -2.906 720 HD21 LEU 94 HD21 LEU 94 -5.953 3.758 0.644 721 HD22 LEU 94 HD22 LEU 94 -4.639 3.121 -0.344 722 HD23 LEU 94 HD23 LEU 94 -6.283 2.544 -0.593 723 H LYS 95 HN LYS 95 -6.021 7.418 1.793 724 HA LYS 95 HA LYS 95 -5.091 8.523 3.542 725 HB2 LYS 95 HB2 LYS 95 -2.895 7.528 2.163 726 HB3 LYS 95 HB1 LYS 95 -2.474 9.207 2.455 727 HG2 LYS 95 HG2 LYS 95 -2.718 8.911 4.823 728 HG3 LYS 95 HG1 LYS 95 -3.340 7.271 4.593 729 HD2 LYS 95 HD2 LYS 95 -1.225 6.584 3.610 730 HD3 LYS 95 HD1 LYS 95 -0.598 8.224 3.773 731 HE2 LYS 95 HE2 LYS 95 -0.768 8.061 6.193 732 HE3 LYS 95 HE1 LYS 95 -1.444 6.437 6.047 733 HZ1 LYS 95 HZ1 LYS 95 1.268 7.234 6.052 734 HZ2 LYS 95 HZ2 LYS 95 0.915 6.444 4.600 735 HZ3 LYS 95 HZ3 LYS 95 0.619 5.671 6.075 Start of MODEL 9 1 H1 MET 8 HT1 MET 8 0.890 0.250 -0.555 2 H2 MET 8 HT2 MET 8 1.578 1.786 -0.392 3 H3 MET 8 HT3 MET 8 2.324 0.446 0.321 4 HA MET 8 HA MET 8 2.004 0.933 -2.579 5 HB2 MET 8 HB2 MET 8 3.893 1.957 -0.807 6 HB3 MET 8 HB1 MET 8 4.703 0.576 -1.537 7 HG2 MET 8 HG2 MET 8 5.265 2.422 -2.889 8 HG3 MET 8 HG1 MET 8 4.021 1.547 -3.783 9 HE1 MET 8 HE1 MET 8 4.896 4.526 -1.535 10 HE2 MET 8 HE2 MET 8 3.925 5.802 -2.268 11 HE3 MET 8 HE3 MET 8 5.173 4.993 -3.214 12 H ALA 9 HN ALA 9 2.401 -0.686 -3.912 13 HA ALA 9 HA ALA 9 3.051 -3.354 -2.830 14 HB1 ALA 9 HB1 ALA 9 0.810 -3.282 -3.728 15 HB2 ALA 9 HB2 ALA 9 1.831 -4.252 -4.791 16 HB3 ALA 9 HB3 ALA 9 1.400 -2.601 -5.243 17 H LYS 10 HN LYS 10 4.615 -4.555 -3.756 18 HA LYS 10 HA LYS 10 6.275 -3.341 -5.859 19 HB2 LYS 10 HB2 LYS 10 6.994 -4.800 -3.354 20 HB3 LYS 10 HB1 LYS 10 8.038 -4.984 -4.756 21 HG2 LYS 10 HG2 LYS 10 8.383 -2.582 -4.840 22 HG3 LYS 10 HG1 LYS 10 7.291 -2.366 -3.470 23 HD2 LYS 10 HD2 LYS 10 8.781 -3.642 -2.044 24 HD3 LYS 10 HD1 LYS 10 9.848 -3.966 -3.411 25 HE2 LYS 10 HE2 LYS 10 10.288 -1.568 -3.629 26 HE3 LYS 10 HE1 LYS 10 9.229 -1.250 -2.255 27 HZ1 LYS 10 HZ1 LYS 10 10.723 -2.161 -0.781 28 HZ2 LYS 10 HZ2 LYS 10 11.763 -1.419 -1.890 29 HZ3 LYS 10 HZ3 LYS 10 11.508 -3.090 -1.958 30 H CYS 11 HN CYS 11 6.850 -4.506 -7.581 31 HA CYS 11 HA CYS 11 5.447 -6.908 -8.260 32 HB2 CYS 11 HB2 CYS 11 6.169 -5.077 -9.911 33 HB3 CYS 11 HB1 CYS 11 7.765 -5.784 -9.835 34 HA PRO 12 HA PRO 12 8.776 -9.771 -6.554 35 HB2 PRO 12 HB2 PRO 12 7.181 -11.905 -7.888 36 HB3 PRO 12 HB1 PRO 12 7.759 -11.834 -6.217 37 HG2 PRO 12 HG2 PRO 12 5.191 -11.448 -6.690 38 HG3 PRO 12 HG1 PRO 12 6.034 -10.357 -5.565 39 HD2 PRO 12 HD2 PRO 12 5.368 -9.901 -8.480 40 HD3 PRO 12 HD1 PRO 12 5.045 -8.850 -7.081 41 H ILE 13 HN ILE 13 7.549 -9.788 -9.870 42 HA ILE 13 HA ILE 13 9.545 -11.334 -11.158 43 HB ILE 13 HB ILE 13 7.702 -9.291 -12.510 44 HG12 ILE 13 HG12 ILE 13 6.632 -11.905 -12.870 45 HG13 ILE 13 HG11 ILE 13 6.965 -11.749 -11.153 46 HG21 ILE 13 HG21 ILE 13 8.357 -11.902 -13.838 47 HG22 ILE 13 HG22 ILE 13 9.646 -10.705 -13.773 48 HG23 ILE 13 HG23 ILE 13 8.124 -10.310 -14.566 49 HD11 ILE 13 HD11 ILE 13 5.350 -9.771 -12.739 50 HD12 ILE 13 HD12 ILE 13 5.562 -9.825 -10.990 51 HD13 ILE 13 HD13 ILE 13 4.667 -11.105 -11.809 52 H CYS 14 HN CYS 14 9.145 -7.662 -11.106 53 HA CYS 14 HA CYS 14 11.890 -7.484 -12.144 54 HB2 CYS 14 HB2 CYS 14 11.265 -5.225 -12.966 55 HB3 CYS 14 HB1 CYS 14 10.308 -6.509 -13.677 56 H GLY 15 HN GLY 15 9.641 -5.999 -9.793 57 HA2 GLY 15 HA2 GLY 15 10.245 -5.544 -7.514 58 HA3 GLY 15 HA1 GLY 15 11.912 -5.344 -8.024 59 H SER 16 HN SER 16 9.195 -3.877 -9.726 60 HA SER 16 HA SER 16 10.235 -1.205 -9.173 61 HB2 SER 16 HB2 SER 16 9.250 -2.401 -11.452 62 HB3 SER 16 HB1 SER 16 7.927 -1.358 -10.934 63 HG SER 16 HG SER 16 9.038 0.296 -11.562 64 HA PRO 17 HA PRO 17 6.778 -0.144 -6.294 65 HB2 PRO 17 HB2 PRO 17 6.894 2.677 -7.206 66 HB3 PRO 17 HB1 PRO 17 7.120 2.033 -5.574 67 HG2 PRO 17 HG2 PRO 17 9.215 2.956 -6.915 68 HG3 PRO 17 HG1 PRO 17 9.358 1.441 -5.995 69 HD2 PRO 17 HD2 PRO 17 8.865 1.799 -8.955 70 HD3 PRO 17 HD1 PRO 17 10.097 0.813 -8.139 71 H LEU 18 HN LEU 18 4.654 -0.116 -6.336 72 HA LEU 18 HA LEU 18 3.184 0.763 -8.741 73 HB2 LEU 18 HB2 LEU 18 2.743 -1.663 -7.004 74 HB3 LEU 18 HB1 LEU 18 1.473 -1.010 -8.025 75 HG LEU 18 HG LEU 18 3.955 -1.485 -9.494 76 HD11 LEU 18 HD11 LEU 18 3.735 -3.943 -9.486 77 HD12 LEU 18 HD12 LEU 18 2.585 -3.812 -8.156 78 HD13 LEU 18 HD13 LEU 18 4.256 -3.294 -7.931 79 HD21 LEU 18 HD21 LEU 18 1.166 -2.576 -9.860 80 HD22 LEU 18 HD22 LEU 18 2.447 -2.497 -11.070 81 HD23 LEU 18 HD23 LEU 18 1.713 -1.012 -10.464 82 H LYS 19 HN LYS 19 1.295 1.832 -8.470 83 HA LYS 19 HA LYS 19 0.770 2.990 -5.829 84 HB2 LYS 19 HB2 LYS 19 0.218 3.817 -8.654 85 HB3 LYS 19 HB1 LYS 19 -0.816 4.443 -7.379 86 HG2 LYS 19 HG2 LYS 19 1.075 5.442 -6.271 87 HG3 LYS 19 HG1 LYS 19 2.182 4.715 -7.437 88 HD2 LYS 19 HD2 LYS 19 1.152 6.014 -9.230 89 HD3 LYS 19 HD1 LYS 19 0.026 6.730 -8.074 90 HE2 LYS 19 HE2 LYS 19 1.896 7.731 -6.867 91 HE3 LYS 19 HE1 LYS 19 3.029 6.998 -8.001 92 HZ1 LYS 19 HZ1 LYS 19 2.538 8.494 -9.601 93 HZ2 LYS 19 HZ2 LYS 19 2.129 9.460 -8.275 94 HZ3 LYS 19 HZ3 LYS 19 0.918 8.653 -9.139 95 H TRP 20 HN TRP 20 -1.034 2.663 -4.690 96 HA TRP 20 HA TRP 20 -2.879 0.561 -5.257 97 HB2 TRP 20 HB2 TRP 20 -2.523 2.533 -3.058 98 HB3 TRP 20 HB1 TRP 20 -4.076 1.710 -3.185 99 HD1 TRP 20 HD1 TRP 20 -0.513 1.187 -2.107 100 HE1 TRP 20 HE1 TRP 20 -0.203 -1.180 -1.146 101 HE3 TRP 20 HE3 TRP 20 -5.040 -0.907 -3.439 102 HZ2 TRP 20 HZ2 TRP 20 -1.637 -3.569 -0.971 103 HZ3 TRP 20 HZ3 TRP 20 -5.459 -3.247 -2.819 104 HH2 TRP 20 HH2 TRP 20 -3.785 -4.550 -1.610 105 H GLU 21 HN GLU 21 -2.975 3.983 -5.783 106 HA GLU 21 HA GLU 21 -5.761 4.354 -6.327 107 HB2 GLU 21 HB2 GLU 21 -5.010 6.573 -7.353 108 HB3 GLU 21 HB1 GLU 21 -4.658 6.343 -5.658 109 HG2 GLU 21 HG2 GLU 21 -2.300 5.959 -6.171 110 HG3 GLU 21 HG1 GLU 21 -2.632 6.069 -7.897 111 H GLU 22 HN GLU 22 -3.008 3.430 -8.329 112 HA GLU 22 HA GLU 22 -4.186 3.772 -10.928 113 HB2 GLU 22 HB2 GLU 22 -1.703 2.540 -9.837 114 HB3 GLU 22 HB1 GLU 22 -2.198 2.101 -11.465 115 HG2 GLU 22 HG2 GLU 22 -2.126 5.001 -10.824 116 HG3 GLU 22 HG1 GLU 22 -0.575 4.178 -10.981 117 H LEU 23 HN LEU 23 -3.958 1.057 -8.660 118 HA LEU 23 HA LEU 23 -4.903 -1.066 -10.297 119 HB2 LEU 23 HB2 LEU 23 -4.627 -0.647 -7.347 120 HB3 LEU 23 HB1 LEU 23 -5.504 -2.041 -7.939 121 HG LEU 23 HG LEU 23 -2.899 -1.733 -9.209 122 HD11 LEU 23 HD11 LEU 23 -1.659 -2.495 -7.171 123 HD12 LEU 23 HD12 LEU 23 -3.078 -2.069 -6.213 124 HD13 LEU 23 HD13 LEU 23 -2.207 -0.819 -7.105 125 HD21 LEU 23 HD21 LEU 23 -2.755 -4.094 -8.712 126 HD22 LEU 23 HD22 LEU 23 -4.369 -3.729 -9.323 127 HD23 LEU 23 HD23 LEU 23 -4.116 -3.977 -7.595 128 H ILE 24 HN ILE 24 -6.618 1.184 -8.128 129 HA ILE 24 HA ILE 24 -9.240 -0.014 -8.434 130 HB ILE 24 HB ILE 24 -8.710 2.724 -7.228 131 HG12 ILE 24 HG12 ILE 24 -7.229 1.433 -5.858 132 HG13 ILE 24 HG11 ILE 24 -8.661 1.706 -4.900 133 HG21 ILE 24 HG21 ILE 24 -10.738 2.493 -5.936 134 HG22 ILE 24 HG22 ILE 24 -10.960 0.840 -6.510 135 HG23 ILE 24 HG23 ILE 24 -11.084 2.185 -7.642 136 HD11 ILE 24 HD11 ILE 24 -7.731 -0.904 -6.129 137 HD12 ILE 24 HD12 ILE 24 -9.303 -0.699 -5.362 138 HD13 ILE 24 HD13 ILE 24 -7.833 -0.487 -4.417 139 H GLU 25 HN GLU 25 -7.562 2.871 -9.772 140 HA GLU 25 HA GLU 25 -9.711 4.024 -11.219 141 HB2 GLU 25 HB2 GLU 25 -7.119 4.737 -10.594 142 HB3 GLU 25 HB1 GLU 25 -7.075 4.560 -12.342 143 HG2 GLU 25 HG2 GLU 25 -8.968 6.103 -12.542 144 HG3 GLU 25 HG1 GLU 25 -9.002 6.280 -10.788 145 H GLU 26 HN GLU 26 -7.181 1.689 -12.229 146 HA GLU 26 HA GLU 26 -7.973 1.434 -14.975 147 HB2 GLU 26 HB2 GLU 26 -6.145 -0.075 -13.142 148 HB3 GLU 26 HB1 GLU 26 -6.480 -0.651 -14.746 149 HG2 GLU 26 HG2 GLU 26 -5.592 1.415 -15.713 150 HG3 GLU 26 HG1 GLU 26 -5.256 2.018 -14.092 151 H MET 27 HN MET 27 -9.176 0.072 -12.039 152 HA MET 27 HA MET 27 -10.421 -2.211 -13.385 153 HB2 MET 27 HB2 MET 27 -9.385 -1.857 -10.605 154 HB3 MET 27 HB1 MET 27 -10.749 -2.934 -10.848 155 HG2 MET 27 HG2 MET 27 -8.156 -3.191 -12.351 156 HG3 MET 27 HG1 MET 27 -8.496 -4.038 -10.843 157 HE1 MET 27 HE1 MET 27 -9.776 -7.234 -12.086 158 HE2 MET 27 HE2 MET 27 -9.495 -6.217 -10.673 159 HE3 MET 27 HE3 MET 27 -8.190 -6.510 -11.824 160 H LEU 28 HN LEU 28 -11.244 0.822 -12.889 161 HA LEU 28 HA LEU 28 -13.829 0.468 -11.585 162 HB2 LEU 28 HB2 LEU 28 -11.992 2.462 -11.405 163 HB3 LEU 28 HB1 LEU 28 -13.079 3.153 -12.593 164 HG LEU 28 HG LEU 28 -14.821 2.295 -10.627 165 HD11 LEU 28 HD11 LEU 28 -13.958 3.048 -8.509 166 HD12 LEU 28 HD12 LEU 28 -12.412 3.467 -9.246 167 HD13 LEU 28 HD13 LEU 28 -12.915 1.780 -9.151 168 HD21 LEU 28 HD21 LEU 28 -15.063 4.358 -11.746 169 HD22 LEU 28 HD22 LEU 28 -13.540 4.972 -11.098 170 HD23 LEU 28 HD23 LEU 28 -14.918 4.713 -10.027 171 H ILE 29 HN ILE 29 -13.094 -0.464 -14.400 172 HA ILE 29 HA ILE 29 -15.036 0.849 -16.131 173 HB ILE 29 HB ILE 29 -14.168 -0.849 -17.876 174 HG12 ILE 29 HG12 ILE 29 -11.481 -1.049 -16.887 175 HG13 ILE 29 HG11 