NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
25591 | 2ka5 | 16019 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1 1.330 -10.169 13.042 2 HA MET 1 HA MET 1 -1.235 -9.767 11.620 3 HB2 MET 1 HB2 MET 1 -0.646 -12.131 12.514 4 HB3 MET 1 HB3 MET 1 -0.788 -11.418 14.116 5 HG2 MET 1 HG2 MET 1 -2.879 -12.238 13.900 6 HG3 MET 1 HG3 MET 1 -3.164 -10.634 13.244 7 HE1 MET 1 HE1 MET 1 -3.207 -14.415 12.749 8 HE2 MET 1 HE2 MET 1 -4.766 -13.581 12.916 9 HE3 MET 1 HE3 MET 1 -4.376 -14.442 11.414 10 H GLY 2 H GLY 2 -2.440 -8.036 12.337 11 HA2 GLY 2 HA2 GLY 2 -3.399 -7.445 14.668 12 HA3 GLY 2 HA3 GLY 2 -1.775 -6.779 14.931 13 H SER 3 H SER 3 -4.180 -5.355 14.954 14 HA SER 3 HA SER 3 -5.243 -3.551 14.335 15 HB2 SER 3 HB2 SER 3 -3.118 -2.962 12.258 16 HB3 SER 3 HB3 SER 3 -4.390 -1.873 12.834 17 HG SER 3 HG SER 3 -3.493 -2.144 14.971 18 H ASP 4 H ASP 4 -6.857 -2.899 12.859 19 HA ASP 4 HA ASP 4 -7.721 -5.196 11.354 20 HB2 ASP 4 HB2 ASP 4 -9.802 -4.335 11.380 21 HB3 ASP 4 HB3 ASP 4 -9.139 -3.818 12.925 22 H LYS 5 H LYS 5 -7.855 -5.438 9.192 23 HA LYS 5 HA LYS 5 -6.524 -3.520 7.459 24 HB2 LYS 5 HB2 LYS 5 -7.146 -5.105 5.638 25 HB3 LYS 5 HB3 LYS 5 -6.013 -5.659 6.856 26 HG2 LYS 5 HG2 LYS 5 -7.307 -7.324 7.607 27 HG3 LYS 5 HG3 LYS 5 -8.819 -6.425 7.458 28 HD2 LYS 5 HD2 LYS 5 -7.323 -7.506 5.027 29 HD3 LYS 5 HD3 LYS 5 -8.497 -8.452 5.946 30 HE2 LYS 5 HE2 LYS 5 -9.793 -5.983 5.563 31 HE3 LYS 5 HE3 LYS 5 -8.960 -6.250 4.022 32 HZ1 LYS 5 HZ1 LYS 5 -11.225 -7.230 4.136 33 HZ2 LYS 5 HZ2 LYS 5 -10.083 -8.376 3.869 34 HZ3 LYS 5 HZ3 LYS 5 -10.737 -8.183 5.377 35 H ILE 6 H ILE 6 -7.607 -1.671 7.248 36 HA ILE 6 HA ILE 6 -10.236 -1.781 5.927 37 HB ILE 6 HB ILE 6 -10.724 -1.507 8.262 38 HG12 ILE 6 HG12 ILE 6 -12.042 0.565 8.227 39 HG13 ILE 6 HG13 ILE 6 -11.186 1.095 6.783 40 HG21 ILE 6 HG21 ILE 6 -9.125 1.088 8.326 41 HG22 ILE 6 HG22 ILE 6 -10.073 0.367 9.635 42 HG23 ILE 6 HG23 ILE 6 -8.622 -0.453 9.066 43 HD11 ILE 6 HD11 ILE 6 -12.154 -0.760 5.492 44 HD12 ILE 6 HD12 ILE 6 -12.871 -1.449 6.969 45 HD13 ILE 6 HD13 ILE 6 -13.443 0.105 6.326 46 H HIS 7 H HIS 7 -9.619 -1.126 3.951 47 HA HIS 7 HA HIS 7 -8.350 1.476 3.594 48 HB2 HIS 7 HB2 HIS 7 -6.381 0.055 4.014 49 HB3 HIS 7 HB3 HIS 7 -6.901 -1.083 2.777 50 HD1 HIS 7 HD1 HIS 7 -5.798 -0.687 0.459 51 HD2 HIS 7 HD2 HIS 7 -5.824 2.701 2.980 52 HE1 HIS 7 HE1 HIS 7 -4.429 1.102 -0.724 53 H HIS 8 H HIS 8 -10.234 1.988 2.493 54 HA HIS 8 HA HIS 8 -11.376 0.512 0.346 55 HB2 HIS 8 HB2 HIS 8 -11.372 3.484 0.937 56 HB3 HIS 8 HB3 HIS 8 -12.349 2.732 -0.317 57 HD1 HIS 8 HD1 HIS 8 -13.322 0.127 1.438 58 HD2 HIS 8 HD2 HIS 8 -13.343 4.232 2.499 59 HE1 HIS 8 HE1 HIS 8 -15.051 0.410 3.311 60 H HIS 9 H HIS 9 -11.504 1.561 -1.991 61 HA HIS 9 HA HIS 9 -8.762 1.064 -2.919 62 HB2 HIS 9 HB2 HIS 9 -10.740 -0.354 -3.550 63 HB3 HIS 9 HB3 HIS 9 -11.416 1.032 -4.404 64 HD1 HIS 9 HD1 HIS 9 -8.870 -1.748 -4.818 65 HD2 HIS 9 HD2 HIS 9 -9.955 1.940 -6.573 66 HE1 HIS 9 HE1 HIS 9 -7.795 -1.693 -7.117 67 H HIS 10 H HIS 10 -7.766 3.155 -2.681 68 HA HIS 10 HA HIS 10 -8.569 5.104 -4.731 69 HB2 HIS 10 HB2 HIS 10 -9.793 5.647 -2.589 70 HB3 HIS 10 HB3 HIS 10 -8.227 5.845 -1.797 71 HD1 HIS 10 HD1 HIS 10 -9.523 7.254 -5.247 72 HD2 HIS 10 HD2 HIS 10 -7.833 8.397 -1.531 73 HE1 HIS 10 HE1 HIS 10 -9.102 9.737 -5.375 74 H HIS 11 H HIS 11 -6.469 3.355 -4.938 75 HA HIS 11 HA HIS 11 -3.977 4.464 -3.984 76 HB2 HIS 11 HB2 HIS 11 -2.931 2.921 -5.439 77 HB3 HIS 11 HB3 HIS 11 -4.299 2.090 -4.744 78 HD1 HIS 11 HD1 HIS 11 -3.192 3.628 -8.130 79 HD2 HIS 11 HD2 HIS 11 -6.130 1.115 -6.429 80 HE1 HIS 11 HE1 HIS 11 -4.497 2.628 -10.059 81 H HIS 12 H HIS 12 -2.514 5.843 -5.196 82 HA HIS 12 HA HIS 12 -3.828 7.380 -7.381 83 HB2 HIS 12 HB2 HIS 12 -2.783 8.762 -5.679 84 HB3 HIS 12 HB3 HIS 12 -1.238 7.940 -5.905 85 HD1 HIS 12 HD1 HIS 12 -3.748 9.924 -8.224 86 HD2 HIS 12 HD2 HIS 12 0.361 9.164 -7.575 87 HE1 HIS 12 HE1 HIS 12 -2.492 11.245 -9.953 88 H MET 13 H MET 13 -0.353 6.673 -7.197 89 HA MET 13 HA MET 13 -0.396 4.940 -9.548 90 HB2 MET 13 HB2 MET 13 -0.886 7.417 -10.222 91 HB3 MET 13 HB3 MET 13 0.781 7.762 -9.781 92 HG2 MET 13 HG2 MET 13 1.568 6.231 -11.508 93 HG3 MET 13 HG3 MET 13 -0.093 5.681 -11.808 94 HE1 MET 13 HE1 MET 13 0.356 7.602 -15.133 95 HE2 MET 13 HE2 MET 13 1.489 6.494 -14.319 96 HE3 MET 13 HE3 MET 13 -0.255 6.146 -14.322 97 H PHE 14 H PHE 14 0.967 3.499 -8.326 98 HA PHE 14 HA PHE 14 2.823 4.417 -6.413 99 HB2 PHE 14 HB2 PHE 14 2.723 1.790 -7.895 100 HB3 PHE 14 HB3 PHE 14 3.473 2.088 -6.330 101 HD1 PHE 14 HD1 PHE 14 1.662 3.062 -4.485 102 HD2 PHE 14 HD2 PHE 14 0.862 0.454 -7.835 103 HE1 PHE 14 HE1 PHE 14 -0.343 2.165 -3.334 104 HE2 PHE 14 HE2 PHE 14 -1.119 -0.440 -6.659 105 HZ PHE 14 HZ PHE 14 -1.739 0.420 -4.424 106 HA PRO 15 HA PRO 15 6.211 4.884 -9.477 107 HB2 PRO 15 HB2 PRO 15 8.030 6.190 -7.988 108 HB3 PRO 15 HB3 PRO 15 6.561 6.983 -8.609 109 HG2 PRO 15 HG2 PRO 15 7.063 5.926 -5.844 110 HG3 PRO 15 HG3 PRO 15 6.293 7.461 -6.319 111 HD2 PRO 15 HD2 PRO 15 4.838 5.183 -5.670 112 HD3 PRO 15 HD3 PRO 15 4.255 6.465 -6.764 113 H TYR 16 H TYR 16 6.812 2.763 -9.808 114 HA TYR 16 HA TYR 16 9.163 1.826 -8.598 115 HB2 TYR 16 HB2 TYR 16 8.481 -0.266 -7.699 116 HB3 TYR 16 HB3 TYR 16 7.525 0.936 -6.875 117 HD1 TYR 16 HD1 TYR 16 5.099 1.132 -7.409 118 HD2 TYR 16 HD2 TYR 16 7.517 -1.990 -9.058 119 HE1 TYR 16 HE1 TYR 16 3.036 -0.292 -7.810 120 HE2 TYR 16 HE2 TYR 16 5.478 -3.271 -9.660 121 HH TYR 16 HH TYR 16 2.334 -2.447 -8.317 122 H LYS 17 H LYS 17 9.692 -0.443 -9.631 123 HA LYS 17 HA LYS 17 8.098 -1.075 -12.003 124 HB2 LYS 17 HB2 LYS 17 9.854 -1.151 -13.535 125 HB3 LYS 17 HB3 LYS 17 10.000 0.407 -12.706 126 HG2 LYS 17 HG2 LYS 17 12.050 0.076 -12.003 127 HG3 LYS 17 HG3 LYS 17 11.689 -1.555 -11.426 128 HD2 LYS 17 HD2 LYS 17 12.456 -2.569 -13.236 129 HD3 LYS 17 HD3 LYS 17 11.830 -1.366 -14.372 130 HE2 LYS 17 HE2 LYS 17 13.693 0.133 -13.846 131 HE3 LYS 17 HE3 LYS 17 14.368 -1.069 -12.736 132 HZ1 LYS 17 HZ1 LYS 17 15.337 -1.094 -15.009 133 HZ2 LYS 17 HZ2 LYS 17 14.665 -2.561 -14.630 134 HZ3 LYS 17 HZ3 LYS 17 13.896 -1.528 -15.629 135 H ILE 18 H ILE 18 9.024 -3.265 -12.970 136 HA ILE 18 HA ILE 18 9.946 -5.082 -10.791 137 HB ILE 18 HB ILE 18 7.819 -5.466 -12.932 138 HG12 ILE 18 HG12 ILE 18 7.208 -6.381 -10.167 139 HG13 ILE 18 HG13 ILE 18 7.528 -4.658 -10.242 140 HG21 ILE 18 HG21 ILE 18 9.060 -7.527 -12.974 141 HG22 ILE 18 HG22 ILE 18 9.051 -7.642 -11.196 142 HG23 ILE 18 HG23 ILE 18 7.548 -7.811 -12.128 143 HD11 ILE 18 HD11 ILE 18 5.860 -4.318 -11.929 144 HD12 ILE 18 HD12 ILE 18 5.590 -6.066 -12.122 145 HD13 ILE 18 HD13 ILE 18 5.123 -5.256 -10.611 146 H VAL 19 H VAL 19 11.352 -6.601 -11.405 147 HA VAL 19 HA VAL 19 12.729 -6.440 -14.001 148 HB VAL 19 HB VAL 19 13.721 -6.291 -11.118 149 HG11 VAL 19 HG11 VAL 19 15.281 -7.844 -12.048 150 HG12 VAL 19 HG12 VAL 19 15.454 -6.847 -13.532 151 HG13 VAL 19 HG13 VAL 19 16.025 -6.257 -11.955 152 HG21 VAL 19 HG21 VAL 19 14.929 -4.283 -12.128 153 HG22 VAL 19 HG22 VAL 19 14.029 -4.576 -13.617 154 HG23 VAL 19 HG23 VAL 19 13.162 -4.197 -12.106 155 H ASP 20 H ASP 20 14.260 -8.659 -13.739 156 HA ASP 20 HA ASP 20 12.566 -10.426 -14.582 157 HB2 ASP 20 HB2 ASP 20 15.381 -10.587 -13.639 158 HB3 ASP 20 HB3 ASP 20 14.563 -12.137 -13.904 159 H ASP 21 H ASP 21 13.956 -10.842 -11.293 160 HA ASP 21 HA ASP 21 11.258 -11.847 -10.494 161 HB2 ASP 21 HB2 ASP 21 13.788 -12.742 -9.094 162 HB3 ASP 21 HB3 ASP 21 12.126 -13.302 -8.848 163 H VAL 22 H VAL 22 12.866 -9.142 -10.460 164 HA VAL 22 HA VAL 22 12.918 -8.749 -7.505 165 HB VAL 22 HB VAL 22 15.035 -7.649 -9.439 166 HG11 VAL 22 HG11 VAL 22 14.407 -7.301 -6.523 167 HG12 VAL 22 HG12 VAL 22 16.060 -7.493 -6.983 168 HG13 VAL 22 HG13 VAL 22 15.086 -6.167 -7.691 169 HG21 VAL 22 HG21 VAL 22 16.494 -9.307 -8.270 170 HG22 VAL 22 HG22 VAL 22 15.087 -10.004 -7.438 171 HG23 VAL 22 HG23 VAL 22 15.255 -10.123 -9.191 172 H VAL 23 H VAL 23 12.729 -6.375 -6.876 173 HA VAL 23 HA VAL 23 10.756 -5.021 -8.646 174 HB VAL 23 HB VAL 23 10.608 -5.558 -5.652 175 HG11 VAL 23 HG11 VAL 23 8.546 -4.287 -7.503 176 HG12 VAL 23 HG12 VAL 23 8.458 -4.483 -5.736 177 HG13 VAL 23 HG13 VAL 23 9.635 -3.382 -6.435 178 HG21 VAL 23 HG21 VAL 23 8.596 -6.929 -6.190 179 HG22 VAL 23 HG22 VAL 23 8.956 -6.762 -7.919 180 HG23 VAL 23 HG23 VAL 23 10.069 -7.636 -6.846 181 H ILE 24 H ILE 24 11.260 -2.861 -8.883 182 HA ILE 24 HA ILE 24 13.459 -1.830 -7.163 183 HB ILE 24 HB ILE 24 12.851 -0.663 -9.882 184 HG12 ILE 24 HG12 ILE 24 13.637 -2.500 -10.903 185 HG13 ILE 24 HG13 ILE 24 15.181 -1.870 -10.442 186 HG21 ILE 24 HG21 ILE 24 15.123 0.230 -9.534 187 HG22 ILE 24 HG22 ILE 24 14.093 0.601 -8.153 188 HG23 ILE 24 HG23 ILE 24 15.261 -0.704 -8.025 189 HD11 ILE 24 HD11 ILE 24 14.857 -3.494 -8.344 190 HD12 ILE 24 HD12 ILE 24 13.753 -4.316 -9.493 191 HD13 ILE 24 HD13 ILE 24 15.438 -4.095 -9.916 192 H LEU 25 H LEU 25 12.546 -0.661 -5.593 193 HA LEU 25 HA LEU 25 9.988 0.768 -6.095 194 HB2 LEU 25 HB2 LEU 25 11.529 0.279 -3.504 195 HB3 LEU 25 HB3 LEU 25 9.900 0.943 -3.668 196 HG LEU 25 HG LEU 25 10.778 -1.893 -4.409 197 HD11 LEU 25 HD11 LEU 25 9.564 -2.693 -2.557 198 HD12 LEU 25 HD12 LEU 25 10.589 -1.377 -1.957 199 HD13 LEU 25 HD13 LEU 25 8.856 -1.091 -2.229 200 HD21 LEU 25 HD21 LEU 25 8.018 -0.606 -4.537 201 HD22 LEU 25 HD22 LEU 25 8.981 -1.264 -5.887 202 HD23 LEU 25 HD23 LEU 25 8.357 -2.345 -4.651 203 H MET 26 H MET 26 10.415 2.710 -7.035 204 HA MET 26 HA MET 26 12.942 4.147 -6.348 205 HB2 MET 26 HB2 MET 26 11.350 4.125 -8.931 206 HB3 MET 26 HB3 MET 26 12.777 5.127 -8.579 207 HG2 MET 26 HG2 MET 26 13.955 2.888 -8.061 208 HG3 MET 26 HG3 MET 26 12.585 2.125 -8.861 209 HE1 MET 26 HE1 MET 26 11.904 2.588 -11.378 210 HE2 MET 26 HE2 MET 26 12.060 4.361 -11.276 211 HE3 MET 26 HE3 MET 26 12.925 3.465 -12.538 212 HA PRO 27 HA PRO 27 9.433 6.782 -4.886 213 HB2 PRO 27 HB2 PRO 27 10.608 7.833 -2.665 214 HB3 PRO 27 HB3 PRO 27 9.928 6.172 -2.679 215 HG2 PRO 27 HG2 PRO 27 12.821 6.993 -3.050 216 HG3 PRO 27 HG3 PRO 27 12.140 5.728 -1.975 217 HD2 PRO 27 HD2 PRO 27 13.159 5.198 -4.475 218 HD3 PRO 27 HD3 PRO 27 11.841 4.245 -3.750 219 H ASN 28 H ASN 28 9.294 9.036 -4.935 220 HA ASN 28 HA ASN 28 11.625 10.527 -6.016 221 HB2 ASN 28 HB2 ASN 28 9.452 11.771 -7.198 222 HB3 ASN 28 HB3 ASN 28 10.612 10.699 -7.941 223 HD21 ASN 28 HD21 ASN 28 7.379 10.574 -6.243 224 HD22 ASN 28 HD22 ASN 28 6.843 9.182 -7.053 225 H LYS 29 H LYS 29 8.361 11.965 -5.141 226 HA LYS 29 HA LYS 29 9.686 13.052 -2.728 227 HB2 LYS 29 HB2 LYS 29 8.980 15.311 -3.321 228 HB3 LYS 29 HB3 LYS 29 10.298 14.693 -4.280 229 HG2 LYS 29 HG2 LYS 29 7.518 14.371 -5.392 230 HG3 LYS 29 HG3 LYS 29 8.197 15.997 -5.350 231 HD2 LYS 29 HD2 LYS 29 9.884 15.529 -6.866 232 HD3 LYS 29 HD3 LYS 29 9.915 13.818 -6.516 233 HE2 LYS 29 HE2 LYS 29 8.949 14.200 -8.732 234 HE3 LYS 29 HE3 LYS 29 7.740 13.512 -7.619 235 HZ1 LYS 29 HZ1 LYS 29 6.894 15.386 -8.962 236 HZ2 LYS 29 HZ2 LYS 29 6.759 15.643 -7.365 237 HZ3 LYS 29 HZ3 LYS 29 7.944 16.408 -8.237 238 H GLU 30 H GLU 30 8.057 11.179 -2.193 239 HA GLU 30 HA GLU 30 5.582 12.514 -1.293 240 HB2 GLU 30 HB2 GLU 30 4.150 10.824 -2.215 241 HB3 GLU 30 HB3 GLU 30 5.203 11.465 -3.473 242 HG2 GLU 30 HG2 GLU 30 6.714 9.435 -3.086 243 HG3 GLU 30 HG3 GLU 30 5.393 8.760 -2.130 244 H LEU 31 H LEU 31 8.127 11.114 -0.044 245 HA LEU 31 HA LEU 31 6.885 8.869 1.430 246 HB2 LEU 31 HB2 LEU 31 9.687 10.030 1.677 247 HB3 LEU 31 HB3 LEU 31 9.076 8.555 2.425 248 HG LEU 31 HG LEU 31 9.600 9.067 -0.519 249 HD11 LEU 31 HD11 LEU 31 10.600 6.963 1.434 250 HD12 LEU 31 HD12 LEU 31 11.127 7.192 -0.247 251 HD13 LEU 31 HD13 LEU 31 11.481 8.428 0.960 252 HD21 LEU 31 HD21 LEU 31 7.538 7.907 -0.632 253 HD22 LEU 31 HD22 LEU 31 8.792 6.700 -0.886 254 HD23 LEU 31 HD23 LEU 31 7.992 6.798 0.693 255 H ASN 32 H ASN 32 5.391 10.747 1.959 256 HA ASN 32 HA ASN 32 6.020 12.138 4.490 257 HB2 ASN 32 HB2 ASN 32 4.056 13.375 4.133 258 HB3 ASN 32 HB3 ASN 32 4.729 13.244 2.516 259 HD21 ASN 32 HD21 ASN 32 3.658 11.384 1.032 260 HD22 ASN 32 HD22 ASN 32 1.947 11.250 1.374 261 H ILE 33 H ILE 33 4.152 11.877 6.143 262 HA ILE 33 HA ILE 33 4.260 9.246 7.112 263 HB ILE 33 HB ILE 33 2.565 11.671 7.788 264 HG12 ILE 33 HG12 ILE 33 5.050 10.339 8.923 265 HG13 ILE 33 HG13 ILE 33 4.911 11.947 8.221 266 HG21 ILE 33 HG21 ILE 33 1.213 9.757 8.489 267 HG22 ILE 33 HG22 ILE 33 2.604 9.065 9.359 268 HG23 ILE 33 HG23 ILE 33 1.847 10.577 9.894 269 HD11 ILE 33 HD11 ILE 33 5.166 12.113 10.618 270 HD12 ILE 33 HD12 ILE 33 3.512 12.632 10.173 271 HD13 ILE 33 HD13 ILE 33 3.810 11.029 10.894 272 H GLU 34 H GLU 34 1.711 10.745 5.055 273 HA GLU 34 HA GLU 34 -0.214 8.696 5.655 274 HB2 GLU 34 HB2 GLU 34 -0.141 10.561 3.262 275 HB3 GLU 34 HB3 GLU 34 -1.525 9.650 3.908 276 HG2 GLU 34 HG2 GLU 34 -0.950 10.856 6.163 277 HG3 GLU 34 HG3 GLU 34 -0.045 11.985 5.198 278 H ASN 35 H ASN 35 2.599 8.756 3.693 279 HA ASN 35 HA ASN 35 1.770 6.234 2.340 280 HB2 ASN 35 HB2 ASN 35 1.907 8.061 0.720 281 HB3 ASN 35 HB3 ASN 35 3.553 8.409 1.257 282 HD21 ASN 35 HD21 ASN 35 4.882 7.731 -0.349 283 HD22 ASN 35 HD22 ASN 35 4.793 6.220 -1.220 284 H ALA 36 H ALA 36 2.539 5.923 4.774 285 HA ALA 36 HA ALA 36 5.333 4.929 4.635 286 HB1 ALA 36 HB1 ALA 36 4.266 6.620 6.910 287 HB2 ALA 36 HB2 ALA 36 5.859 5.823 6.799 288 HB3 ALA 36 HB3 ALA 36 5.438 7.135 5.683 289 H HIS 37 H HIS 37 2.529 5.027 7.027 290 HA HIS 37 HA HIS 37 2.999 2.291 7.810 291 HB2 HIS 37 HB2 HIS 37 1.607 3.844 9.178 292 HB3 HIS 37 HB3 HIS 37 0.355 3.790 7.929 293 HD1 HIS 37 HD1 HIS 37 1.707 1.791 10.861 294 HD2 HIS 37 HD2 HIS 37 -0.848 1.266 7.538 295 HE1 HIS 37 HE1 HIS 37 0.490 -0.391 11.224 296 H LEU 38 H LEU 38 0.874 3.861 5.288 297 HA LEU 38 HA LEU 38 -0.185 1.388 4.412 298 HB2 LEU 38 HB2 LEU 38 -1.439 2.538 3.006 299 HB3 LEU 38 HB3 LEU 38 -0.966 3.884 4.011 300 HG LEU 38 HG LEU 38 0.853 4.389 2.293 301 HD11 LEU 38 HD11 LEU 38 1.252 2.689 0.832 302 HD12 LEU 38 HD12 LEU 38 -0.384 2.017 0.978 303 HD13 LEU 38 HD13 LEU 38 -0.049 3.404 -0.088 304 HD21 LEU 38 HD21 LEU 38 -1.410 5.532 2.389 305 HD22 LEU 38 HD22 LEU 38 -0.627 5.551 0.808 306 HD23 LEU 38 HD23 LEU 38 -1.963 4.414 1.139 307 H PHE 39 H PHE 39 2.871 3.056 3.757 308 HA PHE 39 HA PHE 39 3.537 2.150 1.235 309 HB2 PHE 39 HB2 PHE 39 4.712 3.726 2.916 310 HB3 PHE 39 HB3 PHE 39 5.526 2.286 3.533 311 HD1 PHE 39 HD1 PHE 39 4.949 4.188 0.302 312 HD2 PHE 39 HD2 PHE 39 7.587 1.726 2.692 313 HE1 PHE 39 HE1 PHE 39 6.850 4.886 -1.084 314 HE2 PHE 39 HE2 PHE 39 9.492 2.451 1.296 315 HZ PHE 39 HZ PHE 39 9.122 4.076 -0.592 316 H LYS 40 H LYS 40 4.359 0.664 4.335 317 HA LYS 40 HA LYS 40 5.352 -1.846 3.417 318 HB2 LYS 40 HB2 LYS 40 5.753 -0.983 5.610 319 HB3 LYS 40 HB3 LYS 40 4.043 -0.891 5.986 320 HG2 LYS 40 HG2 LYS 40 5.450 -3.540 5.484 321 HG3 LYS 40 HG3 LYS 40 5.477 -2.704 7.032 322 HD2 LYS 40 HD2 LYS 40 2.870 -2.684 6.900 323 HD3 LYS 40 HD3 LYS 40 3.057 -3.895 5.633 324 HE2 LYS 40 HE2 LYS 40 2.632 -4.948 7.767 325 HE3 LYS 40 HE3 LYS 40 4.242 -5.384 7.187 326 HZ1 LYS 40 HZ1 LYS 40 3.787 -3.243 9.162 327 HZ2 LYS 40 HZ2 LYS 40 4.149 -4.795 9.567 328 HZ3 LYS 40 HZ3 LYS 40 5.228 -3.945 8.697 329 H LYS 41 H LYS 41 2.013 -0.813 4.175 330 HA LYS 41 HA LYS 41 0.778 -3.403 3.909 331 HB2 LYS 41 HB2 LYS 41 0.084 -0.655 4.539 332 HB3 LYS 41 HB3 LYS 41 -0.996 -1.145 3.273 333 HG2 LYS 41 HG2 LYS 41 -0.548 -2.804 5.784 334 HG3 LYS 41 HG3 LYS 41 -1.705 -1.479 5.754 335 HD2 LYS 41 HD2 LYS 41 -1.904 -3.541 3.581 336 HD3 LYS 41 HD3 LYS 41 -2.391 -3.998 5.207 337 HE2 LYS 41 HE2 LYS 41 -4.302 -3.296 3.878 338 HE3 LYS 41 HE3 LYS 41 -4.077 -2.275 5.304 339 HZ1 LYS 41 HZ1 LYS 41 -3.141 -1.500 2.601 340 HZ2 LYS 41 HZ2 LYS 41 -4.602 -1.075 3.219 341 HZ3 LYS 41 HZ3 LYS 41 -3.275 -0.535 3.968 342 H TRP 42 H TRP 42 1.514 -0.844 1.535 343 HA TRP 42 HA TRP 42 0.174 -2.147 -0.691 344 HB2 TRP 42 HB2 TRP 42 0.438 0.083 -1.114 345 HB3 TRP 42 HB3 TRP 42 1.936 0.215 -0.234 346 HD1 TRP 42 HD1 TRP 42 0.911 -1.446 -3.618 347 HE1 TRP 42 HE1 TRP 42 2.764 -1.042 -5.292 348 HE3 TRP 42 HE3 TRP 42 4.034 1.296 -0.670 349 HZ2 TRP 42 HZ2 TRP 42 5.511 0.056 -5.241 350 HZ3 TRP 42 HZ3 TRP 42 6.254 1.960 -1.438 351 HH2 TRP 42 HH2 TRP 42 7.050 1.308 -3.721 352 H VAL 43 H VAL 43 3.696 -1.724 0.123 353 HA VAL 43 HA VAL 43 4.691 -3.564 -1.587 354 HB VAL 43 HB VAL 43 5.565 -2.735 1.193 355 HG11 VAL 43 HG11 VAL 43 6.668 -4.830 1.044 356 HG12 VAL 43 HG12 VAL 43 7.163 -4.556 -0.638 357 HG13 VAL 43 HG13 VAL 43 7.865 -3.595 0.669 358 HG21 VAL 43 HG21 VAL 43 7.237 -1.416 -0.048 359 HG22 VAL 43 HG22 VAL 43 6.662 -2.093 -1.578 360 HG23 VAL 43 HG23 VAL 43 5.614 -1.041 -0.621 361 H PHE 44 H PHE 44 3.248 -4.443 1.575 362 HA PHE 44 HA PHE 44 4.041 -7.144 1.599 363 HB2 PHE 44 HB2 PHE 44 2.024 -5.479 3.008 364 HB3 PHE 44 HB3 PHE 44 1.580 -7.116 2.869 365 HD1 PHE 44 HD1 PHE 44 4.794 -5.288 3.697 366 HD2 PHE 44 HD2 PHE 44 2.110 -8.547 4.609 367 HE1 PHE 44 HE1 PHE 44 6.233 -5.936 5.616 368 HE2 PHE 44 HE2 PHE 44 3.571 -9.206 6.485 369 HZ PHE 44 HZ PHE 44 5.609 -7.900 7.015 370 H ASP 45 H ASP 45 1.379 -5.579 -0.084 371 HA ASP 45 HA ASP 45 0.229 -8.248 -0.824 372 HB2 ASP 45 HB2 ASP 45 -1.120 -6.713 0.577 373 HB3 ASP 45 HB3 ASP 45 -1.106 -5.523 -0.735 374 H GLU 46 H GLU 46 1.779 -5.504 -2.102 375 HA GLU 46 HA GLU 46 1.029 -6.001 -4.915 376 HB2 GLU 46 HB2 GLU 46 1.576 -3.737 -3.731 377 HB3 GLU 46 HB3 GLU 46 3.246 -4.265 -3.764 378 HG2 GLU 46 HG2 GLU 46 3.107 -2.986 -5.677 379 HG3 GLU 46 HG3 GLU 46 2.824 -4.589 -6.352 380 H PHE 47 H PHE 47 3.696 -6.742 -2.618 381 HA PHE 47 HA PHE 47 5.072 -8.194 -4.802 382 HB2 PHE 47 HB2 PHE 47 6.520 -6.671 -2.624 383 HB3 PHE 47 HB3 PHE 47 7.184 -7.410 -4.068 384 HD1 PHE 47 HD1 PHE 47 5.987 -6.508 -6.372 385 HD2 PHE 47 HD2 PHE 47 6.329 -4.374 -2.653 386 HE1 PHE 47 HE1 PHE 47 5.606 -4.399 -7.554 387 HE2 PHE 47 HE2 PHE 47 5.901 -2.234 -3.835 388 HZ PHE 47 HZ PHE 47 5.572 -2.236 -6.298 389 H LEU 48 H LEU 48 5.275 -7.776 -1.261 390 HA LEU 48 HA LEU 48 6.820 -10.030 -0.947 391 HB2 LEU 48 HB2 LEU 48 5.026 -8.875 1.209 392 HB3 LEU 48 HB3 LEU 48 6.457 -9.882 1.434 393 HG LEU 48 HG LEU 48 6.374 -7.038 0.489 394 HD11 LEU 48 HD11 LEU 48 7.915 -8.365 2.755 395 HD12 LEU 48 HD12 LEU 48 7.815 -6.625 2.411 396 HD13 LEU 48 HD13 LEU 48 6.374 -7.525 2.954 397 HD21 LEU 48 HD21 LEU 48 7.983 -8.151 -0.967 398 HD22 LEU 48 HD22 LEU 48 8.840 -7.171 0.217 399 HD23 LEU 48 HD23 LEU 48 8.743 -8.941 0.412 400 H ASN 49 H ASN 49 3.309 -9.920 -0.131 401 HA ASN 49 HA ASN 49 3.107 -12.742 0.339 402 HB2 ASN 49 HB2 ASN 49 1.072 -10.609 -0.408 403 HB3 ASN 49 HB3 ASN 49 0.629 -12.295 -0.335 404 HD21 ASN 49 HD21 ASN 49 1.162 -9.511 1.540 405 HD22 ASN 49 HD22 ASN 49 0.867 -10.238 3.125 406 H LYS 50 H LYS 50 2.881 -10.775 -2.600 407 HA LYS 50 HA LYS 50 1.908 -12.605 -4.436 408 HB2 LYS 50 HB2 LYS 50 3.090 -9.974 -4.416 409 HB3 LYS 50 HB3 LYS 50 3.994 -10.893 -5.581 410 HG2 LYS 50 HG2 LYS 50 1.180 -11.383 -6.054 411 HG3 LYS 50 HG3 LYS 50 1.433 -9.641 -5.777 412 HD2 LYS 50 HD2 LYS 50 3.239 -9.634 -7.453 413 HD3 LYS 50 HD3 LYS 50 2.857 -11.316 -7.862 414 HE2 LYS 50 HE2 LYS 50 0.988 -8.893 -8.031 415 HE3 LYS 50 HE3 LYS 50 1.813 -9.664 -9.399 416 HZ1 LYS 50 HZ1 LYS 50 -0.355 -10.804 -7.782 417 HZ2 LYS 50 HZ2 LYS 50 -0.343 -10.489 -9.377 418 HZ3 LYS 50 HZ3 LYS 50 0.569 -11.721 -8.836 419 H GLY 51 H GLY 51 4.950 -12.732 -2.851 420 HA2 GLY 51 HA2 GLY 51 6.057 -14.906 -2.955 421 HA3 GLY 51 HA3 GLY 51 5.945 -14.845 -4.717 422 H TYR 52 H TYR 52 6.573 -11.686 -3.997 423 HA TYR 52 HA TYR 52 9.245 -12.020 -5.016 424 HB2 TYR 52 HB2 TYR 52 7.593 -9.611 -4.241 425 HB3 TYR 52 HB3 TYR 52 9.237 -9.458 -4.765 426 HD1 TYR 52 HD1 TYR 52 9.828 -10.853 -7.015 427 HD2 TYR 52 HD2 TYR 52 5.869 -9.585 -5.959 428 HE1 TYR 52 HE1 TYR 52 9.305 -10.635 -9.382 429 HE2 TYR 52 HE2 TYR 52 5.280 -9.380 -8.318 430 HH TYR 52 HH TYR 52 6.083 -9.592 -10.545 431 H ASN 53 H ASN 53 10.974 -12.347 -3.976 432 HA ASN 53 HA ASN 53 11.272 -11.767 -1.070 433 HB2 ASN 53 HB2 ASN 53 12.455 -13.922 -2.857 434 HB3 ASN 53 HB3 ASN 53 13.034 -13.611 -1.238 435 HD21 ASN 53 HD21 ASN 53 10.472 -13.220 0.184 436 HD22 ASN 53 HD22 ASN 53 9.738 -14.805 0.130 437 H LYS 54 H LYS 54 11.985 -9.987 -3.599 438 HA LYS 54 HA LYS 54 14.592 -9.132 -2.588 439 HB2 LYS 54 HB2 LYS 54 14.280 -10.658 -5.119 440 HB3 LYS 54 HB3 LYS 54 15.186 -9.165 -5.243 441 HG2 LYS 54 HG2 LYS 54 16.973 -9.891 -4.178 442 HG3 LYS 54 HG3 LYS 54 16.060 -10.636 -2.858 443 HD2 LYS 54 HD2 LYS 54 16.402 -11.891 -5.627 444 HD3 LYS 54 HD3 LYS 54 17.436 -12.207 -4.231 445 HE2 LYS 54 HE2 LYS 54 15.111 -12.608 -3.008 446 HE3 LYS 54 HE3 LYS 54 14.522 -12.849 -4.668 447 HZ1 LYS 54 HZ1 LYS 54 16.880 -14.293 -3.590 448 HZ2 LYS 54 HZ2 LYS 54 15.377 -14.862 -3.291 449 HZ3 LYS 54 HZ3 LYS 54 15.896 -14.756 -4.845 450 H ILE 55 H ILE 55 14.104 -7.108 -2.221 451 HA ILE 55 HA ILE 55 12.595 -5.436 -4.212 452 HB ILE 55 HB ILE 55 12.679 -5.551 -1.188 453 HG12 ILE 55 HG12 ILE 55 10.202 -5.169 -1.503 454 HG13 ILE 55 HG13 ILE 55 10.439 -5.226 -3.254 455 HG21 ILE 55 HG21 ILE 55 11.949 -3.139 -2.856 456 HG22 ILE 55 HG22 ILE 55 11.561 -3.347 -1.121 457 HG23 ILE 55 HG23 ILE 55 13.228 -3.231 -1.655 458 HD11 ILE 55 HD11 ILE 55 9.472 -7.263 -2.239 459 HD12 ILE 55 HD12 ILE 55 10.905 -7.559 -3.197 460 HD13 ILE 55 HD13 ILE 55 11.035 -7.555 -1.421 461 H PHE 56 H PHE 56 13.736 -3.437 -4.712 462 HA PHE 56 HA PHE 56 16.246 -2.932 -3.247 463 HB2 PHE 56 HB2 PHE 56 15.840 -2.564 -6.231 464 HB3 PHE 56 HB3 PHE 56 17.231 -1.981 -5.329 465 HD1 PHE 56 HD1 PHE 56 17.686 -4.454 -3.517 466 HD2 PHE 56 HD2 PHE 56 16.855 -4.106 -7.758 467 HE1 PHE 56 HE1 PHE 56 18.740 -6.634 -3.964 468 HE2 PHE 56 HE2 PHE 56 17.796 -6.320 -8.150 469 HZ PHE 56 HZ PHE 56 18.772 -7.604 -6.224 470 H LEU 57 H LEU 57 16.685 -0.672 -2.881 471 HA LEU 57 HA LEU 57 14.441 1.183 -3.583 472 HB2 LEU 57 HB2 LEU 57 14.343 0.841 -1.252 473 HB3 LEU 57 HB3 LEU 57 16.107 0.865 -1.096 474 HG LEU 57 HG LEU 57 16.215 3.236 -1.473 475 HD11 LEU 57 HD11 LEU 57 14.280 4.639 -1.750 476 HD12 LEU 57 HD12 LEU 57 14.261 3.459 -3.046 477 HD13 LEU 57 HD13 LEU 57 13.181 3.248 -1.657 478 HD21 LEU 57 HD21 LEU 57 15.814 2.400 0.824 479 HD22 LEU 57 HD22 LEU 57 15.060 3.986 0.558 480 HD23 LEU 57 HD23 LEU 57 14.061 2.523 0.559 481 H VAL 58 H VAL 58 15.158 2.508 -5.212 482 HA VAL 58 HA VAL 58 18.007 3.276 -5.361 483 HB VAL 58 HB VAL 58 15.658 4.045 -7.132 484 HG11 VAL 58 HG11 VAL 58 17.439 4.605 -8.791 485 HG12 VAL 58 HG12 VAL 58 17.539 5.595 -7.343 486 HG13 VAL 58 HG13 VAL 58 18.682 4.251 -7.567 487 HG21 VAL 58 HG21 VAL 58 16.112 1.551 -7.187 488 HG22 VAL 58 HG22 VAL 58 16.344 2.380 -8.716 489 HG23 VAL 58 HG23 VAL 58 17.750 1.918 -7.751 490 H LEU 59 H LEU 59 18.701 5.246 -4.539 491 HA LEU 59 HA LEU 59 16.603 7.082 -3.454 492 HB2 LEU 59 HB2 LEU 59 19.474 6.647 -2.576 493 HB3 LEU 59 HB3 LEU 59 18.390 7.877 -1.937 494 HG LEU 59 HG LEU 59 16.904 5.439 -1.845 495 HD11 LEU 59 HD11 LEU 59 19.701 5.063 -0.698 496 HD12 LEU 59 HD12 LEU 59 18.308 3.974 -0.493 497 HD13 LEU 59 HD13 LEU 59 19.023 4.210 -2.099 498 HD21 LEU 59 HD21 LEU 59 18.270 6.755 0.504 499 HD22 LEU 59 HD22 LEU 59 16.760 7.334 -0.243 500 HD23 LEU 59 HD23 LEU 59 16.822 5.733 0.496 501 H SER 60 H SER 60 18.262 6.881 -6.207 502 HA SER 60 HA SER 60 19.687 9.230 -6.577 503 HB2 SER 60 HB2 SER 60 19.610 7.444 -8.210 504 HB3 SER 60 HB3 SER 60 17.876 7.662 -8.463 505 HG SER 60 HG SER 60 19.519 8.589 -9.992 506 H ASP 61 H ASP 61 16.089 8.813 -6.808 507 HA ASP 61 HA ASP 61 15.826 11.565 -7.803 508 HB2 ASP 61 HB2 ASP 61 13.802 9.361 -7.395 509 HB3 ASP 61 HB3 ASP 61 13.445 10.934 -8.099 510 H VAL 62 H VAL 62 16.376 10.596 -4.755 511 HA VAL 62 HA VAL 62 14.459 12.475 -3.515 512 HB VAL 62 HB VAL 62 13.501 10.249 -3.284 513 HG11 VAL 62 HG11 VAL 62 15.316 8.787 -3.676 514 HG12 VAL 62 HG12 VAL 62 16.126 9.267 -2.163 515 HG13 VAL 62 HG13 VAL 62 14.589 8.389 -2.115 516 HG21 VAL 62 HG21 VAL 62 13.338 10.057 -0.871 517 HG22 VAL 62 HG22 VAL 62 14.862 10.928 -0.655 518 HG23 VAL 62 HG23 VAL 62 13.437 11.780 -1.300 519 H GLU 63 H GLU 63 15.528 13.933 -2.212 520 HA GLU 63 HA GLU 63 18.421 13.663 -1.944 521 HB2 GLU 63 HB2 GLU 63 17.184 15.845 -2.201 522 HB3 GLU 63 HB3 GLU 63 16.485 15.525 -0.603 523 HG2 GLU 63 HG2 GLU 63 18.732 15.538 0.446 524 HG3 GLU 63 HG3 GLU 63 19.454 15.844 -1.132 525 H SER 64 H SER 64 15.486 13.341 0.164 526 HA SER 64 HA SER 64 16.920 11.731 2.021 527 HB2 SER 64 HB2 SER 64 17.368 13.226 3.700 528 HB3 SER 64 HB3 SER 64 17.466 14.304 2.345 529 HG SER 64 HG SER 64 15.316 14.952 2.686 530 H ILE 65 H ILE 65 15.398 11.769 4.223 531 HA ILE 65 HA ILE 65 12.611 11.447 3.432 532 HB ILE 65 HB ILE 65 13.825 9.356 2.920 533 HG12 ILE 65 HG12 ILE 65 12.067 9.016 5.351 534 HG13 ILE 65 HG13 ILE 65 11.460 9.418 3.736 535 HG21 ILE 65 HG21 ILE 65 15.702 9.512 4.524 536 HG22 ILE 65 HG22 ILE 65 14.570 9.285 5.878 537 HG23 ILE 65 HG23 ILE 65 14.851 7.988 4.714 538 HD11 ILE 65 HD11 ILE 65 12.565 7.317 2.877 539 HD12 ILE 65 HD12 ILE 65 12.921 6.899 4.567 540 HD13 ILE 65 HD13 ILE 65 11.245 7.042 4.022 541 H ASP 66 H ASP 66 11.245 11.274 5.361 542 HA ASP 66 HA ASP 66 12.256 12.737 7.711 543 HB2 ASP 66 HB2 ASP 66 9.647 12.061 6.487 544 HB3 ASP 66 HB3 ASP 66 9.659 11.680 8.191 545 H SER 67 H SER 67 12.218 11.884 9.879 546 HA SER 67 HA SER 67 13.249 9.428 10.386 547 HB2 SER 67 HB2 SER 67 11.350 10.876 12.247 548 HB3 SER 67 HB3 SER 67 12.700 9.844 12.701 549 HG SER 67 HG SER 67 12.918 12.310 12.621 550 H PHE 68 H PHE 68 9.834 10.138 9.935 551 HA PHE 68 HA PHE 68 8.683 7.898 11.200 552 HB2 PHE 68 HB2 PHE 68 7.581 10.009 10.425 553 HB3 PHE 68 HB3 PHE 68 7.519 9.336 8.805 554 HD1 PHE 68 HD1 PHE 68 6.218 7.124 8.507 555 HD2 PHE 68 HD2 PHE 68 5.998 9.485 12.087 556 HE1 PHE 68 HE1 PHE 68 4.062 5.990 9.131 557 HE2 PHE 68 HE2 PHE 68 3.886 8.349 12.715 558 HZ PHE 68 HZ PHE 68 2.910 6.615 11.230 559 H SER 69 H SER 69 9.188 8.350 7.628 560 HA SER 69 HA SER 69 8.701 5.516 7.241 561 HB2 SER 69 HB2 SER 69 7.879 7.146 5.736 562 HB3 SER 69 HB3 SER 69 9.519 7.603 5.212 563 HG SER 69 HG SER 69 8.316 6.040 3.877 564 H LEU 70 H LEU 70 11.629 7.488 7.659 565 HA LEU 70 HA LEU 70 13.607 5.784 6.694 566 HB2 LEU 70 HB2 LEU 70 13.886 8.038 7.759 567 HB3 LEU 70 HB3 LEU 70 13.407 7.360 9.305 568 HG LEU 70 HG LEU 70 15.518 6.030 9.379 569 HD11 LEU 70 HD11 LEU 70 16.072 7.569 6.805 570 HD12 LEU 70 HD12 LEU 70 17.362 6.915 7.802 571 HD13 LEU 70 HD13 LEU 70 16.166 5.817 7.088 572 HD21 LEU 70 HD21 LEU 70 15.308 8.230 10.492 573 HD22 LEU 70 HD22 LEU 70 16.946 8.009 9.869 574 HD23 LEU 70 HD23 LEU 70 15.808 9.048 8.995 575 H GLY 71 H GLY 71 11.524 5.234 9.496 576 HA2 GLY 71 HA2 GLY 71 13.086 2.846 10.340 577 HA3 GLY 71 HA3 GLY 71 11.654 3.507 11.130 578 H VAL 72 H VAL 72 10.284 3.618 8.363 579 HA VAL 72 HA VAL 72 9.062 0.992 8.446 580 HB VAL 72 HB VAL 72 8.751 3.265 6.396 581 HG11 VAL 72 HG11 VAL 72 6.710 2.096 5.732 582 HG12 VAL 72 HG12 VAL 72 8.063 1.003 5.519 583 HG13 VAL 72 HG13 VAL 72 7.000 0.801 6.926 584 HG21 VAL 72 HG21 VAL 72 8.042 3.938 8.630 585 HG22 VAL 72 HG22 VAL 72 6.642 3.694 7.583 586 HG23 VAL 72 HG23 VAL 72 7.069 2.471 8.810 587 H ILE 73 H ILE 73 11.414 2.726 6.418 588 HA ILE 73 HA ILE 73 11.909 0.749 4.452 589 HB ILE 73 HB ILE 73 13.661 2.889 5.709 590 HG12 ILE 73 HG12 ILE 73 13.853 3.512 3.186 591 HG13 ILE 73 HG13 ILE 73 12.577 2.354 2.905 592 HG21 ILE 73 HG21 ILE 73 14.689 0.855 3.687 593 HG22 ILE 73 HG22 ILE 73 15.495 2.378 4.141 594 HG23 ILE 73 HG23 ILE 73 15.298 1.116 5.339 595 HD11 ILE 73 HD11 ILE 73 11.793 4.699 3.065 596 HD12 ILE 73 HD12 ILE 73 11.064 3.711 4.336 597 HD13 ILE 73 HD13 ILE 73 12.435 4.770 4.716 598 H VAL 74 H VAL 74 13.539 0.991 7.695 599 HA VAL 74 HA VAL 74 14.889 -1.515 7.367 600 HB VAL 74 HB VAL 74 13.885 -0.070 9.897 601 HG11 VAL 74 HG11 VAL 74 14.113 -2.355 10.512 602 HG12 VAL 74 HG12 VAL 74 15.640 -2.540 9.619 603 HG13 VAL 74 HG13 VAL 74 15.570 -1.546 11.092 604 HG21 VAL 74 HG21 VAL 74 16.269 0.558 10.182 605 HG22 VAL 74 HG22 VAL 74 16.641 -0.181 8.605 606 HG23 VAL 74 HG23 VAL 74 15.546 1.227 8.722 607 H ASN 75 H ASN 75 11.616 -0.717 8.709 608 HA ASN 75 HA ASN 75 11.067 -3.271 9.694 609 HB2 ASN 75 HB2 ASN 75 9.591 -0.885 9.307 610 HB3 ASN 75 HB3 ASN 75 8.731 -2.098 8.396 611 HD21 ASN 75 HD21 ASN 75 9.771 -1.141 11.662 612 HD22 ASN 75 HD22 ASN 75 8.741 -2.316 12.442 613 H ILE 76 H ILE 76 10.546 -2.041 6.382 614 HA ILE 76 HA ILE 76 9.312 -4.385 5.320 615 HB ILE 76 HB ILE 76 10.852 -2.069 4.075 616 HG12 ILE 76 HG12 ILE 76 7.885 -2.752 4.371 617 HG13 ILE 76 HG13 ILE 76 8.711 -1.311 4.987 618 HG21 ILE 76 HG21 ILE 76 10.074 -2.818 1.866 619 HG22 ILE 76 HG22 ILE 76 11.114 -4.023 2.592 620 HG23 ILE 76 HG23 ILE 76 9.355 -4.276 2.598 621 HD11 ILE 76 HD11 ILE 76 7.469 -0.525 3.278 622 HD12 ILE 76 HD12 ILE 76 9.131 -0.566 2.704 623 HD13 ILE 76 HD13 ILE 76 7.981 -1.801 2.142 624 H LEU 77 H LEU 77 12.754 -3.527 5.867 625 HA LEU 77 HA LEU 77 13.824 -5.838 4.498 626 HB2 LEU 77 HB2 LEU 77 15.239 -3.855 5.075 627 HB3 LEU 77 HB3 LEU 77 15.041 -4.179 6.756 628 HG LEU 77 HG LEU 77 17.189 -4.823 5.769 629 HD11 LEU 77 HD11 LEU 77 16.318 -5.644 7.954 630 HD12 LEU 77 HD12 LEU 77 15.936 -7.182 7.147 631 HD13 LEU 77 HD13 LEU 77 17.600 -6.594 7.186 632 HD21 LEU 77 HD21 LEU 77 17.470 -7.002 4.690 633 HD22 LEU 77 HD22 LEU 77 15.717 -7.190 4.562 634 HD23 LEU 77 HD23 LEU 77 16.545 -5.874 3.687 635 H LYS 78 H LYS 78 12.933 -5.152 7.915 636 HA LYS 78 HA LYS 78 13.759 -7.620 8.987 637 HB2 LYS 78 HB2 LYS 78 11.255 -6.198 9.933 638 HB3 LYS 78 HB3 LYS 78 12.292 -7.310 10.823 639 HG2 LYS 78 HG2 LYS 78 14.162 -5.603 10.682 640 HG3 LYS 78 HG3 LYS 78 13.031 -4.542 9.855 641 HD2 LYS 78 HD2 LYS 78 12.539 -3.673 11.829 642 HD3 LYS 78 HD3 LYS 78 11.547 -5.092 12.095 643 HE2 LYS 78 HE2 LYS 78 14.473 -4.754 12.910 644 HE3 LYS 78 HE3 LYS 78 13.082 -4.568 13.983 645 HZ1 LYS 78 HZ1 LYS 78 13.948 -6.778 14.260 646 HZ2 LYS 78 HZ2 LYS 78 12.553 -6.938 13.460 647 HZ3 LYS 78 HZ3 LYS 78 14.000 -7.053 12.664 648 H SER 79 H SER 79 10.535 -6.777 7.596 649 HA SER 79 HA SER 79 9.299 -9.269 7.965 650 HB2 SER 79 HB2 SER 79 8.848 -7.419 5.604 651 HB3 SER 79 HB3 SER 79 7.699 -8.523 6.362 652 HG SER 79 HG SER 79 8.374 -7.021 8.336 653 H ILE 80 H ILE 80 10.952 -8.066 4.988 654 HA ILE 80 HA ILE 80 10.836 -10.398 3.469 655 HB ILE 80 HB ILE 80 12.767 -8.056 3.630 656 HG12 ILE 80 HG12 ILE 80 10.645 -8.884 1.603 657 HG13 ILE 80 HG13 ILE 80 10.415 -7.673 2.868 658 HG21 ILE 80 HG21 ILE 80 13.792 -8.692 1.495 659 HG22 ILE 80 HG22 ILE 80 14.081 -9.903 2.707 660 HG23 ILE 80 HG23 ILE 80 12.830 -10.176 1.455 661 HD11 ILE 80 HD11 ILE 80 12.275 -7.540 0.494 662 HD12 ILE 80 HD12 ILE 80 10.911 -6.466 0.873 663 HD13 ILE 80 HD13 ILE 80 12.381 -6.407 1.869 664 H SER 81 H SER 81 13.370 -9.414 5.777 665 HA SER 81 HA SER 81 15.172 -11.510 5.335 666 HB2 SER 81 HB2 SER 81 16.305 -10.564 7.164 667 HB3 SER 81 HB3 SER 81 15.240 -9.265 6.600 668 HG SER 81 HG SER 81 13.769 -9.760 8.205 669 H SER 82 H SER 82 12.393 -11.319 7.275 670 HA SER 82 HA SER 82 12.693 -13.911 8.637 671 HB2 SER 82 HB2 SER 82 11.421 -11.688 9.397 672 HB3 SER 82 HB3 SER 82 10.069 -12.402 8.520 673 HG SER 82 HG SER 82 11.566 -13.819 10.489 674 H SER 83 H SER 83 10.932 -12.682 5.773 675 HA SER 83 HA SER 83 9.425 -15.103 5.371 676 HB2 SER 83 HB2 SER 83 10.121 -12.713 3.608 677 HB3 SER 83 HB3 SER 83 9.127 -14.071 3.063 678 HG SER 83 HG SER 83 7.604 -13.570 4.620 679 H GLY 84 H GLY 84 12.730 -14.214 4.458 680 HA2 GLY 84 HA2 GLY 84 14.007 -16.273 3.626 681 HA3 GLY 84 HA3 GLY 84 12.671 -16.461 2.488 682 H GLY 85 H GLY 85 13.284 -13.046 2.790 683 HA2 GLY 85 HA2 GLY 85 14.682 -13.240 0.188 684 HA3 GLY 85 HA3 GLY 85 13.471 -12.060 0.683 685 H PHE 86 H PHE 86 15.340 -10.897 -0.256 686 HA PHE 86 HA PHE 86 16.998 -9.747 1.914 687 HB2 PHE 86 HB2 PHE 86 17.953 -11.076 -0.576 688 HB3 PHE 86 HB3 PHE 86 18.586 -9.457 -0.320 689 HD1 PHE 86 HD1 PHE 86 18.036 -12.641 1.660 690 HD2 PHE 86 HD2 PHE 86 20.576 -9.227 0.884 691 HE1 PHE 86 HE1 PHE 86 19.518 -13.289 3.538 692 HE2 PHE 86 HE2 PHE 86 22.003 -9.870 2.793 693 HZ PHE 86 HZ PHE 86 21.477 -11.892 4.126 694 H PHE 87 H PHE 87 17.572 -7.494 1.467 695 HA PHE 87 HA PHE 87 16.293 -6.191 -0.770 696 HB2 PHE 87 HB2 PHE 87 14.365 -6.004 0.427 697 HB3 PHE 87 HB3 PHE 87 15.161 -6.017 1.979 698 HD1 PHE 87 HD1 PHE 87 15.583 -3.675 -1.017 699 HD2 PHE 87 HD2 PHE 87 14.520 -4.153 3.128 700 HE1 PHE 87 HE1 PHE 87 15.321 -1.262 -0.785 701 HE2 PHE 87 HE2 PHE 87 14.345 -1.706 3.408 702 HZ PHE 87 HZ PHE 87 14.718 -0.222 1.407 703 H ALA 88 H ALA 88 17.400 -4.413 -1.336 704 HA ALA 88 HA ALA 88 19.570 -3.435 0.362 705 HB1 ALA 88 HB1 ALA 88 20.477 -5.377 -0.945 706 HB2 ALA 88 HB2 ALA 88 20.004 -4.561 -2.437 707 HB3 ALA 88 HB3 ALA 88 21.227 -3.823 -1.372 708 H LEU 89 H LEU 89 20.660 -1.520 -0.808 709 HA LEU 89 HA LEU 89 18.536 -0.004 -2.259 710 HB2 LEU 89 HB2 LEU 89 20.527 1.635 -0.852 711 HB3 LEU 89 HB3 LEU 89 18.815 1.829 -1.069 712 HG LEU 89 HG LEU 89 20.257 0.294 1.069 713 HD11 LEU 89 HD11 LEU 89 18.168 2.484 1.248 714 HD12 LEU 89 HD12 LEU 89 19.179 1.835 2.568 715 HD13 LEU 89 HD13 LEU 89 19.924 2.774 1.266 716 HD21 LEU 89 HD21 LEU 89 17.512 -0.188 0.142 717 HD22 LEU 89 HD22 LEU 89 18.638 -1.190 1.055 718 HD23 LEU 89 HD23 LEU 89 17.697 0.028 1.913 719 H VAL 90 H VAL 90 19.492 1.997 -3.443 720 HA VAL 90 HA VAL 90 22.010 1.333 -4.866 721 HB VAL 90 HB VAL 90 19.194 1.637 -6.029 722 HG11 VAL 90 HG11 VAL 90 20.704 2.766 -7.535 723 HG12 VAL 90 HG12 VAL 90 21.837 1.399 -7.455 724 HG13 VAL 90 HG13 VAL 90 20.246 1.232 -8.245 725 HG21 VAL 90 HG21 VAL 90 19.724 -0.651 -6.987 726 HG22 VAL 90 HG22 VAL 90 21.070 -0.720 -5.854 727 HG23 VAL 90 HG23 VAL 90 19.390 -0.572 -5.254 728 H SER 91 H SER 91 23.018 3.058 -5.655 729 HA SER 91 HA SER 91 23.775 5.200 -5.681 730 HB2 SER 91 HB2 SER 91 22.357 5.166 -7.702 731 HB3 SER 91 HB3 SER 91 20.993 5.771 -6.752 732 HG SER 91 HG SER 91 23.423 7.114 -7.421 733 HA PRO 92 HA PRO 92 21.615 6.280 -1.723 734 HB2 PRO 92 HB2 PRO 92 23.414 5.519 0.115 735 HB3 PRO 92 HB3 PRO 92 22.371 4.323 -0.705 736 HG2 PRO 92 HG2 PRO 92 25.276 5.001 -1.319 737 HG3 PRO 92 HG3 PRO 92 24.507 3.395 -1.232 738 HD2 PRO 92 HD2 PRO 92 24.914 4.826 -3.561 739 HD3 PRO 92 HD3 PRO 92 23.699 3.560 -3.379 740 H ASN 93 H ASN 93 21.783 8.373 -2.543 741 HA ASN 93 HA ASN 93 24.138 9.752 -3.080 742 HB2 ASN 93 HB2 ASN 93 22.883 11.798 -3.003 743 HB3 ASN 93 HB3 ASN 93 21.990 10.563 -3.837 744 HD21 ASN 93 HD21 ASN 93 21.225 13.131 -2.146 745 HD22 ASN 93 HD22 ASN 93 20.006 12.466 -1.035 746 H GLU 94 H GLU 94 25.098 11.500 -1.989 747 HA GLU 94 HA GLU 94 26.153 10.439 0.403 748 HB2 GLU 94 HB2 GLU 94 27.393 11.718 -1.248 749 HB3 GLU 94 HB3 GLU 94 26.540 13.206 -0.794 750 HG2 GLU 94 HG2 GLU 94 27.511 13.259 1.309 751 HG3 GLU 94 HG3 GLU 94 28.030 11.558 1.268 752 H LYS 95 H LYS 95 23.576 12.637 -0.048 753 HA LYS 95 HA LYS 95 23.458 13.817 2.551 754 HB2 LYS 95 HB2 LYS 95 22.228 14.265 0.056 755 HB3 LYS 95 HB3 LYS 95 20.923 13.598 1.026 756 HG2 LYS 95 HG2 LYS 95 22.627 15.992 1.749 757 HG3 LYS 95 HG3 LYS 95 21.001 16.062 1.079 758 HD2 LYS 95 HD2 LYS 95 21.736 14.860 3.765 759 HD3 LYS 95 HD3 LYS 95 21.045 16.452 3.486 760 HE2 LYS 95 HE2 LYS 95 19.252 14.746 2.294 761 HE3 LYS 95 HE3 LYS 95 19.859 13.687 3.601 762 HZ1 LYS 95 HZ1 LYS 95 19.448 15.841 5.019 763 HZ2 LYS 95 HZ2 LYS 95 18.479 16.320 3.772 764 HZ3 LYS 95 HZ3 LYS 95 18.157 14.949 4.612 765 H VAL 96 H VAL 96 21.949 10.672 1.133 766 HA VAL 96 HA VAL 96 20.653 10.404 3.642 767 HB VAL 96 HB VAL 96 20.063 8.298 2.719 768 HG11 VAL 96 HG11 VAL 96 18.596 10.167 2.363 769 HG12 VAL 96 HG12 VAL 96 19.368 10.479 0.784 770 HG13 VAL 96 HG13 VAL 96 18.444 8.995 1.039 771 HG21 VAL 96 HG21 VAL 96 21.874 7.598 1.334 772 HG22 VAL 96 HG22 VAL 96 20.320 7.458 0.515 773 HG23 VAL 96 HG23 VAL 96 21.379 8.786 0.130 774 H GLU 97 H GLU 97 23.606 9.301 1.989 775 HA GLU 97 HA GLU 97 24.178 7.107 3.653 776 HB2 GLU 97 HB2 GLU 97 25.590 8.805 1.713 777 HB3 GLU 97 HB3 GLU 97 26.656 8.196 2.985 778 HG2 GLU 97 HG2 GLU 97 24.687 6.359 1.637 779 HG3 GLU 97 HG3 GLU 97 26.185 6.784 0.810 780 H ARG 98 H ARG 98 24.611 10.571 4.194 781 HA ARG 98 HA ARG 98 26.150 10.298 6.483 782 HB2 ARG 98 HB2 ARG 98 26.055 12.571 6.654 783 HB3 ARG 98 HB3 ARG 98 25.571 12.326 4.984 784 HG2 ARG 98 HG2 ARG 98 24.064 13.879 5.693 785 HG3 ARG 98 HG3 ARG 98 23.199 12.328 5.842 786 HD2 ARG 98 HD2 ARG 98 22.983 12.538 8.112 787 HD3 ARG 98 HD3 ARG 98 24.656 13.060 8.299 788 HE ARG 98 HE ARG 98 22.649 14.960 7.210 789 HH11 ARG 98 HH11 ARG 98 24.765 14.075 10.012 790 HH12 ARG 98 HH12 ARG 98 24.550 15.663 10.703 791 HH21 ARG 98 HH21 ARG 98 22.719 16.969 8.057 792 HH22 ARG 98 HH22 ARG 98 23.385 17.279 9.670 793 H VAL 99 H VAL 99 22.704 9.843 6.103 794 HA VAL 99 HA VAL 99 22.243 10.005 9.015 795 HB VAL 99 HB VAL 99 20.863 11.348 7.384 796 HG11 VAL 99 HG11 VAL 99 19.527 8.796 6.646 797 HG12 VAL 99 HG12 VAL 99 18.909 10.437 6.372 798 HG13 VAL 99 HG13 VAL 99 20.423 9.974 5.621 799 HG21 VAL 99 HG21 VAL 99 20.142 10.704 9.769 800 HG22 VAL 99 HG22 VAL 99 18.781 10.939 8.662 801 HG23 VAL 99 HG23 VAL 99 19.288 9.293 9.062 802 H LEU 100 H LEU 100 22.314 7.893 6.213 803 HA LEU 100 HA LEU 100 21.084 5.605 7.295 804 HB2 LEU 100 HB2 LEU 100 23.191 5.917 5.132 805 HB3 LEU 100 HB3 LEU 100 22.387 4.440 5.481 806 HG LEU 100 HG LEU 100 21.650 6.474 3.646 807 HD11 LEU 100 HD11 LEU 100 20.157 3.965 4.379 808 HD12 LEU 100 HD12 LEU 100 20.059 4.874 2.842 809 HD13 LEU 100 HD13 LEU 100 21.565 4.076 3.307 810 HD21 LEU 100 HD21 LEU 100 19.121 6.596 4.073 811 HD22 LEU 100 HD22 LEU 100 19.490 6.293 5.780 812 HD23 LEU 100 HD23 LEU 100 20.107 7.725 4.919 813 H SER 101 H SER 101 24.260 6.996 8.035 814 HA SER 101 HA SER 101 25.269 4.441 9.137 815 HB2 SER 101 HB2 SER 101 26.144 7.311 8.808 816 HB3 SER 101 HB3 SER 101 26.781 6.436 10.204 817 HG SER 101 HG SER 101 26.935 5.424 7.533 818 H LEU 102 H LEU 102 24.230 7.635 10.150 819 HA LEU 102 HA LEU 102 24.361 7.455 12.918 820 HB2 LEU 102 HB2 LEU 102 22.785 9.240 11.004 821 HB3 LEU 102 HB3 LEU 102 22.963 9.512 12.713 822 HG LEU 102 HG LEU 102 24.443 10.861 11.081 823 HD11 LEU 102 HD11 LEU 102 25.204 9.727 13.774 824 HD12 LEU 102 HD12 LEU 102 25.979 11.149 13.019 825 HD13 LEU 102 HD13 LEU 102 24.260 11.209 13.483 826 HD21 LEU 102 HD21 LEU 102 26.081 8.486 11.946 827 HD22 LEU 102 HD22 LEU 102 25.679 8.901 10.260 828 HD23 LEU 102 HD23 LEU 102 26.750 9.959 11.183 829 H THR 103 H THR 103 22.011 6.016 11.015 830 HA THR 103 HA THR 103 20.098 5.836 13.289 831 HB THR 103 HB THR 103 19.637 7.432 11.295 832 HG1 THR 103 HG1 THR 103 17.731 5.559 12.184 833 HG21 THR 103 HG21 THR 103 18.881 6.680 9.296 834 HG22 THR 103 HG22 THR 103 20.172 5.545 9.600 835 HG23 THR 103 HG23 THR 103 18.495 5.030 9.892 836 H ASN 104 H ASN 104 22.350 4.145 11.813 837 HA ASN 104 HA ASN 104 22.804 2.117 11.055 838 HB2 ASN 104 HB2 ASN 104 20.757 1.312 13.149 839 HB3 ASN 104 HB3 ASN 104 21.866 0.209 12.338 840 HD21 ASN 104 HD21 ASN 104 21.627 2.680 14.876 841 HD22 ASN 104 HD22 ASN 104 23.303 2.520 15.358 842 H LEU 105 H LEU 105 21.837 2.881 8.976 843 HA LEU 105 HA LEU 105 19.445 1.273 8.252 844 HB2 LEU 105 HB2 LEU 105 19.692 3.929 7.880 845 HB3 LEU 105 HB3 LEU 105 20.648 3.429 6.517 846 HG LEU 105 HG LEU 105 18.457 3.867 5.741 847 HD11 LEU 105 HD11 LEU 105 18.456 0.846 6.034 848 HD12 LEU 105 HD12 LEU 105 17.729 1.801 4.741 849 HD13 LEU 105 HD13 LEU 105 19.498 1.700 4.880 850 HD21 LEU 105 HD21 LEU 105 16.433 2.846 6.708 851 HD22 LEU 105 HD22 LEU 105 17.441 2.133 7.986 852 HD23 LEU 105 HD23 LEU 105 17.300 3.883 7.847 853 H ASP 106 H ASP 106 22.572 2.420 6.784 854 HA ASP 106 HA ASP 106 22.912 0.229 4.987 855 HB2 ASP 106 HB2 ASP 106 24.176 2.447 5.056 856 HB3 ASP 106 HB3 ASP 106 25.051 1.836 6.450 857 H ARG 107 H ARG 107 23.494 0.593 8.434 858 HA ARG 107 HA ARG 107 25.257 -1.712 8.588 859 HB2 ARG 107 HB2 ARG 107 23.963 -0.320 10.951 860 HB3 ARG 107 HB3 ARG 107 25.485 -1.216 10.887 861 HG2 ARG 107 HG2 ARG 107 26.244 0.606 9.150 862 HG3 ARG 107 HG3 ARG 107 24.902 1.559 9.780 863 HD2 ARG 107 HD2 ARG 107 26.128 2.254 11.497 864 HD3 ARG 107 HD3 ARG 107 26.410 0.582 12.014 865 HE ARG 107 HE ARG 107 28.155 0.839 9.918 866 HH11 ARG 107 HH11 ARG 107 27.912 2.677 12.990 867 HH12 ARG 107 HH12 ARG 107 29.598 3.033 12.971 868 HH21 ARG 107 HH21 ARG 107 30.200 1.302 9.934 869 HH22 ARG 107 HH22 ARG 107 31.018 2.128 11.207 870 H ILE 108 H ILE 108 22.062 -1.607 7.959 871 HA ILE 108 HA ILE 108 21.539 -4.181 9.292 872 HB ILE 108 HB ILE 108 19.575 -1.899 8.817 873 HG12 ILE 108 HG12 ILE 108 21.148 -2.826 11.237 874 HG13 ILE 108 HG13 ILE 108 21.011 -1.222 10.577 875 HG21 ILE 108 HG21 ILE 108 17.971 -3.282 10.002 876 HG22 ILE 108 HG22 ILE 108 18.593 -4.188 8.624 877 HG23 ILE 108 HG23 ILE 108 19.202 -4.550 10.261 878 HD11 ILE 108 HD11 ILE 108 19.768 -1.243 12.605 879 HD12 ILE 108 HD12 ILE 108 18.591 -1.176 11.269 880 HD13 ILE 108 HD13 ILE 108 18.885 -2.705 12.142 881 H VAL 109 H VAL 109 20.789 -1.962 6.529 882 HA VAL 109 HA VAL 109 19.865 -4.263 4.924 883 HB VAL 109 HB VAL 109 19.521 -1.379 4.152 884 HG11 VAL 109 HG11 VAL 109 17.436 -2.203 3.116 885 HG12 VAL 109 HG12 VAL 109 18.887 -3.018 2.533 886 HG13 VAL 109 HG13 VAL 109 17.815 -3.835 3.694 887 HG21 VAL 109 HG21 VAL 109 17.627 -2.787 6.107 888 HG22 VAL 109 HG22 VAL 109 18.584 -1.345 6.447 889 HG23 VAL 109 HG23 VAL 109 17.268 -1.274 5.259 890 H LYS 110 H LYS 110 20.764 -4.467 2.784 891 HA LYS 110 HA LYS 110 23.543 -3.693 2.605 892 HB2 LYS 110 HB2 LYS 110 21.574 -5.230 0.931 893 HB3 LYS 110 HB3 LYS 110 23.115 -4.811 0.223 894 HG2 LYS 110 HG2 LYS 110 23.184 -6.078 2.924 895 HG3 LYS 110 HG3 LYS 110 22.684 -7.095 1.571 896 HD2 LYS 110 HD2 LYS 110 25.072 -7.323 1.971 897 HD3 LYS 110 HD3 LYS 110 24.741 -6.634 0.378 898 HE2 LYS 110 HE2 LYS 110 25.331 -4.392 1.096 899 HE3 LYS 110 HE3 LYS 110 25.263 -4.856 2.800 900 HZ1 LYS 110 HZ1 LYS 110 27.304 -5.835 0.918 901 HZ2 LYS 110 HZ2 LYS 110 27.462 -4.560 1.927 902 HZ3 LYS 110 HZ3 LYS 110 27.244 -6.063 2.574 903 H ILE 111 H ILE 111 24.458 -2.700 0.710 904 HA ILE 111 HA ILE 111 22.811 -0.716 -0.705 905 HB ILE 111 HB ILE 111 24.565 -0.163 1.566 906 HG12 ILE 111 HG12 ILE 111 23.556 2.284 0.451 907 HG13 ILE 111 HG13 ILE 111 22.338 1.047 0.235 908 HG21 ILE 111 HG21 ILE 111 25.897 1.712 0.742 909 HG22 ILE 111 HG22 ILE 111 26.420 0.192 0.045 910 HG23 ILE 111 HG23 ILE 111 25.456 1.311 -0.933 911 HD11 ILE 111 HD11 ILE 111 21.942 2.086 2.332 912 HD12 ILE 111 HD12 ILE 111 22.528 0.446 2.652 913 HD13 ILE 111 HD13 ILE 111 23.620 1.855 2.837 914 H TYR 112 H TYR 112 23.670 -0.212 -2.720 915 HA TYR 112 HA TYR 112 26.168 -1.378 -3.705 916 HB2 TYR 112 HB2 TYR 112 23.372 -1.809 -4.876 917 HB3 TYR 112 HB3 TYR 112 24.871 -2.170 -5.718 918 HD1 TYR 112 HD1 TYR 112 26.345 -3.947 -5.031 919 HD2 TYR 112 HD2 TYR 112 22.673 -3.230 -2.949 920 HE1 TYR 112 HE1 TYR 112 26.500 -6.219 -4.038 921 HE2 TYR 112 HE2 TYR 112 22.767 -5.547 -1.971 922 HH TYR 112 HH TYR 112 23.970 -7.582 -1.871 923 H ASP 113 H ASP 113 26.515 -0.397 -6.091 924 HA ASP 113 HA ASP 113 25.823 2.456 -5.843 925 HB2 ASP 113 HB2 ASP 113 27.891 0.949 -7.323 926 HB3 ASP 113 HB3 ASP 113 27.097 2.191 -8.294 927 H THR 114 H THR 114 25.296 -0.252 -8.081 928 HA THR 114 HA THR 114 23.092 1.278 -9.400 929 HB THR 114 HB THR 114 23.619 -0.041 -11.379 930 HG1 THR 114 HG1 THR 114 25.876 -0.999 -9.965 931 HG21 THR 114 HG21 THR 114 26.112 1.328 -10.288 932 HG22 THR 114 HG22 THR 114 25.803 0.941 -11.976 933 HG23 THR 114 HG23 THR 114 24.772 2.117 -11.138 934 H ILE 115 H ILE 115 21.557 -0.343 -10.554 935 HA ILE 115 HA ILE 115 20.484 -2.180 -8.564 936 HB ILE 115 HB ILE 115 19.819 -1.455 -11.423 937 HG12 ILE 115 HG12 ILE 115 19.014 -0.052 -9.531 938 HG13 ILE 115 HG13 ILE 115 17.741 -0.729 -10.521 939 HG21 ILE 115 HG21 ILE 115 19.472 -3.841 -11.493 940 HG22 ILE 115 HG22 ILE 115 18.704 -3.849 -9.901 941 HG23 ILE 115 HG23 ILE 115 17.878 -3.102 -11.297 942 HD11 ILE 115 HD11 ILE 115 17.467 -0.728 -7.947 943 HD12 ILE 115 HD12 ILE 115 16.968 -2.152 -8.885 944 HD13 ILE 115 HD13 ILE 115 18.482 -2.175 -7.980 945 H SER 116 H SER 116 22.660 -2.432 -11.456 946 HA SER 116 HA SER 116 22.140 -5.216 -11.693 947 HB2 SER 116 HB2 SER 116 22.980 -3.756 -13.457 948 HB3 SER 116 HB3 SER 116 24.566 -3.657 -12.623 949 HG SER 116 HG SER 116 24.986 -5.404 -13.707 950 H GLU 117 H GLU 117 24.636 -3.304 -9.910 951 HA GLU 117 HA GLU 117 26.319 -5.477 -9.261 952 HB2 GLU 117 HB2 GLU 117 25.585 -2.851 -7.981 953 HB3 GLU 117 HB3 GLU 117 26.714 -3.952 -7.179 954 HG2 GLU 117 HG2 GLU 117 28.377 -3.723 -8.791 955 HG3 GLU 117 HG3 GLU 117 27.261 -3.007 -9.989 956 H ALA 118 H ALA 118 23.100 -4.553 -8.196 957 HA ALA 118 HA ALA 118 23.333 -5.911 -5.598 958 HB1 ALA 118 HB1 ALA 118 20.904 -4.566 -6.917 959 HB2 ALA 118 HB2 ALA 118 21.132 -4.998 -5.209 960 HB3 ALA 118 HB3 ALA 118 22.102 -3.700 -5.958 961 H MET 119 H MET 119 21.509 -5.950 -8.655 962 HA MET 119 HA MET 119 19.771 -7.837 -8.065 963 HB2 MET 119 HB2 MET 119 20.237 -6.215 -10.225 964 HB3 MET 119 HB3 MET 119 20.910 -7.643 -10.895 965 HG2 MET 119 HG2 MET 119 18.334 -8.276 -9.654 966 HG3 MET 119 HG3 MET 119 18.164 -6.848 -10.656 967 HE1 MET 119 HE1 MET 119 18.403 -10.739 -10.596 968 HE2 MET 119 HE2 MET 119 16.850 -9.893 -10.805 969 HE3 MET 119 HE3 MET 119 17.498 -10.887 -12.120 970 H GLU 120 H GLU 120 22.977 -8.499 -9.195 971 HA GLU 120 HA GLU 120 22.461 -11.444 -9.328 972 HB2 GLU 120 HB2 GLU 120 24.309 -11.572 -10.733 973 HB3 GLU 120 HB3 GLU 120 23.421 -10.153 -11.293 974 HG2 GLU 120 HG2 GLU 120 24.983 -8.701 -9.969 975 HG3 GLU 120 HG3 GLU 120 25.874 -10.124 -9.452 976 H GLU 121 H GLU 121 23.439 -9.342 -7.042 977 HA GLU 121 HA GLU 121 25.473 -11.166 -5.924 978 HB2 GLU 121 HB2 GLU 121 25.912 -8.748 -6.732 979 HB3 GLU 121 HB3 GLU 121 25.055 -8.246 -5.273 980 HG2 GLU 121 HG2 GLU 121 27.412 -8.252 -4.749 981 HG3 GLU 121 HG3 GLU 121 26.610 -9.565 -3.891 982 H VAL 122 H VAL 122 22.698 -9.053 -5.007 983 HA VAL 122 HA VAL 122 22.289 -9.874 -2.314 984 HB VAL 122 HB VAL 122 20.165 -9.447 -4.454 985 HG11 VAL 122 HG11 VAL 122 19.090 -8.375 -2.528 986 HG12 VAL 122 HG12 VAL 122 19.545 -10.059 -2.217 987 HG13 VAL 122 HG13 VAL 122 20.546 -8.731 -1.551 988 HG21 VAL 122 HG21 VAL 122 22.237 -7.506 -4.009 989 HG22 VAL 122 HG22 VAL 122 20.702 -7.402 -4.875 990 HG23 VAL 122 HG23 VAL 122 20.818 -6.933 -3.162 991 H ARG 123 H ARG 123 21.824 -11.403 -5.384 992 HA ARG 123 HA ARG 123 20.604 -13.896 -4.568 993 HB2 ARG 123 HB2 ARG 123 22.519 -13.148 -6.789 994 HB3 ARG 123 HB3 ARG 123 22.028 -14.824 -6.558 995 HG2 ARG 123 HG2 ARG 123 19.619 -13.949 -6.621 996 HG3 ARG 123 HG3 ARG 123 20.297 -12.394 -7.121 997 HD2 ARG 123 HD2 ARG 123 21.258 -14.704 -8.744 998 HD3 ARG 123 HD3 ARG 123 19.500 -14.511 -8.782 999 HE ARG 123 HE ARG 123 20.435 -11.979 -9.226 1000 HH11 ARG 123 HH11 ARG 123 20.733 -15.118 -10.919 1001 HH12 ARG 123 HH12 ARG 123 20.949 -14.380 -12.468 1002 HH21 ARG 123 HH21 ARG 123 20.794 -11.055 -11.342 1003 HH22 ARG 123 HH22 ARG 123 21.067 -12.107 -12.683 1004 H ARG 124 H ARG 124 23.956 -12.783 -4.084 1005 HA ARG 124 HA ARG 124 24.464 -15.068 -2.354 1006 HB2 ARG 124 HB2 ARG 124 26.617 -13.837 -4.157 1007 HB3 ARG 124 HB3 ARG 124 26.672 -15.396 -3.340 1008 HG2 ARG 124 HG2 ARG 124 26.275 -16.220 -5.375 1009 HG3 ARG 124 HG3 ARG 124 24.596 -15.871 -4.973 1010 HD2 ARG 124 HD2 ARG 124 24.464 -14.062 -6.443 1011 HD3 ARG 124 HD3 ARG 124 26.178 -13.730 -6.311 1012 HE ARG 124 HE ARG 124 26.408 -14.822 -8.231 1013 HH11 ARG 124 HH11 ARG 124 23.691 -16.612 -6.600 1014 HH12 ARG 124 HH12 ARG 124 23.898 -17.957 -7.644 1015 HH21 ARG 124 HH21 ARG 124 26.331 -16.622 -9.749 1016 HH22 ARG 124 HH22 ARG 124 25.307 -17.962 -9.390 1017 H LYS 125 H LYS 125 23.825 -12.355 -1.666 1018 HA LYS 125 HA LYS 125 25.626 -12.202 0.605 1019 HB2 LYS 125 HB2 LYS 125 25.043 -10.052 -1.546 1020 HB3 LYS 125 HB3 LYS 125 25.483 -9.701 0.081 1021 HG2 LYS 125 HG2 LYS 125 27.501 -11.312 -0.272 1022 HG3 LYS 125 HG3 LYS 125 26.986 -11.388 -1.971 1023 HD2 LYS 125 HD2 LYS 125 28.064 -9.315 -2.396 1024 HD3 LYS 125 HD3 LYS 125 27.448 -8.621 -0.899 1025 HE2 LYS 125 HE2 LYS 125 29.807 -8.646 -0.733 1026 HE3 LYS 125 HE3 LYS 125 29.205 -9.912 0.344 1027 HZ1 LYS 125 HZ1 LYS 125 31.073 -10.693 -0.886 1028 HZ2 LYS 125 HZ2 LYS 125 29.782 -11.519 -1.461 1029 HZ3 LYS 125 HZ3 LYS 125 30.447 -10.267 -2.325 Start of MODEL 2 1 H1 MET 1 H1 MET 1 -1.682 6.025 15.221 2 HA MET 1 HA MET 1 -1.353 3.798 16.204 3 HB2 MET 1 HB2 MET 1 -1.755 5.306 18.834 4 HB3 MET 1 HB3 MET 1 -1.705 3.559 18.623 5 HG2 MET 1 HG2 MET 1 0.399 4.087 19.430 6 HG3 MET 1 HG3 MET 1 0.658 3.848 17.701 7 HE1 MET 1 HE1 MET 1 2.664 5.146 19.764 8 HE2 MET 1 HE2 MET 1 3.071 5.003 18.045 9 HE3 MET 1 HE3 MET 1 3.280 6.557 18.881 10 H GLY 2 H GLY 2 -3.250 2.678 15.933 11 HA2 GLY 2 HA2 GLY 2 -5.435 2.177 15.804 12 HA3 GLY 2 HA3 GLY 2 -5.419 2.745 17.464 13 H SER 3 H SER 3 -5.071 4.820 14.550 14 HA SER 3 HA SER 3 -7.349 6.447 15.173 15 HB2 SER 3 HB2 SER 3 -7.000 7.312 12.869 16 HB3 SER 3 HB3 SER 3 -5.507 7.276 13.805 17 HG SER 3 HG SER 3 -6.281 5.883 11.576 18 H ASP 4 H ASP 4 -9.033 6.619 13.158 19 HA ASP 4 HA ASP 4 -10.439 4.097 12.938 20 HB2 ASP 4 HB2 ASP 4 -11.995 5.260 11.598 21 HB3 ASP 4 HB3 ASP 4 -11.612 6.285 12.971 22 H LYS 5 H LYS 5 -11.052 3.438 10.672 23 HA LYS 5 HA LYS 5 -8.758 2.629 9.126 24 HB2 LYS 5 HB2 LYS 5 -11.090 1.486 9.456 25 HB3 LYS 5 HB3 LYS 5 -11.699 2.665 8.314 26 HG2 LYS 5 HG2 LYS 5 -11.358 0.752 7.064 27 HG3 LYS 5 HG3 LYS 5 -9.949 1.737 6.649 28 HD2 LYS 5 HD2 LYS 5 -8.521 0.435 8.087 29 HD3 LYS 5 HD3 LYS 5 -9.884 -0.408 8.826 30 HE2 LYS 5 HE2 LYS 5 -9.098 -0.656 5.897 31 HE3 LYS 5 HE3 LYS 5 -8.627 -1.795 7.164 32 HZ1 LYS 5 HZ1 LYS 5 -11.417 -1.215 6.393 33 HZ2 LYS 5 HZ2 LYS 5 -10.581 -2.534 5.938 34 HZ3 LYS 5 HZ3 LYS 5 -10.881 -2.353 7.517 35 H ILE 6 H ILE 6 -7.813 3.803 7.481 36 HA ILE 6 HA ILE 6 -8.947 6.461 6.883 37 HB ILE 6 HB ILE 6 -6.329 5.234 5.976 38 HG12 ILE 6 HG12 ILE 6 -6.238 5.260 8.384 39 HG13 ILE 6 HG13 ILE 6 -5.216 6.534 7.750 40 HG21 ILE 6 HG21 ILE 6 -6.979 7.119 4.575 41 HG22 ILE 6 HG22 ILE 6 -7.253 8.124 6.003 42 HG23 ILE 6 HG23 ILE 6 -5.619 7.582 5.604 43 HD11 ILE 6 HD11 ILE 6 -6.435 7.295 9.726 44 HD12 ILE 6 HD12 ILE 6 -6.954 8.225 8.310 45 HD13 ILE 6 HD13 ILE 6 -7.988 6.929 8.961 46 H HIS 7 H HIS 7 -7.644 3.747 4.973 47 HA HIS 7 HA HIS 7 -7.762 3.129 2.845 48 HB2 HIS 7 HB2 HIS 7 -9.998 2.358 3.446 49 HB3 HIS 7 HB3 HIS 7 -10.671 3.913 2.982 50 HD1 HIS 7 HD1 HIS 7 -8.128 2.954 0.405 51 HD2 HIS 7 HD2 HIS 7 -12.208 2.313 1.286 52 HE1 HIS 7 HE1 HIS 7 -9.193 2.277 -1.722 53 H HIS 8 H HIS 8 -6.373 4.386 1.755 54 HA HIS 8 HA HIS 8 -6.681 7.074 1.094 55 HB2 HIS 8 HB2 HIS 8 -4.577 5.742 1.096 56 HB3 HIS 8 HB3 HIS 8 -5.115 4.896 -0.347 57 HD1 HIS 8 HD1 HIS 8 -3.869 5.883 -2.399 58 HD2 HIS 8 HD2 HIS 8 -4.744 8.712 0.613 59 HE1 HIS 8 HE1 HIS 8 -2.999 8.155 -3.227 60 H HIS 9 H HIS 9 -6.748 7.944 -1.195 61 HA HIS 9 HA HIS 9 -9.413 7.333 -2.149 62 HB2 HIS 9 HB2 HIS 9 -7.343 9.461 -2.615 63 HB3 HIS 9 HB3 HIS 9 -8.675 9.318 -3.756 64 HD1 HIS 9 HD1 HIS 9 -10.656 10.815 -3.153 65 HD2 HIS 9 HD2 HIS 9 -8.433 9.515 0.189 66 HE1 HIS 9 HE1 HIS 9 -11.783 11.825 -1.088 67 H HIS 10 H HIS 10 -9.866 7.341 -4.539 68 HA HIS 10 HA HIS 10 -8.539 5.072 -5.711 69 HB2 HIS 10 HB2 HIS 10 -10.300 4.941 -7.084 70 HB3 HIS 10 HB3 HIS 10 -11.067 5.907 -5.855 71 HD1 HIS 10 HD1 HIS 10 -9.443 8.668 -7.462 72 HD2 HIS 10 HD2 HIS 10 -12.177 5.734 -8.797 73 HE1 HIS 10 HE1 HIS 10 -10.661 9.643 -9.471 74 H HIS 11 H HIS 11 -8.025 5.200 -8.134 75 HA HIS 11 HA HIS 11 -6.630 5.662 -9.732 76 HB2 HIS 11 HB2 HIS 11 -7.890 8.322 -9.346 77 HB3 HIS 11 HB3 HIS 11 -6.390 8.301 -10.256 78 HD1 HIS 11 HD1 HIS 11 -10.017 7.512 -10.782 79 HD2 HIS 11 HD2 HIS 11 -6.239 6.445 -12.343 80 HE1 HIS 11 HE1 HIS 11 -10.445 6.477 -13.061 81 H HIS 12 H HIS 12 -4.687 5.000 -9.393 82 HA HIS 12 HA HIS 12 -2.667 6.906 -8.562 83 HB2 HIS 12 HB2 HIS 12 -1.708 4.724 -7.246 84 HB3 HIS 12 HB3 HIS 12 -2.549 6.065 -6.490 85 HD1 HIS 12 HD1 HIS 12 -2.799 2.309 -6.772 86 HD2 HIS 12 HD2 HIS 12 -5.267 5.650 -5.926 87 HE1 HIS 12 HE1 HIS 12 -4.851 1.425 -5.666 88 H MET 13 H MET 13 -0.518 5.908 -9.053 89 HA MET 13 HA MET 13 -0.554 4.100 -11.409 90 HB2 MET 13 HB2 MET 13 1.130 6.614 -10.957 91 HB3 MET 13 HB3 MET 13 1.384 5.431 -12.242 92 HG2 MET 13 HG2 MET 13 0.248 7.062 -13.346 93 HG3 MET 13 HG3 MET 13 -1.044 5.930 -12.948 94 HE1 MET 13 HE1 MET 13 -1.242 8.934 -14.003 95 HE2 MET 13 HE2 MET 13 -2.665 7.897 -13.753 96 HE3 MET 13 HE3 MET 13 -2.622 9.539 -13.069 97 H PHE 14 H PHE 14 1.921 3.251 -11.623 98 HA PHE 14 HA PHE 14 2.606 2.218 -8.961 99 HB2 PHE 14 HB2 PHE 14 3.119 1.296 -11.801 100 HB3 PHE 14 HB3 PHE 14 3.638 0.467 -10.365 101 HD1 PHE 14 HD1 PHE 14 1.278 0.443 -8.557 102 HD2 PHE 14 HD2 PHE 14 1.430 0.078 -12.857 103 HE1 PHE 14 HE1 PHE 14 -0.790 -0.877 -8.528 104 HE2 PHE 14 HE2 PHE 14 -0.702 -1.201 -12.804 105 HZ PHE 14 HZ PHE 14 -1.798 -1.696 -10.635 106 HA PRO 15 HA PRO 15 6.323 4.915 -9.718 107 HB2 PRO 15 HB2 PRO 15 6.830 5.660 -7.187 108 HB3 PRO 15 HB3 PRO 15 5.433 6.320 -8.067 109 HG2 PRO 15 HG2 PRO 15 5.403 3.938 -6.155 110 HG3 PRO 15 HG3 PRO 15 4.378 5.411 -6.085 111 HD2 PRO 15 HD2 PRO 15 3.508 3.163 -7.298 112 HD3 PRO 15 HD3 PRO 15 3.168 4.790 -7.971 113 H TYR 16 H TYR 16 6.545 2.251 -10.099 114 HA TYR 16 HA TYR 16 9.047 1.529 -8.956 115 HB2 TYR 16 HB2 TYR 16 8.367 -0.518 -7.785 116 HB3 TYR 16 HB3 TYR 16 7.546 0.836 -7.085 117 HD1 TYR 16 HD1 TYR 16 7.111 -2.169 -9.251 118 HD2 TYR 16 HD2 TYR 16 5.164 1.108 -7.236 119 HE1 TYR 16 HE1 TYR 16 4.914 -3.295 -9.542 120 HE2 TYR 16 HE2 TYR 16 3.010 -0.106 -7.332 121 HH TYR 16 HH TYR 16 2.067 -2.180 -7.755 122 H LYS 17 H LYS 17 9.701 -0.612 -9.951 123 HA LYS 17 HA LYS 17 7.988 -1.563 -12.154 124 HB2 LYS 17 HB2 LYS 17 9.713 -1.900 -13.736 125 HB3 LYS 17 HB3 LYS 17 9.788 -0.199 -13.270 126 HG2 LYS 17 HG2 LYS 17 11.786 -0.509 -12.050 127 HG3 LYS 17 HG3 LYS 17 11.547 -2.260 -11.939 128 HD2 LYS 17 HD2 LYS 17 13.234 -2.231 -13.400 129 HD3 LYS 17 HD3 LYS 17 11.866 -2.236 -14.536 130 HE2 LYS 17 HE2 LYS 17 12.049 0.314 -14.523 131 HE3 LYS 17 HE3 LYS 17 13.534 0.123 -13.560 132 HZ1 LYS 17 HZ1 LYS 17 13.964 0.401 -15.929 133 HZ2 LYS 17 HZ2 LYS 17 14.522 -1.040 -15.403 134 HZ3 LYS 17 HZ3 LYS 17 13.126 -0.948 -16.294 135 H ILE 18 H ILE 18 9.049 -3.813 -12.884 136 HA ILE 18 HA ILE 18 10.429 -5.107 -10.640 137 HB ILE 18 HB ILE 18 8.141 -6.381 -12.191 138 HG12 ILE 18 HG12 ILE 18 8.276 -5.439 -9.287 139 HG13 ILE 18 HG13 ILE 18 7.245 -4.786 -10.559 140 HG21 ILE 18 HG21 ILE 18 9.967 -7.989 -11.534 141 HG22 ILE 18 HG22 ILE 18 9.718 -7.522 -9.836 142 HG23 ILE 18 HG23 ILE 18 8.444 -8.330 -10.767 143 HD11 ILE 18 HD11 ILE 18 5.839 -6.114 -9.217 144 HD12 ILE 18 HD12 ILE 18 6.104 -7.023 -10.705 145 HD13 ILE 18 HD13 ILE 18 6.963 -7.477 -9.210 146 H VAL 19 H VAL 19 12.026 -6.647 -11.472 147 HA VAL 19 HA VAL 19 12.548 -6.480 -14.361 148 HB VAL 19 HB VAL 19 14.893 -6.860 -13.685 149 HG11 VAL 19 HG11 VAL 19 15.344 -4.549 -12.845 150 HG12 VAL 19 HG12 VAL 19 14.218 -4.599 -14.203 151 HG13 VAL 19 HG13 VAL 19 13.598 -4.361 -12.569 152 HG21 VAL 19 HG21 VAL 19 14.469 -7.798 -11.371 153 HG22 VAL 19 HG22 VAL 19 15.731 -6.563 -11.487 154 HG23 VAL 19 HG23 VAL 19 14.152 -6.119 -10.864 155 H ASP 20 H ASP 20 14.524 -8.684 -13.825 156 HA ASP 20 HA ASP 20 13.646 -11.037 -14.419 157 HB2 ASP 20 HB2 ASP 20 15.912 -10.395 -13.722 158 HB3 ASP 20 HB3 ASP 20 15.433 -10.362 -12.047 159 H ASP 21 H ASP 21 13.991 -10.594 -10.959 160 HA ASP 21 HA ASP 21 11.263 -11.509 -10.261 161 HB2 ASP 21 HB2 ASP 21 13.820 -12.623 -9.058 162 HB3 ASP 21 HB3 ASP 21 12.175 -12.994 -8.545 163 H VAL 22 H VAL 22 13.071 -8.911 -10.166 164 HA VAL 22 HA VAL 22 13.052 -8.535 -7.211 165 HB VAL 22 HB VAL 22 15.165 -7.252 -9.027 166 HG11 VAL 22 HG11 VAL 22 16.171 -6.977 -6.661 167 HG12 VAL 22 HG12 VAL 22 14.934 -5.845 -7.251 168 HG13 VAL 22 HG13 VAL 22 14.517 -7.115 -6.109 169 HG21 VAL 22 HG21 VAL 22 15.636 -9.577 -9.078 170 HG22 VAL 22 HG22 VAL 22 16.717 -8.856 -7.885 171 HG23 VAL 22 HG23 VAL 22 15.289 -9.783 -7.356 172 H VAL 23 H VAL 23 12.146 -6.692 -6.433 173 HA VAL 23 HA VAL 23 10.549 -5.099 -8.334 174 HB VAL 23 HB VAL 23 10.584 -5.188 -5.287 175 HG11 VAL 23 HG11 VAL 23 8.514 -4.069 -7.220 176 HG12 VAL 23 HG12 VAL 23 8.407 -4.121 -5.447 177 HG13 VAL 23 HG13 VAL 23 9.623 -3.106 -6.221 178 HG21 VAL 23 HG21 VAL 23 9.940 -7.410 -6.161 179 HG22 VAL 23 HG22 VAL 23 8.578 -6.577 -5.446 180 HG23 VAL 23 HG23 VAL 23 8.725 -6.651 -7.212 181 H ILE 24 H ILE 24 11.063 -2.949 -8.786 182 HA ILE 24 HA ILE 24 13.423 -1.748 -7.390 183 HB ILE 24 HB ILE 24 12.292 -1.133 -10.114 184 HG12 ILE 24 HG12 ILE 24 13.363 -2.888 -10.971 185 HG13 ILE 24 HG13 ILE 24 14.827 -1.947 -10.745 186 HG21 ILE 24 HG21 ILE 24 14.200 0.267 -10.534 187 HG22 ILE 24 HG22 ILE 24 13.452 0.765 -9.017 188 HG23 ILE 24 HG23 ILE 24 14.931 -0.200 -8.981 189 HD11 ILE 24 HD11 ILE 24 13.836 -4.323 -9.273 190 HD12 ILE 24 HD12 ILE 24 15.425 -3.959 -9.963 191 HD13 ILE 24 HD13 ILE 24 14.900 -3.155 -8.451 192 H LEU 25 H LEU 25 12.299 -0.770 -5.680 193 HA LEU 25 HA LEU 25 9.794 0.713 -6.130 194 HB2 LEU 25 HB2 LEU 25 11.616 0.667 -3.700 195 HB3 LEU 25 HB3 LEU 25 9.958 1.247 -3.763 196 HG LEU 25 HG LEU 25 10.777 -1.656 -4.280 197 HD11 LEU 25 HD11 LEU 25 11.290 -1.025 -1.998 198 HD12 LEU 25 HD12 LEU 25 9.616 -0.450 -1.748 199 HD13 LEU 25 HD13 LEU 25 9.944 -2.176 -2.091 200 HD21 LEU 25 HD21 LEU 25 8.571 -1.009 -5.291 201 HD22 LEU 25 HD22 LEU 25 8.437 -2.205 -3.999 202 HD23 LEU 25 HD23 LEU 25 8.031 -0.522 -3.669 203 H MET 26 H MET 26 9.764 2.996 -6.550 204 HA MET 26 HA MET 26 12.386 4.402 -6.629 205 HB2 MET 26 HB2 MET 26 10.299 4.123 -8.785 206 HB3 MET 26 HB3 MET 26 11.521 5.412 -8.777 207 HG2 MET 26 HG2 MET 26 13.323 3.775 -8.700 208 HG3 MET 26 HG3 MET 26 12.167 2.450 -8.614 209 HE1 MET 26 HE1 MET 26 11.074 1.298 -10.537 210 HE2 MET 26 HE2 MET 26 10.040 2.740 -10.615 211 HE3 MET 26 HE3 MET 26 10.730 2.060 -12.102 212 HA PRO 27 HA PRO 27 9.332 6.533 -4.021 213 HB2 PRO 27 HB2 PRO 27 11.042 7.633 -2.201 214 HB3 PRO 27 HB3 PRO 27 10.806 5.870 -2.334 215 HG2 PRO 27 HG2 PRO 27 12.988 7.568 -3.605 216 HG3 PRO 27 HG3 PRO 27 13.188 6.120 -2.559 217 HD2 PRO 27 HD2 PRO 27 13.160 5.951 -5.281 218 HD3 PRO 27 HD3 PRO 27 12.425 4.675 -4.262 219 H ASN 28 H ASN 28 9.670 7.737 -6.437 220 HA ASN 28 HA ASN 28 11.004 10.104 -6.774 221 HB2 ASN 28 HB2 ASN 28 9.325 10.521 -8.648 222 HB3 ASN 28 HB3 ASN 28 10.257 9.039 -8.677 223 HD21 ASN 28 HD21 ASN 28 7.187 9.889 -6.980 224 HD22 ASN 28 HD22 ASN 28 6.325 8.454 -7.466 225 H LYS 29 H LYS 29 10.993 11.469 -5.105 226 HA LYS 29 HA LYS 29 10.314 12.889 -3.515 227 HB2 LYS 29 HB2 LYS 29 9.928 15.015 -4.299 228 HB3 LYS 29 HB3 LYS 29 10.873 14.216 -5.528 229 HG2 LYS 29 HG2 LYS 29 7.975 14.044 -6.119 230 HG3 LYS 29 HG3 LYS 29 8.475 15.696 -5.802 231 HD2 LYS 29 HD2 LYS 29 8.613 15.340 -8.145 232 HD3 LYS 29 HD3 LYS 29 10.275 15.451 -7.549 233 HE2 LYS 29 HE2 LYS 29 10.578 13.078 -7.643 234 HE3 LYS 29 HE3 LYS 29 8.838 12.789 -7.823 235 HZ1 LYS 29 HZ1 LYS 29 8.890 13.574 -10.004 236 HZ2 LYS 29 HZ2 LYS 29 10.431 14.154 -9.886 237 HZ3 LYS 29 HZ3 LYS 29 10.191 12.547 -9.859 238 H GLU 30 H GLU 30 8.427 10.783 -3.461 239 HA GLU 30 HA GLU 30 5.842 12.226 -2.986 240 HB2 GLU 30 HB2 GLU 30 4.700 10.322 -3.827 241 HB3 GLU 30 HB3 GLU 30 5.968 10.751 -4.973 242 HG2 GLU 30 HG2 GLU 30 7.423 8.968 -3.936 243 HG3 GLU 30 HG3 GLU 30 6.084 8.500 -2.902 244 H LEU 31 H LEU 31 8.146 11.156 -1.101 245 HA LEU 31 HA LEU 31 6.823 9.222 0.650 246 HB2 LEU 31 HB2 LEU 31 9.479 10.620 0.504 247 HB3 LEU 31 HB3 LEU 31 8.980 10.000 2.061 248 HG LEU 31 HG LEU 31 9.045 7.806 1.500 249 HD11 LEU 31 HD11 LEU 31 7.722 7.700 -0.573 250 HD12 LEU 31 HD12 LEU 31 9.046 8.452 -1.477 251 HD13 LEU 31 HD13 LEU 31 9.232 6.833 -0.729 252 HD21 LEU 31 HD21 LEU 31 11.183 9.040 -0.293 253 HD22 LEU 31 HD22 LEU 31 11.270 8.965 1.470 254 HD23 LEU 31 HD23 LEU 31 11.251 7.460 0.530 255 H ASN 32 H ASN 32 4.990 10.744 0.593 256 HA ASN 32 HA ASN 32 4.995 13.236 1.929 257 HB2 ASN 32 HB2 ASN 32 2.619 13.255 1.308 258 HB3 ASN 32 HB3 ASN 32 3.629 12.736 -0.020 259 HD21 ASN 32 HD21 ASN 32 3.101 10.757 -1.049 260 HD22 ASN 32 HD22 ASN 32 1.768 9.787 -0.410 261 H ILE 33 H ILE 33 5.715 11.055 3.766 262 HA ILE 33 HA ILE 33 5.457 10.368 5.897 263 HB ILE 33 HB ILE 33 3.885 12.881 5.888 264 HG12 ILE 33 HG12 ILE 33 6.294 12.664 6.132 265 HG13 ILE 33 HG13 ILE 33 5.466 13.565 7.413 266 HG21 ILE 33 HG21 ILE 33 2.257 11.751 7.175 267 HG22 ILE 33 HG22 ILE 33 3.488 10.921 8.144 268 HG23 ILE 33 HG23 ILE 33 3.272 12.694 8.266 269 HD11 ILE 33 HD11 ILE 33 7.092 12.315 8.521 270 HD12 ILE 33 HD12 ILE 33 5.601 11.372 8.774 271 HD13 ILE 33 HD13 ILE 33 6.795 10.885 7.534 272 H GLU 34 H GLU 34 2.009 10.859 4.702 273 HA GLU 34 HA GLU 34 1.380 8.346 6.072 274 HB2 GLU 34 HB2 GLU 34 -0.302 10.074 4.240 275 HB3 GLU 34 HB3 GLU 34 -0.831 8.528 4.939 276 HG2 GLU 34 HG2 GLU 34 -0.022 9.532 7.234 277 HG3 GLU 34 HG3 GLU 34 -0.056 11.070 6.406 278 H ASN 35 H ASN 35 2.604 9.214 3.010 279 HA ASN 35 HA ASN 35 2.430 6.817 1.519 280 HB2 ASN 35 HB2 ASN 35 3.730 8.615 0.611 281 HB3 ASN 35 HB3 ASN 35 4.803 8.640 2.020 282 HD21 ASN 35 HD21 ASN 35 3.902 6.800 -0.902 283 HD22 ASN 35 HD22 ASN 35 5.407 5.913 -1.027 284 H ALA 36 H ALA 36 4.582 7.536 4.336 285 HA ALA 36 HA ALA 36 5.959 5.035 4.233 286 HB1 ALA 36 HB1 ALA 36 6.742 7.122 5.340 287 HB2 ALA 36 HB2 ALA 36 5.549 6.857 6.626 288 HB3 ALA 36 HB3 ALA 36 6.836 5.672 6.363 289 H HIS 37 H HIS 37 3.031 6.208 5.822 290 HA HIS 37 HA HIS 37 2.690 4.058 7.658 291 HB2 HIS 37 HB2 HIS 37 1.458 6.466 7.300 292 HB3 HIS 37 HB3 HIS 37 0.225 5.412 6.623 293 HD1 HIS 37 HD1 HIS 37 -0.152 3.130 8.590 294 HD2 HIS 37 HD2 HIS 37 1.123 6.979 9.748 295 HE1 HIS 37 HE1 HIS 37 -0.574 3.313 11.096 296 H LEU 38 H LEU 38 1.198 4.583 4.315 297 HA LEU 38 HA LEU 38 0.164 1.862 4.485 298 HB2 LEU 38 HB2 LEU 38 -1.235 2.320 2.907 299 HB3 LEU 38 HB3 LEU 38 -0.969 3.929 3.489 300 HG LEU 38 HG LEU 38 -1.209 4.007 1.209 301 HD11 LEU 38 HD11 LEU 38 0.603 5.442 2.093 302 HD12 LEU 38 HD12 LEU 38 1.775 4.255 1.453 303 HD13 LEU 38 HD13 LEU 38 0.687 5.120 0.360 304 HD21 LEU 38 HD21 LEU 38 -0.228 2.701 -0.470 305 HD22 LEU 38 HD22 LEU 38 1.109 2.178 0.563 306 HD23 LEU 38 HD23 LEU 38 -0.518 1.532 0.835 307 H PHE 39 H PHE 39 3.121 3.240 3.386 308 HA PHE 39 HA PHE 39 4.023 1.796 1.365 309 HB2 PHE 39 HB2 PHE 39 5.256 3.350 3.191 310 HB3 PHE 39 HB3 PHE 39 5.895 1.842 3.719 311 HD1 PHE 39 HD1 PHE 39 5.465 3.957 0.592 312 HD2 PHE 39 HD2 PHE 39 7.934 1.165 2.760 313 HE1 PHE 39 HE1 PHE 39 7.337 4.406 -0.938 314 HE2 PHE 39 HE2 PHE 39 9.731 1.455 1.080 315 HZ PHE 39 HZ PHE 39 9.464 3.138 -0.739 316 H LYS 40 H LYS 40 4.048 0.579 4.716 317 HA LYS 40 HA LYS 40 5.088 -2.006 4.120 318 HB2 LYS 40 HB2 LYS 40 5.080 -1.005 6.362 319 HB3 LYS 40 HB3 LYS 40 3.324 -1.116 6.458 320 HG2 LYS 40 HG2 LYS 40 4.785 -3.667 5.826 321 HG3 LYS 40 HG3 LYS 40 5.099 -2.982 7.410 322 HD2 LYS 40 HD2 LYS 40 2.734 -3.005 7.991 323 HD3 LYS 40 HD3 LYS 40 2.299 -3.599 6.370 324 HE2 LYS 40 HE2 LYS 40 3.512 -5.652 6.710 325 HE3 LYS 40 HE3 LYS 40 4.192 -5.081 8.243 326 HZ1 LYS 40 HZ1 LYS 40 2.010 -5.167 9.198 327 HZ2 LYS 40 HZ2 LYS 40 1.314 -5.608 7.770 328 HZ3 LYS 40 HZ3 LYS 40 2.376 -6.607 8.556 329 H LYS 41 H LYS 41 1.660 -0.932 4.380 330 HA LYS 41 HA LYS 41 0.561 -3.601 4.066 331 HB2 LYS 41 HB2 LYS 41 -0.438 -0.915 4.499 332 HB3 LYS 41 HB3 LYS 41 -1.181 -1.461 3.035 333 HG2 LYS 41 HG2 LYS 41 -1.339 -3.509 5.194 334 HG3 LYS 41 HG3 LYS 41 -2.010 -1.946 5.649 335 HD2 LYS 41 HD2 LYS 41 -3.408 -1.956 3.588 336 HD3 LYS 41 HD3 LYS 41 -2.909 -3.615 3.265 337 HE2 LYS 41 HE2 LYS 41 -3.941 -3.055 6.036 338 HE3 LYS 41 HE3 LYS 41 -5.091 -2.749 4.746 339 HZ1 LYS 41 HZ1 LYS 41 -4.742 -5.036 3.970 340 HZ2 LYS 41 HZ2 LYS 41 -3.817 -5.377 5.252 341 HZ3 LYS 41 HZ3 LYS 41 -5.390 -4.959 5.451 342 H TRP 42 H TRP 42 1.239 -0.934 1.764 343 HA TRP 42 HA TRP 42 0.344 -2.310 -0.562 344 HB2 TRP 42 HB2 TRP 42 0.576 -0.010 -0.773 345 HB3 TRP 42 HB3 TRP 42 2.150 0.022 0.018 346 HD1 TRP 42 HD1 TRP 42 0.882 -1.627 -3.304 347 HE1 TRP 42 HE1 TRP 42 2.528 -1.137 -5.119 348 HE3 TRP 42 HE3 TRP 42 4.216 1.068 -0.546 349 HZ2 TRP 42 HZ2 TRP 42 5.298 0.029 -5.260 350 HZ3 TRP 42 HZ3 TRP 42 6.312 1.830 -1.487 351 HH2 TRP 42 HH2 TRP 42 6.863 1.366 -3.940 352 H VAL 43 H VAL 43 3.870 -1.795 0.393 353 HA VAL 43 HA VAL 43 4.799 -3.592 -1.445 354 HB VAL 43 HB VAL 43 5.940 -2.888 1.283 355 HG11 VAL 43 HG11 VAL 43 7.429 -4.282 -0.986 356 HG12 VAL 43 HG12 VAL 43 8.176 -3.605 0.443 357 HG13 VAL 43 HG13 VAL 43 7.070 -4.971 0.603 358 HG21 VAL 43 HG21 VAL 43 5.735 -0.993 -0.267 359 HG22 VAL 43 HG22 VAL 43 7.430 -1.396 -0.047 360 HG23 VAL 43 HG23 VAL 43 6.587 -1.890 -1.532 361 H PHE 44 H PHE 44 3.328 -4.490 1.697 362 HA PHE 44 HA PHE 44 4.091 -7.191 1.683 363 HB2 PHE 44 HB2 PHE 44 1.978 -5.549 3.011 364 HB3 PHE 44 HB3 PHE 44 1.627 -7.214 2.860 365 HD1 PHE 44 HD1 PHE 44 4.789 -5.336 3.608 366 HD2 PHE 44 HD2 PHE 44 2.103 -8.479 4.807 367 HE1 PHE 44 HE1 PHE 44 6.302 -5.894 5.505 368 HE2 PHE 44 HE2 PHE 44 3.610 -9.047 6.676 369 HZ PHE 44 HZ PHE 44 5.713 -7.750 7.032 370 H ASP 45 H ASP 45 0.993 -5.833 0.724 371 HA ASP 45 HA ASP 45 0.053 -8.309 -0.438 372 HB2 ASP 45 HB2 ASP 45 -1.017 -5.483 -0.397 373 HB3 ASP 45 HB3 ASP 45 -1.751 -6.684 -1.462 374 H GLU 46 H GLU 46 1.642 -5.540 -1.825 375 HA GLU 46 HA GLU 46 1.022 -6.142 -4.571 376 HB2 GLU 46 HB2 GLU 46 1.543 -3.903 -3.436 377 HB3 GLU 46 HB3 GLU 46 3.226 -4.416 -3.376 378 HG2 GLU 46 HG2 GLU 46 3.229 -3.139 -5.239 379 HG3 GLU 46 HG3 GLU 46 2.899 -4.682 -6.007 380 H PHE 47 H PHE 47 3.660 -7.069 -2.348 381 HA PHE 47 HA PHE 47 4.976 -8.510 -4.599 382 HB2 PHE 47 HB2 PHE 47 6.534 -6.872 -2.588 383 HB3 PHE 47 HB3 PHE 47 7.120 -7.669 -4.034 384 HD1 PHE 47 HD1 PHE 47 5.965 -6.777 -6.350 385 HD2 PHE 47 HD2 PHE 47 6.181 -4.618 -2.647 386 HE1 PHE 47 HE1 PHE 47 5.670 -4.630 -7.564 387 HE2 PHE 47 HE2 PHE 47 5.869 -2.466 -3.858 388 HZ PHE 47 HZ PHE 47 5.637 -2.478 -6.317 389 H LEU 48 H LEU 48 5.344 -7.942 -1.055 390 HA LEU 48 HA LEU 48 6.778 -10.334 -0.630 391 HB2 LEU 48 HB2 LEU 48 5.016 -8.889 1.386 392 HB3 LEU 48 HB3 LEU 48 6.291 -10.043 1.764 393 HG LEU 48 HG LEU 48 6.635 -7.263 0.586 394 HD11 LEU 48 HD11 LEU 48 6.324 -7.341 2.988 395 HD12 LEU 48 HD12 LEU 48 7.650 -8.482 3.146 396 HD13 LEU 48 HD13 LEU 48 7.994 -6.844 2.576 397 HD21 LEU 48 HD21 LEU 48 8.778 -9.383 1.030 398 HD22 LEU 48 HD22 LEU 48 8.269 -8.734 -0.538 399 HD23 LEU 48 HD23 LEU 48 9.080 -7.677 0.619 400 H ASN 49 H ASN 49 3.356 -9.768 0.191 401 HA ASN 49 HA ASN 49 2.672 -12.490 0.764 402 HB2 ASN 49 HB2 ASN 49 0.938 -10.194 -0.232 403 HB3 ASN 49 HB3 ASN 49 0.336 -11.727 0.378 404 HD21 ASN 49 HD21 ASN 49 -0.556 -9.271 1.601 405 HD22 ASN 49 HD22 ASN 49 0.079 -9.401 3.238 406 H LYS 50 H LYS 50 2.809 -10.556 -2.225 407 HA LYS 50 HA LYS 50 1.421 -12.291 -3.953 408 HB2 LYS 50 HB2 LYS 50 2.948 -9.898 -4.227 409 HB3 LYS 50 HB3 LYS 50 3.741 -11.072 -5.248 410 HG2 LYS 50 HG2 LYS 50 1.022 -11.386 -5.910 411 HG3 LYS 50 HG3 LYS 50 1.212 -9.651 -5.589 412 HD2 LYS 50 HD2 LYS 50 3.190 -9.647 -7.123 413 HD3 LYS 50 HD3 LYS 50 2.756 -11.299 -7.615 414 HE2 LYS 50 HE2 LYS 50 1.031 -8.785 -7.863 415 HE3 LYS 50 HE3 LYS 50 1.945 -9.521 -9.172 416 HZ1 LYS 50 HZ1 LYS 50 0.512 -11.453 -9.056 417 HZ2 LYS 50 HZ2 LYS 50 -0.331 -10.814 -7.790 418 HZ3 LYS 50 HZ3 LYS 50 -0.356 -10.094 -9.252 419 H GLY 51 H GLY 51 4.737 -12.413 -2.712 420 HA2 GLY 51 HA2 GLY 51 5.606 -14.738 -2.476 421 HA3 GLY 51 HA3 GLY 51 5.205 -14.970 -4.167 422 H TYR 52 H TYR 52 6.419 -11.797 -3.582 423 HA TYR 52 HA TYR 52 9.007 -12.456 -4.817 424 HB2 TYR 52 HB2 TYR 52 7.718 -9.865 -3.874 425 HB3 TYR 52 HB3 TYR 52 9.376 -9.945 -4.429 426 HD1 TYR 52 HD1 TYR 52 9.982 -10.327 -6.701 427 HD2 TYR 52 HD2 TYR 52 5.838 -10.297 -5.553 428 HE1 TYR 52 HE1 TYR 52 9.347 -10.343 -9.075 429 HE2 TYR 52 HE2 TYR 52 5.160 -10.231 -7.910 430 HH TYR 52 HH TYR 52 7.622 -10.550 -10.565 431 H ASN 53 H ASN 53 10.992 -11.881 -3.838 432 HA ASN 53 HA ASN 53 11.149 -11.482 -0.905 433 HB2 ASN 53 HB2 ASN 53 11.699 -13.998 -2.288 434 HB3 ASN 53 HB3 ASN 53 13.176 -13.397 -1.578 435 HD21 ASN 53 HD21 ASN 53 12.719 -15.629 -0.390 436 HD22 ASN 53 HD22 ASN 53 11.676 -15.542 1.001 437 H LYS 54 H LYS 54 11.863 -9.964 -3.624 438 HA LYS 54 HA LYS 54 14.508 -9.093 -2.689 439 HB2 LYS 54 HB2 LYS 54 13.991 -10.357 -5.373 440 HB3 LYS 54 HB3 LYS 54 15.145 -9.050 -5.207 441 HG2 LYS 54 HG2 LYS 54 16.742 -10.280 -4.357 442 HG3 LYS 54 HG3 LYS 54 15.714 -10.959 -3.110 443 HD2 LYS 54 HD2 LYS 54 15.837 -11.981 -5.986 444 HD3 LYS 54 HD3 LYS 54 16.728 -12.667 -4.613 445 HE2 LYS 54 HE2 LYS 54 14.512 -12.963 -3.414 446 HE3 LYS 54 HE3 LYS 54 13.718 -12.422 -4.896 447 HZ1 LYS 54 HZ1 LYS 54 14.764 -14.345 -6.037 448 HZ2 LYS 54 HZ2 LYS 54 15.377 -14.855 -4.600 449 HZ3 LYS 54 HZ3 LYS 54 13.758 -14.810 -4.839 450 H ILE 55 H ILE 55 14.294 -7.029 -2.412 451 HA ILE 55 HA ILE 55 12.511 -5.283 -4.097 452 HB ILE 55 HB ILE 55 12.807 -5.559 -1.094 453 HG12 ILE 55 HG12 ILE 55 10.323 -5.247 -1.178 454 HG13 ILE 55 HG13 ILE 55 10.377 -5.220 -2.935 455 HG21 ILE 55 HG21 ILE 55 13.221 -3.203 -1.553 456 HG22 ILE 55 HG22 ILE 55 11.880 -3.165 -2.697 457 HG23 ILE 55 HG23 ILE 55 11.584 -3.382 -0.941 458 HD11 ILE 55 HD11 ILE 55 9.560 -7.321 -1.797 459 HD12 ILE 55 HD12 ILE 55 10.760 -7.539 -3.051 460 HD13 ILE 55 HD13 ILE 55 11.256 -7.637 -1.343 461 H PHE 56 H PHE 56 13.552 -3.265 -4.563 462 HA PHE 56 HA PHE 56 16.123 -2.681 -3.265 463 HB2 PHE 56 HB2 PHE 56 15.434 -2.433 -6.217 464 HB3 PHE 56 HB3 PHE 56 16.770 -1.573 -5.534 465 HD1 PHE 56 HD1 PHE 56 17.723 -3.927 -3.592 466 HD2 PHE 56 HD2 PHE 56 16.771 -3.702 -7.798 467 HE1 PHE 56 HE1 PHE 56 19.151 -5.867 -4.053 468 HE2 PHE 56 HE2 PHE 56 18.012 -5.753 -8.215 469 HZ PHE 56 HZ PHE 56 19.296 -6.824 -6.334 470 H LEU 57 H LEU 57 16.539 -0.289 -3.059 471 HA LEU 57 HA LEU 57 14.152 1.392 -3.723 472 HB2 LEU 57 HB2 LEU 57 14.482 0.914 -1.244 473 HB3 LEU 57 HB3 LEU 57 16.058 1.697 -1.371 474 HG LEU 57 HG LEU 57 14.863 3.805 -2.109 475 HD11 LEU 57 HD11 LEU 57 12.724 2.839 -2.880 476 HD12 LEU 57 HD12 LEU 57 12.392 2.222 -1.245 477 HD13 LEU 57 HD13 LEU 57 12.433 3.967 -1.555 478 HD21 LEU 57 HD21 LEU 57 14.127 4.402 0.163 479 HD22 LEU 57 HD22 LEU 57 14.104 2.679 0.622 480 HD23 LEU 57 HD23 LEU 57 15.629 3.494 0.226 481 H VAL 58 H VAL 58 14.743 2.960 -5.294 482 HA VAL 58 HA VAL 58 17.617 3.587 -5.714 483 HB VAL 58 HB VAL 58 15.142 4.668 -7.146 484 HG11 VAL 58 HG11 VAL 58 16.980 6.230 -7.418 485 HG12 VAL 58 HG12 VAL 58 18.119 4.920 -7.802 486 HG13 VAL 58 HG13 VAL 58 16.804 5.355 -8.916 487 HG21 VAL 58 HG21 VAL 58 15.879 3.245 -9.048 488 HG22 VAL 58 HG22 VAL 58 17.029 2.418 -7.952 489 HG23 VAL 58 HG23 VAL 58 15.267 2.344 -7.684 490 H LEU 59 H LEU 59 18.501 5.538 -4.925 491 HA LEU 59 HA LEU 59 16.629 7.292 -3.389 492 HB2 LEU 59 HB2 LEU 59 19.613 7.157 -3.009 493 HB3 LEU 59 HB3 LEU 59 18.395 7.902 -2.011 494 HG LEU 59 HG LEU 59 19.373 5.092 -2.108 495 HD11 LEU 59 HD11 LEU 59 19.768 6.856 -0.348 496 HD12 LEU 59 HD12 LEU 59 18.061 6.682 0.122 497 HD13 LEU 59 HD13 LEU 59 19.157 5.300 0.273 498 HD21 LEU 59 HD21 LEU 59 16.445 5.648 -1.506 499 HD22 LEU 59 HD22 LEU 59 17.163 4.383 -2.542 500 HD23 LEU 59 HD23 LEU 59 17.363 4.283 -0.820 501 H SER 60 H SER 60 17.802 7.378 -6.404 502 HA SER 60 HA SER 60 19.060 9.962 -6.513 503 HB2 SER 60 HB2 SER 60 17.738 8.142 -8.577 504 HB3 SER 60 HB3 SER 60 18.619 9.606 -9.003 505 HG SER 60 HG SER 60 19.801 7.525 -8.974 506 H ASP 61 H ASP 61 15.655 8.897 -6.743 507 HA ASP 61 HA ASP 61 14.828 11.500 -7.857 508 HB2 ASP 61 HB2 ASP 61 14.080 9.074 -8.517 509 HB3 ASP 61 HB3 ASP 61 12.973 9.233 -7.197 510 H VAL 62 H VAL 62 15.976 11.431 -5.261 511 HA VAL 62 HA VAL 62 14.139 12.790 -3.569 512 HB VAL 62 HB VAL 62 13.475 10.403 -3.208 513 HG11 VAL 62 HG11 VAL 62 16.311 9.875 -2.344 514 HG12 VAL 62 HG12 VAL 62 14.919 8.775 -2.138 515 HG13 VAL 62 HG13 VAL 62 15.451 9.217 -3.756 516 HG21 VAL 62 HG21 VAL 62 13.306 11.942 -1.298 517 HG22 VAL 62 HG22 VAL 62 13.573 10.264 -0.819 518 HG23 VAL 62 HG23 VAL 62 14.914 11.421 -0.746 519 H GLU 63 H GLU 63 15.504 13.377 -1.580 520 HA GLU 63 HA GLU 63 18.447 13.276 -2.033 521 HB2 GLU 63 HB2 GLU 63 17.854 15.490 -2.700 522 HB3 GLU 63 HB3 GLU 63 16.763 15.716 -1.325 523 HG2 GLU 63 HG2 GLU 63 18.610 15.795 0.255 524 HG3 GLU 63 HG3 GLU 63 19.743 15.201 -0.941 525 H SER 64 H SER 64 15.660 13.836 0.207 526 HA SER 64 HA SER 64 17.096 12.324 2.279 527 HB2 SER 64 HB2 SER 64 16.643 14.177 3.899 528 HB3 SER 64 HB3 SER 64 17.772 14.578 2.617 529 HG SER 64 HG SER 64 16.359 16.245 3.012 530 H ILE 65 H ILE 65 15.539 12.014 4.244 531 HA ILE 65 HA ILE 65 12.752 11.675 3.364 532 HB ILE 65 HB ILE 65 14.171 9.658 2.891 533 HG12 ILE 65 HG12 ILE 65 12.341 9.038 5.182 534 HG13 ILE 65 HG13 ILE 65 11.714 9.568 3.618 535 HG21 ILE 65 HG21 ILE 65 15.834 9.969 4.658 536 HG22 ILE 65 HG22 ILE 65 14.632 9.594 5.901 537 HG23 ILE 65 HG23 ILE 65 15.136 8.351 4.736 538 HD11 ILE 65 HD11 ILE 65 13.037 7.657 2.534 539 HD12 ILE 65 HD12 ILE 65 13.311 7.028 4.175 540 HD13 ILE 65 HD13 ILE 65 11.665 7.166 3.519 541 H ASP 66 H ASP 66 11.279 11.384 5.262 542 HA ASP 66 HA ASP 66 12.078 13.026 7.521 543 HB2 ASP 66 HB2 ASP 66 9.603 11.322 7.017 544 HB3 ASP 66 HB3 ASP 66 9.866 12.266 8.478 545 H SER 67 H SER 67 12.186 12.335 9.673 546 HA SER 67 HA SER 67 13.084 9.593 10.231 547 HB2 SER 67 HB2 SER 67 12.970 12.217 11.724 548 HB3 SER 67 HB3 SER 67 13.119 10.699 12.618 549 HG SER 67 HG SER 67 14.943 10.213 11.577 550 H PHE 68 H PHE 68 10.779 9.355 9.090 551 HA PHE 68 HA PHE 68 9.254 8.049 11.211 552 HB2 PHE 68 HB2 PHE 68 7.789 9.957 10.382 553 HB3 PHE 68 HB3 PHE 68 8.069 9.452 8.758 554 HD1 PHE 68 HD1 PHE 68 7.437 6.905 11.423 555 HD2 PHE 68 HD2 PHE 68 5.716 9.247 8.224 556 HE1 PHE 68 HE1 PHE 68 5.431 5.490 11.455 557 HE2 PHE 68 HE2 PHE 68 3.697 7.913 8.318 558 HZ PHE 68 HZ PHE 68 3.533 5.955 9.906 559 H SER 69 H SER 69 9.227 8.445 7.676 560 HA SER 69 HA SER 69 8.923 5.910 6.854 561 HB2 SER 69 HB2 SER 69 10.487 7.866 5.219 562 HB3 SER 69 HB3 SER 69 9.100 6.849 4.780 563 HG SER 69 HG SER 69 8.916 9.368 5.161 564 H LEU 70 H LEU 70 12.007 7.621 7.367 565 HA LEU 70 HA LEU 70 13.912 5.814 6.457 566 HB2 LEU 70 HB2 LEU 70 14.294 8.075 7.509 567 HB3 LEU 70 HB3 LEU 70 13.666 7.477 9.028 568 HG LEU 70 HG LEU 70 15.708 5.944 9.172 569 HD11 LEU 70 HD11 LEU 70 16.717 7.855 7.009 570 HD12 LEU 70 HD12 LEU 70 17.706 6.713 7.925 571 HD13 LEU 70 HD13 LEU 70 16.459 6.109 6.805 572 HD21 LEU 70 HD21 LEU 70 17.116 7.802 10.015 573 HD22 LEU 70 HD22 LEU 70 16.102 8.974 9.149 574 HD23 LEU 70 HD23 LEU 70 15.428 8.015 10.486 575 H GLY 71 H GLY 71 11.920 5.501 9.393 576 HA2 GLY 71 HA2 GLY 71 13.442 3.171 10.347 577 HA3 GLY 71 HA3 GLY 71 11.984 3.865 11.067 578 H VAL 72 H VAL 72 10.581 3.825 8.375 579 HA VAL 72 HA VAL 72 9.370 1.182 8.738 580 HB VAL 72 HB VAL 72 8.862 3.224 6.492 581 HG11 VAL 72 HG11 VAL 72 6.649 2.122 6.371 582 HG12 VAL 72 HG12 VAL 72 7.938 0.964 6.059 583 HG13 VAL 72 HG13 VAL 72 7.130 0.985 7.644 584 HG21 VAL 72 HG21 VAL 72 8.453 4.403 8.579 585 HG22 VAL 72 HG22 VAL 72 6.907 3.978 7.849 586 HG23 VAL 72 HG23 VAL 72 7.513 3.038 9.216 587 H ILE 73 H ILE 73 11.595 2.801 6.435 588 HA ILE 73 HA ILE 73 11.805 0.745 4.510 589 HB ILE 73 HB ILE 73 13.776 2.811 5.556 590 HG12 ILE 73 HG12 ILE 73 11.915 3.824 4.403 591 HG13 ILE 73 HG13 ILE 73 13.333 3.941 3.398 592 HG21 ILE 73 HG21 ILE 73 15.109 2.427 3.498 593 HG22 ILE 73 HG22 ILE 73 15.195 1.104 4.663 594 HG23 ILE 73 HG23 ILE 73 14.174 0.933 3.220 595 HD11 ILE 73 HD11 ILE 73 12.431 1.945 2.068 596 HD12 ILE 73 HD12 ILE 73 10.947 2.095 3.034 597 HD13 ILE 73 HD13 ILE 73 11.463 3.428 1.997 598 H VAL 74 H VAL 74 13.613 1.048 7.626 599 HA VAL 74 HA VAL 74 14.930 -1.507 7.318 600 HB VAL 74 HB VAL 74 14.280 0.272 9.671 601 HG11 VAL 74 HG11 VAL 74 14.084 -1.911 10.705 602 HG12 VAL 74 HG12 VAL 74 15.529 -2.502 9.855 603 HG13 VAL 74 HG13 VAL 74 15.660 -1.247 11.118 604 HG21 VAL 74 HG21 VAL 74 16.121 0.821 8.143 605 HG22 VAL 74 HG22 VAL 74 16.715 0.448 9.770 606 HG23 VAL 74 HG23 VAL 74 16.882 -0.751 8.464 607 H ASN 75 H ASN 75 11.510 -0.768 8.501 608 HA ASN 75 HA ASN 75 11.111 -3.305 9.612 609 HB2 ASN 75 HB2 ASN 75 9.552 -0.902 8.744 610 HB3 ASN 75 HB3 ASN 75 8.693 -2.379 8.753 611 HD21 ASN 75 HD21 ASN 75 8.710 -3.662 10.929 612 HD22 ASN 75 HD22 ASN 75 8.876 -2.571 12.319 613 H ILE 76 H ILE 76 11.023 -2.158 6.229 614 HA ILE 76 HA ILE 76 9.694 -4.547 5.237 615 HB ILE 76 HB ILE 76 11.429 -2.472 3.819 616 HG12 ILE 76 HG12 ILE 76 8.490 -2.728 4.518 617 HG13 ILE 76 HG13 ILE 76 9.560 -1.374 4.750 618 HG21 ILE 76 HG21 ILE 76 10.423 -3.341 1.733 619 HG22 ILE 76 HG22 ILE 76 11.384 -4.566 2.537 620 HG23 ILE 76 HG23 ILE 76 9.619 -4.634 2.658 621 HD11 ILE 76 HD11 ILE 76 7.857 -0.937 3.093 622 HD12 ILE 76 HD12 ILE 76 9.493 -0.822 2.382 623 HD13 ILE 76 HD13 ILE 76 8.447 -2.235 2.080 624 H LEU 77 H LEU 77 13.028 -3.713 6.155 625 HA LEU 77 HA LEU 77 14.215 -5.980 4.747 626 HB2 LEU 77 HB2 LEU 77 15.451 -3.854 5.284 627 HB3 LEU 77 HB3 LEU 77 15.342 -4.224 6.985 628 HG LEU 77 HG LEU 77 17.510 -4.672 5.873 629 HD11 LEU 77 HD11 LEU 77 16.424 -7.174 7.172 630 HD12 LEU 77 HD12 LEU 77 18.082 -6.578 7.134 631 HD13 LEU 77 HD13 LEU 77 16.869 -5.681 8.038 632 HD21 LEU 77 HD21 LEU 77 16.184 -7.125 4.657 633 HD22 LEU 77 HD22 LEU 77 16.670 -5.660 3.768 634 HD23 LEU 77 HD23 LEU 77 17.890 -6.655 4.546 635 H LYS 78 H LYS 78 13.062 -5.147 8.005 636 HA LYS 78 HA LYS 78 13.665 -7.563 9.349 637 HB2 LYS 78 HB2 LYS 78 11.275 -5.688 9.673 638 HB3 LYS 78 HB3 LYS 78 11.633 -7.027 10.755 639 HG2 LYS 78 HG2 LYS 78 13.893 -6.057 11.120 640 HG3 LYS 78 HG3 LYS 78 13.421 -4.640 10.166 641 HD2 LYS 78 HD2 LYS 78 12.218 -3.746 11.891 642 HD3 LYS 78 HD3 LYS 78 11.483 -5.288 12.347 643 HE2 LYS 78 HE2 LYS 78 14.378 -4.577 12.936 644 HE3 LYS 78 HE3 LYS 78 13.066 -4.233 14.065 645 HZ1 LYS 78 HZ1 LYS 78 13.344 -6.998 13.108 646 HZ2 LYS 78 HZ2 LYS 78 14.413 -6.426 14.216 647 HZ3 LYS 78 HZ3 LYS 78 12.812 -6.383 14.558 648 H SER 79 H SER 79 10.766 -6.786 7.377 649 HA SER 79 HA SER 79 9.496 -9.311 7.745 650 HB2 SER 79 HB2 SER 79 8.466 -7.241 6.724 651 HB3 SER 79 HB3 SER 79 9.355 -7.595 5.230 652 HG SER 79 HG SER 79 8.220 -9.504 5.016 653 H ILE 80 H ILE 80 11.568 -8.186 5.023 654 HA ILE 80 HA ILE 80 11.545 -10.619 3.669 655 HB ILE 80 HB ILE 80 13.347 -8.176 3.657 656 HG12 ILE 80 HG12 ILE 80 11.196 -9.202 1.726 657 HG13 ILE 80 HG13 ILE 80 10.912 -7.992 2.975 658 HG21 ILE 80 HG21 ILE 80 14.280 -8.883 1.510 659 HG22 ILE 80 HG22 ILE 80 14.697 -10.024 2.771 660 HG23 ILE 80 HG23 ILE 80 13.394 -10.415 1.609 661 HD11 ILE 80 HD11 ILE 80 11.213 -6.800 0.962 662 HD12 ILE 80 HD12 ILE 80 12.703 -6.566 1.900 663 HD13 ILE 80 HD13 ILE 80 12.669 -7.719 0.536 664 H SER 81 H SER 81 13.890 -9.468 6.085 665 HA SER 81 HA SER 81 15.743 -11.632 5.992 666 HB2 SER 81 HB2 SER 81 16.184 -9.481 7.052 667 HB3 SER 81 HB3 SER 81 14.846 -9.704 8.184 668 HG SER 81 HG SER 81 16.992 -11.557 8.113 669 H SER 82 H SER 82 12.625 -11.201 7.722 670 HA SER 82 HA SER 82 12.922 -13.634 9.275 671 HB2 SER 82 HB2 SER 82 10.396 -12.064 8.638 672 HB3 SER 82 HB3 SER 82 10.637 -13.229 9.950 673 HG SER 82 HG SER 82 11.792 -10.669 9.580 674 H SER 83 H SER 83 11.449 -12.760 6.141 675 HA SER 83 HA SER 83 10.165 -15.272 5.703 676 HB2 SER 83 HB2 SER 83 11.009 -13.045 3.771 677 HB3 SER 83 HB3 SER 83 9.987 -14.436 3.370 678 HG SER 83 HG SER 83 8.661 -13.695 5.280 679 H GLY 84 H GLY 84 13.294 -13.944 4.452 680 HA2 GLY 84 HA2 GLY 84 15.001 -15.879 4.162 681 HA3 GLY 84 HA3 GLY 84 13.722 -16.569 3.140 682 H GLY 85 H GLY 85 14.182 -13.028 2.943 683 HA2 GLY 85 HA2 GLY 85 15.183 -13.478 0.165 684 HA3 GLY 85 HA3 GLY 85 13.955 -12.300 0.644 685 H PHE 86 H PHE 86 15.500 -10.857 -0.478 686 HA PHE 86 HA PHE 86 17.596 -9.760 1.324 687 HB2 PHE 86 HB2 PHE 86 17.939 -10.792 -1.482 688 HB3 PHE 86 HB3 PHE 86 18.800 -9.332 -1.060 689 HD1 PHE 86 HD1 PHE 86 18.400 -12.921 -0.241 690 HD2 PHE 86 HD2 PHE 86 20.720 -9.331 0.491 691 HE1 PHE 86 HE1 PHE 86 20.136 -14.263 0.907 692 HE2 PHE 86 HE2 PHE 86 22.378 -10.688 1.709 693 HZ PHE 86 HZ PHE 86 22.122 -13.139 1.885 694 H PHE 87 H PHE 87 17.995 -7.451 0.982 695 HA PHE 87 HA PHE 87 16.461 -6.068 -1.003 696 HB2 PHE 87 HB2 PHE 87 14.634 -6.068 0.419 697 HB3 PHE 87 HB3 PHE 87 15.603 -6.062 1.871 698 HD1 PHE 87 HD1 PHE 87 15.595 -3.604 -1.039 699 HD2 PHE 87 HD2 PHE 87 14.795 -4.277 3.150 700 HE1 PHE 87 HE1 PHE 87 15.275 -1.206 -0.719 701 HE2 PHE 87 HE2 PHE 87 14.467 -1.845 3.460 702 HZ PHE 87 HZ PHE 87 14.745 -0.292 1.517 703 H ALA 88 H ALA 88 17.398 -4.050 -1.438 704 HA ALA 88 HA ALA 88 19.547 -3.075 0.255 705 HB1 ALA 88 HB1 ALA 88 20.506 -4.848 -1.328 706 HB2 ALA 88 HB2 ALA 88 20.086 -3.751 -2.662 707 HB3 ALA 88 HB3 ALA 88 21.226 -3.228 -1.398 708 H LEU 89 H LEU 89 20.516 -1.023 -0.853 709 HA LEU 89 HA LEU 89 18.343 0.428 -2.284 710 HB2 LEU 89 HB2 LEU 89 20.318 2.059 -0.810 711 HB3 LEU 89 HB3 LEU 89 18.630 2.330 -1.144 712 HG LEU 89 HG LEU 89 19.912 0.765 1.050 713 HD11 LEU 89 HD11 LEU 89 19.591 3.235 1.295 714 HD12 LEU 89 HD12 LEU 89 17.838 3.002 1.125 715 HD13 LEU 89 HD13 LEU 89 18.716 2.322 2.524 716 HD21 LEU 89 HD21 LEU 89 17.159 0.310 0.134 717 HD22 LEU 89 HD22 LEU 89 18.345 -0.742 0.946 718 HD23 LEU 89 HD23 LEU 89 17.446 0.421 1.904 719 H VAL 90 H VAL 90 19.222 2.290 -3.579 720 HA VAL 90 HA VAL 90 21.705 1.530 -4.995 721 HB VAL 90 HB VAL 90 18.840 1.696 -6.028 722 HG11 VAL 90 HG11 VAL 90 21.443 1.624 -7.568 723 HG12 VAL 90 HG12 VAL 90 19.854 1.209 -8.272 724 HG13 VAL 90 HG13 VAL 90 20.149 2.839 -7.670 725 HG21 VAL 90 HG21 VAL 90 20.909 -0.537 -5.979 726 HG22 VAL 90 HG22 VAL 90 19.363 -0.493 -5.105 727 HG23 VAL 90 HG23 VAL 90 19.383 -0.611 -6.858 728 H SER 91 H SER 91 22.808 3.241 -5.704 729 HA SER 91 HA SER 91 23.575 5.305 -5.878 730 HB2 SER 91 HB2 SER 91 21.992 5.203 -7.794 731 HB3 SER 91 HB3 SER 91 20.773 6.008 -6.801 732 HG SER 91 HG SER 91 21.757 7.821 -7.042 733 HA PRO 92 HA PRO 92 21.526 6.661 -1.826 734 HB2 PRO 92 HB2 PRO 92 23.291 5.785 0.025 735 HB3 PRO 92 HB3 PRO 92 22.063 4.698 -0.703 736 HG2 PRO 92 HG2 PRO 92 24.997 4.978 -1.481 737 HG3 PRO 92 HG3 PRO 92 24.067 3.485 -1.231 738 HD2 PRO 92 HD2 PRO 92 24.461 4.586 -3.699 739 HD3 PRO 92 HD3 PRO 92 23.008 3.610 -3.235 740 H ASN 93 H ASN 93 21.873 8.834 -2.035 741 HA ASN 93 HA ASN 93 24.475 9.936 -2.589 742 HB2 ASN 93 HB2 ASN 93 23.393 12.105 -2.325 743 HB3 ASN 93 HB3 ASN 93 22.453 11.076 -3.352 744 HD21 ASN 93 HD21 ASN 93 21.441 13.472 -1.814 745 HD22 ASN 93 HD22 ASN 93 20.215 12.754 -0.753 746 H GLU 94 H GLU 94 25.314 11.733 -1.048 747 HA GLU 94 HA GLU 94 26.149 10.211 1.208 748 HB2 GLU 94 HB2 GLU 94 27.644 11.675 -0.054 749 HB3 GLU 94 HB3 GLU 94 26.807 13.108 0.594 750 HG2 GLU 94 HG2 GLU 94 27.351 12.459 2.853 751 HG3 GLU 94 HG3 GLU 94 28.016 10.904 2.325 752 H LYS 95 H LYS 95 23.672 12.568 0.829 753 HA LYS 95 HA LYS 95 23.383 13.537 3.515 754 HB2 LYS 95 HB2 LYS 95 22.439 14.907 1.860 755 HB3 LYS 95 HB3 LYS 95 21.958 13.555 0.872 756 HG2 LYS 95 HG2 LYS 95 20.010 14.612 1.477 757 HG3 LYS 95 HG3 LYS 95 20.057 13.074 2.322 758 HD2 LYS 95 HD2 LYS 95 21.217 15.045 4.013 759 HD3 LYS 95 HD3 LYS 95 19.752 15.774 3.367 760 HE2 LYS 95 HE2 LYS 95 18.439 14.400 4.620 761 HE3 LYS 95 HE3 LYS 95 19.430 12.986 4.171 762 HZ1 LYS 95 HZ1 LYS 95 20.980 13.640 5.845 763 HZ2 LYS 95 HZ2 LYS 95 20.079 15.012 6.183 764 HZ3 LYS 95 HZ3 LYS 95 19.465 13.538 6.559 765 H VAL 96 H VAL 96 22.388 10.660 1.781 766 HA VAL 96 HA VAL 96 20.849 9.610 4.066 767 HB VAL 96 HB VAL 96 21.535 8.766 1.199 768 HG11 VAL 96 HG11 VAL 96 21.010 6.632 1.346 769 HG12 VAL 96 HG12 VAL 96 21.420 6.752 3.008 770 HG13 VAL 96 HG13 VAL 96 19.706 6.892 2.529 771 HG21 VAL 96 HG21 VAL 96 19.105 8.803 0.867 772 HG22 VAL 96 HG22 VAL 96 18.868 9.312 2.550 773 HG23 VAL 96 HG23 VAL 96 19.708 10.368 1.418 774 H GLU 97 H GLU 97 24.067 8.948 2.370 775 HA GLU 97 HA GLU 97 24.647 6.733 4.034 776 HB2 GLU 97 HB2 GLU 97 26.321 8.769 2.574 777 HB3 GLU 97 HB3 GLU 97 27.108 7.662 3.652 778 HG2 GLU 97 HG2 GLU 97 25.249 6.669 1.449 779 HG3 GLU 97 HG3 GLU 97 26.966 6.994 1.173 780 H ARG 98 H ARG 98 24.909 10.228 4.637 781 HA ARG 98 HA ARG 98 26.355 9.940 6.997 782 HB2 ARG 98 HB2 ARG 98 26.240 12.185 7.290 783 HB3 ARG 98 HB3 ARG 98 25.880 12.039 5.582 784 HG2 ARG 98 HG2 ARG 98 24.266 13.533 6.179 785 HG3 ARG 98 HG3 ARG 98 23.419 11.998 6.381 786 HD2 ARG 98 HD2 ARG 98 24.358 12.198 8.883 787 HD3 ARG 98 HD3 ARG 98 24.517 13.904 8.462 788 HE ARG 98 HE ARG 98 21.901 12.757 7.891 789 HH11 ARG 98 HH11 ARG 98 23.842 14.200 10.480 790 HH12 ARG 98 HH12 ARG 98 22.515 14.715 11.424 791 HH21 ARG 98 HH21 ARG 98 20.017 13.446 9.183 792 HH22 ARG 98 HH22 ARG 98 20.294 14.190 10.680 793 H VAL 99 H VAL 99 22.852 9.574 6.481 794 HA VAL 99 HA VAL 99 22.443 9.933 9.389 795 HB VAL 99 HB VAL 99 21.046 11.176 7.601 796 HG11 VAL 99 HG11 VAL 99 19.484 8.758 7.174 797 HG12 VAL 99 HG12 VAL 99 19.352 10.372 6.458 798 HG13 VAL 99 HG13 VAL 99 20.758 9.393 6.081 799 HG21 VAL 99 HG21 VAL 99 19.462 9.302 9.470 800 HG22 VAL 99 HG22 VAL 99 20.246 10.802 10.037 801 HG23 VAL 99 HG23 VAL 99 18.904 10.855 8.866 802 H LEU 100 H LEU 100 22.279 7.741 6.656 803 HA LEU 100 HA LEU 100 21.271 5.530 8.027 804 HB2 LEU 100 HB2 LEU 100 22.736 5.903 5.348 805 HB3 LEU 100 HB3 LEU 100 22.403 4.340 6.011 806 HG LEU 100 HG LEU 100 20.098 5.195 6.426 807 HD11 LEU 100 HD11 LEU 100 18.880 6.341 4.745 808 HD12 LEU 100 HD12 LEU 100 19.398 6.930 6.298 809 HD13 LEU 100 HD13 LEU 100 20.322 7.411 4.846 810 HD21 LEU 100 HD21 LEU 100 20.744 3.358 4.854 811 HD22 LEU 100 HD22 LEU 100 19.184 4.107 4.557 812 HD23 LEU 100 HD23 LEU 100 20.589 4.548 3.543 813 H SER 101 H SER 101 24.489 6.894 8.088 814 HA SER 101 HA SER 101 25.487 4.400 9.362 815 HB2 SER 101 HB2 SER 101 26.542 5.740 7.338 816 HB3 SER 101 HB3 SER 101 27.206 6.741 8.641 817 HG SER 101 HG SER 101 27.449 3.941 8.097 818 H LEU 102 H LEU 102 23.916 7.068 10.355 819 HA LEU 102 HA LEU 102 25.264 7.235 13.009 820 HB2 LEU 102 HB2 LEU 102 23.334 8.983 11.443 821 HB3 LEU 102 HB3 LEU 102 23.521 9.195 13.188 822 HG LEU 102 HG LEU 102 25.770 9.430 11.156 823 HD11 LEU 102 HD11 LEU 102 24.225 11.591 12.615 824 HD12 LEU 102 HD12 LEU 102 25.608 11.841 11.519 825 HD13 LEU 102 HD13 LEU 102 24.085 11.188 10.893 826 HD21 LEU 102 HD21 LEU 102 26.675 8.785 13.255 827 HD22 LEU 102 HD22 LEU 102 26.990 10.507 13.047 828 HD23 LEU 102 HD23 LEU 102 25.679 9.983 14.139 829 H THR 103 H THR 103 22.197 6.623 11.341 830 HA THR 103 HA THR 103 20.744 6.196 13.809 831 HB THR 103 HB THR 103 20.167 7.563 11.688 832 HG1 THR 103 HG1 THR 103 18.773 7.225 13.362 833 HG21 THR 103 HG21 THR 103 18.942 4.986 10.680 834 HG22 THR 103 HG22 THR 103 19.119 6.561 9.856 835 HG23 THR 103 HG23 THR 103 20.529 5.531 10.125 836 H ASN 104 H ASN 104 22.694 4.171 12.162 837 HA ASN 104 HA ASN 104 22.905 2.011 11.630 838 HB2 ASN 104 HB2 ASN 104 20.915 0.697 13.258 839 HB3 ASN 104 HB3 ASN 104 22.663 0.574 13.177 840 HD21 ASN 104 HD21 ASN 104 20.129 1.457 15.234 841 HD22 ASN 104 HD22 ASN 104 21.085 2.430 16.349 842 H LEU 105 H LEU 105 22.171 2.663 9.552 843 HA LEU 105 HA LEU 105 19.657 1.289 8.718 844 HB2 LEU 105 HB2 LEU 105 20.020 3.973 8.527 845 HB3 LEU 105 HB3 LEU 105 20.584 3.333 7.025 846 HG LEU 105 HG LEU 105 18.307 3.948 6.722 847 HD11 LEU 105 HD11 LEU 105 17.127 1.881 6.161 848 HD12 LEU 105 HD12 LEU 105 18.810 1.827 5.629 849 HD13 LEU 105 HD13 LEU 105 18.307 0.941 7.079 850 HD21 LEU 105 HD21 LEU 105 17.760 2.488 9.299 851 HD22 LEU 105 HD22 LEU 105 17.630 4.220 8.944 852 HD23 LEU 105 HD23 LEU 105 16.507 3.099 8.186 853 H ASP 106 H ASP 106 22.833 2.600 7.639 854 HA ASP 106 HA ASP 106 23.096 1.105 5.241 855 HB2 ASP 106 HB2 ASP 106 25.301 1.930 5.166 856 HB3 ASP 106 HB3 ASP 106 24.313 3.234 5.803 857 H ARG 107 H ARG 107 23.667 0.323 8.507 858 HA ARG 107 HA ARG 107 25.286 -2.036 8.008 859 HB2 ARG 107 HB2 ARG 107 25.421 -2.096 10.287 860 HB3 ARG 107 HB3 ARG 107 25.775 -0.446 9.770 861 HG2 ARG 107 HG2 ARG 107 24.207 0.299 11.182 862 HG3 ARG 107 HG3 ARG 107 23.026 -0.681 10.331 863 HD2 ARG 107 HD2 ARG 107 24.485 -1.224 12.902 864 HD3 ARG 107 HD3 ARG 107 22.768 -1.329 12.539 865 HE ARG 107 HE ARG 107 23.012 -3.471 11.613 866 HH11 ARG 107 HH11 ARG 107 26.133 -2.319 12.864 867 HH12 ARG 107 HH12 ARG 107 26.983 -3.770 12.483 868 HH21 ARG 107 HH21 ARG 107 24.114 -5.407 11.156 869 HH22 ARG 107 HH22 ARG 107 25.736 -5.631 11.649 870 H ILE 108 H ILE 108 22.108 -1.516 7.957 871 HA ILE 108 HA ILE 108 21.244 -4.166 9.049 872 HB ILE 108 HB ILE 108 19.523 -1.667 8.689 873 HG12 ILE 108 HG12 ILE 108 20.981 -2.754 11.114 874 HG13 ILE 108 HG13 ILE 108 20.941 -1.115 10.450 875 HG21 ILE 108 HG21 ILE 108 18.885 -4.300 10.079 876 HG22 ILE 108 HG22 ILE 108 17.802 -2.897 9.885 877 HG23 ILE 108 HG23 ILE 108 18.288 -3.813 8.479 878 HD11 ILE 108 HD11 ILE 108 18.762 -2.485 12.027 879 HD12 ILE 108 HD12 ILE 108 19.718 -1.065 12.462 880 HD13 ILE 108 HD13 ILE 108 18.534 -0.947 11.146 881 H VAL 109 H VAL 109 20.969 -1.798 6.311 882 HA VAL 109 HA VAL 109 19.975 -4.017 4.706 883 HB VAL 109 HB VAL 109 19.532 -1.166 3.899 884 HG11 VAL 109 HG11 VAL 109 17.473 -2.076 2.933 885 HG12 VAL 109 HG12 VAL 109 18.919 -2.927 2.387 886 HG13 VAL 109 HG13 VAL 109 17.875 -3.672 3.616 887 HG21 VAL 109 HG21 VAL 109 17.359 -1.000 5.071 888 HG22 VAL 109 HG22 VAL 109 17.700 -2.509 5.941 889 HG23 VAL 109 HG23 VAL 109 18.693 -1.072 6.220 890 H LYS 110 H LYS 110 20.812 -4.209 2.572 891 HA LYS 110 HA LYS 110 23.584 -3.421 2.283 892 HB2 LYS 110 HB2 LYS 110 21.541 -4.917 0.687 893 HB3 LYS 110 HB3 LYS 110 23.009 -4.427 -0.105 894 HG2 LYS 110 HG2 LYS 110 23.518 -5.681 2.543 895 HG3 LYS 110 HG3 LYS 110 22.721 -6.733 1.372 896 HD2 LYS 110 HD2 LYS 110 25.117 -7.031 1.128 897 HD3 LYS 110 HD3 LYS 110 24.416 -6.254 -0.281 898 HE2 LYS 110 HE2 LYS 110 26.308 -5.028 -0.097 899 HE3 LYS 110 HE3 LYS 110 25.195 -4.010 0.815 900 HZ1 LYS 110 HZ1 LYS 110 27.161 -4.219 2.008 901 HZ2 LYS 110 HZ2 LYS 110 26.097 -5.145 2.843 902 HZ3 LYS 110 HZ3 LYS 110 27.238 -5.852 1.863 903 H ILE 111 H ILE 111 24.410 -2.212 0.412 904 HA ILE 111 HA ILE 111 22.582 -0.273 -0.776 905 HB ILE 111 HB ILE 111 24.307 0.221 1.474 906 HG12 ILE 111 HG12 ILE 111 23.696 2.765 0.763 907 HG13 ILE 111 HG13 ILE 111 22.449 1.875 -0.115 908 HG21 ILE 111 HG21 ILE 111 25.445 1.679 -0.933 909 HG22 ILE 111 HG22 ILE 111 25.842 1.988 0.769 910 HG23 ILE 111 HG23 ILE 111 26.260 0.441 0.046 911 HD11 ILE 111 HD11 ILE 111 23.133 1.772 2.866 912 HD12 ILE 111 HD12 ILE 111 21.702 2.510 2.147 913 HD13 ILE 111 HD13 ILE 111 21.912 0.737 2.090 914 H TYR 112 H TYR 112 23.278 0.321 -2.864 915 HA TYR 112 HA TYR 112 25.795 -0.748 -4.008 916 HB2 TYR 112 HB2 TYR 112 22.911 -1.154 -4.937 917 HB3 TYR 112 HB3 TYR 112 24.306 -1.474 -5.945 918 HD1 TYR 112 HD1 TYR 112 25.991 -3.182 -5.307 919 HD2 TYR 112 HD2 TYR 112 22.304 -2.693 -3.162 920 HE1 TYR 112 HE1 TYR 112 26.331 -5.364 -4.343 921 HE2 TYR 112 HE2 TYR 112 22.571 -5.074 -2.266 922 HH TYR 112 HH TYR 112 25.551 -6.918 -2.876 923 H ASP 113 H ASP 113 26.085 0.160 -6.345 924 HA ASP 113 HA ASP 113 25.433 3.035 -6.220 925 HB2 ASP 113 HB2 ASP 113 27.699 1.982 -6.966 926 HB3 ASP 113 HB3 ASP 113 26.896 1.550 -8.434 927 H THR 114 H THR 114 24.745 0.151 -8.233 928 HA THR 114 HA THR 114 22.608 1.659 -9.655 929 HB THR 114 HB THR 114 23.281 0.870 -11.722 930 HG1 THR 114 HG1 THR 114 24.996 -0.618 -11.994 931 HG21 THR 114 HG21 THR 114 25.936 1.484 -10.367 932 HG22 THR 114 HG22 THR 114 25.534 1.647 -12.085 933 HG23 THR 114 HG23 THR 114 24.735 2.689 -10.891 934 H ILE 115 H ILE 115 21.457 -0.124 -11.069 935 HA ILE 115 HA ILE 115 20.268 -1.937 -9.050 936 HB ILE 115 HB ILE 115 19.542 -1.162 -11.881 937 HG12 ILE 115 HG12 ILE 115 18.831 0.304 -10.013 938 HG13 ILE 115 HG13 ILE 115 17.503 -0.373 -10.933 939 HG21 ILE 115 HG21 ILE 115 19.109 -3.556 -11.874 940 HG22 ILE 115 HG22 ILE 115 18.340 -3.471 -10.288 941 HG23 ILE 115 HG23 ILE 115 17.556 -2.725 -11.708 942 HD11 ILE 115 HD11 ILE 115 17.231 -0.283 -8.384 943 HD12 ILE 115 HD12 ILE 115 16.778 -1.772 -9.232 944 HD13 ILE 115 HD13 ILE 115 18.296 -1.705 -8.345 945 H SER 116 H SER 116 22.261 -2.102 -12.057 946 HA SER 116 HA SER 116 22.137 -5.000 -12.015 947 HB2 SER 116 HB2 SER 116 22.590 -3.578 -14.036 948 HB3 SER 116 HB3 SER 116 24.201 -3.213 -13.390 949 HG SER 116 HG SER 116 24.663 -5.463 -13.511 950 H GLU 117 H GLU 117 24.249 -2.549 -10.336 951 HA GLU 117 HA GLU 117 26.198 -4.461 -9.540 952 HB2 GLU 117 HB2 GLU 117 25.694 -1.675 -9.207 953 HB3 GLU 117 HB3 GLU 117 25.613 -2.341 -7.583 954 HG2 GLU 117 HG2 GLU 117 27.846 -3.391 -7.924 955 HG3 GLU 117 HG3 GLU 117 27.845 -2.792 -9.594 956 H ALA 118 H ALA 118 22.837 -4.289 -8.807 957 HA ALA 118 HA ALA 118 23.244 -5.367 -6.063 958 HB1 ALA 118 HB1 ALA 118 22.007 -3.174 -6.338 959 HB2 ALA 118 HB2 ALA 118 20.774 -4.026 -7.277 960 HB3 ALA 118 HB3 ALA 118 21.066 -4.463 -5.576 961 H MET 119 H MET 119 21.612 -5.755 -9.197 962 HA MET 119 HA MET 119 19.660 -7.478 -8.415 963 HB2 MET 119 HB2 MET 119 20.228 -6.172 -10.721 964 HB3 MET 119 HB3 MET 119 20.845 -7.741 -11.197 965 HG2 MET 119 HG2 MET 119 18.516 -8.593 -10.255 966 HG3 MET 119 HG3 MET 119 18.114 -6.868 -10.278 967 HE1 MET 119 HE1 MET 119 18.628 -9.632 -13.943 968 HE2 MET 119 HE2 MET 119 19.969 -9.334 -12.817 969 HE3 MET 119 HE3 MET 119 18.492 -10.156 -12.255 970 H GLU 120 H GLU 120 22.857 -8.434 -9.690 971 HA GLU 120 HA GLU 120 22.309 -11.300 -9.128 972 HB2 GLU 120 HB2 GLU 120 24.475 -11.607 -10.262 973 HB3 GLU 120 HB3 GLU 120 23.329 -10.703 -11.267 974 HG2 GLU 120 HG2 GLU 120 24.449 -8.642 -10.964 975 HG3 GLU 120 HG3 GLU 120 25.410 -9.234 -9.619 976 H GLU 121 H GLU 121 23.814 -8.545 -7.611 977 HA GLU 121 HA GLU 121 25.812 -10.172 -6.298 978 HB2 GLU 121 HB2 GLU 121 25.949 -7.705 -7.102 979 HB3 GLU 121 HB3 GLU 121 25.068 -7.323 -5.616 980 HG2 GLU 121 HG2 GLU 121 27.286 -7.078 -4.974 981 HG3 GLU 121 HG3 GLU 121 26.972 -8.722 -4.438 982 H VAL 122 H VAL 122 22.897 -8.325 -5.279 983 HA VAL 122 HA VAL 122 22.727 -8.867 -2.556 984 HB VAL 122 HB VAL 122 21.340 -7.460 -4.254 985 HG11 VAL 122 HG11 VAL 122 19.014 -8.229 -4.499 986 HG12 VAL 122 HG12 VAL 122 20.146 -9.189 -5.446 987 HG13 VAL 122 HG13 VAL 122 19.470 -9.829 -3.914 988 HG21 VAL 122 HG21 VAL 122 19.604 -7.286 -2.353 989 HG22 VAL 122 HG22 VAL 122 20.643 -8.498 -1.556 990 HG23 VAL 122 HG23 VAL 122 21.320 -6.955 -2.024 991 H ARG 123 H ARG 123 22.047 -11.078 -5.139 992 HA ARG 123 HA ARG 123 20.452 -12.979 -3.641 993 HB2 ARG 123 HB2 ARG 123 22.179 -13.242 -6.153 994 HB3 ARG 123 HB3 ARG 123 21.213 -14.565 -5.501 995 HG2 ARG 123 HG2 ARG 123 19.171 -13.182 -5.663 996 HG3 ARG 123 HG3 ARG 123 20.096 -11.869 -6.398 997 HD2 ARG 123 HD2 ARG 123 20.550 -14.467 -7.744 998 HD3 ARG 123 HD3 ARG 123 18.844 -14.021 -7.693 999 HE ARG 123 HE ARG 123 19.799 -11.711 -8.552 1000 HH11 ARG 123 HH11 ARG 123 21.208 -14.819 -9.608 1001 HH12 ARG 123 HH12 ARG 123 21.342 -14.300 -11.244 1002 HH21 ARG 123 HH21 ARG 123 19.554 -11.321 -10.764 1003 HH22 ARG 123 HH22 ARG 123 20.362 -12.319 -11.941 1004 H ARG 124 H ARG 124 23.909 -12.437 -3.903 1005 HA ARG 124 HA ARG 124 24.525 -14.302 -1.770 1006 HB2 ARG 124 HB2 ARG 124 26.485 -15.155 -3.482 1007 HB3 ARG 124 HB3 ARG 124 25.035 -16.017 -3.081 1008 HG2 ARG 124 HG2 ARG 124 25.365 -16.159 -5.446 1009 HG3 ARG 124 HG3 ARG 124 23.915 -15.250 -5.136 1010 HD2 ARG 124 HD2 ARG 124 24.924 -14.049 -6.858 1011 HD3 ARG 124 HD3 ARG 124 25.377 -13.112 -5.447 1012 HE ARG 124 HE ARG 124 27.137 -15.176 -6.727 1013 HH11 ARG 124 HH11 ARG 124 27.146 -12.162 -4.892 1014 HH12 ARG 124 HH12 ARG 124 28.218 -11.319 -5.986 1015 HH21 ARG 124 HH21 ARG 124 29.046 -14.321 -7.745 1016 HH22 ARG 124 HH22 ARG 124 29.620 -12.747 -7.246 1017 H LYS 125 H LYS 125 24.398 -11.779 -1.539 1018 HA LYS 125 HA LYS 125 26.323 -10.127 -2.418 1019 HB2 LYS 125 HB2 LYS 125 25.775 -8.631 -0.649 1020 HB3 LYS 125 HB3 LYS 125 24.345 -9.454 -1.210 1021 HG2 LYS 125 HG2 LYS 125 24.192 -9.336 1.139 1022 HG3 LYS 125 HG3 LYS 125 24.509 -11.022 0.677 1023 HD2 LYS 125 HD2 LYS 125 26.658 -11.012 1.582 1024 HD3 LYS 125 HD3 LYS 125 26.824 -9.257 1.523 1025 HE2 LYS 125 HE2 LYS 125 24.798 -10.608 3.329 1026 HE3 LYS 125 HE3 LYS 125 26.507 -10.557 3.758 1027 HZ1 LYS 125 HZ1 LYS 125 26.390 -8.104 3.503 1028 HZ2 LYS 125 HZ2 LYS 125 24.728 -8.251 3.358 1029 HZ3 LYS 125 HZ3 LYS 125 25.472 -8.701 4.730 Start of MODEL 3 1 H1 MET 1 H1 MET 1 -23.897 -0.452 14.940 2 HA MET 1 HA MET 1 -21.489 -2.108 14.407 3 HB2 MET 1 HB2 MET 1 -23.622 -3.386 15.126 4 HB3 MET 1 HB3 MET 1 -24.344 -2.847 13.610 5 HG2 MET 1 HG2 MET 1 -21.812 -4.519 13.918 6 HG3 MET 1 HG3 MET 1 -23.413 -5.133 13.517 7 HE1 MET 1 HE1 MET 1 -20.884 -5.948 11.897 8 HE2 MET 1 HE2 MET 1 -22.516 -6.483 11.427 9 HE3 MET 1 HE3 MET 1 -21.430 -5.769 10.215 10 H GLY 2 H GLY 2 -20.546 -1.476 12.448 11 HA2 GLY 2 HA2 GLY 2 -22.211 -0.242 10.375 12 HA3 GLY 2 HA3 GLY 2 -20.857 0.699 11.021 13 H SER 3 H SER 3 -20.611 0.183 8.541 14 HA SER 3 HA SER 3 -18.137 -1.133 8.319 15 HB2 SER 3 HB2 SER 3 -20.438 -2.670 7.075 16 HB3 SER 3 HB3 SER 3 -18.800 -2.762 6.404 17 HG SER 3 HG SER 3 -19.330 -3.162 9.147 18 H ASP 4 H ASP 4 -20.606 0.842 7.103 19 HA ASP 4 HA ASP 4 -20.332 2.774 5.983 20 HB2 ASP 4 HB2 ASP 4 -18.043 2.498 7.937 21 HB3 ASP 4 HB3 ASP 4 -18.973 3.949 7.554 22 H LYS 5 H LYS 5 -19.499 1.495 3.869 23 HA LYS 5 HA LYS 5 -16.737 1.732 3.144 24 HB2 LYS 5 HB2 LYS 5 -19.299 1.262 1.648 25 HB3 LYS 5 HB3 LYS 5 -17.959 1.914 0.718 26 HG2 LYS 5 HG2 LYS 5 -18.036 -0.502 0.562 27 HG3 LYS 5 HG3 LYS 5 -16.517 0.072 1.252 28 HD2 LYS 5 HD2 LYS 5 -17.164 -0.625 3.463 29 HD3 LYS 5 HD3 LYS 5 -18.821 -0.999 2.933 30 HE2 LYS 5 HE2 LYS 5 -17.904 -2.729 1.389 31 HE3 LYS 5 HE3 LYS 5 -16.274 -2.382 1.947 32 HZ1 LYS 5 HZ1 LYS 5 -17.472 -4.325 2.956 33 HZ2 LYS 5 HZ2 LYS 5 -16.762 -3.311 4.046 34 HZ3 LYS 5 HZ3 LYS 5 -18.394 -3.290 3.784 35 H ILE 6 H ILE 6 -19.369 3.793 1.896 36 HA ILE 6 HA ILE 6 -19.367 5.736 0.838 37 HB ILE 6 HB ILE 6 -17.271 6.647 2.829 38 HG12 ILE 6 HG12 ILE 6 -19.338 7.927 3.755 39 HG13 ILE 6 HG13 ILE 6 -20.309 6.725 2.917 40 HG21 ILE 6 HG21 ILE 6 -17.985 8.923 2.229 41 HG22 ILE 6 HG22 ILE 6 -17.368 8.106 0.806 42 HG23 ILE 6 HG23 ILE 6 -19.124 8.275 1.027 43 HD11 ILE 6 HD11 ILE 6 -19.388 4.967 4.361 44 HD12 ILE 6 HD12 ILE 6 -18.176 6.096 5.019 45 HD13 ILE 6 HD13 ILE 6 -19.898 6.317 5.372 46 H HIS 7 H HIS 7 -15.823 6.157 1.292 47 HA HIS 7 HA HIS 7 -15.411 5.889 -1.567 48 HB2 HIS 7 HB2 HIS 7 -13.000 6.010 -0.974 49 HB3 HIS 7 HB3 HIS 7 -13.967 7.358 -0.403 50 HD1 HIS 7 HD1 HIS 7 -14.122 4.321 1.874 51 HD2 HIS 7 HD2 HIS 7 -11.986 7.922 1.361 52 HE1 HIS 7 HE1 HIS 7 -12.860 4.722 4.048 53 H HIS 8 H HIS 8 -14.596 4.123 -2.723 54 HA HIS 8 HA HIS 8 -13.986 1.649 -1.211 55 HB2 HIS 8 HB2 HIS 8 -15.060 0.266 -2.782 56 HB3 HIS 8 HB3 HIS 8 -16.233 1.417 -2.167 57 HD1 HIS 8 HD1 HIS 8 -13.991 2.592 -5.094 58 HD2 HIS 8 HD2 HIS 8 -17.790 0.938 -4.281 59 HE1 HIS 8 HE1 HIS 8 -15.236 2.524 -7.301 60 H HIS 9 H HIS 9 -12.612 0.187 -2.602 61 HA HIS 9 HA HIS 9 -10.522 -0.095 -3.334 62 HB2 HIS 9 HB2 HIS 9 -11.480 1.877 -5.430 63 HB3 HIS 9 HB3 HIS 9 -9.822 1.314 -5.432 64 HD1 HIS 9 HD1 HIS 9 -9.401 -1.335 -5.670 65 HD2 HIS 9 HD2 HIS 9 -13.382 0.024 -6.085 66 HE1 HIS 9 HE1 HIS 9 -10.733 -3.286 -6.641 67 H HIS 10 H HIS 10 -8.390 1.284 -4.040 68 HA HIS 10 HA HIS 10 -8.034 3.478 -2.132 69 HB2 HIS 10 HB2 HIS 10 -7.096 0.948 -1.549 70 HB3 HIS 10 HB3 HIS 10 -5.749 1.583 -2.469 71 HD1 HIS 10 HD1 HIS 10 -6.196 4.689 -1.059 72 HD2 HIS 10 HD2 HIS 10 -5.849 0.883 0.727 73 HE1 HIS 10 HE1 HIS 10 -5.311 5.081 1.268 74 H HIS 11 H HIS 11 -6.800 5.084 -3.057 75 HA HIS 11 HA HIS 11 -5.630 4.671 -5.747 76 HB2 HIS 11 HB2 HIS 11 -7.621 6.815 -4.876 77 HB3 HIS 11 HB3 HIS 11 -6.665 6.867 -6.359 78 HD1 HIS 11 HD1 HIS 11 -7.240 5.021 -8.224 79 HD2 HIS 11 HD2 HIS 11 -9.740 5.096 -4.840 80 HE1 HIS 11 HE1 HIS 11 -9.277 3.542 -8.772 81 H HIS 12 H HIS 12 -3.776 4.479 -4.225 82 HA HIS 12 HA HIS 12 -2.643 7.192 -3.775 83 HB2 HIS 12 HB2 HIS 12 -3.152 5.692 -1.675 84 HB3 HIS 12 HB3 HIS 12 -1.727 4.787 -2.179 85 HD1 HIS 12 HD1 HIS 12 -2.342 7.119 0.327 86 HD2 HIS 12 HD2 HIS 12 0.305 7.055 -2.964 87 HE1 HIS 12 HE1 HIS 12 -0.458 8.750 0.875 88 H MET 13 H MET 13 -1.784 3.746 -4.230 89 HA MET 13 HA MET 13 -0.240 2.649 -5.341 90 HB2 MET 13 HB2 MET 13 0.102 2.931 -7.606 91 HB3 MET 13 HB3 MET 13 -1.526 3.530 -7.333 92 HG2 MET 13 HG2 MET 13 -0.915 5.757 -7.767 93 HG3 MET 13 HG3 MET 13 0.779 5.484 -7.394 94 HE1 MET 13 HE1 MET 13 0.319 7.281 -9.729 95 HE2 MET 13 HE2 MET 13 1.885 6.620 -9.205 96 HE3 MET 13 HE3 MET 13 1.426 6.553 -10.916 97 H PHE 14 H PHE 14 2.057 2.951 -6.663 98 HA PHE 14 HA PHE 14 3.528 5.259 -5.817 99 HB2 PHE 14 HB2 PHE 14 3.604 3.367 -3.906 100 HB3 PHE 14 HB3 PHE 14 4.721 2.602 -5.030 101 HD1 PHE 14 HD1 PHE 14 4.071 5.552 -2.896 102 HD2 PHE 14 HD2 PHE 14 6.909 3.631 -5.498 103 HE1 PHE 14 HE1 PHE 14 5.751 7.236 -2.289 104 HE2 PHE 14 HE2 PHE 14 8.548 5.405 -5.018 105 HZ PHE 14 HZ PHE 14 7.976 7.232 -3.392 106 HA PRO 15 HA PRO 15 5.291 3.725 -9.723 107 HB2 PRO 15 HB2 PRO 15 7.568 5.270 -9.959 108 HB3 PRO 15 HB3 PRO 15 5.908 5.856 -10.286 109 HG2 PRO 15 HG2 PRO 15 7.520 6.128 -7.750 110 HG3 PRO 15 HG3 PRO 15 6.620 7.397 -8.634 111 HD2 PRO 15 HD2 PRO 15 5.590 6.149 -6.454 112 HD3 PRO 15 HD3 PRO 15 4.546 6.554 -7.843 113 H TYR 16 H TYR 16 6.462 1.949 -10.195 114 HA TYR 16 HA TYR 16 9.069 1.402 -9.008 115 HB2 TYR 16 HB2 TYR 16 8.390 -0.715 -7.996 116 HB3 TYR 16 HB3 TYR 16 7.445 0.576 -7.340 117 HD1 TYR 16 HD1 TYR 16 7.308 -2.359 -9.628 118 HD2 TYR 16 HD2 TYR 16 5.108 0.648 -7.512 119 HE1 TYR 16 HE1 TYR 16 5.202 -3.589 -10.097 120 HE2 TYR 16 HE2 TYR 16 2.988 -0.575 -7.921 121 HH TYR 16 HH TYR 16 2.051 -2.494 -8.778 122 H LYS 17 H LYS 17 9.792 -0.777 -9.960 123 HA LYS 17 HA LYS 17 8.352 -1.648 -12.327 124 HB2 LYS 17 HB2 LYS 17 10.083 -1.900 -13.809 125 HB3 LYS 17 HB3 LYS 17 10.347 -0.265 -13.227 126 HG2 LYS 17 HG2 LYS 17 12.311 -0.860 -12.051 127 HG3 LYS 17 HG3 LYS 17 11.904 -2.579 -12.029 128 HD2 LYS 17 HD2 LYS 17 13.613 -2.385 -13.611 129 HD3 LYS 17 HD3 LYS 17 12.113 -2.613 -14.525 130 HE2 LYS 17 HE2 LYS 17 12.094 0.024 -14.615 131 HE3 LYS 17 HE3 LYS 17 13.799 -0.151 -14.128 132 HZ1 LYS 17 HZ1 LYS 17 14.089 -1.550 -16.101 133 HZ2 LYS 17 HZ2 LYS 17 12.525 -1.241 -16.542 134 HZ3 LYS 17 HZ3 LYS 17 13.637 -0.021 -16.505 135 H ILE 18 H ILE 18 9.311 -3.862 -12.951 136 HA ILE 18 HA ILE 18 10.594 -5.170 -10.659 137 HB ILE 18 HB ILE 18 8.532 -6.541 -12.397 138 HG12 ILE 18 HG12 ILE 18 7.991 -5.187 -9.719 139 HG13 ILE 18 HG13 ILE 18 7.248 -4.811 -11.276 140 HG21 ILE 18 HG21 ILE 18 8.569 -8.240 -10.634 141 HG22 ILE 18 HG22 ILE 18 10.236 -7.907 -11.064 142 HG23 ILE 18 HG23 ILE 18 9.559 -7.208 -9.587 143 HD11 ILE 18 HD11 ILE 18 6.757 -7.265 -9.587 144 HD12 ILE 18 HD12 ILE 18 5.624 -5.997 -10.057 145 HD13 ILE 18 HD13 ILE 18 6.233 -7.118 -11.287 146 H VAL 19 H VAL 19 12.145 -6.825 -11.465 147 HA VAL 19 HA VAL 19 12.648 -6.822 -14.363 148 HB VAL 19 HB VAL 19 14.976 -7.241 -13.702 149 HG11 VAL 19 HG11 VAL 19 13.860 -4.559 -12.750 150 HG12 VAL 19 HG12 VAL 19 15.561 -4.877 -13.125 151 HG13 VAL 19 HG13 VAL 19 14.348 -4.986 -14.393 152 HG21 VAL 19 HG21 VAL 19 15.853 -6.660 -11.516 153 HG22 VAL 19 HG22 VAL 19 14.230 -6.405 -10.899 154 HG23 VAL 19 HG23 VAL 19 14.748 -8.031 -11.395 155 H ASP 20 H ASP 20 14.485 -9.223 -13.629 156 HA ASP 20 HA ASP 20 13.013 -11.232 -14.355 157 HB2 ASP 20 HB2 ASP 20 15.407 -11.137 -12.498 158 HB3 ASP 20 HB3 ASP 20 14.724 -12.674 -13.065 159 H ASP 21 H ASP 21 13.903 -11.037 -10.885 160 HA ASP 21 HA ASP 21 11.095 -11.424 -10.159 161 HB2 ASP 21 HB2 ASP 21 11.229 -13.273 -8.976 162 HB3 ASP 21 HB3 ASP 21 12.256 -13.697 -10.323 163 H VAL 22 H VAL 22 13.352 -9.316 -9.986 164 HA VAL 22 HA VAL 22 13.073 -8.799 -7.069 165 HB VAL 22 HB VAL 22 15.172 -7.575 -8.916 166 HG11 VAL 22 HG11 VAL 22 15.009 -6.119 -7.151 167 HG12 VAL 22 HG12 VAL 22 14.439 -7.333 -6.017 168 HG13 VAL 22 HG13 VAL 22 16.139 -7.297 -6.444 169 HG21 VAL 22 HG21 VAL 22 16.777 -9.097 -7.722 170 HG22 VAL 22 HG22 VAL 22 15.376 -10.007 -7.107 171 HG23 VAL 22 HG23 VAL 22 15.693 -9.925 -8.838 172 H VAL 23 H VAL 23 12.059 -6.946 -6.406 173 HA VAL 23 HA VAL 23 10.672 -5.308 -8.436 174 HB VAL 23 HB VAL 23 10.524 -5.152 -5.405 175 HG11 VAL 23 HG11 VAL 23 9.549 -3.247 -6.708 176 HG12 VAL 23 HG12 VAL 23 8.470 -4.394 -7.511 177 HG13 VAL 23 HG13 VAL 23 8.383 -4.145 -5.753 178 HG21 VAL 23 HG21 VAL 23 8.542 -6.580 -5.478 179 HG22 VAL 23 HG22 VAL 23 8.776 -6.879 -7.212 180 HG23 VAL 23 HG23 VAL 23 9.939 -7.482 -6.009 181 H ILE 24 H ILE 24 11.008 -2.995 -8.546 182 HA ILE 24 HA ILE 24 13.325 -1.836 -7.053 183 HB ILE 24 HB ILE 24 12.562 -1.594 -9.999 184 HG12 ILE 24 HG12 ILE 24 15.054 -2.037 -10.367 185 HG13 ILE 24 HG13 ILE 24 15.172 -2.461 -8.658 186 HG21 ILE 24 HG21 ILE 24 13.048 0.608 -9.282 187 HG22 ILE 24 HG22 ILE 24 14.495 0.076 -8.377 188 HG23 ILE 24 HG23 ILE 24 14.462 0.058 -10.165 189 HD11 ILE 24 HD11 ILE 24 14.040 -4.503 -9.037 190 HD12 ILE 24 HD12 ILE 24 13.328 -3.922 -10.566 191 HD13 ILE 24 HD13 ILE 24 15.072 -4.270 -10.444 192 H LEU 25 H LEU 25 12.163 -0.351 -5.578 193 HA LEU 25 HA LEU 25 9.779 0.953 -6.640 194 HB2 LEU 25 HB2 LEU 25 11.276 1.483 -4.061 195 HB3 LEU 25 HB3 LEU 25 9.710 2.096 -4.553 196 HG LEU 25 HG LEU 25 9.035 0.519 -3.183 197 HD11 LEU 25 HD11 LEU 25 8.178 -1.493 -4.200 198 HD12 LEU 25 HD12 LEU 25 8.097 -0.215 -5.409 199 HD13 LEU 25 HD13 LEU 25 9.386 -1.418 -5.490 200 HD21 LEU 25 HD21 LEU 25 11.299 -1.269 -3.853 201 HD22 LEU 25 HD22 LEU 25 11.134 -0.241 -2.411 202 HD23 LEU 25 HD23 LEU 25 10.022 -1.610 -2.655 203 H MET 26 H MET 26 9.786 3.391 -6.803 204 HA MET 26 HA MET 26 12.472 4.642 -7.378 205 HB2 MET 26 HB2 MET 26 9.876 4.579 -8.979 206 HB3 MET 26 HB3 MET 26 11.171 5.760 -9.260 207 HG2 MET 26 HG2 MET 26 12.716 4.150 -9.848 208 HG3 MET 26 HG3 MET 26 11.838 2.827 -9.130 209 HE1 MET 26 HE1 MET 26 11.587 1.101 -11.104 210 HE2 MET 26 HE2 MET 26 11.623 1.634 -12.801 211 HE3 MET 26 HE3 MET 26 12.945 2.087 -11.700 212 HA PRO 27 HA PRO 27 9.924 7.166 -4.396 213 HB2 PRO 27 HB2 PRO 27 11.996 8.227 -2.952 214 HB3 PRO 27 HB3 PRO 27 11.344 6.591 -2.657 215 HG2 PRO 27 HG2 PRO 27 13.762 7.318 -4.326 216 HG3 PRO 27 HG3 PRO 27 13.639 6.074 -3.042 217 HD2 PRO 27 HD2 PRO 27 13.367 5.425 -5.671 218 HD3 PRO 27 HD3 PRO 27 12.330 4.655 -4.448 219 H ASN 28 H ASN 28 9.243 8.381 -6.195 220 HA ASN 28 HA ASN 28 10.748 10.690 -7.126 221 HB2 ASN 28 HB2 ASN 28 8.616 11.341 -8.105 222 HB3 ASN 28 HB3 ASN 28 9.010 9.671 -8.516 223 HD21 ASN 28 HD21 ASN 28 6.478 11.632 -7.412 224 HD22 ASN 28 HD22 ASN 28 5.514 10.358 -6.647 225 H LYS 29 H LYS 29 11.148 10.730 -4.578 226 HA LYS 29 HA LYS 29 11.095 11.763 -2.611 227 HB2 LYS 29 HB2 LYS 29 11.529 14.010 -2.805 228 HB3 LYS 29 HB3 LYS 29 11.941 13.345 -4.351 229 HG2 LYS 29 HG2 LYS 29 9.170 14.274 -4.445 230 HG3 LYS 29 HG3 LYS 29 10.156 15.501 -3.701 231 HD2 LYS 29 HD2 LYS 29 10.144 15.990 -5.999 232 HD3 LYS 29 HD3 LYS 29 11.756 15.325 -5.672 233 HE2 LYS 29 HE2 LYS 29 10.820 13.067 -6.475 234 HE3 LYS 29 HE3 LYS 29 9.355 13.937 -6.953 235 HZ1 LYS 29 HZ1 LYS 29 10.769 13.709 -8.806 236 HZ2 LYS 29 HZ2 LYS 29 10.878 15.290 -8.401 237 HZ3 LYS 29 HZ3 LYS 29 12.083 14.203 -8.003 238 H GLU 30 H GLU 30 8.035 11.376 -3.784 239 HA GLU 30 HA GLU 30 6.407 12.741 -1.892 240 HB2 GLU 30 HB2 GLU 30 4.652 11.319 -2.741 241 HB3 GLU 30 HB3 GLU 30 5.635 11.959 -4.043 242 HG2 GLU 30 HG2 GLU 30 6.664 9.919 -4.522 243 HG3 GLU 30 HG3 GLU 30 6.178 9.200 -3.050 244 H LEU 31 H LEU 31 8.590 11.445 -0.443 245 HA LEU 31 HA LEU 31 7.264 9.167 0.898 246 HB2 LEU 31 HB2 LEU 31 9.979 10.299 1.565 247 HB3 LEU 31 HB3 LEU 31 9.272 8.766 2.054 248 HG LEU 31 HG LEU 31 10.276 9.584 -0.698 249 HD11 LEU 31 HD11 LEU 31 11.675 7.589 -0.455 250 HD12 LEU 31 HD12 LEU 31 11.873 8.651 0.942 251 HD13 LEU 31 HD13 LEU 31 10.872 7.183 1.077 252 HD21 LEU 31 HD21 LEU 31 8.199 8.491 -1.275 253 HD22 LEU 31 HD22 LEU 31 9.497 7.334 -1.525 254 HD23 LEU 31 HD23 LEU 31 8.488 7.201 -0.073 255 H ASN 32 H ASN 32 5.605 10.886 1.164 256 HA ASN 32 HA ASN 32 5.780 12.580 3.526 257 HB2 ASN 32 HB2 ASN 32 3.318 12.879 3.171 258 HB3 ASN 32 HB3 ASN 32 4.320 13.314 1.788 259 HD21 ASN 32 HD21 ASN 32 3.475 12.626 -0.106 260 HD22 ASN 32 HD22 ASN 32 3.142 10.941 -0.433 261 H ILE 33 H ILE 33 3.940 12.130 5.264 262 HA ILE 33 HA ILE 33 4.601 9.581 6.468 263 HB ILE 33 HB ILE 33 2.810 11.920 7.211 264 HG12 ILE 33 HG12 ILE 33 5.397 10.685 8.249 265 HG13 ILE 33 HG13 ILE 33 5.248 12.194 7.363 266 HG21 ILE 33 HG21 ILE 33 2.369 10.820 9.377 267 HG22 ILE 33 HG22 ILE 33 1.637 9.965 8.019 268 HG23 ILE 33 HG23 ILE 33 3.124 9.326 8.751 269 HD11 ILE 33 HD11 ILE 33 4.307 11.653 10.202 270 HD12 ILE 33 HD12 ILE 33 5.643 12.678 9.681 271 HD13 ILE 33 HD13 ILE 33 3.967 13.154 9.293 272 H GLU 34 H GLU 34 1.733 10.818 4.697 273 HA GLU 34 HA GLU 34 0.015 8.788 5.675 274 HB2 GLU 34 HB2 GLU 34 -0.235 10.364 3.067 275 HB3 GLU 34 HB3 GLU 34 -1.518 9.461 3.902 276 HG2 GLU 34 HG2 GLU 34 -0.795 10.915 5.975 277 HG3 GLU 34 HG3 GLU 34 -0.052 11.979 4.806 278 H ASN 35 H ASN 35 2.221 8.912 3.069 279 HA ASN 35 HA ASN 35 1.516 6.313 1.847 280 HB2 ASN 35 HB2 ASN 35 2.425 8.149 0.498 281 HB3 ASN 35 HB3 ASN 35 3.878 8.184 1.463 282 HD21 ASN 35 HD21 ASN 35 5.589 6.977 0.677 283 HD22 ASN 35 HD22 ASN 35 5.428 5.688 -0.525 284 H ALA 36 H ALA 36 3.447 7.376 4.559 285 HA ALA 36 HA ALA 36 5.595 5.452 4.280 286 HB1 ALA 36 HB1 ALA 36 5.777 7.664 5.479 287 HB2 ALA 36 HB2 ALA 36 4.736 7.021 6.752 288 HB3 ALA 36 HB3 ALA 36 6.308 6.265 6.432 289 H HIS 37 H HIS 37 2.797 5.653 6.654 290 HA HIS 37 HA HIS 37 3.601 3.090 7.732 291 HB2 HIS 37 HB2 HIS 37 2.135 4.895 8.869 292 HB3 HIS 37 HB3 HIS 37 0.787 4.156 7.996 293 HD1 HIS 37 HD1 HIS 37 3.337 3.410 10.805 294 HD2 HIS 37 HD2 HIS 37 0.044 1.658 8.809 295 HE1 HIS 37 HE1 HIS 37 2.679 1.377 12.155 296 H LEU 38 H LEU 38 1.519 4.050 4.973 297 HA LEU 38 HA LEU 38 0.394 1.436 4.678 298 HB2 LEU 38 HB2 LEU 38 -1.017 2.439 3.315 299 HB3 LEU 38 HB3 LEU 38 -0.388 3.921 3.965 300 HG LEU 38 HG LEU 38 1.262 3.920 1.953 301 HD11 LEU 38 HD11 LEU 38 -0.598 1.645 1.257 302 HD12 LEU 38 HD12 LEU 38 -0.009 2.710 -0.047 303 HD13 LEU 38 HD13 LEU 38 1.130 1.839 0.953 304 HD21 LEU 38 HD21 LEU 38 -1.710 4.230 1.401 305 HD22 LEU 38 HD22 LEU 38 -0.671 5.450 2.179 306 HD23 LEU 38 HD23 LEU 38 -0.354 4.978 0.513 307 H PHE 39 H PHE 39 3.402 3.030 3.648 308 HA PHE 39 HA PHE 39 4.184 1.667 1.473 309 HB2 PHE 39 HB2 PHE 39 5.445 3.337 3.117 310 HB3 PHE 39 HB3 PHE 39 6.155 1.862 3.759 311 HD1 PHE 39 HD1 PHE 39 5.537 3.626 0.483 312 HD2 PHE 39 HD2 PHE 39 8.200 1.155 2.804 313 HE1 PHE 39 HE1 PHE 39 7.348 4.199 -1.056 314 HE2 PHE 39 HE2 PHE 39 9.982 1.559 1.139 315 HZ PHE 39 HZ PHE 39 9.618 3.120 -0.751 316 H LYS 40 H LYS 40 4.240 0.385 4.783 317 HA LYS 40 HA LYS 40 5.424 -2.164 4.127 318 HB2 LYS 40 HB2 LYS 40 5.169 -1.273 6.496 319 HB3 LYS 40 HB3 LYS 40 3.430 -1.591 6.377 320 HG2 LYS 40 HG2 LYS 40 4.115 -4.007 5.687 321 HG3 LYS 40 HG3 LYS 40 5.742 -3.551 6.192 322 HD2 LYS 40 HD2 LYS 40 4.818 -4.727 7.986 323 HD3 LYS 40 HD3 LYS 40 4.679 -3.026 8.489 324 HE2 LYS 40 HE2 LYS 40 2.302 -3.027 7.764 325 HE3 LYS 40 HE3 LYS 40 2.481 -4.670 7.133 326 HZ1 LYS 40 HZ1 LYS 40 1.445 -4.568 9.359 327 HZ2 LYS 40 HZ2 LYS 40 2.821 -5.468 9.365 328 HZ3 LYS 40 HZ3 LYS 40 2.846 -3.953 9.961 329 H LYS 41 H LYS 41 2.014 -1.251 4.683 330 HA LYS 41 HA LYS 41 0.725 -3.587 4.033 331 HB2 LYS 41 HB2 LYS 41 0.020 -1.076 4.826 332 HB3 LYS 41 HB3 LYS 41 -0.448 -0.913 3.169 333 HG2 LYS 41 HG2 LYS 41 -1.424 -3.333 4.699 334 HG3 LYS 41 HG3 LYS 41 -2.084 -1.759 5.102 335 HD2 LYS 41 HD2 LYS 41 -2.762 -1.348 2.821 336 HD3 LYS 41 HD3 LYS 41 -2.114 -2.905 2.276 337 HE2 LYS 41 HE2 LYS 41 -3.783 -4.131 3.360 338 HE3 LYS 41 HE3 LYS 41 -4.064 -2.859 4.568 339 HZ1 LYS 41 HZ1 LYS 41 -4.834 -2.586 1.749 340 HZ2 LYS 41 HZ2 LYS 41 -5.844 -3.092 2.933 341 HZ3 LYS 41 HZ3 LYS 41 -5.190 -1.560 2.995 342 H TRP 42 H TRP 42 1.512 -0.925 1.736 343 HA TRP 42 HA TRP 42 0.557 -2.219 -0.583 344 HB2 TRP 42 HB2 TRP 42 0.854 0.064 -0.811 345 HB3 TRP 42 HB3 TRP 42 2.441 0.047 -0.052 346 HD1 TRP 42 HD1 TRP 42 1.112 -1.653 -3.350 347 HE1 TRP 42 HE1 TRP 42 2.770 -1.235 -5.170 348 HE3 TRP 42 HE3 TRP 42 4.550 0.987 -0.645 349 HZ2 TRP 42 HZ2 TRP 42 5.459 -0.081 -5.407 350 HZ3 TRP 42 HZ3 TRP 42 6.663 1.645 -1.623 351 HH2 TRP 42 HH2 TRP 42 7.106 1.218 -4.098 352 H VAL 43 H VAL 43 4.114 -1.851 0.349 353 HA VAL 43 HA VAL 43 4.995 -3.590 -1.609 354 HB VAL 43 HB VAL 43 6.165 -3.013 1.144 355 HG11 VAL 43 HG11 VAL 43 7.581 -4.324 -1.214 356 HG12 VAL 43 HG12 VAL 43 8.367 -3.714 0.247 357 HG13 VAL 43 HG13 VAL 43 7.246 -5.069 0.364 358 HG21 VAL 43 HG21 VAL 43 7.682 -1.498 -0.145 359 HG22 VAL 43 HG22 VAL 43 6.785 -1.890 -1.633 360 HG23 VAL 43 HG23 VAL 43 5.997 -1.038 -0.298 361 H PHE 44 H PHE 44 3.595 -4.472 1.539 362 HA PHE 44 HA PHE 44 4.277 -7.197 1.487 363 HB2 PHE 44 HB2 PHE 44 2.337 -5.484 2.978 364 HB3 PHE 44 HB3 PHE 44 1.976 -7.157 2.900 365 HD1 PHE 44 HD1 PHE 44 5.173 -5.152 3.443 366 HD2 PHE 44 HD2 PHE 44 2.667 -8.419 4.744 367 HE1 PHE 44 HE1 PHE 44 6.723 -5.599 5.308 368 HE2 PHE 44 HE2 PHE 44 4.249 -8.888 6.579 369 HZ PHE 44 HZ PHE 44 6.281 -7.489 6.873 370 H ASP 45 H ASP 45 1.143 -5.704 0.747 371 HA ASP 45 HA ASP 45 0.053 -8.104 -0.374 372 HB2 ASP 45 HB2 ASP 45 -0.857 -5.253 -0.291 373 HB3 ASP 45 HB3 ASP 45 -1.590 -6.294 -1.493 374 H GLU 46 H GLU 46 1.666 -5.393 -1.926 375 HA GLU 46 HA GLU 46 0.935 -6.094 -4.625 376 HB2 GLU 46 HB2 GLU 46 1.556 -3.815 -3.696 377 HB3 GLU 46 HB3 GLU 46 3.218 -4.376 -3.562 378 HG2 GLU 46 HG2 GLU 46 3.159 -3.122 -5.537 379 HG3 GLU 46 HG3 GLU 46 3.119 -4.779 -6.086 380 H PHE 47 H PHE 47 3.630 -7.035 -2.437 381 HA PHE 47 HA PHE 47 4.739 -8.643 -4.671 382 HB2 PHE 47 HB2 PHE 47 6.573 -7.100 -2.863 383 HB3 PHE 47 HB3 PHE 47 6.887 -7.966 -4.367 384 HD1 PHE 47 HD1 PHE 47 5.823 -7.011 -6.563 385 HD2 PHE 47 HD2 PHE 47 6.225 -4.793 -2.906 386 HE1 PHE 47 HE1 PHE 47 5.601 -4.888 -7.822 387 HE2 PHE 47 HE2 PHE 47 5.960 -2.657 -4.155 388 HZ PHE 47 HZ PHE 47 5.669 -2.709 -6.622 389 H LEU 48 H LEU 48 5.150 -8.041 -1.103 390 HA LEU 48 HA LEU 48 6.573 -10.496 -0.779 391 HB2 LEU 48 HB2 LEU 48 4.936 -9.056 1.332 392 HB3 LEU 48 HB3 LEU 48 6.168 -10.278 1.621 393 HG LEU 48 HG LEU 48 6.610 -7.480 0.523 394 HD11 LEU 48 HD11 LEU 48 7.860 -8.776 2.963 395 HD12 LEU 48 HD12 LEU 48 7.818 -7.059 2.519 396 HD13 LEU 48 HD13 LEU 48 6.333 -7.892 3.024 397 HD21 LEU 48 HD21 LEU 48 8.636 -9.745 0.759 398 HD22 LEU 48 HD22 LEU 48 8.157 -8.883 -0.722 399 HD23 LEU 48 HD23 LEU 48 9.052 -8.035 0.541 400 H ASN 49 H ASN 49 3.171 -9.781 -0.074 401 HA ASN 49 HA ASN 49 2.355 -12.485 0.519 402 HB2 ASN 49 HB2 ASN 49 0.692 -10.092 -0.359 403 HB3 ASN 49 HB3 ASN 49 0.081 -11.564 0.375 404 HD21 ASN 49 HD21 ASN 49 -0.489 -8.946 1.453 405 HD22 ASN 49 HD22 ASN 49 0.131 -9.025 3.068 406 H LYS 50 H LYS 50 3.024 -10.807 -2.443 407 HA LYS 50 HA LYS 50 1.389 -12.525 -4.163 408 HB2 LYS 50 HB2 LYS 50 3.191 -10.207 -4.488 409 HB3 LYS 50 HB3 LYS 50 3.561 -11.440 -5.662 410 HG2 LYS 50 HG2 LYS 50 0.870 -11.351 -5.986 411 HG3 LYS 50 HG3 LYS 50 1.132 -9.776 -5.196 412 HD2 LYS 50 HD2 LYS 50 3.030 -9.506 -7.002 413 HD3 LYS 50 HD3 LYS 50 2.071 -10.720 -7.884 414 HE2 LYS 50 HE2 LYS 50 0.058 -9.188 -7.532 415 HE3 LYS 50 HE3 LYS 50 1.160 -8.014 -6.791 416 HZ1 LYS 50 HZ1 LYS 50 1.085 -7.359 -8.998 417 HZ2 LYS 50 HZ2 LYS 50 2.448 -8.270 -8.961 418 HZ3 LYS 50 HZ3 LYS 50 1.076 -8.910 -9.579 419 H GLY 51 H GLY 51 4.549 -12.583 -2.635 420 HA2 GLY 51 HA2 GLY 51 5.466 -14.862 -2.344 421 HA3 GLY 51 HA3 GLY 51 5.285 -15.093 -4.079 422 H TYR 52 H TYR 52 6.320 -11.838 -3.496 423 HA TYR 52 HA TYR 52 8.935 -12.485 -4.590 424 HB2 TYR 52 HB2 TYR 52 7.641 -9.911 -3.646 425 HB3 TYR 52 HB3 TYR 52 9.289 -9.980 -4.218 426 HD1 TYR 52 HD1 TYR 52 5.754 -10.610 -5.346 427 HD2 TYR 52 HD2 TYR 52 9.852 -10.018 -6.498 428 HE1 TYR 52 HE1 TYR 52 5.019 -10.390 -7.628 429 HE2 TYR 52 HE2 TYR 52 9.189 -9.923 -8.862 430 HH TYR 52 HH TYR 52 7.413 -10.050 -10.360 431 H ASN 53 H ASN 53 10.904 -11.788 -3.622 432 HA ASN 53 HA ASN 53 11.052 -11.669 -0.668 433 HB2 ASN 53 HB2 ASN 53 11.997 -13.871 -2.448 434 HB3 ASN 53 HB3 ASN 53 13.158 -13.309 -1.260 435 HD21 ASN 53 HD21 ASN 53 12.114 -12.998 1.134 436 HD22 ASN 53 HD22 ASN 53 11.226 -14.477 1.524 437 H LYS 54 H LYS 54 11.982 -10.418 -3.701 438 HA LYS 54 HA LYS 54 14.357 -9.110 -2.481 439 HB2 LYS 54 HB2 LYS 54 13.949 -10.351 -5.204 440 HB3 LYS 54 HB3 LYS 54 15.152 -9.126 -4.898 441 HG2 LYS 54 HG2 LYS 54 16.600 -10.498 -3.920 442 HG3 LYS 54 HG3 LYS 54 15.383 -11.194 -2.853 443 HD2 LYS 54 HD2 LYS 54 15.704 -11.964 -5.786 444 HD3 LYS 54 HD3 LYS 54 16.447 -12.841 -4.436 445 HE2 LYS 54 HE2 LYS 54 14.308 -13.395 -3.471 446 HE3 LYS 54 HE3 LYS 54 13.459 -12.314 -4.569 447 HZ1 LYS 54 HZ1 LYS 54 14.116 -13.727 -6.422 448 HZ2 LYS 54 HZ2 LYS 54 14.943 -14.719 -5.388 449 HZ3 LYS 54 HZ3 LYS 54 13.307 -14.612 -5.295 450 H ILE 55 H ILE 55 14.362 -6.968 -2.619 451 HA ILE 55 HA ILE 55 12.654 -5.453 -4.489 452 HB ILE 55 HB ILE 55 12.505 -5.426 -1.450 453 HG12 ILE 55 HG12 ILE 55 10.054 -4.818 -2.988 454 HG13 ILE 55 HG13 ILE 55 10.739 -6.362 -3.479 455 HG21 ILE 55 HG21 ILE 55 11.752 -3.200 -3.340 456 HG22 ILE 55 HG22 ILE 55 11.198 -3.287 -1.648 457 HG23 ILE 55 HG23 ILE 55 12.914 -3.080 -1.995 458 HD11 ILE 55 HD11 ILE 55 10.704 -7.196 -1.198 459 HD12 ILE 55 HD12 ILE 55 10.072 -5.631 -0.616 460 HD13 ILE 55 HD13 ILE 55 9.096 -6.648 -1.702 461 H PHE 56 H PHE 56 13.631 -3.369 -4.886 462 HA PHE 56 HA PHE 56 15.983 -2.636 -3.273 463 HB2 PHE 56 HB2 PHE 56 15.710 -2.286 -6.282 464 HB3 PHE 56 HB3 PHE 56 17.040 -1.673 -5.301 465 HD1 PHE 56 HD1 PHE 56 17.582 -3.980 -3.488 466 HD2 PHE 56 HD2 PHE 56 16.687 -3.876 -7.719 467 HE1 PHE 56 HE1 PHE 56 18.882 -6.036 -3.831 468 HE2 PHE 56 HE2 PHE 56 17.916 -5.959 -8.050 469 HZ PHE 56 HZ PHE 56 19.041 -7.071 -6.095 470 H LEU 57 H LEU 57 16.365 -0.369 -3.101 471 HA LEU 57 HA LEU 57 14.082 1.391 -4.010 472 HB2 LEU 57 HB2 LEU 57 14.113 0.868 -1.553 473 HB3 LEU 57 HB3 LEU 57 15.755 1.505 -1.473 474 HG LEU 57 HG LEU 57 14.892 3.758 -2.136 475 HD11 LEU 57 HD11 LEU 57 12.791 3.010 -3.244 476 HD12 LEU 57 HD12 LEU 57 12.170 2.434 -1.688 477 HD13 LEU 57 HD13 LEU 57 12.462 4.163 -1.942 478 HD21 LEU 57 HD21 LEU 57 13.559 2.539 0.334 479 HD22 LEU 57 HD22 LEU 57 15.248 3.062 0.267 480 HD23 LEU 57 HD23 LEU 57 13.955 4.253 0.081 481 H VAL 58 H VAL 58 14.957 2.839 -5.785 482 HA VAL 58 HA VAL 58 17.861 3.380 -5.504 483 HB VAL 58 HB VAL 58 15.790 4.074 -7.553 484 HG11 VAL 58 HG11 VAL 58 17.444 5.671 -7.733 485 HG12 VAL 58 HG12 VAL 58 18.775 4.500 -7.632 486 HG13 VAL 58 HG13 VAL 58 17.711 4.549 -9.059 487 HG21 VAL 58 HG21 VAL 58 16.204 1.594 -7.416 488 HG22 VAL 58 HG22 VAL 58 16.765 2.286 -8.951 489 HG23 VAL 58 HG23 VAL 58 17.932 1.898 -7.714 490 H LEU 59 H LEU 59 18.536 5.194 -4.380 491 HA LEU 59 HA LEU 59 16.474 7.175 -3.658 492 HB2 LEU 59 HB2 LEU 59 19.208 6.471 -2.474 493 HB3 LEU 59 HB3 LEU 59 18.354 7.966 -2.093 494 HG LEU 59 HG LEU 59 16.271 6.194 -1.811 495 HD11 LEU 59 HD11 LEU 59 16.942 4.238 -0.640 496 HD12 LEU 59 HD12 LEU 59 17.809 4.243 -2.179 497 HD13 LEU 59 HD13 LEU 59 18.647 4.702 -0.682 498 HD21 LEU 59 HD21 LEU 59 16.977 7.937 -0.201 499 HD22 LEU 59 HD22 LEU 59 16.532 6.402 0.561 500 HD23 LEU 59 HD23 LEU 59 18.250 6.829 0.387 501 H SER 60 H SER 60 18.389 7.035 -6.254 502 HA SER 60 HA SER 60 20.005 9.205 -6.405 503 HB2 SER 60 HB2 SER 60 19.667 8.916 -8.887 504 HB3 SER 60 HB3 SER 60 19.872 7.401 -8.037 505 HG SER 60 HG SER 60 17.673 8.446 -9.348 506 H ASP 61 H ASP 61 16.513 9.258 -7.138 507 HA ASP 61 HA ASP 61 16.482 11.915 -8.203 508 HB2 ASP 61 HB2 ASP 61 14.777 10.047 -8.495 509 HB3 ASP 61 HB3 ASP 61 14.176 10.424 -6.876 510 H VAL 62 H VAL 62 16.511 10.703 -4.924 511 HA VAL 62 HA VAL 62 15.062 13.014 -3.809 512 HB VAL 62 HB VAL 62 16.066 10.711 -2.131 513 HG11 VAL 62 HG11 VAL 62 13.848 10.989 -1.090 514 HG12 VAL 62 HG12 VAL 62 14.667 12.550 -1.237 515 HG13 VAL 62 HG13 VAL 62 13.370 12.133 -2.365 516 HG21 VAL 62 HG21 VAL 62 13.790 10.386 -4.099 517 HG22 VAL 62 HG22 VAL 62 15.255 9.389 -4.034 518 HG23 VAL 62 HG23 VAL 62 14.093 9.302 -2.717 519 H GLU 63 H GLU 63 15.912 14.298 -2.172 520 HA GLU 63 HA GLU 63 18.806 14.393 -1.762 521 HB2 GLU 63 HB2 GLU 63 17.503 16.421 -1.567 522 HB3 GLU 63 HB3 GLU 63 16.371 15.675 -0.448 523 HG2 GLU 63 HG2 GLU 63 18.134 15.431 1.249 524 HG3 GLU 63 HG3 GLU 63 19.342 16.067 0.117 525 H SER 64 H SER 64 15.896 13.537 0.205 526 HA SER 64 HA SER 64 17.253 11.343 1.558 527 HB2 SER 64 HB2 SER 64 18.275 13.360 2.531 528 HB3 SER 64 HB3 SER 64 16.709 14.033 2.869 529 HG SER 64 HG SER 64 16.453 12.597 4.530 530 H ILE 65 H ILE 65 15.883 10.816 3.567 531 HA ILE 65 HA ILE 65 12.977 10.927 3.044 532 HB ILE 65 HB ILE 65 14.184 8.773 2.725 533 HG12 ILE 65 HG12 ILE 65 12.422 8.494 5.150 534 HG13 ILE 65 HG13 ILE 65 11.778 9.006 3.582 535 HG21 ILE 65 HG21 ILE 65 14.893 9.003 5.683 536 HG22 ILE 65 HG22 ILE 65 15.075 7.540 4.705 537 HG23 ILE 65 HG23 ILE 65 16.025 8.965 4.316 538 HD11 ILE 65 HD11 ILE 65 13.173 6.383 4.232 539 HD12 ILE 65 HD12 ILE 65 11.526 6.614 3.632 540 HD13 ILE 65 HD13 ILE 65 12.885 6.922 2.566 541 H ASP 66 H ASP 66 11.899 10.531 5.489 542 HA ASP 66 HA ASP 66 13.405 12.172 7.443 543 HB2 ASP 66 HB2 ASP 66 11.180 13.198 6.395 544 HB3 ASP 66 HB3 ASP 66 10.413 12.112 7.555 545 H SER 67 H SER 67 12.235 11.741 9.707 546 HA SER 67 HA SER 67 13.151 9.243 10.562 547 HB2 SER 67 HB2 SER 67 12.834 11.357 11.874 548 HB3 SER 67 HB3 SER 67 11.085 11.077 11.870 549 HG SER 67 HG SER 67 11.333 9.512 13.292 550 H PHE 68 H PHE 68 9.834 10.276 9.656 551 HA PHE 68 HA PHE 68 8.604 8.019 10.778 552 HB2 PHE 68 HB2 PHE 68 7.577 10.282 10.092 553 HB3 PHE 68 HB3 PHE 68 7.391 9.568 8.497 554 HD1 PHE 68 HD1 PHE 68 6.215 7.160 8.502 555 HD2 PHE 68 HD2 PHE 68 5.832 10.055 11.657 556 HE1 PHE 68 HE1 PHE 68 4.124 6.063 9.232 557 HE2 PHE 68 HE2 PHE 68 3.726 8.974 12.388 558 HZ PHE 68 HZ PHE 68 2.855 6.980 11.182 559 H SER 69 H SER 69 9.263 8.512 7.113 560 HA SER 69 HA SER 69 8.474 5.846 6.617 561 HB2 SER 69 HB2 SER 69 10.200 7.854 5.130 562 HB3 SER 69 HB3 SER 69 9.615 6.289 4.545 563 HG SER 69 HG SER 69 8.039 7.350 3.857 564 H LEU 70 H LEU 70 11.635 7.340 7.379 565 HA LEU 70 HA LEU 70 13.435 5.535 6.312 566 HB2 LEU 70 HB2 LEU 70 13.972 7.674 7.338 567 HB3 LEU 70 HB3 LEU 70 13.336 7.151 8.896 568 HG LEU 70 HG LEU 70 15.271 5.580 9.126 569 HD11 LEU 70 HD11 LEU 70 16.330 7.089 6.680 570 HD12 LEU 70 HD12 LEU 70 17.229 5.936 7.666 571 HD13 LEU 70 HD13 LEU 70 15.861 5.372 6.695 572 HD21 LEU 70 HD21 LEU 70 15.147 7.850 10.133 573 HD22 LEU 70 HD22 LEU 70 16.792 7.463 9.689 574 HD23 LEU 70 HD23 LEU 70 15.860 8.547 8.655 575 H GLY 71 H GLY 71 11.762 5.148 9.530 576 HA2 GLY 71 HA2 GLY 71 13.143 2.560 9.730 577 HA3 GLY 71 HA3 GLY 71 12.335 3.257 11.026 578 H VAL 72 H VAL 72 10.520 3.403 8.049 579 HA VAL 72 HA VAL 72 9.154 0.809 8.437 580 HB VAL 72 HB VAL 72 8.651 2.759 6.159 581 HG11 VAL 72 HG11 VAL 72 7.797 0.450 5.902 582 HG12 VAL 72 HG12 VAL 72 6.969 0.564 7.470 583 HG13 VAL 72 HG13 VAL 72 6.466 1.588 6.113 584 HG21 VAL 72 HG21 VAL 72 6.678 3.594 7.424 585 HG22 VAL 72 HG22 VAL 72 7.260 2.746 8.878 586 HG23 VAL 72 HG23 VAL 72 8.201 4.064 8.148 587 H ILE 73 H ILE 73 11.397 2.634 6.263 588 HA ILE 73 HA ILE 73 11.661 0.743 4.234 589 HB ILE 73 HB ILE 73 13.874 2.547 5.307 590 HG12 ILE 73 HG12 ILE 73 12.119 4.055 4.850 591 HG13 ILE 73 HG13 ILE 73 13.216 4.149 3.518 592 HG21 ILE 73 HG21 ILE 73 13.465 1.331 2.573 593 HG22 ILE 73 HG22 ILE 73 14.696 2.543 3.012 594 HG23 ILE 73 HG23 ILE 73 14.745 0.924 3.740 595 HD11 ILE 73 HD11 ILE 73 10.918 4.242 2.730 596 HD12 ILE 73 HD12 ILE 73 11.695 2.776 2.131 597 HD13 ILE 73 HD13 ILE 73 10.548 2.690 3.489 598 H VAL 74 H VAL 74 13.958 1.094 6.970 599 HA VAL 74 HA VAL 74 15.352 -1.306 6.973 600 HB VAL 74 HB VAL 74 15.460 0.695 8.566 601 HG11 VAL 74 HG11 VAL 74 14.279 0.848 10.389 602 HG12 VAL 74 HG12 VAL 74 13.169 0.612 8.994 603 HG13 VAL 74 HG13 VAL 74 13.449 -0.706 10.155 604 HG21 VAL 74 HG21 VAL 74 16.656 -1.621 8.947 605 HG22 VAL 74 HG22 VAL 74 16.200 -0.796 10.467 606 HG23 VAL 74 HG23 VAL 74 15.165 -2.098 9.818 607 H ASN 75 H ASN 75 12.216 -0.790 8.339 608 HA ASN 75 HA ASN 75 11.918 -3.200 9.636 609 HB2 ASN 75 HB2 ASN 75 10.391 -0.927 9.198 610 HB3 ASN 75 HB3 ASN 75 9.525 -2.097 8.264 611 HD21 ASN 75 HD21 ASN 75 9.406 -0.580 11.055 612 HD22 ASN 75 HD22 ASN 75 8.855 -1.814 12.152 613 H ILE 76 H ILE 76 10.922 -2.392 6.297 614 HA ILE 76 HA ILE 76 9.802 -4.854 5.544 615 HB ILE 76 HB ILE 76 11.224 -2.747 3.885 616 HG12 ILE 76 HG12 ILE 76 8.255 -3.316 4.388 617 HG13 ILE 76 HG13 ILE 76 9.140 -1.950 5.061 618 HG21 ILE 76 HG21 ILE 76 11.274 -4.865 2.677 619 HG22 ILE 76 HG22 ILE 76 9.547 -5.138 3.005 620 HG23 ILE 76 HG23 ILE 76 10.068 -3.820 1.943 621 HD11 ILE 76 HD11 ILE 76 7.864 -1.118 3.289 622 HD12 ILE 76 HD12 ILE 76 9.572 -1.075 2.788 623 HD13 ILE 76 HD13 ILE 76 8.466 -2.323 2.152 624 H LEU 77 H LEU 77 13.250 -3.872 5.818 625 HA LEU 77 HA LEU 77 14.359 -6.145 4.460 626 HB2 LEU 77 HB2 LEU 77 15.531 -3.902 5.057 627 HB3 LEU 77 HB3 LEU 77 15.618 -4.475 6.693 628 HG LEU 77 HG LEU 77 17.640 -4.657 5.401 629 HD11 LEU 77 HD11 LEU 77 16.732 -7.302 6.567 630 HD12 LEU 77 HD12 LEU 77 18.371 -6.721 6.374 631 HD13 LEU 77 HD13 LEU 77 17.285 -5.896 7.498 632 HD21 LEU 77 HD21 LEU 77 16.730 -5.558 3.273 633 HD22 LEU 77 HD22 LEU 77 17.995 -6.607 3.919 634 HD23 LEU 77 HD23 LEU 77 16.292 -7.072 4.104 635 H LYS 78 H LYS 78 13.733 -5.358 7.872 636 HA LYS 78 HA LYS 78 14.832 -7.727 8.955 637 HB2 LYS 78 HB2 LYS 78 12.535 -6.026 10.053 638 HB3 LYS 78 HB3 LYS 78 13.477 -7.216 10.962 639 HG2 LYS 78 HG2 LYS 78 15.537 -5.948 10.456 640 HG3 LYS 78 HG3 LYS 78 14.587 -4.706 9.630 641 HD2 LYS 78 HD2 LYS 78 13.548 -3.986 11.562 642 HD3 LYS 78 HD3 LYS 78 13.845 -5.463 12.476 643 HE2 LYS 78 HE2 LYS 78 16.002 -3.510 11.616 644 HE3 LYS 78 HE3 LYS 78 15.177 -3.482 13.178 645 HZ1 LYS 78 HZ1 LYS 78 17.190 -4.614 13.481 646 HZ2 LYS 78 HZ2 LYS 78 16.013 -5.755 13.554 647 HZ3 LYS 78 HZ3 LYS 78 16.945 -5.641 12.218 648 H SER 79 H SER 79 11.498 -7.097 7.855 649 HA SER 79 HA SER 79 10.457 -9.688 8.496 650 HB2 SER 79 HB2 SER 79 8.989 -8.889 6.301 651 HB3 SER 79 HB3 SER 79 8.665 -8.482 7.996 652 HG SER 79 HG SER 79 10.129 -6.902 6.158 653 H ILE 80 H ILE 80 11.979 -8.400 5.500 654 HA ILE 80 HA ILE 80 11.657 -10.792 4.021 655 HB ILE 80 HB ILE 80 13.358 -8.288 3.800 656 HG12 ILE 80 HG12 ILE 80 11.118 -9.453 2.071 657 HG13 ILE 80 HG13 ILE 80 10.901 -8.215 3.304 658 HG21 ILE 80 HG21 ILE 80 13.388 -10.534 1.778 659 HG22 ILE 80 HG22 ILE 80 14.181 -8.954 1.601 660 HG23 ILE 80 HG23 ILE 80 14.747 -10.052 2.836 661 HD11 ILE 80 HD11 ILE 80 11.013 -7.041 1.259 662 HD12 ILE 80 HD12 ILE 80 12.606 -6.804 2.004 663 HD13 ILE 80 HD13 ILE 80 12.400 -7.988 0.685 664 H SER 81 H SER 81 14.353 -9.683 6.114 665 HA SER 81 HA SER 81 16.118 -11.880 5.671 666 HB2 SER 81 HB2 SER 81 15.620 -9.822 7.828 667 HB3 SER 81 HB3 SER 81 16.710 -11.188 8.176 668 HG SER 81 HG SER 81 18.089 -10.527 6.749 669 H SER 82 H SER 82 13.565 -11.412 8.207 670 HA SER 82 HA SER 82 13.800 -14.025 9.302 671 HB2 SER 82 HB2 SER 82 11.580 -11.978 9.228 672 HB3 SER 82 HB3 SER 82 11.554 -13.441 10.235 673 HG SER 82 HG SER 82 13.911 -12.372 10.679 674 H SER 83 H SER 83 12.091 -12.899 6.436 675 HA SER 83 HA SER 83 10.500 -15.296 6.084 676 HB2 SER 83 HB2 SER 83 11.385 -13.187 4.069 677 HB3 SER 83 HB3 SER 83 10.177 -14.442 3.807 678 HG SER 83 HG SER 83 10.072 -12.459 5.875 679 H GLY 84 H GLY 84 13.584 -14.079 4.632 680 HA2 GLY 84 HA2 GLY 84 15.239 -15.956 3.999 681 HA3 GLY 84 HA3 GLY 84 13.805 -16.701 3.269 682 H GLY 85 H GLY 85 14.532 -13.129 3.072 683 HA2 GLY 85 HA2 GLY 85 15.203 -13.519 0.225 684 HA3 GLY 85 HA3 GLY 85 13.956 -12.382 0.732 685 H PHE 86 H PHE 86 15.469 -10.893 -0.425 686 HA PHE 86 HA PHE 86 17.642 -9.771 1.273 687 HB2 PHE 86 HB2 PHE 86 17.844 -11.059 -1.441 688 HB3 PHE 86 HB3 PHE 86 18.748 -9.617 -1.169 689 HD1 PHE 86 HD1 PHE 86 20.708 -9.630 0.599 690 HD2 PHE 86 HD2 PHE 86 18.349 -13.154 -0.347 691 HE1 PHE 86 HE1 PHE 86 22.176 -11.039 1.967 692 HE2 PHE 86 HE2 PHE 86 19.959 -14.552 0.892 693 HZ PHE 86 HZ PHE 86 21.852 -13.483 2.107 694 H PHE 87 H PHE 87 17.237 -7.564 1.444 695 HA PHE 87 HA PHE 87 16.241 -6.175 -0.979 696 HB2 PHE 87 HB2 PHE 87 14.307 -5.970 0.194 697 HB3 PHE 87 HB3 PHE 87 15.073 -6.110 1.757 698 HD1 PHE 87 HD1 PHE 87 15.262 -3.537 -1.107 699 HD2 PHE 87 HD2 PHE 87 14.772 -4.285 3.112 700 HE1 PHE 87 HE1 PHE 87 14.955 -1.153 -0.702 701 HE2 PHE 87 HE2 PHE 87 14.546 -1.850 3.543 702 HZ PHE 87 HZ PHE 87 14.611 -0.282 1.576 703 H ALA 88 H ALA 88 17.139 -4.110 -1.358 704 HA ALA 88 HA ALA 88 19.289 -3.181 0.344 705 HB1 ALA 88 HB1 ALA 88 19.773 -4.209 -2.466 706 HB2 ALA 88 HB2 ALA 88 20.963 -3.441 -1.382 707 HB3 ALA 88 HB3 ALA 88 20.279 -5.039 -0.997 708 H LEU 89 H LEU 89 20.431 -1.287 -0.892 709 HA LEU 89 HA LEU 89 18.318 0.329 -2.250 710 HB2 LEU 89 HB2 LEU 89 20.448 1.591 -0.557 711 HB3 LEU 89 HB3 LEU 89 18.892 2.221 -1.078 712 HG LEU 89 HG LEU 89 19.547 0.383 1.205 713 HD11 LEU 89 HD11 LEU 89 17.703 2.799 1.088 714 HD12 LEU 89 HD12 LEU 89 18.357 1.980 2.533 715 HD13 LEU 89 HD13 LEU 89 19.430 2.902 1.459 716 HD21 LEU 89 HD21 LEU 89 16.871 0.420 1.473 717 HD22 LEU 89 HD22 LEU 89 17.043 0.266 -0.305 718 HD23 LEU 89 HD23 LEU 89 17.821 -0.889 0.767 719 H VAL 90 H VAL 90 19.282 2.199 -3.512 720 HA VAL 90 HA VAL 90 21.898 1.528 -4.732 721 HB VAL 90 HB VAL 90 19.197 1.694 -6.084 722 HG11 VAL 90 HG11 VAL 90 21.876 1.625 -7.492 723 HG12 VAL 90 HG12 VAL 90 20.296 1.370 -8.279 724 HG13 VAL 90 HG13 VAL 90 20.667 2.928 -7.564 725 HG21 VAL 90 HG21 VAL 90 21.182 -0.495 -5.652 726 HG22 VAL 90 HG22 VAL 90 19.399 -0.471 -5.471 727 HG23 VAL 90 HG23 VAL 90 20.171 -0.574 -7.067 728 H SER 91 H SER 91 22.951 3.294 -5.623 729 HA SER 91 HA SER 91 23.584 5.430 -5.831 730 HB2 SER 91 HB2 SER 91 21.393 5.050 -7.379 731 HB3 SER 91 HB3 SER 91 20.808 6.389 -6.407 732 HG SER 91 HG SER 91 22.591 7.591 -7.108 733 HA PRO 92 HA PRO 92 21.849 6.713 -1.653 734 HB2 PRO 92 HB2 PRO 92 23.773 5.913 0.059 735 HB3 PRO 92 HB3 PRO 92 22.533 4.803 -0.563 736 HG2 PRO 92 HG2 PRO 92 25.395 5.197 -1.571 737 HG3 PRO 92 HG3 PRO 92 24.581 3.644 -1.251 738 HD2 PRO 92 HD2 PRO 92 24.746 4.749 -3.746 739 HD3 PRO 92 HD3 PRO 92 23.404 3.700 -3.194 740 H ASN 93 H ASN 93 22.281 8.665 -2.949 741 HA ASN 93 HA ASN 93 24.718 10.065 -2.987 742 HB2 ASN 93 HB2 ASN 93 23.005 12.147 -2.584 743 HB3 ASN 93 HB3 ASN 93 23.255 11.344 -4.133 744 HD21 ASN 93 HD21 ASN 93 20.881 11.855 -1.501 745 HD22 ASN 93 HD22 ASN 93 19.607 11.156 -2.478 746 H GLU 94 H GLU 94 25.724 11.499 -1.605 747 HA GLU 94 HA GLU 94 26.318 10.298 0.698 748 HB2 GLU 94 HB2 GLU 94 27.652 12.001 -0.568 749 HB3 GLU 94 HB3 GLU 94 26.702 13.282 0.198 750 HG2 GLU 94 HG2 GLU 94 27.426 12.284 2.438 751 HG3 GLU 94 HG3 GLU 94 28.566 11.282 1.550 752 H LYS 95 H LYS 95 23.930 12.865 0.460 753 HA LYS 95 HA LYS 95 23.731 13.682 3.179 754 HB2 LYS 95 HB2 LYS 95 22.585 15.083 1.669 755 HB3 LYS 95 HB3 LYS 95 21.986 13.731 0.709 756 HG2 LYS 95 HG2 LYS 95 20.167 14.774 1.796 757 HG3 LYS 95 HG3 LYS 95 20.358 13.164 2.432 758 HD2 LYS 95 HD2 LYS 95 21.846 14.901 4.173 759 HD3 LYS 95 HD3 LYS 95 20.340 15.728 3.742 760 HE2 LYS 95 HE2 LYS 95 19.524 13.169 4.290 761 HE3 LYS 95 HE3 LYS 95 20.765 13.439 5.513 762 HZ1 LYS 95 HZ1 LYS 95 18.392 15.156 5.008 763 HZ2 LYS 95 HZ2 LYS 95 18.578 14.152 6.291 764 HZ3 LYS 95 HZ3 LYS 95 19.524 15.496 6.120 765 H VAL 96 H VAL 96 22.367 10.883 1.355 766 HA VAL 96 HA VAL 96 20.685 10.336 3.645 767 HB VAL 96 HB VAL 96 20.403 10.000 0.974 768 HG11 VAL 96 HG11 VAL 96 20.940 7.148 1.849 769 HG12 VAL 96 HG12 VAL 96 20.377 7.726 0.260 770 HG13 VAL 96 HG13 VAL 96 22.005 8.121 0.809 771 HG21 VAL 96 HG21 VAL 96 18.972 8.248 3.000 772 HG22 VAL 96 HG22 VAL 96 18.674 9.989 2.792 773 HG23 VAL 96 HG23 VAL 96 18.346 8.888 1.459 774 H GLU 97 H GLU 97 23.794 9.249 2.388 775 HA GLU 97 HA GLU 97 24.003 6.960 4.131 776 HB2 GLU 97 HB2 GLU 97 26.208 8.682 2.933 777 HB3 GLU 97 HB3 GLU 97 26.465 7.210 3.884 778 HG2 GLU 97 HG2 GLU 97 24.809 6.088 2.196 779 HG3 GLU 97 HG3 GLU 97 25.162 7.484 1.173 780 H ARG 98 H ARG 98 24.288 10.426 4.689 781 HA ARG 98 HA ARG 98 25.573 10.251 7.212 782 HB2 ARG 98 HB2 ARG 98 25.282 12.452 7.471 783 HB3 ARG 98 HB3 ARG 98 24.950 12.349 5.753 784 HG2 ARG 98 HG2 ARG 98 23.154 13.618 6.323 785 HG3 ARG 98 HG3 ARG 98 22.463 12.035 6.607 786 HD2 ARG 98 HD2 ARG 98 21.833 13.092 8.556 787 HD3 ARG 98 HD3 ARG 98 23.342 12.291 9.035 788 HE ARG 98 HE ARG 98 24.448 14.309 9.106 789 HH11 ARG 98 HH11 ARG 98 21.059 15.146 8.397 790 HH12 ARG 98 HH12 ARG 98 21.462 16.627 7.616 791 HH21 ARG 98 HH21 ARG 98 24.958 16.254 8.020 792 HH22 ARG 98 HH22 ARG 98 23.693 17.413 7.716 793 H VAL 99 H VAL 99 22.194 9.762 6.276 794 HA VAL 99 HA VAL 99 21.444 9.791 9.129 795 HB VAL 99 HB VAL 99 20.181 11.095 7.393 796 HG11 VAL 99 HG11 VAL 99 18.938 8.512 6.509 797 HG12 VAL 99 HG12 VAL 99 18.437 10.156 6.086 798 HG13 VAL 99 HG13 VAL 99 20.003 9.579 5.542 799 HG21 VAL 99 HG21 VAL 99 19.293 10.348 9.662 800 HG22 VAL 99 HG22 VAL 99 18.026 10.626 8.450 801 HG23 VAL 99 HG23 VAL 99 18.525 8.976 8.857 802 H LEU 100 H LEU 100 21.571 7.604 6.309 803 HA LEU 100 HA LEU 100 20.571 5.297 7.567 804 HB2 LEU 100 HB2 LEU 100 22.493 5.777 5.286 805 HB3 LEU 100 HB3 LEU 100 22.121 4.162 5.790 806 HG LEU 100 HG LEU 100 20.881 5.444 3.798 807 HD11 LEU 100 HD11 LEU 100 19.098 3.626 5.433 808 HD12 LEU 100 HD12 LEU 100 19.286 3.769 3.692 809 HD13 LEU 100 HD13 LEU 100 20.566 2.985 4.629 810 HD21 LEU 100 HD21 LEU 100 19.712 7.142 5.040 811 HD22 LEU 100 HD22 LEU 100 18.539 6.001 4.404 812 HD23 LEU 100 HD23 LEU 100 18.979 5.909 6.119 813 H SER 101 H SER 101 23.746 6.903 8.016 814 HA SER 101 HA SER 101 24.889 4.495 9.250 815 HB2 SER 101 HB2 SER 101 26.401 6.057 8.209 816 HB3 SER 101 HB3 SER 101 25.702 7.427 9.095 817 HG SER 101 HG SER 101 27.087 5.199 10.210 818 H LEU 102 H LEU 102 23.606 7.669 10.278 819 HA LEU 102 HA LEU 102 23.967 7.379 13.043 820 HB2 LEU 102 HB2 LEU 102 22.077 9.021 11.333 821 HB3 LEU 102 HB3 LEU 102 22.080 9.183 13.073 822 HG LEU 102 HG LEU 102 24.586 9.555 11.374 823 HD11 LEU 102 HD11 LEU 102 24.193 11.946 11.596 824 HD12 LEU 102 HD12 LEU 102 22.844 11.139 10.783 825 HD13 LEU 102 HD13 LEU 102 22.659 11.646 12.471 826 HD21 LEU 102 HD21 LEU 102 25.319 9.088 13.535 827 HD22 LEU 102 HD22 LEU 102 25.289 10.845 13.501 828 HD23 LEU 102 HD23 LEU 102 23.991 9.907 14.324 829 H THR 103 H THR 103 20.965 6.674 11.140 830 HA THR 103 HA THR 103 19.617 5.828 13.575 831 HB THR 103 HB THR 103 18.321 6.950 11.945 832 HG1 THR 103 HG1 THR 103 17.140 5.301 12.936 833 HG21 THR 103 HG21 THR 103 19.652 5.203 9.983 834 HG22 THR 103 HG22 THR 103 17.902 5.387 9.726 835 HG23 THR 103 HG23 THR 103 18.908 6.808 9.812 836 H ASN 104 H ASN 104 21.987 4.345 11.750 837 HA ASN 104 HA ASN 104 22.861 2.300 11.623 838 HB2 ASN 104 HB2 ASN 104 20.859 1.337 13.714 839 HB3 ASN 104 HB3 ASN 104 22.168 0.432 13.055 840 HD21 ASN 104 HD21 ASN 104 22.677 3.945 13.973 841 HD22 ASN 104 HD22 ASN 104 23.626 3.523 15.361 842 H LEU 105 H LEU 105 21.912 2.598 9.505 843 HA LEU 105 HA LEU 105 19.608 0.803 8.889 844 HB2 LEU 105 HB2 LEU 105 19.857 3.557 8.648 845 HB3 LEU 105 HB3 LEU 105 20.162 2.963 7.063 846 HG LEU 105 HG LEU 105 17.831 3.551 7.322 847 HD11 LEU 105 HD11 LEU 105 18.122 1.430 5.990 848 HD12 LEU 105 HD12 LEU 105 17.782 0.518 7.485 849 HD13 LEU 105 HD13 LEU 105 16.539 1.573 6.821 850 HD21 LEU 105 HD21 LEU 105 17.907 3.245 9.845 851 HD22 LEU 105 HD22 LEU 105 16.403 2.839 9.013 852 HD23 LEU 105 HD23 LEU 105 17.517 1.555 9.573 853 H ASP 106 H ASP 106 22.634 2.281 7.455 854 HA ASP 106 HA ASP 106 22.865 0.418 5.277 855 HB2 ASP 106 HB2 ASP 106 24.950 1.385 4.921 856 HB3 ASP 106 HB3 ASP 106 24.098 2.689 5.741 857 H ARG 107 H ARG 107 23.674 0.348 8.620 858 HA ARG 107 HA ARG 107 25.377 -1.938 8.590 859 HB2 ARG 107 HB2 ARG 107 23.792 -1.147 11.038 860 HB3 ARG 107 HB3 ARG 107 25.445 -1.765 10.921 861 HG2 ARG 107 HG2 ARG 107 25.979 0.465 9.705 862 HG3 ARG 107 HG3 ARG 107 24.409 1.023 10.296 863 HD2 ARG 107 HD2 ARG 107 26.963 0.533 11.726 864 HD3 ARG 107 HD3 ARG 107 25.811 1.870 11.872 865 HE ARG 107 HE ARG 107 24.495 -0.387 12.899 866 HH11 ARG 107 HH11 ARG 107 27.448 1.437 13.688 867 HH12 ARG 107 HH12 ARG 107 27.743 0.491 15.133 868 HH21 ARG 107 HH21 ARG 107 24.682 -1.270 14.894 869 HH22 ARG 107 HH22 ARG 107 26.043 -0.952 15.936 870 H ILE 108 H ILE 108 22.096 -1.787 7.964 871 HA ILE 108 HA ILE 108 21.508 -4.475 9.073 872 HB ILE 108 HB ILE 108 19.684 -2.042 9.109 873 HG12 ILE 108 HG12 ILE 108 21.549 -3.220 11.206 874 HG13 ILE 108 HG13 ILE 108 21.399 -1.545 10.645 875 HG21 ILE 108 HG21 ILE 108 18.530 -4.265 9.010 876 HG22 ILE 108 HG22 ILE 108 19.392 -4.733 10.499 877 HG23 ILE 108 HG23 ILE 108 18.233 -3.380 10.508 878 HD11 ILE 108 HD11 ILE 108 19.570 -3.068 12.515 879 HD12 ILE 108 HD12 ILE 108 20.493 -1.587 12.827 880 HD13 ILE 108 HD13 ILE 108 19.090 -1.544 11.736 881 H VAL 109 H VAL 109 20.957 -2.045 6.471 882 HA VAL 109 HA VAL 109 19.798 -4.168 4.780 883 HB VAL 109 HB VAL 109 19.718 -1.210 4.183 884 HG11 VAL 109 HG11 VAL 109 19.051 -2.700 2.419 885 HG12 VAL 109 HG12 VAL 109 17.843 -3.482 3.457 886 HG13 VAL 109 HG13 VAL 109 17.650 -1.787 2.978 887 HG21 VAL 109 HG21 VAL 109 17.455 -0.979 5.175 888 HG22 VAL 109 HG22 VAL 109 17.595 -2.582 5.910 889 HG23 VAL 109 HG23 VAL 109 18.670 -1.278 6.418 890 H LYS 110 H LYS 110 20.674 -4.297 2.633 891 HA LYS 110 HA LYS 110 23.518 -3.640 2.336 892 HB2 LYS 110 HB2 LYS 110 21.431 -5.116 0.837 893 HB3 LYS 110 HB3 LYS 110 22.921 -4.694 0.007 894 HG2 LYS 110 HG2 LYS 110 23.342 -5.823 2.739 895 HG3 LYS 110 HG3 LYS 110 22.620 -6.925 1.561 896 HD2 LYS 110 HD2 LYS 110 25.050 -7.132 1.655 897 HD3 LYS 110 HD3 LYS 110 24.425 -6.718 0.094 898 HE2 LYS 110 HE2 LYS 110 26.433 -5.581 0.340 899 HE3 LYS 110 HE3 LYS 110 25.167 -4.377 0.304 900 HZ1 LYS 110 HZ1 LYS 110 27.093 -4.246 1.946 901 HZ2 LYS 110 HZ2 LYS 110 25.636 -3.828 2.534 902 HZ3 LYS 110 HZ3 LYS 110 26.275 -5.300 2.898 903 H ILE 111 H ILE 111 24.296 -2.473 0.409 904 HA ILE 111 HA ILE 111 22.475 -0.496 -0.697 905 HB ILE 111 HB ILE 111 23.758 0.093 1.645 906 HG12 ILE 111 HG12 ILE 111 23.934 2.599 0.491 907 HG13 ILE 111 HG13 ILE 111 22.705 1.812 -0.500 908 HG21 ILE 111 HG21 ILE 111 25.741 1.124 -0.388 909 HG22 ILE 111 HG22 ILE 111 25.748 1.399 1.366 910 HG23 ILE 111 HG23 ILE 111 26.008 -0.238 0.734 911 HD11 ILE 111 HD11 ILE 111 22.798 2.128 2.546 912 HD12 ILE 111 HD12 ILE 111 21.709 2.963 1.425 913 HD13 ILE 111 HD13 ILE 111 21.546 1.205 1.697 914 H TYR 112 H TYR 112 23.264 0.206 -2.802 915 HA TYR 112 HA TYR 112 25.842 -0.881 -3.792 916 HB2 TYR 112 HB2 TYR 112 23.047 -1.414 -4.880 917 HB3 TYR 112 HB3 TYR 112 24.525 -1.823 -5.727 918 HD1 TYR 112 HD1 TYR 112 26.095 -3.506 -4.846 919 HD2 TYR 112 HD2 TYR 112 22.254 -2.802 -3.010 920 HE1 TYR 112 HE1 TYR 112 26.183 -5.757 -3.918 921 HE2 TYR 112 HE2 TYR 112 22.305 -5.170 -2.138 922 HH TYR 112 HH TYR 112 25.152 -7.099 -2.164 923 H ASP 113 H ASP 113 26.062 -0.290 -6.207 924 HA ASP 113 HA ASP 113 25.692 2.626 -6.408 925 HB2 ASP 113 HB2 ASP 113 27.621 0.647 -7.397 926 HB3 ASP 113 HB3 ASP 113 27.049 1.668 -8.690 927 H THR 114 H THR 114 24.811 -0.331 -8.269 928 HA THR 114 HA THR 114 22.871 1.272 -9.863 929 HB THR 114 HB THR 114 23.422 -0.175 -11.765 930 HG1 THR 114 HG1 THR 114 25.824 -0.971 -10.548 931 HG21 THR 114 HG21 THR 114 24.554 2.004 -11.628 932 HG22 THR 114 HG22 THR 114 25.895 1.271 -10.717 933 HG23 THR 114 HG23 THR 114 25.587 0.786 -12.394 934 H ILE 115 H ILE 115 21.193 -0.220 -10.867 935 HA ILE 115 HA ILE 115 20.058 -2.022 -8.895 936 HB ILE 115 HB ILE 115 19.489 -1.382 -11.807 937 HG12 ILE 115 HG12 ILE 115 18.550 0.268 -10.344 938 HG13 ILE 115 HG13 ILE 115 17.239 -0.759 -10.926 939 HG21 ILE 115 HG21 ILE 115 19.017 -3.736 -11.739 940 HG22 ILE 115 HG22 ILE 115 18.182 -3.609 -10.183 941 HG23 ILE 115 HG23 ILE 115 17.470 -2.905 -11.661 942 HD11 ILE 115 HD11 ILE 115 17.483 -2.054 -8.698 943 HD12 ILE 115 HD12 ILE 115 18.399 -0.647 -8.157 944 HD13 ILE 115 HD13 ILE 115 16.732 -0.449 -8.674 945 H SER 116 H SER 116 22.276 -2.346 -11.735 946 HA SER 116 HA SER 116 21.798 -5.146 -11.809 947 HB2 SER 116 HB2 SER 116 22.523 -3.725 -13.697 948 HB3 SER 116 HB3 SER 116 24.154 -3.638 -12.991 949 HG SER 116 HG SER 116 24.242 -5.926 -13.185 950 H GLU 117 H GLU 117 24.225 -3.066 -10.147 951 HA GLU 117 HA GLU 117 25.817 -5.265 -9.207 952 HB2 GLU 117 HB2 GLU 117 25.449 -2.329 -8.592 953 HB3 GLU 117 HB3 GLU 117 26.372 -3.323 -7.461 954 HG2 GLU 117 HG2 GLU 117 27.960 -3.984 -9.054 955 HG3 GLU 117 HG3 GLU 117 26.985 -3.386 -10.413 956 H ALA 118 H ALA 118 22.602 -4.469 -8.518 957 HA ALA 118 HA ALA 118 22.860 -5.538 -5.752 958 HB1 ALA 118 HB1 ALA 118 20.753 -4.523 -5.348 959 HB2 ALA 118 HB2 ALA 118 21.793 -3.298 -6.118 960 HB3 ALA 118 HB3 ALA 118 20.523 -4.094 -7.066 961 H MET 119 H MET 119 21.165 -5.837 -8.919 962 HA MET 119 HA MET 119 19.265 -7.609 -8.184 963 HB2 MET 119 HB2 MET 119 19.873 -6.270 -10.502 964 HB3 MET 119 HB3 MET 119 20.537 -7.829 -10.944 965 HG2 MET 119 HG2 MET 119 18.188 -8.693 -9.991 966 HG3 MET 119 HG3 MET 119 17.731 -7.019 -10.301 967 HE1 MET 119 HE1 MET 119 19.639 -6.531 -13.007 968 HE2 MET 119 HE2 MET 119 18.422 -6.867 -14.248 969 HE3 MET 119 HE3 MET 119 17.979 -5.909 -12.819 970 H GLU 120 H GLU 120 22.374 -8.530 -9.667 971 HA GLU 120 HA GLU 120 21.858 -11.378 -9.064 972 HB2 GLU 120 HB2 GLU 120 23.645 -11.665 -10.746 973 HB3 GLU 120 HB3 GLU 120 22.231 -10.766 -11.357 974 HG2 GLU 120 HG2 GLU 120 23.349 -8.679 -11.266 975 HG3 GLU 120 HG3 GLU 120 24.694 -9.330 -10.339 976 H GLU 121 H GLU 121 23.001 -8.977 -7.407 977 HA GLU 121 HA GLU 121 25.417 -10.340 -6.350 978 HB2 GLU 121 HB2 GLU 121 25.118 -7.795 -7.284 979 HB3 GLU 121 HB3 GLU 121 24.682 -7.533 -5.593 980 HG2 GLU 121 HG2 GLU 121 27.021 -7.066 -5.824 981 HG3 GLU 121 HG3 GLU 121 26.888 -8.599 -4.958 982 H VAL 122 H VAL 122 22.654 -8.401 -5.138 983 HA VAL 122 HA VAL 122 22.712 -9.042 -2.439 984 HB VAL 122 HB VAL 122 21.228 -7.437 -3.935 985 HG11 VAL 122 HG11 VAL 122 19.315 -9.797 -3.600 986 HG12 VAL 122 HG12 VAL 122 18.831 -8.174 -4.000 987 HG13 VAL 122 HG13 VAL 122 19.850 -9.049 -5.137 988 HG21 VAL 122 HG21 VAL 122 21.445 -7.157 -1.648 989 HG22 VAL 122 HG22 VAL 122 19.693 -7.232 -1.947 990 HG23 VAL 122 HG23 VAL 122 20.580 -8.626 -1.278 991 H ARG 123 H ARG 123 21.503 -11.009 -5.116 992 HA ARG 123 HA ARG 123 19.956 -12.839 -3.574 993 HB2 ARG 123 HB2 ARG 123 21.432 -13.144 -6.225 994 HB3 ARG 123 HB3 ARG 123 20.481 -14.456 -5.514 995 HG2 ARG 123 HG2 ARG 123 18.497 -12.981 -5.456 996 HG3 ARG 123 HG3 ARG 123 19.391 -11.712 -6.269 997 HD2 ARG 123 HD2 ARG 123 19.545 -14.299 -7.707 998 HD3 ARG 123 HD3 ARG 123 17.874 -13.756 -7.481 999 HE ARG 123 HE ARG 123 19.245 -11.524 -8.328 1000 HH11 ARG 123 HH11 ARG 123 18.728 -14.718 -9.806 1001 HH12 ARG 123 HH12 ARG 123 19.109 -14.165 -11.408 1002 HH21 ARG 123 HH21 ARG 123 19.538 -10.788 -10.398 1003 HH22 ARG 123 HH22 ARG 123 19.511 -11.802 -11.782 1004 H ARG 124 H ARG 124 23.437 -12.553 -3.975 1005 HA ARG 124 HA ARG 124 23.859 -14.755 -2.106 1006 HB2 ARG 124 HB2 ARG 124 25.692 -15.648 -3.786 1007 HB3 ARG 124 HB3 ARG 124 24.023 -16.127 -3.873 1008 HG2 ARG 124 HG2 ARG 124 24.994 -15.729 -6.104 1009 HG3 ARG 124 HG3 ARG 124 23.589 -14.748 -5.754 1010 HD2 ARG 124 HD2 ARG 124 24.804 -13.131 -6.642 1011 HD3 ARG 124 HD3 ARG 124 25.472 -12.939 -5.041 1012 HE ARG 124 HE ARG 124 26.689 -14.262 -7.412 1013 HH11 ARG 124 HH11 ARG 124 27.314 -12.928 -4.149 1014 HH12 ARG 124 HH12 ARG 124 28.859 -12.290 -4.602 1015 HH21 ARG 124 HH21 ARG 124 28.885 -13.785 -7.816 1016 HH22 ARG 124 HH22 ARG 124 29.889 -13.191 -6.546 1017 H LYS 125 H LYS 125 24.048 -11.981 -1.748 1018 HA LYS 125 HA LYS 125 26.779 -11.207 -1.650 1019 HB2 LYS 125 HB2 LYS 125 26.028 -9.433 -0.305 1020 HB3 LYS 125 HB3 LYS 125 24.583 -9.878 -1.164 1021 HG2 LYS 125 HG2 LYS 125 23.722 -9.780 0.927 1022 HG3 LYS 125 HG3 LYS 125 24.185 -11.488 0.918 1023 HD2 LYS 125 HD2 LYS 125 26.499 -9.996 1.825 1024 HD3 LYS 125 HD3 LYS 125 25.119 -9.205 2.551 1025 HE2 LYS 125 HE2 LYS 125 25.728 -10.683 4.185 1026 HE3 LYS 125 HE3 LYS 125 24.414 -11.563 3.397 1027 HZ1 LYS 125 HZ1 LYS 125 26.563 -12.841 3.860 1028 HZ2 LYS 125 HZ2 LYS 125 26.035 -12.909 2.278 1029 HZ3 LYS 125 HZ3 LYS 125 27.253 -11.955 2.666 Start of MODEL 4 1 H1 MET 1 H1 MET 1 -11.342 -1.741 13.453 2 HA MET 1 HA MET 1 -9.115 -2.341 12.652 3 HB2 MET 1 HB2 MET 1 -9.708 -4.051 10.995 4 HB3 MET 1 HB3 MET 1 -10.764 -4.089 12.397 5 HG2 MET 1 HG2 MET 1 -11.495 -2.833 9.723 6 HG3 MET 1 HG3 MET 1 -11.925 -4.457 10.236 7 HE1 MET 1 HE1 MET 1 -14.006 -2.263 9.174 8 HE2 MET 1 HE2 MET 1 -14.376 -3.955 9.595 9 HE3 MET 1 HE3 MET 1 -15.346 -2.634 10.282 10 H GLY 2 H GLY 2 -7.490 -2.078 11.180 11 HA2 GLY 2 HA2 GLY 2 -6.509 -1.456 9.174 12 HA3 GLY 2 HA3 GLY 2 -8.033 -0.794 8.584 13 H SER 3 H SER 3 -5.609 0.561 8.292 14 HA SER 3 HA SER 3 -5.196 2.540 10.318 15 HB2 SER 3 HB2 SER 3 -3.718 3.523 8.550 16 HB3 SER 3 HB3 SER 3 -3.388 1.812 8.899 17 HG SER 3 HG SER 3 -5.022 2.793 6.826 18 H ASP 4 H ASP 4 -6.897 3.809 10.750 19 HA ASP 4 HA ASP 4 -8.588 5.251 10.616 20 HB2 ASP 4 HB2 ASP 4 -6.903 6.719 9.687 21 HB3 ASP 4 HB3 ASP 4 -7.341 6.233 8.052 22 H LYS 5 H LYS 5 -8.477 4.731 7.099 23 HA LYS 5 HA LYS 5 -11.383 4.034 7.147 24 HB2 LYS 5 HB2 LYS 5 -11.785 5.952 5.638 25 HB3 LYS 5 HB3 LYS 5 -11.115 6.438 7.192 26 HG2 LYS 5 HG2 LYS 5 -8.808 6.440 6.048 27 HG3 LYS 5 HG3 LYS 5 -9.669 6.292 4.519 28 HD2 LYS 5 HD2 LYS 5 -10.553 8.472 4.679 29 HD3 LYS 5 HD3 LYS 5 -10.349 8.527 6.450 30 HE2 LYS 5 HE2 LYS 5 -7.929 8.550 6.251 31 HE3 LYS 5 HE3 LYS 5 -8.019 8.412 4.487 32 HZ1 LYS 5 HZ1 LYS 5 -9.110 10.703 6.003 33 HZ2 LYS 5 HZ2 LYS 5 -7.614 10.662 5.344 34 HZ3 LYS 5 HZ3 LYS 5 -8.913 10.547 4.343 35 H ILE 6 H ILE 6 -9.117 2.312 6.345 36 HA ILE 6 HA ILE 6 -8.675 2.361 3.522 37 HB ILE 6 HB ILE 6 -8.479 0.103 5.552 38 HG12 ILE 6 HG12 ILE 6 -6.977 1.772 6.203 39 HG13 ILE 6 HG13 ILE 6 -6.023 0.543 5.414 40 HG21 ILE 6 HG21 ILE 6 -7.360 0.141 2.720 41 HG22 ILE 6 HG22 ILE 6 -6.926 -1.037 3.960 42 HG23 ILE 6 HG23 ILE 6 -8.580 -0.964 3.378 43 HD11 ILE 6 HD11 ILE 6 -5.162 2.673 4.674 44 HD12 ILE 6 HD12 ILE 6 -6.052 2.000 3.305 45 HD13 ILE 6 HD13 ILE 6 -6.779 3.280 4.300 46 H HIS 7 H HIS 7 -9.631 1.454 1.866 47 HA HIS 7 HA HIS 7 -11.098 -0.861 1.904 48 HB2 HIS 7 HB2 HIS 7 -13.308 -0.196 1.061 49 HB3 HIS 7 HB3 HIS 7 -13.057 0.260 2.733 50 HD1 HIS 7 HD1 HIS 7 -12.006 3.173 2.716 51 HD2 HIS 7 HD2 HIS 7 -14.633 1.560 -0.195 52 HE1 HIS 7 HE1 HIS 7 -13.078 5.139 1.516 53 H HIS 8 H HIS 8 -11.614 2.011 -0.225 54 HA HIS 8 HA HIS 8 -11.024 0.615 -2.634 55 HB2 HIS 8 HB2 HIS 8 -11.281 3.532 -1.849 56 HB3 HIS 8 HB3 HIS 8 -10.639 3.118 -3.429 57 HD1 HIS 8 HD1 HIS 8 -13.997 3.309 -1.644 58 HD2 HIS 8 HD2 HIS 8 -12.237 1.681 -5.140 59 HE1 HIS 8 HE1 HIS 8 -15.897 2.648 -3.183 60 H HIS 9 H HIS 9 -9.106 -0.209 -3.262 61 HA HIS 9 HA HIS 9 -6.676 1.428 -2.912 62 HB2 HIS 9 HB2 HIS 9 -5.436 -0.131 -1.728 63 HB3 HIS 9 HB3 HIS 9 -6.953 -0.004 -0.862 64 HD1 HIS 9 HD1 HIS 9 -4.651 -2.507 -1.277 65 HD2 HIS 9 HD2 HIS 9 -8.749 -2.221 -2.251 66 HE1 HIS 9 HE1 HIS 9 -5.518 -4.913 -1.576 67 H HIS 10 H HIS 10 -8.356 0.398 -5.244 68 HA HIS 10 HA HIS 10 -6.327 -1.107 -6.784 69 HB2 HIS 10 HB2 HIS 10 -9.148 -0.143 -7.306 70 HB3 HIS 10 HB3 HIS 10 -8.049 -0.386 -8.656 71 HD1 HIS 10 HD1 HIS 10 -6.631 -3.095 -7.862 72 HD2 HIS 10 HD2 HIS 10 -10.760 -2.196 -7.822 73 HE1 HIS 10 HE1 HIS 10 -7.837 -5.276 -8.233 74 H HIS 11 H HIS 11 -5.004 -0.163 -8.208 75 HA HIS 11 HA HIS 11 -3.630 1.435 -9.058 76 HB2 HIS 11 HB2 HIS 11 -6.274 1.567 -10.491 77 HB3 HIS 11 HB3 HIS 11 -4.945 2.598 -10.999 78 HD1 HIS 11 HD1 HIS 11 -6.178 -0.798 -11.632 79 HD2 HIS 11 HD2 HIS 11 -2.523 1.281 -11.578 80 HE1 HIS 11 HE1 HIS 11 -4.514 -2.204 -13.002 81 H HIS 12 H HIS 12 -3.126 2.709 -7.290 82 HA HIS 12 HA HIS 12 -4.305 5.436 -7.353 83 HB2 HIS 12 HB2 HIS 12 -4.663 3.670 -5.340 84 HB3 HIS 12 HB3 HIS 12 -3.134 4.369 -4.814 85 HD1 HIS 12 HD1 HIS 12 -3.330 7.333 -4.931 86 HD2 HIS 12 HD2 HIS 12 -6.773 4.900 -4.650 87 HE1 HIS 12 HE1 HIS 12 -5.211 8.837 -4.117 88 H MET 13 H MET 13 -1.952 4.276 -8.720 89 HA MET 13 HA MET 13 -0.079 5.109 -9.580 90 HB2 MET 13 HB2 MET 13 -0.508 7.342 -8.595 91 HB3 MET 13 HB3 MET 13 0.409 6.871 -7.156 92 HG2 MET 13 HG2 MET 13 1.771 6.500 -9.789 93 HG3 MET 13 HG3 MET 13 1.393 8.149 -9.360 94 HE1 MET 13 HE1 MET 13 1.810 8.364 -6.184 95 HE2 MET 13 HE2 MET 13 3.501 8.886 -6.202 96 HE3 MET 13 HE3 MET 13 2.369 9.516 -7.417 97 H PHE 14 H PHE 14 2.068 4.437 -9.526 98 HA PHE 14 HA PHE 14 2.821 2.556 -7.376 99 HB2 PHE 14 HB2 PHE 14 2.161 1.998 -10.294 100 HB3 PHE 14 HB3 PHE 14 3.196 0.947 -9.378 101 HD1 PHE 14 HD1 PHE 14 1.844 0.713 -6.719 102 HD2 PHE 14 HD2 PHE 14 0.193 0.767 -10.708 103 HE1 PHE 14 HE1 PHE 14 0.098 -0.901 -6.033 104 HE2 PHE 14 HE2 PHE 14 -1.589 -0.790 -9.988 105 HZ PHE 14 HZ PHE 14 -1.575 -1.699 -7.675 106 HA PRO 15 HA PRO 15 6.425 4.847 -9.152 107 HB2 PRO 15 HB2 PRO 15 7.612 5.708 -6.878 108 HB3 PRO 15 HB3 PRO 15 6.112 6.450 -7.487 109 HG2 PRO 15 HG2 PRO 15 6.396 4.342 -5.319 110 HG3 PRO 15 HG3 PRO 15 5.439 5.855 -5.278 111 HD2 PRO 15 HD2 PRO 15 4.396 3.372 -5.940 112 HD3 PRO 15 HD3 PRO 15 3.727 4.908 -6.552 113 H TYR 16 H TYR 16 6.684 2.377 -9.735 114 HA TYR 16 HA TYR 16 9.216 1.495 -8.643 115 HB2 TYR 16 HB2 TYR 16 8.506 -0.486 -7.514 116 HB3 TYR 16 HB3 TYR 16 7.418 0.722 -6.956 117 HD1 TYR 16 HD1 TYR 16 7.801 -2.239 -9.112 118 HD2 TYR 16 HD2 TYR 16 5.053 0.581 -7.408 119 HE1 TYR 16 HE1 TYR 16 5.902 -3.695 -9.790 120 HE2 TYR 16 HE2 TYR 16 3.191 -0.963 -7.868 121 HH TYR 16 HH TYR 16 2.519 -2.913 -9.329 122 H LYS 17 H LYS 17 9.960 -0.555 -9.753 123 HA LYS 17 HA LYS 17 8.420 -1.300 -12.153 124 HB2 LYS 17 HB2 LYS 17 10.169 -1.408 -13.654 125 HB3 LYS 17 HB3 LYS 17 10.358 0.174 -12.890 126 HG2 LYS 17 HG2 LYS 17 12.210 -0.557 -11.608 127 HG3 LYS 17 HG3 LYS 17 11.902 -2.268 -11.937 128 HD2 LYS 17 HD2 LYS 17 13.791 -1.723 -13.131 129 HD3 LYS 17 HD3 LYS 17 12.497 -1.891 -14.330 130 HE2 LYS 17 HE2 LYS 17 12.707 0.839 -13.254 131 HE3 LYS 17 HE3 LYS 17 14.262 0.284 -13.877 132 HZ1 LYS 17 HZ1 LYS 17 11.755 0.191 -15.458 133 HZ2 LYS 17 HZ2 LYS 17 12.819 1.440 -15.480 134 HZ3 LYS 17 HZ3 LYS 17 13.284 -0.070 -15.997 135 H ILE 18 H ILE 18 9.344 -3.531 -12.998 136 HA ILE 18 HA ILE 18 10.387 -5.200 -10.757 137 HB ILE 18 HB ILE 18 8.300 -5.863 -12.868 138 HG12 ILE 18 HG12 ILE 18 7.570 -4.706 -10.679 139 HG13 ILE 18 HG13 ILE 18 6.720 -6.182 -11.151 140 HG21 ILE 18 HG21 ILE 18 9.741 -7.752 -10.952 141 HG22 ILE 18 HG22 ILE 18 8.249 -8.145 -11.840 142 HG23 ILE 18 HG23 ILE 18 9.734 -7.811 -12.728 143 HD11 ILE 18 HD11 ILE 18 7.206 -5.974 -8.774 144 HD12 ILE 18 HD12 ILE 18 7.886 -7.437 -9.487 145 HD13 ILE 18 HD13 ILE 18 8.946 -6.055 -9.157 146 H VAL 19 H VAL 19 12.283 -6.334 -11.366 147 HA VAL 19 HA VAL 19 12.943 -6.533 -14.209 148 HB VAL 19 HB VAL 19 15.256 -6.484 -13.446 149 HG11 VAL 19 HG11 VAL 19 14.242 -4.356 -14.217 150 HG12 VAL 19 HG12 VAL 19 13.820 -3.974 -12.533 151 HG13 VAL 19 HG13 VAL 19 15.521 -4.093 -13.028 152 HG21 VAL 19 HG21 VAL 19 14.263 -5.624 -10.727 153 HG22 VAL 19 HG22 VAL 19 14.968 -7.216 -11.099 154 HG23 VAL 19 HG23 VAL 19 15.943 -5.756 -11.223 155 H ASP 20 H ASP 20 14.874 -8.403 -13.917 156 HA ASP 20 HA ASP 20 14.030 -10.713 -14.435 157 HB2 ASP 20 HB2 ASP 20 16.386 -10.247 -14.163 158 HB3 ASP 20 HB3 ASP 20 16.232 -10.204 -12.402 159 H ASP 21 H ASP 21 14.602 -10.323 -10.884 160 HA ASP 21 HA ASP 21 11.867 -11.167 -10.487 161 HB2 ASP 21 HB2 ASP 21 12.033 -13.123 -9.560 162 HB3 ASP 21 HB3 ASP 21 13.565 -13.278 -10.400 163 H VAL 22 H VAL 22 13.465 -8.743 -10.129 164 HA VAL 22 HA VAL 22 13.308 -8.455 -7.160 165 HB VAL 22 HB VAL 22 15.351 -6.847 -8.762 166 HG11 VAL 22 HG11 VAL 22 16.185 -6.668 -6.320 167 HG12 VAL 22 HG12 VAL 22 14.787 -5.699 -6.794 168 HG13 VAL 22 HG13 VAL 22 14.595 -7.190 -5.866 169 HG21 VAL 22 HG21 VAL 22 17.026 -8.352 -7.658 170 HG22 VAL 22 HG22 VAL 22 15.695 -9.470 -7.269 171 HG23 VAL 22 HG23 VAL 22 16.101 -9.102 -8.952 172 H VAL 23 H VAL 23 12.111 -6.855 -6.368 173 HA VAL 23 HA VAL 23 10.567 -5.150 -8.227 174 HB VAL 23 HB VAL 23 10.551 -5.448 -5.186 175 HG11 VAL 23 HG11 VAL 23 8.562 -4.067 -7.037 176 HG12 VAL 23 HG12 VAL 23 8.385 -4.289 -5.281 177 HG13 VAL 23 HG13 VAL 23 9.672 -3.260 -5.912 178 HG21 VAL 23 HG21 VAL 23 8.632 -6.823 -5.367 179 HG22 VAL 23 HG22 VAL 23 8.492 -6.562 -7.104 180 HG23 VAL 23 HG23 VAL 23 9.809 -7.541 -6.468 181 H ILE 24 H ILE 24 11.255 -3.076 -8.706 182 HA ILE 24 HA ILE 24 13.383 -1.932 -6.944 183 HB ILE 24 HB ILE 24 12.710 -0.763 -9.621 184 HG12 ILE 24 HG12 ILE 24 13.250 -2.935 -10.390 185 HG13 ILE 24 HG13 ILE 24 14.656 -1.889 -10.626 186 HG21 ILE 24 HG21 ILE 24 15.124 -0.743 -7.779 187 HG22 ILE 24 HG22 ILE 24 15.044 0.073 -9.350 188 HG23 ILE 24 HG23 ILE 24 13.965 0.563 -8.040 189 HD11 ILE 24 HD11 ILE 24 15.379 -2.940 -8.328 190 HD12 ILE 24 HD12 ILE 24 14.278 -4.237 -8.812 191 HD13 ILE 24 HD13 ILE 24 15.637 -3.781 -9.876 192 H LEU 25 H LEU 25 12.345 -0.827 -5.412 193 HA LEU 25 HA LEU 25 9.852 0.638 -5.924 194 HB2 LEU 25 HB2 LEU 25 11.617 0.527 -3.456 195 HB3 LEU 25 HB3 LEU 25 9.969 1.149 -3.546 196 HG LEU 25 HG LEU 25 10.719 -1.767 -4.139 197 HD11 LEU 25 HD11 LEU 25 9.562 -0.712 -1.557 198 HD12 LEU 25 HD12 LEU 25 9.949 -2.404 -2.023 199 HD13 LEU 25 HD13 LEU 25 11.255 -1.229 -1.837 200 HD21 LEU 25 HD21 LEU 25 8.367 -2.273 -3.881 201 HD22 LEU 25 HD22 LEU 25 7.997 -0.596 -3.494 202 HD23 LEU 25 HD23 LEU 25 8.539 -1.040 -5.129 203 H MET 26 H MET 26 9.965 2.796 -6.679 204 HA MET 26 HA MET 26 12.669 4.054 -6.839 205 HB2 MET 26 HB2 MET 26 10.548 3.704 -8.986 206 HB3 MET 26 HB3 MET 26 11.905 4.832 -9.097 207 HG2 MET 26 HG2 MET 26 13.499 2.972 -8.832 208 HG3 MET 26 HG3 MET 26 12.155 1.822 -8.804 209 HE1 MET 26 HE1 MET 26 14.388 2.046 -12.360 210 HE2 MET 26 HE2 MET 26 14.884 2.341 -10.689 211 HE3 MET 26 HE3 MET 26 14.033 0.834 -11.117 212 HA PRO 27 HA PRO 27 9.522 6.835 -4.880 213 HB2 PRO 27 HB2 PRO 27 11.132 7.973 -2.971 214 HB3 PRO 27 HB3 PRO 27 10.326 6.378 -2.787 215 HG2 PRO 27 HG2 PRO 27 13.167 6.909 -3.716 216 HG3 PRO 27 HG3 PRO 27 12.630 5.826 -2.395 217 HD2 PRO 27 HD2 PRO 27 13.062 4.833 -4.845 218 HD3 PRO 27 HD3 PRO 27 11.609 4.305 -3.953 219 H ASN 28 H ASN 28 9.199 8.797 -5.404 220 HA ASN 28 HA ASN 28 11.279 10.711 -6.236 221 HB2 ASN 28 HB2 ASN 28 9.844 11.591 -8.040 222 HB3 ASN 28 HB3 ASN 28 10.557 10.017 -8.340 223 HD21 ASN 28 HD21 ASN 28 7.662 9.825 -6.329 224 HD22 ASN 28 HD22 ASN 28 6.594 9.373 -7.601 225 H LYS 29 H LYS 29 10.658 10.852 -3.812 226 HA LYS 29 HA LYS 29 10.287 12.466 -2.264 227 HB2 LYS 29 HB2 LYS 29 9.303 14.149 -4.610 228 HB3 LYS 29 HB3 LYS 29 9.380 14.722 -2.968 229 HG2 LYS 29 HG2 LYS 29 11.305 15.515 -4.081 230 HG3 LYS 29 HG3 LYS 29 11.772 14.352 -2.847 231 HD2 LYS 29 HD2 LYS 29 13.151 14.080 -4.792 232 HD3 LYS 29 HD3 LYS 29 12.196 12.645 -4.592 233 HE2 LYS 29 HE2 LYS 29 11.770 12.874 -6.801 234 HE3 LYS 29 HE3 LYS 29 10.568 14.071 -6.313 235 HZ1 LYS 29 HZ1 LYS 29 13.391 14.486 -7.123 236 HZ2 LYS 29 HZ2 LYS 29 12.107 14.922 -7.997 237 HZ3 LYS 29 HZ3 LYS 29 12.450 15.743 -6.615 238 H GLU 30 H GLU 30 8.055 10.573 -3.303 239 HA GLU 30 HA GLU 30 5.530 11.833 -2.627 240 HB2 GLU 30 HB2 GLU 30 4.533 9.814 -3.088 241 HB3 GLU 30 HB3 GLU 30 5.657 10.241 -4.371 242 HG2 GLU 30 HG2 GLU 30 6.349 8.256 -2.150 243 HG3 GLU 30 HG3 GLU 30 5.554 7.881 -3.674 244 H LEU 31 H LEU 31 7.971 10.837 -0.656 245 HA LEU 31 HA LEU 31 6.917 8.806 0.941 246 HB2 LEU 31 HB2 LEU 31 9.243 10.691 1.527 247 HB3 LEU 31 HB3 LEU 31 8.998 9.092 2.237 248 HG LEU 31 HG LEU 31 9.594 9.670 -0.699 249 HD11 LEU 31 HD11 LEU 31 11.267 8.278 1.433 250 HD12 LEU 31 HD12 LEU 31 11.688 8.467 -0.280 251 HD13 LEU 31 HD13 LEU 31 11.567 9.899 0.750 252 HD21 LEU 31 HD21 LEU 31 9.052 7.057 0.768 253 HD22 LEU 31 HD22 LEU 31 8.147 7.743 -0.626 254 HD23 LEU 31 HD23 LEU 31 9.783 7.161 -0.846 255 H ASN 32 H ASN 32 5.066 10.854 1.135 256 HA ASN 32 HA ASN 32 5.093 12.427 3.527 257 HB2 ASN 32 HB2 ASN 32 2.888 12.997 2.978 258 HB3 ASN 32 HB3 ASN 32 3.738 12.894 1.437 259 HD21 ASN 32 HD21 ASN 32 3.345 10.695 0.186 260 HD22 ASN 32 HD22 ASN 32 1.730 10.110 0.273 261 H ILE 33 H ILE 33 3.837 12.169 5.430 262 HA ILE 33 HA ILE 33 3.996 9.704 6.692 263 HB ILE 33 HB ILE 33 2.450 12.248 7.216 264 HG12 ILE 33 HG12 ILE 33 4.888 10.815 8.353 265 HG13 ILE 33 HG13 ILE 33 4.838 12.336 7.470 266 HG21 ILE 33 HG21 ILE 33 2.340 9.768 8.966 267 HG22 ILE 33 HG22 ILE 33 1.789 11.392 9.446 268 HG23 ILE 33 HG23 ILE 33 0.985 10.558 8.129 269 HD11 ILE 33 HD11 ILE 33 5.220 12.837 9.763 270 HD12 ILE 33 HD12 ILE 33 3.539 13.313 9.400 271 HD13 ILE 33 HD13 ILE 33 3.892 11.809 10.301 272 H GLU 34 H GLU 34 1.247 11.000 4.831 273 HA GLU 34 HA GLU 34 -0.679 9.161 5.854 274 HB2 GLU 34 HB2 GLU 34 -1.031 10.391 3.173 275 HB3 GLU 34 HB3 GLU 34 -2.190 10.135 4.449 276 HG2 GLU 34 HG2 GLU 34 -1.224 12.012 5.744 277 HG3 GLU 34 HG3 GLU 34 -0.009 12.294 4.510 278 H ASN 35 H ASN 35 1.712 8.959 3.330 279 HA ASN 35 HA ASN 35 0.550 6.325 2.417 280 HB2 ASN 35 HB2 ASN 35 1.435 6.423 0.451 281 HB3 ASN 35 HB3 ASN 35 1.443 8.151 0.730 282 HD21 ASN 35 HD21 ASN 35 3.358 5.335 0.078 283 HD22 ASN 35 HD22 ASN 35 4.885 6.145 0.316 284 H ALA 36 H ALA 36 3.280 7.820 4.095 285 HA ALA 36 HA ALA 36 5.020 5.693 4.123 286 HB1 ALA 36 HB1 ALA 36 4.601 7.714 6.338 287 HB2 ALA 36 HB2 ALA 36 6.047 6.722 6.087 288 HB3 ALA 36 HB3 ALA 36 5.605 7.945 4.887 289 H HIS 37 H HIS 37 2.197 6.153 6.264 290 HA HIS 37 HA HIS 37 2.785 3.980 8.049 291 HB2 HIS 37 HB2 HIS 37 1.022 5.648 8.495 292 HB3 HIS 37 HB3 HIS 37 0.067 5.022 7.160 293 HD1 HIS 37 HD1 HIS 37 -1.667 4.890 9.455 294 HD2 HIS 37 HD2 HIS 37 1.383 2.017 8.979 295 HE1 HIS 37 HE1 HIS 37 -2.259 2.941 10.985 296 H LEU 38 H LEU 38 0.535 3.937 5.162 297 HA LEU 38 HA LEU 38 0.465 1.068 5.382 298 HB2 LEU 38 HB2 LEU 38 -1.301 1.036 4.121 299 HB3 LEU 38 HB3 LEU 38 -1.426 2.658 4.720 300 HG LEU 38 HG LEU 38 -2.088 2.716 2.520 301 HD11 LEU 38 HD11 LEU 38 -0.440 4.521 3.112 302 HD12 LEU 38 HD12 LEU 38 0.766 3.612 2.159 303 HD13 LEU 38 HD13 LEU 38 -0.688 4.233 1.380 304 HD21 LEU 38 HD21 LEU 38 -1.263 1.621 0.671 305 HD22 LEU 38 HD22 LEU 38 0.361 1.486 1.344 306 HD23 LEU 38 HD23 LEU 38 -0.923 0.446 1.969 307 H PHE 39 H PHE 39 2.665 3.097 3.793 308 HA PHE 39 HA PHE 39 3.716 1.875 1.673 309 HB2 PHE 39 HB2 PHE 39 4.682 3.618 3.441 310 HB3 PHE 39 HB3 PHE 39 5.620 2.252 3.976 311 HD1 PHE 39 HD1 PHE 39 7.040 1.003 1.942 312 HD2 PHE 39 HD2 PHE 39 5.533 5.043 1.924 313 HE1 PHE 39 HE1 PHE 39 8.981 1.715 0.640 314 HE2 PHE 39 HE2 PHE 39 7.310 5.692 0.356 315 HZ PHE 39 HZ PHE 39 9.115 4.061 -0.238 316 H LYS 40 H LYS 40 3.993 0.540 4.968 317 HA LYS 40 HA LYS 40 5.497 -1.847 4.390 318 HB2 LYS 40 HB2 LYS 40 5.052 -1.095 6.730 319 HB3 LYS 40 HB3 LYS 40 3.316 -1.292 6.474 320 HG2 LYS 40 HG2 LYS 40 4.055 -3.796 5.821 321 HG3 LYS 40 HG3 LYS 40 5.470 -3.394 6.765 322 HD2 LYS 40 HD2 LYS 40 2.705 -2.952 7.961 323 HD3 LYS 40 HD3 LYS 40 3.271 -4.595 7.698 324 HE2 LYS 40 HE2 LYS 40 5.497 -3.625 8.853 325 HE3 LYS 40 HE3 LYS 40 4.316 -2.531 9.601 326 HZ1 LYS 40 HZ1 LYS 40 4.266 -5.508 9.701 327 HZ2 LYS 40 HZ2 LYS 40 4.683 -4.510 10.905 328 HZ3 LYS 40 HZ3 LYS 40 3.123 -4.530 10.338 329 H LYS 41 H LYS 41 1.978 -1.478 4.840 330 HA LYS 41 HA LYS 41 1.241 -4.019 4.019 331 HB2 LYS 41 HB2 LYS 41 -0.084 -2.243 5.273 332 HB3 LYS 41 HB3 LYS 41 -0.461 -1.505 3.716 333 HG2 LYS 41 HG2 LYS 41 -1.550 -3.566 2.966 334 HG3 LYS 41 HG3 LYS 41 -1.026 -4.419 4.435 335 HD2 LYS 41 HD2 LYS 41 -2.328 -2.682 5.786 336 HD3 LYS 41 HD3 LYS 41 -3.033 -2.140 4.247 337 HE2 LYS 41 HE2 LYS 41 -3.148 -4.965 5.398 338 HE3 LYS 41 HE3 LYS 41 -4.466 -3.774 5.455 339 HZ1 LYS 41 HZ1 LYS 41 -4.829 -5.246 3.670 340 HZ2 LYS 41 HZ2 LYS 41 -4.450 -3.807 3.001 341 HZ3 LYS 41 HZ3 LYS 41 -3.331 -5.038 3.039 342 H TRP 42 H TRP 42 1.526 -1.065 2.031 343 HA TRP 42 HA TRP 42 0.663 -2.182 -0.438 344 HB2 TRP 42 HB2 TRP 42 0.863 0.129 -0.386 345 HB3 TRP 42 HB3 TRP 42 2.455 0.108 0.357 346 HD1 TRP 42 HD1 TRP 42 0.992 -1.067 -3.044 347 HE1 TRP 42 HE1 TRP 42 2.659 -0.537 -4.882 348 HE3 TRP 42 HE3 TRP 42 4.675 0.944 -0.168 349 HZ2 TRP 42 HZ2 TRP 42 5.308 0.597 -5.103 350 HZ3 TRP 42 HZ3 TRP 42 6.782 1.606 -1.098 351 HH2 TRP 42 HH2 TRP 42 7.138 1.510 -3.676 352 H VAL 43 H VAL 43 4.142 -1.869 0.763 353 HA VAL 43 HA VAL 43 5.083 -3.439 -1.342 354 HB VAL 43 HB VAL 43 6.219 -2.887 1.411 355 HG11 VAL 43 HG11 VAL 43 8.412 -3.670 0.554 356 HG12 VAL 43 HG12 VAL 43 7.265 -4.991 0.758 357 HG13 VAL 43 HG13 VAL 43 7.596 -4.353 -0.874 358 HG21 VAL 43 HG21 VAL 43 6.119 -0.974 -0.043 359 HG22 VAL 43 HG22 VAL 43 7.792 -1.503 -0.061 360 HG23 VAL 43 HG23 VAL 43 6.741 -1.892 -1.431 361 H PHE 44 H PHE 44 3.674 -4.502 1.763 362 HA PHE 44 HA PHE 44 4.459 -7.200 1.567 363 HB2 PHE 44 HB2 PHE 44 2.347 -5.678 3.099 364 HB3 PHE 44 HB3 PHE 44 2.562 -7.392 3.213 365 HD1 PHE 44 HD1 PHE 44 5.665 -5.230 3.001 366 HD2 PHE 44 HD2 PHE 44 2.837 -7.242 5.586 367 HE1 PHE 44 HE1 PHE 44 7.228 -5.056 4.863 368 HE2 PHE 44 HE2 PHE 44 4.431 -7.064 7.449 369 HZ PHE 44 HZ PHE 44 6.634 -5.950 7.112 370 H ASP 45 H ASP 45 1.593 -5.428 0.437 371 HA ASP 45 HA ASP 45 0.240 -7.924 -0.372 372 HB2 ASP 45 HB2 ASP 45 -0.775 -5.104 0.023 373 HB3 ASP 45 HB3 ASP 45 -1.737 -6.415 -0.624 374 H GLU 46 H GLU 46 2.021 -5.395 -1.966 375 HA GLU 46 HA GLU 46 0.858 -6.304 -4.570 376 HB2 GLU 46 HB2 GLU 46 3.025 -4.236 -4.187 377 HB3 GLU 46 HB3 GLU 46 2.126 -4.602 -5.664 378 HG2 GLU 46 HG2 GLU 46 1.365 -3.169 -3.165 379 HG3 GLU 46 HG3 GLU 46 1.502 -2.514 -4.791 380 H PHE 47 H PHE 47 3.604 -6.985 -2.445 381 HA PHE 47 HA PHE 47 4.852 -8.489 -4.667 382 HB2 PHE 47 HB2 PHE 47 6.512 -6.902 -2.715 383 HB3 PHE 47 HB3 PHE 47 6.987 -7.727 -4.193 384 HD1 PHE 47 HD1 PHE 47 6.131 -6.788 -6.443 385 HD2 PHE 47 HD2 PHE 47 5.593 -4.687 -2.753 386 HE1 PHE 47 HE1 PHE 47 5.743 -4.686 -7.668 387 HE2 PHE 47 HE2 PHE 47 5.398 -2.533 -3.955 388 HZ PHE 47 HZ PHE 47 5.478 -2.531 -6.421 389 H LEU 48 H LEU 48 4.988 -8.066 -1.038 390 HA LEU 48 HA LEU 48 6.664 -10.371 -0.835 391 HB2 LEU 48 HB2 LEU 48 4.882 -9.198 1.332 392 HB3 LEU 48 HB3 LEU 48 6.132 -10.406 1.592 393 HG LEU 48 HG LEU 48 6.509 -7.548 0.715 394 HD11 LEU 48 HD11 LEU 48 7.746 -7.340 2.816 395 HD12 LEU 48 HD12 LEU 48 6.180 -8.106 3.167 396 HD13 LEU 48 HD13 LEU 48 7.638 -9.099 3.086 397 HD21 LEU 48 HD21 LEU 48 8.172 -8.751 -0.565 398 HD22 LEU 48 HD22 LEU 48 8.998 -8.044 0.830 399 HD23 LEU 48 HD23 LEU 48 8.595 -9.772 0.831 400 H ASN 49 H ASN 49 3.199 -10.076 -0.350 401 HA ASN 49 HA ASN 49 2.778 -12.933 0.130 402 HB2 ASN 49 HB2 ASN 49 0.831 -10.718 -0.611 403 HB3 ASN 49 HB3 ASN 49 0.360 -12.398 -0.411 404 HD21 ASN 49 HD21 ASN 49 1.063 -9.444 1.289 405 HD22 ASN 49 HD22 ASN 49 0.871 -10.104 2.886 406 H LYS 50 H LYS 50 3.020 -10.970 -2.779 407 HA LYS 50 HA LYS 50 2.341 -13.063 -4.666 408 HB2 LYS 50 HB2 LYS 50 3.652 -10.371 -4.709 409 HB3 LYS 50 HB3 LYS 50 4.238 -11.481 -5.936 410 HG2 LYS 50 HG2 LYS 50 1.729 -11.896 -6.419 411 HG3 LYS 50 HG3 LYS 50 1.449 -10.410 -5.481 412 HD2 LYS 50 HD2 LYS 50 3.238 -9.310 -6.955 413 HD3 LYS 50 HD3 LYS 50 3.113 -10.728 -8.016 414 HE2 LYS 50 HE2 LYS 50 0.792 -10.253 -8.490 415 HE3 LYS 50 HE3 LYS 50 0.727 -9.023 -7.215 416 HZ1 LYS 50 HZ1 LYS 50 2.212 -7.664 -8.457 417 HZ2 LYS 50 HZ2 LYS 50 2.421 -8.793 -9.639 418 HZ3 LYS 50 HZ3 LYS 50 0.954 -8.079 -9.433 419 H GLY 51 H GLY 51 4.780 -12.969 -2.408 420 HA2 GLY 51 HA2 GLY 51 6.454 -14.534 -2.016 421 HA3 GLY 51 HA3 GLY 51 6.042 -15.305 -3.555 422 H TYR 52 H TYR 52 6.831 -11.841 -3.586 423 HA TYR 52 HA TYR 52 9.427 -12.375 -4.909 424 HB2 TYR 52 HB2 TYR 52 8.057 -9.806 -4.030 425 HB3 TYR 52 HB3 TYR 52 9.687 -9.883 -4.667 426 HD1 TYR 52 HD1 TYR 52 10.166 -10.433 -6.997 427 HD2 TYR 52 HD2 TYR 52 6.132 -10.090 -5.571 428 HE1 TYR 52 HE1 TYR 52 9.420 -10.211 -9.320 429 HE2 TYR 52 HE2 TYR 52 5.324 -9.835 -7.884 430 HH TYR 52 HH TYR 52 7.469 -9.916 -10.750 431 H ASN 53 H ASN 53 11.345 -12.121 -3.855 432 HA ASN 53 HA ASN 53 11.394 -11.551 -0.906 433 HB2 ASN 53 HB2 ASN 53 12.484 -13.926 -2.423 434 HB3 ASN 53 HB3 ASN 53 13.340 -13.353 -1.000 435 HD21 ASN 53 HD21 ASN 53 12.518 -13.772 1.069 436 HD22 ASN 53 HD22 ASN 53 11.135 -14.821 1.304 437 H LYS 54 H LYS 54 12.395 -10.348 -3.797 438 HA LYS 54 HA LYS 54 14.787 -9.128 -2.495 439 HB2 LYS 54 HB2 LYS 54 14.596 -10.164 -5.339 440 HB3 LYS 54 HB3 LYS 54 15.746 -8.933 -4.821 441 HG2 LYS 54 HG2 LYS 54 17.157 -10.416 -3.981 442 HG3 LYS 54 HG3 LYS 54 15.951 -11.060 -2.900 443 HD2 LYS 54 HD2 LYS 54 16.379 -11.959 -5.779 444 HD3 LYS 54 HD3 LYS 54 16.943 -12.810 -4.316 445 HE2 LYS 54 HE2 LYS 54 14.585 -13.042 -3.546 446 HE3 LYS 54 HE3 LYS 54 14.065 -12.160 -4.993 447 HZ1 LYS 54 HZ1 LYS 54 13.794 -14.208 -5.764 448 HZ2 LYS 54 HZ2 LYS 54 15.303 -14.074 -6.192 449 HZ3 LYS 54 HZ3 LYS 54 14.925 -14.943 -4.805 450 H ILE 55 H ILE 55 14.425 -7.081 -2.297 451 HA ILE 55 HA ILE 55 12.618 -5.418 -4.032 452 HB ILE 55 HB ILE 55 12.738 -5.771 -1.062 453 HG12 ILE 55 HG12 ILE 55 10.373 -4.924 -2.794 454 HG13 ILE 55 HG13 ILE 55 10.945 -6.563 -2.980 455 HG21 ILE 55 HG21 ILE 55 13.226 -3.434 -1.263 456 HG22 ILE 55 HG22 ILE 55 12.027 -3.229 -2.544 457 HG23 ILE 55 HG23 ILE 55 11.519 -3.581 -0.858 458 HD11 ILE 55 HD11 ILE 55 9.040 -6.459 -1.451 459 HD12 ILE 55 HD12 ILE 55 10.483 -7.112 -0.671 460 HD13 ILE 55 HD13 ILE 55 9.972 -5.417 -0.354 461 H PHE 56 H PHE 56 13.611 -3.529 -4.553 462 HA PHE 56 HA PHE 56 16.041 -2.789 -3.120 463 HB2 PHE 56 HB2 PHE 56 15.517 -2.627 -6.090 464 HB3 PHE 56 HB3 PHE 56 16.798 -1.695 -5.367 465 HD1 PHE 56 HD1 PHE 56 17.456 -4.227 -3.316 466 HD2 PHE 56 HD2 PHE 56 17.187 -3.618 -7.603 467 HE1 PHE 56 HE1 PHE 56 18.827 -6.227 -3.732 468 HE2 PHE 56 HE2 PHE 56 18.367 -5.697 -7.995 469 HZ PHE 56 HZ PHE 56 19.249 -7.015 -6.056 470 H LEU 57 H LEU 57 16.473 -0.542 -3.036 471 HA LEU 57 HA LEU 57 14.141 1.215 -3.623 472 HB2 LEU 57 HB2 LEU 57 14.398 0.683 -1.156 473 HB3 LEU 57 HB3 LEU 57 15.990 1.440 -1.220 474 HG LEU 57 HG LEU 57 14.900 3.598 -1.889 475 HD11 LEU 57 HD11 LEU 57 12.350 1.961 -1.466 476 HD12 LEU 57 HD12 LEU 57 12.390 3.738 -1.496 477 HD13 LEU 57 HD13 LEU 57 12.850 2.818 -2.931 478 HD21 LEU 57 HD21 LEU 57 13.945 4.067 0.342 479 HD22 LEU 57 HD22 LEU 57 13.811 2.319 0.662 480 HD23 LEU 57 HD23 LEU 57 15.399 3.073 0.496 481 H VAL 58 H VAL 58 14.831 2.496 -5.315 482 HA VAL 58 HA VAL 58 17.672 3.228 -5.590 483 HB VAL 58 HB VAL 58 15.134 3.882 -7.152 484 HG11 VAL 58 HG11 VAL 58 16.695 4.822 -8.895 485 HG12 VAL 58 HG12 VAL 58 16.566 5.798 -7.436 486 HG13 VAL 58 HG13 VAL 58 18.006 4.772 -7.694 487 HG21 VAL 58 HG21 VAL 58 16.042 1.562 -7.358 488 HG22 VAL 58 HG22 VAL 58 16.157 2.468 -8.877 489 HG23 VAL 58 HG23 VAL 58 17.597 2.231 -7.871 490 H LEU 59 H LEU 59 18.532 5.110 -4.809 491 HA LEU 59 HA LEU 59 16.659 7.146 -3.746 492 HB2 LEU 59 HB2 LEU 59 19.309 6.267 -2.517 493 HB3 LEU 59 HB3 LEU 59 18.401 7.737 -2.122 494 HG LEU 59 HG LEU 59 16.362 6.007 -1.847 495 HD11 LEU 59 HD11 LEU 59 18.712 4.423 -0.772 496 HD12 LEU 59 HD12 LEU 59 17.010 3.954 -0.814 497 HD13 LEU 59 HD13 LEU 59 17.940 4.047 -2.315 498 HD21 LEU 59 HD21 LEU 59 18.475 6.596 0.254 499 HD22 LEU 59 HD22 LEU 59 17.081 7.617 -0.160 500 HD23 LEU 59 HD23 LEU 59 16.826 6.003 0.560 501 H SER 60 H SER 60 17.931 6.804 -6.456 502 HA SER 60 HA SER 60 19.708 9.002 -6.917 503 HB2 SER 60 HB2 SER 60 18.027 7.142 -8.543 504 HB3 SER 60 HB3 SER 60 18.227 8.731 -9.247 505 HG SER 60 HG SER 60 20.350 8.515 -9.310 506 H ASP 61 H ASP 61 16.033 8.800 -7.085 507 HA ASP 61 HA ASP 61 16.069 11.495 -8.265 508 HB2 ASP 61 HB2 ASP 61 14.638 9.434 -8.974 509 HB3 ASP 61 HB3 ASP 61 13.579 9.896 -7.651 510 H VAL 62 H VAL 62 16.039 10.300 -5.146 511 HA VAL 62 HA VAL 62 14.463 12.525 -3.979 512 HB VAL 62 HB VAL 62 13.550 10.275 -3.612 513 HG11 VAL 62 HG11 VAL 62 16.191 9.573 -2.287 514 HG12 VAL 62 HG12 VAL 62 14.707 8.592 -2.229 515 HG13 VAL 62 HG13 VAL 62 15.507 8.887 -3.779 516 HG21 VAL 62 HG21 VAL 62 14.700 11.329 -1.017 517 HG22 VAL 62 HG22 VAL 62 13.248 11.932 -1.859 518 HG23 VAL 62 HG23 VAL 62 13.287 10.285 -1.220 519 H GLU 63 H GLU 63 15.371 13.555 -2.081 520 HA GLU 63 HA GLU 63 18.331 13.474 -2.021 521 HB2 GLU 63 HB2 GLU 63 17.366 15.669 -2.487 522 HB3 GLU 63 HB3 GLU 63 16.370 15.602 -1.046 523 HG2 GLU 63 HG2 GLU 63 18.200 15.905 0.423 524 HG3 GLU 63 HG3 GLU 63 19.346 15.242 -0.698 525 H SER 64 H SER 64 15.327 13.493 0.010 526 HA SER 64 HA SER 64 16.786 12.095 2.124 527 HB2 SER 64 HB2 SER 64 16.252 14.006 3.713 528 HB3 SER 64 HB3 SER 64 17.453 14.380 2.468 529 HG SER 64 HG SER 64 14.789 15.254 2.721 530 H ILE 65 H ILE 65 15.462 11.955 4.084 531 HA ILE 65 HA ILE 65 12.623 11.427 3.699 532 HB ILE 65 HB ILE 65 13.957 9.423 3.113 533 HG12 ILE 65 HG12 ILE 65 12.673 8.926 5.792 534 HG13 ILE 65 HG13 ILE 65 11.773 9.283 4.315 535 HG21 ILE 65 HG21 ILE 65 15.252 9.784 5.857 536 HG22 ILE 65 HG22 ILE 65 15.389 8.316 4.872 537 HG23 ILE 65 HG23 ILE 65 16.047 9.824 4.278 538 HD11 ILE 65 HD11 ILE 65 11.878 6.872 4.612 539 HD12 ILE 65 HD12 ILE 65 12.844 7.315 3.203 540 HD13 ILE 65 HD13 ILE 65 13.642 6.903 4.738 541 H ASP 66 H ASP 66 11.955 10.726 6.219 542 HA ASP 66 HA ASP 66 13.354 12.572 8.071 543 HB2 ASP 66 HB2 ASP 66 11.216 13.561 6.998 544 HB3 ASP 66 HB3 ASP 66 10.332 12.337 7.879 545 H SER 67 H SER 67 12.550 12.218 10.288 546 HA SER 67 HA SER 67 12.539 9.484 11.221 547 HB2 SER 67 HB2 SER 67 12.033 12.130 12.657 548 HB3 SER 67 HB3 SER 67 12.404 10.574 13.417 549 HG SER 67 HG SER 67 14.057 12.355 12.029 550 H PHE 68 H PHE 68 10.578 9.541 9.466 551 HA PHE 68 HA PHE 68 8.493 8.547 11.179 552 HB2 PHE 68 HB2 PHE 68 7.490 10.675 10.212 553 HB3 PHE 68 HB3 PHE 68 7.705 10.024 8.616 554 HD1 PHE 68 HD1 PHE 68 6.567 7.704 8.130 555 HD2 PHE 68 HD2 PHE 68 5.590 10.202 11.504 556 HE1 PHE 68 HE1 PHE 68 4.407 6.500 8.399 557 HE2 PHE 68 HE2 PHE 68 3.435 9.014 11.732 558 HZ PHE 68 HZ PHE 68 2.810 7.211 10.174 559 H SER 69 H SER 69 9.062 8.966 7.645 560 HA SER 69 HA SER 69 8.472 6.369 7.051 561 HB2 SER 69 HB2 SER 69 10.131 8.177 5.302 562 HB3 SER 69 HB3 SER 69 8.839 7.044 4.862 563 HG SER 69 HG SER 69 7.922 9.100 4.817 564 H LEU 70 H LEU 70 11.646 7.698 7.945 565 HA LEU 70 HA LEU 70 13.393 5.805 6.863 566 HB2 LEU 70 HB2 LEU 70 13.308 7.489 9.392 567 HB3 LEU 70 HB3 LEU 70 14.494 6.213 9.361 568 HG LEU 70 HG LEU 70 14.304 8.279 7.174 569 HD11 LEU 70 HD11 LEU 70 16.241 8.280 9.522 570 HD12 LEU 70 HD12 LEU 70 16.156 9.465 8.207 571 HD13 LEU 70 HD13 LEU 70 14.829 9.355 9.370 572 HD21 LEU 70 HD21 LEU 70 16.745 7.524 6.837 573 HD22 LEU 70 HD22 LEU 70 16.390 6.221 7.986 574 HD23 LEU 70 HD23 LEU 70 15.516 6.293 6.453 575 H GLY 71 H GLY 71 11.215 5.411 9.621 576 HA2 GLY 71 HA2 GLY 71 12.435 2.934 10.573 577 HA3 GLY 71 HA3 GLY 71 10.843 3.566 11.027 578 H VAL 72 H VAL 72 9.911 3.767 8.194 579 HA VAL 72 HA VAL 72 8.807 1.111 8.149 580 HB VAL 72 HB VAL 72 8.361 3.290 6.109 581 HG11 VAL 72 HG11 VAL 72 6.856 0.811 7.047 582 HG12 VAL 72 HG12 VAL 72 6.038 2.117 6.171 583 HG13 VAL 72 HG13 VAL 72 7.375 1.240 5.416 584 HG21 VAL 72 HG21 VAL 72 7.984 4.397 8.232 585 HG22 VAL 72 HG22 VAL 72 6.420 4.007 7.558 586 HG23 VAL 72 HG23 VAL 72 7.087 3.015 8.870 587 H ILE 73 H ILE 73 11.156 2.929 6.215 588 HA ILE 73 HA ILE 73 11.628 1.037 4.144 589 HB ILE 73 HB ILE 73 13.267 3.168 5.543 590 HG12 ILE 73 HG12 ILE 73 13.275 4.305 3.434 591 HG13 ILE 73 HG13 ILE 73 12.701 2.889 2.588 592 HG21 ILE 73 HG21 ILE 73 14.324 1.351 3.339 593 HG22 ILE 73 HG22 ILE 73 15.122 2.820 3.945 594 HG23 ILE 73 HG23 ILE 73 14.919 1.420 5.004 595 HD11 ILE 73 HD11 ILE 73 11.035 4.644 4.372 596 HD12 ILE 73 HD12 ILE 73 10.990 4.551 2.617 597 HD13 ILE 73 HD13 ILE 73 10.450 3.162 3.571 598 H VAL 74 H VAL 74 12.952 1.201 7.538 599 HA VAL 74 HA VAL 74 14.491 -1.227 7.283 600 HB VAL 74 HB VAL 74 13.401 0.277 9.702 601 HG11 VAL 74 HG11 VAL 74 15.020 -1.110 11.022 602 HG12 VAL 74 HG12 VAL 74 13.612 -1.994 10.413 603 HG13 VAL 74 HG13 VAL 74 15.196 -2.178 9.611 604 HG21 VAL 74 HG21 VAL 74 16.192 0.050 8.496 605 HG22 VAL 74 HG22 VAL 74 15.100 1.460 8.423 606 HG23 VAL 74 HG23 VAL 74 15.755 0.940 9.971 607 H ASN 75 H ASN 75 11.111 -0.621 8.565 608 HA ASN 75 HA ASN 75 10.471 -3.112 9.367 609 HB2 ASN 75 HB2 ASN 75 9.176 -0.788 9.015 610 HB3 ASN 75 HB3 ASN 75 8.555 -1.588 7.589 611 HD21 ASN 75 HD21 ASN 75 7.638 -0.803 10.499 612 HD22 ASN 75 HD22 ASN 75 6.905 -2.256 11.121 613 H ILE 76 H ILE 76 10.480 -2.000 5.972 614 HA ILE 76 HA ILE 76 9.438 -4.372 4.781 615 HB ILE 76 HB ILE 76 11.164 -2.079 3.763 616 HG12 ILE 76 HG12 ILE 76 8.292 -2.944 3.118 617 HG13 ILE 76 HG13 ILE 76 8.638 -1.726 4.346 618 HG21 ILE 76 HG21 ILE 76 11.802 -4.020 2.416 619 HG22 ILE 76 HG22 ILE 76 10.096 -4.448 2.160 620 HG23 ILE 76 HG23 ILE 76 10.795 -2.968 1.456 621 HD11 ILE 76 HD11 ILE 76 7.930 -0.822 2.259 622 HD12 ILE 76 HD12 ILE 76 9.476 -0.170 2.865 623 HD13 ILE 76 HD13 ILE 76 9.444 -1.308 1.490 624 H LEU 77 H LEU 77 12.802 -3.463 5.735 625 HA LEU 77 HA LEU 77 14.056 -5.717 4.398 626 HB2 LEU 77 HB2 LEU 77 15.415 -3.837 4.933 627 HB3 LEU 77 HB3 LEU 77 14.906 -3.773 6.587 628 HG LEU 77 HG LEU 77 17.159 -4.518 6.395 629 HD11 LEU 77 HD11 LEU 77 15.892 -5.156 8.272 630 HD12 LEU 77 HD12 LEU 77 15.734 -6.804 7.557 631 HD13 LEU 77 HD13 LEU 77 17.324 -6.139 7.887 632 HD21 LEU 77 HD21 LEU 77 16.131 -6.879 4.799 633 HD22 LEU 77 HD22 LEU 77 17.463 -5.735 4.427 634 HD23 LEU 77 HD23 LEU 77 17.672 -6.907 5.694 635 H LYS 78 H LYS 78 12.853 -4.943 7.663 636 HA LYS 78 HA LYS 78 13.715 -7.306 8.929 637 HB2 LYS 78 HB2 LYS 78 11.274 -5.571 9.512 638 HB3 LYS 78 HB3 LYS 78 11.870 -6.864 10.559 639 HG2 LYS 78 HG2 LYS 78 14.114 -5.668 10.568 640 HG3 LYS 78 HG3 LYS 78 13.331 -4.305 9.750 641 HD2 LYS 78 HD2 LYS 78 11.864 -3.927 11.640 642 HD3 LYS 78 HD3 LYS 78 12.225 -5.533 12.304 643 HE2 LYS 78 HE2 LYS 78 14.700 -4.604 12.420 644 HE3 LYS 78 HE3 LYS 78 13.871 -3.028 12.446 645 HZ1 LYS 78 HZ1 LYS 78 13.444 -5.310 14.292 646 HZ2 LYS 78 HZ2 LYS 78 14.193 -3.939 14.671 647 HZ3 LYS 78 HZ3 LYS 78 12.547 -3.947 14.329 648 H SER 79 H SER 79 10.623 -6.674 7.270 649 HA SER 79 HA SER 79 9.461 -9.216 7.675 650 HB2 SER 79 HB2 SER 79 8.448 -7.098 6.632 651 HB3 SER 79 HB3 SER 79 9.202 -7.587 5.107 652 HG SER 79 HG SER 79 8.037 -9.582 5.301 653 H ILE 80 H ILE 80 11.441 -8.033 4.899 654 HA ILE 80 HA ILE 80 11.504 -10.416 3.464 655 HB ILE 80 HB ILE 80 13.368 -8.032 3.649 656 HG12 ILE 80 HG12 ILE 80 11.335 -8.855 1.510 657 HG13 ILE 80 HG13 ILE 80 10.991 -7.716 2.809 658 HG21 ILE 80 HG21 ILE 80 13.440 -10.222 1.560 659 HG22 ILE 80 HG22 ILE 80 14.356 -8.712 1.518 660 HG23 ILE 80 HG23 ILE 80 14.713 -9.868 2.778 661 HD11 ILE 80 HD11 ILE 80 12.881 -7.404 0.499 662 HD12 ILE 80 HD12 ILE 80 11.606 -6.298 1.081 663 HD13 ILE 80 HD13 ILE 80 13.102 -6.434 1.989 664 H SER 81 H SER 81 13.914 -9.263 5.887 665 HA SER 81 HA SER 81 15.605 -11.534 5.575 666 HB2 SER 81 HB2 SER 81 15.354 -9.371 7.698 667 HB3 SER 81 HB3 SER 81 16.580 -10.649 7.768 668 HG SER 81 HG SER 81 17.523 -9.004 6.719 669 H SER 82 H SER 82 12.579 -11.241 7.292 670 HA SER 82 HA SER 82 13.088 -13.768 8.740 671 HB2 SER 82 HB2 SER 82 10.608 -12.018 8.463 672 HB3 SER 82 HB3 SER 82 10.745 -13.464 9.468 673 HG SER 82 HG SER 82 12.547 -12.375 10.538 674 H SER 83 H SER 83 11.121 -12.484 5.977 675 HA SER 83 HA SER 83 9.815 -14.848 5.284 676 HB2 SER 83 HB2 SER 83 10.695 -12.454 3.621 677 HB3 SER 83 HB3 SER 83 9.606 -13.711 3.062 678 HG SER 83 HG SER 83 8.140 -13.059 4.740 679 H GLY 84 H GLY 84 13.173 -14.065 4.616 680 HA2 GLY 84 HA2 GLY 84 14.341 -16.190 3.812 681 HA3 GLY 84 HA3 GLY 84 13.103 -16.199 2.543 682 H GLY 85 H GLY 85 14.008 -12.907 2.901 683 HA2 GLY 85 HA2 GLY 85 15.372 -13.266 0.274 684 HA3 GLY 85 HA3 GLY 85 14.207 -12.044 0.763 685 H PHE 86 H PHE 86 15.911 -10.692 -0.194 686 HA PHE 86 HA PHE 86 17.675 -9.611 1.923 687 HB2 PHE 86 HB2 PHE 86 18.494 -10.621 -0.730 688 HB3 PHE 86 HB3 PHE 86 18.934 -8.955 -0.479 689 HD1 PHE 86 HD1 PHE 86 19.075 -12.246 1.281 690 HD2 PHE 86 HD2 PHE 86 21.160 -8.473 0.554 691 HE1 PHE 86 HE1 PHE 86 21.012 -13.026 2.592 692 HE2 PHE 86 HE2 PHE 86 23.010 -9.293 1.845 693 HZ PHE 86 HZ PHE 86 23.001 -11.541 2.882 694 H PHE 87 H PHE 87 17.983 -7.338 1.691 695 HA PHE 87 HA PHE 87 16.287 -5.943 -0.320 696 HB2 PHE 87 HB2 PHE 87 15.192 -5.625 1.839 697 HB3 PHE 87 HB3 PHE 87 16.724 -5.258 2.589 698 HD1 PHE 87 HD1 PHE 87 15.432 -3.755 -0.668 699 HD2 PHE 87 HD2 PHE 87 16.681 -3.033 3.422 700 HE1 PHE 87 HE1 PHE 87 14.477 -1.493 -0.734 701 HE2 PHE 87 HE2 PHE 87 15.390 -0.939 3.446 702 HZ PHE 87 HZ PHE 87 14.299 -0.122 1.350 703 H ALA 88 H ALA 88 17.363 -4.252 -1.289 704 HA ALA 88 HA ALA 88 19.731 -3.272 0.057 705 HB1 ALA 88 HB1 ALA 88 20.514 -5.183 -1.499 706 HB2 ALA 88 HB2 ALA 88 20.140 -4.066 -2.830 707 HB3 ALA 88 HB3 ALA 88 21.304 -3.585 -1.553 708 H LEU 89 H LEU 89 20.702 -1.375 -1.134 709 HA LEU 89 HA LEU 89 18.458 0.158 -2.353 710 HB2 LEU 89 HB2 LEU 89 20.535 1.545 -0.706 711 HB3 LEU 89 HB3 LEU 89 18.902 2.023 -1.116 712 HG LEU 89 HG LEU 89 19.879 0.162 1.026 713 HD11 LEU 89 HD11 LEU 89 18.697 1.461 2.546 714 HD12 LEU 89 HD12 LEU 89 19.517 2.623 1.463 715 HD13 LEU 89 HD13 LEU 89 17.784 2.327 1.259 716 HD21 LEU 89 HD21 LEU 89 17.294 -0.148 -0.309 717 HD22 LEU 89 HD22 LEU 89 18.241 -1.240 0.711 718 HD23 LEU 89 HD23 LEU 89 17.228 -0.019 1.468 719 H VAL 90 H VAL 90 19.269 1.997 -3.654 720 HA VAL 90 HA VAL 90 21.810 1.327 -5.045 721 HB VAL 90 HB VAL 90 18.997 1.469 -6.164 722 HG11 VAL 90 HG11 VAL 90 21.603 1.728 -7.698 723 HG12 VAL 90 HG12 VAL 90 20.022 1.343 -8.432 724 HG13 VAL 90 HG13 VAL 90 20.278 2.902 -7.626 725 HG21 VAL 90 HG21 VAL 90 19.743 -0.711 -7.194 726 HG22 VAL 90 HG22 VAL 90 21.226 -0.595 -6.249 727 HG23 VAL 90 HG23 VAL 90 19.658 -0.734 -5.427 728 H SER 91 H SER 91 22.931 3.061 -5.693 729 HA SER 91 HA SER 91 23.628 5.165 -5.890 730 HB2 SER 91 HB2 SER 91 20.722 5.859 -6.456 731 HB3 SER 91 HB3 SER 91 22.158 6.763 -6.953 732 HG SER 91 HG SER 91 22.794 5.130 -8.236 733 HA PRO 92 HA PRO 92 22.155 6.473 -1.676 734 HB2 PRO 92 HB2 PRO 92 23.972 5.421 -0.001 735 HB3 PRO 92 HB3 PRO 92 22.598 4.488 -0.641 736 HG2 PRO 92 HG2 PRO 92 25.491 4.475 -1.548 737 HG3 PRO 92 HG3 PRO 92 24.409 3.084 -1.370 738 HD2 PRO 92 HD2 PRO 92 24.906 4.395 -3.786 739 HD3 PRO 92 HD3 PRO 92 23.487 3.370 -3.409 740 H ASN 93 H ASN 93 22.571 8.535 -2.174 741 HA ASN 93 HA ASN 93 25.116 9.717 -2.770 742 HB2 ASN 93 HB2 ASN 93 22.723 11.066 -1.480 743 HB3 ASN 93 HB3 ASN 93 23.968 11.845 -2.443 744 HD21 ASN 93 HD21 ASN 93 21.180 11.850 -2.603 745 HD22 ASN 93 HD22 ASN 93 20.580 11.237 -4.143 746 H GLU 94 H GLU 94 25.866 11.599 -1.238 747 HA GLU 94 HA GLU 94 26.665 10.218 1.182 748 HB2 GLU 94 HB2 GLU 94 28.204 11.649 -0.103 749 HB3 GLU 94 HB3 GLU 94 27.259 13.091 0.356 750 HG2 GLU 94 HG2 GLU 94 27.677 12.720 2.683 751 HG3 GLU 94 HG3 GLU 94 28.305 11.094 2.386 752 H LYS 95 H LYS 95 24.166 12.548 0.423 753 HA LYS 95 HA LYS 95 23.719 13.579 3.081 754 HB2 LYS 95 HB2 LYS 95 22.712 14.932 1.508 755 HB3 LYS 95 HB3 LYS 95 22.362 13.606 0.424 756 HG2 LYS 95 HG2 LYS 95 20.297 14.493 1.165 757 HG3 LYS 95 HG3 LYS 95 20.461 12.905 1.885 758 HD2 LYS 95 HD2 LYS 95 21.555 14.811 3.733 759 HD3 LYS 95 HD3 LYS 95 20.098 15.509 3.096 760 HE2 LYS 95 HE2 LYS 95 18.966 13.199 3.641 761 HE3 LYS 95 HE3 LYS 95 20.426 12.839 4.541 762 HZ1 LYS 95 HZ1 LYS 95 18.723 13.786 5.980 763 HZ2 LYS 95 HZ2 LYS 95 20.073 14.729 5.918 764 HZ3 LYS 95 HZ3 LYS 95 18.728 15.185 5.102 765 H VAL 96 H VAL 96 22.339 10.599 1.268 766 HA VAL 96 HA VAL 96 20.929 10.081 3.665 767 HB VAL 96 HB VAL 96 20.411 8.055 2.489 768 HG11 VAL 96 HG11 VAL 96 19.917 10.381 0.601 769 HG12 VAL 96 HG12 VAL 96 18.946 8.914 0.771 770 HG13 VAL 96 HG13 VAL 96 18.995 10.075 2.104 771 HG21 VAL 96 HG21 VAL 96 20.882 7.505 0.241 772 HG22 VAL 96 HG22 VAL 96 21.928 8.936 0.090 773 HG23 VAL 96 HG23 VAL 96 22.358 7.593 1.197 774 H GLU 97 H GLU 97 24.041 8.972 2.204 775 HA GLU 97 HA GLU 97 24.391 6.727 3.877 776 HB2 GLU 97 HB2 GLU 97 26.351 8.608 2.554 777 HB3 GLU 97 HB3 GLU 97 26.936 7.362 3.638 778 HG2 GLU 97 HG2 GLU 97 25.082 6.684 1.338 779 HG3 GLU 97 HG3 GLU 97 26.826 6.826 1.116 780 H ARG 98 H ARG 98 24.767 10.213 4.569 781 HA ARG 98 HA ARG 98 26.072 9.769 6.984 782 HB2 ARG 98 HB2 ARG 98 25.956 12.000 7.365 783 HB3 ARG 98 HB3 ARG 98 25.606 11.971 5.641 784 HG2 ARG 98 HG2 ARG 98 23.928 13.349 6.274 785 HG3 ARG 98 HG3 ARG 98 23.111 11.825 6.520 786 HD2 ARG 98 HD2 ARG 98 23.968 11.874 8.931 787 HD3 ARG 98 HD3 ARG 98 24.493 13.536 8.636 788 HE ARG 98 HE ARG 98 22.072 13.956 7.982 789 HH11 ARG 98 HH11 ARG 98 22.990 11.638 10.488 790 HH12 ARG 98 HH12 ARG 98 21.434 11.588 11.265 791 HH21 ARG 98 HH21 ARG 98 20.064 14.096 9.110 792 HH22 ARG 98 HH22 ARG 98 19.772 13.148 10.519 793 H VAL 99 H VAL 99 22.667 9.429 6.231 794 HA VAL 99 HA VAL 99 21.998 9.415 9.128 795 HB VAL 99 HB VAL 99 20.810 10.960 7.425 796 HG11 VAL 99 HG11 VAL 99 20.462 9.536 5.597 797 HG12 VAL 99 HG12 VAL 99 19.332 8.519 6.549 798 HG13 VAL 99 HG13 VAL 99 18.956 10.216 6.179 799 HG21 VAL 99 HG21 VAL 99 18.655 10.716 8.558 800 HG22 VAL 99 HG22 VAL 99 18.989 9.010 8.929 801 HG23 VAL 99 HG23 VAL 99 19.910 10.305 9.729 802 H LEU 100 H LEU 100 22.250 7.442 6.221 803 HA LEU 100 HA LEU 100 20.785 5.211 7.157 804 HB2 LEU 100 HB2 LEU 100 23.087 5.257 5.130 805 HB3 LEU 100 HB3 LEU 100 22.071 3.933 5.467 806 HG LEU 100 HG LEU 100 21.701 6.070 3.585 807 HD11 LEU 100 HD11 LEU 100 21.462 3.666 3.173 808 HD12 LEU 100 HD12 LEU 100 19.947 3.657 4.110 809 HD13 LEU 100 HD13 LEU 100 20.077 4.618 2.604 810 HD21 LEU 100 HD21 LEU 100 19.270 6.459 3.736 811 HD22 LEU 100 HD22 LEU 100 19.249 5.744 5.378 812 HD23 LEU 100 HD23 LEU 100 20.142 7.233 5.017 813 H SER 101 H SER 101 23.866 6.531 8.268 814 HA SER 101 HA SER 101 24.712 3.923 9.319 815 HB2 SER 101 HB2 SER 101 25.835 6.660 9.080 816 HB3 SER 101 HB3 SER 101 26.113 5.893 10.664 817 HG SER 101 HG SER 101 27.109 5.206 8.175 818 H LEU 102 H LEU 102 23.558 7.070 10.379 819 HA LEU 102 HA LEU 102 23.554 6.657 13.126 820 HB2 LEU 102 HB2 LEU 102 21.991 8.610 11.369 821 HB3 LEU 102 HB3 LEU 102 22.161 8.700 13.102 822 HG LEU 102 HG LEU 102 23.756 9.996 11.262 823 HD11 LEU 102 HD11 LEU 102 24.261 9.438 14.181 824 HD12 LEU 102 HD12 LEU 102 24.907 10.803 13.223 825 HD13 LEU 102 HD13 LEU 102 23.149 10.667 13.529 826 HD21 LEU 102 HD21 LEU 102 25.299 7.787 12.639 827 HD22 LEU 102 HD22 LEU 102 25.202 8.119 10.880 828 HD23 LEU 102 HD23 LEU 102 26.060 9.226 11.948 829 H THR 103 H THR 103 20.809 6.463 10.851 830 HA THR 103 HA THR 103 18.922 5.824 12.962 831 HB THR 103 HB THR 103 18.571 7.125 10.826 832 HG1 THR 103 HG1 THR 103 16.619 5.142 10.812 833 HG21 THR 103 HG21 THR 103 18.445 6.231 8.750 834 HG22 THR 103 HG22 THR 103 19.647 5.137 9.417 835 HG23 THR 103 HG23 THR 103 17.967 4.609 9.340 836 H ASN 104 H ASN 104 21.387 4.112 11.627 837 HA ASN 104 HA ASN 104 22.043 2.067 11.065 838 HB2 ASN 104 HB2 ASN 104 19.868 1.091 12.942 839 HB3 ASN 104 HB3 ASN 104 21.133 0.112 12.222 840 HD21 ASN 104 HD21 ASN 104 22.889 2.910 12.889 841 HD22 ASN 104 HD22 ASN 104 23.233 2.563 14.549 842 H LEU 105 H LEU 105 21.323 2.558 8.846 843 HA LEU 105 HA LEU 105 18.895 1.052 8.017 844 HB2 LEU 105 HB2 LEU 105 19.249 3.729 7.577 845 HB3 LEU 105 HB3 LEU 105 20.165 3.140 6.250 846 HG LEU 105 HG LEU 105 18.111 3.502 5.302 847 HD11 LEU 105 HD11 LEU 105 18.871 1.152 4.882 848 HD12 LEU 105 HD12 LEU 105 17.715 0.603 6.122 849 HD13 LEU 105 HD13 LEU 105 17.153 1.425 4.652 850 HD21 LEU 105 HD21 LEU 105 16.921 4.144 7.187 851 HD22 LEU 105 HD22 LEU 105 15.960 2.861 6.452 852 HD23 LEU 105 HD23 LEU 105 16.959 2.529 7.897 853 H ASP 106 H ASP 106 21.933 2.227 6.461 854 HA ASP 106 HA ASP 106 22.335 -0.116 4.826 855 HB2 ASP 106 HB2 ASP 106 23.375 2.163 4.413 856 HB3 ASP 106 HB3 ASP 106 24.114 2.115 5.992 857 H ARG 107 H ARG 107 22.982 0.687 8.157 858 HA ARG 107 HA ARG 107 25.008 -1.371 8.575 859 HB2 ARG 107 HB2 ARG 107 23.418 -0.072 10.785 860 HB3 ARG 107 HB3 ARG 107 25.065 -0.726 10.798 861 HG2 ARG 107 HG2 ARG 107 25.450 1.231 8.950 862 HG3 ARG 107 HG3 ARG 107 24.036 1.917 9.776 863 HD2 ARG 107 HD2 ARG 107 25.853 2.820 10.936 864 HD3 ARG 107 HD3 ARG 107 25.321 1.480 11.943 865 HE ARG 107 HE ARG 107 27.391 0.871 9.880 866 HH11 ARG 107 HH11 ARG 107 27.091 1.866 13.294 867 HH12 ARG 107 HH12 ARG 107 28.770 1.603 13.596 868 HH21 ARG 107 HH21 ARG 107 29.495 0.477 10.322 869 HH22 ARG 107 HH22 ARG 107 30.212 0.893 11.829 870 H ILE 108 H ILE 108 21.894 -1.648 7.772 871 HA ILE 108 HA ILE 108 21.520 -4.215 9.146 872 HB ILE 108 HB ILE 108 19.366 -2.174 8.409 873 HG12 ILE 108 HG12 ILE 108 20.764 -2.758 11.024 874 HG13 ILE 108 HG13 ILE 108 20.576 -1.213 10.234 875 HG21 ILE 108 HG21 ILE 108 19.114 -4.703 10.055 876 HG22 ILE 108 HG22 ILE 108 17.810 -3.632 9.485 877 HG23 ILE 108 HG23 ILE 108 18.728 -4.581 8.326 878 HD11 ILE 108 HD11 ILE 108 19.082 -1.227 12.097 879 HD12 ILE 108 HD12 ILE 108 18.066 -1.410 10.650 880 HD13 ILE 108 HD13 ILE 108 18.433 -2.817 11.685 881 H VAL 109 H VAL 109 20.814 -2.140 6.144 882 HA VAL 109 HA VAL 109 20.152 -4.449 4.621 883 HB VAL 109 HB VAL 109 19.220 -2.898 3.275 884 HG11 VAL 109 HG11 VAL 109 18.713 -1.866 6.093 885 HG12 VAL 109 HG12 VAL 109 17.692 -1.481 4.718 886 HG13 VAL 109 HG13 VAL 109 17.889 -3.143 5.215 887 HG21 VAL 109 HG21 VAL 109 20.275 -0.423 4.200 888 HG22 VAL 109 HG22 VAL 109 20.591 -1.336 2.680 889 HG23 VAL 109 HG23 VAL 109 18.926 -0.867 3.057 890 H LYS 110 H LYS 110 20.794 -4.044 2.128 891 HA LYS 110 HA LYS 110 23.767 -3.860 1.981 892 HB2 LYS 110 HB2 LYS 110 21.586 -5.282 0.455 893 HB3 LYS 110 HB3 LYS 110 23.031 -4.819 -0.417 894 HG2 LYS 110 HG2 LYS 110 23.215 -6.333 2.172 895 HG3 LYS 110 HG3 LYS 110 22.890 -7.164 0.610 896 HD2 LYS 110 HD2 LYS 110 24.891 -6.138 -0.353 897 HD3 LYS 110 HD3 LYS 110 25.234 -5.401 1.228 898 HE2 LYS 110 HE2 LYS 110 25.020 -8.306 0.576 899 HE3 LYS 110 HE3 LYS 110 26.544 -7.429 0.641 900 HZ1 LYS 110 HZ1 LYS 110 24.819 -7.844 3.040 901 HZ2 LYS 110 HZ2 LYS 110 26.280 -8.532 2.724 902 HZ3 LYS 110 HZ3 LYS 110 26.202 -6.953 2.962 903 H ILE 111 H ILE 111 24.535 -2.848 -0.038 904 HA ILE 111 HA ILE 111 22.781 -0.705 -1.054 905 HB ILE 111 HB ILE 111 24.195 -0.334 1.325 906 HG12 ILE 111 HG12 ILE 111 23.803 2.260 0.576 907 HG13 ILE 111 HG13 ILE 111 22.672 1.410 -0.468 908 HG21 ILE 111 HG21 ILE 111 26.369 -0.151 0.271 909 HG22 ILE 111 HG22 ILE 111 25.774 1.189 -0.754 910 HG23 ILE 111 HG23 ILE 111 25.885 1.361 1.016 911 HD11 ILE 111 HD11 ILE 111 21.596 1.995 1.643 912 HD12 ILE 111 HD12 ILE 111 21.880 0.227 1.743 913 HD13 ILE 111 HD13 ILE 111 22.941 1.360 2.562 914 H TYR 112 H TYR 112 23.366 -0.067 -3.116 915 HA TYR 112 HA TYR 112 25.973 -0.992 -4.223 916 HB2 TYR 112 HB2 TYR 112 23.129 -1.561 -5.172 917 HB3 TYR 112 HB3 TYR 112 24.582 -1.974 -6.072 918 HD1 TYR 112 HD1 TYR 112 26.341 -3.411 -4.937 919 HD2 TYR 112 HD2 TYR 112 22.326 -3.068 -3.475 920 HE1 TYR 112 HE1 TYR 112 26.589 -5.631 -3.832 921 HE2 TYR 112 HE2 TYR 112 22.517 -5.489 -2.549 922 HH TYR 112 HH TYR 112 25.475 -7.346 -2.930 923 H ASP 113 H ASP 113 26.241 -0.275 -6.551 924 HA ASP 113 HA ASP 113 25.769 2.624 -6.603 925 HB2 ASP 113 HB2 ASP 113 27.834 0.942 -7.560 926 HB3 ASP 113 HB3 ASP 113 27.056 1.504 -9.003 927 H THR 114 H THR 114 24.745 -0.255 -8.418 928 HA THR 114 HA THR 114 22.774 1.412 -9.856 929 HB THR 114 HB THR 114 23.194 0.663 -11.959 930 HG1 THR 114 HG1 THR 114 25.314 -1.019 -11.697 931 HG21 THR 114 HG21 THR 114 26.022 1.010 -10.942 932 HG22 THR 114 HG22 THR 114 25.423 1.279 -12.589 933 HG23 THR 114 HG23 THR 114 24.868 2.322 -11.265 934 H ILE 115 H ILE 115 21.413 -0.278 -11.219 935 HA ILE 115 HA ILE 115 20.222 -2.008 -9.183 936 HB ILE 115 HB ILE 115 19.565 -1.250 -12.045 937 HG12 ILE 115 HG12 ILE 115 19.004 0.306 -10.180 938 HG13 ILE 115 HG13 ILE 115 17.610 -0.234 -11.106 939 HG21 ILE 115 HG21 ILE 115 18.967 -3.560 -12.015 940 HG22 ILE 115 HG22 ILE 115 18.255 -3.458 -10.404 941 HG23 ILE 115 HG23 ILE 115 17.457 -2.662 -11.788 942 HD11 ILE 115 HD11 ILE 115 18.314 -1.646 -8.510 943 HD12 ILE 115 HD12 ILE 115 17.374 -0.147 -8.545 944 HD13 ILE 115 HD13 ILE 115 16.808 -1.585 -9.406 945 H SER 116 H SER 116 22.228 -2.349 -12.145 946 HA SER 116 HA SER 116 21.940 -5.209 -12.116 947 HB2 SER 116 HB2 SER 116 22.633 -3.612 -14.044 948 HB3 SER 116 HB3 SER 116 24.265 -3.698 -13.357 949 HG SER 116 HG SER 116 24.246 -5.924 -13.760 950 H GLU 117 H GLU 117 24.215 -2.872 -10.525 951 HA GLU 117 HA GLU 117 25.931 -4.969 -9.549 952 HB2 GLU 117 HB2 GLU 117 25.842 -2.057 -9.543 953 HB3 GLU 117 HB3 GLU 117 26.112 -2.653 -7.904 954 HG2 GLU 117 HG2 GLU 117 27.929 -4.138 -8.710 955 HG3 GLU 117 HG3 GLU 117 27.679 -3.557 -10.362 956 H ALA 118 H ALA 118 22.697 -4.527 -8.959 957 HA ALA 118 HA ALA 118 23.004 -5.483 -6.163 958 HB1 ALA 118 HB1 ALA 118 20.890 -4.463 -5.667 959 HB2 ALA 118 HB2 ALA 118 21.929 -3.232 -6.400 960 HB3 ALA 118 HB3 ALA 118 20.653 -3.969 -7.373 961 H MET 119 H MET 119 21.412 -5.869 -9.366 962 HA MET 119 HA MET 119 19.380 -7.485 -8.567 963 HB2 MET 119 HB2 MET 119 20.000 -6.244 -10.895 964 HB3 MET 119 HB3 MET 119 20.553 -7.853 -11.351 965 HG2 MET 119 HG2 MET 119 18.302 -8.687 -10.434 966 HG3 MET 119 HG3 MET 119 17.855 -6.977 -10.351 967 HE1 MET 119 HE1 MET 119 17.679 -5.402 -12.415 968 HE2 MET 119 HE2 MET 119 19.217 -5.858 -13.166 969 HE3 MET 119 HE3 MET 119 17.709 -5.932 -14.107 970 H GLU 120 H GLU 120 22.402 -8.600 -10.121 971 HA GLU 120 HA GLU 120 21.791 -11.401 -9.409 972 HB2 GLU 120 HB2 GLU 120 23.976 -11.832 -10.462 973 HB3 GLU 120 HB3 GLU 120 22.831 -10.989 -11.512 974 HG2 GLU 120 HG2 GLU 120 23.996 -8.900 -11.308 975 HG3 GLU 120 HG3 GLU 120 25.031 -9.510 -10.017 976 H GLU 121 H GLU 121 23.194 -8.627 -7.948 977 HA GLU 121 HA GLU 121 25.442 -9.979 -6.818 978 HB2 GLU 121 HB2 GLU 121 24.933 -7.420 -7.548 979 HB3 GLU 121 HB3 GLU 121 24.480 -7.297 -5.851 980 HG2 GLU 121 HG2 GLU 121 26.713 -6.856 -5.659 981 HG3 GLU 121 HG3 GLU 121 26.738 -8.601 -5.444 982 H VAL 122 H VAL 122 22.461 -8.555 -5.552 983 HA VAL 122 HA VAL 122 22.453 -9.033 -2.833 984 HB VAL 122 HB VAL 122 20.887 -7.868 -4.392 985 HG11 VAL 122 HG11 VAL 122 18.842 -8.977 -5.056 986 HG12 VAL 122 HG12 VAL 122 20.217 -9.661 -5.923 987 HG13 VAL 122 HG13 VAL 122 19.482 -10.558 -4.564 988 HG21 VAL 122 HG21 VAL 122 20.027 -9.608 -2.162 989 HG22 VAL 122 HG22 VAL 122 20.649 -7.937 -2.067 990 HG23 VAL 122 HG23 VAL 122 19.037 -8.250 -2.768 991 H ARG 123 H ARG 123 21.796 -11.398 -5.423 992 HA ARG 123 HA ARG 123 21.071 -13.618 -3.876 993 HB2 ARG 123 HB2 ARG 123 22.756 -13.727 -6.424 994 HB3 ARG 123 HB3 ARG 123 21.572 -14.884 -5.842 995 HG2 ARG 123 HG2 ARG 123 19.815 -13.116 -6.043 996 HG3 ARG 123 HG3 ARG 123 20.975 -12.064 -6.876 997 HD2 ARG 123 HD2 ARG 123 21.045 -13.349 -8.787 998 HD3 ARG 123 HD3 ARG 123 20.637 -14.840 -7.916 999 HE ARG 123 HE ARG 123 18.669 -12.731 -7.832 1000 HH11 ARG 123 HH11 ARG 123 19.766 -15.578 -9.642 1001 HH12 ARG 123 HH12 ARG 123 18.223 -15.850 -10.382 1002 HH21 ARG 123 HH21 ARG 123 16.411 -13.508 -8.536 1003 HH22 ARG 123 HH22 ARG 123 16.318 -15.048 -9.287 1004 H ARG 124 H ARG 124 24.358 -12.524 -4.754 1005 HA ARG 124 HA ARG 124 25.573 -14.651 -3.116 1006 HB2 ARG 124 HB2 ARG 124 27.060 -15.245 -4.931 1007 HB3 ARG 124 HB3 ARG 124 25.381 -15.473 -5.396 1008 HG2 ARG 124 HG2 ARG 124 26.021 -12.827 -6.222 1009 HG3 ARG 124 HG3 ARG 124 27.455 -13.774 -6.598 1010 HD2 ARG 124 HD2 ARG 124 25.423 -15.390 -7.556 1011 HD3 ARG 124 HD3 ARG 124 24.739 -13.775 -7.741 1012 HE ARG 124 HE ARG 124 26.416 -15.009 -9.515 1013 HH11 ARG 124 HH11 ARG 124 26.760 -11.843 -7.808 1014 HH12 ARG 124 HH12 ARG 124 27.413 -11.097 -9.213 1015 HH21 ARG 124 HH21 ARG 124 27.559 -13.936 -11.222 1016 HH22 ARG 124 HH22 ARG 124 27.597 -12.192 -11.175 1017 H LYS 125 H LYS 125 25.120 -11.903 -2.684 1018 HA LYS 125 HA LYS 125 27.149 -10.165 -3.037 1019 HB2 LYS 125 HB2 LYS 125 26.218 -8.946 -1.064 1020 HB3 LYS 125 HB3 LYS 125 25.055 -9.509 -2.217 1021 HG2 LYS 125 HG2 LYS 125 24.102 -9.912 -0.127 1022 HG3 LYS 125 HG3 LYS 125 24.467 -11.448 -0.851 1023 HD2 LYS 125 HD2 LYS 125 26.670 -10.505 0.881 1024 HD3 LYS 125 HD3 LYS 125 25.153 -10.579 1.762 1025 HE2 LYS 125 HE2 LYS 125 25.012 -12.849 1.710 1026 HE3 LYS 125 HE3 LYS 125 25.621 -12.936 0.043 1027 HZ1 LYS 125 HZ1 LYS 125 27.408 -12.554 2.371 1028 HZ2 LYS 125 HZ2 LYS 125 27.136 -13.946 1.510 1029 HZ3 LYS 125 HZ3 LYS 125 27.811 -12.682 0.781 Start of MODEL 5 1 H1 MET 1 H1 MET 1 -5.268 3.060 18.351 2 HA MET 1 HA MET 1 -6.556 2.152 16.456 3 HB2 MET 1 HB2 MET 1 -6.099 5.164 16.514 4 HB3 MET 1 HB3 MET 1 -7.348 4.389 15.537 5 HG2 MET 1 HG2 MET 1 -8.359 3.391 17.496 6 HG3 MET 1 HG3 MET 1 -7.128 4.090 18.549 7 HE1 MET 1 HE1 MET 1 -7.112 6.468 19.466 8 HE2 MET 1 HE2 MET 1 -6.730 7.052 17.828 9 HE3 MET 1 HE3 MET 1 -8.024 7.824 18.771 10 H GLY 2 H GLY 2 -6.879 3.119 13.916 11 HA2 GLY 2 HA2 GLY 2 -5.132 3.837 12.146 12 HA3 GLY 2 HA3 GLY 2 -4.348 2.322 12.597 13 H SER 3 H SER 3 -5.546 0.339 12.418 14 HA SER 3 HA SER 3 -6.503 -1.210 11.162 15 HB2 SER 3 HB2 SER 3 -8.862 -1.110 10.700 16 HB3 SER 3 HB3 SER 3 -8.536 -0.400 12.285 17 HG SER 3 HG SER 3 -8.411 1.649 10.873 18 H ASP 4 H ASP 4 -8.080 -1.203 8.805 19 HA ASP 4 HA ASP 4 -6.374 0.215 6.849 20 HB2 ASP 4 HB2 ASP 4 -8.005 -2.324 6.674 21 HB3 ASP 4 HB3 ASP 4 -7.788 -1.330 5.240 22 H LYS 5 H LYS 5 -7.485 1.450 5.257 23 HA LYS 5 HA LYS 5 -10.377 1.814 5.473 24 HB2 LYS 5 HB2 LYS 5 -10.293 4.180 6.007 25 HB3 LYS 5 HB3 LYS 5 -9.413 3.296 7.246 26 HG2 LYS 5 HG2 LYS 5 -7.307 3.884 5.643 27 HG3 LYS 5 HG3 LYS 5 -8.400 5.172 5.135 28 HD2 LYS 5 HD2 LYS 5 -8.643 5.810 7.587 29 HD3 LYS 5 HD3 LYS 5 -7.363 4.617 7.920 30 HE2 LYS 5 HE2 LYS 5 -5.945 5.841 6.173 31 HE3 LYS 5 HE3 LYS 5 -7.177 7.109 6.159 32 HZ1 LYS 5 HZ1 LYS 5 -5.448 7.695 7.637 33 HZ2 LYS 5 HZ2 LYS 5 -6.750 7.344 8.575 34 HZ3 LYS 5 HZ3 LYS 5 -5.532 6.251 8.454 35 H ILE 6 H ILE 6 -11.017 3.555 3.818 36 HA ILE 6 HA ILE 6 -11.156 4.408 1.777 37 HB ILE 6 HB ILE 6 -8.159 3.999 1.562 38 HG12 ILE 6 HG12 ILE 6 -9.321 6.744 1.891 39 HG13 ILE 6 HG13 ILE 6 -9.416 5.737 3.306 40 HG21 ILE 6 HG21 ILE 6 -9.232 4.281 -0.666 41 HG22 ILE 6 HG22 ILE 6 -9.862 5.841 -0.162 42 HG23 ILE 6 HG23 ILE 6 -8.116 5.579 -0.240 43 HD11 ILE 6 HD11 ILE 6 -6.901 6.492 1.775 44 HD12 ILE 6 HD12 ILE 6 -7.364 6.978 3.416 45 HD13 ILE 6 HD13 ILE 6 -6.923 5.294 3.093 46 H HIS 7 H HIS 7 -9.059 1.508 1.698 47 HA HIS 7 HA HIS 7 -9.085 -0.377 0.585 48 HB2 HIS 7 HB2 HIS 7 -11.425 -0.401 1.463 49 HB3 HIS 7 HB3 HIS 7 -11.984 0.023 -0.150 50 HD1 HIS 7 HD1 HIS 7 -11.354 -2.943 1.953 51 HD2 HIS 7 HD2 HIS 7 -10.948 -1.922 -2.132 52 HE1 HIS 7 HE1 HIS 7 -11.416 -5.120 0.637 53 H HIS 8 H HIS 8 -11.225 1.502 -1.627 54 HA HIS 8 HA HIS 8 -9.983 0.541 -4.022 55 HB2 HIS 8 HB2 HIS 8 -11.638 3.065 -3.566 56 HB3 HIS 8 HB3 HIS 8 -11.411 2.219 -5.092 57 HD1 HIS 8 HD1 HIS 8 -14.357 2.692 -3.967 58 HD2 HIS 8 HD2 HIS 8 -11.973 -0.754 -3.530 59 HE1 HIS 8 HE1 HIS 8 -15.951 0.734 -3.613 60 H HIS 9 H HIS 9 -8.266 1.455 -5.358 61 HA HIS 9 HA HIS 9 -7.573 4.236 -4.920 62 HB2 HIS 9 HB2 HIS 9 -5.171 3.809 -4.534 63 HB3 HIS 9 HB3 HIS 9 -6.198 3.490 -3.170 64 HD1 HIS 9 HD1 HIS 9 -5.830 1.153 -2.004 65 HD2 HIS 9 HD2 HIS 9 -4.126 1.552 -5.831 66 HE1 HIS 9 HE1 HIS 9 -4.454 -0.941 -2.402 67 H HIS 10 H HIS 10 -7.217 5.163 -6.771 68 HA HIS 10 HA HIS 10 -5.035 4.160 -8.391 69 HB2 HIS 10 HB2 HIS 10 -7.671 5.118 -9.602 70 HB3 HIS 10 HB3 HIS 10 -6.171 4.998 -10.494 71 HD1 HIS 10 HD1 HIS 10 -5.421 2.533 -11.264 72 HD2 HIS 10 HD2 HIS 10 -8.919 2.904 -9.041 73 HE1 HIS 10 HE1 HIS 10 -6.406 0.167 -11.122 74 H HIS 11 H HIS 11 -3.750 5.945 -8.950 75 HA HIS 11 HA HIS 11 -4.501 8.508 -9.540 76 HB2 HIS 11 HB2 HIS 11 -3.556 9.829 -7.632 77 HB3 HIS 11 HB3 HIS 11 -5.142 9.151 -7.363 78 HD1 HIS 11 HD1 HIS 11 -5.165 6.957 -5.604 79 HD2 HIS 11 HD2 HIS 11 -1.617 9.209 -5.953 80 HE1 HIS 11 HE1 HIS 11 -3.726 6.355 -3.582 81 H HIS 12 H HIS 12 -1.938 6.785 -7.665 82 HA HIS 12 HA HIS 12 0.208 8.003 -9.236 83 HB2 HIS 12 HB2 HIS 12 1.635 6.342 -8.061 84 HB3 HIS 12 HB3 HIS 12 0.710 7.376 -6.994 85 HD1 HIS 12 HD1 HIS 12 0.032 6.052 -4.940 86 HD2 HIS 12 HD2 HIS 12 -0.175 3.829 -8.522 87 HE1 HIS 12 HE1 HIS 12 -0.703 3.705 -4.308 88 H MET 13 H MET 13 1.722 6.490 -10.479 89 HA MET 13 HA MET 13 0.256 4.279 -11.837 90 HB2 MET 13 HB2 MET 13 0.341 6.306 -13.302 91 HB3 MET 13 HB3 MET 13 2.109 6.239 -13.243 92 HG2 MET 13 HG2 MET 13 1.939 3.870 -14.128 93 HG3 MET 13 HG3 MET 13 0.204 4.113 -14.317 94 HE1 MET 13 HE1 MET 13 2.869 3.359 -16.283 95 HE2 MET 13 HE2 MET 13 1.185 3.022 -16.753 96 HE3 MET 13 HE3 MET 13 2.248 3.965 -17.825 97 H PHE 14 H PHE 14 1.291 3.219 -9.990 98 HA PHE 14 HA PHE 14 2.966 2.220 -8.834 99 HB2 PHE 14 HB2 PHE 14 3.102 1.048 -11.615 100 HB3 PHE 14 HB3 PHE 14 3.561 0.257 -10.122 101 HD1 PHE 14 HD1 PHE 14 1.411 0.789 -8.185 102 HD2 PHE 14 HD2 PHE 14 1.171 -0.047 -12.420 103 HE1 PHE 14 HE1 PHE 14 -0.901 0.087 -7.909 104 HE2 PHE 14 HE2 PHE 14 -1.213 -0.674 -12.135 105 HZ PHE 14 HZ PHE 14 -2.264 -0.603 -9.879 106 HA PRO 15 HA PRO 15 6.490 4.833 -10.223 107 HB2 PRO 15 HB2 PRO 15 7.070 6.099 -7.935 108 HB3 PRO 15 HB3 PRO 15 5.562 6.433 -8.814 109 HG2 PRO 15 HG2 PRO 15 5.883 4.518 -6.472 110 HG3 PRO 15 HG3 PRO 15 4.737 5.890 -6.629 111 HD2 PRO 15 HD2 PRO 15 4.024 3.356 -7.300 112 HD3 PRO 15 HD3 PRO 15 3.457 4.757 -8.250 113 H TYR 16 H TYR 16 6.883 2.180 -10.082 114 HA TYR 16 HA TYR 16 9.485 1.730 -8.886 115 HB2 TYR 16 HB2 TYR 16 8.643 -0.088 -7.405 116 HB3 TYR 16 HB3 TYR 16 7.802 1.364 -7.084 117 HD1 TYR 16 HD1 TYR 16 7.423 -1.841 -9.067 118 HD2 TYR 16 HD2 TYR 16 5.486 1.431 -7.015 119 HE1 TYR 16 HE1 TYR 16 5.238 -2.978 -9.311 120 HE2 TYR 16 HE2 TYR 16 3.339 0.210 -7.108 121 HH TYR 16 HH TYR 16 2.390 -1.842 -7.542 122 H LYS 17 H LYS 17 10.109 -0.631 -9.701 123 HA LYS 17 HA LYS 17 8.421 -1.588 -11.917 124 HB2 LYS 17 HB2 LYS 17 10.152 -2.090 -13.433 125 HB3 LYS 17 HB3 LYS 17 10.284 -0.370 -13.078 126 HG2 LYS 17 HG2 LYS 17 12.240 -0.666 -11.770 127 HG3 LYS 17 HG3 LYS 17 11.937 -2.407 -11.582 128 HD2 LYS 17 HD2 LYS 17 13.764 -2.289 -13.013 129 HD3 LYS 17 HD3 LYS 17 12.374 -2.706 -14.026 130 HE2 LYS 17 HE2 LYS 17 12.204 -0.165 -14.475 131 HE3 LYS 17 HE3 LYS 17 13.782 -0.042 -13.649 132 HZ1 LYS 17 HZ1 LYS 17 13.205 -1.677 -16.032 133 HZ2 LYS 17 HZ2 LYS 17 13.944 -0.225 -16.101 134 HZ3 LYS 17 HZ3 LYS 17 14.681 -1.517 -15.338 135 H ILE 18 H ILE 18 9.241 -3.978 -12.462 136 HA ILE 18 HA ILE 18 10.391 -5.232 -10.043 137 HB ILE 18 HB ILE 18 8.050 -6.372 -11.613 138 HG12 ILE 18 HG12 ILE 18 7.990 -5.156 -8.820 139 HG13 ILE 18 HG13 ILE 18 7.248 -4.459 -10.264 140 HG21 ILE 18 HG21 ILE 18 9.601 -8.046 -10.659 141 HG22 ILE 18 HG22 ILE 18 9.462 -7.291 -9.056 142 HG23 ILE 18 HG23 ILE 18 8.071 -8.085 -9.822 143 HD11 ILE 18 HD11 ILE 18 5.843 -6.573 -10.457 144 HD12 ILE 18 HD12 ILE 18 6.394 -6.974 -8.811 145 HD13 ILE 18 HD13 ILE 18 5.476 -5.491 -9.107 146 H VAL 19 H VAL 19 12.304 -6.264 -10.693 147 HA VAL 19 HA VAL 19 12.372 -7.340 -13.407 148 HB VAL 19 HB VAL 19 14.724 -7.286 -13.199 149 HG11 VAL 19 HG11 VAL 19 13.533 -5.322 -14.147 150 HG12 VAL 19 HG12 VAL 19 13.599 -4.534 -12.548 151 HG13 VAL 19 HG13 VAL 19 15.086 -4.893 -13.427 152 HG21 VAL 19 HG21 VAL 19 16.004 -6.181 -11.487 153 HG22 VAL 19 HG22 VAL 19 14.540 -5.785 -10.585 154 HG23 VAL 19 HG23 VAL 19 15.051 -7.481 -10.748 155 H ASP 20 H ASP 20 14.133 -9.236 -13.084 156 HA ASP 20 HA ASP 20 12.895 -11.339 -13.206 157 HB2 ASP 20 HB2 ASP 20 15.492 -11.148 -11.653 158 HB3 ASP 20 HB3 ASP 20 14.816 -12.686 -12.234 159 H ASP 21 H ASP 21 13.943 -10.550 -9.927 160 HA ASP 21 HA ASP 21 11.366 -11.423 -8.944 161 HB2 ASP 21 HB2 ASP 21 13.627 -12.596 -7.326 162 HB3 ASP 21 HB3 ASP 21 11.886 -12.869 -7.302 163 H VAL 22 H VAL 22 13.370 -8.979 -9.115 164 HA VAL 22 HA VAL 22 13.530 -8.375 -6.198 165 HB VAL 22 HB VAL 22 15.587 -7.385 -8.257 166 HG11 VAL 22 HG11 VAL 22 15.069 -7.057 -5.254 167 HG12 VAL 22 HG12 VAL 22 16.648 -6.801 -5.976 168 HG13 VAL 22 HG13 VAL 22 15.282 -5.810 -6.489 169 HG21 VAL 22 HG21 VAL 22 16.200 -9.284 -5.987 170 HG22 VAL 22 HG22 VAL 22 15.668 -9.957 -7.530 171 HG23 VAL 22 HG23 VAL 22 17.105 -8.930 -7.462 172 H VAL 23 H VAL 23 11.981 -6.837 -5.874 173 HA VAL 23 HA VAL 23 10.768 -5.239 -7.985 174 HB VAL 23 HB VAL 23 10.725 -4.817 -4.998 175 HG11 VAL 23 HG11 VAL 23 9.795 -2.905 -6.171 176 HG12 VAL 23 HG12 VAL 23 8.674 -3.963 -7.049 177 HG13 VAL 23 HG13 VAL 23 8.572 -3.779 -5.286 178 HG21 VAL 23 HG21 VAL 23 9.990 -7.163 -5.471 179 HG22 VAL 23 HG22 VAL 23 8.684 -6.156 -4.900 180 HG23 VAL 23 HG23 VAL 23 8.793 -6.533 -6.628 181 H ILE 24 H ILE 24 11.043 -2.832 -8.173 182 HA ILE 24 HA ILE 24 13.509 -1.726 -6.902 183 HB ILE 24 HB ILE 24 12.541 -1.063 -9.690 184 HG12 ILE 24 HG12 ILE 24 13.089 -3.385 -9.962 185 HG13 ILE 24 HG13 ILE 24 14.281 -2.334 -10.733 186 HG21 ILE 24 HG21 ILE 24 13.899 0.631 -8.720 187 HG22 ILE 24 HG22 ILE 24 15.118 -0.516 -8.197 188 HG23 ILE 24 HG23 ILE 24 14.888 -0.192 -9.936 189 HD11 ILE 24 HD11 ILE 24 15.689 -3.789 -9.861 190 HD12 ILE 24 HD12 ILE 24 15.534 -2.700 -8.463 191 HD13 ILE 24 HD13 ILE 24 14.632 -4.229 -8.506 192 H LEU 25 H LEU 25 12.318 -0.399 -5.280 193 HA LEU 25 HA LEU 25 10.114 1.235 -6.202 194 HB2 LEU 25 HB2 LEU 25 11.801 1.423 -3.693 195 HB3 LEU 25 HB3 LEU 25 10.385 2.377 -4.094 196 HG LEU 25 HG LEU 25 9.432 0.856 -2.767 197 HD11 LEU 25 HD11 LEU 25 8.114 -0.806 -3.947 198 HD12 LEU 25 HD12 LEU 25 8.289 0.593 -5.017 199 HD13 LEU 25 HD13 LEU 25 9.262 -0.857 -5.281 200 HD21 LEU 25 HD21 LEU 25 9.934 -1.435 -2.425 201 HD22 LEU 25 HD22 LEU 25 11.054 -1.416 -3.817 202 HD23 LEU 25 HD23 LEU 25 11.431 -0.486 -2.343 203 H MET 26 H MET 26 10.323 3.352 -7.047 204 HA MET 26 HA MET 26 13.066 4.507 -7.220 205 HB2 MET 26 HB2 MET 26 11.050 4.304 -9.470 206 HB3 MET 26 HB3 MET 26 12.587 5.189 -9.507 207 HG2 MET 26 HG2 MET 26 13.706 2.960 -8.921 208 HG3 MET 26 HG3 MET 26 12.159 2.195 -9.280 209 HE1 MET 26 HE1 MET 26 11.745 3.219 -13.114 210 HE2 MET 26 HE2 MET 26 10.943 2.453 -11.718 211 HE3 MET 26 HE3 MET 26 11.244 4.204 -11.742 212 HA PRO 27 HA PRO 27 9.858 7.340 -5.439 213 HB2 PRO 27 HB2 PRO 27 11.307 8.313 -3.334 214 HB3 PRO 27 HB3 PRO 27 10.425 6.754 -3.301 215 HG2 PRO 27 HG2 PRO 27 13.352 7.189 -3.960 216 HG3 PRO 27 HG3 PRO 27 12.664 6.080 -2.737 217 HD2 PRO 27 HD2 PRO 27 13.311 5.193 -5.201 218 HD3 PRO 27 HD3 PRO 27 11.781 4.658 -4.458 219 H ASN 28 H ASN 28 9.595 9.343 -5.863 220 HA ASN 28 HA ASN 28 11.887 11.123 -6.557 221 HB2 ASN 28 HB2 ASN 28 9.945 12.367 -7.910 222 HB3 ASN 28 HB3 ASN 28 10.897 11.062 -8.564 223 HD21 ASN 28 HD21 ASN 28 7.482 11.588 -7.039 224 HD22 ASN 28 HD22 ASN 28 7.038 10.031 -7.661 225 H LYS 29 H LYS 29 8.478 11.773 -5.710 226 HA LYS 29 HA LYS 29 9.374 13.536 -3.475 227 HB2 LYS 29 HB2 LYS 29 8.045 14.352 -6.055 228 HB3 LYS 29 HB3 LYS 29 7.395 15.066 -4.610 229 HG2 LYS 29 HG2 LYS 29 8.966 16.571 -4.566 230 HG3 LYS 29 HG3 LYS 29 10.179 15.342 -4.274 231 HD2 LYS 29 HD2 LYS 29 9.286 16.278 -7.035 232 HD3 LYS 29 HD3 LYS 29 10.681 16.908 -6.140 233 HE2 LYS 29 HE2 LYS 29 11.505 14.455 -6.017 234 HE3 LYS 29 HE3 LYS 29 10.265 14.125 -7.242 235 HZ1 LYS 29 HZ1 LYS 29 12.297 14.515 -8.340 236 HZ2 LYS 29 HZ2 LYS 29 11.398 15.832 -8.622 237 HZ3 LYS 29 HZ3 LYS 29 12.600 15.906 -7.486 238 H GLU 30 H GLU 30 7.888 10.840 -3.839 239 HA GLU 30 HA GLU 30 5.181 11.661 -2.949 240 HB2 GLU 30 HB2 GLU 30 4.413 9.721 -4.108 241 HB3 GLU 30 HB3 GLU 30 5.514 10.645 -5.121 242 HG2 GLU 30 HG2 GLU 30 7.273 8.881 -4.034 243 HG3 GLU 30 HG3 GLU 30 5.821 7.930 -4.056 244 H LEU 31 H LEU 31 7.636 11.196 -1.179 245 HA LEU 31 HA LEU 31 6.819 8.773 0.335 246 HB2 LEU 31 HB2 LEU 31 9.290 10.540 0.623 247 HB3 LEU 31 HB3 LEU 31 8.944 9.062 1.510 248 HG LEU 31 HG LEU 31 9.593 9.363 -1.444 249 HD11 LEU 31 HD11 LEU 31 11.416 9.189 0.303 250 HD12 LEU 31 HD12 LEU 31 10.797 7.573 0.697 251 HD13 LEU 31 HD13 LEU 31 11.453 7.911 -0.926 252 HD21 LEU 31 HD21 LEU 31 9.250 6.799 -1.482 253 HD22 LEU 31 HD22 LEU 31 8.333 7.013 0.015 254 HD23 LEU 31 HD23 LEU 31 7.803 7.789 -1.525 255 H ASN 32 H ASN 32 4.842 9.854 0.849 256 HA ASN 32 HA ASN 32 4.943 12.191 2.672 257 HB2 ASN 32 HB2 ASN 32 2.518 10.474 1.971 258 HB3 ASN 32 HB3 ASN 32 2.550 12.097 2.639 259 HD21 ASN 32 HD21 ASN 32 3.365 10.225 -0.413 260 HD22 ASN 32 HD22 ASN 32 2.975 11.606 -1.422 261 H ILE 33 H ILE 33 4.637 11.894 4.955 262 HA ILE 33 HA ILE 33 4.975 9.450 6.247 263 HB ILE 33 HB ILE 33 5.238 11.485 7.420 264 HG12 ILE 33 HG12 ILE 33 2.773 10.217 8.679 265 HG13 ILE 33 HG13 ILE 33 4.345 9.419 8.636 266 HG21 ILE 33 HG21 ILE 33 3.368 13.011 7.987 267 HG22 ILE 33 HG22 ILE 33 3.631 12.922 6.248 268 HG23 ILE 33 HG23 ILE 33 2.269 12.048 6.989 269 HD11 ILE 33 HD11 ILE 33 4.000 10.545 10.784 270 HD12 ILE 33 HD12 ILE 33 5.359 11.264 9.895 271 HD13 ILE 33 HD13 ILE 33 3.801 12.106 9.972 272 H GLU 34 H GLU 34 1.925 10.846 5.030 273 HA GLU 34 HA GLU 34 0.153 9.011 6.261 274 HB2 GLU 34 HB2 GLU 34 -0.186 10.441 3.598 275 HB3 GLU 34 HB3 GLU 34 -1.470 9.752 4.605 276 HG2 GLU 34 HG2 GLU 34 -0.830 11.374 6.427 277 HG3 GLU 34 HG3 GLU 34 0.313 12.127 5.304 278 H ASN 35 H ASN 35 1.678 8.886 2.986 279 HA ASN 35 HA ASN 35 0.620 6.173 2.605 280 HB2 ASN 35 HB2 ASN 35 1.217 6.187 0.489 281 HB3 ASN 35 HB3 ASN 35 0.940 7.901 0.739 282 HD21 ASN 35 HD21 ASN 35 3.293 5.350 0.197 283 HD22 ASN 35 HD22 ASN 35 4.689 6.390 0.032 284 H ALA 36 H ALA 36 3.498 7.517 4.056 285 HA ALA 36 HA ALA 36 5.082 5.178 3.916 286 HB1 ALA 36 HB1 ALA 36 6.350 6.078 5.717 287 HB2 ALA 36 HB2 ALA 36 5.923 7.394 4.605 288 HB3 ALA 36 HB3 ALA 36 5.060 7.214 6.149 289 H HIS 37 H HIS 37 2.517 6.191 6.294 290 HA HIS 37 HA HIS 37 2.840 3.859 7.929 291 HB2 HIS 37 HB2 HIS 37 1.268 6.030 8.174 292 HB3 HIS 37 HB3 HIS 37 0.059 4.909 7.563 293 HD1 HIS 37 HD1 HIS 37 1.183 6.137 10.683 294 HD2 HIS 37 HD2 HIS 37 0.493 2.262 9.165 295 HE1 HIS 37 HE1 HIS 37 0.979 4.567 12.708 296 H LEU 38 H LEU 38 1.052 4.422 4.923 297 HA LEU 38 HA LEU 38 -0.184 1.801 4.782 298 HB2 LEU 38 HB2 LEU 38 0.297 3.884 2.605 299 HB3 LEU 38 HB3 LEU 38 -0.720 2.468 2.450 300 HG LEU 38 HG LEU 38 -1.220 4.735 4.435 301 HD11 LEU 38 HD11 LEU 38 -1.585 5.617 2.254 302 HD12 LEU 38 HD12 LEU 38 -2.398 4.137 1.708 303 HD13 LEU 38 HD13 LEU 38 -3.189 5.194 2.880 304 HD21 LEU 38 HD21 LEU 38 -2.799 2.251 3.695 305 HD22 LEU 38 HD22 LEU 38 -2.090 2.654 5.276 306 HD23 LEU 38 HD23 LEU 38 -3.452 3.601 4.649 307 H PHE 39 H PHE 39 2.882 3.069 3.809 308 HA PHE 39 HA PHE 39 3.616 1.627 1.651 309 HB2 PHE 39 HB2 PHE 39 4.978 3.201 3.403 310 HB3 PHE 39 HB3 PHE 39 5.747 1.687 3.754 311 HD1 PHE 39 HD1 PHE 39 4.896 4.029 0.976 312 HD2 PHE 39 HD2 PHE 39 7.622 0.948 2.334 313 HE1 PHE 39 HE1 PHE 39 6.606 4.912 -0.541 314 HE2 PHE 39 HE2 PHE 39 9.383 1.924 0.880 315 HZ PHE 39 HZ PHE 39 8.894 3.921 -0.503 316 H LYS 40 H LYS 40 3.674 0.454 5.008 317 HA LYS 40 HA LYS 40 4.999 -2.001 4.401 318 HB2 LYS 40 HB2 LYS 40 4.467 -0.845 6.746 319 HB3 LYS 40 HB3 LYS 40 3.012 -1.835 6.681 320 HG2 LYS 40 HG2 LYS 40 4.955 -3.656 5.940 321 HG3 LYS 40 HG3 LYS 40 5.910 -2.574 6.930 322 HD2 LYS 40 HD2 LYS 40 5.279 -4.242 8.389 323 HD3 LYS 40 HD3 LYS 40 4.116 -2.986 8.785 324 HE2 LYS 40 HE2 LYS 40 3.575 -5.230 6.766 325 HE3 LYS 40 HE3 LYS 40 3.321 -5.451 8.493 326 HZ1 