ILE 29 -12.550 -1.803 -15.711 176 HG21 ILE 29 HG21 ILE 29 -12.416 1.324 -16.790 177 HG22 ILE 29 HG22 ILE 29 -13.677 1.473 -18.013 178 HG23 ILE 29 HG23 ILE 29 -12.202 0.574 -18.373 179 HD11 ILE 29 HD11 ILE 29 -13.446 -3.257 -17.430 180 HD12 ILE 29 HD12 ILE 29 -11.691 -3.404 -17.341 181 HD13 ILE 29 HD13 ILE 29 -12.435 -2.473 -18.641 182 H ILE 30 HN ILE 30 -15.621 -1.092 -13.790 183 HA ILE 30 HA ILE 30 -17.444 -2.993 -15.140 184 HB ILE 30 HB ILE 30 -16.396 -3.547 -12.315 185 HG12 ILE 30 HG12 ILE 30 -15.147 -5.332 -14.243 186 HG13 ILE 30 HG11 ILE 30 -14.723 -3.668 -14.622 187 HG21 ILE 30 HG21 ILE 30 -17.317 -5.688 -12.504 188 HG22 ILE 30 HG22 ILE 30 -17.105 -5.738 -14.254 189 HG23 ILE 30 HG23 ILE 30 -18.423 -4.799 -13.556 190 HD11 ILE 30 HD11 ILE 30 -13.076 -4.752 -13.175 191 HD12 ILE 30 HD12 ILE 30 -14.319 -4.996 -11.947 192 HD13 ILE 30 HD13 ILE 30 -13.825 -3.361 -12.393 193 H GLU 31 HN GLU 31 -19.514 -3.030 -14.550 194 HA GLU 31 HA GLU 31 -20.636 -0.910 -12.900 195 HB2 GLU 31 HB2 GLU 31 -21.791 -2.924 -14.806 196 HB3 GLU 31 HB1 GLU 31 -22.845 -2.045 -13.710 197 HG2 GLU 31 HG2 GLU 31 -22.030 0.077 -14.658 198 HG3 GLU 31 HG1 GLU 31 -21.018 -0.831 -15.781 199 H ASN 32 HN ASN 32 -19.862 -4.241 -12.493 200 HA ASN 32 HA ASN 32 -21.643 -4.749 -10.230 201 HB2 ASN 32 HB2 ASN 32 -19.783 -6.444 -11.890 202 HB3 ASN 32 HB1 ASN 32 -20.349 -7.028 -10.329 203 HD21 ASN 32 HD21 ASN 32 -20.988 -6.872 -13.585 204 HD22 ASN 32 HD22 ASN 32 -22.651 -7.340 -13.562 205 H PHE 33 HN PHE 33 -19.295 -2.780 -10.204 206 HA PHE 33 HA PHE 33 -17.258 -3.826 -8.394 207 HB2 PHE 33 HB2 PHE 33 -16.972 -2.040 -10.334 208 HB3 PHE 33 HB1 PHE 33 -17.361 -0.918 -9.055 209 HD1 PHE 33 HD1 PHE 33 -14.873 -3.396 -10.217 210 HD2 PHE 33 HD2 PHE 33 -15.798 -0.466 -7.260 211 HE1 PHE 33 HE1 PHE 33 -12.556 -3.480 -9.409 212 HE2 PHE 33 HE2 PHE 33 -13.475 -0.553 -6.455 213 HZ PHE 33 HZ PHE 33 -11.854 -2.059 -7.531 214 H GLU 34 HN GLU 34 -20.038 -1.661 -8.305 215 HA GLU 34 HA GLU 34 -19.932 -0.522 -5.750 216 HB2 GLU 34 HB2 GLU 34 -22.189 -1.164 -7.590 217 HB3 GLU 34 HB1 GLU 34 -22.526 -0.549 -5.980 218 HG2 GLU 34 HG2 GLU 34 -21.129 1.424 -6.472 219 HG3 GLU 34 HG1 GLU 34 -20.894 0.817 -8.111 220 H GLU 35 HN GLU 35 -20.775 -3.798 -6.586 221 HA GLU 35 HA GLU 35 -22.021 -4.548 -4.065 222 HB2 GLU 35 HB2 GLU 35 -21.304 -6.053 -6.575 223 HB3 GLU 35 HB1 GLU 35 -21.779 -6.915 -5.123 224 HG2 GLU 35 HG2 GLU 35 -23.933 -5.747 -5.145 225 HG3 GLU 35 HG1 GLU 35 -23.451 -4.901 -6.616 226 H ILE 36 HN ILE 36 -18.880 -5.125 -5.715 227 HA ILE 36 HA ILE 36 -17.688 -6.751 -3.645 228 HB ILE 36 HB ILE 36 -16.157 -5.398 -5.941 229 HG12 ILE 36 HG12 ILE 36 -16.633 -8.284 -6.233 230 HG13 ILE 36 HG11 ILE 36 -18.133 -7.368 -6.261 231 HG21 ILE 36 HG21 ILE 36 -15.117 -6.708 -3.771 232 HG22 ILE 36 HG22 ILE 36 -14.300 -6.655 -5.337 233 HG23 ILE 36 HG23 ILE 36 -15.291 -8.051 -4.899 234 HD11 ILE 36 HD11 ILE 36 -16.997 -7.866 -8.495 235 HD12 ILE 36 HD12 ILE 36 -15.814 -6.643 -8.031 236 HD13 ILE 36 HD13 ILE 36 -17.513 -6.204 -8.204 237 H VAL 37 HN VAL 37 -17.455 -3.289 -4.531 238 HA VAL 37 HA VAL 37 -15.466 -2.532 -2.659 239 HB VAL 37 HB VAL 37 -16.122 -1.429 -4.888 240 HG11 VAL 37 HG11 VAL 37 -18.531 -0.813 -3.910 241 HG12 VAL 37 HG12 VAL 37 -17.745 0.167 -5.152 242 HG13 VAL 37 HG13 VAL 37 -17.682 0.660 -3.462 243 HG21 VAL 37 HG21 VAL 37 -15.245 0.805 -4.164 244 HG22 VAL 37 HG22 VAL 37 -14.277 -0.587 -3.675 245 HG23 VAL 37 HG23 VAL 37 -15.321 0.217 -2.502 246 H LYS 38 HN LYS 38 -18.755 -3.187 -2.105 247 HA LYS 38 HA LYS 38 -19.073 -1.618 0.336 248 HB2 LYS 38 HB2 LYS 38 -20.860 -3.361 -1.316 249 HB3 LYS 38 HB1 LYS 38 -21.298 -3.024 0.351 250 HG2 LYS 38 HG2 LYS 38 -21.311 -0.640 -0.111 251 HG3 LYS 38 HG1 LYS 38 -20.797 -0.945 -1.771 252 HD2 LYS 38 HD2 LYS 38 -22.858 -2.190 -2.182 253 HD3 LYS 38 HD1 LYS 38 -23.371 -1.899 -0.519 254 HE2 LYS 38 HE2 LYS 38 -23.378 0.507 -0.941 255 HE3 LYS 38 HE1 LYS 38 -22.849 0.223 -2.600 256 HZ1 LYS 38 HZ1 LYS 38 -24.933 -1.147 -2.841 257 HZ2 LYS 38 HZ2 LYS 38 -25.162 0.522 -2.694 258 HZ3 LYS 38 HZ3 LYS 38 -25.445 -0.490 -1.369 259 H ASP 39 HN ASP 39 -18.111 -4.824 -0.585 260 HA ASP 39 HA ASP 39 -18.094 -5.731 2.197 261 HB2 ASP 39 HB2 ASP 39 -19.035 -7.126 -0.261 262 HB3 ASP 39 HB1 ASP 39 -18.173 -8.099 0.928 263 H ARG 40 HN ARG 40 -16.091 -5.389 2.795 264 HA ARG 40 HA ARG 40 -13.675 -5.646 1.462 265 HB2 ARG 40 HB2 ARG 40 -12.591 -5.820 3.740 266 HB3 ARG 40 HB1 ARG 40 -13.669 -4.461 3.526 267 HG2 ARG 40 HG2 ARG 40 -15.287 -6.443 4.683 268 HG3 ARG 40 HG1 ARG 40 -13.760 -6.546 5.561 269 HD2 ARG 40 HD2 ARG 40 -13.863 -4.119 5.949 270 HD3 ARG 40 HD1 ARG 40 -15.415 -4.064 5.115 271 HE ARG 40 HE ARG 40 -15.907 -5.878 7.008 272 HH11 ARG 40 HH11 ARG 40 -14.467 -2.626 7.474 273 HH12 ARG 40 HH12 ARG 40 -15.063 -2.512 9.096 274 HH21 ARG 40 HH21 ARG 40 -16.628 -5.634 9.093 275 HH22 ARG 40 HH22 ARG 40 -16.273 -4.202 10.000 276 H GLU 41 HN GLU 41 -15.467 -8.206 3.034 277 HA GLU 41 HA GLU 41 -13.583 -10.325 2.992 278 HB2 GLU 41 HB2 GLU 41 -16.137 -9.897 3.963 279 HB3 GLU 41 HB1 GLU 41 -16.363 -11.139 2.747 280 HG2 GLU 41 HG2 GLU 41 -14.634 -12.500 3.848 281 HG3 GLU 41 HG1 GLU 41 -14.481 -11.256 5.090 282 H ARG 42 HN ARG 42 -15.927 -9.152 0.603 283 HA ARG 42 HA ARG 42 -15.519 -11.241 -1.352 284 HB2 ARG 42 HB2 ARG 42 -17.144 -8.727 -1.239 285 HB3 ARG 42 HB1 ARG 42 -16.858 -9.500 -2.790 286 HG2 ARG 42 HG2 ARG 42 -17.891 -11.555 -1.959 287 HG3 ARG 42 HG1 ARG 42 -18.173 -10.783 -0.396 288 HD2 ARG 42 HD2 ARG 42 -19.599 -9.117 -1.465 289 HD3 ARG 42 HD1 ARG 42 -19.297 -9.849 -3.039 290 HE ARG 42 HE ARG 42 -20.373 -11.716 -1.159 291 HH11 ARG 42 HH11 ARG 42 -21.526 -9.203 -3.440 292 HH12 ARG 42 HH12 ARG 42 -23.095 -9.928 -3.567 293 HH21 ARG 42 HH21 ARG 42 -22.423 -12.570 -1.393 294 HH22 ARG 42 HH22 ARG 42 -23.591 -11.809 -2.420 295 H PHE 43 HN PHE 43 -14.306 -7.922 -0.834 296 HA PHE 43 HA PHE 43 -13.007 -7.559 -3.370 297 HB2 PHE 43 HB2 PHE 43 -13.796 -5.772 -1.571 298 HB3 PHE 43 HB1 PHE 43 -12.171 -5.996 -0.945 299 HD1 PHE 43 HD1 PHE 43 -10.193 -5.425 -2.410 300 HD2 PHE 43 HD2 PHE 43 -14.194 -4.422 -3.498 301 HE1 PHE 43 HE1 PHE 43 -9.340 -3.782 -4.020 302 HE2 PHE 43 HE2 PHE 43 -13.336 -2.778 -5.118 303 HZ PHE 43 HZ PHE 43 -10.911 -2.467 -5.378 304 H LEU 44 HN LEU 44 -11.752 -8.505 -0.124 305 HA LEU 44 HA LEU 44 -8.989 -8.744 -0.864 306 HB2 LEU 44 HB2 LEU 44 -10.605 -9.538 1.525 307 HB3 LEU 44 HB1 LEU 44 -8.979 -10.165 1.339 308 HG LEU 44 HG LEU 44 -9.158 -7.254 0.999 309 HD11 LEU 44 HD11 LEU 44 -9.397 -6.821 3.416 310 HD12 LEU 44 HD12 LEU 44 -9.849 -8.511 3.647 311 HD13 LEU 44 HD13 LEU 44 -10.869 -7.449 2.676 312 HD21 LEU 44 HD21 LEU 44 -7.051 -8.565 1.178 313 HD22 LEU 44 HD22 LEU 44 -7.481 -8.954 2.843 314 HD23 LEU 44 HD23 LEU 44 -7.188 -7.279 2.377 315 H ALA 45 HN ALA 45 -11.687 -10.942 -0.797 316 HA ALA 45 HA ALA 45 -10.334 -13.436 -1.314 317 HB1 ALA 45 HB1 ALA 45 -12.550 -14.355 -1.724 318 HB2 ALA 45 HB2 ALA 45 -13.229 -12.728 -1.756 319 HB3 ALA 45 HB3 ALA 45 -12.539 -13.366 -0.264 320 H GLN 46 HN GLN 46 -11.725 -10.921 -3.388 321 HA GLN 46 HA GLN 46 -11.541 -12.363 -5.886 322 HB2 GLN 46 HB2 GLN 46 -12.943 -10.134 -5.046 323 HB3 GLN 46 HB1 GLN 46 -11.718 -9.450 -6.105 324 HG2 GLN 46 HG2 GLN 46 -12.417 -10.969 -7.896 325 HG3 GLN 46 HG1 GLN 46 -13.654 -11.640 -6.836 326 HE21 GLN 46 HE21 GLN 46 -15.589 -10.806 -6.967 327 HE22 GLN 46 HE22 GLN 46 -16.006 -9.278 -7.655 328 H VAL 47 HN VAL 47 -9.517 -9.928 -4.207 329 HA VAL 47 HA VAL 47 -7.610 -9.457 -6.319 330 HB VAL 47 HB VAL 47 -7.276 -8.860 -3.320 331 HG11 VAL 47 HG11 VAL 47 -5.100 -8.838 -4.767 332 HG12 VAL 47 HG12 VAL 47 -5.425 -7.455 -3.723 333 HG13 VAL 47 HG13 VAL 47 -5.763 -7.356 -5.449 334 HG21 VAL 47 HG21 VAL 47 -8.144 -7.013 -5.544 335 HG22 VAL 47 HG22 VAL 47 -7.751 -6.509 -3.900 336 HG23 VAL 47 HG23 VAL 47 -9.125 -7.577 -4.190 337 H GLU 48 HN GLU 48 -7.691 -11.693 -3.515 338 HA GLU 48 HA GLU 48 -5.102 -12.906 -3.797 339 HB2 GLU 48 HB2 GLU 48 -7.580 -13.746 -2.288 340 HB3 GLU 48 HB1 GLU 48 -6.103 -14.692 -2.279 341 HG2 GLU 48 HG2 GLU 48 -4.917 -12.665 -1.371 342 HG3 GLU 48 HG1 GLU 48 -6.500 -11.901 -1.217 343 H GLU 49 HN GLU 49 -8.190 -13.549 -5.306 344 HA GLU 49 HA GLU 49 -7.434 -16.169 -6.394 345 HB2 GLU 49 HB2 GLU 49 -10.018 -14.629 -6.322 346 HB3 GLU 49 HB1 GLU 49 -9.817 -16.008 -7.390 347 HG2 GLU 49 HG2 GLU 49 -9.328 -17.424 -5.432 348 HG3 GLU 49 HG1 GLU 49 -9.591 -16.028 -4.386 349 H PHE 50 HN PHE 50 -7.691 -12.846 -7.420 350 HA PHE 50 HA PHE 50 -7.470 -13.555 -10.272 351 HB2 PHE 50 HB2 PHE 50 -9.032 -11.597 -9.013 352 HB3 PHE 50 HB1 PHE 50 -7.732 -10.703 -9.782 353 HD1 PHE 50 HD2 PHE 50 -10.686 -12.802 -10.334 354 HD2 PHE 50 HD1 PHE 50 -7.535 -10.627 -12.214 355 HE1 PHE 50 HE2 PHE 50 -11.889 -12.910 -12.476 356 HE2 PHE 50 HE1 PHE 50 -8.742 -10.731 -14.353 357 HZ PHE 50 HZ PHE 50 -10.918 -11.875 -14.487 358 H VAL 51 HN VAL 51 -5.845 -12.918 -11.531 359 HA VAL 51 HA VAL 51 -3.369 -12.078 -10.280 360 HB VAL 51 HB VAL 51 -2.431 -12.533 -12.663 361 HG11 VAL 51 HG11 VAL 51 -2.107 -14.926 -12.081 362 HG12 VAL 51 HG12 VAL 51 -3.272 -14.698 -10.778 363 HG13 VAL 51 HG13 VAL 51 -1.758 -13.794 -10.772 364 HG21 VAL 51 HG21 VAL 51 -3.426 -14.151 -14.069 365 HG22 VAL 51 HG22 VAL 51 -4.705 -12.980 -13.742 366 HG23 VAL 51 HG23 VAL 51 -4.681 -14.520 -12.880 367 H PHE 52 HN PHE 52 -1.986 -10.489 -11.170 368 HA PHE 52 HA PHE 52 -3.343 -8.320 -12.651 369 HB2 PHE 52 HB2 PHE 52 -1.491 -7.970 -10.276 370 HB3 PHE 52 HB1 PHE 52 -2.072 -6.658 -11.278 371 HD1 PHE 52 HD1 PHE 52 -4.413 -5.904 -11.119 372 HD2 PHE 52 HD2 PHE 52 -2.917 -9.022 -8.627 373 HE1 PHE 52 HE1 PHE 52 -6.377 -5.677 -9.656 374 HE2 PHE 52 HE2 PHE 52 -4.877 -8.798 -7.160 375 HZ PHE 52 HZ PHE 52 -6.615 -7.125 -7.679 376 H LYS 53 HN LYS 53 -2.158 -7.151 -14.060 377 HA LYS 53 HA LYS 53 0.330 -8.361 -15.048 378 HB2 LYS 53 HB2 LYS 53 -1.828 -6.699 -16.283 379 HB3 LYS 53 HB1 LYS 53 -0.222 -6.661 -16.996 380 HG2 LYS 53 HG2 LYS 53 -0.287 -9.058 -17.344 381 HG3 LYS 53 HG1 LYS 53 -1.861 -9.148 -16.552 382 HD2 LYS 53 HD2 LYS 53 -2.825 -7.737 -18.297 383 HD3 LYS 53 HD1 LYS 53 -1.249 -7.622 -19.083 384 HE2 LYS 53 HE2 LYS 53 -1.250 -10.039 -19.439 385 HE3 LYS 53 HE1 LYS 53 -2.818 -10.161 -18.642 386 HZ1 LYS 53 HZ1 LYS 53 -3.713 -9.848 -20.631 387 HZ2 LYS 53 HZ2 LYS 53 -2.221 -9.472 -21.334 388 HZ3 LYS 53 HZ3 LYS 53 -3.138 -8.258 -20.597 389 H CYS 54 HN CYS 54 2.215 -7.293 -15.293 390 HA CYS 54 HA CYS 54 2.523 -4.784 -13.840 391 HB2 CYS 54 HB2 CYS 54 3.977 -6.759 -13.302 392 HB3 CYS 54 HB1 CYS 54 4.707 -6.594 -14.892 393 HA PRO 55 HA PRO 55 3.059 -2.519 -17.810 394 HB2 PRO 55 HB2 PRO 55 3.649 -0.029 -16.881 395 HB3 PRO 55 HB1 PRO 55 2.013 -0.689 -16.825 396 HG2 PRO 55 HG2 PRO 55 4.051 -0.464 -14.618 397 HG3 PRO 55 HG1 PRO 55 2.299 -0.176 -14.549 398 HD2 PRO 55 HD2 PRO 55 3.502 -2.510 -13.697 399 HD3 PRO 55 HD1 PRO 55 1.828 -2.423 -14.270 400 H VAL 56 HN VAL 56 5.513 -3.335 -15.694 401 HA VAL 56 HA VAL 56 7.732 -1.969 -17.053 402 HB VAL 56 HB VAL 56 8.280 -3.664 -14.617 403 HG11 VAL 56 HG11 VAL 56 9.990 -2.051 -14.111 404 HG12 VAL 56 HG12 VAL 56 9.383 -0.951 -15.348 405 HG13 VAL 56 HG13 VAL 56 10.107 -2.488 -15.816 406 HG21 VAL 56 HG21 VAL 56 7.660 -0.877 -13.856 407 HG22 VAL 56 HG22 VAL 56 7.299 -2.375 -12.996 408 HG23 VAL 56 HG23 VAL 56 6.248 -1.830 -14.302 409 H CYS 57 HN CYS 57 6.885 -5.285 -15.865 410 HA CYS 57 HA CYS 57 8.707 -6.445 -17.848 411 HB2 CYS 57 HB2 CYS 57 8.520 -8.551 -16.495 412 HB3 CYS 57 HB1 CYS 57 9.222 -7.196 -15.632 413 H GLY 58 HN GLY 58 5.403 -7.069 -16.548 414 HA2 GLY 58 HA2 GLY 58 3.467 -7.167 -18.005 415 HA3 GLY 58 HA1 GLY 58 4.496 -7.813 -19.266 416 H GLU 59 HN GLU 59 4.900 -9.078 -16.059 417 HA GLU 59 HA GLU 59 3.738 -11.668 -16.800 418 HB2 GLU 59 HB2 GLU 59 5.828 -10.760 -14.873 419 HB3 GLU 59 HB1 GLU 59 4.951 -12.237 -14.516 420 HG2 GLU 59 HG2 GLU 59 6.070 -12.031 -17.247 421 HG3 GLU 59 HG1 GLU 59 7.239 -12.219 -15.941 422 H GLU 60 HN GLU 60 2.229 -12.728 -15.593 423 HA GLU 60 HA GLU 60 0.452 -11.195 -13.904 424 HB2 GLU 60 HB2 GLU 60 0.399 -13.862 -15.237 425 HB3 GLU 60 HB1 GLU 60 -0.708 -13.580 -13.905 426 HG2 GLU 60 HG2 GLU 60 -1.826 -11.844 -15.064 427 HG3 GLU 60 HG1 GLU 60 -0.523 -11.692 -16.239 428 H PHE 61 HN PHE 61 0.158 -11.283 -11.832 429 HA PHE 61 HA PHE 61 1.447 -13.293 -10.127 430 HB2 PHE 61 HB2 PHE 61 2.095 -11.488 -8.477 431 HB3 PHE 61 HB1 PHE 61 2.999 -11.442 -9.977 432 HD1 PHE 61 HD1 PHE 61 0.580 -9.698 -7.856 433 HD2 PHE 61 HD2 PHE 61 2.762 -9.544 -11.506 434 HE1 PHE 61 HE1 PHE 61 0.042 -7.309 -8.069 435 HE2 PHE 61 HE2 PHE 61 2.227 -7.152 -11.724 436 HZ PHE 61 HZ PHE 61 0.870 -6.031 -10.006 437 H TYR 62 HN TYR 62 0.445 -13.714 -8.158 438 HA TYR 62 HA TYR 62 -2.424 -13.156 -8.122 439 HB2 TYR 62 HB2 TYR 62 -0.699 -15.272 -6.852 440 HB3 TYR 62 HB1 TYR 62 -2.355 -15.028 -6.328 441 HD1 TYR 62 HD2 TYR 62 -4.241 -15.488 -7.954 442 HD2 TYR 62 HD1 TYR 62 -0.188 -16.380 -8.906 443 HE1 TYR 62 HE2 TYR 62 -4.998 -16.989 -9.744 444 HE2 TYR 62 HE1 TYR 62 -0.938 -17.881 -10.701 445 HH TYR 62 HH TYR 62 -3.842 -17.840 -12.035 446 H GLY 63 HN GLY 63 -3.576 -12.557 -6.277 447 HA2 GLY 63 HA2 GLY 63 -2.301 -10.604 -4.546 448 HA3 GLY 63 HA1 GLY 63 -4.006 -10.949 -4.614 449 H LYS 64 HN LYS 64 -2.522 -13.833 -4.280 450 HA LYS 64 HA LYS 64 -2.993 -14.094 -1.410 451 HB2 LYS 64 HB2 LYS 64 -3.506 -15.805 -3.463 452 HB3 LYS 64 HB1 LYS 64 -1.986 -16.459 -2.872 453 HG2 LYS 64 HG2 LYS 64 -2.921 -16.765 -0.665 454 HG3 LYS 64 HG1 LYS 64 -4.420 -15.977 -1.154 455 HD2 LYS 64 HD2 LYS 64 -4.839 -17.771 -2.761 456 HD3 LYS 64 HD1 LYS 64 -3.335 -18.558 -2.275 457 HE2 LYS 64 HE2 LYS 64 -4.199 -18.771 0.012 458 HE3 LYS 64 HE1 LYS 64 -5.707 -18.011 -0.495 459 HZ1 LYS 64 HZ1 LYS 64 -5.876 -19.889 -2.153 460 HZ2 LYS 64 HZ2 LYS 64 -6.107 -20.301 -0.529 461 HZ3 LYS 64 HZ3 LYS 64 -4.637 -20.651 -1.288 462 H THR 65 HN THR 65 -0.301 -13.549 -3.465 463 HA THR 65 HA THR 65 1.759 -14.689 -1.737 464 HB THR 65 HB THR 65 3.360 -13.713 -3.468 465 HG1 THR 65 HG1 THR 65 1.024 -12.715 -4.414 466 HG21 THR 65 HG21 THR 65 2.934 -15.474 -5.127 467 HG22 THR 65 HG22 THR 65 1.331 -15.736 -4.436 468 HG23 THR 65 HG23 THR 65 2.774 -16.085 -3.479 469 H LEU 66 HN LEU 66 0.138 -11.666 -1.977 470 HA LEU 66 HA LEU 66 2.275 -9.914 -1.198 471 HB2 LEU 66 HB2 LEU 66 0.397 -8.237 -0.716 472 HB3 LEU 66 HB1 LEU 66 0.589 -8.763 -2.365 473 HG LEU 66 HG LEU 66 -1.391 -10.443 -1.640 474 HD11 LEU 66 HD11 LEU 66 -1.383 -9.515 0.699 475 HD12 LEU 66 HD12 LEU 66 -2.946 -9.477 -0.118 476 HD13 LEU 66 HD13 LEU 66 -1.987 -8.003 0.024 477 HD21 LEU 66 HD21 LEU 66 -2.937 -8.990 -2.708 478 HD22 LEU 66 HD22 LEU 66 -1.382 -8.712 -3.484 479 HD23 LEU 66 HD23 LEU 66 -1.988 -7.565 -2.291 480 HA PRO 67 HA PRO 67 2.233 -10.563 3.381 481 HB2 PRO 67 HB2 PRO 67 2.794 -7.678 3.809 482 HB3 PRO 67 HB1 PRO 67 3.751 -9.075 4.315 483 HG2 PRO 67 HG2 PRO 67 4.623 -7.532 2.339 484 HG3 PRO 67 HG1 PRO 67 4.755 -9.300 2.201 485 HD2 PRO 67 HD2 PRO 67 2.661 -7.473 1.021 486 HD3 PRO 67 HD1 PRO 67 3.625 -8.731 0.221 487 H ARG 68 HN ARG 68 1.020 -10.146 5.317 488 HA ARG 68 HA ARG 68 -1.690 -9.434 5.051 489 HB2 ARG 68 HB2 ARG 68 0.039 -9.980 7.427 490 HB3 ARG 68 HB1 ARG 68 -1.609 -9.414 7.653 491 HG2 ARG 68 HG2 ARG 68 -2.463 -11.325 6.425 492 HG3 ARG 68 HG1 ARG 68 -0.817 -11.881 6.110 493 HD2 ARG 68 HD2 ARG 68 -0.442 -12.183 8.488 494 HD3 ARG 68 HD1 ARG 68 -2.051 -11.553 8.842 495 HE ARG 68 HE ARG 68 -2.161 -13.791 7.078 496 HH11 ARG 68 HH11 ARG 68 -1.869 -13.156 10.593 497 HH12 ARG 68 HH12 ARG 68 -2.527 -14.704 11.009 498 HH21 ARG 68 HH21 ARG 68 -2.999 -15.761 7.717 499 HH22 ARG 68 HH22 ARG 68 -3.157 -16.157 9.397 500 H ARG 69 HN ARG 69 1.008 -7.421 6.208 501 HA ARG 69 HA ARG 69 -0.281 -5.153 7.159 502 HB2 ARG 69 HB2 ARG 69 2.375 -5.479 5.775 503 HB3 ARG 69 HB1 ARG 69 1.838 -3.926 6.392 504 HG2 ARG 69 HG2 ARG 69 1.723 -4.849 8.654 505 HG3 ARG 69 HG1 ARG 69 2.218 -6.427 8.041 506 HD2 ARG 69 HD2 ARG 69 4.195 -5.485 8.920 507 HD3 ARG 69 HD1 ARG 69 4.318 -5.239 7.180 508 HE ARG 69 HE ARG 69 3.242 -3.048 8.798 509 HH11 ARG 69 HH11 ARG 69 6.125 -4.143 6.975 510 HH12 ARG 69 HH12 ARG 69 6.772 -2.538 6.887 511 HH21 ARG 69 HH21 ARG 69 4.158 -1.023 8.622 512 HH22 ARG 69 HH22 ARG 69 5.669 -0.800 7.807 513 H GLU 70 HN GLU 70 0.463 -5.954 3.738 514 HA GLU 70 HA GLU 70 -0.553 -3.529 2.582 515 HB2 GLU 70 HB2 GLU 70 0.393 -6.153 1.502 516 HB3 GLU 70 HB1 GLU 70 -0.530 -5.086 0.460 517 HG2 GLU 70 HG2 GLU 70 1.130 -3.293 0.909 518 HG3 GLU 70 HG1 GLU 70 2.087 -4.470 1.810 519 H ALA 71 HN ALA 71 -1.926 -6.654 3.428 520 HA ALA 71 HA ALA 71 -4.426 -6.578 2.064 521 HB1 ALA 71 HB1 ALA 71 -3.700 -8.065 4.584 522 HB2 ALA 71 HB2 ALA 71 -3.427 -8.639 2.939 523 HB3 ALA 71 HB3 ALA 71 -5.072 -8.400 3.527 524 H GLU 72 HN GLU 72 -3.350 -5.325 5.188 525 HA GLU 72 HA GLU 72 -5.863 -4.550 6.327 526 HB2 GLU 72 HB2 GLU 72 -2.999 -3.944 6.972 527 HB3 GLU 72 HB1 GLU 72 -4.286 -3.058 7.775 528 HG2 GLU 72 HG2 GLU 72 -5.224 -5.196 8.574 529 HG3 GLU 72 HG1 GLU 72 -3.877 -6.047 7.821 530 H LYS 73 HN LYS 73 -3.637 -2.987 4.116 531 HA LYS 73 HA LYS 73 -4.534 -0.275 4.209 532 HB2 LYS 73 HB2 LYS 73 -2.932 -1.868 2.233 533 HB3 LYS 73 HB1 LYS 73 -3.458 -0.240 1.837 534 HG2 LYS 73 HG2 LYS 73 -2.271 0.634 3.772 535 HG3 LYS 73 HG1 LYS 73 -1.779 -1.000 4.222 536 HD2 LYS 73 HD2 LYS 73 -0.565 -1.193 2.087 537 HD3 LYS 73 HD1 LYS 73 -1.021 0.466 1.695 538 HE2 LYS 73 HE2 LYS 73 0.175 1.282 3.637 539 HE3 LYS 73 HE1 LYS 73 0.577 -0.368 4.111 540 HZ1 LYS 73 HZ1 LYS 73 1.807 -0.583 2.008 541 HZ2 LYS 73 HZ2 LYS 73 2.440 0.624 3.009 542 HZ3 LYS 73 HZ3 LYS 73 1.497 1.045 1.670 543 H VAL 74 HN VAL 74 -5.674 -3.108 2.507 544 HA VAL 74 HA VAL 74 -7.381 -1.957 0.520 545 HB VAL 74 HB VAL 74 -7.940 -4.741 1.628 546 HG11 VAL 74 HG11 VAL 74 -8.132 -3.650 -1.192 547 HG12 VAL 74 HG12 VAL 74 -9.486 -3.926 -0.095 548 HG13 VAL 74 HG13 VAL 74 -8.543 -5.291 -0.691 549 HG21 VAL 74 HG21 VAL 74 -5.855 -4.226 -0.492 550 HG22 VAL 74 HG22 VAL 74 -6.334 -5.785 0.177 551 HG23 VAL 74 HG23 VAL 74 -5.477 -4.616 1.184 552 H PHE 75 HN PHE 75 -7.928 -2.860 3.944 553 HA PHE 75 HA PHE 75 -10.730 -2.539 4.169 554 HB2 PHE 75 HB2 PHE 75 -8.412 -2.521 6.065 555 HB3 PHE 75 HB1 PHE 75 -9.967 -1.950 6.647 556 HD1 PHE 75 HD2 PHE 75 -8.076 -4.880 5.486 557 HD2 PHE 75 HD1 PHE 75 -11.812 -3.473 6.976 558 HE1 PHE 75 HE2 PHE 75 -8.757 -7.194 5.955 559 HE2 PHE 75 HE1 PHE 75 -12.494 -5.787 7.450 560 HZ PHE 75 HZ PHE 75 -10.969 -7.650 6.934 561 H GLU 76 HN GLU 76 -8.138 -0.164 4.071 562 HA GLU 76 HA GLU 76 -9.376 2.080 5.313 563 HB2 GLU 76 HB2 GLU 76 -6.830 1.482 4.612 564 HB3 GLU 76 HB1 GLU 76 -7.260 2.549 3.283 565 HG2 GLU 76 HG2 GLU 76 -6.476 4.150 4.714 566 HG3 GLU 76 HG1 GLU 76 -8.118 4.048 5.349 567 H LEU 77 HN LEU 77 -9.140 1.041 1.889 568 HA LEU 77 HA LEU 77 -10.444 3.338 0.789 569 HB2 LEU 77 HB2 LEU 77 -10.547 1.938 -1.315 570 HB3 LEU 77 HB1 LEU 77 -8.963 2.287 -0.718 571 HG LEU 77 HG LEU 77 -9.394 -0.193 0.341 572 HD11 LEU 77 HD11 LEU 77 -10.429 -1.614 -1.281 573 HD12 LEU 77 HD12 LEU 77 -10.663 -0.254 -2.384 574 HD13 LEU 77 HD13 LEU 77 -11.563 -0.322 -0.865 575 HD21 LEU 77 HD21 LEU 77 -8.088 -1.015 -1.688 576 HD22 LEU 77 HD22 LEU 77 -7.362 0.272 -0.725 577 HD23 LEU 77 HD23 LEU 77 -8.146 0.654 -2.258 578 H LEU 78 HN LEU 78 -11.530 0.220 1.934 579 HA LEU 78 HA LEU 78 -14.251 0.329 0.977 580 HB2 LEU 78 HB2 LEU 78 -12.615 -1.527 2.642 581 HB3 LEU 78 HB1 LEU 78 -14.358 -1.641 2.741 582 HG LEU 78 HG LEU 78 -13.492 -1.612 -0.033 583 HD11 LEU 78 HD11 LEU 78 -11.452 -2.601 0.677 584 HD12 LEU 78 HD12 LEU 78 -12.472 -3.863 -0.001 585 HD13 LEU 78 HD13 LEU 78 -12.297 -3.719 1.743 586 HD21 LEU 78 HD21 LEU 78 -14.934 -3.652 1.650 587 HD22 LEU 78 HD22 LEU 78 -14.818 -3.653 -0.108 588 HD23 LEU 78 HD23 LEU 78 -15.672 -2.350 0.717 589 H ASN 79 HN ASN 79 -12.584 1.468 3.827 590 HA ASN 79 HA ASN 79 -15.051 1.884 5.376 591 HB2 ASN 79 HB2 ASN 79 -12.159 1.663 6.059 592 HB3 ASN 79 HB1 ASN 79 -13.158 2.688 7.085 593 HD21 ASN 79 HD21 ASN 79 -12.188 -0.467 6.393 594 HD22 ASN 79 HD22 ASN 79 -13.294 -1.301 7.426 595 H ASP 80 HN ASP 80 -13.093 3.614 3.214 596 HA ASP 80 HA ASP 80 -13.766 6.241 4.334 597 HB2 ASP 80 HB2 ASP 80 -11.418 5.225 2.845 598 HB3 ASP 80 HB1 ASP 80 -11.960 6.836 2.392 599 H PHE 81 HN PHE 81 -15.890 5.269 3.411 600 HA PHE 81 HA PHE 81 -16.591 5.542 0.661 601 HB2 PHE 81 HB2 PHE 81 -18.024 5.024 3.164 602 HB3 PHE 81 HB1 PHE 81 -18.981 5.921 1.994 603 HD1 PHE 81 HD1 PHE 81 -19.614 4.897 -0.153 604 HD2 PHE 81 HD2 PHE 81 -17.406 2.708 2.770 605 HE1 PHE 81 HE1 PHE 81 -20.156 2.800 -1.314 606 HE2 PHE 81 HE2 PHE 81 -17.946 0.611 1.603 607 HZ PHE 81 HZ PHE 81 -19.319 0.656 -0.441 608 H LYS 82 HN LYS 82 -16.533 7.880 3.270 609 HA LYS 82 HA LYS 82 -17.412 10.046 1.484 610 HB2 LYS 82 HB2 LYS 82 -17.958 9.486 4.345 611 HB3 LYS 82 HB1 LYS 82 -17.590 11.161 3.959 612 HG2 LYS 82 HG2 LYS 82 -19.411 11.237 2.380 613 HG3 LYS 82 HG1 LYS 82 -19.746 9.524 2.646 614 HD2 LYS 82 HD2 LYS 82 -20.274 9.979 4.981 615 HD3 LYS 82 HD1 LYS 82 -19.909 11.689 4.740 616 HE2 LYS 82 HE2 LYS 82 -21.721 11.844 3.108 617 HE3 LYS 82 HE1 LYS 82 -22.084 10.134 3.345 618 HZ1 LYS 82 HZ1 LYS 82 -22.157 11.100 5.858 619 HZ2 LYS 82 HZ2 LYS 82 -23.513 10.886 4.869 620 HZ3 LYS 82 HZ3 LYS 82 -22.777 12.404 4.976 621 H GLY 83 HN GLY 83 -15.781 11.132 0.714 622 HA2 GLY 83 HA2 GLY 83 -13.997 12.658 0.776 623 HA3 GLY 83 HA1 GLY 83 -13.611 12.126 2.401 624 H GLY 84 HN GLY 84 -12.832 11.942 -0.886 625 HA2 GLY 84 HA2 GLY 84 -10.465 11.177 -1.224 626 HA3 GLY 84 HA1 GLY 84 -10.995 9.671 -0.498 627 H ILE 85 HN ILE 85 -13.198 8.921 -1.651 628 HA ILE 85 HA ILE 85 -12.598 8.746 -4.546 629 HB ILE 85 HB ILE 85 -14.289 6.617 -3.163 630 HG12 ILE 85 HG12 ILE 85 -11.886 5.315 -3.435 631 HG13 ILE 85 HG11 ILE 85 -11.363 6.896 -2.862 632 HG21 ILE 85 HG21 ILE 85 -13.570 5.144 -4.960 633 HG22 ILE 85 HG22 ILE 85 -12.464 6.375 -5.570 634 HG23 ILE 85 HG23 ILE 85 -14.205 6.640 -5.648 635 HD11 ILE 85 HD11 ILE 85 -13.350 5.086 -1.513 636 HD12 ILE 85 HD12 ILE 85 -12.861 6.684 -0.942 637 HD13 ILE 85 HD13 ILE 85 -11.681 5.371 -1.015 638 H ASP 86 HN ASP 86 -13.986 9.556 -5.888 639 HA ASP 86 HA ASP 86 -16.773 10.108 -5.094 640 HB2 ASP 86 HB2 ASP 86 -14.795 11.758 -6.634 641 HB3 ASP 86 HB1 ASP 86 -16.512 11.924 -6.980 642 H TRP 87 HN TRP 87 -18.349 9.375 -6.358 643 HA TRP 87 HA TRP 87 -17.803 7.531 -8.519 644 HB2 TRP 87 HB2 TRP 87 -20.338 8.375 -7.132 645 HB3 TRP 87 HB1 TRP 87 -20.355 7.315 -8.535 646 HD1 TRP 87 HD1 TRP 87 -19.908 7.303 -4.837 647 HE1 TRP 87 HE1 TRP 87 -19.342 4.952 -3.978 648 HE3 TRP 87 HE3 TRP 87 -18.930 4.948 -9.322 649 HZ2 TRP 87 HZ2 TRP 87 -18.593 2.453 -5.019 650 HZ3 TRP 87 HZ3 TRP 87 -18.296 2.574 -9.270 651 HH2 TRP 87 HH2 TRP 87 -18.134 1.361 -7.169 652 H GLU 88 HN GLU 88 -19.073 10.802 -8.299 653 HA GLU 88 HA GLU 88 -19.989 11.018 -11.037 654 HB2 GLU 88 HB2 GLU 88 -19.820 12.933 -8.729 655 HB3 GLU 88 HB1 GLU 88 -20.155 13.522 -10.349 656 HG2 GLU 88 HG2 GLU 88 -22.151 12.140 -10.471 657 HG3 GLU 88 HG1 GLU 88 -21.798 11.457 -8.886 658 H ASN 89 HN ASN 89 -17.101 12.017 -9.243 659 HA ASN 89 HA ASN 89 -15.891 13.405 -11.513 660 HB2 ASN 89 HB2 ASN 89 -15.249 13.151 -8.602 661 HB3 ASN 89 HB1 ASN 89 -13.985 13.633 -9.725 662 HD21 ASN 89 HD21 ASN 89 -16.639 14.632 -7.906 663 HD22 ASN 89 HD22 ASN 89 -16.754 16.250 -8.499 664 H LYS 90 HN LYS 90 -15.838 10.205 -10.190 665 HA LYS 90 HA LYS 90 -14.700 8.277 -10.464 666 HB2 LYS 90 HB2 LYS 90 -14.688 9.529 -13.093 667 HB3 LYS 90 HB1 LYS 90 -13.323 8.437 -12.910 668 HG2 LYS 90 HG2 LYS 90 -14.793 6.618 -12.371 669 HG3 LYS 90 HG1 LYS 90 -16.188 7.696 -12.364 670 HD2 LYS 90 HD2 LYS 90 -15.854 8.160 -14.739 671 HD3 LYS 90 HD1 LYS 90 -14.436 7.110 -14.753 672 HE2 LYS 90 HE2 LYS 90 -17.106 6.041 -13.893 673 HE3 LYS 90 HE1 LYS 90 -16.707 6.163 -15.607 674 HZ1 LYS 90 HZ1 LYS 90 -14.544 4.961 -14.310 675 HZ2 LYS 90 HZ2 LYS 90 -15.604 4.270 -15.431 676 HZ3 LYS 90 HZ3 LYS 90 -15.946 4.174 -13.778 677 H ARG 91 HN ARG 91 -13.353 10.212 -8.927 678 HA ARG 91 HA ARG 91 -10.477 9.731 -9.349 679 HB2 ARG 91 HB2 ARG 91 -11.958 11.910 -7.888 680 HB3 ARG 91 HB1 ARG 91 -10.252 11.611 -7.596 681 HG2 ARG 91 HG2 ARG 91 -9.739 12.081 -9.918 682 HG3 ARG 91 HG1 ARG 91 -11.454 12.283 -10.279 683 HD2 ARG 91 HD2 ARG 91 -11.559 14.197 -8.787 684 HD3 ARG 91 HD1 ARG 91 -9.862 13.978 -8.360 685 HE ARG 91 HE ARG 91 -10.274 14.280 -11.182 686 HH11 ARG 91 HH11 ARG 91 -9.802 16.310 -8.264 687 HH12 ARG 91 HH12 ARG 91 -9.223 17.648 -9.198 688 HH21 ARG 91 HH21 ARG 91 -9.518 16.057 -12.287 689 HH22 ARG 91 HH22 ARG 91 -9.066 17.503 -11.447 690 H VAL 92 HN VAL 92 -9.249 8.746 -7.931 691 HA VAL 92 HA VAL 92 -10.442 7.672 -5.445 692 HB VAL 92 HB VAL 92 -8.185 6.132 -6.771 693 HG11 VAL 92 HG11 VAL 92 -8.857 4.311 -5.472 694 HG12 VAL 92 HG12 VAL 92 -10.533 4.854 -5.400 695 HG13 VAL 92 HG13 VAL 92 -9.304 5.666 -4.434 696 HG21 VAL 92 HG21 VAL 92 -11.040 5.428 -7.490 697 HG22 VAL 92 HG22 VAL 92 -9.553 4.741 -8.139 698 HG23 VAL 92 HG23 VAL 92 -10.010 6.393 -8.546 699 H LYS 93 HN LYS 93 -9.455 8.215 -3.657 700 HA LYS 93 HA LYS 93 -6.677 9.211 -3.673 701 HB2 LYS 93 HB2 LYS 93 -8.981 10.657 -3.021 702 HB3 LYS 93 HB1 LYS 93 -8.280 10.225 -1.468 703 HG2 LYS 93 HG2 LYS 93 -6.203 11.283 -2.064 704 HG3 LYS 93 HG1 LYS 93 -6.804 11.611 -3.691 705 HD2 LYS 93 HD2 LYS 93 -8.538 13.057 -2.768 706 HD3 LYS 93 HD1 LYS 93 -7.964 12.713 -1.135 707 HE2 LYS 93 HE2 LYS 93 -5.793 13.711 -1.703 708 HE3 LYS 93 HE1 LYS 93 -6.396 14.079 -3.320 709 HZ1 LYS 93 HZ1 LYS 93 -6.474 15.840 -1.391 710 HZ2 LYS 93 HZ2 LYS 93 -7.932 15.060 -1.032 711 HZ3 LYS 93 HZ3 LYS 93 -7.700 15.758 -2.556 712 H LEU 94 HN LEU 94 -5.320 8.218 -2.370 713 HA LEU 94 HA LEU 94 -6.268 6.575 -0.126 714 HB2 LEU 94 HB2 LEU 94 -4.344 5.820 -2.315 715 HB3 LEU 94 HB1 LEU 94 -4.272 5.040 -0.748 716 HG LEU 94 HG LEU 94 -6.982 4.971 -1.723 717 HD11 LEU 94 HD11 LEU 94 -6.582 3.444 -3.638 718 HD12 LEU 94 HD12 LEU 94 -4.885 3.913 -3.605 719 HD13 LEU 94 HD13 LEU 94 -6.125 5.118 -3.948 720 HD21 LEU 94 HD21 LEU 94 -4.950 2.795 -1.232 721 HD22 LEU 94 HD22 LEU 94 -6.689 2.567 -1.402 722 HD23 LEU 94 HD23 LEU 94 -6.049 3.478 -0.033 723 H LYS 95 HN LYS 95 -5.260 6.844 1.694 724 HA LYS 95 HA LYS 95 -2.838 8.515 1.843 725 HB2 LYS 95 HB2 LYS 95 -5.364 8.558 3.291 726 HB3 LYS 95 HB1 LYS 95 -3.982 8.502 4.376 727 HG2 LYS 95 HG2 LYS 95 -3.058 10.485 3.375 728 HG3 LYS 95 HG1 LYS 95 -4.339 10.510 2.162 