LYS 40 HZ1 LYS 40 1.301 -4.912 7.606 327 HZ2 LYS 40 HZ2 LYS 40 1.784 -3.533 8.381 328 HZ3 LYS 40 HZ3 LYS 40 1.846 -3.630 6.731 329 H LYS 41 H LYS 41 1.536 -1.150 4.583 330 HA LYS 41 HA LYS 41 0.467 -3.771 4.030 331 HB2 LYS 41 HB2 LYS 41 -0.509 -1.195 4.685 332 HB3 LYS 41 HB3 LYS 41 -1.041 -1.367 3.036 333 HG2 LYS 41 HG2 LYS 41 -1.580 -3.492 5.147 334 HG3 LYS 41 HG3 LYS 41 -2.558 -2.050 4.987 335 HD2 LYS 41 HD2 LYS 41 -3.804 -3.513 3.809 336 HD3 LYS 41 HD3 LYS 41 -2.900 -2.735 2.500 337 HE2 LYS 41 HE2 LYS 41 -1.408 -4.708 2.372 338 HE3 LYS 41 HE3 LYS 41 -2.170 -5.390 3.812 339 HZ1 LYS 41 HZ1 LYS 41 -3.360 -5.092 1.130 340 HZ2 LYS 41 HZ2 LYS 41 -3.089 -6.444 2.013 341 HZ3 LYS 41 HZ3 LYS 41 -4.292 -5.356 2.446 342 H TRP 42 H TRP 42 1.254 -0.958 1.943 343 HA TRP 42 HA TRP 42 0.636 -2.192 -0.531 344 HB2 TRP 42 HB2 TRP 42 0.875 0.141 -0.526 345 HB3 TRP 42 HB3 TRP 42 2.418 0.082 0.312 346 HD1 TRP 42 HD1 TRP 42 1.192 -1.167 -3.202 347 HE1 TRP 42 HE1 TRP 42 2.925 -0.672 -4.894 348 HE3 TRP 42 HE3 TRP 42 4.663 0.815 -0.051 349 HZ2 TRP 42 HZ2 TRP 42 5.713 0.576 -4.896 350 HZ3 TRP 42 HZ3 TRP 42 6.832 1.538 -0.843 351 HH2 TRP 42 HH2 TRP 42 7.314 1.566 -3.380 352 H VAL 43 H VAL 43 4.076 -1.779 0.725 353 HA VAL 43 HA VAL 43 5.102 -3.462 -1.216 354 HB VAL 43 HB VAL 43 6.135 -2.889 1.592 355 HG11 VAL 43 HG11 VAL 43 7.815 -4.050 -0.669 356 HG12 VAL 43 HG12 VAL 43 8.348 -3.587 0.938 357 HG13 VAL 43 HG13 VAL 43 7.266 -4.950 0.766 358 HG21 VAL 43 HG21 VAL 43 6.588 -1.635 -1.137 359 HG22 VAL 43 HG22 VAL 43 6.162 -0.873 0.411 360 HG23 VAL 43 HG23 VAL 43 7.789 -1.452 0.138 361 H PHE 44 H PHE 44 3.476 -4.452 1.803 362 HA PHE 44 HA PHE 44 4.274 -7.126 1.689 363 HB2 PHE 44 HB2 PHE 44 2.118 -5.545 3.081 364 HB3 PHE 44 HB3 PHE 44 1.987 -7.262 3.014 365 HD1 PHE 44 HD1 PHE 44 5.219 -5.168 3.550 366 HD2 PHE 44 HD2 PHE 44 2.365 -8.057 5.126 367 HE1 PHE 44 HE1 PHE 44 6.637 -5.539 5.508 368 HE2 PHE 44 HE2 PHE 44 3.799 -8.356 7.108 369 HZ PHE 44 HZ PHE 44 5.943 -7.115 7.274 370 H ASP 45 H ASP 45 1.088 -5.825 0.953 371 HA ASP 45 HA ASP 45 0.275 -8.215 -0.465 372 HB2 ASP 45 HB2 ASP 45 -1.056 -5.674 0.189 373 HB3 ASP 45 HB3 ASP 45 -1.635 -6.519 -1.244 374 H GLU 46 H GLU 46 1.716 -5.284 -1.682 375 HA GLU 46 HA GLU 46 1.146 -5.798 -4.468 376 HB2 GLU 46 HB2 GLU 46 1.732 -3.586 -3.200 377 HB3 GLU 46 HB3 GLU 46 3.395 -4.143 -3.255 378 HG2 GLU 46 HG2 GLU 46 3.455 -2.894 -5.079 379 HG3 GLU 46 HG3 GLU 46 2.772 -4.304 -5.923 380 H PHE 47 H PHE 47 3.701 -6.875 -2.128 381 HA PHE 47 HA PHE 47 5.020 -8.285 -4.354 382 HB2 PHE 47 HB2 PHE 47 6.706 -6.752 -2.386 383 HB3 PHE 47 HB3 PHE 47 7.162 -7.502 -3.895 384 HD1 PHE 47 HD1 PHE 47 5.889 -6.463 -6.088 385 HD2 PHE 47 HD2 PHE 47 6.574 -4.472 -2.353 386 HE1 PHE 47 HE1 PHE 47 5.672 -4.261 -7.209 387 HE2 PHE 47 HE2 PHE 47 6.308 -2.255 -3.460 388 HZ PHE 47 HZ PHE 47 5.884 -2.157 -5.908 389 H LEU 48 H LEU 48 5.448 -7.763 -0.785 390 HA LEU 48 HA LEU 48 6.816 -10.195 -0.460 391 HB2 LEU 48 HB2 LEU 48 5.120 -8.865 1.665 392 HB3 LEU 48 HB3 LEU 48 6.375 -10.047 1.942 393 HG LEU 48 HG LEU 48 6.716 -7.173 1.081 394 HD11 LEU 48 HD11 LEU 48 8.059 -8.759 3.296 395 HD12 LEU 48 HD12 LEU 48 8.073 -6.998 3.062 396 HD13 LEU 48 HD13 LEU 48 6.572 -7.835 3.520 397 HD21 LEU 48 HD21 LEU 48 8.787 -9.395 0.939 398 HD22 LEU 48 HD22 LEU 48 8.231 -8.368 -0.394 399 HD23 LEU 48 HD23 LEU 48 9.173 -7.651 0.923 400 H ASN 49 H ASN 49 3.432 -9.555 0.248 401 HA ASN 49 HA ASN 49 2.690 -12.268 0.987 402 HB2 ASN 49 HB2 ASN 49 1.212 -9.745 0.251 403 HB3 ASN 49 HB3 ASN 49 0.345 -11.217 0.545 404 HD21 ASN 49 HD21 ASN 49 -0.425 -9.102 2.221 405 HD22 ASN 49 HD22 ASN 49 0.285 -9.402 3.772 406 H LYS 50 H LYS 50 2.763 -10.292 -1.948 407 HA LYS 50 HA LYS 50 1.249 -11.896 -3.698 408 HB2 LYS 50 HB2 LYS 50 2.923 -9.559 -3.800 409 HB3 LYS 50 HB3 LYS 50 3.536 -10.645 -5.028 410 HG2 LYS 50 HG2 LYS 50 0.599 -10.367 -5.063 411 HG3 LYS 50 HG3 LYS 50 1.425 -8.828 -5.225 412 HD2 LYS 50 HD2 LYS 50 2.711 -9.647 -7.121 413 HD3 LYS 50 HD3 LYS 50 2.003 -11.266 -6.946 414 HE2 LYS 50 HE2 LYS 50 0.386 -8.731 -7.402 415 HE3 LYS 50 HE3 LYS 50 0.970 -9.747 -8.720 416 HZ1 LYS 50 HZ1 LYS 50 -0.798 -10.774 -6.572 417 HZ2 LYS 50 HZ2 LYS 50 -1.316 -10.287 -8.072 418 HZ3 LYS 50 HZ3 LYS 50 -0.324 -11.566 -7.899 419 H GLY 51 H GLY 51 4.644 -12.142 -2.708 420 HA2 GLY 51 HA2 GLY 51 5.271 -14.680 -2.686 421 HA3 GLY 51 HA3 GLY 51 5.060 -14.540 -4.426 422 H TYR 52 H TYR 52 6.352 -11.619 -3.060 423 HA TYR 52 HA TYR 52 8.929 -12.262 -4.322 424 HB2 TYR 52 HB2 TYR 52 7.680 -9.648 -3.452 425 HB3 TYR 52 HB3 TYR 52 9.333 -9.776 -4.021 426 HD1 TYR 52 HD1 TYR 52 5.771 -10.173 -5.126 427 HD2 TYR 52 HD2 TYR 52 9.907 -10.152 -6.293 428 HE1 TYR 52 HE1 TYR 52 5.085 -10.136 -7.473 429 HE2 TYR 52 HE2 TYR 52 9.259 -10.271 -8.657 430 HH TYR 52 HH TYR 52 5.771 -10.380 -9.628 431 H ASN 53 H ASN 53 10.921 -11.835 -3.334 432 HA ASN 53 HA ASN 53 11.089 -11.629 -0.410 433 HB2 ASN 53 HB2 ASN 53 11.292 -14.134 -1.955 434 HB3 ASN 53 HB3 ASN 53 12.750 -13.826 -1.038 435 HD21 ASN 53 HD21 ASN 53 12.648 -15.198 0.706 436 HD22 ASN 53 HD22 ASN 53 11.180 -15.435 1.650 437 H LYS 54 H LYS 54 11.678 -9.666 -2.291 438 HA LYS 54 HA LYS 54 14.169 -8.808 -1.451 439 HB2 LYS 54 HB2 LYS 54 15.112 -8.858 -3.901 440 HB3 LYS 54 HB3 LYS 54 15.536 -10.101 -2.779 441 HG2 LYS 54 HG2 LYS 54 13.270 -10.958 -4.171 442 HG3 LYS 54 HG3 LYS 54 14.527 -10.317 -5.264 443 HD2 LYS 54 HD2 LYS 54 15.856 -12.048 -5.136 444 HD3 LYS 54 HD3 LYS 54 15.689 -12.172 -3.367 445 HE2 LYS 54 HE2 LYS 54 13.560 -13.195 -3.515 446 HE3 LYS 54 HE3 LYS 54 13.488 -12.843 -5.268 447 HZ1 LYS 54 HZ1 LYS 54 15.395 -14.417 -5.552 448 HZ2 LYS 54 HZ2 LYS 54 15.205 -14.917 -4.011 449 HZ3 LYS 54 HZ3 LYS 54 14.016 -15.147 -5.118 450 H ILE 55 H ILE 55 14.657 -6.779 -2.410 451 HA ILE 55 HA ILE 55 12.787 -5.439 -4.153 452 HB ILE 55 HB ILE 55 12.701 -5.234 -1.119 453 HG12 ILE 55 HG12 ILE 55 10.243 -4.462 -2.477 454 HG13 ILE 55 HG13 ILE 55 10.835 -5.910 -3.233 455 HG21 ILE 55 HG21 ILE 55 13.299 -2.962 -1.601 456 HG22 ILE 55 HG22 ILE 55 12.172 -2.919 -2.963 457 HG23 ILE 55 HG23 ILE 55 11.566 -2.996 -1.292 458 HD11 ILE 55 HD11 ILE 55 9.257 -6.461 -1.535 459 HD12 ILE 55 HD12 ILE 55 10.843 -7.120 -1.113 460 HD13 ILE 55 HD13 ILE 55 10.223 -5.631 -0.310 461 H PHE 56 H PHE 56 13.731 -3.245 -4.587 462 HA PHE 56 HA PHE 56 16.308 -2.672 -3.312 463 HB2 PHE 56 HB2 PHE 56 15.622 -2.611 -6.267 464 HB3 PHE 56 HB3 PHE 56 16.980 -1.773 -5.609 465 HD1 PHE 56 HD1 PHE 56 17.835 -4.012 -3.553 466 HD2 PHE 56 HD2 PHE 56 17.111 -3.818 -7.805 467 HE1 PHE 56 HE1 PHE 56 19.501 -5.780 -3.988 468 HE2 PHE 56 HE2 PHE 56 18.487 -5.763 -8.185 469 HZ PHE 56 HZ PHE 56 19.815 -6.682 -6.294 470 H LEU 57 H LEU 57 16.646 -0.436 -2.930 471 HA LEU 57 HA LEU 57 14.382 1.396 -3.664 472 HB2 LEU 57 HB2 LEU 57 14.388 0.865 -1.306 473 HB3 LEU 57 HB3 LEU 57 16.128 1.140 -1.202 474 HG LEU 57 HG LEU 57 15.801 3.555 -1.631 475 HD11 LEU 57 HD11 LEU 57 12.839 2.839 -1.592 476 HD12 LEU 57 HD12 LEU 57 13.497 4.479 -1.442 477 HD13 LEU 57 HD13 LEU 57 13.746 3.575 -2.938 478 HD21 LEU 57 HD21 LEU 57 14.732 4.057 0.558 479 HD22 LEU 57 HD22 LEU 57 14.138 2.390 0.631 480 HD23 LEU 57 HD23 LEU 57 15.886 2.724 0.671 481 H VAL 58 H VAL 58 15.106 2.733 -5.322 482 HA VAL 58 HA VAL 58 17.908 3.564 -5.525 483 HB VAL 58 HB VAL 58 15.452 4.606 -7.017 484 HG11 VAL 58 HG11 VAL 58 18.438 4.680 -7.684 485 HG12 VAL 58 HG12 VAL 58 17.132 5.221 -8.763 486 HG13 VAL 58 HG13 VAL 58 17.415 6.066 -7.252 487 HG21 VAL 58 HG21 VAL 58 17.353 2.388 -7.868 488 HG22 VAL 58 HG22 VAL 58 15.625 2.181 -7.432 489 HG23 VAL 58 HG23 VAL 58 16.069 3.118 -8.853 490 H LEU 59 H LEU 59 18.746 5.500 -4.665 491 HA LEU 59 HA LEU 59 16.793 7.456 -3.519 492 HB2 LEU 59 HB2 LEU 59 19.469 6.641 -2.397 493 HB3 LEU 59 HB3 LEU 59 18.429 7.894 -1.749 494 HG LEU 59 HG LEU 59 16.826 5.507 -2.056 495 HD11 LEU 59 HD11 LEU 59 17.938 3.888 -0.728 496 HD12 LEU 59 HD12 LEU 59 19.013 4.322 -2.055 497 HD13 LEU 59 HD13 LEU 59 19.329 4.972 -0.430 498 HD21 LEU 59 HD21 LEU 59 16.443 5.688 0.307 499 HD22 LEU 59 HD22 LEU 59 17.767 6.854 0.468 500 HD23 LEU 59 HD23 LEU 59 16.322 7.258 -0.498 501 H SER 60 H SER 60 17.431 7.687 -6.087 502 HA SER 60 HA SER 60 19.683 9.614 -6.302 503 HB2 SER 60 HB2 SER 60 19.510 7.489 -7.744 504 HB3 SER 60 HB3 SER 60 18.181 8.299 -8.591 505 HG SER 60 HG SER 60 20.689 8.467 -9.089 506 H ASP 61 H ASP 61 16.173 9.168 -7.213 507 HA ASP 61 HA ASP 61 15.957 11.993 -7.993 508 HB2 ASP 61 HB2 ASP 61 14.145 9.585 -7.994 509 HB3 ASP 61 HB3 ASP 61 13.434 11.204 -8.010 510 H VAL 62 H VAL 62 15.840 10.234 -5.083 511 HA VAL 62 HA VAL 62 14.310 12.344 -3.691 512 HB VAL 62 HB VAL 62 13.286 10.164 -3.507 513 HG11 VAL 62 HG11 VAL 62 14.248 8.367 -2.153 514 HG12 VAL 62 HG12 VAL 62 15.115 8.643 -3.674 515 HG13 VAL 62 HG13 VAL 62 15.804 9.202 -2.131 516 HG21 VAL 62 HG21 VAL 62 13.075 11.820 -1.725 517 HG22 VAL 62 HG22 VAL 62 13.023 10.178 -1.077 518 HG23 VAL 62 HG23 VAL 62 14.497 11.146 -0.908 519 H GLU 63 H GLU 63 15.593 13.778 -2.657 520 HA GLU 63 HA GLU 63 18.472 13.450 -2.443 521 HB2 GLU 63 HB2 GLU 63 17.167 15.641 -2.741 522 HB3 GLU 63 HB3 GLU 63 16.451 15.405 -1.165 523 HG2 GLU 63 HG2 GLU 63 18.163 16.929 -0.735 524 HG3 GLU 63 HG3 GLU 63 18.846 15.446 -0.174 525 H SER 64 H SER 64 15.593 13.437 -0.276 526 HA SER 64 HA SER 64 16.946 11.905 1.737 527 HB2 SER 64 HB2 SER 64 16.936 13.701 3.427 528 HB3 SER 64 HB3 SER 64 17.918 14.100 1.997 529 HG SER 64 HG SER 64 16.066 15.285 1.229 530 H ILE 65 H ILE 65 15.536 11.690 3.651 531 HA ILE 65 HA ILE 65 12.696 11.622 2.897 532 HB ILE 65 HB ILE 65 13.866 9.590 2.249 533 HG12 ILE 65 HG12 ILE 65 12.105 9.038 4.652 534 HG13 ILE 65 HG13 ILE 65 11.506 9.589 3.082 535 HG21 ILE 65 HG21 ILE 65 15.734 9.574 3.833 536 HG22 ILE 65 HG22 ILE 65 14.591 9.380 5.187 537 HG23 ILE 65 HG23 ILE 65 14.843 8.073 4.004 538 HD11 ILE 65 HD11 ILE 65 12.814 7.542 2.082 539 HD12 ILE 65 HD12 ILE 65 12.884 6.966 3.759 540 HD13 ILE 65 HD13 ILE 65 11.329 7.223 2.967 541 H ASP 66 H ASP 66 11.274 11.485 4.712 542 HA ASP 66 HA ASP 66 12.258 13.014 7.008 543 HB2 ASP 66 HB2 ASP 66 9.566 11.646 6.740 544 HB3 ASP 66 HB3 ASP 66 10.024 12.784 7.981 545 H SER 67 H SER 67 12.222 12.194 9.250 546 HA SER 67 HA SER 67 13.535 9.721 9.384 547 HB2 SER 67 HB2 SER 67 13.392 10.033 11.874 548 HB3 SER 67 HB3 SER 67 14.084 11.381 10.964 549 HG SER 67 HG SER 67 11.893 11.248 12.543 550 H PHE 68 H PHE 68 10.214 10.180 9.176 551 HA PHE 68 HA PHE 68 9.304 7.833 10.650 552 HB2 PHE 68 HB2 PHE 68 7.878 9.877 10.110 553 HB3 PHE 68 HB3 PHE 68 7.909 9.417 8.430 554 HD1 PHE 68 HD1 PHE 68 6.939 7.009 7.839 555 HD2 PHE 68 HD2 PHE 68 6.172 9.110 11.522 556 HE1 PHE 68 HE1 PHE 68 4.900 5.656 8.202 557 HE2 PHE 68 HE2 PHE 68 4.151 7.753 11.876 558 HZ PHE 68 HZ PHE 68 3.500 6.020 10.212 559 H SER 69 H SER 69 9.329 8.579 7.085 560 HA SER 69 HA SER 69 8.792 5.894 6.437 561 HB2 SER 69 HB2 SER 69 8.160 7.661 5.084 562 HB3 SER 69 HB3 SER 69 9.815 8.223 4.766 563 HG SER 69 HG SER 69 8.599 6.929 3.146 564 H LEU 70 H LEU 70 11.827 7.665 6.684 565 HA LEU 70 HA LEU 70 13.766 5.959 5.772 566 HB2 LEU 70 HB2 LEU 70 14.062 8.164 6.910 567 HB3 LEU 70 HB3 LEU 70 13.374 7.528 8.377 568 HG LEU 70 HG LEU 70 15.328 6.154 8.812 569 HD11 LEU 70 HD11 LEU 70 16.408 7.452 6.270 570 HD12 LEU 70 HD12 LEU 70 17.395 6.660 7.510 571 HD13 LEU 70 HD13 LEU 70 16.194 5.729 6.592 572 HD21 LEU 70 HD21 LEU 70 15.185 8.425 9.707 573 HD22 LEU 70 HD22 LEU 70 16.852 8.079 9.288 574 HD23 LEU 70 HD23 LEU 70 15.882 9.105 8.211 575 H GLY 71 H GLY 71 11.766 5.364 8.686 576 HA2 GLY 71 HA2 GLY 71 13.312 2.822 9.050 577 HA3 GLY 71 HA3 GLY 71 12.527 3.637 10.370 578 H VAL 72 H VAL 72 10.502 3.910 7.704 579 HA VAL 72 HA VAL 72 8.879 1.465 8.178 580 HB VAL 72 HB VAL 72 8.722 3.834 6.210 581 HG11 VAL 72 HG11 VAL 72 6.849 1.482 6.488 582 HG12 VAL 72 HG12 VAL 72 6.585 2.981 5.547 583 HG13 VAL 72 HG13 VAL 72 7.870 1.932 5.067 584 HG21 VAL 72 HG21 VAL 72 6.718 4.375 7.488 585 HG22 VAL 72 HG22 VAL 72 7.041 3.033 8.617 586 HG23 VAL 72 HG23 VAL 72 8.167 4.402 8.491 587 H ILE 73 H ILE 73 11.251 2.825 6.064 588 HA ILE 73 HA ILE 73 11.330 0.718 4.130 589 HB ILE 73 HB ILE 73 13.113 3.038 4.814 590 HG12 ILE 73 HG12 ILE 73 12.306 2.444 2.029 591 HG13 ILE 73 HG13 ILE 73 10.918 2.525 3.091 592 HG21 ILE 73 HG21 ILE 73 14.627 2.379 2.962 593 HG22 ILE 73 HG22 ILE 73 14.761 1.274 4.317 594 HG23 ILE 73 HG23 ILE 73 13.822 0.812 2.890 595 HD11 ILE 73 HD11 ILE 73 11.306 4.736 3.611 596 HD12 ILE 73 HD12 ILE 73 12.995 4.700 2.999 597 HD13 ILE 73 HD13 ILE 73 11.614 4.639 1.883 598 H VAL 74 H VAL 74 13.740 1.161 6.847 599 HA VAL 74 HA VAL 74 14.943 -1.359 6.716 600 HB VAL 74 HB VAL 74 15.368 0.546 8.234 601 HG11 VAL 74 HG11 VAL 74 13.237 0.713 9.080 602 HG12 VAL 74 HG12 VAL 74 13.503 -0.733 10.104 603 HG13 VAL 74 HG13 VAL 74 14.517 0.767 10.282 604 HG21 VAL 74 HG21 VAL 74 16.441 -1.827 8.411 605 HG22 VAL 74 HG22 VAL 74 15.038 -2.227 9.442 606 HG23 VAL 74 HG23 VAL 74 16.261 -1.037 10.008 607 H ASN 75 H ASN 75 12.024 -0.711 8.539 608 HA ASN 75 HA ASN 75 11.304 -3.048 9.517 609 HB2 ASN 75 HB2 ASN 75 10.063 -0.687 9.146 610 HB3 ASN 75 HB3 ASN 75 9.466 -1.589 7.719 611 HD21 ASN 75 HD21 ASN 75 9.633 -1.479 11.355 612 HD22 ASN 75 HD22 ASN 75 8.181 -2.408 11.537 613 H ILE 76 H ILE 76 11.063 -2.329 5.979 614 HA ILE 76 HA ILE 76 9.675 -4.734 5.220 615 HB ILE 76 HB ILE 76 11.372 -2.691 3.687 616 HG12 ILE 76 HG12 ILE 76 8.355 -3.234 3.597 617 HG13 ILE 76 HG13 ILE 76 9.057 -1.981 4.620 618 HG21 ILE 76 HG21 ILE 76 9.829 -5.072 2.549 619 HG22 ILE 76 HG22 ILE 76 10.580 -3.727 1.590 620 HG23 ILE 76 HG23 ILE 76 11.601 -4.820 2.532 621 HD11 ILE 76 HD11 ILE 76 8.077 -1.235 2.513 622 HD12 ILE 76 HD12 ILE 76 9.670 -0.615 2.935 623 HD13 ILE 76 HD13 ILE 76 9.544 -1.808 1.696 624 H LEU 77 H LEU 77 13.118 -3.790 5.552 625 HA LEU 77 HA LEU 77 14.313 -6.174 4.474 626 HB2 LEU 77 HB2 LEU 77 15.541 -4.018 4.991 627 HB3 LEU 77 HB3 LEU 77 15.354 -4.358 6.683 628 HG LEU 77 HG LEU 77 17.491 -4.762 5.827 629 HD11 LEU 77 HD11 LEU 77 16.655 -5.737 7.948 630 HD12 LEU 77 HD12 LEU 77 16.400 -7.264 7.087 631 HD13 LEU 77 HD13 LEU 77 18.027 -6.621 7.207 632 HD21 LEU 77 HD21 LEU 77 18.026 -6.957 4.726 633 HD22 LEU 77 HD22 LEU 77 16.314 -7.259 4.507 634 HD23 LEU 77 HD23 LEU 77 17.056 -5.873 3.670 635 H LYS 78 H LYS 78 13.282 -5.249 7.748 636 HA LYS 78 HA LYS 78 14.257 -7.517 9.072 637 HB2 LYS 78 HB2 LYS 78 11.828 -5.818 9.778 638 HB3 LYS 78 HB3 LYS 78 12.663 -6.940 10.888 639 HG2 LYS 78 HG2 LYS 78 14.750 -5.686 10.636 640 HG3 LYS 78 HG3 LYS 78 14.015 -4.605 9.480 641 HD2 LYS 78 HD2 LYS 78 13.710 -3.203 11.133 642 HD3 LYS 78 HD3 LYS 78 12.315 -4.182 11.540 643 HE2 LYS 78 HE2 LYS 78 15.043 -4.826 12.675 644 HE3 LYS 78 HE3 LYS 78 14.087 -3.462 13.293 645 HZ1 LYS 78 HZ1 LYS 78 12.322 -4.938 13.814 646 HZ2 LYS 78 HZ2 LYS 78 13.215 -6.290 13.360 647 HZ3 LYS 78 HZ3 LYS 78 13.666 -5.365 14.626 648 H SER 79 H SER 79 11.130 -7.078 7.542 649 HA SER 79 HA SER 79 10.162 -9.793 7.979 650 HB2 SER 79 HB2 SER 79 9.441 -7.575 6.058 651 HB3 SER 79 HB3 SER 79 8.969 -9.234 5.666 652 HG SER 79 HG SER 79 8.413 -8.003 8.167 653 H ILE 80 H ILE 80 11.720 -8.401 4.976 654 HA ILE 80 HA ILE 80 11.638 -10.894 3.734 655 HB ILE 80 HB ILE 80 13.579 -8.646 3.132 656 HG12 ILE 80 HG12 ILE 80 10.896 -9.140 1.769 657 HG13 ILE 80 HG13 ILE 80 11.041 -8.027 3.130 658 HG21 ILE 80 HG21 ILE 80 13.582 -9.602 0.762 659 HG22 ILE 80 HG22 ILE 80 14.135 -10.704 1.999 660 HG23 ILE 80 HG23 ILE 80 12.508 -10.882 1.320 661 HD11 ILE 80 HD11 ILE 80 12.945 -6.895 1.909 662 HD12 ILE 80 HD12 ILE 80 12.472 -7.834 0.474 663 HD13 ILE 80 HD13 ILE 80 11.330 -6.696 1.219 664 H SER 81 H SER 81 14.398 -9.477 5.586 665 HA SER 81 HA SER 81 16.241 -11.567 5.045 666 HB2 SER 81 HB2 SER 81 15.868 -9.616 7.343 667 HB3 SER 81 HB3 SER 81 17.127 -10.860 7.366 668 HG SER 81 HG SER 81 17.976 -10.097 5.492 669 H SER 82 H SER 82 13.687 -11.282 7.615 670 HA SER 82 HA SER 82 14.352 -13.797 8.840 671 HB2 SER 82 HB2 SER 82 11.695 -12.316 8.847 672 HB3 SER 82 HB3 SER 82 12.275 -13.507 10.033 673 HG SER 82 HG SER 82 12.945 -10.825 9.673 674 H SER 83 H SER 83 12.213 -12.892 6.108 675 HA SER 83 HA SER 83 11.071 -15.523 5.815 676 HB2 SER 83 HB2 SER 83 11.494 -13.223 3.838 677 HB3 SER 83 HB3 SER 83 10.722 -14.767 3.460 678 HG SER 83 HG SER 83 9.493 -14.112 5.585 679 H GLY 84 H GLY 84 14.060 -13.991 4.568 680 HA2 GLY 84 HA2 GLY 84 15.925 -15.466 3.809 681 HA3 GLY 84 HA3 GLY 84 14.647 -16.556 3.202 682 H GLY 85 H GLY 85 15.174 -12.883 2.806 683 HA2 GLY 85 HA2 GLY 85 15.442 -13.378 -0.071 684 HA3 GLY 85 HA3 GLY 85 14.148 -12.390 0.618 685 H PHE 86 H PHE 86 15.588 -10.951 -0.973 686 HA PHE 86 HA PHE 86 17.999 -9.870 0.428 687 HB2 PHE 86 HB2 PHE 86 17.527 -11.268 -2.113 688 HB3 PHE 86 HB3 PHE 86 18.441 -9.863 -2.395 689 HD1 PHE 86 HD1 PHE 86 20.507 -9.628 -0.148 690 HD2 PHE 86 HD2 PHE 86 18.609 -13.224 -1.778 691 HE1 PHE 86 HE1 PHE 86 22.276 -11.052 0.694 692 HE2 PHE 86 HE2 PHE 86 20.533 -14.558 -1.047 693 HZ PHE 86 HZ PHE 86 22.387 -13.464 0.204 694 H PHE 87 H PHE 87 17.180 -7.863 1.177 695 HA PHE 87 HA PHE 87 16.308 -6.026 -0.974 696 HB2 PHE 87 HB2 PHE 87 14.536 -6.073 0.470 697 HB3 PHE 87 HB3 PHE 87 15.560 -6.103 1.897 698 HD1 PHE 87 HD1 PHE 87 15.745 -3.565 -0.976 699 HD2 PHE 87 HD2 PHE 87 14.636 -4.356 3.128 700 HE1 PHE 87 HE1 PHE 87 15.606 -1.180 -0.554 701 HE2 PHE 87 HE2 PHE 87 14.487 -1.883 3.556 702 HZ PHE 87 HZ PHE 87 15.077 -0.315 1.672 703 H ALA 88 H ALA 88 17.442 -4.255 -1.475 704 HA ALA 88 HA ALA 88 19.611 -3.337 0.272 705 HB1 ALA 88 HB1 ALA 88 21.278 -3.437 -1.390 706 HB2 ALA 88 HB2 ALA 88 20.524 -5.053 -1.382 707 HB3 ALA 88 HB3 ALA 88 20.127 -3.877 -2.662 708 H LEU 89 H LEU 89 20.503 -1.225 -0.491 709 HA LEU 89 HA LEU 89 18.536 0.493 -1.869 710 HB2 LEU 89 HB2 LEU 89 20.717 1.009 0.215 711 HB3 LEU 89 HB3 LEU 89 19.806 2.257 -0.598 712 HG LEU 89 HG LEU 89 17.686 1.132 0.310 713 HD11 LEU 89 HD11 LEU 89 19.679 -0.420 1.741 714 HD12 LEU 89 HD12 LEU 89 18.104 -0.004 2.491 715 HD13 LEU 89 HD13 LEU 89 18.135 -0.851 0.927 716 HD21 LEU 89 HD21 LEU 89 17.937 2.265 2.539 717 HD22 LEU 89 HD22 LEU 89 19.693 2.328 2.271 718 HD23 LEU 89 HD23 LEU 89 18.617 3.290 1.265 719 H VAL 90 H VAL 90 19.401 2.120 -3.324 720 HA VAL 90 HA VAL 90 22.021 1.414 -4.518 721 HB VAL 90 HB VAL 90 19.250 1.574 -5.751 722 HG11 VAL 90 HG11 VAL 90 21.912 1.196 -7.114 723 HG12 VAL 90 HG12 VAL 90 20.319 0.891 -7.878 724 HG13 VAL 90 HG13 VAL 90 20.742 2.518 -7.345 725 HG21 VAL 90 HG21 VAL 90 21.137 -0.778 -5.361 726 HG22 VAL 90 HG22 VAL 90 19.527 -0.581 -4.642 727 HG23 VAL 90 HG23 VAL 90 19.699 -0.842 -6.379 728 H SER 91 H SER 91 23.116 3.162 -5.288 729 HA SER 91 HA SER 91 23.802 5.275 -5.291 730 HB2 SER 91 HB2 SER 91 22.327 5.124 -7.325 731 HB3 SER 91 HB3 SER 91 21.049 5.928 -6.403 732 HG SER 91 HG SER 91 22.511 7.207 -7.793 733 HA PRO 92 HA PRO 92 21.293 6.180 -1.395 734 HB2 PRO 92 HB2 PRO 92 22.999 5.455 0.585 735 HB3 PRO 92 HB3 PRO 92 21.973 4.276 -0.285 736 HG2 PRO 92 HG2 PRO 92 24.867 5.047 -0.924 737 HG3 PRO 92 HG3 PRO 92 24.218 3.404 -0.625 738 HD2 PRO 92 HD2 PRO 92 24.452 4.279 -3.146 739 HD3 PRO 92 HD3 PRO 92 22.997 3.393 -2.634 740 H ASN 93 H ASN 93 24.077 7.441 -2.847 741 HA ASN 93 HA ASN 93 25.345 9.276 -2.577 742 HB2 ASN 93 HB2 ASN 93 24.165 11.379 -2.297 743 HB3 ASN 93 HB3 ASN 93 23.297 10.259 -3.338 744 HD21 ASN 93 HD21 ASN 93 21.138 10.097 -2.924 745 HD22 ASN 93 HD22 ASN 93 20.347 10.632 -1.466 746 H GLU 94 H GLU 94 25.268 11.433 -0.681 747 HA GLU 94 HA GLU 94 26.509 10.058 1.653 748 HB2 GLU 94 HB2 GLU 94 28.048 11.588 0.637 749 HB3 GLU 94 HB3 GLU 94 26.841 12.900 0.570 750 HG2 GLU 94 HG2 GLU 94 26.761 13.062 2.964 751 HG3 GLU 94 HG3 GLU 94 27.570 11.493 3.107 752 H LYS 95 H LYS 95 23.902 12.188 0.619 753 HA LYS 95 HA LYS 95 23.389 13.468 3.183 754 HB2 LYS 95 HB2 LYS 95 22.493 14.672 1.360 755 HB3 LYS 95 HB3 LYS 95 22.008 13.239 0.489 756 HG2 LYS 95 HG2 LYS 95 20.094 14.360 1.155 757 HG3 LYS 95 HG3 LYS 95 20.130 12.895 2.100 758 HD2 LYS 95 HD2 LYS 95 21.501 15.125 3.481 759 HD3 LYS 95 HD3 LYS 95 19.922 15.581 2.908 760 HE2 LYS 95 HE2 LYS 95 19.180 13.236 4.013 761 HE3 LYS 95 HE3 LYS 95 20.695 13.388 4.869 762 HZ1 LYS 95 HZ1 LYS 95 20.087 15.460 5.779 763 HZ2 LYS 95 HZ2 LYS 95 18.644 15.498 5.021 764 HZ3 LYS 95 HZ3 LYS 95 18.922 14.365 6.175 765 H VAL 96 H VAL 96 21.990 10.670 1.396 766 HA VAL 96 HA VAL 96 20.270 9.997 3.603 767 HB VAL 96 HB VAL 96 20.855 9.085 0.860 768 HG11 VAL 96 HG11 VAL 96 19.908 6.913 0.960 769 HG12 VAL 96 HG12 VAL 96 21.266 6.910 2.060 770 HG13 VAL 96 HG13 VAL 96 19.602 7.050 2.710 771 HG21 VAL 96 HG21 VAL 96 18.961 10.483 1.591 772 HG22 VAL 96 HG22 VAL 96 18.515 9.032 0.699 773 HG23 VAL 96 HG23 VAL 96 18.310 9.069 2.472 774 H GLU 97 H GLU 97 23.535 8.710 2.545 775 HA GLU 97 HA GLU 97 23.591 6.735 4.585 776 HB2 GLU 97 HB2 GLU 97 25.724 8.051 2.903 777 HB3 GLU 97 HB3 GLU 97 26.156 7.055 4.292 778 HG2 GLU 97 HG2 GLU 97 24.402 5.339 3.145 779 HG3 GLU 97 HG3 GLU 97 24.965 6.190 1.690 780 H ARG 98 H ARG 98 23.934 10.197 4.841 781 HA ARG 98 HA ARG 98 25.555 10.097 7.184 782 HB2 ARG 98 HB2 ARG 98 25.545 12.344 7.223 783 HB3 ARG 98 HB3 ARG 98 24.990 12.109 5.573 784 HG2 ARG 98 HG2 ARG 98 23.458 13.662 6.297 785 HG3 ARG 98 HG3 ARG 98 22.622 12.165 6.625 786 HD2 ARG 98 HD2 ARG 98 22.582 12.523 8.856 787 HD3 ARG 98 HD3 ARG 98 24.274 12.910 8.913 788 HE ARG 98 HE ARG 98 22.080 14.792 8.862 789 HH11 ARG 98 HH11 ARG 98 25.437 14.437 7.758 790 HH12 ARG 98 HH12 ARG 98 25.856 16.076 8.028 791 HH21 ARG 98 HH21 ARG 98 22.620 17.016 9.228 792 HH22 ARG 98 HH22 ARG 98 24.240 17.546 8.887 793 H VAL 99 H VAL 99 22.341 9.344 6.676 794 HA VAL 99 HA VAL 99 21.691 9.571 9.576 795 HB VAL 99 HB VAL 99 19.716 9.100 7.276 796 HG11 VAL 99 HG11 VAL 99 18.962 8.960 9.694 797 HG12 VAL 99 HG12 VAL 99 19.384 10.677 9.876 798 HG13 VAL 99 HG13 VAL 99 18.108 10.177 8.742 799 HG21 VAL 99 HG21 VAL 99 19.289 11.484 7.050 800 HG22 VAL 99 HG22 VAL 99 20.780 11.779 8.001 801 HG23 VAL 99 HG23 VAL 99 20.846 10.893 6.441 802 H LEU 100 H LEU 100 21.679 7.516 6.636 803 HA LEU 100 HA LEU 100 20.469 5.242 7.833 804 HB2 LEU 100 HB2 LEU 100 22.605 5.305 5.668 805 HB3 LEU 100 HB3 LEU 100 21.662 3.954 6.090 806 HG LEU 100 HG LEU 100 21.026 5.934 4.170 807 HD11 LEU 100 HD11 LEU 100 19.215 3.712 5.197 808 HD12 LEU 100 HD12 LEU 100 19.198 4.478 3.595 809 HD13 LEU 100 HD13 LEU 100 20.584 3.485 4.073 810 HD21 LEU 100 HD21 LEU 100 18.888 5.826 6.321 811 HD22 LEU 100 HD22 LEU 100 19.647 7.321 5.721 812 HD23 LEU 100 HD23 LEU 100 18.597 6.425 4.684 813 H SER 101 H SER 101 23.445 6.871 8.681 814 HA SER 101 HA SER 101 24.673 4.273 9.592 815 HB2 SER 101 HB2 SER 101 25.433 7.164 9.461 816 HB3 SER 101 HB3 SER 101 26.204 6.146 10.704 817 HG SER 101 HG SER 101 26.137 5.361 7.952 818 H LEU 102 H LEU 102 22.678 6.897 10.691 819 HA LEU 102 HA LEU 102 23.193 6.734 13.477 820 HB2 LEU 102 HB2 LEU 102 21.244 8.377 11.763 821 HB3 LEU 102 HB3 LEU 102 21.616 8.638 13.450 822 HG LEU 102 HG LEU 102 23.702 9.287 13.113 823 HD11 LEU 102 HD11 LEU 102 23.807 8.449 10.372 824 HD12 LEU 102 HD12 LEU 102 24.973 9.580 11.126 825 HD13 LEU 102 HD13 LEU 102 24.777 7.981 11.799 826 HD21 LEU 102 HD21 LEU 102 21.986 10.766 11.147 827 HD22 LEU 102 HD22 LEU 102 22.105 11.017 12.882 828 HD23 LEU 102 HD23 LEU 102 23.503 11.358 11.843 829 H THR 103 H THR 103 20.696 5.658 11.308 830 HA THR 103 HA THR 103 19.098 4.579 13.575 831 HB THR 103 HB THR 103 17.793 6.183 12.445 832 HG1 THR 103 HG1 THR 103 17.239 3.553 11.724 833 HG21 THR 103 HG21 THR 103 18.889 5.069 9.866 834 HG22 THR 103 HG22 THR 103 17.279 5.828 9.918 835 HG23 THR 103 HG23 THR 103 18.683 6.743 10.419 836 H ASN 104 H ASN 104 21.557 3.471 12.606 837 HA ASN 104 HA ASN 104 22.497 1.559 11.668 838 HB2 ASN 104 HB2 ASN 104 21.620 -0.487 12.835 839 HB3 ASN 104 HB3 ASN 104 22.112 0.839 13.871 840 HD21 ASN 104 HD21 ASN 104 18.988 0.147 12.215 841 HD22 ASN 104 HD22 ASN 104 18.014 0.530 13.624 842 H LEU 105 H LEU 105 21.588 2.333 9.491 843 HA LEU 105 HA LEU 105 19.397 0.538 8.555 844 HB2 LEU 105 HB2 LEU 105 19.528 3.334 8.703 845 HB3 LEU 105 HB3 LEU 105 19.999 3.032 7.097 846 HG LEU 105 HG LEU 105 17.779 3.400 6.844 847 HD11 LEU 105 HD11 LEU 105 17.563 0.432 7.355 848 HD12 LEU 105 HD12 LEU 105 16.481 1.395 6.403 849 HD13 LEU 105 HD13 LEU 105 18.184 1.162 5.840 850 HD21 LEU 105 HD21 LEU 105 16.013 2.711 8.342 851 HD22 LEU 105 HD22 LEU 105 17.212 1.888 9.383 852 HD23 LEU 105 HD23 LEU 105 17.256 3.638 9.143 853 H ASP 106 H ASP 106 22.449 2.254 7.541 854 HA ASP 106 HA ASP 106 22.842 0.627 5.195 855 HB2 ASP 106 HB2 ASP 106 24.880 1.687 4.957 856 HB3 ASP 106 HB3 ASP 106 23.958 2.916 5.821 857 H ARG 107 H ARG 107 23.462 0.201 8.580 858 HA ARG 107 HA ARG 107 25.336 -1.957 8.262 859 HB2 ARG 107 HB2 ARG 107 23.711 -1.216 10.747 860 HB3 ARG 107 HB3 ARG 107 25.189 -2.188 10.678 861 HG2 ARG 107 HG2 ARG 107 26.260 -0.068 9.592 862 HG3 ARG 107 HG3 ARG 107 24.868 0.802 10.218 863 HD2 ARG 107 HD2 ARG 107 25.490 0.527 12.424 864 HD3 ARG 107 HD3 ARG 107 26.350 -0.989 12.127 865 HE ARG 107 HE ARG 107 27.441 1.700 11.962 866 HH11 ARG 107 HH11 ARG 107 27.927 -1.620 10.697 867 HH12 ARG 107 HH12 ARG 107 29.625 -1.458 10.614 868 HH21 ARG 107 HH21 ARG 107 29.633 1.900 11.799 869 HH22 ARG 107 HH22 ARG 107 30.651 0.576 11.274 870 H ILE 108 H ILE 108 21.999 -1.957 7.813 871 HA ILE 108 HA ILE 108 21.722 -4.817 8.609 872 HB ILE 108 HB ILE 108 19.667 -2.586 8.939 873 HG12 ILE 108 HG12 ILE 108 21.630 -3.835 10.884 874 HG13 ILE 108 HG13 ILE 108 21.395 -2.148 10.513 875 HG21 ILE 108 HG21 ILE 108 18.344 -4.223 10.153 876 HG22 ILE 108 HG22 ILE 108 18.732 -4.868 8.570 877 HG23 ILE 108 HG23 ILE 108 19.634 -5.447 9.989 878 HD11 ILE 108 HD11 ILE 108 20.452 -2.459 12.658 879 HD12 ILE 108 HD12 ILE 108 19.066 -2.326 11.566 880 HD13 ILE 108 HD13 ILE 108 19.570 -3.919 12.172 881 H VAL 109 H VAL 109 20.813 -2.178 6.330 882 HA VAL 109 HA VAL 109 19.780 -4.249 4.506 883 HB VAL 109 HB VAL 109 19.535 -1.359 3.913 884 HG11 VAL 109 HG11 VAL 109 18.896 -2.965 2.267 885 HG12 VAL 109 HG12 VAL 109 17.752 -3.734 3.390 886 HG13 VAL 109 HG13 VAL 109 17.477 -2.083 2.783 887 HG21 VAL 109 HG21 VAL 109 17.501 -2.667 5.760 888 HG22 VAL 109 HG22 VAL 109 18.596 -1.352 6.203 889 HG23 VAL 109 HG23 VAL 109 17.343 -1.093 4.976 890 H LYS 110 H LYS 110 20.841 -4.441 2.615 891 HA LYS 110 HA LYS 110 23.608 -3.670 2.455 892 HB2 LYS 110 HB2 LYS 110 21.572 -5.082 0.715 893 HB3 LYS 110 HB3 LYS 110 23.135 -4.839 0.034 894 HG2 LYS 110 HG2 LYS 110 23.209 -5.907 2.811 895 HG3 LYS 110 HG3 LYS 110 22.463 -6.926 1.597 896 HD2 LYS 110 HD2 LYS 110 24.789 -7.514 1.724 897 HD3 LYS 110 HD3 LYS 110 24.586 -6.672 0.196 898 HE2 LYS 110 HE2 LYS 110 25.534 -4.674 0.921 899 HE3 LYS 110 HE3 LYS 110 25.356 -5.059 2.630 900 HZ1 LYS 110 HZ1 LYS 110 27.118 -6.643 0.897 901 HZ2 LYS 110 HZ2 LYS 110 27.615 -5.217 1.468 902 HZ3 LYS 110 HZ3 LYS 110 27.222 -6.430 2.535 903 H ILE 111 H ILE 111 24.616 -2.617 0.628 904 HA ILE 111 HA ILE 111 23.010 -0.511 -0.632 905 HB ILE 111 HB ILE 111 25.256 -0.195 1.341 906 HG12 ILE 111 HG12 ILE 111 24.330 2.221 1.406 907 HG13 ILE 111 HG13 ILE 111 23.011 1.633 0.407 908 HG21 ILE 111 HG21 ILE 111 25.375 1.529 -1.148 909 HG22 ILE 111 HG22 ILE 111 26.257 1.825 0.364 910 HG23 ILE 111 HG23 ILE 111 26.599 0.381 -0.570 911 HD11 ILE 111 HD11 ILE 111 23.773 0.428 3.102 912 HD12 ILE 111 HD12 ILE 111 22.661 1.799 2.937 913 HD13 ILE 111 HD13 ILE 111 22.246 0.221 2.221 914 H TYR 112 H TYR 112 23.722 0.072 -2.696 915 HA TYR 112 HA TYR 112 26.173 -1.057 -3.845 916 HB2 TYR 112 HB2 TYR 112 23.359 -1.465 -4.941 917 HB3 TYR 112 HB3 TYR 112 24.840 -1.850 -5.801 918 HD1 TYR 112 HD1 TYR 112 26.263 -3.669 -5.123 919 HD2 TYR 112 HD2 TYR 112 22.598 -2.861 -3.086 920 HE1 TYR 112 HE1 TYR 112 26.359 -5.948 -4.073 921 HE2 TYR 112 HE2 TYR 112 22.604 -5.232 -2.144 922 HH TYR 112 HH TYR 112 23.769 -7.172 -1.890 923 H ASP 113 H ASP 113 26.449 -0.079 -6.128 924 HA ASP 113 HA ASP 113 25.919 2.811 -5.930 925 HB2 ASP 113 HB2 ASP 113 27.770 1.014 -7.422 926 HB3 ASP 113 HB3 ASP 113 27.080 2.232 -8.450 927 H THR 114 H THR 114 25.133 0.071 -8.113 928 HA THR 114 HA THR 114 22.959 1.708 -9.312 929 HB THR 114 HB THR 114 23.586 0.921 -11.546 930 HG1 THR 114 HG1 THR 114 26.140 0.292 -10.604 931 HG21 THR 114 HG21 THR 114 24.299 3.151 -10.811 932 HG22 THR 114 HG22 THR 114 25.801 2.462 -10.176 933 HG23 THR 114 HG23 THR 114 25.482 2.434 -11.917 934 H ILE 115 H ILE 115 21.591 0.166 -10.842 935 HA ILE 115 HA ILE 115 20.609 -1.894 -9.056 936 HB ILE 115 HB ILE 115 19.948 -0.902 -11.845 937 HG12 ILE 115 HG12 ILE 115 19.135 0.383 -9.887 938 HG13 ILE 115 HG13 ILE 115 17.850 -0.299 -10.874 939 HG21 ILE 115 HG21 ILE 115 18.819 -3.425 -10.582 940 HG22 ILE 115 HG22 ILE 115 17.988 -2.513 -11.871 941 HG23 ILE 115 HG23 ILE 115 19.576 -3.228 -12.172 942 HD11 ILE 115 HD11 ILE 115 18.733 -1.484 -8.224 943 HD12 ILE 115 HD12 ILE 115 17.308 -0.473 -8.533 944 HD13 ILE 115 HD13 ILE 115 17.438 -2.062 -9.282 945 H SER 116 H SER 116 22.716 -1.777 -11.970 946 HA SER 116 HA SER 116 22.482 -4.573 -12.335 947 HB2 SER 116 HB2 SER 116 23.250 -2.843 -14.022 948 HB3 SER 116 HB3 SER 116 24.837 -2.851 -13.223 949 HG SER 116 HG SER 116 25.137 -4.916 -13.808 950 H GLU 117 H GLU 117 24.784 -2.492 -10.369 951 HA GLU 117 HA GLU 117 26.543 -4.484 -9.637 952 HB2 GLU 117 HB2 GLU 117 26.275 -1.762 -9.337 953 HB3 GLU 117 HB3 GLU 117 25.756 -2.298 -7.740 954 HG2 GLU 117 HG2 GLU 117 27.907 -3.699 -7.680 955 HG3 GLU 117 HG3 GLU 117 28.328 -2.881 -9.206 956 H ALA 118 H ALA 118 23.195 -4.352 -8.993 957 HA ALA 118 HA ALA 118 23.478 -5.692 -6.364 958 HB1 ALA 118 HB1 ALA 118 21.104 -4.042 -7.333 959 HB2 ALA 118 HB2 ALA 118 21.498 -4.615 -5.670 960 HB3 ALA 118 HB3 ALA 118 22.461 -3.354 -6.446 961 H MET 119 H MET 119 21.934 -5.693 -9.616 962 HA MET 119 HA MET 119 19.830 -7.285 -9.049 963 HB2 MET 119 HB2 MET 119 20.624 -5.891 -11.246 964 HB3 MET 119 HB3 MET 119 21.199 -7.473 -11.763 965 HG2 MET 119 HG2 MET 119 18.845 -8.328 -11.084 966 HG3 MET 119 HG3 MET 119 18.429 -6.622 -10.941 967 HE1 MET 119 HE1 MET 119 20.742 -8.368 -13.780 968 HE2 MET 119 HE2 MET 119 19.494 -9.563 -13.337 969 HE3 MET 119 HE3 MET 119 19.464 -8.783 -14.933 970 H GLU 120 H GLU 120 22.949 -8.377 -10.312 971 HA GLU 120 HA GLU 120 22.315 -11.263 -9.824 972 HB2 GLU 120 HB2 GLU 120 24.225 -11.605 -11.221 973 HB3 GLU 120 HB3 GLU 120 23.015 -10.590 -12.037 974 HG2 GLU 120 HG2 GLU 120 24.361 -8.660 -11.902 975 HG3 GLU 120 HG3 GLU 120 25.430 -9.352 -10.691 976 H GLU 121 H GLU 121 23.550 -8.703 -8.161 977 HA GLU 121 HA GLU 121 25.716 -10.235 -6.933 978 HB2 GLU 121 HB2 GLU 121 25.762 -7.714 -7.690 979 HB3 GLU 121 HB3 GLU 121 24.843 -7.426 -6.211 980 HG2 GLU 121 HG2 GLU 121 27.112 -7.005 -5.702 981 HG3 GLU 121 HG3 GLU 121 26.760 -8.576 -4.951 982 H VAL 122 H VAL 122 22.874 -8.358 -5.768 983 HA VAL 122 HA VAL 122 22.551 -9.349 -3.193 984 HB VAL 122 HB VAL 122 21.238 -7.593 -4.737 985 HG11 VAL 122 HG11 VAL 122 20.004 -9.124 -6.183 986 HG12 VAL 122 HG12 VAL 122 19.318 -9.978 -4.758 987 HG13 VAL 122 HG13 VAL 122 18.869 -8.325 -5.099 988 HG21 VAL 122 HG21 VAL 122 20.434 -8.933 -2.227 989 HG22 VAL 122 HG22 VAL 122 21.058 -7.305 -2.514 990 HG23 VAL 122 HG23 VAL 122 19.381 -7.693 -2.930 991 H ARG 123 H ARG 123 21.698 -10.984 -6.212 992 HA ARG 123 HA ARG 123 20.223 -13.197 -5.406 993 HB2 ARG 123 HB2 ARG 123 22.600 -12.891 -7.277 994 HB3 ARG 123 HB3 ARG 123 21.649 -14.380 -7.220 995 HG2 ARG 123 HG2 ARG 123 20.309 -11.678 -7.626 996 HG3 ARG 123 HG3 ARG 123 21.125 -12.531 -8.932 997 HD2 ARG 123 HD2 ARG 123 19.636 -14.128 -9.124 998 HD3 ARG 123 HD3 ARG 123 19.233 -14.199 -7.375 999 HE ARG 123 HE ARG 123 18.432 -11.744 -8.655 1000 HH11 ARG 123 HH11 ARG 123 17.270 -15.066 -7.927 1001 HH12 ARG 123 HH12 ARG 123 15.680 -14.733 -8.539 1002 HH21 ARG 123 HH21 ARG 123 16.348 -11.400 -9.407 1003 HH22 ARG 123 HH22 ARG 123 15.125 -12.693 -9.316 1004 H ARG 124 H ARG 124 23.676 -12.624 -4.879 1005 HA ARG 124 HA ARG 124 23.579 -14.630 -2.772 1006 HB2 ARG 124 HB2 ARG 124 25.711 -15.694 -3.596 1007 HB3 ARG 124 HB3 ARG 124 24.446 -15.884 -4.776 1008 HG2 ARG 124 HG2 ARG 124 26.374 -13.541 -4.900 1009 HG3 ARG 124 HG3 ARG 124 26.867 -15.117 -5.470 1010 HD2 ARG 124 HD2 ARG 124 24.363 -13.923 -6.739 1011 HD3 ARG 124 HD3 ARG 124 25.902 -13.211 -7.094 1012 HE ARG 124 HE ARG 124 26.590 -14.986 -8.263 1013 HH11 ARG 124 HH11 ARG 124 23.774 -16.079 -6.428 1014 HH12 ARG 124 HH12 ARG 124 23.294 -17.279 -7.600 1015 HH21 ARG 124 HH21 ARG 124 26.032 -16.717 -9.734 1016 HH22 ARG 124 HH22 ARG 124 24.783 -17.849 -9.326 1017 H LYS 125 H LYS 125 23.726 -11.769 -2.840 1018 HA LYS 125 HA LYS 125 25.003 -10.001 -2.775 1019 HB2 LYS 125 HB2 LYS 125 25.199 -9.435 -0.551 1020 HB3 LYS 125 HB3 LYS 125 23.763 -10.353 -0.851 1021 HG2 LYS 125 HG2 LYS 125 24.400 -11.182 1.191 1022 HG3 LYS 125 HG3 LYS 125 24.816 -12.376 0.006 1023 HD2 LYS 125 HD2 LYS 125 27.260 -11.372 0.236 1024 HD3 LYS 125 HD3 LYS 125 26.612 -10.522 1.625 1025 HE2 LYS 125 HE2 LYS 125 27.493 -12.459 2.569 1026 HE3 LYS 125 HE3 LYS 125 25.808 -12.942 2.334 1027 HZ1 LYS 125 HZ1 LYS 125 26.614 -13.893 0.143 1028 HZ2 LYS 125 HZ2 LYS 125 28.139 -13.525 0.603 1029 HZ3 LYS 125 HZ3 LYS 125 27.308 -14.628 1.464 Start of MODEL 6 1 H1 MET 1 H1 MET 1 -12.040 15.251 7.166 2 HA MET 1 HA MET 1 -11.919 13.203 8.571 3 HB2 MET 1 HB2 MET 1 -12.913 14.127 10.468 4 HB3 MET 1 HB3 MET 1 -12.365 15.486 9.508 5 HG2 MET 1 HG2 MET 1 -14.732 15.795 8.691 6 HG3 MET 1 HG3 MET 1 -15.222 14.514 9.810 7 HE1 MET 1 HE1 MET 1 -16.693 17.334 11.909 8 HE2 MET 1 HE2 MET 1 -16.862 16.972 10.173 9 HE3 MET 1 HE3 MET 1 -16.840 15.650 11.367 10 H GLY 2 H GLY 2 -12.958 11.245 9.250 11 HA2 GLY 2 HA2 GLY 2 -15.627 10.625 9.064 12 HA3 GLY 2 HA3 GLY 2 -14.904 10.154 7.508 13 H SER 3 H SER 3 -15.502 7.937 8.390 14 HA SER 3 HA SER 3 -13.677 6.909 10.470 15 HB2 SER 3 HB2 SER 3 -16.142 6.301 10.354 16 HB3 SER 3 HB3 SER 3 -15.756 5.306 8.946 17 HG SER 3 HG SER 3 -15.730 4.280 11.085 18 H ASP 4 H ASP 4 -14.494 5.253 7.305 19 HA ASP 4 HA ASP 4 -11.670 5.609 6.486 20 HB2 ASP 4 HB2 ASP 4 -11.961 3.546 7.987 21 HB3 ASP 4 HB3 ASP 4 -12.995 2.877 6.722 22 H LYS 5 H LYS 5 -11.332 5.186 4.208 23 HA LYS 5 HA LYS 5 -13.676 4.703 2.481 24 HB2 LYS 5 HB2 LYS 5 -11.970 7.229 2.427 25 HB3 LYS 5 HB3 LYS 5 -12.947 6.693 1.059 26 HG2 LYS 5 HG2 LYS 5 -14.993 6.855 2.326 27 HG3 LYS 5 HG3 LYS 5 -14.103 7.257 3.810 28 HD2 LYS 5 HD2 LYS 5 -13.387 9.375 2.939 29 HD3 LYS 5 HD3 LYS 5 -13.985 8.993 1.322 30 HE2 LYS 5 HE2 LYS 5 -15.473 10.547 2.547 31 HE3 LYS 5 HE3 LYS 5 -16.279 9.063 2.031 32 HZ1 LYS 5 HZ1 LYS 5 -16.180 8.224 4.254 33 HZ2 LYS 5 HZ2 LYS 5 -15.241 9.472 4.771 34 HZ3 LYS 5 HZ3 LYS 5 -16.775 9.759 4.353 35 H ILE 6 H ILE 6 -12.931 4.324 0.208 36 HA ILE 6 HA ILE 6 -10.133 3.412 0.027 37 HB ILE 6 HB ILE 6 -11.423 1.531 0.685 38 HG12 ILE 6 HG12 ILE 6 -9.645 1.378 -1.151 39 HG13 ILE 6 HG13 ILE 6 -10.667 0.005 -0.794 40 HG21 ILE 6 HG21 ILE 6 -13.697 2.065 0.172 41 HG22 ILE 6 HG22 ILE 6 -13.367 2.047 -1.580 42 HG23 ILE 6 HG23 ILE 6 -13.272 0.553 -0.638 43 HD11 ILE 6 HD11 ILE 6 -10.328 0.238 -3.205 44 HD12 ILE 6 HD12 ILE 6 -12.036 0.415 -2.801 45 HD13 ILE 6 HD13 ILE 6 -11.063 1.852 -3.186 46 H HIS 7 H HIS 7 -9.215 4.188 -1.776 47 HA HIS 7 HA HIS 7 -10.672 6.050 -3.420 48 HB2 HIS 7 HB2 HIS 7 -8.501 6.443 -4.497 49 HB3 HIS 7 HB3 HIS 7 -8.475 6.629 -2.760 50 HD1 HIS 7 HD1 HIS 7 -6.787 4.616 -5.513 51 HD2 HIS 7 HD2 HIS 7 -7.078 4.726 -1.298 52 HE1 HIS 7 HE1 HIS 7 -4.928 3.146 -4.623 53 H HIS 8 H HIS 8 -12.180 5.046 -4.764 54 HA HIS 8 HA HIS 8 -11.245 2.882 -6.572 55 HB2 HIS 8 HB2 HIS 8 -13.492 3.011 -7.563 56 HB3 HIS 8 HB3 HIS 8 -13.458 2.609 -5.860 57 HD1 HIS 8 HD1 HIS 8 -15.970 3.281 -5.615 58 HD2 HIS 8 HD2 HIS 8 -13.434 6.386 -6.901 59 HE1 HIS 8 HE1 HIS 8 -17.304 5.452 -5.378 60 H HIS 9 H HIS 9 -11.591 3.240 -8.963 61 HA HIS 9 HA HIS 9 -10.937 4.164 -10.883 62 HB2 HIS 9 HB2 HIS 9 -12.209 6.554 -9.563 63 HB3 HIS 9 HB3 HIS 9 -11.239 6.839 -10.982 64 HD1 HIS 9 HD1 HIS 9 -14.754 5.783 -10.147 65 HD2 HIS 9 HD2 HIS 9 -11.933 5.449 -13.287 66 HE1 HIS 9 HE1 HIS 9 -16.048 5.266 -12.232 67 H HIS 10 H HIS 10 -9.457 6.102 -11.789 68 HA HIS 10 HA HIS 10 -7.418 6.691 -12.220 69 HB2 HIS 10 HB2 HIS 10 -7.498 7.572 -9.352 70 HB3 HIS 10 HB3 HIS 10 -6.101 7.837 -10.386 71 HD1 HIS 10 HD1 HIS 10 -9.724 9.090 -9.989 72 HD2 HIS 10 HD2 HIS 10 -6.383 9.284 -12.504 73 HE1 HIS 10 HE1 HIS 10 -10.262 10.903 -11.697 74 H HIS 11 H HIS 11 -6.700 4.916 -12.980 75 HA HIS 11 HA HIS 11 -5.933 2.577 -12.007 76 HB2 HIS 11 HB2 HIS 11 -6.009 3.531 -14.405 77 HB3 HIS 11 HB3 HIS 11 -4.304 3.905 -14.182 78 HD1 HIS 11 HD1 HIS 11 -2.643 1.795 -14.643 79 HD2 HIS 11 HD2 HIS 11 -6.771 0.885 -14.258 80 HE1 HIS 11 HE1 HIS 11 -2.925 -0.580 -15.390 81 H HIS 12 H HIS 12 -4.841 2.179 -10.235 82 HA HIS 12 HA HIS 12 -2.831 3.875 -9.106 83 HB2 HIS 12 HB2 HIS 12 -4.535 2.468 -7.892 84 HB3 HIS 12 HB3 HIS 12 -3.617 1.039 -8.387 85 HD1 HIS 12 HD1 HIS 12 -3.097 4.227 -6.160 86 HD2 HIS 12 HD2 HIS 12 -1.575 0.334 -6.901 87 HE1 HIS 12 HE1 HIS 12 -1.505 3.702 -4.293 88 H MET 13 H MET 13 -0.635 3.736 -9.245 89 HA MET 13 HA MET 13 0.873 1.415 -9.827 90 HB2 MET 13 HB2 MET 13 0.111 1.662 -12.110 91 HB3 MET 13 HB3 MET 13 0.489 3.387 -12.129 92 HG2 MET 13 HG2 MET 13 2.816 2.986 -12.164 93 HG3 MET 13 HG3 MET 13 2.639 1.315 -11.622 94 HE1 MET 13 HE1 MET 13 4.501 0.888 -13.657 95 HE2 MET 13 HE2 MET 13 4.145 1.284 -15.359 96 HE3 MET 13 HE3 MET 13 4.335 2.578 -14.175 97 H PHE 14 H PHE 14 2.053 2.116 -8.020 98 HA PHE 14 HA PHE 14 3.089 4.761 -7.627 99 HB2 PHE 14 HB2 PHE 14 3.606 2.000 -6.526 100 HB3 PHE 14 HB3 PHE 14 4.760 3.253 -6.174 101 HD1 PHE 14 HD1 PHE 14 3.783 5.519 -5.147 102 HD2 PHE 14 HD2 PHE 14 1.716 1.719 -5.122 103 HE1 PHE 14 HE1 PHE 14 2.518 6.211 -3.158 104 HE2 PHE 14 HE2 PHE 14 0.474 2.417 -3.126 105 HZ PHE 14 HZ PHE 14 0.842 4.666 -2.135 106 HA PRO 15 HA PRO 15 6.737 4.669 -10.270 107 HB2 PRO 15 HB2 PRO 15 8.620 6.043 -8.896 108 HB3 PRO 15 HB3 PRO 15 7.137 6.830 -9.518 109 HG2 PRO 15 HG2 PRO 15 7.662 5.799 -6.720 110 HG3 PRO 15 HG3 PRO 15 6.967 7.368 -7.216 111 HD2 PRO 15 HD2 PRO 15 5.436 5.260 -6.473 112 HD3 PRO 15 HD3 PRO 15 4.886 6.432 -7.701 113 H TYR 16 H TYR 16 7.005 2.369 -10.264 114 HA TYR 16 HA TYR 16 9.491 1.509 -9.039 115 HB2 TYR 16 HB2 TYR 16 8.570 -0.310 -7.739 116 HB3 TYR 16 HB3 TYR 16 7.668 1.100 -7.324 117 HD1 TYR 16 HD1 TYR 16 7.476 -2.017 -9.426 118 HD2 TYR 16 HD2 TYR 16 5.373 1.203 -7.533 119 HE1 TYR 16 HE1 TYR 16 5.333 -3.159 -9.898 120 HE2 TYR 16 HE2 TYR 16 3.205 -0.012 -7.854 121 HH TYR 16 HH TYR 16 2.364 -2.181 -8.291 122 H LYS 17 H LYS 17 9.961 -0.765 -9.898 123 HA LYS 17 HA LYS 17 8.379 -1.454 -12.258 124 HB2 LYS 17 HB2 LYS 17 9.976 -1.496 -13.841 125 HB3 LYS 17 HB3 LYS 17 10.337 0.004 -13.018 126 HG2 LYS 17 HG2 LYS 17 12.386 -0.647 -12.300 127 HG3 LYS 17 HG3 LYS 17 11.916 -2.323 -12.044 128 HD2 LYS 17 HD2 LYS 17 12.372 -1.071 -14.759 129 HD3 LYS 17 HD3 LYS 17 13.514 -2.139 -13.884 130 HE2 LYS 17 HE2 LYS 17 12.475 -3.997 -14.578 131 HE3 LYS 17 HE3 LYS 17 10.989 -3.414 -13.884 132 HZ1 LYS 17 HZ1 LYS 17 11.805 -3.483 -16.628 133 HZ2 LYS 17 HZ2 LYS 17 10.309 -3.502 -15.967 134 HZ3 LYS 17 HZ3 LYS 17 11.049 -2.065 -16.200 135 H ILE 18 H ILE 18 9.150 -3.665 -13.131 136 HA ILE 18 HA ILE 18 10.042 -5.470 -10.958 137 HB ILE 18 HB ILE 18 7.624 -5.663 -12.758 138 HG12 ILE 18 HG12 ILE 18 8.017 -5.947 -9.731 139 HG13 ILE 18 HG13 ILE 18 7.415 -4.500 -10.538 140 HG21 ILE 18 HG21 ILE 18 7.355 -7.980 -12.022 141 HG22 ILE 18 HG22 ILE 18 8.865 -7.807 -12.887 142 HG23 ILE 18 HG23 ILE 18 8.887 -7.906 -11.113 143 HD11 ILE 18 HD11 ILE 18 5.445 -5.742 -11.356 144 HD12 ILE 18 HD12 ILE 18 5.980 -7.167 -10.428 145 HD13 ILE 18 HD13 ILE 18 5.562 -5.673 -9.588 146 H VAL 19 H VAL 19 11.915 -6.490 -11.631 147 HA VAL 19 HA VAL 19 12.548 -6.792 -14.486 148 HB VAL 19 HB VAL 19 14.832 -6.994 -13.719 149 HG11 VAL 19 HG11 VAL 19 15.275 -4.642 -12.917 150 HG12 VAL 19 HG12 VAL 19 14.240 -4.764 -14.337 151 HG13 VAL 19 HG13 VAL 19 13.536 -4.413 -12.740 152 HG21 VAL 19 HG21 VAL 19 15.657 -6.536 -11.526 153 HG22 VAL 19 HG22 VAL 19 14.028 -6.211 -10.922 154 HG23 VAL 19 HG23 VAL 19 14.498 -7.857 -11.404 155 H ASP 20 H ASP 20 14.432 -8.938 -13.819 156 HA ASP 20 HA ASP 20 13.542 -11.263 -14.318 157 HB2 ASP 20 HB2 ASP 20 15.338 -10.629 -11.935 158 HB3 ASP 20 HB3 ASP 20 15.136 -12.237 -12.615 159 H ASP 21 H ASP 21 13.838 -10.896 -10.818 160 HA ASP 21 HA ASP 21 11.007 -11.320 -10.267 161 HB2 ASP 21 HB2 ASP 21 11.226 -13.174 -8.901 162 HB3 ASP 21 HB3 ASP 21 12.143 -13.614 -10.352 163 H VAL 22 H VAL 22 12.876 -9.089 -10.097 164 HA VAL 22 HA VAL 22 12.846 -8.672 -7.159 165 HB VAL 22 HB VAL 22 15.040 -7.517 -8.957 166 HG11 VAL 22 HG11 VAL 22 14.874 -6.070 -7.171 167 HG12 VAL 22 HG12 VAL 22 14.287 -7.304 -6.060 168 HG13 VAL 22 HG13 VAL 22 15.973 -7.279 -6.494 169 HG21 VAL 22 HG21 VAL 22 15.460 -9.881 -8.905 170 HG22 VAL 22 HG22 VAL 22 16.537 -9.122 -7.731 171 HG23 VAL 22 HG23 VAL 22 15.082 -9.991 -7.184 172 H VAL 23 H VAL 23 12.178 -6.651 -6.495 173 HA VAL 23 HA VAL 23 10.710 -5.028 -8.512 174 HB VAL 23 HB VAL 23 10.558 -5.016 -5.486 175 HG11 VAL 23 HG11 VAL 23 8.468 -3.873 -5.792 176 HG12 VAL 23 HG12 VAL 23 9.701 -2.983 -6.662 177 HG13 VAL 23 HG13 VAL 23 8.573 -4.013 -7.567 178 HG21 VAL 23 HG21 VAL 23 8.509 -6.357 -5.722 179 HG22 VAL 23 HG22 VAL 23 8.803 -6.565 -7.447 180 HG23 VAL 23 HG23 VAL 23 9.909 -7.278 -6.235 181 H ILE 24 H ILE 24 11.284 -2.861 -8.786 182 HA ILE 24 HA ILE 24 13.548 -1.767 -7.148 183 HB ILE 24 HB ILE 24 12.886 -1.560 -10.145 184 HG12 ILE 24 HG12 ILE 24 15.401 -1.947 -10.325 185 HG13 ILE 24 HG13 ILE 24 15.459 -2.114 -8.554 186 HG21 ILE 24 HG21 ILE 24 14.677 0.205 -8.436 187 HG22 ILE 24 HG22 ILE 24 14.753 0.160 -10.213 188 HG23 ILE 24 HG23 ILE 24 13.290 0.721 -9.418 189 HD11 ILE 24 HD11 ILE 24 14.552 -4.017 -10.656 190 HD12 ILE 24 HD12 ILE 24 15.862 -4.188 -9.542 191 HD13 ILE 24 HD13 ILE 24 14.227 -4.304 -8.898 192 H LEU 25 H LEU 25 12.256 -0.530 -5.536 193 HA LEU 25 HA LEU 25 10.055 1.099 -6.494 194 HB2 LEU 25 HB2 LEU 25 11.721 1.240 -3.959 195 HB3 LEU 25 HB3 LEU 25 10.323 2.221 -4.346 196 HG LEU 25 HG LEU 25 9.309 0.734 -3.093 197 HD11 LEU 25 HD11 LEU 25 8.226 0.381 -5.322 198 HD12 LEU 25 HD12 LEU 25 9.241 -1.044 -5.549 199 HD13 LEU 25 HD13 LEU 25 8.064 -1.000 -4.233 200 HD21 LEU 25 HD21 LEU 25 11.297 -0.549 -2.510 201 HD22 LEU 25 HD22 LEU 25 9.819 -1.519 -2.617 202 HD23 LEU 25 HD23 LEU 25 11.004 -1.547 -3.962 203 H MET 26 H MET 26 10.283 3.378 -6.984 204 HA MET 26 HA MET 26 13.033 4.524 -7.055 205 HB2 MET 26 HB2 MET 26 10.873 4.777 -9.165 206 HB3 MET 26 HB3 MET 26 12.432 5.622 -9.147 207 HG2 MET 26 HG2 MET 26 13.592 3.401 -9.118 208 HG3 MET 26 HG3 MET 26 12.024 2.610 -9.262 209 HE1 MET 26 HE1 MET 26 10.838 3.463 -12.845 210 HE2 MET 26 HE2 MET 26 10.425 2.783 -11.260 211 HE3 MET 26 HE3 MET 26 10.523 4.547 -11.475 212 HA PRO 27 HA PRO 27 10.164 7.046 -4.392 213 HB2 PRO 27 HB2 PRO 27 12.182 8.057 -2.765 214 HB3 PRO 27 HB3 PRO 27 11.313 6.519 -2.453 215 HG2 PRO 27 HG2 PRO 27 13.945 6.912 -3.925 216 HG3 PRO 27 HG3 PRO 27 13.615 5.795 -2.573 217 HD2 PRO 27 HD2 PRO 27 13.480 4.822 -5.061 218 HD3 PRO 27 HD3 PRO 27 12.123 4.461 -3.977 219 H ASN 28 H ASN 28 9.683 9.031 -4.878 220 HA ASN 28 HA ASN 28 11.694 11.037 -5.587 221 HB2 ASN 28 HB2 ASN 28 9.863 11.940 -7.313 222 HB3 ASN 28 HB3 ASN 28 11.171 10.874 -7.742 223 HD21 ASN 28 HD21 ASN 28 7.679 10.255 -6.444 224 HD22 ASN 28 HD22 ASN 28 7.562 8.954 -7.587 225 H LYS 29 H LYS 29 8.206 11.889 -5.799 226 HA LYS 29 HA LYS 29 8.544 13.108 -3.105 227 HB2 LYS 29 HB2 LYS 29 6.639 13.894 -5.347 228 HB3 LYS 29 HB3 LYS 29 6.668 14.549 -3.716 229 HG2 LYS 29 HG2 LYS 29 7.838 16.145 -4.816 230 HG3 LYS 29 HG3 LYS 29 9.116 15.173 -4.127 231 HD2 LYS 29 HD2 LYS 29 8.372 14.170 -6.805 232 HD3 LYS 29 HD3 LYS 29 8.713 15.892 -6.889 233 HE2 LYS 29 HE2 LYS 29 10.521 13.854 -5.544 234 HE3 LYS 29 HE3 LYS 29 10.719 14.355 -7.217 235 HZ1 LYS 29 HZ1 LYS 29 12.008 15.478 -5.276 236 HZ2 LYS 29 HZ2 LYS 29 11.520 16.404 -6.522 237 HZ3 LYS 29 HZ3 LYS 29 10.686 16.411 -5.098 238 H GLU 30 H GLU 30 8.084 10.753 -2.344 239 HA GLU 30 HA GLU 30 5.254 10.721 -1.647 240 HB2 GLU 30 HB2 GLU 30 4.760 8.610 -2.569 241 HB3 GLU 30 HB3 GLU 30 5.510 9.650 -3.809 242 HG2 GLU 30 HG2 GLU 30 7.599 8.492 -3.674 243 HG3 GLU 30 HG3 GLU 30 7.008 7.492 -2.338 244 H LEU 31 H LEU 31 8.310 10.466 -0.395 245 HA LEU 31 HA LEU 31 7.637 8.305 1.537 246 HB2 LEU 31 HB2 LEU 31 10.090 9.845 0.766 247 HB3 LEU 31 HB3 LEU 31 9.972 9.304 2.421 248 HG LEU 31 HG LEU 31 10.111 7.074 1.949 249 HD11 LEU 31 HD11 LEU 31 8.303 6.636 0.398 250 HD12 LEU 31 HD12 LEU 31 9.131 7.540 -0.897 251 HD13 LEU 31 HD13 LEU 31 9.793 6.012 -0.292 252 HD21 LEU 31 HD21 LEU 31 12.171 8.320 1.254 253 HD22 LEU 31 HD22 LEU 31 11.974 6.774 0.408 254 HD23 LEU 31 HD23 LEU 31 11.588 8.306 -0.413 255 H ASN 32 H ASN 32 5.796 10.153 1.409 256 HA ASN 32 HA ASN 32 6.018 12.084 3.627 257 HB2 ASN 32 HB2 ASN 32 3.801 12.781 2.997 258 HB3 ASN 32 HB3 ASN 32 4.803 12.752 1.548 259 HD21 ASN 32 HD21 ASN 32 4.259 11.088 -0.175 260 HD22 ASN 32 HD22 ASN 32 2.656 10.419 -0.085 261 H ILE 33 H ILE 33 4.489 11.890 5.392 262 HA ILE 33 HA ILE 33 4.602 9.361 6.622 263 HB ILE 33 HB ILE 33 2.973 11.855 7.254 264 HG12 ILE 33 HG12 ILE 33 5.627 10.756 8.288 265 HG13 ILE 33 HG13 ILE 33 5.434 12.152 7.245 266 HG21 ILE 33 HG21 ILE 33 1.895 9.972 8.340 267 HG22 ILE 33 HG22 ILE 33 3.450 9.355 8.915 268 HG23 ILE 33 HG23 ILE 33 2.794 10.870 9.562 269 HD11 ILE 33 HD11 ILE 33 4.043 13.215 9.108 270 HD12 ILE 33 HD12 ILE 33 4.668 11.915 10.157 271 HD13 ILE 33 HD13 ILE 33 5.801 13.030 9.396 272 H GLU 34 H GLU 34 1.950 10.830 4.656 273 HA GLU 34 HA GLU 34 0.007 8.895 5.598 274 HB2 GLU 34 HB2 GLU 34 -0.157 10.725 3.176 275 HB3 GLU 34 HB3 GLU 34 -1.483 9.845 3.964 276 HG2 GLU 34 HG2 GLU 34 -0.905 11.113 6.107 277 HG3 GLU 34 HG3 GLU 34 0.198 12.090 5.150 278 H ASN 35 H ASN 35 2.627 8.689 3.488 279 HA ASN 35 HA ASN 35 1.568 6.209 2.212 280 HB2 ASN 35 HB2 ASN 35 2.257 8.121 0.670 281 HB3 ASN 35 HB3 ASN 35 3.882 7.950 1.343 282 HD21 ASN 35 HD21 ASN 35 5.135 6.870 -0.140 283 HD22 ASN 35 HD22 ASN 35 4.705 5.382 -0.973 284 H ALA 36 H ALA 36 2.698 6.673 5.001 285 HA ALA 36 HA ALA 36 5.231 5.114 4.790 286 HB1 ALA 36 HB1 ALA 36 5.860 6.001 6.844 287 HB2 ALA 36 HB2 ALA 36 5.256 7.350 5.869 288 HB3 ALA 36 HB3 ALA 36 4.244 6.681 7.172 289 H HIS 37 H HIS 37 2.259 5.205 7.038 290 HA HIS 37 HA HIS 37 2.876 2.619 8.066 291 HB2 HIS 37 HB2 HIS 37 1.266 4.152 9.131 292 HB3 HIS 37 HB3 HIS 37 0.163 3.954 7.782 293 HD1 HIS 37 HD1 HIS 37 2.006 1.165 9.870 294 HD2 HIS 37 HD2 HIS 37 -1.816 2.507 8.650 295 HE1 HIS 37 HE1 HIS 37 0.336 -0.541 10.713 296 H LEU 38 H LEU 38 0.583 3.604 5.456 297 HA LEU 38 HA LEU 38 -0.157 1.025 4.686 298 HB2 LEU 38 HB2 LEU 38 -1.326 2.012 3.012 299 HB3 LEU 38 HB3 LEU 38 -1.135 3.363 4.093 300 HG LEU 38 HG LEU 38 0.939 3.998 2.628 301 HD11 LEU 38 HD11 LEU 38 0.176 3.138 0.117 302 HD12 LEU 38 HD12 LEU 38 1.436 2.379 1.077 303 HD13 LEU 38 HD13 LEU 38 -0.190 1.693 1.102 304 HD21 LEU 38 HD21 LEU 38 -1.797 4.179 1.329 305 HD22 LEU 38 HD22 LEU 38 -1.250 5.201 2.665 306 HD23 LEU 38 HD23 LEU 38 -0.395 5.259 1.113 307 H PHE 39 H PHE 39 2.849 2.725 4.055 308 HA PHE 39 HA PHE 39 3.718 1.699 1.638 309 HB2 PHE 39 HB2 PHE 39 4.779 3.297 3.435 310 HB3 PHE 39 HB3 PHE 39 5.514 1.867 4.086 311 HD1 PHE 39 HD1 PHE 39 5.065 3.436 0.621 312 HD2 PHE 39 HD2 PHE 39 7.757 1.589 3.494 313 HE1 PHE 39 HE1 PHE 39 6.955 4.392 -0.545 314 HE2 PHE 39 HE2 PHE 39 9.680 2.423 2.153 315 HZ PHE 39 HZ PHE 39 9.274 3.888 0.207 316 H LYS 40 H LYS 40 3.871 0.239 4.876 317 HA LYS 40 HA LYS 40 5.348 -2.085 4.009 318 HB2 LYS 40 HB2 LYS 40 5.065 -1.074 6.411 319 HB3 LYS 40 HB3 LYS 40 3.574 -2.025 6.484 320 HG2 LYS 40 HG2 LYS 40 4.906 -4.079 6.000 321 HG3 LYS 40 HG3 LYS 40 6.347 -3.098 5.814 322 HD2 LYS 40 HD2 LYS 40 6.772 -3.761 7.894 323 HD3 LYS 40 HD3 LYS 40 5.788 -2.371 8.335 324 HE2 LYS 40 HE2 LYS 40 4.932 -5.299 8.173 325 HE3 LYS 40 HE3 LYS 40 5.242 -4.387 9.653 326 HZ1 LYS 40 HZ1 LYS 40 3.057 -3.935 7.713 327 HZ2 LYS 40 HZ2 LYS 40 2.901 -4.578 9.197 328 HZ3 LYS 40 HZ3 LYS 40 3.317 -2.987 9.048 329 H LYS 41 H LYS 41 1.817 -1.380 4.377 330 HA LYS 41 HA LYS 41 0.979 -4.043 3.776 331 HB2 LYS 41 HB2 LYS 41 -0.258 -1.403 4.291 332 HB3 LYS 41 HB3 LYS 41 -0.969 -2.144 2.915 333 HG2 LYS 41 HG2 LYS 41 -0.911 -4.335 4.674 334 HG3 LYS 41 HG3 LYS 41 -1.158 -2.967 5.756 335 HD2 LYS 41 HD2 LYS 41 -3.335 -3.795 5.088 336 HD3 LYS 41 HD3 LYS 41 -3.049 -2.237 4.293 337 HE2 LYS 41 HE2 LYS 41 -2.138 -3.673 2.307 338 HE3 LYS 41 HE3 LYS 41 -2.999 -5.019 3.054 339 HZ1 LYS 41 HZ1 LYS 41 -4.070 -3.441 1.304 340 HZ2 LYS 41 HZ2 LYS 41 -5.011 -4.019 2.521 341 HZ3 LYS 41 HZ3 LYS 41 -4.400 -2.485 2.595 342 H TRP 42 H TRP 42 1.525 -1.156 1.758 343 HA TRP 42 HA TRP 42 0.704 -2.263 -0.741 344 HB2 TRP 42 HB2 TRP 42 0.950 0.068 -0.668 345 HB3 TRP 42 HB3 TRP 42 2.527 -0.016 0.089 346 HD1 TRP 42 HD1 TRP 42 1.118 -1.182 -3.379 347 HE1 TRP 42 HE1 TRP 42 2.856 -0.685 -5.151 348 HE3 TRP 42 HE3 TRP 42 4.681 0.905 -0.384 349 HZ2 TRP 42 HZ2 TRP 42 5.618 0.508 -5.256 350 HZ3 TRP 42 HZ3 TRP 42 6.783 1.693 -1.277 351 HH2 TRP 42 HH2 TRP 42 7.240 1.537 -3.804 352 H VAL 43 H VAL 43 4.173 -1.878 0.445 353 HA VAL 43 HA VAL 43 5.155 -3.561 -1.486 354 HB VAL 43 HB VAL 43 6.198 -3.039 1.325 355 HG11 VAL 43 HG11 VAL 43 7.719 -4.309 -0.994 356 HG12 VAL 43 HG12 VAL 43 8.441 -3.712 0.506 357 HG13 VAL 43 HG13 VAL 43 7.325 -5.080 0.555 358 HG21 VAL 43 HG21 VAL 43 6.093 -1.029 -0.015 359 HG22 VAL 43 HG22 VAL 43 7.779 -1.522 0.017 360 HG23 VAL 43 HG23 VAL 43 6.804 -1.842 -1.423 361 H PHE 44 H PHE 44 3.651 -4.644 1.607 362 HA PHE 44 HA PHE 44 4.305 -7.352 1.439 363 HB2 PHE 44 HB2 PHE 44 2.097 -5.729 2.674 364 HB3 PHE 44 HB3 PHE 44 1.944 -7.449 2.566 365 HD1 PHE 44 HD1 PHE 44 5.239 -5.761 3.322 366 HD2 PHE 44 HD2 PHE 44 1.790 -7.863 4.864 367 HE1 PHE 44 HE1 PHE 44 6.399 -6.067 5.500 368 HE2 PHE 44 HE2 PHE 44 2.970 -8.216 6.996 369 HZ PHE 44 HZ PHE 44 5.283 -7.362 7.305 370 H ASP 45 H ASP 45 1.284 -5.739 0.358 371 HA ASP 45 HA ASP 45 0.371 -8.228 -0.840 372 HB2 ASP 45 HB2 ASP 45 -0.858 -5.611 -0.337 373 HB3 ASP 45 HB3 ASP 45 -1.288 -6.259 -1.918 374 H GLU 46 H GLU 46 1.625 -5.195 -2.160 375 HA GLU 46 HA GLU 46 1.128 -5.671 -4.889 376 HB2 GLU 46 HB2 GLU 46 1.758 -3.512 -3.573 377 HB3 GLU 46 HB3 GLU 46 3.416 -4.069 -3.686 378 HG2 GLU 46 HG2 GLU 46 3.306 -2.662 -5.485 379 HG3 GLU 46 HG3 GLU 46 2.929 -4.175 -6.289 380 H PHE 47 H PHE 47 3.722 -6.827 -2.718 381 HA PHE 47 HA PHE 47 5.061 -8.073 -5.036 382 HB2 PHE 47 HB2 PHE 47 6.592 -6.660 -2.848 383 HB3 PHE 47 HB3 PHE 47 7.205 -7.401 -4.309 384 HD1 PHE 47 HD1 PHE 47 5.945 -6.388 -6.580 385 HD2 PHE 47 HD2 PHE 47 6.499 -4.367 -2.829 386 HE1 PHE 47 HE1 PHE 47 5.657 -4.220 -7.709 387 HE2 PHE 47 HE2 PHE 47 6.129 -2.175 -3.946 388 HZ PHE 47 HZ PHE 47 5.745 -2.095 -6.398 389 H LEU 48 H LEU 48 5.338 -7.918 -1.410 390 HA LEU 48 HA LEU 48 6.762 -10.324 -1.306 391 HB2 LEU 48 HB2 LEU 48 4.981 -9.196 0.883 392 HB3 LEU 48 HB3 LEU 48 6.226 -10.417 1.105 393 HG LEU 48 HG LEU 48 6.631 -7.500 0.377 394 HD11 LEU 48 HD11 LEU 48 7.722 -9.076 2.728 395 HD12 LEU 48 HD12 LEU 48 7.794 -7.317 2.471 396 HD13 LEU 48 HD13 LEU 48 6.236 -8.121 2.783 397 HD21 LEU 48 HD21 LEU 48 8.777 -9.646 0.516 398 HD22 LEU 48 HD22 LEU 48 8.287 -8.742 -0.930 399 HD23 LEU 48 HD23 LEU 48 9.059 -7.893 0.410 400 H ASN 49 H ASN 49 3.326 -9.891 -0.663 401 HA ASN 49 HA ASN 49 2.643 -12.700 -0.487 402 HB2 ASN 49 HB2 ASN 49 0.871 -10.276 -0.998 403 HB3 ASN 49 HB3 ASN 49 0.323 -11.874 -0.517 404 HD21 ASN 49 HD21 ASN 49 -0.329 -9.413 1.052 405 HD22 ASN 49 HD22 ASN 49 0.541 -9.628 2.545 406 H LYS 50 H LYS 50 2.710 -10.228 -3.039 407 HA LYS 50 HA LYS 50 1.271 -11.593 -5.054 408 HB2 LYS 50 HB2 LYS 50 2.900 -9.236 -4.850 409 HB3 LYS 50 HB3 LYS 50 3.525 -10.142 -6.192 410 HG2 LYS 50 HG2 LYS 50 0.654 -10.101 -6.503 411 HG3 LYS 50 HG3 LYS 50 1.176 -8.493 -5.985 412 HD2 LYS 50 HD2 LYS 50 2.964 -8.649 -7.842 413 HD3 LYS 50 HD3 LYS 50 1.999 -9.983 -8.481 414 HE2 LYS 50 HE2 LYS 50 1.157 -7.084 -8.021 415 HE3 LYS 50 HE3 LYS 50 1.449 -7.873 -9.575 416 HZ1 LYS 50 HZ1 LYS 50 -0.841 -7.750 -9.251 417 HZ2 LYS 50 HZ2 LYS 50 -0.471 -9.333 -9.021 418 HZ3 LYS 50 HZ3 LYS 50 -0.799 -8.352 -7.727 419 H GLY 51 H GLY 51 4.573 -12.086 -3.913 420 HA2 GLY 51 HA2 GLY 51 5.095 -14.575 -4.432 421 HA3 GLY 51 HA3 GLY 51 5.087 -14.039 -6.111 422 H TYR 52 H TYR 52 6.365 -11.439 -4.265 423 HA TYR 52 HA TYR 52 9.013 -12.132 -5.343 424 HB2 TYR 52 HB2 TYR 52 7.822 -9.558 -4.269 425 HB3 TYR 52 HB3 TYR 52 9.463 -9.729 -4.879 426 HD1 TYR 52 HD1 TYR 52 9.940 -9.996 -7.231 427 HD2 TYR 52 HD2 TYR 52 5.855 -9.821 -5.898 428 HE1 TYR 52 HE1 TYR 52 9.166 -9.903 -9.583 429 HE2 TYR 52 HE2 TYR 52 5.067 -9.617 -8.192 430 HH TYR 52 HH TYR 52 6.117 -10.520 -10.565 431 H ASN 53 H ASN 53 10.887 -12.002 -4.101 432 HA ASN 53 HA ASN 53 10.653 -11.645 -1.124 433 HB2 ASN 53 HB2 ASN 53 12.174 -13.824 -2.632 434 HB3 ASN 53 HB3 ASN 53 12.447 -13.451 -0.944 435 HD21 ASN 53 HD21 ASN 53 10.769 -14.046 0.657 436 HD22 ASN 53 HD22 ASN 53 9.594 -15.239 0.209 437 H LYS 54 H LYS 54 11.747 -10.172 -3.825 438 HA LYS 54 HA LYS 54 14.246 -9.244 -2.516 439 HB2 LYS 54 HB2 LYS 54 13.934 -10.422 -5.277 440 HB3 LYS 54 HB3 LYS 54 15.128 -9.179 -4.944 441 HG2 LYS 54 HG2 LYS 54 16.557 -10.606 -4.060 442 HG3 LYS 54 HG3 LYS 54 15.407 -11.112 -2.838 443 HD2 LYS 54 HD2 LYS 54 15.624 -12.277 -5.654 444 HD3 LYS 54 HD3 LYS 54 16.264 -12.971 -4.140 445 HE2 LYS 54 HE2 LYS 54 14.074 -13.199 -3.203 446 HE3 LYS 54 HE3 LYS 54 13.338 -12.459 -4.653 447 HZ1 LYS 54 HZ1 LYS 54 13.270 -14.927 -4.599 448 HZ2 LYS 54 HZ2 LYS 54 13.962 -14.284 -5.932 449 HZ3 LYS 54 HZ3 LYS 54 14.907 -14.969 -4.753 450 H ILE 55 H ILE 55 14.370 -7.084 -2.564 451 HA ILE 55 HA ILE 55 12.840 -5.468 -4.508 452 HB ILE 55 HB ILE 55 12.682 -5.403 -1.474 453 HG12 ILE 55 HG12 ILE 55 10.310 -4.603 -3.059 454 HG13 ILE 55 HG13 ILE 55 10.911 -6.150 -3.602 455 HG21 ILE 55 HG21 ILE 55 11.544 -3.141 -1.681 456 HG22 ILE 55 HG22 ILE 55 13.293 -3.125 -1.896 457 HG23 ILE 55 HG23 ILE 55 12.244 -3.049 -3.313 458 HD11 ILE 55 HD11 ILE 55 9.185 -6.494 -1.979 459 HD12 ILE 55 HD12 ILE 55 10.731 -7.083 -1.345 460 HD13 ILE 55 HD13 ILE 55 10.061 -5.514 -0.784 461 H PHE 56 H PHE 56 13.956 -3.470 -4.908 462 HA PHE 56 HA PHE 56 16.350 -2.898 -3.302 463 HB2 PHE 56 HB2 PHE 56 16.095 -2.487 -6.290 464 HB3 PHE 56 HB3 PHE 56 17.464 -1.993 -5.318 465 HD1 PHE 56 HD1 PHE 56 17.734 -4.568 -3.564 466 HD2 PHE 56 HD2 PHE 56 17.123 -3.973 -7.802 467 HE1 PHE 56 HE1 PHE 56 18.618 -6.790 -4.030 468 HE2 PHE 56 HE2 PHE 56 18.007 -6.217 -8.262 469 HZ PHE 56 HZ PHE 56 18.799 -7.651 -6.354 470 H LEU 57 H LEU 57 16.689 -0.623 -2.928 471 HA LEU 57 HA LEU 57 14.412 1.142 -3.762 472 HB2 LEU 57 HB2 LEU 57 14.513 0.647 -1.350 473 HB3 LEU 57 HB3 LEU 57 16.209 1.153 -1.312 474 HG LEU 57 HG LEU 57 15.447 3.482 -1.972 475 HD11 LEU 57 HD11 LEU 57 13.333 2.901 -3.050 476 HD12 LEU 57 HD12 LEU 57 12.719 2.170 -1.555 477 HD13 LEU 57 HD13 LEU 57 12.987 3.915 -1.643 478 HD21 LEU 57 HD21 LEU 57 15.920 2.910 0.374 479 HD22 LEU 57 HD22 LEU 57 14.548 4.025 0.263 480 HD23 LEU 57 HD23 LEU 57 14.258 2.307 0.575 481 H VAL 58 H VAL 58 15.061 2.528 -5.419 482 HA VAL 58 HA VAL 58 17.920 3.271 -5.602 483 HB VAL 58 HB VAL 58 15.600 3.844 -7.493 484 HG11 VAL 58 HG11 VAL 58 18.628 4.200 -7.783 485 HG12 VAL 58 HG12 VAL 58 17.480 4.287 -9.126 486 HG13 VAL 58 HG13 VAL 58 17.397 5.474 -7.823 487 HG21 VAL 58 HG21 VAL 58 16.139 1.417 -7.305 488 HG22 VAL 58 HG22 VAL 58 16.549 2.079 -8.894 489 HG23 VAL 58 HG23 VAL 58 17.829 1.777 -7.697 490 H LEU 59 H LEU 59 18.593 4.973 -4.427 491 HA LEU 59 HA LEU 59 16.625 7.033 -3.709 492 HB2 LEU 59 HB2 LEU 59 19.403 6.461 -2.627 493 HB3 LEU 59 HB3 LEU 59 18.379 7.786 -2.113 494 HG LEU 59 HG LEU 59 16.690 5.499 -2.049 495 HD11 LEU 59 HD11 LEU 59 17.836 3.832 -0.764 496 HD12 LEU 59 HD12 LEU 59 18.753 4.121 -2.243 497 HD13 LEU 59 HD13 LEU 59 19.330 4.807 -0.716 498 HD21 LEU 59 HD21 LEU 59 16.156 6.108 0.008 499 HD22 LEU 59 HD22 LEU 59 17.820 6.152 0.586 500 HD23 LEU 59 HD23 LEU 59 17.155 7.540 -0.300 501 H SER 60 H SER 60 18.489 6.664 -6.385 502 HA SER 60 HA SER 60 20.033 8.876 -6.726 503 HB2 SER 60 HB2 SER 60 18.107 7.673 -8.756 504 HB3 SER 60 HB3 SER 60 19.544 8.620 -9.119 505 HG SER 60 HG SER 60 20.812 6.970 -8.266 506 H ASP 61 H ASP 61 16.427 8.798 -7.159 507 HA ASP 61 HA ASP 61 16.421 11.569 -8.085 508 HB2 ASP 61 HB2 ASP 61 14.267 9.551 -7.502 509 HB3 ASP 61 HB3 ASP 61 13.891 11.233 -7.852 510 H VAL 62 H VAL 62 16.107 9.992 -4.951 511 HA VAL 62 HA VAL 62 14.505 12.230 -3.866 512 HB VAL 62 HB VAL 62 13.981 9.876 -3.298 513 HG11 VAL 62 HG11 VAL 62 15.213 8.709 -1.538 514 HG12 VAL 62 HG12 VAL 62 16.222 8.974 -2.964 515 HG13 VAL 62 HG13 VAL 62 16.462 9.982 -1.527 516 HG21 VAL 62 HG21 VAL 62 14.594 11.448 -0.777 517 HG22 VAL 62 HG22 VAL 62 13.237 11.823 -1.885 518 HG23 VAL 62 HG23 VAL 62 13.321 10.260 -1.060 519 H GLU 63 H GLU 63 15.371 13.096 -1.586 520 HA GLU 63 HA GLU 63 18.308 13.516 -1.715 521 HB2 GLU 63 HB2 GLU 63 17.248 15.563 -2.438 522 HB3 GLU 63 HB3 GLU 63 16.091 15.478 -1.064 523 HG2 GLU 63 HG2 GLU 63 17.993 15.737 0.550 524 HG3 GLU 63 HG3 GLU 63 19.114 15.941 -0.854 525 H SER 64 H SER 64 15.303 13.443 0.357 526 HA SER 64 HA SER 64 16.822 11.944 2.324 527 HB2 SER 64 HB2 SER 64 16.075 13.621 4.136 528 HB3 SER 64 HB3 SER 64 17.381 14.109 3.057 529 HG SER 64 HG SER 64 14.744 15.013 3.147 530 H ILE 65 H ILE 65 15.341 11.466 4.285 531 HA ILE 65 HA ILE 65 12.558 10.981 3.460 532 HB ILE 65 HB ILE 65 13.841 8.961 2.934 533 HG12 ILE 65 HG12 ILE 65 12.276 8.477 5.490 534 HG13 ILE 65 HG13 ILE 65 11.542 8.870 3.937 535 HG21 ILE 65 HG21 ILE 65 15.033 7.671 4.658 536 HG22 ILE 65 HG22 ILE 65 15.786 9.234 4.407 537 HG23 ILE 65 HG23 ILE 65 14.743 8.982 5.830 538 HD11 ILE 65 HD11 ILE 65 11.442 6.534 4.085 539 HD12 ILE 65 HD12 ILE 65 12.792 6.829 2.986 540 HD13 ILE 65 HD13 ILE 65 13.109 6.385 4.672 541 H ASP 66 H ASP 66 11.188 10.668 5.382 542 HA ASP 66 HA ASP 66 12.074 12.509 7.502 543 HB2 ASP 66 HB2 ASP 66 9.670 12.206 6.182 544 HB3 ASP 66 HB3 ASP 66 9.364 11.280 7.654 545 H SER 67 H SER 67 11.492 11.896 9.845 546 HA SER 67 HA SER 67 12.874 9.531 10.612 547 HB2 SER 67 HB2 SER 67 11.460 10.050 12.838 548 HB3 SER 67 HB3 SER 67 12.860 10.989 12.333 549 HG SER 67 HG SER 67 10.141 11.695 12.286 550 H PHE 68 H PHE 68 9.497 10.180 10.032 551 HA PHE 68 HA PHE 68 8.274 8.002 11.224 552 HB2 PHE 68 HB2 PHE 68 7.343 10.153 10.135 553 HB3 PHE 68 HB3 PHE 68 7.264 9.217 8.661 554 HD1 PHE 68 HD1 PHE 68 6.000 6.918 8.834 555 HD2 PHE 68 HD2 PHE 68 5.578 10.119 11.673 556 HE1 PHE 68 HE1 PHE 68 3.832 5.949 9.583 557 HE2 PHE 68 HE2 PHE 68 3.395 9.209 12.374 558 HZ PHE 68 HZ PHE 68 2.521 7.106 11.358 559 H SER 69 H SER 69 8.731 8.175 7.535 560 HA SER 69 HA SER 69 8.484 5.442 7.216 561 HB2 SER 69 HB2 SER 69 9.797 7.567 5.470 562 HB3 SER 69 HB3 SER 69 9.251 5.954 4.997 563 HG SER 69 HG SER 69 7.486 6.841 4.532 564 H LEU 70 H LEU 70 11.437 7.407 7.906 565 HA LEU 70 HA LEU 70 13.337 5.603 6.931 566 HB2 LEU 70 HB2 LEU 70 13.775 7.904 7.558 567 HB3 LEU 70 HB3 LEU 70 13.416 7.567 9.248 568 HG LEU 70 HG LEU 70 15.455 6.270 9.466 569 HD11 LEU 70 HD11 LEU 70 17.186 6.240 7.707 570 HD12 LEU 70 HD12 LEU 70 15.741 5.365 7.164 571 HD13 LEU 70 HD13 LEU 70 16.072 6.999 6.565 572 HD21 LEU 70 HD21 LEU 70 16.100 8.919 8.090 573 HD22 LEU 70 HD22 LEU 70 15.424 8.777 9.729 574 HD23 LEU 70 HD23 LEU 70 17.007 8.089 9.367 575 H GLY 71 H GLY 71 11.315 5.173 9.749 576 HA2 GLY 71 HA2 GLY 71 12.948 2.885 10.729 577 HA3 GLY 71 HA3 GLY 71 11.441 3.480 11.413 578 H VAL 72 H VAL 72 10.038 3.526 8.757 579 HA VAL 72 HA VAL 72 8.992 0.849 8.818 580 HB VAL 72 HB VAL 72 8.517 2.964 6.682 581 HG11 VAL 72 HG11 VAL 72 7.746 0.704 6.051 582 HG12 VAL 72 HG12 VAL 72 6.890 0.540 7.597 583 HG13 VAL 72 HG13 VAL 72 6.371 1.741 6.396 584 HG21 VAL 72 HG21 VAL 72 7.956 3.926 8.876 585 HG22 VAL 72 HG22 VAL 72 6.487 3.570 7.977 586 HG23 VAL 72 HG23 VAL 72 7.006 2.494 9.299 587 H ILE 73 H ILE 73 11.253 2.625 6.692 588 HA ILE 73 HA ILE 73 11.641 0.714 4.666 589 HB ILE 73 HB ILE 73 13.388 2.850 5.886 590 HG12 ILE 73 HG12 ILE 73 13.427 3.688 3.561 591 HG13 ILE 73 HG13 ILE 73 12.565 2.264 3.008 592 HG21 ILE 73 HG21 ILE 73 15.204 2.364 4.252 593 HG22 ILE 73 HG22 ILE 73 15.066 1.102 5.471 594 HG23 ILE 73 HG23 ILE 73 14.412 0.827 3.838 595 HD11 ILE 73 HD11 ILE 73 11.492 4.435 4.803 596 HD12 ILE 73 HD12 ILE 73 11.092 4.203 3.111 597 HD13 ILE 73 HD13 ILE 73 10.556 3.002 4.302 598 H VAL 74 H VAL 74 13.326 0.849 7.885 599 HA VAL 74 HA VAL 74 14.697 -1.629 7.375 600 HB VAL 74 HB VAL 74 14.108 0.135 9.786 601 HG11 VAL 74 HG11 VAL 74 13.905 -2.067 10.816 602 HG12 VAL 74 HG12 VAL 74 15.433 -2.591 10.057 603 HG13 VAL 74 HG13 VAL 74 15.417 -1.294 11.281 604 HG21 VAL 74 HG21 VAL 74 16.510 0.394 9.798 605 HG22 VAL 74 HG22 VAL 74 16.718 -0.907 8.606 606 HG23 VAL 74 HG23 VAL 74 15.925 0.613 8.143 607 H ASN 75 H ASN 75 11.499 -0.843 8.802 608 HA ASN 75 HA ASN 75 10.938 -3.385 9.903 609 HB2 ASN 75 HB2 ASN 75 9.503 -1.006 9.512 610 HB3 ASN 75 HB3 ASN 75 8.629 -2.163 8.483 611 HD21 ASN 75 HD21 ASN 75 10.041 -1.753 11.800 612 HD22 ASN 75 HD22 ASN 75 8.840 -2.738 12.571 613 H ILE 76 H ILE 76 10.414 -2.204 6.558 614 HA ILE 76 HA ILE 76 9.332 -4.629 5.524 615 HB ILE 76 HB ILE 76 10.772 -2.258 4.259 616 HG12 ILE 76 HG12 ILE 76 7.872 -3.192 4.158 617 HG13 ILE 76 HG13 ILE 76 8.478 -1.906 5.204 618 HG21 ILE 76 HG21 ILE 76 11.148 -4.325 2.810 619 HG22 ILE 76 HG22 ILE 76 9.394 -4.520 2.704 620 HG23 ILE 76 HG23 ILE 76 10.229 -3.077 2.049 621 HD11 ILE 76 HD11 ILE 76 7.401 -0.898 3.334 622 HD12 ILE 76 HD12 ILE 76 9.148 -0.592 3.204 623 HD13 ILE 76 HD13 ILE 76 8.363 -1.832 2.189 624 H LEU 77 H LEU 77 12.695 -3.749 6.369 625 HA LEU 77 HA LEU 77 13.864 -5.908 4.760 626 HB2 LEU 77 HB2 LEU 77 15.205 -3.905 5.294 627 HB3 LEU 77 HB3 LEU 77 15.075 -4.223 7.000 628 HG LEU 77 HG LEU 77 17.239 -4.797 5.897 629 HD11 LEU 77 HD11 LEU 77 16.555 -5.666 8.141 630 HD12 LEU 77 HD12 LEU 77 16.126 -7.203 7.335 631 HD13 LEU 77 HD13 LEU 77 17.785 -6.584 7.275 632 HD21 LEU 77 HD21 LEU 77 15.796 -7.229 4.789 633 HD22 LEU 77 HD22 LEU 77 16.484 -5.878 3.854 634 HD23 LEU 77 HD23 LEU 77 17.547 -6.930 4.778 635 H LYS 78 H LYS 78 12.942 -5.327 8.176 636 HA LYS 78 HA LYS 78 13.771 -7.888 9.135 637 HB2 LYS 78 HB2 LYS 78 11.444 -6.206 10.161 638 HB3 LYS 78 HB3 LYS 78 12.260 -7.554 10.983 639 HG2 LYS 78 HG2 LYS 78 14.369 -6.279 10.960 640 HG3 LYS 78 HG3 LYS 78 13.542 -4.894 10.239 641 HD2 LYS 78 HD2 LYS 78 12.138 -4.583 12.139 642 HD3 LYS 78 HD3 LYS 78 12.579 -6.150 12.840 643 HE2 LYS 78 HE2 LYS 78 14.589 -3.921 12.417 644 HE3 LYS 78 HE3 LYS 78 13.618 -4.096 13.894 645 HZ1 LYS 78 HZ1 LYS 78 14.559 -6.334 14.148 646 HZ2 LYS 78 HZ2 LYS 78 15.574 -6.071 12.888 647 HZ3 LYS 78 HZ3 LYS 78 15.692 -5.164 14.256 648 H SER 79 H SER 79 10.594 -6.806 7.834 649 HA SER 79 HA SER 79 9.243 -9.276 7.891 650 HB2 SER 79 HB2 SER 79 9.161 -6.900 5.996 651 HB3 SER 79 HB3 SER 79 8.057 -8.270 5.834 652 HG SER 79 HG SER 79 7.340 -7.953 7.873 653 H ILE 80 H ILE 80 11.125 -7.939 5.106 654 HA ILE 80 HA ILE 80 11.023 -10.204 3.524 655 HB ILE 80 HB ILE 80 12.909 -7.861 3.798 656 HG12 ILE 80 HG12 ILE 80 10.899 -8.811 1.695 657 HG13 ILE 80 HG13 ILE 80 10.606 -7.558 2.898 658 HG21 ILE 80 HG21 ILE 80 14.349 -9.687 2.937 659 HG22 ILE 80 HG22 ILE 80 13.179 -9.913 1.590 660 HG23 ILE 80 HG23 ILE 80 14.095 -8.407 1.776 661 HD11 ILE 80 HD11 ILE 80 12.417 -7.488 0.495 662 HD12 ILE 80 HD12 ILE 80 11.108 -6.374 0.961 663 HD13 ILE 80 HD13 ILE 80 12.637 -6.333 1.849 664 H SER 81 H SER 81 13.500 -9.486 6.042 665 HA SER 81 HA SER 81 15.151 -11.688 5.536 666 HB2 SER 81 HB2 SER 81 16.117 -11.216 7.651 667 HB3 SER 81 HB3 SER 81 15.446 -9.673 7.067 668 HG SER 81 HG SER 81 13.592 -10.099 8.400 669 H SER 82 H SER 82 12.388 -11.416 7.640 670 HA SER 82 HA SER 82 12.303 -14.122 8.579 671 HB2 SER 82 HB2 SER 82 11.211 -11.762 9.341 672 HB3 SER 82 HB3 SER 82 9.820 -12.417 8.485 673 HG SER 82 HG SER 82 11.218 -13.990 10.382 674 H SER 83 H SER 83 10.745 -12.500 5.754 675 HA SER 83 HA SER 83 9.240 -14.757 4.822 676 HB2 SER 83 HB2 SER 83 10.507 -12.326 3.538 677 HB3 SER 83 HB3 SER 83 9.725 -13.572 2.582 678 HG SER 83 HG SER 83 7.819 -13.071 3.408 679 H GLY 84 H GLY 84 12.706 -14.190 4.847 680 HA2 GLY 84 HA2 GLY 84 14.230 -15.939 4.090 681 HA3 GLY 84 HA3 GLY 84 12.954 -16.425 2.928 682 H GLY 85 H GLY 85 13.084 -13.027 2.821 683 HA2 GLY 85 HA2 GLY 85 14.346 -13.225 0.193 684 HA3 GLY 85 HA3 GLY 85 13.248 -11.988 0.850 685 H PHE 86 H PHE 86 15.040 -10.815 -0.255 686 HA PHE 86 HA PHE 86 16.983 -9.841 1.732 687 HB2 PHE 86 HB2 PHE 86 17.677 -11.295 -0.761 688 HB3 PHE 86 HB3 PHE 86 18.435 -9.719 -0.651 689 HD1 PHE 86 HD1 PHE 86 17.878 -12.851 1.377 690 HD2 PHE 86 HD2 PHE 86 20.441 -9.460 0.593 691 HE1 PHE 86 HE1 PHE 86 19.500 -13.685 3.036 692 HE2 PHE 86 HE2 PHE 86 21.994 -10.254 2.327 693 HZ PHE 86 HZ PHE 86 21.577 -12.405 3.505 694 H PHE 87 H PHE 87 17.723 -7.610 1.223 695 HA PHE 87 HA PHE 87 16.450 -6.256 -0.954 696 HB2 PHE 87 HB2 PHE 87 14.552 -5.895 0.307 697 HB3 PHE 87 HB3 PHE 87 15.403 -6.002 1.838 698 HD1 PHE 87 HD1 PHE 87 15.572 -3.625 -1.176 699 HD2 PHE 87 HD2 PHE 87 15.263 -4.109 3.099 700 HE1 PHE 87 HE1 PHE 87 15.522 -1.209 -0.876 701 HE2 PHE 87 HE2 PHE 87 14.942 -1.698 3.374 702 HZ PHE 87 HZ PHE 87 15.218 -0.175 1.368 703 H ALA 88 H ALA 88 17.414 -4.268 -1.344 704 HA ALA 88 HA ALA 88 19.580 -3.361 0.381 705 HB1 ALA 88 HB1 ALA 88 20.078 -4.484 -2.386 706 HB2 ALA 88 HB2 ALA 88 21.258 -3.575 -1.391 707 HB3 ALA 88 HB3 ALA 88 20.626 -5.165 -0.886 708 H LEU 89 H LEU 89 20.474 -1.302 -0.326 709 HA LEU 89 HA LEU 89 18.499 0.378 -1.767 710 HB2 LEU 89 HB2 LEU 89 20.664 0.974 0.307 711 HB3 LEU 89 HB3 LEU 89 19.735 2.192 -0.531 712 HG LEU 89 HG LEU 89 17.625 1.036 0.394 713 HD11 LEU 89 HD11 LEU 89 19.608 -0.465 1.849 714 HD12 LEU 89 HD12 LEU 89 17.979 -0.076 2.525 715 HD13 LEU 89 HD13 LEU 89 18.101 -0.916 0.968 716 HD21 LEU 89 HD21 LEU 89 19.558 2.238 2.429 717 HD22 LEU 89 HD22 LEU 89 18.603 3.226 1.319 718 HD23 LEU 89 HD23 LEU 89 17.779 2.243 2.540 719 H VAL 90 H VAL 90 19.380 2.112 -3.147 720 HA VAL 90 HA VAL 90 21.909 1.342 -4.474 721 HB VAL 90 HB VAL 90 19.128 1.590 -5.707 722 HG11 VAL 90 HG11 VAL 90 20.792 2.525 -7.256 723 HG12 VAL 90 HG12 VAL 90 21.827 1.113 -6.972 724 HG13 VAL 90 HG13 VAL 90 20.269 0.952 -7.834 725 HG21 VAL 90 HG21 VAL 90 21.014 -0.713 -5.249 726 HG22 VAL 90 HG22 VAL 90 19.339 -0.505 -4.624 727 HG23 VAL 90 HG23 VAL 90 19.627 -0.832 -6.331 728 H SER 91 H SER 91 23.050 3.006 -5.197 729 HA SER 91 HA SER 91 23.825 5.088 -5.329 730 HB2 SER 91 HB2 SER 91 22.015 4.852 -7.263 731 HB3 SER 91 HB3 SER 91 21.157 6.069 -6.326 732 HG SER 91 HG SER 91 23.553 7.011 -6.462 733 HA PRO 92 HA PRO 92 21.396 6.213 -1.442 734 HB2 PRO 92 HB2 PRO 92 23.144 5.505 0.508 735 HB3 PRO 92 HB3 PRO 92 22.090 4.309 -0.309 736 HG2 PRO 92 HG2 PRO 92 25.000 4.956 -0.957 737 HG3 PRO 92 HG3 PRO 92 24.261 3.353 -0.707 738 HD2 PRO 92 HD2 PRO 92 24.615 4.387 -3.184 739 HD3 PRO 92 HD3 PRO 92 23.217 3.362 -2.748 740 H ASN 93 H ASN 93 21.685 8.281 -2.385 741 HA ASN 93 HA ASN 93 24.033 9.666 -2.687 742 HB2 ASN 93 HB2 ASN 93 22.749 11.746 -2.671 743 HB3 ASN 93 HB3 ASN 93 21.943 10.498 -3.570 744 HD21 ASN 93 HD21 ASN 93 21.518 12.883 -1.157 745 HD22 ASN 93 HD22 ASN 93 20.010 12.262 -0.471 746 H GLU 94 H GLU 94 25.064 11.213 -1.638 747 HA GLU 94 HA GLU 94 26.057 10.474 0.828 748 HB2 GLU 94 HB2 GLU 94 27.195 11.755 -0.898 749 HB3 GLU 94 HB3 GLU 94 26.200 13.173 -0.552 750 HG2 GLU 94 HG2 GLU 94 27.162 13.328 1.686 751 HG3 GLU 94 HG3 GLU 94 28.162 11.898 1.395 752 H LYS 95 H LYS 95 23.436 12.780 0.248 753 HA LYS 95 HA LYS 95 23.331 13.900 2.913 754 HB2 LYS 95 HB2 LYS 95 22.385 14.787 0.668 755 HB3 LYS 95 HB3 LYS 95 20.980 13.803 1.013 756 HG2 LYS 95 HG2 LYS 95 22.089 15.800 3.042 757 HG3 LYS 95 HG3 LYS 95 21.138 16.316 1.671 758 HD2 LYS 95 HD2 LYS 95 19.532 16.184 3.284 759 HD3 LYS 95 HD3 LYS 95 19.339 14.715 2.341 760 HE2 LYS 95 HE2 LYS 95 19.029 14.625 4.886 761 HE3 LYS 95 HE3 LYS 95 19.964 13.340 4.143 762 HZ1 LYS 95 HZ1 LYS 95 21.963 14.375 4.860 763 HZ2 LYS 95 HZ2 LYS 95 21.159 15.728 5.423 764 HZ3 LYS 95 HZ3 LYS 95 20.965 14.285 6.159 765 H VAL 96 H VAL 96 21.647 11.184 1.232 766 HA VAL 96 HA VAL 96 20.111 10.475 3.522 767 HB VAL 96 HB VAL 96 20.543 9.554 0.755 768 HG11 VAL 96 HG11 VAL 96 19.667 7.412 2.706 769 HG12 VAL 96 HG12 VAL 96 19.672 7.332 0.920 770 HG13 VAL 96 HG13 VAL 96 21.196 7.408 1.796 771 HG21 VAL 96 HG21 VAL 96 18.152 9.325 0.808 772 HG22 VAL 96 HG22 VAL 96 18.121 9.299 2.593 773 HG23 VAL 96 HG23 VAL 96 18.571 10.779 1.719 774 H GLU 97 H GLU 97 23.279 9.336 2.136 775 HA GLU 97 HA GLU 97 23.684 7.096 3.605 776 HB2 GLU 97 HB2 GLU 97 24.955 8.774 1.730 777 HB3 GLU 97 HB3 GLU 97 26.048 8.821 3.087 778 HG2 GLU 97 HG2 GLU 97 24.937 6.252 1.936 779 HG3 GLU 97 HG3 GLU 97 26.278 7.108 1.222 780 H ARG 98 H ARG 98 24.268 10.552 4.526 781 HA ARG 98 HA ARG 98 25.795 10.363 6.637 782 HB2 ARG 98 HB2 ARG 98 24.432 12.156 5.177 783 HB3 ARG 98 HB3 ARG 98 23.311 12.176 6.516 784 HG2 ARG 98 HG2 ARG 98 26.250 12.478 7.024 785 HG3 ARG 98 HG3 ARG 98 25.212 13.659 6.203 786 HD2 ARG 98 HD2 ARG 98 23.737 13.449 8.338 787 HD3 ARG 98 HD3 ARG 98 25.189 12.776 9.081 788 HE ARG 98 HE ARG 98 26.323 14.928 8.102 789 HH11 ARG 98 HH11 ARG 98 22.940 14.932 9.361 790 HH12 ARG 98 HH12 ARG 98 22.931 16.634 9.552 791 HH21 ARG 98 HH21 ARG 98 26.034 17.261 8.060 792 HH22 ARG 98 HH22 ARG 98 24.580 17.911 8.738 793 H VAL 99 H VAL 99 22.400 10.406 6.472 794 HA VAL 99 HA VAL 99 21.734 10.123 9.188 795 HB VAL 99 HB VAL 99 19.989 9.325 6.794 796 HG11 VAL 99 HG11 VAL 99 19.215 10.628 9.453 797 HG12 VAL 99 HG12 VAL 99 18.115 10.088 8.166 798 HG13 VAL 99 HG13 VAL 99 19.046 8.887 9.079 799 HG21 VAL 99 HG21 VAL 99 20.674 12.043 7.781 800 HG22 VAL 99 HG22 VAL 99 20.863 11.309 6.169 801 HG23 VAL 99 HG23 VAL 99 19.214 11.659 6.768 802 H LEU 100 H LEU 100 21.856 7.910 6.380 803 HA LEU 100 HA LEU 100 20.938 5.601 7.658 804 HB2 LEU 100 HB2 LEU 100 22.927 5.647 5.313 805 HB3 LEU 100 HB3 LEU 100 22.077 4.327 5.921 806 HG LEU 100 HG LEU 100 21.245 6.431 4.075 807 HD11 LEU 100 HD11 LEU 100 19.871 3.811 4.708 808 HD12 LEU 100 HD12 LEU 100 19.710 4.800 3.236 809 HD13 LEU 100 HD13 LEU 100 21.258 4.022 3.598 810 HD21 LEU 100 HD21 LEU 100 19.186 5.849 6.252 811 HD22 LEU 100 HD22 LEU 100 19.733 7.427 5.641 812 HD23 LEU 100 HD23 LEU 100 18.762 6.431 4.625 813 H SER 101 H SER 101 23.794 7.352 8.072 814 HA SER 101 HA SER 101 25.077 5.028 9.460 815 HB2 SER 101 HB2 SER 101 26.213 7.410 8.020 816 HB3 SER 101 HB3 SER 101 27.203 6.332 9.011 817 HG SER 101 HG SER 101 26.081 4.540 7.574 818 H LEU 102 H LEU 102 23.239 7.417 10.249 819 HA LEU 102 HA LEU 102 24.392 7.883 12.962 820 HB2 LEU 102 HB2 LEU 102 22.580 9.556 11.212 821 HB3 LEU 102 HB3 LEU 102 22.743 9.849 12.929 822 HG LEU 102 HG LEU 102 25.018 10.001 10.930 823 HD11 LEU 102 HD11 LEU 102 23.383 11.810 10.661 824 HD12 LEU 102 HD12 LEU 102 23.505 12.190 12.395 825 HD13 LEU 102 HD13 LEU 102 24.906 12.427 11.339 826 HD21 LEU 102 HD21 LEU 102 24.957 10.537 13.911 827 HD22 LEU 102 HD22 LEU 102 25.931 9.340 13.031 828 HD23 LEU 102 HD23 LEU 102 26.262 11.069 12.824 829 H THR 103 H THR 103 21.778 6.583 11.089 830 HA THR 103 HA THR 103 20.116 6.101 13.483 831 HB THR 103 HB THR 103 19.340 7.430 11.512 832 HG1 THR 103 HG1 THR 103 17.575 5.305 11.575 833 HG21 THR 103 HG21 THR 103 18.742 4.927 9.980 834 HG22 THR 103 HG22 THR 103 19.019 6.617 9.410 835 HG23 THR 103 HG23 THR 103 20.374 5.590 9.861 836 H ASN 104 H ASN 104 22.514 4.510 11.925 837 HA ASN 104 HA ASN 104 23.056 2.439 11.178 838 HB2 ASN 104 HB2 ASN 104 21.495 1.764 13.675 839 HB3 ASN 104 HB3 ASN 104 22.025 0.494 12.581 840 HD21 ASN 104 HD21 ASN 104 23.374 3.302 14.476 841 HD22 ASN 104 HD22 ASN 104 24.935 2.525 14.611 842 H LEU 105 H LEU 105 21.996 2.923 9.200 843 HA LEU 105 HA LEU 105 19.644 1.171 8.643 844 HB2 LEU 105 HB2 LEU 105 19.734 3.881 8.233 845 HB3 LEU 105 HB3 LEU 105 20.481 3.325 6.770 846 HG LEU 105 HG LEU 105 18.269 3.659 6.202 847 HD11 LEU 105 HD11 LEU 105 18.289 0.705 6.819 848 HD12 LEU 105 HD12 LEU 105 17.388 1.536 5.540 849 HD13 LEU 105 HD13 LEU 105 19.155 1.421 5.443 850 HD21 LEU 105 HD21 LEU 105 17.514 2.266 8.765 851 HD22 LEU 105 HD22 LEU 105 17.374 3.975 8.366 852 HD23 LEU 105 HD23 LEU 105 16.366 2.826 7.496 853 H ASP 106 H ASP 106 22.703 2.620 7.333 854 HA ASP 106 HA ASP 106 23.021 0.700 5.245 855 HB2 ASP 106 HB2 ASP 106 24.902 1.855 4.685 856 HB3 ASP 106 HB3 ASP 106 24.031 3.109 5.555 857 H ARG 107 H ARG 107 23.487 0.460 8.539 858 HA ARG 107 HA ARG 107 25.539 -1.658 8.422 859 HB2 ARG 107 HB2 ARG 107 24.208 -0.397 10.853 860 HB3 ARG 107 HB3 ARG 107 25.720 -1.316 10.802 861 HG2 ARG 107 HG2 ARG 107 26.458 0.498 9.046 862 HG3 ARG 107 HG3 ARG 107 25.148 1.467 9.718 863 HD2 ARG 107 HD2 ARG 107 26.306 2.062 11.508 864 HD3 ARG 107 HD3 ARG 107 26.960 0.433 11.786 865 HE ARG 107 HE ARG 107 28.688 0.760 10.248 866 HH11 ARG 107 HH11 ARG 107 27.259 3.896 10.958 867 HH12 ARG 107 HH12 ARG 107 28.112 4.723 9.685 868 HH21 ARG 107 HH21 ARG 107 29.454 1.763 8.330 869 HH22 ARG 107 HH22 ARG 107 29.398 3.479 8.176 870 H ILE 108 H ILE 108 22.343 -1.634 7.878 871 HA ILE 108 HA ILE 108 21.800 -4.240 9.168 872 HB ILE 108 HB ILE 108 19.808 -1.954 8.909 873 HG12 ILE 108 HG12 ILE 108 21.604 -2.751 11.231 874 HG13 ILE 108 HG13 ILE 108 21.417 -1.159 10.475 875 HG21 ILE 108 HG21 ILE 108 18.851 -4.262 8.926 876 HG22 ILE 108 HG22 ILE 108 19.680 -4.583 10.461 877 HG23 ILE 108 HG23 ILE 108 18.391 -3.354 10.352 878 HD11 ILE 108 HD11 ILE 108 19.494 -2.560 12.321 879 HD12 ILE 108 HD12 ILE 108 20.317 -1.018 12.554 880 HD13 ILE 108 HD13 ILE 108 19.029 -1.155 11.334 881 H VAL 109 H VAL 109 21.174 -1.959 6.420 882 HA VAL 109 HA VAL 109 20.102 -4.235 4.868 883 HB VAL 109 HB VAL 109 19.907 -1.326 4.127 884 HG11 VAL 109 HG11 VAL 109 18.245 -3.787 3.468 885 HG12 VAL 109 HG12 VAL 109 17.796 -2.137 2.981 886 HG13 VAL 109 HG13 VAL 109 19.288 -2.825 2.392 887 HG21 VAL 109 HG21 VAL 109 17.868 -2.759 5.902 888 HG22 VAL 109 HG22 VAL 109 18.857 -1.377 6.371 889 HG23 VAL 109 HG23 VAL 109 17.621 -1.185 5.123 890 H LYS 110 H LYS 110 20.982 -4.451 2.742 891 HA LYS 110 HA LYS 110 23.815 -3.803 2.469 892 HB2 LYS 110 HB2 LYS 110 21.714 -5.249 0.900 893 HB3 LYS 110 HB3 LYS 110 23.237 -4.844 0.122 894 HG2 LYS 110 HG2 LYS 110 23.594 -6.054 2.807 895 HG3 LYS 110 HG3 LYS 110 22.708 -7.105 1.695 896 HD2 LYS 110 HD2 LYS 110 25.037 -7.647 1.434 897 HD3 LYS 110 HD3 LYS 110 24.535 -6.765 0.015 898 HE2 LYS 110 HE2 LYS 110 26.539 -5.714 0.486 899 HE3 LYS 110 HE3 LYS 110 25.387 -4.628 1.265 900 HZ1 LYS 110 HZ1 LYS 110 27.197 -5.087 2.721 901 HZ2 LYS 110 HZ2 LYS 110 25.907 -5.874 3.377 902 HZ3 LYS 110 HZ3 LYS 110 27.056 -6.695 2.515 903 H ILE 111 H ILE 111 24.654 -2.647 0.635 904 HA ILE 111 HA ILE 111 22.864 -0.640 -0.577 905 HB ILE 111 HB ILE 111 25.106 -0.214 1.344 906 HG12 ILE 111 HG12 ILE 111 24.242 2.217 1.219 907 HG13 ILE 111 HG13 ILE 111 22.907 1.579 0.268 908 HG21 ILE 111 HG21 ILE 111 26.206 1.665 0.287 909 HG22 ILE 111 HG22 ILE 111 26.493 0.197 -0.593 910 HG23 ILE 111 HG23 ILE 111 25.326 1.383 -1.222 911 HD11 ILE 111 HD11 ILE 111 23.677 0.624 3.069 912 HD12 ILE 111 HD12 ILE 111 22.559 1.965 2.790 913 HD13 ILE 111 HD13 ILE 111 22.135 0.328 2.220 914 H TYR 112 H TYR 112 23.511 0.039 -2.674 915 HA TYR 112 HA TYR 112 25.964 -1.001 -3.915 916 HB2 TYR 112 HB2 TYR 112 23.136 -1.482 -4.979 917 HB3 TYR 112 HB3 TYR 112 24.607 -1.792 -5.878 918 HD1 TYR 112 HD1 TYR 112 26.131 -3.605 -5.279 919 HD2 TYR 112 HD2 TYR 112 22.498 -2.934 -3.082 920 HE1 TYR 112 HE1 TYR 112 26.358 -5.808 -4.342 921 HE2 TYR 112 HE2 TYR 112 22.645 -5.303 -2.185 922 HH TYR 112 HH TYR 112 25.554 -7.151 -2.400 923 H ASP 113 H ASP 113 26.045 -0.112 -6.246 924 HA ASP 113 HA ASP 113 25.514 2.800 -6.093 925 HB2 ASP 113 HB2 ASP 113 27.314 0.982 -7.638 926 HB3 ASP 113 HB3 ASP 113 26.676 2.333 -8.549 927 H THR 114 H THR 114 24.601 -0.141 -7.908 928 HA THR 114 HA THR 114 22.459 1.336 -9.335 929 HB THR 114 HB THR 114 23.132 0.060 -11.394 930 HG1 THR 114 HG1 THR 114 25.612 -0.236 -10.037 931 HG21 THR 114 HG21 THR 114 23.589 2.503 -10.925 932 HG22 THR 114 HG22 THR 114 25.261 2.035 -10.517 933 HG23 THR 114 HG23 THR 114 24.575 1.712 -12.145 934 H ILE 115 H ILE 115 21.097 -0.253 -10.587 935 HA ILE 115 HA ILE 115 20.093 -2.272 -8.787 936 HB ILE 115 HB ILE 115 19.577 -1.558 -11.704 937 HG12 ILE 115 HG12 ILE 115 18.706 0.187 -10.351 938 HG13 ILE 115 HG13 ILE 115 17.342 -0.821 -10.799 939 HG21 ILE 115 HG21 ILE 115 18.238 -3.688 -9.991 940 HG22 ILE 115 HG22 ILE 115 17.511 -3.029 -11.489 941 HG23 ILE 115 HG23 ILE 115 19.049 -3.890 -11.545 942 HD11 ILE 115 HD11 ILE 115 17.772 -1.998 -8.480 943 HD12 ILE 115 HD12 ILE 115 18.666 -0.524 -8.138 944 HD13 ILE 115 HD13 ILE 115 16.955 -0.419 -8.540 945 H SER 116 H SER 116 22.191 -2.233 -11.761 946 HA SER 116 HA SER 116 21.921 -5.031 -11.989 947 HB2 SER 116 HB2 SER 116 22.524 -3.350 -13.754 948 HB3 SER 116 HB3 SER 116 24.190 -3.400 -13.145 949 HG SER 116 HG SER 116 24.451 -5.169 -14.226 950 H GLU 117 H GLU 117 24.280 -2.938 -10.193 951 HA GLU 117 HA GLU 117 25.964 -5.162 -9.587 952 HB2 GLU 117 HB2 GLU 117 25.627 -2.278 -8.760 953 HB3 GLU 117 HB3 GLU 117 26.609 -3.345 -7.719 954 HG2 GLU 117 HG2 GLU 117 27.914 -4.098 -9.540 955 HG3 GLU 117 HG3 GLU 117 26.962 -3.135 -10.713 956 H ALA 118 H ALA 118 22.825 -4.451 -8.578 957 HA ALA 118 HA ALA 118 23.281 -5.524 -5.845 958 HB1 ALA 118 HB1 ALA 118 20.952 -4.907 -5.504 959 HB2 ALA 118 HB2 ALA 118 21.871 -3.492 -6.127 960 HB3 ALA 118 HB3 ALA 118 20.777 -4.376 -7.188 961 H MET 119 H MET 119 21.581 -5.873 -8.930 962 HA MET 119 HA MET 119 19.960 -7.867 -8.216 963 HB2 MET 119 HB2 MET 119 20.358 -6.361 -10.515 964 HB3 MET 119 HB3 MET 119 20.895 -7.880 -11.077 965 HG2 MET 119 HG2 MET 119 18.338 -7.962 -9.493 966 HG3 MET 119 HG3 MET 119 18.281 -6.882 -10.872 967 HE1 MET 119 HE1 MET 119 17.978 -10.335 -9.452 968 HE2 MET 119 HE2 MET 119 18.024 -11.435 -10.841 969 HE3 MET 119 HE3 MET 119 19.533 -10.746 -10.233 970 H GLU 120 H GLU 120 23.075 -8.385 -9.872 971 HA GLU 120 HA GLU 120 23.117 -11.321 -9.643 972 HB2 GLU 120 HB2 GLU 120 25.413 -10.979 -10.554 973 HB3 GLU 120 HB3 GLU 120 24.238 -10.109 -11.528 974 HG2 GLU 120 HG2 GLU 120 25.087 -8.102 -11.050 975 HG3 GLU 120 HG3 GLU 120 25.334 -8.420 -9.339 976 H GLU 121 H GLU 121 23.629 -8.946 -7.302 977 HA GLU 121 HA GLU 121 25.815 -10.510 -6.114 978 HB2 GLU 121 HB2 GLU 121 25.948 -8.040 -6.634 979 HB3 GLU 121 HB3 GLU 121 24.837 -7.775 -5.274 980 HG2 GLU 121 HG2 GLU 121 26.367 -8.435 -3.714 981 HG3 GLU 121 HG3 GLU 121 27.132 -9.625 -4.767 982 H VAL 122 H VAL 122 22.748 -8.908 -5.094 983 HA VAL 122 HA VAL 122 22.173 -10.027 -2.604 984 HB VAL 122 HB VAL 122 20.256 -9.490 -4.918 985 HG11 VAL 122 HG11 VAL 122 18.819 -8.760 -3.092 986 HG12 VAL 122 HG12 VAL 122 19.346 -10.429 -2.845 987 HG13 VAL 122 HG13 VAL 122 20.148 -9.118 -1.946 988 HG21 VAL 122 HG21 VAL 122 22.162 -7.604 -4.059 989 HG22 VAL 122 HG22 VAL 122 20.688 -7.417 -4.992 990 HG23 VAL 122 HG23 VAL 122 20.691 -7.183 -3.213 991 H ARG 123 H ARG 123 21.778 -11.364 -5.859 992 HA ARG 123 HA ARG 123 20.570 -13.865 -5.408 993 HB2 ARG 123 HB2 ARG 123 22.991 -13.096 -7.027 994 HB3 ARG 123 HB3 ARG 123 22.201 -14.689 -7.200 995 HG2 ARG 123 HG2 ARG 123 20.421 -12.319 -7.447 996 HG3 ARG 123 HG3 ARG 123 21.684 -12.405 -8.645 997 HD2 ARG 123 HD2 ARG 123 19.589 -13.274 -9.480 998 HD3 ARG 123 HD3 ARG 123 20.821 -14.534 -9.439 999 HE ARG 123 HE ARG 123 19.522 -14.665 -7.004 1000 HH11 ARG 123 HH11 ARG 123 18.179 -14.705 -10.344 1001 HH12 ARG 123 HH12 ARG 123 17.141 -16.038 -10.032 1002 HH21 ARG 123 HH21 ARG 123 18.384 -16.729 -6.828 1003 HH22 ARG 123 HH22 ARG 123 17.015 -16.988 -7.868 1004 H ARG 124 H ARG 124 23.871 -12.982 -4.441 1005 HA ARG 124 HA ARG 124 23.882 -15.281 -2.646 1006 HB2 ARG 124 HB2 ARG 124 26.257 -15.845 -3.396 1007 HB3 ARG 124 HB3 ARG 124 25.059 -16.132 -4.641 1008 HG2 ARG 124 HG2 ARG 124 26.154 -13.360 -4.723 1009 HG3 ARG 124 HG3 ARG 124 27.392 -14.570 -4.878 1010 HD2 ARG 124 HD2 ARG 124 25.021 -15.128 -6.604 1011 HD3 ARG 124 HD3 ARG 124 25.783 -13.604 -6.956 1012 HE ARG 124 HE ARG 124 27.897 -15.414 -6.671 1013 HH11 ARG 124 HH11 ARG 124 25.109 -15.088 -8.969 1014 HH12 ARG 124 HH12 ARG 124 25.995 -15.777 -10.250 1015 HH21 ARG 124 HH21 ARG 124 29.011 -16.224 -8.472 1016 HH22 ARG 124 HH22 ARG 124 28.175 -16.487 -9.977 1017 H LYS 125 H LYS 125 23.594 -12.464 -2.196 1018 HA LYS 125 HA LYS 125 25.316 -12.240 0.122 1019 HB2 LYS 125 HB2 LYS 125 24.666 -10.222 -2.075 1020 HB3 LYS 125 HB3 LYS 125 25.337 -9.786 -0.571 1021 HG2 LYS 125 HG2 LYS 125 26.747 -11.876 -2.299 1022 HG3 LYS 125 HG3 LYS 125 26.755 -10.237 -2.783 1023 HD2 LYS 125 HD2 LYS 125 27.775 -9.589 -0.560 1024 HD3 LYS 125 HD3 LYS 125 28.106 -11.326 -0.340 1025 HE2 LYS 125 HE2 LYS 125 29.311 -11.376 -2.487 1026 HE3 LYS 125 HE3 LYS 125 28.875 -9.700 -2.819 1027 HZ1 LYS 125 HZ1 LYS 125 30.289 -9.003 -1.002 1028 HZ2 LYS 125 HZ2 LYS 125 30.637 -10.590 -0.634 1029 HZ3 LYS 125 HZ3 LYS 125 31.122 -9.920 -2.055 Start of MODEL 7 1 H1 MET 1 H1 MET 1 -11.920 -6.247 16.053 2 HA MET 1 HA MET 1 -10.230 -4.747 15.191 3 HB2 MET 1 HB2 MET 1 -8.438 -6.317 16.655 4 HB3 MET 1 HB3 MET 1 -8.130 -6.814 14.995 5 HG2 MET 1 HG2 MET 1 -8.178 -4.225 14.489 6 HG3 MET 1 HG3 MET 1 -7.949 -4.060 16.226 7 HE1 MET 1 HE1 MET 1 -6.457 -6.506 13.364 8 HE2 MET 1 HE2 MET 1 -6.550 -4.828 12.776 9 HE3 MET 1 HE3 MET 1 -4.969 -5.590 13.042 10 H GLY 2 H GLY 2 -10.204 -4.667 12.892 11 HA2 GLY 2 HA2 GLY 2 -10.110 -7.114 11.296 12 HA3 GLY 2 HA3 GLY 2 -11.728 -6.417 11.465 13 H SER 3 H SER 3 -8.515 -4.908 11.184 14 HA SER 3 HA SER 3 -7.536 -3.437 9.877 15 HB2 SER 3 HB2 SER 3 -9.359 -4.638 7.791 16 HB3 SER 3 HB3 SER 3 -8.043 -3.521 7.409 17 HG SER 3 HG SER 3 -7.669 -5.924 7.396 18 H ASP 4 H ASP 4 -10.974 -3.067 10.024 19 HA ASP 4 HA ASP 4 -12.389 -1.302 9.587 20 HB2 ASP 4 HB2 ASP 4 -11.931 -1.357 11.959 21 HB3 ASP 4 HB3 ASP 4 -10.541 -0.289 11.761 22 H LYS 5 H LYS 5 -12.042 -0.588 7.411 23 HA LYS 5 HA LYS 5 -11.093 2.164 7.369 24 HB2 LYS 5 HB2 LYS 5 -9.150 0.382 6.829 25 HB3 LYS 5 HB3 LYS 5 -9.880 0.392 5.226 26 HG2 LYS 5 HG2 LYS 5 -9.441 2.746 4.975 27 HG3 LYS 5 HG3 LYS 5 -9.125 2.940 6.710 28 HD2 LYS 5 HD2 LYS 5 -7.135 1.432 6.467 29 HD3 LYS 5 HD3 LYS 5 -7.324 1.515 4.712 30 HE2 LYS 5 HE2 LYS 5 -6.953 3.889 6.609 31 HE3 LYS 5 HE3 LYS 5 -5.645 3.121 5.692 32 HZ1 LYS 5 HZ1 LYS 5 -6.699 3.783 3.666 33 HZ2 LYS 5 HZ2 LYS 5 -7.994 4.426 4.469 34 HZ3 LYS 5 HZ3 LYS 5 -6.501 5.106 4.640 35 H ILE 6 H ILE 6 -11.740 3.233 5.223 36 HA ILE 6 HA ILE 6 -14.118 1.897 4.058 37 HB ILE 6 HB ILE 6 -14.560 4.147 4.492 38 HG12 ILE 6 HG12 ILE 6 -13.837 4.099 1.530 39 HG13 ILE 6 HG13 ILE 6 -15.150 3.139 2.220 40 HG21 ILE 6 HG21 ILE 6 -13.237 6.077 3.704 41 HG22 ILE 6 HG22 ILE 6 -12.328 5.097 4.828 42 HG23 ILE 6 HG23 ILE 6 -11.985 4.992 3.080 43 HD11 ILE 6 HD11 ILE 6 -16.023 5.183 1.247 44 HD12 ILE 6 HD12 ILE 6 -16.274 5.174 3.000 45 HD13 ILE 6 HD13 ILE 6 -14.987 6.178 2.283 46 H HIS 7 H HIS 7 -13.811 0.566 2.296 47 HA HIS 7 HA HIS 7 -11.232 0.662 0.921 48 HB2 HIS 7 HB2 HIS 7 -11.917 -1.097 -0.429 49 HB3 HIS 7 HB3 HIS 7 -12.276 -1.485 1.243 50 HD1 HIS 7 HD1 HIS 7 -14.520 0.073 -1.551 51 HD2 HIS 7 HD2 HIS 7 -14.150 -3.211 1.042 52 HE1 HIS 7 HE1 HIS 7 -16.500 -1.468 -2.054 53 H HIS 8 H HIS 8 -10.759 2.220 -0.505 54 HA HIS 8 HA HIS 8 -12.352 2.357 -2.809 55 HB2 HIS 8 HB2 HIS 8 -13.500 4.180 -1.366 56 HB3 HIS 8 HB3 HIS 8 -12.050 5.140 -1.619 57 HD1 HIS 8 HD1 HIS 8 -11.530 5.709 -4.349 58 HD2 HIS 8 HD2 HIS 8 -15.186 3.844 -3.345 59 HE1 HIS 8 HE1 HIS 8 -12.916 5.704 -6.453 60 H HIS 9 H HIS 9 -10.456 1.585 -3.805 61 HA HIS 9 HA HIS 9 -8.523 3.690 -4.442 62 HB2 HIS 9 HB2 HIS 9 -7.676 2.449 -2.342 63 HB3 HIS 9 HB3 HIS 9 -7.414 1.060 -3.381 64 HD1 HIS 9 HD1 HIS 9 -6.115 4.572 -2.652 65 HD2 HIS 9 HD2 HIS 9 -5.336 1.267 -5.147 66 HE1 HIS 9 HE1 HIS 9 -3.889 5.060 -3.824 67 H HIS 10 H HIS 10 -9.830 3.402 -6.451 68 HA HIS 10 HA HIS 10 -9.243 0.909 -7.909 69 HB2 HIS 10 HB2 HIS 10 -11.637 2.291 -7.722 70 HB3 HIS 10 HB3 HIS 10 -11.062 2.700 -9.317 71 HD1 HIS 10 HD1 HIS 10 -12.556 -0.175 -7.344 72 HD2 HIS 10 HD2 HIS 10 -10.278 0.545 -10.763 73 HE1 HIS 10 HE1 HIS 10 -12.483 -2.383 -8.588 74 H HIS 11 H HIS 11 -7.081 2.342 -7.446 75 HA HIS 11 HA HIS 11 -6.189 2.545 -10.202 76 HB2 HIS 11 HB2 HIS 11 -5.326 4.422 -7.957 77 HB3 HIS 11 HB3 HIS 11 -4.240 3.989 -9.262 78 HD1 HIS 11 HD1 HIS 11 -7.532 4.339 -10.879 79 HD2 HIS 11 HD2 HIS 11 -4.349 6.784 -9.569 80 HE1 HIS 11 HE1 HIS 11 -7.663 6.476 -12.225 81 H HIS 12 H HIS 12 -3.869 1.667 -10.228 82 HA HIS 12 HA HIS 12 -2.940 0.482 -7.757 83 HB2 HIS 12 HB2 HIS 12 -4.642 -1.176 -8.897 84 HB3 HIS 12 HB3 HIS 12 -3.307 -1.537 -9.989 85 HD1 HIS 12 HD1 HIS 12 -1.397 -3.146 -8.875 86 HD2 HIS 12 HD2 HIS 12 -4.236 -1.456 -6.232 87 HE1 HIS 12 HE1 HIS 12 -0.971 -4.185 -6.597 88 H MET 13 H MET 13 -1.670 2.412 -8.723 89 HA MET 13 HA MET 13 0.495 1.419 -10.540 90 HB2 MET 13 HB2 MET 13 0.332 3.569 -11.787 91 HB3 MET 13 HB3 MET 13 -1.025 2.479 -12.033 92 HG2 MET 13 HG2 MET 13 -2.524 3.783 -10.830 93 HG3 MET 13 HG3 MET 13 -1.275 4.596 -9.894 94 HE1 MET 13 HE1 MET 13 0.792 5.817 -11.824 95 HE2 MET 13 HE2 MET 13 0.048 7.407 -12.096 96 HE3 MET 13 HE3 MET 13 -0.022 6.650 -10.490 97 H PHE 14 H PHE 14 1.291 1.314 -8.083 98 HA PHE 14 HA PHE 14 2.309 3.854 -7.099 99 HB2 PHE 14 HB2 PHE 14 2.750 0.932 -6.477 100 HB3 PHE 14 HB3 PHE 14 3.886 2.123 -5.895 101 HD1 PHE 14 HD1 PHE 14 0.322 1.041 -5.691 102 HD2 PHE 14 HD2 PHE 14 3.395 3.616 -4.068 103 HE1 PHE 14 HE1 PHE 14 -1.088 1.497 -3.717 104 HE2 PHE 14 HE2 PHE 14 1.972 4.064 -2.100 105 HZ PHE 14 HZ PHE 14 -0.229 2.967 -1.888 106 HA PRO 15 HA PRO 15 5.840 4.189 -9.751 107 HB2 PRO 15 HB2 PRO 15 7.559 5.708 -8.306 108 HB3 PRO 15 HB3 PRO 15 5.971 6.315 -8.853 109 HG2 PRO 15 HG2 PRO 15 6.657 5.176 -6.124 110 HG3 PRO 15 HG3 PRO 15 5.807 6.706 -6.498 111 HD2 PRO 15 HD2 PRO 15 4.465 4.410 -5.916 112 HD3 PRO 15 HD3 PRO 15 3.840 5.587 -7.105 113 H TYR 16 H TYR 16 6.369 1.955 -9.906 114 HA TYR 16 HA TYR 16 9.002 1.375 -8.848 115 HB2 TYR 16 HB2 TYR 16 8.478 -0.640 -7.649 116 HB3 TYR 16 HB3 TYR 16 7.418 0.580 -7.037 117 HD1 TYR 16 HD1 TYR 16 7.687 -2.442 -9.121 118 HD2 TYR 16 HD2 TYR 16 4.994 0.404 -7.373 119 HE1 TYR 16 HE1 TYR 16 5.750 -3.908 -9.711 120 HE2 TYR 16 HE2 TYR 16 3.067 -1.115 -7.819 121 HH TYR 16 HH TYR 16 2.557 -3.548 -8.389 122 H LYS 17 H LYS 17 10.031 -0.442 -10.031 123 HA LYS 17 HA LYS 17 8.397 -1.587 -12.216 124 HB2 LYS 17 HB2 LYS 17 10.159 -1.387 -13.768 125 HB3 LYS 17 HB3 LYS 17 9.832 0.163 -12.989 126 HG2 LYS 17 HG2 LYS 17 11.984 0.324 -13.255 127 HG3 LYS 17 HG3 LYS 17 11.829 -0.125 -11.592 128 HD2 LYS 17 HD2 LYS 17 13.443 -1.654 -12.146 129 HD3 LYS 17 HD3 LYS 17 12.133 -2.637 -12.815 130 HE2 LYS 17 HE2 LYS 17 13.755 -0.519 -14.237 131 HE3 LYS 17 HE3 LYS 17 14.172 -2.242 -14.259 132 HZ1 LYS 17 HZ1 LYS 17 11.919 -2.556 -15.372 133 HZ2 LYS 17 HZ2 LYS 17 11.843 -0.924 -15.525 134 HZ3 LYS 17 HZ3 LYS 17 13.044 -1.704 -16.247 135 H ILE 18 H ILE 18 9.482 -3.730 -13.019 136 HA ILE 18 HA ILE 18 10.866 -5.135 -10.825 137 HB ILE 18 HB ILE 18 8.575 -6.343 -12.426 138 HG12 ILE 18 HG12 ILE 18 8.569 -5.371 -9.529 139 HG13 ILE 18 HG13 ILE 18 7.612 -4.736 -10.868 140 HG21 ILE 18 HG21 ILE 18 9.955 -7.489 -9.956 141 HG22 ILE 18 HG22 ILE 18 8.771 -8.290 -11.008 142 HG23 ILE 18 HG23 ILE 18 10.364 -7.959 -11.622 143 HD11 ILE 18 HD11 ILE 18 7.275 -7.436 -9.519 144 HD12 ILE 18 HD12 ILE 18 6.141 -6.092 -9.560 145 HD13 ILE 18 HD13 ILE 18 6.471 -6.990 -11.049 146 H VAL 19 H VAL 19 12.363 -6.710 -11.667 147 HA VAL 19 HA VAL 19 12.799 -6.751 -14.582 148 HB VAL 19 HB VAL 19 15.167 -6.914 -13.962 149 HG11 VAL 19 HG11 VAL 19 13.832 -4.343 -12.983 150 HG12 VAL 19 HG12 VAL 19 15.498 -4.507 -13.570 151 HG13 VAL 19 HG13 VAL 19 14.145 -4.761 -14.678 152 HG21 VAL 19 HG21 VAL 19 15.175 -7.656 -11.676 153 HG22 VAL 19 HG22 VAL 19 15.944 -6.067 -11.775 154 HG23 VAL 19 HG23 VAL 19 14.303 -6.219 -11.151 155 H ASP 20 H ASP 20 14.940 -8.880 -13.572 156 HA ASP 20 HA ASP 20 13.881 -11.104 -14.360 157 HB2 ASP 20 HB2 ASP 20 15.854 -10.693 -12.120 158 HB3 ASP 20 HB3 ASP 20 15.472 -12.283 -12.792 159 H ASP 21 H ASP 21 14.323 -10.864 -10.842 160 HA ASP 21 HA ASP 21 11.492 -11.460 -10.278 161 HB2 ASP 21 HB2 ASP 21 13.689 -13.048 -8.908 162 HB3 ASP 21 HB3 ASP 21 11.941 -13.237 -8.755 163 H VAL 22 H VAL 22 13.166 -9.101 -10.181 164 HA VAL 22 HA VAL 22 13.322 -8.640 -7.266 165 HB VAL 22 HB VAL 22 15.351 -7.378 -9.177 166 HG11 VAL 22 HG11 VAL 22 15.217 -6.020 -7.350 167 HG12 VAL 22 HG12 VAL 22 14.763 -7.302 -6.237 168 HG13 VAL 22 HG13 VAL 22 16.420 -7.215 -6.777 169 HG21 VAL 22 HG21 VAL 22 15.854 -9.739 -9.253 170 HG22 VAL 22 HG22 VAL 22 17.003 -8.956 -8.163 171 HG23 VAL 22 HG23 VAL 22 15.650 -9.900 -7.505 172 H VAL 23 H VAL 23 12.474 -6.804 -6.555 173 HA VAL 23 HA VAL 23 10.846 -5.208 -8.428 174 HB VAL 23 HB VAL 23 10.881 -5.494 -5.393 175 HG11 VAL 23 HG11 VAL 23 8.808 -4.172 -7.176 176 HG12 VAL 23 HG12 VAL 23 8.731 -4.391 -5.413 177 HG13 VAL 23 HG13 VAL 23 9.944 -3.324 -6.101 178 HG21 VAL 23 HG21 VAL 23 8.928 -6.891 -5.603 179 HG22 VAL 23 HG22 VAL 23 8.927 -6.733 -7.374 180 HG23 VAL 23 HG23 VAL 23 10.206 -7.625 -6.525 181 H ILE 24 H ILE 24 11.159 -3.000 -8.623 182 HA ILE 24 HA ILE 24 13.481 -1.728 -7.263 183 HB ILE 24 HB ILE 24 12.404 -1.459 -10.134 184 HG12 ILE 24 HG12 ILE 24 14.979 -1.897 -10.531 185 HG13 ILE 24 HG13 ILE 24 15.044 -2.407 -8.850 186 HG21 ILE 24 HG21 ILE 24 14.433 0.218 -8.572 187 HG22 ILE 24 HG22 ILE 24 14.336 0.210 -10.345 188 HG23 ILE 24 HG23 ILE 24 12.969 0.754 -9.421 189 HD11 ILE 24 HD11 ILE 24 13.163 -3.730 -10.804 190 HD12 ILE 24 HD12 ILE 24 14.910 -4.104 -10.726 191 HD13 ILE 24 HD13 ILE 24 13.890 -4.381 -9.308 192 H LEU 25 H LEU 25 12.402 -0.702 -5.596 193 HA LEU 25 HA LEU 25 9.848 0.669 -6.141 194 HB2 LEU 25 HB2 LEU 25 11.540 0.529 -3.611 195 HB3 LEU 25 HB3 LEU 25 9.899 1.150 -3.731 196 HG LEU 25 HG LEU 25 10.659 -1.744 -4.394 197 HD11 LEU 25 HD11 LEU 25 9.789 -2.434 -2.307 198 HD12 LEU 25 HD12 LEU 25 11.143 -1.334 -2.056 199 HD13 LEU 25 HD13 LEU 25 9.462 -0.759 -1.795 200 HD21 LEU 25 HD21 LEU 25 7.930 -0.610 -3.689 201 HD22 LEU 25 HD22 LEU 25 8.481 -0.886 -5.361 202 HD23 LEU 25 HD23 LEU 25 8.353 -2.245 -4.245 203 H MET 26 H MET 26 9.954 2.922 -6.753 204 HA MET 26 HA MET 26 12.534 4.345 -6.267 205 HB2 MET 26 HB2 MET 26 10.946 4.158 -8.827 206 HB3 MET 26 HB3 MET 26 11.990 5.548 -8.463 207 HG2 MET 26 HG2 MET 26 13.869 4.044 -8.010 208 HG3 MET 26 HG3 MET 26 12.895 2.653 -8.462 209 HE1 MET 26 HE1 MET 26 12.477 3.397 -12.381 210 HE2 MET 26 HE2 MET 26 11.946 2.364 -11.035 211 HE3 MET 26 HE3 MET 26 11.394 4.057 -11.145 212 HA PRO 27 HA PRO 27 9.140 6.795 -4.444 213 HB2 PRO 27 HB2 PRO 27 10.550 7.973 -2.423 214 HB3 PRO 27 HB3 PRO 27 9.902 6.303 -2.307 215 HG2 PRO 27 HG2 PRO 27 12.717 7.163 -3.002 216 HG3 PRO 27 HG3 PRO 27 12.176 5.897 -1.878 217 HD2 PRO 27 HD2 PRO 27 12.973 5.408 -4.465 218 HD3 PRO 27 HD3 PRO 27 11.781 4.374 -3.665 219 H ASN 28 H ASN 28 8.924 8.224 -6.127 220 HA ASN 28 HA ASN 28 10.956 10.135 -6.898 221 HB2 ASN 28 HB2 ASN 28 9.141 11.147 -8.208 222 HB3 ASN 28 HB3 ASN 28 9.372 9.428 -8.540 223 HD21 ASN 28 HD21 ASN 28 7.189 11.743 -6.885 224 HD22 ASN 28 HD22 ASN 28 5.789 10.655 -6.889 225 H LYS 29 H LYS 29 11.081 10.512 -4.349 226 HA LYS 29 HA LYS 29 10.647 11.733 -2.474 227 HB2 LYS 29 HB2 LYS 29 11.171 13.950 -2.601 228 HB3 LYS 29 HB3 LYS 29 12.050 13.201 -3.912 229 HG2 LYS 29 HG2 LYS 29 9.478 14.378 -4.821 230 HG3 LYS 29 HG3 LYS 29 10.475 15.516 -3.948 231 HD2 LYS 29 HD2 LYS 29 11.067 15.856 -6.144 232 HD3 LYS 29 HD3 LYS 29 12.393 14.863 -5.531 233 HE2 LYS 29 HE2 LYS 29 11.352 12.856 -6.574 234 HE3 LYS 29 HE3 LYS 29 9.953 13.812 -7.051 235 HZ1 LYS 29 HZ1 LYS 29 11.591 13.421 -8.807 236 HZ2 LYS 29 HZ2 LYS 29 11.317 15.014 -8.602 237 HZ3 LYS 29 HZ3 LYS 29 12.697 14.305 -8.045 238 H GLU 30 H GLU 30 8.328 10.443 -3.175 239 HA GLU 30 HA GLU 30 6.241 12.437 -2.452 240 HB2 GLU 30 HB2 GLU 30 4.571 11.020 -3.281 241 HB3 GLU 30 HB3 GLU 30 5.755 11.419 -4.528 242 HG2 GLU 30 HG2 GLU 30 6.485 9.201 -4.743 243 HG3 GLU 30 HG3 GLU 30 5.903 8.731 -3.150 244 H LEU 31 H LEU 31 7.820 11.979 -0.419 245 HA LEU 31 HA LEU 31 6.711 9.691 1.108 246 HB2 LEU 31 HB2 LEU 31 9.204 11.334 1.398 247 HB3 LEU 31 HB3 LEU 31 8.572 10.437 2.751 248 HG LEU 31 HG LEU 31 9.296 8.471 2.029 249 HD11 LEU 31 HD11 LEU 31 8.630 9.041 -0.897 250 HD12 LEU 31 HD12 LEU 31 9.284 7.528 -0.226 251 HD13 LEU 31 HD13 LEU 31 7.681 8.054 0.244 252 HD21 LEU 31 HD21 LEU 31 11.264 9.914 1.668 253 HD22 LEU 31 HD22 LEU 31 11.287 8.491 0.608 254 HD23 LEU 31 HD23 LEU 31 10.833 10.080 -0.037 255 H ASN 32 H ASN 32 4.808 10.737 0.782 256 HA ASN 32 HA ASN 32 3.902 13.149 1.905 257 HB2 ASN 32 HB2 ASN 32 2.356 10.644 1.183 258 HB3 ASN 32 HB3 ASN 32 1.655 12.247 1.381 259 HD21 ASN 32 HD21 ASN 32 1.952 10.277 -1.007 260 HD22 ASN 32 HD22 ASN 32 2.506 11.322 -2.301 261 H ILE 33 H ILE 33 4.896 10.667 3.795 262 HA ILE 33 HA ILE 33 4.648 9.844 5.828 263 HB ILE 33 HB ILE 33 3.120 12.378 6.264 264 HG12 ILE 33 HG12 ILE 33 5.538 10.974 7.431 265 HG13 ILE 33 HG13 ILE 33 5.473 12.417 6.413 266 HG21 ILE 33 HG21 ILE 33 2.510 11.800 8.568 267 HG22 ILE 33 HG22 ILE 33 1.629 10.821 7.431 268 HG23 ILE 33 HG23 ILE 33 3.020 10.120 8.285 269 HD11 ILE 33 HD11 ILE 33 4.268 13.584 8.312 270 HD12 ILE 33 HD12 ILE 33 4.604 12.161 9.316 271 HD13 ILE 33 HD13 ILE 33 5.955 13.110 8.675 272 H GLU 34 H GLU 34 1.376 10.772 4.693 273 HA GLU 34 HA GLU 34 0.158 8.483 5.863 274 HB2 GLU 34 HB2 GLU 34 -0.767 10.000 3.390 275 HB3 GLU 34 HB3 GLU 34 -1.734 8.939 4.425 276 HG2 GLU 34 HG2 GLU 34 -1.028 10.606 6.373 277 HG3 GLU 34 HG3 GLU 34 -0.591 11.684 5.049 278 H ASN 35 H ASN 35 1.778 8.984 2.797 279 HA ASN 35 HA ASN 35 1.402 6.368 1.638 280 HB2 ASN 35 HB2 ASN 35 2.279 8.141 0.250 281 HB3 ASN 35 HB3 ASN 35 3.670 8.360 1.336 282 HD21 ASN 35 HD21 ASN 35 5.065 7.894 -0.633 283 HD22 ASN 35 HD22 ASN 35 5.284 6.179 -0.996 284 H ALA 36 H ALA 36 4.185 7.676 3.648 285 HA ALA 36 HA ALA 36 5.513 5.260 3.873 286 HB1 ALA 36 HB1 ALA 36 6.676 7.040 4.609 287 HB2 ALA 36 HB2 ALA 36 5.404 7.570 5.750 288 HB3 ALA 36 HB3 ALA 36 6.374 6.106 6.071 289 H HIS 37 H HIS 37 2.740 6.303 5.951 290 HA HIS 37 HA HIS 37 3.028 4.050 7.738 291 HB2 HIS 37 HB2 HIS 37 1.743 6.056 8.359 292 HB3 HIS 37 HB3 HIS 37 0.567 5.707 7.085 293 HD1 HIS 37 HD1 HIS 37 -1.422 4.058 7.799 294 HD2 HIS 37 HD2 HIS 37 1.991 3.953 10.296 295 HE1 HIS 37 HE1 HIS 37 -1.986 2.508 9.706 296 H LEU 38 H LEU 38 1.370 4.426 4.573 297 HA LEU 38 HA LEU 38 0.148 1.763 4.887 298 HB2 LEU 38 HB2 LEU 38 -1.262 2.284 3.229 299 HB3 LEU 38 HB3 LEU 38 -0.939 3.887 3.850 300 HG LEU 38 HG LEU 38 0.989 3.810 1.952 301 HD11 LEU 38 HD11 LEU 38 -0.041 1.378 1.398 302 HD12 LEU 38 HD12 LEU 38 -1.098 2.363 0.391 303 HD13 LEU 38 HD13 LEU 38 0.659 2.466 0.181 304 HD21 LEU 38 HD21 LEU 38 -1.921 4.408 1.387 305 HD22 LEU 38 HD22 LEU 38 -0.739 5.523 2.097 306 HD23 LEU 38 HD23 LEU 38 -0.516 4.964 0.448 307 H PHE 39 H PHE 39 3.003 3.228 3.567 308 HA PHE 39 HA PHE 39 3.803 1.923 1.429 309 HB2 PHE 39 HB2 PHE 39 5.004 3.530 3.100 310 HB3 PHE 39 HB3 PHE 39 5.781 2.070 3.737 311 HD1 PHE 39 HD1 PHE 39 5.370 4.205 0.619 312 HD2 PHE 39 HD2 PHE 39 7.771 1.328 2.787 313 HE1 PHE 39 HE1 PHE 39 7.270 4.714 -0.824 314 HE2 PHE 39 HE2 PHE 39 9.642 1.754 1.236 315 HZ PHE 39 HZ PHE 39 9.398 3.436 -0.594 316 H LYS 40 H LYS 40 4.246 0.661 4.690 317 HA LYS 40 HA LYS 40 5.383 -1.872 4.102 318 HB2 LYS 40 HB2 LYS 40 5.427 -0.871 6.282 319 HB3 LYS 40 HB3 LYS 40 3.676 -0.823 6.416 320 HG2 LYS 40 HG2 LYS 40 5.077 -3.462 5.992 321 HG3 LYS 40 HG3 LYS 40 5.184 -2.702 7.560 322 HD2 LYS 40 HD2 LYS 40 2.415 -2.561 6.991 323 HD3 LYS 40 HD3 LYS 40 2.906 -4.101 6.301 324 HE2 LYS 40 HE2 LYS 40 2.290 -4.532 8.575 325 HE3 LYS 40 HE3 LYS 40 4.051 -4.634 8.504 326 HZ1 LYS 40 HZ1 LYS 40 3.390 -3.386 10.390 327 HZ2 LYS 40 HZ2 LYS 40 4.116 -2.339 9.359 328 HZ3 LYS 40 HZ3 LYS 40 2.469 -2.341 9.495 329 H LYS 41 H LYS 41 1.895 -1.003 4.507 330 HA LYS 41 HA LYS 41 0.892 -3.627 3.964 331 HB2 LYS 41 HB2 LYS 41 -0.188 -1.225 4.866 332 HB3 LYS 41 HB3 LYS 41 -0.726 -1.190 3.211 333 HG2 LYS 41 HG2 LYS 41 -1.746 -3.431 3.449 334 HG3 LYS 41 HG3 LYS 41 -1.217 -3.500 5.140 335 HD2 LYS 41 HD2 LYS 41 -2.550 -1.454 5.624 336 HD3 LYS 41 HD3 LYS 41 -3.137 -1.435 3.959 337 HE2 LYS 41 HE2 LYS 41 -3.589 -3.678 5.988 338 HE3 LYS 41 HE3 LYS 41 -4.757 -2.408 5.601 339 HZ1 LYS 41 HZ1 LYS 41 -5.209 -4.463 4.395 340 HZ2 LYS 41 HZ2 LYS 41 -4.886 -3.271 3.351 341 HZ3 LYS 41 HZ3 LYS 41 -3.737 -4.431 3.723 342 H TRP 42 H TRP 42 1.363 -0.753 1.848 343 HA TRP 42 HA TRP 42 0.352 -1.923 -0.524 344 HB2 TRP 42 HB2 TRP 42 0.658 0.335 -0.796 345 HB3 TRP 42 HB3 TRP 42 2.214 0.366 0.039 346 HD1 TRP 42 HD1 TRP 42 1.231 -1.671 -3.141 347 HE1 TRP 42 HE1 TRP 42 2.859 -1.254 -4.945 348 HE3 TRP 42 HE3 TRP 42 4.162 1.728 -0.712 349 HZ2 TRP 42 HZ2 TRP 42 5.502 0.019 -5.180 350 HZ3 TRP 42 HZ3 TRP 42 6.324 2.300 -1.612 351 HH2 TRP 42 HH2 TRP 42 7.014 1.535 -3.952 352 H VAL 43 H VAL 43 3.878 -1.398 0.128 353 HA VAL 43 HA VAL 43 4.827 -3.098 -1.748 354 HB VAL 43 HB VAL 43 5.987 -2.563 1.031 355 HG11 VAL 43 HG11 VAL 43 7.139 -4.426 -0.235 356 HG12 VAL 43 HG12 VAL 43 7.606 -3.238 -1.457 357 HG13 VAL 43 HG13 VAL 43 8.162 -3.059 0.209 358 HG21 VAL 43 HG21 VAL 43 5.582 -0.486 -0.262 359 HG22 VAL 43 HG22 VAL 43 7.304 -0.798 -0.172 360 HG23 VAL 43 HG23 VAL 43 6.399 -1.179 -1.654 361 H PHE 44 H PHE 44 3.631 -4.195 1.570 362 HA PHE 44 HA PHE 44 4.475 -6.831 1.280 363 HB2 PHE 44 HB2 PHE 44 2.371 -5.393 2.897 364 HB3 PHE 44 HB3 PHE 44 2.461 -7.107 2.937 365 HD1 PHE 44 HD1 PHE 44 5.752 -5.452 2.536 366 HD2 PHE 44 HD2 PHE 44 2.809 -6.809 5.394 367 HE1 PHE 44 HE1 PHE 44 7.409 -5.315 4.254 368 HE2 PHE 44 HE2 PHE 44 4.458 -6.543 7.183 369 HZ PHE 44 HZ PHE 44 6.774 -5.658 6.661 370 H ASP 45 H ASP 45 1.237 -5.470 0.682 371 HA ASP 45 HA ASP 45 0.124 -7.902 -0.446 372 HB2 ASP 45 HB2 ASP 45 -0.778 -4.994 -0.455 373 HB3 ASP 45 HB3 ASP 45 -1.730 -6.321 -1.127 374 H GLU 46 H GLU 46 2.308 -5.704 -1.688 375 HA GLU 46 HA GLU 46 1.495 -6.080 -4.493 376 HB2 GLU 46 HB2 GLU 46 1.797 -3.809 -3.523 377 HB3 GLU 46 HB3 GLU 46 3.502 -4.180 -3.290 378 HG2 GLU 46 HG2 GLU 46 3.580 -2.993 -5.208 379 HG3 GLU 46 HG3 GLU 46 3.469 -4.619 -5.877 380 H PHE 47 H PHE 47 4.397 -7.007 -2.155 381 HA PHE 47 HA PHE 47 5.313 -8.480 -4.620 382 HB2 PHE 47 HB2 PHE 47 6.836 -6.938 -2.508 383 HB3 PHE 47 HB3 PHE 47 7.570 -7.860 -3.757 384 HD1 PHE 47 HD1 PHE 47 6.453 -7.029 -6.267 385 HD2 PHE 47 HD2 PHE 47 6.504 -4.725 -2.643 386 HE1 PHE 47 HE1 PHE 47 6.052 -4.974 -7.556 387 HE2 PHE 47 HE2 PHE 47 6.043 -2.661 -3.936 388 HZ PHE 47 HZ PHE 47 5.869 -2.775 -6.384 389 H LEU 48 H LEU 48 5.477 -8.076 -1.118 390 HA LEU 48 HA LEU 48 6.878 -10.487 -0.645 391 HB2 LEU 48 HB2 LEU 48 5.102 -8.741 1.124 392 HB3 LEU 48 HB3 LEU 48 6.208 -9.969 1.716 393 HG LEU 48 HG LEU 48 6.866 -7.701 1.896 394 HD11 LEU 48 HD11 LEU 48 8.696 -9.241 -0.127 395 HD12 LEU 48 HD12 LEU 48 9.325 -8.171 1.126 396 HD13 LEU 48 HD13 LEU 48 8.651 -9.715 1.567 397 HD21 LEU 48 HD21 LEU 48 7.846 -6.224 0.769 398 HD22 LEU 48 HD22 LEU 48 7.890 -7.146 -0.722 399 HD23 LEU 48 HD23 LEU 48 6.302 -6.594 -0.039 400 H ASN 49 H ASN 49 3.479 -9.636 0.095 401 HA ASN 49 HA ASN 49 2.667 -12.319 0.715 402 HB2 ASN 49 HB2 ASN 49 1.055 -9.882 -0.140 403 HB3 ASN 49 HB3 ASN 49 0.348 -11.406 0.418 404 HD21 ASN 49 HD21 ASN 49 0.029 -8.702 1.810 405 HD22 ASN 49 HD22 ASN 49 0.768 -8.971 3.352 406 H LYS 50 H LYS 50 3.090 -10.523 -2.240 407 HA LYS 50 HA LYS 50 1.744 -12.306 -4.056 408 HB2 LYS 50 HB2 LYS 50 3.330 -9.846 -4.118 409 HB3 LYS 50 HB3 LYS 50 3.992 -10.954 -5.290 410 HG2 LYS 50 HG2 LYS 50 1.279 -11.144 -5.808 411 HG3 LYS 50 HG3 LYS 50 1.429 -9.465 -5.196 412 HD2 LYS 50 HD2 LYS 50 3.294 -9.129 -6.885 413 HD3 LYS 50 HD3 LYS 50 2.883 -10.750 -7.523 414 HE2 LYS 50 HE2 LYS 50 0.478 -9.891 -7.743 415 HE3 LYS 50 HE3 LYS 50 1.090 -8.267 -7.378 416 HZ1 LYS 50 HZ1 LYS 50 2.462 -8.403 -9.349 417 HZ2 LYS 50 HZ2 LYS 50 1.962 -9.964 -9.635 418 HZ3 LYS 50 HZ3 LYS 50 0.894 -8.723 -9.733 419 H GLY 51 H GLY 51 4.776 -12.615 -2.354 420 HA2 GLY 51 HA2 GLY 51 5.850 -14.713 -2.219 421 HA3 GLY 51 HA3 GLY 51 5.386 -15.095 -3.875 422 H TYR 52 H TYR 52 6.624 -11.854 -3.663 423 HA TYR 52 HA TYR 52 9.147 -12.649 -4.944 424 HB2 TYR 52 HB2 TYR 52 8.025 -9.968 -4.153 425 HB3 TYR 52 HB3 TYR 52 9.639 -10.163 -4.812 426 HD1 TYR 52 HD1 TYR 52 6.042 -10.388 -5.570 427 HD2 TYR 52 HD2 TYR 52 10.040 -10.636 -7.164 428 HE1 TYR 52 HE1 TYR 52 5.109 -10.354 -7.832 429 HE2 TYR 52 HE2 TYR 52 9.130 -10.607 -9.464 430 HH TYR 52 HH TYR 52 5.830 -11.231 -10.110 431 H ASN 53 H ASN 53 11.139 -12.393 -4.068 432 HA ASN 53 HA ASN 53 11.353 -11.775 -1.149 433 HB2 ASN 53 HB2 ASN 53 12.743 -13.925 -2.760 434 HB3 ASN 53 HB3 ASN 53 13.086 -13.555 -1.117 435 HD21 ASN 53 HD21 ASN 53 10.327 -13.196 -0.100 436 HD22 ASN 53 HD22 ASN 53 9.894 -14.872 0.085 437 H LYS 54 H LYS 54 12.139 -10.279 -3.959 438 HA LYS 54 HA LYS 54 14.667 -9.283 -2.796 439 HB2 LYS 54 HB2 LYS 54 14.367 -10.298 -5.620 440 HB3 LYS 54 HB3 LYS 54 15.559 -9.079 -5.158 441 HG2 LYS 54 HG2 LYS 54 16.975 -10.546 -4.329 442 HG3 LYS 54 HG3 LYS 54 15.781 -11.239 -3.244 443 HD2 LYS 54 HD2 LYS 54 16.242 -12.036 -6.160 444 HD3 LYS 54 HD3 LYS 54 16.757 -12.936 -4.715 445 HE2 LYS 54 HE2 LYS 54 14.323 -13.027 -4.003 446 HE3 LYS 54 HE3 LYS 54 13.887 -12.342 -5.580 447 HZ1 LYS 54 HZ1 LYS 54 15.007 -14.333 -6.572 448 HZ2 LYS 54 HZ2 LYS 54 15.142 -14.937 -5.018 449 HZ3 LYS 54 HZ3 LYS 54 13.665 -14.635 -5.678 450 H ILE 55 H ILE 55 14.295 -7.247 -2.409 451 HA ILE 55 HA ILE 55 12.544 -5.517 -4.126 452 HB ILE 55 HB ILE 55 12.704 -5.779 -1.113 453 HG12 ILE 55 HG12 ILE 55 10.204 -5.698 -1.324 454 HG13 ILE 55 HG13 ILE 55 10.333 -5.772 -3.060 455 HG21 ILE 55 HG21 ILE 55 11.279 -3.707 -1.109 456 HG22 ILE 55 HG22 ILE 55 12.933 -3.422 -1.598 457 HG23 ILE 55 HG23 ILE 55 11.665 -3.504 -2.836 458 HD11 ILE 55 HD11 ILE 55 10.907 -8.018 -3.038 459 HD12 ILE 55 HD12 ILE 55 11.467 -7.963 -1.335 460 HD13 ILE 55 HD13 ILE 55 9.726 -7.882 -1.760 461 H PHE 56 H PHE 56 13.537 -3.497 -4.534 462 HA PHE 56 HA PHE 56 15.998 -2.870 -3.025 463 HB2 PHE 56 HB2 PHE 56 15.478 -2.412 -5.986 464 HB3 PHE 56 HB3 PHE 56 16.818 -1.711 -5.099 465 HD1 PHE 56 HD1 PHE 56 17.631 -4.126 -3.399 466 HD2 PHE 56 HD2 PHE 56 16.595 -3.715 -7.574 467 HE1 PHE 56 HE1 PHE 56 19.128 -6.003 -3.978 468 HE2 PHE 56 HE2 PHE 56 17.975 -5.649 -8.130 469 HZ PHE 56 HZ PHE 56 19.292 -6.803 -6.316 470 H LEU 57 H LEU 57 16.427 -0.629 -2.862 471 HA LEU 57 HA LEU 57 14.220 1.235 -3.548 472 HB2 LEU 57 HB2 LEU 57 13.717 0.709 -1.335 473 HB3 LEU 57 HB3 LEU 57 15.401 0.644 -0.855 474 HG LEU 57 HG LEU 57 15.616 3.068 -0.974 475 HD11 LEU 57 HD11 LEU 57 14.052 3.492 -2.873 476 HD12 LEU 57 HD12 LEU 57 12.692 3.142 -1.799 477 HD13 LEU 57 HD13 LEU 57 13.790 4.516 -1.488 478 HD21 LEU 57 HD21 LEU 57 13.182 2.136 0.560 479 HD22 LEU 57 HD22 LEU 57 14.867 2.096 1.112 480 HD23 LEU 57 HD23 LEU 57 14.063 3.643 0.846 481 H VAL 58 H VAL 58 15.736 1.636 -5.323 482 HA VAL 58 HA VAL 58 18.082 2.934 -5.329 483 HB VAL 58 HB VAL 58 15.463 3.420 -6.825 484 HG11 VAL 58 HG11 VAL 58 16.915 4.118 -8.773 485 HG12 VAL 58 