729 HD2 LYS 95 HD2 LYS 95 -6.008 10.860 3.907 730 HD3 LYS 95 HD1 LYS 95 -4.748 10.783 5.141 731 HE2 LYS 95 HE2 LYS 95 -5.019 13.085 4.876 732 HE3 LYS 95 HE1 LYS 95 -3.684 12.746 3.776 733 HZ1 LYS 95 HZ1 LYS 95 -5.205 14.132 2.641 734 HZ2 LYS 95 HZ2 LYS 95 -6.532 13.179 3.077 735 HZ3 LYS 95 HZ3 LYS 95 -5.393 12.587 1.976 Start of MODEL 10 1 H1 MET 8 HT1 MET 8 1.091 2.069 -0.181 2 H2 MET 8 HT2 MET 8 1.519 0.560 0.448 3 H3 MET 8 HT3 MET 8 0.207 0.689 -0.605 4 HA MET 8 HA MET 8 1.581 1.242 -2.423 5 HB2 MET 8 HB2 MET 8 4.156 1.091 -2.112 6 HB3 MET 8 HB1 MET 8 3.360 2.579 -1.657 7 HG2 MET 8 HG2 MET 8 3.611 2.060 0.689 8 HG3 MET 8 HG1 MET 8 4.219 0.448 0.316 9 HE1 MET 8 HE1 MET 8 6.786 0.051 0.653 10 HE2 MET 8 HE2 MET 8 7.835 0.866 -0.509 11 HE3 MET 8 HE3 MET 8 6.385 0.031 -1.065 12 H ALA 9 HN ALA 9 1.928 -0.324 -3.785 13 HA ALA 9 HA ALA 9 2.378 -3.062 -2.787 14 HB1 ALA 9 HB1 ALA 9 1.223 -3.820 -4.833 15 HB2 ALA 9 HB2 ALA 9 0.941 -2.137 -5.273 16 HB3 ALA 9 HB3 ALA 9 0.201 -2.804 -3.818 17 H LYS 10 HN LYS 10 3.941 -4.326 -3.682 18 HA LYS 10 HA LYS 10 5.772 -3.132 -5.655 19 HB2 LYS 10 HB2 LYS 10 6.302 -4.628 -3.119 20 HB3 LYS 10 HB1 LYS 10 7.435 -4.801 -4.449 21 HG2 LYS 10 HG2 LYS 10 7.820 -2.398 -4.458 22 HG3 LYS 10 HG1 LYS 10 6.639 -2.194 -3.163 23 HD2 LYS 10 HD2 LYS 10 8.021 -3.566 -1.681 24 HD3 LYS 10 HD1 LYS 10 9.195 -3.791 -2.980 25 HE2 LYS 10 HE2 LYS 10 9.615 -1.384 -3.023 26 HE3 LYS 10 HE1 LYS 10 8.431 -1.150 -1.736 27 HZ1 LYS 10 HZ1 LYS 10 10.764 -1.196 -0.960 28 HZ2 LYS 10 HZ2 LYS 10 10.878 -2.808 -1.462 29 HZ3 LYS 10 HZ3 LYS 10 9.796 -2.380 -0.234 30 H CYS 11 HN CYS 11 6.422 -4.335 -7.361 31 HA CYS 11 HA CYS 11 4.992 -6.694 -8.127 32 HB2 CYS 11 HB2 CYS 11 5.869 -4.994 -9.777 33 HB3 CYS 11 HB1 CYS 11 7.483 -5.594 -9.466 34 HA PRO 12 HA PRO 12 7.924 -9.675 -6.116 35 HB2 PRO 12 HB2 PRO 12 6.679 -12.026 -6.708 36 HB3 PRO 12 HB1 PRO 12 6.119 -10.949 -5.428 37 HG2 PRO 12 HG2 PRO 12 5.055 -11.284 -8.223 38 HG3 PRO 12 HG1 PRO 12 4.154 -11.111 -6.702 39 HD2 PRO 12 HD2 PRO 12 4.556 -9.031 -8.431 40 HD3 PRO 12 HD1 PRO 12 4.391 -8.801 -6.684 41 H ILE 13 HN ILE 13 7.489 -9.207 -9.431 42 HA ILE 13 HA ILE 13 9.265 -11.339 -10.362 43 HB ILE 13 HB ILE 13 7.714 -9.394 -12.149 44 HG12 ILE 13 HG12 ILE 13 6.480 -11.999 -12.250 45 HG13 ILE 13 HG11 ILE 13 6.528 -11.479 -10.569 46 HG21 ILE 13 HG21 ILE 13 9.583 -11.477 -12.759 47 HG22 ILE 13 HG22 ILE 13 8.650 -10.522 -13.911 48 HG23 ILE 13 HG23 ILE 13 8.003 -12.044 -13.299 49 HD11 ILE 13 HD11 ILE 13 5.234 -9.569 -11.021 50 HD12 ILE 13 HD12 ILE 13 4.456 -10.897 -11.881 51 HD13 ILE 13 HD13 ILE 13 5.446 -9.738 -12.764 52 H CYS 14 HN CYS 14 8.845 -7.729 -10.700 53 HA CYS 14 HA CYS 14 11.686 -7.526 -11.434 54 HB2 CYS 14 HB2 CYS 14 11.186 -5.422 -12.521 55 HB3 CYS 14 HB1 CYS 14 10.113 -6.680 -13.110 56 H GLY 15 HN GLY 15 9.250 -6.109 -9.279 57 HA2 GLY 15 HA2 GLY 15 9.641 -5.444 -7.029 58 HA3 GLY 15 HA1 GLY 15 11.346 -5.283 -7.397 59 H SER 16 HN SER 16 8.737 -3.866 -9.328 60 HA SER 16 HA SER 16 9.812 -1.172 -8.951 61 HB2 SER 16 HB2 SER 16 8.235 -0.589 -10.815 62 HB3 SER 16 HB1 SER 16 9.401 -1.841 -11.225 63 HG SER 16 HG SER 16 6.631 -2.034 -10.867 64 HA PRO 17 HA PRO 17 6.473 0.153 -6.066 65 HB2 PRO 17 HB2 PRO 17 6.450 2.878 -6.409 66 HB3 PRO 17 HB1 PRO 17 7.663 2.037 -5.443 67 HG2 PRO 17 HG2 PRO 17 7.864 3.043 -8.273 68 HG3 PRO 17 HG1 PRO 17 9.063 3.149 -6.968 69 HD2 PRO 17 HD2 PRO 17 9.248 1.277 -8.914 70 HD3 PRO 17 HD1 PRO 17 9.746 0.936 -7.247 71 H LEU 18 HN LEU 18 4.359 0.094 -6.181 72 HA LEU 18 HA LEU 18 2.906 1.129 -8.528 73 HB2 LEU 18 HB2 LEU 18 2.461 -1.434 -6.999 74 HB3 LEU 18 HB1 LEU 18 1.220 -0.719 -8.013 75 HG LEU 18 HG LEU 18 3.775 -1.078 -9.405 76 HD11 LEU 18 HD11 LEU 18 3.998 -3.009 -8.010 77 HD12 LEU 18 HD12 LEU 18 3.498 -3.532 -9.619 78 HD13 LEU 18 HD13 LEU 18 2.322 -3.472 -8.305 79 HD21 LEU 18 HD21 LEU 18 2.362 -1.865 -11.157 80 HD22 LEU 18 HD22 LEU 18 1.536 -0.500 -10.405 81 HD23 LEU 18 HD23 LEU 18 1.028 -2.148 -10.039 82 H LYS 19 HN LYS 19 0.959 2.109 -8.203 83 HA LYS 19 HA LYS 19 0.376 3.036 -5.486 84 HB2 LYS 19 HB2 LYS 19 -0.287 4.081 -8.227 85 HB3 LYS 19 HB1 LYS 19 -1.205 4.617 -6.828 86 HG2 LYS 19 HG2 LYS 19 0.813 5.493 -5.804 87 HG3 LYS 19 HG1 LYS 19 1.782 4.885 -7.147 88 HD2 LYS 19 HD2 LYS 19 0.596 6.361 -8.684 89 HD3 LYS 19 HD1 LYS 19 -0.411 6.949 -7.359 90 HE2 LYS 19 HE2 LYS 19 1.583 7.823 -6.238 91 HE3 LYS 19 HE1 LYS 19 2.586 7.231 -7.561 92 HZ1 LYS 19 HZ1 LYS 19 0.484 8.831 -8.568 93 HZ2 LYS 19 HZ2 LYS 19 2.154 9.055 -8.715 94 HZ3 LYS 19 HZ3 LYS 19 1.331 9.687 -7.380 95 H TRP 20 HN TRP 20 -1.426 2.555 -4.399 96 HA TRP 20 HA TRP 20 -3.160 0.427 -5.175 97 HB2 TRP 20 HB2 TRP 20 -2.938 2.193 -2.791 98 HB3 TRP 20 HB1 TRP 20 -4.426 1.272 -3.018 99 HD1 TRP 20 HD1 TRP 20 -0.778 0.882 -2.092 100 HE1 TRP 20 HE1 TRP 20 -0.304 -1.530 -1.332 101 HE3 TRP 20 HE3 TRP 20 -5.255 -1.331 -3.372 102 HZ2 TRP 20 HZ2 TRP 20 -1.610 -4.024 -1.285 103 HZ3 TRP 20 HZ3 TRP 20 -5.533 -3.728 -2.921 104 HH2 TRP 20 HH2 TRP 20 -3.750 -5.042 -1.899 105 H GLU 21 HN GLU 21 -3.451 3.879 -5.430 106 HA GLU 21 HA GLU 21 -6.263 4.072 -5.906 107 HB2 GLU 21 HB2 GLU 21 -5.800 6.414 -6.652 108 HB3 GLU 21 HB1 GLU 21 -5.229 6.039 -5.041 109 HG2 GLU 21 HG2 GLU 21 -3.227 5.852 -7.255 110 HG3 GLU 21 HG1 GLU 21 -3.753 7.468 -6.786 111 H GLU 22 HN GLU 22 -3.496 3.520 -8.007 112 HA GLU 22 HA GLU 22 -4.744 4.020 -10.549 113 HB2 GLU 22 HB2 GLU 22 -2.161 2.768 -9.690 114 HB3 GLU 22 HB1 GLU 22 -2.690 2.635 -11.361 115 HG2 GLU 22 HG2 GLU 22 -2.776 5.089 -11.512 116 HG3 GLU 22 HG1 GLU 22 -2.212 5.199 -9.847 117 H LEU 23 HN LEU 23 -4.328 1.157 -8.527 118 HA LEU 23 HA LEU 23 -5.128 -0.899 -10.324 119 HB2 LEU 23 HB2 LEU 23 -4.872 -0.669 -7.348 120 HB3 LEU 23 HB1 LEU 23 -5.616 -2.095 -8.046 121 HG LEU 23 HG LEU 23 -3.035 -1.418 -9.255 122 HD11 LEU 23 HD11 LEU 23 -3.240 -2.026 -6.308 123 HD12 LEU 23 HD12 LEU 23 -2.366 -0.712 -7.100 124 HD13 LEU 23 HD13 LEU 23 -1.794 -2.369 -7.259 125 HD21 LEU 23 HD21 LEU 23 -2.682 -3.790 -9.049 126 HD22 LEU 23 HD22 LEU 23 -4.332 -3.512 -9.611 127 HD23 LEU 23 HD23 LEU 23 -4.034 -3.934 -7.925 128 H ILE 24 HN ILE 24 -6.931 1.064 -7.972 129 HA ILE 24 HA ILE 24 -9.495 -0.209 -8.271 130 HB ILE 24 HB ILE 24 -9.063 2.540 -7.041 131 HG12 ILE 24 HG12 ILE 24 -7.512 1.346 -5.687 132 HG13 ILE 24 HG11 ILE 24 -8.968 1.423 -4.731 133 HG21 ILE 24 HG21 ILE 24 -11.036 2.175 -5.709 134 HG22 ILE 24 HG22 ILE 24 -11.161 0.520 -6.284 135 HG23 ILE 24 HG23 ILE 24 -11.418 1.855 -7.401 136 HD11 ILE 24 HD11 ILE 24 -9.207 -1.077 -5.811 137 HD12 ILE 24 HD12 ILE 24 -8.433 -0.737 -4.264 138 HD13 ILE 24 HD13 ILE 24 -7.453 -0.919 -5.719 139 H GLU 25 HN GLU 25 -7.989 2.743 -9.612 140 HA GLU 25 HA GLU 25 -10.198 3.847 -11.008 141 HB2 GLU 25 HB2 GLU 25 -7.651 4.653 -10.397 142 HB3 GLU 25 HB1 GLU 25 -7.551 4.416 -12.134 143 HG2 GLU 25 HG2 GLU 25 -9.454 5.929 -12.438 144 HG3 GLU 25 HG1 GLU 25 -9.521 6.180 -10.695 145 H GLU 26 HN GLU 26 -7.673 1.537 -12.022 146 HA GLU 26 HA GLU 26 -8.416 1.373 -14.802 147 HB2 GLU 26 HB2 GLU 26 -6.510 -0.099 -13.019 148 HB3 GLU 26 HB1 GLU 26 -6.836 -0.652 -14.635 149 HG2 GLU 26 HG2 GLU 26 -6.043 1.487 -15.547 150 HG3 GLU 26 HG1 GLU 26 -5.694 2.037 -13.910 151 H MET 27 HN MET 27 -9.440 -0.187 -11.867 152 HA MET 27 HA MET 27 -10.668 -2.428 -13.292 153 HB2 MET 27 HB2 MET 27 -9.723 -2.136 -10.453 154 HB3 MET 27 HB1 MET 27 -10.940 -3.334 -10.855 155 HG2 MET 27 HG2 MET 27 -9.386 -4.359 -12.459 156 HG3 MET 27 HG1 MET 27 -8.160 -3.176 -12.000 157 HE1 MET 27 HE1 MET 27 -9.685 -6.765 -9.637 158 HE2 MET 27 HE2 MET 27 -9.086 -6.889 -11.292 159 HE3 MET 27 HE3 MET 27 -10.512 -5.913 -10.941 160 H LEU 28 HN LEU 28 -11.626 0.541 -12.688 161 HA LEU 28 HA LEU 28 -14.153 0.072 -11.327 162 HB2 LEU 28 HB2 LEU 28 -12.423 2.156 -11.260 163 HB3 LEU 28 HB1 LEU 28 -13.569 2.759 -12.441 164 HG LEU 28 HG LEU 28 -15.214 1.883 -10.389 165 HD11 LEU 28 HD11 LEU 28 -13.185 1.562 -8.985 166 HD12 LEU 28 HD12 LEU 28 -14.345 2.716 -8.330 167 HD13 LEU 28 HD13 LEU 28 -12.876 3.293 -9.119 168 HD21 LEU 28 HD21 LEU 28 -15.534 3.905 -11.638 169 HD22 LEU 28 HD22 LEU 28 -14.088 4.622 -10.926 170 HD23 LEU 28 HD23 LEU 28 -15.495 4.283 -9.917 171 H ILE 29 HN ILE 29 -13.435 -0.858 -14.164 172 HA ILE 29 HA ILE 29 -15.457 0.312 -15.891 173 HB ILE 29 HB ILE 29 -14.622 -1.445 -17.578 174 HG12 ILE 29 HG12 ILE 29 -11.903 -1.583 -16.625 175 HG13 ILE 29 HG11 ILE 29 -12.962 -2.328 -15.428 176 HG21 ILE 29 HG21 ILE 29 -14.148 0.863 -17.848 177 HG22 ILE 29 HG22 ILE 29 -12.668 -0.037 -18.182 178 HG23 ILE 29 HG23 ILE 29 -12.865 0.795 -16.639 179 HD11 ILE 29 HD11 ILE 29 -12.218 -4.028 -16.910 180 HD12 ILE 29 HD12 ILE 29 -12.653 -3.071 -18.326 181 HD13 ILE 29 HD13 ILE 29 -13.915 -3.718 -17.277 182 H ILE 30 HN ILE 30 -15.595 -1.956 -13.531 183 HA ILE 30 HA ILE 30 -17.588 -3.729 -14.793 184 HB ILE 30 HB ILE 30 -16.414 -4.347 -12.057 185 HG12 ILE 30 HG12 ILE 30 -15.101 -6.010 -13.990 186 HG13 ILE 30 HG11 ILE 30 -14.811 -4.332 -14.429 187 HG21 ILE 30 HG21 ILE 30 -17.047 -6.608 -12.430 188 HG22 ILE 30 HG22 ILE 30 -17.250 -6.347 -14.162 189 HG23 ILE 30 HG23 ILE 30 -18.402 -5.645 -13.025 190 HD11 ILE 30 HD11 ILE 30 -13.937 -3.909 -12.181 191 HD12 ILE 30 HD12 ILE 30 -13.036 -5.175 -13.014 192 HD13 ILE 30 HD13 ILE 30 -14.208 -5.603 -11.767 193 H GLU 31 HN GLU 31 -19.611 -3.844 -14.116 194 HA GLU 31 HA GLU 31 -20.781 -1.796 -12.515 195 HB2 GLU 31 HB2 GLU 31 -22.990 -2.977 -12.990 196 HB3 GLU 31 HB1 GLU 31 -22.118 -2.340 -14.367 197 HG2 GLU 31 HG2 GLU 31 -21.336 -4.603 -14.902 198 HG3 GLU 31 HG1 GLU 31 -22.238 -5.236 -13.531 199 H ASN 32 HN ASN 32 -19.886 -5.047 -11.797 200 HA ASN 32 HA ASN 32 -21.449 -5.418 -9.407 201 HB2 ASN 32 HB2 ASN 32 -19.279 -6.950 -10.787 202 HB3 ASN 32 HB1 ASN 32 -19.726 -7.375 -9.137 203 HD21 ASN 32 HD21 ASN 32 -20.428 -7.758 -12.397 204 HD22 ASN 32 HD22 ASN 32 -21.943 -8.572 -12.238 205 H PHE 33 HN PHE 33 -18.433 -3.904 -10.096 206 HA PHE 33 HA PHE 33 -16.916 -4.062 -7.769 207 HB2 PHE 33 HB2 PHE 33 -16.526 -2.855 -10.138 208 HB3 PHE 33 HB1 PHE 33 -16.851 -1.444 -9.154 209 HD1 PHE 33 HD1 PHE 33 -15.326 -0.818 -7.302 210 HD2 PHE 33 HD2 PHE 33 -14.481 -4.147 -9.836 211 HE1 PHE 33 HE1 PHE 33 -13.023 -0.872 -6.470 212 HE2 PHE 33 HE2 PHE 33 -12.167 -4.188 -9.000 213 HZ PHE 33 HZ PHE 33 -11.432 -2.544 -7.322 214 H GLU 34 HN GLU 34 -19.570 -1.851 -8.468 215 HA GLU 34 HA GLU 34 -19.518 -0.102 -6.251 216 HB2 GLU 34 HB2 GLU 34 -21.701 -1.031 -8.089 217 HB3 GLU 34 HB1 GLU 34 -22.085 -0.012 -6.710 218 HG2 GLU 34 HG2 GLU 34 -20.515 1.689 -7.555 219 HG3 GLU 34 HG1 GLU 34 -20.198 0.670 -8.956 220 H GLU 35 HN GLU 35 -20.703 -3.381 -6.552 221 HA GLU 35 HA GLU 35 -22.046 -3.538 -3.958 222 HB2 GLU 35 HB2 GLU 35 -21.632 -5.461 -6.229 223 HB3 GLU 35 HB1 GLU 35 -22.128 -6.055 -4.652 224 HG2 GLU 35 HG2 GLU 35 -24.116 -4.629 -4.746 225 HG3 GLU 35 HG1 GLU 35 -23.615 -4.053 -6.336 226 H ILE 36 HN ILE 36 -18.967 -4.536 -5.406 227 HA ILE 36 HA ILE 36 -18.019 -6.256 -3.293 228 HB ILE 36 HB ILE 36 -16.344 -5.003 -5.544 229 HG12 ILE 36 HG12 ILE 36 -17.060 -7.905 -5.646 230 HG13 ILE 36 HG11 ILE 36 -18.379 -6.786 -5.952 231 HG21 ILE 36 HG21 ILE 36 -15.299 -7.567 -4.723 232 HG22 ILE 36 HG22 ILE 36 -15.517 -6.587 -3.275 233 HG23 ILE 36 HG23 ILE 36 -14.502 -5.993 -4.587 234 HD11 ILE 36 HD11 ILE 36 -15.949 -6.240 -7.519 235 HD12 ILE 36 HD12 ILE 36 -17.639 -6.319 -8.026 236 HD13 ILE 36 HD13 ILE 36 -16.702 -7.798 -7.843 237 H VAL 37 HN VAL 37 -17.510 -2.838 -4.113 238 HA VAL 37 HA VAL 37 -15.509 -2.118 -2.278 239 HB VAL 37 HB VAL 37 -16.335 0.286 -2.501 240 HG11 VAL 37 HG11 VAL 37 -15.704 0.390 -4.967 241 HG12 VAL 37 HG12 VAL 37 -15.577 -1.366 -4.896 242 HG13 VAL 37 HG13 VAL 37 -14.537 -0.366 -3.878 243 HG21 VAL 37 HG21 VAL 37 -17.865 0.741 -4.441 244 HG22 VAL 37 HG22 VAL 37 -18.668 0.060 -3.038 245 HG23 VAL 37 HG23 VAL 37 -18.307 -0.959 -4.429 246 H LYS 38 HN LYS 38 -18.857 -2.656 -1.630 247 HA LYS 38 HA LYS 38 -18.976 -1.318 0.944 248 HB2 LYS 38 HB2 LYS 38 -20.853 -2.676 -0.886 249 HB3 LYS 38 HB1 LYS 38 -21.225 -2.843 0.826 250 HG2 LYS 38 HG2 LYS 38 -21.308 -0.447 1.085 251 HG3 LYS 38 HG1 LYS 38 -20.799 -0.218 -0.589 252 HD2 LYS 38 HD2 LYS 38 -22.845 -1.329 -1.363 253 HD3 LYS 38 HD1 LYS 38 -23.348 -1.565 0.312 254 HE2 LYS 38 HE2 LYS 38 -24.538 0.349 -0.284 255 HE3 LYS 38 HE1 LYS 38 -23.097 1.032 0.469 256 HZ1 LYS 38 HZ1 LYS 38 -22.845 0.571 -2.371 257 HZ2 LYS 38 HZ2 LYS 38 -22.434 1.933 -1.456 258 HZ3 LYS 38 HZ3 LYS 38 -24.032 1.706 -1.964 259 H ASP 39 HN ASP 39 -18.142 -4.492 -0.227 260 HA ASP 39 HA ASP 39 -18.165 -5.599 2.482 261 HB2 ASP 39 HB2 ASP 39 -19.060 -6.808 -0.100 262 HB3 ASP 39 HB1 ASP 39 -18.334 -7.866 1.106 263 H ARG 40 HN ARG 40 -16.169 -5.402 3.142 264 HA ARG 40 HA ARG 40 -13.733 -5.647 1.820 265 HB2 ARG 40 HB2 ARG 40 -12.709 -6.072 4.121 266 HB3 ARG 40 HB1 ARG 40 -13.628 -4.599 3.936 267 HG2 ARG 40 HG2 ARG 40 -15.250 -6.785 5.023 268 HG3 ARG 40 HG1 ARG 40 -13.879 -6.368 6.057 269 HD2 ARG 40 HD2 ARG 40 -14.574 -4.061 6.112 270 HD3 ARG 40 HD1 ARG 40 -15.861 -4.383 4.949 271 HE ARG 40 HE ARG 40 -16.236 -6.069 7.144 272 HH11 ARG 40 HH11 ARG 40 -16.555 -2.540 6.586 273 HH12 ARG 40 HH12 ARG 40 -17.730 -2.369 7.846 274 HH21 ARG 40 HH21 ARG 40 -17.745 -5.745 8.742 275 HH22 ARG 40 HH22 ARG 40 -18.393 -4.169 9.052 276 H GLU 41 HN GLU 41 -15.637 -8.254 3.231 277 HA GLU 41 HA GLU 41 -13.798 -10.406 3.096 278 HB2 GLU 41 HB2 GLU 41 -16.343 -9.944 4.076 279 HB3 GLU 41 HB1 GLU 41 -16.598 -11.131 2.811 280 HG2 GLU 41 HG2 GLU 41 -14.918 -12.584 3.876 281 HG3 GLU 41 HG1 GLU 41 -14.746 -11.394 5.168 282 H ARG 42 HN ARG 42 -16.061 -9.028 0.747 283 HA ARG 42 HA ARG 42 -15.782 -11.084 -1.279 284 HB2 ARG 42 HB2 ARG 42 -17.295 -8.519 -1.046 285 HB3 ARG 42 HB1 ARG 42 -17.006 -9.182 -2.647 286 HG2 ARG 42 HG2 ARG 42 -18.127 -11.261 -1.983 287 HG3 ARG 42 HG1 ARG 42 -18.424 -10.578 -0.382 288 HD2 ARG 42 HD2 ARG 42 -19.785 -8.817 -1.364 289 HD3 ARG 42 HD1 ARG 42 -19.446 -9.435 -2.982 290 HE ARG 42 HE ARG 42 -20.563 -11.515 -1.476 291 HH11 ARG 42 HH11 ARG 42 -21.816 -8.448 -2.856 292 HH12 ARG 42 HH12 ARG 42 -23.432 -9.064 -2.955 293 HH21 ARG 42 HH21 ARG 42 -22.683 -12.207 -1.652 294 HH22 ARG 42 HH22 ARG 42 -23.910 -11.160 -2.281 295 H PHE 43 HN PHE 43 -14.389 -7.897 -0.578 296 HA PHE 43 HA PHE 43 -13.131 -7.439 -3.120 297 HB2 PHE 43 HB2 PHE 43 -13.827 -5.731 -1.186 298 HB3 PHE 43 HB1 PHE 43 -12.174 -6.020 -0.668 299 HD1 PHE 43 HD1 PHE 43 -10.263 -5.520 -2.340 300 HD2 PHE 43 HD2 PHE 43 -14.281 -4.164 -2.900 301 HE1 PHE 43 HE1 PHE 43 -9.472 -3.794 -3.897 302 HE2 PHE 43 HE2 PHE 43 -13.473 -2.448 -4.465 303 HZ PHE 43 HZ PHE 43 -11.079 -2.265 -4.962 304 H LEU 44 HN LEU 44 -11.891 -8.574 0.083 305 HA LEU 44 HA LEU 44 -9.120 -8.739 -0.657 306 HB2 LEU 44 HB2 LEU 44 -10.734 -9.619 1.704 307 HB3 LEU 44 HB1 LEU 44 -9.096 -10.215 1.507 308 HG LEU 44 HG LEU 44 -9.317 -7.295 1.244 309 HD11 LEU 44 HD11 LEU 44 -9.993 -8.624 3.864 310 HD12 LEU 44 HD12 LEU 44 -11.030 -7.555 2.920 311 HD13 LEU 44 HD13 LEU 44 -9.566 -6.923 3.672 312 HD21 LEU 44 HD21 LEU 44 -7.627 -8.981 3.086 313 HD22 LEU 44 HD22 LEU 44 -7.333 -7.319 2.574 314 HD23 LEU 44 HD23 LEU 44 -7.203 -8.638 1.409 315 H ALA 45 HN ALA 45 -11.794 -10.989 -0.637 316 HA ALA 45 HA ALA 45 -10.388 -13.426 -1.201 317 HB1 ALA 45 HB1 ALA 45 -13.303 -12.834 -1.685 318 HB2 ALA 45 HB2 ALA 45 -12.624 -13.314 -0.128 319 HB3 ALA 45 HB3 ALA 45 -12.553 -14.418 -1.501 320 H GLN 46 HN GLN 46 -11.797 -10.907 -3.233 321 HA GLN 46 HA GLN 46 -11.639 -12.316 -5.744 322 HB2 GLN 46 HB2 GLN 46 -12.723 -9.793 -4.822 323 HB3 GLN 46 HB1 GLN 46 -11.842 -9.604 -6.334 324 HG2 GLN 46 HG2 GLN 46 -13.189 -11.335 -7.367 325 HG3 GLN 46 HG1 GLN 46 -14.046 -11.594 -5.848 326 HE21 GLN 46 HE21 GLN 46 -13.832 -9.758 -8.702 327 HE22 GLN 46 HE22 GLN 46 -15.133 -8.668 -8.381 328 H VAL 47 HN VAL 47 -9.585 -9.953 -4.035 329 HA VAL 47 HA VAL 47 -7.721 -9.396 -6.151 330 HB VAL 47 HB VAL 47 -7.277 -9.023 -3.129 331 HG11 VAL 47 HG11 VAL 47 -5.152 -8.956 -4.605 332 HG12 VAL 47 HG12 VAL 47 -5.430 -7.593 -3.520 333 HG13 VAL 47 HG13 VAL 47 -5.797 -7.442 -5.237 334 HG21 VAL 47 HG21 VAL 47 -8.229 -7.024 -5.181 335 HG22 VAL 47 HG22 VAL 47 -7.730 -6.617 -3.540 336 HG23 VAL 47 HG23 VAL 47 -9.132 -7.654 -3.803 337 H GLU 48 HN GLU 48 -7.792 -11.821 -3.512 338 HA GLU 48 HA GLU 48 -5.233 -13.037 -3.986 339 HB2 GLU 48 HB2 GLU 48 -7.636 -13.883 -2.359 340 HB3 GLU 48 HB1 GLU 48 -6.184 -14.860 -2.472 341 HG2 GLU 48 HG2 GLU 48 -4.910 -12.876 -1.563 342 HG3 GLU 48 HG1 GLU 48 -6.476 -12.124 -1.253 343 H GLU 49 HN GLU 49 -8.413 -13.521 -5.342 344 HA GLU 49 HA GLU 49 -7.831 -16.138 -6.526 345 HB2 GLU 49 HB2 GLU 49 -10.321 -14.482 -6.284 346 HB3 GLU 49 HB1 GLU 49 -10.238 -15.793 -7.448 347 HG2 GLU 49 HG2 GLU 49 -9.795 -17.378 -5.646 348 HG3 GLU 49 HG1 GLU 49 -9.837 -16.065 -4.474 349 H PHE 50 HN PHE 50 -7.954 -12.792 -7.465 350 HA PHE 50 HA PHE 50 -7.871 -13.404 -10.347 351 HB2 PHE 50 HB2 PHE 50 -9.257 -11.408 -8.927 352 HB3 PHE 50 HB1 PHE 50 -7.954 -10.567 -9.752 353 HD1 PHE 50 HD2 PHE 50 -7.899 -10.445 -12.195 354 HD2 PHE 50 HD1 PHE 50 -11.069 -12.454 -10.167 355 HE1 PHE 50 HE2 PHE 50 -9.231 -10.429 -14.262 356 HE2 PHE 50 HE1 PHE 50 -12.401 -12.432 -12.235 357 HZ PHE 50 HZ PHE 50 -11.483 -11.421 -14.282 358 H VAL 51 HN VAL 51 -6.268 -12.534 -11.688 359 HA VAL 51 HA VAL 51 -3.744 -11.958 -10.333 360 HB VAL 51 HB VAL 51 -4.053 -13.976 -11.939 361 HG11 VAL 51 HG11 VAL 51 -4.884 -12.583 -13.919 362 HG12 VAL 51 HG12 VAL 51 -3.669 -13.823 -14.245 363 HG13 VAL 51 HG13 VAL 51 -3.188 -12.128 -14.140 364 HG21 VAL 51 HG21 VAL 51 -1.659 -12.173 -12.055 365 HG22 