HG12 VAL 58 16.800 5.253 -7.435 486 HG13 VAL 58 HG13 VAL 58 18.265 4.255 -7.625 487 HG21 VAL 58 HG21 VAL 58 16.317 1.899 -8.543 488 HG22 VAL 58 HG22 VAL 58 17.739 1.552 -7.525 489 HG23 VAL 58 HG23 VAL 58 16.120 1.084 -6.997 490 H LEU 59 H LEU 59 18.628 5.181 -4.598 491 HA LEU 59 HA LEU 59 16.433 7.103 -3.946 492 HB2 LEU 59 HB2 LEU 59 19.144 6.696 -2.586 493 HB3 LEU 59 HB3 LEU 59 18.146 8.142 -2.430 494 HG LEU 59 HG LEU 59 16.241 6.235 -1.900 495 HD11 LEU 59 HD11 LEU 59 17.982 4.425 -1.977 496 HD12 LEU 59 HD12 LEU 59 18.844 5.213 -0.660 497 HD13 LEU 59 HD13 LEU 59 17.206 4.557 -0.396 498 HD21 LEU 59 HD21 LEU 59 16.782 8.257 -0.542 499 HD22 LEU 59 HD22 LEU 59 16.481 6.825 0.426 500 HD23 LEU 59 HD23 LEU 59 18.156 7.363 0.153 501 H SER 60 H SER 60 17.259 6.686 -6.516 502 HA SER 60 HA SER 60 19.264 8.644 -7.347 503 HB2 SER 60 HB2 SER 60 18.860 6.437 -8.458 504 HB3 SER 60 HB3 SER 60 17.254 6.991 -8.949 505 HG SER 60 HG SER 60 19.561 8.474 -9.640 506 H ASP 61 H ASP 61 15.653 8.429 -7.169 507 HA ASP 61 HA ASP 61 15.425 11.048 -8.552 508 HB2 ASP 61 HB2 ASP 61 13.687 8.648 -8.206 509 HB3 ASP 61 HB3 ASP 61 12.863 10.199 -8.157 510 H VAL 62 H VAL 62 16.063 10.240 -5.514 511 HA VAL 62 HA VAL 62 14.665 12.502 -4.292 512 HB VAL 62 HB VAL 62 13.410 10.356 -3.803 513 HG11 VAL 62 HG11 VAL 62 14.351 8.743 -2.193 514 HG12 VAL 62 HG12 VAL 62 15.159 8.750 -3.765 515 HG13 VAL 62 HG13 VAL 62 15.937 9.513 -2.370 516 HG21 VAL 62 HG21 VAL 62 13.022 10.737 -1.497 517 HG22 VAL 62 HG22 VAL 62 14.622 11.426 -1.243 518 HG23 VAL 62 HG23 VAL 62 13.413 12.321 -2.187 519 H GLU 63 H GLU 63 15.864 12.939 -2.122 520 HA GLU 63 HA GLU 63 18.772 12.356 -2.484 521 HB2 GLU 63 HB2 GLU 63 19.245 14.500 -1.630 522 HB3 GLU 63 HB3 GLU 63 18.020 14.629 -2.925 523 HG2 GLU 63 HG2 GLU 63 16.315 14.665 -0.928 524 HG3 GLU 63 HG3 GLU 63 17.727 15.113 0.043 525 H SER 64 H SER 64 16.111 12.539 -0.172 526 HA SER 64 HA SER 64 17.343 10.358 1.223 527 HB2 SER 64 HB2 SER 64 18.425 12.326 2.293 528 HB3 SER 64 HB3 SER 64 16.834 12.939 2.762 529 HG SER 64 HG SER 64 16.611 11.243 4.179 530 H ILE 65 H ILE 65 16.079 9.410 2.789 531 HA ILE 65 HA ILE 65 13.180 9.778 2.613 532 HB ILE 65 HB ILE 65 14.317 7.549 2.634 533 HG12 ILE 65 HG12 ILE 65 12.694 7.211 5.032 534 HG13 ILE 65 HG13 ILE 65 11.917 8.330 3.908 535 HG21 ILE 65 HG21 ILE 65 14.914 8.115 5.565 536 HG22 ILE 65 HG22 ILE 65 15.106 6.565 4.728 537 HG23 ILE 65 HG23 ILE 65 16.108 7.938 4.257 538 HD11 ILE 65 HD11 ILE 65 12.979 5.628 3.037 539 HD12 ILE 65 HD12 ILE 65 11.309 5.907 3.527 540 HD13 ILE 65 HD13 ILE 65 11.955 6.754 2.119 541 H ASP 66 H ASP 66 12.072 9.963 4.856 542 HA ASP 66 HA ASP 66 13.406 12.075 6.480 543 HB2 ASP 66 HB2 ASP 66 11.333 12.688 5.374 544 HB3 ASP 66 HB3 ASP 66 10.492 11.300 6.078 545 H SER 67 H SER 67 12.956 11.996 8.816 546 HA SER 67 HA SER 67 13.463 9.401 9.924 547 HB2 SER 67 HB2 SER 67 14.256 11.787 10.680 548 HB3 SER 67 HB3 SER 67 12.753 11.771 11.634 549 HG SER 67 HG SER 67 14.713 10.840 12.644 550 H PHE 68 H PHE 68 10.540 10.510 8.820 551 HA PHE 68 HA PHE 68 8.977 8.852 10.690 552 HB2 PHE 68 HB2 PHE 68 8.038 10.800 9.370 553 HB3 PHE 68 HB3 PHE 68 8.279 9.888 7.896 554 HD1 PHE 68 HD1 PHE 68 6.949 7.739 7.556 555 HD2 PHE 68 HD2 PHE 68 6.179 10.459 10.774 556 HE1 PHE 68 HE1 PHE 68 4.712 6.684 7.910 557 HE2 PHE 68 HE2 PHE 68 3.919 9.417 11.107 558 HZ PHE 68 HZ PHE 68 3.201 7.553 9.643 559 H SER 69 H SER 69 9.559 8.466 7.166 560 HA SER 69 HA SER 69 9.011 5.690 7.395 561 HB2 SER 69 HB2 SER 69 8.528 7.207 5.491 562 HB3 SER 69 HB3 SER 69 10.215 7.125 5.019 563 HG SER 69 HG SER 69 8.335 4.968 5.178 564 H LEU 70 H LEU 70 12.057 7.341 7.770 565 HA LEU 70 HA LEU 70 13.990 5.426 7.223 566 HB2 LEU 70 HB2 LEU 70 14.211 7.738 8.259 567 HB3 LEU 70 HB3 LEU 70 13.576 7.084 9.764 568 HG LEU 70 HG LEU 70 15.632 5.616 9.906 569 HD11 LEU 70 HD11 LEU 70 17.584 6.320 8.505 570 HD12 LEU 70 HD12 LEU 70 16.276 5.617 7.522 571 HD13 LEU 70 HD13 LEU 70 16.527 7.384 7.575 572 HD21 LEU 70 HD21 LEU 70 15.418 7.786 11.106 573 HD22 LEU 70 HD22 LEU 70 17.087 7.494 10.616 574 HD23 LEU 70 HD23 LEU 70 16.094 8.639 9.703 575 H GLY 71 H GLY 71 11.518 5.311 9.777 576 HA2 GLY 71 HA2 GLY 71 12.615 2.805 10.913 577 HA3 GLY 71 HA3 GLY 71 11.118 3.603 11.382 578 H VAL 72 H VAL 72 10.284 3.592 8.419 579 HA VAL 72 HA VAL 72 8.836 1.049 8.585 580 HB VAL 72 HB VAL 72 8.735 3.306 6.495 581 HG11 VAL 72 HG11 VAL 72 7.874 1.146 5.607 582 HG12 VAL 72 HG12 VAL 72 6.869 0.933 7.055 583 HG13 VAL 72 HG13 VAL 72 6.546 2.255 5.920 584 HG21 VAL 72 HG21 VAL 72 6.982 2.715 8.923 585 HG22 VAL 72 HG22 VAL 72 8.062 4.112 8.702 586 HG23 VAL 72 HG23 VAL 72 6.641 3.930 7.667 587 H ILE 73 H ILE 73 11.382 2.561 6.656 588 HA ILE 73 HA ILE 73 11.770 0.525 4.725 589 HB ILE 73 HB ILE 73 13.693 2.464 6.076 590 HG12 ILE 73 HG12 ILE 73 12.219 3.753 4.798 591 HG13 ILE 73 HG13 ILE 73 13.588 3.537 3.740 592 HG21 ILE 73 HG21 ILE 73 15.304 2.121 4.304 593 HG22 ILE 73 HG22 ILE 73 15.085 0.642 5.230 594 HG23 ILE 73 HG23 ILE 73 14.329 0.786 3.632 595 HD11 ILE 73 HD11 ILE 73 11.615 3.288 2.431 596 HD12 ILE 73 HD12 ILE 73 12.268 1.645 2.612 597 HD13 ILE 73 HD13 ILE 73 10.869 2.183 3.575 598 H VAL 74 H VAL 74 13.273 0.720 8.007 599 HA VAL 74 HA VAL 74 14.604 -1.764 7.714 600 HB VAL 74 HB VAL 74 13.599 -0.177 10.132 601 HG11 VAL 74 HG11 VAL 74 15.016 -1.606 11.596 602 HG12 VAL 74 HG12 VAL 74 13.632 -2.485 10.929 603 HG13 VAL 74 HG13 VAL 74 15.256 -2.736 10.240 604 HG21 VAL 74 HG21 VAL 74 15.458 0.802 8.836 605 HG22 VAL 74 HG22 VAL 74 16.005 0.304 10.438 606 HG23 VAL 74 HG23 VAL 74 16.400 -0.692 9.025 607 H ASN 75 H ASN 75 11.228 -1.056 8.916 608 HA ASN 75 HA ASN 75 10.548 -3.566 9.766 609 HB2 ASN 75 HB2 ASN 75 9.283 -1.169 9.412 610 HB3 ASN 75 HB3 ASN 75 8.681 -1.958 7.974 611 HD21 ASN 75 HD21 ASN 75 8.294 -1.549 11.313 612 HD22 ASN 75 HD22 ASN 75 7.146 -2.832 11.575 613 H ILE 76 H ILE 76 10.504 -2.345 6.383 614 HA ILE 76 HA ILE 76 9.420 -4.738 5.219 615 HB ILE 76 HB ILE 76 11.024 -2.417 4.058 616 HG12 ILE 76 HG12 ILE 76 8.066 -3.119 3.751 617 HG13 ILE 76 HG13 ILE 76 8.632 -1.909 4.882 618 HG21 ILE 76 HG21 ILE 76 10.330 -3.292 1.797 619 HG22 ILE 76 HG22 ILE 76 11.410 -4.383 2.632 620 HG23 ILE 76 HG23 ILE 76 9.672 -4.737 2.592 621 HD11 ILE 76 HD11 ILE 76 8.928 -1.653 1.898 622 HD12 ILE 76 HD12 ILE 76 7.773 -0.849 2.962 623 HD13 ILE 76 HD13 ILE 76 9.519 -0.518 3.145 624 H LEU 77 H LEU 77 12.723 -3.839 6.227 625 HA LEU 77 HA LEU 77 14.042 -5.963 4.739 626 HB2 LEU 77 HB2 LEU 77 15.229 -3.913 5.464 627 HB3 LEU 77 HB3 LEU 77 14.951 -4.299 7.130 628 HG LEU 77 HG LEU 77 17.233 -4.692 6.147 629 HD11 LEU 77 HD11 LEU 77 16.494 -5.453 8.387 630 HD12 LEU 77 HD12 LEU 77 16.137 -7.050 7.679 631 HD13 LEU 77 HD13 LEU 77 17.792 -6.400 7.647 632 HD21 LEU 77 HD21 LEU 77 17.766 -6.859 5.186 633 HD22 LEU 77 HD22 LEU 77 16.053 -7.280 5.079 634 HD23 LEU 77 HD23 LEU 77 16.715 -5.927 4.129 635 H LYS 78 H LYS 78 12.720 -5.555 8.028 636 HA LYS 78 HA LYS 78 13.600 -8.078 9.028 637 HB2 LYS 78 HB2 LYS 78 11.121 -6.481 9.846 638 HB3 LYS 78 HB3 LYS 78 11.860 -7.814 10.736 639 HG2 LYS 78 HG2 LYS 78 14.054 -6.443 10.614 640 HG3 LYS 78 HG3 LYS 78 13.047 -5.075 10.155 641 HD2 LYS 78 HD2 LYS 78 11.940 -5.054 12.262 642 HD3 LYS 78 HD3 LYS 78 12.475 -6.713 12.655 643 HE2 LYS 78 HE2 LYS 78 14.883 -5.772 12.494 644 HE3 LYS 78 HE3 LYS 78 14.127 -4.167 12.577 645 HZ1 LYS 78 HZ1 LYS 78 14.816 -5.085 14.772 646 HZ2 LYS 78 HZ2 LYS 78 13.182 -4.820 14.698 647 HZ3 LYS 78 HZ3 LYS 78 13.799 -6.333 14.589 648 H SER 79 H SER 79 10.500 -7.227 7.411 649 HA SER 79 HA SER 79 9.401 -9.820 7.392 650 HB2 SER 79 HB2 SER 79 9.236 -7.463 5.484 651 HB3 SER 79 HB3 SER 79 8.293 -8.948 5.228 652 HG SER 79 HG SER 79 7.017 -7.750 6.406 653 H ILE 80 H ILE 80 11.543 -8.330 4.926 654 HA ILE 80 HA ILE 80 11.553 -10.638 3.279 655 HB ILE 80 HB ILE 80 13.335 -8.186 3.556 656 HG12 ILE 80 HG12 ILE 80 11.319 -9.149 1.477 657 HG13 ILE 80 HG13 ILE 80 10.955 -8.001 2.772 658 HG21 ILE 80 HG21 ILE 80 13.563 -10.149 1.246 659 HG22 ILE 80 HG22 ILE 80 14.471 -8.662 1.495 660 HG23 ILE 80 HG23 ILE 80 14.762 -10.016 2.568 661 HD11 ILE 80 HD11 ILE 80 12.696 -6.474 1.843 662 HD12 ILE 80 HD12 ILE 80 12.819 -7.606 0.450 663 HD13 ILE 80 HD13 ILE 80 11.292 -6.755 0.784 664 H SER 81 H SER 81 13.766 -9.620 5.852 665 HA SER 81 HA SER 81 15.743 -11.582 5.754 666 HB2 SER 81 HB2 SER 81 15.919 -9.661 7.129 667 HB3 SER 81 HB3 SER 81 14.386 -9.965 7.913 668 HG SER 81 HG SER 81 15.370 -10.855 9.379 669 H SER 82 H SER 82 12.646 -11.699 7.665 670 HA SER 82 HA SER 82 12.891 -14.430 8.340 671 HB2 SER 82 HB2 SER 82 10.538 -12.504 8.184 672 HB3 SER 82 HB3 SER 82 10.471 -14.090 8.986 673 HG SER 82 HG SER 82 12.422 -13.312 10.185 674 H SER 83 H SER 83 11.295 -12.957 5.468 675 HA SER 83 HA SER 83 10.043 -15.372 4.553 676 HB2 SER 83 HB2 SER 83 11.043 -12.806 3.286 677 HB3 SER 83 HB3 SER 83 10.535 -14.139 2.266 678 HG SER 83 HG SER 83 8.513 -14.133 3.458 679 H GLY 84 H GLY 84 13.407 -14.446 4.577 680 HA2 GLY 84 HA2 GLY 84 15.167 -15.917 3.824 681 HA3 GLY 84 HA3 GLY 84 13.975 -16.701 2.750 682 H GLY 85 H GLY 85 13.755 -13.207 2.536 683 HA2 GLY 85 HA2 GLY 85 14.903 -13.412 -0.146 684 HA3 GLY 85 HA3 GLY 85 13.923 -12.129 0.564 685 H PHE 86 H PHE 86 15.665 -10.995 -0.554 686 HA PHE 86 HA PHE 86 17.639 -10.037 1.428 687 HB2 PHE 86 HB2 PHE 86 18.206 -11.135 -1.282 688 HB3 PHE 86 HB3 PHE 86 18.876 -9.553 -1.006 689 HD1 PHE 86 HD1 PHE 86 18.737 -13.044 0.307 690 HD2 PHE 86 HD2 PHE 86 21.023 -9.333 0.377 691 HE1 PHE 86 HE1 PHE 86 20.614 -14.171 1.463 692 HE2 PHE 86 HE2 PHE 86 22.742 -10.444 1.662 693 HZ PHE 86 HZ PHE 86 22.600 -12.877 2.174 694 H PHE 87 H PHE 87 17.900 -7.712 1.196 695 HA PHE 87 HA PHE 87 16.343 -6.330 -0.840 696 HB2 PHE 87 HB2 PHE 87 14.658 -6.322 0.749 697 HB3 PHE 87 HB3 PHE 87 15.750 -6.246 2.111 698 HD1 PHE 87 HD1 PHE 87 15.469 -3.840 -0.857 699 HD2 PHE 87 HD2 PHE 87 15.029 -4.472 3.379 700 HE1 PHE 87 HE1 PHE 87 14.888 -1.494 -0.559 701 HE2 PHE 87 HE2 PHE 87 14.508 -2.083 3.723 702 HZ PHE 87 HZ PHE 87 14.424 -0.564 1.710 703 H ALA 88 H ALA 88 17.290 -4.274 -1.255 704 HA ALA 88 HA ALA 88 19.471 -3.431 0.435 705 HB1 ALA 88 HB1 ALA 88 21.159 -3.544 -1.188 706 HB2 ALA 88 HB2 ALA 88 20.452 -5.164 -1.131 707 HB3 ALA 88 HB3 ALA 88 20.035 -4.064 -2.476 708 H LEU 89 H LEU 89 20.375 -1.408 -0.263 709 HA LEU 89 HA LEU 89 18.314 0.294 -1.608 710 HB2 LEU 89 HB2 LEU 89 20.683 1.196 0.041 711 HB3 LEU 89 HB3 LEU 89 19.316 2.176 -0.506 712 HG LEU 89 HG LEU 89 19.330 0.025 1.642 713 HD11 LEU 89 HD11 LEU 89 18.360 1.790 3.062 714 HD12 LEU 89 HD12 LEU 89 19.891 2.369 2.391 715 HD13 LEU 89 HD13 LEU 89 18.361 2.917 1.678 716 HD21 LEU 89 HD21 LEU 89 17.420 -0.310 0.208 717 HD22 LEU 89 HD22 LEU 89 16.880 0.422 1.742 718 HD23 LEU 89 HD23 LEU 89 17.063 1.425 0.261 719 H VAL 90 H VAL 90 19.255 2.154 -2.942 720 HA VAL 90 HA VAL 90 21.662 1.447 -4.374 721 HB VAL 90 HB VAL 90 20.506 0.254 -5.819 722 HG11 VAL 90 HG11 VAL 90 19.065 -0.672 -4.840 723 HG12 VAL 90 HG12 VAL 90 18.058 0.717 -4.672 724 HG13 VAL 90 HG13 VAL 90 18.227 -0.086 -6.258 725 HG21 VAL 90 HG21 VAL 90 21.239 1.923 -7.179 726 HG22 VAL 90 HG22 VAL 90 19.836 1.088 -7.821 727 HG23 VAL 90 HG23 VAL 90 19.657 2.706 -7.082 728 H SER 91 H SER 91 22.545 3.144 -5.626 729 HA SER 91 HA SER 91 23.176 5.258 -5.930 730 HB2 SER 91 HB2 SER 91 21.415 4.801 -7.670 731 HB3 SER 91 HB3 SER 91 20.266 5.706 -6.680 732 HG SER 91 HG SER 91 21.541 7.538 -6.962 733 HA PRO 92 HA PRO 92 21.404 6.795 -1.894 734 HB2 PRO 92 HB2 PRO 92 23.747 6.742 -0.405 735 HB3 PRO 92 HB3 PRO 92 22.541 5.441 -0.503 736 HG2 PRO 92 HG2 PRO 92 25.230 5.660 -1.838 737 HG3 PRO 92 HG3 PRO 92 24.344 4.177 -1.369 738 HD2 PRO 92 HD2 PRO 92 24.512 5.303 -3.943 739 HD3 PRO 92 HD3 PRO 92 23.427 3.993 -3.380 740 H ASN 93 H ASN 93 22.533 8.690 -0.556 741 HA ASN 93 HA ASN 93 23.995 10.494 -2.346 742 HB2 ASN 93 HB2 ASN 93 21.632 11.444 -0.651 743 HB3 ASN 93 HB3 ASN 93 22.710 12.439 -1.605 744 HD21 ASN 93 HD21 ASN 93 20.984 9.537 -2.382 745 HD22 ASN 93 HD22 ASN 93 20.004 10.107 -3.737 746 H GLU 94 H GLU 94 24.890 12.136 -1.004 747 HA GLU 94 HA GLU 94 26.307 11.225 1.328 748 HB2 GLU 94 HB2 GLU 94 27.201 13.014 -0.036 749 HB3 GLU 94 HB3 GLU 94 25.713 13.934 0.112 750 HG2 GLU 94 HG2 GLU 94 26.887 15.140 1.535 751 HG3 GLU 94 HG3 GLU 94 26.343 13.991 2.702 752 H LYS 95 H LYS 95 23.292 13.032 0.933 753 HA LYS 95 HA LYS 95 22.814 13.882 3.620 754 HB2 LYS 95 HB2 LYS 95 21.871 14.575 1.236 755 HB3 LYS 95 HB3 LYS 95 20.590 13.477 1.716 756 HG2 LYS 95 HG2 LYS 95 21.494 15.428 3.853 757 HG3 LYS 95 HG3 LYS 95 20.892 16.161 2.379 758 HD2 LYS 95 HD2 LYS 95 19.023 16.007 3.743 759 HD3 LYS 95 HD3 LYS 95 18.946 14.777 2.479 760 HE2 LYS 95 HE2 LYS 95 18.018 14.003 4.608 761 HE3 LYS 95 HE3 LYS 95 19.314 12.981 3.986 762 HZ1 LYS 95 HZ1 LYS 95 19.881 15.054 6.000 763 HZ2 LYS 95 HZ2 LYS 95 19.257 13.587 6.413 764 HZ3 LYS 95 HZ3 LYS 95 20.694 13.646 5.630 765 H VAL 96 H VAL 96 22.462 10.880 1.936 766 HA VAL 96 HA VAL 96 20.731 9.715 4.042 767 HB VAL 96 HB VAL 96 21.488 9.189 1.153 768 HG11 VAL 96 HG11 VAL 96 22.319 7.106 1.893 769 HG12 VAL 96 HG12 VAL 96 20.933 6.850 2.962 770 HG13 VAL 96 HG13 VAL 96 20.725 6.842 1.195 771 HG21 VAL 96 HG21 VAL 96 19.359 10.160 2.136 772 HG22 VAL 96 HG22 VAL 96 19.261 9.008 0.821 773 HG23 VAL 96 HG23 VAL 96 18.912 8.486 2.512 774 H GLU 97 H GLU 97 24.120 9.274 2.648 775 HA GLU 97 HA GLU 97 24.699 7.214 4.559 776 HB2 GLU 97 HB2 GLU 97 26.338 9.224 2.996 777 HB3 GLU 97 HB3 GLU 97 27.093 8.224 4.242 778 HG2 GLU 97 HG2 GLU 97 25.361 6.563 2.532 779 HG3 GLU 97 HG3 GLU 97 26.514 7.476 1.567 780 H ARG 98 H ARG 98 24.614 10.763 4.842 781 HA ARG 98 HA ARG 98 25.933 10.834 7.314 782 HB2 ARG 98 HB2 ARG 98 25.609 13.071 7.285 783 HB3 ARG 98 HB3 ARG 98 25.193 12.709 5.623 784 HG2 ARG 98 HG2 ARG 98 23.441 14.084 6.172 785 HG3 ARG 98 HG3 ARG 98 22.796 12.476 6.499 786 HD2 ARG 98 HD2 ARG 98 22.246 13.235 8.534 787 HD3 ARG 98 HD3 ARG 98 23.934 13.037 8.928 788 HE ARG 98 HE ARG 98 23.807 15.570 7.738 789 HH11 ARG 98 HH11 ARG 98 22.515 14.182 10.701 790 HH12 ARG 98 HH12 ARG 98 21.761 15.622 11.272 791 HH21 ARG 98 HH21 ARG 98 23.399 17.574 8.724 792 HH22 ARG 98 HH22 ARG 98 22.464 17.644 10.182 793 H VAL 99 H VAL 99 22.597 9.861 6.628 794 HA VAL 99 HA VAL 99 21.981 10.235 9.514 795 HB VAL 99 HB VAL 99 20.565 11.320 7.564 796 HG11 VAL 99 HG11 VAL 99 20.460 9.624 6.061 797 HG12 VAL 99 HG12 VAL 99 19.439 8.618 7.159 798 HG13 VAL 99 HG13 VAL 99 18.861 10.170 6.508 799 HG21 VAL 99 HG21 VAL 99 19.738 10.967 9.996 800 HG22 VAL 99 HG22 VAL 99 18.434 10.923 8.792 801 HG23 VAL 99 HG23 VAL 99 19.050 9.404 9.458 802 H LEU 100 H LEU 100 22.064 8.040 6.769 803 HA LEU 100 HA LEU 100 21.147 5.766 8.151 804 HB2 LEU 100 HB2 LEU 100 22.527 6.171 5.417 805 HB3 LEU 100 HB3 LEU 100 22.316 4.613 6.116 806 HG LEU 100 HG LEU 100 19.962 5.410 6.599 807 HD11 LEU 100 HD11 LEU 100 19.242 6.507 4.226 808 HD12 LEU 100 HD12 LEU 100 18.692 6.571 5.917 809 HD13 LEU 100 HD13 LEU 100 20.130 7.520 5.391 810 HD21 LEU 100 HD21 LEU 100 20.547 4.397 3.804 811 HD22 LEU 100 HD22 LEU 100 20.648 3.373 5.245 812 HD23 LEU 100 HD23 LEU 100 19.087 4.065 4.783 813 H SER 101 H SER 101 24.170 7.367 8.478 814 HA SER 101 HA SER 101 25.276 4.684 9.409 815 HB2 SER 101 HB2 SER 101 26.485 7.119 8.354 816 HB3 SER 101 HB3 SER 101 27.121 6.727 9.940 817 HG SER 101 HG SER 101 26.778 4.687 7.943 818 H LEU 102 H LEU 102 24.325 7.936 10.442 819 HA LEU 102 HA LEU 102 25.028 7.763 13.136 820 HB2 LEU 102 HB2 LEU 102 22.986 9.405 11.558 821 HB3 LEU 102 HB3 LEU 102 23.278 9.600 13.268 822 HG LEU 102 HG LEU 102 24.414 11.162 11.586 823 HD11 LEU 102 HD11 LEU 102 26.034 11.680 13.332 824 HD12 LEU 102 HD12 LEU 102 24.460 11.328 14.046 825 HD13 LEU 102 HD13 LEU 102 25.712 10.072 14.090 826 HD21 LEU 102 HD21 LEU 102 26.420 8.998 12.055 827 HD22 LEU 102 HD22 LEU 102 25.622 9.395 10.507 828 HD23 LEU 102 HD23 LEU 102 26.718 10.575 11.246 829 H THR 103 H THR 103 21.963 6.820 11.539 830 HA THR 103 HA THR 103 20.834 6.138 14.199 831 HB THR 103 HB THR 103 19.422 7.338 12.635 832 HG1 THR 103 HG1 THR 103 18.892 4.734 13.425 833 HG21 THR 103 HG21 THR 103 19.458 6.936 10.435 834 HG22 THR 103 HG22 THR 103 20.342 5.416 10.630 835 HG23 THR 103 HG23 THR 103 18.578 5.436 10.740 836 H ASN 104 H ASN 104 22.992 4.581 12.206 837 HA ASN 104 HA ASN 104 23.461 2.467 11.553 838 HB2 ASN 104 HB2 ASN 104 21.765 1.505 13.850 839 HB3 ASN 104 HB3 ASN 104 22.848 0.600 12.814 840 HD21 ASN 104 HD21 ASN 104 22.772 3.088 15.505 841 HD22 ASN 104 HD22 ASN 104 24.486 3.017 15.750 842 H LEU 105 H LEU 105 22.331 3.039 9.592 843 HA LEU 105 HA LEU 105 19.862 1.504 8.970 844 HB2 LEU 105 HB2 LEU 105 19.913 4.109 8.844 845 HB3 LEU 105 HB3 LEU 105 20.580 3.641 7.337 846 HG LEU 105 HG LEU 105 18.218 3.911 7.023 847 HD11 LEU 105 HD11 LEU 105 17.342 1.793 6.301 848 HD12 LEU 105 HD12 LEU 105 19.076 1.803 5.924 849 HD13 LEU 105 HD13 LEU 105 18.476 0.890 7.321 850 HD21 LEU 105 HD21 LEU 105 16.538 2.872 8.429 851 HD22 LEU 105 HD22 LEU 105 17.804 2.115 9.429 852 HD23 LEU 105 HD23 LEU 105 17.630 3.870 9.386 853 H ASP 106 H ASP 106 22.833 2.937 7.480 854 HA ASP 106 HA ASP 106 22.801 1.155 5.248 855 HB2 ASP 106 HB2 ASP 106 24.589 2.292 4.470 856 HB3 ASP 106 HB3 ASP 106 24.044 3.502 5.594 857 H ARG 107 H ARG 107 23.899 0.751 8.525 858 HA ARG 107 HA ARG 107 25.703 -1.448 7.821 859 HB2 ARG 107 HB2 ARG 107 25.953 -1.729 10.074 860 HB3 ARG 107 HB3 ARG 107 26.307 -0.037 9.687 861 HG2 ARG 107 HG2 ARG 107 24.327 0.623 10.825 862 HG3 ARG 107 HG3 ARG 107 23.632 -0.991 10.628 863 HD2 ARG 107 HD2 ARG 107 25.923 -0.229 12.411 864 HD3 ARG 107 HD3 ARG 107 24.323 -0.620 12.995 865 HE ARG 107 HE ARG 107 24.638 -2.934 12.042 866 HH11 ARG 107 HH11 ARG 107 27.264 -1.165 13.562 867 HH12 ARG 107 HH12 ARG 107 28.535 -2.213 13.044 868 HH21 ARG 107 HH21 ARG 107 26.225 -4.589 11.616 869 HH22 ARG 107 HH22 ARG 107 27.833 -4.380 12.271 870 H ILE 108 H ILE 108 22.425 -1.220 8.070 871 HA ILE 108 HA ILE 108 21.923 -3.757 9.462 872 HB ILE 108 HB ILE 108 19.924 -1.753 8.346 873 HG12 ILE 108 HG12 ILE 108 21.345 -0.519 9.910 874 HG13 ILE 108 HG13 ILE 108 19.697 -0.674 10.408 875 HG21 ILE 108 HG21 ILE 108 18.914 -3.889 8.852 876 HG22 ILE 108 HG22 ILE 108 19.639 -3.904 10.466 877 HG23 ILE 108 HG23 ILE 108 18.392 -2.693 10.048 878 HD11 ILE 108 HD11 ILE 108 22.015 -2.331 11.471 879 HD12 ILE 108 HD12 ILE 108 21.292 -0.945 12.280 880 HD13 ILE 108 HD13 ILE 108 20.342 -2.425 12.066 881 H VAL 109 H VAL 109 21.706 -1.971 6.356 882 HA VAL 109 HA VAL 109 21.042 -4.473 5.082 883 HB VAL 109 HB VAL 109 19.937 -1.924 3.885 884 HG11 VAL 109 HG11 VAL 109 19.117 -4.847 4.304 885 HG12 VAL 109 HG12 VAL 109 17.947 -3.661 3.716 886 HG13 VAL 109 HG13 VAL 109 19.428 -3.942 2.791 887 HG21 VAL 109 HG21 VAL 109 19.272 -1.381 6.134 888 HG22 VAL 109 HG22 VAL 109 17.858 -1.988 5.278 889 HG23 VAL 109 HG23 VAL 109 18.699 -3.037 6.443 890 H LYS 110 H LYS 110 21.651 -4.738 2.883 891 HA LYS 110 HA LYS 110 24.104 -3.580 2.021 892 HB2 LYS 110 HB2 LYS 110 21.889 -5.178 0.752 893 HB3 LYS 110 HB3 LYS 110 23.182 -4.521 -0.243 894 HG2 LYS 110 HG2 LYS 110 24.104 -5.921 2.219 895 HG3 LYS 110 HG3 LYS 110 23.279 -6.935 1.031 896 HD2 LYS 110 HD2 LYS 110 25.612 -7.042 0.624 897 HD3 LYS 110 HD3 LYS 110 24.820 -6.268 -0.720 898 HE2 LYS 110 HE2 LYS 110 25.509 -4.006 0.099 899 HE3 LYS 110 HE3 LYS 110 26.377 -4.767 1.432 900 HZ1 LYS 110 HZ1 LYS 110 27.014 -5.151 -1.448 901 HZ2 LYS 110 HZ2 LYS 110 27.808 -4.172 -0.402 902 HZ3 LYS 110 HZ3 LYS 110 27.827 -5.807 -0.191 903 H ILE 111 H ILE 111 24.469 -2.239 0.249 904 HA ILE 111 HA ILE 111 22.356 -0.437 -0.643 905 HB ILE 111 HB ILE 111 23.614 0.195 1.554 906 HG12 ILE 111 HG12 ILE 111 24.024 2.678 0.231 907 HG13 ILE 111 HG13 ILE 111 22.603 1.937 -0.471 908 HG21 ILE 111 HG21 ILE 111 25.765 1.383 1.284 909 HG22 ILE 111 HG22 ILE 111 25.896 -0.282 0.696 910 HG23 ILE 111 HG23 ILE 111 25.720 1.044 -0.469 911 HD11 ILE 111 HD11 ILE 111 21.859 1.472 2.007 912 HD12 ILE 111 HD12 ILE 111 23.215 2.505 2.479 913 HD13 ILE 111 HD13 ILE 111 21.907 3.194 1.514 914 H TYR 112 H TYR 112 22.908 0.378 -2.724 915 HA TYR 112 HA TYR 112 25.253 -0.812 -4.084 916 HB2 TYR 112 HB2 TYR 112 22.310 -0.989 -4.816 917 HB3 TYR 112 HB3 TYR 112 23.585 -1.261 -5.973 918 HD1 TYR 112 HD1 TYR 112 25.206 -2.993 -5.773 919 HD2 TYR 112 HD2 TYR 112 21.933 -2.649 -2.971 920 HE1 TYR 112 HE1 TYR 112 25.710 -5.267 -5.019 921 HE2 TYR 112 HE2 TYR 112 22.404 -5.105 -2.307 922 HH TYR 112 HH TYR 112 25.373 -6.673 -3.238 923 H ASP 113 H ASP 113 25.617 -0.020 -6.304 924 HA ASP 113 HA ASP 113 25.456 2.907 -6.391 925 HB2 ASP 113 HB2 ASP 113 26.974 0.712 -7.778 926 HB3 ASP 113 HB3 ASP 113 26.810 2.257 -8.591 927 H THR 114 H THR 114 24.537 0.115 -8.498 928 HA THR 114 HA THR 114 22.459 1.823 -9.760 929 HB THR 114 HB THR 114 22.887 0.753 -11.881 930 HG1 THR 114 HG1 THR 114 25.320 -0.315 -11.256 931 HG21 THR 114 HG21 THR 114 24.115 2.811 -11.442 932 HG22 THR 114 HG22 THR 114 25.470 1.888 -10.742 933 HG23 THR 114 HG23 THR 114 25.064 1.722 -12.467 934 H ILE 115 H ILE 115 20.882 0.249 -11.023 935 HA ILE 115 HA ILE 115 19.885 -1.720 -9.146 936 HB ILE 115 HB ILE 115 19.199 -0.789 -11.952 937 HG12 ILE 115 HG12 ILE 115 18.196 0.499 -10.181 938 HG13 ILE 115 HG13 ILE 115 16.942 -0.469 -10.954 939 HG21 ILE 115 HG21 ILE 115 18.957 -3.148 -12.280 940 HG22 ILE 115 HG22 ILE 115 18.172 -3.375 -10.712 941 HG23 ILE 115 HG23 ILE 115 17.332 -2.506 -12.033 942 HD11 ILE 115 HD11 ILE 115 17.271 -2.166 -9.045 943 HD12 ILE 115 HD12 ILE 115 18.216 -0.915 -8.237 944 HD13 ILE 115 HD13 ILE 115 16.522 -0.622 -8.621 945 H SER 116 H SER 116 21.944 -1.775 -12.124 946 HA SER 116 HA SER 116 21.607 -4.596 -12.235 947 HB2 SER 116 HB2 SER 116 22.096 -3.015 -14.105 948 HB3 SER 116 HB3 SER 116 23.807 -3.021 -13.589 949 HG SER 116 HG SER 116 23.904 -5.178 -14.090 950 H GLU 117 H GLU 117 24.018 -2.472 -10.536 951 HA GLU 117 HA GLU 117 25.748 -4.614 -9.906 952 HB2 GLU 117 HB2 GLU 117 25.693 -1.828 -9.561 953 HB3 GLU 117 HB3 GLU 117 25.532 -2.425 -7.910 954 HG2 GLU 117 HG2 GLU 117 27.510 -3.912 -8.304 955 HG3 GLU 117 HG3 GLU 117 27.605 -3.261 -9.956 956 H ALA 118 H ALA 118 22.510 -3.973 -8.902 957 HA ALA 118 HA ALA 118 22.930 -5.021 -6.153 958 HB1 ALA 118 HB1 ALA 118 20.415 -3.836 -7.336 959 HB2 ALA 118 HB2 ALA 118 20.838 -4.141 -5.625 960 HB3 ALA 118 HB3 ALA 118 21.672 -2.881 -6.539 961 H MET 119 H MET 119 21.066 -5.364 -9.099 962 HA MET 119 HA MET 119 19.323 -7.305 -8.461 963 HB2 MET 119 HB2 MET 119 19.954 -5.881 -10.756 964 HB3 MET 119 HB3 MET 119 20.487 -7.440 -11.248 965 HG2 MET 119 HG2 MET 119 17.811 -7.400 -9.884 966 HG3 MET 119 HG3 MET 119 17.939 -6.413 -11.328 967 HE1 MET 119 HE1 MET 119 19.796 -10.006 -11.033 968 HE2 MET 119 HE2 MET 119 18.378 -10.104 -9.950 969 HE3 MET 119 HE3 MET 119 18.419 -11.023 -11.469 970 H GLU 120 H GLU 120 22.389 -8.036 -10.105 971 HA GLU 120 HA GLU 120 21.969 -10.928 -9.657 972 HB2 GLU 120 HB2 GLU 120 24.018 -11.123 -11.034 973 HB3 GLU 120 HB3 GLU 120 22.754 -10.182 -11.829 974 HG2 GLU 120 HG2 GLU 120 23.898 -8.093 -11.287 975 HG3 GLU 120 HG3 GLU 120 25.092 -8.941 -10.311 976 H GLU 121 H GLU 121 23.507 -8.327 -7.936 977 HA GLU 121 HA GLU 121 25.606 -10.045 -6.799 978 HB2 GLU 121 HB2 GLU 121 26.004 -7.608 -7.017 979 HB3 GLU 121 HB3 GLU 121 24.732 -7.297 -5.831 980 HG2 GLU 121 HG2 GLU 121 25.863 -8.607 -4.151 981 HG3 GLU 121 HG3 GLU 121 27.094 -9.168 -5.292 982 H VAL 122 H VAL 122 22.759 -8.351 -5.522 983 HA VAL 122 HA VAL 122 22.626 -9.350 -2.933 984 HB VAL 122 HB VAL 122 21.225 -7.625 -4.373 985 HG11 VAL 122 HG11 VAL 122 19.286 -9.955 -4.154 986 HG12 VAL 122 HG12 VAL 122 18.864 -8.291 -4.553 987 HG13 VAL 122 HG13 VAL 122 19.910 -9.194 -5.651 988 HG21 VAL 122 HG21 VAL 122 21.392 -7.355 -2.126 989 HG22 VAL 122 HG22 VAL 122 19.647 -7.592 -2.352 990 HG23 VAL 122 HG23 VAL 122 20.688 -8.925 -1.770 991 H ARG 123 H ARG 123 21.736 -11.090 -5.793 992 HA ARG 123 HA ARG 123 20.352 -13.340 -4.768 993 HB2 ARG 123 HB2 ARG 123 22.258 -12.895 -7.113 994 HB3 ARG 123 HB3 ARG 123 21.297 -14.341 -6.969 995 HG2 ARG 123 HG2 ARG 123 19.733 -11.770 -6.765 996 HG3 ARG 123 HG3 ARG 123 20.606 -11.992 -8.273 997 HD2 ARG 123 HD2 ARG 123 18.175 -12.807 -8.162 998 HD3 ARG 123 HD3 ARG 123 19.400 -13.864 -8.861 999 HE ARG 123 HE ARG 123 19.440 -14.523 -6.212 1000 HH11 ARG 123 HH11 ARG 123 16.808 -14.548 -8.646 1001 HH12 ARG 123 HH12 ARG 123 16.203 -16.069 -8.177 1002 HH21 ARG 123 HH21 ARG 123 18.477 -16.531 -5.476 1003 HH22 ARG 123 HH22 ARG 123 16.987 -17.070 -6.153 1004 H ARG 124 H ARG 124 23.778 -12.579 -4.748 1005 HA ARG 124 HA ARG 124 24.406 -14.741 -2.907 1006 HB2 ARG 124 HB2 ARG 124 26.086 -15.804 -4.286 1007 HB3 ARG 124 HB3 ARG 124 24.489 -16.026 -4.965 1008 HG2 ARG 124 HG2 ARG 124 26.163 -13.709 -5.950 1009 HG3 ARG 124 HG3 ARG 124 26.592 -15.340 -6.408 1010 HD2 ARG 124 HD2 ARG 124 23.902 -15.362 -6.994 1011 HD3 ARG 124 HD3 ARG 124 24.305 -13.664 -7.275 1012 HE ARG 124 HE ARG 124 26.035 -15.750 -8.452 1013 HH11 ARG 124 HH11 ARG 124 23.826 -13.040 -9.127 1014 HH12 ARG 124 HH12 ARG 124 23.847 -13.348 -10.846 1015 HH21 ARG 124 HH21 ARG 124 26.404 -15.611 -10.709 1016 HH22 ARG 124 HH22 ARG 124 25.286 -14.743 -11.714 1017 H LYS 125 H LYS 125 24.499 -11.950 -2.630 1018 HA LYS 125 HA LYS 125 26.836 -10.649 -3.223 1019 HB2 LYS 125 HB2 LYS 125 26.167 -9.038 -1.490 1020 HB3 LYS 125 HB3 LYS 125 24.795 -9.595 -2.409 1021 HG2 LYS 125 HG2 LYS 125 23.900 -9.698 -0.327 1022 HG3 LYS 125 HG3 LYS 125 24.473 -11.348 -0.488 1023 HD2 LYS 125 HD2 LYS 125 26.653 -9.916 0.667 1024 HD3 LYS 125 HD3 LYS 125 25.218 -9.229 1.403 1025 HE2 LYS 125 HE2 LYS 125 25.291 -10.923 2.872 1026 HE3 LYS 125 HE3 LYS 125 24.636 -11.927 1.573 1027 HZ1 LYS 125 HZ1 LYS 125 26.619 -12.883 2.592 1028 HZ2 LYS 125 HZ2 LYS 125 26.854 -12.575 0.999 1029 HZ3 LYS 125 HZ3 LYS 125 27.533 -11.590 2.063 Start of MODEL 8 1 H1 MET 1 H1 MET 1 -10.205 6.770 14.453 2 HA MET 1 HA MET 1 -11.505 4.739 14.278 3 HB2 MET 1 HB2 MET 1 -9.673 4.710 15.977 4 HB3 MET 1 HB3 MET 1 -10.820 5.288 17.194 5 HG2 MET 1 HG2 MET 1 -12.244 3.185 16.539 6 HG3 MET 1 HG3 MET 1 -10.792 2.633 15.712 7 HE1 MET 1 HE1 MET 1 -11.472 4.455 19.249 8 HE2 MET 1 HE2 MET 1 -12.701 3.189 19.022 9 HE3 MET 1 HE3 MET 1 -11.461 3.015 20.280 10 H GLY 2 H GLY 2 -13.656 4.338 14.014 11 HA2 GLY 2 HA2 GLY 2 -15.928 4.296 14.433 12 HA3 GLY 2 HA3 GLY 2 -15.654 4.929 16.070 13 H SER 3 H SER 3 -14.853 7.244 16.127 14 HA SER 3 HA SER 3 -16.257 9.077 14.341 15 HB2 SER 3 HB2 SER 3 -15.598 9.563 16.778 16 HB3 SER 3 HB3 SER 3 -13.925 9.715 16.199 17 HG SER 3 HG SER 3 -14.438 11.564 15.168 18 H ASP 4 H ASP 4 -14.889 10.652 13.204 19 HA ASP 4 HA ASP 4 -13.723 11.072 11.257 20 HB2 ASP 4 HB2 ASP 4 -11.553 10.454 13.271 21 HB3 ASP 4 HB3 ASP 4 -11.373 11.372 11.760 22 H LYS 5 H LYS 5 -14.625 9.191 10.208 23 HA LYS 5 HA LYS 5 -12.969 6.758 10.185 24 HB2 LYS 5 HB2 LYS 5 -15.544 7.093 10.632 25 HB3 LYS 5 HB3 LYS 5 -15.705 7.036 8.891 26 HG2 LYS 5 HG2 LYS 5 -14.188 4.826 10.328 27 HG3 LYS 5 HG3 LYS 5 -15.922 4.944 10.535 28 HD2 LYS 5 HD2 LYS 5 -15.730 3.407 8.863 29 HD3 LYS 5 HD3 LYS 5 -16.164 4.872 7.984 30 HE2 LYS 5 HE2 LYS 5 -14.018 5.086 7.037 31 HE3 LYS 5 HE3 LYS 5 -13.239 4.206 8.361 32 HZ1 LYS 5 HZ1 LYS 5 -14.893 2.981 6.244 33 HZ2 LYS 5 HZ2 LYS 5 -13.256 2.889 6.410 34 HZ3 LYS 5 HZ3 LYS 5 -14.213 2.189 7.543 35 H ILE 6 H ILE 6 -14.202 9.135 7.909 36 HA ILE 6 HA ILE 6 -13.964 9.422 5.663 37 HB ILE 6 HB ILE 6 -11.133 9.751 6.653 38 HG12 ILE 6 HG12 ILE 6 -12.602 10.832 8.293 39 HG13 ILE 6 HG13 ILE 6 -11.648 11.980 7.387 40 HG21 ILE 6 HG21 ILE 6 -11.268 10.066 4.286 41 HG22 ILE 6 HG22 ILE 6 -12.698 11.102 4.452 42 HG23 ILE 6 HG23 ILE 6 -11.105 11.640 5.050 43 HD11 ILE 6 HD11 ILE 6 -14.588 11.387 6.838 44 HD12 ILE 6 HD12 ILE 6 -13.954 12.769 7.750 45 HD13 ILE 6 HD13 ILE 6 -13.595 12.617 6.026 46 H HIS 7 H HIS 7 -14.361 7.760 4.313 47 HA HIS 7 HA HIS 7 -12.665 5.479 3.906 48 HB2 HIS 7 HB2 HIS 7 -14.085 5.322 1.754 49 HB3 HIS 7 HB3 HIS 7 -14.841 5.090 3.316 50 HD1 HIS 7 HD1 HIS 7 -16.949 6.518 3.791 51 HD2 HIS 7 HD2 HIS 7 -14.613 7.854 0.556 52 HE1 HIS 7 HE1 HIS 7 -18.287 8.370 2.644 53 H HIS 8 H HIS 8 -10.562 5.862 3.348 54 HA HIS 8 HA HIS 8 -9.513 7.816 1.599 55 HB2 HIS 8 HB2 HIS 8 -8.597 4.920 1.852 56 HB3 HIS 8 HB3 HIS 8 -7.645 6.257 1.252 57 HD1 HIS 8 HD1 HIS 8 -5.878 6.984 2.974 58 HD2 HIS 8 HD2 HIS 8 -9.279 5.157 4.647 59 HE1 HIS 8 HE1 HIS 8 -5.356 6.591 5.425 60 H HIS 9 H HIS 9 -9.424 7.908 -0.716 61 HA HIS 9 HA HIS 9 -10.261 5.574 -2.302 62 HB2 HIS 9 HB2 HIS 9 -11.578 8.323 -2.384 63 HB3 HIS 9 HB3 HIS 9 -11.649 7.217 -3.738 64 HD1 HIS 9 HD1 HIS 9 -14.302 8.122 -2.402 65 HD2 HIS 9 HD2 HIS 9 -12.201 4.554 -1.637 66 HE1 HIS 9 HE1 HIS 9 -15.963 6.482 -1.375 67 H HIS 10 H HIS 10 -9.976 6.344 -4.746 68 HA HIS 10 HA HIS 10 -8.671 7.008 -6.409 69 HB2 HIS 10 HB2 HIS 10 -9.289 9.259 -4.940 70 HB3 HIS 10 HB3 HIS 10 -7.571 9.453 -5.174 71 HD1 HIS 10 HD1 HIS 10 -6.826 9.941 -7.819 72 HD2 HIS 10 HD2 HIS 10 -10.870 9.212 -6.936 73 HE1 HIS 10 HE1 HIS 10 -8.129 10.590 -9.907 74 H HIS 11 H HIS 11 -7.447 5.223 -4.499 75 HA HIS 11 HA HIS 11 -4.656 5.761 -4.168 76 HB2 HIS 11 HB2 HIS 11 -6.339 4.194 -2.919 77 HB3 HIS 11 HB3 HIS 11 -6.035 3.044 -4.208 78 HD1 HIS 11 HD1 HIS 11 -3.495 1.931 -4.187 79 HD2 HIS 11 HD2 HIS 11 -4.578 4.551 -1.053 80 HE1 HIS 11 HE1 HIS 11 -1.833 1.543 -2.308 81 H HIS 12 H HIS 12 -3.798 6.361 -6.245 82 HA HIS 12 HA HIS 12 -3.273 4.172 -8.133 83 HB2 HIS 12 HB2 HIS 12 -4.746 6.710 -8.938 84 HB3 HIS 12 HB3 HIS 12 -3.928 5.659 -10.082 85 HD1 HIS 12 HD1 HIS 12 -5.319 3.513 -10.902 86 HD2 HIS 12 HD2 HIS 12 -7.003 5.844 -7.818 87 HE1 HIS 12 HE1 HIS 12 -7.747 2.784 -10.692 88 H MET 13 H MET 13 -1.118 4.575 -7.197 89 HA MET 13 HA MET 13 0.401 6.304 -8.961 90 HB2 MET 13 HB2 MET 13 0.106 7.018 -6.044 91 HB3 MET 13 HB3 MET 13 1.744 6.980 -6.679 92 HG2 MET 13 HG2 MET 13 1.100 8.499 -8.518 93 HG3 MET 13 HG3 MET 13 -0.508 8.654 -7.838 94 HE1 MET 13 HE1 MET 13 -1.136 10.171 -5.738 95 HE2 MET 13 HE2 MET 13 -0.216 8.979 -4.781 96 HE3 MET 13 HE3 MET 13 0.083 10.712 -4.571 97 H PHE 14 H PHE 14 2.284 5.053 -9.518 98 HA PHE 14 HA PHE 14 2.974 2.846 -7.738 99 HB2 PHE 14 HB2 PHE 14 3.940 1.977 -9.895 100 HB3 PHE 14 HB3 PHE 14 2.237 1.764 -9.560 101 HD1 PHE 14 HD1 PHE 14 0.536 2.925 -10.915 102 HD2 PHE 14 HD2 PHE 14 4.742 3.220 -11.833 103 HE1 PHE 14 HE1 PHE 14 -0.012 3.613 -13.224 104 HE2 PHE 14 HE2 PHE 14 4.190 3.934 -14.131 105 HZ PHE 14 HZ PHE 14 1.807 4.092 -14.849 106 HA PRO 15 HA PRO 15 6.827 5.363 -7.720 107 HB2 PRO 15 HB2 PRO 15 7.331 5.284 -5.071 108 HB3 PRO 15 HB3 PRO 15 6.152 6.409 -5.766 109 HG2 PRO 15 HG2 PRO 15 5.542 3.730 -4.491 110 HG3 PRO 15 HG3 PRO 15 4.791 5.323 -4.130 111 HD2 PRO 15 HD2 PRO 15 3.665 3.544 -5.853 112 HD3 PRO 15 HD3 PRO 15 3.568 5.310 -6.122 113 H TYR 16 H TYR 16 6.612 2.883 -8.800 114 HA TYR 16 HA TYR 16 8.949 1.583 -7.844 115 HB2 TYR 16 HB2 TYR 16 7.995 -0.633 -7.347 116 HB3 TYR 16 HB3 TYR 16 7.337 0.560 -6.259 117 HD1 TYR 16 HD1 TYR 16 5.019 1.418 -6.585 118 HD2 TYR 16 HD2 TYR 16 6.581 -1.902 -8.848 119 HE1 TYR 16 HE1 TYR 16 2.689 0.643 -7.052 120 HE2 TYR 16 HE2 TYR 16 4.266 -2.648 -9.357 121 HH TYR 16 HH TYR 16 1.600 -1.588 -7.618 122 H LYS 17 H LYS 17 9.458 -0.368 -9.175 123 HA LYS 17 HA LYS 17 7.951 -0.701 -11.660 124 HB2 LYS 17 HB2 LYS 17 9.778 -0.614 -13.112 125 HB3 LYS 17 HB3 LYS 17 9.906 0.856 -12.148 126 HG2 LYS 17 HG2 LYS 17 11.821 0.210 -11.097 127 HG3 LYS 17 HG3 LYS 17 11.525 -1.539 -11.346 128 HD2 LYS 17 HD2 LYS 17 12.344 -1.631 -13.382 129 HD3 LYS 17 HD3 LYS 17 11.876 0.053 -13.795 130 HE2 LYS 17 HE2 LYS 17 13.742 0.859 -12.296 131 HE3 LYS 17 HE3 LYS 17 14.268 -0.833 -12.156 132 HZ1 LYS 17 HZ1 LYS 17 14.370 -0.799 -14.655 133 HZ2 LYS 17 HZ2 LYS 17 14.231 0.834 -14.601 134 HZ3 LYS 17 HZ3 LYS 17 15.510 0.086 -13.892 135 H ILE 18 H ILE 18 8.729 -2.771 -12.753 136 HA ILE 18 HA ILE 18 9.520 -4.832 -10.740 137 HB ILE 18 HB ILE 18 7.499 -4.939 -13.024 138 HG12 ILE 18 HG12 ILE 18 6.823 -5.431 -10.101 139 HG13 ILE 18 HG13 ILE 18 6.819 -3.794 -10.747 140 HG21 ILE 18 HG21 ILE 18 6.997 -7.267 -12.232 141 HG22 ILE 18 HG22 ILE 18 8.644 -7.119 -12.813 142 HG23 ILE 18 HG23 ILE 18 8.330 -7.145 -11.065 143 HD11 ILE 18 HD11 ILE 18 5.144 -6.050 -11.888 144 HD12 ILE 18 HD12 ILE 18 4.577 -4.742 -10.832 145 HD13 ILE 18 HD13 ILE 18 5.186 -4.373 -12.458 146 H VAL 19 H VAL 19 11.008 -6.203 -11.240 147 HA VAL 19 HA VAL 19 12.291 -6.210 -13.875 148 HB VAL 19 HB VAL 19 13.493 -5.886 -11.073 149 HG11 VAL 19 HG11 VAL 19 15.645 -5.598 -12.202 150 HG12 VAL 19 HG12 VAL 19 15.008 -7.235 -12.406 151 HG13 VAL 19 HG13 VAL 19 14.891 -6.064 -13.750 152 HG21 VAL 19 HG21 VAL 19 13.259 -4.051 -13.478 153 HG22 VAL 19 HG22 VAL 19 12.617 -3.753 -11.875 154 HG23 VAL 19 HG23 VAL 19 14.365 -3.707 -12.139 155 H ASP 20 H ASP 20 13.614 -8.156 -14.053 156 HA ASP 20 HA ASP 20 12.429 -10.242 -14.685 157 HB2 ASP 20 HB2 ASP 20 14.992 -10.307 -13.095 158 HB3 ASP 20 HB3 ASP 20 14.364 -11.752 -13.884 159 H ASP 21 H ASP 21 13.668 -10.471 -11.377 160 HA ASP 21 HA ASP 21 11.054 -11.028 -10.370 161 HB2 ASP 21 HB2 ASP 21 11.649 -13.028 -9.015 162 HB3 ASP 21 HB3 ASP 21 11.482 -13.315 -10.729 163 H VAL 22 H VAL 22 12.257 -8.770 -10.156 164 HA VAL 22 HA VAL 22 12.834 -8.635 -7.297 165 HB VAL 22 HB VAL 22 14.692 -7.078 -9.196 166 HG11 VAL 22 HG11 VAL 22 14.256 -7.242 -6.224 167 HG12 VAL 22 HG12 VAL 22 15.887 -7.065 -6.788 168 HG13 VAL 22 HG13 VAL 22 14.665 -5.851 -7.219 169 HG21 VAL 22 HG21 VAL 22 16.475 -8.549 -8.408 170 HG22 VAL 22 HG22 VAL 22 15.303 -9.520 -7.501 171 HG23 VAL 22 HG23 VAL 22 15.271 -9.483 -9.290 172 H VAL 23 H VAL 23 12.187 -6.610 -6.383 173 HA VAL 23 HA VAL 23 10.483 -4.954 -8.181 174 HB VAL 23 HB VAL 23 10.336 -5.220 -5.152 175 HG11 VAL 23 HG11 VAL 23 8.231 -4.348 -7.167 176 HG12 VAL 23 HG12 VAL 23 8.252 -4.193 -5.385 177 HG13 VAL 23 HG13 VAL 23 9.331 -3.222 -6.356 178 HG21 VAL 23 HG21 VAL 23 8.831 -6.817 -7.297 179 HG22 VAL 23 HG22 VAL 23 9.869 -7.477 -6.014 180 HG23 VAL 23 HG23 VAL 23 8.346 -6.716 -5.598 181 H ILE 24 H ILE 24 10.848 -2.734 -8.235 182 HA ILE 24 HA ILE 24 13.128 -1.670 -6.601 183 HB ILE 24 HB ILE 24 12.330 -1.218 -9.489 184 HG12 ILE 24 HG12 ILE 24 14.789 -1.539 -9.888 185 HG13 ILE 24 HG13 ILE 24 14.982 -1.872 -8.159 186 HG21 ILE 24 HG21 ILE 24 14.120 0.580 -9.510 187 HG22 ILE 24 HG22 ILE 24 12.621 0.971 -8.681 188 HG23 ILE 24 HG23 ILE 24 14.056 0.532 -7.732 189 HD11 ILE 24 HD11 ILE 24 14.955 -3.809 -9.881 190 HD12 ILE 24 HD12 ILE 24 14.124 -3.992 -8.331 191 HD13 ILE 24 HD13 ILE 24 13.181 -3.621 -9.786 192 H LEU 25 H LEU 25 12.072 -0.592 -4.989 193 HA LEU 25 HA LEU 25 9.461 0.685 -5.302 194 HB2 LEU 25 HB2 LEU 25 11.612 0.243 -3.181 195 HB3 LEU 25 HB3 LEU 25 10.205 1.270 -2.841 196 HG LEU 25 HG LEU 25 8.635 -0.350 -2.917 197 HD11 LEU 25 HD11 LEU 25 10.451 -2.334 -4.277 198 HD12 LEU 25 HD12 LEU 25 8.827 -2.672 -3.635 199 HD13 LEU 25 HD13 LEU 25 8.995 -1.514 -4.930 200 HD21 LEU 25 HD21 LEU 25 9.579 -0.816 -0.865 201 HD22 LEU 25 HD22 LEU 25 9.734 -2.416 -1.629 202 HD23 LEU 25 HD23 LEU 25 11.124 -1.323 -1.587 203 H MET 26 H MET 26 10.566 1.989 -7.109 204 HA MET 26 HA MET 26 12.608 3.901 -6.639 205 HB2 MET 26 HB2 MET 26 10.774 3.122 -8.811 206 HB3 MET 26 HB3 MET 26 11.093 4.852 -8.789 207 HG2 MET 26 HG2 MET 26 13.401 2.954 -8.460 208 HG3 MET 26 HG3 MET 26 12.720 3.226 -10.071 209 HE1 MET 26 HE1 MET 26 11.948 6.262 -10.254 210 HE2 MET 26 HE2 MET 26 13.490 6.904 -10.832 211 HE3 MET 26 HE3 MET 26 12.906 5.343 -11.434 212 HA PRO 27 HA PRO 27 9.683 6.380 -4.157 213 HB2 PRO 27 HB2 PRO 27 11.477 7.919 -2.814 214 HB3 PRO 27 HB3 PRO 27 11.311 6.172 -2.431 215 HG2 PRO 27 HG2 PRO 27 13.401 7.514 -4.164 216 HG3 PRO 27 HG3 PRO 27 13.644 6.281 -2.897 217 HD2 PRO 27 HD2 PRO 27 13.416 5.690 -5.604 218 HD3 PRO 27 HD3 PRO 27 12.959 4.566 -4.324 219 H ASN 28 H ASN 28 12.442 7.932 -5.949 220 HA ASN 28 HA ASN 28 12.466 10.080 -6.690 221 HB2 ASN 28 HB2 ASN 28 11.776 10.091 -8.844 222 HB3 ASN 28 HB3 ASN 28 11.921 8.375 -8.514 223 HD21 ASN 28 HD21 ASN 28 9.312 8.035 -7.197 224 HD22 ASN 28 HD22 ASN 28 8.077 8.343 -8.374 225 H LYS 29 H LYS 29 11.373 10.557 -4.453 226 HA LYS 29 HA LYS 29 10.495 12.308 -3.336 227 HB2 LYS 29 HB2 LYS 29 9.476 13.366 -6.005 228 HB3 LYS 29 HB3 LYS 29 9.403 14.188 -4.475 229 HG2 LYS 29 HG2 LYS 29 11.225 15.046 -5.746 230 HG3 LYS 29 HG3 LYS 29 11.790 14.301 -4.266 231 HD2 LYS 29 HD2 LYS 29 13.362 13.933 -6.014 232 HD3 LYS 29 HD3 LYS 29 12.688 12.401 -5.558 233 HE2 LYS 29 HE2 LYS 29 12.488 12.044 -7.776 234 HE3 LYS 29 HE3 LYS 29 11.029 13.012 -7.681 235 HZ1 LYS 29 HZ1 LYS 29 12.554 13.741 -9.437 236 HZ2 LYS 29 HZ2 LYS 29 12.396 14.934 -8.323 237 HZ3 LYS 29 HZ3 LYS 29 13.741 14.002 -8.330 238 H GLU 30 H GLU 30 8.955 9.714 -4.005 239 HA GLU 30 HA GLU 30 6.305 10.618 -3.017 240 HB2 GLU 30 HB2 GLU 30 6.959 7.975 -4.359 241 HB3 GLU 30 HB3 GLU 30 5.380 8.686 -4.030 242 HG2 GLU 30 HG2 GLU 30 6.024 10.555 -5.670 243 HG3 GLU 30 HG3 GLU 30 7.500 9.602 -5.973 244 H LEU 31 H LEU 31 7.521 10.784 -0.906 245 HA LEU 31 HA LEU 31 7.574 8.154 0.527 246 HB2 LEU 31 HB2 LEU 31 9.646 10.362 0.607 247 HB3 LEU 31 HB3 LEU 31 9.546 9.113 1.849 248 HG LEU 31 HG LEU 31 9.974 8.530 -1.112 249 HD11 LEU 31 HD11 LEU 31 11.948 8.464 1.184 250 HD12 LEU 31 HD12 LEU 31 12.261 8.083 -0.534 251 HD13 LEU 31 HD13 LEU 31 11.875 9.739 -0.055 252 HD21 LEU 31 HD21 LEU 31 10.082 6.753 1.378 253 HD22 LEU 31 HD22 LEU 31 8.987 6.585 -0.018 254 HD23 LEU 31 HD23 LEU 31 10.710 6.278 -0.214 255 H ASN 32 H ASN 32 5.773 10.418 0.177 256 HA ASN 32 HA ASN 32 5.278 12.167 2.166 257 HB2 ASN 32 HB2 ASN 32 3.056 10.532 0.904 258 HB3 ASN 32 HB3 ASN 32 3.084 12.249 1.240 259 HD21 ASN 32 HD21 ASN 32 2.463 10.769 -1.321 260 HD22 ASN 32 HD22 ASN 32 3.621 11.348 -2.503 261 H ILE 33 H ILE 33 4.206 12.043 4.306 262 HA ILE 33 HA ILE 33 4.551 9.663 5.747 263 HB ILE 33 HB ILE 33 2.775 12.039 6.344 264 HG12 ILE 33 HG12 ILE 33 5.534 11.123 7.255 265 HG13 ILE 33 HG13 ILE 33 5.143 12.537 6.279 266 HG21 ILE 33 HG21 ILE 33 2.612 11.218 8.684 267 HG22 ILE 33 HG22 ILE 33 1.791 10.165 7.560 268 HG23 ILE 33 HG23 ILE 33 3.395 9.702 8.172 269 HD11 ILE 33 HD11 ILE 33 3.848 13.423 8.301 270 HD12 ILE 33 HD12 ILE 33 4.629 12.125 9.236 271 HD13 ILE 33 HD13 ILE 33 5.621 13.358 8.448 272 H GLU 34 H GLU 34 1.468 10.818 4.256 273 HA GLU 34 HA GLU 34 0.103 8.422 5.235 274 HB2 GLU 34 HB2 GLU 34 -0.853 10.624 3.376 275 HB3 GLU 34 HB3 GLU 34 -1.852 9.336 4.075 276 HG2 GLU 34 HG2 GLU 34 -1.088 10.115 6.384 277 HG3 GLU 34 HG3 GLU 34 -0.328 11.472 5.600 278 H ASN 35 H ASN 35 2.285 8.639 2.907 279 HA ASN 35 HA ASN 35 1.282 6.211 1.460 280 HB2 ASN 35 HB2 ASN 35 2.315 7.666 -0.120 281 HB3 ASN 35 HB3 ASN 35 3.688 7.982 0.944 282 HD21 ASN 35 HD21 ASN 35 5.265 7.184 -0.648 283 HD22 ASN 35 HD22 ASN 35 5.367 5.484 -0.959 284 H ALA 36 H ALA 36 4.075 7.505 3.322 285 HA ALA 36 HA ALA 36 5.435 5.193 3.818 286 HB1 ALA 36 HB1 ALA 36 6.498 6.352 5.623 287 HB2 ALA 36 HB2 ALA 36 6.245 7.463 4.253 288 HB3 ALA 36 HB3 ALA 36 5.188 7.553 5.681 289 H HIS 37 H HIS 37 2.582 6.327 5.687 290 HA HIS 37 HA HIS 37 2.865 4.375 7.768 291 HB2 HIS 37 HB2 HIS 37 1.422 6.410 7.896 292 HB3 HIS 37 HB3 HIS 37 0.277 5.642 6.793 293 HD1 HIS 37 HD1 HIS 37 0.892 5.982 10.442 294 HD2 HIS 37 HD2 HIS 37 -0.532 2.984 7.825 295 HE1 HIS 37 HE1 HIS 37 -0.303 4.279 11.876 296 H LEU 38 H LEU 38 0.856 4.225 4.663 297 HA LEU 38 HA LEU 38 0.188 1.474 5.370 298 HB2 LEU 38 HB2 LEU 38 -1.543 1.585 4.079 299 HB3 LEU 38 HB3 LEU 38 -1.348 3.286 4.356 300 HG LEU 38 HG LEU 38 -2.017 3.035 2.203 301 HD11 LEU 38 HD11 LEU 38 -0.153 4.661 2.518 302 HD12 LEU 38 HD12 LEU 38 0.936 3.449 1.792 303 HD13 LEU 38 HD13 LEU 38 -0.401 4.103 0.854 304 HD21 LEU 38 HD21 LEU 38 -1.270 1.569 0.540 305 HD22 LEU 38 HD22 LEU 38 0.232 1.207 1.394 306 HD23 LEU 38 HD23 LEU 38 -1.308 0.578 2.016 307 H PHE 39 H PHE 39 2.660 3.009 3.702 308 HA PHE 39 HA PHE 39 3.667 1.751 1.722 309 HB2 PHE 39 HB2 PHE 39 4.752 3.301 3.482 310 HB3 PHE 39 HB3 PHE 39 5.435 1.831 4.176 311 HD1 PHE 39 HD1 PHE 39 5.373 3.930 1.047 312 HD2 PHE 39 HD2 PHE 39 7.476 1.044 3.439 313 HE1 PHE 39 HE1 PHE 39 7.478 4.527 -0.074 314 HE2 PHE 39 HE2 PHE 39 9.557 1.496 2.163 315 HZ PHE 39 HZ PHE 39 9.570 3.301 0.433 316 H LYS 40 H LYS 40 4.063 0.257 4.981 317 HA LYS 40 HA LYS 40 5.408 -2.052 3.965 318 HB2 LYS 40 HB2 LYS 40 4.802 -1.030 6.534 319 HB3 LYS 40 HB3 LYS 40 3.897 -2.538 6.431 320 HG2 LYS 40 HG2 LYS 40 6.323 -3.383 5.504 321 HG3 LYS 40 HG3 LYS 40 6.827 -2.045 6.564 322 HD2 LYS 40 HD2 LYS 40 5.091 -4.408 7.324 323 HD3 LYS 40 HD3 LYS 40 6.795 -4.207 7.767 324 HE2 LYS 40 HE2 LYS 40 6.296 -2.421 9.262 325 HE3 LYS 40 HE3 LYS 40 4.717 -2.123 8.521 326 HZ1 LYS 40 HZ1 LYS 40 3.978 -4.249 9.373 327 HZ2 LYS 40 HZ2 LYS 40 5.390 -4.490 10.156 328 HZ3 LYS 40 HZ3 LYS 40 4.438 -3.229 10.574 329 H LYS 41 H LYS 41 1.922 -1.493 4.791 330 HA LYS 41 HA LYS 41 1.104 -4.154 4.199 331 HB2 LYS 41 HB2 LYS 41 -0.160 -2.116 5.327 332 HB3 LYS 41 HB3 LYS 41 -0.711 -1.784 3.690 333 HG2 LYS 41 HG2 LYS 41 -1.112 -4.354 5.291 334 HG3 LYS 41 HG3 LYS 41 -2.313 -3.106 4.968 335 HD2 LYS 41 HD2 LYS 41 -2.053 -3.648 2.480 336 HD3 LYS 41 HD3 LYS 41 -1.123 -5.084 2.991 337 HE2 LYS 41 HE2 LYS 41 -2.953 -5.942 4.274 338 HE3 LYS 41 HE3 LYS 41 -3.902 -4.476 4.016 339 HZ1 LYS 41 HZ1 LYS 41 -3.170 -6.483 1.968 340 HZ2 LYS 41 HZ2 LYS 41 -4.647 -6.148 2.546 341 HZ3 LYS 41 HZ3 LYS 41 -3.884 -5.057 1.592 342 H TRP 42 H TRP 42 1.320 -1.236 2.086 343 HA TRP 42 HA TRP 42 0.399 -2.537 -0.297 344 HB2 TRP 42 HB2 TRP 42 0.481 -0.230 -0.499 345 HB3 TRP 42 HB3 TRP 42 2.025 -0.092 0.325 346 HD1 TRP 42 HD1 TRP 42 0.890 -1.612 -3.101 347 HE1 TRP 42 HE1 TRP 42 2.623 -1.094 -4.831 348 HE3 TRP 42 HE3 TRP 42 4.154 0.985 -0.143 349 HZ2 TRP 42 HZ2 TRP 42 5.372 0.015 -4.829 350 HZ3 TRP 42 HZ3 TRP 42 6.267 1.812 -1.014 351 HH2 TRP 42 HH2 TRP 42 6.940 1.288 -3.401 352 H VAL 43 H VAL 43 3.845 -1.906 0.690 353 HA VAL 43 HA VAL 43 5.027 -3.507 -1.194 354 HB VAL 43 HB VAL 43 5.813 -2.767 1.658 355 HG11 VAL 43 HG11 VAL 43 7.648 -3.938 -0.448 356 HG12 VAL 43 HG12 VAL 43 8.129 -3.309 1.139 357 HG13 VAL 43 HG13 VAL 43 7.110 -4.738 1.068 358 HG21 VAL 43 HG21 VAL 43 6.627 -1.752 -1.112 359 HG22 VAL 43 HG22 VAL 43 5.659 -0.897 0.098 360 HG23 VAL 43 HG23 VAL 43 7.363 -1.199 0.423 361 H PHE 44 H PHE 44 3.463 -4.698 1.797 362 HA PHE 44 HA PHE 44 4.391 -7.387 1.649 363 HB2 PHE 44 HB2 PHE 44 2.151 -5.902 3.015 364 HB3 PHE 44 HB3 PHE 44 2.081 -7.624 2.892 365 HD1 PHE 44 HD1 PHE 44 5.174 -5.490 3.670 366 HD2 PHE 44 HD2 PHE 44 2.255 -8.382 5.064 367 HE1 PHE 44 HE1 PHE 44 6.424 -5.793 5.756 368 HE2 PHE 44 HE2 PHE 44 3.517 -8.625 7.167 369 HZ PHE 44 HZ PHE 44 5.597 -7.322 7.533 370 H ASP 45 H ASP 45 1.160 -5.991 0.792 371 HA ASP 45 HA ASP 45 0.498 -8.535 -0.470 372 HB2 ASP 45 HB2 ASP 45 -0.986 -6.108 0.406 373 HB3 ASP 45 HB3 ASP 45 -1.673 -6.964 -0.959 374 H GLU 46 H GLU 46 1.885 -5.653 -1.721 375 HA GLU 46 HA GLU 46 1.015 -6.135 -4.495 376 HB2 GLU 46 HB2 GLU 46 1.420 -3.870 -3.415 377 HB3 GLU 46 HB3 GLU 46 3.129 -4.299 -3.310 378 HG2 GLU 46 HG2 GLU 46 3.188 -3.050 -5.151 379 HG3 GLU 46 HG3 GLU 46 2.886 -4.592 -5.951 380 H PHE 47 H PHE 47 3.808 -7.034 -2.359 381 HA PHE 47 HA PHE 47 5.124 -8.228 -4.751 382 HB2 PHE 47 HB2 PHE 47 6.365 -6.709 -2.501 383 HB3 PHE 47 HB3 PHE 47 7.246 -7.442 -3.803 384 HD1 PHE 47 HD1 PHE 47 5.702 -6.426 -6.210 385 HD2 PHE 47 HD2 PHE 47 6.573 -4.452 -2.472 386 HE1 PHE 47 HE1 PHE 47 5.321 -4.224 -7.271 387 HE2 PHE 47 HE2 PHE 47 6.158 -2.255 -3.531 388 HZ PHE 47 HZ PHE 47 5.526 -2.140 -5.927 389 H LEU 48 H LEU 48 5.641 -8.077 -1.165 390 HA LEU 48 HA LEU 48 6.887 -10.489 -0.909 391 HB2 LEU 48 HB2 LEU 48 4.839 -9.447 1.116 392 HB3 LEU 48 HB3 LEU 48 6.036 -10.684 1.405 393 HG LEU 48 HG LEU 48 6.570 -7.739 0.931 394 HD11 LEU 48 HD11 LEU 48 7.776 -8.201 3.227 395 HD12 LEU 48 HD12 LEU 48 6.008 -7.965 3.167 396 HD13 LEU 48 HD13 LEU 48 6.685 -9.580 3.311 397 HD21 LEU 48 HD21 LEU 48 8.487 -10.080 1.098 398 HD22 LEU 48 HD22 LEU 48 8.281 -8.902 -0.223 399 HD23 LEU 48 HD23 LEU 48 8.987 -8.398 1.302 400 H ASN 49 H ASN 49 3.386 -10.023 -0.617 401 HA ASN 49 HA ASN 49 2.972 -12.927 -0.425 402 HB2 ASN 49 HB2 ASN 49 0.979 -10.636 -0.388 403 HB3 ASN 49 HB3 ASN 49 0.652 -12.310 0.061 404 HD21 ASN 49 HD21 ASN 49 0.583 -9.740 1.788 405 HD22 ASN 49 HD22 ASN 49 1.711 -10.108 3.093 406 H LYS 50 H LYS 50 3.598 -11.016 -2.958 407 HA LYS 50 HA LYS 50 1.791 -12.260 -4.911 408 HB2 LYS 50 HB2 LYS 50 3.118 -9.701 -4.588 409 HB3 LYS 50 HB3 LYS 50 3.908 -10.461 -5.912 410 HG2 LYS 50 HG2 LYS 50 1.024 -10.820 -6.208 411 HG3 LYS 50 HG3 LYS 50 1.379 -9.135 -5.797 412 HD2 LYS 50 HD2 LYS 50 3.028 -9.036 -7.645 413 HD3 LYS 50 HD3 LYS 50 2.646 -10.726 -8.057 414 HE2 LYS 50 HE2 LYS 50 0.303 -10.071 -8.512 415 HE3 LYS 50 HE3 LYS 50 0.698 -8.384 -8.101 416 HZ1 LYS 50 HZ1 LYS 50 2.008 -9.910 -10.282 417 HZ2 LYS 50 HZ2 LYS 50 0.740 -8.894 -10.510 418 HZ3 LYS 50 HZ3 LYS 50 2.196 -8.326 -9.968 419 H GLY 51 H GLY 51 4.474 -13.282 -3.316 420 HA2 GLY 51 HA2 GLY 51 5.933 -14.992 -3.849 421 HA3 GLY 51 HA3 GLY 51 5.223 -15.075 -5.469 422 H TYR 52 H TYR 52 6.735 -12.230 -3.901 423 HA TYR 52 HA TYR 52 9.187 -12.608 -5.562 424 HB2 TYR 52 HB2 TYR 52 7.970 -10.031 -4.503 425 HB3 TYR 52 HB3 TYR 52 9.591 -10.159 -5.166 426 HD1 TYR 52 HD1 TYR 52 9.901 -10.782 -7.604 427 HD2 TYR 52 HD2 TYR 52 6.051 -9.842 -5.898 428 HE1 TYR 52 HE1 TYR 52 8.979 -10.422 -9.884 429 HE2 TYR 52 HE2 TYR 52 5.152 -9.413 -8.146 430 HH TYR 52 HH TYR 52 6.884 -10.367 -11.013 431 H ASN 53 H ASN 53 11.094 -11.813 -4.365 432 HA ASN 53 HA ASN 53 11.076 -12.021 -1.419 433 HB2 ASN 53 HB2 ASN 53 12.570 -13.873 -3.290 434 HB3 ASN 53 HB3 ASN 53 13.126 -13.582 -1.655 435 HD21 ASN 53 HD21 ASN 53 10.708 -13.660 -0.088 436 HD22 ASN 53 HD22 ASN 53 10.201 -15.311 -0.210 437 H LYS 54 H LYS 54 11.913 -10.002 -3.920 438 HA LYS 54 HA LYS 54 14.315 -9.075 -2.531 439 HB2 LYS 54 HB2 LYS 54 14.382 -10.095 -5.375 440 HB3 LYS 54 HB3 LYS 54 15.354 -8.718 -4.899 441 HG2 LYS 54 HG2 LYS 54 16.917 -9.960 -4.067 442 HG3 LYS 54 HG3 LYS 54 15.844 -10.610 -2.846 443 HD2 LYS 54 HD2 LYS 54 16.301 -11.763 -5.624 444 HD3 LYS 54 HD3 LYS 54 16.968 -12.388 -4.116 445 HE2 LYS 54 HE2 LYS 54 14.629 -12.726 -3.296 446 HE3 LYS 54 HE3 LYS 54 14.036 -12.111 -4.862 447 HZ1 LYS 54 HZ1 LYS 54 15.665 -14.115 -5.618 448 HZ2 LYS 54 HZ2 LYS 54 15.082 -14.712 -4.205 449 HZ3 LYS 54 HZ3 LYS 54 14.054 -14.264 -5.401 450 H ILE 55 H ILE 55 14.432 -6.965 -2.502 451 HA ILE 55 HA ILE 55 12.514 -5.203 -3.977 452 HB ILE 55 HB ILE 55 12.957 -5.581 -0.996 453 HG12 ILE 55 HG12 ILE 55 10.435 -5.374 -1.011 454 HG13 ILE 55 HG13 ILE 55 10.456 -5.409 -2.772 455 HG21 ILE 55 HG21 ILE 55 11.754 -3.253 -2.509 456 HG22 ILE 55 HG22 ILE 55 11.617 -3.501 -0.736 457 HG23 ILE 55 HG23 ILE 55 13.185 -3.183 -1.440 458 HD11 ILE 55 HD11 ILE 55 10.036 -7.556 -1.187 459 HD12 ILE 55 HD12 ILE 55 10.670 -7.650 -2.828 460 HD13 ILE 55 HD13 ILE 55 11.776 -7.717 -1.428 461 H PHE 56 H PHE 56 13.552 -3.168 -4.421 462 HA PHE 56 HA PHE 56 16.085 -2.613 -3.019 463 HB2 PHE 56 HB2 PHE 56 15.551 -2.128 -5.967 464 HB3 PHE 56 HB3 PHE 56 16.953 -1.540 -5.094 465 HD1 PHE 56 HD1 PHE 56 17.693 -3.917 -3.422 466 HD2 PHE 56 HD2 PHE 56 16.488 -3.603 -7.562 467 HE1 PHE 56 HE1 PHE 56 18.962 -5.943 -3.981 468 HE2 PHE 56 HE2 PHE 56 17.520 -5.758 -8.064 469 HZ PHE 56 HZ PHE 56 18.841 -6.929 -6.268 470 H LEU 57 H LEU 57 16.542 -0.415 -2.549 471 HA LEU 57 HA LEU 57 14.375 1.537 -3.212 472 HB2 LEU 57 HB2 LEU 57 14.462 0.915 -0.857 473 HB3 LEU 57 HB3 LEU 57 16.175 1.343 -0.792 474 HG LEU 57 HG LEU 57 15.739 3.675 -0.997 475 HD11 LEU 57 HD11 LEU 57 13.355 4.527 -1.183 476 HD12 LEU 57 HD12 LEU 57 14.029 3.797 -2.646 477 HD13 LEU 57 HD13 LEU 57 12.876 2.887 -1.666 478 HD21 LEU 57 HD21 LEU 57 14.378 4.058 0.999 479 HD22 LEU 57 HD22 LEU 57 13.681 2.432 0.874 480 HD23 LEU 57 HD23 LEU 57 15.407 2.644 1.229 481 H VAL 58 H VAL 58 15.767 1.605 -5.240 482 HA VAL 58 HA VAL 58 18.064 2.984 -5.600 483 HB VAL 58 HB VAL 58 15.409 3.347 -7.107 484 HG11 VAL 58 HG11 VAL 58 18.226 4.091 -8.015 485 HG12 VAL 58 HG12 VAL 58 16.853 3.905 -9.096 486 HG13 VAL 58 HG13 VAL 58 16.824 5.158 -7.864 487 HG21 VAL 58 HG21 VAL 58 16.154 1.019 -6.990 488 HG22 VAL 58 HG22 VAL 58 16.283 1.663 -8.636 489 HG23 VAL 58 HG23 VAL 58 17.728 1.483 -7.627 490 H LEU 59 H LEU 59 18.529 4.846 -4.246 491 HA LEU 59 HA LEU 59 16.612 6.986 -3.633 492 HB2 LEU 59 HB2 LEU 59 19.536 6.486 -2.949 493 HB3 LEU 59 HB3 LEU 59 18.571 7.765 -2.248 494 HG LEU 59 HG LEU 59 17.331 5.090 -1.910 495 HD11 LEU 59 HD11 LEU 59 19.644 4.328 -1.747 496 HD12 LEU 59 HD12 LEU 59 20.044 5.649 -0.635 497 HD13 LEU 59 HD13 LEU 59 18.921 4.381 -0.128 498 HD21 LEU 59 HD21 LEU 59 16.688 7.248 -0.745 499 HD22 LEU 59 HD22 LEU 59 16.914 5.824 0.292 500 HD23 LEU 59 HD23 LEU 59 18.184 7.050 0.203 501 H SER 60 H SER 60 17.952 6.494 -6.466 502 HA SER 60 HA SER 60 19.942 8.443 -6.841 503 HB2 SER 60 HB2 SER 60 19.159 6.375 -8.301 504 HB3 SER 60 HB3 SER 60 18.093 7.539 -9.089 505 HG SER 60 HG SER 60 20.925 7.650 -8.839 506 H ASP 61 H ASP 61 16.474 8.626 -7.688 507 HA ASP 61 HA ASP 61 16.724 11.205 -8.895 508 HB2 ASP 61 HB2 ASP 61 14.189 9.777 -8.031 509 HB3 ASP 61 HB3 ASP 61 14.336 10.971 -9.294 510 H VAL 62 H VAL 62 16.537 10.314 -5.702 511 HA VAL 62 HA VAL 62 15.135 12.721 -4.688 512 HB VAL 62 HB VAL 62 13.954 10.484 -4.289 513 HG11 VAL 62 HG11 VAL 62 15.726 8.945 -4.200 514 HG12 VAL 62 HG12 VAL 62 16.445 9.716 -2.765 515 HG13 VAL 62 HG13 VAL 62 14.876 8.891 -2.656 516 HG21 VAL 62 HG21 VAL 62 15.032 11.603 -1.691 517 HG22 VAL 62 HG22 VAL 62 13.732 12.382 -2.632 518 HG23 VAL 62 HG23 VAL 62 13.497 10.761 -1.944 519 H GLU 63 H GLU 63 16.115 13.362 -2.531 520 HA GLU 63 HA GLU 63 19.073 12.952 -2.689 521 HB2 GLU 63 HB2 GLU 63 19.432 15.007 -1.863 522 HB3 GLU 63 HB3 GLU 63 18.069 15.216 -2.968 523 HG2 GLU 63 HG2 GLU 63 17.911 15.115 0.085 524 HG3 GLU 63 HG3 GLU 63 17.910 16.574 -0.898 525 H SER 64 H SER 64 16.232 12.848 -0.572 526 HA SER 64 HA SER 64 17.648 10.976 1.088 527 HB2 SER 64 HB2 SER 64 17.140 12.351 3.152 528 HB3 SER 64 HB3 SER 64 18.278 13.083 2.022 529 HG SER 64 HG SER 64 16.101 14.090 1.173 530 H ILE 65 H ILE 65 16.390 10.195 3.020 531 HA ILE 65 HA ILE 65 13.511 9.973 2.453 532 HB ILE 65 HB ILE 65 14.704 7.823 2.456 533 HG12 ILE 65 HG12 ILE 65 13.036 8.037 4.986 534 HG13 ILE 65 HG13 ILE 65 12.323 8.193 3.380 535 HG21 ILE 65 HG21 ILE 65 16.582 8.393 4.000 536 HG22 ILE 65 HG22 ILE 65 15.423 8.424 5.349 537 HG23 ILE 65 HG23 ILE 65 15.756 6.917 4.466 538 HD11 ILE 65 HD11 ILE 65 13.839 5.784 4.431 539 HD12 ILE 65 HD12 ILE 65 12.103 5.905 4.131 540 HD13 ILE 65 HD13 ILE 65 13.224 5.952 2.766 541 H ASP 66 H ASP 66 12.195 10.432 4.257 542 HA ASP 66 HA ASP 66 13.348 12.400 6.109 543 HB2 ASP 66 HB2 ASP 66 11.209 12.672 4.642 544 HB3 ASP 66 HB3 ASP 66 10.434 11.638 5.821 545 H SER 67 H SER 67 12.434 12.425 8.347 546 HA SER 67 HA SER 67 12.809 9.870 9.729 547 HB2 SER 67 HB2 SER 67 12.199 12.650 10.792 548 HB3 SER 67 HB3 SER 67 12.725 11.243 11.739 549 HG SER 67 HG SER 67 14.141 12.746 9.794 550 H PHE 68 H PHE 68 10.728 9.475 8.146 551 HA PHE 68 HA PHE 68 8.817 8.782 10.213 552 HB2 PHE 68 HB2 PHE 68 7.732 10.651 8.909 553 HB3 PHE 68 HB3 PHE 68 7.782 9.630 7.488 554 HD1 PHE 68 HD1 PHE 68 6.614 7.390 7.572 555 HD2 PHE 68 HD2 PHE 68 6.041 10.361 10.616 556 HE1 PHE 68 HE1 PHE 68 4.514 6.241 8.289 557 HE2 PHE 68 HE2 PHE 68 3.947 9.242 11.321 558 HZ PHE 68 HZ PHE 68 3.179 7.182 10.164 559 H SER 69 H SER 69 9.304 8.372 6.650 560 HA SER 69 HA SER 69 8.823 5.574 6.751 561 HB2 SER 69 HB2 SER 69 8.500 6.916 4.779 562 HB3 SER 69 HB3 SER 69 10.251 7.149 4.583 563 HG SER 69 HG SER 69 8.969 5.341 3.428 564 H LEU 70 H LEU 70 11.839 7.360 7.294 565 HA LEU 70 HA LEU 70 13.723 5.359 6.855 566 HB2 LEU 70 HB2 LEU 70 14.147 7.731 7.342 567 HB3 LEU 70 HB3 LEU 70 13.520 7.536 8.981 568 HG LEU 70 HG LEU 70 15.454 6.116 9.564 569 HD11 LEU 70 HD11 LEU 70 16.433 6.759 6.735 570 HD12 LEU 70 HD12 LEU 70 17.373 5.962 7.995 571 HD13 LEU 70 HD13 LEU 70 15.959 5.154 7.313 572 HD21 LEU 70 HD21 LEU 70 16.371 8.687 8.234 573 HD22 LEU 70 HD22 LEU 70 15.442 8.652 9.741 574 HD23 LEU 70 HD23 LEU 70 17.029 7.893 9.692 575 H GLY 71 H GLY 71 11.249 5.216 9.313 576 HA2 GLY 71 HA2 GLY 71 12.710 3.040 10.775 577 HA3 GLY 71 HA3 GLY 71 11.145 3.730 11.208 578 H VAL 72 H VAL 72 10.118 3.629 8.442 579 HA VAL 72 HA VAL 72 8.853 1.080 8.545 580 HB VAL 72 HB VAL 72 8.746 3.196 6.322 581 HG11 VAL 72 HG11 VAL 72 6.503 2.181 5.997 582 HG12 VAL 72 HG12 VAL 72 7.776 0.977 5.729 583 HG13 VAL 72 HG13 VAL 72 6.840 0.969 7.241 584 HG21 VAL 72 HG21 VAL 72 6.746 4.027 7.499 585 HG22 VAL 72 HG22 VAL 72 7.051 2.919 8.847 586 HG23 VAL 72 HG23 VAL 72 8.177 4.243 8.497 587 H ILE 73 H ILE 73 11.417 2.502 6.532 588 HA ILE 73 HA ILE 73 11.864 0.455 4.670 589 HB ILE 73 HB ILE 73 13.895 2.224 6.110 590 HG12 ILE 73 HG12 ILE 73 12.576 3.794 5.087 591 HG13 ILE 73 HG13 ILE 73 13.792 3.533 3.881 592 HG21 ILE 73 HG21 ILE 73 15.038 0.380 4.905 593 HG22 ILE 73 HG22 ILE 73 14.215 0.906 3.418 594 HG23 ILE 73 HG23 ILE 73 15.371 1.978 4.228 595 HD11 ILE 73 HD11 ILE 73 11.653 3.733 2.798 596 HD12 ILE 73 HD12 ILE 73 12.194 2.057 2.632 597 HD13 ILE 73 HD13 ILE 73 10.942 2.482 3.824 598 H VAL 74 H VAL 74 13.233 0.700 7.980 599 HA VAL 74 HA VAL 74 14.663 -1.853 7.900 600 HB VAL 74 HB VAL 74 13.448 -0.153 10.191 601 HG11 VAL 74 HG11 VAL 74 15.066 -1.277 11.667 602 HG12 VAL 74 HG12 VAL 74 13.816 -2.337 11.000 603 HG13 VAL 74 HG13 VAL 74 15.474 -2.387 10.325 604 HG21 VAL 74 HG21 VAL 74 16.218 -0.045 8.990 605 HG22 VAL 74 HG22 VAL 74 14.975 1.229 8.991 606 HG23 VAL 74 HG23 VAL 74 15.724 0.757 10.507 607 H ASN 75 H ASN 75 11.399 -0.817 9.064 608 HA ASN 75 HA ASN 75 10.705 -3.296 10.142 609 HB2 ASN 75 HB2 ASN 75 9.455 -0.773 9.549 610 HB3 ASN 75 HB3 ASN 75 8.502 -1.955 8.715 611 HD21 ASN 75 HD21 ASN 75 9.024 -0.422 11.703 612 HD22 ASN 75 HD22 ASN 75 8.078 -1.513 12.693 613 H ILE 76 H ILE 76 10.439 -2.172 6.767 614 HA ILE 76 HA ILE 76 9.324 -4.515 5.601 615 HB ILE 76 HB ILE 76 10.835 -2.067 4.714 616 HG12 ILE 76 HG12 ILE 76 8.247 -3.351 3.773 617 HG13 ILE 76 HG13 ILE 76 8.368 -2.155 5.066 618 HG21 ILE 76 HG21 ILE 76 10.830 -2.912 2.318 619 HG22 ILE 76 HG22 ILE 76 12.066 -3.584 3.375 620 HG23 ILE 76 HG23 ILE 76 10.614 -4.531 2.989 621 HD11 ILE 76 HD11 ILE 76 9.158 -0.479 3.557 622 HD12 ILE 76 HD12 ILE 76 9.107 -1.608 2.192 623 HD13 ILE 76 HD13 ILE 76 7.604 -1.193 3.016 624 H LEU 77 H LEU 77 12.721 -3.713 6.502 625 HA LEU 77 HA LEU 77 13.976 -5.967 5.140 626 HB2 LEU 77 HB2 LEU 77 15.395 -4.256 5.589 627 HB3 LEU 77 HB3 LEU 77 14.816 -4.028 7.226 628 HG LEU 77 HG LEU 77 15.681 -6.089 7.982 629 HD11 LEU 77 HD11 LEU 77 17.251 -7.482 6.508 630 HD12 LEU 77 HD12 LEU 77 15.652 -7.566 5.800 631 HD13 LEU 77 HD13 LEU 77 16.828 -6.461 5.117 632 HD21 LEU 77 HD21 LEU 77 16.973 -4.143 7.930 633 HD22 LEU 77 HD22 LEU 77 17.964 -5.631 7.772 634 HD23 LEU 77 HD23 LEU 77 17.611 -4.643 6.316 635 H LYS 78 H LYS 78 12.840 -5.279 8.476 636 HA LYS 78 HA LYS 78 13.504 -7.845 9.527 637 HB2 LYS 78 HB2 LYS 78 11.327 -5.920 10.495 638 HB3 LYS 78 HB3 LYS 78 12.050 -7.244 11.417 639 HG2 LYS 78 HG2 LYS 78 14.322 -6.066 10.915 640 HG3 LYS 78 HG3 LYS 78 13.370 -4.672 10.475 641 HD2 LYS 78 HD2 LYS 78 12.462 -4.513 12.736 642 HD3 LYS 78 HD3 LYS 78 13.198 -6.081 13.173 643 HE2 LYS 78 HE2 LYS 78 15.427 -4.804 12.383 644 HE3 LYS 78 HE3 LYS 78 14.464 -3.369 12.781 645 HZ1 LYS 78 HZ1 LYS 78 15.776 -4.090 14.624 646 HZ2 LYS 78 HZ2 LYS 78 14.177 -4.343 15.020 647 HZ3 LYS 78 HZ3 LYS 78 15.189 -5.598 14.578 648 H SER 79 H SER 79 11.201 -7.054 7.292 649 HA SER 79 HA SER 79 9.374 -9.347 7.934 650 HB2 SER 79 HB2 SER 79 8.364 -7.164 7.163 651 HB3 SER 79 HB3 SER 79 9.130 -7.437 5.583 652 HG SER 79 HG SER 79 7.020 -8.291 5.616 653 H ILE 80 H ILE 80 11.570 -8.141 5.293 654 HA ILE 80 HA ILE 80 11.377 -10.548 3.755 655 HB ILE 80 HB ILE 80 13.462 -8.319 3.867 656 HG12 ILE 80 HG12 ILE 80 11.064 -8.982 2.100 657 HG13 ILE 80 HG13 ILE 80 11.204 -7.611 3.180 658 HG21 ILE 80 HG21 ILE 80 14.459 -10.424 2.941 659 HG22 ILE 80 HG22 ILE 80 13.156 -10.473 1.728 660 HG23 ILE 80 HG23 ILE 80 14.348 -9.148 1.768 661 HD11 ILE 80 HD11 ILE 80 11.491 -6.917 0.869 662 HD12 ILE 80 HD12 ILE 80 12.963 -6.641 1.804 663 HD13 ILE 80 HD13 ILE 80 12.829 -8.016 0.642 664 H SER 81 H SER 81 13.763 -9.620 6.311 665 HA SER 81 HA SER 81 15.049 -12.225 6.229 666 HB2 SER 81 HB2 SER 81 15.096 -9.798 8.025 667 HB3 SER 81 HB3 SER 81 15.948 -11.291 8.494 668 HG SER 81 HG SER 81 17.292 -11.120 6.939 669 H SER 82 H SER 82 11.984 -11.385 7.372 670 HA SER 82 HA SER 82 11.882 -13.587 9.351 671 HB2 SER 82 HB2 SER 82 10.353 -11.692 9.676 672 HB3 SER 82 HB3 SER 82 9.644 -11.954 8.085 673 HG SER 82 HG SER 82 9.499 -13.645 10.343 674 H SER 83 H SER 83 10.837 -12.855 5.968 675 HA SER 83 HA SER 83 9.961 -15.470 5.352 676 HB2 SER 83 HB2 SER 83 10.795 -13.038 3.748 677 HB3 SER 83 HB3 SER 83 10.343 -14.518 2.929 678 HG SER 83 HG SER 83 8.761 -12.684 3.839 679 H GLY 84 H GLY 84 13.122 -13.920 4.490 680 HA2 GLY 84 HA2 GLY 84 15.105 -15.482 4.397 681 HA3 GLY 84 HA3 GLY 84 14.051 -16.590 3.512 682 H GLY 85 H GLY 85 13.536 -13.220 2.708 683 HA2 GLY 85 HA2 GLY 85 14.766 -13.630 0.066 684 HA3 GLY 85 HA3 GLY 85 13.683 -12.330 0.571 685 H PHE 86 H PHE 86 15.289 -10.951 -0.447 686 HA PHE 86 HA PHE 86 17.402 -10.045 1.425 687 HB2 PHE 86 HB2 PHE 86 17.855 -11.090 -1.338 688 HB3 PHE 86 HB3 PHE 86 18.626 -9.580 -0.995 689 HD1 PHE 86 HD1 PHE 86 18.387 -13.142 0.062 690 HD2 PHE 86 HD2 PHE 86 20.660 -9.455 0.508 691 HE1 PHE 86 HE1 PHE 86 20.285 -14.391 1.013 692 HE2 PHE 86 HE2 PHE 86 22.453 -10.708 1.509 693 HZ PHE 86 HZ PHE 86 22.345 -13.173 1.723 694 H PHE 87 H PHE 87 18.065 -7.757 0.941 695 HA PHE 87 HA PHE 87 16.398 -6.193 -0.858 696 HB2 PHE 87 HB2 PHE 87 14.814 -6.299 0.841 697 HB3 PHE 87 HB3 PHE 87 16.002 -6.236 2.130 698 HD1 PHE 87 HD1 PHE 87 15.692 -3.712 -0.738 699 HD2 PHE 87 HD2 PHE 87 15.164 -4.564 3.474 700 HE1 PHE 87 HE1 PHE 87 15.165 -1.368 -0.311 701 HE2 PHE 87 HE2 PHE 87 14.659 -2.184 3.909 702 HZ PHE 87 HZ PHE 87 14.663 -0.573 1.967 703 H ALA 88 H ALA 88 17.424 -4.231 -1.345 704 HA ALA 88 HA ALA 88 19.560 -3.293 0.403 705 HB1 ALA 88 HB1 ALA 88 20.569 -4.943 -1.234 706 HB2 ALA 88 HB2 ALA 88 20.086 -3.841 -2.544 707 HB3 ALA 88 HB3 ALA 88 21.232 -3.299 -1.290 708 H LEU 89 H LEU 89 20.486 -1.223 -0.474 709 HA LEU 89 HA LEU 89 18.372 0.376 -1.840 710 HB2 LEU 89 HB2 LEU 89 20.523 1.684 -0.245 711 HB3 LEU 89 HB3 LEU 89 18.893 2.201 -0.638 712 HG LEU 89 HG LEU 89 19.890 0.510 1.599 713 HD11 LEU 89 HD11 LEU 89 18.513 1.999 2.949 714 HD12 LEU 89 HD12 LEU 89 19.516 2.940 1.840 715 HD13 LEU 89 HD13 LEU 89 17.788 2.708 1.473 716 HD21 LEU 89 HD21 LEU 89 17.229 -0.015 0.432 717 HD22 LEU 89 HD22 LEU 89 18.363 -1.054 1.290 718 HD23 LEU 89 HD23 LEU 89 17.376 0.070 2.214 719 H VAL 90 H VAL 90 19.436 2.328 -3.050 720 HA VAL 90 HA VAL 90 21.811 1.525 -4.496 721 HB VAL 90 HB VAL 90 20.557 0.329 -5.914 722 HG11 VAL 90 HG11 VAL 90 19.189 -0.527 -4.785 723 HG12 VAL 90 HG12 VAL 90 18.168 0.895 -4.649 724 HG13 VAL 90 HG13 VAL 90 18.315 -0.003 -6.201 725 HG21 VAL 90 HG21 VAL 90 19.816 1.184 -7.857 726 HG22 VAL 90 HG22 VAL 90 19.635 2.799 -7.092 727 HG23 VAL 90 HG23 VAL 90 21.212 2.062 -7.291 728 H SER 91 H SER 91 22.821 3.178 -5.626 729 HA SER 91 HA SER 91 23.503 5.298 -5.929 730 HB2 SER 91 HB2 SER 91 21.985 5.009 -7.824 731 HB3 SER 91 HB3 SER 91 20.623 5.559 -6.837 732 HG SER 91 HG SER 91 21.824 7.530 -6.559 733 HA PRO 92 HA PRO 92 21.539 6.955 -1.983 734 HB2 PRO 92 HB2 PRO 92 23.704 6.689 -0.294 735 HB3 PRO 92 HB3 PRO 92 22.490 5.402 -0.547 736 HG2 PRO 92 HG2 PRO 92 25.266 5.593 -1.666 737 HG3 PRO 92 HG3 PRO 92 24.314 4.138 -1.230 738 HD2 PRO 92 HD2 PRO 92 24.655 5.185 -3.807 739 HD3 PRO 92 HD3 PRO 92 23.458 3.957 -3.278 740 H ASN 93 H ASN 93 22.402 8.945 -0.797 741 HA ASN 93 HA ASN 93 24.462 10.432 -2.311 742 HB2 ASN 93 HB2 ASN 93 22.067 11.931 -1.222 743 HB3 ASN 93 HB3 ASN 93 23.238 12.460 -2.400 744 HD21 ASN 93 HD21 ASN 93 20.408 10.917 -1.773 745 HD22 ASN 93 HD22 ASN 93 19.803 10.470 -3.401 746 H GLU 94 H GLU 94 25.003 12.388 -0.935 747 HA GLU 94 HA GLU 94 26.042 11.453 1.547 748 HB2 GLU 94 HB2 GLU 94 27.250 13.142 0.392 749 HB3 GLU 94 HB3 GLU 94 25.865 14.260 0.380 750 HG2 GLU 94 HG2 GLU 94 26.025 14.717 2.681 751 HG3 GLU 94 HG3 GLU 94 26.831 13.197 3.007 752 H LYS 95 H LYS 95 23.166 13.475 0.793 753 HA LYS 95 HA LYS 95 22.620 14.106 3.555 754 HB2 LYS 95 HB2 LYS 95 21.651 15.048 1.250 755 HB3 LYS 95 HB3 LYS 95 20.359 13.965 1.638 756 HG2 LYS 95 HG2 LYS 95 21.335 15.639 3.990 757 HG3 LYS 95 HG3 LYS 95 20.760 16.559 2.622 758 HD2 LYS 95 HD2 LYS 95 18.874 16.325 3.947 759 HD3 LYS 95 HD3 LYS 95 18.756 15.201 2.600 760 HE2 LYS 95 HE2 LYS 95 17.786 14.290 4.652 761 HE3 LYS 95 HE3 LYS 95 19.090 13.279 4.011 762 HZ1 LYS 95 HZ1 LYS 95 20.536 14.111 5.668 763 HZ2 LYS 95 HZ2 LYS 95 19.405 15.213 6.231 764 HZ3 LYS 95 HZ3 LYS 95 19.179 13.594 6.417 765 H VAL 96 H VAL 96 22.131 11.250 1.666 766 HA VAL 96 HA VAL 96 20.239 10.249 3.635 767 HB VAL 96 HB VAL 96 20.521 9.949 0.865 768 HG11 VAL 96 HG11 VAL 96 20.638 7.620 0.369 769 HG12 VAL 96 HG12 VAL 96 22.162 8.127 1.103 770 HG13 VAL 96 HG13 VAL 96 20.988 7.219 2.065 771 HG21 VAL 96 HG21 VAL 96 18.531 9.842 2.526 772 HG22 VAL 96 HG22 VAL 96 18.475 9.020 0.959 773 HG23 VAL 96 HG23 VAL 96 18.786 8.091 2.461 774 H GLU 97 H GLU 97 23.553 9.600 2.432 775 HA GLU 97 HA GLU 97 24.192 7.366 3.964 776 HB2 GLU 97 HB2 GLU 97 25.753 9.689 2.799 777 HB3 GLU 97 HB3 GLU 97 26.571 8.564 3.849 778 HG2 GLU 97 HG2 GLU 97 25.026 7.117 1.813 779 HG3 GLU 97 HG3 GLU 97 26.073 8.310 1.069 780 H ARG 98 H ARG 98 24.260 10.873 4.770 781 HA ARG 98 HA ARG 98 25.828 10.462 7.078 782 HB2 ARG 98 HB2 ARG 98 25.685 12.699 7.463 783 HB3 ARG 98 HB3 ARG 98 25.453 12.557 5.733 784 HG2 ARG 98 HG2 ARG 98 23.776 14.026 6.253 785 HG3 ARG 98 HG3 ARG 98 22.914 12.495 6.328 786 HD2 ARG 98 HD2 ARG 98 22.496 12.752 8.581 787 HD3 ARG 98 HD3 ARG 98 24.167 13.164 8.908 788 HE ARG 98 HE ARG 98 23.154 15.418 7.632 789 HH11 ARG 98 HH11 ARG 98 22.031 13.788 10.592 790 HH12 ARG 98 HH12 ARG 98 22.266 15.206 11.564 791 HH21 ARG 98 HH21 ARG 98 22.935 17.265 8.758 792 HH22 ARG 98 HH22 ARG 98 22.656 17.239 10.500 793 H VAL 99 H VAL 99 22.533 9.884 6.578 794 HA VAL 99 HA VAL 99 21.782 10.000 9.461 795 HB VAL 99 HB VAL 99 20.094 9.270 7.010 796 HG11 VAL 99 HG11 VAL 99 18.197 10.036 8.445 797 HG12 VAL 99 HG12 VAL 99 19.087 8.698 9.192 798 HG13 VAL 99 HG13 VAL 99 19.332 10.353 9.770 799 HG21 VAL 99 HG21 VAL 99 20.555 12.020 8.025 800 HG22 VAL 99 HG22 VAL 99 20.973 11.267 6.459 801 HG23 VAL 99 HG23 VAL 99 19.259 11.504 6.880 802 H LEU 100 H LEU 100 21.820 7.876 6.542 803 HA LEU 100 HA LEU 100 20.948 5.505 7.804 804 HB2 LEU 100 HB2 LEU 100 22.759 5.899 5.386 805 HB3 LEU 100 HB3 LEU 100 22.077 4.385 5.874 806 HG LEU 100 HG LEU 100 21.005 6.332 4.119 807 HD11 LEU 100 HD11 LEU 100 19.584 3.840 5.087 808 HD12 LEU 100 HD12 LEU 100 19.424 4.674 3.535 809 HD13 LEU 100 HD13 LEU 100 20.931 3.831 3.927 810 HD21 LEU 100 HD21 LEU 100 18.622 6.470 4.862 811 HD22 LEU 100 HD22 LEU 100 19.124 5.929 6.472 812 HD23 LEU 100 HD23 LEU 100 19.706 7.470 5.799 813 H SER 101 H SER 101 23.907 7.254 7.943 814 HA SER 101 HA SER 101 25.567 4.957 8.829 815 HB2 SER 101 HB2 SER 101 26.090 7.951 8.644 816 HB3 SER 101 HB3 SER 101 27.281 6.741 9.136 817 HG SER 101 HG SER 101 25.906 6.788 6.637 818 H LEU 102 H LEU 102 23.355 7.044 10.329 819 HA LEU 102 HA LEU 102 24.728 7.069 12.987 820 HB2 LEU 102 HB2 LEU 102 22.896 8.982 11.487 821 HB3 LEU 102 HB3 LEU 102 23.128 9.154 13.191 822 HG LEU 102 HG LEU 102 25.282 9.346 11.048 823 HD11 LEU 102 HD11 LEU 102 25.306 11.703 11.636 824 HD12 LEU 102 HD12 LEU 102 23.631 11.241 11.316 825 HD13 LEU 102 HD13 LEU 102 24.176 11.420 12.995 826 HD21 LEU 102 HD21 LEU 102 26.781 10.182 12.836 827 HD22 LEU 102 HD22 LEU 102 25.617 9.595 14.046 828 HD23 LEU 102 HD23 LEU 102 26.434 8.451 12.941 829 H THR 103 H THR 103 21.617 6.770 11.333 830 HA THR 103 HA THR 103 20.152 6.011 13.698 831 HB THR 103 HB THR 103 19.438 7.388 11.635 832 HG1 THR 103 HG1 THR 103 17.959 6.611 13.156 833 HG21 THR 103 HG21 THR 103 18.794 4.710 10.422 834 HG22 THR 103 HG22 THR 103 18.734 6.335 9.670 835 HG23 THR 103 HG23 THR 103 20.283 5.570 10.009 836 H ASN 104 H ASN 104 22.424 4.373 12.080 837 HA ASN 104 HA ASN 104 22.987 2.325 11.434 838 HB2 ASN 104 HB2 ASN 104 21.987 0.343 12.776 839 HB3 ASN 104 HB3 ASN 104 23.209 1.401 13.406 840 HD21 ASN 104 HD21 ASN 104 22.586 3.050 14.967 841 HD22 ASN 104 HD22 ASN 104 21.243 2.720 16.044 842 H LEU 105 H LEU 105 22.041 2.822 9.402 843 HA LEU 105 HA LEU 105 19.759 1.015 8.770 844 HB2 LEU 105 HB2 LEU 105 19.762 3.784 8.585 845 HB3 LEU 105 HB3 LEU 105 20.361 3.363 7.025 846 HG LEU 105 HG LEU 105 18.092 3.667 6.707 847 HD11 LEU 105 HD11 LEU 105 18.780 1.458 5.746 848 HD12 LEU 105 HD12 LEU 105 18.120 0.686 7.216 849 HD13 LEU 105 HD13 LEU 105 17.057 1.575 6.127 850 HD21 LEU 105 HD21 LEU 105 17.415 3.853 8.982 851 HD22 LEU 105 HD22 LEU 105 16.335 2.776 8.115 852 HD23 LEU 105 HD23 LEU 105 17.562 2.104 9.233 853 H ASP 106 H ASP 106 22.575 2.760 7.296 854 HA ASP 106 HA ASP 106 22.944 0.969 5.082 855 HB2 ASP 106 HB2 ASP 106 23.794 3.112 4.858 856 HB3 ASP 106 HB3 ASP 106 24.548 3.108 6.443 857 H ARG 107 H ARG 107 23.870 0.727 8.512 858 HA ARG 107 HA ARG 107 25.801 -1.326 7.896 859 HB2 ARG 107 HB2 ARG 107 26.022 -1.532 10.143 860 HB3 ARG 107 HB3 ARG 107 26.302 0.149 9.677 861 HG2 ARG 107 HG2 ARG 107 24.601 0.872 10.991 862 HG3 ARG 107 HG3 ARG 107 23.568 -0.425 10.449 863 HD2 ARG 107 HD2 ARG 107 25.699 -0.558 12.607 864 HD3 ARG 107 HD3 ARG 107 23.963 -0.531 12.864 865 HE ARG 107 HE ARG 107 23.745 -2.766 12.140 866 HH11 ARG 107 HH11 ARG 107 27.152 -1.823 12.395 867 HH12 ARG 107 HH12 ARG 107 27.770 -3.381 11.975 868 HH21 ARG 107 HH21 ARG 107 24.532 -4.848 11.659 869 HH22 ARG 107 HH22 ARG 107 26.223 -5.182 11.762 870 H ILE 108 H ILE 108 22.546 -1.433 7.985 871 HA ILE 108 HA ILE 108 22.401 -4.221 8.995 872 HB ILE 108 HB ILE 108 20.227 -2.092 9.153 873 HG12 ILE 108 HG12 ILE 108 22.305 -3.133 11.092 874 HG13 ILE 108 HG13 ILE 108 21.843 -1.470 10.702 875 HG21 ILE 108 HG21 ILE 108 20.277 -4.857 10.433 876 HG22 ILE 108 HG22 ILE 108 18.937 -3.685 10.407 877 HG23 ILE 108 HG23 ILE 108 19.438 -4.486 8.922 878 HD11 ILE 108 HD11 ILE 108 20.227 -3.343 12.426 879 HD12 ILE 108 HD12 ILE 108 21.277 -2.019 12.962 880 HD13 ILE 108 HD13 ILE 108 19.847 -1.650 12.004 881 H VAL 109 H VAL 109 21.088 -1.853 6.585 882 HA VAL 109 HA VAL 109 20.308 -4.154 4.989 883 HB VAL 109 HB VAL 109 19.618 -1.415 4.033 884 HG11 VAL 109 HG11 VAL 109 19.012 -3.342 2.729 885 HG12 VAL 109 HG12 VAL 109 18.099 -4.024 4.097 886 HG13 VAL 109 HG13 VAL 109 17.575 -2.512 3.315 887 HG21 VAL 109 HG21 VAL 109 18.996 -1.087 6.336 888 HG22 VAL 109 HG22 VAL 109 17.530 -1.304 5.363 889 HG23 VAL 109 HG23 VAL 109 18.133 -2.613 6.394 890 H LYS 110 H LYS 110 21.052 -4.416 2.855 891 HA LYS 110 HA LYS 110 23.687 -3.495 2.272 892 HB2 LYS 110 HB2 LYS 110 21.531 -5.016 0.804 893 HB3 LYS 110 HB3 LYS 110 22.990 -4.574 -0.040 894 HG2 LYS 110 HG2 LYS 110 23.440 -5.818 2.644 895 HG3 LYS 110 HG3 LYS 110 22.722 -6.865 1.411 896 HD2 LYS 110 HD2 LYS 110 25.116 -7.090 1.399 897 HD3 LYS 110 HD3 LYS 110 24.517 -6.453 -0.116 898 HE2 LYS 110 HE2 LYS 110 26.492 -5.221 0.332 899 HE3 LYS 110 HE3 LYS 110 25.153 -4.122 0.589 900 HZ1 LYS 110 HZ1 LYS 110 25.472 -4.523 3.026 901 HZ2 LYS 110 HZ2 LYS 110 26.778 -5.464 2.656 902 HZ3 LYS 110 HZ3 LYS 110 26.749 -3.854 2.279 903 H ILE 111 H ILE 111 24.359 -2.454 0.274 904 HA ILE 111 HA ILE 111 22.568 -0.403 -0.726 905 HB ILE 111 HB ILE 111 24.247 0.110 1.482 906 HG12 ILE 111 HG12 ILE 111 24.084 2.641 0.383 907 HG13 ILE 111 HG13 ILE 111 22.749 1.825 -0.403 908 HG21 ILE 111 HG21 ILE 111 26.075 1.488 0.858 909 HG22 ILE 111 HG22 ILE 111 26.295 -0.102 0.128 910 HG23 ILE 111 HG23 ILE 111 25.745 1.273 -0.867 911 HD11 ILE 111 HD11 ILE 111 21.976 1.090 1.904 912 HD12 ILE 111 HD12 ILE 111 23.294 2.037 2.616 913 HD13 ILE 111 HD13 ILE 111 22.016 2.861 1.711 914 H TYR 112 H TYR 112 23.167 0.223 -2.858 915 HA TYR 112 HA TYR 112 25.666 -0.861 -4.033 916 HB2 TYR 112 HB2 TYR 112 22.766 -1.193 -4.948 917 HB3 TYR 112 HB3 TYR 112 24.144 -1.524 -5.981 918 HD1 TYR 112 HD1 TYR 112 25.863 -3.214 -5.321 919 HD2 TYR 112 HD2 TYR 112 22.147 -2.756 -3.174 920 HE1 TYR 112 HE1 TYR 112 26.191 -5.440 -4.396 921 HE2 TYR 112 HE2 TYR 112 22.418 -5.150 -2.340 922 HH TYR 112 HH TYR 112 25.345 -7.019 -2.990 923 H ASP 113 H ASP 113 25.852 0.041 -6.379 924 HA ASP 113 HA ASP 113 25.282 2.956 -6.171 925 HB2 ASP 113 HB2 ASP 113 27.528 1.704 -7.064 926 HB3 ASP 113 HB3 ASP 113 26.692 1.865 -8.558 927 H THR 114 H THR 114 24.542 0.113 -8.211 928 HA THR 114 HA THR 114 22.502 1.667 -9.687 929 HB THR 114 HB THR 114 23.267 0.640 -11.766 930 HG1 THR 114 HG1 THR 114 25.682 -0.198 -10.560 931 HG21 THR 114 HG21 THR 114 25.586 2.039 -10.353 932 HG22 THR 114 HG22 THR 114 25.337 1.877 -12.107 933 HG23 THR 114 HG23 THR 114 24.181 2.820 -11.148 934 H ILE 115 H ILE 115 21.117 0.007 -10.994 935 HA ILE 115 HA ILE 115 20.049 -1.873 -9.002 936 HB ILE 115 HB ILE 115 19.274 -0.856 -11.732 937 HG12 ILE 115 HG12 ILE 115 18.504 0.347 -9.755 938 HG13 ILE 115 HG13 ILE 115 17.151 -0.390 -10.617 939 HG21 ILE 115 HG21 ILE 115 18.197 -3.458 -10.579 940 HG22 ILE 115 HG22 ILE 115 17.329 -2.471 -11.788 941 HG23 ILE 115 HG23 ILE 115 18.908 -3.156 -12.168 942 HD11 ILE 115 HD11 ILE 115 16.769 -0.722 -8.286 943 HD12 ILE 115 HD12 ILE 115 17.185 -2.279 -8.991 944 HD13 ILE 115 HD13 ILE 115 18.365 -1.389 -8.007 945 H SER 116 H SER 116 21.979 -2.082 -12.034 946 HA SER 116 HA SER 116 21.673 -4.934 -11.934 947 HB2 SER 116 HB2 SER 116 21.979 -3.583 -13.985 948 HB3 SER 116 HB3 SER 116 23.692 -3.368 -13.500 949 HG SER 116 HG SER 116 23.930 -5.615 -13.657 950 H GLU 117 H GLU 117 23.616 -2.810 -10.054 951 HA GLU 117 HA GLU 117 25.638 -4.865 -9.523 952 HB2 GLU 117 HB2 GLU 117 25.236 -1.980 -9.163 953 HB3 GLU 117 HB3 GLU 117 25.923 -2.776 -7.730 954 HG2 GLU 117 HG2 GLU 117 27.711 -3.733 -9.022 955 HG3 GLU 117 HG3 GLU 117 26.981 -3.225 -10.549 956 H ALA 118 H ALA 118 22.406 -4.207 -8.703 957 HA ALA 118 HA ALA 118 22.690 -5.223 -5.935 958 HB1 ALA 118 HB1 ALA 118 20.655 -4.276 -5.462 959 HB2 ALA 118 HB2 ALA 118 21.555 -3.059 -6.363 960 HB3 ALA 118 HB3 ALA 118 20.263 -3.972 -7.182 961 H MET 119 H MET 119 21.032 -5.731 -9.124 962 HA MET 119 HA MET 119 19.135 -7.473 -8.374 963 HB2 MET 119 HB2 MET 119 19.621 -6.010 -10.522 964 HB3 MET 119 HB3 MET 119 20.539 -7.373 -11.117 965 HG2 MET 119 HG2 MET 119 17.790 -7.836 -10.052 966 HG3 MET 119 HG3 MET 119 17.947 -6.996 -11.602 967 HE1 MET 119 HE1 MET 119 16.252 -9.380 -11.551 968 HE2 MET 119 HE2 MET 119 16.938 -10.958 -12.016 969 HE3 MET 119 HE3 MET 119 17.075 -10.393 -10.339 970 H GLU 120 H GLU 120 22.329 -8.363 -9.592 971 HA GLU 120 HA GLU 120 21.783 -11.288 -9.149 972 HB2 GLU 120 HB2 GLU 120 23.351 -11.647 -10.933 973 HB3 GLU 120 HB3 GLU 120 22.146 -10.450 -11.471 974 HG2 GLU 120 HG2 GLU 120 23.612 -8.731 -11.628 975 HG3 GLU 120 HG3 GLU 120 24.611 -9.288 -10.289 976 H GLU 121 H GLU 121 23.036 -8.758 -7.593 977 HA GLU 121 HA GLU 121 25.313 -10.258 -6.467 978 HB2 GLU 121 HB2 GLU 121 25.264 -7.795 -7.337 979 HB3 GLU 121 HB3 GLU 121 24.594 -7.426 -5.743 980 HG2 GLU 121 HG2 GLU 121 26.628 -7.866 -4.702 981 HG3 GLU 121 HG3 GLU 121 27.070 -9.129 -5.869 982 H VAL 122 H VAL 122 22.543 -8.302 -5.256 983 HA VAL 122 HA VAL 122 22.487 -9.044 -2.617 984 HB VAL 122 HB VAL 122 21.091 -7.405 -4.127 985 HG11 VAL 122 HG11 VAL 122 19.675 -8.936 -5.337 986 HG12 VAL 122 HG12 VAL 122 19.129 -9.706 -3.820 987 HG13 VAL 122 HG13 VAL 122 18.662 -8.066 -4.185 988 HG21 VAL 122 HG21 VAL 122 19.553 -7.129 -2.130 989 HG22 VAL 122 HG22 VAL 122 20.380 -8.561 -1.464 990 HG23 VAL 122 HG23 VAL 122 21.308 -7.127 -1.824 991 H ARG 123 H ARG 123 21.415 -11.004 -5.267 992 HA ARG 123 HA ARG 123 19.861 -12.960 -3.845 993 HB2 ARG 123 HB2 ARG 123 21.719 -13.414 -6.224 994 HB3 ARG 123 HB3 ARG 123 20.514 -14.561 -5.627 995 HG2 ARG 123 HG2 ARG 123 18.722 -12.857 -6.105 996 HG3 ARG 123 HG3 ARG 123 19.972 -11.815 -6.820 997 HD2 ARG 123 HD2 ARG 123 20.366 -14.341 -8.036 998 HD3 ARG 123 HD3 ARG 123 18.606 -14.162 -7.946 999 HE ARG 123 HE ARG 123 19.519 -11.719 -8.876 1000 HH11 ARG 123 HH11 ARG 123 19.938 -15.100 -9.997 1001 HH12 ARG 123 HH12 ARG 123 19.953 -14.664 -11.667 1002 HH21 ARG 123 HH21 ARG 123 19.569 -11.189 -11.151 1003 HH22 ARG 123 HH22 ARG 123 19.805 -12.456 -12.307 1004 H ARG 124 H ARG 124 23.288 -12.318 -3.627 1005 HA ARG 124 HA ARG 124 23.519 -14.408 -1.660 1006 HB2 ARG 124 HB2 ARG 124 25.620 -15.332 -2.751 1007 HB3 ARG 124 HB3 ARG 124 24.157 -15.665 -3.633 1008 HG2 ARG 124 HG2 ARG 124 25.718 -13.198 -4.340 1009 HG3 ARG 124 HG3 ARG 124 26.363 -14.761 -4.816 1010 HD2 ARG 124 HD2 ARG 124 23.815 -15.011 -5.804 1011 HD3 ARG 124 HD3 ARG 124 24.009 -13.267 -5.952 1012 HE ARG 124 HE ARG 124 25.750 -13.521 -7.447 1013 HH11 ARG 124 HH11 ARG 124 24.800 -16.783 -6.348 1014 HH12 ARG 124 HH12 ARG 124 25.494 -17.581 -7.710 1015 HH21 ARG 124 HH21 ARG 124 26.363 -14.543 -9.342 1016 HH22 ARG 124 HH22 ARG 124 26.428 -16.267 -9.494 1017 H LYS 125 H LYS 125 23.525 -11.548 -1.522 1018 HA LYS 125 HA LYS 125 26.301 -11.075 -0.518 1019 HB2 LYS 125 HB2 LYS 125 24.610 -9.690 -2.597 1020 HB3 LYS 125 HB3 LYS 125 25.811 -8.822 -1.764 1021 HG2 LYS 125 HG2 LYS 125 26.550 -11.467 -3.068 1022 HG3 LYS 125 HG3 LYS 125 26.386 -10.049 -4.045 1023 HD2 LYS 125 HD2 LYS 125 28.467 -9.359 -3.533 1024 HD3 LYS 125 HD3 LYS 125 28.026 -9.264 -1.839 1025 HE2 LYS 125 HE2 LYS 125 29.570 -10.791 -1.506 1026 HE3 LYS 125 HE3 LYS 125 28.336 -11.945 -2.005 1027 HZ1 LYS 125 HZ1 LYS 125 29.300 -11.883 -4.242 1028 HZ2 LYS 125 HZ2 LYS 125 30.379 -10.729 -3.780 1029 HZ3 LYS 125 HZ3 LYS 125 30.437 -12.246 -3.111 Start of MODEL 9 1 H1 MET 1 H1 MET 1 -21.828 9.137 10.157 2 HA MET 1 HA MET 1 -19.658 9.666 11.102 3 HB2 MET 1 HB2 MET 1 -20.390 7.463 13.091 4 HB3 MET 1 HB3 MET 1 -18.776 8.149 12.898 5 HG2 MET 1 HG2 MET 1 -19.821 9.187 14.781 6 HG3 MET 1 HG3 MET 1 -19.613 10.384 13.505 7 HE1 MET 1 HE1 MET 1 -21.430 10.688 16.163 8 HE2 MET 1 HE2 MET 1 -21.230 11.988 14.964 9 HE3 MET 1 HE3 MET 1 -22.857 11.505 15.492 10 H GLY 2 H GLY 2 -17.744 8.485 10.304 11 HA2 GLY 2 HA2 GLY 2 -17.047 6.250 9.330 12 HA3 GLY 2 HA3 GLY 2 -18.573 6.346 8.429 13 H SER 3 H SER 3 -15.560 6.658 7.735 14 HA SER 3 HA SER 3 -15.988 8.310 5.495 15 HB2 SER 3 HB2 SER 3 -13.888 9.218 7.524 16 HB3 SER 3 HB3 SER 3 -13.996 9.790 5.857 17 HG SER 3 HG SER 3 -16.397 9.979 7.109 18 H ASP 4 H ASP 4 -14.056 8.010 4.069 19 HA ASP 4 HA ASP 4 -12.634 5.433 4.686 20 HB2 ASP 4 HB2 ASP 4 -14.064 6.257 2.127 21 HB3 ASP 4 HB3 ASP 4 -12.963 4.889 2.262 22 H LYS 5 H LYS 5 -12.819 8.015 2.227 23 HA LYS 5 HA LYS 5 -11.314 9.037 0.960 24 HB2 LYS 5 HB2 LYS 5 -9.626 9.227 3.464 25 HB3 LYS 5 HB3 LYS 5 -9.529 10.207 1.995 26 HG2 LYS 5 HG2 LYS 5 -12.126 10.688 2.534 27 HG3 LYS 5 HG3 LYS 5 -11.628 10.214 4.174 28 HD2 LYS 5 HD2 LYS 5 -9.649 11.847 3.793 29 HD3 LYS 5 HD3 LYS 5 -10.580 12.436 2.407 30 HE2 LYS 5 HE2 LYS 5 -12.437 13.064 3.918 31 HE3 LYS 5 HE3 LYS 5 -11.511 12.451 5.299 32 HZ1 LYS 5 HZ1 LYS 5 -10.703 14.668 3.519 33 HZ2 LYS 5 HZ2 LYS 5 -11.120 14.806 5.111 34 HZ3 LYS 5 HZ3 LYS 5 -9.744 14.004 4.675 35 H ILE 6 H ILE 6 -11.306 6.852 0.032 36 HA ILE 6 HA ILE 6 -8.526 5.791 -0.198 37 HB ILE 6 HB ILE 6 -11.213 4.469 -0.789 38 HG12 ILE 6 HG12 ILE 6 -9.097 3.777 1.301 39 HG13 ILE 6 HG13 ILE 6 -10.627 4.589 1.646 40 HG21 ILE 6 HG21 ILE 6 -9.944 2.493 -1.442 41 HG22 ILE 6 HG22 ILE 6 -9.407 3.838 -2.430 42 HG23 ILE 6 HG23 ILE 6 -8.408 3.304 -1.062 43 HD11 ILE 6 HD11 ILE 6 -10.250 1.742 0.688 44 HD12 ILE 6 HD12 ILE 6 -10.998 2.318 2.181 45 HD13 ILE 6 HD13 ILE 6 -11.823 2.585 0.643 46 H HIS 7 H HIS 7 -7.721 7.198 -1.789 47 HA HIS 7 HA HIS 7 -8.733 6.605 -4.400 48 HB2 HIS 7 HB2 HIS 7 -10.241 8.510 -3.894 49 HB3 HIS 7 HB3 HIS 7 -8.845 9.519 -3.510 50 HD1 HIS 7 HD1 HIS 7 -8.201 7.417 -6.561 51 HD2 HIS 7 HD2 HIS 7 -10.027 11.083 -5.559 52 HE1 HIS 7 HE1 HIS 7 -8.084 8.841 -8.622 53 H HIS 8 H HIS 8 -6.846 6.208 -5.512 54 HA HIS 8 HA HIS 8 -4.694 8.190 -5.416 55 HB2 HIS 8 HB2 HIS 8 -3.727 6.792 -3.808 56 HB3 HIS 8 HB3 HIS 8 -4.406 5.326 -4.519 57 HD1 HIS 8 HD1 HIS 8 -1.903 7.988 -6.064 58 HD2 HIS 8 HD2 HIS 8 -2.662 3.846 -5.567 59 HE1 HIS 8 HE1 HIS 8 -0.136 6.782 -7.368 60 H HIS 9 H HIS 9 -4.424 8.703 -7.538 61 HA HIS 9 HA HIS 9 -3.821 6.733 -9.517 62 HB2 HIS 9 HB2 HIS 9 -6.376 6.772 -9.551 63 HB3 HIS 9 HB3 HIS 9 -6.283 8.481 -9.941 64 HD1 HIS 9 HD1 HIS 9 -4.092 5.791 -11.791 65 HD2 HIS 9 HD2 HIS 9 -7.513 8.255 -12.238 66 HE1 HIS 9 HE1 HIS 9 -4.869 5.545 -14.183 67 H HIS 10 H HIS 10 -3.068 7.998 -11.566 68 HA HIS 10 HA HIS 10 -1.805 9.560 -12.483 69 HB2 HIS 10 HB2 HIS 10 -4.075 11.076 -11.357 70 HB3 HIS 10 HB3 HIS 10 -2.676 12.060 -11.600 71 HD1 HIS 10 HD1 HIS 10 -2.463 13.045 -14.033 72 HD2 HIS 10 HD2 HIS 10 -4.718 9.552 -13.519 73 HE1 HIS 10 HE1 HIS 10 -3.466 12.535 -16.310 74 H HIS 11 H HIS 11 -0.538 11.689 -12.056 75 HA HIS 11 HA HIS 11 1.324 12.565 -11.304 76 HB2 HIS 11 HB2 HIS 11 -0.472 13.261 -9.633 77 HB3 HIS 11 HB3 HIS 11 0.328 12.172 -8.496 78 HD1 HIS 11 HD1 HIS 11 1.449 15.063 -10.884 79 HD2 HIS 11 HD2 HIS 11 2.196 13.335 -7.123 80 HE1 HIS 11 HE1 HIS 11 3.307 16.455 -9.803 81 H HIS 12 H HIS 12 1.525 9.707 -11.745 82 HA HIS 12 HA HIS 12 3.784 8.901 -10.002 83 HB2 HIS 12 HB2 HIS 12 2.733 7.747 -12.622 84 HB3 HIS 12 HB3 HIS 12 4.015 7.070 -11.639 85 HD1 HIS 12 HD1 HIS 12 3.064 6.276 -8.965 86 HD2 HIS 12 HD2 HIS 12 0.364 6.802 -12.173 87 HE1 HIS 12 HE1 HIS 12 1.063 4.811 -8.482 88 H MET 13 H MET 13 5.943 9.181 -10.602 89 HA MET 13 HA MET 13 6.710 10.159 -13.281 90 HB2 MET 13 HB2 MET 13 6.931 11.691 -10.717 91 HB3 MET 13 HB3 MET 13 8.401 11.627 -11.691 92 HG2 MET 13 HG2 MET 13 5.744 12.319 -12.910 93 HG3 MET 13 HG3 MET 13 6.752 13.551 -12.144 94 HE1 MET 13 HE1 MET 13 9.713 14.046 -14.501 95 HE2 MET 13 HE2 MET 13 8.702 14.719 -13.205 96 HE3 MET 13 HE3 MET 13 9.653 13.244 -12.917 97 H PHE 14 H PHE 14 7.969 8.499 -13.907 98 HA PHE 14 HA PHE 14 8.969 6.521 -13.777 99 HB2 PHE 14 HB2 PHE 14 11.111 8.181 -12.449 100 HB3 PHE 14 HB3 PHE 14 11.273 6.784 -13.503 101 HD1 PHE 14 HD1 PHE 14 10.849 6.973 -15.950 102 HD2 PHE 14 HD2 PHE 14 10.845 10.409 -13.336 103 HE1 PHE 14 HE1 PHE 14 11.369 8.453 -17.881 104 HE2 PHE 14 HE2 PHE 14 11.343 11.873 -15.261 105 HZ PHE 14 HZ PHE 14 11.683 10.878 -17.527 106 HA PRO 15 HA PRO 15 8.266 5.642 -9.240 107 HB2 PRO 15 HB2 PRO 15 6.051 4.128 -9.285 108 HB3 PRO 15 HB3 PRO 15 5.926 5.890 -9.549 109 HG2 PRO 15 HG2 PRO 15 6.128 3.745 -11.708 110 HG3 PRO 15 HG3 PRO 15 4.851 4.986 -11.533 111 HD2 PRO 15 HD2 PRO 15 7.028 5.397 -13.128 112 HD3 PRO 15 HD3 PRO 15 6.348 6.731 -12.147 113 H TYR 16 H TYR 16 7.454 3.061 -8.609 114 HA TYR 16 HA TYR 16 9.815 1.706 -8.917 115 HB2 TYR 16 HB2 TYR 16 8.892 0.112 -7.499 116 HB3 TYR 16 HB3 TYR 16 7.924 1.521 -7.150 117 HD1 TYR 16 HD1 TYR 16 8.115 -1.891 -8.552 118 HD2 TYR 16 HD2 TYR 16 5.515 1.473 -7.706 119 HE1 TYR 16 HE1 TYR 16 6.155 -3.320 -8.846 120 HE2 TYR 16 HE2 TYR 16 3.567 -0.016 -7.855 121 HH TYR 16 HH TYR 16 2.993 -2.498 -7.742 122 H LYS 17 H LYS 17 10.039 -0.639 -9.615 123 HA LYS 17 HA LYS 17 8.551 -1.387 -12.024 124 HB2 LYS 17 HB2 LYS 17 10.355 -1.572 -13.526 125 HB3 LYS 17 HB3 LYS 17 10.472 0.058 -12.826 126 HG2 LYS 17 HG2 LYS 17 12.242 -0.559 -11.409 127 HG3 LYS 17 HG3 LYS 17 12.106 -2.281 -11.845 128 HD2 LYS 17 HD2 LYS 17 13.968 -1.609 -12.992 129 HD3 LYS 17 HD3 LYS 17 12.708 -1.522 -14.222 130 HE2 LYS 17 HE2 LYS 17 12.916 1.000 -12.737 131 HE3 LYS 17 HE3 LYS 17 14.517 0.494 -13.310 132 HZ1 LYS 17 HZ1 LYS 17 13.204 1.882 -14.922 133 HZ2 LYS 17 HZ2 LYS 17 13.751 0.431 -15.498 134 HZ3 LYS 17 HZ3 LYS 17 12.183 0.596 -15.103 135 H ILE 18 H ILE 18 9.428 -3.698 -12.722 136 HA ILE 18 HA ILE 18 10.563 -5.204 -10.434 137 HB ILE 18 HB ILE 18 8.033 -5.901 -11.971 138 HG12 ILE 18 HG12 ILE 18 8.519 -5.507 -8.989 139 HG13 ILE 18 HG13 ILE 18 7.652 -4.419 -10.079 140 HG21 ILE 18 HG21 ILE 18 9.462 -7.918 -11.773 141 HG22 ILE 18 HG22 ILE 18 9.633 -7.652 -10.024 142 HG23 ILE 18 HG23 ILE 18 8.067 -8.068 -10.759 143 HD11 ILE 18 HD11 ILE 18 5.959 -5.626 -8.922 144 HD12 ILE 18 HD12 ILE 18 6.022 -6.322 -10.545 145 HD13 ILE 18 HD13 ILE 18 6.767 -7.173 -9.172 146 H VAL 19 H VAL 19 12.521 -5.806 -11.294 147 HA VAL 19 HA VAL 19 12.739 -6.547 -14.138 148 HB VAL 19 HB VAL 19 15.082 -6.668 -13.696 149 HG11 VAL 19 HG11 VAL 19 14.200 -4.458 -14.327 150 HG12 VAL 19 HG12 VAL 19 14.004 -4.019 -12.616 151 HG13 VAL 19 HG13 VAL 19 15.616 -4.297 -13.285 152 HG21 VAL 19 HG21 VAL 19 15.056 -7.371 -11.284 153 HG22 VAL 19 HG22 VAL 19 16.174 -6.040 -11.624 154 HG23 VAL 19 HG23 VAL 19 14.623 -5.707 -10.857 155 H ASP 20 H ASP 20 14.323 -8.725 -13.965 156 HA ASP 20 HA ASP 20 13.045 -10.797 -14.252 157 HB2 ASP 20 HB2 ASP 20 15.685 -10.385 -13.265 158 HB3 ASP 20 HB3 ASP 20 15.084 -11.784 -12.405 159 H ASP 21 H ASP 21 14.141 -10.762 -10.864 160 HA ASP 21 HA ASP 21 11.511 -11.488 -9.831 161 HB2 ASP 21 HB2 ASP 21 12.496 -13.227 -8.502 162 HB3 ASP 21 HB3 ASP 21 12.807 -13.551 -10.209 163 H VAL 22 H VAL 22 13.262 -9.014 -9.961 164 HA VAL 22 HA VAL 22 13.300 -8.425 -7.057 165 HB VAL 22 HB VAL 22 15.638 -7.408 -8.829 166 HG11 VAL 22 HG11 VAL 22 15.141 -7.452 -5.860 167 HG12 VAL 22 HG12 VAL 22 16.674 -7.165 -6.606 168 HG13 VAL 22 HG13 VAL 22 15.315 -6.066 -6.935 169 HG21 VAL 22 HG21 VAL 22 17.078 -9.113 -7.670 170 HG22 VAL 22 HG22 VAL 22 15.599 -9.936 -7.101 171 HG23 VAL 22 HG23 VAL 22 15.965 -9.809 -8.829 172 H VAL 23 H VAL 23 12.631 -6.768 -6.407 173 HA VAL 23 HA VAL 23 11.008 -5.223 -8.299 174 HB VAL 23 HB VAL 23 9.671 -5.254 -6.748 175 HG11 VAL 23 HG11 VAL 23 9.276 -6.877 -5.112 176 HG12 VAL 23 HG12 VAL 23 9.675 -7.403 -6.748 177 HG13 VAL 23 HG13 VAL 23 10.890 -7.493 -5.505 178 HG21 VAL 23 HG21 VAL 23 9.890 -3.429 -5.858 179 HG22 VAL 23 HG22 VAL 23 9.553 -4.530 -4.512 180 HG23 VAL 23 HG23 VAL 23 11.240 -3.981 -4.858 181 H ILE 24 H ILE 24 11.121 -2.854 -8.244 182 HA ILE 24 HA ILE 24 13.439 -1.753 -6.736 183 HB ILE 24 HB ILE 24 12.825 -0.818 -9.520 184 HG12 ILE 24 HG12 ILE 24 13.071 -3.136 -10.062 185 HG13 ILE 24 HG13 ILE 24 14.426 -2.163 -10.630 186 HG21 ILE 24 HG21 ILE 24 15.110 -0.094 -9.480 187 HG22 ILE 24 HG22 ILE 24 14.280 0.402 -8.001 188 HG23 ILE 24 HG23 ILE 24 15.389 -0.956 -7.933 189 HD11 ILE 24 HD11 ILE 24 15.801 -3.661 -9.756 190 HD12 ILE 24 HD12 ILE 24 15.183 -3.198 -8.147 191 HD13 ILE 24 HD13 ILE 24 14.445 -4.530 -9.007 192 H LEU 25 H LEU 25 11.971 -0.708 -5.146 193 HA LEU 25 HA LEU 25 9.952 1.136 -6.068 194 HB2 LEU 25 HB2 LEU 25 11.421 0.939 -3.435 195 HB3 LEU 25 HB3 LEU 25 10.109 2.038 -3.825 196 HG LEU 25 HG LEU 25 8.950 0.448 -2.751 197 HD11 LEU 25 HD11 LEU 25 8.865 -1.021 -5.420 198 HD12 LEU 25 HD12 LEU 25 7.611 -0.905 -4.180 199 HD13 LEU 25 HD13 LEU 25 8.028 0.511 -5.137 200 HD21 LEU 25 HD21 LEU 25 10.566 -1.781 -3.931 201 HD22 LEU 25 HD22 LEU 25 10.800 -1.066 -2.310 202 HD23 LEU 25 HD23 LEU 25 9.307 -1.944 -2.694 203 H MET 26 H MET 26 10.471 3.131 -7.029 204 HA MET 26 HA MET 26 13.360 4.073 -6.879 205 HB2 MET 26 HB2 MET 26 11.423 4.371 -9.223 206 HB3 MET 26 HB3 MET 26 13.129 4.824 -9.118 207 HG2 MET 26 HG2 MET 26 13.191 2.125 -8.538 208 HG3 MET 26 HG3 MET 26 11.826 2.208 -9.622 209 HE1 MET 26 HE1 MET 26 12.718 4.637 -11.556 210 HE2 MET 26 HE2 MET 26 13.335 3.613 -12.871 211 HE3 MET 26 HE3 MET 26 11.879 3.125 -11.979 212 HA PRO 27 HA PRO 27 9.936 6.779 -5.098 213 HB2 PRO 27 HB2 PRO 27 11.131 7.754 -2.858 214 HB3 PRO 27 HB3 PRO 27 10.596 6.044 -2.979 215 HG2 PRO 27 HG2 PRO 27 13.373 7.145 -3.486 216 HG3 PRO 27 HG3 PRO 27 12.910 5.792 -2.409 217 HD2 PRO 27 HD2 PRO 27 13.748 5.425 -4.983 218 HD3 PRO 27 HD3 PRO 27 12.541 4.352 -4.266 219 H ASN 28 H ASN 28 9.770 9.106 -4.539 220 HA ASN 28 HA ASN 28 11.834 10.920 -5.616 221 HB2 ASN 28 HB2 ASN 28 9.942 12.017 -7.074 222 HB3 ASN 28 HB3 ASN 28 10.839 10.644 -7.653 223 HD21 ASN 28 HD21 ASN 28 7.408 11.518 -6.530 224 HD22 ASN 28 HD22 ASN 28 6.909 9.894 -6.955 225 H LYS 29 H LYS 29 8.678 12.240 -5.510 226 HA LYS 29 HA LYS 29 9.104 13.321 -2.751 227 HB2 LYS 29 HB2 LYS 29 7.564 14.382 -5.156 228 HB3 LYS 29 HB3 LYS 29 7.279 14.954 -3.525 229 HG2 LYS 29 HG2 LYS 29 8.785 16.508 -4.183 230 HG3 LYS 29 HG3 LYS 29 9.821 15.367 -3.348 231 HD2 LYS 29 HD2 LYS 29 10.940 16.075 -5.303 232 HD3 LYS 29 HD3 LYS 29 10.468 14.408 -5.624 233 HE2 LYS 29 HE2 LYS 29 8.865 15.027 -7.209 234 HE3 LYS 29 HE3 LYS 29 8.511 16.552 -6.398 235 HZ1 LYS 29 HZ1 LYS 29 10.855 15.971 -8.090 236 HZ2 LYS 29 HZ2 LYS 29 9.644 17.019 -8.408 237 HZ3 LYS 29 HZ3 LYS 29 10.688 17.359 -7.189 238 H GLU 30 H GLU 30 7.655 10.730 -3.987 239 HA GLU 30 HA GLU 30 4.960 11.048 -3.034 240 HB2 GLU 30 HB2 GLU 30 4.684 8.710 -3.735 241 HB3 GLU 30 HB3 GLU 30 5.374 9.778 -4.953 242 HG2 GLU 30 HG2 GLU 30 7.651 8.897 -4.374 243 HG3 GLU 30 HG3 GLU 30 6.887 7.726 -3.323 244 H LEU 31 H LEU 31 7.698 10.706 -1.218 245 HA LEU 31 HA LEU 31 6.904 8.576 0.593 246 HB2 LEU 31 HB2 LEU 31 9.163 10.598 0.837 247 HB3 LEU 31 HB3 LEU 31 8.936 9.145 1.802 248 HG LEU 31 HG LEU 31 9.730 9.368 -1.114 249 HD11 LEU 31 HD11 LEU 31 11.479 9.510 0.653 250 HD12 LEU 31 HD12 LEU 31 10.985 7.921 1.263 251 HD13 LEU 31 HD13 LEU 31 11.674 8.075 -0.367 252 HD21 LEU 31 HD21 LEU 31 9.699 6.783 -1.050 253 HD22 LEU 31 HD22 LEU 31 8.610 6.952 0.328 254 HD23 LEU 31 HD23 LEU 31 8.150 7.604 -1.262 255 H ASN 32 H ASN 32 5.204 11.004 0.280 256 HA ASN 32 HA ASN 32 4.656 12.551 2.486 257 HB2 ASN 32 HB2 ASN 32 2.612 10.698 1.191 258 HB3 ASN 32 HB3 ASN 32 2.307 12.216 2.012 259 HD21 ASN 32 HD21 ASN 32 3.734 10.777 -1.002 260 HD22 ASN 32 HD22 ASN 32 3.416 12.245 -1.915 261 H ILE 33 H ILE 33 4.188 12.115 4.665 262 HA ILE 33 HA ILE 33 4.824 9.755 5.911 263 HB ILE 33 HB ILE 33 4.502 12.093 6.801 264 HG12 ILE 33 HG12 ILE 33 3.626 9.681 8.428 265 HG13 ILE 33 HG13 ILE 33 5.269 10.271 8.128 266 HG21 ILE 33 HG21 ILE 33 2.082 12.354 6.186 267 HG22 ILE 33 HG22 ILE 33 1.705 11.126 7.436 268 HG23 ILE 33 HG23 ILE 33 2.459 12.661 7.888 269 HD11 ILE 33 HD11 ILE 33 4.605 12.438 9.286 270 HD12 ILE 33 HD12 ILE 33 3.100 11.608 9.777 271 HD13 ILE 33 HD13 ILE 33 4.667 11.017 10.334 272 H GLU 34 H GLU 34 1.593 10.617 4.605 273 HA GLU 34 HA GLU 34 0.149 8.440 5.787 274 HB2 GLU 34 HB2 GLU 34 -0.380 10.146 3.310 275 HB3 GLU 34 HB3 GLU 34 -1.524 8.969 3.966 276 HG2 GLU 34 HG2 GLU 34 -1.524 10.197 6.141 277 HG3 GLU 34 HG3 GLU 34 -0.445 11.409 5.435 278 H ASN 35 H ASN 35 1.952 8.762 2.755 279 HA ASN 35 HA ASN 35 1.240 6.110 1.707 280 HB2 ASN 35 HB2 ASN 35 1.952 7.736 0.080 281 HB3 ASN 35 HB3 ASN 35 3.438 8.068 0.980 282 HD21 ASN 35 HD21 ASN 35 4.941 7.407 -0.609 283 HD22 ASN 35 HD22 ASN 35 5.020 5.745 -1.205 284 H ALA 36 H ALA 36 3.948 7.660 3.523 285 HA ALA 36 HA ALA 36 5.606 5.450 3.749 286 HB1 ALA 36 HB1 ALA 36 6.292 7.667 4.462 287 HB2 ALA 36 HB2 ALA 36 5.162 7.595 5.837 288 HB3 ALA 36 HB3 ALA 36 6.499 6.459 5.766 289 H HIS 37 H HIS 37 2.819 6.250 5.980 290 HA HIS 37 HA HIS 37 3.389 3.982 7.616 291 HB2 HIS 37 HB2 HIS 37 1.800 5.851 8.288 292 HB3 HIS 37 HB3 HIS 37 0.619 5.166 7.190 293 HD1 HIS 37 HD1 HIS 37 -0.991 4.601 9.303 294 HD2 HIS 37 HD2 HIS 37 2.804 2.765 9.352 295 HE1 HIS 37 HE1 HIS 37 -1.123 2.709 11.000 296 H LEU 38 H LEU 38 1.311 4.250 4.624 297 HA LEU 38 HA LEU 38 0.422 1.518 4.989 298 HB2 LEU 38 HB2 LEU 38 -1.140 1.988 3.458 299 HB3 LEU 38 HB3 LEU 38 -0.803 3.613 3.999 300 HG LEU 38 HG LEU 38 0.957 3.506 1.921 301 HD11 LEU 38 HD11 LEU 38 0.070 1.071 1.540 302 HD12 LEU 38 HD12 LEU 38 -1.374 1.850 0.932 303 HD13 LEU 38 HD13 LEU 38 0.183 2.162 0.135 304 HD21 LEU 38 HD21 LEU 38 -0.806 4.552 0.528 305 HD22 LEU 38 HD22 LEU 38 -2.030 4.050 1.701 306 HD23 LEU 38 HD23 LEU 38 -0.776 5.217 2.164 307 H PHE 39 H PHE 39 3.180 3.077 3.628 308 HA PHE 39 HA PHE 39 3.931 1.775 1.454 309 HB2 PHE 39 HB2 PHE 39 5.113 3.528 2.954 310 HB3 PHE 39 HB3 PHE 39 5.917 2.179 3.714 311 HD1 PHE 39 HD1 PHE 39 5.345 3.924 0.472 312 HD2 PHE 39 HD2 PHE 39 7.972 1.341 2.735 313 HE1 PHE 39 HE1 PHE 39 7.178 4.516 -1.053 314 HE2 PHE 39 HE2 PHE 39 9.783 1.810 1.099 315 HZ PHE 39 HZ PHE 39 9.424 3.436 -0.758 316 H LYS 40 H LYS 40 4.389 0.504 4.749 317 HA LYS 40 HA LYS 40 5.639 -1.967 3.897 318 HB2 LYS 40 HB2 LYS 40 6.066 -1.055 6.053 319 HB3 LYS 40 HB3 LYS 40 4.369 -1.058 6.507 320 HG2 LYS 40 HG2 LYS 40 5.844 -3.640 5.839 321 HG3 LYS 40 HG3 LYS 40 6.035 -2.863 7.398 322 HD2 LYS 40 HD2 LYS 40 3.323 -2.855 7.323 323 HD3 LYS 40 HD3 LYS 40 3.610 -4.225 6.252 324 HE2 LYS 40 HE2 LYS 40 3.307 -5.039 8.487 325 HE3 LYS 40 HE3 LYS 40 5.002 -5.286 8.047 326 HZ1 LYS 40 HZ1 LYS 40 4.075 -2.972 9.653 327 HZ2 LYS 40 HZ2 LYS 40 4.587 -4.392 10.294 328 HZ3 LYS 40 HZ3 LYS 40 5.622 -3.457 9.421 329 H LYS 41 H LYS 41 2.208 -1.032 4.453 330 HA LYS 41 HA LYS 41 1.153 -3.711 4.253 331 HB2 LYS 41 HB2 LYS 41 -0.105 -1.528 5.073 332 HB3 LYS 41 HB3 LYS 41 -0.318 -1.183 3.376 333 HG2 LYS 41 HG2 LYS 41 -1.366 -3.396 3.004 334 HG3 LYS 41 HG3 LYS 41 -1.171 -3.776 4.723 335 HD2 LYS 41 HD2 LYS 41 -2.839 -2.245 5.385 336 HD3 LYS 41 HD3 LYS 41 -2.741 -1.343 3.866 337 HE2 LYS 41 HE2 LYS 41 -4.800 -2.681 3.939 338 HE3 LYS 41 HE3 LYS 41 -3.739 -3.136 2.609 339 HZ1 LYS 41 HZ1 LYS 41 -4.607 -5.061 3.560 340 HZ2 LYS 41 HZ2 LYS 41 -3.025 -5.054 3.949 341 HZ3 LYS 41 HZ3 LYS 41 -4.129 -4.673 5.099 342 H TRP 42 H TRP 42 1.612 -1.028 1.921 343 HA TRP 42 HA TRP 42 0.767 -2.391 -0.396 344 HB2 TRP 42 HB2 TRP 42 0.956 -0.086 -0.589 345 HB3 TRP 42 HB3 TRP 42 2.533 -0.034 0.160 346 HD1 TRP 42 HD1 TRP 42 1.203 -1.486 -3.263 347 HE1 TRP 42 HE1 TRP 42 2.771 -0.718 -5.076 348 HE3 TRP 42 HE3 TRP 42 4.686 0.778 -0.320 349 HZ2 TRP 42 HZ2 TRP 42 5.418 0.668 -5.232 350 HZ3 TRP 42 HZ3 TRP 42 6.716 1.711 -1.278 351 HH2 TRP 42 HH2 TRP 42 7.025 1.821 -3.754 352 H VAL 43 H VAL 43 4.250 -1.878 0.624 353 HA VAL 43 HA VAL 43 5.215 -3.634 -1.216 354 HB VAL 43 HB VAL 43 6.288 -2.907 1.524 355 HG11 VAL 43 HG11 VAL 43 7.768 -4.520 -0.598 356 HG12 VAL 43 HG12 VAL 43 8.528 -3.728 0.792 357 HG13 VAL 43 HG13 VAL 43 7.374 -5.034 1.057 358 HG21 VAL 43 HG21 VAL 43 6.189 -1.116 -0.184 359 HG22 VAL 43 HG22 VAL 43 7.862 -1.526 0.158 360 HG23 VAL 43 HG23 VAL 43 7.092 -2.118 -1.323 361 H PHE 44 H PHE 44 3.749 -4.590 1.930 362 HA PHE 44 HA PHE 44 4.459 -7.301 1.834 363 HB2 PHE 44 HB2 PHE 44 2.378 -5.658 3.224 364 HB3 PHE 44 HB3 PHE 44 2.107 -7.353 3.093 365 HD1 PHE 44 HD1 PHE 44 5.382 -5.525 3.741 366 HD2 PHE 44 HD2 PHE 44 2.345 -8.228 5.226 367 HE1 PHE 44 HE1 PHE 44 6.722 -5.933 5.778 368 HE2 PHE 44 HE2 PHE 44 3.704 -8.619 7.250 369 HZ PHE 44 HZ PHE 44 5.874 -7.482 7.540 370 H ASP 45 H ASP 45 1.455 -5.744 0.916 371 HA ASP 45 HA ASP 45 0.131 -8.054 -0.135 372 HB2 ASP 45 HB2 ASP 45 -0.895 -5.918 0.738 373 HB3 ASP 45 HB3 ASP 45 -0.450 -5.129 -0.768 374 H GLU 46 H GLU 46 1.721 -5.340 -1.756 375 HA GLU 46 HA GLU 46 1.233 -6.068 -4.440 376 HB2 GLU 46 HB2 GLU 46 1.778 -3.800 -3.326 377 HB3 GLU 46 HB3 GLU 46 3.451 -4.337 -3.306 378 HG2 GLU 46 HG2 GLU 46 3.506 -3.122 -5.162 379 HG3 GLU 46 HG3 GLU 46 3.037 -4.640 -5.934 380 H PHE 47 H PHE 47 4.003 -6.837 -2.212 381 HA PHE 47 HA PHE 47 5.151 -8.407 -4.456 382 HB2 PHE 47 HB2 PHE 47 6.903 -7.021 -2.437 383 HB3 PHE 47 HB3 PHE 47 7.330 -7.825 -3.942 384 HD1 PHE 47 HD1 PHE 47 6.856 -6.701 -6.169 385 HD2 PHE 47 HD2 PHE 47 6.334 -4.781 -2.378 386 HE1 PHE 47 HE1 PHE 47 6.960 -4.494 -7.257 387 HE2 PHE 47 HE2 PHE 47 6.247 -2.535 -3.501 388 HZ PHE 47 HZ PHE 47 6.591 -2.405 -5.943 389 H LEU 48 H LEU 48 5.468 -7.957 -0.900 390 HA LEU 48 HA LEU 48 6.945 -10.336 -0.611 391 HB2 LEU 48 HB2 LEU 48 5.224 -9.110 1.562 392 HB3 LEU 48 HB3 LEU 48 6.612 -10.169 1.780 393 HG LEU 48 HG LEU 48 6.565 -7.279 1.026 394 HD11 LEU 48 HD11 LEU 48 8.218 -8.824 3.054 395 HD12 LEU 48 HD12 LEU 48 8.096 -7.057 2.897 396 HD13 LEU 48 HD13 LEU 48 6.684 -8.002 3.405 397 HD21 LEU 48 HD21 LEU 48 8.108 -8.251 -0.632 398 HD22 LEU 48 HD22 LEU 48 8.955 -7.266 0.550 399 HD23 LEU 48 HD23 LEU 48 9.016 -9.038 0.666 400 H ASN 49 H ASN 49 3.553 -9.868 -0.597 401 HA ASN 49 HA ASN 49 2.876 -12.655 0.192 402 HB2 ASN 49 HB2 ASN 49 1.228 -10.173 -0.441 403 HB3 ASN 49 HB3 ASN 49 0.524 -11.731 -0.067 404 HD21 ASN 49 HD21 ASN 49 0.075 -9.356 1.431 405 HD22 ASN 49 HD22 ASN 49 0.595 -9.656 3.071 406 H LYS 50 H LYS 50 3.394 -10.767 -2.639 407 HA LYS 50 HA LYS 50 1.927 -12.484 -4.490 408 HB2 LYS 50 HB2 LYS 50 3.556 -10.016 -4.581 409 HB3 LYS 50 HB3 LYS 50 4.129 -11.169 -5.763 410 HG2 LYS 50 HG2 LYS 50 1.479 -11.330 -6.275 411 HG3 LYS 50 HG3 LYS 50 1.508 -9.720 -5.536 412 HD2 LYS 50 HD2 LYS 50 3.248 -8.988 -7.134 413 HD3 LYS 50 HD3 LYS 50 3.244 -10.599 -7.876 414 HE2 LYS 50 HE2 LYS 50 0.853 -10.306 -8.466 415 HE3 LYS 50 HE3 LYS 50 0.898 -8.666 -7.779 416 HZ1 LYS 50 HZ1 LYS 50 1.213 -8.646 -10.165 417 HZ2 LYS 50 HZ2 LYS 50 2.575 -8.107 -9.446 418 HZ3 LYS 50 HZ3 LYS 50 2.523 -9.627 -10.070 419 H GLY 51 H GLY 51 4.792 -12.659 -2.606 420 HA2 GLY 51 HA2 GLY 51 5.842 -14.819 -2.314 421 HA3 GLY 51 HA3 GLY 51 5.666 -15.122 -4.041 422 H TYR 52 H TYR 52 6.606 -11.868 -3.672 423 HA TYR 52 HA TYR 52 9.245 -12.421 -4.705 424 HB2 TYR 52 HB2 TYR 52 7.723 -9.950 -3.901 425 HB3 TYR 52 HB3 TYR 52 9.384 -9.840 -4.377 426 HD1 TYR 52 HD1 TYR 52 10.019 -11.019 -6.714 427 HD2 TYR 52 HD2 TYR 52 6.050 -9.788 -5.597 428 HE1 TYR 52 HE1 TYR 52 9.416 -10.869 -9.074 429 HE2 TYR 52 HE2 TYR 52 5.417 -9.642 -7.966 430 HH TYR 52 HH TYR 52 6.839 -11.172 -10.376 431 H ASN 53 H ASN 53 11.189 -12.071 -3.732 432 HA ASN 53 HA ASN 53 11.268 -11.694 -0.745 433 HB2 ASN 53 HB2 ASN 53 12.579 -13.860 -2.365 434 HB3 ASN 53 HB3 ASN 53 13.238 -13.375 -0.825 435 HD21 ASN 53 HD21 ASN 53 10.632 -12.968 0.698 436 HD22 ASN 53 HD22 ASN 53 10.043 -14.608 0.785 437 H LYS 54 H LYS 54 12.134 -9.999 -3.369 438 HA LYS 54 HA LYS 54 14.748 -9.092 -2.276 439 HB2 LYS 54 HB2 LYS 54 14.358 -10.690 -4.768 440 HB3 LYS 54 HB3 LYS 54 15.452 -9.313 -4.827 441 HG2 LYS 54 HG2 LYS 54 16.961 -10.116 -3.467 442 HG3 LYS 54 HG3 LYS 54 15.848 -10.907 -2.350 443 HD2 LYS 54 HD2 LYS 54 16.731 -12.004 -5.076 444 HD3 LYS 54 HD3 LYS 54 17.312 -12.504 -3.478 445 HE2 LYS 54 HE2 LYS 54 14.820 -12.988 -2.889 446 HE3 LYS 54 HE3 LYS 54 14.498 -12.788 -4.614 447 HZ1 LYS 54 HZ1 LYS 54 14.825 -15.057 -4.157 448 HZ2 LYS 54 HZ2 LYS 54 16.096 -14.581 -5.054 449 HZ3 LYS 54 HZ3 LYS 54 16.305 -14.825 -3.435 450 H ILE 55 H ILE 55 13.876 -7.135 -1.842 451 HA ILE 55 HA ILE 55 12.441 -5.650 -4.009 452 HB ILE 55 HB ILE 55 12.589 -5.404 -0.957 453 HG12 ILE 55 HG12 ILE 55 10.339 -5.846 -0.830 454 HG13 ILE 55 HG13 ILE 55 9.978 -5.239 -2.442 455 HG21 ILE 55 HG21 ILE 55 12.711 -3.089 -1.795 456 HG22 ILE 55 HG22 ILE 55 11.394 -3.449 -2.929 457 HG23 ILE 55 HG23 ILE 55 11.077 -3.394 -1.193 458 HD11 ILE 55 HD11 ILE 55 10.827 -7.245 -3.424 459 HD12 ILE 55 HD12 ILE 55 11.203 -7.913 -1.798 460 HD13 ILE 55 HD13 ILE 55 9.515 -7.582 -2.314 461 H PHE 56 H PHE 56 13.346 -3.639 -4.644 462 HA PHE 56 HA PHE 56 15.793 -2.794 -3.114 463 HB2 PHE 56 HB2 PHE 56 15.346 -2.536 -6.082 464 HB3 PHE 56 HB3 PHE 56 16.564 -1.613 -5.287 465 HD1 PHE 56 HD1 PHE 56 17.297 -4.128 -3.321 466 HD2 PHE 56 HD2 PHE 56 17.085 -3.516 -7.611 467 HE1 PHE 56 HE1 PHE 56 18.850 -5.993 -3.733 468 HE2 PHE 56 HE2 PHE 56 18.294 -5.582 -7.994 469 HZ PHE 56 HZ PHE 56 19.357 -6.727 -6.050 470 H LEU 57 H LEU 57 16.212 -0.527 -2.801 471 HA LEU 57 HA LEU 57 13.884 1.255 -3.353 472 HB2 LEU 57 HB2 LEU 57 13.896 0.598 -0.987 473 HB3 LEU 57 HB3 LEU 57 15.612 1.002 -0.884 474 HG LEU 57 HG LEU 57 14.987 3.428 -1.379 475 HD11 LEU 57 HD11 LEU 57 12.612 4.031 -0.893 476 HD12 LEU 57 HD12 LEU 57 12.754 3.058 -2.365 477 HD13 LEU 57 HD13 LEU 57 12.184 2.309 -0.855 478 HD21 LEU 57 HD21 LEU 57 13.920 2.032 1.104 479 HD22 LEU 57 HD22 LEU 57 15.557 2.672 0.852 480 HD23 LEU 57 HD23 LEU 57 14.184 3.779 0.959 481 H VAL 58 H VAL 58 14.655 2.559 -4.966 482 HA VAL 58 HA VAL 58 17.449 3.297 -5.000 483 HB VAL 58 HB VAL 58 17.158 3.827 -7.048 484 HG11 VAL 58 HG11 VAL 58 15.739 2.642 -8.408 485 HG12 VAL 58 HG12 VAL 58 16.276 1.684 -7.024 486 HG13 VAL 58 HG13 VAL 58 14.645 2.363 -7.043 487 HG21 VAL 58 HG21 VAL 58 16.488 5.841 -7.197 488 HG22 VAL 58 HG22 VAL 58 15.417 4.964 -8.274 489 HG23 VAL 58 HG23 VAL 58 14.840 5.516 -6.681 490 H LEU 59 H LEU 59 18.224 5.470 -5.052 491 HA LEU 59 HA LEU 59 16.731 7.355 -3.306 492 HB2 LEU 59 HB2 LEU 59 19.561 6.298 -3.098 493 HB3 LEU 59 HB3 LEU 59 18.969 7.649 -2.144 494 HG LEU 59 HG LEU 59 17.663 4.881 -2.052 495 HD11 LEU 59 HD11 LEU 59 19.927 5.858 -0.330 496 HD12 LEU 59 HD12 LEU 59 18.931 4.419 -0.029 497 HD13 LEU 59 HD13 LEU 59 19.935 4.507 -1.485 498 HD21 LEU 59 HD21 LEU 59 17.666 7.216 -0.109 499 HD22 LEU 59 HD22 LEU 59 16.315 6.726 -1.153 500 HD23 LEU 59 HD23 LEU 59 16.869 5.648 0.139 501 H SER 60 H SER 60 17.577 7.078 -6.356 502 HA SER 60 HA SER 60 19.509 9.062 -6.881 503 HB2 SER 60 HB2 SER 60 17.301 7.878 -8.628 504 HB3 SER 60 HB3 SER 60 18.642 8.871 -9.219 505 HG SER 60 HG SER 60 20.059 7.348 -8.657 506 H ASP 61 H ASP 61 15.923 9.165 -7.525 507 HA ASP 61 HA ASP 61 16.060 11.885 -8.261 508 HB2 ASP 61 HB2 ASP 61 14.304 10.250 -8.949 509 HB3 ASP 61 HB3 ASP 61 13.607 10.339 -7.321 510 H VAL 62 H VAL 62 15.102 10.325 -5.271 511 HA VAL 62 HA VAL 62 14.052 12.619 -3.914 512 HB VAL 62 HB VAL 62 13.393 10.243 -3.629 513 HG11 VAL 62 HG11 VAL 62 15.517 9.117 -3.769 514 HG12 VAL 62 HG12 VAL 62 16.075 9.854 -2.256 515 HG13 VAL 62 HG13 VAL 62 14.716 8.701 -2.256 516 HG21 VAL 62 HG21 VAL 62 12.988 10.295 -1.291 517 HG22 VAL 62 HG22 VAL 62 14.364 11.389 -1.008 518 HG23 VAL 62 HG23 VAL 62 12.930 11.953 -1.887 519 H GLU 63 H GLU 63 14.962 13.505 -1.866 520 HA GLU 63 HA GLU 63 17.894 13.901 -2.023 521 HB2 GLU 63 HB2 GLU 63 16.430 15.890 -1.951 522 HB3 GLU 63 HB3 GLU 63 15.685 15.302 -0.476 523 HG2 GLU 63 HG2 GLU 63 17.249 16.855 0.321 524 HG3 GLU 63 HG3 GLU 63 18.146 15.377 0.546 525 H SER 64 H SER 64 15.288 13.182 0.427 526 HA SER 64 HA SER 64 16.987 11.260 1.726 527 HB2 SER 64 HB2 SER 64 17.377 12.388 3.743 528 HB3 SER 64 HB3 SER 64 17.841 13.503 2.456 529 HG SER 64 HG SER 64 15.861 14.623 2.788 530 H ILE 65 H ILE 65 15.564 11.211 4.267 531 HA ILE 65 HA ILE 65 12.805 10.772 3.544 532 HB ILE 65 HB ILE 65 14.226 8.720 3.072 533 HG12 ILE 65 HG12 ILE 65 12.222 8.372 5.331 534 HG13 ILE 65 HG13 ILE 65 11.878 8.747 3.643 535 HG21 ILE 65 HG21 ILE 65 15.126 7.400 4.856 536 HG22 ILE 65 HG22 ILE 65 15.861 9.007 4.958 537 HG23 ILE 65 HG23 ILE 65 14.528 8.560 6.064 538 HD11 ILE 65 HD11 ILE 65 11.625 6.354 3.819 539 HD12 ILE 65 HD12 ILE 65 13.161 6.614 3.018 540 HD13 ILE 65 HD13 ILE 65 13.131 6.204 4.746 541 H ASP 66 H ASP 66 11.503 10.976 5.409 542 HA ASP 66 HA ASP 66 12.722 12.404 7.687 543 HB2 ASP 66 HB2 ASP 66 10.586 13.161 6.652 544 HB3 ASP 66 HB3 ASP 66 9.837 11.645 7.150 545 H SER 67 H SER 67 12.106 11.690 9.935 546 HA SER 67 HA SER 67 13.074 9.145 10.539 547 HB2 SER 67 HB2 SER 67 11.185 10.832 12.192 548 HB3 SER 67 HB3 SER 67 12.329 9.626 12.804 549 HG SER 67 HG SER 67 12.944 11.863 12.947 550 H PHE 68 H PHE 68 9.729 10.130 9.814 551 HA PHE 68 HA PHE 68 8.394 7.952 10.980 552 HB2 PHE 68 HB2 PHE 68 7.314 10.079 9.721 553 HB3 PHE 68 HB3 PHE 68 7.472 9.089 8.317 554 HD1 PHE 68 HD1 PHE 68 5.926 9.367 11.685 555 HD2 PHE 68 HD2 PHE 68 6.041 7.164 7.981 556 HE1 PHE 68 HE1 PHE 68 3.718 8.370 12.211 557 HE2 PHE 68 HE2 PHE 68 3.895 6.133 8.531 558 HZ PHE 68 HZ PHE 68 2.643 6.810 10.588 559 H SER 69 H SER 69 9.401 8.268 7.502 560 HA SER 69 HA SER 69 8.888 5.427 7.160 561 HB2 SER 69 HB2 SER 69 8.429 7.140 5.411 562 HB3 SER 69 HB3 SER 69 10.159 7.257 5.123 563 HG SER 69 HG SER 69 8.783 5.614 3.876 564 H LEU 70 H LEU 70 11.756 7.371 7.921 565 HA LEU 70 HA LEU 70 13.747 5.545 7.200 566 HB2 LEU 70 HB2 LEU 70 13.927 7.892 8.258 567 HB3 LEU 70 HB3 LEU 70 13.567 7.122 9.804 568 HG LEU 70 HG LEU 70 15.691 5.778 9.566 569 HD11 LEU 70 HD11 LEU 70 16.299 7.719 7.294 570 HD12 LEU 70 HD12 LEU 70 17.327 6.423 7.885 571 HD13 LEU 70 HD13 LEU 70 15.832 6.015 7.038 572 HD21 LEU 70 HD21 LEU 70 15.573 7.877 10.878 573 HD22 LEU 70 HD22 LEU 70 17.139 7.754 10.069 574 HD23 LEU 70 HD23 LEU 70 15.907 8.815 9.387 575 H GLY 71 H GLY 71 11.407 5.295 9.733 576 HA2 GLY 71 HA2 GLY 71 12.590 2.879 10.962 577 HA3 GLY 71 HA3 GLY 71 11.036 3.615 11.372 578 H VAL 72 H VAL 72 10.099 3.664 8.545 579 HA VAL 72 HA VAL 72 8.820 1.051 8.571 580 HB VAL 72 HB VAL 72 8.721 3.258 6.438 581 HG11 VAL 72 HG11 VAL 72 7.974 1.080 5.540 582 HG12 VAL 72 HG12 VAL 72 6.959 0.820 6.981 583 HG13 VAL 72 HG13 VAL 72 6.571 2.110 5.835 584 HG21 VAL 72 HG21 VAL 72 6.597 3.900 7.436 585 HG22 VAL 72 HG22 VAL 72 6.757 2.655 8.691 586 HG23 VAL 72 HG23 VAL 72 7.873 4.034 8.632 587 H ILE 73 H ILE 73 11.286 2.687 6.577 588 HA ILE 73 HA ILE 73 11.776 0.630 4.704 589 HB ILE 73 HB ILE 73 13.606 2.727 5.943 590 HG12 ILE 73 HG12 ILE 73 11.968 3.900 4.706 591 HG13 ILE 73 HG13 ILE 73 13.346 3.813 3.647 592 HG21 ILE 73 HG21 ILE 73 14.181 1.087 3.458 593 HG22 ILE 73 HG22 ILE 73 15.153 2.430 4.111 594 HG23 ILE 73 HG23 ILE 73 15.000 0.925 5.022 595 HD11 ILE 73 HD11 ILE 73 10.736 2.271 3.475 596 HD12 ILE 73 HD12 ILE 73 11.413 3.431 2.323 597 HD13 ILE 73 HD13 ILE 73 12.155 1.827 2.501 598 H VAL 74 H VAL 74 13.314 1.074 7.966 599 HA VAL 74 HA VAL 74 14.738 -1.406 7.809 600 HB VAL 74 HB VAL 74 13.778 0.381 10.106 601 HG11 VAL 74 HG11 VAL 74 15.269 -0.907 11.630 602 HG12 VAL 74 HG12 VAL 74 13.847 -1.812 11.093 603 HG13 VAL 74 HG13 VAL 74 15.441 -2.152 10.363 604 HG21 VAL 74 HG21 VAL 74 15.578 1.280 8.693 605 HG22 VAL 74 HG22 VAL 74 16.177 0.915 10.308 606 HG23 VAL 74 HG23 VAL 74 16.552 -0.187 8.969 607 H ASN 75 H ASN 75 11.409 -0.639 9.100 608 HA ASN 75 HA ASN 75 10.735 -3.097 10.142 609 HB2 ASN 75 HB2 ASN 75 9.400 -0.769 9.661 610 HB3 ASN 75 HB3 ASN 75 8.760 -1.688 8.327 611 HD21 ASN 75 HD21 ASN 75 9.128 -1.626 11.838 612 HD22 ASN 75 HD22 ASN 75 7.689 -2.539 12.152 613 H ILE 76 H ILE 76 10.560 -2.076 6.733 614 HA ILE 76 HA ILE 76 9.471 -4.489 5.676 615 HB ILE 76 HB ILE 76 11.065 -2.196 4.467 616 HG12 ILE 76 HG12 ILE 76 8.113 -3.010 4.343 617 HG13 ILE 76 HG13 ILE 76 8.757 -1.633 5.246 618 HG21 ILE 76 HG21 ILE 76 11.510 -4.206 3.109 619 HG22 ILE 76 HG22 ILE 76 9.759 -4.502 2.965 620 HG23 ILE 76 HG23 ILE 76 10.519 -3.065 2.235 621 HD11 ILE 76 HD11 ILE 76 7.713 -0.814 3.351 622 HD12 ILE 76 HD12 ILE 76 9.467 -0.528 3.230 623 HD13 ILE 76 HD13 ILE 76 8.683 -1.816 2.265 624 H LEU 77 H LEU 77 12.836 -3.591 6.612 625 HA LEU 77 HA LEU 77 14.021 -5.865 5.223 626 HB2 LEU 77 HB2 LEU 77 15.297 -3.784 5.720 627 HB3 LEU 77 HB3 LEU 77 15.136 -4.069 7.432 628 HG LEU 77 HG LEU 77 17.312 -4.624 6.471 629 HD11 LEU 77 HD11 LEU 77 16.490 -5.632 8.610 630 HD12 LEU 77 HD12 LEU 77 16.182 -7.132 7.688 631 HD13 LEU 77 HD13 LEU 77 17.810 -6.477 7.778 632 HD21 LEU 77 HD21 LEU 77 17.713 -6.686 5.229 633 HD22 LEU 77 HD22 LEU 77 15.978 -7.043 5.181 634 HD23 LEU 77 HD23 LEU 77 16.632 -5.625 4.319 635 H LYS 78 H LYS 78 13.090 -5.064 8.599 636 HA LYS 78 HA LYS 78 13.865 -7.499 9.809 637 HB2 LYS 78 HB2 LYS 78 11.424 -5.791 10.485 638 HB3 LYS 78 HB3 LYS 78 12.141 -7.033 11.516 639 HG2 LYS 78 HG2 LYS 78 14.277 -5.711 11.521 640 HG3 LYS 78 HG3 LYS 78 13.455 -4.438 10.611 641 HD2 LYS 78 HD2 LYS 78 11.922 -4.031 12.442 642 HD3 LYS 78 HD3 LYS 78 12.452 -5.470 13.315 643 HE2 LYS 78 HE2 LYS 78 14.663 -3.603 12.661 644 HE3 LYS 78 HE3 LYS 78 13.414 -2.872 13.672 645 HZ1 LYS 78 HZ1 LYS 78 13.729 -4.577 15.300 646 HZ2 LYS 78 HZ2 LYS 78 14.826 -5.388 14.336 647 HZ3 LYS 78 HZ3 LYS 78 15.207 -3.937 14.937 648 H SER 79 H SER 79 10.794 -6.661 8.264 649 HA SER 79 HA SER 79 9.480 -9.146 8.602 650 HB2 SER 79 HB2 SER 79 9.137 -7.173 6.312 651 HB3 SER 79 HB3 SER 79 7.952 -8.337 6.923 652 HG SER 79 HG SER 79 8.993 -6.002 8.210 653 H ILE 80 H ILE 80 11.325 -7.921 5.717 654 HA ILE 80 HA ILE 80 11.035 -10.272 4.172 655 HB ILE 80 HB ILE 80 12.902 -7.890 4.205 656 HG12 ILE 80 HG12 ILE 80 10.699 -8.856 2.309 657 HG13 ILE 80 HG13 ILE 80 10.473 -7.669 3.586 658 HG21 ILE 80 HG21 ILE 80 12.969 -9.894 1.922 659 HG22 ILE 80 HG22 ILE 80 13.968 -8.439 2.179 660 HG23 ILE 80 HG23 ILE 80 14.194 -9.804 3.213 661 HD11 ILE 80 HD11 ILE 80 10.729 -6.340 1.707 662 HD12 ILE 80 HD12 ILE 80 12.377 -6.337 2.386 663 HD13 ILE 80 HD13 ILE 80 11.952 -7.389 1.011 664 H SER 81 H SER 81 13.624 -9.319 6.456 665 HA SER 81 HA SER 81 15.234 -11.644 5.996 666 HB2 SER 81 HB2 SER 81 15.962 -9.405 6.870 667 HB3 SER 81 HB3 SER 81 15.128 -9.756 8.386 668 HG SER 81 HG SER 81 16.541 -11.775 8.273 669 H SER 82 H SER 82 12.219 -11.278 7.657 670 HA SER 82 HA SER 82 12.619 -13.643 9.375 671 HB2 SER 82 HB2 SER 82 11.123 -11.553 9.896 672 HB3 SER 82 HB3 SER 82 10.004 -12.245 8.735 673 HG SER 82 HG SER 82 9.711 -13.970 9.986 674 H SER 83 H SER 83 10.801 -12.551 6.427 675 HA SER 83 HA SER 83 9.624 -14.990 5.728 676 HB2 SER 83 HB2 SER 83 10.717 -12.793 3.914 677 HB3 SER 83 HB3 SER 83 9.691 -14.123 3.403 678 HG SER 83 HG SER 83 8.216 -12.682 3.862 679 H GLY 84 H GLY 84 12.843 -13.718 4.728 680 HA2 GLY 84 HA2 GLY 84 14.592 -15.655 4.535 681 HA3 GLY 84 HA3 GLY 84 13.386 -16.325 3.421 682 H GLY 85 H GLY 85 13.714 -12.729 3.397 683 HA2 GLY 85 HA2 GLY 85 14.791 -13.013 0.676 684 HA3 GLY 85 HA3 GLY 85 13.658 -11.817 1.292 685 H PHE 86 H PHE 86 15.515 -10.777 0.050 686 HA PHE 86 HA PHE 86 17.535 -9.599 1.888 687 HB2 PHE 86 HB2 PHE 86 18.049 -11.348 -0.458 688 HB3 PHE 86 HB3 PHE 86 18.908 -9.827 -0.480 689 HD1 PHE 86 HD1 PHE 86 18.282 -12.627 1.982 690 HD2 PHE 86 HD2 PHE 86 20.930 -9.548 0.559 691 HE1 PHE 86 HE1 PHE 86 19.942 -13.261 3.695 692 HE2 PHE 86 HE2 PHE 86 22.543 -10.098 2.391 693 HZ PHE 86 HZ PHE 86 22.069 -11.980 3.913 694 H PHE 87 H PHE 87 17.043 -7.500 1.841 695 HA PHE 87 HA PHE 87 15.975 -6.258 -0.644 696 HB2 PHE 87 HB2 PHE 87 14.294 -6.052 0.925 697 HB3 PHE 87 HB3 PHE 87 15.395 -6.030 2.285 698 HD1 PHE 87 HD1 PHE 87 15.174 -3.730 -0.748 699 HD2 PHE 87 HD2 PHE 87 14.897 -4.199 3.550 700 HE1 PHE 87 HE1 PHE 87 14.880 -1.327 -0.484 701 HE2 PHE 87 HE2 PHE 87 14.626 -1.755 3.824 702 HZ PHE 87 HZ PHE 87 14.616 -0.295 1.768 703 H ALA 88 H ALA 88 17.064 -4.350 -1.395 704 HA ALA 88 HA ALA 88 19.372 -3.385 0.169 705 HB1 ALA 88 HB1 ALA 88 19.752 -4.021 -2.762 706 HB2 ALA 88 HB2 ALA 88 20.937 -3.635 -1.515 707 HB3 ALA 88 HB3 ALA 88 20.118 -5.219 -1.503 708 H LEU 89 H LEU 89 20.387 -1.385 -1.053 709 HA LEU 89 HA LEU 89 18.163 0.205 -2.199 710 HB2 LEU 89 HB2 LEU 89 20.217 1.783 -0.811 711 HB3 LEU 89 HB3 LEU 89 18.501 2.006 -0.899 712 HG LEU 89 HG LEU 89 20.009 0.209 0.989 713 HD11 LEU 89 HD11 LEU 89 20.032 2.700 1.388 714 HD12 LEU 89 HD12 LEU 89 18.260 2.646 1.536 715 HD13 LEU 89 HD13 LEU 89 19.298 1.771 2.696 716 HD21 LEU 89 HD21 LEU 89 17.680 0.090 2.170 717 HD22 LEU 89 HD22 LEU 89 17.085 0.318 0.494 718 HD23 LEU 89 HD23 LEU 89 18.143 -1.035 0.907 719 H VAL 90 H VAL 90 19.050 2.224 -3.400 720 HA VAL 90 HA VAL 90 21.468 1.458 -4.959 721 HB VAL 90 HB VAL 90 18.664 2.048 -6.001 722 HG11 VAL 90 HG11 VAL 90 19.771 1.349 -8.232 723 HG12 VAL 90 HG12 VAL 90 19.948 2.990 -7.614 724 HG13 VAL 90 HG13 VAL 90 21.295 1.848 -7.413 725 HG21 VAL 90 HG21 VAL 90 18.506 -0.143 -6.813 726 HG22 VAL 90 HG22 VAL 90 20.117 -0.577 -6.162 727 HG23 VAL 90 HG23 VAL 90 18.744 -0.201 -5.084 728 H SER 91 H SER 91 22.618 3.150 -5.680 729 HA SER 91 HA SER 91 23.477 5.187 -5.777 730 HB2 SER 91 HB2 SER 91 21.608 5.135 -7.602 731 HB3 SER 91 HB3 SER 91 20.768 6.283 -6.553 732 HG SER 91 HG SER 91 23.351 6.481 -7.740 733 HA PRO 92 HA PRO 92 21.485 6.418 -1.696 734 HB2 PRO 92 HB2 PRO 92 23.318 5.524 0.101 735 HB3 PRO 92 HB3 PRO 92 22.070 4.441 -0.580 736 HG2 PRO 92 HG2 PRO 92 24.958 4.746 -1.477 737 HG3 PRO 92 HG3 PRO 92 24.038 3.240 -1.209 738 HD2 PRO 92 HD2 PRO 92 24.337 4.328 -3.688 739 HD3 PRO 92 HD3 PRO 92 22.890 3.407 -3.173 740 H ASN 93 H ASN 93 21.756 8.527 -2.199 741 HA ASN 93 HA ASN 93 24.288 9.689 -2.695 742 HB2 ASN 93 HB2 ASN 93 23.197 11.861 -2.460 743 HB3 ASN 93 HB3 ASN 93 22.264 10.763 -3.457 744 HD21 ASN 93 HD21 ASN 93 21.269 13.223 -2.100 745 HD22 ASN 93 HD22 ASN 93 20.012 12.615 -1.013 746 H GLU 94 H GLU 94 25.370 11.287 -1.459 747 HA GLU 94 HA GLU 94 26.304 10.204 0.911 748 HB2 GLU 94 HB2 GLU 94 27.515 11.743 -0.628 749 HB3 GLU 94 HB3 GLU 94 26.503 13.076 -0.071 750 HG2 GLU 94 HG2 GLU 94 27.418 12.902 2.167 751 HG3 GLU 94 HG3 GLU 94 28.362 11.471 1.731 752 H LYS 95 H LYS 95 23.766 12.593 0.508 753 HA LYS 95 HA LYS 95 23.520 13.468 3.217 754 HB2 LYS 95 HB2 LYS 95 22.435 14.864 1.663 755 HB3 LYS 95 HB3 LYS 95 21.998 13.540 0.624 756 HG2 LYS 95 HG2 LYS 95 20.024 14.501 1.328 757 HG3 LYS 95 HG3 LYS 95 20.107 12.929 2.084 758 HD2 LYS 95 HD2 LYS 95 21.230 14.963 3.810 759 HD3 LYS 95 HD3 LYS 95 19.632 15.481 3.285 760 HE2 LYS 95 HE2 LYS 95 18.679 14.075 4.762 761 HE3 LYS 95 HE3 LYS 95 19.621 12.747 4.027 762 HZ1 LYS 95 HZ1 LYS 95 20.018 13.116 6.467 763 HZ2 LYS 95 HZ2 LYS 95 21.317 12.976 5.464 764 HZ3 LYS 95 HZ3 LYS 95 20.865 14.440 6.047 765 H VAL 96 H VAL 96 22.150 10.686 1.376 766 HA VAL 96 HA VAL 96 20.598 9.971 3.703 767 HB VAL 96 HB VAL 96 21.029 8.807 0.919 768 HG11 VAL 96 HG11 VAL 96 21.004 6.771 2.137 769 HG12 VAL 96 HG12 VAL 96 19.646 7.359 3.159 770 HG13 VAL 96 HG13 VAL 96 19.389 6.993 1.460 771 HG21 VAL 96 HG21 VAL 96 19.285 10.595 1.438 772 HG22 VAL 96 HG22 VAL 96 18.623 9.102 0.769 773 HG23 VAL 96 HG23 VAL 96 18.491 9.397 2.514 774 H GLU 97 H GLU 97 23.703 8.814 2.191 775 HA GLU 97 HA GLU 97 23.984 6.526 3.830 776 HB2 GLU 97 HB2 GLU 97 26.056 8.343 2.535 777 HB3 GLU 97 HB3 GLU 97 26.490 6.949 3.528 778 HG2 GLU 97 HG2 GLU 97 24.953 5.548 2.002 779 HG3 GLU 97 HG3 GLU 97 25.000 6.937 0.904 780 H ARG 98 H ARG 98 24.596 10.063 4.593 781 HA ARG 98 HA ARG 98 25.997 9.712 6.837 782 HB2 ARG 98 HB2 ARG 98 24.980 11.625 5.249 783 HB3 ARG 98 HB3 ARG 98 23.724 11.745 6.430 784 HG2 ARG 98 HG2 ARG 98 26.671 11.906 7.087 785 HG3 ARG 98 HG3 ARG 98 25.582 13.110 6.371 786 HD2 ARG 98 HD2 ARG 98 24.127 12.501 8.559 787 HD3 ARG 98 HD3 ARG 98 25.741 12.107 9.203 788 HE ARG 98 HE ARG 98 26.340 14.438 8.268 789 HH11 ARG 98 HH11 ARG 98 23.474 13.675 10.186 790 HH12 ARG 98 HH12 ARG 98 22.999 15.316 10.428 791 HH21 ARG 98 HH21 ARG 98 25.498 16.631 8.263 792 HH22 ARG 98 HH22 ARG 98 24.045 17.003 9.134 793 H VAL 99 H VAL 99 22.600 10.003 6.390 794 HA VAL 99 HA VAL 99 21.989 9.842 9.171 795 HB VAL 99 HB VAL 99 20.688 11.179 7.371 796 HG11 VAL 99 HG11 VAL 99 19.193 8.653 6.832 797 HG12 VAL 99 HG12 VAL 99 18.793 10.287 6.277 798 HG13 VAL 99 HG13 VAL 99 20.283 9.537 5.727 799 HG21 VAL 99 HG21 VAL 99 18.555 11.027 8.592 800 HG22 VAL 99 HG22 VAL 99 18.939 9.391 9.152 801 HG23 VAL 99 HG23 VAL 99 19.859 10.787 9.768 802 H LEU 100 H LEU 100 22.037 7.595 6.420 803 HA LEU 100 HA LEU 100 20.773 5.400 7.700 804 HB2 LEU 100 HB2 LEU 100 22.914 5.313 5.540 805 HB3 LEU 100 HB3 LEU 100 21.911 4.000 6.075 806 HG LEU 100 HG LEU 100 21.296 6.208 4.263 807 HD11 LEU 100 HD11 LEU 100 19.965 4.637 3.100 808 HD12 LEU 100 HD12 LEU 100 21.560 3.950 3.472 809 HD13 LEU 100 HD13 LEU 100 20.138 3.463 4.444 810 HD21 LEU 100 HD21 LEU 100 19.630 6.919 5.723 811 HD22 LEU 100 HD22 LEU 100 18.764 5.899 4.595 812 HD23 LEU 100 HD23 LEU 100 19.157 5.267 6.199 813 H SER 101 H SER 101 24.037 6.774 8.176 814 HA SER 101 HA SER 101 24.894 4.361 9.627 815 HB2 SER 101 HB2 SER 101 25.919 7.113 8.948 816 HB3 SER 101 HB3 SER 101 26.663 6.183 10.289 817 HG SER 101 HG SER 101 26.209 4.737 7.962 818 H LEU 102 H LEU 102 23.847 7.670 10.267 819 HA LEU 102 HA LEU 102 23.883 7.753 13.066 820 HB2 LEU 102 HB2 LEU 102 22.051 9.249 11.205 821 HB3 LEU 102 HB3 LEU 102 22.446 9.602 12.856 822 HG LEU 102 HG LEU 102 23.799 10.543 10.521 823 HD11 LEU 102 HD11 LEU 102 24.906 11.936 12.189 824 HD12 LEU 102 HD12 LEU 102 23.156 11.775 12.527 825 HD13 LEU 102 HD13 LEU 102 24.328 10.791 13.457 826 HD21 LEU 102 HD21 LEU 102 26.173 10.276 11.287 827 HD22 LEU 102 HD22 LEU 102 25.617 9.018 12.445 828 HD23 LEU 102 HD23 LEU 102 25.507 8.784 10.700 829 H THR 103 H THR 103 21.536 6.185 11.041 830 HA THR 103 HA THR 103 19.703 5.692 13.348 831 HB THR 103 HB THR 103 18.822 7.062 11.474 832 HG1 THR 103 HG1 THR 103 17.572 4.548 11.900 833 HG21 THR 103 HG21 THR 103 18.271 4.925 9.558 834 HG22 THR 103 HG22 THR 103 19.009 6.530 9.305 835 HG23 THR 103 HG23 THR 103 20.010 5.166 9.736 836 H ASN 104 H ASN 104 22.147 4.208 11.769 837 HA ASN 104 HA ASN 104 22.724 2.300 10.983 838 HB2 ASN 104 HB2 ASN 104 21.011 0.917 13.075 839 HB3 ASN 104 HB3 ASN 104 22.474 0.315 12.290 840 HD21 ASN 104 HD21 ASN 104 21.278 2.798 14.695 841 HD22 ASN 104 HD22 ASN 104 22.850 2.961 15.418 842 H LEU 105 H LEU 105 21.349 2.915 9.056 843 HA LEU 105 HA LEU 105 19.550 0.685 8.344 844 HB2 LEU 105 HB2 LEU 105 19.268 3.432 7.905 845 HB3 LEU 105 HB3 LEU 105 19.994 2.952 6.463 846 HG LEU 105 HG LEU 105 17.752 1.173 7.366 847 HD11 LEU 105 HD11 LEU 105 16.011 2.751 6.717 848 HD12 LEU 105 HD12 LEU 105 16.976 3.394 8.056 849 HD13 LEU 105 HD13 LEU 105 17.229 4.007 6.407 850 HD21 LEU 105 HD21 LEU 105 18.985 1.015 5.127 851 HD22 LEU 105 HD22 LEU 105 17.219 1.048 5.071 852 HD23 LEU 105 HD23 LEU 105 18.126 2.510 4.672 853 H ASP 106 H ASP 106 22.523 2.510 7.223 854 HA ASP 106 HA ASP 106 22.976 0.753 4.999 855 HB2 ASP 106 HB2 ASP 106 24.998 1.870 4.635 856 HB3 ASP 106 HB3 ASP 106 23.938 3.109 5.272 857 H ARG 107 H ARG 107 23.362 0.284 8.234 858 HA ARG 107 HA ARG 107 25.484 -1.756 8.016 859 HB2 ARG 107 HB2 ARG 107 25.033 -1.256 10.725 860 HB3 ARG 107 HB3 ARG 107 26.360 -0.711 9.748 861 HG2 ARG 107 HG2 ARG 107 24.867 1.392 9.233 862 HG3 ARG 107 HG3 ARG 107 23.911 0.751 10.567 863 HD2 ARG 107 HD2 ARG 107 26.697 1.933 10.533 864 HD3 ARG 107 HD3 ARG 107 25.299 2.483 11.418 865 HE ARG 107 HE ARG 107 25.600 0.880 13.057 866 HH11 ARG 107 HH11 ARG 107 28.111 0.579 10.524 867 HH12 ARG 107 HH12 ARG 107 29.266 -0.154 11.583 868 HH21 ARG 107 HH21 ARG 107 27.125 -0.244 14.415 869 HH22 ARG 107 HH22 ARG 107 28.614 -0.821 13.737 870 H ILE 108 H ILE 108 22.264 -1.736 7.788 871 HA ILE 108 HA ILE 108 21.879 -4.397 8.996 872 HB ILE 108 HB ILE 108 19.877 -2.100 8.692 873 HG12 ILE 108 HG12 ILE 108 21.449 -3.245 10.993 874 HG13 ILE 108 HG13 ILE 108 21.339 -1.574 10.492 875 HG21 ILE 108 HG21 ILE 108 19.555 -4.884 9.854 876 HG22 ILE 108 HG22 ILE 108 18.301 -3.607 9.879 877 HG23 ILE 108 HG23 ILE 108 18.818 -4.300 8.352 878 HD11 ILE 108 HD11 ILE 108 19.243 -3.175 11.985 879 HD12 ILE 108 HD12 ILE 108 20.078 -1.688 12.483 880 HD13 ILE 108 HD13 ILE 108 18.875 -1.629 11.183 881 H VAL 109 H VAL 109 21.071 -2.105 6.325 882 HA VAL 109 HA VAL 109 20.076 -4.352 4.691 883 HB VAL 109 HB VAL 109 19.944 -1.416 3.914 884 HG11 VAL 109 HG11 VAL 109 18.160 -3.856 3.461 885 HG12 VAL 109 HG12 VAL 109 17.764 -2.226 2.901 886 HG13 VAL 109 HG13 VAL 109 19.193 -3.032 2.271 887 HG21 VAL 109 HG21 VAL 109 17.660 -1.252 4.950 888 HG22 VAL 109 HG22 VAL 109 17.993 -2.738 5.841 889 HG23 VAL 109 HG23 VAL 109 18.953 -1.288 6.144 890 H LYS 110 H LYS 110 20.815 -4.175 2.311 891 HA LYS 110 HA LYS 110 23.730 -3.585 2.162 892 HB2 LYS 110 HB2 LYS 110 21.756 -5.252 0.625 893 HB3 LYS 110 HB3 LYS 110 23.308 -4.772 -0.071 894 HG2 LYS 110 HG2 LYS 110 24.260 -5.789 2.198 895 HG3 LYS 110 HG3 LYS 110 22.784 -6.757 2.118 896 HD2 LYS 110 HD2 LYS 110 24.917 -6.529 -0.085 897 HD3 LYS 110 HD3 LYS 110 24.854 -7.759 1.092 898 HE2 LYS 110 HE2 LYS 110 24.131 -8.199 -1.194 899 HE3 LYS 110 HE3 LYS 110 22.992 -8.799 0.069 900 HZ1 LYS 110 HZ1 LYS 110 22.808 -6.460 -1.665 901 HZ2 LYS 110 HZ2 LYS 110 21.945 -7.825 -1.853 902 HZ3 LYS 110 HZ3 LYS 110 21.631 -6.897 -0.522 903 H ILE 111 H ILE 111 24.210 -2.833 -0.233 904 HA ILE 111 HA ILE 111 22.448 -0.629 -1.026 905 HB ILE 111 HB ILE 111 24.262 -0.426 1.211 906 HG12 ILE 111 HG12 ILE 111 23.320 2.187 0.528 907 HG13 ILE 111 HG13 ILE 111 22.040 1.041 0.175 908 HG21 ILE 111 HG21 ILE 111 25.596 1.554 0.659 909 HG22 ILE 111 HG22 ILE 111 26.119 0.095 -0.192 910 HG23 ILE 111 HG23 ILE 111 25.189 1.337 -1.051 911 HD11 ILE 111 HD11 ILE 111 21.964 1.889 2.505 912 HD12 ILE 111 HD12 ILE 111 22.228 0.131 2.467 913 HD13 ILE 111 HD13 ILE 111 23.584 1.246 2.787 914 H TYR 112 H TYR 112 23.217 0.344 -2.991 915 HA TYR 112 HA TYR 112 25.516 -0.944 -4.331 916 HB2 TYR 112 HB2 TYR 112 22.575 -1.110 -5.149 917 HB3 TYR 112 HB3 TYR 112 23.906 -1.445 -6.239 918 HD1 TYR 112 HD1 TYR 112 22.154 -2.623 -3.224 919 HD2 TYR 112 HD2 TYR 112 25.326 -3.369 -6.047 920 HE1 TYR 112 HE1 TYR 112 22.582 -4.854 -2.197 921 HE2 TYR 112 HE2 TYR 112 25.637 -5.645 -5.125 922 HH TYR 112 HH TYR 112 25.385 -6.684 -3.044 923 H ASP 113 H ASP 113 25.849 -0.106 -6.547 924 HA ASP 113 HA ASP 113 25.524 2.846 -6.477 925 HB2 ASP 113 HB2 ASP 113 27.537 0.988 -7.540 926 HB3 ASP 113 HB3 ASP 113 26.908 1.927 -8.860 927 H THR 114 H THR 114 25.056 0.140 -8.815 928 HA THR 114 HA THR 114 22.964 1.838 -10.157 929 HB THR 114 HB THR 114 23.392 0.496 -12.085 930 HG1 THR 114 HG1 THR 114 25.527 -0.791 -10.740 931 HG21 THR 114 HG21 THR 114 24.769 2.546 -11.569 932 HG22 THR 114 HG22 THR 114 26.057 1.483 -11.002 933 HG23 THR 114 HG23 THR 114 25.532 1.401 -12.690 934 H ILE 115 H ILE 115 21.571 -0.096 -11.399 935 HA ILE 115 HA ILE 115 20.443 -1.772 -9.230 936 HB ILE 115 HB ILE 115 19.834 -1.132 -12.114 937 HG12 ILE 115 HG12 ILE 115 19.001 0.372 -10.362 938 HG13 ILE 115 HG13 ILE 115 17.710 -0.380 -11.295 939 HG21 ILE 115 HG21 ILE 115 18.671 -3.461 -10.511 940 HG22 ILE 115 HG22 ILE 115 17.850 -2.779 -11.947 941 HG23 ILE 115 HG23 ILE 115 19.450 -3.528 -12.093 942 HD11 ILE 115 HD11 ILE 115 17.066 -1.783 -9.515 943 HD12 ILE 115 HD12 ILE 115 18.539 -1.493 -8.590 944 HD13 ILE 115 HD13 ILE 115 17.364 -0.184 -8.794 945 H SER 116 H SER 116 22.811 -1.971 -11.887 946 HA SER 116 HA SER 116 21.980 -4.618 -12.555 947 HB2 SER 116 HB2 SER 116 23.178 -2.741 -13.917 948 HB3 SER 116 HB3 SER 116 24.667 -3.498 -13.286 949 HG SER 116 HG SER 116 24.064 -5.402 -14.404 950 H GLU 117 H GLU 117 24.559 -3.331 -10.381 951 HA GLU 117 HA GLU 117 25.833 -5.929 -10.231 952 HB2 GLU 117 HB2 GLU 117 25.753 -3.456 -8.497 953 HB3 GLU 117 HB3 GLU 117 26.774 -4.841 -8.120 954 HG2 GLU 117 HG2 GLU 117 28.297 -4.273 -9.793 955 HG3 GLU 117 HG3 GLU 117 27.061 -3.496 -10.812 956 H ALA 118 H ALA 118 23.065 -4.210 -8.773 957 HA ALA 118 HA ALA 118 23.041 -5.686 -6.273 958 HB1 ALA 118 HB1 ALA 118 22.089 -3.307 -6.737 959 HB2 ALA 118 HB2 ALA 118 20.735 -4.116 -7.515 960 HB3 ALA 118 HB3 ALA 118 21.084 -4.415 -5.792 961 H MET 119 H MET 119 21.520 -5.733 -9.401 962 HA MET 119 HA MET 119 19.401 -7.384 -9.099 963 HB2 MET 119 HB2 MET 119 20.437 -5.937 -11.159 964 HB3 MET 119 HB3 MET 119 21.214 -7.449 -11.550 965 HG2 MET 119 HG2 MET 119 18.925 -8.554 -11.369 966 HG3 MET 119 HG3 MET 119 18.256 -6.940 -11.075 967 HE1 MET 119 HE1 MET 119 16.630 -8.039 -12.959 968 HE2 MET 119 HE2 MET 119 17.068 -8.180 -14.677 969 HE3 MET 119 HE3 MET 119 17.674 -9.353 -13.485 970 H GLU 120 H GLU 120 22.826 -8.318 -9.779 971 HA GLU 120 HA GLU 120 22.112 -11.200 -9.544 972 HB2 GLU 120 HB2 GLU 120 24.202 -11.530 -10.715 973 HB3 GLU 120 HB3 GLU 120 23.100 -10.448 -11.591 974 HG2 GLU 120 HG2 GLU 120 24.362 -8.531 -11.186 975 HG3 GLU 120 HG3 GLU 120 25.281 -9.254 -9.883 976 H GLU 121 H GLU 121 23.610 -8.647 -7.688 977 HA GLU 121 HA GLU 121 25.359 -10.477 -6.276 978 HB2 GLU 121 HB2 GLU 121 25.727 -8.020 -6.639 979 HB3 GLU 121 HB3 GLU 121 24.478 -7.690 -5.445 980 HG2 GLU 121 HG2 GLU 121 25.722 -8.844 -3.744 981 HG3 GLU 121 HG3 GLU 121 26.873 -9.511 -4.928 982 H VAL 122 H VAL 122 22.311 -8.751 -5.545 983 HA VAL 122 HA VAL 122 21.788 -9.806 -2.992 984 HB VAL 122 HB VAL 122 20.682 -8.040 -4.565 985 HG11 VAL 122 HG11 VAL 122 19.730 -9.421 -6.324 986 HG12 VAL 122 HG12 VAL 122 18.761 -10.328 -5.131 987 HG13 VAL 122 HG13 VAL 122 18.443 -8.619 -5.408 988 HG21 VAL 122 HG21 VAL 122 20.153 -8.312 -2.229 989 HG22 VAL 122 HG22 VAL 122 18.640 -8.064 -3.121 990 HG23 VAL 122 HG23 VAL 122 19.093 -9.690 -2.611 991 H ARG 123 H ARG 123 21.715 -11.436 -5.918 992 HA ARG 123 HA ARG 123 20.003 -13.673 -5.091 993 HB2 ARG 123 HB2 ARG 123 21.885 -13.348 -7.465 994 HB3 ARG 123 HB3 ARG 123 20.949 -14.803 -7.145 995 HG2 ARG 123 HG2 ARG 123 18.874 -13.352 -7.072 996 HG3 ARG 123 HG3 ARG 123 19.850 -12.010 -7.608 997 HD2 ARG 123 HD2 ARG 123 20.243 -14.252 -9.437 998 HD3 ARG 123 HD3 ARG 123 18.505 -13.978 -9.207 999 HE ARG 123 HE ARG 123 19.701 -11.485 -9.513 1000 HH11 ARG 123 HH11 ARG 123 18.535 -14.050 -11.685 1001 HH12 ARG 123 HH12 ARG 123 18.863 -13.152 -13.122 1002 HH21 ARG 123 HH21 ARG 123 20.195 -10.382 -11.337 1003 HH22 ARG 123 HH22 ARG 123 19.867 -10.998 -12.933 1004 H ARG 124 H ARG 124 23.428 -12.855 -4.602 1005 HA ARG 124 HA ARG 124 23.802 -15.022 -2.752 1006 HB2 ARG 124 HB2 ARG 124 25.538 -16.228 -3.938 1007 HB3 ARG 124 HB3 ARG 124 23.993 -16.398 -4.722 1008 HG2 ARG 124 HG2 ARG 124 25.939 -14.266 -5.641 1009 HG3 ARG 124 HG3 ARG 124 26.145 -15.951 -6.132 1010 HD2 ARG 124 HD2 ARG 124 23.709 -15.846 -6.927 1011 HD3 ARG 124 HD3 ARG 124 23.904 -14.074 -6.859 1012 HE ARG 124 HE ARG 124 26.101 -14.787 -8.230 1013 HH11 ARG 124 HH11 ARG 124 22.710 -15.771 -8.613 1014 HH12 ARG 124 HH12 ARG 124 22.682 -15.643 -10.330 1015 HH21 ARG 124 HH21 ARG 124 26.107 -14.647 -10.569 1016 HH22 ARG 124 HH22 ARG 124 24.636 -14.914 -11.416 1017 H LYS 125 H LYS 125 24.025 -12.337 -2.344 1018 HA LYS 125 HA LYS 125 26.331 -11.041 -2.776 1019 HB2 LYS 125 HB2 LYS 125 25.660 -9.485 -1.047 1020 HB3 LYS 125 HB3 LYS 125 24.215 -10.296 -1.619 1021 HG2 LYS 125 HG2 LYS 125 23.844 -10.498 0.616 1022 HG3 LYS 125 HG3 LYS 125 24.678 -12.002 0.359 1023 HD2 LYS 125 HD2 LYS 125 26.663 -9.964 0.885 1024 HD3 LYS 125 HD3 LYS 125 25.370 -9.723 2.053 1025 HE2 LYS 125 HE2 LYS 125 25.603 -11.990 2.890 1026 HE3 LYS 125 HE3 LYS 125 26.746 -12.390 1.602 1027 HZ1 LYS 125 HZ1 LYS 125 27.229 -10.372 3.690 1028 HZ2 LYS 125 HZ2 LYS 125 27.922 -11.883 3.613 1029 HZ3 LYS 125 HZ3 LYS 125 28.256 -10.769 2.463 Start of MODEL 10 1 H1 MET 1 H1 MET 1 2.308 -16.114 8.772 2 HA MET 1 HA MET 1 0.385 -15.019 6.798 3 HB2 MET 1 HB2 MET 1 0.916 -17.913 7.615 4 HB3 MET 1 HB3 MET 1 -0.400 -17.390 6.565 5 HG2 MET 1 HG2 MET 1 1.180 -16.536 4.919 6 HG3 MET 1 HG3 MET 1 2.537 -16.892 5.986 7 HE1 MET 1 HE1 MET 1 -0.542 -18.705 4.163 8 HE2 MET 1 HE2 MET 1 0.574 -17.851 3.068 9 HE3 MET 1 HE3 MET 1 0.467 -19.611 3.020 10 H GLY 2 H GLY 2 -1.498 -14.358 7.647 11 HA2 GLY 2 HA2 GLY 2 -2.330 -15.163 10.376 12 HA3 GLY 2 HA3 GLY 2 -3.144 -14.008 9.305 13 H SER 3 H SER 3 -4.867 -15.728 10.283 14 HA SER 3 HA SER 3 -5.116 -18.129 8.623 15 HB2 SER 3 HB2 SER 3 -7.252 -16.837 10.339 16 HB3 SER 3 HB3 SER 3 -7.138 -18.517 9.793 17 HG SER 3 HG SER 3 -6.377 -17.560 12.041 18 H ASP 4 H ASP 4 -6.807 -14.965 8.916 19 HA ASP 4 HA ASP 4 -7.699 -14.915 6.150 20 HB2 ASP 4 HB2 ASP 4 -10.039 -15.173 6.659 21 HB3 ASP 4 HB3 ASP 4 -9.211 -16.621 7.211 22 H LYS 5 H LYS 5 -7.845 -12.811 5.626 23 HA LYS 5 HA LYS 5 -9.953 -11.549 6.790 24 HB2 LYS 5 HB2 LYS 5 -7.729 -10.637 8.206 25 HB3 LYS 5 HB3 LYS 5 -7.851 -9.414 6.966 26 HG2 LYS 5 HG2 LYS 5 -9.969 -8.698 7.653 27 HG3 LYS 5 HG3 LYS 5 -10.398 -10.235 8.391 28 HD2 LYS 5 HD2 LYS 5 -8.447 -8.238 9.586 29 HD3 LYS 5 HD3 LYS 5 -10.135 -8.508 10.068 30 HE2 LYS 5 HE2 LYS 5 -9.477 -10.988 10.416 31 HE3 LYS 5 HE3 LYS 5 -7.810 -10.449 10.282 32 HZ1 LYS 5 HZ1 LYS 5 -8.345 -10.531 12.531 33 HZ2 LYS 5 HZ2 LYS 5 -8.355 -8.903 12.201 34 HZ3 LYS 5 HZ3 LYS 5 -9.763 -9.751 12.356 35 H ILE 6 H ILE 6 -10.741 -9.760 5.389 36 HA ILE 6 HA ILE 6 -9.084 -9.316 2.945 37 HB ILE 6 HB ILE 6 -12.106 -9.538 3.052 38 HG12 ILE 6 HG12 ILE 6 -9.919 -11.307 1.838 39 HG13 ILE 6 HG13 ILE 6 -11.015 -11.732 3.152 40 HG21 ILE 6 HG21 ILE 6 -11.296 -7.771 1.477 41 HG22 ILE 6 HG22 ILE 6 -10.196 -8.949 0.734 42 HG23 ILE 6 HG23 ILE 6 -11.955 -9.140 0.602 43 HD11 ILE 6 HD11 ILE 6 -12.935 -11.459 1.492 44 HD12 ILE 6 HD12 ILE 6 -11.694 -11.401 0.220 45 HD13 ILE 6 HD13 ILE 6 -11.840 -12.839 1.237 46 H HIS 7 H HIS 7 -8.079 -7.564 3.570 47 HA HIS 7 HA HIS 7 -9.491 -5.182 4.601 48 HB2 HIS 7 HB2 HIS 7 -7.272 -4.149 4.438 49 HB3 HIS 7 HB3 HIS 7 -7.203 -5.631 5.380 50 HD1 HIS 7 HD1 HIS 7 -6.119 -4.315 1.880 51 HD2 HIS 7 HD2 HIS 7 -5.531 -7.504 4.602 52 HE1 HIS 7 HE1 HIS 7 -4.082 -5.596 1.076 53 H HIS 8 H HIS 8 -9.032 -3.130 3.145 54 HA HIS 8 HA HIS 8 -10.396 -3.571 0.761 55 HB2 HIS 8 HB2 HIS 8 -9.510 -1.265 2.159 56 HB3 HIS 8 HB3 HIS 8 -8.802 -1.127 0.565 57 HD1 HIS 8 HD1 HIS 8 -11.479 0.581 1.772 58 HD2 HIS 8 HD2 HIS 8 -11.196 -2.411 -1.185 59 HE1 HIS 8 HE1 HIS 8 -13.607 0.695 0.412 60 H HIS 9 H HIS 9 -9.895 -3.926 -1.292 61 HA HIS 9 HA HIS 9 -7.079 -3.878 -2.227 62 HB2 HIS 9 HB2 HIS 9 -8.569 -5.999 -2.461 63 HB3 HIS 9 HB3 HIS 9 -9.490 -5.069 -3.643 64 HD1 HIS 9 HD1 HIS 9 -5.853 -6.306 -3.043 65 HD2 HIS 9 HD2 HIS 9 -8.477 -5.001 -6.077 66 HE1 HIS 9 HE1 HIS 9 -4.667 -6.757 -5.273 67 H HIS 10 H HIS 10 -6.616 -2.181 -3.609 68 HA HIS 10 HA HIS 10 -8.701 -0.499 -4.767 69 HB2 HIS 10 HB2 HIS 10 -7.040 0.305 -2.357 70 HB3 HIS 10 HB3 HIS 10 -7.338 1.489 -3.610 71 HD1 HIS 10 HD1 HIS 10 -10.542 -0.069 -3.717 72 HD2 HIS 10 HD2 HIS 10 -8.451 2.354 -0.982 73 HE1 HIS 10 HE1 HIS 10 -12.290 1.245 -2.416 74 H HIS 11 H HIS 11 -7.812 -0.840 -6.782 75 HA HIS 11 HA HIS 11 -4.989 -0.808 -7.357 76 HB2 HIS 11 HB2 HIS 11 -7.527 -0.526 -9.014 77 HB3 HIS 11 HB3 HIS 11 -5.950 -0.229 -9.725 78 HD1 HIS 11 HD1 HIS 11 -5.706 -3.106 -7.333 79 HD2 HIS 11 HD2 HIS 11 -6.656 -2.289 -11.370 80 HE1 HIS 11 HE1 HIS 11 -5.465 -5.299 -8.582 81 H HIS 12 H HIS 12 -3.884 0.979 -6.642 82 HA HIS 12 HA HIS 12 -4.147 3.224 -8.405 83 HB2 HIS 12 HB2 HIS 12 -5.583 3.947 -6.426 84 HB3 HIS 12 HB3 HIS 12 -4.122 3.913 -5.437 85 HD1 HIS 12 HD1 HIS 12 -5.422 5.620 -8.701 86 HD2 HIS 12 HD2 HIS 12 -2.643 6.107 -5.553 87 HE1 HIS 12 HE1 HIS 12 -4.286 7.864 -9.080 88 H MET 13 H MET 13 -2.204 2.867 -9.221 89 HA MET 13 HA MET 13 -0.080 1.513 -8.175 90 HB2 MET 13 HB2 MET 13 1.258 2.515 -10.024 91 HB3 MET 13 HB3 MET 13 -0.324 1.971 -10.544 92 HG2 MET 13 HG2 MET 13 -1.173 4.318 -10.395 93 HG3 MET 13 HG3 MET 13 0.426 4.856 -9.875 94 HE1 MET 13 HE1 MET 13 0.217 6.755 -11.842 95 HE2 MET 13 HE2 MET 13 -0.267 6.300 -13.492 96 HE3 MET 13 HE3 MET 13 -1.381 6.034 -12.141 97 H PHE 14 H PHE 14 2.159 2.163 -7.885 98 HA PHE 14 HA PHE 14 2.700 4.703 -6.466 99 HB2 PHE 14 HB2 PHE 14 3.292 1.828 -5.709 100 HB3 PHE 14 HB3 PHE 14 4.272 3.130 -5.079 101 HD1 PHE 14 HD1 PHE 14 0.815 1.710 -5.099 102 HD2 PHE 14 HD2 PHE 14 3.529 4.530 -3.266 103 HE1 PHE 14 HE1 PHE 14 -0.849 2.169 -3.349 104 HE2 PHE 14 HE2 PHE 14 1.844 5.002 -1.518 105 HZ PHE 14 HZ PHE 14 -0.373 3.846 -1.567 106 HA PRO 15 HA PRO 15 6.001 4.723 -9.376 107 HB2 PRO 15 HB2 PRO 15 8.011 6.102 -8.277 108 HB3 PRO 15 HB3 PRO 15 6.384 6.819 -8.481 109 HG2 PRO 15 HG2 PRO 15 7.576 5.611 -5.965 110 HG3 PRO 15 HG3 PRO 15 6.699 7.157 -6.147 111 HD2 PRO 15 HD2 PRO 15 5.520 4.808 -5.330 112 HD3 PRO 15 HD3 PRO 15 4.631 6.089 -6.198 113 H TYR 16 H TYR 16 6.627 2.574 -9.875 114 HA TYR 16 HA TYR 16 9.184 1.710 -8.777 115 HB2 TYR 16 HB2 TYR 16 8.367 -0.382 -7.856 116 HB3 TYR 16 HB3 TYR 16 7.477 0.903 -7.124 117 HD1 TYR 16 HD1 TYR 16 7.307 -1.829 -9.620 118 HD2 TYR 16 HD2 TYR 16 5.111 1.068 -7.351 119 HE1 TYR 16 HE1 TYR 16 5.189 -3.030 -10.160 120 HE2 TYR 16 HE2 TYR 16 2.976 -0.187 -7.799 121 HH TYR 16 HH TYR 16 2.973 -3.378 -9.005 122 H LYS 17 H LYS 17 9.906 -0.314 -9.928 123 HA LYS 17 HA LYS 17 8.424 -0.983 -12.377 124 HB2 LYS 17 HB2 LYS 17 10.283 -1.130 -13.811 125 HB3 LYS 17 HB3 LYS 17 10.350 0.478 -13.099 126 HG2 LYS 17 HG2 LYS 17 12.185 -0.032 -11.759 127 HG3 LYS 17 HG3 LYS 17 11.943 -1.785 -11.912 128 HD2 LYS 17 HD2 LYS 17 13.809 -1.520 -13.168 129 HD3 LYS 17 HD3 LYS 17 12.553 -1.406 -14.427 130 HE2 LYS 17 HE2 LYS 17 12.659 1.136 -14.031 131 HE3 LYS 17 HE3 LYS 17 14.077 0.821 -13.012 132 HZ1 LYS 17 HZ1 LYS 17 13.901 0.088 -15.875 133 HZ2 LYS 17 HZ2 LYS 17 14.561 1.467 -15.334 134 HZ3 LYS 17 HZ3 LYS 17 15.254 0.037 -14.941 135 H ILE 18 H ILE 18 9.367 -3.201 -13.194 136 HA ILE 18 HA ILE 18 10.070 -5.015 -10.925 137 HB ILE 18 HB ILE 18 7.818 -5.168 -12.949 138 HG12 ILE 18 HG12 ILE 18 7.873 -5.532 -9.917 139 HG13 ILE 18 HG13 ILE 18 7.335 -4.089 -10.772 140 HG21 ILE 18 HG21 ILE 18 9.142 -7.430 -12.828 141 HG22 ILE 18 HG22 ILE 18 8.363 -7.581 -11.239 142 HG23 ILE 18 HG23 ILE 18 7.391 -7.412 -12.691 143 HD11 ILE 18 HD11 ILE 18 5.385 -5.334 -10.119 144 HD12 ILE 18 HD12 ILE 18 5.543 -5.448 -11.883 145 HD13 ILE 18 HD13 ILE 18 6.003 -6.820 -10.839 146 H VAL 19 H VAL 19 12.112 -5.961 -11.549 147 HA VAL 19 HA VAL 19 12.344 -6.628 -14.375 148 HB VAL 19 HB VAL 19 14.633 -6.332 -14.147 149 HG11 VAL 19 HG11 VAL 19 14.813 -3.886 -13.999 150 HG12 VAL 19 HG12 VAL 19 13.279 -4.338 -14.765 151 HG13 VAL 19 HG13 VAL 19 13.312 -3.816 -13.069 152 HG21 VAL 19 HG21 VAL 19 15.054 -6.862 -11.774 153 HG22 VAL 19 HG22 VAL 19 15.870 -5.390 -12.342 154 HG23 VAL 19 HG23 VAL 19 14.410 -5.255 -11.354 155 H ASP 20 H ASP 20 14.461 -8.330 -13.956 156 HA ASP 20 HA ASP 20 13.209 -10.415 -14.579 157 HB2 ASP 20 HB2 ASP 20 15.919 -10.256 -13.249 158 HB3 ASP 20 HB3 ASP 20 15.327 -11.748 -13.998 159 H ASP 21 H ASP 21 14.272 -10.244 -11.148 160 HA ASP 21 HA ASP 21 11.652 -11.217 -10.546 161 HB2 ASP 21 HB2 ASP 21 11.937 -13.208 -9.669 162 HB3 ASP 21 HB3 ASP 21 13.349 -13.315 -10.696 163 H VAL 22 H VAL 22 13.287 -8.822 -10.294 164 HA VAL 22 HA VAL 22 13.333 -8.491 -7.359 165 HB VAL 22 HB VAL 22 15.446 -7.257 -9.178 166 HG11 VAL 22 HG11 VAL 22 14.662 -7.061 -6.302 167 HG12 VAL 22 HG12 VAL 22 16.386 -7.129 -6.651 168 HG13 VAL 22 HG13 VAL 22 15.352 -5.877 -7.382 169 HG21 VAL 22 HG21 VAL 22 17.059 -8.829 -8.107 170 HG22 VAL 22 HG22 VAL 22 15.682 -9.780 -7.514 171 HG23 VAL 22 HG23 VAL 22 15.950 -9.594 -9.242 172 H VAL 23 H VAL 23 11.950 -6.983 -6.796 173 HA VAL 23 HA VAL 23 10.727 -5.180 -8.712 174 HB VAL 23 HB VAL 23 10.599 -5.328 -5.666 175 HG11 VAL 23 HG11 VAL 23 9.760 -3.171 -6.514 176 HG12 VAL 23 HG12 VAL 23 8.690 -4.020 -7.649 177 HG13 VAL 23 HG13 VAL 23 8.449 -4.161 -5.892 178 HG21 VAL 23 HG21 VAL 23 9.892 -7.481 -6.687 179 HG22 VAL 23 HG22 VAL 23 8.552 -6.630 -5.947 180 HG23 VAL 23 HG23 VAL 23 8.742 -6.612 -7.717 181 H ILE 24 H ILE 24 11.111 -2.882 -8.838 182 HA ILE 24 HA ILE 24 13.390 -1.847 -7.214 183 HB ILE 24 HB ILE 24 12.684 -0.793 -9.925 184 HG12 ILE 24 HG12 ILE 24 13.306 -2.953 -10.656 185 HG13 ILE 24 HG13 ILE 24 14.725 -1.919 -10.851 186 HG21 ILE 24 HG21 ILE 24 15.192 -0.641 -8.239 187 HG22 ILE 24 HG22 ILE 24 14.946 0.144 -9.819 188 HG23 ILE 24 HG23 ILE 24 13.966 0.617 -8.426 189 HD11 ILE 24 HD11 ILE 24 15.256 -2.942 -8.445 190 HD12 ILE 24 HD12 ILE 24 14.314 -4.270 -9.115 191 HD13 ILE 24 HD13 ILE 24 15.744 -3.699 -9.985 192 H LEU 25 H LEU 25 12.387 -0.673 -5.678 193 HA LEU 25 HA LEU 25 9.840 0.740 -6.232 194 HB2 LEU 25 HB2 LEU 25 11.492 0.499 -3.678 195 HB3 LEU 25 HB3 LEU 25 9.840 1.104 -3.811 196 HG LEU 25 HG LEU 25 10.674 -1.767 -4.493 197 HD11 LEU 25 HD11 LEU 25 9.797 -2.494 -2.424 198 HD12 LEU 25 HD12 LEU 25 11.074 -1.301 -2.142 199 HD13 LEU 25 HD13 LEU 25 9.368 -0.819 -1.940 200 HD21 LEU 25 HD21 LEU 25 7.902 -0.645 -3.975 201 HD22 LEU 25 HD22 LEU 25 8.546 -1.062 -5.577 202 HD23 LEU 25 HD23 LEU 25 8.307 -2.315 -4.359 203 H MET 26 H MET 26 9.998 2.993 -6.763 204 HA MET 26 HA MET 26 12.730 4.206 -6.658 205 HB2 MET 26 HB2 MET 26 10.813 4.218 -9.006 206 HB3 MET 26 HB3 MET 26 12.358 5.081 -8.882 207 HG2 MET 26 HG2 MET 26 13.464 2.835 -8.501 208 HG3 MET 26 HG3 MET 26 11.936 2.081 -8.936 209 HE1 MET 26 HE1 MET 26 11.545 3.098 -12.722 210 HE2 MET 26 HE2 MET 26 10.769 2.362 -11.302 211 HE3 MET 26 HE3 MET 26 10.987 4.126 -11.390 212 HA PRO 27 HA PRO 27 9.380 6.615 -4.547 213 HB2 PRO 27 HB2 PRO 27 10.948 7.861 -2.647 214 HB3 PRO 27 HB3 PRO 27 10.360 6.174 -2.490 215 HG2 PRO 27 HG2 PRO 27 13.037 7.105 -3.613 216 HG3 PRO 27 HG3 PRO 27 12.780 5.919 -2.302 217 HD2 PRO 27 HD2 PRO 27 13.147 5.074 -4.800 218 HD3 PRO 27 HD3 PRO 27 11.804 4.344 -3.865 219 H ASN 28 H ASN 28 8.797 8.784 -4.747 220 HA ASN 28 HA ASN 28 10.822 10.705 -5.721 221 HB2 ASN 28 HB2 ASN 28 9.005 11.588 -7.394 222 HB3 ASN 28 HB3 ASN 28 10.173 10.364 -7.796 223 HD21 ASN 28 HD21 ASN 28 6.545 10.525 -6.791 224 HD22 ASN 28 HD22 ASN 28 6.328 9.091 -7.726 225 H LYS 29 H LYS 29 7.258 11.124 -5.445 226 HA LYS 29 HA LYS 29 7.738 13.046 -3.219 227 HB2 LYS 29 HB2 LYS 29 6.340 13.575 -5.867 228 HB3 LYS 29 HB3 LYS 29 5.811 14.372 -4.407 229 HG2 LYS 29 HG2 LYS 29 7.221 15.905 -5.356 230 HG3 LYS 29 HG3 LYS 29 8.113 15.227 -4.019 231 HD2 LYS 29 HD2 LYS 29 9.537 15.648 -5.956 232 HD3 LYS 29 HD3 LYS 29 9.519 13.947 -5.565 233 HE2 LYS 29 HE2 LYS 29 9.443 14.141 -7.939 234 HE3 LYS 29 HE3 LYS 29 7.859 13.566 -7.415 235 HZ1 LYS 29 HZ1 LYS 29 7.049 15.866 -7.627 236 HZ2 LYS 29 HZ2 LYS 29 8.507 16.364 -8.140 237 HZ3 LYS 29 HZ3 LYS 29 7.646 15.303 -9.054 238 H GLU 30 H GLU 30 7.030 10.345 -3.002 239 HA GLU 30 HA GLU 30 4.120 10.402 -2.281 240 HB2 GLU 30 HB2 GLU 30 4.195 7.986 -2.379 241 HB3 GLU 30 HB3 GLU 30 4.538 8.754 -3.932 242 HG2 GLU 30 HG2 GLU 30 6.661 8.134 -4.023 243 HG3 GLU 30 HG3 GLU 30 7.001 8.300 -2.353 244 H LEU 31 H LEU 31 7.327 10.244 -1.000 245 HA LEU 31 HA LEU 31 6.742 8.809 1.466 246 HB2 LEU 31 HB2 LEU 31 9.086 10.282 0.256 247 HB3 LEU 31 HB3 LEU 31 9.023 10.067 1.993 248 HG LEU 31 HG LEU 31 9.031 7.706 1.887 249 HD11 LEU 31 HD11 LEU 31 7.674 7.252 -0.117 250 HD12 LEU 31 HD12 LEU 31 8.955 7.918 -1.149 251 HD13 LEU 31 HD13 LEU 31 9.226 6.430 -0.223 252 HD21 LEU 31 HD21 LEU 31 11.085 8.823 -0.060 253 HD22 LEU 31 HD22 LEU 31 11.194 8.892 1.705 254 HD23 LEU 31 HD23 LEU 31 11.233 7.323 0.877 255 H ASN 32 H ASN 32 4.976 9.852 2.325 256 HA ASN 32 HA ASN 32 5.197 12.768 2.993 257 HB2 ASN 32 HB2 ASN 32 2.837 11.279 1.788 258 HB3 ASN 32 HB3 ASN 32 2.796 12.952 2.344 259 HD21 ASN 32 HD21 ASN 32 2.888 11.301 -0.438 260 HD22 ASN 32 HD22 ASN 32 4.034 12.216 -1.410 261 H ILE 33 H ILE 33 5.681 10.444 4.705 262 HA ILE 33 HA ILE 33 5.292 9.499 6.643 263 HB ILE 33 HB ILE 33 3.762 12.060 7.171 264 HG12 ILE 33 HG12 ILE 33 6.405 10.784 7.999 265 HG13 ILE 33 HG13 ILE 33 6.153 12.223 6.999 266 HG21 ILE 33 HG21 ILE 33 2.573 10.361 8.498 267 HG22 ILE 33 HG22 ILE 33 4.119 9.769 9.145 268 HG23 ILE 33 HG23 ILE 33 3.508 11.393 9.536 269 HD11 ILE 33 HD11 ILE 33 6.827 12.967 9.185 270 HD12 ILE 33 HD12 ILE 33 5.083 13.300 9.036 271 HD13 ILE 33 HD13 ILE 33 5.654 11.902 9.988 272 H GLU 34 H GLU 34 2.024 10.554 5.470 273 HA GLU 34 HA GLU 34 0.841 8.398 6.967 274 HB2 GLU 34 HB2 GLU 34 -0.334 9.709 4.496 275 HB3 GLU 34 HB3 GLU 34 -1.172 8.760 5.716 276 HG2 GLU 34 HG2 GLU 34 -0.326 10.529 7.422 277 HG3 GLU 34 HG3 GLU 34 0.098 11.507 6.016 278 H ASN 35 H ASN 35 2.269 8.567 3.784 279 HA ASN 35 HA ASN 35 1.439 5.863 2.907 280 HB2 ASN 35 HB2 ASN 35 2.407 6.257 0.987 281 HB3 ASN 35 HB3 ASN 35 2.361 7.946 1.471 282 HD21 ASN 35 HD21 ASN 35 4.402 6.100 -0.195 283 HD22 ASN 35 HD22 ASN 35 5.777 6.003 0.781 284 H ALA 36 H ALA 36 3.534 6.855 5.411 285 HA ALA 36 HA ALA 36 5.730 5.143 4.807 286 HB1 ALA 36 HB1 ALA 36 6.622 5.795 6.937 287 HB2 ALA 36 HB2 ALA 36 5.870 7.224 6.204 288 HB3 ALA 36 HB3 ALA 36 5.046 6.355 7.507 289 H HIS 37 H HIS 37 3.361 4.774 7.635 290 HA HIS 37 HA HIS 37 4.362 2.038 7.881 291 HB2 HIS 37 HB2 HIS 37 2.833 1.633 9.561 292 HB3 HIS 37 HB3 HIS 37 3.424 3.268 9.810 293 HD1 HIS 37 HD1 HIS 37 1.522 5.021 10.165 294 HD2 HIS 37 HD2 HIS 37 0.286 1.418 8.384 295 HE1 HIS 37 HE1 HIS 37 -1.029 5.168 9.907 296 H LEU 38 H LEU 38 2.098 3.581 5.819 297 HA LEU 38 HA LEU 38 0.681 1.197 4.932 298 HB2 LEU 38 HB2 LEU 38 0.935 3.986 3.756 299 HB3 LEU 38 HB3 LEU 38 -0.198 2.758 3.242 300 HG LEU 38 HG LEU 38 -0.197 4.133 5.956 301 HD11 LEU 38 HD11 LEU 38 -2.269 5.145 5.243 302 HD12 LEU 38 HD12 LEU 38 -1.086 5.452 3.964 303 HD13 LEU 38 HD13 LEU 38 -2.299 4.173 3.754 304 HD21 LEU 38 HD21 LEU 38 -0.917 1.845 6.235 305 HD22 LEU 38 HD22 LEU 38 -2.332 2.913 6.291 306 HD23 LEU 38 HD23 LEU 38 -1.977 1.975 4.811 307 H PHE 39 H PHE 39 3.832 2.458 4.429 308 HA PHE 39 HA PHE 39 4.174 2.111 1.697 309 HB2 PHE 39 HB2 PHE 39 5.692 3.305 3.385 310 HB3 PHE 39 HB3 PHE 39 6.361 1.745 3.809 311 HD1 PHE 39 HD1 PHE 39 5.546 3.840 0.803 312 HD2 PHE 39 HD2 PHE 39 8.402 1.229 2.704 313 HE1 PHE 39 HE1 PHE 39 7.228 4.647 -0.738 314 HE2 PHE 39 HE2 PHE 39 10.090 1.865 0.969 315 HZ PHE 39 HZ PHE 39 9.534 3.613 -0.734 316 H LYS 40 H LYS 40 5.422 -0.092 4.339 317 HA LYS 40 HA LYS 40 5.821 -2.202 2.568 318 HB2 LYS 40 HB2 LYS 40 6.543 -3.230 4.418 319 HB3 LYS 40 HB3 LYS 40 6.506 -1.667 5.166 320 HG2 LYS 40 HG2 LYS 40 4.327 -3.812 5.425 321 HG3 LYS 40 HG3 LYS 40 5.665 -3.579 6.541 322 HD2 LYS 40 HD2 LYS 40 4.905 -1.357 7.121 323 HD3 LYS 40 HD3 LYS 40 3.584 -1.440 5.974 324 HE2 LYS 40 HE2 LYS 40 2.574 -3.345 7.145 325 HE3 LYS 40 HE3 LYS 40 3.968 -3.423 8.251 326 HZ1 LYS 40 HZ1 LYS 40 3.381 -1.190 8.981 327 HZ2 LYS 40 HZ2 LYS 40 1.954 -1.238 8.120 328 HZ3 LYS 40 HZ3 LYS 40 2.250 -2.303 9.342 329 H LYS 41 H LYS 41 2.764 -1.076 4.049 330 HA LYS 41 HA LYS 41 1.473 -3.655 3.883 331 HB2 LYS 41 HB2 LYS 41 0.792 -0.907 4.681 332 HB3 LYS 41 HB3 LYS 41 -0.404 -1.533 3.562 333 HG2 LYS 41 HG2 LYS 41 -0.531 -3.619 5.070 334 HG3 LYS 41 HG3 LYS 41 0.397 -2.670 6.261 335 HD2 LYS 41 HD2 LYS 41 -1.361 -0.889 6.152 336 HD3 LYS 41 HD3 LYS 41 -2.219 -1.826 4.929 337 HE2 LYS 41 HE2 LYS 41 -2.170 -3.742 6.743 338 HE3 LYS 41 HE3 LYS 41 -1.903 -2.402 7.878 339 HZ1 LYS 41 HZ1 LYS 41 -4.230 -2.723 7.698 340 HZ2 LYS 41 HZ2 LYS 41 -3.923 -1.382 6.777 341 HZ3 LYS 41 HZ3 LYS 41 -4.161 -2.848 6.052 342 H TRP 42 H TRP 42 1.433 -0.712 1.802 343 HA TRP 42 HA TRP 42 0.265 -1.820 -0.487 344 HB2 TRP 42 HB2 TRP 42 0.635 0.405 -0.750 345 HB3 TRP 42 HB3 TRP 42 2.205 0.383 0.062 346 HD1 TRP 42 HD1 TRP 42 0.855 -1.097 -3.228 347 HE1 TRP 42 HE1 TRP 42 2.566 -0.889 -5.046 348 HE3 TRP 42 HE3 TRP 42 4.375 1.370 -0.525 349 HZ2 TRP 42 HZ2 TRP 42 5.361 0.191 -5.248 350 HZ3 TRP 42 HZ3 TRP 42 6.500 1.993 -1.486 351 HH2 TRP 42 HH2 TRP 42 7.016 1.458 -3.934 352 H VAL 43 H VAL 43 3.959 -1.712 0.077 353 HA VAL 43 HA VAL 43 4.387 -3.071 -2.086 354 HB VAL 43 HB VAL 43 6.230 -3.825 -1.228 355 HG11 VAL 43 HG11 VAL 43 7.617 -1.926 -0.969 356 HG12 VAL 43 HG12 VAL 43 6.194 -1.512 -1.927 357 HG13 VAL 43 HG13 VAL 43 6.286 -1.035 -0.223 358 HG21 VAL 43 HG21 VAL 43 6.002 -3.876 1.504 359 HG22 VAL 43 HG22 VAL 43 6.661 -4.961 0.271 360 HG23 VAL 43 HG23 VAL 43 7.581 -3.539 0.732 361 H PHE 44 H PHE 44 3.808 -4.561 1.022 362 HA PHE 44 HA PHE 44 4.342 -7.256 0.604 363 HB2 PHE 44 HB2 PHE 44 2.609 -5.488 2.117 364 HB3 PHE 44 HB3 PHE 44 2.244 -7.203 2.342 365 HD1 PHE 44 HD1 PHE 44 5.802 -5.919 2.153 366 HD2 PHE 44 HD2 PHE 44 2.520 -6.973 4.738 367 HE1 PHE 44 HE1 PHE 44 7.314 -5.854 4.095 368 HE2 PHE 44 HE2 PHE 44 4.042 -6.894 6.690 369 HZ PHE 44 HZ PHE 44 6.443 -6.338 6.382 370 H ASP 45 H ASP 45 1.540 -5.289 -0.107 371 HA ASP 45 HA ASP 45 -0.244 -7.429 -0.971 372 HB2 ASP 45 HB2 ASP 45 -0.839 -5.300 0.323 373 HB3 ASP 45 HB3 ASP 45 -0.708 -4.439 -1.209 374 H GLU 46 H GLU 46 2.092 -5.502 -2.595 375 HA GLU 46 HA GLU 46 0.889 -6.345 -5.223 376 HB2 GLU 46 HB2 GLU 46 2.788 -4.016 -5.002 377 HB3 GLU 46 HB3 GLU 46 1.664 -4.463 -6.310 378 HG2 GLU 46 HG2 GLU 46 -0.129 -4.075 -4.362 379 HG3 GLU 46 HG3 GLU 46 1.237 -3.185 -3.658 380 H PHE 47 H PHE 47 3.567 -6.846 -3.149 381 HA PHE 47 HA PHE 47 5.071 -8.084 -5.388 382 HB2 PHE 47 HB2 PHE 47 6.182 -6.527 -3.031 383 HB3 PHE 47 HB3 PHE 47 7.091 -7.292 -4.284 384 HD1 PHE 47 HD1 PHE 47 6.267 -6.510 -6.844 385 HD2 PHE 47 HD2 PHE 47 5.590 -4.282 -3.232 386 HE1 PHE 47 HE1 PHE 47 5.960 -4.421 -8.139 387 HE2 PHE 47 HE2 PHE 47 5.312 -2.227 -4.509 388 HZ PHE 47 HZ PHE 47 5.495 -2.279 -6.948 389 H LEU 48 H LEU 48 4.967 -7.979 -1.775 390 HA LEU 48 HA LEU 48 6.445 -10.434 -1.659 391 HB2 LEU 48 HB2 LEU 48 4.745 -9.198 0.535 392 HB3 LEU 48 HB3 LEU 48 5.908 -10.505 0.739 393 HG LEU 48 HG LEU 48 6.457 -7.589 0.149 394 HD11 LEU 48 HD11 LEU 48 7.808 -7.706 2.141 395 HD12 LEU 48 HD12 LEU 48 6.279 -8.528 2.506 396 HD13 LEU 48 HD13 LEU 48 7.728 -9.479 2.177 397 HD21 LEU 48 HD21 LEU 48 8.510 -9.817 -0.136 398 HD22 LEU 48 HD22 LEU 48 7.967 -8.712 -1.414 399 HD23 LEU 48 HD23 LEU 48 8.866 -8.095 -0.030 400 H ASN 49 H ASN 49 3.005 -9.806 -1.042 401 HA ASN 49 HA ASN 49 2.222 -12.574 -0.786 402 HB2 ASN 49 HB2 ASN 49 0.604 -10.122 -1.570 403 HB3 ASN 49 HB3 ASN 49 -0.069 -11.696 -1.188 404 HD21 ASN 49 HD21 ASN 49 -0.041 -8.803 0.097 405 HD22 ASN 49 HD22 ASN 49 0.046 -9.190 1.803 406 H LYS 50 H LYS 50 2.832 -10.379 -3.462 407 HA LYS 50 HA LYS 50 1.341 -11.712 -5.462 408 HB2 LYS 50 HB2 LYS 50 2.945 -9.378 -5.254 409 HB3 LYS 50 HB3 LYS 50 3.760 -10.296 -6.452 410 HG2 LYS 50 HG2 LYS 50 0.901 -10.378 -7.022 411 HG3 LYS 50 HG3 LYS 50 1.313 -8.724 -6.611 412 HD2 LYS 50 HD2 LYS 50 3.079 -8.702 -8.332 413 HD3 LYS 50 HD3 LYS 50 2.721 -10.386 -8.741 414 HE2 LYS 50 HE2 LYS 50 0.947 -7.940 -9.147 415 HE3 LYS 50 HE3 LYS 50 1.705 -8.954 -10.385 416 HZ1 LYS 50 HZ1 LYS 50 0.266 -10.797 -9.317 417 HZ2 LYS 50 HZ2 LYS 50 -0.613 -9.537 -8.706 418 HZ3 LYS 50 HZ3 LYS 50 -0.489 -9.706 -10.295 419 H GLY 51 H GLY 51 4.723 -11.863 -4.478 420 HA2 GLY 51 HA2 GLY 51 5.551 -14.282 -4.308 421 HA3 GLY 51 HA3 GLY 51 5.122 -14.376 -6.029 422 H TYR 52 H TYR 52 6.617 -11.674 -4.151 423 HA TYR 52 HA TYR 52 9.120 -12.045 -5.752 424 HB2 TYR 52 HB2 TYR 52 7.780 -9.462 -4.905 425 HB3 TYR 52 HB3 TYR 52 9.438 -9.568 -5.474 426 HD1 TYR 52 HD1 TYR 52 9.962 -10.344 -7.777 427 HD2 TYR 52 HD2 TYR 52 5.910 -9.625 -6.485 428 HE1 TYR 52 HE1 TYR 52 9.219 -10.426 -10.125 429 HE2 TYR 52 HE2 TYR 52 5.167 -9.557 -8.826 430 HH TYR 52 HH TYR 52 7.161 -10.699 -11.432 431 H ASN 53 H ASN 53 10.900 -12.274 -4.689 432 HA ASN 53 HA ASN 53 11.076 -11.635 -1.780 433 HB2 ASN 53 HB2 ASN 53 11.747 -14.118 -3.348 434 HB3 ASN 53 HB3 ASN 53 12.685 -13.765 -1.920 435 HD21 ASN 53 HD21 ASN 53 11.992 -14.922 -0.198 436 HD22 ASN 53 HD22 ASN 53 10.336 -15.363 0.104 437 H LYS 54 H LYS 54 11.908 -10.014 -4.121 438 HA LYS 54 HA LYS 54 14.284 -9.204 -2.879 439 HB2 LYS 54 HB2 LYS 54 14.486 -10.155 -5.717 440 HB3 LYS 54 HB3 LYS 54 15.417 -8.770 -5.163 441 HG2 LYS 54 HG2 LYS 54 16.941 -9.967 -4.232 442 HG3 LYS 54 HG3 LYS 54 15.825 -10.730 -3.135 443 HD2 LYS 54 HD2 LYS 54 16.551 -11.609 -5.984 444 HD3 LYS 54 HD3 LYS 54 17.082 -12.368 -4.475 445 HE2 LYS 54 HE2 LYS 54 14.831 -13.085 -3.931 446 HE3 LYS 54 HE3 LYS 54 14.166 -12.167 -5.282 447 HZ1 LYS 54 HZ1 LYS 54 16.096 -14.378 -5.682 448 HZ2 LYS 54 HZ2 LYS 54 14.460 -14.546 -5.762 449 HZ3 LYS 54 HZ3 LYS 54 15.193 -13.568 -6.835 450 H ILE 55 H ILE 55 14.464 -7.030 -3.028 451 HA ILE 55 HA ILE 55 12.601 -5.291 -4.562 452 HB ILE 55 HB ILE 55 12.660 -5.837 -1.603 453 HG12 ILE 55 HG12 ILE 55 10.306 -4.889 -3.288 454 HG13 ILE 55 HG13 ILE 55 10.866 -6.528 -3.542 455 HG21 ILE 55 HG21 ILE 55 13.182 -3.460 -1.694 456 HG22 ILE 55 HG22 ILE 55 11.974 -3.205 -2.946 457 HG23 ILE 55 HG23 ILE 55 11.483 -3.643 -1.277 458 HD11 ILE 55 HD11 ILE 55 9.012 -6.429 -1.961 459 HD12 ILE 55 HD12 ILE 55 10.479 -7.168 -1.299 460 HD13 ILE 55 HD13 ILE 55 10.025 -5.497 -0.831 461 H PHE 56 H PHE 56 13.656 -3.301 -4.890 462 HA PHE 56 HA PHE 56 16.118 -2.738 -3.384 463 HB2 PHE 56 HB2 PHE 56 15.631 -2.529 -6.363 464 HB3 PHE 56 HB3 PHE 56 16.907 -1.613 -5.634 465 HD1 PHE 56 HD1 PHE 56 17.761 -3.890 -3.558 466 HD2 PHE 56 HD2 PHE 56 17.011 -3.873 -7.822 467 HE1 PHE 56 HE1 PHE 56 19.191 -5.837 -3.854 468 HE2 PHE 56 HE2 PHE 56 18.272 -5.921 -8.066 469 HZ PHE 56 HZ PHE 56 19.412 -6.929 -6.084 470 H LEU 57 H LEU 57 16.547 -0.488 -2.999 471 HA LEU 57 HA LEU 57 14.238 1.295 -3.637 472 HB2 LEU 57 HB2 LEU 57 14.548 0.649 -1.227 473 HB3 LEU 57 HB3 LEU 57 16.147 1.403 -1.278 474 HG LEU 57 HG LEU 57 15.039 3.599 -1.733 475 HD11 LEU 57 HD11 LEU 57 12.564 3.751 -1.354 476 HD12 LEU 57 HD12 LEU 57 12.943 2.809 -2.800 477 HD13 LEU 57 HD13 LEU 57 12.469 1.982 -1.303 478 HD21 LEU 57 HD21 LEU 57 14.057 3.807 0.563 479 HD22 LEU 57 HD22 LEU 57 14.069 2.045 0.713 480 HD23 LEU 57 HD23 LEU 57 15.598 2.940 0.564 481 H VAL 58 H VAL 58 14.837 2.607 -5.299 482 HA VAL 58 HA VAL 58 17.672 3.225 -5.772 483 HB VAL 58 HB VAL 58 15.124 3.796 -7.336 484 HG11 VAL 58 HG11 VAL 58 18.022 4.371 -8.116 485 HG12 VAL 58 HG12 VAL 58 16.617 4.475 -9.202 486 HG13 VAL 58 HG13 VAL 58 16.741 5.582 -7.844 487 HG21 VAL 58 HG21 VAL 58 16.079 2.138 -8.897 488 HG22 VAL 58 HG22 VAL 58 17.507 1.948 -7.852 489 HG23 VAL 58 HG23 VAL 58 15.916 1.425 -7.283 490 H LEU 59 H LEU 59 18.471 4.679 -4.432 491 HA LEU 59 HA LEU 59 16.942 6.920 -3.358 492 HB2 LEU 59 HB2 LEU 59 19.789 5.885 -3.161 493 HB3 LEU 59 HB3 LEU 59 19.377 7.453 -2.524 494 HG LEU 59 HG LEU 59 19.458 5.844 -0.801 495 HD11 LEU 59 HD11 LEU 59 17.463 6.272 0.332 496 HD12 LEU 59 HD12 LEU 59 17.664 7.647 -0.779 497 HD13 LEU 59 HD13 LEU 59 16.496 6.379 -1.171 498 HD21 LEU 59 HD21 LEU 59 17.208 4.300 -2.108 499 HD22 LEU 59 HD22 LEU 59 18.920 3.820 -2.069 500 HD23 LEU 59 HD23 LEU 59 17.986 3.965 -0.556 501 H SER 60 H SER 60 18.825 6.339 -6.169 502 HA SER 60 HA SER 60 19.907 8.784 -6.886 503 HB2 SER 60 HB2 SER 60 20.333 7.338 -8.570 504 HB3 SER 60 HB3 SER 60 18.864 6.415 -8.247 505 HG SER 60 HG SER 60 19.297 8.331 -10.143 506 H ASP 61 H ASP 61 16.446 7.886 -6.867 507 HA ASP 61 HA ASP 61 15.833 10.133 -8.558 508 HB2 ASP 61 HB2 ASP 61 14.710 7.772 -8.429 509 HB3 ASP 61 HB3 ASP 61 13.686 8.511 -7.215 510 H VAL 62 H VAL 62 15.223 9.240 -5.196 511 HA VAL 62 HA VAL 62 13.958 11.754 -4.422 512 HB VAL 62 HB VAL 62 13.323 9.471 -3.631 513 HG11 VAL 62 HG11 VAL 62 15.625 8.554 -3.350 514 HG12 VAL 62 HG12 VAL 62 15.728 9.472 -1.830 515 HG13 VAL 62 HG13 VAL 62 14.495 8.222 -2.025 516 HG21 VAL 62 HG21 VAL 62 12.717 11.505 -2.287 517 HG22 VAL 62 HG22 VAL 62 12.766 9.986 -1.402 518 HG23 VAL 62 HG23 VAL 62 14.105 11.119 -1.210 519 H GLU 63 H GLU 63 15.037 12.645 -2.159 520 HA GLU 63 HA GLU 63 17.982 12.824 -2.494 521 HB2 GLU 63 HB2 GLU 63 16.937 14.929 -3.226 522 HB3 GLU 63 HB3 GLU 63 15.980 14.990 -1.756 523 HG2 GLU 63 HG2 GLU 63 17.727 16.542 -1.481 524 HG3 GLU 63 HG3 GLU 63 18.076 15.194 -0.415 525 H SER 64 H SER 64 15.081 12.879 -0.254 526 HA SER 64 HA SER 64 16.735 11.394 1.607 527 HB2 SER 64 HB2 SER 64 17.145 13.930 1.921 528 HB3 SER 64 HB3 SER 64 15.489 14.043 2.476 529 HG SER 64 HG SER 64 17.203 12.220 3.782 530 H ILE 65 H ILE 65 15.673 10.897 3.590 531 HA ILE 65 HA ILE 65 12.765 10.589 3.607 532 HB ILE 65 HB ILE 65 13.699 8.539 2.576 533 HG12 ILE 65 HG12 ILE 65 12.894 7.959 5.429 534 HG13 ILE 65 HG13 ILE 65 11.801 8.483 4.149 535 HG21 ILE 65 HG21 ILE 65 15.992 8.571 3.304 536 HG22 ILE 65 HG22 ILE 65 15.493 8.443 5.002 537 HG23 ILE 65 HG23 ILE 65 15.281 7.075 3.893 538 HD11 ILE 65 HD11 ILE 65 11.694 6.060 4.301 539 HD12 ILE 65 HD12 ILE 65 12.497 6.469 2.787 540 HD13 ILE 65 HD13 ILE 65 13.440 5.900 4.183 541 H ASP 66 H ASP 66 12.088 10.253 5.900 542 HA ASP 66 HA ASP 66 13.974 11.740 7.660 543 HB2 ASP 66 HB2 ASP 66 11.033 11.746 8.231 544 HB3 ASP 66 HB3 ASP 66 12.245 12.937 8.615 545 H SER 67 H SER 67 13.239 11.539 10.050 546 HA SER 67 HA SER 67 13.559 8.912 11.060 547 HB2 SER 67 HB2 SER 67 13.077 10.195 13.249 548 HB3 SER 67 HB3 SER 67 14.469 10.680 12.294 549 HG SER 67 HG SER 67 12.260 12.128 12.943 550 H PHE 68 H PHE 68 11.069 9.400 9.373 551 HA PHE 68 HA PHE 68 9.233 8.026 11.226 552 HB2 PHE 68 HB2 PHE 68 8.463 10.363 10.337 553 HB3 PHE 68 HB3 PHE 68 8.232 9.543 8.806 554 HD1 PHE 68 HD1 PHE 68 6.833 7.304 8.900 555 HD2 PHE 68 HD2 PHE 68 6.810 10.321 11.965 556 HE1 PHE 68 HE1 PHE 68 4.680 6.406 9.751 557 HE2 PHE 68 HE2 PHE 68 4.594 9.518 12.741 558 HZ PHE 68 HZ PHE 68 3.520 7.563 11.643 559 H SER 69 H SER 69 9.607 8.429 7.546 560 HA SER 69 HA SER 69 8.839 5.796 7.195 561 HB2 SER 69 HB2 SER 69 10.317 7.784 5.462 562 HB3 SER 69 HB3 SER 69 9.617 6.236 4.938 563 HG SER 69 HG SER 69 7.849 7.203 4.702 564 H LEU 70 H LEU 70 12.170 7.080 7.715 565 HA LEU 70 HA LEU 70 13.722 5.092 6.545 566 HB2 LEU 70 HB2 LEU 70 13.933 6.604 9.184 567 HB3 LEU 70 HB3 LEU 70 15.136 5.389 8.812 568 HG LEU 70 HG LEU 70 14.578 7.585 6.829 569 HD11 LEU 70 HD11 LEU 70 16.604 7.767 9.073 570 HD12 LEU 70 HD12 LEU 70 16.250 8.984 7.801 571 HD13 LEU 70 HD13 LEU 70 15.057 8.621 9.054 572 HD21 LEU 70 HD21 LEU 70 17.092 5.999 7.543 573 HD22 LEU 70 HD22 LEU 70 16.058 5.703 6.119 574 HD23 LEU 70 HD23 LEU 70 16.975 7.220 6.274 575 H GLY 71 H GLY 71 12.126 5.001 9.752 576 HA2 GLY 71 HA2 GLY 71 13.066 2.469 10.585 577 HA3 GLY 71 HA3 GLY 71 11.579 3.244 11.152 578 H VAL 72 H VAL 72 10.384 3.299 8.372 579 HA VAL 72 HA VAL 72 9.217 0.667 8.564 580 HB VAL 72 HB VAL 72 8.534 2.678 6.410 581 HG11 VAL 72 HG11 VAL 72 7.298 0.194 7.681 582 HG12 VAL 72 HG12 VAL 72 6.284 1.363 6.882 583 HG13 VAL 72 HG13 VAL 72 7.564 0.574 5.961 584 HG21 VAL 72 HG21 VAL 72 6.734 3.498 7.943 585 HG22 VAL 72 HG22 VAL 72 7.470 2.577 9.267 586 HG23 VAL 72 HG23 VAL 72 8.343 3.922 8.490 587 H ILE 73 H ILE 73 11.581 2.303 6.502 588 HA ILE 73 HA ILE 73 11.633 0.267 4.451 589 HB ILE 73 HB ILE 73 13.501 2.494 5.296 590 HG12 ILE 73 HG12 ILE 73 13.139 3.296 3.042 591 HG13 ILE 73 HG13 ILE 73 12.331 1.814 2.570 592 HG21 ILE 73 HG21 ILE 73 15.082 0.744 4.726 593 HG22 ILE 73 HG22 ILE 73 14.093 0.283 3.318 594 HG23 ILE 73 HG23 ILE 73 14.957 1.824 3.334 595 HD11 ILE 73 HD11 ILE 73 10.374 2.401 3.930 596 HD12 ILE 73 HD12 ILE 73 11.221 3.863 4.487 597 HD13 ILE 73 HD13 ILE 73 10.781 3.694 2.791 598 H VAL 74 H VAL 74 13.356 0.585 7.617 599 HA VAL 74 HA VAL 74 14.727 -1.949 7.367 600 HB VAL 74 HB VAL 74 13.849 -0.236 9.729 601 HG11 VAL 74 HG11 VAL 74 13.734 -2.474 10.636 602 HG12 VAL 74 HG12 VAL 74 15.282 -2.916 9.890 603 HG13 VAL 74 HG13 VAL 74 15.223 -1.714 11.204 604 HG21 VAL 74 HG21 VAL 74 16.250 0.122 9.978 605 HG22 VAL 74 HG22 VAL 74 16.594 -1.017 8.656 606 HG23 VAL 74 HG23 VAL 74 15.749 0.510 8.325 607 H ASN 75 H ASN 75 11.424 -1.149 8.664 608 HA ASN 75 HA ASN 75 10.619 -3.599 9.538 609 HB2 ASN 75 HB2 ASN 75 9.448 -1.209 9.171 610 HB3 ASN 75 HB3 ASN 75 8.750 -1.992 7.759 611 HD21 ASN 75 HD21 ASN 75 9.298 -2.702 11.244 612 HD22 ASN 75 HD22 ASN 75 7.683 -3.288 11.525 613 H ILE 76 H ILE 76 10.581 -2.489 6.145 614 HA ILE 76 HA ILE 76 9.432 -4.813 4.962 615 HB ILE 76 HB ILE 76 11.185 -2.530 3.980 616 HG12 ILE 76 HG12 ILE 76 8.364 -3.443 3.309 617 HG13 ILE 76 HG13 ILE 76 8.750 -2.249 4.568 618 HG21 ILE 76 HG21 ILE 76 11.877 -4.406 2.570 619 HG22 ILE 76 HG22 ILE 76 10.169 -4.814 2.241 620 HG23 ILE 76 HG23 ILE 76 10.882 -3.300 1.650 621 HD11 ILE 76 HD11 ILE 76 9.162 -1.886 1.601 622 HD12 ILE 76 HD12 ILE 76 7.971 -1.118 2.663 623 HD13 ILE 76 HD13 ILE 76 9.694 -0.754 2.892 624 H LEU 77 H LEU 77 12.803 -4.069 5.963 625 HA LEU 77 HA LEU 77 13.930 -6.308 4.496 626 HB2 LEU 77 HB2 LEU 77 15.178 -4.187 5.207 627 HB3 LEU 77 HB3 LEU 77 15.078 -4.728 6.856 628 HG LEU 77 HG LEU 77 17.226 -5.116 5.776 629 HD11 LEU 77 HD11 LEU 77 17.749 -7.125 6.794 630 HD12 LEU 77 HD12 LEU 77 16.254 -6.673 7.646 631 HD13 LEU 77 HD13 LEU 77 16.210 -7.886 6.368 632 HD21 LEU 77 HD21 LEU 77 17.530 -7.009 4.206 633 HD22 LEU 77 HD22 LEU 77 15.782 -7.253 4.094 634 HD23 LEU 77 HD23 LEU 77 16.549 -5.745 3.491 635 H LYS 78 H LYS 78 13.062 -5.599 7.883 636 HA LYS 78 HA LYS 78 13.811 -8.042 9.058 637 HB2 LYS 78 HB2 LYS 78 11.340 -6.368 9.726 638 HB3 LYS 78 HB3 LYS 78 12.067 -7.632 10.723 639 HG2 LYS 78 HG2 LYS 78 14.181 -6.258 10.780 640 HG3 LYS 78 HG3 LYS 78 13.306 -4.950 9.971 641 HD2 LYS 78 HD2 LYS 78 11.810 -4.711 11.838 642 HD3 LYS 78 HD3 LYS 78 12.282 -6.274 12.521 643 HE2 LYS 78 HE2 LYS 78 14.623 -5.240 12.801 644 HE3 LYS 78 HE3 LYS 78 13.839 -3.671 12.540 645 HZ1 LYS 78 HZ1 LYS 78 13.974 -4.312 14.914 646 HZ2 LYS 78 HZ2 LYS 78 12.411 -4.176 14.425 647 HZ3 LYS 78 HZ3 LYS 78 13.104 -5.667 14.606 648 H SER 79 H SER 79 10.731 -7.200 7.442 649 HA SER 79 HA SER 79 9.515 -9.725 7.993 650 HB2 SER 79 HB2 SER 79 8.335 -7.590 7.450 651 HB3 SER 79 HB3 SER 79 8.861 -7.752 5.762 652 HG SER 79 HG SER 79 7.498 -9.866 7.070 653 H ILE 80 H ILE 80 11.213 -8.452 5.088 654 HA ILE 80 HA ILE 80 10.931 -10.722 3.462 655 HB ILE 80 HB ILE 80 12.784 -8.358 3.553 656 HG12 ILE 80 HG12 ILE 80 10.651 -9.289 1.547 657 HG13 ILE 80 HG13 ILE 80 10.302 -8.236 2.922 658 HG21 ILE 80 HG21 ILE 80 13.669 -8.951 1.318 659 HG22 ILE 80 HG22 ILE 80 14.146 -10.083 2.540 660 HG23 ILE 80 HG23 ILE 80 12.836 -10.516 1.398 661 HD11 ILE 80 HD11 ILE 80 12.148 -7.606 0.619 662 HD12 ILE 80 HD12 ILE 80 10.609 -6.852 1.036 663 HD13 ILE 80 HD13 ILE 80 12.038 -6.641 2.091 664 H SER 81 H SER 81 13.605 -9.942 5.760 665 HA SER 81 HA SER 81 14.959 -12.448 5.126 666 HB2 SER 81 HB2 SER 81 15.298 -10.377 7.320 667 HB3 SER 81 HB3 SER 81 16.399 -11.763 7.036 668 HG SER 81 HG SER 81 16.193 -10.738 4.723 669 H SER 82 H SER 82 12.394 -11.519 7.428 670 HA SER 82 HA SER 82 12.543 -13.914 8.982 671 HB2 SER 82 HB2 SER 82 11.091 -11.691 9.257 672 HB3 SER 82 HB3 SER 82 9.886 -12.622 8.369 673 HG SER 82 HG SER 82 9.706 -13.959 10.083 674 H SER 83 H SER 83 10.827 -13.015 5.937 675 HA SER 83 HA SER 83 9.614 -15.504 5.423 676 HB2 SER 83 HB2 SER 83 10.398 -13.170 3.581 677 HB3 SER 83 HB3 SER 83 9.410 -14.569 3.099 678 HG SER 83 HG SER 83 8.155 -12.846 3.710 679 H GLY 84 H GLY 84 12.406 -14.148 3.621 680 HA2 GLY 84 HA2 GLY 84 14.258 -16.044 3.301 681 HA3 GLY 84 HA3 GLY 84 12.887 -16.845 2.528 682 H GLY 85 H GLY 85 13.490 -13.239 2.431 683 HA2 GLY 85 HA2 GLY 85 14.444 -13.538 -0.346 684 HA3 GLY 85 HA3 GLY 85 13.191 -12.352 0.076 685 H PHE 86 H PHE 86 15.062 -11.056 -0.855 686 HA PHE 86 HA PHE 86 16.746 -10.025 1.371 687 HB2 PHE 86 HB2 PHE 86 17.594 -11.129 -1.275 688 HB3 PHE 86 HB3 PHE 86 18.351 -9.647 -0.772 689 HD1 PHE 86 HD1 PHE 86 17.578 -13.142 0.412 690 HD2 PHE 86 HD2 PHE 86 20.235 -9.727 0.795 691 HE1 PHE 86 HE1 PHE 86 19.018 -14.406 1.980 692 HE2 PHE 86 HE2 PHE 86 21.589 -10.991 2.392 693 HZ PHE 86 HZ PHE 86 21.022 -13.336 2.980 694 H PHE 87 H PHE 87 17.482 -7.751 0.971 695 HA PHE 87 HA PHE 87 16.174 -6.238 -1.125 696 HB2 PHE 87 HB2 PHE 87 14.316 -6.064 0.249 697 HB3 PHE 87 HB3 PHE 87 15.237 -6.187 1.723 698 HD1 PHE 87 HD1 PHE 87 15.409 -3.723 -1.181 699 HD2 PHE 87 HD2 PHE 87 14.918 -4.302 3.074 700 HE1 PHE 87 HE1 PHE 87 15.257 -1.330 -0.862 701 HE2 PHE 87 HE2 PHE 87 14.770 -1.885 3.391 702 HZ PHE 87 HZ PHE 87 14.940 -0.350 1.402 703 H ALA 88 H ALA 88 17.273 -4.320 -1.528 704 HA ALA 88 HA ALA 88 19.250 -3.333 0.371 705 HB1 ALA 88 HB1 ALA 88 20.501 -5.041 -0.921 706 HB2 ALA 88 HB2 ALA 88 20.133 -4.161 -2.429 707 HB3 ALA 88 HB3 ALA 88 21.125 -3.414 -1.162 708 H LEU 89 H LEU 89 20.496 -1.415 -0.793 709 HA LEU 89 HA LEU 89 18.456 0.169 -2.275 710 HB2 LEU 89 HB2 LEU 89 20.327 1.770 -0.711 711 HB3 LEU 89 HB3 LEU 89 18.614 1.880 -0.967 712 HG LEU 89 HG LEU 89 19.991 0.238 1.119 713 HD11 LEU 89 HD11 LEU 89 18.095 2.611 1.364 714 HD12 LEU 89 HD12 LEU 89 18.994 1.809 2.691 715 HD13 LEU 89 HD13 LEU 89 19.868 2.727 1.455 716 HD21 LEU 89 HD21 LEU 89 17.440 0.122 1.959 717 HD22 LEU 89 HD22 LEU 89 17.207 0.072 0.181 718 HD23 LEU 89 HD23 LEU 89 18.236 -1.111 0.989 719 H VAL 90 H VAL 90 19.402 2.023 -3.459 720 HA VAL 90 HA VAL 90 21.931 1.245 -4.793 721 HB VAL 90 HB VAL 90 19.081 1.358 -5.855 722 HG11 VAL 90 HG11 VAL 90 20.413 2.591 -7.473 723 HG12 VAL 90 HG12 VAL 90 21.623 1.287 -7.495 724 HG13 VAL 90 HG13 VAL 90 19.972 1.013 -8.103 725 HG21 VAL 90 HG21 VAL 90 19.815 -0.925 -6.745 726 HG22 VAL 90 HG22 VAL 90 21.243 -0.777 -5.740 727 HG23 VAL 90 HG23 VAL 90 19.629 -0.814 -4.992 728 H SER 91 H SER 91 23.077 2.926 -5.464 729 HA SER 91 HA SER 91 23.920 4.952 -5.512 730 HB2 SER 91 HB2 SER 91 22.402 4.943 -7.553 731 HB3 SER 91 HB3 SER 91 21.282 5.954 -6.612 732 HG SER 91 HG SER 91 22.730 7.289 -7.764 733 HA PRO 92 HA PRO 92 21.763 6.340 -1.602 734 HB2 PRO 92 HB2 PRO 92 23.444 5.426 0.301 735 HB3 PRO 92 HB3 PRO 92 22.198 4.380 -0.463 736 HG2 PRO 92 HG2 PRO 92 25.170 4.620 -1.159 737 HG3 PRO 92 HG3 PRO 92 24.230 3.124 -0.937 738 HD2 PRO 92 HD2 PRO 92 24.737 4.257 -3.386 739 HD3 PRO 92 HD3 PRO 92 23.282 3.266 -3.009 740 H ASN 93 H ASN 93 22.201 8.274 -2.448 741 HA ASN 93 HA ASN 93 24.590 9.664 -2.684 742 HB2 ASN 93 HB2 ASN 93 23.082 11.721 -2.371 743 HB3 ASN 93 HB3 ASN 93 22.590 10.587 -3.616 744 HD21 ASN 93 HD21 ASN 93 20.906 12.627 -1.694 745 HD22 ASN 93 HD22 ASN 93 19.720 11.567 -1.081 746 H GLU 94 H GLU 94 25.538 11.275 -1.437 747 HA GLU 94 HA GLU 94 26.355 10.552 1.095 748 HB2 GLU 94 HB2 GLU 94 27.546 12.098 -0.416 749 HB3 GLU 94 HB3 GLU 94 26.283 13.319 -0.188 750 HG2 GLU 94 HG2 GLU 94 26.894 13.396 2.245 751 HG3 GLU 94 HG3 GLU 94 28.201 12.258 1.920 752 H LYS 95 H LYS 95 23.529 12.330 0.208 753 HA LYS 95 HA LYS 95 23.012 13.718 2.659 754 HB2 LYS 95 HB2 LYS 95 22.299 14.029 0.061 755 HB3 LYS 95 HB3 LYS 95 20.916 13.087 0.590 756 HG2 LYS 95 HG2 LYS 95 21.706 15.614 2.076 757 HG3 LYS 95 HG3 LYS 95 20.922 15.700 0.523 758 HD2 LYS 95 HD2 LYS 95 19.178 15.849 2.047 759 HD3 LYS 95 HD3 LYS 95 19.142 14.232 1.362 760 HE2 LYS 95 HE2 LYS 95 18.643 14.510 3.845 761 HE3 LYS 95 HE3 LYS 95 19.688 13.181 3.349 762 HZ1 LYS 95 HZ1 LYS 95 20.259 14.875 5.247 763 HZ2 LYS 95 HZ2 LYS 95 21.455 14.157 4.325 764 HZ3 LYS 95 HZ3 LYS 95 20.956 15.715 4.026 765 H VAL 96 H VAL 96 21.934 10.679 1.160 766 HA VAL 96 HA VAL 96 20.365 9.836 3.498 767 HB VAL 96 HB VAL 96 20.646 9.182 0.691 768 HG11 VAL 96 HG11 VAL 96 21.157 6.860 2.548 769 HG12 VAL 96 HG12 VAL 96 20.248 6.672 1.040 770 HG13 VAL 96 HG13 VAL 96 21.900 7.293 1.007 771 HG21 VAL 96 HG21 VAL 96 18.639 9.902 1.799 772 HG22 VAL 96 HG22 VAL 96 18.417 8.322 1.075 773 HG23 VAL 96 HG23 VAL 96 18.640 8.437 2.828 774 H GLU 97 H GLU 97 23.654 9.114 2.153 775 HA GLU 97 HA GLU 97 24.119 7.025 3.992 776 HB2 GLU 97 HB2 GLU 97 25.916 8.876 2.399 777 HB3 GLU 97 HB3 GLU 97 26.620 7.890 3.707 778 HG2 GLU 97 HG2 GLU 97 25.329 5.929 2.683 779 HG3 GLU 97 HG3 GLU 97 25.190 6.896 1.238 780 H ARG 98 H ARG 98 24.023 10.532 4.533 781 HA ARG 98 HA ARG 98 25.524 10.765 6.770 782 HB2 ARG 98 HB2 ARG 98 23.918 12.176 5.044 783 HB3 ARG 98 HB3 ARG 98 22.815 12.159 6.375 784 HG2 ARG 98 HG2 ARG 98 25.676 12.947 6.711 785 HG3 ARG 98 HG3 ARG 98 24.370 13.897 5.914 786 HD2 ARG 98 HD2 ARG 98 23.078 13.844 8.038 787 HD3 ARG 98 HD3 ARG 98 24.341 12.824 8.767 788 HE ARG 98 HE ARG 98 25.654 14.666 9.125 789 HH11 ARG 98 HH11 ARG 98 23.246 15.714 6.700 790 HH12 ARG 98 HH12 ARG 98 23.733 17.383 6.832 791 HH21 ARG 98 HH21 ARG 98 26.451 16.686 8.975 792 HH22 ARG 98 HH22 ARG 98 25.732 17.911 7.989 793 H VAL 99 H VAL 99 22.164 10.217 6.346 794 HA VAL 99 HA VAL 99 21.487 10.212 9.083 795 HB VAL 99 HB VAL 99 19.759 9.191 6.762 796 HG11 VAL 99 HG11 VAL 99 19.093 10.883 9.228 797 HG12 VAL 99 HG12 VAL 99 17.936 10.414 7.968 798 HG13 VAL 99 HG13 VAL 99 18.678 9.165 8.988 799 HG21 VAL 99 HG21 VAL 99 19.120 11.570 6.312 800 HG22 VAL 99 HG22 VAL 99 20.600 12.022 7.220 801 HG23 VAL 99 HG23 VAL 99 20.691 10.967 5.770 802 H LEU 100 H LEU 100 21.738 7.902 6.400 803 HA LEU 100 HA LEU 100 20.981 5.574 7.819 804 HB2 LEU 100 HB2 LEU 100 22.496 6.060 5.167 805 HB3 LEU 100 HB3 LEU 100 22.234 4.497 5.830 806 HG LEU 100 HG LEU 100 19.836 5.595 6.207 807 HD11 LEU 100 HD11 LEU 100 19.492 6.251 3.551 808 HD12 LEU 100 HD12 LEU 100 18.471 6.097 4.960 809 HD13 LEU 100 HD13 LEU 100 19.732 7.373 4.972 810 HD21 LEU 100 HD21 LEU 100 20.590 3.214 5.131 811 HD22 LEU 100 HD22 LEU 100 18.969 3.813 4.821 812 HD23 LEU 100 HD23 LEU 100 20.273 4.038 3.610 813 H SER 101 H SER 101 23.818 7.399 7.978 814 HA SER 101 HA SER 101 25.262 5.022 9.159 815 HB2 SER 101 HB2 SER 101 26.026 7.798 8.363 816 HB3 SER 101 HB3 SER 101 27.036 6.903 9.552 817 HG SER 101 HG SER 101 27.836 6.326 7.584 818 H LEU 102 H LEU 102 24.236 8.321 10.147 819 HA LEU 102 HA LEU 102 24.623 8.167 12.881 820 HB2 LEU 102 HB2 LEU 102 22.496 9.553 11.201 821 HB3 LEU 102 HB3 LEU 102 22.608 9.836 12.924 822 HG LEU 102 HG LEU 102 24.910 10.346 10.994 823 HD11 LEU 102 HD11 LEU 102 24.282 12.713 11.190 824 HD12 LEU 102 HD12 LEU 102 22.986 11.758 10.441 825 HD13 LEU 102 HD13 LEU 102 22.848 12.264 12.137 826 HD21 LEU 102 HD21 LEU 102 25.747 11.747 12.887 827 HD22 LEU 102 HD22 LEU 102 24.415 11.140 13.896 828 HD23 LEU 102 HD23 LEU 102 25.667 10.032 13.289 829 H THR 103 H THR 103 21.632 7.252 11.180 830 HA THR 103 HA THR 103 20.312 6.584 13.683 831 HB THR 103 HB THR 103 19.485 7.965 11.658 832 HG1 THR 103 HG1 THR 103 17.754 5.989 12.702 833 HG21 THR 103 HG21 THR 103 18.278 5.437 10.575 834 HG22 THR 103 HG22 THR 103 18.569 7.015 9.801 835 HG23 THR 103 HG23 THR 103 19.897 5.896 10.048 836 H ASN 104 H ASN 104 22.405 4.843 11.957 837 HA ASN 104 HA ASN 104 22.846 2.723 11.425 838 HB2 ASN 104 HB2 ASN 104 20.854 1.806 13.503 839 HB3 ASN 104 HB3 ASN 104 22.305 0.987 12.922 840 HD21 ASN 104 HD21 ASN 104 21.072 2.886 15.431 841 HD22 ASN 104 HD22 ASN 104 22.584 3.456 16.095 842 H LEU 105 H LEU 105 21.850 3.209 9.366 843 HA LEU 105 HA LEU 105 19.426 1.551 8.767 844 HB2 LEU 105 HB2 LEU 105 19.372 4.160 8.662 845 HB3 LEU 105 HB3 LEU 105 20.041 3.753 7.131 846 HG LEU 105 HG LEU 105 17.709 3.884 6.772 847 HD11 LEU 105 HD11 LEU 105 16.867 1.732 6.173 848 HD12 LEU 105 HD12 LEU 105 18.601 1.724 5.809 849 HD13 LEU 105 HD13 LEU 105 17.994 0.893 7.253 850 HD21 LEU 105 HD21 LEU 105 16.056 2.856 8.263 851 HD22 LEU 105 HD22 LEU 105 17.372 2.274 9.320 852 HD23 LEU 105 HD23 LEU 105 17.096 4.010 9.113 853 H ASP 106 H ASP 106 22.345 3.035 7.337 854 HA ASP 106 HA ASP 106 22.835 1.064 5.297 855 HB2 ASP 106 HB2 ASP 106 23.857 3.232 5.087 856 HB3 ASP 106 HB3 ASP 106 24.474 3.189 6.729 857 H ARG 107 H ARG 107 23.549 1.341 8.730 858 HA ARG 107 HA ARG 107 25.501 -0.792 8.675 859 HB2 ARG 107 HB2 ARG 107 24.034 0.391 11.103 860 HB3 ARG 107 HB3 ARG 107 25.487 -0.630 11.127 861 HG2 ARG 107 HG2 ARG 107 26.692 1.115 9.802 862 HG3 ARG 107 HG3 ARG 107 25.313 2.198 10.073 863 HD2 ARG 107 HD2 ARG 107 25.693 2.328 12.390 864 HD3 ARG 107 HD3 ARG 107 26.679 0.845 12.411 865 HE ARG 107 HE ARG 107 27.934 2.742 10.726 866 HH11 ARG 107 HH11 ARG 107 27.437 2.356 14.279 867 HH12 ARG 107 HH12 ARG 107 28.973 3.077 14.621 868 HH21 ARG 107 HH21 ARG 107 29.781 3.691 11.234 869 HH22 ARG 107 HH22 ARG 107 30.297 3.977 12.878 870 H ILE 108 H ILE 108 22.292 -1.120 8.052 871 HA ILE 108 HA ILE 108 22.075 -3.695 9.462 872 HB ILE 108 HB ILE 108 19.861 -1.625 9.201 873 HG12 ILE 108 HG12 ILE 108 21.809 -2.124 11.485 874 HG13 ILE 108 HG13 ILE 108 21.420 -0.593 10.683 875 HG21 ILE 108 HG21 ILE 108 20.041 -3.980 11.085 876 HG22 ILE 108 HG22 ILE 108 18.597 -3.052 10.614 877 HG23 ILE 108 HG23 ILE 108 19.369 -4.156 9.468 878 HD11 ILE 108 HD11 ILE 108 20.390 -0.547 12.831 879 HD12 ILE 108 HD12 ILE 108 19.084 -0.784 11.643 880 HD13 ILE 108 HD13 ILE 108 19.675 -2.150 12.626 881 H VAL 109 H VAL 109 21.107 -1.635 6.612 882 HA VAL 109 HA VAL 109 20.076 -4.098 5.323 883 HB VAL 109 HB VAL 109 19.690 -1.253 4.378 884 HG11 VAL 109 HG11 VAL 109 19.147 -2.891 2.719 885 HG12 VAL 109 HG12 VAL 109 18.177 -3.839 3.863 886 HG13 VAL 109 HG13 VAL 109 17.632 -2.237 3.312 887 HG21 VAL 109 HG21 VAL 109 17.756 -2.815 6.191 888 HG22 VAL 109 HG22 VAL 109 18.632 -1.338 6.657 889 HG23 VAL 109 HG23 VAL 109 17.394 -1.271 5.407 890 H LYS 110 H LYS 110 20.715 -4.443 3.093 891 HA LYS 110 HA LYS 110 23.479 -3.811 2.563 892 HB2 LYS 110 HB2 LYS 110 21.268 -5.259 1.164 893 HB3 LYS 110 HB3 LYS 110 22.794 -4.964 0.343 894 HG2 LYS 110 HG2 LYS 110 23.137 -6.022 3.100 895 HG3 LYS 110 HG3 LYS 110 22.307 -7.117 1.981 896 HD2 LYS 110 HD2 LYS 110 24.702 -7.544 2.018 897 HD3 LYS 110 HD3 LYS 110 24.115 -7.052 0.458 898 HE2 LYS 110 HE2 LYS 110 26.232 -6.057 0.748 899 HE3 LYS 110 HE3 LYS 110 25.035 -4.781 0.709 900 HZ1 LYS 110 HZ1 LYS 110 26.372 -5.847 3.139 901 HZ2 LYS 110 HZ2 LYS 110 26.731 -4.448 2.391 902 HZ3 LYS 110 HZ3 LYS 110 25.322 -4.575 3.149 903 H ILE 111 H ILE 111 24.243 -2.813 0.644 904 HA ILE 111 HA ILE 111 22.547 -0.769 -0.563 905 HB ILE 111 HB ILE 111 24.184 -0.376 1.797 906 HG12 ILE 111 HG12 ILE 111 23.379 2.169 0.755 907 HG13 ILE 111 HG13 ILE 111 22.100 1.037 0.406 908 HG21 ILE 111 HG21 ILE 111 26.167 -0.059 0.494 909 HG22 ILE 111 HG22 ILE 111 25.382 1.205 -0.483 910 HG23 ILE 111 HG23 ILE 111 25.664 1.446 1.256 911 HD11 ILE 111 HD11 ILE 111 21.966 2.269 2.649 912 HD12 ILE 111 HD12 ILE 111 21.867 0.473 2.744 913 HD13 ILE 111 HD13 ILE 111 23.372 1.332 3.152 914 H TYR 112 H TYR 112 23.449 -0.061 -2.545 915 HA TYR 112 HA TYR 112 25.993 -1.158 -3.589 916 HB2 TYR 112 HB2 TYR 112 23.207 -1.646 -4.743 917 HB3 TYR 112 HB3 TYR 112 24.703 -2.009 -5.580 918 HD1 TYR 112 HD1 TYR 112 26.177 -3.827 -4.871 919 HD2 TYR 112 HD2 TYR 112 22.440 -3.051 -2.877 920 HE1 TYR 112 HE1 TYR 112 26.330 -6.032 -3.858 921 HE2 TYR 112 HE2 TYR 112 22.577 -5.352 -1.829 922 HH TYR 112 HH TYR 112 25.476 -7.310 -1.988 923 H ASP 113 H ASP 113 26.265 -0.293 -6.005 924 HA ASP 113 HA ASP 113 25.558 2.572 -5.886 925 HB2 ASP 113 HB2 ASP 113 27.655 0.966 -7.302 926 HB3 ASP 113 HB3 ASP 113 27.004 2.357 -8.153 927 H THR 114 H THR 114 25.216 -0.290 -8.091 928 HA THR 114 HA THR 114 22.955 1.129 -9.419 929 HB THR 114 HB THR 114 23.598 -0.128 -11.445 930 HG1 THR 114 HG1 THR 114 26.164 -0.621 -10.810 931 HG21 THR 114 HG21 THR 114 24.261 2.216 -11.116 932 HG22 THR 114 HG22 THR 114 25.796 1.687 -10.389 933 HG23 THR 114 HG23 THR 114 25.430 1.329 -12.094 934 H ILE 115 H ILE 115 21.596 -0.575 -10.669 935 HA ILE 115 HA ILE 115 20.546 -2.391 -8.671 936 HB ILE 115 HB ILE 115 19.913 -1.769 -11.565 937 HG12 ILE 115 HG12 ILE 115 19.346 -0.081 -9.811 938 HG13 ILE 115 HG13 ILE 115 17.986 -0.651 -10.736 939 HG21 ILE 115 HG21 ILE 115 18.574 -3.810 -9.757 940 HG22 ILE 115 HG22 ILE 115 17.803 -3.148 -11.217 941 HG23 ILE 115 HG23 ILE 115 19.300 -4.083 -11.342 942 HD11 ILE 115 HD11 ILE 115 18.569 -1.977 -8.093 943 HD12 ILE 115 HD12 ILE 115 17.715 -0.411 -8.161 944 HD13 ILE 115 HD13 ILE 115 17.063 -1.831 -8.991 945 H SER 116 H SER 116 22.732 -2.609 -11.508 946 HA SER 116 HA SER 116 22.399 -5.451 -11.685 947 HB2 SER 116 HB2 SER 116 23.014 -3.864 -13.508 948 HB3 SER 116 HB3 SER 116 24.621 -3.664 -12.758 949 HG SER 116 HG SER 116 24.758 -5.163 -14.377 950 H GLU 117 H GLU 117 24.700 -3.271 -9.927 951 HA GLU 117 HA GLU 117 26.409 -5.368 -9.027 952 HB2 GLU 117 HB2 GLU 117 25.737 -2.525 -8.258 953 HB3 GLU 117 HB3 GLU 117 26.447 -3.543 -7.015 954 HG2 GLU 117 HG2 GLU 117 28.187 -4.135 -8.946 955 HG3 GLU 117 HG3 GLU 117 27.698 -2.540 -9.529 956 H ALA 118 H ALA 118 23.062 -4.724 -8.359 957 HA ALA 118 HA ALA 118 23.296 -5.793 -5.604 958 HB1 ALA 118 HB1 ALA 118 20.959 -4.321 -6.894 959 HB2 ALA 118 HB2 ALA 118 21.234 -4.683 -5.175 960 HB3 ALA 118 HB3 ALA 118 22.260 -3.515 -6.010 961 H MET 119 H MET 119 21.606 -6.188 -8.807 962 HA MET 119 HA MET 119 19.619 -7.770 -8.226 963 HB2 MET 119 HB2 MET 119 20.422 -6.692 -10.506 964 HB3 MET 119 HB3 MET 119 21.530 -8.070 -10.666 965 HG2 MET 119 HG2 MET 119 19.587 -9.583 -10.397 966 HG3 MET 119 HG3 MET 119 18.562 -8.150 -10.326 967 HE1 MET 119 HE1 MET 119 18.897 -6.845 -14.066 968 HE2 MET 119 HE2 MET 119 17.717 -6.841 -12.743 969 HE3 MET 119 HE3 MET 119 19.381 -6.285 -12.461 970 H GLU 120 H GLU 120 22.889 -8.939 -8.926 971 HA GLU 120 HA GLU 120 22.052 -11.736 -8.257 972 HB2 GLU 120 HB2 GLU 120 24.125 -12.320 -9.422 973 HB3 GLU 120 HB3 GLU 120 23.090 -11.294 -10.434 974 HG2 GLU 120 HG2 GLU 120 24.458 -9.445 -10.323 975 HG3 GLU 120 HG3 GLU 120 25.166 -9.885 -8.778 976 H GLU 121 H GLU 121 23.265 -9.188 -6.519 977 HA GLU 121 HA GLU 121 25.244 -10.864 -5.071 978 HB2 GLU 121 HB2 GLU 121 25.861 -8.744 -6.462 979 HB3 GLU 121 HB3 GLU 121 25.190 -7.858 -5.097 980 HG2 GLU 121 HG2 GLU 121 26.790 -8.597 -3.581 981 HG3 GLU 121 HG3 GLU 121 27.150 -10.065 -4.477 982 H VAL 122 H VAL 122 22.690 -8.429 -4.672 983 HA VAL 122 HA VAL 122 22.320 -8.805 -1.872 984 HB VAL 122 HB VAL 122 21.090 -7.310 -3.719 985 HG11 VAL 122 HG11 VAL 122 18.716 -8.045 -4.078 986 HG12 VAL 122 HG12 VAL 122 19.877 -8.967 -5.028 987 HG13 VAL 122 HG13 VAL 122 19.143 -9.658 -3.551 988 HG21 VAL 122 HG21 VAL 122 19.335 -6.951 -1.965 989 HG22 VAL 122 HG22 VAL 122 19.957 -8.406 -1.150 990 HG23 VAL 122 HG23 VAL 122 21.026 -7.042 -1.388 991 H ARG 123 H ARG 123 22.023 -10.888 -4.545 992 HA ARG 123 HA ARG 123 20.633 -13.030 -3.097 993 HB2 ARG 123 HB2 ARG 123 22.049 -13.100 -5.767 994 HB3 ARG 123 HB3 ARG 123 21.031 -14.372 -5.062 995 HG2 ARG 123 HG2 ARG 123 19.093 -12.880 -5.177 996 HG3 ARG 123 HG3 ARG 123 20.095 -11.613 -5.779 997 HD2 ARG 123 HD2 ARG 123 18.778 -13.742 -7.204 998 HD3 ARG 123 HD3 ARG 123 19.486 -12.328 -7.905 999 HE ARG 123 HE ARG 123 21.659 -13.472 -7.786 1000 HH11 ARG 123 HH11 ARG 123 18.818 -15.594 -7.781 1001 HH12 ARG 123 HH12 ARG 123 19.700 -17.045 -7.483 1002 HH21 ARG 123 HH21 ARG 123 22.771 -15.523 -8.312 1003 HH22 ARG 123 HH22 ARG 123 22.063 -16.921 -7.557 1004 H ARG 124 H ARG 124 21.763 -13.771 -1.831 1005 HA ARG 124 HA ARG 124 23.284 -14.973 -0.706 1006 HB2 ARG 124 HB2 ARG 124 25.442 -14.980 -2.772 1007 HB3 ARG 124 HB3 ARG 124 24.807 -16.287 -1.846 1008 HG2 ARG 124 HG2 ARG 124 23.956 -17.081 -3.725 1009 HG3 ARG 124 HG3 ARG 124 22.687 -15.879 -3.597 1010 HD2 ARG 124 HD2 ARG 124 23.496 -14.728 -5.455 1011 HD3 ARG 124 HD3 ARG 124 25.137 -14.819 -4.884 1012 HE ARG 124 HE ARG 124 23.795 -17.191 -6.042 1013 HH11 ARG 124 HH11 ARG 124 26.443 -14.712 -6.400 1014 HH12 ARG 124 HH12 ARG 124 27.313 -15.718 -7.497 1015 HH21 ARG 124 HH21 ARG 124 24.955 -18.307 -7.705 1016 HH22 ARG 124 HH22 ARG 124 26.445 -17.666 -8.290 1017 H LYS 125 H LYS 125 23.503 -12.108 -0.630 1018 HA LYS 125 HA LYS 125 25.920 -12.201 1.122 1019 HB2 LYS 125 HB2 LYS 125 24.613 -10.019 -0.514 1020 HB3 LYS 125 HB3 LYS 125 25.853 -9.698 0.605 1021 HG2 LYS 125 HG2 LYS 125 26.223 -11.729 -1.623 1022 HG3 LYS 125 HG3 LYS 125 26.606 -9.997 -1.813 1023 HD2 LYS 125 HD2 LYS 125 28.231 -10.221 0.145 1024 HD3 LYS 125 HD3 LYS 125 27.970 -11.965 0.038 1025 HE2 LYS 125 HE2 LYS 125 29.881 -11.679 -1.249 1026 HE3 LYS 125 HE3 LYS 125 28.603 -11.750 -2.465 1027 HZ1 LYS 125 HZ1 LYS 125 29.990 -9.341 -1.448 1028 HZ2 LYS 125 HZ2 LYS 125 30.132 -9.996 -2.948 1029 HZ3 LYS 125 HZ3 LYS 125 28.737 -9.277 -2.521 Start of MODEL 11 1 H1 MET 1 H1 MET 1 -9.973 -6.892 15.643 2 HA MET 1 HA MET 1 -8.846 -4.967 14.621 3 HB2 MET 1 HB2 MET 1 -10.683 -6.417 12.668 4 HB3 MET 1 HB3 MET 1 -9.312 -5.396 12.227 5 HG2 MET 1 HG2 MET 1 -7.941 -7.112 12.405 6 HG3 MET 1 HG3 MET 1 -8.316 -7.276 14.116 7 HE1 MET 1 HE1 MET 1 -7.447 -9.594 11.838 8 HE2 MET 1 HE2 MET 1 -7.355 -9.509 13.605 9 HE3 MET 1 HE3 MET 1 -8.190 -10.866 12.829 10 H GLY 2 H GLY 2 -9.176 -2.762 14.539 11 HA2 GLY 2 HA2 GLY 2 -10.909 -1.542 12.756 12 HA3 GLY 2 HA3 GLY 2 -11.742 -1.550 14.317 13 H SER 3 H SER 3 -9.254 -0.076 12.443 14 HA SER 3 HA SER 3 -8.969 1.975 14.501 15 HB2 SER 3 HB2 SER 3 -6.510 0.724 13.184 16 HB3 SER 3 HB3 SER 3 -6.532 2.122 14.270 17 HG SER 3 HG SER 3 -6.006 0.478 15.559 18 H ASP 4 H ASP 4 -9.116 3.921 13.467 19 HA ASP 4 HA ASP 4 -9.266 5.538 11.968 20 HB2 ASP 4 HB2 ASP 4 -7.601 3.820 10.081 21 HB3 ASP 4 HB3 ASP 4 -8.130 5.461 9.774 22 H LYS 5 H LYS 5 -10.182 6.122 9.747 23 HA LYS 5 HA LYS 5 -11.520 4.012 8.311 24 HB2 LYS 5 HB2 LYS 5 -13.683 5.015 8.102 25 HB3 LYS 5 HB3 LYS 5 -13.323 4.723 9.793 26 HG2 LYS 5 HG2 LYS 5 -12.650 7.277 9.843 27 HG3 LYS 5 HG3 LYS 5 -13.543 7.348 8.324 28 HD2 LYS 5 HD2 LYS 5 -15.371 7.704 9.537 29 HD3 LYS 5 HD3 LYS 5 -15.349 5.996 9.948 30 HE2 LYS 5 HE2 LYS 5 -14.086 8.296 11.526 31 HE3 LYS 5 HE3 LYS 5 -15.582 7.467 11.945 32 HZ1 LYS 5 HZ1 LYS 5 -13.606 6.758 13.198 33 HZ2 LYS 5 HZ2 LYS 5 -14.318 5.479 12.398 34 HZ3 LYS 5 HZ3 LYS 5 -12.934 6.164 11.866 35 H ILE 6 H ILE 6 -9.984 4.291 6.751 36 HA ILE 6 HA ILE 6 -9.755 6.970 5.417 37 HB ILE 6 HB ILE 6 -7.645 4.863 6.044 38 HG12 ILE 6 HG12 ILE 6 -7.697 7.804 6.890 39 HG13 ILE 6 HG13 ILE 6 -8.351 6.532 7.896 40 HG21 ILE 6 HG21 ILE 6 -6.012 6.211 4.888 41 HG22 ILE 6 HG22 ILE 6 -7.334 5.987 3.754 42 HG23 ILE 6 HG23 ILE 6 -7.183 7.515 4.625 43 HD11 ILE 6 HD11 ILE 6 -6.139 5.393 7.947 44 HD12 ILE 6 HD12 ILE 6 -5.448 6.755 7.030 45 HD13 ILE 6 HD13 ILE 6 -6.120 7.029 8.640 46 H HIS 7 H HIS 7 -11.048 6.678 3.570 47 HA HIS 7 HA HIS 7 -10.487 4.292 1.900 48 HB2 HIS 7 HB2 HIS 7 -12.871 3.831 1.684 49 HB3 HIS 7 HB3 HIS 7 -12.251 3.577 3.301 50 HD1 HIS 7 HD1 HIS 7 -15.051 5.264 1.558 51 HD2 HIS 7 HD2 HIS 7 -12.970 5.453 5.224 52 HE1 HIS 7 HE1 HIS 7 -16.612 6.416 3.237 53 H HIS 8 H HIS 8 -9.336 6.441 1.156 54 HA HIS 8 HA HIS 8 -11.007 7.576 -1.041 55 HB2 HIS 8 HB2 HIS 8 -9.670 9.665 -0.703 56 HB3 HIS 8 HB3 HIS 8 -10.837 9.269 0.553 57 HD1 HIS 8 HD1 HIS 8 -6.970 9.462 0.065 58 HD2 HIS 8 HD2 HIS 8 -9.962 9.040 3.020 59 HE1 HIS 8 HE1 HIS 8 -5.863 9.836 2.308 60 H HIS 9 H HIS 9 -8.428 5.513 -0.579 61 HA HIS 9 HA HIS 9 -6.660 6.590 -2.610 62 HB2 HIS 9 HB2 HIS 9 -5.596 4.356 -2.444 63 HB3 HIS 9 HB3 HIS 9 -5.737 5.208 -0.913 64 HD1 HIS 9 HD1 HIS 9 -6.842 3.809 1.057 65 HD2 HIS 9 HD2 HIS 9 -7.390 2.239 -2.823 66 HE1 HIS 9 HE1 HIS 9 -8.161 1.712 1.332 67 H HIS 10 H HIS 10 -6.360 5.699 -4.701 68 HA HIS 10 HA HIS 10 -8.406 4.046 -5.986 69 HB2 HIS 10 HB2 HIS 10 -7.762 6.917 -6.844 70 HB3 HIS 10 HB3 HIS 10 -8.624 5.755 -7.824 71 HD1 HIS 10 HD1 HIS 10 -11.017 4.798 -6.148 72 HD2 HIS 10 HD2 HIS 10 -9.383 8.691 -5.977 73 HE1 HIS 10 HE1 HIS 10 -12.832 6.315 -5.260 74 H HIS 11 H HIS 11 -7.002 2.590 -7.009 75 HA HIS 11 HA HIS 11 -4.238 2.812 -7.064 76 HB2 HIS 11 HB2 HIS 11 -6.241 1.055 -8.436 77 HB3 HIS 11 HB3 HIS 11 -4.616 1.061 -9.092 78 HD1 HIS 11 HD1 HIS 11 -2.565 0.340 -7.347 79 HD2 HIS 11 HD2 HIS 11 -6.574 -0.483 -6.279 80 HE1 HIS 11 HE1 HIS 11 -2.479 -1.404 -5.549 81 H HIS 12 H HIS 12 -3.072 4.452 -7.932 82 HA HIS 12 HA HIS 12 -2.782 4.496 -10.788 83 HB2 HIS 12 HB2 HIS 12 -4.617 6.312 -10.041 84 HB3 HIS 12 HB3 HIS 12 -3.210 7.188 -9.493 85 HD1 HIS 12 HD1 HIS 12 -4.324 5.480 -12.818 86 HD2 HIS 12 HD2 HIS 12 -2.158 8.759 -11.286 87 HE1 HIS 12 HE1 HIS 12 -3.558 6.871 -14.834 88 H MET 13 H MET 13 -0.736 5.542 -11.280 89 HA MET 13 HA MET 13 1.345 6.341 -11.077 90 HB2 MET 13 HB2 MET 13 0.295 7.505 -8.510 91 HB3 MET 13 HB3 MET 13 2.022 7.479 -8.802 92 HG2 MET 13 HG2 MET 13 0.156 8.512 -10.937 93 HG3 MET 13 HG3 MET 13 0.600 9.535 -9.575 94 HE1 MET 13 HE1 MET 13 2.676 10.885 -9.359 95 HE2 MET 13 HE2 MET 13 3.444 9.372 -8.821 96 HE3 MET 13 HE3 MET 13 4.255 10.411 -10.010 97 H PHE 14 H PHE 14 2.661 4.739 -11.251 98 HA PHE 14 HA PHE 14 3.198 2.940 -8.962 99 HB2 PHE 14 HB2 PHE 14 3.957 1.345 -10.672 100 HB3 PHE 14 HB3 PHE 14 2.253 1.731 -10.768 101 HD1 PHE 14 HD1 PHE 14 1.473 3.324 -12.658 102 HD2 PHE 14 HD2 PHE 14 5.399 1.559 -12.537 103 HE1 PHE 14 HE1 PHE 14 1.739 3.744 -15.081 104 HE2 PHE 14 HE2 PHE 14 5.658 1.948 -14.945 105 HZ PHE 14 HZ PHE 14 3.846 3.060 -16.243 106 HA PRO 15 HA PRO 15 7.072 5.410 -9.530 107 HB2 PRO 15 HB2 PRO 15 7.659 5.964 -6.929 108 HB3 PRO 15 HB3 PRO 15 6.378 6.822 -7.827 109 HG2 PRO 15 HG2 PRO 15 6.039 4.447 -5.963 110 HG3 PRO 15 HG3 PRO 15 5.156 6.013 -5.943 111 HD2 PRO 15 HD2 PRO 15 4.135 3.813 -7.181 112 HD3 PRO 15 HD3 PRO 15 3.902 5.473 -7.817 113 H TYR 16 H TYR 16 7.152 2.820 -10.146 114 HA TYR 16 HA TYR 16 9.539 1.800 -8.909 115 HB2 TYR 16 HB2 TYR 16 8.573 -0.208 -7.898 116 HB3 TYR 16 HB3 TYR 16 7.816 1.205 -7.234 117 HD1 TYR 16 HD1 TYR 16 5.480 1.732 -7.597 118 HD2 TYR 16 HD2 TYR 16 7.295 -1.789 -9.312 119 HE1 TYR 16 HE1 TYR 16 3.224 0.778 -8.023 120 HE2 TYR 16 HE2 TYR 16 5.056 -2.696 -9.823 121 HH TYR 16 HH TYR 16 2.573 -2.378 -8.946 122 H LYS 17 H LYS 17 10.160 -0.285 -9.951 123 HA LYS 17 HA LYS 17 8.705 -1.007 -12.411 124 HB2 LYS 17 HB2 LYS 17 10.650 -1.141 -13.782 125 HB3 LYS 17 HB3 LYS 17 10.640 0.464 -13.069 126 HG2 LYS 17 HG2 LYS 17 12.410 -0.025 -11.630 127 HG3 LYS 17 HG3 LYS 17 12.296 -1.784 -11.963 128 HD2 LYS 17 HD2 LYS 17 13.503 -1.732 -13.785 129 HD3 LYS 17 HD3 LYS 17 12.887 -0.159 -14.350 130 HE2 LYS 17 HE2 LYS 17 14.357 1.050 -12.900 131 HE3 LYS 17 HE3 LYS 17 14.748 -0.396 -11.969 132 HZ1 LYS 17 HZ1 LYS 17 15.989 -1.254 -13.872 133 HZ2 LYS 17 HZ2 LYS 17 15.617 0.066 -14.772 134 HZ3 LYS 17 HZ3 LYS 17 16.508 0.219 -13.416 135 H ILE 18 H ILE 18 9.500 -3.279 -13.145 136 HA ILE 18 HA ILE 18 10.578 -4.876 -10.904 137 HB ILE 18 HB ILE 18 8.171 -5.822 -12.497 138 HG12 ILE 18 HG12 ILE 18 8.105 -4.619 -9.684 139 HG13 ILE 18 HG13 ILE 18 7.371 -3.928 -11.143 140 HG21 ILE 18 HG21 ILE 18 9.375 -6.831 -9.869 141 HG22 ILE 18 HG22 ILE 18 8.139 -7.634 -10.869 142 HG23 ILE 18 HG23 ILE 18 9.781 -7.489 -11.462 143 HD11 ILE 18 HD11 ILE 18 6.528 -6.459 -9.725 144 HD12 ILE 18 HD12 ILE 18 5.603 -4.974 -9.988 145 HD13 ILE 18 HD13 ILE 18 5.980 -6.020 -11.363 146 H VAL 19 H VAL 19 12.245 -6.083 -11.736 147 HA VAL 19 HA VAL 19 12.456 -6.311 -14.684 148 HB VAL 19 HB VAL 19 14.789 -6.598 -14.266 149 HG11 VAL 19 HG11 VAL 19 13.758 -4.071 -12.924 150 HG12 VAL 19 HG12 VAL 19 15.391 -4.319 -13.572 151 HG13 VAL 19 HG13 VAL 19 13.994 -4.334 -14.659 152 HG21 VAL 19 HG21 VAL 19 14.255 -6.148 -11.322 153 HG22 VAL 19 HG22 VAL 19 14.908 -7.618 -12.064 154 HG23 VAL 19 HG23 VAL 19 15.849 -6.126 -12.082 155 H ASP 20 H ASP 20 14.355 -8.463 -14.463 156 HA ASP 20 HA ASP 20 13.371 -10.723 -15.069 157 HB2 ASP 20 HB2 ASP 20 15.477 -10.416 -12.878 158 HB3 ASP 20 HB3 ASP 20 15.139 -11.892 -13.794 159 H ASP 21 H ASP 21 14.026 -10.526 -11.571 160 HA ASP 21 HA ASP 21 11.265 -11.319 -10.917 161 HB2 ASP 21 HB2 ASP 21 13.066 -12.722 -9.127 162 HB3 ASP 21 HB3 ASP 21 11.627 -13.251 -9.950 163 H VAL 22 H VAL 22 13.241 -8.862 -10.624 164 HA VAL 22 HA VAL 22 13.168 -8.689 -7.651 165 HB VAL 22 HB VAL 22 15.199 -7.188 -9.366 166 HG11 VAL 22 HG11 VAL 22 16.282 -7.319 -7.007 167 HG12 VAL 22 HG12 VAL 22 14.990 -6.132 -7.306 168 HG13 VAL 22 HG13 VAL 22 14.658 -7.628 -6.431 169 HG21 VAL 22 HG21 VAL 22 16.798 -8.906 -8.585 170 HG22 VAL 22 HG22 VAL 22 15.449 -9.895 -7.975 171 HG23 VAL 22 HG23 VAL 22 15.634 -9.576 -9.716 172 H VAL 23 H VAL 23 12.187 -6.952 -6.746 173 HA VAL 23 HA VAL 23 10.681 -5.113 -8.495 174 HB VAL 23 HB VAL 23 10.817 -5.451 -5.487 175 HG11 VAL 23 HG11 VAL 23 8.824 -3.900 -7.170 176 HG12 VAL 23 HG12 VAL 23 8.698 -4.211 -5.421 177 HG13 VAL 23 HG13 VAL 23 10.012 -3.228 -6.035 178 HG21 VAL 23 HG21 VAL 23 9.945 -7.508 -6.542 179 HG22 VAL 23 HG22 VAL 23 8.723 -6.658 -5.631 180 HG23 VAL 23 HG23 VAL 23 8.732 -6.538 -7.411 181 H ILE 24 H ILE 24 11.123 -2.875 -8.596 182 HA ILE 24 HA ILE 24 13.439 -1.812 -7.045 183 HB ILE 24 HB ILE 24 12.669 -1.412 -9.973 184 HG12 ILE 24 HG12 ILE 24 15.154 -1.909 -10.329 185 HG13 ILE 24 HG13 ILE 24 15.167 -2.510 -8.660 186 HG21 ILE 24 HG21 ILE 24 13.190 0.754 -9.287 187 HG22 ILE 24 HG22 ILE 24 14.439 0.211 -8.159 188 HG23 ILE 24 HG23 ILE 24 14.732 0.195 -9.913 189 HD11 ILE 24 HD11 ILE 24 13.971 -4.415 -9.256 190 HD12 ILE 24 HD12 ILE 24 13.296 -3.652 -10.726 191 HD13 ILE 24 HD13 ILE 24 15.018 -4.106 -10.638 192 H LEU 25 H LEU 25 12.059 -0.754 -5.407 193 HA LEU 25 HA LEU 25 9.942 0.995 -6.380 194 HB2 LEU 25 HB2 LEU 25 11.467 1.005 -3.754 195 HB3 LEU 25 HB3 LEU 25 10.076 1.990 -4.182 196 HG LEU 25 HG LEU 25 9.077 0.389 -2.959 197 HD11 LEU 25 HD11 LEU 25 7.725 -1.064 -4.270 198 HD12 LEU 25 HD12 LEU 25 8.039 0.332 -5.290 199 HD13 LEU 25 HD13 LEU 25 8.920 -1.162 -5.578 200 HD21 LEU 25 HD21 LEU 25 11.051 -1.031 -2.615 201 HD22 LEU 25 HD22 LEU 25 9.536 -1.954 -2.798 202 HD23 LEU 25 HD23 LEU 25 10.678 -1.860 -4.144 203 H MET 26 H MET 26 10.243 3.167 -6.930 204 HA MET 26 HA MET 26 12.906 4.426 -6.665 205 HB2 MET 26 HB2 MET 26 11.291 4.066 -9.198 206 HB3 MET 26 HB3 MET 26 12.230 5.551 -8.950 207 HG2 MET 26 HG2 MET 26 14.277 4.412 -8.785 208 HG3 MET 26 HG3 MET 26 13.499 2.828 -8.703 209 HE1 MET 26 HE1 MET 26 15.502 3.273 -12.250 210 HE2 MET 26 HE2 MET 26 15.851 4.285 -10.840 211 HE3 MET 26 HE3 MET 26 15.629 2.529 -10.638 212 HA PRO 27 HA PRO 27 9.314 6.844 -5.042 213 HB2 PRO 27 HB2 PRO 27 10.392 7.482 -2.619 214 HB3 PRO 27 HB3 PRO 27 9.478 5.957 -2.893 215 HG2 PRO 27 HG2 PRO 27 12.465 6.430 -2.875 216 HG3 PRO 27 HG3 PRO 27 11.517 5.141 -2.085 217 HD2 PRO 27 HD2 PRO 27 12.832 4.886 -4.522 218 HD3 PRO 27 HD3 PRO 27 11.356 3.960 -4.134 219 H ASN 28 H ASN 28 9.470 9.046 -4.176 220 HA ASN 28 HA ASN 28 11.691 10.793 -4.789 221 HB2 ASN 28 HB2 ASN 28 10.138 11.882 -6.733 222 HB3 ASN 28 HB3 ASN 28 11.441 10.813 -6.984 223 HD21 ASN 28 HD21 ASN 28 7.977 9.922 -6.038 224 HD22 ASN 28 HD22 ASN 28 7.870 8.848 -7.402 225 H LYS 29 H LYS 29 8.712 12.139 -5.630 226 HA LYS 29 HA LYS 29 8.656 13.627 -3.206 227 HB2 LYS 29 HB2 LYS 29 6.983 14.952 -4.291 228 HB3 LYS 29 HB3 LYS 29 8.279 14.624 -5.410 229 HG2 LYS 29 HG2 LYS 29 5.618 13.127 -5.382 230 HG3 LYS 29 HG3 LYS 29 5.907 14.581 -6.306 231 HD2 LYS 29 HD2 LYS 29 7.238 11.897 -6.784 232 HD3 LYS 29 HD3 LYS 29 5.975 12.656 -7.728 233 HE2 LYS 29 HE2 LYS 29 7.622 14.613 -8.072 234 HE3 LYS 29 HE3 LYS 29 8.886 13.533 -7.515 235 HZ1 LYS 29 HZ1 LYS 29 8.577 13.606 -9.941 236 HZ2 LYS 29 HZ2 LYS 29 8.434 12.098 -9.401 237 HZ3 LYS 29 HZ3 LYS 29 7.076 12.975 -9.803 238 H GLU 30 H GLU 30 7.487 10.627 -3.366 239 HA GLU 30 HA GLU 30 4.691 11.130 -2.538 240 HB2 GLU 30 HB2 GLU 30 4.437 8.720 -2.736 241 HB3 GLU 30 HB3 GLU 30 5.134 9.401 -4.208 242 HG2 GLU 30 HG2 GLU 30 7.321 8.638 -3.709 243 HG3 GLU 30 HG3 GLU 30 6.913 8.211 -2.063 244 H LEU 31 H LEU 31 7.722 10.437 -0.953 245 HA LEU 31 HA LEU 31 6.658 8.356 0.687 246 HB2 LEU 31 HB2 LEU 31 9.303 9.881 0.731 247 HB3 LEU 31 HB3 LEU 31 8.919 8.650 1.934 248 HG LEU 31 HG LEU 31 9.201 8.281 -1.043 249 HD11 LEU 31 HD11 LEU 31 11.075 6.799 -0.301 250 HD12 LEU 31 HD12 LEU 31 11.274 8.448 0.316 251 HD13 LEU 31 HD13 LEU 31 10.677 7.158 1.391 252 HD21 LEU 31 HD21 LEU 31 7.409 6.736 -0.466 253 HD22 LEU 31 HD22 LEU 31 8.899 5.813 -0.605 254 HD23 LEU 31 HD23 LEU 31 8.265 6.216 1.007 255 H ASN 32 H ASN 32 8.277 11.153 1.938 256 HA ASN 32 HA ASN 32 7.850 12.277 4.032 257 HB2 ASN 32 HB2 ASN 32 6.331 14.134 2.771 258 HB3 ASN 32 HB3 ASN 32 8.047 13.955 2.671 259 HD21 ASN 32 HD21 ASN 32 4.993 13.188 0.959 260 HD22 ASN 32 HD22 ASN 32 5.881 12.896 -0.569 261 H ILE 33 H ILE 33 6.652 10.332 5.009 262 HA ILE 33 HA ILE 33 5.110 9.546 6.390 263 HB ILE 33 HB ILE 33 4.324 12.443 6.384 264 HG12 ILE 33 HG12 ILE 33 4.957 10.397 8.532 265 HG13 ILE 33 HG13 ILE 33 6.192 11.350 7.693 266 HG21 ILE 33 HG21 ILE 33 2.094 11.370 6.379 267 HG22 ILE 33 HG22 ILE 33 2.598 10.347 7.752 268 HG23 ILE 33 HG23 ILE 33 2.474 12.116 7.912 269 HD11 ILE 33 HD11 ILE 33 3.976 12.449 9.455 270 HD12 ILE 33 HD12 ILE 33 5.713 12.338 9.828 271 HD13 ILE 33 HD13 ILE 33 5.126 13.427 8.522 272 H GLU 34 H GLU 34 3.592 11.268 3.662 273 HA GLU 34 HA GLU 34 1.089 10.119 3.917 274 HB2 GLU 34 HB2 GLU 34 2.360 10.971 1.296 275 HB3 GLU 34 HB3 GLU 34 0.637 10.924 1.687 276 HG2 GLU 34 HG2 GLU 34 1.172 12.642 3.566 277 HG3 GLU 34 HG3 GLU 34 2.749 12.779 2.827 278 H ASN 35 H ASN 35 3.916 8.657 2.569 279 HA ASN 35 HA ASN 35 2.375 6.153 2.096 280 HB2 ASN 35 HB2 ASN 35 2.897 6.966 -0.131 281 HB3 ASN 35 HB3 ASN 35 4.597 7.179 0.301 282 HD21 ASN 35 HD21 ASN 35 4.943 5.628 -1.656 283 HD22 ASN 35 HD22 ASN 35 5.116 3.984 -1.149 284 H ALA 36 H ALA 36 3.111 6.454 4.516 285 HA ALA 36 HA ALA 36 5.780 5.129 4.808 286 HB1 ALA 36 HB1 ALA 36 5.803 7.457 5.588 287 HB2 ALA 36 HB2 ALA 36 4.563 7.045 6.794 288 HB3 ALA 36 HB3 ALA 36 6.137 6.229 6.830 289 H HIS 37 H HIS 37 2.833 5.519 7.008 290 HA HIS 37 HA HIS 37 3.370 2.957 8.149 291 HB2 HIS 37 HB2 HIS 37 2.016 4.624 9.305 292 HB3 HIS 37 HB3 HIS 37 0.764 4.526 8.058 293 HD1 HIS 37 HD1 HIS 37 -1.190 2.874 8.709 294 HD2 HIS 37 HD2 HIS 37 2.553 2.009 10.473 295 HE1 HIS 37 HE1 HIS 37 -1.527 0.809 10.123 296 H LEU 38 H LEU 38 1.292 3.933 5.378 297 HA LEU 38 HA LEU 38 0.481 1.228 4.814 298 HB2 LEU 38 HB2 LEU 38 -0.772 2.074 3.142 299 HB3 LEU 38 HB3 LEU 38 -0.702 3.428 4.233 300 HG LEU 38 HG LEU 38 1.490 3.978 2.643 301 HD11 LEU 38 HD11 LEU 38 -0.595 2.833 0.744 302 HD12 LEU 38 HD12 LEU 38 1.062 3.362 0.368 303 HD13 LEU 38 HD13 LEU 38 0.766 1.874 1.295 304 HD21 LEU 38 HD21 LEU 38 0.007 5.479 1.327 305 HD22 LEU 38 HD22 LEU 38 -1.409 4.729 2.091 306 HD23 LEU 38 HD23 LEU 38 -0.222 5.630 3.069 307 H PHE 39 H PHE 39 3.529 2.816 4.323 308 HA PHE 39 HA PHE 39 4.252 2.049 1.782 309 HB2 PHE 39 HB2 PHE 39 5.542 3.426 3.497 310 HB3 PHE 39 HB3 PHE 39 6.121 1.928 4.200 311 HD1 PHE 39 HD1 PHE 39 5.746 3.275 0.735 312 HD2 PHE 39 HD2 PHE 39 8.430 1.616 3.657 313 HE1 PHE 39 HE1 PHE 39 7.575 3.763 -0.767 314 HE2 PHE 39 HE2 PHE 39 10.324 2.015 2.082 315 HZ PHE 39 HZ PHE 39 9.951 3.154 -0.098 316 H LYS 40 H LYS 40 4.603 0.164 4.775 317 HA LYS 40 HA LYS 40 5.643 -2.149 3.363 318 HB2 LYS 40 HB2 LYS 40 5.732 -3.259 5.365 319 HB3 LYS 40 HB3 LYS 40 5.979 -1.589 5.830 320 HG2 LYS 40 HG2 LYS 40 3.455 -1.515 6.418 321 HG3 LYS 40 HG3 LYS 40 3.440 -3.266 6.126 322 HD2 LYS 40 HD2 LYS 40 3.699 -3.005 8.452 323 HD3 LYS 40 HD3 LYS 40 5.296 -3.489 7.843 324 HE2 LYS 40 HE2 LYS 40 5.971 -1.078 7.804 325 HE3 LYS 40 HE3 LYS 40 4.367 -0.624 8.416 326 HZ1 LYS 40 HZ1 LYS 40 6.036 -0.747 10.179 327 HZ2 LYS 40 HZ2 LYS 40 4.839 -1.885 10.392 328 HZ3 LYS 40 HZ3 LYS 40 6.315 -2.325 9.858 329 H LYS 41 H LYS 41 2.312 -1.131 4.321 330 HA LYS 41 HA LYS 41 1.089 -3.631 3.773 331 HB2 LYS 41 HB2 LYS 41 0.182 -1.026 4.539 332 HB3 LYS 41 HB3 LYS 41 -0.590 -1.334 3.007 333 HG2 LYS 41 HG2 LYS 41 -1.258 -3.644 3.927 334 HG3 LYS 41 HG3 LYS 41 -0.767 -3.039 5.517 335 HD2 LYS 41 HD2 LYS 41 -2.395 -1.149 5.230 336 HD3 LYS 41 HD3 LYS 41 -2.930 -1.857 3.703 337 HE2 LYS 41 HE2 LYS 41 -3.127 -3.118 6.476 338 HE3 LYS 41 HE3 LYS 41 -4.456 -2.376 5.580 339 HZ1 LYS 41 HZ1 LYS 41 -3.004 -4.810 4.752 340 HZ2 LYS 41 HZ2 LYS 41 -4.489 -4.744 5.419 341 HZ3 LYS 41 HZ3 LYS 41 -4.248 -4.111 3.919 342 H TRP 42 H TRP 42 1.721 -0.843 1.656 343 HA TRP 42 HA TRP 42 0.652 -1.943 -0.738 344 HB2 TRP 42 HB2 TRP 42 1.016 0.353 -0.724 345 HB3 TRP 42 HB3 TRP 42 2.622 0.221 -0.039 346 HD1 TRP 42 HD1 TRP 42 1.176 -1.141 -3.477 347 HE1 TRP 42 HE1 TRP 42 2.734 -0.428 -5.288 348 HE3 TRP 42 HE3 TRP 42 4.775 1.103 -0.582 349 HZ2 TRP 42 HZ2 TRP 42 5.395 0.835 -5.505 350 HZ3 TRP 42 HZ3 TRP 42 6.911 1.756 -1.626 351 HH2 TRP 42 HH2 TRP 42 7.141 1.824 -4.104 352 H VAL 43 H VAL 43 4.212 -1.723 0.170 353 HA VAL 43 HA VAL 43 4.951 -3.428 -1.896 354 HB VAL 43 HB VAL 43 6.256 -2.874 0.787 355 HG11 VAL 43 HG11 VAL 43 7.322 -4.896 -0.255 356 HG12 VAL 43 HG12 VAL 43 7.727 -3.913 -1.680 357 HG13 VAL 43 HG13 VAL 43 8.407 -3.510 -0.097 358 HG21 VAL 43 HG21 VAL 43 7.681 -1.522 -1.224 359 HG22 VAL 43 HG22 VAL 43 6.049 -1.439 -1.831 360 HG23 VAL 43 HG23 VAL 43 6.404 -0.797 -0.213 361 H PHE 44 H PHE 44 3.725 -4.430 1.331 362 HA PHE 44 HA PHE 44 4.345 -7.155 1.206 363 HB2 PHE 44 HB2 PHE 44 2.137 -5.499 2.433 364 HB3 PHE 44 HB3 PHE 44 2.035 -7.206 2.407 365 HD1 PHE 44 HD1 PHE 44 5.272 -5.390 3.276 366 HD2 PHE 44 HD2 PHE 44 1.850 -7.639 4.644 367 HE1 PHE 44 HE1 PHE 44 6.213 -5.478 5.593 368 HE2 PHE 44 HE2 PHE 44 2.795 -7.700 6.916 369 HZ PHE 44 HZ PHE 44 4.983 -6.609 7.393 370 H ASP 45 H ASP 45 1.423 -5.300 0.156 371 HA ASP 45 HA ASP 45 0.202 -7.699 -0.800 372 HB2 ASP 45 HB2 ASP 45 -0.746 -5.178 -0.184 373 HB3 ASP 45 HB3 ASP 45 -0.893 -5.192 -1.946 374 H GLU 46 H GLU 46 1.793 -5.059 -2.446 375 HA GLU 46 HA GLU 46 1.092 -5.854 -5.091 376 HB2 GLU 46 HB2 GLU 46 1.357 -3.550 -4.283 377 HB3 GLU 46 HB3 GLU 46 3.044 -3.837 -3.920 378 HG2 GLU 46 HG2 GLU 46 2.740 -2.465 -5.894 379 HG3 GLU 46 HG3 GLU 46 3.612 -3.941 -6.214 380 H PHE 47 H PHE 47 3.648 -6.885 -2.957 381 HA PHE 47 HA PHE 47 4.887 -8.364 -5.209 382 HB2 PHE 47 HB2 PHE 47 6.623 -7.014 -3.150 383 HB3 PHE 47 HB3 PHE 47 7.039 -7.793 -4.667 384 HD1 PHE 47 HD1 PHE 47 6.256 -6.540 -6.889 385 HD2 PHE 47 HD2 PHE 47 6.214 -4.745 -3.006 386 HE1 PHE 47 HE1 PHE 47 6.132 -4.277 -7.925 387 HE2 PHE 47 HE2 PHE 47 6.037 -2.467 -4.035 388 HZ PHE 47 HZ PHE 47 6.033 -2.251 -6.502 389 H LEU 48 H LEU 48 5.008 -7.997 -1.569 390 HA LEU 48 HA LEU 48 6.401 -10.495 -1.277 391 HB2 LEU 48 HB2 LEU 48 4.673 -9.150 0.829 392 HB3 LEU 48 HB3 LEU 48 5.923 -10.351 1.102 393 HG LEU 48 HG LEU 48 6.364 -7.517 0.120 394 HD11 LEU 48 HD11 LEU 48 7.133 -6.975 2.209 395 HD12 LEU 48 HD12 LEU 48 5.816 -8.066 2.634 396 HD13 LEU 48 HD13 LEU 48 7.475 -8.668 2.675 397 HD21 LEU 48 HD21 LEU 48 8.013 -8.896 -0.958 398 HD22 LEU 48 HD22 LEU 48 8.800 -8.073 0.400 399 HD23 LEU 48 HD23 LEU 48 8.333 -9.762 0.565 400 H ASN 49 H ASN 49 3.010 -9.678 -0.731 401 HA ASN 49 HA ASN 49 1.982 -12.304 -0.184 402 HB2 ASN 49 HB2 ASN 49 0.611 -9.766 -1.224 403 HB3 ASN 49 HB3 ASN 49 -0.234 -11.239 -0.752 404 HD21 ASN 49 HD21 ASN 49 -0.845 -8.679 0.620 405 HD22 ASN 49 HD22 ASN 49 -0.309 -8.986 2.240 406 H LYS 50 H LYS 50 2.705 -10.512 -3.121 407 HA LYS 50 HA LYS 50 1.320 -12.244 -4.970 408 HB2 LYS 50 HB2 LYS 50 3.119 -9.943 -5.099 409 HB3 LYS 50 HB3 LYS 50 3.704 -11.170 -6.179 410 HG2 LYS 50 HG2 LYS 50 1.104 -11.225 -6.926 411 HG3 LYS 50 HG3 LYS 50 1.115 -9.658 -6.112 412 HD2 LYS 50 HD2 LYS 50 3.152 -9.098 -7.542 413 HD3 LYS 50 HD3 LYS 50 2.712 -10.498 -8.560 414 HE2 LYS 50 HE2 LYS 50 0.762 -8.259 -7.836 415 HE3 LYS 50 HE3 LYS 50 1.838 -8.133 -9.217 416 HZ1 LYS 50 HZ1 LYS 50 -0.077 -10.358 -8.923 417 HZ2 LYS 50 HZ2 LYS 50 -0.387 -8.964 -9.760 418 HZ3 LYS 50 HZ3 LYS 50 0.815 -9.980 -10.235 419 H GLY 51 H GLY 51 4.601 -12.155 -3.575 420 HA2 GLY 51 HA2 GLY 51 5.223 -14.438 -2.732 421 HA3 GLY 51 HA3 GLY 51 5.044 -14.990 -4.402 422 H TYR 52 H TYR 52 6.328 -11.788 -4.349 423 HA TYR 52 HA TYR 52 8.864 -12.643 -5.393 424 HB2 TYR 52 HB2 TYR 52 7.774 -9.963 -4.433 425 HB3 TYR 52 HB3 TYR 52 9.405 -10.172 -5.048 426 HD1 TYR 52 HD1 TYR 52 5.823 -10.375 -6.088 427 HD2 TYR 52 HD2 TYR 52 9.942 -10.227 -7.279 428 HE1 TYR 52 HE1 TYR 52 5.097 -10.119 -8.412 429 HE2 TYR 52 HE2 TYR 52 9.268 -10.119 -9.657 430 HH TYR 52 HH TYR 52 7.489 -10.009 -11.145 431 H ASN 53 H ASN 53 10.885 -12.431 -4.455 432 HA ASN 53 HA ASN 53 11.033 -12.075 -1.491 433 HB2 ASN 53 HB2 ASN 53 12.249 -14.231 -3.255 434 HB3 ASN 53 HB3 ASN 53 13.107 -13.743 -1.823 435 HD21 ASN 53 HD21 ASN 53 10.753 -13.482 0.082 436 HD22 ASN 53 HD22 ASN 53 10.424 -15.197 0.302 437 H LYS 54 H LYS 54 11.921 -10.457 -4.184 438 HA LYS 54 HA LYS 54 14.374 -9.448 -2.856 439 HB2 LYS 54 HB2 LYS 54 14.282 -10.541 -5.684 440 HB3 LYS 54 HB3 LYS 54 15.429 -9.301 -5.186 441 HG2 LYS 54 HG2 LYS 54 16.750 -10.688 -4.151 442 HG3 LYS 54 HG3 LYS 54 15.487 -11.384 -3.166 443 HD2 LYS 54 HD2 LYS 54 16.356 -12.244 -5.936 444 HD3 LYS 54 HD3 LYS 54 16.618 -13.112 -4.413 445 HE2 LYS 54 HE2 LYS 54 14.207 -13.460 -4.131 446 HE3 LYS 54 HE3 LYS 54 13.882 -12.536 -5.611 447 HZ1 LYS 54 HZ1 LYS 54 15.127 -14.192 -6.850 448 HZ2 LYS 54 HZ2 LYS 54 15.346 -15.091 -5.472 449 HZ3 LYS 54 HZ3 LYS 54 13.836 -14.871 -6.093 450 H ILE 55 H ILE 55 14.170 -7.375 -2.623 451 HA ILE 55 HA ILE 55 12.735 -5.713 -4.608 452 HB ILE 55 HB ILE 55 12.421 -5.806 -1.576 453 HG12 ILE 55 HG12 ILE 55 10.051 -5.282 -3.306 454 HG13 ILE 55 HG13 ILE 55 10.805 -6.847 -3.624 455 HG21 ILE 55 HG21 ILE 55 11.731 -3.530 -3.451 456 HG22 ILE 55 HG22 ILE 55 10.955 -3.719 -1.865 457 HG23 ILE 55 HG23 ILE 55 12.698 -3.450 -1.957 458 HD11 ILE 55 HD11 ILE 55 10.615 -7.488 -1.276 459 HD12 ILE 55 HD12 ILE 55 9.885 -5.886 -0.914 460 HD13 ILE 55 HD13 ILE 55 9.041 -7.044 -1.959 461 H PHE 56 H PHE 56 13.603 -3.601 -4.712 462 HA PHE 56 HA PHE 56 15.873 -2.949 -2.932 463 HB2 PHE 56 HB2 PHE 56 15.622 -2.280 -5.889 464 HB3 PHE 56 HB3 PHE 56 16.933 -1.794 -4.816 465 HD1 PHE 56 HD1 PHE 56 17.424 -4.315 -3.282 466 HD2 PHE 56 HD2 PHE 56 16.614 -3.676 -7.466 467 HE1 PHE 56 HE1 PHE 56 18.898 -6.216 -3.899 468 HE2 PHE 56 HE2 PHE 56 17.859 -5.690 -8.071 469 HZ PHE 56 HZ PHE 56 19.113 -6.929 -6.282 470 H LEU 57 H LEU 57 16.223 -0.707 -2.619 471 HA LEU 57 HA LEU 57 14.003 1.136 -3.401 472 HB2 LEU 57 HB2 LEU 57 13.609 0.584 -1.138 473 HB3 LEU 57 HB3 LEU 57 15.320 0.652 -0.730 474 HG LEU 57 HG LEU 57 15.349 3.056 -0.765 475 HD11 LEU 57 HD11 LEU 57 13.891 3.456 -2.737 476 HD12 LEU 57 HD12 LEU 57 12.476 2.947 -1.783 477 HD13 LEU 57 HD13 LEU 57 13.422 4.396 -1.339 478 HD21 LEU 57 HD21 LEU 57 12.775 2.113 0.575 479 HD22 LEU 57 HD22 LEU 57 14.407 2.069 1.276 480 HD23 LEU 57 HD23 LEU 57 13.652 3.620 0.917 481 H VAL 58 H VAL 58 15.617 1.365 -5.235 482 HA VAL 58 HA VAL 58 17.874 2.840 -5.259 483 HB VAL 58 HB VAL 58 15.291 3.107 -6.908 484 HG11 VAL 58 HG11 VAL 58 16.751 5.036 -7.401 485 HG12 VAL 58 HG12 VAL 58 18.082 3.909 -7.769 486 HG13 VAL 58 HG13 VAL 58 16.643 3.943 -8.760 487 HG21 VAL 58 HG21 VAL 58 16.163 0.833 -6.952 488 HG22 VAL 58 HG22 VAL 58 16.443 1.613 -8.522 489 HG23 VAL 58 HG23 VAL 58 17.773 1.406 -7.381 490 H LEU 59 H LEU 59 18.319 5.020 -4.658 491 HA LEU 59 HA LEU 59 16.114 6.811 -3.789 492 HB2 LEU 59 HB2 LEU 59 18.912 6.398 -2.687 493 HB3 LEU 59 HB3 LEU 59 17.849 7.703 -2.208 494 HG LEU 59 HG LEU 59 16.335 5.234 -1.971 495 HD11 LEU 59 HD11 LEU 59 19.077 5.181 -0.635 496 HD12 LEU 59 HD12 LEU 59 17.686 4.195 -0.128 497 HD13 LEU 59 HD13 LEU 59 18.404 3.998 -1.742 498 HD21 LEU 59 HD21 LEU 59 16.204 5.888 0.386 499 HD22 LEU 59 HD22 LEU 59 17.537 7.018 0.124 500 HD23 LEU 59 HD23 LEU 59 15.997 7.333 -0.667 501 H SER 60 H SER 60 17.877 6.400 -6.410 502 HA SER 60 HA SER 60 19.235 8.589 -7.248 503 HB2 SER 60 HB2 SER 60 16.916 7.190 -8.651 504 HB3 SER 60 HB3 SER 60 18.076 8.219 -9.463 505 HG SER 60 HG SER 60 18.778 6.143 -9.693 506 H ASP 61 H ASP 61 15.690 8.419 -6.889 507 HA ASP 61 HA ASP 61 15.371 11.100 -8.085 508 HB2 ASP 61 HB2 ASP 61 14.189 8.644 -8.547 509 HB3 ASP 61 HB3 ASP 61 12.994 9.429 -7.573 510 H VAL 62 H VAL 62 15.842 10.007 -5.013 511 HA VAL 62 HA VAL 62 14.097 12.034 -3.778 512 HB VAL 62 HB VAL 62 12.966 9.918 -3.490 513 HG11 VAL 62 HG11 VAL 62 15.450 8.706 -2.346 514 HG12 VAL 62 HG12 VAL 62 13.809 8.042 -2.192 515 HG13 VAL 62 HG13 VAL 62 14.526 8.236 -3.786 516 HG21 VAL 62 HG21 VAL 62 12.696 9.881 -1.107 517 HG22 VAL 62 HG22 VAL 62 14.279 10.655 -0.875 518 HG23 VAL 62 HG23 VAL 62 12.935 11.551 -1.632 519 H GLU 63 H GLU 63 15.420 13.460 -2.684 520 HA GLU 63 HA GLU 63 18.276 12.949 -2.442 521 HB2 GLU 63 HB2 GLU 63 17.402 15.207 -2.882 522 HB3 GLU 63 HB3 GLU 63 16.416 15.116 -1.421 523 HG2 GLU 63 HG2 GLU 63 18.599 14.861 -0.097 524 HG3 GLU 63 HG3 GLU 63 19.447 15.306 -1.588 525 H SER 64 H SER 64 15.298 12.907 -0.425 526 HA SER 64 HA SER 64 16.787 11.411 1.628 527 HB2 SER 64 HB2 SER 64 16.159 13.087 3.386 528 HB3 SER 64 HB3 SER 64 17.293 13.662 2.160 529 HG SER 64 HG SER 64 14.663 14.111 1.512 530 H ILE 65 H ILE 65 15.639 10.384 3.046 531 HA ILE 65 HA ILE 65 12.675 10.371 2.898 532 HB ILE 65 HB ILE 65 13.734 8.203 2.395 533 HG12 ILE 65 HG12 ILE 65 12.351 8.164 5.097 534 HG13 ILE 65 HG13 ILE 65 11.514 8.453 3.573 535 HG21 ILE 65 HG21 ILE 65 14.875 8.322 5.229 536 HG22 ILE 65 HG22 ILE 65 14.970 6.928 4.136 537 HG23 ILE 65 HG23 ILE 65 15.817 8.396 3.710 538 HD11 ILE 65 HD11 ILE 65 12.433 6.230 2.739 539 HD12 ILE 65 HD12 ILE 65 12.997 5.936 4.401 540 HD13 ILE 65 HD13 ILE 65 11.269 6.117 4.054 541 H ASP 66 H ASP 66 11.629 10.552 4.988 542 HA ASP 66 HA ASP 66 13.264 12.174 6.833 543 HB2 ASP 66 HB2 ASP 66 10.907 12.844 5.915 544 HB3 ASP 66 HB3 ASP 66 10.300 11.746 7.150 545 H SER 67 H SER 67 12.717 11.991 9.068 546 HA SER 67 HA SER 67 13.462 9.747 10.513 547 HB2 SER 67 HB2 SER 67 12.497 11.236 12.346 548 HB3 SER 67 HB3 SER 67 13.720 11.988 11.334 549 HG SER 67 HG SER 67 12.157 13.191 10.312 550 H PHE 68 H PHE 68 10.621 9.790 8.837 551 HA PHE 68 HA PHE 68 9.038 8.440 10.973 552 HB2 PHE 68 HB2 PHE 68 8.082 10.433 9.656 553 HB3 PHE 68 HB3 PHE 68 7.956 9.354 8.300 554 HD1 PHE 68 HD1 PHE 68 6.614 7.182 8.623 555 HD2 PHE 68 HD2 PHE 68 6.430 10.501 11.326 556 HE1 PHE 68 HE1 PHE 68 4.421 6.350 9.460 557 HE2 PHE 68 HE2 PHE 68 4.194 9.726 12.124 558 HZ PHE 68 HZ PHE 68 3.185 7.669 11.186 559 H SER 69 H SER 69 9.438 8.168 7.371 560 HA SER 69 HA SER 69 8.913 5.339 7.552 561 HB2 SER 69 HB2 SER 69 8.096 6.803 5.846 562 HB3 SER 69 HB3 SER 69 9.713 7.051 5.182 563 HG SER 69 HG SER 69 8.422 5.507 4.115 564 H LEU 70 H LEU 70 11.925 7.213 7.524 565 HA LEU 70 HA LEU 70 13.807 5.297 6.728 566 HB2 LEU 70 HB2 LEU 70 14.274 7.636 7.536 567 HB3 LEU 70 HB3 LEU 70 13.666 7.220 9.125 568 HG LEU 70 HG LEU 70 15.704 5.610 9.308 569 HD11 LEU 70 HD11 LEU 70 16.372 5.685 6.938 570 HD12 LEU 70 HD12 LEU 70 16.640 7.443 7.057 571 HD13 LEU 70 HD13 LEU 70 17.667 6.345 7.980 572 HD21 LEU 70 HD21 LEU 70 17.128 7.471 10.075 573 HD22 LEU 70 HD22 LEU 70 16.122 8.631 9.183 574 HD23 LEU 70 HD23 LEU 70 15.445 7.736 10.557 575 H GLY 71 H GLY 71 11.840 5.253 9.656 576 HA2 GLY 71 HA2 GLY 71 13.247 2.908 10.736 577 HA3 GLY 71 HA3 GLY 71 11.742 3.583 11.373 578 H VAL 72 H VAL 72 10.426 3.470 8.698 579 HA VAL 72 HA VAL 72 9.252 0.847 9.027 580 HB VAL 72 HB VAL 72 8.819 2.953 6.819 581 HG11 VAL 72 HG11 VAL 72 7.172 0.568 7.765 582 HG12 VAL 72 HG12 VAL 72 6.621 1.780 6.591 583 HG13 VAL 72 HG13 VAL 72 7.974 0.719 6.183 584 HG21 VAL 72 HG21 VAL 72 8.355 3.877 9.071 585 HG22 VAL 72 HG22 VAL 72 6.885 3.660 8.110 586 HG23 VAL 72 HG23 VAL 72 7.286 2.506 9.408 587 H ILE 73 H ILE 73 11.539 2.383 6.774 588 HA ILE 73 HA ILE 73 11.845 0.301 4.888 589 HB ILE 73 HB ILE 73 13.718 2.438 5.920 590 HG12 ILE 73 HG12 ILE 73 13.769 3.074 3.530 591 HG13 ILE 73 HG13 ILE 73 12.800 1.662 3.127 592 HG21 ILE 73 HG21 ILE 73 14.611 0.185 4.061 593 HG22 ILE 73 HG22 ILE 73 15.471 1.719 4.258 594 HG23 ILE 73 HG23 ILE 73 15.327 0.620 5.633 595 HD11 ILE 73 HD11 ILE 73 11.495 3.723 3.099 596 HD12 ILE 73 HD12 ILE 73 10.877 2.627 4.344 597 HD13 ILE 73 HD13 ILE 73 11.914 3.998 4.790 598 H VAL 74 H VAL 74 13.512 0.582 8.086 599 HA VAL 74 HA VAL 74 14.861 -1.958 7.683 600 HB VAL 74 HB VAL 74 14.201 -0.204 10.127 601 HG11 VAL 74 HG11 VAL 74 15.674 -2.873 10.179 602 HG12 VAL 74 HG12 VAL 74 15.714 -1.658 11.494 603 HG13 VAL 74 HG13 VAL 74 14.188 -2.432 11.046 604 HG21 VAL 74 HG21 VAL 74 16.863 -0.942 8.818 605 HG22 VAL 74 HG22 VAL 74 15.952 0.556 8.527 606 HG23 VAL 74 HG23 VAL 74 16.596 0.225 10.139 607 H ASN 75 H ASN 75 11.754 -1.028 9.210 608 HA ASN 75 HA ASN 75 11.004 -3.522 10.273 609 HB2 ASN 75 HB2 ASN 75 9.812 -1.003 9.840 610 HB3 ASN 75 HB3 ASN 75 8.820 -2.115 8.896 611 HD21 ASN 75 HD21 ASN 75 10.477 -1.926 12.104 612 HD22 ASN 75 HD22 ASN 75 9.101 -2.515 12.998 613 H ILE 76 H ILE 76 10.681 -2.269 6.984 614 HA ILE 76 HA ILE 76 9.374 -4.459 5.775 615 HB ILE 76 HB ILE 76 10.835 -1.959 5.018 616 HG12 ILE 76 HG12 ILE 76 8.165 -3.148 4.182 617 HG13 ILE 76 HG13 ILE 76 8.430 -1.934 5.426 618 HG21 ILE 76 HG21 ILE 76 10.295 -4.006 2.921 619 HG22 ILE 76 HG22 ILE 76 10.927 -2.369 2.666 620 HG23 ILE 76 HG23 ILE 76 11.906 -3.569 3.497 621 HD11 ILE 76 HD11 ILE 76 8.751 -1.614 2.442 622 HD12 ILE 76 HD12 ILE 76 7.663 -0.761 3.550 623 HD13 ILE 76 HD13 ILE 76 9.418 -0.444 3.623 624 H LEU 77 H LEU 77 12.842 -3.870 6.539 625 HA LEU 77 HA LEU 77 13.777 -6.071 4.876 626 HB2 LEU 77 HB2 LEU 77 15.236 -4.169 5.523 627 HB3 LEU 77 HB3 LEU 77 15.109 -4.607 7.205 628 HG LEU 77 HG LEU 77 17.204 -5.216 6.069 629 HD11 LEU 77 HD11 LEU 77 16.352 -6.318 8.194 630 HD12 LEU 77 HD12 LEU 77 16.025 -7.742 7.186 631 HD13 LEU 77 HD13 LEU 77 17.656 -7.096 7.305 632 HD21 LEU 77 HD21 LEU 77 17.345 -7.279 4.707 633 HD22 LEU 77 HD22 LEU 77 15.593 -7.380 4.654 634 HD23 LEU 77 HD23 LEU 77 16.440 -6.011 3.902 635 H LYS 78 H LYS 78 12.852 -5.627 8.279 636 HA LYS 78 HA LYS 78 13.551 -8.199 9.227 637 HB2 LYS 78 HB2 LYS 78 11.197 -6.438 10.082 638 HB3 LYS 78 HB3 LYS 78 11.779 -7.867 10.944 639 HG2 LYS 78 HG2 LYS 78 13.982 -6.882 11.159 640 HG3 LYS 78 HG3 LYS 78 13.471 -5.403 10.324 641 HD2 LYS 78 HD2 LYS 78 12.132 -4.684 12.099 642 HD3 LYS 78 HD3 LYS 78 11.929 -6.305 12.779 643 HE2 LYS 78 HE2 LYS 78 14.667 -5.053 12.641 644 HE3 LYS 78 HE3 LYS 78 13.553 -4.567 13.941 645 HZ1 LYS 78 HZ1 LYS 78 13.607 -6.701 14.839 646 HZ2 LYS 78 HZ2 LYS 78 14.186 -7.406 13.448 647 HZ3 LYS 78 HZ3 LYS 78 15.145 -6.458 14.376 648 H SER 79 H SER 79 10.577 -7.155 7.587 649 HA SER 79 HA SER 79 9.154 -9.594 7.632 650 HB2 SER 79 HB2 SER 79 8.387 -7.294 6.820 651 HB3 SER 79 HB3 SER 79 9.257 -7.629 5.315 652 HG SER 79 HG SER 79 7.163 -9.213 6.403 653 H ILE 80 H ILE 80 11.450 -8.425 5.125 654 HA ILE 80 HA ILE 80 11.277 -10.801 3.565 655 HB ILE 80 HB ILE 80 13.316 -8.529 3.664 656 HG12 ILE 80 HG12 ILE 80 10.809 -9.135 2.019 657 HG13 ILE 80 HG13 ILE 80 11.027 -7.822 3.154 658 HG21 ILE 80 HG21 ILE 80 14.038 -9.282 1.407 659 HG22 ILE 80 HG22 ILE 80 14.361 -10.516 2.619 660 HG23 ILE 80 HG23 ILE 80 12.945 -10.690 1.536 661 HD11 ILE 80 HD11 ILE 80 12.638 -6.734 1.755 662 HD12 ILE 80 HD12 ILE 80 12.540 -8.044 0.519 663 HD13 ILE 80 HD13 ILE 80 11.150 -7.041 0.861 664 H SER 81 H SER 81 13.540 -9.833 6.130 665 HA SER 81 HA SER 81 15.289 -12.099 5.920 666 HB2 SER 81 HB2 SER 81 16.037 -10.046 6.913 667 HB3 SER 81 HB3 SER 81 14.679 -10.017 8.044 668 HG SER 81 HG SER 81 17.016 -11.624 8.125 669 H SER 82 H SER 82 12.234 -11.528 7.767 670 HA SER 82 HA SER 82 12.315 -14.041 9.167 671 HB2 SER 82 HB2 SER 82 9.984 -12.281 8.294 672 HB3 SER 82 HB3 SER 82 9.880 -13.655 9.406 673 HG SER 82 HG SER 82 11.005 -12.645 10.888 674 H SER 83 H SER 83 11.150 -13.024 5.954 675 HA SER 83 HA SER 83 9.761 -15.465 5.432 676 HB2 SER 83 HB2 SER 83 10.676 -13.277 3.537 677 HB3 SER 83 HB3 SER 83 9.449 -14.505 3.187 678 HG SER 83 HG SER 83 9.389 -12.412 5.161 679 H GLY 84 H GLY 84 12.700 -14.154 3.750 680 HA2 GLY 84 HA2 GLY 84 14.353 -16.227 3.449 681 HA3 GLY 84 HA3 GLY 84 12.948 -16.831 2.547 682 H GLY 85 H GLY 85 14.057 -13.399 2.635 683 HA2 GLY 85 HA2 GLY 85 14.743 -13.666 -0.265 684 HA3 GLY 85 HA3 GLY 85 13.715 -12.381 0.381 685 H PHE 86 H PHE 86 15.351 -11.012 -0.635 686 HA PHE 86 HA PHE 86 17.272 -10.134 1.403 687 HB2 PHE 86 HB2 PHE 86 18.033 -11.148 -1.239 688 HB3 PHE 86 HB3 PHE 86 18.597 -9.523 -1.016 689 HD1 PHE 86 HD1 PHE 86 18.741 -12.990 0.223 690 HD2 PHE 86 HD2 PHE 86 20.680 -9.094 0.522 691 HE1 PHE 86 HE1 PHE 86 20.614 -13.981 1.485 692 HE2 PHE 86 HE2 PHE 86 22.443 -10.103 1.832 693 HZ PHE 86 HZ PHE 86 22.474 -12.537 2.301 694 H PHE 87 H PHE 87 17.567 -7.808 1.262 695 HA PHE 87 HA PHE 87 16.210 -6.391 -0.842 696 HB2 PHE 87 HB2 PHE 87 14.316 -6.423 0.400 697 HB3 PHE 87 HB3 PHE 87 15.132 -6.508 1.955 698 HD1 PHE 87 HD1 PHE 87 15.040 -3.964 -0.926 699 HD2 PHE 87 HD2 PHE 87 14.786 -4.655 3.379 700 HE1 PHE 87 HE1 PHE 87 14.396 -1.610 -0.508 701 HE2 PHE 87 HE2 PHE 87 14.190 -2.325 3.745 702 HZ PHE 87 HZ PHE 87 13.903 -0.792 1.773 703 H ALA 88 H ALA 88 17.006 -4.295 -0.997 704 HA ALA 88 HA ALA 88 19.008 -3.376 0.862 705 HB1 ALA 88 HB1 ALA 88 20.825 -3.409 -0.676 706 HB2 ALA 88 HB2 ALA 88 20.220 -5.058 -0.481 707 HB3 ALA 88 HB3 ALA 88 19.801 -4.152 -1.947 708 H LEU 89 H LEU 89 20.011 -1.298 -0.017 709 HA LEU 89 HA LEU 89 17.878 0.226 -1.462 710 HB2 LEU 89 HB2 LEU 89 19.939 1.680 0.131 711 HB3 LEU 89 HB3 LEU 89 18.302 2.116 -0.303 712 HG LEU 89 HG LEU 89 19.118 0.143 1.864 713 HD11 LEU 89 HD11 LEU 89 17.538 2.766 2.092 714 HD12 LEU 89 HD12 LEU 89 18.078 1.696 3.417 715 HD13 LEU 89 HD13 LEU 89 19.253 2.619 2.464 716 HD21 LEU 89 HD21 LEU 89 16.813 -0.084 2.375 717 HD22 LEU 89 HD22 LEU 89 16.356 1.064 1.090 718 HD23 LEU 89 HD23 LEU 89 17.070 -0.489 0.666 719 H VAL 90 H VAL 90 18.830 2.165 -2.775 720 HA VAL 90 HA VAL 90 21.409 1.568 -3.932 721 HB VAL 90 HB VAL 90 20.499 0.317 -5.457 722 HG11 VAL 90 HG11 VAL 90 18.816 -0.673 -5.910 723 HG12 VAL 90 HG12 VAL 90 18.666 -0.298 -4.246 724 HG13 VAL 90 HG13 VAL 90 17.736 0.604 -5.399 725 HG21 VAL 90 HG21 VAL 90 19.577 2.675 -6.824 726 HG22 VAL 90 HG22 VAL 90 21.207 2.010 -6.806 727 HG23 VAL 90 HG23 VAL 90 19.905 1.065 -7.526 728 H SER 91 H SER 91 22.317 3.235 -5.177 729 HA SER 91 HA SER 91 22.959 5.349 -5.371 730 HB2 SER 91 HB2 SER 91 21.197 6.811 -6.562 731 HB3 SER 91 HB3 SER 91 21.807 5.359 -7.341 732 HG SER 91 HG SER 91 19.527 5.666 -7.451 733 HA PRO 92 HA PRO 92 20.849 6.524 -1.405 734 HB2 PRO 92 HB2 PRO 92 22.899 6.251 0.374 735 HB3 PRO 92 HB3 PRO 92 21.933 4.881 -0.261 736 HG2 PRO 92 HG2 PRO 92 24.630 5.873 -1.292 737 HG3 PRO 92 HG3 PRO 92 24.173 4.190 -0.877 738 HD2 PRO 92 HD2 PRO 92 24.076 5.049 -3.398 739 HD3 PRO 92 HD3 PRO 92 22.848 3.942 -2.720 740 H ASN 93 H ASN 93 22.837 8.121 -3.428 741 HA ASN 93 HA ASN 93 23.631 10.205 -3.658 742 HB2 ASN 93 HB2 ASN 93 21.902 11.123 -1.341 743 HB3 ASN 93 HB3 ASN 93 22.504 12.057 -2.701 744 HD21 ASN 93 HD21 ASN 93 20.205 9.500 -1.784 745 HD22 ASN 93 HD22 ASN 93 19.046 9.859 -3.042 746 H GLU 94 H GLU 94 24.235 12.239 -1.702 747 HA GLU 94 HA GLU 94 26.263 10.920 0.002 748 HB2 GLU 94 HB2 GLU 94 27.033 12.778 -1.317 749 HB3 GLU 94 HB3 GLU 94 25.709 13.828 -0.722 750 HG2 GLU 94 HG2 GLU 94 26.517 13.755 1.497 751 HG3 GLU 94 HG3 GLU 94 27.636 12.438 1.117 752 H LYS 95 H LYS 95 22.989 11.928 0.096 753 HA LYS 95 HA LYS 95 23.093 13.100 2.768 754 HB2 LYS 95 HB2 LYS 95 22.043 13.966 0.560 755 HB3 LYS 95 HB3 LYS 95 20.642 13.081 1.153 756 HG2 LYS 95 HG2 LYS 95 22.015 14.739 3.288 757 HG3 LYS 95 HG3 LYS 95 21.578 15.656 1.846 758 HD2 LYS 95 HD2 LYS 95 19.706 15.830 3.259 759 HD3 LYS 95 HD3 LYS 95 19.380 14.705 1.928 760 HE2 LYS 95 HE2 LYS 95 18.342 14.057 4.080 761 HE3 LYS 95 HE3 LYS 95 19.354 12.789 3.323 762 HZ1 LYS 95 HZ1 LYS 95 19.597 13.179 5.744 763 HZ2 LYS 95 HZ2 LYS 95 20.985 13.112 4.885 764 HZ3 LYS 95 HZ3 LYS 95 20.370 14.576 5.456 765 H VAL 96 H VAL 96 21.610 10.224 1.201 766 HA VAL 96 HA VAL 96 20.475 9.299 3.818 767 HB VAL 96 HB VAL 96 20.193 8.711 0.934 768 HG11 VAL 96 HG11 VAL 96 19.396 6.324 2.443 769 HG12 VAL 96 HG12 VAL 96 19.904 6.531 0.784 770 HG13 VAL 96 HG13 VAL 96 21.147 6.443 2.042 771 HG21 VAL 96 HG21 VAL 96 17.922 8.360 1.627 772 HG22 VAL 96 HG22 VAL 96 18.389 8.373 3.330 773 HG23 VAL 96 HG23 VAL 96 18.557 9.851 2.298 774 H GLU 97 H GLU 97 23.472 8.776 1.795 775 HA GLU 97 HA GLU 97 24.544 6.831 3.528 776 HB2 GLU 97 HB2 GLU 97 25.646 8.969 1.718 777 HB3 GLU 97 HB3 GLU 97 26.750 8.236 2.863 778 HG2 GLU 97 HG2 GLU 97 25.044 6.646 0.916 779 HG3 GLU 97 HG3 GLU 97 26.707 7.148 0.585 780 H ARG 98 H ARG 98 24.206 10.366 3.929 781 HA ARG 98 HA ARG 98 25.969 10.432 6.110 782 HB2 ARG 98 HB2 ARG 98 25.640 12.670 6.185 783 HB3 ARG 98 HB3 ARG 98 24.851 12.363 4.668 784 HG2 ARG 98 HG2 ARG 98 23.226 13.653 5.589 785 HG3 ARG 98 HG3 ARG 98 22.716 12.069 6.195 786 HD2 ARG 98 HD2 ARG 98 24.285 12.560 8.203 787 HD3 ARG 98 HD3 ARG 98 24.279 14.225 7.604 788 HE ARG 98 HE ARG 98 21.575 13.552 7.962 789 HH11 ARG 98 HH11 ARG 98 24.486 14.252 9.837 790 HH12 ARG 98 HH12 ARG 98 23.611 14.427 11.335 791 HH21 ARG 98 HH21 ARG 98 20.447 13.682 10.054 792 HH22 ARG 98 HH22 ARG 98 21.384 14.130 11.439 793 H VAL 99 H VAL 99 22.535 9.542 6.034 794 HA VAL 99 HA VAL 99 22.341 10.025 8.952 795 HB VAL 99 HB VAL 99 20.672 11.012 7.282 796 HG11 VAL 99 HG11 VAL 99 18.921 9.787 6.377 797 HG12 VAL 99 HG12 VAL 99 20.415 9.006 5.859 798 HG13 VAL 99 HG13 VAL 99 19.417 8.312 7.188 799 HG21 VAL 99 HG21 VAL 99 20.188 10.630 9.763 800 HG22 VAL 99 HG22 VAL 99 18.733 10.588 8.743 801 HG23 VAL 99 HG23 VAL 99 19.427 9.079 9.319 802 H LEU 100 H LEU 100 22.312 7.595 6.387 803 HA LEU 100 HA LEU 100 21.483 5.411 7.983 804 HB2 LEU 100 HB2 LEU 100 22.780 