VAL 51 HG22 VAL 51 -1.674 -13.815 -12.693 366 HG23 VAL 51 HG23 VAL 51 -1.944 -13.535 -10.971 367 H PHE 52 HN PHE 52 -2.287 -10.371 -11.228 368 HA PHE 52 HA PHE 52 -3.592 -8.090 -12.550 369 HB2 PHE 52 HB2 PHE 52 -1.687 -7.917 -10.197 370 HB3 PHE 52 HB1 PHE 52 -2.282 -6.541 -11.104 371 HD1 PHE 52 HD1 PHE 52 -4.645 -5.823 -10.875 372 HD2 PHE 52 HD2 PHE 52 -3.054 -9.016 -8.544 373 HE1 PHE 52 HE1 PHE 52 -6.571 -5.673 -9.356 374 HE2 PHE 52 HE2 PHE 52 -4.979 -8.863 -7.021 375 HZ PHE 52 HZ PHE 52 -6.741 -7.192 -7.429 376 H LYS 53 HN LYS 53 -2.383 -6.884 -13.916 377 HA LYS 53 HA LYS 53 0.049 -8.144 -14.972 378 HB2 LYS 53 HB2 LYS 53 -1.995 -6.276 -16.147 379 HB3 LYS 53 HB1 LYS 53 -0.410 -6.432 -16.888 380 HG2 LYS 53 HG2 LYS 53 -0.783 -8.802 -17.254 381 HG3 LYS 53 HG1 LYS 53 -2.345 -8.699 -16.437 382 HD2 LYS 53 HD2 LYS 53 -3.149 -7.160 -18.151 383 HD3 LYS 53 HD1 LYS 53 -1.581 -7.224 -18.958 384 HE2 LYS 53 HE2 LYS 53 -1.885 -9.621 -19.355 385 HE3 LYS 53 HE1 LYS 53 -3.449 -9.558 -18.543 386 HZ1 LYS 53 HZ1 LYS 53 -4.417 -8.812 -20.383 387 HZ2 LYS 53 HZ2 LYS 53 -2.987 -9.169 -21.213 388 HZ3 LYS 53 HZ3 LYS 53 -3.250 -7.609 -20.615 389 H CYS 54 HN CYS 54 1.999 -7.177 -15.077 390 HA CYS 54 HA CYS 54 2.350 -4.641 -13.679 391 HB2 CYS 54 HB2 CYS 54 3.765 -6.637 -13.059 392 HB3 CYS 54 HB1 CYS 54 4.552 -6.485 -14.630 393 HA PRO 55 HA PRO 55 2.635 -2.707 -17.962 394 HB2 PRO 55 HB2 PRO 55 2.709 -0.167 -16.411 395 HB3 PRO 55 HB1 PRO 55 1.640 -0.618 -17.743 396 HG2 PRO 55 HG2 PRO 55 0.665 -0.497 -15.287 397 HG3 PRO 55 HG1 PRO 55 0.221 -1.863 -16.337 398 HD2 PRO 55 HD2 PRO 55 2.328 -1.762 -14.176 399 HD3 PRO 55 HD1 PRO 55 1.021 -2.947 -14.406 400 H VAL 56 HN VAL 56 4.784 -2.660 -15.361 401 HA VAL 56 HA VAL 56 6.842 -0.894 -16.429 402 HB VAL 56 HB VAL 56 7.361 -2.616 -13.992 403 HG11 VAL 56 HG11 VAL 56 9.190 -1.222 -14.744 404 HG12 VAL 56 HG12 VAL 56 8.611 -0.660 -13.178 405 HG13 VAL 56 HG13 VAL 56 8.178 0.221 -14.641 406 HG21 VAL 56 HG21 VAL 56 5.167 -1.722 -13.432 407 HG22 VAL 56 HG22 VAL 56 5.700 -0.086 -13.823 408 HG23 VAL 56 HG23 VAL 56 6.405 -0.941 -12.451 409 H CYS 57 HN CYS 57 6.545 -4.407 -15.644 410 HA CYS 57 HA CYS 57 8.885 -4.968 -17.323 411 HB2 CYS 57 HB2 CYS 57 9.137 -7.085 -16.137 412 HB3 CYS 57 HB1 CYS 57 9.109 -5.734 -15.018 413 H GLY 58 HN GLY 58 5.613 -6.343 -16.672 414 HA2 GLY 58 HA2 GLY 58 4.151 -6.585 -18.708 415 HA3 GLY 58 HA1 GLY 58 5.541 -7.339 -19.465 416 H GLU 59 HN GLU 59 5.639 -8.378 -16.347 417 HA GLU 59 HA GLU 59 4.362 -10.947 -16.885 418 HB2 GLU 59 HB2 GLU 59 6.447 -9.943 -14.998 419 HB3 GLU 59 HB1 GLU 59 5.533 -11.371 -14.525 420 HG2 GLU 59 HG2 GLU 59 6.676 -11.388 -17.264 421 HG3 GLU 59 HG1 GLU 59 7.824 -11.518 -15.933 422 H GLU 60 HN GLU 60 2.942 -11.997 -15.416 423 HA GLU 60 HA GLU 60 1.084 -10.191 -14.027 424 HB2 GLU 60 HB2 GLU 60 0.806 -12.952 -15.196 425 HB3 GLU 60 HB1 GLU 60 -0.379 -12.322 -14.064 426 HG2 GLU 60 HG2 GLU 60 -0.944 -10.522 -15.549 427 HG3 GLU 60 HG1 GLU 60 0.382 -10.936 -16.631 428 H PHE 61 HN PHE 61 0.531 -10.378 -11.922 429 HA PHE 61 HA PHE 61 1.874 -12.344 -10.212 430 HB2 PHE 61 HB2 PHE 61 2.218 -10.556 -8.478 431 HB3 PHE 61 HB1 PHE 61 3.182 -10.331 -9.921 432 HD1 PHE 61 HD1 PHE 61 2.764 -8.414 -11.408 433 HD2 PHE 61 HD2 PHE 61 0.501 -8.976 -7.847 434 HE1 PHE 61 HE1 PHE 61 1.958 -6.091 -11.554 435 HE2 PHE 61 HE2 PHE 61 -0.306 -6.655 -7.988 436 HZ PHE 61 HZ PHE 61 0.419 -5.211 -9.845 437 H TYR 62 HN TYR 62 0.702 -13.064 -8.430 438 HA TYR 62 HA TYR 62 -2.191 -12.608 -8.559 439 HB2 TYR 62 HB2 TYR 62 -0.501 -14.871 -7.508 440 HB3 TYR 62 HB1 TYR 62 -2.197 -14.737 -7.079 441 HD1 TYR 62 HD1 TYR 62 -3.950 -15.032 -8.858 442 HD2 TYR 62 HD2 TYR 62 0.190 -15.608 -9.690 443 HE1 TYR 62 HE1 TYR 62 -4.536 -16.249 -10.907 444 HE2 TYR 62 HE2 TYR 62 -0.394 -16.819 -11.748 445 HH TYR 62 HH TYR 62 -3.696 -17.683 -12.505 446 H GLY 63 HN GLY 63 -3.481 -12.279 -6.718 447 HA2 GLY 63 HA2 GLY 63 -2.403 -10.583 -4.650 448 HA3 GLY 63 HA1 GLY 63 -4.074 -11.071 -4.823 449 H LYS 64 HN LYS 64 -2.645 -13.904 -4.860 450 HA LYS 64 HA LYS 64 -3.002 -14.540 -2.039 451 HB2 LYS 64 HB2 LYS 64 -3.636 -15.916 -4.295 452 HB3 LYS 64 HB1 LYS 64 -2.106 -16.680 -3.883 453 HG2 LYS 64 HG2 LYS 64 -2.953 -17.327 -1.721 454 HG3 LYS 64 HG1 LYS 64 -4.446 -16.429 -1.989 455 HD2 LYS 64 HD2 LYS 64 -4.999 -17.925 -3.854 456 HD3 LYS 64 HD1 LYS 64 -3.511 -18.830 -3.561 457 HE2 LYS 64 HE2 LYS 64 -4.305 -19.369 -1.297 458 HE3 LYS 64 HE1 LYS 64 -5.798 -18.490 -1.620 459 HZ1 LYS 64 HZ1 LYS 64 -5.405 -20.343 -3.679 460 HZ2 LYS 64 HZ2 LYS 64 -6.633 -20.315 -2.516 461 HZ3 LYS 64 HZ3 LYS 64 -5.198 -21.156 -2.210 462 H THR 65 HN THR 65 -0.370 -13.925 -4.203 463 HA THR 65 HA THR 65 1.704 -15.128 -2.524 464 HB THR 65 HB THR 65 3.276 -14.229 -4.357 465 HG1 THR 65 HG1 THR 65 0.753 -13.718 -5.530 466 HG21 THR 65 HG21 THR 65 2.825 -16.074 -5.884 467 HG22 THR 65 HG22 THR 65 1.218 -16.285 -5.186 468 HG23 THR 65 HG23 THR 65 2.657 -16.604 -4.211 469 H LEU 66 HN LEU 66 0.047 -12.318 -2.314 470 HA LEU 66 HA LEU 66 2.241 -10.446 -1.783 471 HB2 LEU 66 HB2 LEU 66 -0.648 -10.197 -2.341 472 HB3 LEU 66 HB1 LEU 66 -0.081 -9.119 -1.087 473 HG LEU 66 HG LEU 66 1.762 -8.688 -3.120 474 HD11 LEU 66 HD11 LEU 66 0.692 -8.518 -5.165 475 HD12 LEU 66 HD12 LEU 66 -0.914 -8.672 -4.457 476 HD13 LEU 66 HD13 LEU 66 0.146 -10.081 -4.562 477 HD21 LEU 66 HD21 LEU 66 0.535 -6.573 -3.417 478 HD22 LEU 66 HD22 LEU 66 0.788 -6.983 -1.721 479 HD23 LEU 66 HD23 LEU 66 -0.793 -7.232 -2.463 480 HA PRO 67 HA PRO 67 2.186 -11.206 2.739 481 HB2 PRO 67 HB2 PRO 67 3.010 -8.790 3.767 482 HB3 PRO 67 HB1 PRO 67 4.116 -9.955 3.031 483 HG2 PRO 67 HG2 PRO 67 2.869 -7.493 1.816 484 HG3 PRO 67 HG1 PRO 67 4.551 -8.056 1.707 485 HD2 PRO 67 HD2 PRO 67 2.811 -8.472 -0.305 486 HD3 PRO 67 HD1 PRO 67 4.030 -9.690 0.117 487 H ARG 68 HN ARG 68 1.081 -10.765 4.737 488 HA ARG 68 HA ARG 68 -1.618 -9.933 4.574 489 HB2 ARG 68 HB2 ARG 68 0.137 -10.678 6.883 490 HB3 ARG 68 HB1 ARG 68 -1.472 -10.031 7.172 491 HG2 ARG 68 HG2 ARG 68 -2.463 -11.832 5.874 492 HG3 ARG 68 HG1 ARG 68 -0.862 -12.472 5.506 493 HD2 ARG 68 HD2 ARG 68 -0.480 -12.937 7.851 494 HD3 ARG 68 HD1 ARG 68 -2.027 -12.204 8.275 495 HE ARG 68 HE ARG 68 -2.278 -14.369 6.396 496 HH11 ARG 68 HH11 ARG 68 -2.154 -13.803 9.936 497 HH12 ARG 68 HH12 ARG 68 -2.938 -15.308 10.283 498 HH21 ARG 68 HH21 ARG 68 -3.290 -16.289 6.958 499 HH22 ARG 68 HH22 ARG 68 -3.569 -16.690 8.620 500 H ARG 69 HN ARG 69 1.226 -8.185 5.790 501 HA ARG 69 HA ARG 69 0.185 -5.843 6.819 502 HB2 ARG 69 HB2 ARG 69 2.726 -6.297 5.256 503 HB3 ARG 69 HB1 ARG 69 2.333 -4.731 5.946 504 HG2 ARG 69 HG2 ARG 69 2.337 -5.686 8.184 505 HG3 ARG 69 HG1 ARG 69 2.645 -7.290 7.513 506 HD2 ARG 69 HD2 ARG 69 4.777 -6.536 6.631 507 HD3 ARG 69 HD1 ARG 69 4.467 -4.905 7.227 508 HE ARG 69 HE ARG 69 4.280 -6.603 9.415 509 HH11 ARG 69 HH11 ARG 69 6.994 -5.675 7.262 510 HH12 ARG 69 HH12 ARG 69 8.170 -5.925 8.508 511 HH21 ARG 69 HH21 ARG 69 5.878 -6.892 10.951 512 HH22 ARG 69 HH22 ARG 69 7.542 -6.604 10.565 513 H GLU 70 HN GLU 70 0.828 -6.477 3.310 514 HA GLU 70 HA GLU 70 -0.233 -4.013 2.331 515 HB2 GLU 70 HB2 GLU 70 0.635 -6.591 1.080 516 HB3 GLU 70 HB1 GLU 70 -0.274 -5.429 0.122 517 HG2 GLU 70 HG2 GLU 70 1.428 -3.729 0.572 518 HG3 GLU 70 HG1 GLU 70 2.336 -4.899 1.528 519 H ALA 71 HN ALA 71 -1.618 -7.162 3.046 520 HA ALA 71 HA ALA 71 -4.131 -6.995 1.704 521 HB1 ALA 71 HB1 ALA 71 -3.559 -8.597 4.188 522 HB2 ALA 71 HB2 ALA 71 -3.019 -9.081 2.578 523 HB3 ALA 71 HB3 ALA 71 -4.742 -8.937 2.928 524 H GLU 72 HN GLU 72 -3.012 -5.941 4.886 525 HA GLU 72 HA GLU 72 -5.511 -5.223 6.072 526 HB2 GLU 72 HB2 GLU 72 -2.634 -4.797 6.725 527 HB3 GLU 72 HB1 GLU 72 -3.822 -3.780 7.532 528 HG2 GLU 72 HG2 GLU 72 -4.324 -6.711 7.536 529 HG3 GLU 72 HG1 GLU 72 -3.022 -6.115 8.564 530 H LYS 73 HN LYS 73 -3.321 -3.567 3.909 531 HA LYS 73 HA LYS 73 -4.163 -0.855 4.190 532 HB2 LYS 73 HB2 LYS 73 -2.689 -2.339 2.028 533 HB3 LYS 73 HB1 LYS 73 -3.174 -0.666 1.800 534 HG2 LYS 73 HG2 LYS 73 -1.855 -0.009 3.755 535 HG3 LYS 73 HG1 LYS 73 -1.386 -1.691 4.006 536 HD2 LYS 73 HD2 LYS 73 -0.302 -1.689 1.788 537 HD3 LYS 73 HD1 LYS 73 -0.730 0.011 1.601 538 HE2 LYS 73 HE2 LYS 73 0.615 0.585 3.546 539 HE3 LYS 73 HE1 LYS 73 0.997 -1.117 3.803 540 HZ1 LYS 73 HZ1 LYS 73 2.828 -0.471 2.655 541 HZ2 LYS 73 HZ2 LYS 73 2.020 0.733 1.786 542 HZ3 LYS 73 HZ3 LYS 73 1.847 -0.889 1.341 543 H VAL 74 HN VAL 74 -5.421 -3.572 2.395 544 HA VAL 74 HA VAL 74 -7.177 -2.286 0.540 545 HB VAL 74 HB VAL 74 -7.719 -5.120 1.526 546 HG11 VAL 74 HG11 VAL 74 -9.348 -4.227 -0.067 547 HG12 VAL 74 HG12 VAL 74 -8.428 -5.545 -0.793 548 HG13 VAL 74 HG13 VAL 74 -8.055 -3.874 -1.215 549 HG21 VAL 74 HG21 VAL 74 -5.302 -5.039 1.011 550 HG22 VAL 74 HG22 VAL 74 -5.682 -4.458 -0.608 551 HG23 VAL 74 HG23 VAL 74 -6.193 -6.071 -0.108 552 H PHE 75 HN PHE 75 -7.692 -3.519 3.913 553 HA PHE 75 HA PHE 75 -10.432 -3.018 4.256 554 HB2 PHE 75 HB2 PHE 75 -8.369 -4.020 5.788 555 HB3 PHE 75 HB1 PHE 75 -8.750 -2.519 6.619 556 HD1 PHE 75 HD2 PHE 75 -10.987 -2.190 7.645 557 HD2 PHE 75 HD1 PHE 75 -9.875 -5.884 5.824 558 HE1 PHE 75 HE2 PHE 75 -12.847 -3.316 8.790 559 HE2 PHE 75 HE1 PHE 75 -11.733 -7.007 6.973 560 HZ PHE 75 HZ PHE 75 -13.219 -5.725 8.459 561 H GLU 76 HN GLU 76 -7.721 -0.773 4.240 562 HA GLU 76 HA GLU 76 -8.785 1.415 5.740 563 HB2 GLU 76 HB2 GLU 76 -6.295 0.774 4.915 564 HB3 GLU 76 HB1 GLU 76 -6.715 1.943 3.671 565 HG2 GLU 76 HG2 GLU 76 -7.189 3.610 5.383 566 HG3 GLU 76 HG1 GLU 76 -6.766 2.450 6.642 567 H LEU 77 HN LEU 77 -8.661 0.707 2.212 568 HA LEU 77 HA LEU 77 -9.909 3.109 1.344 569 HB2 LEU 77 HB2 LEU 77 -10.213 1.859 -0.841 570 HB3 LEU 77 HB1 LEU 77 -8.585 2.108 -0.315 571 HG LEU 77 HG LEU 77 -9.042 -0.416 0.610 572 HD11 LEU 77 HD11 LEU 77 -10.269 -1.701 -0.949 573 HD12 LEU 77 HD12 LEU 77 -10.459 -0.321 -2.037 574 HD13 LEU 77 HD13 LEU 77 -11.297 -0.341 -0.481 575 HD21 LEU 77 HD21 LEU 77 -7.919 -1.145 -1.574 576 HD22 LEU 77 HD22 LEU 77 -7.073 0.026 -0.562 577 HD23 LEU 77 HD23 LEU 77 -7.933 0.564 -2.006 578 H LEU 78 HN LEU 78 -11.162 0.002 2.333 579 HA LEU 78 HA LEU 78 -13.890 0.318 1.471 580 HB2 LEU 78 HB2 LEU 78 -12.388 -1.658 3.133 581 HB3 LEU 78 HB1 LEU 78 -14.140 -1.649 3.200 582 HG LEU 78 HG LEU 78 -13.222 -1.661 0.442 583 HD11 LEU 78 HD11 LEU 78 -12.425 -4.020 0.504 584 HD12 LEU 78 HD12 LEU 78 -12.185 -3.835 2.233 585 HD13 LEU 78 HD13 LEU 78 -11.288 -2.824 1.104 586 HD21 LEU 78 HD21 LEU 78 -14.711 -3.588 0.321 587 HD22 LEU 78 HD22 LEU 78 -15.468 -2.229 1.151 588 HD23 LEU 78 HD23 LEU 78 -14.854 -3.594 2.079 589 H ASN 79 HN ASN 79 -12.081 1.227 4.320 590 HA ASN 79 HA ASN 79 -14.448 1.857 5.929 591 HB2 ASN 79 HB2 ASN 79 -11.613 1.309 6.486 592 HB3 ASN 79 HB1 ASN 79 -12.302 2.615 7.450 593 HD21 ASN 79 HD21 ASN 79 -12.400 -0.780 6.723 594 HD22 ASN 79 HD22 ASN 79 -13.376 -1.246 8.070 595 H ASP 80 HN ASP 80 -12.254 3.411 3.790 596 HA ASP 80 HA ASP 80 -12.893 6.090 4.785 597 HB2 ASP 80 HB2 ASP 80 -10.478 5.000 3.385 598 HB3 ASP 80 HB1 ASP 80 -10.884 6.700 3.197 599 H PHE 81 HN PHE 81 -14.948 5.296 3.716 600 HA PHE 81 HA PHE 81 -15.333 5.477 0.889 601 HB2 PHE 81 HB2 PHE 81 -17.009 5.007 3.215 602 HB3 PHE 81 HB1 PHE 81 -17.820 6.022 2.032 603 HD1 PHE 81 HD1 PHE 81 -18.304 5.146 -0.240 604 HD2 PHE 81 HD2 PHE 81 -16.581 2.682 2.787 605 HE1 PHE 81 HE1 PHE 81 -18.903 3.141 -1.531 606 HE2 PHE 81 HE2 PHE 81 -17.176 0.680 1.490 607 HZ PHE 81 HZ PHE 81 -18.337 0.907 -0.668 608 H LYS 82 HN LYS 82 -15.244 7.873 3.392 609 HA LYS 82 HA LYS 82 -16.145 10.038 1.619 610 HB2 LYS 82 HB2 LYS 82 -16.070 9.714 4.602 611 HB3 LYS 82 HB1 LYS 82 -15.996 11.328 3.913 612 HG2 LYS 82 HG2 LYS 82 -18.133 10.995 2.820 613 HG3 LYS 82 HG1 LYS 82 -18.198 9.332 3.408 614 HD2 LYS 82 HD2 LYS 82 -18.238 10.144 5.713 615 HD3 LYS 82 HD1 LYS 82 -18.140 11.808 5.135 616 HE2 LYS 82 HE2 LYS 82 -20.282 11.535 3.985 617 HE3 LYS 82 HE1 LYS 82 -20.375 9.868 4.553 618 HZ1 LYS 82 HZ1 LYS 82 -20.696 12.363 6.067 619 HZ2 LYS 82 HZ2 LYS 82 -20.126 10.988 6.868 620 HZ3 LYS 82 HZ3 LYS 82 -21.635 10.956 6.105 621 H GLY 83 HN GLY 83 -14.761 11.574 0.974 622 HA2 GLY 83 HA2 GLY 83 -12.547 12.700 2.034 623 HA3 GLY 83 HA1 GLY 83 -11.914 11.207 1.363 624 H GLY 84 HN GLY 84 -11.504 11.042 -0.744 625 HA2 GLY 84 HA2 GLY 84 -12.424 13.152 -2.600 626 HA3 GLY 84 HA1 GLY 84 -10.722 12.734 -2.503 627 H ILE 85 HN ILE 85 -13.771 10.886 -2.691 628 HA ILE 85 HA ILE 85 -12.717 9.389 -5.015 629 HB ILE 85 HB ILE 85 -14.807 8.108 -3.204 630 HG12 ILE 85 HG12 ILE 85 -12.319 6.831 -2.651 631 HG13 ILE 85 HG11 ILE 85 -12.086 8.555 -2.372 632 HG21 ILE 85 HG21 ILE 85 -14.476 7.026 -5.358 633 HG22 ILE 85 HG22 ILE 85 -13.876 5.978 -4.072 634 HG23 ILE 85 HG23 ILE 85 -12.742 6.897 -5.059 635 HD11 ILE 85 HD11 ILE 85 -12.744 7.531 -0.321 636 HD12 ILE 85 HD12 ILE 85 -14.134 6.766 -1.091 637 HD13 ILE 85 HD13 ILE 85 -14.086 8.519 -0.901 638 H ASP 86 HN ASP 86 -13.764 9.768 -6.812 639 HA ASP 86 HA ASP 86 -16.606 10.537 -6.798 640 HB2 ASP 86 HB2 ASP 86 -14.297 11.789 -8.241 641 HB3 ASP 86 HB1 ASP 86 -15.887 11.811 -8.995 642 H TRP 87 HN TRP 87 -17.904 9.374 -8.027 643 HA TRP 87 HA TRP 87 -16.936 7.145 -9.606 644 HB2 TRP 87 HB2 TRP 87 -19.672 8.049 -8.766 645 HB3 TRP 87 HB1 TRP 87 -19.469 6.776 -9.968 646 HD1 TRP 87 HD1 TRP 87 -19.297 7.450 -6.277 647 HE1 TRP 87 HE1 TRP 87 -18.776 5.294 -4.990 648 HE3 TRP 87 HE3 TRP 87 -18.125 4.326 -10.220 649 HZ2 TRP 87 HZ2 TRP 87 -17.995 2.694 -5.530 650 HZ3 TRP 87 HZ3 TRP 87 -17.508 1.998 -9.699 651 HH2 TRP 87 HH2 TRP 87 -17.444 1.199 -7.395 652 H GLU 88 HN GLU 88 -18.427 10.253 -10.293 653 HA GLU 88 HA GLU 88 -18.819 9.819 -13.124 654 HB2 GLU 88 HB2 GLU 88 -19.307 12.047 -11.205 655 HB3 GLU 88 HB1 GLU 88 -19.212 12.436 -12.918 656 HG2 GLU 88 HG2 GLU 88 -20.988 10.182 -12.145 657 HG3 GLU 88 HG1 GLU 88 -21.527 11.809 -11.731 658 H ASN 89 HN ASN 89 -16.416 11.476 -11.096 659 HA ASN 89 HA ASN 89 -14.910 12.576 -13.329 660 HB2 ASN 89 HB2 ASN 89 -15.337 13.457 -10.798 661 HB3 ASN 89 HB1 ASN 89 -13.759 12.697 -10.611 662 HD21 ASN 89 HD21 ASN 89 -11.983 13.636 -11.504 663 HD22 ASN 89 HD22 ASN 89 -12.005 15.172 -12.293 664 H LYS 90 HN LYS 90 -14.871 9.642 -11.475 665 HA LYS 90 HA LYS 90 -13.585 7.796 -11.227 666 HB2 LYS 90 HB2 LYS 90 -13.163 8.594 -14.003 667 HB3 LYS 90 HB1 LYS 90 -11.793 7.691 -13.381 668 HG2 LYS 90 HG2 LYS 90 -13.205 5.823 -12.841 669 HG3 LYS 90 HG1 LYS 90 -14.649 6.742 -13.286 670 HD2 LYS 90 HD2 LYS 90 -13.835 6.917 -15.582 671 HD3 LYS 90 HD1 LYS 90 -12.381 6.024 -15.144 672 HE2 LYS 90 HE2 LYS 90 -13.730 4.060 -14.634 673 HE3 LYS 90 HE1 LYS 90 -15.202 4.957 -15.018 674 HZ1 LYS 90 HZ1 LYS 90 -13.032 4.676 -17.002 675 HZ2 LYS 90 HZ2 LYS 90 -14.667 5.021 -17.266 676 HZ3 LYS 90 HZ3 LYS 90 -14.194 3.461 -16.813 677 H ARG 91 HN ARG 91 -12.781 9.535 -9.536 678 HA ARG 91 HA ARG 91 -9.845 9.427 -9.442 679 HB2 ARG 91 HB2 ARG 91 -11.672 11.664 -8.579 680 HB3 ARG 91 HB1 ARG 91 -10.064 11.489 -7.888 681 HG2 ARG 91 HG2 ARG 91 -9.063 11.710 -10.100 682 HG3 ARG 91 HG1 ARG 91 -10.664 11.801 -10.834 683 HD2 ARG 91 HD2 ARG 91 -9.965 14.039 -10.722 684 HD3 ARG 91 HD1 ARG 91 -11.017 13.857 -9.318 685 HE ARG 91 HE ARG 91 -8.360 13.324 -8.548 686 HH11 ARG 91 HH11 ARG 91 -10.261 16.238 -9.412 687 HH12 ARG 91 HH12 ARG 91 -9.208 17.284 -8.520 688 HH21 ARG 91 HH21 ARG 91 -7.066 14.760 -7.427 689 HH22 ARG 91 HH22 ARG 91 -7.424 16.454 -7.414 690 H VAL 92 HN VAL 92 -9.020 8.329 -7.926 691 HA VAL 92 HA VAL 92 -10.524 7.668 -5.473 692 HB VAL 92 HB VAL 92 -8.503 5.680 -6.554 693 HG11 VAL 92 HG11 VAL 92 -9.629 4.043 -5.263 694 HG12 VAL 92 HG12 VAL 92 -11.068 5.043 -5.097 695 HG13 VAL 92 HG13 VAL 92 -9.589 5.485 -4.247 696 HG21 VAL 92 HG21 VAL 92 -11.385 5.237 -7.304 697 HG22 VAL 92 HG22 VAL 92 -9.939 4.500 -7.987 698 HG23 VAL 92 HG23 VAL 92 -10.334 6.174 -8.364 699 H LYS 93 HN LYS 93 -9.553 8.347 -3.707 700 HA LYS 93 HA LYS 93 -6.628 8.717 -3.634 701 HB2 LYS 93 HB2 LYS 93 -8.823 10.538 -2.712 702 HB3 LYS 93 HB1 LYS 93 -7.290 10.547 -1.855 703 HG2 LYS 93 HG2 LYS 93 -6.118 11.152 -3.891 704 HG3 LYS 93 HG1 LYS 93 -7.624 11.057 -4.809 705 HD2 LYS 93 HD2 LYS 93 -8.556 12.876 -3.473 706 HD3 LYS 93 HD1 LYS 93 -7.067 12.964 -2.535 707 HE2 LYS 93 HE2 LYS 93 -5.831 13.570 -4.554 708 HE3 LYS 93 HE1 LYS 93 -7.315 13.458 -5.501 709 HZ1 LYS 93 HZ1 LYS 93 -8.161 15.363 -4.569 710 HZ2 LYS 93 HZ2 LYS 93 -6.515 15.747 -4.633 711 HZ3 LYS 93 HZ3 LYS 93 -7.211 15.252 -3.174 712 H LEU 94 HN LEU 94 -5.563 7.897 -1.960 713 HA LEU 94 HA LEU 94 -7.043 6.597 0.224 714 HB2 LEU 94 HB2 LEU 94 -4.592 5.733 -1.298 715 HB3 LEU 94 HB1 LEU 94 -4.884 5.140 0.322 716 HG LEU 94 HG LEU 94 -7.275 4.562 -0.917 717 HD11 LEU 94 HD11 LEU 94 -6.770 3.513 -3.037 718 HD12 LEU 94 HD12 LEU 94 -5.094 4.053 -2.936 719 HD13 LEU 94 HD13 LEU 94 -6.395 5.233 -3.102 720 HD21 LEU 94 HD21 LEU 94 -4.784 2.911 -0.543 721 HD22 LEU 94 HD22 LEU 94 -6.322 2.233 -1.070 722 HD23 LEU 94 HD23 LEU 94 -6.201 3.010 0.506 723 H LYS 95 HN LYS 95 -6.660 7.227 2.161 724 HA LYS 95 HA LYS 95 -4.318 8.905 2.800 725 HB2 LYS 95 HB2 LYS 95 -7.037 9.537 3.016 726 HB3 LYS 95 HB1 LYS 95 -6.520 9.203 4.663 727 HG2 LYS 95 HG2 LYS 95 -4.794 10.874 4.515 728 HG3 LYS 95 HG1 LYS 95 -5.151 11.144 2.809 729 HD2 LYS 95 HD2 LYS 95 -7.380 11.952 3.393 730 HD3 LYS 95 HD1 LYS 95 -7.047 11.656 5.101 731 HE2 LYS 95 HE2 LYS 95 -5.209 13.278 5.015 732 HE3 LYS 95 HE1 LYS 95 -5.561 13.579 3.313 733 HZ1 LYS 95 HZ1 LYS 95 -7.436 14.076 5.561 734 HZ2 LYS 95 HZ2 LYS 95 -7.732 14.407 3.930 735 HZ3 LYS 95 HZ3 LYS 95 -6.534 15.263 4.760
Contact the webmaster for help, if required. Monday, May 20, 2024 7:12:29 PM GMT (wattos1)