5.754 5.246 805 HB3 LEU 100 HB3 LEU 100 22.673 4.192 5.997 806 HG LEU 100 HG LEU 100 20.203 4.958 6.424 807 HD11 LEU 100 HD11 LEU 100 18.920 5.763 4.774 808 HD12 LEU 100 HD12 LEU 100 19.755 6.783 5.920 809 HD13 LEU 100 HD13 LEU 100 20.396 6.677 4.291 810 HD21 LEU 100 HD21 LEU 100 20.783 3.991 3.661 811 HD22 LEU 100 HD22 LEU 100 21.078 2.922 5.078 812 HD23 LEU 100 HD23 LEU 100 19.433 3.486 4.750 813 H SER 101 H SER 101 24.446 7.170 8.131 814 HA SER 101 HA SER 101 25.822 4.852 9.368 815 HB2 SER 101 HB2 SER 101 26.998 6.551 7.882 816 HB3 SER 101 HB3 SER 101 26.640 7.766 9.107 817 HG SER 101 HG SER 101 28.606 5.853 9.017 818 H LEU 102 H LEU 102 24.505 8.097 10.066 819 HA LEU 102 HA LEU 102 25.095 8.287 12.760 820 HB2 LEU 102 HB2 LEU 102 22.789 9.515 11.195 821 HB3 LEU 102 HB3 LEU 102 23.269 9.953 12.820 822 HG LEU 102 HG LEU 102 24.167 11.131 10.436 823 HD11 LEU 102 HD11 LEU 102 25.396 12.530 11.964 824 HD12 LEU 102 HD12 LEU 102 23.756 12.172 12.559 825 HD13 LEU 102 HD13 LEU 102 25.162 11.307 13.255 826 HD21 LEU 102 HD21 LEU 102 26.444 9.774 11.943 827 HD22 LEU 102 HD22 LEU 102 26.010 9.489 10.235 828 HD23 LEU 102 HD23 LEU 102 26.634 11.049 10.735 829 H THR 103 H THR 103 22.105 6.956 11.281 830 HA THR 103 HA THR 103 20.927 6.570 13.948 831 HB THR 103 HB THR 103 19.557 7.344 12.141 832 HG1 THR 103 HG1 THR 103 17.892 6.101 12.693 833 HG21 THR 103 HG21 THR 103 20.658 5.151 10.535 834 HG22 THR 103 HG22 THR 103 18.887 5.151 10.547 835 HG23 THR 103 HG23 THR 103 19.759 6.587 10.031 836 H ASN 104 H ASN 104 23.047 4.793 11.931 837 HA ASN 104 HA ASN 104 23.576 2.657 11.553 838 HB2 ASN 104 HB2 ASN 104 21.779 1.665 13.808 839 HB3 ASN 104 HB3 ASN 104 22.990 0.777 12.961 840 HD21 ASN 104 HD21 ASN 104 22.439 3.406 15.222 841 HD22 ASN 104 HD22 ASN 104 24.039 3.478 15.968 842 H LEU 105 H LEU 105 22.526 2.915 9.550 843 HA LEU 105 HA LEU 105 19.937 1.468 9.280 844 HB2 LEU 105 HB2 LEU 105 20.099 4.012 8.619 845 HB3 LEU 105 HB3 LEU 105 20.792 3.186 7.224 846 HG LEU 105 HG LEU 105 18.452 3.568 6.829 847 HD11 LEU 105 HD11 LEU 105 18.620 0.619 7.558 848 HD12 LEU 105 HD12 LEU 105 17.525 1.401 6.405 849 HD13 LEU 105 HD13 LEU 105 19.259 1.322 6.064 850 HD21 LEU 105 HD21 LEU 105 17.775 3.973 9.062 851 HD22 LEU 105 HD22 LEU 105 16.721 2.751 8.357 852 HD23 LEU 105 HD23 LEU 105 17.989 2.277 9.523 853 H ASP 106 H ASP 106 23.063 2.444 7.648 854 HA ASP 106 HA ASP 106 22.966 0.396 5.736 855 HB2 ASP 106 HB2 ASP 106 24.855 1.329 4.960 856 HB3 ASP 106 HB3 ASP 106 24.687 2.524 6.232 857 H ARG 107 H ARG 107 23.883 0.479 9.010 858 HA ARG 107 HA ARG 107 25.370 -2.007 9.210 859 HB2 ARG 107 HB2 ARG 107 24.211 -0.263 11.417 860 HB3 ARG 107 HB3 ARG 107 25.527 -1.447 11.536 861 HG2 ARG 107 HG2 ARG 107 26.780 -0.032 9.793 862 HG3 ARG 107 HG3 ARG 107 25.553 1.216 10.051 863 HD2 ARG 107 HD2 ARG 107 26.195 1.514 12.322 864 HD3 ARG 107 HD3 ARG 107 27.245 0.067 12.294 865 HE ARG 107 HE ARG 107 28.143 1.654 10.252 866 HH11 ARG 107 HH11 ARG 107 27.822 2.202 13.680 867 HH12 ARG 107 HH12 ARG 107 29.201 3.254 13.818 868 HH21 ARG 107 HH21 ARG 107 29.713 3.100 10.264 869 HH22 ARG 107 HH22 ARG 107 30.338 3.890 11.672 870 H ILE 108 H ILE 108 22.240 -1.637 8.514 871 HA ILE 108 HA ILE 108 21.351 -3.936 10.168 872 HB ILE 108 HB ILE 108 19.572 -1.679 9.172 873 HG12 ILE 108 HG12 ILE 108 20.962 -1.954 11.868 874 HG13 ILE 108 HG13 ILE 108 21.053 -0.601 10.748 875 HG21 ILE 108 HG21 ILE 108 17.960 -2.685 10.691 876 HG22 ILE 108 HG22 ILE 108 18.627 -4.003 9.739 877 HG23 ILE 108 HG23 ILE 108 19.204 -3.730 11.402 878 HD11 ILE 108 HD11 ILE 108 19.619 0.006 12.586 879 HD12 ILE 108 HD12 ILE 108 18.626 -0.140 11.130 880 HD13 ILE 108 HD13 ILE 108 18.608 -1.403 12.385 881 H VAL 109 H VAL 109 21.261 -2.247 6.961 882 HA VAL 109 HA VAL 109 20.392 -4.784 5.732 883 HB VAL 109 HB VAL 109 19.758 -2.055 4.558 884 HG11 VAL 109 HG11 VAL 109 19.071 -3.681 3.096 885 HG12 VAL 109 HG12 VAL 109 18.870 -4.929 4.342 886 HG13 VAL 109 HG13 VAL 109 17.631 -3.716 4.099 887 HG21 VAL 109 HG21 VAL 109 17.454 -2.213 5.646 888 HG22 VAL 109 HG22 VAL 109 18.137 -3.380 6.799 889 HG23 VAL 109 HG23 VAL 109 18.762 -1.707 6.726 890 H LYS 110 H LYS 110 20.738 -3.729 3.088 891 HA LYS 110 HA LYS 110 23.650 -3.487 2.705 892 HB2 LYS 110 HB2 LYS 110 21.524 -5.147 1.399 893 HB3 LYS 110 HB3 LYS 110 22.825 -4.546 0.402 894 HG2 LYS 110 HG2 LYS 110 23.705 -5.765 2.988 895 HG3 LYS 110 HG3 LYS 110 22.906 -6.877 1.865 896 HD2 LYS 110 HD2 LYS 110 25.255 -6.941 1.452 897 HD3 LYS 110 HD3 LYS 110 24.452 -6.263 0.076 898 HE2 LYS 110 HE2 LYS 110 26.342 -4.921 0.256 899 HE3 LYS 110 HE3 LYS 110 25.035 -3.930 0.851 900 HZ1 LYS 110 HZ1 LYS 110 26.963 -3.719 2.197 901 HZ2 LYS 110 HZ2 LYS 110 25.831 -4.389 3.131 902 HZ3 LYS 110 HZ3 LYS 110 27.089 -5.293 2.518 903 H ILE 111 H ILE 111 24.125 -2.189 0.872 904 HA ILE 111 HA ILE 111 22.002 -0.472 -0.211 905 HB ILE 111 HB ILE 111 23.293 0.300 1.964 906 HG12 ILE 111 HG12 ILE 111 23.349 2.723 0.537 907 HG13 ILE 111 HG13 ILE 111 22.057 1.770 -0.172 908 HG21 ILE 111 HG21 ILE 111 25.216 1.383 -0.134 909 HG22 ILE 111 HG22 ILE 111 25.260 1.661 1.628 910 HG23 ILE 111 HG23 ILE 111 25.616 0.051 0.960 911 HD11 ILE 111 HD11 ILE 111 21.259 3.064 1.733 912 HD12 ILE 111 HD12 ILE 111 21.236 1.329 2.229 913 HD13 ILE 111 HD13 ILE 111 22.534 2.405 2.778 914 H TYR 112 H TYR 112 22.655 0.397 -2.330 915 HA TYR 112 HA TYR 112 25.120 -0.767 -3.506 916 HB2 TYR 112 HB2 TYR 112 22.185 -0.987 -4.335 917 HB3 TYR 112 HB3 TYR 112 23.508 -1.336 -5.436 918 HD1 TYR 112 HD1 TYR 112 25.174 -3.022 -4.957 919 HD2 TYR 112 HD2 TYR 112 21.651 -2.630 -2.491 920 HE1 TYR 112 HE1 TYR 112 25.511 -5.296 -4.211 921 HE2 TYR 112 HE2 TYR 112 21.966 -5.092 -1.836 922 HH TYR 112 HH TYR 112 24.793 -6.946 -2.772 923 H ASP 113 H ASP 113 25.471 -0.000 -5.778 924 HA ASP 113 HA ASP 113 25.268 2.925 -5.775 925 HB2 ASP 113 HB2 ASP 113 27.082 0.893 -6.857 926 HB3 ASP 113 HB3 ASP 113 26.623 2.043 -8.099 927 H THR 114 H THR 114 24.398 0.182 -7.953 928 HA THR 114 HA THR 114 22.419 1.909 -9.333 929 HB THR 114 HB THR 114 23.097 0.928 -11.445 930 HG1 THR 114 HG1 THR 114 25.516 -0.083 -10.578 931 HG21 THR 114 HG21 THR 114 25.543 2.124 -10.094 932 HG22 THR 114 HG22 THR 114 25.236 2.015 -11.836 933 HG23 THR 114 HG23 THR 114 24.188 3.018 -10.824 934 H ILE 115 H ILE 115 21.043 0.250 -10.782 935 HA ILE 115 HA ILE 115 20.034 -1.784 -8.934 936 HB ILE 115 HB ILE 115 19.310 -0.742 -11.678 937 HG12 ILE 115 HG12 ILE 115 18.358 0.407 -9.762 938 HG13 ILE 115 HG13 ILE 115 17.105 -0.494 -10.609 939 HG21 ILE 115 HG21 ILE 115 19.108 -3.061 -12.130 940 HG22 ILE 115 HG22 ILE 115 18.414 -3.429 -10.555 941 HG23 ILE 115 HG23 ILE 115 17.471 -2.513 -11.758 942 HD11 ILE 115 HD11 ILE 115 18.333 -1.155 -7.938 943 HD12 ILE 115 HD12 ILE 115 16.646 -0.876 -8.341 944 HD13 ILE 115 HD13 ILE 115 17.452 -2.356 -8.882 945 H SER 116 H SER 116 22.172 -1.678 -11.852 946 HA SER 116 HA SER 116 22.059 -4.519 -12.072 947 HB2 SER 116 HB2 SER 116 22.581 -3.138 -13.950 948 HB3 SER 116 HB3 SER 116 23.980 -2.415 -13.125 949 HG SER 116 HG SER 116 24.761 -3.924 -14.548 950 H GLU 117 H GLU 117 24.137 -2.262 -10.193 951 HA GLU 117 HA GLU 117 25.939 -4.335 -9.343 952 HB2 GLU 117 HB2 GLU 117 25.416 -1.462 -8.723 953 HB3 GLU 117 HB3 GLU 117 26.090 -2.365 -7.389 954 HG2 GLU 117 HG2 GLU 117 28.107 -2.729 -8.367 955 HG3 GLU 117 HG3 GLU 117 27.443 -2.888 -9.986 956 H ALA 118 H ALA 118 22.668 -4.022 -8.706 957 HA ALA 118 HA ALA 118 22.938 -5.087 -5.933 958 HB1 ALA 118 HB1 ALA 118 20.900 -4.237 -5.406 959 HB2 ALA 118 HB2 ALA 118 21.769 -2.925 -6.234 960 HB3 ALA 118 HB3 ALA 118 20.502 -3.796 -7.109 961 H MET 119 H MET 119 21.354 -5.389 -9.116 962 HA MET 119 HA MET 119 19.439 -7.188 -8.464 963 HB2 MET 119 HB2 MET 119 20.075 -5.785 -10.746 964 HB3 MET 119 HB3 MET 119 20.651 -7.364 -11.232 965 HG2 MET 119 HG2 MET 119 18.184 -7.937 -10.060 966 HG3 MET 119 HG3 MET 119 17.938 -6.330 -10.744 967 HE1 MET 119 HE1 MET 119 18.483 -10.337 -12.949 968 HE2 MET 119 HE2 MET 119 19.700 -9.765 -11.783 969 HE3 MET 119 HE3 MET 119 18.031 -10.102 -11.246 970 H GLU 120 H GLU 120 22.538 -8.013 -10.016 971 HA GLU 120 HA GLU 120 22.180 -10.881 -9.550 972 HB2 GLU 120 HB2 GLU 120 24.428 -10.949 -10.655 973 HB3 GLU 120 HB3 GLU 120 23.158 -10.181 -11.634 974 HG2 GLU 120 HG2 GLU 120 24.013 -7.966 -11.181 975 HG3 GLU 120 HG3 GLU 120 25.196 -8.621 -9.982 976 H GLU 121 H GLU 121 23.327 -8.188 -7.739 977 HA GLU 121 HA GLU 121 25.570 -9.664 -6.617 978 HB2 GLU 121 HB2 GLU 121 25.362 -7.135 -7.252 979 HB3 GLU 121 HB3 GLU 121 24.572 -6.977 -5.669 980 HG2 GLU 121 HG2 GLU 121 26.827 -6.499 -5.226 981 HG3 GLU 121 HG3 GLU 121 26.704 -8.193 -4.743 982 H VAL 122 H VAL 122 22.522 -8.236 -5.389 983 HA VAL 122 HA VAL 122 22.452 -9.087 -2.709 984 HB VAL 122 HB VAL 122 21.019 -7.560 -4.265 985 HG11 VAL 122 HG11 VAL 122 19.925 -9.141 -5.675 986 HG12 VAL 122 HG12 VAL 122 19.290 -10.034 -4.267 987 HG13 VAL 122 HG13 VAL 122 18.720 -8.415 -4.605 988 HG21 VAL 122 HG21 VAL 122 19.260 -7.727 -2.350 989 HG22 VAL 122 HG22 VAL 122 20.444 -8.895 -1.699 990 HG23 VAL 122 HG23 VAL 122 20.941 -7.241 -2.027 991 H ARG 123 H ARG 123 22.017 -10.990 -5.549 992 HA ARG 123 HA ARG 123 20.657 -13.300 -4.606 993 HB2 ARG 123 HB2 ARG 123 22.856 -12.876 -6.667 994 HB3 ARG 123 HB3 ARG 123 21.946 -14.348 -6.546 995 HG2 ARG 123 HG2 ARG 123 20.242 -11.911 -6.763 996 HG3 ARG 123 HG3 ARG 123 21.292 -12.152 -8.144 997 HD2 ARG 123 HD2 ARG 123 19.020 -13.174 -8.332 998 HD3 ARG 123 HD3 ARG 123 20.375 -14.269 -8.622 999 HE ARG 123 HE ARG 123 19.991 -14.592 -5.989 1000 HH11 ARG 123 HH11 ARG 123 17.689 -14.663 -8.664 1001 HH12 ARG 123 HH12 ARG 123 16.650 -15.863 -8.013 1002 HH21 ARG 123 HH21 ARG 123 18.828 -16.494 -5.241 1003 HH22 ARG 123 HH22 ARG 123 17.302 -16.924 -5.975 1004 H ARG 124 H ARG 124 24.046 -12.311 -4.502 1005 HA ARG 124 HA ARG 124 24.881 -14.333 -2.590 1006 HB2 ARG 124 HB2 ARG 124 26.767 -14.941 -4.417 1007 HB3 ARG 124 HB3 ARG 124 25.302 -15.853 -4.180 1008 HG2 ARG 124 HG2 ARG 124 25.691 -15.693 -6.510 1009 HG3 ARG 124 HG3 ARG 124 24.204 -14.910 -6.075 1010 HD2 ARG 124 HD2 ARG 124 25.177 -13.487 -7.654 1011 HD3 ARG 124 HD3 ARG 124 25.439 -12.674 -6.125 1012 HE ARG 124 HE ARG 124 27.506 -14.366 -7.462 1013 HH11 ARG 124 HH11 ARG 124 27.126 -11.553 -5.488 1014 HH12 ARG 124 HH12 ARG 124 27.876 -10.415 -6.621 1015 HH21 ARG 124 HH21 ARG 124 28.662 -12.922 -8.973 1016 HH22 ARG 124 HH22 ARG 124 28.979 -11.306 -8.490 1017 H LYS 125 H LYS 125 24.601 -11.734 -2.125 1018 HA LYS 125 HA LYS 125 26.968 -10.252 -2.613 1019 HB2 LYS 125 HB2 LYS 125 26.132 -8.706 -1.053 1020 HB3 LYS 125 HB3 LYS 125 24.732 -9.430 -1.756 1021 HG2 LYS 125 HG2 LYS 125 24.104 -9.491 0.391 1022 HG3 LYS 125 HG3 LYS 125 24.863 -11.077 0.305 1023 HD2 LYS 125 HD2 LYS 125 26.647 -8.787 1.151 1024 HD3 LYS 125 HD3 LYS 125 25.292 -9.135 2.207 1025 HE2 LYS 125 HE2 LYS 125 26.541 -10.600 3.248 1026 HE3 LYS 125 HE3 LYS 125 26.316 -11.663 1.855 1027 HZ1 LYS 125 HZ1 LYS 125 28.540 -9.738 2.129 1028 HZ2 LYS 125 HZ2 LYS 125 28.658 -11.310 2.543 1029 HZ3 LYS 125 HZ3 LYS 125 28.394 -10.916 0.970 Start of MODEL 12 1 H1 MET 1 H1 MET 1 -9.169 -1.846 13.813 2 HA MET 1 HA MET 1 -8.834 -3.532 12.056 3 HB2 MET 1 HB2 MET 1 -10.333 -5.426 11.924 4 HB3 MET 1 HB3 MET 1 -9.418 -5.497 13.427 5 HG2 MET 1 HG2 MET 1 -12.319 -4.579 13.179 6 HG3 MET 1 HG3 MET 1 -11.792 -6.197 13.576 7 HE1 MET 1 HE1 MET 1 -12.916 -6.623 15.759 8 HE2 MET 1 HE2 MET 1 -13.106 -5.417 17.042 9 HE3 MET 1 HE3 MET 1 -13.845 -5.141 15.441 10 H GLY 2 H GLY 2 -9.897 -2.982 10.083 11 HA2 GLY 2 HA2 GLY 2 -12.691 -2.460 10.073 12 HA3 GLY 2 HA3 GLY 2 -11.752 -0.957 9.890 13 H SER 3 H SER 3 -13.396 -2.080 7.917 14 HA SER 3 HA SER 3 -13.568 -2.525 5.749 15 HB2 SER 3 HB2 SER 3 -10.577 -2.044 5.518 16 HB3 SER 3 HB3 SER 3 -11.756 -2.083 4.199 17 HG SER 3 HG SER 3 -12.822 -0.318 5.204 18 H ASP 4 H ASP 4 -13.873 -4.397 4.690 19 HA ASP 4 HA ASP 4 -12.748 -6.886 5.565 20 HB2 ASP 4 HB2 ASP 4 -14.907 -6.702 4.384 21 HB3 ASP 4 HB3 ASP 4 -14.083 -6.106 2.936 22 H LYS 5 H LYS 5 -12.115 -4.864 2.642 23 HA LYS 5 HA LYS 5 -9.277 -5.462 2.780 24 HB2 LYS 5 HB2 LYS 5 -10.789 -7.176 1.292 25 HB3 LYS 5 HB3 LYS 5 -10.612 -5.891 0.097 26 HG2 LYS 5 HG2 LYS 5 -8.211 -6.129 0.110 27 HG3 LYS 5 HG3 LYS 5 -8.244 -7.114 1.587 28 HD2 LYS 5 HD2 LYS 5 -9.305 -8.946 0.504 29 HD3 LYS 5 HD3 LYS 5 -9.606 -8.030 -0.972 30 HE2 LYS 5 HE2 LYS 5 -6.806 -8.597 0.090 31 HE3 LYS 5 HE3 LYS 5 -7.647 -9.714 -0.973 32 HZ1 LYS 5 HZ1 LYS 5 -7.254 -6.902 -1.778 33 HZ2 LYS 5 HZ2 LYS 5 -6.137 -8.063 -2.100 34 HZ3 LYS 5 HZ3 LYS 5 -7.669 -8.202 -2.693 35 H ILE 6 H ILE 6 -8.116 -3.833 1.438 36 HA ILE 6 HA ILE 6 -9.565 -1.305 1.326 37 HB ILE 6 HB ILE 6 -7.198 -1.669 2.039 38 HG12 ILE 6 HG12 ILE 6 -7.970 0.566 1.745 39 HG13 ILE 6 HG13 ILE 6 -6.293 0.406 1.261 40 HG21 ILE 6 HG21 ILE 6 -5.373 -1.806 0.531 41 HG22 ILE 6 HG22 ILE 6 -6.471 -3.148 0.174 42 HG23 ILE 6 HG23 ILE 6 -6.431 -1.742 -0.882 43 HD11 ILE 6 HD11 ILE 6 -8.699 0.850 -0.527 44 HD12 ILE 6 HD12 ILE 6 -7.318 1.907 -0.253 45 HD13 ILE 6 HD13 ILE 6 -7.092 0.405 -1.162 46 H HIS 7 H HIS 7 -10.619 -0.490 -0.451 47 HA HIS 7 HA HIS 7 -11.381 -2.182 -2.516 48 HB2 HIS 7 HB2 HIS 7 -11.395 0.837 -2.806 49 HB3 HIS 7 HB3 HIS 7 -12.539 -0.320 -3.460 50 HD1 HIS 7 HD1 HIS 7 -13.230 2.259 -1.628 51 HD2 HIS 7 HD2 HIS 7 -13.086 -1.799 -0.466 52 HE1 HIS 7 HE1 HIS 7 -14.681 2.057 0.471 53 H HIS 8 H HIS 8 -8.728 0.059 -2.445 54 HA HIS 8 HA HIS 8 -7.238 0.849 -3.932 55 HB2 HIS 8 HB2 HIS 8 -6.666 -1.533 -3.015 56 HB3 HIS 8 HB3 HIS 8 -6.743 -2.017 -4.688 57 HD1 HIS 8 HD1 HIS 8 -4.190 -1.153 -2.379 58 HD2 HIS 8 HD2 HIS 8 -5.238 0.153 -6.251 59 HE1 HIS 8 HE1 HIS 8 -2.142 0.013 -3.330 60 H HIS 9 H HIS 9 -8.873 1.920 -5.278 61 HA HIS 9 HA HIS 9 -8.335 1.286 -8.067 62 HB2 HIS 9 HB2 HIS 9 -10.860 0.640 -6.872 63 HB3 HIS 9 HB3 HIS 9 -11.125 2.164 -7.693 64 HD1 HIS 9 HD1 HIS 9 -12.520 1.283 -9.715 65 HD2 HIS 9 HD2 HIS 9 -8.905 -0.770 -8.995 66 HE1 HIS 9 HE1 HIS 9 -12.330 -0.491 -11.528 67 H HIS 10 H HIS 10 -9.073 3.210 -9.402 68 HA HIS 10 HA HIS 10 -9.471 5.248 -9.990 69 HB2 HIS 10 HB2 HIS 10 -11.408 4.833 -8.517 70 HB3 HIS 10 HB3 HIS 10 -10.562 5.649 -7.210 71 HD1 HIS 10 HD1 HIS 10 -9.715 7.954 -9.754 72 HD2 HIS 10 HD2 HIS 10 -13.325 6.769 -7.933 73 HE1 HIS 10 HE1 HIS 10 -11.350 9.883 -10.070 74 H HIS 11 H HIS 11 -7.537 5.204 -6.975 75 HA HIS 11 HA HIS 11 -6.093 7.628 -7.943 76 HB2 HIS 11 HB2 HIS 11 -5.484 5.710 -5.674 77 HB3 HIS 11 HB3 HIS 11 -4.397 6.978 -6.214 78 HD1 HIS 11 HD1 HIS 11 -7.631 6.559 -4.178 79 HD2 HIS 11 HD2 HIS 11 -5.197 9.584 -5.865 80 HE1 HIS 11 HE1 HIS 11 -8.284 8.704 -3.060 81 H HIS 12 H HIS 12 -3.947 7.397 -8.861 82 HA HIS 12 HA HIS 12 -3.435 4.818 -10.213 83 HB2 HIS 12 HB2 HIS 12 -3.197 6.150 -12.328 84 HB3 HIS 12 HB3 HIS 12 -4.836 5.926 -11.739 85 HD1 HIS 12 HD1 HIS 12 -2.616 8.655 -12.903 86 HD2 HIS 12 HD2 HIS 12 -5.976 8.155 -10.423 87 HE1 HIS 12 HE1 HIS 12 -3.607 10.974 -12.555 88 H MET 13 H MET 13 -1.547 4.425 -9.126 89 HA MET 13 HA MET 13 0.623 6.453 -9.090 90 HB2 MET 13 HB2 MET 13 -1.054 6.887 -7.246 91 HB3 MET 13 HB3 MET 13 -0.739 5.267 -6.618 92 HG2 MET 13 HG2 MET 13 1.595 5.869 -6.211 93 HG3 MET 13 HG3 MET 13 1.328 7.464 -6.929 94 HE1 MET 13 HE1 MET 13 -0.767 9.338 -4.236 95 HE2 MET 13 HE2 MET 13 0.079 9.436 -5.795 96 HE3 MET 13 HE3 MET 13 -1.434 8.514 -5.657 97 H PHE 14 H PHE 14 2.588 5.197 -9.583 98 HA PHE 14 HA PHE 14 2.954 2.761 -8.070 99 HB2 PHE 14 HB2 PHE 14 3.879 1.708 -10.060 100 HB3 PHE 14 HB3 PHE 14 2.147 1.758 -9.974 101 HD1 PHE 14 HD1 PHE 14 1.104 3.985 -11.384 102 HD2 PHE 14 HD2 PHE 14 4.812 1.881 -12.146 103 HE1 PHE 14 HE1 PHE 14 1.112 4.813 -13.680 104 HE2 PHE 14 HE2 PHE 14 4.793 2.721 -14.464 105 HZ PHE 14 HZ PHE 14 2.963 4.250 -15.223 106 HA PRO 15 HA PRO 15 6.783 5.346 -8.117 107 HB2 PRO 15 HB2 PRO 15 7.202 5.492 -5.456 108 HB3 PRO 15 HB3 PRO 15 5.974 6.478 -6.270 109 HG2 PRO 15 HG2 PRO 15 5.554 3.865 -4.778 110 HG3 PRO 15 HG3 PRO 15 4.650 5.408 -4.589 111 HD2 PRO 15 HD2 PRO 15 3.765 3.367 -6.171 112 HD3 PRO 15 HD3 PRO 15 3.469 5.085 -6.560 113 H TYR 16 H TYR 16 6.859 2.827 -9.048 114 HA TYR 16 HA TYR 16 9.144 1.594 -7.843 115 HB2 TYR 16 HB2 TYR 16 8.112 -0.470 -7.053 116 HB3 TYR 16 HB3 TYR 16 7.303 0.864 -6.312 117 HD1 TYR 16 HD1 TYR 16 6.918 -1.784 -8.882 118 HD2 TYR 16 HD2 TYR 16 5.045 1.347 -6.621 119 HE1 TYR 16 HE1 TYR 16 4.697 -2.536 -9.701 120 HE2 TYR 16 HE2 TYR 16 2.782 0.527 -7.330 121 HH TYR 16 HH TYR 16 1.605 -1.099 -8.621 122 H LYS 17 H LYS 17 9.439 -0.655 -9.023 123 HA LYS 17 HA LYS 17 7.989 -1.063 -11.470 124 HB2 LYS 17 HB2 LYS 17 9.794 -1.052 -12.994 125 HB3 LYS 17 HB3 LYS 17 9.880 0.505 -12.148 126 HG2 LYS 17 HG2 LYS 17 11.798 0.047 -11.049 127 HG3 LYS 17 HG3 LYS 17 11.620 -1.738 -11.193 128 HD2 LYS 17 HD2 LYS 17 12.200 -1.814 -13.367 129 HD3 LYS 17 HD3 LYS 17 11.921 -0.078 -13.648 130 HE2 LYS 17 HE2 LYS 17 13.919 0.340 -12.084 131 HE3 LYS 17 HE3 LYS 17 14.250 -1.407 -12.220 132 HZ1 LYS 17 HZ1 LYS 17 14.179 0.604 -14.360 133 HZ2 LYS 17 HZ2 LYS 17 15.480 -0.316 -13.936 134 HZ3 LYS 17 HZ3 LYS 17 14.172 -0.997 -14.691 135 H ILE 18 H ILE 18 9.032 -3.180 -12.501 136 HA ILE 18 HA ILE 18 10.444 -4.847 -10.504 137 HB ILE 18 HB ILE 18 8.044 -5.716 -12.179 138 HG12 ILE 18 HG12 ILE 18 7.406 -6.548 -9.685 139 HG13 ILE 18 HG13 ILE 18 8.386 -5.164 -9.235 140 HG21 ILE 18 HG21 ILE 18 9.881 -7.363 -10.385 141 HG22 ILE 18 HG22 ILE 18 8.382 -7.940 -11.161 142 HG23 ILE 18 HG23 ILE 18 9.736 -7.482 -12.155 143 HD11 ILE 18 HD11 ILE 18 5.973 -4.649 -9.372 144 HD12 ILE 18 HD12 ILE 18 6.854 -3.702 -10.582 145 HD13 ILE 18 HD13 ILE 18 5.947 -5.139 -11.070 146 H VAL 19 H VAL 19 12.229 -5.906 -11.467 147 HA VAL 19 HA VAL 19 12.572 -5.645 -14.392 148 HB VAL 19 HB VAL 19 14.936 -6.056 -13.873 149 HG11 VAL 19 HG11 VAL 19 15.435 -3.783 -13.056 150 HG12 VAL 19 HG12 VAL 19 14.123 -3.794 -14.234 151 HG13 VAL 19 HG13 VAL 19 13.747 -3.611 -12.511 152 HG21 VAL 19 HG21 VAL 19 15.852 -5.674 -11.628 153 HG22 VAL 19 HG22 VAL 19 14.214 -5.675 -10.965 154 HG23 VAL 19 HG23 VAL 19 14.886 -7.147 -11.679 155 H ASP 20 H ASP 20 14.649 -8.022 -13.719 156 HA ASP 20 HA ASP 20 13.526 -10.103 -14.777 157 HB2 ASP 20 HB2 ASP 20 15.583 -9.831 -12.591 158 HB3 ASP 20 HB3 ASP 20 15.042 -11.445 -13.058 159 H ASP 21 H ASP 21 13.936 -10.204 -11.289 160 HA ASP 21 HA ASP 21 11.104 -10.724 -10.763 161 HB2 ASP 21 HB2 ASP 21 11.269 -12.768 -10.007 162 HB3 ASP 21 HB3 ASP 21 12.729 -12.915 -10.968 163 H VAL 22 H VAL 22 13.436 -8.639 -10.295 164 HA VAL 22 HA VAL 22 13.204 -8.487 -7.336 165 HB VAL 22 HB VAL 22 15.232 -6.992 -9.074 166 HG11 VAL 22 HG11 VAL 22 14.564 -7.093 -6.147 167 HG12 VAL 22 HG12 VAL 22 16.237 -6.926 -6.620 168 HG13 VAL 22 HG13 VAL 22 15.028 -5.736 -7.155 169 HG21 VAL 22 HG21 VAL 22 16.863 -8.616 -8.033 170 HG22 VAL 22 HG22 VAL 22 15.472 -9.605 -7.523 171 HG23 VAL 22 HG23 VAL 22 15.791 -9.319 -9.244 172 H VAL 23 H VAL 23 12.000 -6.872 -6.473 173 HA VAL 23 HA VAL 23 10.580 -5.008 -8.281 174 HB VAL 23 HB VAL 23 10.453 -5.297 -5.263 175 HG11 VAL 23 HG11 VAL 23 8.468 -4.015 -7.189 176 HG12 VAL 23 HG12 VAL 23 8.305 -4.143 -5.430 177 HG13 VAL 23 HG13 VAL 23 9.573 -3.136 -6.114 178 HG21 VAL 23 HG21 VAL 23 8.773 -6.662 -7.397 179 HG22 VAL 23 HG22 VAL 23 9.753 -7.419 -6.116 180 HG23 VAL 23 HG23 VAL 23 8.298 -6.527 -5.701 181 H ILE 24 H ILE 24 11.006 -2.765 -8.210 182 HA ILE 24 HA ILE 24 13.301 -1.812 -6.546 183 HB ILE 24 HB ILE 24 12.568 -1.161 -9.449 184 HG12 ILE 24 HG12 ILE 24 15.051 -1.529 -9.813 185 HG13 ILE 24 HG13 ILE 24 15.140 -2.184 -8.172 186 HG21 ILE 24 HG21 ILE 24 14.335 0.323 -7.511 187 HG22 ILE 24 HG22 ILE 24 14.436 0.535 -9.285 188 HG23 ILE 24 HG23 ILE 24 12.953 0.930 -8.432 189 HD11 ILE 24 HD11 ILE 24 15.073 -3.769 -10.134 190 HD12 ILE 24 HD12 ILE 24 13.984 -4.132 -8.797 191 HD13 ILE 24 HD13 ILE 24 13.338 -3.379 -10.280 192 H LEU 25 H LEU 25 12.180 -0.487 -4.920 193 HA LEU 25 HA LEU 25 9.801 0.954 -5.828 194 HB2 LEU 25 HB2 LEU 25 11.508 1.178 -3.314 195 HB3 LEU 25 HB3 LEU 25 10.020 2.012 -3.688 196 HG LEU 25 HG LEU 25 9.200 0.433 -2.364 197 HD11 LEU 25 HD11 LEU 25 8.044 -1.379 -3.491 198 HD12 LEU 25 HD12 LEU 25 8.013 0.057 -4.505 199 HD13 LEU 25 HD13 LEU 25 9.126 -1.254 -4.891 200 HD21 LEU 25 HD21 LEU 25 11.038 -1.649 -3.390 201 HD22 LEU 25 HD22 LEU 25 11.275 -0.696 -1.897 202 HD23 LEU 25 HD23 LEU 25 9.896 -1.808 -2.016 203 H MET 26 H MET 26 9.835 3.186 -6.181 204 HA MET 26 HA MET 26 12.349 4.726 -6.415 205 HB2 MET 26 HB2 MET 26 10.446 3.903 -8.601 206 HB3 MET 26 HB3 MET 26 11.232 5.476 -8.689 207 HG2 MET 26 HG2 MET 26 13.360 4.608 -8.883 208 HG3 MET 26 HG3 MET 26 12.929 3.051 -8.193 209 HE1 MET 26 HE1 MET 26 14.485 4.169 -11.064 210 HE2 MET 26 HE2 MET 26 14.700 2.500 -10.496 211 HE3 MET 26 HE3 MET 26 14.118 2.812 -12.144 212 HA PRO 27 HA PRO 27 8.667 6.581 -4.256 213 HB2 PRO 27 HB2 PRO 27 9.997 7.799 -2.179 214 HB3 PRO 27 HB3 PRO 27 9.551 6.073 -2.204 215 HG2 PRO 27 HG2 PRO 27 12.211 7.285 -3.102 216 HG3 PRO 27 HG3 PRO 27 11.933 5.996 -1.905 217 HD2 PRO 27 HD2 PRO 27 12.564 5.453 -4.443 218 HD3 PRO 27 HD3 PRO 27 11.261 4.496 -3.661 219 H ASN 28 H ASN 28 8.024 8.129 -5.683 220 HA ASN 28 HA ASN 28 9.878 10.106 -6.685 221 HB2 ASN 28 HB2 ASN 28 8.005 10.804 -8.176 222 HB3 ASN 28 HB3 ASN 28 8.504 9.127 -8.266 223 HD21 ASN 28 HD21 ASN 28 6.009 10.952 -6.290 224 HD22 ASN 28 HD22 ASN 28 4.739 9.808 -6.644 225 H LYS 29 H LYS 29 10.388 11.245 -4.774 226 HA LYS 29 HA LYS 29 10.197 12.829 -3.162 227 HB2 LYS 29 HB2 LYS 29 10.254 14.945 -3.925 228 HB3 LYS 29 HB3 LYS 29 10.777 14.007 -5.296 229 HG2 LYS 29 HG2 LYS 29 7.865 14.699 -5.335 230 HG3 LYS 29 HG3 LYS 29 8.936 16.075 -5.241 231 HD2 LYS 29 HD2 LYS 29 8.542 15.849 -7.486 232 HD3 LYS 29 HD3 LYS 29 10.128 15.071 -7.313 233 HE2 LYS 29 HE2 LYS 29 9.173 12.887 -7.435 234 HE3 LYS 29 HE3 LYS 29 7.527 13.511 -7.180 235 HZ1 LYS 29 HZ1 LYS 29 9.148 14.051 -9.567 236 HZ2 LYS 29 HZ2 LYS 29 7.951 12.916 -9.475 237 HZ3 LYS 29 HZ3 LYS 29 7.579 14.507 -9.340 238 H GLU 30 H GLU 30 8.058 11.127 -2.867 239 HA GLU 30 HA GLU 30 5.649 12.836 -2.440 240 HB2 GLU 30 HB2 GLU 30 4.379 10.850 -2.840 241 HB3 GLU 30 HB3 GLU 30 5.603 10.966 -4.112 242 HG2 GLU 30 HG2 GLU 30 7.052 9.446 -2.572 243 HG3 GLU 30 HG3 GLU 30 5.552 9.126 -1.691 244 H LEU 31 H LEU 31 8.035 11.264 -0.668 245 HA LEU 31 HA LEU 31 6.502 9.958 1.397 246 HB2 LEU 31 HB2 LEU 31 9.372 10.710 0.915 247 HB3 LEU 31 HB3 LEU 31 8.923 10.317 2.552 248 HG LEU 31 HG LEU 31 8.656 8.123 2.231 249 HD11 LEU 31 HD11 LEU 31 6.943 7.994 0.509 250 HD12 LEU 31 HD12 LEU 31 8.111 8.476 -0.742 251 HD13 LEU 31 HD13 LEU 31 8.267 6.922 0.105 252 HD21 LEU 31 HD21 LEU 31 10.970 8.884 1.737 253 HD22 LEU 31 HD22 LEU 31 10.604 7.378 0.882 254 HD23 LEU 31 HD23 LEU 31 10.604 8.901 0.013 255 H ASN 32 H ASN 32 5.002 11.618 1.797 256 HA ASN 32 HA ASN 32 5.888 13.767 3.694 257 HB2 ASN 32 HB2 ASN 32 3.546 13.674 1.739 258 HB3 ASN 32 HB3 ASN 32 3.841 14.941 2.923 259 HD21 ASN 32 HD21 ASN 32 4.669 13.802 -0.241 260 HD22 ASN 32 HD22 ASN 32 5.680 15.196 -0.627 261 H ILE 33 H ILE 33 5.553 11.174 4.506 262 HA ILE 33 HA ILE 33 4.774 9.798 5.964 263 HB ILE 33 HB ILE 33 4.673 12.115 7.186 264 HG12 ILE 33 HG12 ILE 33 5.344 10.199 8.337 265 HG13 ILE 33 HG13 ILE 33 4.101 10.953 9.301 266 HG21 ILE 33 HG21 ILE 33 1.801 11.197 7.471 267 HG22 ILE 33 HG22 ILE 33 2.620 12.478 8.409 268 HG23 ILE 33 HG23 ILE 33 2.342 12.659 6.675 269 HD11 ILE 33 HD11 ILE 33 3.958 8.465 7.632 270 HD12 ILE 33 HD12 ILE 33 3.689 8.599 9.355 271 HD13 ILE 33 HD13 ILE 33 2.477 9.255 8.206 272 H GLU 34 H GLU 34 2.310 11.312 4.129 273 HA GLU 34 HA GLU 34 -0.042 10.234 4.440 274 HB2 GLU 34 HB2 GLU 34 1.197 10.006 1.674 275 HB3 GLU 34 HB3 GLU 34 -0.441 10.512 2.104 276 HG2 GLU 34 HG2 GLU 34 0.651 12.515 3.260 277 HG3 GLU 34 HG3 GLU 34 2.149 12.025 2.495 278 H ASN 35 H ASN 35 2.606 8.360 3.335 279 HA ASN 35 HA ASN 35 0.957 6.015 2.540 280 HB2 ASN 35 HB2 ASN 35 2.657 5.584 0.880 281 HB3 ASN 35 HB3 ASN 35 2.028 7.224 0.711 282 HD21 ASN 35 HD21 ASN 35 4.800 5.293 1.845 283 HD22 ASN 35 HD22 ASN 35 5.854 6.648 2.108 284 H ALA 36 H ALA 36 2.999 6.955 5.059 285 HA ALA 36 HA ALA 36 4.927 4.857 4.916 286 HB1 ALA 36 HB1 ALA 36 5.815 5.700 6.876 287 HB2 ALA 36 HB2 ALA 36 4.944 7.101 6.217 288 HB3 ALA 36 HB3 ALA 36 4.231 6.190 7.538 289 H HIS 37 H HIS 37 1.999 5.212 7.033 290 HA HIS 37 HA HIS 37 2.442 2.759 8.458 291 HB2 HIS 37 HB2 HIS 37 -0.083 3.038 8.969 292 HB3 HIS 37 HB3 HIS 37 1.055 4.233 9.578 293 HD1 HIS 37 HD1 HIS 37 0.574 6.770 8.905 294 HD2 HIS 37 HD2 HIS 37 -1.612 3.852 6.749 295 HE1 HIS 37 HE1 HIS 37 -0.941 8.022 7.324 296 H LEU 38 H LEU 38 0.593 3.512 5.461 297 HA LEU 38 HA LEU 38 -0.323 0.772 5.231 298 HB2 LEU 38 HB2 LEU 38 -1.612 1.467 3.518 299 HB3 LEU 38 HB3 LEU 38 -1.485 2.922 4.462 300 HG LEU 38 HG LEU 38 0.668 3.242 2.751 301 HD11 LEU 38 HD11 LEU 38 0.133 2.448 0.572 302 HD12 LEU 38 HD12 LEU 38 -0.147 1.060 1.654 303 HD13 LEU 38 HD13 LEU 38 -1.521 2.000 1.077 304 HD21 LEU 38 HD21 LEU 38 -2.206 4.077 2.265 305 HD22 LEU 38 HD22 LEU 38 -0.989 4.965 3.203 306 HD23 LEU 38 HD23 LEU 38 -0.785 4.769 1.452 307 H PHE 39 H PHE 39 2.660 2.405 4.320 308 HA PHE 39 HA PHE 39 3.376 1.199 2.014 309 HB2 PHE 39 HB2 PHE 39 4.655 2.776 3.833 310 HB3 PHE 39 HB3 PHE 39 5.536 1.312 4.101 311 HD1 PHE 39 HD1 PHE 39 4.330 3.542 1.314 312 HD2 PHE 39 HD2 PHE 39 7.465 0.926 2.660 313 HE1 PHE 39 HE1 PHE 39 5.903 4.612 -0.249 314 HE2 PHE 39 HE2 PHE 39 9.083 2.116 1.304 315 HZ PHE 39 HZ PHE 39 8.271 4.029 -0.213 316 H LYS 40 H LYS 40 3.745 -0.218 5.267 317 HA LYS 40 HA LYS 40 5.115 -2.601 4.407 318 HB2 LYS 40 HB2 LYS 40 4.948 -1.701 6.785 319 HB3 LYS 40 HB3 LYS 40 3.283 -2.293 6.807 320 HG2 LYS 40 HG2 LYS 40 4.133 -4.608 6.391 321 HG3 LYS 40 HG3 LYS 40 5.796 -3.978 6.455 322 HD2 LYS 40 HD2 LYS 40 5.345 -3.166 8.793 323 HD3 LYS 40 HD3 LYS 40 3.721 -3.837 8.685 324 HE2 LYS 40 HE2 LYS 40 4.938 -5.418 9.905 325 HE3 LYS 40 HE3 LYS 40 4.736 -6.123 8.305 326 HZ1 LYS 40 HZ1 LYS 40 7.068 -5.557 7.840 327 HZ2 LYS 40 HZ2 LYS 40 7.191 -4.746 9.265 328 HZ3 LYS 40 HZ3 LYS 40 6.987 -6.367 9.238 329 H LYS 41 H LYS 41 1.644 -1.940 5.041 330 HA LYS 41 HA LYS 41 0.489 -4.390 4.263 331 HB2 LYS 41 HB2 LYS 41 -0.349 -1.752 4.994 332 HB3 LYS 41 HB3 LYS 41 -0.994 -1.947 3.401 333 HG2 LYS 41 HG2 LYS 41 -1.445 -4.067 5.531 334 HG3 LYS 41 HG3 LYS 41 -2.423 -2.597 5.425 335 HD2 LYS 41 HD2 LYS 41 -3.068 -3.159 3.101 336 HD3 LYS 41 HD3 LYS 41 -2.110 -4.638 3.199 337 HE2 LYS 41 HE2 LYS 41 -4.399 -5.214 3.572 338 HE3 LYS 41 HE3 LYS 41 -3.542 -5.406 5.100 339 HZ1 LYS 41 HZ1 LYS 41 -5.085 -2.972 4.474 340 HZ2 LYS 41 HZ2 LYS 41 -5.749 -4.287 5.241 341 HZ3 LYS 41 HZ3 LYS 41 -4.538 -3.467 5.939 342 H TRP 42 H TRP 42 1.397 -1.581 2.248 343 HA TRP 42 HA TRP 42 0.511 -2.678 -0.260 344 HB2 TRP 42 HB2 TRP 42 0.717 -0.372 -0.221 345 HB3 TRP 42 HB3 TRP 42 2.260 -0.406 0.612 346 HD1 TRP 42 HD1 TRP 42 1.046 -1.608 -2.905 347 HE1 TRP 42 HE1 TRP 42 2.859 -1.010 -4.603 348 HE3 TRP 42 HE3 TRP 42 4.507 0.347 0.291 349 HZ2 TRP 42 HZ2 TRP 42 5.411 0.398 -4.585 350 HZ3 TRP 42 HZ3 TRP 42 6.661 1.142 -0.486 351 HH2 TRP 42 HH2 TRP 42 7.083 1.326 -3.012 352 H VAL 43 H VAL 43 3.975 -2.386 0.925 353 HA VAL 43 HA VAL 43 4.910 -3.927 -1.213 354 HB VAL 43 HB VAL 43 6.057 -3.491 1.575 355 HG11 VAL 43 HG11 VAL 43 7.562 -4.703 -0.780 356 HG12 VAL 43 HG12 VAL 43 8.264 -4.169 0.747 357 HG13 VAL 43 HG13 VAL 43 7.142 -5.527 0.737 358 HG21 VAL 43 HG21 VAL 43 6.333 -2.144 -1.123 359 HG22 VAL 43 HG22 VAL 43 6.074 -1.446 0.491 360 HG23 VAL 43 HG23 VAL 43 7.663 -2.042 0.025 361 H PHE 44 H PHE 44 3.532 -5.055 1.867 362 HA PHE 44 HA PHE 44 4.182 -7.768 1.623 363 HB2 PHE 44 HB2 PHE 44 2.092 -6.147 3.054 364 HB3 PHE 44 HB3 PHE 44 1.867 -7.844 2.926 365 HD1 PHE 44 HD1 PHE 44 5.079 -5.841 3.568 366 HD2 PHE 44 HD2 PHE 44 2.301 -8.874 4.954 367 HE1 PHE 44 HE1 PHE 44 6.461 -6.201 5.570 368 HE2 PHE 44 HE2 PHE 44 3.723 -9.248 6.925 369 HZ PHE 44 HZ PHE 44 5.771 -7.899 7.267 370 H ASP 45 H ASP 45 1.078 -6.176 0.829 371 HA ASP 45 HA ASP 45 -0.049 -8.401 -0.497 372 HB2 ASP 45 HB2 ASP 45 -0.701 -5.488 -0.341 373 HB3 ASP 45 HB3 ASP 45 -1.347 -6.354 -1.724 374 H GLU 46 H GLU 46 1.611 -5.597 -1.926 375 HA GLU 46 HA GLU 46 0.924 -6.257 -4.597 376 HB2 GLU 46 HB2 GLU 46 2.073 -4.077 -3.216 377 HB3 GLU 46 HB3 GLU 46 3.374 -4.631 -4.226 378 HG2 GLU 46 HG2 GLU 46 0.721 -3.439 -4.933 379 HG3 GLU 46 HG3 GLU 46 2.353 -2.960 -5.426 380 H PHE 47 H PHE 47 3.656 -7.217 -2.548 381 HA PHE 47 HA PHE 47 5.016 -8.410 -4.912 382 HB2 PHE 47 HB2 PHE 47 6.435 -6.940 -2.686 383 HB3 PHE 47 HB3 PHE 47 7.084 -7.557 -4.193 384 HD1 PHE 47 HD1 PHE 47 5.500 -6.477 -6.361 385 HD2 PHE 47 HD2 PHE 47 6.387 -4.631 -2.581 386 HE1 PHE 47 HE1 PHE 47 5.061 -4.255 -7.331 387 HE2 PHE 47 HE2 PHE 47 5.935 -2.399 -3.556 388 HZ PHE 47 HZ PHE 47 5.280 -2.214 -5.956 389 H LEU 48 H LEU 48 5.372 -8.253 -1.315 390 HA LEU 48 HA LEU 48 6.696 -10.720 -1.153 391 HB2 LEU 48 HB2 LEU 48 4.912 -9.518 0.983 392 HB3 LEU 48 HB3 LEU 48 6.167 -10.710 1.246 393 HG LEU 48 HG LEU 48 6.557 -7.816 0.404 394 HD11 LEU 48 HD11 LEU 48 7.690 -9.201 2.830 395 HD12 LEU 48 HD12 LEU 48 7.618 -7.466 2.481 396 HD13 LEU 48 HD13 LEU 48 6.130 -8.370 2.843 397 HD21 LEU 48 HD21 LEU 48 8.998 -8.220 0.499 398 HD22 LEU 48 HD22 LEU 48 8.691 -9.961 0.681 399 HD23 LEU 48 HD23 LEU 48 8.236 -9.124 -0.813 400 H ASN 49 H ASN 49 3.234 -10.162 -0.527 401 HA ASN 49 HA ASN 49 2.458 -12.932 -0.346 402 HB2 ASN 49 HB2 ASN 49 0.909 -10.366 -0.907 403 HB3 ASN 49 HB3 ASN 49 0.143 -11.946 -0.815 404 HD21 ASN 49 HD21 ASN 49 -0.354 -9.590 1.012 405 HD22 ASN 49 HD22 ASN 49 -0.115 -10.349 2.552 406 H LYS 50 H LYS 50 3.072 -10.788 -3.080 407 HA LYS 50 HA LYS 50 1.737 -12.481 -5.040 408 HB2 LYS 50 HB2 LYS 50 2.931 -9.838 -4.937 409 HB3 LYS 50 HB3 LYS 50 3.819 -10.775 -6.110 410 HG2 LYS 50 HG2 LYS 50 1.253 -11.405 -6.821 411 HG3 LYS 50 HG3 LYS 50 1.034 -9.771 -6.173 412 HD2 LYS 50 HD2 LYS 50 3.092 -9.149 -7.638 413 HD3 LYS 50 HD3 LYS 50 2.794 -10.661 -8.489 414 HE2 LYS 50 HE2 LYS 50 0.745 -8.424 -8.135 415 HE3 LYS 50 HE3 LYS 50 1.832 -8.547 -9.520 416 HZ1 LYS 50 HZ1 LYS 50 -0.193 -10.553 -8.769 417 HZ2 LYS 50 HZ2 LYS 50 -0.303 -9.472 -10.009 418 HZ3 LYS 50 HZ3 LYS 50 0.826 -10.667 -10.073 419 H GLY 51 H GLY 51 4.549 -12.836 -3.155 420 HA2 GLY 51 HA2 GLY 51 5.725 -14.852 -3.213 421 HA3 GLY 51 HA3 GLY 51 5.465 -14.996 -4.949 422 H TYR 52 H TYR 52 6.509 -11.792 -4.125 423 HA TYR 52 HA TYR 52 9.105 -12.302 -5.358 424 HB2 TYR 52 HB2 TYR 52 7.803 -9.829 -4.154 425 HB3 TYR 52 HB3 TYR 52 9.444 -9.843 -4.753 426 HD1 TYR 52 HD1 TYR 52 5.909 -10.455 -5.865 427 HD2 TYR 52 HD2 TYR 52 9.939 -9.640 -7.024 428 HE1 TYR 52 HE1 TYR 52 5.150 -10.181 -8.185 429 HE2 TYR 52 HE2 TYR 52 9.246 -9.461 -9.399 430 HH TYR 52 HH TYR 52 5.765 -9.715 -10.354 431 H ASN 53 H ASN 53 11.104 -11.662 -4.314 432 HA ASN 53 HA ASN 53 11.310 -11.921 -1.360 433 HB2 ASN 53 HB2 ASN 53 11.716 -14.142 -3.207 434 HB3 ASN 53 HB3 ASN 53 13.280 -13.653 -2.583 435 HD21 ASN 53 HD21 ASN 53 10.074 -13.793 -0.893 436 HD22 ASN 53 HD22 ASN 53 10.669 -14.995 0.264 437 H LYS 54 H LYS 54 12.107 -10.062 -3.933 438 HA LYS 54 HA LYS 54 14.680 -9.262 -2.735 439 HB2 LYS 54 HB2 LYS 54 14.296 -10.245 -5.565 440 HB3 LYS 54 HB3 LYS 54 15.423 -8.967 -5.204 441 HG2 LYS 54 HG2 LYS 54 16.974 -10.298 -4.344 442 HG3 LYS 54 HG3 LYS 54 15.847 -11.131 -3.281 443 HD2 LYS 54 HD2 LYS 54 16.203 -11.705 -6.254 444 HD3 LYS 54 HD3 LYS 54 16.951 -12.638 -4.950 445 HE2 LYS 54 HE2 LYS 54 14.872 -13.468 -4.153 446 HE3 LYS 54 HE3 LYS 54 13.962 -12.194 -4.968 447 HZ1 LYS 54 HZ1 LYS 54 15.252 -14.482 -6.350 448 HZ2 LYS 54 HZ2 LYS 54 13.672 -14.174 -6.167 449 HZ3 LYS 54 HZ3 LYS 54 14.519 -13.190 -7.100 450 H ILE 55 H ILE 55 14.377 -7.195 -2.364 451 HA ILE 55 HA ILE 55 12.720 -5.538 -4.184 452 HB ILE 55 HB ILE 55 12.831 -5.637 -1.131 453 HG12 ILE 55 HG12 ILE 55 10.320 -5.312 -1.379 454 HG13 ILE 55 HG13 ILE 55 10.494 -5.451 -3.114 455 HG21 ILE 55 HG21 ILE 55 13.200 -3.310 -1.618 456 HG22 ILE 55 HG22 ILE 55 11.998 -3.373 -2.918 457 HG23 ILE 55 HG23 ILE 55 11.487 -3.480 -1.217 458 HD11 ILE 55 HD11 ILE 55 11.232 -7.688 -1.217 459 HD12 ILE 55 HD12 ILE 55 9.594 -7.448 -1.874 460 HD13 ILE 55 HD13 ILE 55 10.938 -7.787 -2.964 461 H PHE 56 H PHE 56 13.739 -3.443 -4.538 462 HA PHE 56 HA PHE 56 16.173 -2.832 -2.984 463 HB2 PHE 56 HB2 PHE 56 15.765 -2.227 -5.935 464 HB3 PHE 56 HB3 PHE 56 17.112 -1.657 -4.958 465 HD1 PHE 56 HD1 PHE 56 17.814 -4.105 -3.398 466 HD2 PHE 56 HD2 PHE 56 16.789 -3.597 -7.565 467 HE1 PHE 56 HE1 PHE 56 19.194 -6.072 -4.005 468 HE2 PHE 56 HE2 PHE 56 18.085 -5.597 -8.148 469 HZ PHE 56 HZ PHE 56 19.319 -6.845 -6.344 470 H LEU 57 H LEU 57 16.563 -0.488 -2.813 471 HA LEU 57 HA LEU 57 14.194 1.195 -3.569 472 HB2 LEU 57 HB2 LEU 57 13.956 0.915 -1.260 473 HB3 LEU 57 HB3 LEU 57 15.684 1.074 -0.961 474 HG LEU 57 HG LEU 57 15.667 3.436 -1.394 475 HD11 LEU 57 HD11 LEU 57 12.681 3.197 -1.988 476 HD12 LEU 57 HD12 LEU 57 13.649 4.692 -1.845 477 HD13 LEU 57 HD13 LEU 57 13.927 3.601 -3.179 478 HD21 LEU 57 HD21 LEU 57 13.329 2.602 0.386 479 HD22 LEU 57 HD22 LEU 57 15.033 2.608 0.852 480 HD23 LEU 57 HD23 LEU 57 14.235 4.136 0.483 481 H VAL 58 H VAL 58 14.783 2.513 -5.126 482 HA VAL 58 HA VAL 58 17.549 3.342 -5.574 483 HB VAL 58 HB VAL 58 14.889 3.664 -7.017 484 HG11 VAL 58 HG11 VAL 58 16.156 4.640 -8.918 485 HG12 VAL 58 HG12 VAL 58 16.135 5.698 -7.520 486 HG13 VAL 58 HG13 VAL 58 17.604 4.743 -7.876 487 HG21 VAL 58 HG21 VAL 58 17.494 2.288 -7.788 488 HG22 VAL 58 HG22 VAL 58 16.099 1.456 -7.072 489 HG23 VAL 58 HG23 VAL 58 15.952 2.214 -8.666 490 H LEU 59 H LEU 59 18.307 4.914 -4.314 491 HA LEU 59 HA LEU 59 16.631 7.071 -3.251 492 HB2 LEU 59 HB2 LEU 59 19.673 6.546 -3.409 493 HB3 LEU 59 HB3 LEU 59 18.991 7.995 -2.723 494 HG LEU 59 HG LEU 59 19.653 6.619 -1.037 495 HD11 LEU 59 HD11 LEU 59 16.646 6.283 -1.028 496 HD12 LEU 59 HD12 LEU 59 17.741 6.662 0.335 497 HD13 LEU 59 HD13 LEU 59 17.460 7.856 -0.922 498 HD21 LEU 59 HD21 LEU 59 18.943 4.414 -0.473 499 HD22 LEU 59 HD22 LEU 59 17.894 4.325 -1.916 500 HD23 LEU 59 HD23 LEU 59 19.662 4.412 -2.081 501 H SER 60 H SER 60 18.250 6.446 -6.296 502 HA SER 60 HA SER 60 18.819 9.029 -7.132 503 HB2 SER 60 HB2 SER 60 17.377 7.039 -8.894 504 HB3 SER 60 HB3 SER 60 18.562 8.254 -9.371 505 HG SER 60 HG SER 60 20.144 7.037 -8.739 506 H ASP 61 H ASP 61 15.609 7.736 -6.396 507 HA ASP 61 HA ASP 61 14.254 9.982 -7.793 508 HB2 ASP 61 HB2 ASP 61 13.573 7.290 -7.396 509 HB3 ASP 61 HB3 ASP 61 12.572 8.130 -6.229 510 H VAL 62 H VAL 62 15.626 9.316 -4.700 511 HA VAL 62 HA VAL 62 13.975 11.372 -3.405 512 HB VAL 62 HB VAL 62 12.847 9.346 -2.900 513 HG11 VAL 62 HG11 VAL 62 13.770 7.563 -1.454 514 HG12 VAL 62 HG12 VAL 62 14.516 7.597 -3.062 515 HG13 VAL 62 HG13 VAL 62 15.368 8.232 -1.634 516 HG21 VAL 62 HG21 VAL 62 14.344 10.366 -0.483 517 HG22 VAL 62 HG22 VAL 62 12.936 11.131 -1.242 518 HG23 VAL 62 HG23 VAL 62 12.783 9.540 -0.471 519 H GLU 63 H GLU 63 15.456 12.856 -3.118 520 HA GLU 63 HA GLU 63 18.252 12.523 -2.833 521 HB2 GLU 63 HB2 GLU 63 17.047 14.662 -3.470 522 HB3 GLU 63 HB3 GLU 63 16.402 14.749 -1.844 523 HG2 GLU 63 HG2 GLU 63 18.218 16.175 -1.698 524 HG3 GLU 63 HG3 GLU 63 18.875 14.724 -1.000 525 H SER 64 H SER 64 15.555 12.975 -0.465 526 HA SER 64 HA SER 64 16.913 11.387 1.419 527 HB2 SER 64 HB2 SER 64 17.066 14.372 1.587 528 HB3 SER 64 HB3 SER 64 16.834 13.513 3.120 529 HG SER 64 HG SER 64 18.689 12.686 1.160 530 H ILE 65 H ILE 65 15.791 11.532 3.657 531 HA ILE 65 HA ILE 65 12.901 11.285 3.240 532 HB ILE 65 HB ILE 65 14.056 9.125 2.684 533 HG12 ILE 65 HG12 ILE 65 12.862 8.663 5.380 534 HG13 ILE 65 HG13 ILE 65 11.853 9.306 4.084 535 HG21 ILE 65 HG21 ILE 65 15.287 7.925 4.484 536 HG22 ILE 65 HG22 ILE 65 16.138 9.269 3.702 537 HG23 ILE 65 HG23 ILE 65 15.428 9.483 5.310 538 HD11 ILE 65 HD11 ILE 65 11.538 7.244 3.316 539 HD12 ILE 65 HD12 ILE 65 13.227 7.111 2.917 540 HD13 ILE 65 HD13 ILE 65 12.681 6.574 4.512 541 H ASP 66 H ASP 66 11.802 11.122 5.254 542 HA ASP 66 HA ASP 66 12.952 12.700 7.475 543 HB2 ASP 66 HB2 ASP 66 10.755 13.191 6.339 544 HB3 ASP 66 HB3 ASP 66 10.176 11.625 6.883 545 H SER 67 H SER 67 12.668 11.864 9.746 546 HA SER 67 HA SER 67 13.528 9.226 10.097 547 HB2 SER 67 HB2 SER 67 12.240 11.183 12.011 548 HB3 SER 67 HB3 SER 67 12.932 9.627 12.504 549 HG SER 67 HG SER 67 14.222 11.820 12.282 550 H PHE 68 H PHE 68 10.181 10.340 9.679 551 HA PHE 68 HA PHE 68 8.770 8.113 10.658 552 HB2 PHE 68 HB2 PHE 68 7.007 8.929 9.671 553 HB3 PHE 68 HB3 PHE 68 7.964 10.366 9.681 554 HD1 PHE 68 HD1 PHE 68 7.103 7.512 7.679 555 HD2 PHE 68 HD2 PHE 68 8.084 11.630 7.682 556 HE1 PHE 68 HE1 PHE 68 6.683 7.609 5.134 557 HE2 PHE 68 HE2 PHE 68 7.787 11.783 5.226 558 HZ PHE 68 HZ PHE 68 7.091 9.734 3.937 559 H SER 69 H SER 69 10.014 8.349 7.307 560 HA SER 69 HA SER 69 9.337 5.494 7.112 561 HB2 SER 69 HB2 SER 69 8.529 6.767 5.460 562 HB3 SER 69 HB3 SER 69 10.067 7.641 5.144 563 HG SER 69 HG SER 69 8.924 5.443 4.109 564 H LEU 70 H LEU 70 12.255 7.376 7.609 565 HA LEU 70 HA LEU 70 14.079 5.562 6.575 566 HB2 LEU 70 HB2 LEU 70 14.014 7.232 9.161 567 HB3 LEU 70 HB3 LEU 70 15.332 6.092 8.997 568 HG LEU 70 HG LEU 70 14.739 8.136 6.864 569 HD11 LEU 70 HD11 LEU 70 15.231 9.464 8.837 570 HD12 LEU 70 HD12 LEU 70 16.634 8.441 9.239 571 HD13 LEU 70 HD13 LEU 70 16.635 9.480 7.796 572 HD21 LEU 70 HD21 LEU 70 17.134 7.688 6.280 573 HD22 LEU 70 HD22 LEU 70 17.225 6.533 7.618 574 HD23 LEU 70 HD23 LEU 70 16.176 6.194 6.244 575 H GLY 71 H GLY 71 12.033 5.322 9.497 576 HA2 GLY 71 HA2 GLY 71 13.090 2.730 10.366 577 HA3 GLY 71 HA3 GLY 71 11.699 3.576 11.025 578 H VAL 72 H VAL 72 10.502 3.700 8.088 579 HA VAL 72 HA VAL 72 9.104 1.160 8.380 580 HB VAL 72 HB VAL 72 8.049 3.411 7.626 581 HG11 VAL 72 HG11 VAL 72 9.582 3.619 5.554 582 HG12 VAL 72 HG12 VAL 72 8.506 2.456 4.808 583 HG13 VAL 72 HG13 VAL 72 7.861 4.003 5.432 584 HG21 VAL 72 HG21 VAL 72 7.465 0.798 6.157 585 HG22 VAL 72 HG22 VAL 72 6.865 1.225 7.779 586 HG23 VAL 72 HG23 VAL 72 6.336 2.149 6.363 587 H ILE 73 H ILE 73 11.558 2.570 6.246 588 HA ILE 73 HA ILE 73 11.891 0.548 4.351 589 HB ILE 73 HB ILE 73 13.621 2.656 5.651 590 HG12 ILE 73 HG12 ILE 73 13.938 3.371 3.325 591 HG13 ILE 73 HG13 ILE 73 13.184 1.920 2.758 592 HG21 ILE 73 HG21 ILE 73 14.803 0.458 3.908 593 HG22 ILE 73 HG22 ILE 73 15.586 2.008 4.257 594 HG23 ILE 73 HG23 ILE 73 15.284 0.878 5.571 595 HD11 ILE 73 HD11 ILE 73 10.986 2.706 3.742 596 HD12 ILE 73 HD12 ILE 73 11.842 4.229 4.124 597 HD13 ILE 73 HD13 ILE 73 11.662 3.706 2.458 598 H VAL 74 H VAL 74 13.361 0.827 7.640 599 HA VAL 74 HA VAL 74 14.665 -1.675 7.619 600 HB VAL 74 HB VAL 74 13.372 -0.183 9.967 601 HG11 VAL 74 HG11 VAL 74 15.304 -2.516 10.008 602 HG12 VAL 74 HG12 VAL 74 14.974 -1.462 11.398 603 HG13 VAL 74 HG13 VAL 74 13.671 -2.416 10.702 604 HG21 VAL 74 HG21 VAL 74 15.042 1.192 8.939 605 HG22 VAL 74 HG22 VAL 74 15.648 0.604 10.476 606 HG23 VAL 74 HG23 VAL 74 16.226 -0.135 8.964 607 H ASN 75 H ASN 75 11.378 -0.879 8.823 608 HA ASN 75 HA ASN 75 10.679 -3.386 9.725 609 HB2 ASN 75 HB2 ASN 75 9.360 -0.911 9.331 610 HB3 ASN 75 HB3 ASN 75 8.433 -2.039 8.344 611 HD21 ASN 75 HD21 ASN 75 9.749 -1.540 11.667 612 HD22 ASN 75 HD22 ASN 75 8.465 -2.393 12.463 613 H ILE 76 H ILE 76 10.905 -2.441 6.360 614 HA ILE 76 HA ILE 76 9.426 -4.781 5.370 615 HB ILE 76 HB ILE 76 10.946 -2.481 4.085 616 HG12 ILE 76 HG12 ILE 76 8.039 -3.435 4.006 617 HG13 ILE 76 HG13 ILE 76 8.633 -2.074 4.967 618 HG21 ILE 76 HG21 ILE 76 10.384 -3.414 1.870 619 HG22 ILE 76 HG22 ILE 76 11.469 -4.475 2.734 620 HG23 ILE 76 HG23 ILE 76 9.740 -4.884 2.641 621 HD11 ILE 76 HD11 ILE 76 9.144 -0.779 3.016 622 HD12 ILE 76 HD12 ILE 76 8.642 -2.122 1.961 623 HD13 ILE 76 HD13 ILE 76 7.449 -1.348 3.002 624 H LEU 77 H LEU 77 12.860 -3.779 5.873 625 HA LEU 77 HA LEU 77 14.089 -6.008 4.587 626 HB2 LEU 77 HB2 LEU 77 15.259 -3.903 5.350 627 HB3 LEU 77 HB3 LEU 77 15.030 -4.375 6.998 628 HG LEU 77 HG LEU 77 17.293 -4.715 6.042 629 HD11 LEU 77 HD11 LEU 77 16.210 -7.292 7.176 630 HD12 LEU 77 HD12 LEU 77 17.840 -6.602 7.299 631 HD13 LEU 77 HD13 LEU 77 16.494 -5.812 8.128 632 HD21 LEU 77 HD21 LEU 77 17.845 -6.793 4.822 633 HD22 LEU 77 HD22 LEU 77 16.104 -7.100 4.575 634 HD23 LEU 77 HD23 LEU 77 16.909 -5.675 3.858 635 H LYS 78 H LYS 78 13.023 -5.442 7.941 636 HA LYS 78 HA LYS 78 13.923 -7.897 9.021 637 HB2 LYS 78 HB2 LYS 78 11.475 -6.354 9.986 638 HB3 LYS 78 HB3 LYS 78 12.470 -7.496 10.907 639 HG2 LYS 78 HG2 LYS 78 14.464 -5.920 10.342 640 HG3 LYS 78 HG3 LYS 78 13.248 -4.760 9.857 641 HD2 LYS 78 HD2 LYS 78 13.664 -5.874 12.620 642 HD3 LYS 78 HD3 LYS 78 14.054 -4.253 12.021 643 HE2 LYS 78 HE2 LYS 78 11.655 -3.779 11.683 644 HE3 LYS 78 HE3 LYS 78 11.261 -5.374 12.363 645 HZ1 LYS 78 HZ1 LYS 78 11.175 -3.594 14.017 646 HZ2 LYS 78 HZ2 LYS 78 12.335 -4.712 14.400 647 HZ3 LYS 78 HZ3 LYS 78 12.735 -3.220 13.782 648 H SER 79 H SER 79 10.791 -7.181 7.414 649 HA SER 79 HA SER 79 9.652 -9.772 7.789 650 HB2 SER 79 HB2 SER 79 9.218 -7.829 5.486 651 HB3 SER 79 HB3 SER 79 8.133 -9.114 6.027 652 HG SER 79 HG SER 79 8.227 -7.930 8.148 653 H ILE 80 H ILE 80 11.515 -8.383 5.004 654 HA ILE 80 HA ILE 80 11.440 -10.698 3.414 655 HB ILE 80 HB ILE 80 13.407 -8.397 3.504 656 HG12 ILE 80 HG12 ILE 80 11.006 -9.033 1.700 657 HG13 ILE 80 HG13 ILE 80 10.972 -7.868 3.012 658 HG21 ILE 80 HG21 ILE 80 14.149 -9.067 1.268 659 HG22 ILE 80 HG22 ILE 80 14.373 -10.407 2.356 660 HG23 ILE 80 HG23 ILE 80 12.977 -10.408 1.245 661 HD11 ILE 80 HD11 ILE 80 12.631 -7.703 0.483 662 HD12 ILE 80 HD12 ILE 80 11.274 -6.665 0.969 663 HD13 ILE 80 HD13 ILE 80 12.803 -6.586 1.871 664 H SER 81 H SER 81 13.829 -9.720 5.833 665 HA SER 81 HA SER 81 15.734 -11.725 5.640 666 HB2 SER 81 HB2 SER 81 15.308 -9.596 7.235 667 HB3 SER 81 HB3 SER 81 14.709 -10.828 8.342 668 HG SER 81 HG SER 81 17.246 -10.474 7.146 669 H SER 82 H SER 82 12.561 -11.799 7.180 670 HA SER 82 HA SER 82 12.866 -14.369 8.480 671 HB2 SER 82 HB2 SER 82 11.701 -12.104 9.167 672 HB3 SER 82 HB3 SER 82 10.375 -12.670 8.144 673 HG SER 82 HG SER 82 11.532 -14.149 10.280 674 H SER 83 H SER 83 12.214 -13.541 5.350 675 HA SER 83 HA SER 83 10.161 -15.659 4.869 676 HB2 SER 83 HB2 SER 83 10.765 -12.945 3.681 677 HB3 SER 83 HB3 SER 83 9.701 -14.129 2.903 678 HG SER 83 HG SER 83 8.457 -14.170 4.866 679 H GLY 84 H GLY 84 13.368 -14.723 3.974 680 HA2 GLY 84 HA2 GLY 84 14.390 -16.779 2.736 681 HA3 GLY 84 HA3 GLY 84 13.127 -16.389 1.552 682 H GLY 85 H GLY 85 13.601 -13.380 2.172 683 HA2 GLY 85 HA2 GLY 85 15.006 -13.296 -0.316 684 HA3 GLY 85 HA3 GLY 85 13.963 -12.118 0.447 685 H PHE 86 H PHE 86 15.659 -10.873 -0.591 686 HA PHE 86 HA PHE 86 17.577 -9.920 1.453 687 HB2 PHE 86 HB2 PHE 86 18.305 -11.014 -1.191 688 HB3 PHE 86 HB3 PHE 86 18.918 -9.411 -0.918 689 HD1 PHE 86 HD1 PHE 86 18.566 -12.766 0.716 690 HD2 PHE 86 HD2 PHE 86 21.105 -9.218 0.474 691 HE1 PHE 86 HE1 PHE 86 20.175 -13.797 2.255 692 HE2 PHE 86 HE2 PHE 86 22.607 -10.302 2.082 693 HZ PHE 86 HZ PHE 86 22.192 -12.536 2.965 694 H PHE 87 H PHE 87 17.922 -7.599 1.304 695 HA PHE 87 HA PHE 87 16.603 -6.169 -0.847 696 HB2 PHE 87 HB2 PHE 87 14.726 -6.110 0.486 697 HB3 PHE 87 HB3 PHE 87 15.630 -6.146 1.981 698 HD1 PHE 87 HD1 PHE 87 15.530 -3.719 -0.974 699 HD2 PHE 87 HD2 PHE 87 15.270 -4.315 3.270 700 HE1 PHE 87 HE1 PHE 87 15.166 -1.295 -0.631 701 HE2 PHE 87 HE2 PHE 87 14.864 -1.905 3.634 702 HZ PHE 87 HZ PHE 87 14.828 -0.365 1.640 703 H ALA 88 H ALA 88 17.443 -4.098 -1.133 704 HA ALA 88 HA ALA 88 19.706 -3.186 0.432 705 HB1 ALA 88 HB1 ALA 88 20.694 -5.026 -0.882 706 HB2 ALA 88 HB2 ALA 88 20.096 -4.256 -2.373 707 HB3 ALA 88 HB3 ALA 88 21.301 -3.427 -1.352 708 H LEU 89 H LEU 89 20.789 -1.317 -0.870 709 HA LEU 89 HA LEU 89 18.586 0.384 -1.954 710 HB2 LEU 89 HB2 LEU 89 20.913 1.423 -0.335 711 HB3 LEU 89 HB3 LEU 89 19.363 2.180 -0.679 712 HG LEU 89 HG LEU 89 20.021 0.014 1.316 713 HD11 LEU 89 HD11 LEU 89 20.265 2.426 1.961 714 HD12 LEU 89 HD12 LEU 89 18.542 2.641 1.631 715 HD13 LEU 89 HD13 LEU 89 19.085 1.549 2.935 716 HD21 LEU 89 HD21 LEU 89 18.097 -0.977 0.919 717 HD22 LEU 89 HD22 LEU 89 17.347 0.378 1.769 718 HD23 LEU 89 HD23 LEU 89 17.448 0.364 -0.014 719 H VAL 90 H VAL 90 19.394 2.298 -3.256 720 HA VAL 90 HA VAL 90 21.888 1.700 -4.739 721 HB VAL 90 HB VAL 90 19.061 1.823 -5.816 722 HG11 VAL 90 HG11 VAL 90 21.617 2.047 -7.421 723 HG12 VAL 90 HG12 VAL 90 20.009 1.682 -8.101 724 HG13 VAL 90 HG13 VAL 90 20.298 3.239 -7.332 725 HG21 VAL 90 HG21 VAL 90 19.523 -0.357 -5.286 726 HG22 VAL 90 HG22 VAL 90 20.107 -0.333 -6.963 727 HG23 VAL 90 HG23 VAL 90 21.266 -0.224 -5.671 728 H SER 91 H SER 91 23.017 3.402 -5.322 729 HA SER 91 HA SER 91 23.813 5.439 -5.599 730 HB2 SER 91 HB2 SER 91 22.171 5.133 -7.528 731 HB3 SER 91 HB3 SER 91 21.087 6.213 -6.642 732 HG SER 91 HG SER 91 22.325 7.406 -8.058 733 HA PRO 92 HA PRO 92 21.513 6.994 -1.906 734 HB2 PRO 92 HB2 PRO 92 23.750 6.701 -0.074 735 HB3 PRO 92 HB3 PRO 92 22.165 5.854 -0.132 736 HG2 PRO 92 HG2 PRO 92 24.656 4.682 -0.754 737 HG3 PRO 92 HG3 PRO 92 23.020 4.061 -1.163 738 HD2 PRO 92 HD2 PRO 92 24.948 5.488 -2.926 739 HD3 PRO 92 HD3 PRO 92 23.765 4.230 -3.286 740 H ASN 93 H ASN 93 24.995 7.843 -2.111 741 HA ASN 93 HA ASN 93 26.029 9.870 -2.422 742 HB2 ASN 93 HB2 ASN 93 23.680 11.450 -1.381 743 HB3 ASN 93 HB3 ASN 93 25.063 12.030 -2.291 744 HD21 ASN 93 HD21 ASN 93 22.259 12.390 -2.643 745 HD22 ASN 93 HD22 ASN 93 21.638 11.503 -4.021 746 H GLU 94 H GLU 94 26.717 11.669 -0.803 747 HA GLU 94 HA GLU 94 27.204 10.816 1.803 748 HB2 GLU 94 HB2 GLU 94 28.460 12.617 1.824 749 HB3 GLU 94 HB3 GLU 94 27.888 12.878 0.196 750 HG2 GLU 94 HG2 GLU 94 27.522 14.934 1.089 751 HG3 GLU 94 HG3 GLU 94 25.971 14.101 1.090 752 H LYS 95 H LYS 95 24.407 12.356 0.421 753 HA LYS 95 HA LYS 95 23.388 13.318 2.885 754 HB2 LYS 95 HB2 LYS 95 22.523 13.235 0.067 755 HB3 LYS 95 HB3 LYS 95 21.177 12.838 1.059 756 HG2 LYS 95 HG2 LYS 95 22.893 15.209 1.827 757 HG3 LYS 95 HG3 LYS 95 21.796 15.362 0.459 758 HD2 LYS 95 HD2 LYS 95 20.907 16.194 2.684 759 HD3 LYS 95 HD3 LYS 95 19.906 15.121 1.732 760 HE2 LYS 95 HE2 LYS 95 19.628 14.484 3.997 761 HE3 LYS 95 HE3 LYS 95 20.494 13.194 3.181 762 HZ1 LYS 95 HZ1 LYS 95 21.316 14.878 5.341 763 HZ2 LYS 95 HZ2 LYS 95 21.908 13.393 4.859 764 HZ3 LYS 95 HZ3 LYS 95 22.455 14.811 4.184 765 H VAL 96 H VAL 96 22.733 10.315 1.045 766 HA VAL 96 HA VAL 96 20.922 9.603 3.150 767 HB VAL 96 HB VAL 96 21.792 8.237 0.611 768 HG11 VAL 96 HG11 VAL 96 19.909 7.138 2.700 769 HG12 VAL 96 HG12 VAL 96 19.995 6.534 1.048 770 HG13 VAL 96 HG13 VAL 96 21.400 6.386 2.076 771 HG21 VAL 96 HG21 VAL 96 20.188 10.171 0.542 772 HG22 VAL 96 HG22 VAL 96 19.435 8.687 0.027 773 HG23 VAL 96 HG23 VAL 96 19.119 9.287 1.676 774 H GLU 97 H GLU 97 24.237 8.543 2.099 775 HA GLU 97 HA GLU 97 24.419 6.474 4.104 776 HB2 GLU 97 HB2 GLU 97 26.213 7.760 2.085 777 HB3 GLU 97 HB3 GLU 97 26.984 6.968 3.443 778 HG2 GLU 97 HG2 GLU 97 24.843 5.444 1.965 779 HG3 GLU 97 HG3 GLU 97 26.419 5.644 1.208 780 H ARG 98 H ARG 98 24.489 9.977 4.409 781 HA ARG 98 HA ARG 98 26.034 9.991 6.822 782 HB2 ARG 98 HB2 ARG 98 24.129 11.758 5.346 783 HB3 ARG 98 HB3 ARG 98 23.897 11.882 7.058 784 HG2 ARG 98 HG2 ARG 98 26.720 11.905 6.329 785 HG3 ARG 98 HG3 ARG 98 25.696 13.187 5.599 786 HD2 ARG 98 HD2 ARG 98 24.834 13.680 7.806 787 HD3 ARG 98 HD3 ARG 98 25.786 12.383 8.548 788 HE ARG 98 HE ARG 98 27.699 13.988 7.515 789 HH11 ARG 98 HH11 ARG 98 24.836 14.823 9.492 790 HH12 ARG 98 HH12 ARG 98 25.696 16.070 10.337 791 HH21 ARG 98 HH21 ARG 98 28.598 15.974 8.404 792 HH22 ARG 98 HH22 ARG 98 27.768 16.704 9.750 793 H VAL 99 H VAL 99 22.674 10.182 6.225 794 HA VAL 99 HA VAL 99 22.196 10.131 9.005 795 HB VAL 99 HB VAL 99 20.123 9.529 6.789 796 HG11 VAL 99 HG11 VAL 99 18.501 10.768 8.267 797 HG12 VAL 99 HG12 VAL 99 19.119 9.301 9.043 798 HG13 VAL 99 HG13 VAL 99 19.776 10.897 9.515 799 HG21 VAL 99 HG21 VAL 99 19.766 11.992 6.720 800 HG22 VAL 99 HG22 VAL 99 21.366 12.092 7.584 801 HG23 VAL 99 HG23 VAL 99 21.226 11.271 6.015 802 H LEU 100 H LEU 100 22.051 7.746 6.438 803 HA LEU 100 HA LEU 100 20.810 5.598 7.728 804 HB2 LEU 100 HB2 LEU 100 23.021 5.660 5.631 805 HB3 LEU 100 HB3 LEU 100 22.160 4.244 6.109 806 HG LEU 100 HG LEU 100 21.502 6.159 4.169 807 HD11 LEU 100 HD11 LEU 100 21.295 3.788 3.959 808 HD12 LEU 100 HD12 LEU 100 19.847 3.861 4.991 809 HD13 LEU 100 HD13 LEU 100 19.877 4.708 3.416 810 HD21 LEU 100 HD21 LEU 100 20.023 7.550 5.444 811 HD22 LEU 100 HD22 LEU 100 18.981 6.478 4.580 812 HD23 LEU 100 HD23 LEU 100 19.304 6.143 6.267 813 H SER 101 H SER 101 23.656 7.303 8.781 814 HA SER 101 HA SER 101 24.762 4.779 9.946 815 HB2 SER 101 HB2 SER 101 25.958 6.811 8.470 816 HB3 SER 101 HB3 SER 101 26.262 7.311 10.114 817 HG SER 101 HG SER 101 26.901 4.801 8.840 818 H LEU 102 H LEU 102 23.512 8.016 10.370 819 HA LEU 102 HA LEU 102 23.528 8.293 13.190 820 HB2 LEU 102 HB2 LEU 102 21.774 9.525 10.984 821 HB3 LEU 102 HB3 LEU 102 21.781 9.987 12.639 822 HG LEU 102 HG LEU 102 24.022 10.566 12.628 823 HD11 LEU 102 HD11 LEU 102 25.296 11.232 10.860 824 HD12 LEU 102 HD12 LEU 102 24.910 9.521 10.742 825 HD13 LEU 102 HD13 LEU 102 24.048 10.717 9.717 826 HD21 LEU 102 HD21 LEU 102 22.156 12.243 12.358 827 HD22 LEU 102 HD22 LEU 102 23.600 12.793 11.503 828 HD23 LEU 102 HD23 LEU 102 22.252 11.999 10.614 829 H THR 103 H THR 103 21.484 6.439 11.064 830 HA THR 103 HA THR 103 19.496 5.991 13.217 831 HB THR 103 HB THR 103 18.724 7.487 11.405 832 HG1 THR 103 HG1 THR 103 17.569 4.952 11.676 833 HG21 THR 103 HG21 THR 103 18.819 6.975 9.205 834 HG22 THR 103 HG22 THR 103 19.919 5.676 9.636 835 HG23 THR 103 HG23 THR 103 18.184 5.347 9.457 836 H ASN 104 H ASN 104 21.976 4.337 12.302 837 HA ASN 104 HA ASN 104 22.517 2.239 11.632 838 HB2 ASN 104 HB2 ASN 104 21.108 0.417 12.972 839 HB3 ASN 104 HB3 ASN 104 22.502 1.308 13.499 840 HD21 ASN 104 HD21 ASN 104 19.018 2.381 13.512 841 HD22 ASN 104 HD22 ASN 104 19.159 2.846 15.217 842 H LEU 105 H LEU 105 21.917 2.663 9.494 843 HA LEU 105 HA LEU 105 19.774 0.856 8.549 844 HB2 LEU 105 HB2 LEU 105 19.625 3.634 8.510 845 HB3 LEU 105 HB3 LEU 105 20.480 3.339 7.041 846 HG LEU 105 HG LEU 105 18.242 3.575 6.437 847 HD11 LEU 105 HD11 LEU 105 18.491 0.569 6.609 848 HD12 LEU 105 HD12 LEU 105 17.628 1.515 5.394 849 HD13 LEU 105 HD13 LEU 105 19.398 1.531 5.417 850 HD21 LEU 105 HD21 LEU 105 17.592 1.717 8.719 851 HD22 LEU 105 HD22 LEU 105 17.195 3.433 8.554 852 HD23 LEU 105 HD23 LEU 105 16.424 2.269 7.473 853 H ASP 106 H ASP 106 22.762 2.699 7.809 854 HA ASP 106 HA ASP 106 23.513 1.231 5.498 855 HB2 ASP 106 HB2 ASP 106 25.624 2.377 5.734 856 HB3 ASP 106 HB3 ASP 106 24.345 3.523 6.085 857 H ARG 107 H ARG 107 23.894 0.650 8.877 858 HA ARG 107 HA ARG 107 25.866 -1.486 8.550 859 HB2 ARG 107 HB2 ARG 107 25.551 -1.802 10.946 860 HB3 ARG 107 HB3 ARG 107 26.123 -0.172 10.507 861 HG2 ARG 107 HG2 ARG 107 24.103 0.792 11.137 862 HG3 ARG 107 HG3 ARG 107 23.242 -0.694 10.749 863 HD2 ARG 107 HD2 ARG 107 23.054 -0.692 13.021 864 HD3 ARG 107 HD3 ARG 107 24.454 -1.738 12.836 865 HE ARG 107 HE ARG 107 24.271 0.886 14.095 866 HH11 ARG 107 HH11 ARG 107 26.723 -1.111 12.455 867 HH12 ARG 107 HH12 ARG 107 28.031 -0.244 13.177 868 HH21 ARG 107 HH21 ARG 107 25.811 1.950 14.898 869 HH22 ARG 107 HH22 ARG 107 27.472 1.772 14.427 870 H ILE 108 H ILE 108 22.612 -1.462 8.136 871 HA ILE 108 HA ILE 108 22.157 -4.210 9.205 872 HB ILE 108 HB ILE 108 20.012 -2.124 8.613 873 HG12 ILE 108 HG12 ILE 108 21.432 -2.754 11.218 874 HG13 ILE 108 HG13 ILE 108 21.162 -1.191 10.430 875 HG21 ILE 108 HG21 ILE 108 19.848 -4.717 10.198 876 HG22 ILE 108 HG22 ILE 108 18.513 -3.658 9.760 877 HG23 ILE 108 HG23 ILE 108 19.342 -4.553 8.496 878 HD11 ILE 108 HD11 ILE 108 19.119 -2.864 11.909 879 HD12 ILE 108 HD12 ILE 108 19.722 -1.261 12.308 880 HD13 ILE 108 HD13 ILE 108 18.688 -1.467 10.882 881 H VAL 109 H VAL 109 21.457 -1.852 6.517 882 HA VAL 109 HA VAL 109 20.774 -4.155 4.867 883 HB VAL 109 HB VAL 109 20.168 -1.325 4.080 884 HG11 VAL 109 HG11 VAL 109 19.623 -3.168 2.536 885 HG12 VAL 109 HG12 VAL 109 18.596 -3.937 3.765 886 HG13 VAL 109 HG13 VAL 109 18.145 -2.371 3.077 887 HG21 VAL 109 HG21 VAL 109 19.297 -1.406 6.398 888 HG22 VAL 109 HG22 VAL 109 17.931 -1.496 5.271 889 HG23 VAL 109 HG23 VAL 109 18.549 -2.972 6.079 890 H LYS 110 H LYS 110 21.603 -4.357 2.832 891 HA LYS 110 HA LYS 110 24.279 -3.336 2.302 892 HB2 LYS 110 HB2 LYS 110 22.398 -5.187 1.003 893 HB3 LYS 110 HB3 LYS 110 23.779 -4.542 0.119 894 HG2 LYS 110 HG2 LYS 110 25.329 -5.053 2.029 895 HG3 LYS 110 HG3 LYS 110 23.965 -5.829 2.896 896 HD2 LYS 110 HD2 LYS 110 24.585 -6.593 0.112 897 HD3 LYS 110 HD3 LYS 110 25.755 -7.172 1.282 898 HE2 LYS 110 HE2 LYS 110 22.889 -7.354 1.952 899 HE3 LYS 110 HE3 LYS 110 23.578 -8.567 0.851 900 HZ1 LYS 110 HZ1 LYS 110 23.852 -9.284 3.284 901 HZ2 LYS 110 HZ2 LYS 110 25.311 -9.017 2.576 902 HZ3 LYS 110 HZ3 LYS 110 24.648 -7.915 3.582 903 H ILE 111 H ILE 111 24.787 -2.535 0.254 904 HA ILE 111 HA ILE 111 22.911 -0.551 -0.762 905 HB ILE 111 HB ILE 111 24.141 0.157 1.483 906 HG12 ILE 111 HG12 ILE 111 24.546 2.504 -0.132 907 HG13 ILE 111 HG13 ILE 111 23.082 1.693 -0.663 908 HG21 ILE 111 HG21 ILE 111 26.236 1.377 1.193 909 HG22 ILE 111 HG22 ILE 111 26.433 -0.338 0.789 910 HG23 ILE 111 HG23 ILE 111 26.314 0.882 -0.501 911 HD11 ILE 111 HD11 ILE 111 23.735 2.541 2.209 912 HD12 ILE 111 HD12 ILE 111 22.528 3.280 1.146 913 HD13 ILE 111 HD13 ILE 111 22.318 1.607 1.743 914 H TYR 112 H TYR 112 23.562 0.330 -2.810 915 HA TYR 112 HA TYR 112 26.023 -0.721 -4.068 916 HB2 TYR 112 HB2 TYR 112 23.128 -1.238 -4.891 917 HB3 TYR 112 HB3 TYR 112 24.520 -1.620 -5.874 918 HD1 TYR 112 HD1 TYR 112 26.261 -3.226 -5.019 919 HD2 TYR 112 HD2 TYR 112 22.504 -2.682 -3.005 920 HE1 TYR 112 HE1 TYR 112 26.576 -5.370 -3.895 921 HE2 TYR 112 HE2 TYR 112 22.715 -5.077 -2.071 922 HH TYR 112 HH TYR 112 25.657 -6.821 -2.220 923 H ASP 113 H ASP 113 26.173 0.121 -6.377 924 HA ASP 113 HA ASP 113 25.540 3.016 -6.285 925 HB2 ASP 113 HB2 ASP 113 27.608 1.382 -7.530 926 HB3 ASP 113 HB3 ASP 113 26.862 2.438 -8.711 927 H THR 114 H THR 114 24.747 0.125 -8.235 928 HA THR 114 HA THR 114 22.603 1.706 -9.542 929 HB THR 114 HB THR 114 22.993 0.928 -11.633 930 HG1 THR 114 HG1 THR 114 25.063 -0.666 -11.677 931 HG21 THR 114 HG21 THR 114 25.171 1.583 -12.311 932 HG22 THR 114 HG22 THR 114 24.692 2.590 -10.920 933 HG23 THR 114 HG23 THR 114 25.853 1.263 -10.698 934 H ILE 115 H ILE 115 21.148 0.136 -10.696 935 HA ILE 115 HA ILE 115 20.154 -1.784 -8.676 936 HB ILE 115 HB ILE 115 19.197 -0.970 -11.428 937 HG12 ILE 115 HG12 ILE 115 18.634 0.625 -9.712 938 HG13 ILE 115 HG13 ILE 115 17.197 -0.215 -10.260 939 HG21 ILE 115 HG21 ILE 115 18.027 -3.163 -9.643 940 HG22 ILE 115 HG22 ILE 115 17.192 -2.461 -11.058 941 HG23 ILE 115 HG23 ILE 115 18.692 -3.372 -11.253 942 HD11 ILE 115 HD11 ILE 115 18.131 -1.640 -7.941 943 HD12 ILE 115 HD12 ILE 115 18.113 0.093 -7.590 944 HD13 ILE 115 HD13 ILE 115 16.658 -0.668 -8.151 945 H SER 116 H SER 116 21.894 -1.846 -11.838 946 HA SER 116 HA SER 116 21.750 -4.687 -12.030 947 HB2 SER 116 HB2 SER 116 22.159 -3.174 -13.933 948 HB3 SER 116 HB3 SER 116 23.698 -2.658 -13.203 949 HG SER 116 HG SER 116 23.267 -5.401 -13.749 950 H GLU 117 H GLU 117 24.048 -2.388 -10.355 951 HA GLU 117 HA GLU 117 25.995 -4.290 -9.714 952 HB2 GLU 117 HB2 GLU 117 25.605 -1.538 -9.429 953 HB3 GLU 117 HB3 GLU 117 25.392 -2.104 -7.774 954 HG2 GLU 117 HG2 GLU 117 27.570 -3.374 -8.061 955 HG3 GLU 117 HG3 GLU 117 27.700 -2.598 -9.650 956 H ALA 118 H ALA 118 22.718 -4.177 -8.741 957 HA ALA 118 HA ALA 118 23.275 -5.452 -6.118 958 HB1 ALA 118 HB1 ALA 118 21.173 -4.540 -5.408 959 HB2 ALA 118 HB2 ALA 118 22.125 -3.218 -6.121 960 HB3 ALA 118 HB3 ALA 118 20.793 -3.928 -7.045 961 H MET 119 H MET 119 21.353 -5.567 -9.163 962 HA MET 119 HA MET 119 19.469 -7.353 -8.410 963 HB2 MET 119 HB2 MET 119 19.899 -5.927 -10.657 964 HB3 MET 119 HB3 MET 119 20.560 -7.448 -11.233 965 HG2 MET 119 HG2 MET 119 18.281 -8.378 -10.107 966 HG3 MET 119 HG3 MET 119 17.817 -6.681 -10.300 967 HE1 MET 119 HE1 MET 119 18.546 -9.815 -13.612 968 HE2 MET 119 HE2 MET 119 19.721 -9.451 -12.333 969 HE3 MET 119 HE3 MET 119 18.157 -10.190 -11.921 970 H GLU 120 H GLU 120 22.552 -8.180 -9.951 971 HA GLU 120 HA GLU 120 22.094 -11.067 -9.582 972 HB2 GLU 120 HB2 GLU 120 24.269 -11.206 -10.818 973 HB3 GLU 120 HB3 GLU 120 23.012 -10.315 -11.693 974 HG2 GLU 120 HG2 GLU 120 23.999 -8.171 -11.138 975 HG3 GLU 120 HG3 GLU 120 25.170 -8.927 -10.055 976 H GLU 121 H GLU 121 23.577 -8.436 -7.874 977 HA GLU 121 HA GLU 121 25.705 -10.034 -6.702 978 HB2 GLU 121 HB2 GLU 121 25.769 -7.547 -7.309 979 HB3 GLU 121 HB3 GLU 121 24.746 -7.264 -5.895 980 HG2 GLU 121 HG2 GLU 121 26.968 -6.911 -5.166 981 HG3 GLU 121 HG3 GLU 121 26.530 -8.483 -4.496 982 H VAL 122 H VAL 122 22.727 -8.423 -5.531 983 HA VAL 122 HA VAL 122 22.677 -9.231 -2.838 984 HB VAL 122 HB VAL 122 21.246 -7.645 -4.399 985 HG11 VAL 122 HG11 VAL 122 18.936 -8.364 -4.648 986 HG12 VAL 122 HG12 VAL 122 20.014 -9.364 -5.609 987 HG13 VAL 122 HG13 VAL 122 19.337 -9.978 -4.067 988 HG21 VAL 122 HG21 VAL 122 19.618 -7.599 -2.386 989 HG22 VAL 122 HG22 VAL 122 20.736 -8.829 -1.733 990 HG23 VAL 122 HG23 VAL 122 21.343 -7.233 -2.169 991 H ARG 123 H ARG 123 22.193 -11.124 -5.582 992 HA ARG 123 HA ARG 123 20.877 -13.427 -4.443 993 HB2 ARG 123 HB2 ARG 123 22.804 -13.410 -6.787 994 HB3 ARG 123 HB3 ARG 123 21.484 -14.528 -6.517 995 HG2 ARG 123 HG2 ARG 123 20.996 -11.576 -7.017 996 HG3 ARG 123 HG3 ARG 123 21.184 -12.725 -8.290 997 HD2 ARG 123 HD2 ARG 123 18.808 -12.034 -6.996 998 HD3 ARG 123 HD3 ARG 123 19.126 -13.246 -8.230 999 HE ARG 123 HE ARG 123 19.064 -13.823 -5.315 1000 HH11 ARG 123 HH11 ARG 123 18.478 -14.946 -8.682 1001 HH12 ARG 123 HH12 ARG 123 18.117 -16.550 -8.186 1002 HH21 ARG 123 HH21 ARG 123 18.582 -15.880 -4.721 1003 HH22 ARG 123 HH22 ARG 123 18.296 -17.146 -5.896 1004 H ARG 124 H ARG 124 24.364 -12.551 -4.829 1005 HA ARG 124 HA ARG 124 25.168 -14.575 -2.896 1006 HB2 ARG 124 HB2 ARG 124 27.084 -15.222 -4.751 1007 HB3 ARG 124 HB3 ARG 124 25.665 -16.141 -4.392 1008 HG2 ARG 124 HG2 ARG 124 26.123 -15.932 -6.765 1009 HG3 ARG 124 HG3 ARG 124 24.514 -15.401 -6.304 1010 HD2 ARG 124 HD2 ARG 124 25.048 -13.824 -7.836 1011 HD3 ARG 124 HD3 ARG 124 25.577 -12.971 -6.403 1012 HE ARG 124 HE ARG 124 27.160 -14.120 -8.591 1013 HH11 ARG 124 HH11 ARG 124 27.893 -12.874 -5.339 1014 HH12 ARG 124 HH12 ARG 124 28.477 -11.367 -5.954 1015 HH21 ARG 124 HH21 ARG 124 28.156 -12.166 -9.349 1016 HH22 ARG 124 HH22 ARG 124 29.104 -11.227 -8.249 1017 H LYS 125 H LYS 125 25.051 -11.838 -2.937 1018 HA LYS 125 HA LYS 125 27.328 -10.466 -2.345 1019 HB2 LYS 125 HB2 LYS 125 25.848 -9.408 -0.673 1020 HB3 LYS 125 HB3 LYS 125 24.883 -9.831 -2.069 1021 HG2 LYS 125 HG2 LYS 125 25.163 -11.555 0.393 1022 HG3 LYS 125 HG3 LYS 125 23.885 -10.365 0.187 1023 HD2 LYS 125 HD2 LYS 125 22.620 -12.086 -0.471 1024 HD3 LYS 125 HD3 LYS 125 23.539 -12.054 -1.964 1025 HE2 LYS 125 HE2 LYS 125 23.469 -14.333 -1.121 1026 HE3 LYS 125 HE3 LYS 125 25.122 -13.710 -1.025 1027 HZ1 LYS 125 HZ1 LYS 125 23.300 -14.267 1.199 1028 HZ2 LYS 125 HZ2 LYS 125 24.870 -14.700 0.941 1029 HZ3 LYS 125 HZ3 LYS 125 24.525 -13.174 1.374 Start of MODEL 13 1 H1 MET 1 H1 MET 1 -1.822 -12.331 12.549 2 HA MET 1 HA MET 1 -4.135 -12.505 11.979 3 HB2 MET 1 HB2 MET 1 -3.239 -12.359 14.466 4 HB3 MET 1 HB3 MET 1 -4.183 -10.859 14.515 5 HG2 MET 1 HG2 MET 1 -6.182 -12.169 13.790 6 HG3 MET 1 HG3 MET 1 -5.170 -13.612 13.663 7 HE1 MET 1 HE1 MET 1 -6.908 -15.057 16.583 8 HE2 MET 1 HE2 MET 1 -7.289 -14.515 14.944 9 HE3 MET 1 HE3 MET 1 -5.780 -15.395 15.260 10 H GLY 2 H GLY 2 -6.256 -11.369 11.555 11 HA2 GLY 2 HA2 GLY 2 -7.664 -9.625 11.487 12 HA3 GLY 2 HA3 GLY 2 -6.410 -8.590 12.155 13 H SER 3 H SER 3 -6.731 -10.334 8.976 14 HA SER 3 HA SER 3 -7.962 -8.103 7.888 15 HB2 SER 3 HB2 SER 3 -6.436 -7.700 5.918 16 HB3 SER 3 HB3 SER 3 -5.883 -7.016 7.438 17 HG SER 3 HG SER 3 -4.445 -8.771 7.660 18 H ASP 4 H ASP 4 -9.121 -8.750 5.955 19 HA ASP 4 HA ASP 4 -8.594 -11.372 4.818 20 HB2 ASP 4 HB2 ASP 4 -10.894 -12.191 5.397 21 HB3 ASP 4 HB3 ASP 4 -9.729 -12.194 6.703 22 H LYS 5 H LYS 5 -8.684 -10.931 2.755 23 HA LYS 5 HA LYS 5 -9.248 -10.114 0.741 24 HB2 LYS 5 HB2 LYS 5 -11.235 -11.644 1.750 25 HB3 LYS 5 HB3 LYS 5 -12.143 -10.178 1.493 26 HG2 LYS 5 HG2 LYS 5 -12.506 -11.368 -0.442 27 HG3 LYS 5 HG3 LYS 5 -11.252 -10.245 -0.966 28 HD2 LYS 5 HD2 LYS 5 -9.694 -11.899 -1.259 29 HD3 LYS 5 HD3 LYS 5 -10.328 -12.914 0.045 30 HE2 LYS 5 HE2 LYS 5 -11.863 -13.970 -1.226 31 HE3 LYS 5 HE3 LYS 5 -12.196 -12.569 -2.251 32 HZ1 LYS 5 HZ1 LYS 5 -10.181 -13.038 -3.461 33 HZ2 LYS 5 HZ2 LYS 5 -9.839 -14.331 -2.489 34 HZ3 LYS 5 HZ3 LYS 5 -11.176 -14.338 -3.459 35 H ILE 6 H ILE 6 -8.765 -7.940 2.661 36 HA ILE 6 HA ILE 6 -10.902 -6.049 2.411 37 HB ILE 6 HB ILE 6 -9.718 -6.547 4.479 38 HG12 ILE 6 HG12 ILE 6 -9.215 -4.052 5.127 39 HG13 ILE 6 HG13 ILE 6 -9.893 -3.682 3.553 40 HG21 ILE 6 HG21 ILE 6 -7.404 -6.834 3.688 41 HG22 ILE 6 HG22 ILE 6 -7.289 -5.088 3.407 42 HG23 ILE 6 HG23 ILE 6 -7.544 -5.707 5.045 43 HD11 ILE 6 HD11 ILE 6 -11.910 -5.122 4.215 44 HD12 ILE 6 HD12 ILE 6 -11.240 -5.155 5.850 45 HD13 ILE 6 HD13 ILE 6 -11.710 -3.606 5.110 46 H HIS 7 H HIS 7 -10.288 -6.265 -0.177 47 HA HIS 7 HA HIS 7 -9.776 -3.533 -0.829 48 HB2 HIS 7 HB2 HIS 7 -7.979 -3.985 -2.521 49 HB3 HIS 7 HB3 HIS 7 -7.484 -3.922 -0.842 50 HD1 HIS 7 HD1 HIS 7 -6.651 -6.247 0.363 51 HD2 HIS 7 HD2 HIS 7 -7.302 -6.218 -3.811 52 HE1 HIS 7 HE1 HIS 7 -5.552 -8.277 -0.499 53 H HIS 8 H HIS 8 -10.417 -3.031 -2.965 54 HA HIS 8 HA HIS 8 -12.187 -5.031 -4.227 55 HB2 HIS 8 HB2 HIS 8 -13.098 -2.856 -3.405 56 HB3 HIS 8 HB3 HIS 8 -12.016 -2.006 -4.507 57 HD1 HIS 8 HD1 HIS 8 -14.940 -4.619 -4.870 58 HD2 HIS 8 HD2 HIS 8 -13.042 -1.355 -6.770 59 HE1 HIS 8 HE1 HIS 8 -16.098 -4.308 -7.097 60 H HIS 9 H HIS 9 -12.305 -4.018 -6.841 61 HA HIS 9 HA HIS 9 -9.726 -4.862 -7.960 62 HB2 HIS 9 HB2 HIS 9 -12.423 -5.113 -8.765 63 HB3 HIS 9 HB3 HIS 9 -11.750 -3.966 -9.903 64 HD1 HIS 9 HD1 HIS 9 -12.224 -7.480 -9.668 65 HD2 HIS 9 HD2 HIS 9 -8.999 -4.982 -10.734 66 HE1 HIS 9 HE1 HIS 9 -10.514 -8.966 -10.876 67 H HIS 10 H HIS 10 -8.152 -3.283 -7.785 68 HA HIS 10 HA HIS 10 -8.784 -0.680 -9.071 69 HB2 HIS 10 HB2 HIS 10 -7.282 -1.187 -6.490 70 HB3 HIS 10 HB3 HIS 10 -7.195 0.312 -7.382 71 HD1 HIS 10 HD1 HIS 10 -10.689 -0.238 -7.803 72 HD2 HIS 10 HD2 HIS 10 -8.192 0.573 -4.492 73 HE1 HIS 10 HE1 HIS 10 -12.158 0.893 -6.057 74 H HIS 11 H HIS 11 -7.046 0.148 -10.311 75 HA HIS 11 HA HIS 11 -4.971 -1.684 -11.185 76 HB2 HIS 11 HB2 HIS 11 -5.888 1.101 -11.835 77 HB3 HIS 11 HB3 HIS 11 -4.206 0.723 -12.134 78 HD1 HIS 11 HD1 HIS 11 -7.606 -0.933 -13.134 79 HD2 HIS 11 HD2 HIS 11 -3.656 -0.216 -14.434 80 HE1 HIS 11 HE1 HIS 11 -7.433 -1.829 -15.524 81 H HIS 12 H HIS 12 -2.716 -1.315 -11.025 82 HA HIS 12 HA HIS 12 -1.796 -0.087 -8.482 83 HB2 HIS 12 HB2 HIS 12 -0.861 -2.513 -10.058 84 HB3 HIS 12 HB3 HIS 12 0.019 -1.799 -8.720 85 HD1 HIS 12 HD1 HIS 12 -3.709 -2.998 -8.990 86 HD2 HIS 12 HD2 HIS 12 -0.264 -3.078 -6.601 87 HE1 HIS 12 HE1 HIS 12 -4.305 -4.403 -6.920 88 H MET 13 H MET 13 -0.711 1.796 -8.836 89 HA MET 13 HA MET 13 1.478 1.783 -10.737 90 HB2 MET 13 HB2 MET 13 -0.963 3.369 -11.227 91 HB3 MET 13 HB3 MET 13 0.481 4.370 -11.103 92 HG2 MET 13 HG2 MET 13 0.268 1.964 -12.944 93 HG3 MET 13 HG3 MET 13 -0.075 3.630 -13.407 94 HE1 MET 13 HE1 MET 13 1.567 4.417 -15.136 95 HE2 MET 13 HE2 MET 13 3.170 3.682 -15.333 96 HE3 MET 13 HE3 MET 13 1.716 2.664 -15.399 97 H PHE 14 H PHE 14 3.226 2.362 -9.486 98 HA PHE 14 HA PHE 14 3.054 4.646 -7.718 99 HB2 PHE 14 HB2 PHE 14 3.640 1.766 -7.010 100 HB3 PHE 14 HB3 PHE 14 4.660 2.982 -6.341 101 HD1 PHE 14 HD1 PHE 14 3.623 4.760 -4.747 102 HD2 PHE 14 HD2 PHE 14 1.399 1.399 -6.305 103 HE1 PHE 14 HE1 PHE 14 1.854 5.140 -3.077 104 HE2 PHE 14 HE2 PHE 14 -0.389 1.823 -4.616 105 HZ PHE 14 HZ PHE 14 -0.178 3.734 -3.060 106 HA PRO 15 HA PRO 15 6.985 5.206 -9.799 107 HB2 PRO 15 HB2 PRO 15 8.546 6.494 -8.027 108 HB3 PRO 15 HB3 PRO 15 7.099 7.242 -8.700 109 HG2 PRO 15 HG2 PRO 15 7.382 5.883 -6.011 110 HG3 PRO 15 HG3 PRO 15 6.608 7.455 -6.377 111 HD2 PRO 15 HD2 PRO 15 5.222 5.107 -6.124 112 HD3 PRO 15 HD3 PRO 15 4.680 6.413 -7.221 113 H TYR 16 H TYR 16 7.364 2.912 -10.061 114 HA TYR 16 HA TYR 16 9.745 1.977 -8.871 115 HB2 TYR 16 HB2 TYR 16 8.999 0.150 -7.600 116 HB3 TYR 16 HB3 TYR 16 7.951 1.473 -7.089 117 HD1 TYR 16 HD1 TYR 16 5.634 1.537 -8.123 118 HD2 TYR 16 HD2 TYR 16 8.202 -1.884 -8.348 119 HE1 TYR 16 HE1 TYR 16 3.681 0.132 -8.769 120 HE2 TYR 16 HE2 TYR 16 6.308 -3.293 -8.958 121 HH TYR 16 HH TYR 16 3.162 -1.889 -9.777 122 H LYS 17 H LYS 17 10.115 -0.431 -9.671 123 HA LYS 17 HA LYS 17 8.631 -1.138 -12.107 124 HB2 LYS 17 HB2 LYS 17 10.854 0.191 -12.625 125 HB3 LYS 17 HB3 LYS 17 11.670 -1.248 -11.993 126 HG2 LYS 17 HG2 LYS 17 9.792 -2.252 -13.771 127 HG3 LYS 17 HG3 LYS 17 10.422 -0.836 -14.584 128 HD2 LYS 17 HD2 LYS 17 12.178 -2.989 -13.379 129 HD3 LYS 17 HD3 LYS 17 11.483 -3.128 -15.015 130 HE2 LYS 17 HE2 LYS 17 12.535 -0.825 -15.476 131 HE3 LYS 17 HE3 LYS 17 13.470 -1.122 -13.996 132 HZ1 LYS 17 HZ1 LYS 17 13.396 -2.947 -16.344 133 HZ2 LYS 17 HZ2 LYS 17 14.625 -1.900 -16.026 134 HZ3 LYS 17 HZ3 LYS 17 14.310 -3.146 -15.010 135 H ILE 18 H ILE 18 9.383 -3.431 -12.734 136 HA ILE 18 HA ILE 18 10.593 -5.101 -10.654 137 HB ILE 18 HB ILE 18 7.969 -5.567 -12.101 138 HG12 ILE 18 HG12 ILE 18 8.731 -5.739 -9.144 139 HG13 ILE 18 HG13 ILE 18 7.885 -4.396 -9.914 140 HG21 ILE 18 HG21 ILE 18 9.572 -7.675 -10.563 141 HG22 ILE 18 HG22 ILE 18 7.968 -7.874 -11.316 142 HG23 ILE 18 HG23 ILE 18 9.352 -7.634 -12.323 143 HD11 ILE 18 HD11 ILE 18 6.064 -6.001 -10.589 144 HD12 ILE 18 HD12 ILE 18 6.814 -7.206 -9.508 145 HD13 ILE 18 HD13 ILE 18 6.206 -5.696 -8.850 146 H VAL 19 H VAL 19 12.069 -6.481 -11.582 147 HA VAL 19 HA VAL 19 12.274 -6.830 -14.475 148 HB VAL 19 HB VAL 19 14.635 -7.260 -14.026 149 HG11 VAL 19 HG11 VAL 19 15.454 -4.949 -13.568 150 HG12 VAL 19 HG12 VAL 19 14.090 -5.005 -14.711 151 HG13 VAL 19 HG13 VAL 19 13.822 -4.502 -13.031 152 HG21 VAL 19 HG21 VAL 19 14.557 -8.008 -11.688 153 HG22 VAL 19 HG22 VAL 19 15.778 -6.772 -11.987 154 HG23 VAL 19 HG23 VAL 19 14.237 -6.338 -11.189 155 H ASP 20 H ASP 20 13.811 -9.051 -14.342 156 HA ASP 20 HA ASP 20 12.445 -11.205 -14.522 157 HB2 ASP 20 HB2 ASP 20 14.815 -11.301 -14.683 158 HB3 ASP 20 HB3 ASP 20 15.024 -10.895 -12.980 159 H ASP 21 H ASP 21 13.816 -11.202 -11.210 160 HA ASP 21 HA ASP 21 11.069 -11.607 -10.154 161 HB2 ASP 21 HB2 ASP 21 13.466 -13.186 -9.270 162 HB3 ASP 21 HB3 ASP 21 11.869 -13.216 -8.563 163 H VAL 22 H VAL 22 12.521 -9.092 -10.205 164 HA VAL 22 HA VAL 22 12.716 -8.548 -7.356 165 HB VAL 22 HB VAL 22 15.020 -7.545 -9.182 166 HG11 VAL 22 HG11 VAL 22 14.538 -7.510 -6.270 167 HG12 VAL 22 HG12 VAL 22 16.173 -7.546 -6.843 168 HG13 VAL 22 HG13 VAL 22 15.055 -6.231 -7.358 169 HG21 VAL 22 HG21 VAL 22 16.579 -9.303 -8.270 170 HG22 VAL 22 HG22 VAL 22 15.192 -10.088 -7.477 171 HG23 VAL 22 HG23 VAL 22 15.305 -10.039 -9.228 172 H VAL 23 H VAL 23 12.662 -6.573 -6.739 173 HA VAL 23 HA VAL 23 11.033 -5.037 -8.593 174 HB VAL 23 HB VAL 23 9.631 -4.885 -7.000 175 HG11 VAL 23 HG11 VAL 23 9.175 -6.618 -5.502 176 HG12 VAL 23 HG12 VAL 23 9.575 -7.015 -7.157 177 HG13 VAL 23 HG13 VAL 23 10.728 -7.377 -5.951 178 HG21 VAL 23 HG21 VAL 23 9.768 -4.416 -4.676 179 HG22 VAL 23 HG22 VAL 23 11.471 -3.948 -5.100 180 HG23 VAL 23 HG23 VAL 23 10.103 -3.265 -5.994 181 H ILE 24 H ILE 24 11.296 -2.716 -8.636 182 HA ILE 24 HA ILE 24 13.682 -1.574 -7.241 183 HB ILE 24 HB ILE 24 12.628 -1.194 -10.107 184 HG12 ILE 24 HG12 ILE 24 14.976 -1.911 -10.743 185 HG13 ILE 24 HG13 ILE 24 15.142 -2.570 -9.101 186 HG21 ILE 24 HG21 ILE 24 14.478 0.345 -10.368 187 HG22 ILE 24 HG22 ILE 24 13.637 0.835 -8.872 188 HG23 ILE 24 HG23 ILE 24 15.108 -0.103 -8.761 189 HD11 ILE 24 HD11 ILE 24 12.938 -3.518 -10.933 190 HD12 ILE 24 HD12 ILE 24 14.652 -4.038 -11.104 191 HD13 ILE 24 HD13 ILE 24 13.855 -4.437 -9.635 192 H LEU 25 H LEU 25 12.256 -0.648 -5.457 193 HA LEU 25 HA LEU 25 10.183 1.144 -6.254 194 HB2 LEU 25 HB2 LEU 25 11.727 0.934 -3.642 195 HB3 LEU 25 HB3 LEU 25 10.413 2.041 -3.953 196 HG LEU 25 HG LEU 25 9.259 0.446 -2.980 197 HD11 LEU 25 HD11 LEU 25 8.348 0.339 -5.344 198 HD12 LEU 25 HD12 LEU 25 9.312 -1.128 -5.565 199 HD13 LEU 25 HD13 LEU 25 8.003 -1.046 -4.365 200 HD21 LEU 25 HD21 LEU 25 10.987 -1.726 -3.985 201 HD22 LEU 25 HD22 LEU 25 11.119 -0.969 -2.385 202 HD23 LEU 25 HD23 LEU 25 9.654 -1.854 -2.803 203 H MET 26 H MET 26 10.392 3.586 -6.076 204 HA MET 26 HA MET 26 13.019 4.807 -5.940 205 HB2 MET 26 HB2 MET 26 12.733 5.644 -8.403 206 HB3 MET 26 HB3 MET 26 13.494 4.086 -8.031 207 HG2 MET 26 HG2 MET 26 11.827 2.809 -8.650 208 HG3 MET 26 HG3 MET 26 10.614 4.122 -8.624 209 HE1 MET 26 HE1 MET 26 12.190 1.746 -10.821 210 HE2 MET 26 HE2 MET 26 12.902 2.633 -12.186 211 HE3 MET 26 HE3 MET 26 13.702 2.668 -10.602 212 HA PRO 27 HA PRO 27 9.105 7.075 -4.987 213 HB2 PRO 27 HB2 PRO 27 9.922 8.333 -2.650 214 HB3 PRO 27 HB3 PRO 27 9.221 6.690 -2.735 215 HG2 PRO 27 HG2 PRO 27 12.097 7.513 -2.503 216 HG3 PRO 27 HG3 PRO 27 11.265 6.132 -1.731 217 HD2 PRO 27 HD2 PRO 27 12.865 5.972 -3.975 218 HD3 PRO 27 HD3 PRO 27 11.544 4.811 -3.665 219 H ASN 28 H ASN 28 8.804 8.868 -6.258 220 HA ASN 28 HA ASN 28 10.907 10.845 -6.599 221 HB2 ASN 28 HB2 ASN 28 9.380 12.043 -8.069 222 HB3 ASN 28 HB3 ASN 28 9.662 10.376 -8.497 223 HD21 ASN 28 HD21 ASN 28 7.225 12.078 -6.446 224 HD22 ASN 28 HD22 ASN 28 5.822 11.344 -7.246 225 H LYS 29 H LYS 29 11.036 11.093 -4.186 226 HA LYS 29 HA LYS 29 10.888 12.414 -2.321 227 HB2 LYS 29 HB2 LYS 29 9.648 14.469 -4.207 228 HB3 LYS 29 HB3 LYS 29 9.936 14.724 -2.502 229 HG2 LYS 29 HG2 LYS 29 11.697 15.758 -3.607 230 HG3 LYS 29 HG3 LYS 29 12.307 14.363 -2.733 231 HD2 LYS 29 HD2 LYS 29 13.426 14.658 -4.791 232 HD3 LYS 29 HD3 LYS 29 12.577 13.107 -4.756 233 HE2 LYS 29 HE2 LYS 29 11.127 13.673 -6.464 234 HE3 LYS 29 HE3 LYS 29 11.169 15.392 -6.086 235 HZ1 LYS 29 HZ1 LYS 29 13.382 13.855 -7.307 236 HZ2 LYS 29 HZ2 LYS 29 12.325 14.864 -8.109 237 HZ3 LYS 29 HZ3 LYS 29 13.407 15.464 -7.002 238 H GLU 30 H GLU 30 8.380 10.748 -3.425 239 HA GLU 30 HA GLU 30 6.164 11.901 -1.954 240 HB2 GLU 30 HB2 GLU 30 4.953 9.920 -2.646 241 HB3 GLU 30 HB3 GLU 30 5.791 10.688 -3.991 242 HG2 GLU 30 HG2 GLU 30 6.990 8.944 -4.469 243 HG3 GLU 30 HG3 GLU 30 7.501 8.669 -2.818 244 H LEU 31 H LEU 31 8.545 11.347 -0.330 245 HA LEU 31 HA LEU 31 7.532 9.181 1.439 246 HB2 LEU 31 HB2 LEU 31 10.219 10.429 1.076 247 HB3 LEU 31 HB3 LEU 31 9.760 9.818 2.664 248 HG LEU 31 HG LEU 31 9.944 7.674 2.158 249 HD11 LEU 31 HD11 LEU 31 8.864 8.158 -0.654 250 HD12 LEU 31 HD12 LEU 31 9.519 6.600 -0.081 251 HD13 LEU 31 HD13 LEU 31 8.106 7.287 0.686 252 HD21 LEU 31 HD21 LEU 31 12.057 8.774 1.377 253 HD22 LEU 31 HD22 LEU 31 11.747 7.191 0.644 254 HD23 LEU 31 HD23 LEU 31 11.436 8.675 -0.283 255 H ASN 32 H ASN 32 5.727 10.230 1.750 256 HA ASN 32 HA ASN 32 5.725 12.319 3.883 257 HB2 ASN 32 HB2 ASN 32 3.130 12.017 3.507 258 HB3 ASN 32 HB3 ASN 32 4.051 13.084 2.501 259 HD21 ASN 32 HD21 ASN 32 4.592 12.359 0.304 260 HD22 ASN 32 HD22 ASN 32 3.813 10.978 -0.457 261 H ILE 33 H ILE 33 4.819 11.721 5.833 262 HA ILE 33 HA ILE 33 5.078 9.134 6.859 263 HB ILE 33 HB ILE 33 5.121 10.958 8.296 264 HG12 ILE 33 HG12 ILE 33 2.422 9.688 8.900 265 HG13 ILE 33 HG13 ILE 33 3.943 8.866 9.108 266 HG21 ILE 33 HG21 ILE 33 3.009 12.440 8.618 267 HG22 ILE 33 HG22 ILE 33 3.996 12.713 7.203 268 HG23 ILE 33 HG23 ILE 33 2.489 11.802 7.036 269 HD11 ILE 33 HD11 ILE 33 3.169 9.732 11.192 270 HD12 ILE 33 HD12 ILE 33 4.690 10.531 10.722 271 HD13 ILE 33 HD13 ILE 33 3.110 11.380 10.546 272 H GLU 34 H GLU 34 2.301 10.586 5.180 273 HA GLU 34 HA GLU 34 0.325 8.659 5.878 274 HB2 GLU 34 HB2 GLU 34 0.671 10.269 3.304 275 HB3 GLU 34 HB3 GLU 34 -0.755 9.326 3.737 276 HG2 GLU 34 HG2 GLU 34 -0.940 10.745 5.819 277 HG3 GLU 34 HG3 GLU 34 0.354 11.766 5.187 278 H ASN 35 H ASN 35 2.296 8.922 2.958 279 HA ASN 35 HA ASN 35 1.781 6.430 1.814 280 HB2 ASN 35 HB2 ASN 35 2.873 8.211 0.621 281 HB3 ASN 35 HB3 ASN 35 4.332 8.053 1.611 282 HD21 ASN 35 HD21 ASN 35 5.633 7.556 -0.235 283 HD22 ASN 35 HD22 ASN 35 5.512 6.037 -1.086 284 H ALA 36 H ALA 36 4.343 7.325 4.140 285 HA ALA 36 HA ALA 36 5.787 4.949 4.252 286 HB1 ALA 36 HB1 ALA 36 5.185 6.947 6.449 287 HB2 ALA 36 HB2 ALA 36 6.373 5.634 6.606 288 HB3 ALA 36 HB3 ALA 36 6.606 6.878 5.404 289 H HIS 37 H HIS 37 2.679 5.633 6.041 290 HA HIS 37 HA HIS 37 2.892 3.234 7.626 291 HB2 HIS 37 HB2 HIS 37 1.406 4.901 8.397 292 HB3 HIS 37 HB3 HIS 37 0.497 4.919 6.879 293 HD1 HIS 37 HD1 HIS 37 -1.865 4.014 7.787 294 HD2 HIS 37 HD2 HIS 37 1.468 1.788 9.060 295 HE1 HIS 37 HE1 HIS 37 -2.767 1.853 8.678 296 H LEU 38 H LEU 38 1.296 4.016 4.480 297 HA LEU 38 HA LEU 38 0.134 1.377 4.139 298 HB2 LEU 38 HB2 LEU 38 0.736 3.444 1.972 299 HB3 LEU 38 HB3 LEU 38 -0.362 2.090 1.907 300 HG LEU 38 HG LEU 38 -1.931 3.436 2.351 301 HD11 LEU 38 HD11 LEU 38 -2.646 3.981 4.530 302 HD12 LEU 38 HD12 LEU 38 -1.726 2.465 4.661 303 HD13 LEU 38 HD13 LEU 38 -0.988 4.013 5.146 304 HD21 LEU 38 HD21 LEU 38 -1.542 5.858 3.228 305 HD22 LEU 38 HD22 LEU 38 0.165 5.438 2.960 306 HD23 LEU 38 HD23 LEU 38 -0.953 5.380 1.618 307 H PHE 39 H PHE 39 2.954 2.977 3.027 308 HA PHE 39 HA PHE 39 4.151 1.537 1.165 309 HB2 PHE 39 HB2 PHE 39 5.100 3.315 2.979 310 HB3 PHE 39 HB3 PHE 39 5.944 1.878 3.523 311 HD1 PHE 39 HD1 PHE 39 5.366 3.809 0.167 312 HD2 PHE 39 HD2 PHE 39 8.019 1.635 2.774 313 HE1 PHE 39 HE1 PHE 39 7.295 4.627 -1.090 314 HE2 PHE 39 HE2 PHE 39 9.971 2.499 1.489 315 HZ PHE 39 HZ PHE 39 9.584 3.979 -0.476 316 H LYS 40 H LYS 40 4.011 0.372 4.563 317 HA LYS 40 HA LYS 40 5.197 -2.224 4.140 318 HB2 LYS 40 HB2 LYS 40 4.643 -1.361 6.388 319 HB3 LYS 40 HB3 LYS 40 2.923 -1.435 6.007 320 HG2 LYS 40 HG2 LYS 40 3.797 -4.062 5.473 321 HG3 LYS 40 HG3 LYS 40 4.833 -3.570 6.790 322 HD2 LYS 40 HD2 LYS 40 3.150 -4.483 8.013 323 HD3 LYS 40 HD3 LYS 40 2.506 -2.845 7.895 324 HE2 LYS 40 HE2 LYS 40 1.298 -3.715 5.730 325 HE3 LYS 40 HE3 LYS 40 1.768 -5.332 6.263 326 HZ1 LYS 40 HZ1 LYS 40 -0.402 -4.884 7.030 327 HZ2 LYS 40 HZ2 LYS 40 0.577 -4.861 8.358 328 HZ3 LYS 40 HZ3 LYS 40 0.024 -3.451 7.729 329 H LYS 41 H LYS 41 1.685 -1.407 4.165 330 HA LYS 41 HA LYS 41 0.951 -4.060 3.376 331 HB2 LYS 41 HB2 LYS 41 -0.267 -1.560 4.210 332 HB3 LYS 41 HB3 LYS 41 -1.075 -2.060 2.771 333 HG2 LYS 41 HG2 LYS 41 -0.647 -4.282 4.728 334 HG3 LYS 41 HG3 LYS 41 -1.553 -2.949 5.397 335 HD2 LYS 41 HD2 LYS 41 -2.512 -3.891 2.725 336 HD3 LYS 41 HD3 LYS 41 -2.592 -5.081 4.000 337 HE2 LYS 41 HE2 LYS 41 -4.692 -3.889 3.909 338 HE3 LYS 41 HE3 LYS 41 -3.877 -3.523 5.441 339 HZ1 LYS 41 HZ1 LYS 41 -3.135 -1.420 4.381 340 HZ2 LYS 41 HZ2 LYS 41 -4.017 -1.818 3.041 341 HZ3 LYS 41 HZ3 LYS 41 -4.768 -1.550 4.477 342 H TRP 42 H TRP 42 1.674 -1.141 1.498 343 HA TRP 42 HA TRP 42 0.954 -2.156 -1.055 344 HB2 TRP 42 HB2 TRP 42 1.231 0.134 -0.875 345 HB3 TRP 42 HB3 TRP 42 2.822 -0.023 -0.144 346 HD1 TRP 42 HD1 TRP 42 1.427 -1.349 -3.595 347 HE1 TRP 42 HE1 TRP 42 3.124 -0.749 -5.377 348 HE3 TRP 42 HE3 TRP 42 4.922 0.922 -0.632 349 HZ2 TRP 42 HZ2 TRP 42 5.738 0.517 -5.512 350 HZ3 TRP 42 HZ3 TRP 42 6.995 1.789 -1.557 351 HH2 TRP 42 HH2 TRP 42 7.411 1.637 -4.020 352 H VAL 43 H VAL 43 4.414 -1.834 0.090 353 HA VAL 43 HA VAL 43 5.485 -3.525 -1.800 354 HB VAL 43 HB VAL 43 6.307 -2.970 1.080 355 HG11 VAL 43 HG11 VAL 43 7.483 -5.066 0.230 356 HG12 VAL 43 HG12 VAL 43 8.293 -3.998 -0.948 357 HG13 VAL 43 HG13 VAL 43 8.475 -3.726 0.785 358 HG21 VAL 43 HG21 VAL 43 6.897 -1.675 -1.583 359 HG22 VAL 43 HG22 VAL 43 6.473 -0.948 -0.038 360 HG23 VAL 43 HG23 VAL 43 8.101 -1.577 -0.287 361 H PHE 44 H PHE 44 3.854 -4.493 1.236 362 HA PHE 44 HA PHE 44 4.673 -7.182 1.220 363 HB2 PHE 44 HB2 PHE 44 2.481 -5.572 2.565 364 HB3 PHE 44 HB3 PHE 44 2.561 -7.289 2.713 365 HD1 PHE 44 HD1 PHE 44 5.657 -4.973 2.730 366 HD2 PHE 44 HD2 PHE 44 2.977 -7.593 4.878 367 HE1 PHE 44 HE1 PHE 44 7.162 -4.967 4.677 368 HE2 PHE 44 HE2 PHE 44 4.491 -7.540 6.844 369 HZ PHE 44 HZ PHE 44 6.550 -6.212 6.743 370 H ASP 45 H ASP 45 1.525 -5.661 0.299 371 HA ASP 45 HA ASP 45 0.403 -8.114 -0.669 372 HB2 ASP 45 HB2 ASP 45 -0.354 -5.224 -1.057 373 HB3 ASP 45 HB3 ASP 45 -1.180 -6.511 -1.900 374 H GLU 46 H GLU 46 2.290 -5.544 -2.161 375 HA GLU 46 HA GLU 46 1.637 -6.433 -4.833 376 HB2 GLU 46 HB2 GLU 46 1.845 -4.000 -4.077 377 HB3 GLU 46 HB3 GLU 46 3.564 -4.249 -3.864 378 HG2 GLU 46 HG2 GLU 46 2.712 -3.034 -5.957 379 HG3 GLU 46 HG3 GLU 46 3.971 -4.234 -6.133 380 H PHE 47 H PHE 47 4.271 -7.074 -2.660 381 HA PHE 47 HA PHE 47 5.510 -8.621 -4.898 382 HB2 PHE 47 HB2 PHE 47 7.227 -7.426 -2.751 383 HB3 PHE 47 HB3 PHE 47 7.613 -8.033 -4.360 384 HD1 PHE 47 HD1 PHE 47 6.339 -6.653 -6.350 385 HD2 PHE 47 HD2 PHE 47 7.379 -5.153 -2.474 386 HE1 PHE 47 HE1 PHE 47 6.222 -4.344 -7.196 387 HE2 PHE 47 HE2 PHE 47 7.288 -2.784 -3.374 388 HZ PHE 47 HZ PHE 47 6.695 -2.412 -5.733 389 H LEU 48 H LEU 48 5.444 -8.300 -1.306 390 HA LEU 48 HA LEU 48 6.703 -10.826 -0.902 391 HB2 LEU 48 HB2 LEU 48 4.967 -9.311 1.085 392 HB3 LEU 48 HB3 LEU 48 6.161 -10.577 1.427 393 HG LEU 48 HG LEU 48 6.730 -7.788 0.328 394 HD11 LEU 48 HD11 LEU 48 6.267 -8.060 2.842 395 HD12 LEU 48 HD12 LEU 48 7.699 -9.087 2.932 396 HD13 LEU 48 HD13 LEU 48 7.858 -7.381 2.461 397 HD21 LEU 48 HD21 LEU 48 8.223 -9.231 -0.760 398 HD22 LEU 48 HD22 LEU 48 9.007 -8.226 0.455 399 HD23 LEU 48 HD23 LEU 48 8.722 -9.986 0.784 400 H ASN 49 H ASN 49 3.290 -9.932 -0.997 401 HA ASN 49 HA ASN 49 2.180 -12.565 -0.511 402 HB2 ASN 49 HB2 ASN 49 1.153 -9.921 -1.595 403 HB3 ASN 49 HB3 ASN 49 0.203 -11.345 -1.839 404 HD21 ASN 49 HD21 ASN 49 1.816 -9.607 0.893 405 HD22 ASN 49 HD22 ASN 49 0.444 -9.896 1.974 406 H LYS 50 H LYS 50 3.175 -10.693 -3.481 407 HA LYS 50 HA LYS 50 2.002 -12.378 -5.409 408 HB2 LYS 50 HB2 LYS 50 3.955 -10.173 -5.196 409 HB3 LYS 50 HB3 LYS 50 4.491 -11.366 -6.349 410 HG2 LYS 50 HG2 LYS 50 3.269 -9.718 -7.451 411 HG3 LYS 50 HG3 LYS 50 2.252 -11.171 -7.481 412 HD2 LYS 50 HD2 LYS 50 1.402 -9.741 -5.183 413 HD3 LYS 50 HD3 LYS 50 1.827 -8.473 -6.328 414 HE2 LYS 50 HE2 LYS 50 -0.379 -8.769 -6.866 415 HE3 LYS 50 HE3 LYS 50 0.426 -9.797 -8.061 416 HZ1 LYS 50 HZ1 LYS 50 -0.074 -11.683 -6.681 417 HZ2 LYS 50 HZ2 LYS 50 -0.790 -10.696 -5.518 418 HZ3 LYS 50 HZ3 LYS 50 -1.427 -10.864 -7.039 419 H GLY 51 H GLY 51 5.184 -12.474 -3.802 420 HA2 GLY 51 HA2 GLY 51 5.770 -14.927 -3.222 421 HA3 GLY 51 HA3 GLY 51 5.696 -15.169 -4.973 422 H TYR 52 H TYR 52 6.849 -12.007 -4.227 423 HA TYR 52 HA TYR 52 9.505 -12.640 -5.197 424 HB2 TYR 52 HB2 TYR 52 8.224 -10.114 -4.096 425 HB3 TYR 52 HB3 TYR 52 9.896 -10.183 -4.611 426 HD1 TYR 52 HD1 TYR 52 6.403 -10.501 -5.824 427 HD2 TYR 52 HD2 TYR 52 10.545 -10.137 -6.914 428 HE1 TYR 52 HE1 TYR 52 5.741 -10.275 -8.207 429 HE2 TYR 52 HE2 TYR 52 9.896 -9.898 -9.290 430 HH TYR 52 HH TYR 52 6.690 -10.575 -10.482 431 H ASN 53 H ASN 53 11.381 -12.320 -4.081 432 HA ASN 53 HA ASN 53 11.346 -12.042 -1.114 433 HB2 ASN 53 HB2 ASN 53 12.560 -14.187 -2.862 434 HB3 ASN 53 HB3 ASN 53 13.462 -13.705 -1.440 435 HD21 ASN 53 HD21 ASN 53 11.842 -13.506 0.702 436 HD22 ASN 53 HD22 ASN 53 10.845 -14.968 0.767 437 H LYS 54 H LYS 54 11.945 -10.092 -3.528 438 HA LYS 54 HA LYS 54 14.676 -9.299 -2.737 439 HB2 LYS 54 HB2 LYS 54 14.042 -10.788 -5.292 440 HB3 LYS 54 HB3 LYS 54 15.175 -9.437 -5.314 441 HG2 LYS 54 HG2 LYS 54 16.799 -10.474 -4.469 442 HG3 LYS 54 HG3 LYS 54 15.908 -11.138 -3.097 443 HD2 LYS 54 HD2 LYS 54 16.072 -12.389 -5.880 444 HD3 LYS 54 HD3 LYS 54 16.909 -12.953 -4.405 445 HE2 LYS 54 HE2 LYS 54 14.574 -13.102 -3.345 446 HE3 LYS 54 HE3 LYS 54 13.971 -12.945 -5.002 447 HZ1 LYS 54 HZ1 LYS 54 14.207 -15.285 -4.185 448 HZ2 LYS 54 HZ2 LYS 54 15.081 -15.071 -5.520 449 HZ3 LYS 54 HZ3 LYS 54 15.802 -15.100 -4.026 450 H ILE 55 H ILE 55 14.117 -7.222 -2.338 451 HA ILE 55 HA ILE 55 12.413 -5.760 -4.344 452 HB ILE 55 HB ILE 55 12.562 -5.542 -1.261 453 HG12 ILE 55 HG12 ILE 55 10.441 -5.918 -1.118 454 HG13 ILE 55 HG13 ILE 55 10.052 -5.188 -2.644 455 HG21 ILE 55 HG21 ILE 55 12.863 -3.249 -1.991 456 HG22 ILE 55 HG22 ILE 55 11.470 -3.476 -3.113 457 HG23 ILE 55 HG23 ILE 55 11.226 -3.420 -1.407 458 HD11 ILE 55 HD11 ILE 55 10.600 -7.085 -3.792 459 HD12 ILE 55 HD12 ILE 55 11.151 -8.031 -2.308 460 HD13 ILE 55 HD13 ILE 55 9.500 -7.521 -2.475 461 H PHE 56 H PHE 56 13.387 -3.594 -4.827 462 HA PHE 56 HA PHE 56 15.779 -2.926 -3.194 463 HB2 PHE 56 HB2 PHE 56 15.509 -2.425 -6.154 464 HB3 PHE 56 HB3 PHE 56 16.864 -1.823 -5.163 465 HD1 PHE 56 HD1 PHE 56 17.548 -4.072 -3.439 466 HD2 PHE 56 HD2 PHE 56 16.401 -4.058 -7.596 467 HE1 PHE 56 HE1 PHE 56 18.860 -6.128 -3.837 468 HE2 PHE 56 HE2 PHE 56 17.782 -6.167 -7.962 469 HZ PHE 56 HZ PHE 56 18.959 -7.144 -6.112 470 H LEU 57 H LEU 57 16.183 -0.608 -2.932 471 HA LEU 57 HA LEU 57 13.896 1.133 -3.756 472 HB2 LEU 57 HB2 LEU 57 13.809 0.621 -1.346 473 HB3 LEU 57 HB3 LEU 57 15.526 1.057 -1.195 474 HG LEU 57 HG LEU 57 14.899 3.414 -1.869 475 HD11 LEU 57 HD11 LEU 57 12.505 4.043 -1.555 476 HD12 LEU 57 HD12 LEU 57 12.774 3.024 -2.976 477 HD13 LEU 57 HD13 LEU 57 12.077 2.322 -1.495 478 HD21 LEU 57 HD21 LEU 57 13.609 2.235 0.622 479 HD22 LEU 57 HD22 LEU 57 15.292 2.788 0.469 480 HD23 LEU 57 HD23 LEU 57 13.965 3.957 0.371 481 H VAL 58 H VAL 58 14.778 2.310 -5.545 482 HA VAL 58 HA VAL 58 17.567 3.154 -5.349 483 HB VAL 58 HB VAL 58 15.439 3.957 -7.327 484 HG11 VAL 58 HG11 VAL 58 17.346 4.415 -8.844 485 HG12 VAL 58 HG12 VAL 58 17.491 5.363 -7.367 486 HG13 VAL 58 HG13 VAL 58 18.480 3.905 -7.577 487 HG21 VAL 58 HG21 VAL 58 16.329 2.205 -8.849 488 HG22 VAL 58 HG22 VAL 58 17.437 1.657 -7.570 489 HG23 VAL 58 HG23 VAL 58 15.683 1.483 -7.374 490 H LEU 59 H LEU 59 18.148 5.308 -4.730 491 HA LEU 59 HA LEU 59 15.865 7.067 -3.849 492 HB2 LEU 59 HB2 LEU 59 18.537 6.851 -2.462 493 HB3 LEU 59 HB3 LEU 59 17.145 7.771 -2.008 494 HG LEU 59 HG LEU 59 15.978 5.331 -2.069 495 HD11 LEU 59 HD11 LEU 59 18.203 4.233 -2.549 496 HD12 LEU 59 HD12 LEU 59 18.800 4.846 -1.001 497 HD13 LEU 59 HD13 LEU 59 17.447 3.681 -1.053 498 HD21 LEU 59 HD21 LEU 59 16.162 5.270 0.366 499 HD22 LEU 59 HD22 LEU 59 17.474 6.475 0.309 500 HD23 LEU 59 HD23 LEU 59 15.829 6.916 -0.205 501 H SER 60 H SER 60 17.807 6.917 -6.306 502 HA SER 60 HA SER 60 19.375 9.164 -6.552 503 HB2 SER 60 HB2 SER 60 18.839 7.206 -8.181 504 HB3 SER 60 HB3 SER 60 17.521 8.241 -8.773 505 HG SER 60 HG SER 60 19.308 8.592 -10.004 506 H ASP 61 H ASP 61 15.815 8.944 -6.974 507 HA ASP 61 HA ASP 61 15.466 11.612 -7.963 508 HB2 ASP 61 HB2 ASP 61 13.469 9.802 -6.508 509 HB3 ASP 61 HB3 ASP 61 13.059 11.299 -7.345 510 H VAL 62 H VAL 62 15.656 10.224 -4.711 511 HA VAL 62 HA VAL 62 14.195 12.490 -3.501 512 HB VAL 62 HB VAL 62 13.057 10.448 -3.185 513 HG11 VAL 62 HG11 VAL 62 14.535 8.745 -3.701 514 HG12 VAL 62 HG12 VAL 62 15.623 9.184 -2.350 515 HG13 VAL 62 HG13 VAL 62 14.046 8.468 -2.021 516 HG21 VAL 62 HG21 VAL 62 14.623 10.920 -0.631 517 HG22 VAL 62 HG22 VAL 62 13.264 11.932 -1.184 518 HG23 VAL 62 HG23 VAL 62 13.003 10.233 -0.769 519 H GLU 63 H GLU 63 15.366 13.981 -2.434 520 HA GLU 63 HA GLU 63 18.202 13.449 -2.014 521 HB2 GLU 63 HB2 GLU 63 17.442 15.614 -2.811 522 HB3 GLU 63 HB3 GLU 63 16.443 15.838 -1.368 523 HG2 GLU 63 HG2 GLU 63 18.398 15.877 0.084 524 HG3 GLU 63 HG3 GLU 63 19.474 15.457 -1.257 525 H SER 64 H SER 64 15.145 13.670 -0.018 526 HA SER 64 HA SER 64 16.726 12.557 2.139 527 HB2 SER 64 HB2 SER 64 16.063 14.206 3.732 528 HB3 SER 64 HB3 SER 64 16.810 15.024 2.379 529 HG SER 64 HG SER 64 14.054 14.913 3.039 530 H ILE 65 H ILE 65 15.435 11.952 4.077 531 HA ILE 65 HA ILE 65 12.697 11.232 3.548 532 HB ILE 65 HB ILE 65 13.976 9.251 2.796 533 HG12 ILE 65 HG12 ILE 65 12.746 8.664 5.454 534 HG13 ILE 65 HG13 ILE 65 11.843 9.049 3.977 535 HG21 ILE 65 HG21 ILE 65 15.365 8.009 4.473 536 HG22 ILE 65 HG22 ILE 65 16.054 9.445 3.742 537 HG23 ILE 65 HG23 ILE 65 15.400 9.534 5.402 538 HD11 ILE 65 HD11 ILE 65 13.502 6.602 4.581 539 HD12 ILE 65 HD12 ILE 65 11.907 6.720 3.789 540 HD13 ILE 65 HD13 ILE 65 13.362 7.123 2.894 541 H ASP 66 H ASP 66 11.645 10.859 5.578 542 HA ASP 66 HA ASP 66 12.588 12.639 7.718 543 HB2 ASP 66 HB2 ASP 66 9.978 11.160 7.159 544 HB3 ASP 66 HB3 ASP 66 10.280 11.974 8.689 545 H SER 67 H SER 67 12.522 11.997 9.988 546 HA SER 67 HA SER 67 13.644 9.482 10.658 547 HB2 SER 67 HB2 SER 67 13.616 11.806 11.878 548 HB3 SER 67 HB3 SER 67 12.146 11.193 12.650 549 HG SER 67 HG SER 67 13.478 9.343 13.277 550 H PHE 68 H PHE 68 10.345 10.144 9.905 551 HA PHE 68 HA PHE 68 9.226 7.951 11.480 552 HB2 PHE 68 HB2 PHE 68 7.853 9.842 10.618 553 HB3 PHE 68 HB3 PHE 68 8.089 9.274 8.982 554 HD1 PHE 68 HD1 PHE 68 6.810 8.299 12.368 555 HD2 PHE 68 HD2 PHE 68 6.679 7.549 8.146 556 HE1 PHE 68 HE1 PHE 68 4.744 6.914 12.674 557 HE2 PHE 68 HE2 PHE 68 4.608 6.150 8.469 558 HZ PHE 68 HZ PHE 68 3.616 5.926 10.718 559 H SER 69 H SER 69 9.683 8.458 7.928 560 HA SER 69 HA SER 69 9.118 5.837 7.335 561 HB2 SER 69 HB2 SER 69 10.581 7.331 5.264 562 HB3 SER 69 HB3 SER 69 8.999 6.581 5.268 563 HG SER 69 HG SER 69 9.220 8.988 5.125 564 H LEU 70 H LEU 70 12.282 7.398 7.819 565 HA LEU 70 HA LEU 70 14.049 5.625 6.625 566 HB2 LEU 70 HB2 LEU 70 13.967 7.192 9.259 567 HB3 LEU 70 HB3 LEU 70 15.322 6.118 9.002 568 HG LEU 70 HG LEU 70 14.596 8.174 6.936 569 HD11 LEU 70 HD11 LEU 70 16.375 9.639 7.938 570 HD12 LEU 70 HD12 LEU 70 14.937 9.494 8.949 571 HD13 LEU 70 HD13 LEU 70 16.391 8.574 9.366 572 HD21 LEU 70 HD21 LEU 70 16.895 7.938 6.213 573 HD22 LEU 70 HD22 LEU 70 17.353 7.121 7.679 574 HD23 LEU 70 HD23 LEU 70 16.285 6.294 6.505 575 H GLY 71 H GLY 71 12.197 5.239 9.641 576 HA2 GLY 71 HA2 GLY 71 13.503 2.748 10.473 577 HA3 GLY 71 HA3 GLY 71 12.006 3.433 11.144 578 H VAL 72 H VAL 72 10.755 3.563 8.406 579 HA VAL 72 HA VAL 72 9.537 0.951 8.451 580 HB VAL 72 HB VAL 72 9.158 3.119 6.362 581 HG11 VAL 72 HG11 VAL 72 7.056 2.052 5.977 582 HG12 VAL 72 HG12 VAL 72 8.244 0.746 6.029 583 HG13 VAL 72 HG13 VAL 72 7.220 1.023 7.427 584 HG21 VAL 72 HG21 VAL 72 7.768 2.742 9.052 585 HG22 VAL 72 HG22 VAL 72 8.722 4.144 8.566 586 HG23 VAL 72 HG23 VAL 72 7.181 3.797 7.756 587 H ILE 73 H ILE 73 11.991 2.644 6.477 588 HA ILE 73 HA ILE 73 12.323 0.681 4.442 589 HB ILE 73 HB ILE 73 14.133 2.801 5.594 590 HG12 ILE 73 HG12 ILE 73 14.148 3.502 3.172 591 HG13 ILE 73 HG13 ILE 73 13.025 2.193 2.830 592 HG21 ILE 73 HG21 ILE 73 15.040 0.793 3.508 593 HG22 ILE 73 HG22 ILE 73 15.899 2.268 4.030 594 HG23 ILE 73 HG23 ILE 73 15.693 0.937 5.153 595 HD11 ILE 73 HD11 ILE 73 12.497 4.543 4.634 596 HD12 ILE 73 HD12 ILE 73 11.925 4.368 2.962 597 HD13 ILE 73 HD13 ILE 73 11.305 3.287 4.216 598 H VAL 74 H VAL 74 13.874 0.835 7.703 599 HA VAL 74 HA VAL 74 15.216 -1.690 7.372 600 HB VAL 74 HB VAL 74 14.332 -0.086 9.808 601 HG11 VAL 74 HG11 VAL 74 15.733 -1.644 11.179 602 HG12 VAL 74 HG12 VAL 74 14.220 -2.341 10.585 603 HG13 VAL 74 HG13 VAL 74 15.762 -2.775 9.793 604 HG21 VAL 74 HG21 VAL 74 17.054 -0.743 8.572 605 HG22 VAL 74 HG22 VAL 74 16.174 0.804 8.512 606 HG23 VAL 74 HG23 VAL 74 16.788 0.197 10.058 607 H ASN 75 H ASN 75 11.892 -0.914 8.498 608 HA ASN 75 HA ASN 75 11.272 -3.450 9.519 609 HB2 ASN 75 HB2 ASN 75 9.862 -1.035 8.815 610 HB3 ASN 75 HB3 ASN 75 9.027 -2.292 8.033 611 HD21 ASN 75 HD21 ASN 75 10.257 -1.437 11.348 612 HD22 ASN 75 HD22 ASN 75 8.949 -2.328 12.108 613 H ILE 76 H ILE 76 10.978 -2.265 6.141 614 HA ILE 76 HA ILE 76 9.827 -4.602 4.951 615 HB ILE 76 HB ILE 76 11.694 -2.432 3.915 616 HG12 ILE 76 HG12 ILE 76 8.775 -3.112 3.283 617 HG13 ILE 76 HG13 ILE 76 9.306 -1.777 4.308 618 HG21 ILE 76 HG21 ILE 76 11.488 -3.300 1.633 619 HG22 ILE 76 HG22 ILE 76 12.225 -4.517 2.620 620 HG23 ILE 76 HG23 ILE 76 10.503 -4.669 2.207 621 HD11 ILE 76 HD11 ILE 76 10.579 -0.816 2.467 622 HD12 ILE 76 HD12 ILE 76 9.793 -1.973 1.344 623 HD13 ILE 76 HD13 ILE 76 8.810 -0.838 2.256 624 H LEU 77 H LEU 77 13.178 -3.837 6.029 625 HA LEU 77 HA LEU 77 14.325 -6.001 4.488 626 HB2 LEU 77 HB2 LEU 77 15.612 -3.955 5.062 627 HB3 LEU 77 HB3 LEU 77 15.458 -4.295 6.762 628 HG LEU 77 HG LEU 77 17.618 -4.834 5.678 629 HD11 LEU 77 HD11 LEU 77 18.090 -6.256 7.316 630 HD12 LEU 77 HD12 LEU 77 16.458 -5.923 7.862 631 HD13 LEU 77 HD13 LEU 77 16.791 -7.399 6.919 632 HD21 LEU 77 HD21 LEU 77 17.899 -6.920 4.469 633 HD22 LEU 77 HD22 LEU 77 16.176 -7.295 4.540 634 HD23 LEU 77 HD23 LEU 77 16.759 -5.894 3.605 635 H LYS 78 H LYS 78 13.469 -5.423 7.922 636 HA LYS 78 HA LYS 78 14.205 -7.947 8.942 637 HB2 LYS 78 HB2 LYS 78 11.825 -6.253 9.782 638 HB3 LYS 78 HB3 LYS 78 12.570 -7.583 10.690 639 HG2 LYS 78 HG2 LYS 78 14.720 -6.264 10.712 640 HG3 LYS 78 HG3 LYS 78 13.862 -4.919 9.961 641 HD2 LYS 78 HD2 LYS 78 12.546 -4.514 11.847 642 HD3 LYS 78 HD3 LYS 78 12.700 -6.146 12.490 643 HE2 LYS 78 HE2 LYS 78 15.153 -4.408 12.305 644 HE3 LYS 78 HE3 LYS 78 13.999 -4.133 13.608 645 HZ1 LYS 78 HZ1 LYS 78 14.311 -6.374 14.385 646 HZ2 LYS 78 HZ2 LYS 78 15.299 -6.765 13.120 647 HZ3 LYS 78 HZ3 LYS 78 15.763 -5.678 14.254 648 H SER 79 H SER 79 11.073 -6.930 7.558 649 HA SER 79 HA SER 79 9.726 -9.340 7.916 650 HB2 SER 79 HB2 SER 79 9.322 -7.246 5.738 651 HB3 SER 79 HB3 SER 79 8.134 -8.422 6.322 652 HG SER 79 HG SER 79 9.314 -6.243 7.755 653 H ILE 80 H ILE 80 11.595 -8.162 5.058 654 HA ILE 80 HA ILE 80 11.149 -10.472 3.446 655 HB ILE 80 HB ILE 80 13.084 -8.145 3.437 656 HG12 ILE 80 HG12 ILE 80 10.795 -9.096 1.630 657 HG13 ILE 80 HG13 ILE 80 10.683 -7.812 2.848 658 HG21 ILE 80 HG21 ILE 80 13.014 -10.388 1.390 659 HG22 ILE 80 HG22 ILE 80 13.881 -8.857 1.203 660 HG23 ILE 80 HG23 ILE 80 14.379 -9.937 2.471 661 HD11 ILE 80 HD11 ILE 80 12.539 -6.641 1.590 662 HD12 ILE 80 HD12 ILE 80 12.217 -7.805 0.275 663 HD13 ILE 80 HD13 ILE 80 10.903 -6.737 0.855 664 H SER 81 H SER 81 13.915 -9.616 5.564 665 HA SER 81 HA SER 81 15.406 -11.969 5.010 666 HB2 SER 81 HB2 SER 81 15.653 -9.689 6.655 667 HB3 SER 81 HB3 SER 81 15.548 -11.023 7.798 668 HG SER 81 HG SER 81 17.400 -10.849 5.634 669 H SER 82 H SER 82 12.748 -11.339 7.332 670 HA SER 82 HA SER 82 12.840 -13.899 8.613 671 HB2 SER 82 HB2 SER 82 10.463 -12.052 8.162 672 HB3 SER 82 HB3 SER 82 10.556 -13.395 9.279 673 HG SER 82 HG SER 82 12.013 -10.946 9.322 674 H SER 83 H SER 83 11.086 -12.807 5.638 675 HA SER 83 HA SER 83 9.717 -15.297 5.210 676 HB2 SER 83 HB2 SER 83 10.540 -12.946 3.472 677 HB3 SER 83 HB3 SER 83 9.851 -14.385 2.737 678 HG SER 83 HG SER 83 8.588 -13.100 4.932 679 H GLY 84 H GLY 84 12.859 -14.036 4.028 680 HA2 GLY 84 HA2 GLY 84 14.635 -15.960 3.884 681 HA3 GLY 84 HA3 GLY 84 13.438 -16.686 2.807 682 H GLY 85 H GLY 85 13.863 -13.098 2.783 683 HA2 GLY 85 HA2 GLY 85 15.074 -13.415 0.101 684 HA3 GLY 85 HA3 GLY 85 13.805 -12.269 0.554 685 H PHE 86 H PHE 86 15.543 -10.932 -0.460 686 HA PHE 86 HA PHE 86 17.278 -9.690 1.623 687 HB2 PHE 86 HB2 PHE 86 18.084 -10.917 -0.983 688 HB3 PHE 86 HB3 PHE 86 18.690 -9.314 -0.641 689 HD1 PHE 86 HD1 PHE 86 18.325 -12.721 1.010 690 HD2 PHE 86 HD2 PHE 86 20.729 -9.161 0.620 691 HE1 PHE 86 HE1 PHE 86 19.792 -13.484 2.827 692 HE2 PHE 86 HE2 PHE 86 22.097 -9.900 2.548 693 HZ PHE 86 HZ PHE 86 21.603 -12.067 3.667 694 H PHE 87 H PHE 87 17.645 -7.411 1.215 695 HA PHE 87 HA PHE 87 16.215 -6.171 -0.945 696 HB2 PHE 87 HB2 PHE 87 14.339 -6.096 0.307 697 HB3 PHE 87 HB3 PHE 87 15.161 -6.089 1.847 698 HD1 PHE 87 HD1 PHE 87 15.102 -3.790 -1.153 699 HD2 PHE 87 HD2 PHE 87 14.913 -4.186 3.088 700 HE1 PHE 87 HE1 PHE 87 15.029 -1.282 -0.878 701 HE2 PHE 87 HE2 PHE 87 14.866 -1.725 3.390 702 HZ PHE 87 HZ PHE 87 14.888 -0.263 1.364 703 H ALA 88 H ALA 88 17.165 -4.174 -1.505 704 HA ALA 88 HA ALA 88 19.227 -3.103 0.310 705 HB1 ALA 88 HB1 ALA 88 20.936 -3.240 -1.258 706 HB2 ALA 88 HB2 ALA 88 20.238 -4.872 -1.142 707 HB3 ALA 88 HB3 ALA 88 19.848 -3.830 -2.538 708 H LEU 89 H LEU 89 20.054 -1.069 -0.363 709 HA LEU 89 HA LEU 89 18.100 0.604 -1.808 710 HB2 LEU 89 HB2 LEU 89 20.326 1.159 0.210 711 HB3 LEU 89 HB3 LEU 89 19.444 2.412 -0.631 712 HG LEU 89 HG LEU 89 17.280 1.352 0.350 713 HD11 LEU 89 HD11 LEU 89 17.676 -0.609 0.932 714 HD12 LEU 89 HD12 LEU 89 19.219 -0.227 1.757 715 HD13 LEU 89 HD13 LEU 89 17.641 0.264 2.486 716 HD21 LEU 89 HD21 LEU 89 19.339 2.543 2.283 717 HD22 LEU 89 HD22 LEU 89 18.369 3.536 1.190 718 HD23 LEU 89 HD23 LEU 89 17.571 2.606 2.467 719 H VAL 90 H VAL 90 18.953 2.147 -3.380 720 HA VAL 90 HA VAL 90 21.610 1.406 -4.461 721 HB VAL 90 HB VAL 90 18.888 1.131 -5.826 722 HG11 VAL 90 HG11 VAL 90 20.074 0.377 -7.828 723 HG12 VAL 90 HG12 VAL 90 20.449 2.050 -7.453 724 HG13 VAL 90 HG13 VAL 90 21.634 0.779 -7.051 725 HG21 VAL 90 HG21 VAL 90 19.833 -1.303 -6.195 726 HG22 VAL 90 HG22 VAL 90 20.952 -0.881 -4.930 727 HG23 VAL 90 HG23 VAL 90 19.209 -0.855 -4.602 728 H SER 91 H SER 91 22.577 3.005 -5.689 729 HA SER 91 HA SER 91 23.128 5.177 -6.103 730 HB2 SER 91 HB2 SER 91 21.762 4.555 -8.106 731 HB3 SER 91 HB3 SER 91 20.311 5.087 -7.264 732 HG SER 91 HG SER 91 21.308 7.190 -7.171 733 HA PRO 92 HA PRO 92 20.426 6.144 -2.453 734 HB2 PRO 92 HB2 PRO 92 22.325 6.549 -0.466 735 HB3 PRO 92 HB3 PRO 92 21.575 4.989 -0.897 736 HG2 PRO 92 HG2 PRO 92 24.258 6.071 -1.779 737 HG3 PRO 92 HG3 PRO 92 23.807 4.402 -1.301 738 HD2 PRO 92 HD2 PRO 92 24.033 5.129 -3.909 739 HD3 PRO 92 HD3 PRO 92 22.858 3.922 -3.327 740 H ASN 93 H ASN 93 23.456 7.858 -1.990 741 HA ASN 93 HA ASN 93 23.924 9.866 -3.237 742 HB2 ASN 93 HB2 ASN 93 22.764 11.924 -2.771 743 HB3 ASN 93 HB3 ASN 93 21.682 10.757 -3.522 744 HD21 ASN 93 HD21 ASN 93 19.719 11.330 -2.634 745 HD22 ASN 93 HD22 ASN 93 19.372 11.519 -0.937 746 H GLU 94 H GLU 94 24.428 12.027 -1.524 747 HA GLU 94 HA GLU 94 26.190 10.747 0.455 748 HB2 GLU 94 HB2 GLU 94 26.897 12.613 -1.013 749 HB3 GLU 94 HB3 GLU 94 25.689 13.678 -0.285 750 HG2 GLU 94 HG2 GLU 94 26.802 13.490 1.891 751 HG3 GLU 94 HG3 GLU 94 27.889 12.259 1.221 752 H LYS 95 H LYS 95 23.114 12.307 0.320 753 HA LYS 95 HA LYS 95 23.036 13.672 2.861 754 HB2 LYS 95 HB2 LYS 95 22.006 13.990 0.358 755 HB3 LYS 95 HB3 LYS 95 20.622 13.231 1.157 756 HG2 LYS 95 HG2 LYS 95 22.066 15.598 2.412 757 HG3 LYS 95 HG3 LYS 95 21.026 15.829 1.017 758 HD2 LYS 95 HD2 LYS 95 19.740 16.184 3.014 759 HD3 LYS 95 HD3 LYS 95 19.140 14.761 2.161 760 HE2 LYS 95 HE2 LYS 95 19.931 13.302 3.865 761 HE3 LYS 95 HE3 LYS 95 21.231 14.419 4.301 762 HZ1 LYS 95 HZ1 LYS 95 19.765 15.828 5.440 763 HZ2 LYS 95 HZ2 LYS 95 18.396 15.053 4.926 764 HZ3 LYS 95 HZ3 LYS 95 19.364 14.303 5.938 765 H VAL 96 H VAL 96 21.398 10.889 1.379 766 HA VAL 96 HA VAL 96 20.163 9.896 3.850 767 HB VAL 96 HB VAL 96 20.135 9.417 0.960 768 HG11 VAL 96 HG11 VAL 96 19.710 6.788 2.243 769 HG12 VAL 96 HG12 VAL 96 19.992 7.255 0.556 770 HG13 VAL 96 HG13 VAL 96 21.342 7.221 1.689 771 HG21 VAL 96 HG21 VAL 96 18.309 8.573 3.235 772 HG22 VAL 96 HG22 VAL 96 18.153 9.990 2.075 773 HG23 VAL 96 HG23 VAL 96 17.948 8.336 1.540 774 H GLU 97 H GLU 97 23.339 9.112 2.027 775 HA GLU 97 HA GLU 97 23.818 6.989 3.815 776 HB2 GLU 97 HB2 GLU 97 25.537 8.610 1.953 777 HB3 GLU 97 HB3 GLU 97 26.262 7.425 3.052 778 HG2 GLU 97 HG2 GLU 97 23.883 6.617 1.371 779 HG3 GLU 97 HG3 GLU 97 25.478 6.737 0.621 780 H ARG 98 H ARG 98 24.239 10.498 4.217 781 HA ARG 98 HA ARG 98 25.931 10.294 6.442 782 HB2 ARG 98 HB2 ARG 98 25.817 12.511 6.667 783 HB3 ARG 98 HB3 ARG 98 25.111 12.364 5.058 784 HG2 ARG 98 HG2 ARG 98 23.600 13.802 5.899 785 HG3 ARG 98 HG3 ARG 98 22.879 12.280 6.385 786 HD2 ARG 98 HD2 ARG 98 22.838 13.139 8.515 787 HD3 ARG 98 HD3 ARG 98 24.570 12.791 8.526 788 HE ARG 98 HE ARG 98 24.277 15.274 7.289 789 HH11 ARG 98 HH11 ARG 98 24.039 13.876 10.520 790 HH12 ARG 98 HH12 ARG 98 24.101 15.399 11.347 791 HH21 ARG 98 HH21 ARG 98 24.208 17.323 8.395 792 HH22 ARG 98 HH22 ARG 98 24.372 17.316 10.128 793 H VAL 99 H VAL 99 22.381 10.018 6.214 794 HA VAL 99 HA VAL 99 22.168 10.086 9.138 795 HB VAL 99 HB VAL 99 20.572 11.166 7.476 796 HG11 VAL 99 HG11 VAL 99 20.178 9.665 5.891 797 HG12 VAL 99 HG12 VAL 99 19.556 8.405 7.018 798 HG13 VAL 99 HG13 VAL 99 18.628 9.877 6.709 799 HG21 VAL 99 HG21 VAL 99 18.631 10.885 8.908 800 HG22 VAL 99 HG22 VAL 99 19.195 9.309 9.466 801 HG23 VAL 99 HG23 VAL 99 20.064 10.790 9.945 802 H LEU 100 H LEU 100 22.229 7.812 6.419 803 HA LEU 100 HA LEU 100 21.308 5.561 7.900 804 HB2 LEU 100 HB2 LEU 100 22.904 5.995 5.397 805 HB3 LEU 100 HB3 LEU 100 22.706 4.390 6.014 806 HG LEU 100 HG LEU 100 20.078 5.413 6.178 807 HD11 LEU 100 HD11 LEU 100 19.253 5.973 4.329 808 HD12 LEU 100 HD12 LEU 100 20.114 7.213 5.233 809 HD13 LEU 100 HD13 LEU 100 20.941 6.495 3.825 810 HD21 LEU 100 HD21 LEU 100 20.874 3.088 5.285 811 HD22 LEU 100 HD22 LEU 100 19.565 3.832 4.376 812 HD23 LEU 100 HD23 LEU 100 21.203 3.880 3.735 813 H SER 101 H SER 101 24.303 7.317 8.148 814 HA SER 101 HA SER 101 25.657 5.039 9.407 815 HB2 SER 101 HB2 SER 101 26.169 7.929 8.759 816 HB3 SER 101 HB3 SER 101 27.220 7.101 9.950 817 HG SER 101 HG SER 101 26.745 5.779 7.577 818 H LEU 102 H LEU 102 24.396 8.272 10.203 819 HA LEU 102 HA LEU 102 24.520 8.347 12.920 820 HB2 LEU 102 HB2 LEU 102 22.346 9.558 11.212 821 HB3 LEU 102 HB3 LEU 102 22.746 9.942 12.860 822 HG LEU 102 HG LEU 102 23.833 11.081 10.468 823 HD11 LEU 102 HD11 LEU 102 24.408 11.401 13.394 824 HD12 LEU 102 HD12 LEU 102 24.809 12.616 12.142 825 HD13 LEU 102 HD13 LEU 102 23.099 12.211 12.482 826 HD21 LEU 102 HD21 LEU 102 25.814 9.571 10.580 827 HD22 LEU 102 HD22 LEU 102 26.243 11.185 11.090 828 HD23 LEU 102 HD23 LEU 102 25.959 9.921 12.312 829 H THR 103 H THR 103 21.415 7.542 11.236 830 HA THR 103 HA THR 103 20.247 6.684 13.726 831 HB THR 103 HB THR 103 19.052 8.056 11.994 832 HG1 THR 103 HG1 THR 103 17.869 5.561 12.639 833 HG21 THR 103 HG21 THR 103 17.799 6.656 10.211 834 HG22 THR 103 HG22 THR 103 19.412 7.101 9.792 835 HG23 THR 103 HG23 THR 103 19.106 5.462 10.329 836 H ASN 104 H ASN 104 22.472 5.091 12.295 837 HA ASN 104 HA ASN 104 22.992 3.087 11.415 838 HB2 ASN 104 HB2 ASN 104 22.182 1.086 12.745 839 HB3 ASN 104 HB3 ASN 104 23.144 2.315 13.572 840 HD21 ASN 104 HD21 ASN 104 19.732 1.273 13.091 841 HD22 ASN 104 HD22 ASN 104 19.220 1.867 14.687 842 H LEU 105 H LEU 105 22.023 3.486 9.420 843 HA LEU 105 HA LEU 105 19.834 1.573 8.664 844 HB2 LEU 105 HB2 LEU 105 19.788 4.329 8.601 845 HB3 LEU 105 HB3 LEU 105 19.874 3.682 7.072 846 HG LEU 105 HG LEU 105 17.888 2.254 8.762 847 HD11 LEU 105 HD11 LEU 105 17.842 5.169 8.130 848 HD12 LEU 105 HD12 LEU 105 16.328 4.215 8.188 849 HD13 LEU 105 HD13 LEU 105 17.353 4.308 9.592 850 HD21 LEU 105 HD21 LEU 105 17.742 3.483 5.936 851 HD22 LEU 105 HD22 LEU 105 18.220 1.807 6.311 852 HD23 LEU 105 HD23 LEU 105 16.595 2.364 6.695 853 H ASP 106 H ASP 106 22.950 2.941 7.544 854 HA ASP 106 HA ASP 106 23.016 1.034 5.368 855 HB2 ASP 106 HB2 ASP 106 25.185 1.669 4.964 856 HB3 ASP 106 HB3 ASP 106 24.416 3.140 5.457 857 H ARG 107 H ARG 107 23.674 0.894 8.788 858 HA ARG 107 HA ARG 107 25.307 -1.435 8.628 859 HB2 ARG 107 HB2 ARG 107 23.995 -0.936 11.275 860 HB3 ARG 107 HB3 ARG 107 25.688 -1.199 10.850 861 HG2 ARG 107 HG2 ARG 107 25.666 1.180 9.930 862 HG3 ARG 107 HG3 ARG 107 24.187 1.397 10.874 863 HD2 ARG 107 HD2 ARG 107 26.968 0.726 11.896 864 HD3 ARG 107 HD3 ARG 107 26.017 2.195 12.183 865 HE ARG 107 HE ARG 107 24.531 0.073 13.261 866 HH11 ARG 107 HH11 ARG 107 27.717 1.630 13.837 867 HH12 ARG 107 HH12 ARG 107 27.660 1.376 15.534 868 HH21 ARG 107 HH21 ARG 107 24.576 -0.406 15.538 869 HH22 ARG 107 HH22 ARG 107 25.909 0.136 16.485 870 H ILE 108 H ILE 108 22.057 -1.192 7.952 871 HA ILE 108 HA ILE 108 21.316 -3.733 9.226 872 HB ILE 108 HB ILE 108 19.477 -1.441 8.445 873 HG12 ILE 108 HG12 ILE 108 21.174 -0.323 9.883 874 HG13 ILE 108 HG13 ILE 108 19.546 -0.355 10.446 875 HG21 ILE 108 HG21 ILE 108 18.166 -2.308 10.381 876 HG22 ILE 108 HG22 ILE 108 18.390 -3.496 9.069 877 HG23 ILE 108 HG23 ILE 108 19.362 -3.624 10.547 878 HD11 ILE 108 HD11 ILE 108 21.260 -0.751 12.196 879 HD12 ILE 108 HD12 ILE 108 20.079 -2.060 12.123 880 HD13 ILE 108 HD13 ILE 108 21.681 -2.289 11.402 881 H VAL 109 H VAL 109 20.926 -1.496 6.368 882 HA VAL 109 HA VAL 109 19.799 -3.789 4.889 883 HB VAL 109 HB VAL 109 19.554 -0.899 4.092 884 HG11 VAL 109 HG11 VAL 109 18.898 -2.473 2.401 885 HG12 VAL 109 HG12 VAL 109 17.908 -3.402 3.561 886 HG13 VAL 109 HG13 VAL 109 17.438 -1.770 3.022 887 HG21 VAL 109 HG21 VAL 109 17.664 -2.337 6.035 888 HG22 VAL 109 HG22 VAL 109 18.543 -0.818 6.338 889 HG23 VAL 109 HG23 VAL 109 17.246 -0.866 5.148 890 H LYS 110 H LYS 110 20.557 -4.052 2.765 891 HA LYS 110 HA LYS 110 23.389 -3.430 2.445 892 HB2 LYS 110 HB2 LYS 110 21.293 -4.997 0.981 893 HB3 LYS 110 HB3 LYS 110 22.746 -4.537 0.101 894 HG2 LYS 110 HG2 LYS 110 23.144 -5.760 2.827 895 HG3 LYS 110 HG3 LYS 110 22.590 -6.819 1.527 896 HD2 LYS 110 HD2 LYS 110 25.030 -6.842 1.721 897 HD3 LYS 110 HD3 LYS 110 24.451 -6.272 0.153 898 HE2 LYS 110 HE2 LYS 110 26.340 -4.936 0.776 899 HE3 LYS 110 HE3 LYS 110 24.907 -3.933 0.801 900 HZ1 LYS 110 HZ1 LYS 110 26.523 -4.898 3.036 901 HZ2 LYS 110 HZ2 LYS 110 26.009 -3.385 2.709 902 HZ3 LYS 110 HZ3 LYS 110 24.963 -4.458 3.342 903 H ILE 111 H ILE 111 24.189 -2.440 0.425 904 HA ILE 111 HA ILE 111 22.428 -0.486 -0.730 905 HB ILE 111 HB ILE 111 23.596 0.223 1.559 906 HG12 ILE 111 HG12 ILE 111 23.994 2.503 -0.203 907 HG13 ILE 111 HG13 ILE 111 22.476 1.694 -0.566 908 HG21 ILE 111 HG21 ILE 111 25.698 1.369 1.280 909 HG22 ILE 111 HG22 ILE 111 25.851 -0.368 0.926 910 HG23 ILE 111 HG23 ILE 111 25.805 0.815 -0.402 911 HD11 ILE 111 HD11 ILE 111 21.860 1.806 1.852 912 HD12 ILE 111 HD12 ILE 111 23.384 2.659 2.182 913 HD13 ILE 111 HD13 ILE 111 22.148 3.415 1.152 914 H TYR 112 H TYR 112 23.182 0.105 -2.808 915 HA TYR 112 HA TYR 112 25.711 -1.027 -3.828 916 HB2 TYR 112 HB2 TYR 112 22.951 -1.633 -4.971 917 HB3 TYR 112 HB3 TYR 112 24.460 -2.031 -5.743 918 HD1 TYR 112 HD1 TYR 112 25.944 -3.772 -4.929 919 HD2 TYR 112 HD2 TYR 112 22.196 -2.909 -3.018 920 HE1 TYR 112 HE1 TYR 112 26.009 -5.992 -3.928 921 HE2 TYR 112 HE2 TYR 112 22.210 -5.254 -2.027 922 HH TYR 112 HH TYR 112 24.969 -7.438 -2.517 923 H ASP 113 H ASP 113 25.914 -0.402 -6.224 924 HA ASP 113 HA ASP 113 25.426 2.492 -6.377 925 HB2 ASP 113 HB2 ASP 113 27.243 0.503 -7.760 926 HB3 ASP 113 HB3 ASP 113 26.877 2.070 -8.499 927 H THR 114 H THR 114 24.732 -0.491 -8.349 928 HA THR 114 HA THR 114 22.473 1.066 -9.494 929 HB THR 114 HB THR 114 22.772 0.030 -11.634 930 HG1 THR 114 HG1 THR 114 25.266 -1.016 -11.099 931 HG21 THR 114 HG21 THR 114 25.422 1.238 -10.755 932 HG22 THR 114 HG22 THR 114 24.766 1.169 -12.410 933 HG23 THR 114 HG23 THR 114 23.976 2.171 -11.183 934 H ILE 115 H ILE 115 20.893 -0.432 -10.602 935 HA ILE 115 HA ILE 115 19.884 -2.467 -8.797 936 HB ILE 115 HB ILE 115 19.199 -1.392 -11.546 937 HG12 ILE 115 HG12 ILE 115 18.490 0.090 -9.765 938 HG13 ILE 115 HG13 ILE 115 17.092 -0.733 -10.411 939 HG21 ILE 115 HG21 ILE 115 18.094 -3.802 -10.113 940 HG22 ILE 115 HG22 ILE 115 17.137 -2.932 -11.350 941 HG23 ILE 115 HG23 ILE 115 18.669 -3.708 -11.775 942 HD11 ILE 115 HD11 ILE 115 16.912 -0.663 -7.968 943 HD12 ILE 115 HD12 ILE 115 17.223 -2.331 -8.465 944 HD13 ILE 115 HD13 ILE 115 18.503 -1.337 -7.788 945 H SER 116 H SER 116 22.054 -2.400 -11.662 946 HA SER 116 HA SER 116 21.688 -5.206 -12.060 947 HB2 SER 116 HB2 SER 116 22.881 -3.274 -13.521 948 HB3 SER 116 HB3 SER 116 24.311 -4.084 -12.839 949 HG SER 116 HG SER 116 23.767 -5.906 -13.895 950 H GLU 117 H GLU 117 24.078 -3.205 -10.154 951 HA GLU 117 HA GLU 117 25.589 -5.509 -9.376 952 HB2 GLU 117 HB2 GLU 117 25.760 -2.601 -9.182 953 HB3 GLU 117 HB3 GLU 117 26.036 -3.346 -7.588 954 HG2 GLU 117 HG2 GLU 117 27.615 -4.947 -8.638 955 HG3 GLU 117 HG3 GLU 117 27.416 -4.065 -10.178 956 H ALA 118 H ALA 118 22.444 -4.934 -8.679 957 HA ALA 118 HA ALA 118 22.749 -5.978 -5.912 958 HB1 ALA 118 HB1 ALA 118 20.749 -4.898 -5.342 959 HB2 ALA 118 HB2 ALA 118 21.751 -3.673 -6.115 960 HB3 ALA 118 HB3 ALA 118 20.400 -4.392 -7.019 961 H MET 119 H MET 119 21.314 -6.241 -9.187 962 HA MET 119 HA MET 119 19.173 -7.838 -8.455 963 HB2 MET 119 HB2 MET 119 20.136 -6.602 -10.851 964 HB3 MET 119 HB3 MET 119 20.417 -8.244 -11.215 965 HG2 MET 119 HG2 MET 119 17.745 -8.064 -10.082 966 HG3 MET 119 HG3 MET 119 17.961 -6.767 -11.242 967 HE1 MET 119 HE1 MET 119 17.424 -11.245 -12.037 968 HE2 MET 119 HE2 MET 119 18.021 -10.543 -10.515 969 HE3 MET 119 HE3 MET 119 16.376 -10.191 -11.083 970 H GLU 120 H GLU 120 22.291 -9.004 -9.889 971 HA GLU 120 HA GLU 120 21.603 -11.771 -9.056 972 HB2 GLU 120 HB2 GLU 120 23.643 -12.328 -10.218 973 HB3 GLU 120 HB3 GLU 120 22.476 -11.463 -11.240 974 HG2 GLU 120 HG2 GLU 120 23.788 -9.516 -11.351 975 HG3 GLU 120 HG3 GLU 120 24.788 -9.997 -9.964 976 H GLU 121 H GLU 121 23.095 -8.984 -7.725 977 HA GLU 121 HA GLU 121 25.224 -10.490 -6.494 978 HB2 GLU 121 HB2 GLU 121 24.907 -7.896 -7.306 979 HB3 GLU 121 HB3 GLU 121 24.569 -7.734 -5.577 980 HG2 GLU 121 HG2 GLU 121 26.889 -7.474 -5.592 981 HG3 GLU 121 HG3 GLU 121 26.721 -9.223 -5.269 982 H VAL 122 H VAL 122 22.346 -8.689 -5.391 983 HA VAL 122 HA VAL 122 22.386 -9.329 -2.652 984 HB VAL 122 HB VAL 122 20.943 -7.698 -4.205 985 HG11 VAL 122 HG11 VAL 122 19.514 -9.262 -5.371 986 HG12 VAL 122 HG12 VAL 122 19.034 -10.036 -3.809 987 HG13 VAL 122 HG13 VAL 122 18.537 -8.399 -4.191 988 HG21 VAL 122 HG21 VAL 122 20.483 -8.818 -1.501 989 HG22 VAL 122 HG22 VAL 122 21.145 -7.277 -1.992 990 HG23 VAL 122 HG23 VAL 122 19.393 -7.552 -2.148 991 H ARG 123 H ARG 123 21.444 -11.242 -5.378 992 HA ARG 123 HA ARG 123 19.916 -13.225 -3.983 993 HB2 ARG 123 HB2 ARG 123 21.404 -13.295 -6.665 994 HB3 ARG 123 HB3 ARG 123 20.517 -14.683 -6.027 995 HG2 ARG 123 HG2 ARG 123 18.502 -13.293 -5.823 996 HG3 ARG 123 HG3 ARG 123 19.309 -11.954 -6.613 997 HD2 ARG 123 HD2 ARG 123 19.152 -14.676 -7.968 998 HD3 ARG 123 HD3 ARG 123 17.713 -13.636 -7.926 999 HE ARG 123 HE ARG 123 19.650 -11.951 -8.793 1000 HH11 ARG 123 HH11 ARG 123 18.055 -14.837 -10.095 1001 HH12 ARG 123 HH12 ARG 123 18.494 -14.491 -11.726 1002 HH21 ARG 123 HH21 ARG 123 20.311 -11.556 -10.903 1003 HH22 ARG 123 HH22 ARG 123 19.929 -12.604 -12.194 1004 H ARG 124 H ARG 124 23.369 -12.667 -4.226 1005 HA ARG 124 HA ARG 124 23.715 -14.645 -2.155 1006 HB2 ARG 124 HB2 ARG 124 25.574 -15.807 -3.163 1007 HB3 ARG 124 HB3 ARG 124 24.054 -16.182 -3.938 1008 HG2 ARG 124 HG2 ARG 124 25.746 -13.996 -5.145 1009 HG3 ARG 124 HG3 ARG 124 26.322 -15.655 -5.290 1010 HD2 ARG 124 HD2 ARG 124 23.795 -16.028 -6.159 1011 HD3 ARG 124 HD3 ARG 124 23.976 -14.320 -6.585 1012 HE ARG 124 HE ARG 124 25.454 -16.656 -7.654 1013 HH11 ARG 124 HH11 ARG 124 25.143 -13.088 -7.722 1014 HH12 ARG 124 HH12 ARG 124 26.492 -12.901 -8.793 1015 HH21 ARG 124 HH21 ARG 124 27.048 -16.373 -9.280 1016 HH22 ARG 124 HH22 ARG 124 27.392 -14.796 -9.883 1017 H LYS 125 H LYS 125 23.737 -11.985 -1.754 1018 HA LYS 125 HA LYS 125 26.187 -10.742 -2.238 1019 HB2 LYS 125 HB2 LYS 125 25.535 -9.084 -0.735 1020 HB3 LYS 125 HB3 LYS 125 24.136 -9.631 -1.606 1021 HG2 LYS 125 HG2 LYS 125 23.301 -9.398 0.498 1022 HG3 LYS 125 HG3 LYS 125 23.652 -11.129 0.421 1023 HD2 LYS 125 HD2 LYS 125 25.843 -9.422 1.511 1024 HD3 LYS 125 HD3 LYS 125 24.385 -9.375 2.479 1025 HE2 LYS 125 HE2 LYS 125 24.755 -11.399 3.373 1026 HE3 LYS 125 HE3 LYS 125 24.964 -12.115 1.774 1027 HZ1 LYS 125 HZ1 LYS 125 27.250 -11.346 1.773 1028 HZ2 LYS 125 HZ2 LYS 125 27.132 -10.873 3.361 1029 HZ3 LYS 125 HZ3 LYS 125 26.946 -12.462 2.893 Start of MODEL 14 1 H1 MET 1 H1 MET 1 -28.574 1.365 -8.466 2 HA MET 1 HA MET 1 -27.344 3.495 -8.547 3 HB2 MET 1 HB2 MET 1 -27.686 5.155 -6.828 4 HB3 MET 1 HB3 MET 1 -29.196 4.886 -7.687 5 HG2 MET 1 HG2 MET 1 -28.497 3.754 -4.943 6 HG3 MET 1 HG3 MET 1 -29.494 5.170 -5.256 7 HE1 MET 1 HE1 MET 1 -31.455 4.347 -3.775 8 HE2 MET 1 HE2 MET 1 -32.167 2.723 -3.877 9 HE3 MET 1 HE3 MET 1 -30.487 2.920 -3.333 10 H GLY 2 H GLY 2 -25.518 3.977 -6.838 11 HA2 GLY 2 HA2 GLY 2 -24.017 3.019 -5.256 12 HA3 GLY 2 HA3 GLY 2 -24.888 1.474 -5.366 13 H SER 3 H SER 3 -22.599 0.738 -5.903 14 HA SER 3 HA SER 3 -20.984 0.021 -7.266 15 HB2 SER 3 HB2 SER 3 -22.948 0.481 -9.534 16 HB3 SER 3 HB3 SER 3 -21.504 -0.542 -9.556 17 HG SER 3 HG SER 3 -23.429 -1.721 -9.099 18 H ASP 4 H ASP 4 -20.244 2.164 -6.392 19 HA ASP 4 HA ASP 4 -20.053 4.569 -7.665 20 HB2 ASP 4 HB2 ASP 4 -19.225 3.495 -5.322 21 HB3 ASP 4 HB3 ASP 4 -17.670 3.571 -6.124 22 H LYS 5 H LYS 5 -17.512 2.059 -7.764 23 HA LYS 5 HA LYS 5 -15.834 1.585 -9.230 24 HB2 LYS 5 HB2 LYS 5 -18.099 2.099 -11.194 25 HB3 LYS 5 HB3 LYS 5 -16.617 1.209 -11.551 26 HG2 LYS 5 HG2 LYS 5 -17.206 -0.398 -9.658 27 HG3 LYS 5 HG3 LYS 5 -18.739 0.448 -9.507 28 HD2 LYS 5 HD2 LYS 5 -19.472 -1.179 -10.871 29 HD3 LYS 5 HD3 LYS 5 -18.904 -0.106 -12.146 30 HE2 LYS 5 HE2 LYS 5 -17.333 -2.417 -10.891 31 HE3 LYS 5 HE3 LYS 5 -18.217 -2.509 -12.421 32 HZ1 LYS 5 HZ1 LYS 5 -15.874 -2.134 -12.757 33 HZ2 LYS 5 HZ2 LYS 5 -16.732 -0.895 -13.355 34 HZ3 LYS 5 HZ3 LYS 5 -15.910 -0.734 -11.913 35 H ILE 6 H ILE 6 -15.762 4.325 -8.409 36 HA ILE 6 HA ILE 6 -14.986 5.861 -10.723 37 HB ILE 6 HB ILE 6 -16.354 6.511 -8.652 38 HG12 ILE 6 HG12 ILE 6 -15.440 8.872 -8.618 39 HG13 ILE 6 HG13 ILE 6 -14.230 8.335 -9.787 40 HG21 ILE 6 HG21 ILE 6 -15.245 7.367 -6.723 41 HG22 ILE 6 HG22 ILE 6 -14.755 5.688 -6.957 42 HG23 ILE 6 HG23 ILE 6 -13.638 7.013 -7.391 43 HD11 ILE 6 HD11 ILE 6 -17.255 8.158 -10.145 44 HD12 ILE 6 HD12 ILE 6 -16.187 9.364 -10.884 45 HD13 ILE 6 HD13 ILE 6 -16.046 7.661 -11.349 46 H HIS 7 H HIS 7 -13.255 3.478 -9.452 47 HA HIS 7 HA HIS 7 -10.689 4.906 -9.077 48 HB2 HIS 7 HB2 HIS 7 -9.927 2.873 -7.989 49 HB3 HIS 7 HB3 HIS 7 -11.341 3.563 -7.205 50 HD1 HIS 7 HD1 HIS 7 -10.179 0.421 -8.923 51 HD2 HIS 7 HD2 HIS 7 -13.762 2.221 -7.668 52 HE1 HIS 7 HE1 HIS 7 -11.912 -1.452 -8.816 53 H HIS 8 H HIS 8 -10.632 5.297 -11.349 54 HA HIS 8 HA HIS 8 -9.483 3.044 -12.901 55 HB2 HIS 8 HB2 HIS 8 -10.602 3.854 -14.945 56 HB3 HIS 8 HB3 HIS 8 -11.677 3.117 -13.766 57 HD1 HIS 8 HD1 HIS 8 -11.454 6.209 -15.828 58 HD2 HIS 8 HD2 HIS 8 -13.196 4.889 -12.237 59 HE1 HIS 8 HE1 HIS 8 -13.162 7.969 -15.185 60 H HIS 9 H HIS 9 -10.159 6.520 -13.475 61 HA HIS 9 HA HIS 9 -7.810 6.936 -14.874 62 HB2 HIS 9 HB2 HIS 9 -10.048 8.384 -14.507 63 HB3 HIS 9 HB3 HIS 9 -9.008 9.269 -13.397 64 HD1 HIS 9 HD1 HIS 9 -8.540 7.881 -17.032 65 HD2 HIS 9 HD2 HIS 9 -7.932 11.308 -14.618 66 HE1 HIS 9 HE1 HIS 9 -7.731 9.720 -18.568 67 H HIS 10 H HIS 10 -5.716 7.086 -14.323 68 HA HIS 10 HA HIS 10 -5.056 7.409 -11.434 69 HB2 HIS 10 HB2 HIS 10 -3.466 5.564 -11.782 70 HB3 HIS 10 HB3 HIS 10 -5.120 5.088 -12.054 71 HD1 HIS 10 HD1 HIS 10 -2.074 6.121 -14.339 72 HD2 HIS 10 HD2 HIS 10 -5.491 3.640 -14.168 73 HE1 HIS 10 HE1 HIS 10 -2.018 4.679 -16.401 74 H HIS 11 H HIS 11 -2.742 7.934 -11.031 75 HA HIS 11 HA HIS 11 -1.797 9.988 -12.973 76 HB2 HIS 11 HB2 HIS 11 -3.500 10.678 -11.155 77 HB3 HIS 11 HB3 HIS 11 -2.189 10.469 -10.009 78 HD1 HIS 11 HD1 HIS 11 -0.385 12.501 -9.977 79 HD2 HIS 11 HD2 HIS 11 -3.424 12.691 -12.907 80 HE1 HIS 11 HE1 HIS 11 -0.382 14.889 -10.887 81 H HIS 12 H HIS 12 -0.597 7.477 -12.614 82 HA HIS 12 HA HIS 12 1.296 6.406 -12.234 83 HB2 HIS 12 HB2 HIS 12 1.914 8.320 -13.764 84 HB3 HIS 12 HB3 HIS 12 2.688 9.075 -12.367 85 HD1 HIS 12 HD1 HIS 12 4.735 7.561 -11.249 86 HD2 HIS 12 HD2 HIS 12 3.230 6.411 -15.006 87 HE1 HIS 12 HE1 HIS 12 6.465 5.963 -12.268 88 H MET 13 H MET 13 0.070 6.430 -9.917 89 HA MET 13 HA MET 13 1.993 6.918 -7.770 90 HB2 MET 13 HB2 MET 13 -0.564 6.800 -7.539 91 HB3 MET 13 HB3 MET 13 -0.418 5.053 -7.678 92 HG2 MET 13 HG2 MET 13 0.852 4.928 -5.658 93 HG3 MET 13 HG3 MET 13 1.231 6.644 -5.687 94 HE1 MET 13 HE1 MET 13 -0.697 6.455 -2.376 95 HE2 MET 13 HE2 MET 13 0.428 5.252 -3.057 96 HE3 MET 13 HE3 MET 13 0.774 6.982 -3.229 97 H PHE 14 H PHE 14 3.471 5.807 -9.667 98 HA PHE 14 HA PHE 14 3.909 2.978 -8.851 99 HB2 PHE 14 HB2 PHE 14 3.701 4.062 -11.656 100 HB3 PHE 14 HB3 PHE 14 4.732 2.691 -11.281 101 HD1 PHE 14 HD1 PHE 14 1.202 3.884 -11.085 102 HD2 PHE 14 HD2 PHE 14 3.857 0.502 -10.856 103 HE1 PHE 14 HE1 PHE 14 -0.752 2.354 -11.065 104 HE2 PHE 14 HE2 PHE 14 1.889 -1.026 -10.813 105 HZ PHE 14 HZ PHE 14 -0.403 -0.108 -10.918 106 HA PRO 15 HA PRO 15 7.816 5.365 -8.335 107 HB2 PRO 15 HB2 PRO 15 8.110 5.272 -5.685 108 HB3 PRO 15 HB3 PRO 15 6.882 6.352 -6.411 109 HG2 PRO 15 HG2 PRO 15 6.446 3.543 -5.320 110 HG3 PRO 15 HG3 PRO 15 5.588 5.025 -4.822 111 HD2 PRO 15 HD2 PRO 15 4.636 3.333 -6.758 112 HD3 PRO 15 HD3 PRO 15 4.383 5.099 -6.835 113 H TYR 16 H TYR 16 7.408 2.781 -9.426 114 HA TYR 16 HA TYR 16 9.671 1.424 -8.428 115 HB2 TYR 16 HB2 TYR 16 8.758 -0.548 -7.472 116 HB3 TYR 16 HB3 TYR 16 7.861 0.733 -6.721 117 HD1 TYR 16 HD1 TYR 16 5.524 1.269 -7.598 118 HD2 TYR 16 HD2 TYR 16 7.729 -2.214 -8.725 119 HE1 TYR 16 HE1 TYR 16 3.363 0.098 -8.104 120 HE2 TYR 16 HE2 TYR 16 5.621 -3.338 -9.445 121 HH TYR 16 HH TYR 16 2.446 -2.263 -8.433 122 H LYS 17 H LYS 17 9.964 -0.741 -9.523 123 HA LYS 17 HA LYS 17 8.332 -1.361 -11.858 124 HB2 LYS 17 HB2 LYS 17 10.110 -1.520 -13.432 125 HB3 LYS 17 HB3 LYS 17 10.318 0.058 -12.641 126 HG2 LYS 17 HG2 LYS 17 12.062 -0.615 -11.351 127 HG3 LYS 17 HG3 LYS 17 11.988 -2.306 -11.940 128 HD2 LYS 17 HD2 LYS 17 13.615 -1.565 -13.340 129 HD3 LYS 17 HD3 LYS 17 12.254 -0.972 -14.308 130 HE2 LYS 17 HE2 LYS 17 12.465 1.247 -13.106 131 HE3 LYS 17 HE3 LYS 17 13.828 0.562 -12.198 132 HZ1 LYS 17 HZ1 LYS 17 14.738 0.162 -14.572 133 HZ2 LYS 17 HZ2 LYS 17 13.751 1.388 -15.000 134 HZ3 LYS 17 HZ3 LYS 17 14.918 1.630 -13.852 135 H ILE 18 H ILE 18 9.049 -3.621 -12.658 136 HA ILE 18 HA ILE 18 10.564 -5.105 -10.597 137 HB ILE 18 HB ILE 18 8.166 -6.244 -12.046 138 HG12 ILE 18 HG12 ILE 18 8.296 -5.114 -9.219 139 HG13 ILE 18 HG13 ILE 18 7.251 -4.603 -10.549 140 HG21 ILE 18 HG21 ILE 18 9.660 -7.291 -9.592 141 HG22 ILE 18 HG22 ILE 18 8.469 -8.146 -10.603 142 HG23 ILE 18 HG23 ILE 18 10.054 -7.785 -11.249 143 HD11 ILE 18 HD11 ILE 18 6.205 -6.930 -10.476 144 HD12 ILE 18 HD12 ILE 18 7.047 -7.155 -8.929 145 HD13 ILE 18 HD13 ILE 18 5.858 -5.858 -9.119 146 H VAL 19 H VAL 19 12.358 -5.940 -11.539 147 HA VAL 19 HA VAL 19 12.530 -6.147 -14.466 148 HB VAL 19 HB VAL 19 14.904 -6.315 -14.090 149 HG11 VAL 19 HG11 VAL 19 13.913 -4.085 -14.363 150 HG12 VAL 19 HG12 VAL 19 13.753 -3.915 -12.609 151 HG13 VAL 19 HG13 VAL 19 15.358 -4.020 -13.342 152 HG21 VAL 19 HG21 VAL 19 15.969 -5.913 -11.895 153 HG22 VAL 19 HG22 VAL 19 14.386 -6.073 -11.117 154 HG23 VAL 19 HG23 VAL 19 15.109 -7.448 -11.951 155 H ASP 20 H ASP 20 14.569 -8.288 -14.155 156 HA ASP 20 HA ASP 20 13.564 -10.496 -14.907 157 HB2 ASP 20 HB2 ASP 20 15.952 -10.112 -14.249 158 HB3 ASP 20 HB3 ASP 20 15.549 -10.516 -12.591 159 H ASP 21 H ASP 21 13.999 -10.588 -11.363 160 HA ASP 21 HA ASP 21 11.147 -10.969 -10.955 161 HB2 ASP 21 HB2 ASP 21 12.013 -12.922 -9.209 162 HB3 ASP 21 HB3 ASP 21 11.111 -13.116 -10.677 163 H VAL 22 H VAL 22 13.043 -8.804 -10.478 164 HA VAL 22 HA VAL 22 12.870 -8.719 -7.501 165 HB VAL 22 HB VAL 22 15.180 -7.523 -9.102 166 HG11 VAL 22 HG11 VAL 22 15.001 -6.225 -7.195 167 HG12 VAL 22 HG12 VAL 22 14.303 -7.529 -6.232 168 HG13 VAL 22 HG13 VAL 22 16.002 -7.569 -6.597 169 HG21 VAL 22 HG21 VAL 22 16.528 -9.317 -7.981 170 HG22 VAL 22 HG22 VAL 22 15.023 -10.055 -7.378 171 HG23 VAL 22 HG23 VAL 22 15.369 -9.997 -9.116 172 H VAL 23 H VAL 23 12.079 -6.909 -6.573 173 HA VAL 23 HA VAL 23 10.699 -4.989 -8.315 174 HB VAL 23 HB VAL 23 10.814 -5.213 -5.285 175 HG11 VAL 23 HG11 VAL 23 9.989 -2.999 -6.182 176 HG12 VAL 23 HG12 VAL 23 8.703 -3.874 -7.032 177 HG13 VAL 23 HG13 VAL 23 8.789 -3.879 -5.261 178 HG21 VAL 23 HG21 VAL 23 8.704 -6.405 -7.123 179 HG22 VAL 23 HG22 VAL 23 9.914 -7.332 -6.210 180 HG23 VAL 23 HG23 VAL 23 8.720 -6.394 -5.344 181 H ILE 24 H ILE 24 11.394 -2.901 -8.557 182 HA ILE 24 HA ILE 24 13.698 -1.897 -6.940 183 HB ILE 24 HB ILE 24 13.007 -1.529 -9.879 184 HG12 ILE 24 HG12 ILE 24 15.501 -1.986 -10.136 185 HG13 ILE 24 HG13 ILE 24 15.564 -2.373 -8.411 186 HG21 ILE 24 HG21 ILE 24 14.885 0.153 -9.930 187 HG22 ILE 24 HG22 ILE 24 13.473 0.663 -9.023 188 HG23 ILE 24 HG23 ILE 24 14.913 0.094 -8.148 189 HD11 ILE 24 HD11 ILE 24 13.796 -3.882 -10.341 190 HD12 ILE 24 HD12 ILE 24 15.526 -4.255 -10.104 191 HD13 ILE 24 HD13 ILE 24 14.406 -4.402 -8.748 192 H LEU 25 H LEU 25 12.681 -0.702 -5.470 193 HA LEU 25 HA LEU 25 10.163 0.827 -5.814 194 HB2 LEU 25 HB2 LEU 25 12.229 0.098 -3.648 195 HB3 LEU 25 HB3 LEU 25 11.322 1.550 -3.417 196 HG LEU 25 HG LEU 25 10.523 -0.392 -2.138 197 HD11 LEU 25 HD11 LEU 25 8.189 0.135 -2.551 198 HD12 LEU 25 HD12 LEU 25 9.165 1.618 -2.681 199 HD13 LEU 25 HD13 LEU 25 8.638 0.752 -4.161 200 HD21 LEU 25 HD21 LEU 25 8.954 -1.952 -3.078 201 HD22 LEU 25 HD22 LEU 25 9.256 -1.372 -4.717 202 HD23 LEU 25 HD23 LEU 25 10.533 -2.255 -3.840 203 H MET 26 H MET 26 10.776 2.649 -7.258 204 HA MET 26 HA MET 26 13.319 4.236 -6.760 205 HB2 MET 26 HB2 MET 26 11.250 4.210 -8.997 206 HB3 MET 26 HB3 MET 26 12.462 5.480 -8.825 207 HG2 MET 26 HG2 MET 26 14.219 4.115 -9.399 208 HG3 MET 26 HG3 MET 26 13.396 2.658 -8.876 209 HE1 MET 26 HE1 MET 26 11.450 1.564 -10.075 210 HE2 MET 26 HE2 MET 26 10.500 2.990 -10.581 211 HE3 MET 26 HE3 MET 26 11.023 1.814 -11.776 212 HA PRO 27 HA PRO 27 9.650 6.642 -4.829 213 HB2 PRO 27 HB2 PRO 27 10.974 7.995 -2.898 214 HB3 PRO 27 HB3 PRO 27 10.605 6.254 -2.689 215 HG2 PRO 27 HG2 PRO 27 13.185 7.497 -3.702 216 HG3 PRO 27 HG3 PRO 27 12.992 6.293 -2.398 217 HD2 PRO 27 HD2 PRO 27 13.573 5.660 -5.015 218 HD3 PRO 27 HD3 PRO 27 12.651 4.554 -3.979 219 H ASN 28 H ASN 28 9.564 9.091 -4.616 220 HA ASN 28 HA ASN 28 11.632 10.694 -5.798 221 HB2 ASN 28 HB2 ASN 28 9.907 11.808 -7.462 222 HB3 ASN 28 HB3 ASN 28 10.934 10.476 -7.936 223 HD21 ASN 28 HD21 ASN 28 7.496 11.205 -7.010 224 HD22 ASN 28 HD22 ASN 28 6.854 9.755 -7.680 225 H LYS 29 H LYS 29 8.090 10.957 -5.450 226 HA LYS 29 HA LYS 29 8.452 12.921 -3.237 227 HB2 LYS 29 HB2 LYS 29 6.790 14.388 -4.197 228 HB3 LYS 29 HB3 LYS 29 8.247 14.274 -5.146 229 HG2 LYS 29 HG2 LYS 29 6.076 12.378 -5.994 230 HG3 LYS 29 HG3 LYS 29 5.578 14.058 -6.009 231 HD2 LYS 29 HD2 LYS 29 7.861 12.853 -7.614 232 HD3 LYS 29 HD3 LYS 29 6.333 13.528 -8.188 233 HE2 LYS 29 HE2 LYS 29 7.277 15.688 -6.867 234 HE3 LYS 29 HE3 LYS 29 8.827 14.849 -7.144 235 HZ1 LYS 29 HZ1 LYS 29 6.892 15.655 -9.208 236 HZ2 LYS 29 HZ2 LYS 29 8.332 16.392 -8.856 237 HZ3 LYS 29 HZ3 LYS 29 8.336 14.870 -9.485 238 H GLU 30 H GLU 30 7.506 10.009 -3.510 239 HA GLU 30 HA GLU 30 4.684 10.274 -2.667 240 HB2 GLU 30 HB2 GLU 30 6.364 7.831 -3.305 241 HB3 GLU 30 HB3 GLU 30 4.658 7.834 -2.809 242 HG2 GLU 30 HG2 GLU 30 4.507 9.579 -4.885 243 HG3 GLU 30 HG3 GLU 30 5.972 8.734 -5.370 244 H LEU 31 H LEU 31 7.612 10.668 -1.091 245 HA LEU 31 HA LEU 31 6.875 9.065 1.279 246 HB2 LEU 31 HB2 LEU 31 9.265 10.897 0.955 247 HB3 LEU 31 HB3 LEU 31 8.999 9.654 2.167 248 HG LEU 31 HG LEU 31 9.622 9.286 -0.794 249 HD11 LEU 31 HD11 LEU 31 11.107 8.382 1.707 250 HD12 LEU 31 HD12 LEU 31 11.617 8.182 0.017 251 HD13 LEU 31 HD13 LEU 31 11.514 9.802 0.722 252 HD21 LEU 31 HD21 LEU 31 8.084 7.545 -0.494 253 HD22 LEU 31 HD22 LEU 31 9.644 6.783 -0.189 254 HD23 LEU 31 HD23 LEU 31 8.590 7.251 1.169 255 H ASN 32 H ASN 32 4.972 10.103 1.855 256 HA ASN 32 HA ASN 32 5.098 13.005 2.624 257 HB2 ASN 32 HB2 ASN 32 2.810 11.514 1.268 258 HB3 ASN 32 HB3 ASN 32 2.793 13.205 1.757 259 HD21 ASN 32 HD21 ASN 32 3.130 11.319 -0.920 260 HD22 ASN 32 HD22 ASN 32 4.192 12.368 -1.871 261 H ILE 33 H ILE 33 5.284 10.606 4.399 262 HA ILE 33 HA ILE 33 4.577 9.627 6.183 263 HB ILE 33 HB ILE 33 4.389 12.234 6.741 264 HG12 ILE 33 HG12 ILE 33 5.392 10.903 8.288 265 HG13 ILE 33 HG13 ILE 33 4.031 11.537 9.170 266 HG21 ILE 33 HG21 ILE 33 1.916 12.397 6.403 267 HG22 ILE 33 HG22 ILE 33 1.711 11.229 7.736 268 HG23 ILE 33 HG23 ILE 33 2.436 12.813 8.026 269 HD11 ILE 33 HD11 ILE 33 2.832 9.332 8.747 270 HD12 ILE 33 HD12 ILE 33 4.379 8.705 8.116 271 HD13 ILE 33 HD13 ILE 33 4.258 9.250 9.791 272 H GLU 34 H GLU 34 1.697 10.911 4.517 273 HA GLU 34 HA GLU 34 -0.158 8.970 5.492 274 HB2 GLU 34 HB2 GLU 34 -0.079 10.412 2.801 275 HB3 GLU 34 HB3 GLU 34 -1.443 9.474 3.444 276 HG2 GLU 34 HG2 GLU 34 -1.390 11.030 5.470 277 HG3 GLU 34 HG3 GLU 34 -0.266 12.050 4.579 278 H ASN 35 H ASN 35 2.541 8.615 3.475 279 HA ASN 35 HA ASN 35 1.749 5.867 2.651 280 HB2 ASN 35 HB2 ASN 35 1.908 7.126 0.614 281 HB3 ASN 35 HB3 ASN 35 3.435 7.848 1.124 282 HD21 ASN 35 HD21 ASN 35 4.784 7.003 -0.469 283 HD22 ASN 35 HD22 ASN 35 5.000 5.290 -0.806 284 H ALA 36 H ALA 36 2.455 5.830 4.996 285 HA ALA 36 HA ALA 36 5.218 4.710 4.857 286 HB1 ALA 36 HB1 ALA 36 4.818 6.928 6.356 287 HB2 ALA 36 HB2 ALA 36 4.285 5.754 7.543 288 HB3 ALA 36 HB3 ALA 36 5.924 5.622 6.848 289 H HIS 37 H HIS 37 2.313 4.706 7.144 290 HA HIS 37 HA HIS 37 2.631 1.959 7.712 291 HB2 HIS 37 HB2 HIS 37 1.067 3.819 8.751 292 HB3 HIS 37 HB3 HIS 37 -0.126 3.197 7.610 293 HD1 HIS 37 HD1 HIS 37 2.375 1.656 10.153 294 HD2 HIS 37 HD2 HIS 37 -1.638 1.445 8.878 295 HE1 HIS 37 HE1 HIS 37 1.204 -0.056 11.672 296 H LEU 38 H LEU 38 0.963 3.592 5.058 297 HA LEU 38 HA LEU 38 -0.145 1.299 3.765 298 HB2 LEU 38 HB2 LEU 38 0.874 3.858 2.462 299 HB3 LEU 38 HB3 LEU 38 -0.237 2.680 1.785 300 HG LEU 38 HG LEU 38 -0.765 4.585 4.078 301 HD11 LEU 38 HD11 LEU 38 -2.036 4.226 1.319 302 HD12 LEU 38 HD12 LEU 38 -2.458 5.479 2.517 303 HD13 LEU 38 HD13 LEU 38 -0.863 5.476 1.757 304 HD21 LEU 38 HD21 LEU 38 -3.105 3.539 4.031 305 HD22 LEU 38 HD22 LEU 38 -2.352 2.187 3.156 306 HD23 LEU 38 HD23 LEU 38 -1.827 2.591 4.785 307 H PHE 39 H PHE 39 3.143 2.585 3.829 308 HA PHE 39 HA PHE 39 4.023 1.780 1.297 309 HB2 PHE 39 HB2 PHE 39 5.084 3.301 3.128 310 HB3 PHE 39 HB3 PHE 39 5.778 1.826 3.797 311 HD1 PHE 39 HD1 PHE 39 5.378 3.594 0.537 312 HD2 PHE 39 HD2 PHE 39 7.985 1.343 3.107 313 HE1 PHE 39 HE1 PHE 39 7.250 4.226 -0.899 314 HE2 PHE 39 HE2 PHE 39 9.885 1.837 1.549 315 HZ PHE 39 HZ PHE 39 9.550 3.317 -0.414 316 H LYS 40 H LYS 40 4.480 0.198 4.454 317 HA LYS 40 HA LYS 40 5.392 -2.400 3.508 318 HB2 LYS 40 HB2 LYS 40 5.213 -1.259 5.955 319 HB3 LYS 40 HB3 LYS 40 3.654 -2.085 5.954 320 HG2 LYS 40 HG2 LYS 40 4.718 -4.202 5.444 321 HG3 LYS 40 HG3 LYS 40 6.293 -3.431 5.243 322 HD2 LYS 40 HD2 LYS 40 6.461 -4.436 7.317 323 HD3 LYS 40 HD3 LYS 40 6.136 -2.756 7.722 324 HE2 LYS 40 HE2 LYS 40 3.957 -4.868 7.598 325 HE3 LYS 40 HE3 LYS 40 4.912 -4.538 9.041 326 HZ1 LYS 40 HZ1 LYS 40 3.062 -2.676 7.730 327 HZ2 LYS 40 HZ2 LYS 40 3.025 -3.308 9.247 328 HZ3 LYS 40 HZ3 LYS 40 4.186 -2.211 8.866 329 H LYS 41 H LYS 41 1.967 -1.201 4.077 330 HA LYS 41 HA LYS 41 0.871 -3.775 3.568 331 HB2 LYS 41 HB2 LYS 41 -0.073 -1.024 4.001 332 HB3 LYS 41 HB3 LYS 41 -0.881 -1.671 2.614 333 HG2 LYS 41 HG2 LYS 41 -0.906 -3.679 4.758 334 HG3 LYS 41 HG3 LYS 41 -1.475 -2.124 5.343 335 HD2 LYS 41 HD2 LYS 41 -3.383 -3.295 4.562 336 HD3 LYS 41 HD3 LYS 41 -3.064 -2.004 3.396 337 HE2 LYS 41 HE2 LYS 41 -1.928 -3.721 1.917 338 HE3 LYS 41 HE3 LYS 41 -2.412 -4.964 3.089 339 HZ1 LYS 41 HZ1 LYS 41 -4.735 -4.181 2.712 340 HZ2 LYS 41 HZ2 LYS 41 -4.178 -3.240 1.471 341 HZ3 LYS 41 HZ3 LYS 41 -4.045 -4.867 1.385 342 H TRP 42 H TRP 42 1.642 -1.101 1.329 343 HA TRP 42 HA TRP 42 0.601 -2.449 -0.990 344 HB2 TRP 42 HB2 TRP 42 0.672 -0.165 -1.278 345 HB3 TRP 42 HB3 TRP 42 2.200 0.014 -0.435 346 HD1 TRP 42 HD1 TRP 42 1.131 -1.576 -3.862 347 HE1 TRP 42 HE1 TRP 42 2.892 -0.923 -5.571 348 HE3 TRP 42 HE3 TRP 42 4.393 0.814 -0.746 349 HZ2 TRP 42 HZ2 TRP 42 5.537 0.482 -5.553 350 HZ3 TRP 42 HZ3 TRP 42 6.528 1.742 -1.640 351 HH2 TRP 42 HH2 TRP 42 6.898 1.793 -4.090 352 H VAL 43 H VAL 43 4.097 -1.888 0.050 353 HA VAL 43 HA VAL 43 5.139 -3.536 -1.946 354 HB VAL 43 HB VAL 43 6.217 -3.212 0.892 355 HG11 VAL 43 HG11 VAL 43 8.334 -3.938 0.235 356 HG12 VAL 43 HG12 VAL 43 7.341 -5.056 -0.685 357 HG13 VAL 43 HG13 VAL 43 8.025 -3.666 -1.496 358 HG21 VAL 43 HG21 VAL 43 6.803 -1.635 -1.656 359 HG22 VAL 43 HG22 VAL 43 6.010 -1.015 -0.217 360 HG23 VAL 43 HG23 VAL 43 7.707 -1.472 -0.130 361 H PHE 44 H PHE 44 3.713 -4.526 1.214 362 HA PHE 44 HA PHE 44 4.407 -7.201 1.100 363 HB2 PHE 44 HB2 PHE 44 2.221 -5.621 2.446 364 HB3 PHE 44 HB3 PHE 44 2.248 -7.327 2.521 365 HD1 PHE 44 HD1 PHE 44 5.800 -6.277 2.657 366 HD2 PHE 44 HD2 PHE 44 2.073 -6.590 4.899 367 HE1 PHE 44 HE1 PHE 44 7.007 -6.427 4.847 368 HE2 PHE 44 HE2 PHE 44 3.359 -6.898 7.002 369 HZ PHE 44 HZ PHE 44 5.833 -6.866 6.932 370 H ASP 45 H ASP 45 1.149 -5.733 0.332 371 HA ASP 45 HA ASP 45 0.386 -8.294 -0.801 372 HB2 ASP 45 HB2 ASP 45 -1.009 -5.876 0.079 373 HB3 ASP 45 HB3 ASP 45 -1.655 -6.514 -1.430 374 H GLU 46 H GLU 46 1.993 -5.620 -2.154 375 HA GLU 46 HA GLU 46 1.161 -6.287 -4.872 376 HB2 GLU 46 HB2 GLU 46 1.607 -3.918 -3.954 377 HB3 GLU 46 HB3 GLU 46 3.319 -4.355 -4.015 378 HG2 GLU 46 HG2 GLU 46 2.952 -3.234 -6.013 379 HG3 GLU 46 HG3 GLU 46 2.865 -4.921 -6.502 380 H PHE 47 H PHE 47 4.123 -7.114 -2.591 381 HA PHE 47 HA PHE 47 5.008 -8.612 -4.965 382 HB2 PHE 47 HB2 PHE 47 6.915 -7.233 -3.125 383 HB3 PHE 47 HB3 PHE 47 7.088 -7.899 -4.751 384 HD1 PHE 47 HD1 PHE 47 5.592 -6.668 -6.627 385 HD2 PHE 47 HD2 PHE 47 6.823 -4.914 -2.910 386 HE1 PHE 47 HE1 PHE 47 5.156 -4.421 -7.531 387 HE2 PHE 47 HE2 PHE 47 6.423 -2.613 -3.852 388 HZ PHE 47 HZ PHE 47 5.588 -2.385 -6.157 389 H LEU 48 H LEU 48 5.332 -8.117 -1.411 390 HA LEU 48 HA LEU 48 6.714 -10.531 -0.943 391 HB2 LEU 48 HB2 LEU 48 4.784 -9.110 0.978 392 HB3 LEU 48 HB3 LEU 48 5.879 -10.398 1.354 393 HG LEU 48 HG LEU 48 7.542 -8.975 0.197 394 HD11 LEU 48 HD11 LEU 48 8.297 -7.110 0.351 395 HD12 LEU 48 HD12 LEU 48 7.027 -7.334 -0.786 396 HD13 LEU 48 HD13 LEU 48 6.652 -6.477 0.766 397 HD21 LEU 48 HD21 LEU 48 8.625 -8.442 2.238 398 HD22 LEU 48 HD22 LEU 48 7.046 -8.172 3.049 399 HD23 LEU 48 HD23 LEU 48 7.580 -9.789 2.620 400 H ASN 49 H ASN 49 3.380 -9.908 -0.431 401 HA ASN 49 HA ASN 49 2.617 -12.739 -0.178 402 HB2 ASN 49 HB2 ASN 49 0.871 -10.284 -0.504 403 HB3 ASN 49 HB3 ASN 49 0.301 -11.889 -0.083 404 HD21 ASN 49 HD21 ASN 49 0.356 -9.258 1.626 405 HD22 ASN 49 HD22 ASN 49 1.274 -9.720 3.052 406 H LYS 50 H LYS 50 3.380 -10.945 -2.897 407 HA LYS 50 HA LYS 50 1.625 -12.466 -4.755 408 HB2 LYS 50 HB2 LYS 50 3.532 -10.190 -4.933 409 HB3 LYS 50 HB3 LYS 50 3.791 -11.357 -6.181 410 HG2 LYS 50 HG2 LYS 50 1.074 -11.041 -6.363 411 HG3 LYS 50 HG3 LYS 50 1.490 -9.514 -5.593 412 HD2 LYS 50 HD2 LYS 50 3.397 -9.342 -7.365 413 HD3 LYS 50 HD3 LYS 50 2.490 -10.532 -8.291 414 HE2 LYS 50 HE2 LYS 50 1.187 -7.975 -7.262 415 HE3 LYS 50 HE3 LYS 50 2.274 -7.912 -8.644 416 HZ1 LYS 50 HZ1 LYS 50 -0.215 -9.491 -8.538 417 HZ2 LYS 50 HZ2 LYS 50 0.068 -8.114 -9.359 418 HZ3 LYS 50 HZ3 LYS 50 0.881 -9.467 -9.807 419 H GLY 51 H GLY 51 4.737 -12.619 -3.135 420 HA2 GLY 51 HA2 GLY 51 5.590 -14.952 -2.847 421 HA3 GLY 51 HA3 GLY 51 5.486 -15.103 -4.602 422 H TYR 52 H TYR 52 6.395 -11.903 -4.122 423 HA TYR 52 HA TYR 52 9.164 -12.442 -4.835 424 HB2 TYR 52 HB2 TYR 52 7.751 -9.853 -4.198 425 HB3 TYR 52 HB3 TYR 52 9.395 -9.969 -4.754 426 HD1 TYR 52 HD1 TYR 52 5.880 -10.595 -5.830 427 HD2 TYR 52 HD2 TYR 52 9.974 -10.194 -7.053 428 HE1 TYR 52 HE1 TYR 52 5.146 -10.472 -8.178 429 HE2 TYR 52 HE2 TYR 52 9.256 -10.060 -9.424 430 HH TYR 52 HH TYR 52 5.818 -10.485 -10.347 431 H ASN 53 H ASN 53 10.708 -10.972 -3.570 432 HA ASN 53 HA ASN 53 10.681 -10.874 -0.666 433 HB2 ASN 53 HB2 ASN 53 11.131 -13.482 -1.986 434 HB3 ASN 53 HB3 ASN 53 12.666 -12.958 -1.359 435 HD21 ASN 53 HD21 ASN 53 11.270 -15.327 -0.500 436 HD22 ASN 53 HD22 ASN 53 10.828 -15.061 1.151 437 H LYS 54 H LYS 54 11.759 -9.637 -3.499 438 HA LYS 54 HA LYS 54 14.411 -8.937 -2.442 439 HB2 LYS 54 HB2 LYS 54 13.894 -10.053 -5.213 440 HB3 LYS 54 HB3 LYS 54 15.269 -9.038 -4.798 441 HG2 LYS 54 HG2 LYS 54 16.437 -10.737 -4.045 442 HG3 LYS 54 HG3 LYS 54 15.245 -11.090 -2.806 443 HD2 LYS 54 HD2 LYS 54 15.158 -12.132 -5.668 444 HD3 LYS 54 HD3 LYS 54 15.781 -13.032 -4.287 445 HE2 LYS 54 HE2 LYS 54 13.542 -12.729 -3.165 446 HE3 LYS 54 HE3 LYS 54 12.944 -12.025 -4.684 447 HZ1 LYS 54 HZ1 LYS 54 13.954 -14.793 -4.361 448 HZ2 LYS 54 HZ2 LYS 54 12.371 -14.348 -4.492 449 HZ3 LYS 54 HZ3 LYS 54 13.370 -14.139 -5.754 450 H ILE 55 H ILE 55 14.204 -6.812 -2.186 451 HA ILE 55 HA ILE 55 12.664 -5.158 -4.113 452 HB ILE 55 HB ILE 55 12.640 -5.187 -1.069 453 HG12 ILE 55 HG12 ILE 55 10.228 -4.733 -1.331 454 HG13 ILE 55 HG13 ILE 55 10.380 -4.870 -3.083 455 HG21 ILE 55 HG21 ILE 55 13.269 -2.970 -1.334 456 HG22 ILE 55 HG22 ILE 55 12.254 -2.729 -2.749 457 HG23 ILE 55 HG23 ILE 55 11.524 -2.907 -1.137 458 HD11 ILE 55 HD11 ILE 55 10.682 -7.207 -2.944 459 HD12 ILE 55 HD12 ILE 55 11.160 -7.139 -1.230 460 HD13 ILE 55 HD13 ILE 55 9.469 -6.865 -1.725 461 H PHE 56 H PHE 56 13.930 -3.294 -4.711 462 HA PHE 56 HA PHE 56 16.265 -2.706 -2.999 463 HB2 PHE 56 HB2 PHE 56 16.215 -2.334 -6.001 464 HB3 PHE 56 HB3 PHE 56 17.551 -2.019 -4.896 465 HD1 PHE 56 HD1 PHE 56 17.598 -4.485 -3.180 466 HD2 PHE 56 HD2 PHE 56 17.127 -3.993 -7.489 467 HE1 PHE 56 HE1 PHE 56 18.431 -6.750 -3.581 468 HE2 PHE 56 HE2 PHE 56 17.935 -6.267 -7.804 469 HZ PHE 56 HZ PHE 56 18.481 -7.697 -5.892 470 H LEU 57 H LEU 57 16.344 -0.566 -2.284 471 HA LEU 57 HA LEU 57 14.118 1.220 -3.156 472 HB2 LEU 57 HB2 LEU 57 14.263 0.827 -0.750 473 HB3 LEU 57 HB3 LEU 57 15.990 1.208 -0.768 474 HG LEU 57 HG LEU 57 15.467 3.566 -1.393 475 HD11 LEU 57 HD11 LEU 57 13.236 3.134 -2.444 476 HD12 LEU 57 HD12 LEU 57 12.566 2.796 -0.838 477 HD13 LEU 57 HD13 LEU 57 13.221 4.412 -1.244 478 HD21 LEU 57 HD21 LEU 57 15.835 2.903 0.951 479 HD22 LEU 57 HD22 LEU 57 14.711 4.261 0.802 480 HD23 LEU 57 HD23 LEU 57 14.089 2.624 1.149 481 H VAL 58 H VAL 58 14.636 2.847 -4.646 482 HA VAL 58 HA VAL 58 17.481 3.518 -4.918 483 HB VAL 58 HB VAL 58 17.108 3.911 -6.983 484 HG11 VAL 58 HG11 VAL 58 15.693 2.707 -8.251 485 HG12 VAL 58 HG12 VAL 58 16.149 1.796 -6.816 486 HG13 VAL 58 HG13 VAL 58 14.547 2.518 -6.913 487 HG21 VAL 58 HG21 VAL 58 15.567 5.194 -8.179 488 HG22 VAL 58 HG22 VAL 58 14.831 5.670 -6.631 489 HG23 VAL 58 HG23 VAL 58 16.531 6.006 -6.976 490 H LEU 59 H LEU 59 18.385 5.544 -4.830 491 HA LEU 59 HA LEU 59 16.683 7.683 -3.655 492 HB2 LEU 59 HB2 LEU 59 19.358 6.660 -2.599 493 HB3 LEU 59 HB3 LEU 59 18.733 8.269 -2.258 494 HG LEU 59 HG LEU 59 16.504 6.584 -1.747 495 HD11 LEU 59 HD11 LEU 59 17.257 4.961 -0.121 496 HD12 LEU 59 HD12 LEU 59 17.974 4.597 -1.694 497 HD13 LEU 59 HD13 LEU 59 18.954 5.379 -0.432 498 HD21 LEU 59 HD21 LEU 59 18.480 7.903 0.026 499 HD22 LEU 59 HD22 LEU 59 16.961 8.581 -0.566 500 HD23 LEU 59 HD23 LEU 59 16.920 7.225 0.598 501 H SER 60 H SER 60 18.601 6.911 -6.287 502 HA SER 60 HA SER 60 19.811 9.381 -6.888 503 HB2 SER 60 HB2 SER 60 18.931 6.947 -8.307 504 HB3 SER 60 HB3 SER 60 18.717 8.370 -9.300 505 HG SER 60 HG SER 60 21.021 8.845 -8.496 506 H ASP 61 H ASP 61 16.519 8.985 -6.282 507 HA ASP 61 HA ASP 61 15.653 11.053 -8.266 508 HB2 ASP 61 HB2 ASP 61 14.311 8.646 -7.024 509 HB3 ASP 61 HB3 ASP 61 13.388 9.927 -7.840 510 H VAL 62 H VAL 62 16.379 10.764 -4.969 511 HA VAL 62 HA VAL 62 14.470 12.842 -4.153 512 HB VAL 62 HB VAL 62 13.360 10.619 -3.823 513 HG11 VAL 62 HG11 VAL 62 15.684 9.937 -2.012 514 HG12 VAL 62 HG12 VAL 62 14.137 9.060 -2.089 515 HG13 VAL 62 HG13 VAL 62 15.178 9.129 -3.513 516 HG21 VAL 62 HG21 VAL 62 14.135 11.872 -1.167 517 HG22 VAL 62 HG22 VAL 62 12.898 12.518 -2.274 518 HG23 VAL 62 HG23 VAL 62 12.677 10.928 -1.525 519 H GLU 63 H GLU 63 15.286 14.034 -2.316 520 HA GLU 63 HA GLU 63 18.189 13.848 -2.099 521 HB2 GLU 63 HB2 GLU 63 17.147 16.032 -2.215 522 HB3 GLU 63 HB3 GLU 63 16.097 15.638 -0.868 523 HG2 GLU 63 HG2 GLU 63 17.798 17.103 -0.062 524 HG3 GLU 63 HG3 GLU 63 18.056 15.546 0.679 525 H SER 64 H SER 64 15.274 13.296 0.107 526 HA SER 64 HA SER 64 16.920 11.305 1.398 527 HB2 SER 64 HB2 SER 64 17.139 12.292 3.504 528 HB3 SER 64 HB3 SER 64 17.519 13.606 2.369 529 HG SER 64 HG SER 64 16.013 13.923 4.262 530 H ILE 65 H ILE 65 15.942 10.325 3.285 531 HA ILE 65 HA ILE 65 13.026 10.024 3.127 532 HB ILE 65 HB ILE 65 14.547 8.001 2.934 533 HG12 ILE 65 HG12 ILE 65 12.892 7.901 5.452 534 HG13 ILE 65 HG13 ILE 65 12.172 8.092 3.844 535 HG21 ILE 65 HG21 ILE 65 16.342 8.723 4.528 536 HG22 ILE 65 HG22 ILE 65 15.190 8.444 5.864 537 HG23 ILE 65 HG23 ILE 65 15.705 7.106 4.827 538 HD11 ILE 65 HD11 ILE 65 13.411 6.030 3.089 539 HD12 ILE 65 HD12 ILE 65 13.887 5.770 4.793 540 HD13 ILE 65 HD13 ILE 65 12.184 5.768 4.317 541 H ASP 66 H ASP 66 11.944 10.114 5.328 542 HA ASP 66 HA ASP 66 13.340 12.086 7.057 543 HB2 ASP 66 HB2 ASP 66 11.143 12.622 5.608 544 HB3 ASP 66 HB3 ASP 66 10.379 11.971 7.051 545 H SER 67 H SER 67 12.166 12.055 9.374 546 HA SER 67 HA SER 67 13.148 9.711 10.563 547 HB2 SER 67 HB2 SER 67 11.221 11.817 11.628 548 HB3 SER 67 HB3 SER 67 11.930 10.535 12.621 549 HG SER 67 HG SER 67 13.059 12.824 11.636 550 H PHE 68 H PHE 68 9.789 10.514 9.723 551 HA PHE 68 HA PHE 68 8.362 8.369 10.831 552 HB2 PHE 68 HB2 PHE 68 6.667 9.055 9.647 553 HB3 PHE 68 HB3 PHE 68 7.614 10.517 9.706 554 HD1 PHE 68 HD1 PHE 68 6.819 7.612 7.802 555 HD2 PHE 68 HD2 PHE 68 8.213 11.601 7.605 556 HE1 PHE 68 HE1 PHE 68 6.572 7.557 5.227 557 HE2 PHE 68 HE2 PHE 68 8.036 11.610 5.109 558 HZ PHE 68 HZ PHE 68 7.232 9.568 3.927 559 H SER 69 H SER 69 9.931 8.401 7.572 560 HA SER 69 HA SER 69 9.157 5.623 7.314 561 HB2 SER 69 HB2 SER 69 10.327 6.135 5.062 562 HB3 SER 69 HB3 SER 69 8.704 6.672 5.396 563 HG SER 69 HG SER 69 10.025 8.283 4.482 564 H LEU 70 H LEU 70 12.081 7.394 8.039 565 HA LEU 70 HA LEU 70 14.000 5.407 7.473 566 HB2 LEU 70 HB2 LEU 70 14.378 7.741 8.205 567 HB3 LEU 70 HB3 LEU 70 13.777 7.356 9.818 568 HG LEU 70 HG LEU 70 15.730 5.965 10.262 569 HD11 LEU 70 HD11 LEU 70 17.598 5.848 8.615 570 HD12 LEU 70 HD12 LEU 70 16.163 5.030 8.012 571 HD13 LEU 70 HD13 LEU 70 16.582 6.644 7.397 572 HD21 LEU 70 HD21 LEU 70 16.536 8.618 8.958 573 HD22 LEU 70 HD22 LEU 70 15.767 8.482 10.548 574 HD23 LEU 70 HD23 LEU 70 17.364 7.794 10.286 575 H GLY 71 H GLY 71 11.402 5.316 9.842 576 HA2 GLY 71 HA2 GLY 71 12.450 2.819 11.095 577 HA3 GLY 71 HA3 GLY 71 11.087 3.777 11.638 578 H VAL 72 H VAL 72 10.471 3.636 8.408 579 HA VAL 72 HA VAL 72 8.803 1.193 8.628 580 HB VAL 72 HB VAL 72 8.021 3.600 7.869 581 HG11 VAL 72 HG11 VAL 72 7.832 3.987 5.499 582 HG12 VAL 72 HG12 VAL 72 9.548 3.832 5.829 583 HG13 VAL 72 HG13 VAL 72 8.690 2.484 5.110 584 HG21 VAL 72 HG21 VAL 72 6.168 2.671 6.877 585 HG22 VAL 72 HG22 VAL 72 7.048 1.299 6.181 586 HG23 VAL 72 HG23 VAL 72 6.726 1.383 7.938 587 H ILE 73 H ILE 73 11.464 2.623 6.686 588 HA ILE 73 HA ILE 73 11.744 0.542 4.822 589 HB ILE 73 HB ILE 73 13.702 2.458 6.168 590 HG12 ILE 73 HG12 ILE 73 12.219 3.753 4.996 591 HG13 ILE 73 HG13 ILE 73 13.528 3.578 3.847 592 HG21 ILE 73 HG21 ILE 73 14.313 1.013 3.600 593 HG22 ILE 73 HG22 ILE 73 15.303 2.217 4.466 594 HG23 ILE 73 HG23 ILE 73 15.046 0.624 5.183 595 HD11 ILE 73 HD11 ILE 73 12.130 1.864 2.650 596 HD12 ILE 73 HD12 ILE 73 10.796 2.228 3.790 597 HD13 ILE 73 HD13 ILE 73 11.415 3.482 2.716 598 H VAL 74 H VAL 74 13.123 0.746 8.151 599 HA VAL 74 HA VAL 74 14.520 -1.736 8.031 600 HB VAL 74 HB VAL 74 13.156 -0.219 10.335 601 HG11 VAL 74 HG11 VAL 74 14.622 -1.541 11.875 602 HG12 VAL 74 HG12 VAL 74 13.371 -2.505 11.083 603 HG13 VAL 74 HG13 VAL 74 15.052 -2.597 10.508 604 HG21 VAL 74 HG21 VAL 74 15.470 0.477 10.904 605 HG22 VAL 74 HG22 VAL 74 16.065 -0.340 9.448 606 HG23 VAL 74 HG23 VAL 74 14.957 1.051 9.318 607 H ASN 75 H ASN 75 11.006 -1.004 8.749 608 HA ASN 75 HA ASN 75 10.440 -3.609 9.754 609 HB2 ASN 75 HB2 ASN 75 9.028 -1.080 9.039 610 HB3 ASN 75 HB3 ASN 75 8.136 -2.516 8.691 611 HD21 ASN 75 HD21 ASN 75 9.232 -0.397 11.220 612 HD22 ASN 75 HD22 ASN 75 8.552 -1.329 12.546 613 H ILE 76 H ILE 76 10.646 -2.227 6.492 614 HA ILE 76 HA ILE 76 9.401 -4.445 5.130 615 HB ILE 76 HB ILE 76 11.408 -2.366 4.227 616 HG12 ILE 76 HG12 ILE 76 8.434 -2.362 4.460 617 HG13 ILE 76 HG13 ILE 76 9.606 -1.069 4.616 618 HG21 ILE 76 HG21 ILE 76 9.847 -4.125 2.333 619 HG22 ILE 76 HG22 ILE 76 11.014 -2.880 1.922 620 HG23 ILE 76 HG23 ILE 76 11.563 -4.332 2.736 621 HD11 ILE 76 HD11 ILE 76 8.549 -2.233 2.028 622 HD12 ILE 76 HD12 ILE 76 7.978 -0.786 2.836 623 HD13 ILE 76 HD13 ILE 76 9.654 -0.806 2.220 624 H LEU 77 H LEU 77 12.687 -3.839 6.465 625 HA LEU 77 HA LEU 77 13.967 -5.989 4.970 626 HB2 LEU 77 HB2 LEU 77 15.168 -3.929 5.766 627 HB3 LEU 77 HB3 LEU 77 14.865 -4.380 7.421 628 HG LEU 77 HG LEU 77 17.140 -4.805 6.459 629 HD11 LEU 77 HD11 LEU 77 17.618 -6.679 7.771 630 HD12 LEU 77 HD12 LEU 77 16.366 -5.763 8.610 631 HD13 LEU 77 HD13 LEU 77 15.947 -7.267 7.753 632 HD21 LEU 77 HD21 LEU 77 17.564 -6.936 5.310 633 HD22 LEU 77 HD22 LEU 77 15.829 -7.255 5.191 634 HD23 LEU 77 HD23 LEU 77 16.560 -5.873 4.328 635 H LYS 78 H LYS 78 12.844 -5.419 8.289 636 HA LYS 78 HA LYS 78 13.435 -7.857 9.455 637 HB2 LYS 78 HB2 LYS 78 11.016 -6.029 9.849 638 HB3 LYS 78 HB3 LYS 78 11.381 -7.421 10.886 639 HG2 LYS 78 HG2 LYS 78 13.576 -6.544 11.391 640 HG3 LYS 78 HG3 LYS 78 13.314 -5.134 10.339 641 HD2 LYS 78 HD2 LYS 78 11.666 -4.231 11.817 642 HD3 LYS 78 HD3 LYS 78 11.525 -5.741 12.737 643 HE2 LYS 78 HE2 LYS 78 14.285 -4.631 12.543 644 HE3 LYS 78 HE3 LYS 78 13.151 -3.615 13.455 645 HZ1 LYS 78 HZ1 LYS 78 13.503 -6.481 14.027 646 HZ2 LYS 78 HZ2 LYS 78 14.379 -5.302 14.770 647 HZ3 LYS 78 HZ3 LYS 78 12.745 -5.335 14.951 648 H SER 79 H SER 79 10.340 -7.125 7.724 649 HA SER 79 HA SER 79 9.603 -9.904 8.057 650 HB2 SER 79 HB2 SER 79 8.245 -7.627 6.611 651 HB3 SER 79 HB3 SER 79 7.541 -9.249 6.893 652 HG SER 79 HG SER 79 7.244 -7.479 8.623 653 H ILE 80 H ILE 80 11.173 -8.181 5.356 654 HA ILE 80 HA ILE 80 10.971 -10.370 3.492 655 HB ILE 80 HB ILE 80 12.864 -8.047 3.938 656 HG12 ILE 80 HG12 ILE 80 11.038 -8.926 1.637 657 HG13 ILE 80 HG13 ILE 80 10.627 -7.774 2.903 658 HG21 ILE 80 HG21 ILE 80 14.151 -8.599 1.957 659 HG22 ILE 80 HG22 ILE 80 14.341 -9.868 3.150 660 HG23 ILE 80 HG23 ILE 80 13.242 -10.106 1.757 661 HD11 ILE 80 HD11 ILE 80 11.194 -6.474 1.027 662 HD12 ILE 80 HD12 ILE 80 12.587 -6.356 2.125 663 HD13 ILE 80 HD13 ILE 80 12.654 -7.426 0.698 664 H SER 81 H SER 81 13.232 -9.626 6.167 665 HA SER 81 HA SER 81 14.807 -11.955 5.737 666 HB2 SER 81 HB2 SER 81 15.532 -9.774 6.623 667 HB3 SER 81 HB3 SER 81 14.622 -10.025 8.095 668 HG SER 81 HG SER 81 16.444 -12.029 7.307 669 H SER 82 H SER 82 11.796 -11.488 7.435 670 HA SER 82 HA SER 82 11.919 -14.030 8.904 671 HB2 SER 82 HB2 SER 82 9.585 -12.215 8.154 672 HB3 SER 82 HB3 SER 82 9.475 -13.638 9.188 673 HG SER 82 HG SER 82 11.440 -11.875 9.997 674 H SER 83 H SER 83 10.484 -12.750 5.849 675 HA SER 83 HA SER 83 9.162 -15.121 5.107 676 HB2 SER 83 HB2 SER 83 10.129 -12.655 3.605 677 HB3 SER 83 HB3 SER 83 9.374 -14.030 2.769 678 HG SER 83 HG SER 83 8.117 -13.102 5.111 679 H GLY 84 H GLY 84 12.380 -13.877 4.106 680 HA2 GLY 84 HA2 GLY 84 14.063 -15.836 3.990 681 HA3 GLY 84 HA3 GLY 84 12.899 -16.503 2.816 682 H GLY 85 H GLY 85 13.454 -12.986 2.879 683 HA2 GLY 85 HA2 GLY 85 14.609 -13.235 0.159 684 HA3 GLY 85 HA3 GLY 85 13.460 -12.025 0.753 685 H PHE 86 H PHE 86 15.178 -10.675 -0.257 686 HA PHE 86 HA PHE 86 17.151 -9.780 1.721 687 HB2 PHE 86 HB2 PHE 86 17.863 -11.096 -0.794 688 HB3 PHE 86 HB3 PHE 86 18.441 -9.447 -0.782 689 HD1 PHE 86 HD1 PHE 86 18.407 -12.434 1.519 690 HD2 PHE 86 HD2 PHE 86 20.460 -8.851 0.245 691 HE1 PHE 86 HE1 PHE 86 20.139 -12.822 3.229 692 HE2 PHE 86 HE2 PHE 86 22.133 -9.191 2.020 693 HZ PHE 86 HZ PHE 86 21.991 -11.180 3.528 694 H PHE 87 H PHE 87 17.836 -7.542 1.373 695 HA PHE 87 HA PHE 87 16.386 -6.048 -0.659 696 HB2 PHE 87 HB2 PHE 87 14.649 -5.969 0.855 697 HB3 PHE 87 HB3 PHE 87 15.698 -6.041 2.253 698 HD1 PHE 87 HD1 PHE 87 15.657 -3.529 -0.610 699 HD2 PHE 87 HD2 PHE 87 15.050 -4.305 3.589 700 HE1 PHE 87 HE1 PHE 87 15.470 -1.123 -0.175 701 HE2 PHE 87 HE2 PHE 87 14.962 -1.874 4.059 702 HZ PHE 87 HZ PHE 87 15.233 -0.258 2.124 703 H ALA 88 H ALA 88 17.365 -4.097 -1.119 704 HA ALA 88 HA ALA 88 19.749 -3.278 0.337 705 HB1 ALA 88 HB1 ALA 88 19.942 -3.855 -2.632 706 HB2 ALA 88 HB2 ALA 88 21.221 -3.458 -1.455 707 HB3 ALA 88 HB3 ALA 88 20.421 -5.040 -1.390 708 H LEU 89 H LEU 89 20.655 -1.185 -0.883 709 HA LEU 89 HA LEU 89 18.348 0.311 -2.006 710 HB2 LEU 89 HB2 LEU 89 20.417 1.960 -0.744 711 HB3 LEU 89 HB3 LEU 89 18.699 2.180 -0.846 712 HG LEU 89 HG LEU 89 20.292 0.643 1.199 713 HD11 LEU 89 HD11 LEU 89 18.264 2.903 1.437 714 HD12 LEU 89 HD12 LEU 89 19.252 2.214 2.760 715 HD13 LEU 89 HD13 LEU 89 20.026 3.101 1.439 716 HD21 LEU 89 HD21 LEU 89 17.992 0.262 2.341 717 HD22 LEU 89 HD22 LEU 89 17.377 0.326 0.660 718 HD23 LEU 89 HD23 LEU 89 18.608 -0.854 1.134 719 H VAL 90 H VAL 90 19.149 2.290 -3.338 720 HA VAL 90 HA VAL 90 21.325 1.346 -5.128 721 HB VAL 90 HB VAL 90 18.510 2.177 -5.865 722 HG11 VAL 90 HG11 VAL 90 20.630 1.067 -7.672 723 HG12 VAL 90 HG12 VAL 90 18.973 1.612 -8.092 724 HG13 VAL 90 HG13 VAL 90 20.151 2.764 -7.544 725 HG21 VAL 90 HG21 VAL 90 18.170 -0.248 -6.445 726 HG22 VAL 90 HG22 VAL 90 19.587 -0.593 -5.416 727 HG23 VAL 90 HG23 VAL 90 18.159 0.189 -4.758 728 H SER 91 H SER 91 22.600 2.978 -5.735 729 HA SER 91 HA SER 91 23.608 4.974 -5.803 730 HB2 SER 91 HB2 SER 91 22.086 4.982 -7.794 731 HB3 SER 91 HB3 SER 91 20.944 5.951 -6.859 732 HG SER 91 HG SER 91 22.137 7.301 -8.013 733 HA PRO 92 HA PRO 92 21.742 6.644 -1.901 734 HB2 PRO 92 HB2 PRO 92 24.137 6.180 -0.437 735 HB3 PRO 92 HB3 PRO 92 22.562 5.337 -0.273 736 HG2 PRO 92 HG2 PRO 92 25.018 4.213 -1.277 737 HG3 PRO 92 HG3 PRO 92 23.383 3.479 -1.312 738 HD2 PRO 92 HD2 PRO 92 24.843 4.855 -3.490 739 HD3 PRO 92 HD3 PRO 92 23.559 3.623 -3.544 740 H ASN 93 H ASN 93 21.862 8.759 -2.101 741 HA ASN 93 HA ASN 93 24.277 10.124 -2.949 742 HB2 ASN 93 HB2 ASN 93 23.105 12.176 -2.532 743 HB3 ASN 93 HB3 ASN 93 22.074 11.088 -3.446 744 HD21 ASN 93 HD21 ASN 93 20.528 12.910 -2.536 745 HD22 ASN 93 HD22 ASN 93 19.771 12.488 -1.020 746 H GLU 94 H GLU 94 25.155 11.784 -1.493 747 HA GLU 94 HA GLU 94 26.328 10.453 0.766 748 HB2 GLU 94 HB2 GLU 94 27.440 12.085 -0.760 749 HB3 GLU 94 HB3 GLU 94 26.400 13.361 -0.122 750 HG2 GLU 94 HG2 GLU 94 27.362 12.874 2.159 751 HG3 GLU 94 HG3 GLU 94 28.474 11.740 1.401 752 H LYS 95 H LYS 95 23.567 12.485 0.419 753 HA LYS 95 HA LYS 95 23.305 13.567 3.065 754 HB2 LYS 95 HB2 LYS 95 22.162 14.775 1.418 755 HB3 LYS 95 HB3 LYS 95 21.661 13.337 0.554 756 HG2 LYS 95 HG2 LYS 95 19.756 14.364 1.434 757 HG3 LYS 95 HG3 LYS 95 19.965 12.855 2.284 758 HD2 LYS 95 HD2 LYS 95 21.317 14.954 3.774 759 HD3 LYS 95 HD3 LYS 95 19.756 15.557 3.247 760 HE2 LYS 95 HE2 LYS 95 18.958 13.125 4.129 761 HE3 LYS 95 HE3 LYS 95 20.415 13.261 5.105 762 HZ1 LYS 95 HZ1 LYS 95 19.549 15.068 6.231 763 HZ2 LYS 95 HZ2 LYS 95 18.436 15.441 5.032 764 HZ3 LYS 95 HZ3 LYS 95 18.204 14.155 5.986 765 H VAL 96 H VAL 96 21.882 10.673 1.389 766 HA VAL 96 HA VAL 96 20.564 10.023 3.877 767 HB VAL 96 HB VAL 96 20.647 8.793 1.125 768 HG11 VAL 96 HG11 VAL 96 20.783 6.812 2.508 769 HG12 VAL 96 HG12 VAL 96 19.450 7.430 3.539 770 HG13 VAL 96 HG13 VAL 96 19.158 6.957 1.869 771 HG21 VAL 96 HG21 VAL 96 18.066 9.003 1.837 772 HG22 VAL 96 HG22 VAL 96 18.668 10.090 3.043 773 HG23 VAL 96 HG23 VAL 96 19.002 10.432 1.314 774 H GLU 97 H GLU 97 23.579 8.982 2.301 775 HA GLU 97 HA GLU 97 24.213 6.761 3.878 776 HB2 GLU 97 HB2 GLU 97 25.573 8.788 2.172 777 HB3 GLU 97 HB3 GLU 97 26.599 8.125 3.418 778 HG2 GLU 97 HG2 GLU 97 24.948 6.388 1.555 779 HG3 GLU 97 HG3 GLU 97 26.592 6.912 1.176 780 H ARG 98 H ARG 98 24.603 10.344 4.585 781 HA ARG 98 HA ARG 98 25.877 10.330 6.830 782 HB2 ARG 98 HB2 ARG 98 24.401 11.944 5.193 783 HB3 ARG 98 HB3 ARG 98 23.278 11.927 6.532 784 HG2 ARG 98 HG2 ARG 98 26.188 12.474 6.830 785 HG3 ARG 98 HG3 ARG 98 24.915 13.587 6.258 786 HD2 ARG 98 HD2 ARG 98 23.869 13.603 8.412 787 HD3 ARG 98 HD3 ARG 98 24.769 12.166 8.938 788 HE ARG 98 HE ARG 98 25.699 14.955 8.846 789 HH11 ARG 98 HH11 ARG 98 26.773 11.535 9.055 790 HH12 ARG 98 HH12 ARG 98 28.384 11.954 9.530 791 HH21 ARG 98 HH21 ARG 98 27.878 15.450 9.326 792 HH22 ARG 98 HH22 ARG 98 29.029 14.191 9.527 793 H VAL 99 H VAL 99 22.434 10.079 6.540 794 HA VAL 99 HA VAL 99 21.875 10.020 9.291 795 HB VAL 99 HB VAL 99 20.256 9.300 6.768 796 HG11 VAL 99 HG11 VAL 99 18.965 8.248 8.433 797 HG12 VAL 99 HG12 VAL 99 19.279 9.525 9.627 798 HG13 VAL 99 HG13 VAL 99 18.220 9.838 8.232 799 HG21 VAL 99 HG21 VAL 99 21.035 11.432 6.742 800 HG22 VAL 99 HG22 VAL 99 19.292 11.509 7.172 801 HG23 VAL 99 HG23 VAL 99 20.555 11.729 8.442 802 H LEU 100 H LEU 100 21.866 7.626 6.672 803 HA LEU 100 HA LEU 100 21.009 5.385 8.158 804 HB2 LEU 100 HB2 LEU 100 22.802 5.494 5.694 805 HB3 LEU 100 HB3 LEU 100 21.994 4.105 6.292 806 HG LEU 100 HG LEU 100 21.068 6.146 4.533 807 HD11 LEU 100 HD11 LEU 100 19.376 4.773 3.846 808 HD12 LEU 100 HD12 LEU 100 20.771 3.728 4.198 809 HD13 LEU 100 HD13 LEU 100 19.398 3.805 5.356 810 HD21 LEU 100 HD21 LEU 100 19.759 7.369 6.048 811 HD22 LEU 100 HD22 LEU 100 18.605 6.298 5.329 812 HD23 LEU 100 HD23 LEU 100 19.225 5.909 6.935 813 H SER 101 H SER 101 23.906 7.203 8.171 814 HA SER 101 HA SER 101 25.505 4.927 9.275 815 HB2 SER 101 HB2 SER 101 26.221 7.832 8.734 816 HB3 SER 101 HB3 SER 101 27.304 6.680 9.506 817 HG SER 101 HG SER 101 26.193 6.628 6.908 818 H LEU 102 H LEU 102 24.324 8.139 10.306 819 HA LEU 102 HA LEU 102 24.901 8.052 13.061 820 HB2 LEU 102 HB2 LEU 102 22.662 9.389 11.484 821 HB3 LEU 102 HB3 LEU 102 22.936 9.722 13.174 822 HG LEU 102 HG LEU 102 25.059 10.208 11.044 823 HD11 LEU 102 HD11 LEU 102 23.047 11.586 10.621 824 HD12 LEU 102 HD12 LEU 102 23.072 12.135 12.310 825 HD13 LEU 102 HD13 LEU 102 24.393 12.578 11.207 826 HD21 LEU 102 HD21 LEU 102 25.926 9.988 13.358 827 HD22 LEU 102 HD22 LEU 102 26.107 11.615 12.703 828 HD23 LEU 102 HD23 LEU 102 24.822 11.277 13.877 829 H THR 103 H THR 103 22.183 6.600 11.342 830 HA THR 103 HA THR 103 20.850 5.926 13.904 831 HB THR 103 HB THR 103 19.846 7.405 12.116 832 HG1 THR 103 HG1 THR 103 17.924 6.828 12.767 833 HG21 THR 103 HG21 THR 103 19.271 6.676 10.062 834 HG22 THR 103 HG22 THR 103 20.479 5.445 10.314 835 HG23 THR 103 HG23 THR 103 18.786 5.051 10.648 836 H ASN 104 H ASN 104 22.937 4.480 11.797 837 HA ASN 104 HA ASN 104 23.560 2.429 11.228 838 HB2 ASN 104 HB2 ASN 104 22.073 1.506 13.709 839 HB3 ASN 104 HB3 ASN 104 23.163 0.532 12.760 840 HD21 ASN 104 HD21 ASN 104 23.168 3.759 14.430 841 HD22 ASN 104 HD22 ASN 104 24.756 3.634 15.090 842 H LEU 105 H LEU 105 22.251 2.733 9.391 843 HA LEU 105 HA LEU 105 19.948 0.851 9.129 844 HB2 LEU 105 HB2 LEU 105 19.832 3.580 8.866 845 HB3 LEU 105 HB3 LEU 105 20.401 3.176 7.284 846 HG LEU 105 HG LEU 105 18.115 3.449 7.086 847 HD11 LEU 105 HD11 LEU 105 18.973 1.391 5.922 848 HD12 LEU 105 HD12 LEU 105 18.395 0.440 7.311 849 HD13 LEU 105 HD13 LEU 105 17.242 1.343 6.314 850 HD21 LEU 105 HD21 LEU 105 17.693 1.591 9.422 851 HD22 LEU 105 HD22 LEU 105 17.609 3.364 9.459 852 HD23 LEU 105 HD23 LEU 105 16.455 2.469 8.466 853 H ASP 106 H ASP 106 22.749 2.457 7.483 854 HA ASP 106 HA ASP 106 22.827 0.715 5.209 855 HB2 ASP 106 HB2 ASP 106 24.773 1.873 4.628 856 HB3 ASP 106 HB3 ASP 106 23.795 3.098 5.414 857 H ARG 107 H ARG 107 23.749 0.329 8.427 858 HA ARG 107 HA ARG 107 25.801 -1.726 7.958 859 HB2 ARG 107 HB2 ARG 107 24.565 -1.083 10.654 860 HB3 ARG 107 HB3 ARG 107 26.181 -1.684 10.284 861 HG2 ARG 107 HG2 ARG 107 26.607 0.617 9.174 862 HG3 ARG 107 HG3 ARG 107 25.075 1.118 9.904 863 HD2 ARG 107 HD2 ARG 107 26.370 1.809 11.598 864 HD3 ARG 107 HD3 ARG 107 26.245 0.114 12.109 865 HE ARG 107 HE ARG 107 28.460 0.788 10.289 866 HH11 ARG 107 HH11 ARG 107 27.561 0.453 13.744 867 HH12 ARG 107 HH12 ARG 107 29.225 0.276 14.220 868 HH21 ARG 107 HH21 ARG 107 30.598 0.990 11.150 869 HH22 ARG 107 HH22 ARG 107 30.887 0.395 12.768 870 H ILE 108 H ILE 108 22.464 -1.755 7.747 871 HA ILE 108 HA ILE 108 22.109 -4.435 8.950 872 HB ILE 108 HB ILE 108 19.972 -2.331 8.579 873 HG12 ILE 108 HG12 ILE 108 21.753 -1.071 9.769 874 HG13 ILE 108 HG13 ILE 108 20.262 -1.283 10.599 875 HG21 ILE 108 HG21 ILE 108 19.213 -4.512 9.299 876 HG22 ILE 108 HG22 ILE 108 20.350 -4.504 10.662 877 HG23 ILE 108 HG23 ILE 108 19.020 -3.336 10.623 878 HD11 ILE 108 HD11 ILE 108 21.225 -2.923 12.120 879 HD12 ILE 108 HD12 ILE 108 22.735 -2.959 11.181 880 HD13 ILE 108 HD13 ILE 108 22.265 -1.495 12.061 881 H VAL 109 H VAL 109 21.163 -2.102 6.392 882 HA VAL 109 HA VAL 109 20.120 -4.300 4.716 883 HB VAL 109 HB VAL 109 19.925 -1.355 4.059 884 HG11 VAL 109 HG11 VAL 109 17.826 -2.146 2.955 885 HG12 VAL 109 HG12 VAL 109 19.258 -2.968 2.355 886 HG13 VAL 109 HG13 VAL 109 18.179 -3.799 3.493 887 HG21 VAL 109 HG21 VAL 109 17.687 -1.249 5.133 888 HG22 VAL 109 HG22 VAL 109 17.952 -2.853 5.849 889 HG23 VAL 109 HG23 VAL 109 18.953 -1.480 6.337 890 H LYS 110 H LYS 110 20.934 -4.372 2.464 891 HA LYS 110 HA LYS 110 23.787 -3.707 2.182 892 HB2 LYS 110 HB2 LYS 110 21.661 -5.118 0.589 893 HB3 LYS 110 HB3 LYS 110 23.221 -4.706 -0.150 894 HG2 LYS 110 HG2 LYS 110 23.460 -5.947 2.517 895 HG3 LYS 110 HG3 LYS 110 22.632 -6.977 1.347 896 HD2 LYS 110 HD2 LYS 110 24.929 -7.577 1.259 897 HD3 LYS 110 HD3 LYS 110 24.589 -6.710 -0.192 898 HE2 LYS 110 HE2 LYS 110 26.605 -5.753 0.448 899 HE3 LYS 110 HE3 LYS 110 25.483 -4.602 1.150 900 HZ1 LYS 110 HZ1 LYS 110 27.044 -5.121 2.796 901 HZ2 LYS 110 HZ2 LYS 110 25.740 -6.025 3.253 902 HZ3 LYS 110 HZ3 LYS 110 27.018 -6.730 2.464 903 H ILE 111 H ILE 111 24.442 -2.569 0.198 904 HA ILE 111 HA ILE 111 22.619 -0.472 -0.807 905 HB ILE 111 HB ILE 111 24.600 -0.028 1.297 906 HG12 ILE 111 HG12 ILE 111 23.562 2.485 0.722 907 HG13 ILE 111 HG13 ILE 111 22.293 1.414 0.170 908 HG21 ILE 111 HG21 ILE 111 25.776 1.932 0.511 909 HG22 ILE 111 HG22 ILE 111 26.248 0.499 -0.394 910 HG23 ILE 111 HG23 ILE 111 25.152 1.679 -1.135 911 HD11 ILE 111 HD11 ILE 111 22.021 2.108 2.550 912 HD12 ILE 111 HD12 ILE 111 22.281 0.344 2.445 913 HD13 ILE 111 HD13 ILE 111 23.601 1.433 2.913 914 H TYR 112 H TYR 112 23.144 0.171 -2.903 915 HA TYR 112 HA TYR 112 25.650 -0.758 -4.153 916 HB2 TYR 112 HB2 TYR 112 22.787 -1.309 -5.016 917 HB3 TYR 112 HB3 TYR 112 24.184 -1.586 -6.055 918 HD1 TYR 112 HD1 TYR 112 25.824 -3.307 -5.529 919 HD2 TYR 112 HD2 TYR 112 22.212 -2.827 -3.233 920 HE1 TYR 112 HE1 TYR 112 26.143 -5.608 -4.598 921 HE2 TYR 112 HE2 TYR 112 22.501 -5.184 -2.365 922 HH TYR 112 HH TYR 112 25.535 -6.920 -2.870 923 H ASP 113 H ASP 113 25.834 0.227 -6.395 924 HA ASP 113 HA ASP 113 24.743 2.991 -6.285 925 HB2 ASP 113 HB2 ASP 113 27.192 1.746 -7.440 926 HB3 ASP 113 HB3 ASP 113 26.455 3.021 -8.389 927 H THR 114 H THR 114 25.102 0.283 -8.718 928 HA THR 114 HA THR 114 22.806 1.532 -10.152 929 HB THR 114 HB THR 114 23.507 0.344 -12.112 930 HG1 THR 114 HG1 THR 114 25.754 -0.539 -10.635 931 HG21 THR 114 HG21 THR 114 25.497 1.563 -12.667 932 HG22 THR 114 HG22 THR 114 24.502 2.578 -11.594 933 HG23 THR 114 HG23 THR 114 25.928 1.755 -10.953 934 H ILE 115 H ILE 115 21.293 0.025 -11.116 935 HA ILE 115 HA ILE 115 20.278 -1.900 -9.192 936 HB ILE 115 HB ILE 115 19.588 -1.193 -12.059 937 HG12 ILE 115 HG12 ILE 115 18.705 0.475 -10.646 938 HG13 ILE 115 HG13 ILE 115 17.358 -0.610 -11.040 939 HG21 ILE 115 HG21 ILE 115 17.750 -2.686 -12.144 940 HG22 ILE 115 HG22 ILE 115 19.139 -3.659 -11.647 941 HG23 ILE 115 HG23 ILE 115 17.938 -3.135 -10.444 942 HD11 ILE 115 HD11 ILE 115 18.889 -0.568 -8.444 943 HD12 ILE 115 HD12 ILE 115 17.233 0.002 -8.709 944 HD13 ILE 115 HD13 ILE 115 17.633 -1.728 -8.819 945 H SER 116 H SER 116 22.460 -2.035 -11.971 946 HA SER 116 HA SER 116 22.156 -4.790 -12.390 947 HB2 SER 116 HB2 SER 116 23.030 -3.340 -14.061 948 HB3 SER 116 HB3 SER 116 24.409 -2.864 -13.036 949 HG SER 116 HG SER 116 25.295 -4.870 -13.293 950 H GLU 117 H GLU 117 24.280 -2.889 -10.203 951 HA GLU 117 HA GLU 117 25.957 -5.124 -9.569 952 HB2 GLU 117 HB2 GLU 117 25.320 -2.425 -8.365 953 HB3 GLU 117 HB3 GLU 117 26.537 -3.509 -7.650 954 HG2 GLU 117 HG2 GLU 117 27.954 -3.365 -9.535 955 HG3 GLU 117 HG3 GLU 117 26.689 -2.605 -10.526 956 H ALA 118 H ALA 118 22.713 -4.276 -8.730 957 HA ALA 118 HA ALA 118 22.985 -5.398 -5.980 958 HB1 ALA 118 HB1 ALA 118 20.563 -4.918 -5.850 959 HB2 ALA 118 HB2 ALA 118 21.633 -3.530 -5.986 960 HB3 ALA 118 HB3 ALA 118 20.706 -4.044 -7.420 961 H MET 119 H MET 119 21.375 -5.673 -9.133 962 HA MET 119 HA MET 119 19.760 -7.660 -8.637 963 HB2 MET 119 HB2 MET 119 20.539 -6.235 -10.958 964 HB3 MET 119 HB3 MET 119 21.118 -7.766 -11.372 965 HG2 MET 119 HG2 MET 119 18.328 -7.831 -10.257 966 HG3 MET 119 HG3 MET 119 18.508 -6.796 -11.648 967 HE1 MET 119 HE1 MET 119 18.496 -10.292 -10.204 968 HE2 MET 119 HE2 MET 119 18.656 -11.352 -11.614 969 HE3 MET 119 HE3 MET 119 20.090 -10.529 -10.972 970 H GLU 120 H GLU 120 22.978 -8.273 -10.086 971 HA GLU 120 HA GLU 120 22.588 -11.176 -9.866 972 HB2 GLU 120 HB2 GLU 120 24.861 -11.340 -10.785 973 HB3 GLU 120 HB3 GLU 120 23.928 -10.190 -11.748 974 HG2 GLU 120 HG2 GLU 120 25.050 -8.297 -10.730 975 HG3 GLU 120 HG3 GLU 120 25.774 -9.296 -9.489 976 H GLU 121 H GLU 121 23.655 -8.769 -7.677 977 HA GLU 121 HA GLU 121 25.538 -10.587 -6.375 978 HB2 GLU 121 HB2 GLU 121 25.922 -8.098 -6.641 979 HB3 GLU 121 HB3 GLU 121 24.695 -7.804 -5.435 980 HG2 GLU 121 HG2 GLU 121 25.838 -8.899 -3.723 981 HG3 GLU 121 HG3 GLU 121 26.865 -9.841 -4.807 982 H VAL 122 H VAL 122 22.517 -8.784 -5.461 983 HA VAL 122 HA VAL 122 22.054 -9.725 -2.941 984 HB VAL 122 HB VAL 122 20.111 -9.356 -5.267 985 HG11 VAL 122 HG11 VAL 122 18.523 -8.825 -3.601 986 HG12 VAL 122 HG12 VAL 122 19.272 -10.316 -3.068 987 HG13 VAL 122 HG13 VAL 122 19.810 -8.782 -2.341 988 HG21 VAL 122 HG21 VAL 122 20.563 -7.326 -5.397 989 HG22 VAL 122 HG22 VAL 122 20.518 -6.999 -3.624 990 HG23 VAL 122 HG23 VAL 122 21.998 -7.477 -4.417 991 H ARG 123 H ARG 123 21.464 -11.342 -6.015 992 HA ARG 123 HA ARG 123 20.185 -13.722 -5.259 993 HB2 ARG 123 HB2 ARG 123 22.456 -13.198 -7.154 994 HB3 ARG 123 HB3 ARG 123 21.430 -14.645 -7.233 995 HG2 ARG 123 HG2 ARG 123 19.912 -12.103 -7.423 996 HG3 ARG 123 HG3 ARG 123 21.194 -12.247 -8.622 997 HD2 ARG 123 HD2 ARG 123 19.177 -12.956 -9.585 998 HD3 ARG 123 HD3 ARG 123 20.261 -14.344 -9.410 999 HE ARG 123 HE ARG 123 18.889 -14.424 -7.120 1000 HH11 ARG 123 HH11 ARG 123 17.649 -13.952 -10.462 1001 HH12 ARG 123 HH12 ARG 123 16.018 -14.342 -10.061 1002 HH21 ARG 123 HH21 ARG 123 16.974 -15.958 -6.989 1003 HH22 ARG 123 HH22 ARG 123 15.721 -15.792 -8.163 1004 H ARG 124 H ARG 124 23.690 -12.920 -4.956 1005 HA ARG 124 HA ARG 124 24.241 -15.347 -3.392 1006 HB2 ARG 124 HB2 ARG 124 26.099 -14.180 -5.484 1007 HB3 ARG 124 HB3 ARG 124 26.251 -15.727 -4.676 1008 HG2 ARG 124 HG2 ARG 124 25.279 -16.787 -6.327 1009 HG3 ARG 124 HG3 ARG 124 23.836 -15.777 -6.301 1010 HD2 ARG 124 HD2 ARG 124 24.805 -14.151 -7.739 1011 HD3 ARG 124 HD3 ARG 124 26.438 -14.822 -7.547 1012 HE ARG 124 HE ARG 124 24.822 -16.865 -8.606 1013 HH11 ARG 124 HH11 ARG 124 26.432 -13.874 -9.621 1014 HH12 ARG 124 HH12 ARG 124 26.479 -14.269 -11.283 1015 HH21 ARG 124 HH21 ARG 124 24.731 -17.382 -10.862 1016 HH22 ARG 124 HH22 ARG 124 25.758 -16.503 -11.937 1017 H LYS 125 H LYS 125 23.827 -12.639 -2.615 1018 HA LYS 125 HA LYS 125 25.518 -10.817 -2.511 1019 HB2 LYS 125 HB2 LYS 125 24.627 -9.882 -0.502 1020 HB3 LYS 125 HB3 LYS 125 23.389 -10.831 -1.275 1021 HG2 LYS 125 HG2 LYS 125 23.080 -11.585 0.865 1022 HG3 LYS 125 HG3 LYS 125 24.162 -12.805 0.251 1023 HD2 LYS 125 HD2 LYS 125 24.978 -12.309 2.408 1024 HD3 LYS 125 HD3 LYS 125 26.083 -11.446 1.350 1025 HE2 LYS 125 HE2 LYS 125 24.498 -9.421 1.702 1026 HE3 LYS 125 HE3 LYS 125 23.915 -10.335 3.104 1027 HZ1 LYS 125 HZ1 LYS 125 26.297 -10.465 3.806 1028 HZ2 LYS 125 HZ2 LYS 125 26.680 -9.410 2.612 1029 HZ3 LYS 125 HZ3 LYS 125 25.671 -8.941 3.803 Start of MODEL 15 1 H1 MET 1 H1 MET 1 -3.606 -19.726 1.331 2 HA MET 1 HA MET 1 -5.493 -19.331 2.910 3 HB2 MET 1 HB2 MET 1 -3.175 -18.363 4.580 4 HB3 MET 1 HB3 MET 1 -4.781 -17.654 4.777 5 HG2 MET 1 HG2 MET 1 -5.772 -19.639 5.444 6 HG3 MET 1 HG3 MET 1 -4.525 -20.661 4.722 7 HE1 MET 1 HE1 MET 1 -5.229 -21.942 7.059 8 HE2 MET 1 HE2 MET 1 -4.681 -21.381 8.659 9 HE3 MET 1 HE3 MET 1 -6.019 -20.559 7.841 10 H GLY 2 H GLY 2 -6.747 -17.636 2.368 11 HA2 GLY 2 HA2 GLY 2 -5.614 -15.674 0.456 12 HA3 GLY 2 HA3 GLY 2 -7.321 -16.016 0.788 13 H SER 3 H SER 3 -6.809 -13.466 0.715 14 HA SER 3 HA SER 3 -7.907 -12.760 3.203 15 HB2 SER 3 HB2 SER 3 -5.527 -12.417 3.888 16 HB3 SER 3 HB3 SER 3 -5.336 -11.268 2.555 17 HG SER 3 HG SER 3 -6.736 -11.080 4.972 18 H ASP 4 H ASP 4 -9.603 -12.006 2.222 19 HA ASP 4 HA ASP 4 -11.074 -11.214 0.778 20 HB2 ASP 4 HB2 ASP 4 -9.985 -9.137 1.836 21 HB3 ASP 4 HB3 ASP 4 -9.255 -8.867 0.254 22 H LYS 5 H LYS 5 -11.366 -10.135 -1.581 23 HA LYS 5 HA LYS 5 -9.280 -10.597 -3.484 24 HB2 LYS 5 HB2 LYS 5 -11.608 -12.544 -3.495 25 HB3 LYS 5 HB3 LYS 5 -11.077 -11.868 -5.039 26 HG2 LYS 5 HG2 LYS 5 -8.711 -12.491 -4.409 27 HG3 LYS 5 HG3 LYS 5 -9.397 -13.481 -3.110 28 HD2 LYS 5 HD2 LYS 5 -10.479 -14.945 -4.650 29 HD3 LYS 5 HD3 LYS 5 -10.148 -13.849 -6.031 30 HE2 LYS 5 HE2 LYS 5 -7.740 -14.075 -5.696 31 HE3 LYS 5 HE3 LYS 5 -7.987 -15.077 -4.262 32 HZ1 LYS 5 HZ1 LYS 5 -8.860 -15.899 -6.967 33 HZ2 LYS 5 HZ2 LYS 5 -7.404 -16.251 -6.309 34 HZ3 LYS 5 HZ3 LYS 5 -8.752 -16.831 -5.582 35 H ILE 6 H ILE 6 -9.429 -8.426 -3.953 36 HA ILE 6 HA ILE 6 -11.972 -7.527 -5.206 37 HB ILE 6 HB ILE 6 -10.187 -5.948 -3.329 38 HG12 ILE 6 HG12 ILE 6 -11.741 -7.465 -2.163 39 HG13 ILE 6 HG13 ILE 6 -12.067 -5.777 -1.848 40 HG21 ILE 6 HG21 ILE 6 -10.852 -4.434 -5.021 41 HG22 ILE 6 HG22 ILE 6 -12.521 -5.049 -5.044 42 HG23 ILE 6 HG23 ILE 6 -11.902 -4.127 -3.644 43 HD11 ILE 6 HD11 ILE 6 -14.040 -5.807 -3.264 44 HD12 ILE 6 HD12 ILE 6 -13.667 -7.449 -3.845 45 HD13 ILE 6 HD13 ILE 6 -14.096 -7.187 -2.156 46 H HIS 7 H HIS 7 -11.733 -6.736 -7.181 47 HA HIS 7 HA HIS 7 -9.144 -6.744 -8.443 48 HB2 HIS 7 HB2 HIS 7 -10.237 -6.280 -10.445 49 HB3 HIS 7 HB3 HIS 7 -11.285 -7.381 -9.553 50 HD1 HIS 7 HD1 HIS 7 -11.225 -4.086 -11.248 51 HD2 HIS 7 HD2 HIS 7 -13.533 -6.081 -8.332 52 HE1 HIS 7 HE1 HIS 7 -13.348 -2.652 -10.859 53 H HIS 8 H HIS 8 -11.392 -4.212 -7.454 54 HA HIS 8 HA HIS 8 -11.413 -1.962 -7.592 55 HB2 HIS 8 HB2 HIS 8 -9.367 -2.809 -5.667 56 HB3 HIS 8 HB3 HIS 8 -9.075 -1.199 -6.255 57 HD1 HIS 8 HD1 HIS 8 -12.771 -2.393 -5.623 58 HD2 HIS 8 HD2 HIS 8 -9.700 0.090 -4.131 59 HE1 HIS 8 HE1 HIS 8 -13.827 -0.906 -3.906 60 H HIS 9 H HIS 9 -11.361 -1.817 -9.825 61 HA HIS 9 HA HIS 9 -8.965 -1.485 -11.312 62 HB2 HIS 9 HB2 HIS 9 -10.213 -0.959 -13.157 63 HB3 HIS 9 HB3 HIS 9 -11.244 -2.038 -12.261 64 HD1 HIS 9 HD1 HIS 9 -13.655 -1.351 -12.835 65 HD2 HIS 9 HD2 HIS 9 -10.985 1.891 -12.528 66 HE1 HIS 9 HE1 HIS 9 -15.023 0.740 -13.179 67 H HIS 10 H HIS 10 -7.517 0.094 -11.148 68 HA HIS 10 HA HIS 10 -8.351 2.697 -11.582 69 HB2 HIS 10 HB2 HIS 10 -7.196 3.881 -9.797 70 HB3 HIS 10 HB3 HIS 10 -8.544 2.956 -9.180 71 HD1 HIS 10 HD1 HIS 10 -7.304 0.186 -8.345 72 HD2 HIS 10 HD2 HIS 10 -5.479 3.984 -7.958 73 HE1 HIS 10 HE1 HIS 10 -5.664 0.022 -6.415 74 H HIS 11 H HIS 11 -6.366 4.015 -12.116 75 HA HIS 11 HA HIS 11 -3.999 2.364 -12.867 76 HB2 HIS 11 HB2 HIS 11 -5.830 3.943 -14.650 77 HB3 HIS 11 HB3 HIS 11 -4.104 4.174 -14.879 78 HD1 HIS 11 HD1 HIS 11 -3.210 2.733 -16.719 79 HD2 HIS 11 HD2 HIS 11 -6.208 0.868 -14.430 80 HE1 HIS 11 HE1 HIS 11 -3.480 0.400 -17.666 81 H HIS 12 H HIS 12 -2.922 3.163 -11.104 82 HA HIS 12 HA HIS 12 -3.080 6.034 -10.459 83 HB2 HIS 12 HB2 HIS 12 -3.243 3.935 -8.843 84 HB3 HIS 12 HB3 HIS 12 -1.494 3.959 -8.924 85 HD1 HIS 12 HD1 HIS 12 -0.465 5.508 -7.016 86 HD2 HIS 12 HD2 HIS 12 -4.401 6.454 -8.196 87 HE1 HIS 12 HE1 HIS 12 -1.179 7.508 -5.611 88 H MET 13 H MET 13 -0.561 6.409 -9.372 89 HA MET 13 HA MET 13 1.376 6.065 -11.587 90 HB2 MET 13 HB2 MET 13 2.997 7.165 -10.124 91 HB3 MET 13 HB3 MET 13 1.593 8.174 -10.453 92 HG2 MET 13 HG2 MET 13 1.127 6.631 -8.029 93 HG3 MET 13 HG3 MET 13 2.689 7.415 -7.930 94 HE1 MET 13 HE1 MET 13 2.791 9.992 -9.117 95 HE2 MET 13 HE2 MET 13 2.017 11.150 -8.023 96 HE3 MET 13 HE3 MET 13 3.057 9.878 -7.363 97 H PHE 14 H PHE 14 3.255 4.868 -11.242 98 HA PHE 14 HA PHE 14 3.212 2.816 -9.096 99 HB2 PHE 14 HB2 PHE 14 4.585 1.466 -10.828 100 HB3 PHE 14 HB3 PHE 14 2.833 1.455 -10.847 101 HD1 PHE 14 HD1 PHE 14 1.535 2.512 -12.631 102 HD2 PHE 14 HD2 PHE 14 5.841 2.551 -12.653 103 HE1 PHE 14 HE1 PHE 14 1.509 3.156 -15.013 104 HE2 PHE 14 HE2 PHE 14 5.820 3.199 -15.051 105 HZ PHE 14 HZ PHE 14 3.678 3.486 -16.240 106 HA PRO 15 HA PRO 15 7.001 5.394 -8.643 107 HB2 PRO 15 HB2 PRO 15 7.041 5.531 -5.925 108 HB3 PRO 15 HB3 PRO 15 5.919 6.494 -6.914 109 HG2 PRO 15 HG2 PRO 15 5.365 3.875 -5.505 110 HG3 PRO 15 HG3 PRO 15 4.400 5.382 -5.459 111 HD2 PRO 15 HD2 PRO 15 3.838 3.290 -7.131 112 HD3 PRO 15 HD3 PRO 15 3.496 4.990 -7.566 113 H TYR 16 H TYR 16 7.231 2.884 -9.610 114 HA TYR 16 HA TYR 16 9.491 1.802 -8.290 115 HB2 TYR 16 HB2 TYR 16 8.710 -0.248 -7.421 116 HB3 TYR 16 HB3 TYR 16 7.598 0.914 -6.775 117 HD1 TYR 16 HD1 TYR 16 5.268 1.186 -8.066 118 HD2 TYR 16 HD2 TYR 16 7.976 -2.122 -8.529 119 HE1 TYR 16 HE1 TYR 16 3.419 -0.222 -8.917 120 HE2 TYR 16 HE2 TYR 16 6.203 -3.470 -9.469 121 HH TYR 16 HH TYR 16 2.903 -2.843 -9.134 122 H LYS 17 H LYS 17 10.095 -0.390 -9.315 123 HA LYS 17 HA LYS 17 8.753 -1.116 -11.805 124 HB2 LYS 17 HB2 LYS 17 10.943 0.294 -12.300 125 HB3 LYS 17 HB3 LYS 17 11.779 -1.128 -11.640 126 HG2 LYS 17 HG2 LYS 17 10.089 -2.283 -13.418 127 HG3 LYS 17 HG3 LYS 17 10.442 -0.775 -14.245 128 HD2 LYS 17 HD2 LYS 17 12.519 -2.685 -13.127 129 HD3 LYS 17 HD3 LYS 17 11.890 -2.861 -14.764 130 HE2 LYS 17 HE2 LYS 17 13.148 -0.294 -13.776 131 HE3 LYS 17 HE3 LYS 17 14.125 -1.608 -14.436 132 HZ1 LYS 17 HZ1 LYS 17 13.562 0.040 -16.099 133 HZ2 LYS 17 HZ2 LYS 17 13.007 -1.451 -16.497 134 HZ3 LYS 17 HZ3 LYS 17 11.963 -0.277 -15.950 135 H ILE 18 H ILE 18 9.585 -3.417 -12.351 136 HA ILE 18 HA ILE 18 10.975 -4.929 -10.270 137 HB ILE 18 HB ILE 18 8.457 -5.833 -11.741 138 HG12 ILE 18 HG12 ILE 18 8.770 -5.892 -8.715 139 HG13 ILE 18 HG13 ILE 18 8.192 -4.446 -9.520 140 HG21 ILE 18 HG21 ILE 18 10.244 -7.433 -9.835 141 HG22 ILE 18 HG22 ILE 18 8.736 -7.993 -10.571 142 HG23 ILE 18 HG23 ILE 18 10.094 -7.678 -11.590 143 HD11 ILE 18 HD11 ILE 18 6.870 -7.182 -9.754 144 HD12 ILE 18 HD12 ILE 18 6.303 -5.833 -8.776 145 HD13 ILE 18 HD13 ILE 18 6.335 -5.680 -10.541 146 H VAL 19 H VAL 19 12.450 -6.407 -11.346 147 HA VAL 19 HA VAL 19 12.540 -6.203 -14.320 148 HB VAL 19 HB VAL 19 14.885 -6.812 -14.014 149 HG11 VAL 19 HG11 VAL 19 14.298 -4.511 -14.455 150 HG12 VAL 19 HG12 VAL 19 14.007 -4.221 -12.728 151 HG13 VAL 19 HG13 VAL 19 15.649 -4.541 -13.298 152 HG21 VAL 19 HG21 VAL 19 16.101 -6.575 -11.992 153 HG22 VAL 19 HG22 VAL 19 14.622 -6.153 -11.097 154 HG23 VAL 19 HG23 VAL 19 14.853 -7.792 -11.714 155 H ASP 20 H ASP 20 14.491 -8.707 -13.749 156 HA ASP 20 HA ASP 20 13.018 -10.657 -14.636 157 HB2 ASP 20 HB2 ASP 20 15.535 -10.416 -14.158 158 HB3 ASP 20 HB3 ASP 20 15.224 -11.132 -12.602 159 H ASP 21 H ASP 21 14.003 -10.693 -11.173 160 HA ASP 21 HA ASP 21 11.273 -11.319 -10.251 161 HB2 ASP 21 HB2 ASP 21 12.039 -13.077 -8.958 162 HB3 ASP 21 HB3 ASP 21 12.744 -13.371 -10.557 163 H VAL 22 H VAL 22 13.377 -8.954 -10.165 164 HA VAL 22 HA VAL 22 13.249 -8.561 -7.209 165 HB VAL 22 HB VAL 22 15.481 -7.404 -8.965 166 HG11 VAL 22 HG11 VAL 22 16.630 -7.353 -6.727 167 HG12 VAL 22 HG12 VAL 22 15.289 -6.198 -6.965 168 HG13 VAL 22 HG13 VAL 22 15.095 -7.662 -5.996 169 HG21 VAL 22 HG21 VAL 22 15.803 -9.825 -9.115 170 HG22 VAL 22 HG22 VAL 22 16.938 -9.241 -7.912 171 HG23 VAL 22 HG23 VAL 22 15.438 -10.044 -7.395 172 H VAL 23 H VAL 23 12.503 -6.834 -6.499 173 HA VAL 23 HA VAL 23 11.119 -4.943 -8.216 174 HB VAL 23 HB VAL 23 9.699 -5.373 -6.627 175 HG11 VAL 23 HG11 VAL 23 11.366 -6.656 -5.027 176 HG12 VAL 23 HG12 VAL 23 9.610 -6.438 -4.772 177 HG13 VAL 23 HG13 VAL 23 10.263 -7.261 -6.210 178 HG21 VAL 23 HG21 VAL 23 9.675 -3.196 -6.211 179 HG22 VAL 23 HG22 VAL 23 9.456 -4.046 -4.690 180 HG23 VAL 23 HG23 VAL 23 11.045 -3.339 -5.076 181 H ILE 24 H ILE 24 11.401 -2.749 -8.253 182 HA ILE 24 HA ILE 24 13.723 -1.599 -6.836 183 HB ILE 24 HB ILE 24 12.795 -1.138 -9.739 184 HG12 ILE 24 HG12 ILE 24 15.209 -1.817 -10.254 185 HG13 ILE 24 HG13 ILE 24 15.293 -2.508 -8.631 186 HG21 ILE 24 HG21 ILE 24 13.705 0.882 -8.537 187 HG22 ILE 24 HG22 ILE 24 15.152 -0.065 -8.136 188 HG23 ILE 24 HG23 ILE 24 14.787 0.337 -9.821 189 HD11 ILE 24 HD11 ILE 24 14.848 -3.893 -10.777 190 HD12 ILE 24 HD12 ILE 24 14.106 -4.377 -9.293 191 HD13 ILE 24 HD13 ILE 24 13.142 -3.451 -10.534 192 H LEU 25 H LEU 25 12.296 -0.793 -5.144 193 HA LEU 25 HA LEU 25 9.918 0.812 -5.576 194 HB2 LEU 25 HB2 LEU 25 12.034 0.533 -3.404 195 HB3 LEU 25 HB3 LEU 25 11.020 1.931 -3.398 196 HG LEU 25 HG LEU 25 10.343 0.292 -1.815 197 HD11 LEU 25 HD11 LEU 25 8.316 0.511 -4.051 198 HD12 LEU 25 HD12 LEU 25 7.999 0.331 -2.321 199 HD13 LEU 25 HD13 LEU 25 8.711 1.838 -2.919 200 HD21 LEU 25 HD21 LEU 25 9.498 -1.528 -4.088 201 HD22 LEU 25 HD22 LEU 25 10.881 -1.785 -2.991 202 HD23 LEU 25 HD23 LEU 25 9.232 -1.757 -2.342 203 H MET 26 H MET 26 9.803 3.000 -6.093 204 HA MET 26 HA MET 26 12.270 4.633 -6.188 205 HB2 MET 26 HB2 MET 26 10.201 4.395 -8.420 206 HB3 MET 26 HB3 MET 26 11.516 5.573 -8.338 207 HG2 MET 26 HG2 MET 26 13.157 3.716 -8.368 208 HG3 MET 26 HG3 MET 26 11.823 2.556 -8.518 209 HE1 MET 26 HE1 MET 26 14.123 2.536 -10.171 210 HE2 MET 26 HE2 MET 26 12.897 1.583 -11.047 211 HE3 MET 26 HE3 MET 26 13.842 2.858 -11.873 212 HA PRO 27 HA PRO 27 8.609 6.769 -4.217 213 HB2 PRO 27 HB2 PRO 27 9.670 7.480 -1.872 214 HB3 PRO 27 HB3 PRO 27 9.195 5.785 -2.147 215 HG2 PRO 27 HG2 PRO 27 11.985 7.003 -2.488 216 HG3 PRO 27 HG3 PRO 27 11.532 5.618 -1.472 217 HD2 PRO 27 HD2 PRO 27 12.444 5.301 -4.047 218 HD3 PRO 27 HD3 PRO 27 11.152 4.243 -3.406 219 H ASN 28 H ASN 28 9.519 7.888 -6.234 220 HA ASN 28 HA ASN 28 11.416 10.031 -6.040 221 HB2 ASN 28 HB2 ASN 28 10.088 10.862 -8.137 222 HB3 ASN 28 HB3 ASN 28 11.100 9.434 -8.230 223 HD21 ASN 28 HD21 ASN 28 7.588 9.942 -7.228 224 HD22 ASN 28 HD22 ASN 28 7.048 8.622 -8.220 225 H LYS 29 H LYS 29 11.007 11.154 -4.245 226 HA LYS 29 HA LYS 29 10.256 12.749 -2.866 227 HB2 LYS 29 HB2 LYS 29 8.130 13.569 -4.873 228 HB3 LYS 29 HB3 LYS 29 8.721 14.468 -3.494 229 HG2 LYS 29 HG2 LYS 29 10.026 15.512 -4.996 230 HG3 LYS 29 HG3 LYS 29 11.096 14.145 -4.766 231 HD2 LYS 29 HD2 LYS 29 9.203 13.462 -6.855 232 HD3 LYS 29 HD3 LYS 29 9.761 15.089 -7.157 233 HE2 LYS 29 HE2 LYS 29 11.514 12.601 -6.868 234 HE3 LYS 29 HE3 LYS 29 11.114 13.463 -8.357 235 HZ1 LYS 29 HZ1 LYS 29 12.986 14.231 -6.246 236 HZ2 LYS 29 HZ2 LYS 29 13.153 14.305 -7.851 237 HZ3 LYS 29 HZ3 LYS 29 12.221 15.432 -7.076 238 H GLU 30 H GLU 30 7.894 10.513 -4.105 239 HA GLU 30 HA GLU 30 5.827 10.692 -2.365 240 HB2 GLU 30 HB2 GLU 30 7.072 8.584 -4.132 241 HB3 GLU 30 HB3 GLU 30 5.772 8.071 -3.073 242 HG2 GLU 30 HG2 GLU 30 4.885 8.531 -5.175 243 HG3 GLU 30 HG3 GLU 30 4.237 9.650 -4.006 244 H LEU 31 H LEU 31 7.492 11.140 -0.362 245 HA LEU 31 HA LEU 31 7.261 8.692 1.351 246 HB2 LEU 31 HB2 LEU 31 9.592 10.637 1.354 247 HB3 LEU 31 HB3 LEU 31 9.299 9.441 2.615 248 HG LEU 31 HG LEU 31 9.921 8.847 -0.278 249 HD11 LEU 31 HD11 LEU 31 11.475 8.155 2.213 250 HD12 LEU 31 HD12 LEU 31 12.014 8.033 0.532 251 HD13 LEU 31 HD13 LEU 31 11.778 9.631 1.282 252 HD21 LEU 31 HD21 LEU 31 8.460 7.015 0.567 253 HD22 LEU 31 HD22 LEU 31 10.113 6.436 0.522 254 HD23 LEU 31 HD23 LEU 31 9.399 6.925 2.065 255 H ASN 32 H ASN 32 5.471 10.987 0.937 256 HA ASN 32 HA ASN 32 5.282 12.492 3.378 257 HB2 ASN 32 HB2 ASN 32 2.914 12.739 2.845 258 HB3 ASN 32 HB3 ASN 32 3.890 13.056 1.407 259 HD21 ASN 32 HD21 ASN 32 3.776 11.535 -0.388 260 HD22 ASN 32 HD22 ASN 32 2.829 10.101 -0.328 261 H ILE 33 H ILE 33 4.041 11.919 5.295 262 HA ILE 33 HA ILE 33 4.588 9.328 6.213 263 HB ILE 33 HB ILE 33 2.857 11.576 7.242 264 HG12 ILE 33 HG12 ILE 33 5.367 10.061 8.052 265 HG13 ILE 33 HG13 ILE 33 5.220 11.740 7.532 266 HG21 ILE 33 HG21 ILE 33 2.254 10.302 9.273 267 HG22 ILE 33 HG22 ILE 33 1.506 9.619 7.865 268 HG23 ILE 33 HG23 ILE 33 2.948 8.826 8.552 269 HD11 ILE 33 HD11 ILE 33 5.556 11.744 9.921 270 HD12 ILE 33 HD12 ILE 33 3.838 12.140 9.629 271 HD13 ILE 33 HD13 ILE 33 4.303 10.508 10.174 272 H GLU 34 H GLU 34 1.580 10.507 4.677 273 HA GLU 34 HA GLU 34 0.025 8.306 5.632 274 HB2 GLU 34 HB2 GLU 34 -0.468 9.957 3.132 275 HB3 GLU 34 HB3 GLU 34 -1.649 9.068 4.103 276 HG2 GLU 34 HG2 GLU 34 -1.047 10.619 6.067 277 HG3 GLU 34 HG3 GLU 34 -0.054 11.543 4.941 278 H ASN 35 H ASN 35 2.090 8.821 2.886 279 HA ASN 35 HA ASN 35 1.402 6.275 1.560 280 HB2 ASN 35 HB2 ASN 35 2.260 8.041 0.142 281 HB3 ASN 35 HB3 ASN 35 3.780 8.114 1.070 282 HD21 ASN 35 HD21 ASN 35 5.432 7.083 -0.226 283 HD22 ASN 35 HD22 ASN 35 5.172 5.583 -1.028 284 H ALA 36 H ALA 36 4.024 7.604 3.648 285 HA ALA 36 HA ALA 36 5.549 5.250 3.853 286 HB1 ALA 36 HB1 ALA 36 6.246 7.466 4.687 287 HB2 ALA 36 HB2 ALA 36 5.108 7.275 6.045 288 HB3 ALA 36 HB3 ALA 36 6.453 6.138 5.855 289 H HIS 37 H HIS 37 2.502 6.111 5.560 290 HA HIS 37 HA HIS 37 2.544 3.829 7.328 291 HB2 HIS 37 HB2 HIS 37 1.108 5.693 7.896 292 HB3 HIS 37 HB3 HIS 37 0.266 5.595 6.344 293 HD1 HIS 37 HD1 HIS 37 1.019 2.779 8.944 294 HD2 HIS 37 HD2 HIS 37 -2.064 4.442 6.590 295 HE1 HIS 37 HE1 HIS 37 -0.978 1.292 9.235 296 H LEU 38 H LEU 38 0.987 4.446 4.116 297 HA LEU 38 HA LEU 38 -0.113 1.758 4.080 298 HB2 LEU 38 HB2 LEU 38 -1.215 2.345 2.243 299 HB3 LEU 38 HB3 LEU 38 -1.008 3.904 2.991 300 HG LEU 38 HG LEU 38 1.071 4.139 1.407 301 HD11 LEU 38 HD11 LEU 38 1.491 2.228 0.268 302 HD12 LEU 38 HD12 LEU 38 -0.168 1.624 0.413 303 HD13 LEU 38 HD13 LEU 38 0.262 2.832 -0.830 304 HD21 LEU 38 HD21 LEU 38 -0.985 5.478 1.258 305 HD22 LEU 38 HD22 LEU 38 -0.313 5.109 -0.327 306 HD23 LEU 38 HD23 LEU 38 -1.735 4.214 0.255 307 H PHE 39 H PHE 39 2.940 3.080 3.265 308 HA PHE 39 HA PHE 39 3.947 1.834 1.200 309 HB2 PHE 39 HB2 PHE 39 5.019 3.368 3.056 310 HB3 PHE 39 HB3 PHE 39 5.660 1.888 3.708 311 HD1 PHE 39 HD1 PHE 39 5.374 3.751 0.415 312 HD2 PHE 39 HD2 PHE 39 7.832 1.356 3.028 313 HE1 PHE 39 HE1 PHE 39 7.328 4.342 -0.924 314 HE2 PHE 39 HE2 PHE 39 9.777 1.752 1.515 315 HZ PHE 39 HZ PHE 39 9.556 3.296 -0.423 316 H LYS 40 H LYS 40 4.145 0.363 4.476 317 HA LYS 40 HA LYS 40 5.263 -2.090 3.550 318 HB2 LYS 40 HB2 LYS 40 5.336 -1.045 5.870 319 HB3 LYS 40 HB3 LYS 40 3.673 -1.624 6.104 320 HG2 LYS 40 HG2 LYS 40 4.551 -3.962 5.744 321 HG3 LYS 40 HG3 LYS 40 6.171 -3.281 5.556 322 HD2 LYS 40 HD2 LYS 40 6.164 -3.881 7.805 323 HD3 LYS 40 HD3 LYS 40 5.774 -2.173 7.866 324 HE2 LYS 40 HE2 LYS 40 4.318 -3.234 9.407 325 HE3 LYS 40 HE3 LYS 40 3.302 -2.799 8.028 326 HZ1 LYS 40 HZ1 LYS 40 2.983 -5.080 8.942 327 HZ2 LYS 40 HZ2 LYS 40 3.295 -5.064 7.336 328 HZ3 LYS 40 HZ3 LYS 40 4.494 -5.487 8.420 329 H LYS 41 H LYS 41 1.863 -0.983 3.674 330 HA LYS 41 HA LYS 41 0.814 -3.724 3.382 331 HB2 LYS 41 HB2 LYS 41 -0.368 -1.137 3.869 332 HB3 LYS 41 HB3 LYS 41 -0.857 -1.553 2.239 333 HG2 LYS 41 HG2 LYS 41 -1.470 -3.898 3.187 334 HG3 LYS 41 HG3 LYS 41 -1.345 -3.135 4.779 335 HD2 LYS 41 HD2 LYS 41 -3.195 -2.321 2.493 336 HD3 LYS 41 HD3 LYS 41 -3.664 -3.214 3.949 337 HE2 LYS 41 HE2 LYS 41 -3.010 -1.278 5.359 338 HE3 LYS 41 HE3 LYS 41 -2.551 -0.373 3.904 339 HZ1 LYS 41 HZ1 LYS 41 -4.847 -0.520 3.165 340 HZ2 LYS 41 HZ2 LYS 41 -5.265 -1.339 4.546 341 HZ3 LYS 41 HZ3 LYS 41 -4.739 0.214 4.632 342 H TRP 42 H TRP 42 1.431 -0.924 1.208 343 HA TRP 42 HA TRP 42 0.753 -2.308 -1.176 344 HB2 TRP 42 HB2 TRP 42 0.793 0.012 -1.255 345 HB3 TRP 42 HB3 TRP 42 2.368 0.123 -0.485 346 HD1 TRP 42 HD1 TRP 42 1.226 -1.460 -3.914 347 HE1 TRP 42 HE1 TRP 42 2.739 -0.593 -5.696 348 HE3 TRP 42 HE3 TRP 42 4.471 1.078 -0.919 349 HZ2 TRP 42 HZ2 TRP 42 5.287 0.956 -5.822 350 HZ3 TRP 42 HZ3 TRP 42 6.514 2.021 -1.855 351 HH2 TRP 42 HH2 TRP 42 6.823 2.166 -4.351 352 H VAL 43 H VAL 43 4.138 -1.634 0.040 353 HA VAL 43 HA VAL 43 5.447 -3.330 -1.674 354 HB VAL 43 HB VAL 43 6.028 -2.651 1.237 355 HG11 VAL 43 HG11 VAL 43 8.373 -3.238 0.889 356 HG12 VAL 43 HG12 VAL 43 7.363 -4.665 0.712 357 HG13 VAL 43 HG13 VAL 43 8.024 -3.852 -0.726 358 HG21 VAL 43 HG21 VAL 43 5.994 -0.723 -0.327 359 HG22 VAL 43 HG22 VAL 43 7.645 -1.039 0.197 360 HG23 VAL 43 HG23 VAL 43 7.092 -1.577 -1.407 361 H PHE 44 H PHE 44 3.349 -4.381 1.004 362 HA PHE 44 HA PHE 44 4.408 -7.070 0.949 363 HB2 PHE 44 HB2 PHE 44 2.189 -5.655 2.403 364 HB3 PHE 44 HB3 PHE 44 2.033 -7.302 2.180 365 HD1 PHE 44 HD1 PHE 44 5.238 -5.352 2.962 366 HD2 PHE 44 HD2 PHE 44 2.332 -8.306 4.246 367 HE1 PHE 44 HE1 PHE 44 6.503 -5.692 5.059 368 HE2 PHE 44 HE2 PHE 44 3.637 -8.645 6.316 369 HZ PHE 44 HZ PHE 44 5.695 -7.365 6.717 370 H ASP 45 H ASP 45 1.297 -5.630 0.248 371 HA ASP 45 HA ASP 45 0.288 -7.899 -1.010 372 HB2 ASP 45 HB2 ASP 45 -0.840 -5.782 0.040 373 HB3 ASP 45 HB3 ASP 45 -0.898 -5.234 -1.638 374 H GLU 46 H GLU 46 1.879 -5.161 -2.481 375 HA GLU 46 HA GLU 46 1.499 -5.923 -5.239 376 HB2 GLU 46 HB2 GLU 46 1.870 -3.593 -4.191 377 HB3 GLU 46 HB3 GLU 46 3.547 -4.073 -3.967 378 HG2 GLU 46 HG2 GLU 46 3.699 -2.815 -5.819 379 HG3 GLU 46 HG3 GLU 46 3.570 -4.412 -6.555 380 H PHE 47 H PHE 47 3.971 -6.730 -2.662 381 HA PHE 47 HA PHE 47 5.428 -8.204 -4.750 382 HB2 PHE 47 HB2 PHE 47 7.043 -6.803 -2.654 383 HB3 PHE 47 HB3 PHE 47 7.494 -7.503 -4.195 384 HD1 PHE 47 HD1 PHE 47 6.289 -6.342 -6.322 385 HD2 PHE 47 HD2 PHE 47 7.096 -4.487 -2.537 386 HE1 PHE 47 HE1 PHE 47 6.105 -4.129 -7.355 387 HE2 PHE 47 HE2 PHE 47 6.904 -2.210 -3.609 388 HZ PHE 47 HZ PHE 47 6.404 -2.054 -6.016 389 H LEU 48 H LEU 48 5.563 -7.715 -1.165 390 HA LEU 48 HA LEU 48 6.803 -10.208 -0.804 391 HB2 LEU 48 HB2 LEU 48 5.069 -8.886 1.322 392 HB3 LEU 48 HB3 LEU 48 6.295 -10.115 1.561 393 HG LEU 48 HG LEU 48 6.663 -7.182 1.044 394 HD11 LEU 48 HD11 LEU 48 6.658 -8.246 3.338 395 HD12 LEU 48 HD12 LEU 48 8.132 -9.111 2.881 396 HD13 LEU 48 HD13 LEU 48 8.133 -7.331 2.947 397 HD21 LEU 48 HD21 LEU 48 9.064 -7.477 0.619 398 HD22 LEU 48 HD22 LEU 48 8.840 -9.237 0.496 399 HD23 LEU 48 HD23 LEU 48 8.102 -8.148 -0.688 400 H ASN 49 H ASN 49 3.373 -9.421 -0.472 401 HA ASN 49 HA ASN 49 2.441 -12.046 0.300 402 HB2 ASN 49 HB2 ASN 49 1.008 -9.746 -1.060 403 HB3 ASN 49 HB3 ASN 49 0.213 -11.170 -0.452 404 HD21 ASN 49 HD21 ASN 49 -0.801 -8.806 0.530 405 HD22 ASN 49 HD22 ASN 49 -0.376 -8.742 2.215 406 H LYS 50 H LYS 50 2.986 -10.322 -2.764 407 HA LYS 50 HA LYS 50 1.912 -12.262 -4.557 408 HB2 LYS 50 HB2 LYS 50 3.381 -9.754 -4.690 409 HB3 LYS 50 HB3 LYS 50 4.207 -10.930 -5.694 410 HG2 LYS 50 HG2 LYS 50 1.786 -11.425 -6.625 411 HG3 LYS 50 HG3 LYS 50 1.405 -9.855 -5.883 412 HD2 LYS 50 HD2 LYS 50 3.563 -9.071 -7.207 413 HD3 LYS 50 HD3 LYS 50 3.217 -10.484 -8.212 414 HE2 LYS 50 HE2 LYS 50 1.305 -8.183 -7.577 415 HE3 LYS 50 HE3 LYS 50 2.264 -8.320 -9.050 416 HZ1 LYS 50 HZ1 LYS 50 0.088 -9.060 -9.461 417 HZ2 LYS 50 HZ2 LYS 50 1.040 -10.357 -9.594 418 HZ3 LYS 50 HZ3 LYS 50 0.124 -10.214 -8.251 419 H GLY 51 H GLY 51 4.834 -12.281 -2.591 420 HA2 GLY 51 HA2 GLY 51 6.017 -14.300 -2.189 421 HA3 GLY 51 HA3 GLY 51 5.608 -14.886 -3.805 422 H TYR 52 H TYR 52 6.622 -11.529 -3.662 423 HA TYR 52 HA TYR 52 9.213 -12.144 -4.928 424 HB2 TYR 52 HB2 TYR 52 7.918 -9.603 -3.909 425 HB3 TYR 52 HB3 TYR 52 9.593 -9.645 -4.411 426 HD1 TYR 52 HD1 TYR 52 6.113 -9.957 -5.645 427 HD2 TYR 52 HD2 TYR 52 10.281 -9.955 -6.693 428 HE1 TYR 52 HE1 TYR 52 5.486 -9.832 -8.022 429 HE2 TYR 52 HE2 TYR 52 9.698 -9.913 -9.072 430 HH TYR 52 HH TYR 52 6.266 -9.847 -10.256 431 H ASN 53 H ASN 53 11.119 -12.238 -3.891 432 HA ASN 53 HA ASN 53 11.172 -11.930 -0.919 433 HB2 ASN 53 HB2 ASN 53 12.414 -14.003 -2.752 434 HB3 ASN 53 HB3 ASN 53 13.021 -13.719 -1.150 435 HD21 ASN 53 HD21 ASN 53 10.592 -13.408 0.417 436 HD22 ASN 53 HD22 ASN 53 9.891 -15.004 0.398 437 H LYS 54 H LYS 54 11.986 -10.116 -3.488 438 HA LYS 54 HA LYS 54 14.618 -9.378 -2.410 439 HB2 LYS 54 HB2 LYS 54 14.109 -10.679 -5.102 440 HB3 LYS 54 HB3 LYS 54 15.376 -9.501 -4.940 441 HG2 LYS 54 HG2 LYS 54 16.781 -10.801 -3.802 442 HG3 LYS 54 HG3 LYS 54 15.549 -11.537 -2.793 443 HD2 LYS 54 HD2 LYS 54 16.085 -12.239 -5.721 444 HD3 LYS 54 HD3 LYS 54 16.671 -13.153 -4.326 445 HE2 LYS 54 HE2 LYS 54 14.365 -13.586 -3.581 446 HE3 LYS 54 HE3 LYS 54 13.740 -12.613 -4.945 447 HZ1 LYS 54 HZ1 LYS 54 15.418 -14.980 -5.418 448 HZ2 LYS 54 HZ2 LYS 54 13.791 -15.093 -5.320 449 HZ3 LYS 54 HZ3 LYS 54 14.469 -14.154 -6.483 450 H ILE 55 H ILE 55 14.041 -7.380 -1.958 451 HA ILE 55 HA ILE 55 12.632 -5.707 -4.027 452 HB ILE 55 HB ILE 55 12.664 -5.543 -0.993 453 HG12 ILE 55 HG12 ILE 55 10.313 -5.644 -1.081 454 HG13 ILE 55 HG13 ILE 55 10.267 -5.312 -2.827 455 HG21 ILE 55 HG21 ILE 55 11.301 -3.466 -1.339 456 HG22 ILE 55 HG22 ILE 55 13.021 -3.289 -1.711 457 HG23 ILE 55 HG23 ILE 55 11.840 -3.561 -3.038 458 HD11 ILE 55 HD11 ILE 55 11.178 -7.898 -1.596 459 HD12 ILE 55 HD12 ILE 55 9.539 -7.530 -2.305 460 HD13 ILE 55 HD13 ILE 55 10.914 -7.525 -3.324 461 H PHE 56 H PHE 56 13.521 -3.904 -4.665 462 HA PHE 56 HA PHE 56 15.922 -3.032 -3.032 463 HB2 PHE 56 HB2 PHE 56 15.610 -2.536 -6.013 464 HB3 PHE 56 HB3 PHE 56 16.846 -1.834 -4.995 465 HD1 PHE 56 HD1 PHE 56 17.600 -4.201 -3.267 466 HD2 PHE 56 HD2 PHE 56 16.848 -3.909 -7.530 467 HE1 PHE 56 HE1 PHE 56 19.173 -6.051 -3.715 468 HE2 PHE 56 HE2 PHE 56 18.234 -5.873 -7.912 469 HZ PHE 56 HZ PHE 56 19.480 -6.918 -6.033 470 H LEU 57 H LEU 57 16.301 -0.742 -2.736 471 HA LEU 57 HA LEU 57 13.960 0.997 -3.393 472 HB2 LEU 57 HB2 LEU 57 14.035 0.467 -0.988 473 HB3 LEU 57 HB3 LEU 57 15.753 0.867 -0.942 474 HG LEU 57 HG LEU 57 15.194 3.254 -1.469 475 HD11 LEU 57 HD11 LEU 57 13.062 3.001 -2.601 476 HD12 LEU 57 HD12 LEU 57 12.332 2.251 -1.148 477 HD13 LEU 57 HD13 LEU 57 12.842 3.950 -1.132 478 HD21 LEU 57 HD21 LEU 57 14.315 3.765 0.773 479 HD22 LEU 57 HD22 LEU 57 13.801 2.072 0.978 480 HD23 LEU 57 HD23 LEU 57 15.530 2.486 0.858 481 H VAL 58 H VAL 58 14.504 2.602 -4.825 482 HA VAL 58 HA VAL 58 17.350 3.352 -5.031 483 HB VAL 58 HB VAL 58 15.023 4.211 -6.797 484 HG11 VAL 58 HG11 VAL 58 16.927 4.642 -8.426 485 HG12 VAL 58 HG12 VAL 58 16.928 5.689 -7.021 486 HG13 VAL 58 HG13 VAL 58 18.068 4.310 -7.111 487 HG21 VAL 58 HG21 VAL 58 17.002 1.940 -7.281 488 HG22 VAL 58 HG22 VAL 58 15.268 1.777 -6.930 489 HG23 VAL 58 HG23 VAL 58 15.790 2.553 -8.426 490 H LEU 59 H LEU 59 18.075 5.316 -4.488 491 HA LEU 59 HA LEU 59 16.185 7.234 -3.203 492 HB2 LEU 59 HB2 LEU 59 19.032 6.450 -2.387 493 HB3 LEU 59 HB3 LEU 59 18.014 7.681 -1.632 494 HG LEU 59 HG LEU 59 16.261 5.579 -1.570 495 HD11 LEU 59 HD11 LEU 59 19.023 4.337 -1.169 496 HD12 LEU 59 HD12 LEU 59 17.464 3.540 -0.859 497 HD13 LEU 59 HD13 LEU 59 17.932 3.969 -2.502 498 HD21 LEU 59 HD21 LEU 59 17.004 6.997 0.372 499 HD22 LEU 59 HD22 LEU 59 16.701 5.290 0.736 500 HD23 LEU 59 HD23 LEU 59 18.368 5.849 0.546 501 H SER 60 H SER 60 17.787 6.949 -5.959 502 HA SER 60 HA SER 60 19.284 9.265 -6.424 503 HB2 SER 60 HB2 SER 60 18.607 7.154 -7.911 504 HB3 SER 60 HB3 SER 60 17.263 8.147 -8.390 505 HG SER 60 HG SER 60 20.034 8.594 -8.758 506 H ASP 61 H ASP 61 15.758 8.816 -6.302 507 HA ASP 61 HA ASP 61 15.254 11.543 -7.336 508 HB2 ASP 61 HB2 ASP 61 13.503 9.087 -7.055 509 HB3 ASP 61 HB3 ASP 61 12.975 10.664 -7.666 510 H VAL 62 H VAL 62 16.058 10.835 -4.437 511 HA VAL 62 HA VAL 62 14.073 12.530 -3.164 512 HB VAL 62 HB VAL 62 13.015 10.340 -3.067 513 HG11 VAL 62 HG11 VAL 62 13.869 8.430 -1.810 514 HG12 VAL 62 HG12 VAL 62 14.742 8.775 -3.301 515 HG13 VAL 62 HG13 VAL 62 15.476 9.213 -1.740 516 HG21 VAL 62 HG21 VAL 62 12.678 10.209 -0.662 517 HG22 VAL 62 HG22 VAL 62 14.157 11.156 -0.407 518 HG23 VAL 62 HG23 VAL 62 12.753 11.889 -1.185 519 H GLU 63 H GLU 63 15.071 13.912 -1.825 520 HA GLU 63 HA GLU 63 17.939 13.591 -1.433 521 HB2 GLU 63 HB2 GLU 63 17.245 15.819 -1.857 522 HB3 GLU 63 HB3 GLU 63 15.930 15.734 -0.669 523 HG2 GLU 63 HG2 GLU 63 17.459 15.720 1.199 524 HG3 GLU 63 HG3 GLU 63 18.837 15.352 0.180 525 H SER 64 H SER 64 14.883 13.449 0.567 526 HA SER 64 HA SER 64 16.466 12.022 2.561 527 HB2 SER 64 HB2 SER 64 16.626 14.582 2.892 528 HB3 SER 64 HB3 SER 64 14.900 14.530 3.238 529 HG SER 64 HG SER 64 15.425 14.123 5.170 530 H ILE 65 H ILE 65 14.926 11.723 4.604 531 HA ILE 65 HA ILE 65 12.267 10.857 3.797 532 HB ILE 65 HB ILE 65 13.726 8.968 3.245 533 HG12 ILE 65 HG12 ILE 65 12.347 8.338 5.875 534 HG13 ILE 65 HG13 ILE 65 11.494 8.635 4.361 535 HG21 ILE 65 HG21 ILE 65 15.654 9.493 4.687 536 HG22 ILE 65 HG22 ILE 65 14.680 9.088 6.123 537 HG23 ILE 65 HG23 ILE 65 15.128 7.839 4.930 538 HD11 ILE 65 HD11 ILE 65 13.443 6.363 4.972 539 HD12 ILE 65 HD12 ILE 65 11.726 6.252 4.553 540 HD13 ILE 65 HD13 ILE 65 12.895 6.743 3.312 541 H ASP 66 H ASP 66 11.013 10.558 5.648 542 HA ASP 66 HA ASP 66 11.687 12.480 7.751 543 HB2 ASP 66 HB2 ASP 66 9.171 10.943 7.008 544 HB3 ASP 66 HB3 ASP 66 9.284 11.871 8.502 545 H SER 67 H SER 67 11.565 12.042 10.017 546 HA SER 67 HA SER 67 12.858 9.773 10.985 547 HB2 SER 67 HB2 SER 67 11.788 10.577 13.215 548 HB3 SER 67 HB3 SER 67 12.849 11.679 12.326 549 HG SER 67 HG SER 67 10.047 11.800 12.657 550 H PHE 68 H PHE 68 9.490 10.171 10.239 551 HA PHE 68 HA PHE 68 8.399 7.842 11.515 552 HB2 PHE 68 HB2 PHE 68 7.074 9.722 10.577 553 HB3 PHE 68 HB3 PHE 68 7.585 9.295 8.956 554 HD1 PHE 68 HD1 PHE 68 6.783 7.117 7.930 555 HD2 PHE 68 HD2 PHE 68 5.258 8.613 11.664 556 HE1 PHE 68 HE1 PHE 68 5.005 5.423 7.846 557 HE2 PHE 68 HE2 PHE 68 3.378 7.068 11.521 558 HZ PHE 68 HZ PHE 68 3.232 5.397 9.635 559 H SER 69 H SER 69 9.523 8.382 8.153 560 HA SER 69 HA SER 69 8.924 5.624 7.501 561 HB2 SER 69 HB2 SER 69 8.194 7.417 6.162 562 HB3 SER 69 HB3 SER 69 9.863 7.979 5.849 563 HG SER 69 HG SER 69 8.804 6.745 4.165 564 H LEU 70 H LEU 70 11.861 7.475 8.196 565 HA LEU 70 HA LEU 70 13.733 5.602 7.140 566 HB2 LEU 70 HB2 LEU 70 14.139 7.940 8.024 567 HB3 LEU 70 HB3 LEU 70 13.805 7.364 9.658 568 HG LEU 70 HG LEU 70 15.830 5.959 9.614 569 HD11 LEU 70 HD11 LEU 70 15.965 5.433 7.192 570 HD12 LEU 70 HD12 LEU 70 16.285 7.145 6.831 571 HD13 LEU 70 HD13 LEU 70 17.457 6.191 7.749 572 HD21 LEU 70 HD21 LEU 70 17.415 7.785 9.706 573 HD22 LEU 70 HD22 LEU 70 16.400 8.816 8.675 574 HD23 LEU 70 HD23 LEU 70 15.881 8.378 10.319 575 H GLY 71 H GLY 71 11.504 5.268 9.798 576 HA2 GLY 71 HA2 GLY 71 12.799 2.783 10.773 577 HA3 GLY 71 HA3 GLY 71 11.335 3.536 11.397 578 H VAL 72 H VAL 72 10.184 3.823 8.554 579 HA VAL 72 HA VAL 72 8.901 1.273 8.555 580 HB VAL 72 HB VAL 72 8.034 3.725 7.794 581 HG11 VAL 72 HG11 VAL 72 8.448 2.457 5.071 582 HG12 VAL 72 HG12 VAL 72 7.595 3.958 5.512 583 HG13 VAL 72 HG13 VAL 72 9.355 3.848 5.654 584 HG21 VAL 72 HG21 VAL 72 6.156 2.567 6.937 585 HG22 VAL 72 HG22 VAL 72 7.118 1.166 6.410 586 HG23 VAL 72 HG23 VAL 72 6.812 1.482 8.148 587 H ILE 73 H ILE 73 11.423 2.770 6.567 588 HA ILE 73 HA ILE 73 11.757 0.733 4.640 589 HB ILE 73 HB ILE 73 13.713 2.663 5.956 590 HG12 ILE 73 HG12 ILE 73 12.253 4.065 4.893 591 HG13 ILE 73 HG13 ILE 73 13.426 3.838 3.638 592 HG21 ILE 73 HG21 ILE 73 14.177 1.207 3.341 593 HG22 ILE 73 HG22 ILE 73 15.207 2.451 4.136 594 HG23 ILE 73 HG23 ILE 73 15.001 0.857 4.880 595 HD11 ILE 73 HD11 ILE 73 11.859 2.124 2.609 596 HD12 ILE 73 HD12 ILE 73 10.646 2.587 3.837 597 HD13 ILE 73 HD13 ILE 73 11.224 3.784 2.671 598 H VAL 74 H VAL 74 13.235 1.033 7.914 599 HA VAL 74 HA VAL 74 14.652 -1.447 7.741 600 HB VAL 74 HB VAL 74 13.457 0.140 10.101 601 HG11 VAL 74 HG11 VAL 74 13.597 -2.051 10.930 602 HG12 VAL 74 HG12 VAL 74 15.214 -2.317 10.233 603 HG13 VAL 74 HG13 VAL 74 14.992 -1.183 11.586 604 HG21 VAL 74 HG21 VAL 74 16.312 0.005 9.099 605 HG22 VAL 74 HG22 VAL 74 15.195 1.379 8.985 606 HG23 VAL 74 HG23 VAL 74 15.764 0.846 10.565 607 H ASN 75 H ASN 75 11.294 -0.622 8.716 608 HA ASN 75 HA ASN 75 10.571 -3.069 9.882 609 HB2 ASN 75 HB2 ASN 75 9.294 -0.674 9.301 610 HB3 ASN 75 HB3 ASN 75 8.506 -1.789 8.183 611 HD21 ASN 75 HD21 ASN 75 9.443 -1.382 11.672 612 HD22 ASN 75 HD22 ASN 75 8.070 -2.266 12.269 613 H ILE 76 H ILE 76 10.509 -2.092 6.459 614 HA ILE 76 HA ILE 76 9.433 -4.539 5.425 615 HB ILE 76 HB ILE 76 11.021 -2.236 4.236 616 HG12 ILE 76 HG12 ILE 76 8.147 -3.169 3.765 617 HG13 ILE 76 HG13 ILE 76 8.562 -1.978 5.001 618 HG21 ILE 76 HG21 ILE 76 9.896 -4.643 2.726 619 HG22 ILE 76 HG22 ILE 76 10.557 -3.171 1.979 620 HG23 ILE 76 HG23 ILE 76 11.613 -4.223 2.896 621 HD11 ILE 76 HD11 ILE 76 9.351 -0.396 3.409 622 HD12 ILE 76 HD12 ILE 76 9.115 -1.527 2.064 623 HD13 ILE 76 HD13 ILE 76 7.708 -0.957 2.968 624 H LEU 77 H LEU 77 12.785 -3.573 6.342 625 HA LEU 77 HA LEU 77 14.050 -5.806 4.978 626 HB2 LEU 77 HB2 LEU 77 15.302 -3.754 5.651 627 HB3 LEU 77 HB3 LEU 77 15.007 -4.102 7.333 628 HG LEU 77 HG LEU 77 17.252 -4.647 6.434 629 HD11 LEU 77 HD11 LEU 77 16.069 -7.072 7.745 630 HD12 LEU 77 HD12 LEU 77 17.728 -6.454 7.780 631 HD13 LEU 77 HD13 LEU 77 16.444 -5.533 8.583 632 HD21 LEU 77 HD21 LEU 77 16.672 -5.682 4.305 633 HD22 LEU 77 HD22 LEU 77 17.692 -6.726 5.284 634 HD23 LEU 77 HD23 LEU 77 15.958 -7.065 5.159 635 H LYS 78 H LYS 78 12.985 -5.124 8.295 636 HA LYS 78 HA LYS 78 13.672 -7.552 9.507 637 HB2 LYS 78 HB2 LYS 78 11.152 -5.892 10.011 638 HB3 LYS 78 HB3 LYS 78 11.778 -7.163 11.067 639 HG2 LYS 78 HG2 LYS 78 13.880 -5.896 11.340 640 HG3 LYS 78 HG3 LYS 78 13.257 -4.605 10.316 641 HD2 LYS 78 HD2 LYS 78 11.531 -4.034 11.869 642 HD3 LYS 78 HD3 LYS 78 11.745 -5.521 12.806 643 HE2 LYS 78 HE2 LYS 78 13.987 -3.505 12.472 644 HE3 LYS 78 HE3 LYS 78 12.764 -3.343 13.745 645 HZ1 LYS 78 HZ1 LYS 78 14.421 -5.771 13.414 646 HZ2 LYS 78 HZ2 LYS 78 14.795 -4.537 14.432 647 HZ3 LYS 78 HZ3 LYS 78 13.419 -5.418 14.641 648 H SER 79 H SER 79 10.560 -6.791 7.853 649 HA SER 79 HA SER 79 9.657 -9.492 8.198 650 HB2 SER 79 HB2 SER 79 8.602 -7.050 6.982 651 HB3 SER 79 HB3 SER 79 8.248 -8.483 5.989 652 HG SER 79 HG SER 79 7.447 -9.531 7.714 653 H ILE 80 H ILE 80 11.470 -7.996 5.412 654 HA ILE 80 HA ILE 80 11.114 -10.355 3.843 655 HB ILE 80 HB ILE 80 13.160 -8.112 3.738 656 HG12 ILE 80 HG12 ILE 80 10.799 -8.881 1.941 657 HG13 ILE 80 HG13 ILE 80 10.735 -7.633 3.180 658 HG21 ILE 80 HG21 ILE 80 14.209 -10.148 2.757 659 HG22 ILE 80 HG22 ILE 80 12.789 -10.350 1.692 660 HG23 ILE 80 HG23 ILE 80 13.860 -8.962 1.524 661 HD11 ILE 80 HD11 ILE 80 11.059 -6.508 1.110 662 HD12 ILE 80 HD12 ILE 80 12.599 -6.426 1.984 663 HD13 ILE 80 HD13 ILE 80 12.384 -7.595 0.640 664 H SER 81 H SER 81 13.706 -9.424 6.172 665 HA SER 81 HA SER 81 15.251 -11.785 5.932 666 HB2 SER 81 HB2 SER 81 14.731 -9.778 8.152 667 HB3 SER 81 HB3 SER 81 15.852 -11.148 8.353 668 HG SER 81 HG SER 81 17.234 -10.164 7.211 669 H SER 82 H SER 82 12.444 -11.090 8.128 670 HA SER 82 HA SER 82 12.347 -13.711 9.243 671 HB2 SER 82 HB2 SER 82 10.271 -11.509 8.981 672 HB3 SER 82 HB3 SER 82 10.175 -12.878 10.109 673 HG SER 82 HG SER 82 11.627 -11.984 11.373 674 H SER 83 H SER 83 11.285 -12.640 6.098 675 HA SER 83 HA SER 83 9.399 -14.908 5.802 676 HB2 SER 83 HB2 SER 83 10.172 -12.541 4.044 677 HB3 SER 83 HB3 SER 83 9.259 -13.935 3.465 678 HG SER 83 HG SER 83 7.585 -12.856 4.217 679 H GLY 84 H GLY 84 12.732 -13.986 4.947 680 HA2 GLY 84 HA2 GLY 84 14.092 -16.042 4.365 681 HA3 GLY 84 HA3 GLY 84 12.777 -16.431 3.241 682 H GLY 85 H GLY 85 13.320 -13.052 3.030 683 HA2 GLY 85 HA2 GLY 85 14.516 -13.568 0.357 684 HA3 GLY 85 HA3 GLY 85 13.543 -12.194 0.908 685 H PHE 86 H PHE 86 15.206 -10.919 -0.120 686 HA PHE 86 HA PHE 86 17.185 -10.014 1.832 687 HB2 PHE 86 HB2 PHE 86 17.976 -11.363 -0.632 688 HB3 PHE 86 HB3 PHE 86 18.445 -9.673 -0.708 689 HD1 PHE 86 HD1 PHE 86 18.664 -12.777 1.261 690 HD2 PHE 86 HD2 PHE 86 20.400 -8.849 0.672 691 HE1 PHE 86 HE1 PHE 86 20.231 -13.196 3.131 692 HE2 PHE 86 HE2 PHE 86 21.812 -9.213 2.664 693 HZ PHE 86 HZ PHE 86 21.729 -11.386 3.895 694 H PHE 87 H PHE 87 17.832 -7.707 1.364 695 HA PHE 87 HA PHE 87 16.282 -6.304 -0.657 696 HB2 PHE 87 HB2 PHE 87 14.607 -6.221 0.951 697 HB3 PHE 87 HB3 PHE 87 15.729 -6.124 2.292 698 HD1 PHE 87 HD1 PHE 87 15.371 -3.906 -0.775 699 HD2 PHE 87 HD2 PHE 87 15.071 -4.244 3.516 700 HE1 PHE 87 HE1 PHE 87 15.250 -1.463 -0.544 701 HE2 PHE 87 HE2 PHE 87 14.915 -1.797 3.755 702 HZ PHE 87 HZ PHE 87 15.020 -0.374 1.681 703 H ALA 88 H ALA 88 17.285 -4.334 -1.240 704 HA ALA 88 HA ALA 88 19.509 -3.343 0.346 705 HB1 ALA 88 HB1 ALA 88 20.492 -5.101 -1.181 706 HB2 ALA 88 HB2 ALA 88 20.017 -4.063 -2.553 707 HB3 ALA 88 HB3 ALA 88 21.157 -3.466 -1.334 708 H LEU 89 H LEU 89 20.361 -1.304 -0.512 709 HA LEU 89 HA LEU 89 18.244 0.361 -1.710 710 HB2 LEU 89 HB2 LEU 89 20.499 0.911 0.272 711 HB3 LEU 89 HB3 LEU 89 19.488 2.143 -0.435 712 HG LEU 89 HG LEU 89 17.447 0.833 0.492 713 HD11 LEU 89 HD11 LEU 89 19.526 -0.615 1.816 714 HD12 LEU 89 HD12 LEU 89 17.965 -0.257 2.628 715 HD13 LEU 89 HD13 LEU 89 17.952 -1.081 1.057 716 HD21 LEU 89 HD21 LEU 89 17.580 2.047 2.627 717 HD22 LEU 89 HD22 LEU 89 19.348 2.168 2.470 718 HD23 LEU 89 HD23 LEU 89 18.299 3.073 1.371 719 H VAL 90 H VAL 90 18.993 2.162 -3.070 720 HA VAL 90 HA VAL 90 21.400 1.487 -4.665 721 HB VAL 90 HB VAL 90 18.519 1.696 -5.613 722 HG11 VAL 90 HG11 VAL 90 21.071 1.065 -7.112 723 HG12 VAL 90 HG12 VAL 90 19.439 0.797 -7.764 724 HG13 VAL 90 HG13 VAL 90 19.962 2.426 -7.381 725 HG21 VAL 90 HG21 VAL 90 18.567 -0.348 -4.441 726 HG22 VAL 90 HG22 VAL 90 18.777 -0.779 -6.139 727 HG23 VAL 90 HG23 VAL 90 20.178 -0.765 -5.047 728 H SER 91 H SER 91 22.137 3.160 -6.028 729 HA SER 91 HA SER 91 22.735 5.267 -6.478 730 HB2 SER 91 HB2 SER 91 20.632 5.069 -7.802 731 HB3 SER 91 HB3 SER 91 19.743 5.796 -6.459 732 HG SER 91 HG SER 91 21.263 7.573 -6.666 733 HA PRO 92 HA PRO 92 21.579 6.341 -2.074 734 HB2 PRO 92 HB2 PRO 92 23.653 5.456 -0.580 735 HB3 PRO 92 HB3 PRO 92 22.498 4.347 -1.391 736 HG2 PRO 92 HG2 PRO 92 25.242 5.251 -2.411 737 HG3 PRO 92 HG3 PRO 92 24.659 3.579 -2.182 738 HD2 PRO 92 HD2 PRO 92 24.455 4.868 -4.582 739 HD3 PRO 92 HD3 PRO 92 23.248 3.691 -3.994 740 H ASN 93 H ASN 93 21.770 8.550 -3.103 741 HA ASN 93 HA ASN 93 24.165 10.001 -3.143 742 HB2 ASN 93 HB2 ASN 93 22.001 11.732 -2.115 743 HB3 ASN 93 HB3 ASN 93 23.021 11.957 -3.491 744 HD21 ASN 93 HD21 ASN 93 20.125 11.052 -2.285 745 HD22 ASN 93 HD22 ASN 93 19.197 10.514 -3.675 746 H GLU 94 H GLU 94 24.950 11.659 -1.800 747 HA GLU 94 HA GLU 94 25.864 10.468 0.524 748 HB2 GLU 94 HB2 GLU 94 27.184 12.051 -0.786 749 HB3 GLU 94 HB3 GLU 94 26.118 13.392 -0.310 750 HG2 GLU 94 HG2 GLU 94 26.689 13.154 1.996 751 HG3 GLU 94 HG3 GLU 94 27.585 11.648 1.715 752 H LYS 95 H LYS 95 23.218 12.801 0.249 753 HA LYS 95 HA LYS 95 23.278 13.753 2.932 754 HB2 LYS 95 HB2 LYS 95 22.240 14.862 0.939 755 HB3 LYS 95 HB3 LYS 95 20.948 13.693 0.942 756 HG2 LYS 95 HG2 LYS 95 21.631 15.504 3.342 757 HG3 LYS 95 HG3 LYS 95 20.616 16.028 2.015 758 HD2 LYS 95 HD2 LYS 95 18.876 15.355 3.168 759 HD3 LYS 95 HD3 LYS 95 19.317 13.711 2.740 760 HE2 LYS 95 HE2 LYS 95 19.905 13.140 4.807 761 HE3 LYS 95 HE3 LYS 95 20.720 14.686 5.144 762 HZ1 LYS 95 HZ1 LYS 95 18.781 14.378 6.550 763 HZ2 LYS 95 HZ2 LYS 95 18.525 15.658 5.551 764 HZ3 LYS 95 HZ3 LYS 95 17.802 14.207 5.242 765 H VAL 96 H VAL 96 21.564 11.073 1.292 766 HA VAL 96 HA VAL 96 20.238 10.354 3.742 767 HB VAL 96 HB VAL 96 20.440 9.091 1.015 768 HG11 VAL 96 HG11 VAL 96 20.585 7.108 2.378 769 HG12 VAL 96 HG12 VAL 96 19.415 7.769 3.554 770 HG13 VAL 96 HG13 VAL 96 18.892 7.283 1.951 771 HG21 VAL 96 HG21 VAL 96 18.683 10.844 1.890 772 HG22 VAL 96 HG22 VAL 96 18.142 9.437 0.950 773 HG23 VAL 96 HG23 VAL 96 17.949 9.456 2.703 774 H GLU 97 H GLU 97 23.339 9.358 2.183 775 HA GLU 97 HA GLU 97 23.775 7.003 3.699 776 HB2 GLU 97 HB2 GLU 97 25.533 8.907 2.139 777 HB3 GLU 97 HB3 GLU 97 26.296 7.779 3.233 778 HG2 GLU 97 HG2 GLU 97 24.442 6.205 1.773 779 HG3 GLU 97 HG3 GLU 97 25.149 7.316 0.611 780 H ARG 98 H ARG 98 24.230 10.436 4.528 781 HA ARG 98 HA ARG 98 25.870 10.347 6.669 782 HB2 ARG 98 HB2 ARG 98 24.246 12.043 5.224 783 HB3 ARG 98 HB3 ARG 98 23.289 12.006 6.674 784 HG2 ARG 98 HG2 ARG 98 26.243 12.452 6.841 785 HG3 ARG 98 HG3 ARG 98 25.064 13.596 6.165 786 HD2 ARG 98 HD2 ARG 98 23.871 13.626 8.338 787 HD3 ARG 98 HD3 ARG 98 25.120 12.522 9.001 788 HE ARG 98 HE ARG 98 26.219 14.860 7.690 789 HH11 ARG 98 HH11 ARG 98 24.748 13.921 10.781 790 HH12 ARG 98 HH12 ARG 98 25.742 15.056 11.691 791 HH21 ARG 98 HH21 ARG 98 27.342 16.410 8.884 792 HH22 ARG 98 HH22 ARG 98 27.214 16.448 10.619 793 H VAL 99 H VAL 99 22.443 10.198 6.540 794 HA VAL 99 HA VAL 99 22.044 9.807 9.291 795 HB VAL 99 HB VAL 99 20.092 9.160 7.008 796 HG11 VAL 99 HG11 VAL 99 19.361 8.713 9.412 797 HG12 VAL 99 HG12 VAL 99 19.554 10.449 9.721 798 HG13 VAL 99 HG13 VAL 99 18.350 9.898 8.555 799 HG21 VAL 99 HG21 VAL 99 19.419 11.580 7.230 800 HG22 VAL 99 HG22 VAL 99 21.012 11.799 8.056 801 HG23 VAL 99 HG23 VAL 99 20.946 11.176 6.387 802 H LEU 100 H LEU 100 22.096 7.695 6.411 803 HA LEU 100 HA LEU 100 21.255 5.307 7.692 804 HB2 LEU 100 HB2 LEU 100 23.070 5.579 5.295 805 HB3 LEU 100 HB3 LEU 100 22.307 4.155 5.835 806 HG LEU 100 HG LEU 100 21.288 6.391 4.278 807 HD11 LEU 100 HD11 LEU 100 19.917 3.724 4.563 808 HD12 LEU 100 HD12 LEU 100 19.765 4.928 3.269 809 HD13 LEU 100 HD13 LEU 100 21.295 4.053 3.477 810 HD21 LEU 100 HD21 LEU 100 19.439 5.555 6.530 811 HD22 LEU 100 HD22 LEU 100 19.830 7.191 5.935 812 HD23 LEU 100 HD23 LEU 100 18.813 6.131 4.989 813 H SER 101 H SER 101 24.074 7.191 8.131 814 HA SER 101 HA SER 101 25.623 4.805 9.087 815 HB2 SER 101 HB2 SER 101 26.287 7.692 8.549 816 HB3 SER 101 HB3 SER 101 27.116 6.942 9.907 817 HG SER 101 HG SER 101 26.892 5.754 7.332 818 H LEU 102 H LEU 102 24.172 7.791 10.225 819 HA LEU 102 HA LEU 102 24.655 7.686 13.006 820 HB2 LEU 102 HB2 LEU 102 22.317 8.903 11.489 821 HB3 LEU 102 HB3 LEU 102 22.756 9.157 13.154 822 HG LEU 102 HG LEU 102 23.646 10.605 10.841 823 HD11 LEU 102 HD11 LEU 102 24.351 10.660 13.768 824 HD12 LEU 102 HD12 LEU 102 24.617 12.026 12.642 825 HD13 LEU 102 HD13 LEU 102 22.959 11.499 13.013 826 HD21 LEU 102 HD21 LEU 102 26.066 10.806 11.357 827 HD22 LEU 102 HD22 LEU 102 25.939 9.417 12.461 828 HD23 LEU 102 HD23 LEU 102 25.694 9.230 10.711 829 H THR 103 H THR 103 21.732 6.838 11.187 830 HA THR 103 HA THR 103 20.253 5.890 13.418 831 HB THR 103 HB THR 103 19.744 7.260 11.253 832 HG1 THR 103 HG1 THR 103 17.919 5.483 12.429 833 HG21 THR 103 HG21 THR 103 19.107 6.293 9.312 834 HG22 THR 103 HG22 THR 103 20.417 5.222 9.772 835 HG23 THR 103 HG23 THR 103 18.742 4.706 10.064 836 H ASN 104 H ASN 104 22.626 4.413 11.603 837 HA ASN 104 HA ASN 104 23.267 2.394 10.913 838 HB2 ASN 104 HB2 ASN 104 21.706 1.424 13.322 839 HB3 ASN 104 HB3 ASN 104 22.605 0.370 12.267 840 HD21 ASN 104 HD21 ASN 104 23.413 3.651 13.768 841 HD22 ASN 104 HD22 ASN 104 24.940 3.090 14.365 842 H LEU 105 H LEU 105 22.079 2.912 9.027 843 HA LEU 105 HA LEU 105 19.757 1.056 8.534 844 HB2 LEU 105 HB2 LEU 105 19.823 3.740 8.077 845 HB3 LEU 105 HB3 LEU 105 20.563 3.191 6.600 846 HG LEU 105 HG LEU 105 18.321 3.538 6.089 847 HD11 LEU 105 HD11 LEU 105 18.369 0.590 6.679 848 HD12 LEU 105 HD12 LEU 105 17.446 1.431 5.412 849 HD13 LEU 105 HD13 LEU 105 19.215 1.348 5.307 850 HD21 LEU 105 HD21 LEU 105 16.449 2.670 7.376 851 HD22 LEU 105 HD22 LEU 105 17.597 2.048 8.604 852 HD23 LEU 105 HD23 LEU 105 17.461 3.787 8.297 853 H ASP 106 H ASP 106 22.653 2.474 6.960 854 HA ASP 106 HA ASP 106 23.197 0.391 5.049 855 HB2 ASP 106 HB2 ASP 106 23.894 2.632 4.647 856 HB3 ASP 106 HB3 ASP 106 24.584 2.753 6.250 857 H ARG 107 H ARG 107 23.698 0.527 8.448 858 HA ARG 107 HA ARG 107 25.743 -1.573 8.371 859 HB2 ARG 107 HB2 ARG 107 24.307 -0.346 10.762 860 HB3 ARG 107 HB3 ARG 107 25.772 -1.336 10.780 861 HG2 ARG 107 HG2 ARG 107 26.750 0.445 9.142 862 HG3 ARG 107 HG3 ARG 107 25.442 1.499 9.698 863 HD2 ARG 107 HD2 ARG 107 26.284 1.675 11.832 864 HD3 ARG 107 HD3 ARG 107 27.180 0.153 11.760 865 HE ARG 107 HE ARG 107 28.068 2.791 10.913 866 HH11 ARG 107 HH11 ARG 107 28.643 -0.685 10.310 867 HH12 ARG 107 HH12 ARG 107 29.822 -0.314 9.078 868 HH21 ARG 107 HH21 ARG 107 29.937 3.113 9.738 869 HH22 ARG 107 HH22 ARG 107 30.862 1.817 9.075 870 H ILE 108 H ILE 108 22.554 -1.673 7.749 871 HA ILE 108 HA ILE 108 22.206 -4.336 8.984 872 HB ILE 108 HB ILE 108 20.071 -2.165 8.740 873 HG12 ILE 108 HG12 ILE 108 21.856 -2.936 11.070 874 HG13 ILE 108 HG13 ILE 108 21.609 -1.345 10.365 875 HG21 ILE 108 HG21 ILE 108 20.069 -4.821 10.233 876 HG22 ILE 108 HG22 ILE 108 18.735 -3.648 10.150 877 HG23 ILE 108 HG23 ILE 108 19.229 -4.496 8.695 878 HD11 ILE 108 HD11 ILE 108 19.212 -1.420 11.190 879 HD12 ILE 108 HD12 ILE 108 19.672 -2.862 12.134 880 HD13 ILE 108 HD13 ILE 108 20.474 -1.312 12.428 881 H VAL 109 H VAL 109 21.304 -2.034 6.303 882 HA VAL 109 HA VAL 109 20.393 -4.333 4.680 883 HB VAL 109 HB VAL 109 19.830 -1.470 4.009 884 HG11 VAL 109 HG11 VAL 109 17.755 -2.341 3.045 885 HG12 VAL 109 HG12 VAL 109 19.194 -3.081 2.407 886 HG13 VAL 109 HG13 VAL 109 18.218 -3.982 3.597 887 HG21 VAL 109 HG21 VAL 109 18.325 -2.976 6.141 888 HG22 VAL 109 HG22 VAL 109 19.087 -1.402 6.278 889 HG23 VAL 109 HG23 VAL 109 17.635 -1.571 5.277 890 H LYS 110 H LYS 110 21.304 -4.440 2.615 891 HA LYS 110 HA LYS 110 23.975 -3.383 2.202 892 HB2 LYS 110 HB2 LYS 110 22.042 -5.096 0.664 893 HB3 LYS 110 HB3 LYS 110 23.439 -4.400 -0.123 894 HG2 LYS 110 HG2 LYS 110 24.712 -5.303 2.116 895 HG3 LYS 110 HG3 LYS 110 23.369 -6.435 2.100 896 HD2 LYS 110 HD2 LYS 110 24.255 -7.546 0.344 897 HD3 LYS 110 HD3 LYS 110 24.572 -6.111 -0.557 898 HE2 LYS 110 HE2 LYS 110 26.326 -6.876 1.746 899 HE3 LYS 110 HE3 LYS 110 26.593 -7.483 0.108 900 HZ1 LYS 110 HZ1 LYS 110 26.900 -5.236 -0.655 901 HZ2 LYS 110 HZ2 LYS 110 26.724 -4.625 0.870 902 HZ3 LYS 110 HZ3 LYS 110 27.965 -5.631 0.493 903 H ILE 111 H ILE 111 24.683 -2.169 0.343 904 HA ILE 111 HA ILE 111 22.702 -0.424 -0.887 905 HB ILE 111 HB ILE 111 24.893 0.388 0.882 906 HG12 ILE 111 HG12 ILE 111 23.997 2.766 0.116 907 HG13 ILE 111 HG13 ILE 111 22.696 1.825 -0.615 908 HG21 ILE 111 HG21 ILE 111 26.373 0.411 -1.029 909 HG22 ILE 111 HG22 ILE 111 25.253 1.468 -1.911 910 HG23 ILE 111 HG23 ILE 111 26.057 2.034 -0.442 911 HD11 ILE 111 HD11 ILE 111 23.565 1.891 2.316 912 HD12 ILE 111 HD12 ILE 111 22.063 2.517 1.640 913 HD13 ILE 111 HD13 ILE 111 22.366 0.760 1.660 914 H TYR 112 H TYR 112 23.277 0.079 -3.118 915 HA TYR 112 HA TYR 112 25.696 -1.108 -4.268 916 HB2 TYR 112 HB2 TYR 112 22.831 -1.650 -5.166 917 HB3 TYR 112 HB3 TYR 112 24.244 -1.986 -6.158 918 HD1 TYR 112 HD1 TYR 112 22.391 -2.971 -3.139 919 HD2 TYR 112 HD2 TYR 112 25.787 -3.808 -5.632 920 HE1 TYR 112 HE1 TYR 112 22.569 -5.342 -2.168 921 HE2 TYR 112 HE2 TYR 112 25.983 -6.050 -4.677 922 HH TYR 112 HH TYR 112 25.283 -7.305 -2.729 923 H ASP 113 H ASP 113 26.012 -0.216 -6.554 924 HA ASP 113 HA ASP 113 25.189 2.606 -6.452 925 HB2 ASP 113 HB2 ASP 113 27.472 1.416 -7.465 926 HB3 ASP 113 HB3 ASP 113 26.581 1.609 -8.913 927 H THR 114 H THR 114 24.834 -0.149 -8.671 928 HA THR 114 HA THR 114 22.512 1.155 -9.998 929 HB THR 114 HB THR 114 23.427 0.191 -12.091 930 HG1 THR 114 HG1 THR 114 25.979 -0.074 -11.133 931 HG21 THR 114 HG21 THR 114 23.981 2.530 -11.523 932 HG22 THR 114 HG22 THR 114 25.459 1.982 -10.673 933 HG23 THR 114 HG23 THR 114 25.287 1.733 -12.431 934 H ILE 115 H ILE 115 21.250 -0.528 -11.269 935 HA ILE 115 HA ILE 115 20.308 -2.448 -9.321 936 HB ILE 115 HB ILE 115 19.595 -1.797 -12.188 937 HG12 ILE 115 HG12 ILE 115 18.979 -0.029 -10.611 938 HG13 ILE 115 HG13 ILE 115 17.555 -0.899 -11.152 939 HG21 ILE 115 HG21 ILE 115 18.427 -3.786 -10.237 940 HG22 ILE 115 HG22 ILE 115 17.516 -3.196 -11.665 941 HG23 ILE 115 HG23 ILE 115 19.017 -4.125 -11.865 942 HD11 ILE 115 HD11 ILE 115 18.854 -1.233 -8.436 943 HD12 ILE 115 HD12 ILE 115 17.363 -0.365 -8.802 944 HD13 ILE 115 HD13 ILE 115 17.449 -2.127 -9.013 945 H SER 116 H SER 116 22.395 -2.608 -12.275 946 HA SER 116 HA SER 116 22.121 -5.424 -12.206 947 HB2 SER 116 HB2 SER 116 22.621 -3.959 -14.166 948 HB3 SER 116 HB3 SER 116 24.316 -3.927 -13.640 949 HG SER 116 HG SER 116 24.218 -6.305 -13.848 950 H GLU 117 H GLU 117 24.244 -3.183 -10.391 951 HA GLU 117 HA GLU 117 26.230 -5.109 -9.741 952 HB2 GLU 117 HB2 GLU 117 25.725 -2.337 -9.434 953 HB3 GLU 117 HB3 GLU 117 25.608 -2.955 -7.793 954 HG2 GLU 117 HG2 GLU 117 27.842 -3.960 -7.991 955 HG3 GLU 117 HG3 GLU 117 27.871 -3.532 -9.723 956 H ALA 118 H ALA 118 22.892 -4.749 -8.936 957 HA ALA 118 HA ALA 118 23.244 -5.832 -6.183 958 HB1 ALA 118 HB1 ALA 118 21.142 -4.829 -5.689 959 HB2 ALA 118 HB2 ALA 118 22.194 -3.652 -6.444 960 HB3 ALA 118 HB3 ALA 118 20.873 -4.359 -7.404 961 H MET 119 H MET 119 21.492 -6.150 -9.255 962 HA MET 119 HA MET 119 19.513 -7.755 -8.489 963 HB2 MET 119 HB2 MET 119 20.191 -6.605 -10.873 964 HB3 MET 119 HB3 MET 119 20.777 -8.207 -11.212 965 HG2 MET 119 HG2 MET 119 18.307 -8.755 -10.054 966 HG3 MET 119 HG3 MET 119 18.026 -7.179 -10.758 967 HE1 MET 119 HE1 MET 119 18.166 -6.673 -13.357 968 HE2 MET 119 HE2 MET 119 19.794 -7.376 -13.513 969 HE3 MET 119 HE3 MET 119 18.492 -7.903 -14.598 970 H GLU 120 H GLU 120 22.702 -8.923 -9.635 971 HA GLU 120 HA GLU 120 21.951 -11.781 -9.081 972 HB2 GLU 120 HB2 GLU 120 23.890 -12.349 -10.315 973 HB3 GLU 120 HB3 GLU 120 23.004 -11.157 -11.270 974 HG2 GLU 120 HG2 GLU 120 24.576 -9.373 -10.472 975 HG3 GLU 120 HG3 GLU 120 25.468 -10.582 -9.537 976 H GLU 121 H GLU 121 23.318 -9.140 -7.434 977 HA GLU 121 HA GLU 121 25.314 -10.817 -6.082 978 HB2 GLU 121 HB2 GLU 121 25.780 -8.511 -6.967 979 HB3 GLU 121 HB3 GLU 121 24.826 -7.872 -5.628 980 HG2 GLU 121 HG2 GLU 121 26.311 -8.740 -3.983 981 HG3 GLU 121 HG3 GLU 121 26.979 -9.941 -5.071 982 H VAL 122 H VAL 122 22.589 -8.693 -5.202 983 HA VAL 122 HA VAL 122 22.245 -9.325 -2.492 984 HB VAL 122 HB VAL 122 20.972 -7.739 -4.174 985 HG11 VAL 122 HG11 VAL 122 19.014 -10.076 -4.001 986 HG12 VAL 122 HG12 VAL 122 18.609 -8.441 -4.498 987 HG13 VAL 122 HG13 VAL 122 19.728 -9.379 -5.487 988 HG21 VAL 122 HG21 VAL 122 20.201 -8.965 -1.569 989 HG22 VAL 122 HG22 VAL 122 20.890 -7.382 -1.921 990 HG23 VAL 122 HG23 VAL 122 19.172 -7.699 -2.280 991 H ARG 123 H ARG 123 21.338 -11.319 -5.291 992 HA ARG 123 HA ARG 123 19.891 -13.330 -3.896 993 HB2 ARG 123 HB2 ARG 123 21.571 -13.457 -6.445 994 HB3 ARG 123 HB3 ARG 123 20.665 -14.837 -5.815 995 HG2 ARG 123 HG2 ARG 123 18.572 -13.543 -5.911 996 HG3 ARG 123 HG3 ARG 123 19.430 -12.162 -6.583 997 HD2 ARG 123 HD2 ARG 123 19.816 -14.717 -8.095 998 HD3 ARG 123 HD3 ARG 123 18.144 -14.150 -8.036 999 HE ARG 123 HE ARG 123 19.501 -11.893 -8.679 1000 HH11 ARG 123 HH11 ARG 123 19.142 -15.050 -10.351 1001 HH12 ARG 123 HH12 ARG 123 19.525 -14.354 -11.895 1002 HH21 ARG 123 HH21 ARG 123 19.914 -11.081 -10.741 1003 HH22 ARG 123 HH22 ARG 123 20.069 -12.167 -12.097 1004 H ARG 124 H ARG 124 23.405 -12.789 -4.042 1005 HA ARG 124 HA ARG 124 23.747 -14.994 -2.147 1006 HB2 ARG 124 HB2 ARG 124 25.733 -14.663 -4.418 1007 HB3 ARG 124 HB3 ARG 124 25.513 -16.036 -3.361 1008 HG2 ARG 124 HG2 ARG 124 24.391 -17.096 -4.944 1009 HG3 ARG 124 HG3 ARG 124 23.124 -15.896 -4.955 1010 HD2 ARG 124 HD2 ARG 124 24.115 -14.615 -6.691 1011 HD3 ARG 124 HD3 ARG 124 25.715 -15.331 -6.439 1012 HE ARG 124 HE ARG 124 23.819 -16.196 -8.282 1013 HH11 ARG 124 HH11 ARG 124 26.095 -17.785 -5.939 1014 HH12 ARG 124 HH12 ARG 124 26.237 -19.163 -6.989 1015 HH21 ARG 124 HH21 ARG 124 24.285 -18.009 -9.592 1016 HH22 ARG 124 HH22 ARG 124 25.167 -19.345 -8.906 1017 H LYS 125 H LYS 125 23.797 -12.173 -1.842 1018 HA LYS 125 HA LYS 125 26.325 -11.078 -1.823 1019 HB2 LYS 125 HB2 LYS 125 25.322 -9.212 -0.652 1020 HB3 LYS 125 HB3 LYS 125 24.079 -9.968 -1.598 1021 HG2 LYS 125 HG2 LYS 125 22.942 -9.810 0.365 1022 HG3 LYS 125 HG3 LYS 125 23.606 -11.440 0.560 1023 HD2 LYS 125 HD2 LYS 125 25.619 -9.648 1.547 1024 HD3 LYS 125 HD3 LYS 125 24.109 -8.907 2.070 1025 HE2 LYS 125 HE2 LYS 125 23.498 -11.010 3.226 1026 HE3 LYS 125 HE3 LYS 125 25.014 -11.721 2.656 1027 HZ1 LYS 125 HZ1 LYS 125 26.201 -10.021 3.817 1028 HZ2 LYS 125 HZ2 LYS 125 24.822 -9.380 4.457 1029 HZ3 LYS 125 HZ3 LYS 125 25.331 -10.926 4.843 Start of MODEL 16 1 H1 MET 1 H1 MET 1 5.897 14.965 9.515 2 HA MET 1 HA MET 1 5.779 14.848 11.923 3 HB2 MET 1 HB2 MET 1 8.634 15.833 11.714 4 HB3 MET 1 HB3 MET 1 7.666 16.110 13.167 5 HG2 MET 1 HG2 MET 1 7.137 13.684 13.268 6 HG3 MET 1 HG3 MET 1 8.245 13.398 11.916 7 HE1 MET 1 HE1 MET 1 8.004 12.413 15.165 8 HE2 MET 1 HE2 MET 1 9.022 11.551 13.993 9 HE3 MET 1 HE3 MET 1 9.723 12.156 15.515 10 H GLY 2 H GLY 2 5.279 16.741 13.397 11 HA2 GLY 2 HA2 GLY 2 4.219 18.773 13.632 12 HA3 GLY 2 HA3 GLY 2 5.055 19.361 12.180 13 H SER 3 H SER 3 2.893 20.374 11.692 14 HA SER 3 HA SER 3 0.481 19.053 11.809 15 HB2 SER 3 HB2 SER 3 1.101 21.417 10.014 16 HB3 SER 3 HB3 SER 3 -0.433 21.013 10.801 17 HG SER 3 HG SER 3 1.000 21.225 12.838 18 H ASP 4 H ASP 4 0.427 17.064 10.757 19 HA ASP 4 HA ASP 4 1.051 16.393 8.169 20 HB2 ASP 4 HB2 ASP 4 -1.046 15.402 10.115 21 HB3 ASP 4 HB3 ASP 4 -1.049 14.796 8.461 22 H LYS 5 H LYS 5 -2.038 17.797 9.283 23 HA LYS 5 HA LYS 5 -3.980 18.304 8.253 24 HB2 LYS 5 HB2 LYS 5 -2.070 19.210 6.083 25 HB3 LYS 5 HB3 LYS 5 -3.794 19.428 5.915 26 HG2 LYS 5 HG2 LYS 5 -2.313 20.527 8.345 27 HG3 LYS 5 HG3 LYS 5 -2.398 21.357 6.796 28 HD2 LYS 5 HD2 LYS 5 -4.168 22.344 7.832 29 HD3 LYS 5 HD3 LYS 5 -4.988 21.043 6.980 30 HE2 LYS 5 HE2 LYS 5 -4.827 19.719 9.229 31 HE3 LYS 5 HE3 LYS 5 -4.251 21.228 9.934 32 HZ1 LYS 5 HZ1 LYS 5 -6.907 20.561 8.936 33 HZ2 LYS 5 HZ2 LYS 5 -6.489 21.347 10.297 34 HZ3 LYS 5 HZ3 LYS 5 -6.439 22.125 8.828 35 H ILE 6 H ILE 6 -5.034 17.991 5.751 36 HA ILE 6 HA ILE 6 -4.824 15.125 5.077 37 HB ILE 6 HB ILE 6 -7.309 14.929 5.256 38 HG12 ILE 6 HG12 ILE 6 -7.160 17.507 6.893 39 HG13 ILE 6 HG13 ILE 6 -7.803 17.388 5.253 40 HG21 ILE 6 HG21 ILE 6 -5.692 14.093 6.999 41 HG22 ILE 6 HG22 ILE 6 -6.035 15.555 7.944 42 HG23 ILE 6 HG23 ILE 6 -7.329 14.390 7.586 43 HD11 ILE 6 HD11 ILE 6 -9.635 17.392 6.835 44 HD12 ILE 6 HD12 ILE 6 -9.543 15.790 6.073 45 HD13 ILE 6 HD13 ILE 6 -8.946 16.034 7.733 46 H HIS 7 H HIS 7 -4.066 17.688 3.768 47 HA HIS 7 HA HIS 7 -5.994 18.083 1.578 48 HB2 HIS 7 HB2 HIS 7 -3.310 19.341 2.219 49 HB3 HIS 7 HB3 HIS 7 -4.293 19.733 0.812 50 HD1 HIS 7 HD1 HIS 7 -7.172 19.806 2.473 51 HD2 HIS 7 HD2 HIS 7 -3.523 21.737 3.364 52 HE1 HIS 7 HE1 HIS 7 -7.764 21.821 3.853 53 H HIS 8 H HIS 8 -6.078 16.280 0.439 54 HA HIS 8 HA HIS 8 -4.111 14.355 -0.003 55 HB2 HIS 8 HB2 HIS 8 -6.533 14.033 -0.212 56 HB3 HIS 8 HB3 HIS 8 -6.593 15.105 -1.606 57 HD1 HIS 8 HD1 HIS 8 -6.258 11.481 -0.777 58 HD2 HIS 8 HD2 HIS 8 -5.272 14.157 -3.897 59 HE1 HIS 8 HE1 HIS 8 -6.094 10.108 -2.889 60 H HIS 9 H HIS 9 -2.199 14.669 -1.011 61 HA HIS 9 HA HIS 9 -2.053 15.866 -3.675 62 HB2 HIS 9 HB2 HIS 9 -1.532 17.771 -2.317 63 HB3 HIS 9 HB3 HIS 9 -0.601 16.808 -1.167 64 HD1 HIS 9 HD1 HIS 9 1.952 16.160 -1.861 65 HD2 HIS 9 HD2 HIS 9 -0.209 18.689 -4.475 66 HE1 HIS 9 HE1 HIS 9 3.654 17.277 -3.360 67 H HIS 10 H HIS 10 -0.373 14.908 -4.826 68 HA HIS 10 HA HIS 10 1.704 13.483 -3.480 69 HB2 HIS 10 HB2 HIS 10 1.472 11.347 -4.511 70 HB3 HIS 10 HB3 HIS 10 -0.026 11.681 -3.670 71 HD1 HIS 10 HD1 HIS 10 -1.185 13.478 -6.368 72 HD2 HIS 10 HD2 HIS 10 0.311 9.554 -6.027 73 HE1 HIS 10 HE1 HIS 10 -2.109 12.185 -8.346 74 H HIS 11 H HIS 11 3.235 12.581 -5.266 75 HA HIS 11 HA HIS 11 3.351 14.488 -7.562 76 HB2 HIS 11 HB2 HIS 11 5.480 12.969 -6.013 77 HB3 HIS 11 HB3 HIS 11 5.755 13.540 -7.638 78 HD1 HIS 11 HD1 HIS 11 6.552 15.978 -7.897 79 HD2 HIS 11 HD2 HIS 11 4.889 15.085 -4.141 80 HE1 HIS 11 HE1 HIS 11 7.022 17.989 -6.408 81 H HIS 12 H HIS 12 4.134 13.337 -9.580 82 HA HIS 12 HA HIS 12 3.860 10.420 -9.608 83 HB2 HIS 12 HB2 HIS 12 1.606 11.545 -10.118 84 HB3 HIS 12 HB3 HIS 12 2.339 12.184 -11.579 85 HD1 HIS 12 HD1 HIS 12 0.835 10.809 -13.236 86 HD2 HIS 12 HD2 HIS 12 2.669 8.514 -10.216 87 HE1 HIS 12 HE1 HIS 12 0.351 8.381 -13.799 88 H MET 13 H MET 13 6.113 10.390 -9.886 89 HA MET 13 HA MET 13 7.044 11.166 -12.590 90 HB2 MET 13 HB2 MET 13 8.713 11.336 -10.049 91 HB3 MET 13 HB3 MET 13 9.337 11.420 -11.684 92 HG2 MET 13 HG2 MET 13 9.164 13.626 -11.349 93 HG3 MET 13 HG3 MET 13 7.553 13.339 -11.958 94 HE1 MET 13 HE1 MET 13 7.454 15.889 -10.966 95 HE2 MET 13 HE2 MET 13 5.986 14.905 -11.143 96 HE3 MET 13 HE3 MET 13 6.207 15.910 -9.696 97 H PHE 14 H PHE 14 9.474 9.647 -12.394 98 HA PHE 14 HA PHE 14 8.585 7.119 -13.227 99 HB2 PHE 14 HB2 PHE 14 11.206 8.357 -12.448 100 HB3 PHE 14 HB3 PHE 14 11.134 6.621 -12.451 101 HD1 PHE 14 HD1 PHE 14 9.806 5.606 -14.674 102 HD2 PHE 14 HD2 PHE 14 12.117 9.240 -14.426 103 HE1 PHE 14 HE1 PHE 14 10.250 5.487 -17.097 104 HE2 PHE 14 HE2 PHE 14 12.588 9.086 -16.852 105 HZ PHE 14 HZ PHE 14 11.647 7.237 -18.202 106 HA PRO 15 HA PRO 15 8.010 5.666 -8.961 107 HB2 PRO 15 HB2 PRO 15 6.114 3.807 -9.282 108 HB3 PRO 15 HB3 PRO 15 5.720 5.509 -9.615 109 HG2 PRO 15 HG2 PRO 15 6.491 3.390 -11.641 110 HG3 PRO 15 HG3 PRO 15 5.105 4.539 -11.700 111 HD2 PRO 15 HD2 PRO 15 7.598 4.969 -12.911 112 HD3 PRO 15 HD3 PRO 15 6.490 6.268 -12.411 113 H TYR 16 H TYR 16 7.629 3.154 -8.309 114 HA TYR 16 HA TYR 16 9.963 1.721 -8.548 115 HB2 TYR 16 HB2 TYR 16 8.821 0.041 -7.379 116 HB3 TYR 16 HB3 TYR 16 7.963 1.521 -6.948 117 HD1 TYR 16 HD1 TYR 16 7.800 -1.713 -8.752 118 HD2 TYR 16 HD2 TYR 16 5.611 1.844 -7.625 119 HE1 TYR 16 HE1 TYR 16 5.711 -2.752 -9.528 120 HE2 TYR 16 HE2 TYR 16 3.526 0.762 -8.313 121 HH TYR 16 HH TYR 16 3.453 -2.442 -9.952 122 H LYS 17 H LYS 17 10.438 -0.311 -9.509 123 HA LYS 17 HA LYS 17 8.959 -1.079 -11.969 124 HB2 LYS 17 HB2 LYS 17 11.375 -0.015 -12.266 125 HB3 LYS 17 HB3 LYS 17 11.916 -1.536 -11.537 126 HG2 LYS 17 HG2 LYS 17 10.337 -2.524 -13.431 127 HG3 LYS 17 HG3 LYS 17 10.732 -1.021 -14.218 128 HD2 LYS 17 HD2 LYS 17 12.811 -2.896 -13.060 129 HD3 LYS 17 HD3 LYS 17 12.099 -3.232 -14.636 130 HE2 LYS 17 HE2 LYS 17 13.509 -0.631 -13.940 131 HE3 LYS 17 HE3 LYS 17 14.297 -2.025 -14.715 132 HZ1 LYS 17 HZ1 LYS 17 13.712 -0.719 -16.444 133 HZ2 LYS 17 HZ2 LYS 17 12.455 -1.772 -16.446 134 HZ3 LYS 17 HZ3 LYS 17 12.258 -0.253 -15.814 135 H ILE 18 H ILE 18 9.422 -3.422 -12.411 136 HA ILE 18 HA ILE 18 10.550 -5.045 -10.278 137 HB ILE 18 HB ILE 18 8.124 -5.888 -11.912 138 HG12 ILE 18 HG12 ILE 18 8.136 -5.195 -8.946 139 HG13 ILE 18 HG13 ILE 18 7.426 -4.203 -10.218 140 HG21 ILE 18 HG21 ILE 18 9.480 -7.238 -9.522 141 HG22 ILE 18 HG22 ILE 18 8.163 -7.886 -10.529 142 HG23 ILE 18 HG23 ILE 18 9.759 -7.689 -11.218 143 HD11 ILE 18 HD11 ILE 18 5.899 -6.101 -10.818 144 HD12 ILE 18 HD12 ILE 18 6.469 -6.945 -9.353 145 HD13 ILE 18 HD13 ILE 18 5.635 -5.392 -9.217 146 H VAL 19 H VAL 19 12.213 -6.275 -11.281 147 HA VAL 19 HA VAL 19 12.498 -6.182 -14.218 148 HB VAL 19 HB VAL 19 14.776 -7.034 -13.724 149 HG11 VAL 19 HG11 VAL 19 14.143 -4.435 -12.349 150 HG12 VAL 19 HG12 VAL 19 15.723 -4.942 -12.972 151 HG13 VAL 19 HG13 VAL 19 14.377 -4.649 -14.084 152 HG21 VAL 19 HG21 VAL 19 15.757 -6.910 -11.515 153 HG22 VAL 19 HG22 VAL 19 14.221 -6.436 -10.813 154 HG23 VAL 19 HG23 VAL 19 14.425 -8.063 -11.485 155 H ASP 20 H ASP 20 14.135 -8.842 -13.858 156 HA ASP 20 HA ASP 20 12.548 -10.804 -14.488 157 HB2 ASP 20 HB2 ASP 20 14.915 -11.034 -14.428 158 HB3 ASP 20 HB3 ASP 20 14.989 -10.719 -12.698 159 H ASP 21 H ASP 21 13.704 -10.848 -11.086 160 HA ASP 21 HA ASP 21 10.911 -11.151 -10.138 161 HB2 ASP 21 HB2 ASP 21 11.184 -13.168 -9.430 162 HB3 ASP 21 HB3 ASP 21 12.611 -13.295 -10.447 163 H VAL 22 H VAL 22 13.225 -9.007 -10.033 164 HA VAL 22 HA VAL 22 13.069 -8.632 -7.089 165 HB VAL 22 HB VAL 22 15.169 -7.387 -8.923 166 HG11 VAL 22 HG11 VAL 22 16.130 -7.331 -6.412 167 HG12 VAL 22 HG12 VAL 22 15.188 -6.009 -7.147 168 HG13 VAL 22 HG13 VAL 22 14.435 -7.139 -6.048 169 HG21 VAL 22 HG21 VAL 22 15.585 -9.758 -8.971 170 HG22 VAL 22 HG22 VAL 22 16.699 -9.054 -7.806 171 HG23 VAL 22 HG23 VAL 22 15.254 -9.935 -7.249 172 H VAL 23 H VAL 23 12.057 -6.878 -6.295 173 HA VAL 23 HA VAL 23 10.659 -5.028 -8.133 174 HB VAL 23 HB VAL 23 10.711 -5.088 -5.098 175 HG11 VAL 23 HG11 VAL 23 8.581 -3.912 -5.253 176 HG12 VAL 23 HG12 VAL 23 9.830 -2.998 -6.076 177 HG13 VAL 23 HG13 VAL 23 8.651 -3.932 -7.024 178 HG21 VAL 23 HG21 VAL 23 8.639 -6.324 -5.140 179 HG22 VAL 23 HG22 VAL 23 8.716 -6.522 -6.902 180 HG23 VAL 23 HG23 VAL 23 9.912 -7.297 -5.830 181 H ILE 24 H ILE 24 11.198 -2.785 -8.176 182 HA ILE 24 HA ILE 24 13.591 -1.863 -6.652 183 HB ILE 24 HB ILE 24 12.935 -1.379 -9.641 184 HG12 ILE 24 HG12 ILE 24 15.354 -2.159 -9.905 185 HG13 ILE 24 HG13 ILE 24 15.247 -2.813 -8.265 186 HG21 ILE 24 HG21 ILE 24 13.828 0.619 -8.441 187 HG22 ILE 24 HG22 ILE 24 15.181 -0.323 -7.836 188 HG23 ILE 24 HG23 ILE 24 15.013 0.017 -9.582 189 HD11 ILE 24 HD11 ILE 24 13.786 -4.505 -8.995 190 HD12 ILE 24 HD12 ILE 24 13.337 -3.619 -10.481 191 HD13 ILE 24 HD13 ILE 24 14.977 -4.340 -10.264 192 H LEU 25 H LEU 25 12.112 -0.738 -5.040 193 HA LEU 25 HA LEU 25 10.085 1.074 -6.031 194 HB2 LEU 25 HB2 LEU 25 11.467 0.781 -3.340 195 HB3 LEU 25 HB3 LEU 25 10.191 1.911 -3.708 196 HG LEU 25 HG LEU 25 9.007 0.333 -2.706 197 HD11 LEU 25 HD11 LEU 25 7.590 -0.838 -4.199 198 HD12 LEU 25 HD12 LEU 25 8.093 0.603 -5.042 199 HD13 LEU 25 HD13 LEU 25 8.837 -0.971 -5.437 200 HD21 LEU 25 HD21 LEU 25 9.127 -2.111 -2.912 201 HD22 LEU 25 HD22 LEU 25 10.580 -1.907 -3.911 202 HD23 LEU 25 HD23 LEU 25 10.543 -1.352 -2.206 203 H MET 26 H MET 26 10.630 2.944 -7.158 204 HA MET 26 HA MET 26 13.341 4.215 -6.680 205 HB2 MET 26 HB2 MET 26 11.378 4.582 -8.994 206 HB3 MET 26 HB3 MET 26 13.018 5.218 -8.821 207 HG2 MET 26 HG2 MET 26 13.451 2.573 -8.554 208 HG3 MET 26 HG3 MET 26 12.005 2.516 -9.533 209 HE1 MET 26 HE1 MET 26 12.301 1.954 -11.795 210 HE2 MET 26 HE2 MET 26 13.835 1.999 -12.691 211 HE3 MET 26 HE3 MET 26 13.705 1.035 -11.189 212 HA PRO 27 HA PRO 27 9.710 6.677 -4.864 213 HB2 PRO 27 HB2 PRO 27 10.835 7.752 -2.646 214 HB3 PRO 27 HB3 PRO 27 10.358 6.020 -2.762 215 HG2 PRO 27 HG2 PRO 27 13.108 7.266 -3.128 216 HG3 PRO 27 HG3 PRO 27 12.662 5.817 -2.167 217 HD2 PRO 27 HD2 PRO 27 13.618 5.703 -4.792 218 HD3 PRO 27 HD3 PRO 27 12.539 4.488 -4.085 219 H ASN 28 H ASN 28 9.180 8.556 -5.911 220 HA ASN 28 HA ASN 28 11.270 10.588 -6.384 221 HB2 ASN 28 HB2 ASN 28 9.654 11.668 -7.881 222 HB3 ASN 28 HB3 ASN 28 10.086 10.036 -8.315 223 HD21 ASN 28 HD21 ASN 28 7.501 11.579 -6.278 224 HD22 ASN 28 HD22 ASN 28 6.253 10.503 -6.864 225 H LYS 29 H LYS 29 11.509 11.022 -4.098 226 HA LYS 29 HA LYS 29 11.198 12.264 -2.203 227 HB2 LYS 29 HB2 LYS 29 9.301 14.263 -3.316 228 HB3 LYS 29 HB3 LYS 29 10.656 14.445 -2.251 229 HG2 LYS 29 HG2 LYS 29 11.630 15.480 -3.963 230 HG3 LYS 29 HG3 LYS 29 11.996 13.885 -4.553 231 HD2 LYS 29 HD2 LYS 29 9.288 14.721 -5.397 232 HD3 LYS 29 HD3 LYS 29 10.459 15.949 -5.816 233 HE2 LYS 29 HE2 LYS 29 10.881 13.021 -6.485 234 HE3 LYS 29 HE3 LYS 29 9.944 14.068 -7.522 235 HZ1 LYS 29 HZ1 LYS 29 12.826 14.184 -6.839 236 HZ2 LYS 29 HZ2 LYS 29 12.093 14.161 -8.329 237 HZ3 LYS 29 HZ3 LYS 29 12.097 15.537 -7.414 238 H GLU 30 H GLU 30 9.112 10.153 -2.997 239 HA GLU 30 HA GLU 30 6.642 11.328 -1.954 240 HB2 GLU 30 HB2 GLU 30 5.532 9.610 -3.149 241 HB3 GLU 30 HB3 GLU 30 6.745 10.355 -4.189 242 HG2 GLU 30 HG2 GLU 30 8.323 8.427 -3.570 243 HG3 GLU 30 HG3 GLU 30 6.936 7.677 -2.811 244 H LEU 31 H LEU 31 8.983 10.196 -0.193 245 HA LEU 31 HA LEU 31 7.426 8.157 1.339 246 HB2 LEU 31 HB2 LEU 31 10.159 9.414 1.798 247 HB3 LEU 31 HB3 LEU 31 9.368 8.341 2.911 248 HG LEU 31 HG LEU 31 10.162 6.532 1.975 249 HD11 LEU 31 HD11 LEU 31 9.913 5.828 -0.349 250 HD12 LEU 31 HD12 LEU 31 8.366 6.421 0.279 251 HD13 LEU 31 HD13 LEU 31 9.334 7.413 -0.831 252 HD21 LEU 31 HD21 LEU 31 11.556 8.302 -0.075 253 HD22 LEU 31 HD22 LEU 31 12.113 8.045 1.596 254 HD23 LEU 31 HD23 LEU 31 12.043 6.681 0.476 255 H ASN 32 H ASN 32 5.662 9.700 1.395 256 HA ASN 32 HA ASN 32 5.903 11.847 3.471 257 HB2 ASN 32 HB2 ASN 32 3.640 12.481 2.796 258 HB3 ASN 32 HB3 ASN 32 4.718 12.524 1.410 259 HD21 ASN 32 HD21 ASN 32 4.626 10.393 -0.068 260 HD22 ASN 32 HD22 ASN 32 3.008 9.916 -0.371 261 H ILE 33 H ILE 33 4.537 11.535 5.440 262 HA ILE 33 HA ILE 33 4.568 8.834 6.366 263 HB ILE 33 HB ILE 33 4.832 10.278 8.002 264 HG12 ILE 33 HG12 ILE 33 3.160 10.156 9.684 265 HG13 ILE 33 HG13 ILE 33 1.843 9.855 8.510 266 HG21 ILE 33 HG21 ILE 33 2.350 11.761 7.255 267 HG22 ILE 33 HG22 ILE 33 3.348 12.057 8.696 268 HG23 ILE 33 HG23 ILE 33 4.055 12.337 7.081 269 HD11 ILE 33 HD11 ILE 33 2.861 7.986 9.934 270 HD12 ILE 33 HD12 ILE 33 2.525 7.683 8.236 271 HD13 ILE 33 HD13 ILE 33 4.188 8.089 8.726 272 H GLU 34 H GLU 34 1.959 10.768 4.784 273 HA GLU 34 HA GLU 34 -0.154 8.946 5.306 274 HB2 GLU 34 HB2 GLU 34 -0.015 10.505 2.749 275 HB3 GLU 34 HB3 GLU 34 -1.419 10.063 3.675 276 HG2 GLU 34 HG2 GLU 34 -1.055 11.702 5.273 277 HG3 GLU 34 HG3 GLU 34 0.602 12.049 4.763 278 H ASN 35 H ASN 35 2.505 8.592 3.341 279 HA ASN 35 HA ASN 35 1.341 6.156 1.990 280 HB2 ASN 35 HB2 ASN 35 2.417 7.906 0.453 281 HB3 ASN 35 HB3 ASN 35 3.960 7.428 1.154 282 HD21 ASN 35 HD21 ASN 35 5.029 5.750 -0.207 283 HD22 ASN 35 HD22 ASN 35 4.030 4.728 -1.209 284 H ALA 36 H ALA 36 3.863 7.348 4.175 285 HA ALA 36 HA ALA 36 5.427 4.979 4.235 286 HB1 ALA 36 HB1 ALA 36 5.175 6.914 6.496 287 HB2 ALA 36 HB2 ALA 36 6.549 5.882 6.034 288 HB3 ALA 36 HB3 ALA 36 6.115 7.267 5.020 289 H HIS 37 H HIS 37 2.625 6.107 6.147 290 HA HIS 37 HA HIS 37 2.316 3.909 7.932 291 HB2 HIS 37 HB2 HIS 37 0.948 5.816 8.279 292 HB3 HIS 37 HB3 HIS 37 0.409 5.860 6.596 293 HD1 HIS 37 HD1 HIS 37 -2.045 5.078 6.347 294 HD2 HIS 37 HD2 HIS 37 0.093 3.199 9.487 295 HE1 HIS 37 HE1 HIS 37 -3.625 3.404 7.402 296 H LEU 38 H LEU 38 1.160 4.410 4.556 297 HA LEU 38 HA LEU 38 -0.047 1.796 4.352 298 HB2 LEU 38 HB2 LEU 38 0.978 3.579 2.098 299 HB3 LEU 38 HB3 LEU 38 -0.122 2.213 1.964 300 HG LEU 38 HG LEU 38 -0.766 4.773 3.499 301 HD11 LEU 38 HD11 LEU 38 -2.146 5.356 1.565 302 HD12 LEU 38 HD12 LEU 38 -0.460 5.175 1.073 303 HD13 LEU 38 HD13 LEU 38 -1.632 3.886 0.711 304 HD21 LEU 38 HD21 LEU 38 -1.979 2.825 4.336 305 HD22 LEU 38 HD22 LEU 38 -3.095 3.832 3.393 306 HD23 LEU 38 HD23 LEU 38 -2.421 2.343 2.684 307 H PHE 39 H PHE 39 3.181 2.948 3.866 308 HA PHE 39 HA PHE 39 4.131 1.506 1.874 309 HB2 PHE 39 HB2 PHE 39 5.235 3.112 3.690 310 HB3 PHE 39 HB3 PHE 39 5.994 1.654 4.233 311 HD1 PHE 39 HD1 PHE 39 5.297 3.494 0.950 312 HD2 PHE 39 HD2 PHE 39 8.138 1.331 3.369 313 HE1 PHE 39 HE1 PHE 39 7.079 4.357 -0.454 314 HE2 PHE 39 HE2 PHE 39 9.938 1.993 1.778 315 HZ PHE 39 HZ PHE 39 9.447 3.556 -0.087 316 H LYS 40 H LYS 40 3.900 0.201 5.184 317 HA LYS 40 HA LYS 40 4.947 -2.423 4.660 318 HB2 LYS 40 HB2 LYS 40 4.525 -1.548 6.912 319 HB3 LYS 40 HB3 LYS 40 2.791 -1.415 6.575 320 HG2 LYS 40 HG2 LYS 40 2.909 -4.005 6.164 321 HG3 LYS 40 HG3 LYS 40 4.477 -3.889 6.993 322 HD2 LYS 40 HD2 LYS 40 3.369 -2.959 8.980 323 HD3 LYS 40 HD3 LYS 40 1.817 -2.923 8.120 324 HE2 LYS 40 HE2 LYS 40 2.048 -5.442 7.795 325 HE3 LYS 40 HE3 LYS 40 3.434 -5.372 8.902 326 HZ1 LYS 40 HZ1 LYS 40 1.883 -4.352 10.538 327 HZ2 LYS 40 HZ2 LYS 40 0.627 -4.628 9.535 328 HZ3 LYS 40 HZ3 LYS 40 1.453 -5.902 10.132 329 H LYS 41 H LYS 41 1.514 -1.232 4.630 330 HA LYS 41 HA LYS 41 0.388 -3.701 3.805 331 HB2 LYS 41 HB2 LYS 41 -0.597 -1.200 4.576 332 HB3 LYS 41 HB3 LYS 41 -0.932 -1.159 2.883 333 HG2 LYS 41 HG2 LYS 41 -1.709 -3.689 4.378 334 HG3 LYS 41 HG3 LYS 41 -2.638 -2.221 4.668 335 HD2 LYS 41 HD2 LYS 41 -3.089 -1.968 2.279 336 HD3 LYS 41 HD3 LYS 41 -2.144 -3.442 1.927 337 HE2 LYS 41 HE2 LYS 41 -3.722 -4.860 2.837 338 HE3 LYS 41 HE3 LYS 41 -4.430 -3.614 3.871 339 HZ1 LYS 41 HZ1 LYS 41 -5.374 -2.587 1.918 340 HZ2 LYS 41 HZ2 LYS 41 -4.724 -3.728 0.932 341 HZ3 LYS 41 HZ3 LYS 41 -5.848 -4.163 2.061 342 H TRP 42 H TRP 42 1.450 -0.889 1.891 343 HA TRP 42 HA TRP 42 0.812 -1.967 -0.661 344 HB2 TRP 42 HB2 TRP 42 1.099 0.373 -0.435 345 HB3 TRP 42 HB3 TRP 42 2.688 0.180 0.308 346 HD1 TRP 42 HD1 TRP 42 1.193 -0.856 -3.170 347 HE1 TRP 42 HE1 TRP 42 2.854 -0.274 -4.962 348 HE3 TRP 42 HE3 TRP 42 4.860 0.943 -0.158 349 HZ2 TRP 42 HZ2 TRP 42 5.546 1.048 -5.091 350 HZ3 TRP 42 HZ3 TRP 42 6.940 1.752 -1.044 351 HH2 TRP 42 HH2 TRP 42 7.286 1.947 -3.561 352 H VAL 43 H VAL 43 4.231 -1.716 0.750 353 HA VAL 43 HA VAL 43 5.225 -3.376 -1.228 354 HB VAL 43 HB VAL 43 6.190 -2.899 1.607 355 HG11 VAL 43 HG11 VAL 43 7.685 -4.362 -0.592 356 HG12 VAL 43 HG12 VAL 43 8.427 -3.705 0.877 357 HG13 VAL 43 HG13 VAL 43 7.225 -4.986 1.012 358 HG21 VAL 43 HG21 VAL 43 7.895 -1.480 0.329 359 HG22 VAL 43 HG22 VAL 43 6.977 -1.809 -1.143 360 HG23 VAL 43 HG23 VAL 43 6.235 -0.917 0.197 361 H PHE 44 H PHE 44 3.496 -4.434 1.718 362 HA PHE 44 HA PHE 44 4.050 -7.178 1.516 363 HB2 PHE 44 HB2 PHE 44 1.896 -5.486 2.766 364 HB3 PHE 44 HB3 PHE 44 1.714 -7.201 2.647 365 HD1 PHE 44 HD1 PHE 44 4.896 -5.295 3.611 366 HD2 PHE 44 HD2 PHE 44 1.672 -7.913 4.829 367 HE1 PHE 44 HE1 PHE 44 5.931 -5.567 5.849 368 HE2 PHE 44 HE2 PHE 44 2.752 -8.227 7.004 369 HZ PHE 44 HZ PHE 44 4.895 -7.056 7.530 370 H ASP 45 H ASP 45 1.051 -5.551 0.753 371 HA ASP 45 HA ASP 45 -0.007 -7.737 -0.763 372 HB2 ASP 45 HB2 ASP 45 -1.049 -4.949 -0.245 373 HB3 ASP 45 HB3 ASP 45 -1.885 -6.055 -1.301 374 H GLU 46 H GLU 46 1.954 -5.111 -1.874 375 HA GLU 46 HA GLU 46 1.099 -5.434 -4.654 376 HB2 GLU 46 HB2 GLU 46 1.926 -3.280 -3.349 377 HB3 GLU 46 HB3 GLU 46 3.530 -3.913 -3.708 378 HG2 GLU 46 HG2 GLU 46 3.100 -2.466 -5.478 379 HG3 GLU 46 HG3 GLU 46 2.543 -3.998 -6.188 380 H PHE 47 H PHE 47 3.713 -6.582 -2.463 381 HA PHE 47 HA PHE 47 4.892 -8.058 -4.769 382 HB2 PHE 47 HB2 PHE 47 6.581 -6.674 -2.683 383 HB3 PHE 47 HB3 PHE 47 7.056 -7.394 -4.203 384 HD1 PHE 47 HD1 PHE 47 5.823 -6.229 -6.380 385 HD2 PHE 47 HD2 PHE 47 6.489 -4.398 -2.548 386 HE1 PHE 47 HE1 PHE 47 5.508 -3.979 -7.390 387 HE2 PHE 47 HE2 PHE 47 6.053 -2.159 -3.529 388 HZ PHE 47 HZ PHE 47 5.630 -1.946 -5.979 389 H LEU 48 H LEU 48 5.240 -7.719 -1.159 390 HA LEU 48 HA LEU 48 6.482 -10.250 -0.933 391 HB2 LEU 48 HB2 LEU 48 4.838 -8.928 1.241 392 HB3 LEU 48 HB3 LEU 48 6.071 -10.164 1.427 393 HG LEU 48 HG LEU 48 6.456 -7.248 0.821 394 HD11 LEU 48 HD11 LEU 48 7.684 -9.186 2.817 395 HD12 LEU 48 HD12 LEU 48 8.129 -7.485 2.636 396 HD13 LEU 48 HD13 LEU 48 6.474 -7.932 3.156 397 HD21 LEU 48 HD21 LEU 48 8.822 -7.592 0.367 398 HD22 LEU 48 HD22 LEU 48 8.609 -9.356 0.417 399 HD23 LEU 48 HD23 LEU 48 7.857 -8.405 -0.862 400 H ASN 49 H ASN 49 3.073 -9.473 -0.184 401 HA ASN 49 HA ASN 49 2.230 -12.237 0.187 402 HB2 ASN 49 HB2 ASN 49 0.643 -9.711 -0.430 403 HB3 ASN 49 HB3 ASN 49 -0.069 -11.275 -0.095 404 HD21 ASN 49 HD21 ASN 49 -0.843 -9.068 1.455 405 HD22 ASN 49 HD22 ASN 49 -0.243 -9.342 3.056 406 H LYS 50 H LYS 50 3.205 -10.533 -2.590 407 HA LYS 50 HA LYS 50 1.537 -12.020 -4.506 408 HB2 LYS 50 HB2 LYS 50 2.871 -9.426 -4.399 409 HB3 LYS 50 HB3 LYS 50 3.703 -10.407 -5.580 410 HG2 LYS 50 HG2 LYS 50 1.028 -10.781 -6.185 411 HG3 LYS 50 HG3 LYS 50 1.110 -9.083 -5.688 412 HD2 LYS 50 HD2 LYS 50 3.123 -8.800 -7.185 413 HD3 LYS 50 HD3 LYS 50 2.804 -10.417 -7.839 414 HE2 LYS 50 HE2 LYS 50 0.616 -8.329 -7.825 415 HE3 LYS 50 HE3 LYS 50 1.932 -8.190 -8.994 416 HZ1 LYS 50 HZ1 LYS 50 0.139 -9.377 -9.928 417 HZ2 LYS 50 HZ2 LYS 50 1.434 -10.403 -9.778 418 HZ3 LYS 50 HZ3 LYS 50 0.154 -10.523 -8.756 419 H GLY 51 H GLY 51 4.273 -12.597 -2.635 420 HA2 GLY 51 HA2 GLY 51 5.499 -14.571 -2.752 421 HA3 GLY 51 HA3 GLY 51 5.191 -14.697 -4.475 422 H TYR 52 H TYR 52 6.266 -11.502 -3.704 423 HA TYR 52 HA TYR 52 8.867 -12.083 -4.950 424 HB2 TYR 52 HB2 TYR 52 7.596 -9.512 -3.982 425 HB3 TYR 52 HB3 TYR 52 9.254 -9.601 -4.547 426 HD1 TYR 52 HD1 TYR 52 5.744 -10.078 -5.615 427 HD2 TYR 52 HD2 TYR 52 9.807 -9.772 -6.857 428 HE1 TYR 52 HE1 TYR 52 4.991 -10.021 -7.969 429 HE2 TYR 52 HE2 TYR 52 9.129 -9.827 -9.232 430 HH TYR 52 HH TYR 52 7.140 -9.548 -10.737 431 H ASN 53 H ASN 53 10.828 -11.832 -4.024 432 HA ASN 53 HA ASN 53 11.091 -11.754 -1.073 433 HB2 ASN 53 HB2 ASN 53 11.989 -13.923 -2.999 434 HB3 ASN 53 HB3 ASN 53 12.589 -13.786 -1.353 435 HD21 ASN 53 HD21 ASN 53 10.494 -13.413 0.347 436 HD22 ASN 53 HD22 ASN 53 9.324 -14.677 0.052 437 H LYS 54 H LYS 54 11.806 -9.971 -3.580 438 HA LYS 54 HA LYS 54 14.438 -9.259 -2.538 439 HB2 LYS 54 HB2 LYS 54 14.009 -10.468 -5.269 440 HB3 LYS 54 HB3 LYS 54 15.090 -9.115 -5.103 441 HG2 LYS 54 HG2 LYS 54 16.744 -10.274 -4.187 442 HG3 LYS 54 HG3 LYS 54 15.716 -11.050 -3.003 443 HD2 LYS 54 HD2 LYS 54 15.946 -11.864 -5.940 444 HD3 LYS 54 HD3 LYS 54 16.835 -12.638 -4.619 445 HE2 LYS 54 HE2 LYS 54 14.860 -13.514 -3.631 446 HE3 LYS 54 HE3 LYS 54 13.803 -12.435 -4.535 447 HZ1 LYS 54 HZ1 LYS 54 14.097 -13.639 -6.487 448 HZ2 LYS 54 HZ2 LYS 54 15.476 -14.373 -6.012 449 HZ3 LYS 54 HZ3 LYS 54 14.059 -14.848 -5.370 450 H ILE 55 H ILE 55 14.199 -7.182 -2.215 451 HA ILE 55 HA ILE 55 12.627 -5.515 -4.118 452 HB ILE 55 HB ILE 55 12.642 -5.545 -1.059 453 HG12 ILE 55 HG12 ILE 55 10.219 -5.260 -1.229 454 HG13 ILE 55 HG13 ILE 55 10.286 -5.223 -2.965 455 HG21 ILE 55 HG21 ILE 55 11.953 -3.195 -2.856 456 HG22 ILE 55 HG22 ILE 55 11.408 -3.338 -1.169 457 HG23 ILE 55 HG23 ILE 55 13.122 -3.250 -1.516 458 HD11 ILE 55 HD11 ILE 55 10.714 -7.548 -3.118 459 HD12 ILE 55 HD12 ILE 55 11.126 -7.634 -1.351 460 HD13 ILE 55 HD13 ILE 55 9.486 -7.312 -1.923 461 H PHE 56 H PHE 56 13.712 -3.523 -4.556 462 HA PHE 56 HA PHE 56 16.084 -2.930 -2.925 463 HB2 PHE 56 HB2 PHE 56 15.802 -2.340 -5.894 464 HB3 PHE 56 HB3 PHE 56 17.134 -1.837 -4.861 465 HD1 PHE 56 HD1 PHE 56 17.606 -4.420 -3.261 466 HD2 PHE 56 HD2 PHE 56 16.963 -3.802 -7.511 467 HE1 PHE 56 HE1 PHE 56 18.641 -6.528 -3.775 468 HE2 PHE 56 HE2 PHE 56 17.991 -5.938 -7.974 469 HZ PHE 56 HZ PHE 56 18.827 -7.355 -6.104 470 H LEU 57 H LEU 57 16.499 -0.597 -2.600 471 HA LEU 57 HA LEU 57 14.094 1.163 -2.968 472 HB2 LEU 57 HB2 LEU 57 14.643 0.731 -0.530 473 HB3 LEU 57 HB3 LEU 57 16.302 1.184 -0.850 474 HG LEU 57 HG LEU 57 15.632 3.500 -1.329 475 HD11 LEU 57 HD11 LEU 57 13.233 4.168 -0.747 476 HD12 LEU 57 HD12 LEU 57 13.465 3.342 -2.291 477 HD13 LEU 57 HD13 LEU 57 12.799 2.451 -0.922 478 HD21 LEU 57 HD21 LEU 57 14.882 4.098 0.956 479 HD22 LEU 57 HD22 LEU 57 14.521 2.380 1.270 480 HD23 LEU 57 HD23 LEU 57 16.180 2.904 0.951 481 H VAL 58 H VAL 58 14.583 2.788 -4.503 482 HA VAL 58 HA VAL 58 17.453 3.414 -4.836 483 HB VAL 58 HB VAL 58 17.106 3.675 -6.886 484 HG11 VAL 58 HG11 VAL 58 16.128 1.614 -6.714 485 HG12 VAL 58 HG12 VAL 58 14.532 2.354 -6.763 486 HG13 VAL 58 HG13 VAL 58 15.632 2.516 -8.150 487 HG21 VAL 58 HG21 VAL 58 15.494 4.917 -8.129 488 HG22 VAL 58 HG22 VAL 58 14.960 5.552 -6.544 489 HG23 VAL 58 HG23 VAL 58 16.650 5.730 -7.062 490 H LEU 59 H LEU 59 18.215 5.548 -4.886 491 HA LEU 59 HA LEU 59 16.708 7.317 -3.027 492 HB2 LEU 59 HB2 LEU 59 19.592 6.404 -3.062 493 HB3 LEU 59 HB3 LEU 59 18.985 7.651 -1.968 494 HG LEU 59 HG LEU 59 17.800 4.828 -2.040 495 HD11 LEU 59 HD11 LEU 59 20.103 4.466 -1.642 496 HD12 LEU 59 HD12 LEU 59 20.164 5.724 -0.396 497 HD13 LEU 59 HD13 LEU 59 19.214 4.252 -0.132 498 HD21 LEU 59 HD21 LEU 59 17.131 5.381 0.259 499 HD22 LEU 59 HD22 LEU 59 17.809 7.009 0.067 500 HD23 LEU 59 HD23 LEU 59 16.424 6.487 -0.936 501 H SER 60 H SER 60 17.250 7.400 -6.097 502 HA SER 60 HA SER 60 19.017 9.671 -6.431 503 HB2 SER 60 HB2 SER 60 17.221 8.130 -8.345 504 HB3 SER 60 HB3 SER 60 18.360 9.395 -8.844 505 HG SER 60 HG SER 60 19.992 8.177 -7.767 506 H ASP 61 H ASP 61 15.415 9.244 -6.770 507 HA ASP 61 HA ASP 61 15.257 12.072 -7.676 508 HB2 ASP 61 HB2 ASP 61 13.212 9.838 -7.477 509 HB3 ASP 61 HB3 ASP 61 12.744 11.516 -7.677 510 H VAL 62 H VAL 62 14.906 10.234 -4.750 511 HA VAL 62 HA VAL 62 13.513 12.355 -3.255 512 HB VAL 62 HB VAL 62 13.147 9.926 -2.836 513 HG11 VAL 62 HG11 VAL 62 15.675 9.299 -3.091 514 HG12 VAL 62 HG12 VAL 62 15.795 9.728 -1.391 515 HG13 VAL 62 HG13 VAL 62 14.692 8.443 -1.886 516 HG21 VAL 62 HG21 VAL 62 12.839 11.693 -1.033 517 HG22 VAL 62 HG22 VAL 62 13.011 10.022 -0.480 518 HG23 VAL 62 HG23 VAL 62 14.367 11.144 -0.351 519 H GLU 63 H GLU 63 14.628 13.331 -1.329 520 HA GLU 63 HA GLU 63 17.594 13.497 -1.663 521 HB2 GLU 63 HB2 GLU 63 16.444 15.603 -2.227 522 HB3 GLU 63 HB3 GLU 63 15.633 15.596 -0.644 523 HG2 GLU 63 HG2 GLU 63 17.814 15.726 0.507 524 HG3 GLU 63 HG3 GLU 63 18.654 15.667 -1.054 525 H SER 64 H SER 64 14.780 13.216 0.616 526 HA SER 64 HA SER 64 16.489 11.785 2.440 527 HB2 SER 64 HB2 SER 64 16.457 14.569 2.790 528 HB3 SER 64 HB3 SER 64 15.224 14.038 3.913 529 HG SER 64 HG SER 64 16.829 12.653 4.885 530 H ILE 65 H ILE 65 15.186 11.459 4.508 531 HA ILE 65 HA ILE 65 12.392 10.722 3.908 532 HB ILE 65 HB ILE 65 13.947 8.930 3.331 533 HG12 ILE 65 HG12 ILE 65 12.513 8.166 5.871 534 HG13 ILE 65 HG13 ILE 65 11.687 8.506 4.347 535 HG21 ILE 65 HG21 ILE 65 14.901 8.990 6.213 536 HG22 ILE 65 HG22 ILE 65 15.322 7.751 5.008 537 HG23 ILE 65 HG23 ILE 65 15.862 9.398 4.764 538 HD11 ILE 65 HD11 ILE 65 13.652 6.232 4.890 539 HD12 ILE 65 HD12 ILE 65 11.952 6.106 4.444 540 HD13 ILE 65 HD13 ILE 65 13.110 6.686 3.259 541 H ASP 66 H ASP 66 11.178 10.240 6.056 542 HA ASP 66 HA ASP 66 11.921 12.402 7.879 543 HB2 ASP 66 HB2 ASP 66 9.668 12.157 6.717 544 HB3 ASP 66 HB3 ASP 66 9.325 10.815 7.812 545 H SER 67 H SER 67 11.270 12.047 10.226 546 HA SER 67 HA SER 67 12.498 9.798 11.609 547 HB2 SER 67 HB2 SER 67 10.844 12.261 12.309 548 HB3 SER 67 HB3 SER 67 11.302 11.079 13.532 549 HG SER 67 HG SER 67 13.310 11.542 13.376 550 H PHE 68 H PHE 68 10.472 9.022 9.722 551 HA PHE 68 HA PHE 68 8.727 7.454 11.466 552 HB2 PHE 68 HB2 PHE 68 7.269 9.323 10.629 553 HB3 PHE 68 HB3 PHE 68 7.665 8.892 8.983 554 HD1 PHE 68 HD1 PHE 68 6.884 6.725 8.062 555 HD2 PHE 68 HD2 PHE 68 5.669 8.135 11.926 556 HE1 PHE 68 HE1 PHE 68 5.241 4.859 8.207 557 HE2 PHE 68 HE2 PHE 68 3.953 6.368 12.037 558 HZ PHE 68 HZ PHE 68 3.755 4.683 10.198 559 H SER 69 H SER 69 9.210 8.054 7.966 560 HA SER 69 HA SER 69 9.055 5.383 7.400 561 HB2 SER 69 HB2 SER 69 10.318 7.154 5.385 562 HB3 SER 69 HB3 SER 69 8.924 6.073 5.291 563 HG SER 69 HG SER 69 8.971 8.729 5.539 564 H LEU 70 H LEU 70 11.936 7.271 8.178 565 HA LEU 70 HA LEU 70 13.942 5.531 7.148 566 HB2 LEU 70 HB2 LEU 70 14.217 7.810 8.222 567 HB3 LEU 70 HB3 LEU 70 13.830 7.089 9.781 568 HG LEU 70 HG LEU 70 15.904 5.646 9.561 569 HD11 LEU 70 HD11 LEU 70 16.145 5.807 7.058 570 HD12 LEU 70 HD12 LEU 70 16.548 7.542 7.244 571 HD13 LEU 70 HD13 LEU 70 17.611 6.330 7.913 572 HD21 LEU 70 HD21 LEU 70 17.420 7.535 10.100 573 HD22 LEU 70 HD22 LEU 70 16.314 8.682 9.401 574 HD23 LEU 70 HD23 LEU 70 15.860 7.762 10.865 575 H GLY 71 H GLY 71 11.817 5.235 9.951 576 HA2 GLY 71 HA2 GLY 71 13.030 2.670 10.786 577 HA3 GLY 71 HA3 GLY 71 11.803 3.608 11.635 578 H VAL 72 H VAL 72 10.762 3.473 8.420 579 HA VAL 72 HA VAL 72 9.207 0.977 8.876 580 HB VAL 72 HB VAL 72 8.122 3.279 8.077 581 HG11 VAL 72 HG11 VAL 72 9.389 3.620 5.960 582 HG12 VAL 72 HG12 VAL 72 8.785 2.078 5.372 583 HG13 VAL 72 HG13 VAL 72 7.668 3.418 5.704 584 HG21 VAL 72 HG21 VAL 72 6.355 1.970 7.002 585 HG22 VAL 72 HG22 VAL 72 7.461 0.602 6.788 586 HG23 VAL 72 HG23 VAL 72 6.968 1.120 8.436 587 H ILE 73 H ILE 73 11.664 2.510 6.791 588 HA ILE 73 HA ILE 73 11.922 0.516 4.827 589 HB ILE 73 HB ILE 73 13.667 2.652 6.035 590 HG12 ILE 73 HG12 ILE 73 13.648 3.638 3.894 591 HG13 ILE 73 HG13 ILE 73 13.252 2.123 3.107 592 HG21 ILE 73 HG21 ILE 73 15.358 0.942 5.737 593 HG22 ILE 73 HG22 ILE 73 14.725 0.524 4.130 594 HG23 ILE 73 HG23 ILE 73 15.493 2.101 4.408 595 HD11 ILE 73 HD11 ILE 73 11.410 3.623 2.881 596 HD12 ILE 73 HD12 ILE 73 10.907 2.293 3.928 597 HD13 ILE 73 HD13 ILE 73 11.311 3.877 4.615 598 H VAL 74 H VAL 74 13.704 0.711 7.990 599 HA VAL 74 HA VAL 74 14.909 -1.860 7.724 600 HB VAL 74 HB VAL 74 14.145 -0.159 10.130 601 HG11 VAL 74 HG11 VAL 74 15.525 -2.872 10.082 602 HG12 VAL 74 HG12 VAL 74 15.711 -1.717 11.417 603 HG13 VAL 74 HG13 VAL 74 14.104 -2.355 11.025 604 HG21 VAL 74 HG21 VAL 74 16.835 -0.860 8.854 605 HG22 VAL 74 HG22 VAL 74 15.926 0.646 8.599 606 HG23 VAL 74 HG23 VAL 74 16.553 0.265 10.203 607 H ASN 75 H ASN 75 11.661 -0.960 9.006 608 HA ASN 75 HA ASN 75 10.922 -3.425 10.074 609 HB2 ASN 75 HB2 ASN 75 9.700 -1.003 9.698 610 HB3 ASN 75 HB3 ASN 75 8.946 -1.902 8.367 611 HD21 ASN 75 HD21 ASN 75 9.713 -2.289 11.880 612 HD22 ASN 75 HD22 ASN 75 8.098 -2.836 12.238 613 H ILE 76 H ILE 76 10.854 -2.355 6.657 614 HA ILE 76 HA ILE 76 9.525 -4.727 5.677 615 HB ILE 76 HB ILE 76 11.100 -2.480 4.367 616 HG12 ILE 76 HG12 ILE 76 8.136 -3.238 4.315 617 HG13 ILE 76 HG13 ILE 76 8.833 -2.003 5.362 618 HG21 ILE 76 HG21 ILE 76 10.304 -3.421 2.169 619 HG22 ILE 76 HG22 ILE 76 11.483 -4.428 2.967 620 HG23 ILE 76 HG23 ILE 76 9.767 -4.871 3.024 621 HD11 ILE 76 HD11 ILE 76 7.746 -0.976 3.493 622 HD12 ILE 76 HD12 ILE 76 9.506 -0.682 3.393 623 HD13 ILE 76 HD13 ILE 76 8.716 -1.894 2.352 624 H LEU 77 H LEU 77 12.937 -3.895 6.433 625 HA LEU 77 HA LEU 77 14.060 -6.158 4.988 626 HB2 LEU 77 HB2 LEU 77 15.419 -4.154 5.599 627 HB3 LEU 77 HB3 LEU 77 15.182 -4.477 7.289 628 HG LEU 77 HG LEU 77 17.376 -5.104 6.261 629 HD11 LEU 77 HD11 LEU 77 16.109 -7.406 7.746 630 HD12 LEU 77 HD12 LEU 77 17.803 -6.889 7.706 631 HD13 LEU 77 HD13 LEU 77 16.600 -5.868 8.505 632 HD21 LEU 77 HD21 LEU 77 16.761 -6.266 4.247 633 HD22 LEU 77 HD22 LEU 77 17.548 -7.414 5.330 634 HD23 LEU 77 HD23 LEU 77 15.810 -7.485 5.131 635 H LYS 78 H LYS 78 13.152 -5.516 8.383 636 HA LYS 78 HA LYS 78 13.800 -8.064 9.389 637 HB2 LYS 78 HB2 LYS 78 11.459 -6.315 10.294 638 HB3 LYS 78 HB3 LYS 78 12.228 -7.627 11.203 639 HG2 LYS 78 HG2 LYS 78 14.430 -6.317 10.875 640 HG3 LYS 78 HG3 LYS 78 13.441 -4.959 10.388 641 HD2 LYS 78 HD2 LYS 78 12.419 -4.799 12.571 642 HD3 LYS 78 HD3 LYS 78 13.106 -6.365 13.059 643 HE2 LYS 78 HE2 LYS 78 15.427 -5.348 12.585 644 HE3 LYS 78 HE3 LYS 78 14.596 -3.786 12.462 645 HZ1 LYS 78 HZ1 LYS 78 15.108 -5.402 14.838 646 HZ2 LYS 78 HZ2 LYS 78 15.174 -3.761 14.599 647 HZ3 LYS 78 HZ3 LYS 78 13.748 -4.511 14.812 648 H SER 79 H SER 79 10.738 -6.986 7.965 649 HA SER 79 HA SER 79 9.295 -9.391 8.027 650 HB2 SER 79 HB2 SER 79 8.474 -7.077 7.638 651 HB3 SER 79 HB3 SER 79 9.264 -7.070 6.065 652 HG SER 79 HG SER 79 7.066 -8.624 6.957 653 H ILE 80 H ILE 80 11.119 -8.055 5.134 654 HA ILE 80 HA ILE 80 10.740 -10.285 3.490 655 HB ILE 80 HB ILE 80 12.907 -8.163 3.594 656 HG12 ILE 80 HG12 ILE 80 10.558 -8.697 1.701 657 HG13 ILE 80 HG13 ILE 80 10.541 -7.524 3.010 658 HG21 ILE 80 HG21 ILE 80 13.695 -8.866 1.359 659 HG22 ILE 80 HG22 ILE 80 13.912 -10.166 2.475 660 HG23 ILE 80 HG23 ILE 80 12.534 -10.204 1.340 661 HD11 ILE 80 HD11 ILE 80 10.983 -6.345 0.971 662 HD12 ILE 80 HD12 ILE 80 12.485 -6.349 1.934 663 HD13 ILE 80 HD13 ILE 80 12.282 -7.454 0.537 664 H SER 81 H SER 81 13.390 -9.643 5.780 665 HA SER 81 HA SER 81 14.920 -11.938 5.111 666 HB2 SER 81 HB2 SER 81 15.526 -9.784 6.302 667 HB3 SER 81 HB3 SER 81 14.808 -10.428 7.762 668 HG SER 81 HG SER 81 16.397 -12.243 7.423 669 H SER 82 H SER 82 12.224 -11.431 7.478 670 HA SER 82 HA SER 82 12.286 -14.104 8.520 671 HB2 SER 82 HB2 SER 82 11.137 -11.806 9.339 672 HB3 SER 82 HB3 SER 82 9.748 -12.450 8.462 673 HG SER 82 HG SER 82 9.552 -13.970 9.979 674 H SER 83 H SER 83 10.936 -12.732 5.568 675 HA SER 83 HA SER 83 9.248 -15.057 5.011 676 HB2 SER 83 HB2 SER 83 10.155 -12.630 3.457 677 HB3 SER 83 HB3 SER 83 9.445 -14.024 2.645 678 HG SER 83 HG SER 83 8.230 -12.603 4.856 679 H GLY 84 H GLY 84 12.662 -14.206 4.571 680 HA2 GLY 84 HA2 GLY 84 14.209 -15.946 3.831 681 HA3 GLY 84 HA3 GLY 84 12.904 -16.603 2.809 682 H GLY 85 H GLY 85 13.150 -13.054 2.629 683 HA2 GLY 85 HA2 GLY 85 14.357 -13.389 -0.050 684 HA3 GLY 85 HA3 GLY 85 13.431 -12.029 0.559 685 H PHE 86 H PHE 86 15.244 -10.961 -0.434 686 HA PHE 86 HA PHE 86 17.038 -10.105 1.730 687 HB2 PHE 86 HB2 PHE 86 17.916 -11.181 -0.874 688 HB3 PHE 86 HB3 PHE 86 18.562 -9.576 -0.507 689 HD1 PHE 86 HD1 PHE 86 18.200 -12.990 0.913 690 HD2 PHE 86 HD2 PHE 86 20.722 -9.396 0.866 691 HE1 PHE 86 HE1 PHE 86 19.800 -14.047 2.461 692 HE2 PHE 86 HE2 PHE 86 22.120 -10.440 2.533 693 HZ PHE 86 HZ PHE 86 21.747 -12.775 3.296 694 H PHE 87 H PHE 87 17.700 -7.829 1.389 695 HA PHE 87 HA PHE 87 16.286 -6.317 -0.702 696 HB2 PHE 87 HB2 PHE 87 14.608 -6.276 0.918 697 HB3 PHE 87 HB3 PHE 87 15.739 -6.218 2.249 698 HD1 PHE 87 HD1 PHE 87 15.510 -3.845 -0.715 699 HD2 PHE 87 HD2 PHE 87 14.942 -4.469 3.513 700 HE1 PHE 87 HE1 PHE 87 15.194 -1.425 -0.391 701 HE2 PHE 87 HE2 PHE 87 14.552 -2.035 3.820 702 HZ PHE 87 HZ PHE 87 14.682 -0.507 1.853 703 H ALA 88 H ALA 88 17.298 -4.260 -1.116 704 HA ALA 88 HA ALA 88 19.623 -3.454 0.404 705 HB1 ALA 88 HB1 ALA 88 20.501 -5.228 -1.138 706 HB2 ALA 88 HB2 ALA 88 19.967 -4.229 -2.517 707 HB3 ALA 88 HB3 ALA 88 21.173 -3.600 -1.368 708 H LEU 89 H LEU 89 20.599 -1.402 -0.761 709 HA LEU 89 HA LEU 89 18.329 0.109 -1.963 710 HB2 LEU 89 HB2 LEU 89 20.450 1.674 -0.677 711 HB3 LEU 89 HB3 LEU 89 18.722 1.932 -0.753 712 HG LEU 89 HG LEU 89 20.268 0.184 1.188 713 HD11 LEU 89 HD11 LEU 89 19.450 1.741 2.839 714 HD12 LEU 89 HD12 LEU 89 20.179 2.653 1.519 715 HD13 LEU 89 HD13 LEU 89 18.403 2.549 1.643 716 HD21 LEU 89 HD21 LEU 89 17.266 0.261 0.833 717 HD22 LEU 89 HD22 LEU 89 18.344 -1.125 1.049 718 HD23 LEU 89 HD23 LEU 89 18.022 -0.086 2.411 719 H VAL 90 H VAL 90 19.174 2.154 -3.221 720 HA VAL 90 HA VAL 90 21.440 1.427 -4.951 721 HB VAL 90 HB VAL 90 18.512 1.891 -5.722 722 HG11 VAL 90 HG11 VAL 90 20.952 1.626 -7.444 723 HG12 VAL 90 HG12 VAL 90 19.369 1.170 -8.073 724 HG13 VAL 90 HG13 VAL 90 19.635 2.809 -7.469 725 HG21 VAL 90 HG21 VAL 90 18.811 -0.363 -4.806 726 HG22 VAL 90 HG22 VAL 90 18.288 -0.293 -6.464 727 HG23 VAL 90 HG23 VAL 90 19.999 -0.688 -6.095 728 H SER 91 H SER 91 22.347 3.138 -5.956 729 HA SER 91 HA SER 91 23.186 5.183 -6.125 730 HB2 SER 91 HB2 SER 91 21.135 6.809 -6.925 731 HB3 SER 91 HB3 SER 91 22.167 5.815 -7.946 732 HG SER 91 HG SER 91 19.640 5.886 -7.723 733 HA PRO 92 HA PRO 92 21.640 6.712 -2.028 734 HB2 PRO 92 HB2 PRO 92 23.483 5.777 -0.320 735 HB3 PRO 92 HB3 PRO 92 22.319 4.675 -1.077 736 HG2 PRO 92 HG2 PRO 92 25.190 5.190 -1.917 737 HG3 PRO 92 HG3 PRO 92 24.382 3.625 -1.760 738 HD2 PRO 92 HD2 PRO 92 24.629 4.988 -4.130 739 HD3 PRO 92 HD3 PRO 92 23.338 3.829 -3.771 740 H ASN 93 H ASN 93 21.974 8.836 -2.870 741 HA ASN 93 HA ASN 93 24.548 10.028 -3.086 742 HB2 ASN 93 HB2 ASN 93 22.607 12.021 -2.183 743 HB3 ASN 93 HB3 ASN 93 23.541 11.955 -3.637 744 HD21 ASN 93 HD21 ASN 93 20.602 11.070 -2.113 745 HD22 ASN 93 HD22 ASN 93 19.683 10.632 -3.540 746 H GLU 94 H GLU 94 25.412 11.820 -1.713 747 HA GLU 94 HA GLU 94 26.212 10.555 0.682 748 HB2 GLU 94 HB2 GLU 94 27.708 11.974 -0.594 749 HB3 GLU 94 HB3 GLU 94 26.699 13.384 -0.320 750 HG2 GLU 94 HG2 GLU 94 27.112 13.318 2.096 751 HG3 GLU 94 HG3 GLU 94 27.948 11.766 1.906 752 H LYS 95 H LYS 95 23.813 13.123 0.134 753 HA LYS 95 HA LYS 95 23.511 13.985 2.822 754 HB2 LYS 95 HB2 LYS 95 22.690 14.954 0.559 755 HB3 LYS 95 HB3 LYS 95 21.329 13.867 0.662 756 HG2 LYS 95 HG2 LYS 95 22.027 15.919 2.841 757 HG3 LYS 95 HG3 LYS 95 21.142 16.338 1.382 758 HD2 LYS 95 HD2 LYS 95 19.376 16.059 2.701 759 HD3 LYS 95 HD3 LYS 95 19.495 14.402 2.120 760 HE2 LYS 95 HE2 LYS 95 20.008 13.557 4.150 761 HE3 LYS 95 HE3 LYS 95 21.077 14.925 4.562 762 HZ1 LYS 95 HZ1 LYS 95 18.140 14.837 4.724 763 HZ2 LYS 95 HZ2 LYS 95 19.184 14.983 5.993 764 HZ3 LYS 95 HZ3 LYS 95 19.014 16.209 4.951 765 H VAL 96 H VAL 96 22.439 11.136 1.114 766 HA VAL 96 HA VAL 96 20.752 10.458 3.398 767 HB VAL 96 HB VAL 96 20.637 10.004 0.525 768 HG11 VAL 96 HG11 VAL 96 19.932 7.784 0.314 769 HG12 VAL 96 HG12 VAL 96 21.567 7.743 0.983 770 HG13 VAL 96 HG13 VAL 96 20.157 7.448 2.041 771 HG21 VAL 96 HG21 VAL 96 18.654 9.298 2.715 772 HG22 VAL 96 HG22 VAL 96 18.845 10.902 1.973 773 HG23 VAL 96 HG23 VAL 96 18.311 9.543 0.978 774 H GLU 97 H GLU 97 23.847 9.384 1.806 775 HA GLU 97 HA GLU 97 24.177 7.053 3.449 776 HB2 GLU 97 HB2 GLU 97 26.179 8.954 2.197 777 HB3 GLU 97 HB3 GLU 97 26.646 7.522 3.106 778 HG2 GLU 97 HG2 GLU 97 24.662 6.975 0.984 779 HG3 GLU 97 HG3 GLU 97 26.175 7.628 0.390 780 H ARG 98 H ARG 98 24.683 10.562 4.063 781 HA ARG 98 HA ARG 98 26.136 10.201 6.454 782 HB2 ARG 98 HB2 ARG 98 26.096 12.477 6.655 783 HB3 ARG 98 HB3 ARG 98 25.798 12.261 4.941 784 HG2 ARG 98 HG2 ARG 98 24.155 13.772 5.345 785 HG3 ARG 98 HG3 ARG 98 23.275 12.291 5.686 786 HD2 ARG 98 HD2 ARG 98 22.804 13.026 7.735 787 HD3 ARG 98 HD3 ARG 98 24.511 12.919 8.141 788 HE ARG 98 HE ARG 98 24.361 15.289 6.736 789 HH11 ARG 98 HH11 ARG 98 22.685 14.375 9.751 790 HH12 ARG 98 HH12 ARG 98 21.906 15.897 9.906 791 HH21 ARG 98 HH21 ARG 98 23.763 17.260 7.148 792 HH22 ARG 98 HH22 ARG 98 22.909 17.749 8.599 793 H VAL 99 H VAL 99 22.701 9.901 5.869 794 HA VAL 99 HA VAL 99 22.201 10.113 8.782 795 HB VAL 99 HB VAL 99 20.856 11.448 7.130 796 HG11 VAL 99 HG11 VAL 99 19.424 8.962 6.366 797 HG12 VAL 99 HG12 VAL 99 19.042 10.651 5.924 798 HG13 VAL 99 HG13 VAL 99 20.542 9.964 5.374 799 HG21 VAL 99 HG21 VAL 99 18.753 11.143 8.348 800 HG22 VAL 99 HG22 VAL 99 19.147 9.458 8.724 801 HG23 VAL 99 HG23 VAL 99 20.061 10.804 9.477 802 H LEU 100 H LEU 100 22.024 7.922 5.988 803 HA LEU 100 HA LEU 100 20.942 5.659 7.220 804 HB2 LEU 100 HB2 LEU 100 22.936 6.001 4.967 805 HB3 LEU 100 HB3 LEU 100 22.301 4.456 5.401 806 HG LEU 100 HG LEU 100 21.344 6.253 3.501 807 HD11 LEU 100 HD11 LEU 100 19.804 4.612 2.879 808 HD12 LEU 100 HD12 LEU 100 21.229 3.767 3.501 809 HD13 LEU 100 HD13 LEU 100 19.766 3.885 4.487 810 HD21 LEU 100 HD21 LEU 100 18.888 6.473 4.041 811 HD22 LEU 100 HD22 LEU 100 19.270 6.120 5.733 812 HD23 LEU 100 HD23 LEU 100 19.942 7.555 4.910 813 H SER 101 H SER 101 24.075 7.159 7.959 814 HA SER 101 HA SER 101 25.157 4.489 8.731 815 HB2 SER 101 HB2 SER 101 26.465 6.243 7.388 816 HB3 SER 101 HB3 SER 101 26.551 7.177 8.901 817 HG SER 101 HG SER 101 27.863 5.741 9.713 818 H LEU 102 H LEU 102 24.593 7.746 9.909 819 HA LEU 102 HA LEU 102 24.949 7.577 12.609 820 HB2 LEU 102 HB2 LEU 102 23.073 9.241 10.850 821 HB3 LEU 102 HB3 LEU 102 23.203 9.447 12.574 822 HG LEU 102 HG LEU 102 24.473 11.060 11.068 823 HD11 LEU 102 HD11 LEU 102 26.065 11.360 12.937 824 HD12 LEU 102 HD12 LEU 102 24.409 11.115 13.520 825 HD13 LEU 102 HD13 LEU 102 25.585 9.768 13.582 826 HD21 LEU 102 HD21 LEU 102 26.795 10.403 10.790 827 HD22 LEU 102 HD22 LEU 102 26.436 8.835 11.590 828 HD23 LEU 102 HD23 LEU 102 25.736 9.207 10.014 829 H THR 103 H THR 103 21.904 6.863 10.816 830 HA THR 103 HA THR 103 20.462 6.401 13.326 831 HB THR 103 HB THR 103 19.497 7.479 11.361 832 HG1 THR 103 HG1 THR 103 18.086 5.090 11.855 833 HG21 THR 103 HG21 THR 103 18.844 5.088 9.806 834 HG22 THR 103 HG22 THR 103 19.391 6.708 9.290 835 HG23 THR 103 HG23 THR 103 20.564 5.483 9.751 836 H ASN 104 H ASN 104 22.520 4.576 11.316 837 HA ASN 104 HA ASN 104 22.993 2.439 10.889 838 HB2 ASN 104 HB2 ASN 104 21.214 1.664 13.230 839 HB3 ASN 104 HB3 ASN 104 22.035 0.554 12.172 840 HD21 ASN 104 HD21 ASN 104 23.957 3.474 12.803 841 HD22 ASN 104 HD22 ASN 104 24.917 2.697 14.053 842 H LEU 105 H LEU 105 22.105 2.806 8.899 843 HA LEU 105 HA LEU 105 19.631 1.258 8.424 844 HB2 LEU 105 HB2 LEU 105 19.756 3.930 7.989 845 HB3 LEU 105 HB3 LEU 105 20.551 3.407 6.526 846 HG LEU 105 HG LEU 105 18.251 3.732 6.014 847 HD11 LEU 105 HD11 LEU 105 19.324 1.531 5.183 848 HD12 LEU 105 HD12 LEU 105 18.341 0.731 6.428 849 HD13 LEU 105 HD13 LEU 105 17.573 1.648 5.123 850 HD21 LEU 105 HD21 LEU 105 16.425 2.678 7.285 851 HD22 LEU 105 HD22 LEU 105 17.630 2.104 8.477 852 HD23 LEU 105 HD23 LEU 105 17.379 3.829 8.232 853 H ASP 106 H ASP 106 22.654 2.480 6.775 854 HA ASP 106 HA ASP 106 22.954 0.270 4.981 855 HB2 ASP 106 HB2 ASP 106 24.354 2.131 4.579 856 HB3 ASP 106 HB3 ASP 106 24.829 2.260 6.271 857 H ARG 107 H ARG 107 23.701 0.632 8.385 858 HA ARG 107 HA ARG 107 25.300 -1.793 8.580 859 HB2 ARG 107 HB2 ARG 107 23.926 -0.246 10.818 860 HB3 ARG 107 HB3 ARG 107 25.237 -1.433 10.976 861 HG2 ARG 107 HG2 ARG 107 26.599 0.048 9.383 862 HG3 ARG 107 HG3 ARG 107 25.380 1.300 9.623 863 HD2 ARG 107 HD2 ARG 107 25.886 1.475 11.958 864 HD3 ARG 107 HD3 ARG 107 26.944 0.046 11.898 865 HE ARG 107 HE ARG 107 28.122 1.496 10.050 866 HH11 ARG 107 HH11 ARG 107 27.168 2.442 13.341 867 HH12 ARG 107 HH12 ARG 107 28.370 3.663 13.485 868 HH21 ARG 107 HH21 ARG 107 29.683 3.142 10.214 869 HH22 ARG 107 HH22 ARG 107 29.814 4.119 11.626 870 H ILE 108 H ILE 108 22.107 -1.503 7.855 871 HA ILE 108 HA ILE 108 21.350 -4.018 9.210 872 HB ILE 108 HB ILE 108 19.499 -1.688 8.584 873 HG12 ILE 108 HG12 ILE 108 20.958 -2.492 11.136 874 HG13 ILE 108 HG13 ILE 108 20.996 -0.939 10.308 875 HG21 ILE 108 HG21 ILE 108 18.448 -3.926 8.561 876 HG22 ILE 108 HG22 ILE 108 19.139 -4.262 10.158 877 HG23 ILE 108 HG23 ILE 108 17.903 -2.997 9.952 878 HD11 ILE 108 HD11 ILE 108 18.595 -0.587 10.906 879 HD12 ILE 108 HD12 ILE 108 18.680 -2.061 11.903 880 HD13 ILE 108 HD13 ILE 108 19.717 -0.676 12.278 881 H VAL 109 H VAL 109 21.124 -1.938 6.232 882 HA VAL 109 HA VAL 109 20.274 -4.334 4.745 883 HB VAL 109 HB VAL 109 19.698 -1.546 3.812 884 HG11 VAL 109 HG11 VAL 109 18.144 -4.167 3.693 885 HG12 VAL 109 HG12 VAL 109 17.721 -2.664 2.840 886 HG13 VAL 109 HG13 VAL 109 19.213 -3.524 2.436 887 HG21 VAL 109 HG21 VAL 109 18.786 -1.415 6.113 888 HG22 VAL 109 HG22 VAL 109 17.471 -1.514 4.937 889 HG23 VAL 109 HG23 VAL 109 17.934 -2.948 5.880 890 H LYS 110 H LYS 110 21.252 -4.574 2.683 891 HA LYS 110 HA LYS 110 23.941 -3.531 2.341 892 HB2 LYS 110 HB2 LYS 110 22.036 -5.257 0.786 893 HB3 LYS 110 HB3 LYS 110 23.524 -4.784 0.054 894 HG2 LYS 110 HG2 LYS 110 24.035 -5.712 2.820 895 HG3 LYS 110 HG3 LYS 110 23.262 -6.931 1.821 896 HD2 LYS 110 HD2 LYS 110 25.417 -7.378 1.480 897 HD3 LYS 110 HD3 LYS 110 24.901 -6.576 0.070 898 HE2 LYS 110 HE2 LYS 110 27.149 -5.781 0.638 899 HE3 LYS 110 HE3 LYS 110 25.969 -4.497 0.512 900 HZ1 LYS 110 HZ1 LYS 110 27.536 -4.273 2.320 901 HZ2 LYS 110 HZ2 LYS 110 26.026 -4.137 2.823 902 HZ3 LYS 110 HZ3 LYS 110 26.886 -5.538 3.117 903 H ILE 111 H ILE 111 24.693 -2.350 0.492 904 HA ILE 111 HA ILE 111 22.700 -0.565 -0.732 905 HB ILE 111 HB ILE 111 24.307 -0.001 1.495 906 HG12 ILE 111 HG12 ILE 111 23.651 2.423 -0.076 907 HG13 ILE 111 HG13 ILE 111 22.313 1.301 0.207 908 HG21 ILE 111 HG21 ILE 111 25.942 1.682 0.901 909 HG22 ILE 111 HG22 ILE 111 26.375 0.121 0.193 910 HG23 ILE 111 HG23 ILE 111 25.657 1.397 -0.831 911 HD11 ILE 111 HD11 ILE 111 24.076 2.365 2.396 912 HD12 ILE 111 HD12 ILE 111 22.514 3.038 1.920 913 HD13 ILE 111 HD13 ILE 111 22.593 1.373 2.578 914 H TYR 112 H TYR 112 23.198 0.158 -2.828 915 HA TYR 112 HA TYR 112 25.716 -0.729 -4.111 916 HB2 TYR 112 HB2 TYR 112 22.909 -1.394 -5.109 917 HB3 TYR 112 HB3 TYR 112 24.460 -1.727 -5.891 918 HD1 TYR 112 HD1 TYR 112 22.277 -2.833 -3.099 919 HD2 TYR 112 HD2 TYR 112 25.821 -3.496 -5.461 920 HE1 TYR 112 HE1 TYR 112 22.627 -5.110 -2.024 921 HE2 TYR 112 HE2 TYR 112 26.162 -5.671 -4.404 922 HH TYR 112 HH TYR 112 25.706 -6.694 -2.445 923 H ASP 113 H ASP 113 25.496 0.011 -6.615 924 HA ASP 113 HA ASP 113 24.689 2.864 -6.406 925 HB2 ASP 113 HB2 ASP 113 27.136 1.845 -7.123 926 HB3 ASP 113 HB3 ASP 113 26.381 1.976 -8.675 927 H THR 114 H THR 114 24.471 -0.021 -8.610 928 HA THR 114 HA THR 114 22.435 1.453 -10.261 929 HB THR 114 HB THR 114 23.207 0.170 -12.067 930 HG1 THR 114 HG1 THR 114 25.293 -1.097 -11.473 931 HG21 THR 114 HG21 THR 114 25.721 1.128 -10.637 932 HG22 THR 114 HG22 THR 114 25.424 1.007 -12.397 933 HG23 THR 114 HG23 THR 114 24.551 2.196 -11.429 934 H ILE 115 H ILE 115 21.324 -0.641 -11.419 935 HA ILE 115 HA ILE 115 20.218 -2.260 -9.156 936 HB ILE 115 HB ILE 115 19.486 -1.820 -12.021 937 HG12 ILE 115 HG12 ILE 115 18.752 -0.036 -10.672 938 HG13 ILE 115 HG13 ILE 115 17.357 -1.024 -11.042 939 HG21 ILE 115 HG21 ILE 115 19.028 -4.192 -11.603 940 HG22 ILE 115 HG22 ILE 115 18.346 -3.843 -10.011 941 HG23 ILE 115 HG23 ILE 115 17.465 -3.370 -11.479 942 HD11 ILE 115 HD11 ILE 115 17.293 -0.226 -8.743 943 HD12 ILE 115 HD12 ILE 115 17.417 -2.005 -8.781 944 HD13 ILE 115 HD13 ILE 115 18.828 -1.003 -8.405 945 H SER 116 H SER 116 22.370 -2.652 -12.048 946 HA SER 116 HA SER 116 21.924 -5.488 -11.940 947 HB2 SER 116 HB2 SER 116 22.537 -4.118 -13.926 948 HB3 SER 116 HB3 SER 116 24.190 -3.980 -13.271 949 HG SER 116 HG SER 116 23.592 -6.582 -13.378 950 H GLU 117 H GLU 117 24.344 -3.305 -10.383 951 HA GLU 117 HA GLU 117 26.026 -5.501 -9.592 952 HB2 GLU 117 HB2 GLU 117 25.762 -2.551 -9.009 953 HB3 GLU 117 HB3 GLU 117 26.628 -3.565 -7.806 954 HG2 GLU 117 HG2 GLU 117 28.001 -4.423 -9.659 955 HG3 GLU 117 HG3 GLU 117 27.097 -3.312 -10.742 956 H ALA 118 H ALA 118 22.895 -4.579 -8.659 957 HA ALA 118 HA ALA 118 23.245 -5.552 -5.864 958 HB1 ALA 118 HB1 ALA 118 20.819 -4.240 -7.203 959 HB2 ALA 118 HB2 ALA 118 21.043 -4.649 -5.459 960 HB3 ALA 118 HB3 ALA 118 22.019 -3.399 -6.226 961 H MET 119 H MET 119 21.331 -5.877 -8.844 962 HA MET 119 HA MET 119 19.680 -7.787 -8.012 963 HB2 MET 119 HB2 MET 119 20.050 -6.431 -10.417 964 HB3 MET 119 HB3 MET 119 20.663 -7.987 -10.892 965 HG2 MET 119 HG2 MET 119 18.398 -8.830 -9.705 966 HG3 MET 119 HG3 MET 119 17.911 -7.164 -10.014 967 HE1 MET 119 HE1 MET 119 17.962 -6.112 -12.572 968 HE2 MET 119 HE2 MET 119 19.564 -6.806 -12.944 969 HE3 MET 119 HE3 MET 119 18.189 -7.119 -14.019 970 H GLU 120 H GLU 120 22.910 -8.380 -9.469 971 HA GLU 120 HA GLU 120 22.570 -11.298 -9.235 972 HB2 GLU 120 HB2 GLU 120 24.606 -11.405 -10.539 973 HB3 GLU 120 HB3 GLU 120 23.598 -10.131 -11.248 974 HG2 GLU 120 HG2 GLU 120 24.930 -8.450 -9.829 975 HG3 GLU 120 HG3 GLU 120 25.970 -9.781 -9.346 976 H GLU 121 H GLU 121 23.679 -8.800 -7.200 977 HA GLU 121 HA GLU 121 25.667 -10.542 -5.947 978 HB2 GLU 121 HB2 GLU 121 25.972 -8.010 -6.447 979 HB3 GLU 121 HB3 GLU 121 24.918 -7.766 -5.052 980 HG2 GLU 121 HG2 GLU 121 27.196 -7.660 -4.245 981 HG3 GLU 121 HG3 GLU 121 26.519 -9.221 -3.702 982 H VAL 122 H VAL 122 22.731 -8.683 -4.957 983 HA VAL 122 HA VAL 122 22.314 -9.466 -2.419 984 HB VAL 122 HB VAL 122 20.325 -9.219 -4.731 985 HG11 VAL 122 HG11 VAL 122 19.393 -10.091 -2.644 986 HG12 VAL 122 HG12 VAL 122 20.071 -8.661 -1.810 987 HG13 VAL 122 HG13 VAL 122 18.780 -8.493 -3.044 988 HG21 VAL 122 HG21 VAL 122 22.175 -7.282 -4.025 989 HG22 VAL 122 HG22 VAL 122 20.647 -7.120 -4.865 990 HG23 VAL 122 HG23 VAL 122 20.744 -6.834 -3.094 991 H ARG 123 H ARG 123 21.597 -11.206 -5.342 992 HA ARG 123 HA ARG 123 20.150 -13.398 -4.270 993 HB2 ARG 123 HB2 ARG 123 20.505 -14.589 -6.289 994 HB3 ARG 123 HB3 ARG 123 19.990 -12.884 -6.469 995 HG2 ARG 123 HG2 ARG 123 22.004 -12.106 -7.116 996 HG3 ARG 123 HG3 ARG 123 22.752 -13.376 -6.167 997 HD2 ARG 123 HD2 ARG 123 23.288 -13.682 -8.538 998 HD3 ARG 123 HD3 ARG 123 22.267 -15.017 -8.002 999 HE ARG 123 HE ARG 123 20.440 -13.179 -8.815 1000 HH11 ARG 123 HH11 ARG 123 23.328 -14.570 -10.406 1001 HH12 ARG 123 HH12 ARG 123 22.827 -14.142 -12.000 1002 HH21 ARG 123 HH21 ARG 123 19.724 -12.711 -11.011 1003 HH22 ARG 123 HH22 ARG 123 20.841 -12.950 -12.311 1004 H ARG 124 H ARG 124 23.376 -12.927 -4.167 1005 HA ARG 124 HA ARG 124 23.877 -15.113 -2.317 1006 HB2 ARG 124 HB2 ARG 124 25.899 -15.958 -3.820 1007 HB3 ARG 124 HB3 ARG 124 24.306 -16.579 -3.983 1008 HG2 ARG 124 HG2 ARG 124 25.334 -16.220 -6.154 1009 HG3 ARG 124 HG3 ARG 124 23.851 -15.351 -5.964 1010 HD2 ARG 124 HD2 ARG 124 25.431 -14.013 -7.154 1011 HD3 ARG 124 HD3 ARG 124 25.162 -13.237 -5.581 1012 HE ARG 124 HE ARG 124 27.394 -14.910 -5.320 1013 HH11 ARG 124 HH11 ARG 124 26.440 -12.157 -7.343 1014 HH12 ARG 124 HH12 ARG 124 27.935 -11.315 -7.145 1015 HH21 ARG 124 HH21 ARG 124 29.580 -14.028 -5.507 1016 HH22 ARG 124 HH22 ARG 124 29.847 -12.679 -6.548 1017 H LYS 125 H LYS 125 23.925 -12.372 -1.860 1018 HA LYS 125 HA LYS 125 26.587 -11.372 -1.814 1019 HB2 LYS 125 HB2 LYS 125 25.683 -9.611 -0.478 1020 HB3 LYS 125 HB3 LYS 125 24.343 -10.141 -1.474 1021 HG2 LYS 125 HG2 LYS 125 23.310 -10.074 0.548 1022 HG3 LYS 125 HG3 LYS 125 23.816 -11.749 0.571 1023 HD2 LYS 125 HD2 LYS 125 25.991 -10.293 1.735 1024 HD3 LYS 125 HD3 LYS 125 24.556 -9.462 2.290 1025 HE2 LYS 125 HE2 LYS 125 24.741 -10.987 3.976 1026 HE3 LYS 125 HE3 LYS 125 23.706 -11.922 2.873 1027 HZ1 LYS 125 HZ1 LYS 125 25.554 -13.270 3.650 1028 HZ2 LYS 125 HZ2 LYS 125 25.773 -12.977 2.051 1029 HZ3 LYS 125 HZ3 LYS 125 26.637 -12.147 3.162 Start of MODEL 17 1 H1 MET 1 H1 MET 1 -11.558 23.457 3.887 2 HA MET 1 HA MET 1 -10.058 21.082 4.797 3 HB2 MET 1 HB2 MET 1 -12.856 22.016 5.489 4 HB3 MET 1 HB3 MET 1 -12.326 20.342 5.723 5 HG2 MET 1 HG2 MET 1 -10.407 21.098 7.061 6 HG3 MET 1 HG3 MET 1 -10.946 22.776 6.909 7 HE1 MET 1 HE1 MET 1 -11.511 21.706 10.691 8 HE2 MET 1 HE2 MET 1 -10.261 21.063 9.604 9 HE3 MET 1 HE3 MET 1 -10.631 22.803 9.603 10 H GLY 2 H GLY 2 -11.397 19.002 4.210 11 HA2 GLY 2 HA2 GLY 2 -11.840 17.607 2.385 12 HA3 GLY 2 HA3 GLY 2 -11.620 18.955 1.259 13 H SER 3 H SER 3 -9.566 19.506 0.647 14 HA SER 3 HA SER 3 -7.403 19.453 0.218 15 HB2 SER 3 HB2 SER 3 -7.206 18.713 3.144 16 HB3 SER 3 HB3 SER 3 -5.797 18.479 2.119 17 HG SER 3 HG SER 3 -5.897 20.618 1.465 18 H ASP 4 H ASP 4 -5.545 18.117 -0.118 19 HA ASP 4 HA ASP 4 -5.830 15.452 -1.086 20 HB2 ASP 4 HB2 ASP 4 -3.265 15.588 -0.768 21 HB3 ASP 4 HB3 ASP 4 -4.009 16.736 -1.879 22 H LYS 5 H LYS 5 -4.629 13.659 -0.071 23 HA LYS 5 HA LYS 5 -4.477 12.057 1.531 24 HB2 LYS 5 HB2 LYS 5 -2.739 13.890 2.088 25 HB3 LYS 5 HB3 LYS 5 -3.787 14.300 3.415 26 HG2 LYS 5 HG2 LYS 5 -3.459 11.573 3.849 27 HG3 LYS 5 HG3 LYS 5 -1.969 11.987 3.012 28 HD2 LYS 5 HD2 LYS 5 -1.265 12.445 5.140 29 HD3 LYS 5 HD3 LYS 5 -1.954 14.012 4.796 30 HE2 LYS 5 HE2 LYS 5 -3.257 11.742 6.354 31 HE3 LYS 5 HE3 LYS 5 -2.583 13.239 7.014 32 HZ1 LYS 5 HZ1 LYS 5 -4.932 13.463 6.899 33 HZ2 LYS 5 HZ2 LYS 5 -4.338 14.431 5.707 34 HZ3 LYS 5 HZ3 LYS 5 -4.994 12.979 5.345 35 H ILE 6 H ILE 6 -7.188 13.735 1.520 36 HA ILE 6 HA ILE 6 -8.145 14.272 3.888 37 HB ILE 6 HB ILE 6 -9.262 14.658 1.752 38 HG12 ILE 6 HG12 ILE 6 -11.120 13.468 3.854 39 HG13 ILE 6 HG13 ILE 6 -10.425 15.092 3.874 40 HG21 ILE 6 HG21 ILE 6 -10.673 13.056 0.668 41 HG22 ILE 6 HG22 ILE 6 -9.109 12.280 0.893 42 HG23 ILE 6 HG23 ILE 6 -10.465 11.880 1.979 43 HD11 ILE 6 HD11 ILE 6 -12.658 15.296 3.047 44 HD12 ILE 6 HD12 ILE 6 -11.588 15.507 1.640 45 HD13 ILE 6 HD13 ILE 6 -12.443 13.971 1.893 46 H HIS 7 H HIS 7 -8.062 10.844 2.835 47 HA HIS 7 HA HIS 7 -8.360 10.158 5.681 48 HB2 HIS 7 HB2 HIS 7 -10.619 9.819 5.013 49 HB3 HIS 7 HB3 HIS 7 -10.147 9.011 3.525 50 HD1 HIS 7 HD1 HIS 7 -9.109 8.130 7.218 51 HD2 HIS 7 HD2 HIS 7 -10.753 6.532 3.670 52 HE1 HIS 7 HE1 HIS 7 -9.516 5.670 7.659 53 H HIS 8 H HIS 8 -8.337 8.069 2.773 54 HA HIS 8 HA HIS 8 -5.556 7.302 3.221 55 HB2 HIS 8 HB2 HIS 8 -7.539 5.773 4.401 56 HB3 HIS 8 HB3 HIS 8 -7.389 4.987 2.840 57 HD1 HIS 8 HD1 HIS 8 -5.532 5.586 6.089 58 HD2 HIS 8 HD2 HIS 8 -4.995 3.659 2.379 59 HE1 HIS 8 HE1 HIS 8 -3.508 4.061 6.356 60 H HIS 9 H HIS 9 -5.439 5.318 1.302 61 HA HIS 9 HA HIS 9 -6.811 6.294 -1.117 62 HB2 HIS 9 HB2 HIS 9 -3.801 5.973 -0.766 63 HB3 HIS 9 HB3 HIS 9 -4.591 5.855 -2.337 64 HD1 HIS 9 HD1 HIS 9 -4.280 8.575 0.494 65 HD2 HIS 9 HD2 HIS 9 -5.165 8.016 -3.601 66 HE1 HIS 9 HE1 HIS 9 -4.458 10.859 -0.491 67 H HIS 10 H HIS 10 -6.981 4.641 -2.721 68 HA HIS 10 HA HIS 10 -6.192 1.894 -2.055 69 HB2 HIS 10 HB2 HIS 10 -9.086 2.743 -2.610 70 HB3 HIS 10 HB3 HIS 10 -8.497 1.090 -2.626 71 HD1 HIS 10 HD1 HIS 10 -8.956 3.975 0.012 72 HD2 HIS 10 HD2 HIS 10 -8.554 -0.203 -0.380 73 HE1 HIS 10 HE1 HIS 10 -9.182 3.042 2.319 74 H HIS 11 H HIS 11 -6.121 0.650 -4.032 75 HA HIS 11 HA HIS 11 -5.336 0.373 -6.100 76 HB2 HIS 11 HB2 HIS 11 -7.779 0.590 -6.544 77 HB3 HIS 11 HB3 HIS 11 -7.526 2.283 -6.965 78 HD1 HIS 11 HD1 HIS 11 -6.547 2.739 -9.428 79 HD2 HIS 11 HD2 HIS 11 -6.657 -1.299 -8.191 80 HE1 HIS 11 HE1 HIS 11 -6.018 1.348 -11.467 81 H HIS 12 H HIS 12 -3.306 1.409 -5.414 82 HA HIS 12 HA HIS 12 -2.711 3.683 -7.199 83 HB2 HIS 12 HB2 HIS 12 -3.055 4.511 -4.776 84 HB3 HIS 12 HB3 HIS 12 -1.582 3.637 -4.377 85 HD1 HIS 12 HD1 HIS 12 -2.829 6.763 -6.083 86 HD2 HIS 12 HD2 HIS 12 0.749 4.595 -5.648 87 HE1 HIS 12 HE1 HIS 12 -0.935 8.341 -6.782 88 H MET 13 H MET 13 -1.075 3.040 -8.484 89 HA MET 13 HA MET 13 0.817 0.967 -7.476 90 HB2 MET 13 HB2 MET 13 -0.285 1.282 -10.292 91 HB3 MET 13 HB3 MET 13 1.080 0.258 -9.826 92 HG2 MET 13 HG2 MET 13 -0.753 -1.206 -9.871 93 HG3 MET 13 HG3 MET 13 -0.456 -0.895 -8.166 94 HE1 MET 13 HE1 MET 13 -4.275 -1.384 -7.997 95 HE2 MET 13 HE2 MET 13 -3.199 -2.287 -9.066 96 HE3 MET 13 HE3 MET 13 -2.680 -1.864 -7.409 97 H PHE 14 H PHE 14 2.235 2.285 -6.721 98 HA PHE 14 HA PHE 14 3.074 4.807 -7.468 99 HB2 PHE 14 HB2 PHE 14 4.528 2.533 -6.043 100 HB3 PHE 14 HB3 PHE 14 5.069 4.189 -6.015 101 HD1 PHE 14 HD1 PHE 14 2.417 1.850 -4.833 102 HD2 PHE 14 HD2 PHE 14 3.928 5.904 -4.668 103 HE1 PHE 14 HE1 PHE 14 0.836 2.364 -3.026 104 HE2 PHE 14 HE2 PHE 14 2.401 6.380 -2.811 105 HZ PHE 14 HZ PHE 14 0.779 4.667 -2.034 106 HA PRO 15 HA PRO 15 6.092 4.135 -10.750 107 HB2 PRO 15 HB2 PRO 15 8.228 5.726 -10.072 108 HB3 PRO 15 HB3 PRO 15 6.677 6.332 -10.723 109 HG2 PRO 15 HG2 PRO 15 7.521 6.137 -7.826 110 HG3 PRO 15 HG3 PRO 15 6.839 7.565 -8.674 111 HD2 PRO 15 HD2 PRO 15 5.262 5.960 -7.198 112 HD3 PRO 15 HD3 PRO 15 4.690 6.550 -8.782 113 H TYR 16 H TYR 16 6.481 1.970 -10.475 114 HA TYR 16 HA TYR 16 9.093 1.268 -9.322 115 HB2 TYR 16 HB2 TYR 16 8.221 -0.615 -8.060 116 HB3 TYR 16 HB3 TYR 16 7.416 0.841 -7.568 117 HD1 TYR 16 HD1 TYR 16 6.931 -2.257 -9.678 118 HD2 TYR 16 HD2 TYR 16 5.106 0.996 -7.547 119 HE1 TYR 16 HE1 TYR 16 4.713 -3.350 -9.899 120 HE2 TYR 16 HE2 TYR 16 2.902 -0.138 -7.666 121 HH TYR 16 HH TYR 16 1.899 -2.285 -8.068 122 H LYS 17 H LYS 17 9.719 -1.010 -10.032 123 HA LYS 17 HA LYS 17 8.368 -1.838 -12.529 124 HB2 LYS 17 HB2 LYS 17 10.129 -1.740 -13.874 125 HB3 LYS 17 HB3 LYS 17 10.618 -0.439 -12.792 126 HG2 LYS 17 HG2 LYS 17 11.795 -2.598 -11.572 127 HG3 LYS 17 HG3 LYS 17 11.710 -3.218 -13.183 128 HD2 LYS 17 HD2 LYS 17 12.884 -0.468 -12.656 129 HD3 LYS 17 HD3 LYS 17 13.854 -1.947 -12.429 130 HE2 LYS 17 HE2 LYS 17 13.214 -2.715 -14.679 131 HE3 LYS 17 HE3 LYS 17 12.375 -1.191 -14.961 132 HZ1 LYS 17 HZ1 LYS 17 15.277 -1.380 -14.397 133 HZ2 LYS 17 HZ2 LYS 17 14.668 -1.431 -15.891 134 HZ3 LYS 17 HZ3 LYS 17 14.466 -0.065 -14.928 135 H ILE 18 H ILE 18 9.124 -3.993 -13.236 136 HA ILE 18 HA ILE 18 9.858 -5.842 -11.051 137 HB ILE 18 HB ILE 18 7.707 -6.000 -13.206 138 HG12 ILE 18 HG12 ILE 18 7.457 -6.110 -10.156 139 HG13 ILE 18 HG13 ILE 18 7.049 -4.722 -11.165 140 HG21 ILE 18 HG21 ILE 18 8.914 -8.206 -12.884 141 HG22 ILE 18 HG22 ILE 18 8.254 -8.216 -11.224 142 HG23 ILE 18 HG23 ILE 18 7.176 -8.221 -12.611 143 HD11 ILE 18 HD11 ILE 18 5.283 -6.047 -12.306 144 HD12 ILE 18 HD12 ILE 18 5.597 -7.382 -11.164 145 HD13 ILE 18 HD13 ILE 18 5.016 -5.827 -10.564 146 H VAL 19 H VAL 19 12.004 -6.540 -11.706 147 HA VAL 19 HA VAL 19 12.569 -6.642 -14.586 148 HB VAL 19 HB VAL 19 14.873 -6.826 -13.911 149 HG11 VAL 19 HG11 VAL 19 15.233 -4.520 -13.323 150 HG12 VAL 19 HG12 VAL 19 13.829 -4.639 -14.391 151 HG13 VAL 19 HG13 VAL 19 13.606 -4.396 -12.639 152 HG21 VAL 19 HG21 VAL 19 14.685 -7.782 -11.594 153 HG22 VAL 19 HG22 VAL 19 15.731 -6.365 -11.730 154 HG23 VAL 19 HG23 VAL 19 14.114 -6.192 -11.067 155 H ASP 20 H ASP 20 14.738 -8.783 -13.640 156 HA ASP 20 HA ASP 20 13.750 -11.063 -14.405 157 HB2 ASP 20 HB2 ASP 20 16.079 -10.661 -13.965 158 HB3 ASP 20 HB3 ASP 20 15.786 -10.578 -12.226 159 H ASP 21 H ASP 21 14.295 -10.790 -10.902 160 HA ASP 21 HA ASP 21 11.543 -11.723 -10.249 161 HB2 ASP 21 HB2 ASP 21 14.174 -12.772 -9.091 162 HB3 ASP 21 HB3 ASP 21 12.566 -13.078 -8.422 163 H VAL 22 H VAL 22 13.088 -9.065 -10.173 164 HA VAL 22 HA VAL 22 13.107 -8.647 -7.229 165 HB VAL 22 HB VAL 22 15.225 -7.396 -9.020 166 HG11 VAL 22 HG11 VAL 22 16.207 -7.246 -6.582 167 HG12 VAL 22 HG12 VAL 22 15.004 -6.060 -7.137 168 HG13 VAL 22 HG13 VAL 22 14.533 -7.392 -6.089 169 HG21 VAL 22 HG21 VAL 22 15.364 -9.928 -7.325 170 HG22 VAL 22 HG22 VAL 22 15.689 -9.776 -9.063 171 HG23 VAL 22 HG23 VAL 22 16.788 -9.031 -7.906 172 H VAL 23 H VAL 23 12.045 -6.948 -6.520 173 HA VAL 23 HA VAL 23 10.549 -5.316 -8.468 174 HB VAL 23 HB VAL 23 10.483 -5.684 -5.462 175 HG11 VAL 23 HG11 VAL 23 8.573 -4.073 -7.198 176 HG12 VAL 23 HG12 VAL 23 8.376 -4.435 -5.468 177 HG13 VAL 23 HG13 VAL 23 9.713 -3.421 -5.995 178 HG21 VAL 23 HG21 VAL 23 9.673 -7.663 -6.769 179 HG22 VAL 23 HG22 VAL 23 8.416 -6.896 -5.818 180 HG23 VAL 23 HG23 VAL 23 8.486 -6.624 -7.569 181 H ILE 24 H ILE 24 11.074 -3.166 -8.850 182 HA ILE 24 HA ILE 24 13.206 -1.920 -7.126 183 HB ILE 24 HB ILE 24 12.716 -1.581 -10.121 184 HG12 ILE 24 HG12 ILE 24 15.142 -2.039 -10.276 185 HG13 ILE 24 HG13 ILE 24 15.183 -2.331 -8.527 186 HG21 ILE 24 HG21 ILE 24 14.548 0.131 -9.986 187 HG22 ILE 24 HG22 ILE 24 12.985 0.613 -9.339 188 HG23 ILE 24 HG23 ILE 24 14.280 0.144 -8.223 189 HD11 ILE 24 HD11 ILE 24 15.243 -4.313 -10.118 190 HD12 ILE 24 HD12 ILE 24 14.109 -4.409 -8.763 191 HD13 ILE 24 HD13 ILE 24 13.508 -4.005 -10.389 192 H LEU 25 H LEU 25 11.890 -0.768 -5.608 193 HA LEU 25 HA LEU 25 9.706 0.836 -6.624 194 HB2 LEU 25 HB2 LEU 25 11.277 1.011 -4.042 195 HB3 LEU 25 HB3 LEU 25 9.863 1.958 -4.471 196 HG LEU 25 HG LEU 25 8.863 0.393 -3.223 197 HD11 LEU 25 HD11 LEU 25 7.868 0.083 -5.551 198 HD12 LEU 25 HD12 LEU 25 8.885 -1.331 -5.745 199 HD13 LEU 25 HD13 LEU 25 7.671 -1.298 -4.468 200 HD21 LEU 25 HD21 LEU 25 10.639 -1.809 -4.197 201 HD22 LEU 25 HD22 LEU 25 10.916 -0.873 -2.713 202 HD23 LEU 25 HD23 LEU 25 9.458 -1.898 -2.880 203 H MET 26 H MET 26 10.068 3.024 -7.458 204 HA MET 26 HA MET 26 12.707 4.316 -7.042 205 HB2 MET 26 HB2 MET 26 11.474 3.457 -9.650 206 HB3 MET 26 HB3 MET 26 12.216 5.055 -9.596 207 HG2 MET 26 HG2 MET 26 14.340 4.239 -9.051 208 HG3 MET 26 HG3 MET 26 13.743 2.604 -8.762 209 HE1 MET 26 HE1 MET 26 16.018 2.029 -10.660 210 HE2 MET 26 HE2 MET 26 16.024 2.837 -12.227 211 HE3 MET 26 HE3 MET 26 16.182 3.802 -10.746 212 HA PRO 27 HA PRO 27 8.772 6.693 -6.248 213 HB2 PRO 27 HB2 PRO 27 9.357 7.799 -3.834 214 HB3 PRO 27 HB3 PRO 27 8.886 6.096 -4.051 215 HG2 PRO 27 HG2 PRO 27 11.683 7.226 -3.775 216 HG3 PRO 27 HG3 PRO 27 10.963 5.860 -2.881 217 HD2 PRO 27 HD2 PRO 27 12.540 5.467 -5.075 218 HD3 PRO 27 HD3 PRO 27 11.144 4.422 -4.745 219 H ASN 28 H ASN 28 10.764 9.041 -4.598 220 HA ASN 28 HA ASN 28 11.746 10.860 -6.444 221 HB2 ASN 28 HB2 ASN 28 9.848 12.336 -6.916 222 HB3 ASN 28 HB3 ASN 28 9.670 10.835 -7.765 223 HD21 ASN 28 HD21 ASN 28 7.739 13.012 -6.407 224 HD22 ASN 28 HD22 ASN 28 6.588 11.993 -5.582 225 H LYS 29 H LYS 29 9.079 12.260 -4.626 226 HA LYS 29 HA LYS 29 10.596 12.267 -2.091 227 HB2 LYS 29 HB2 LYS 29 9.200 14.710 -3.228 228 HB3 LYS 29 HB3 LYS 29 9.943 14.557 -1.646 229 HG2 LYS 29 HG2 LYS 29 11.678 15.590 -2.704 230 HG3 LYS 29 HG3 LYS 29 12.125 13.923 -3.045 231 HD2 LYS 29 HD2 LYS 29 10.419 14.583 -5.165 232 HD3 LYS 29 HD3 LYS 29 11.250 16.098 -4.852 233 HE2 LYS 29 HE2 LYS 29 12.689 13.456 -5.187 234 HE3 LYS 29 HE3 LYS 29 12.221 14.421 -6.594 235 HZ1 LYS 29 HZ1 LYS 29 13.697 16.051 -6.066 236 HZ2 LYS 29 HZ2 LYS 29 13.936 15.600 -4.498 237 HZ3 LYS 29 HZ3 LYS 29 14.511 14.670 -5.748 238 H GLU 30 H GLU 30 8.417 10.615 -3.334 239 HA GLU 30 HA GLU 30 5.970 11.099 -1.953 240 HB2 GLU 30 HB2 GLU 30 7.291 8.853 -3.420 241 HB3 GLU 30 HB3 GLU 30 5.979 8.414 -2.332 242 HG2 GLU 30 HG2 GLU 30 5.643 10.637 -4.375 243 HG3 GLU 30 HG3 GLU 30 5.432 8.943 -4.802 244 H LEU 31 H LEU 31 9.082 10.062 -0.858 245 HA LEU 31 HA LEU 31 8.117 8.808 1.594 246 HB2 LEU 31 HB2 LEU 31 10.801 9.586 0.471 247 HB3 LEU 31 HB3 LEU 31 10.663 9.428 2.214 248 HG LEU 31 HG LEU 31 10.099 7.178 2.183 249 HD11 LEU 31 HD11 LEU 31 9.840 5.780 0.183 250 HD12 LEU 31 HD12 LEU 31 8.559 6.999 0.279 251 HD13 LEU 31 HD13 LEU 31 9.905 7.227 -0.854 252 HD21 LEU 31 HD21 LEU 31 12.051 6.183 1.175 253 HD22 LEU 31 HD22 LEU 31 12.180 7.487 -0.010 254 HD23 LEU 31 HD23 LEU 31 12.505 7.806 1.710 255 H ASN 32 H ASN 32 6.538 10.716 1.777 256 HA ASN 32 HA ASN 32 7.686 13.041 3.248 257 HB2 ASN 32 HB2 ASN 32 5.772 14.358 2.360 258 HB3 ASN 32 HB3 ASN 32 6.984 13.831 1.179 259 HD21 ASN 32 HD21 ASN 32 6.040 13.176 -0.689 260 HD22 ASN 32 HD22 ASN 32 4.662 12.079 -0.681 261 H ILE 33 H ILE 33 6.129 10.354 3.835 262 HA ILE 33 HA ILE 33 5.390 9.446 5.716 263 HB ILE 33 HB ILE 33 5.353 11.917 6.757 264 HG12 ILE 33 HG12 ILE 33 5.847 9.790 7.831 265 HG13 ILE 33 HG13 ILE 33 4.961 10.932 8.842 266 HG21 ILE 33 HG21 ILE 33 2.427 11.165 6.853 267 HG22 ILE 33 HG22 ILE 33 3.257 12.404 7.815 268 HG23 ILE 33 HG23 ILE 33 3.152 12.588 6.061 269 HD11 ILE 33 HD11 ILE 33 2.856 9.585 8.368 270 HD12 ILE 33 HD12 ILE 33 3.900 8.389 7.557 271 HD13 ILE 33 HD13 ILE 33 4.121 8.744 9.267 272 H GLU 34 H GLU 34 3.615 11.247 3.285 273 HA GLU 34 HA GLU 34 1.073 10.094 3.843 274 HB2 GLU 34 HB2 GLU 34 2.023 11.218 1.192 275 HB3 GLU 34 HB3 GLU 34 0.367 10.994 1.723 276 HG2 GLU 34 HG2 GLU 34 0.663 12.596 3.542 277 HG3 GLU 34 HG3 GLU 34 2.328 12.917 3.070 278 H ASN 35 H ASN 35 3.877 8.848 2.338 279 HA ASN 35 HA ASN 35 2.285 6.591 1.098 280 HB2 ASN 35 HB2 ASN 35 3.669 6.189 -0.437 281 HB3 ASN 35 HB3 ASN 35 4.040 7.873 -0.263 282 HD21 ASN 35 HD21 ASN 35 5.701 5.505 -1.301 283 HD22 ASN 35 HD22 ASN 35 6.959 5.419 -0.121 284 H ALA 36 H ALA 36 4.599 7.425 3.621 285 HA ALA 36 HA ALA 36 5.740 4.981 3.888 286 HB1 ALA 36 HB1 ALA 36 5.432 7.084 6.025 287 HB2 ALA 36 HB2 ALA 36 6.584 5.709 6.034 288 HB3 ALA 36 HB3 ALA 36 6.724 6.954 4.811 289 H HIS 37 H HIS 37 2.808 6.021 5.767 290 HA HIS 37 HA HIS 37 2.965 3.735 7.501 291 HB2 HIS 37 HB2 HIS 37 1.587 5.779 7.958 292 HB3 HIS 37 HB3 HIS 37 0.439 5.239 6.733 293 HD1 HIS 37 HD1 HIS 37 0.764 2.041 7.921 294 HD2 HIS 37 HD2 HIS 37 -0.492 5.625 9.733 295 HE1 HIS 37 HE1 HIS 37 -0.664 1.365 9.931 296 H LEU 38 H LEU 38 1.321 4.218 4.321 297 HA LEU 38 HA LEU 38 0.151 1.534 4.438 298 HB2 LEU 38 HB2 LEU 38 -1.127 2.126 2.691 299 HB3 LEU 38 HB3 LEU 38 -0.860 3.685 3.421 300 HG LEU 38 HG LEU 38 1.203 3.695 1.630 301 HD11 LEU 38 HD11 LEU 38 -0.982 2.073 0.283 302 HD12 LEU 38 HD12 LEU 38 0.551 2.614 -0.446 303 HD13 LEU 38 HD13 LEU 38 0.530 1.395 0.840 304 HD21 LEU 38 HD21 LEU 38 -0.483 5.446 1.781 305 HD22 LEU 38 HD22 LEU 38 -0.247 4.982 0.114 306 HD23 LEU 38 HD23 LEU 38 -1.689 4.393 0.996 307 H PHE 39 H PHE 39 3.067 3.020 3.254 308 HA PHE 39 HA PHE 39 3.973 1.768 1.193 309 HB2 PHE 39 HB2 PHE 39 5.139 3.353 2.799 310 HB3 PHE 39 HB3 PHE 39 5.743 1.959 3.659 311 HD1 PHE 39 HD1 PHE 39 5.573 3.460 0.225 312 HD2 PHE 39 HD2 PHE 39 7.962 1.309 3.088 313 HE1 PHE 39 HE1 PHE 39 7.519 3.790 -1.208 314 HE2 PHE 39 HE2 PHE 39 9.945 1.590 1.620 315 HZ PHE 39 HZ PHE 39 9.754 2.852 -0.512 316 H LYS 40 H LYS 40 4.355 0.216 4.420 317 HA LYS 40 HA LYS 40 5.461 -2.154 3.186 318 HB2 LYS 40 HB2 LYS 40 5.751 -3.065 5.265 319 HB3 LYS 40 HB3 LYS 40 5.900 -1.330 5.563 320 HG2 LYS 40 HG2 LYS 40 3.404 -1.444 6.299 321 HG3 LYS 40 HG3 LYS 40 3.613 -3.211 6.234 322 HD2 LYS 40 HD2 LYS 40 5.645 -2.889 7.770 323 HD3 LYS 40 HD3 LYS 40 5.086 -1.208 7.998 324 HE2 LYS 40 HE2 LYS 40 2.840 -2.158 8.728 325 HE3 LYS 40 HE3 LYS 40 3.552 -3.775 8.569 326 HZ1 LYS 40 HZ1 LYS 40 5.245 -3.042 10.191 327 HZ2 LYS 40 HZ2 LYS 40 4.336 -1.693 10.497 328 HZ3 LYS 40 HZ3 LYS 40 3.758 -3.235 10.786 329 H LYS 41 H LYS 41 2.103 -1.291 4.113 330 HA LYS 41 HA LYS 41 1.032 -3.961 3.833 331 HB2 LYS 41 HB2 LYS 41 0.057 -1.214 4.358 332 HB3 LYS 41 HB3 LYS 41 -0.896 -1.947 3.112 333 HG2 LYS 41 HG2 LYS 41 -1.969 -2.439 5.158 334 HG3 LYS 41 HG3 LYS 41 -1.295 -3.950 4.564 335 HD2 LYS 41 HD2 LYS 41 0.679 -3.585 6.126 336 HD3 LYS 41 HD3 LYS 41 -0.180 -2.193 6.800 337 HE2 LYS 41 HE2 LYS 41 -1.087 -5.120 6.799 338 HE3 LYS 41 HE3 LYS 41 -0.516 -4.194 8.187 339 HZ1 LYS 41 HZ1 LYS 41 -3.013 -3.771 6.680 340 HZ2 LYS 41 HZ2 LYS 41 -2.877 -4.260 8.229 341 HZ3 LYS 41 HZ3 LYS 41 -2.456 -2.706 7.817 342 H TRP 42 H TRP 42 1.441 -1.197 1.616 343 HA TRP 42 HA TRP 42 0.418 -2.496 -0.722 344 HB2 TRP 42 HB2 TRP 42 0.654 -0.199 -0.925 345 HB3 TRP 42 HB3 TRP 42 2.237 -0.165 -0.158 346 HD1 TRP 42 HD1 TRP 42 0.902 -1.744 -3.476 347 HE1 TRP 42 HE1 TRP 42 2.549 -1.302 -5.307 348 HE3 TRP 42 HE3 TRP 42 4.374 0.791 -0.729 349 HZ2 TRP 42 HZ2 TRP 42 5.267 0.008 -5.549 350 HZ3 TRP 42 HZ3 TRP 42 6.492 1.514 -1.753 351 HH2 TRP 42 HH2 TRP 42 6.837 1.318 -4.199 352 H VAL 43 H VAL 43 3.949 -2.028 0.127 353 HA VAL 43 HA VAL 43 4.914 -3.752 -1.739 354 HB VAL 43 HB VAL 43 5.921 -3.131 1.062 355 HG11 VAL 43 HG11 VAL 43 7.489 -4.573 -1.107 356 HG12 VAL 43 HG12 VAL 43 8.179 -3.880 0.378 357 HG13 VAL 43 HG13 VAL 43 7.042 -5.227 0.482 358 HG21 VAL 43 HG21 VAL 43 7.491 -1.655 -0.128 359 HG22 VAL 43 HG22 VAL 43 6.829 -2.184 -1.696 360 HG23 VAL 43 HG23 VAL 43 5.832 -1.262 -0.574 361 H PHE 44 H PHE 44 3.522 -4.795 1.403 362 HA PHE 44 HA PHE 44 4.348 -7.467 1.333 363 HB2 PHE 44 HB2 PHE 44 2.129 -5.907 2.671 364 HB3 PHE 44 HB3 PHE 44 2.122 -7.608 2.754 365 HD1 PHE 44 HD1 PHE 44 5.309 -5.578 2.981 366 HD2 PHE 44 HD2 PHE 44 2.328 -7.887 5.070 367 HE1 PHE 44 HE1 PHE 44 6.648 -5.444 5.040 368 HE2 PHE 44 HE2 PHE 44 3.728 -7.826 7.121 369 HZ PHE 44 HZ PHE 44 5.876 -6.579 7.113 370 H ASP 45 H ASP 45 1.185 -6.036 0.388 371 HA ASP 45 HA ASP 45 0.277 -8.611 -0.661 372 HB2 ASP 45 HB2 ASP 45 -0.842 -5.822 -0.568 373 HB3 ASP 45 HB3 ASP 45 -1.512 -6.924 -1.763 374 H GLU 46 H GLU 46 1.455 -5.607 -2.094 375 HA GLU 46 HA GLU 46 0.887 -6.190 -4.782 376 HB2 GLU 46 HB2 GLU 46 1.482 -3.977 -3.714 377 HB3 GLU 46 HB3 GLU 46 3.148 -4.523 -3.578 378 HG2 GLU 46 HG2 GLU 46 3.220 -3.212 -5.452 379 HG3 GLU 46 HG3 GLU 46 3.013 -4.796 -6.185 380 H PHE 47 H PHE 47 3.642 -7.157 -2.698 381 HA PHE 47 HA PHE 47 4.778 -8.578 -5.036 382 HB2 PHE 47 HB2 PHE 47 6.532 -7.130 -3.084 383 HB3 PHE 47 HB3 PHE 47 6.881 -7.898 -4.660 384 HD1 PHE 47 HD1 PHE 47 5.801 -6.835 -6.794 385 HD2 PHE 47 HD2 PHE 47 6.162 -4.841 -3.006 386 HE1 PHE 47 HE1 PHE 47 5.606 -4.651 -7.932 387 HE2 PHE 47 HE2 PHE 47 5.869 -2.632 -4.127 388 HZ PHE 47 HZ PHE 47 5.647 -2.539 -6.603 389 H LEU 48 H LEU 48 5.073 -8.265 -1.429 390 HA LEU 48 HA LEU 48 6.683 -10.618 -1.244 391 HB2 LEU 48 HB2 LEU 48 4.902 -9.462 0.919 392 HB3 LEU 48 HB3 LEU 48 6.237 -10.591 1.146 393 HG LEU 48 HG LEU 48 6.414 -7.675 0.339 394 HD11 LEU 48 HD11 LEU 48 6.101 -8.307 2.777 395 HD12 LEU 48 HD12 LEU 48 7.679 -9.109 2.690 396 HD13 LEU 48 HD13 LEU 48 7.563 -7.356 2.411 397 HD21 LEU 48 HD21 LEU 48 8.602 -9.775 0.346 398 HD22 LEU 48 HD22 LEU 48 8.110 -8.717 -0.976 399 HD23 LEU 48 HD23 LEU 48 8.910 -8.025 0.449 400 H ASN 49 H ASN 49 3.200 -10.140 -0.999 401 HA ASN 49 HA ASN 49 2.642 -12.993 -0.571 402 HB2 ASN 49 HB2 ASN 49 0.763 -10.661 -1.073 403 HB3 ASN 49 HB3 ASN 49 0.280 -12.296 -0.647 404 HD21 ASN 49 HD21 ASN 49 -0.141 -9.674 0.957 405 HD22 ASN 49 HD22 ASN 49 0.567 -10.098 2.494 406 H LYS 50 H LYS 50 3.373 -11.052 -3.259 407 HA LYS 50 HA LYS 50 2.361 -13.028 -5.222 408 HB2 LYS 50 HB2 LYS 50 3.727 -10.335 -5.367 409 HB3 LYS 50 HB3 LYS 50 3.975 -11.406 -6.695 410 HG2 LYS 50 HG2 LYS 50 1.197 -11.537 -6.340 411 HG3 LYS 50 HG3 LYS 50 1.575 -9.909 -5.764 412 HD2 LYS 50 HD2 LYS 50 2.673 -9.408 -7.949 413 HD3 LYS 50 HD3 LYS 50 2.213 -11.040 -8.521 414 HE2 LYS 50 HE2 LYS 50 -0.191 -10.468 -7.985 415 HE3 LYS 50 HE3 LYS 50 0.329 -8.834 -7.569 416 HZ1 LYS 50 HZ1 LYS 50 1.153 -8.683 -9.932 417 HZ2 LYS 50 HZ2 LYS 50 0.352 -10.106 -10.226 418 HZ3 LYS 50 HZ3 LYS 50 -0.476 -8.789 -9.745 419 H GLY 51 H GLY 51 4.637 -13.036 -2.850 420 HA2 GLY 51 HA2 GLY 51 6.219 -14.564 -2.414 421 HA3 GLY 51 HA3 GLY 51 6.067 -15.228 -4.044 422 H TYR 52 H TYR 52 6.687 -11.824 -4.147 423 HA TYR 52 HA TYR 52 9.369 -12.276 -5.184 424 HB2 TYR 52 HB2 TYR 52 7.780 -9.794 -4.521 425 HB3 TYR 52 HB3 TYR 52 9.433 -9.735 -5.114 426 HD1 TYR 52 HD1 TYR 52 9.968 -11.113 -7.227 427 HD2 TYR 52 HD2 TYR 52 6.022 -9.826 -6.148 428 HE1 TYR 52 HE1 TYR 52 9.322 -11.207 -9.595 429 HE2 TYR 52 HE2 TYR 52 5.296 -9.906 -8.488 430 HH TYR 52 HH TYR 52 7.584 -10.740 -11.155 431 H ASN 53 H ASN 53 10.950 -12.751 -3.878 432 HA ASN 53 HA ASN 53 11.059 -11.522 -1.146 433 HB2 ASN 53 HB2 ASN 53 11.656 -14.247 -2.150 434 HB3 ASN 53 HB3 ASN 53 12.798 -13.610 -1.003 435 HD21 ASN 53 HD21 ASN 53 11.346 -15.814 -0.427 436 HD22 ASN 53 HD22 ASN 53 10.066 -15.549 0.748 437 H LYS 54 H LYS 54 12.040 -10.482 -3.909 438 HA LYS 54 HA LYS 54 14.363 -9.324 -2.566 439 HB2 LYS 54 HB2 LYS 54 14.497 -10.599 -5.272 440 HB3 LYS 54 HB3 LYS 54 15.375 -9.114 -4.979 441 HG2 LYS 54 HG2 LYS 54 17.009 -10.130 -3.954 442 HG3 LYS 54 HG3 LYS 54 15.953 -10.732 -2.703 443 HD2 LYS 54 HD2 LYS 54 16.613 -12.093 -5.326 444 HD3 LYS 54 HD3 LYS 54 17.213 -12.532 -3.711 445 HE2 LYS 54 HE2 LYS 54 14.814 -12.916 -2.996 446 HE3 LYS 54 HE3 LYS 54 14.323 -12.629 -4.676 447 HZ1 LYS 54 HZ1 LYS 54 15.748 -14.494 -5.311 448 HZ2 LYS 54 HZ2 LYS 54 16.120 -14.794 -3.734 449 HZ3 LYS 54 HZ3 LYS 54 14.581 -14.974 -4.265 450 H ILE 55 H ILE 55 14.127 -7.249 -2.442 451 HA ILE 55 HA ILE 55 12.633 -5.702 -4.486 452 HB ILE 55 HB ILE 55 12.379 -5.628 -1.454 453 HG12 ILE 55 HG12 ILE 55 10.056 -5.186 -3.314 454 HG13 ILE 55 HG13 ILE 55 10.759 -6.803 -3.359 455 HG21 ILE 55 HG21 ILE 55 11.680 -3.395 -3.381 456 HG22 ILE 55 HG22 ILE 55 10.951 -3.528 -1.772 457 HG23 ILE 55 HG23 ILE 55 12.693 -3.287 -1.924 458 HD11 ILE 55 HD11 ILE 55 8.855 -6.568 -1.783 459 HD12 ILE 55 HD12 ILE 55 10.360 -7.172 -1.068 460 HD13 ILE 55 HD13 ILE 55 9.860 -5.482 -0.788 461 H PHE 56 H PHE 56 13.514 -3.522 -4.657 462 HA PHE 56 HA PHE 56 15.779 -2.867 -2.891 463 HB2 PHE 56 HB2 PHE 56 15.606 -2.194 -5.858 464 HB3 PHE 56 HB3 PHE 56 16.864 -1.671 -4.750 465 HD1 PHE 56 HD1 PHE 56 17.452 -4.128 -3.201 466 HD2 PHE 56 HD2 PHE 56 16.586 -3.639 -7.408 467 HE1 PHE 56 HE1 PHE 56 18.833 -6.110 -3.752 468 HE2 PHE 56 HE2 PHE 56 17.836 -5.677 -7.932 469 HZ PHE 56 HZ PHE 56 19.002 -6.915 -6.091 470 H LEU 57 H LEU 57 16.034 -0.558 -2.496 471 HA LEU 57 HA LEU 57 13.804 1.136 -3.525 472 HB2 LEU 57 HB2 LEU 57 13.406 0.527 -1.162 473 HB3 LEU 57 HB3 LEU 57 15.009 1.143 -0.739 474 HG LEU 57 HG LEU 57 14.327 3.413 -1.493 475 HD11 LEU 57 HD11 LEU 57 11.859 3.844 -1.777 476 HD12 LEU 57 HD12 LEU 57 12.569 2.936 -3.106 477 HD13 LEU 57 HD13 LEU 57 11.600 2.085 -1.869 478 HD21 LEU 57 HD21 LEU 57 12.867 3.885 0.426 479 HD22 LEU 57 HD22 LEU 57 12.520 2.145 0.606 480 HD23 LEU 57 HD23 LEU 57 14.165 2.775 0.859 481 H VAL 58 H VAL 58 15.363 1.640 -5.273 482 HA VAL 58 HA VAL 58 17.639 3.025 -5.184 483 HB VAL 58 HB VAL 58 15.070 3.645 -6.751 484 HG11 VAL 58 HG11 VAL 58 16.489 5.533 -7.166 485 HG12 VAL 58 HG12 VAL 58 17.929 4.524 -7.354 486 HG13 VAL 58 HG13 VAL 58 16.635 4.507 -8.562 487 HG21 VAL 58 HG21 VAL 58 17.389 1.771 -7.306 488 HG22 VAL 58 HG22 VAL 58 15.708 1.338 -7.015 489 HG23 VAL 58 HG23 VAL 58 16.144 2.202 -8.493 490 H LEU 59 H LEU 59 18.130 5.284 -4.787 491 HA LEU 59 HA LEU 59 16.078 7.086 -3.699 492 HB2 LEU 59 HB2 LEU 59 18.859 6.435 -2.761 493 HB3 LEU 59 HB3 LEU 59 18.021 7.846 -2.173 494 HG LEU 59 HG LEU 59 16.438 5.344 -1.874 495 HD11 LEU 59 HD11 LEU 59 18.710 4.411 -1.511 496 HD12 LEU 59 HD12 LEU 59 18.982 5.604 -0.225 497 HD13 LEU 59 HD13 LEU 59 17.701 4.392 -0.057 498 HD21 LEU 59 HD21 LEU 59 15.868 7.523 -0.798 499 HD22 LEU 59 HD22 LEU 59 16.075 6.194 0.380 500 HD23 LEU 59 HD23 LEU 59 17.355 7.407 0.141 501 H SER 60 H SER 60 17.430 6.832 -6.535 502 HA SER 60 HA SER 60 19.554 8.538 -6.878 503 HB2 SER 60 HB2 SER 60 17.242 7.808 -8.747 504 HB3 SER 60 HB3 SER 60 18.766 8.497 -9.276 505 HG SER 60 HG SER 60 19.809 6.714 -8.241 506 H ASP 61 H ASP 61 16.092 9.313 -7.382 507 HA ASP 61 HA ASP 61 16.744 12.200 -7.331 508 HB2 ASP 61 HB2 ASP 61 15.246 10.893 -9.055 509 HB3 ASP 61 HB3 ASP 61 13.988 11.148 -7.847 510 H VAL 62 H VAL 62 16.530 10.148 -4.934 511 HA VAL 62 HA VAL 62 14.308 11.438 -3.451 512 HB VAL 62 HB VAL 62 15.750 8.888 -2.730 513 HG11 VAL 62 HG11 VAL 62 13.233 10.255 -1.735 514 HG12 VAL 62 HG12 VAL 62 13.682 8.573 -1.332 515 HG13 VAL 62 HG13 VAL 62 14.727 9.911 -0.854 516 HG21 VAL 62 HG21 VAL 62 13.105 9.137 -4.227 517 HG22 VAL 62 HG22 VAL 62 14.612 8.500 -4.909 518 HG23 VAL 62 HG23 VAL 62 13.820 7.645 -3.608 519 H GLU 63 H GLU 63 15.179 13.205 -2.628 520 HA GLU 63 HA GLU 63 17.971 13.521 -2.050 521 HB2 GLU 63 HB2 GLU 63 16.474 15.383 -2.510 522 HB3 GLU 63 HB3 GLU 63 15.489 15.014 -1.086 523 HG2 GLU 63 HG2 GLU 63 17.351 15.539 0.418 524 HG3 GLU 63 HG3 GLU 63 18.466 15.701 -0.933 525 H SER 64 H SER 64 15.051 12.794 -0.111 526 HA SER 64 HA SER 64 16.787 11.385 1.714 527 HB2 SER 64 HB2 SER 64 17.009 13.737 2.353 528 HB3 SER 64 HB3 SER 64 15.282 13.919 2.475 529 HG SER 64 HG SER 64 15.303 12.727 4.345 530 H ILE 65 H ILE 65 15.710 10.480 3.488 531 HA ILE 65 HA ILE 65 12.883 9.735 3.127 532 HB ILE 65 HB ILE 65 14.543 7.914 3.099 533 HG12 ILE 65 HG12 ILE 65 13.132 7.600 5.740 534 HG13 ILE 65 HG13 ILE 65 12.242 7.799 4.229 535 HG21 ILE 65 HG21 ILE 65 16.363 8.790 4.429 536 HG22 ILE 65 HG22 ILE 65 15.304 8.863 5.861 537 HG23 ILE 65 HG23 ILE 65 15.754 7.299 5.152 538 HD11 ILE 65 HD11 ILE 65 13.389 5.864 3.235 539 HD12 ILE 65 HD12 ILE 65 14.271 5.619 4.773 540 HD13 ILE 65 HD13 ILE 65 12.520 5.449 4.714 541 H ASP 66 H ASP 66 12.492 9.287 6.035 542 HA ASP 66 HA ASP 66 13.075 11.879 7.302 543 HB2 ASP 66 HB2 ASP 66 10.987 12.349 6.211 544 HB3 ASP 66 HB3 ASP 66 10.349 10.756 6.615 545 H SER 67 H SER 67 12.328 11.747 9.615 546 HA SER 67 HA SER 67 13.417 9.585 11.029 547 HB2 SER 67 HB2 SER 67 12.956 12.016 11.737 548 HB3 SER 67 HB3 SER 67 11.291 11.504 12.043 549 HG SER 67 HG SER 67 13.707 10.714 13.335 550 H PHE 68 H PHE 68 10.045 10.071 9.858 551 HA PHE 68 HA PHE 68 8.902 7.869 11.336 552 HB2 PHE 68 HB2 PHE 68 7.530 9.635 10.297 553 HB3 PHE 68 HB3 PHE 68 7.983 9.114 8.703 554 HD1 PHE 68 HD1 PHE 68 6.096 8.193 11.776 555 HD2 PHE 68 HD2 PHE 68 7.088 7.100 7.744 556 HE1 PHE 68 HE1 PHE 68 4.296 6.470 11.787 557 HE2 PHE 68 HE2 PHE 68 5.351 5.275 7.822 558 HZ PHE 68 HZ PHE 68 3.951 5.006 9.839 559 H SER 69 H SER 69 10.038 8.140 7.887 560 HA SER 69 HA SER 69 9.369 5.398 7.434 561 HB2 SER 69 HB2 SER 69 10.496 6.178 5.130 562 HB3 SER 69 HB3 SER 69 8.866 6.590 5.667 563 HG SER 69 HG SER 69 9.557 8.584 5.335 564 H LEU 70 H LEU 70 12.356 6.981 8.245 565 HA LEU 70 HA LEU 70 14.166 4.945 7.390 566 HB2 LEU 70 HB2 LEU 70 14.045 6.769 9.866 567 HB3 LEU 70 HB3 LEU 70 15.315 5.566 9.771 568 HG LEU 70 HG LEU 70 14.867 7.599 7.569 569 HD11 LEU 70 HD11 LEU 70 15.351 8.869 9.573 570 HD12 LEU 70 HD12 LEU 70 16.739 7.832 9.970 571 HD13 LEU 70 HD13 LEU 70 16.788 8.883 8.534 572 HD21 LEU 70 HD21 LEU 70 16.194 5.638 6.941 573 HD22 LEU 70 HD22 LEU 70 17.264 7.056 7.095 574 HD23 LEU 70 HD23 LEU 70 17.212 5.836 8.382 575 H GLY 71 H GLY 71 11.881 4.959 10.037 576 HA2 GLY 71 HA2 GLY 71 12.604 2.386 11.159 577 HA3 GLY 71 HA3 GLY 71 11.076 3.225 11.372 578 H VAL 72 H VAL 72 10.295 3.450 8.587 579 HA VAL 72 HA VAL 72 8.998 0.902 8.566 580 HB VAL 72 HB VAL 72 8.082 3.280 7.830 581 HG11 VAL 72 HG11 VAL 72 8.821 2.188 5.102 582 HG12 VAL 72 HG12 VAL 72 7.721 3.527 5.452 583 HG13 VAL 72 HG13 VAL 72 9.435 3.677 5.836 584 HG21 VAL 72 HG21 VAL 72 7.298 0.675 6.426 585 HG22 VAL 72 HG22 VAL 72 6.814 1.133 8.086 586 HG23 VAL 72 HG23 VAL 72 6.255 2.078 6.715 587 H ILE 73 H ILE 73 11.621 2.294 6.661 588 HA ILE 73 HA ILE 73 11.889 0.315 4.649 589 HB ILE 73 HB ILE 73 13.648 2.364 5.996 590 HG12 ILE 73 HG12 ILE 73 13.756 3.395 3.898 591 HG13 ILE 73 HG13 ILE 73 13.393 1.941 3.037 592 HG21 ILE 73 HG21 ILE 73 14.741 0.261 4.089 593 HG22 ILE 73 HG22 ILE 73 15.540 1.797 4.469 594 HG23 ILE 73 HG23 ILE 73 15.297 0.597 5.745 595 HD11 ILE 73 HD11 ILE 73 11.579 3.556 2.830 596 HD12 ILE 73 HD12 ILE 73 11.010 2.084 3.631 597 HD13 ILE 73 HD13 ILE 73 11.326 3.532 4.582 598 H VAL 74 H VAL 74 13.443 0.447 7.916 599 HA VAL 74 HA VAL 74 14.526 -2.236 7.735 600 HB VAL 74 HB VAL 74 13.811 -0.335 10.034 601 HG11 VAL 74 HG11 VAL 74 15.102 -1.841 11.544 602 HG12 VAL 74 HG12 VAL 74 13.566 -2.531 10.993 603 HG13 VAL 74 HG13 VAL 74 15.101 -3.083 10.268 604 HG21 VAL 74 HG21 VAL 74 16.465 -1.266 8.848 605 HG22 VAL 74 HG22 VAL 74 15.698 0.331 8.659 606 HG23 VAL 74 HG23 VAL 74 16.279 -0.183 10.244 607 H ASN 75 H ASN 75 11.330 -0.934 8.806 608 HA ASN 75 HA ASN 75 10.458 -3.341 9.947 609 HB2 ASN 75 HB2 ASN 75 9.409 -0.833 9.619 610 HB3 ASN 75 HB3 ASN 75 8.464 -1.687 8.408 611 HD21 ASN 75 HD21 ASN 75 9.585 -1.783 11.813 612 HD22 ASN 75 HD22 ASN 75 8.102 -2.475 12.423 613 H ILE 76 H ILE 76 10.323 -2.321 6.519 614 HA ILE 76 HA ILE 76 9.006 -4.694 5.537 615 HB ILE 76 HB ILE 76 10.686 -2.485 4.296 616 HG12 ILE 76 HG12 ILE 76 7.748 -3.246 3.960 617 HG13 ILE 76 HG13 ILE 76 8.320 -2.051 5.131 618 HG21 ILE 76 HG21 ILE 76 11.121 -4.472 2.905 619 HG22 ILE 76 HG22 ILE 76 9.379 -4.792 2.782 620 HG23 ILE 76 HG23 ILE 76 10.102 -3.340 2.047 621 HD11 ILE 76 HD11 ILE 76 8.545 -1.769 2.133 622 HD12 ILE 76 HD12 ILE 76 7.466 -0.907 3.241 623 HD13 ILE 76 HD13 ILE 76 9.216 -0.654 3.360 624 H LEU 77 H LEU 77 12.376 -3.951 6.431 625 HA LEU 77 HA LEU 77 13.642 -6.182 5.037 626 HB2 LEU 77 HB2 LEU 77 15.049 -4.446 5.590 627 HB3 LEU 77 HB3 LEU 77 14.497 -4.375 7.242 628 HG LEU 77 HG LEU 77 15.405 -6.491 7.823 629 HD11 LEU 77 HD11 LEU 77 15.325 -7.756 5.594 630 HD12 LEU 77 HD12 LEU 77 16.505 -6.610 4.943 631 HD13 LEU 77 HD13 LEU 77 16.962 -7.714 6.257 632 HD21 LEU 77 HD21 LEU 77 16.649 -4.467 7.924 633 HD22 LEU 77 HD22 LEU 77 17.731 -5.842 7.552 634 HD23 LEU 77 HD23 LEU 77 17.202 -4.743 6.237 635 H LYS 78 H LYS 78 12.454 -5.477 8.331 636 HA LYS 78 HA LYS 78 12.855 -8.049 9.457 637 HB2 LYS 78 HB2 LYS 78 10.885 -5.831 10.172 638 HB3 LYS 78 HB3 LYS 78 11.309 -7.204 11.195 639 HG2 LYS 78 HG2 LYS 78 13.757 -6.417 10.919 640 HG3 LYS 78 HG3 LYS 78 13.073 -4.883 10.403 641 HD2 LYS 78 HD2 LYS 78 11.832 -4.681 12.528 642 HD3 LYS 78 HD3 LYS 78 12.337 -6.318 12.990 643 HE2 LYS 78 HE2 LYS 78 14.786 -5.269 12.620 644 HE3 LYS 78 HE3 LYS 78 13.909 -3.767 12.988 645 HZ1 LYS 78 HZ1 LYS 78 14.695 -4.665 15.021 646 HZ2 LYS 78 HZ2 LYS 78 13.092 -4.954 15.010 647 HZ3 LYS 78 HZ3 LYS 78 14.162 -6.181 14.683 648 H SER 79 H SER 79 11.024 -7.590 6.983 649 HA SER 79 HA SER 79 9.000 -9.683 7.772 650 HB2 SER 79 HB2 SER 79 8.083 -7.445 6.836 651 HB3 SER 79 HB3 SER 79 8.688 -8.001 5.273 652 HG SER 79 HG SER 79 6.648 -8.786 5.418 653 H ILE 80 H ILE 80 10.892 -8.484 4.963 654 HA ILE 80 HA ILE 80 11.079 -10.872 3.530 655 HB ILE 80 HB ILE 80 12.873 -8.423 3.754 656 HG12 ILE 80 HG12 ILE 80 10.738 -9.245 1.715 657 HG13 ILE 80 HG13 ILE 80 10.519 -8.050 2.993 658 HG21 ILE 80 HG21 ILE 80 14.207 -10.273 2.776 659 HG22 ILE 80 HG22 ILE 80 12.947 -10.506 1.539 660 HG23 ILE 80 HG23 ILE 80 13.908 -9.009 1.613 661 HD11 ILE 80 HD11 ILE 80 12.486 -6.782 1.992 662 HD12 ILE 80 HD12 ILE 80 12.297 -7.856 0.579 663 HD13 ILE 80 HD13 ILE 80 10.960 -6.783 1.086 664 H SER 81 H SER 81 13.041 -9.732 6.241 665 HA SER 81 HA SER 81 15.267 -11.344 6.023 666 HB2 SER 81 HB2 SER 81 15.687 -10.744 8.288 667 HB3 SER 81 HB3 SER 81 14.892 -9.365 7.537 668 HG SER 81 HG SER 81 14.032 -11.101 9.495 669 H SER 82 H SER 82 12.411 -11.859 7.950 670 HA SER 82 HA SER 82 12.815 -14.479 8.856 671 HB2 SER 82 HB2 SER 82 11.183 -12.519 9.518 672 HB3 SER 82 HB3 SER 82 10.083 -13.259 8.352 673 HG SER 82 HG SER 82 10.170 -15.182 9.593 674 H SER 83 H SER 83 11.116 -13.296 5.910 675 HA SER 83 HA SER 83 10.153 -15.854 5.015 676 HB2 SER 83 HB2 SER 83 10.649 -13.138 3.828 677 HB3 SER 83 HB3 SER 83 10.623 -14.519 2.723 678 HG SER 83 HG SER 83 8.565 -13.812 4.598 679 H GLY 84 H GLY 84 13.338 -14.406 4.913 680 HA2 GLY 84 HA2 GLY 84 15.311 -15.660 4.299 681 HA3 GLY 84 HA3 GLY 84 14.252 -16.762 3.392 682 H GLY 85 H GLY 85 13.632 -13.322 2.834 683 HA2 GLY 85 HA2 GLY 85 14.786 -13.612 0.143 684 HA3 GLY 85 HA3 GLY 85 13.634 -12.403 0.718 685 H PHE 86 H PHE 86 15.345 -11.124 -0.391 686 HA PHE 86 HA PHE 86 17.309 -10.106 1.555 687 HB2 PHE 86 HB2 PHE 86 17.928 -11.332 -1.054 688 HB3 PHE 86 HB3 PHE 86 18.627 -9.740 -0.870 689 HD1 PHE 86 HD1 PHE 86 18.311 -13.100 0.725 690 HD2 PHE 86 HD2 PHE 86 20.603 -9.407 0.635 691 HE1 PHE 86 HE1 PHE 86 19.972 -14.084 2.261 692 HE2 PHE 86 HE2 PHE 86 22.187 -10.394 2.243 693 HZ PHE 86 HZ PHE 86 21.932 -12.741 3.002 694 H PHE 87 H PHE 87 17.592 -7.858 1.453 695 HA PHE 87 HA PHE 87 16.212 -6.336 -0.683 696 HB2 PHE 87 HB2 PHE 87 14.532 -6.455 0.955 697 HB3 PHE 87 HB3 PHE 87 15.673 -6.277 2.275 698 HD1 PHE 87 HD1 PHE 87 15.076 -4.052 -0.822 699 HD2 PHE 87 HD2 PHE 87 15.156 -4.442 3.493 700 HE1 PHE 87 HE1 PHE 87 14.466 -1.683 -0.561 701 HE2 PHE 87 HE2 PHE 87 14.542 -2.081 3.742 702 HZ PHE 87 HZ PHE 87 14.210 -0.667 1.684 703 H ALA 88 H ALA 88 17.005 -4.226 -0.940 704 HA ALA 88 HA ALA 88 19.240 -3.311 0.605 705 HB1 ALA 88 HB1 ALA 88 20.871 -3.314 -1.135 706 HB2 ALA 88 HB2 ALA 88 20.253 -4.982 -1.049 707 HB3 ALA 88 HB3 ALA 88 19.713 -3.889 -2.347 708 H LEU 89 H LEU 89 20.095 -1.226 -0.306 709 HA LEU 89 HA LEU 89 17.909 0.269 -1.687 710 HB2 LEU 89 HB2 LEU 89 19.948 1.677 -0.020 711 HB3 LEU 89 HB3 LEU 89 18.334 2.164 -0.502 712 HG LEU 89 HG LEU 89 19.208 0.426 1.775 713 HD11 LEU 89 HD11 LEU 89 17.794 1.923 3.077 714 HD12 LEU 89 HD12 LEU 89 18.848 2.895 2.043 715 HD13 LEU 89 HD13 LEU 89 17.145 2.658 1.593 716 HD21 LEU 89 HD21 LEU 89 17.656 -1.063 1.279 717 HD22 LEU 89 HD22 LEU 89 16.639 0.051 2.174 718 HD23 LEU 89 HD23 LEU 89 16.630 0.064 0.377 719 H VAL 90 H VAL 90 18.901 2.312 -2.806 720 HA VAL 90 HA VAL 90 21.373 1.688 -4.178 721 HB VAL 90 HB VAL 90 20.204 0.487 -5.713 722 HG11 VAL 90 HG11 VAL 90 18.823 -0.487 -4.674 723 HG12 VAL 90 HG12 VAL 90 17.795 0.897 -4.404 724 HG13 VAL 90 HG13 VAL 90 17.884 0.142 -6.013 725 HG21 VAL 90 HG21 VAL 90 19.482 1.374 -7.626 726 HG22 VAL 90 HG22 VAL 90 19.234 2.954 -6.813 727 HG23 VAL 90 HG23 VAL 90 20.833 2.248 -6.990 728 H SER 91 H SER 91 22.264 3.374 -5.268 729 HA SER 91 HA SER 91 22.824 5.525 -5.617 730 HB2 SER 91 HB2 SER 91 20.962 4.857 -7.297 731 HB3 SER 91 HB3 SER 91 19.897 5.864 -6.325 732 HG SER 91 HG SER 91 22.332 6.806 -7.463 733 HA PRO 92 HA PRO 92 20.534 6.425 -1.558 734 HB2 PRO 92 HB2 PRO 92 22.712 6.599 0.141 735 HB3 PRO 92 HB3 PRO 92 21.757 5.134 -0.197 736 HG2 PRO 92 HG2 PRO 92 24.390 6.007 -1.446 737 HG3 PRO 92 HG3 PRO 92 23.906 4.348 -0.920 738 HD2 PRO 92 HD2 PRO 92 23.817 5.047 -3.491 739 HD3 PRO 92 HD3 PRO 92 22.573 4.020 -2.727 740 H ASN 93 H ASN 93 23.346 7.923 -2.969 741 HA ASN 93 HA ASN 93 24.181 9.963 -3.075 742 HB2 ASN 93 HB2 ASN 93 21.941 11.321 -1.616 743 HB3 ASN 93 HB3 ASN 93 23.058 11.992 -2.781 744 HD21 ASN 93 HD21 ASN 93 20.314 10.132 -2.316 745 HD22 ASN 93 HD22 ASN 93 19.484 10.271 -3.843 746 H GLU 94 H GLU 94 24.943 11.606 -1.761 747 HA GLU 94 HA GLU 94 26.381 10.826 0.542 748 HB2 GLU 94 HB2 GLU 94 26.887 12.702 -1.063 749 HB3 GLU 94 HB3 GLU 94 25.518 13.600 -0.414 750 HG2 GLU 94 HG2 GLU 94 26.725 13.509 1.850 751 HG3 GLU 94 HG3 GLU 94 28.134 12.938 0.954 752 H LYS 95 H LYS 95 23.166 12.197 0.232 753 HA LYS 95 HA LYS 95 23.230 13.567 2.761 754 HB2 LYS 95 HB2 LYS 95 22.264 14.266 0.531 755 HB3 LYS 95 HB3 LYS 95 20.927 13.208 0.805 756 HG2 LYS 95 HG2 LYS 95 21.605 15.203 3.009 757 HG3 LYS 95 HG3 LYS 95 21.071 15.861 1.473 758 HD2 LYS 95 HD2 LYS 95 18.970 15.589 2.166 759 HD3 LYS 95 HD3 LYS 95 19.244 13.908 1.795 760 HE2 LYS 95 HE2 LYS 95 18.137 14.103 3.891 761 HE3 LYS 95 HE3 LYS 95 19.689 13.313 4.060 762 HZ1 LYS 95 HZ1 LYS 95 20.513 15.396 5.004 763 HZ2 LYS 95 HZ2 LYS 95 19.133 16.191 4.573 764 HZ3 LYS 95 HZ3 LYS 95 19.071 15.027 5.726 765 H VAL 96 H VAL 96 21.322 10.640 1.550 766 HA VAL 96 HA VAL 96 20.241 10.368 4.124 767 HB VAL 96 HB VAL 96 19.493 8.358 3.329 768 HG11 VAL 96 HG11 VAL 96 18.046 9.027 1.599 769 HG12 VAL 96 HG12 VAL 96 18.482 10.468 2.538 770 HG13 VAL 96 HG13 VAL 96 19.244 10.162 0.940 771 HG21 VAL 96 HG21 VAL 96 21.086 7.129 2.302 772 HG22 VAL 96 HG22 VAL 96 19.974 7.483 0.966 773 HG23 VAL 96 HG23 VAL 96 21.489 8.409 1.171 774 H GLU 97 H GLU 97 23.065 9.015 2.375 775 HA GLU 97 HA GLU 97 23.591 6.850 4.055 776 HB2 GLU 97 HB2 GLU 97 25.088 8.394 2.016 777 HB3 GLU 97 HB3 GLU 97 26.077 7.620 3.210 778 HG2 GLU 97 HG2 GLU 97 24.004 5.769 2.224 779 HG3 GLU 97 HG3 GLU 97 24.960 6.446 0.921 780 H ARG 98 H ARG 98 24.316 10.309 4.463 781 HA ARG 98 HA ARG 98 26.010 10.398 6.503 782 HB2 ARG 98 HB2 ARG 98 24.344 11.983 5.003 783 HB3 ARG 98 HB3 ARG 98 23.425 12.059 6.470 784 HG2 ARG 98 HG2 ARG 98 26.370 12.495 6.548 785 HG3 ARG 98 HG3 ARG 98 25.185 13.600 5.788 786 HD2 ARG 98 HD2 ARG 98 24.076 13.897 7.990 787 HD3 ARG 98 HD3 ARG 98 25.172 12.700 8.700 788 HE ARG 98 HE ARG 98 26.863 14.268 8.793 789 HH11 ARG 98 HH11 ARG 98 24.237 15.683 6.849 790 HH12 ARG 98 HH12 ARG 98 25.262 16.947 6.210 791 HH21 ARG 98 HH21 ARG 98 28.103 16.175 8.072 792 HH22 ARG 98 HH22 ARG 98 27.355 17.201 6.871 793 H VAL 99 H VAL 99 22.587 10.252 6.587 794 HA VAL 99 HA VAL 99 22.281 10.133 9.441 795 HB VAL 99 HB VAL 99 20.258 9.424 7.232 796 HG11 VAL 99 HG11 VAL 99 18.557 10.348 8.858 797 HG12 VAL 99 HG12 VAL 99 19.315 8.858 9.401 798 HG13 VAL 99 HG13 VAL 99 19.830 10.419 10.091 799 HG21 VAL 99 HG21 VAL 99 19.581 11.784 7.438 800 HG22 VAL 99 HG22 VAL 99 21.162 12.050 8.275 801 HG23 VAL 99 HG23 VAL 99 21.110 11.405 6.602 802 H LEU 100 H LEU 100 22.084 7.861 6.722 803 HA LEU 100 HA LEU 100 21.169 5.548 8.074 804 HB2 LEU 100 HB2 LEU 100 23.060 5.723 5.716 805 HB3 LEU 100 HB3 LEU 100 22.198 4.334 6.216 806 HG LEU 100 HG LEU 100 21.379 6.521 4.485 807 HD11 LEU 100 HD11 LEU 100 19.842 5.039 3.550 808 HD12 LEU 100 HD12 LEU 100 21.307 4.114 3.940 809 HD13 LEU 100 HD13 LEU 100 19.855 3.986 4.973 810 HD21 LEU 100 HD21 LEU 100 19.920 7.511 6.121 811 HD22 LEU 100 HD22 LEU 100 18.925 6.579 5.048 812 HD23 LEU 100 HD23 LEU 100 19.331 5.910 6.641 813 H SER 101 H SER 101 24.111 7.331 8.324 814 HA SER 101 HA SER 101 25.573 4.957 9.408 815 HB2 SER 101 HB2 SER 101 26.461 6.871 7.714 816 HB3 SER 101 HB3 SER 101 26.923 7.624 9.248 817 HG SER 101 HG SER 101 27.631 5.098 8.143 818 H LEU 102 H LEU 102 23.529 7.238 10.572 819 HA LEU 102 HA LEU 102 24.768 7.557 13.276 820 HB2 LEU 102 HB2 LEU 102 22.851 9.301 11.660 821 HB3 LEU 102 HB3 LEU 102 23.246 9.614 13.332 822 HG LEU 102 HG LEU 102 25.295 9.588 11.076 823 HD11 LEU 102 HD11 LEU 102 25.246 12.019 11.230 824 HD12 LEU 102 HD12 LEU 102 23.633 11.416 10.838 825 HD13 LEU 102 HD13 LEU 102 24.005 11.950 12.497 826 HD21 LEU 102 HD21 LEU 102 26.371 9.109 13.187 827 HD22 LEU 102 HD22 LEU 102 26.740 10.769 12.714 828 HD23 LEU 102 HD23 LEU 102 25.524 10.456 13.976 829 H THR 103 H THR 103 21.768 7.074 11.455 830 HA THR 103 HA THR 103 20.170 6.365 13.766 831 HB THR 103 HB THR 103 19.619 7.793 11.640 832 HG1 THR 103 HG1 THR 103 17.884 5.832 12.645 833 HG21 THR 103 HG21 THR 103 18.862 6.762 9.683 834 HG22 THR 103 HG22 THR 103 20.302 5.839 10.060 835 HG23 THR 103 HG23 THR 103 18.711 5.163 10.450 836 H ASN 104 H ASN 104 22.461 4.709 12.133 837 HA ASN 104 HA ASN 104 22.845 2.727 11.217 838 HB2 ASN 104 HB2 ASN 104 22.100 0.690 12.605 839 HB3 ASN 104 HB3 ASN 104 23.321 1.802 13.184 840 HD21 ASN 104 HD21 ASN 104 22.583 3.531 14.729 841 HD22 ASN 104 HD22 ASN 104 21.440 3.001 15.945 842 H LEU 105 H LEU 105 21.776 3.125 9.347 843 HA LEU 105 HA LEU 105 19.469 1.311 8.890 844 HB2 LEU 105 HB2 LEU 105 19.345 3.943 8.453 845 HB3 LEU 105 HB3 LEU 105 20.335 3.591 7.079 846 HG LEU 105 HG LEU 105 18.100 3.711 6.325 847 HD11 LEU 105 HD11 LEU 105 18.587 0.723 6.565 848 HD12 LEU 105 HD12 LEU 105 17.638 1.560 5.345 849 HD13 LEU 105 HD13 LEU 105 19.397 1.761 5.373 850 HD21 LEU 105 HD21 LEU 105 16.272 2.446 7.325 851 HD22 LEU 105 HD22 LEU 105 17.408 1.799 8.549 852 HD23 LEU 105 HD23 LEU 105 17.066 3.523 8.493 853 H ASP 106 H ASP 106 22.282 2.732 7.078 854 HA ASP 106 HA ASP 106 22.735 0.460 5.394 855 HB2 ASP 106 HB2 ASP 106 23.703 2.512 4.713 856 HB3 ASP 106 HB3 ASP 106 24.367 2.825 6.319 857 H ARG 107 H ARG 107 23.569 1.201 8.712 858 HA ARG 107 HA ARG 107 25.600 -0.862 8.992 859 HB2 ARG 107 HB2 ARG 107 23.957 0.398 11.208 860 HB3 ARG 107 HB3 ARG 107 25.534 -0.375 11.326 861 HG2 ARG 107 HG2 ARG 107 26.363 1.496 9.700 862 HG3 ARG 107 HG3 ARG 107 24.862 2.324 10.100 863 HD2 ARG 107 HD2 ARG 107 26.451 3.216 11.597 864 HD3 ARG 107 HD3 ARG 107 25.551 2.035 12.569 865 HE ARG 107 HE ARG 107 28.179 1.483 11.240 866 HH11 ARG 107 HH11 ARG 107 26.204 1.255 14.225 867 HH12 ARG 107 HH12 ARG 107 27.489 0.526 15.116 868 HH21 ARG 107 HH21 ARG 107 29.718 0.354 12.367 869 HH22 ARG 107 HH22 ARG 107 29.517 -0.064 14.038 870 H ILE 108 H ILE 108 22.416 -1.282 8.270 871 HA ILE 108 HA ILE 108 22.216 -3.856 9.693 872 HB ILE 108 HB ILE 108 19.934 -1.906 9.160 873 HG12 ILE 108 HG12 ILE 108 21.631 -2.355 11.631 874 HG13 ILE 108 HG13 ILE 108 21.257 -0.853 10.808 875 HG21 ILE 108 HG21 ILE 108 19.985 -4.453 10.820 876 HG22 ILE 108 HG22 ILE 108 18.585 -3.398 10.515 877 HG23 ILE 108 HG23 ILE 108 19.279 -4.299 9.189 878 HD11 ILE 108 HD11 ILE 108 18.864 -1.106 11.508 879 HD12 ILE 108 HD12 ILE 108 19.370 -2.480 12.525 880 HD13 ILE 108 HD13 ILE 108 20.017 -0.855 12.831 881 H VAL 109 H VAL 109 21.423 -1.857 6.747 882 HA VAL 109 HA VAL 109 20.612 -4.315 5.328 883 HB VAL 109 HB VAL 109 19.765 -1.510 4.599 884 HG11 VAL 109 HG11 VAL 109 19.217 -3.253 3.013 885 HG12 VAL 109 HG12 VAL 109 18.468 -4.248 4.286 886 HG13 VAL 109 HG13 VAL 109 17.735 -2.704 3.768 887 HG21 VAL 109 HG21 VAL 109 18.994 -1.458 6.855 888 HG22 VAL 109 HG22 VAL 109 17.578 -1.976 5.930 889 HG23 VAL 109 HG23 VAL 109 18.555 -3.152 6.847 890 H LYS 110 H LYS 110 21.106 -4.426 3.107 891 HA LYS 110 HA LYS 110 23.644 -3.429 2.264 892 HB2 LYS 110 HB2 LYS 110 21.340 -4.883 0.952 893 HB3 LYS 110 HB3 LYS 110 22.744 -4.425 0.051 894 HG2 LYS 110 HG2 LYS 110 23.750 -5.677 2.454 895 HG3 LYS 110 HG3 LYS 110 22.430 -6.670 1.829 896 HD2 LYS 110 HD2 LYS 110 24.174 -7.522 0.672 897 HD3 LYS 110 HD3 LYS 110 23.665 -6.254 -0.445 898 HE2 LYS 110 HE2 LYS 110 25.817 -5.723 1.615 899 HE3 LYS 110 HE3 LYS 110 26.164 -6.592 0.140 900 HZ1 LYS 110 HZ1 LYS 110 26.616 -4.470 -0.471 901 HZ2 LYS 110 HZ2 LYS 110 25.111 -4.561 -1.026 902 HZ3 LYS 110 HZ3 LYS 110 25.473 -3.768 0.397 903 H ILE 111 H ILE 111 24.119 -2.101 0.477 904 HA ILE 111 HA ILE 111 22.106 -0.219 -0.495 905 HB ILE 111 HB ILE 111 23.535 0.406 1.753 906 HG12 ILE 111 HG12 ILE 111 23.411 2.926 0.610 907 HG13 ILE 111 HG13 ILE 111 22.191 2.049 -0.302 908 HG21 ILE 111 HG21 ILE 111 25.734 0.287 0.559 909 HG22 ILE 111 HG22 ILE 111 25.237 1.691 -0.401 910 HG23 ILE 111 HG23 ILE 111 25.398 1.823 1.364 911 HD11 ILE 111 HD11 ILE 111 21.211 3.069 1.691 912 HD12 ILE 111 HD12 ILE 111 21.253 1.309 1.972 913 HD13 ILE 111 HD13 ILE 111 22.461 2.372 2.732 914 H TYR 112 H TYR 112 22.706 0.542 -2.628 915 HA TYR 112 HA TYR 112 25.312 -0.305 -3.799 916 HB2 TYR 112 HB2 TYR 112 22.441 -0.811 -4.721 917 HB3 TYR 112 HB3 TYR 112 23.850 -1.093 -5.729 918 HD1 TYR 112 HD1 TYR 112 25.655 -2.632 -4.947 919 HD2 TYR 112 HD2 TYR 112 21.804 -2.490 -2.983 920 HE1 TYR 112 HE1 TYR 112 26.019 -4.908 -4.169 921 HE2 TYR 112 HE2 TYR 112 22.176 -4.888 -2.227 922 HH TYR 112 HH TYR 112 25.012 -6.735 -3.301 923 H ASP 113 H ASP 113 25.486 0.660 -6.222 924 HA ASP 113 HA ASP 113 24.791 3.533 -5.871 925 HB2 ASP 113 HB2 ASP 113 27.089 2.691 -6.771 926 HB3 ASP 113 HB3 ASP 113 26.252 2.338 -8.237 927 H THR 114 H THR 114 24.181 0.631 -7.844 928 HA THR 114 HA THR 114 21.907 1.969 -9.259 929 HB THR 114 HB THR 114 22.731 0.994 -11.304 930 HG1 THR 114 HG1 THR 114 25.216 0.327 -10.296 931 HG21 THR 114 HG21 THR 114 24.559 2.482 -11.721 932 HG22 THR 114 HG22 THR 114 23.531 3.273 -10.538 933 HG23 THR 114 HG23 THR 114 25.049 2.496 -10.020 934 H ILE 115 H ILE 115 20.756 0.206 -10.676 935 HA ILE 115 HA ILE 115 19.752 -1.780 -8.796 936 HB ILE 115 HB ILE 115 19.169 -1.005 -11.692 937 HG12 ILE 115 HG12 ILE 115 18.185 0.548 -10.165 938 HG13 ILE 115 HG13 ILE 115 16.886 -0.500 -10.736 939 HG21 ILE 115 HG21 ILE 115 18.778 -3.381 -11.726 940 HG22 ILE 115 HG22 ILE 115 17.929 -3.349 -10.169 941 HG23 ILE 115 HG23 ILE 115 17.208 -2.607 -11.616 942 HD11 ILE 115 HD11 ILE 115 16.516 -0.337 -8.406 943 HD12 ILE 115 HD12 ILE 115 17.349 -1.887 -8.562 944 HD13 ILE 115 HD13 ILE 115 18.245 -0.474 -8.034 945 H SER 116 H SER 116 21.969 -1.793 -11.642 946 HA SER 116 HA SER 116 21.675 -4.623 -11.834 947 HB2 SER 116 HB2 SER 116 22.243 -3.005 -13.609 948 HB3 SER 116 HB3 SER 116 23.905 -2.913 -12.929 949 HG SER 116 HG SER 116 24.291 -4.889 -13.701 950 H GLU 117 H GLU 117 23.925 -2.420 -10.064 951 HA GLU 117 HA GLU 117 25.754 -4.408 -9.142 952 HB2 GLU 117 HB2 GLU 117 24.702 -1.695 -8.306 953 HB3 GLU 117 HB3 GLU 117 25.906 -2.539 -7.317 954 HG2 GLU 117 HG2 GLU 117 27.586 -2.375 -8.970 955 HG3 GLU 117 HG3 GLU 117 26.417 -1.954 -10.238 956 H ALA 118 H ALA 118 22.392 -4.084 -8.589 957 HA ALA 118 HA ALA 118 22.567 -4.966 -5.750 958 HB1 ALA 118 HB1 ALA 118 21.356 -2.862 -6.215 959 HB2 ALA 118 HB2 ALA 118 20.156 -3.804 -7.132 960 HB3 ALA 118 HB3 ALA 118 20.446 -4.118 -5.402 961 H MET 119 H MET 119 21.010 -5.473 -8.916 962 HA MET 119 HA MET 119 19.211 -7.370 -8.254 963 HB2 MET 119 HB2 MET 119 19.850 -5.960 -10.549 964 HB3 MET 119 HB3 MET 119 20.443 -7.516 -11.024 965 HG2 MET 119 HG2 MET 119 17.847 -7.909 -9.806 966 HG3 MET 119 HG3 MET 119 17.751 -6.517 -10.880 967 HE1 MET 119 HE1 MET 119 18.433 -10.930 -12.002 968 HE2 MET 119 HE2 MET 119 19.741 -10.058 -11.168 969 HE3 MET 119 HE3 MET 119 18.153 -10.249 -10.389 970 H GLU 120 H GLU 120 22.338 -8.161 -9.759 971 HA GLU 120 HA GLU 120 21.995 -11.075 -9.331 972 HB2 GLU 120 HB2 GLU 120 24.174 -11.093 -10.587 973 HB3 GLU 120 HB3 GLU 120 22.820 -10.334 -11.454 974 HG2 GLU 120 HG2 GLU 120 23.655 -8.126 -11.039 975 HG3 GLU 120 HG3 GLU 120 24.894 -8.717 -9.921 976 H GLU 121 H GLU 121 23.132 -8.420 -7.599 977 HA GLU 121 HA GLU 121 25.482 -9.730 -6.497 978 HB2 GLU 121 HB2 GLU 121 24.769 -7.175 -7.247 979 HB3 GLU 121 HB3 GLU 121 24.553 -7.084 -5.502 980 HG2 GLU 121 HG2 GLU 121 26.748 -6.317 -5.975 981 HG3 GLU 121 HG3 GLU 121 26.948 -7.905 -5.277 982 H VAL 122 H VAL 122 22.439 -8.281 -5.254 983 HA VAL 122 HA VAL 122 22.460 -9.074 -2.522 984 HB VAL 122 HB VAL 122 21.011 -7.480 -4.062 985 HG11 VAL 122 HG11 VAL 122 19.852 -9.157 -5.372 986 HG12 VAL 122 HG12 VAL 122 19.224 -9.925 -3.877 987 HG13 VAL 122 HG13 VAL 122 18.712 -8.313 -4.336 988 HG21 VAL 122 HG21 VAL 122 19.377 -7.480 -2.091 989 HG22 VAL 122 HG22 VAL 122 20.409 -8.785 -1.459 990 HG23 VAL 122 HG23 VAL 122 21.118 -7.209 -1.787 991 H ARG 123 H ARG 123 21.706 -10.965 -5.382 992 HA ARG 123 HA ARG 123 20.554 -13.209 -4.046 993 HB2 ARG 123 HB2 ARG 123 22.385 -13.103 -6.495 994 HB3 ARG 123 HB3 ARG 123 21.433 -14.518 -6.001 995 HG2 ARG 123 HG2 ARG 123 19.358 -13.190 -6.187 996 HG3 ARG 123 HG3 ARG 123 20.286 -11.768 -6.670 997 HD2 ARG 123 HD2 ARG 123 21.026 -12.928 -8.688 998 HD3 ARG 123 HD3 ARG 123 20.083 -14.370 -8.238 999 HE ARG 123 HE ARG 123 18.702 -11.847 -8.124 1000 HH11 ARG 123 HH11 ARG 123 19.670 -14.177 -10.598 1001 HH12 ARG 123 HH12 ARG 123 18.122 -14.352 -11.351 1002 HH21 ARG 123 HH21 ARG 123 16.454 -12.385 -8.943 1003 HH22 ARG 123 HH22 ARG 123 16.312 -13.052 -10.542 1004 H ARG 124 H ARG 124 23.883 -12.060 -4.052 1005 HA ARG 124 HA ARG 124 24.648 -14.161 -2.221 1006 HB2 ARG 124 HB2 ARG 124 26.721 -13.381 -4.258 1007 HB3 ARG 124 HB3 ARG 124 26.539 -14.880 -3.420 1008 HG2 ARG 124 HG2 ARG 124 26.002 -15.677 -5.429 1009 HG3 ARG 124 HG3 ARG 124 24.389 -15.120 -5.047 1010 HD2 ARG 124 HD2 ARG 124 24.451 -13.641 -6.780 1011 HD3 ARG 124 HD3 ARG 124 25.886 -12.875 -6.121 1012 HE ARG 124 HE ARG 124 25.707 -14.838 -8.285 1013 HH11 ARG 124 HH11 ARG 124 28.030 -13.291 -6.006 1014 HH12 ARG 124 HH12 ARG 124 29.395 -13.879 -6.843 1015 HH21 ARG 124 HH21 ARG 124 27.504 -15.495 -9.357 1016 HH22 ARG 124 HH22 ARG 124 29.126 -15.117 -8.775 1017 H LYS 125 H LYS 125 23.991 -11.420 -1.711 1018 HA LYS 125 HA LYS 125 26.427 -10.646 -0.238 1019 HB2 LYS 125 HB2 LYS 125 24.610 -9.067 -2.114 1020 HB3 LYS 125 HB3 LYS 125 25.675 -8.348 -0.971 1021 HG2 LYS 125 HG2 LYS 125 26.750 -10.299 -3.030 1022 HG3 LYS 125 HG3 LYS 125 26.325 -8.652 -3.482 1023 HD2 LYS 125 HD2 LYS 125 28.205 -7.782 -2.742 1024 HD3 LYS 125 HD3 LYS 125 28.024 -8.487 -1.143 1025 HE2 LYS 125 HE2 LYS 125 29.113 -9.983 -3.577 1026 HE3 LYS 125 HE3 LYS 125 30.121 -9.128 -2.409 1027 HZ1 LYS 125 HZ1 LYS 125 30.028 -11.404 -1.802 1028 HZ2 LYS 125 HZ2 LYS 125 29.209 -10.542 -0.680 1029 HZ3 LYS 125 HZ3 LYS 125 28.374 -11.424 -1.797 Start of MODEL 18 1 H1 MET 1 H1 MET 1 -25.666 -13.243 1.011 2 HA MET 1 HA MET 1 -27.499 -15.420 0.183 3 HB2 MET 1 HB2 MET 1 -27.922 -13.399 2.419 4 HB3 MET 1 HB3 MET 1 -29.219 -14.339 1.658 5 HG2 MET 1 HG2 MET 1 -28.012 -16.450 2.259 6 HG3 MET 1 HG3 MET 1 -26.800 -15.478 3.099 7 HE1 MET 1 HE1 MET 1 -30.257 -17.197 3.236 8 HE2 MET 1 HE2 MET 1 -31.115 -16.330 4.524 9 HE3 MET 1 HE3 MET 1 -30.839 -15.536 2.962 10 H GLY 2 H GLY 2 -28.080 -11.862 0.796 11 HA2 GLY 2 HA2 GLY 2 -28.390 -11.316 -2.051 12 HA3 GLY 2 HA3 GLY 2 -28.084 -10.159 -0.736 13 H SER 3 H SER 3 -26.586 -9.802 -3.023 14 HA SER 3 HA SER 3 -23.849 -10.641 -2.325 15 HB2 SER 3 HB2 SER 3 -23.634 -11.291 -4.789 16 HB3 SER 3 HB3 SER 3 -24.558 -12.415 -3.779 17 HG SER 3 HG SER 3 -25.685 -10.365 -5.387 18 H ASP 4 H ASP 4 -22.659 -8.770 -2.380 19 HA ASP 4 HA ASP 4 -23.405 -6.580 -4.213 20 HB2 ASP 4 HB2 ASP 4 -22.011 -5.200 -2.781 21 HB3 ASP 4 HB3 ASP 4 -23.266 -5.983 -1.840 22 H LYS 5 H LYS 5 -20.558 -8.196 -2.922 23 HA LYS 5 HA LYS 5 -18.444 -8.221 -3.323 24 HB2 LYS 5 HB2 LYS 5 -17.483 -8.957 -5.372 25 HB3 LYS 5 HB3 LYS 5 -18.883 -9.945 -4.990 26 HG2 LYS 5 HG2 LYS 5 -20.189 -8.964 -6.724 27 HG3 LYS 5 HG3 LYS 5 -19.061 -7.621 -6.943 28 HD2 LYS 5 HD2 LYS 5 -17.775 -10.246 -7.371 29 HD3 LYS 5 HD3 LYS 5 -19.177 -10.034 -8.404 30 HE2 LYS 5 HE2 LYS 5 -16.865 -8.062 -8.157 31 HE3 LYS 5 HE3 LYS 5 -17.029 -9.259 -9.440 32 HZ1 LYS 5 HZ1 LYS 5 -18.965 -7.076 -8.920 33 HZ2 LYS 5 HZ2 LYS 5 -17.864 -7.078 -10.137 34 HZ3 LYS 5 HZ3 LYS 5 -19.083 -8.181 -10.127 35 H ILE 6 H ILE 6 -16.530 -7.132 -4.332 36 HA ILE 6 HA ILE 6 -17.133 -4.643 -5.725 37 HB ILE 6 HB ILE 6 -17.220 -4.032 -3.327 38 HG12 ILE 6 HG12 ILE 6 -15.442 -2.230 -3.365 39 HG13 ILE 6 HG13 ILE 6 -14.868 -2.870 -4.880 40 HG21 ILE 6 HG21 ILE 6 -15.773 -5.715 -2.348 41 HG22 ILE 6 HG22 ILE 6 -14.355 -5.019 -3.153 42 HG23 ILE 6 HG23 ILE 6 -15.214 -4.109 -1.908 43 HD11 ILE 6 HD11 ILE 6 -17.703 -1.867 -4.307 44 HD12 ILE 6 HD12 ILE 6 -16.445 -0.962 -5.153 45 HD13 ILE 6 HD13 ILE 6 -17.118 -2.426 -5.895 46 H HIS 7 H HIS 7 -15.202 -3.831 -6.793 47 HA HIS 7 HA HIS 7 -12.994 -5.774 -7.091 48 HB2 HIS 7 HB2 HIS 7 -13.271 -5.521 -9.616 49 HB3 HIS 7 HB3 HIS 7 -14.362 -6.603 -8.766 50 HD1 HIS 7 HD1 HIS 7 -14.515 -3.576 -11.061 51 HD2 HIS 7 HD2 HIS 7 -16.919 -5.744 -8.342 52 HE1 HIS 7 HE1 HIS 7 -16.936 -3.014 -11.615 53 H HIS 8 H HIS 8 -14.226 -2.844 -8.692 54 HA HIS 8 HA HIS 8 -13.464 -0.785 -8.985 55 HB2 HIS 8 HB2 HIS 8 -12.727 -1.377 -6.267 56 HB3 HIS 8 HB3 HIS 8 -11.390 -0.522 -6.998 57 HD1 HIS 8 HD1 HIS 8 -15.071 0.003 -6.009 58 HD2 HIS 8 HD2 HIS 8 -11.786 2.034 -7.683 59 HE1 HIS 8 HE1 HIS 8 -15.785 2.426 -6.244 60 H HIS 9 H HIS 9 -11.610 0.519 -9.872 61 HA HIS 9 HA HIS 9 -9.100 -0.917 -10.269 62 HB2 HIS 9 HB2 HIS 9 -11.042 -0.682 -12.449 63 HB3 HIS 9 HB3 HIS 9 -9.604 0.255 -12.800 64 HD1 HIS 9 HD1 HIS 9 -10.759 -3.079 -13.469 65 HD2 HIS 9 HD2 HIS 9 -7.169 -1.321 -12.159 66 HE1 HIS 9 HE1 HIS 9 -8.903 -4.792 -13.883 67 H HIS 10 H HIS 10 -7.817 0.493 -9.331 68 HA HIS 10 HA HIS 10 -7.674 3.220 -10.422 69 HB2 HIS 10 HB2 HIS 10 -7.647 2.435 -7.498 70 HB3 HIS 10 HB3 HIS 10 -6.930 3.919 -8.046 71 HD1 HIS 10 HD1 HIS 10 -9.836 3.103 -6.289 72 HD2 HIS 10 HD2 HIS 10 -9.044 4.951 -9.928 73 HE1 HIS 10 HE1 HIS 10 -11.768 4.716 -6.656 74 H HIS 11 H HIS 11 -5.444 4.086 -9.721 75 HA HIS 11 HA HIS 11 -3.332 2.197 -9.236 76 HB2 HIS 11 HB2 HIS 11 -2.039 2.726 -11.229 77 HB3 HIS 11 HB3 HIS 11 -3.430 1.713 -11.571 78 HD1 HIS 11 HD1 HIS 11 -5.524 4.247 -12.088 79 HD2 HIS 11 HD2 HIS 11 -1.636 3.598 -13.576 80 HE1 HIS 11 HE1 HIS 11 -5.345 5.593 -14.240 81 H HIS 12 H HIS 12 -4.285 5.437 -10.344 82 HA HIS 12 HA HIS 12 -3.597 7.491 -10.016 83 HB2 HIS 12 HB2 HIS 12 -2.710 6.466 -7.317 84 HB3 HIS 12 HB3 HIS 12 -2.656 8.159 -7.812 85 HD1 HIS 12 HD1 HIS 12 -4.851 9.478 -7.187 86 HD2 HIS 12 HD2 HIS 12 -5.357 5.335 -7.717 87 HE1 HIS 12 HE1 HIS 12 -7.311 9.020 -6.860 88 H MET 13 H MET 13 -0.662 5.729 -8.708 89 HA MET 13 HA MET 13 0.807 6.402 -11.053 90 HB2 MET 13 HB2 MET 13 0.970 8.297 -8.795 91 HB3 MET 13 HB3 MET 13 2.528 7.536 -9.090 92 HG2 MET 13 HG2 MET 13 2.460 8.191 -11.449 93 HG3 MET 13 HG3 MET 13 0.853 8.887 -11.231 94 HE1 MET 13 HE1 MET 13 3.113 10.493 -12.637 95 HE2 MET 13 HE2 MET 13 1.487 11.133 -12.299 96 HE3 MET 13 HE3 MET 13 2.925 12.084 -11.863 97 H PHE 14 H PHE 14 3.126 5.499 -10.782 98 HA PHE 14 HA PHE 14 3.152 3.283 -8.807 99 HB2 PHE 14 HB2 PHE 14 3.744 3.160 -11.772 100 HB3 PHE 14 HB3 PHE 14 4.101 1.899 -10.623 101 HD1 PHE 14 HD1 PHE 14 1.605 1.814 -8.906 102 HD2 PHE 14 HD2 PHE 14 2.077 2.233 -13.190 103 HE1 PHE 14 HE1 PHE 14 -0.516 0.649 -9.264 104 HE2 PHE 14 HE2 PHE 14 -0.141 1.185 -13.509 105 HZ PHE 14 HZ PHE 14 -1.378 0.273 -11.553 106 HA PRO 15 HA PRO 15 7.151 5.565 -8.576 107 HB2 PRO 15 HB2 PRO 15 7.356 5.798 -5.884 108 HB3 PRO 15 HB3 PRO 15 6.202 6.793 -6.814 109 HG2 PRO 15 HG2 PRO 15 5.645 4.195 -5.372 110 HG3 PRO 15 HG3 PRO 15 4.767 5.756 -5.205 111 HD2 PRO 15 HD2 PRO 15 3.909 3.761 -6.852 112 HD3 PRO 15 HD3 PRO 15 3.709 5.485 -7.282 113 H TYR 16 H TYR 16 7.119 3.002 -9.427 114 HA TYR 16 HA TYR 16 9.400 1.843 -8.181 115 HB2 TYR 16 HB2 TYR 16 8.544 -0.178 -7.304 116 HB3 TYR 16 HB3 TYR 16 7.523 1.047 -6.617 117 HD1 TYR 16 HD1 TYR 16 5.269 1.544 -8.061 118 HD2 TYR 16 HD2 TYR 16 7.595 -2.088 -8.163 119 HE1 TYR 16 HE1 TYR 16 3.298 0.297 -8.882 120 HE2 TYR 16 HE2 TYR 16 5.613 -3.329 -8.897 121 HH TYR 16 HH TYR 16 2.888 -2.956 -8.815 122 H LYS 17 H LYS 17 9.751 -0.419 -9.327 123 HA LYS 17 HA LYS 17 8.072 -0.952 -11.597 124 HB2 LYS 17 HB2 LYS 17 9.700 -1.214 -13.286 125 HB3 LYS 17 HB3 LYS 17 9.968 0.403 -12.609 126 HG2 LYS 17 HG2 LYS 17 11.902 -0.284 -11.431 127 HG3 LYS 17 HG3 LYS 17 11.612 -1.999 -11.778 128 HD2 LYS 17 HD2 LYS 17 13.326 -1.463 -13.196 129 HD3 LYS 17 HD3 LYS 17 11.890 -1.371 -14.253 130 HE2 LYS 17 HE2 LYS 17 11.910 1.183 -13.522 131 HE3 LYS 17 HE3 LYS 17 13.565 0.799 -12.996 132 HZ1 LYS 17 HZ1 LYS 17 12.527 0.824 -15.755 133 HZ2 LYS 17 HZ2 LYS 17 13.798 1.642 -15.122 134 HZ3 LYS 17 HZ3 LYS 17 13.891 0.017 -15.368 135 H ILE 18 H ILE 18 8.823 -3.225 -12.496 136 HA ILE 18 HA ILE 18 10.185 -4.878 -10.453 137 HB ILE 18 HB ILE 18 7.633 -5.498 -12.008 138 HG12 ILE 18 HG12 ILE 18 8.153 -5.549 -8.988 139 HG13 ILE 18 HG13 ILE 18 7.357 -4.235 -9.844 140 HG21 ILE 18 HG21 ILE 18 9.271 -7.393 -10.250 141 HG22 ILE 18 HG22 ILE 18 7.739 -7.727 -11.099 142 HG23 ILE 18 HG23 ILE 18 9.153 -7.434 -12.036 143 HD11 ILE 18 HD11 ILE 18 6.310 -7.074 -9.563 144 HD12 ILE 18 HD12 ILE 18 5.632 -5.617 -8.864 145 HD13 ILE 18 HD13 ILE 18 5.580 -5.838 -10.620 146 H VAL 19 H VAL 19 11.853 -6.117 -11.500 147 HA VAL 19 HA VAL 19 11.814 -6.288 -14.402 148 HB VAL 19 HB VAL 19 14.196 -6.337 -14.269 149 HG11 VAL 19 HG11 VAL 19 14.513 -3.933 -14.064 150 HG12 VAL 19 HG12 VAL 19 12.884 -4.212 -14.668 151 HG13 VAL 19 HG13 VAL 19 13.127 -3.782 -12.972 152 HG21 VAL 19 HG21 VAL 19 15.580 -5.763 -12.411 153 HG22 VAL 19 HG22 VAL 19 14.187 -5.352 -11.423 154 HG23 VAL 19 HG23 VAL 19 14.501 -7.045 -11.855 155 H ASP 20 H ASP 20 13.931 -8.446 -14.206 156 HA ASP 20 HA ASP 20 12.364 -10.407 -14.787 157 HB2 ASP 20 HB2 ASP 20 14.818 -10.464 -14.976 158 HB3 ASP 20 HB3 ASP 20 14.936 -10.934 -13.269 159 H ASP 21 H ASP 21 13.804 -10.697 -11.497 160 HA ASP 21 HA ASP 21 11.149 -11.459 -10.424 161 HB2 ASP 21 HB2 ASP 21 11.995 -13.177 -9.131 162 HB3 ASP 21 HB3 ASP 21 12.645 -13.463 -10.747 163 H VAL 22 H VAL 22 12.797 -8.907 -10.516 164 HA VAL 22 HA VAL 22 13.034 -8.464 -7.559 165 HB VAL 22 HB VAL 22 15.218 -7.456 -9.482 166 HG11 VAL 22 HG11 VAL 22 15.221 -6.246 -7.529 167 HG12 VAL 22 HG12 VAL 22 14.779 -7.625 -6.519 168 HG13 VAL 22 HG13 VAL 22 16.375 -7.569 -7.218 169 HG21 VAL 22 HG21 VAL 22 16.615 -9.297 -8.769 170 HG22 VAL 22 HG22 VAL 22 15.268 -10.041 -7.834 171 HG23 VAL 22 HG23 VAL 22 15.264 -9.958 -9.613 172 H VAL 23 H VAL 23 11.996 -7.024 -6.875 173 HA VAL 23 HA VAL 23 10.700 -4.931 -8.361 174 HB VAL 23 HB VAL 23 9.395 -5.419 -6.715 175 HG11 VAL 23 HG11 VAL 23 9.329 -6.587 -4.941 176 HG12 VAL 23 HG12 VAL 23 9.931 -7.372 -6.403 177 HG13 VAL 23 HG13 VAL 23 11.083 -6.859 -5.181 178 HG21 VAL 23 HG21 VAL 23 9.514 -3.277 -6.141 179 HG22 VAL 23 HG22 VAL 23 9.354 -4.207 -4.677 180 HG23 VAL 23 HG23 VAL 23 10.952 -3.550 -5.120 181 H ILE 24 H ILE 24 11.007 -2.732 -8.179 182 HA ILE 24 HA ILE 24 13.453 -1.751 -6.861 183 HB ILE 24 HB ILE 24 12.534 -0.692 -9.541 184 HG12 ILE 24 HG12 ILE 24 12.927 -2.941 -10.171 185 HG13 ILE 24 HG13 ILE 24 14.175 -1.860 -10.795 186 HG21 ILE 24 HG21 ILE 24 13.952 0.753 -8.309 187 HG22 ILE 24 HG22 ILE 24 15.102 -0.542 -7.973 188 HG23 ILE 24 HG23 ILE 24 14.921 0.084 -9.633 189 HD11 ILE 24 HD11 ILE 24 14.470 -4.300 -9.385 190 HD12 ILE 24 HD12 ILE 24 15.701 -3.241 -10.070 191 HD13 ILE 24 HD13 ILE 24 15.130 -2.984 -8.393 192 H LEU 25 H LEU 25 12.275 -0.750 -5.181 193 HA LEU 25 HA LEU 25 9.901 0.925 -5.555 194 HB2 LEU 25 HB2 LEU 25 12.081 0.666 -3.425 195 HB3 LEU 25 HB3 LEU 25 10.959 1.978 -3.410 196 HG LEU 25 HG LEU 25 10.368 0.221 -1.835 197 HD11 LEU 25 HD11 LEU 25 8.688 1.736 -2.873 198 HD12 LEU 25 HD12 LEU 25 8.327 0.419 -4.029 199 HD13 LEU 25 HD13 LEU 25 8.044 0.178 -2.298 200 HD21 LEU 25 HD21 LEU 25 10.960 -1.803 -3.148 201 HD22 LEU 25 HD22 LEU 25 9.360 -1.872 -2.377 202 HD23 LEU 25 HD23 LEU 25 9.481 -1.571 -4.114 203 H MET 26 H MET 26 9.966 3.040 -6.294 204 HA MET 26 HA MET 26 12.552 4.411 -6.767 205 HB2 MET 26 HB2 MET 26 10.446 3.710 -8.779 206 HB3 MET 26 HB3 MET 26 11.105 5.331 -8.855 207 HG2 MET 26 HG2 MET 26 12.842 2.855 -8.799 208 HG3 MET 26 HG3 MET 26 12.270 3.622 -10.280 209 HE1 MET 26 HE1 MET 26 12.852 6.200 -10.943 210 HE2 MET 26 HE2 MET 26 12.616 6.912 -9.327 211 HE3 MET 26 HE3 MET 26 14.152 7.138 -10.170 212 HA PRO 27 HA PRO 27 9.593 6.985 -4.320 213 HB2 PRO 27 HB2 PRO 27 11.502 8.229 -2.787 214 HB3 PRO 27 HB3 PRO 27 10.798 6.641 -2.359 215 HG2 PRO 27 HG2 PRO 27 13.353 7.150 -3.934 216 HG3 PRO 27 HG3 PRO 27 13.160 6.172 -2.458 217 HD2 PRO 27 HD2 PRO 27 13.062 4.975 -4.874 218 HD3 PRO 27 HD3 PRO 27 11.837 4.525 -3.657 219 H ASN 28 H ASN 28 9.264 9.076 -4.753 220 HA ASN 28 HA ASN 28 11.204 10.691 -6.257 221 HB2 ASN 28 HB2 ASN 28 8.457 10.780 -7.482 222 HB3 ASN 28 HB3 ASN 28 10.030 11.027 -8.197 223 HD21 ASN 28 HD21 ASN 28 7.616 8.594 -7.189 224 HD22 ASN 28 HD22 ASN 28 8.570 7.237 -7.735 225 H LYS 29 H LYS 29 7.664 11.166 -5.829 226 HA LYS 29 HA LYS 29 8.228 13.018 -3.556 227 HB2 LYS 29 HB2 LYS 29 5.910 13.065 -5.520 228 HB3 LYS 29 HB3 LYS 29 6.142 14.129 -4.150 229 HG2 LYS 29 HG2 LYS 29 7.136 15.529 -5.518 230 HG3 LYS 29 HG3 LYS 29 8.556 14.528 -5.396 231 HD2 LYS 29 HD2 LYS 29 6.575 13.722 -7.515 232 HD3 LYS 29 HD3 LYS 29 7.299 15.294 -7.736 233 HE2 LYS 29 HE2 LYS 29 9.311 13.248 -7.032 234 HE3 LYS 29 HE3 LYS 29 8.384 12.841 -8.492 235 HZ1 LYS 29 HZ1 LYS 29 8.928 15.032 -9.333 236 HZ2 LYS 29 HZ2 LYS 29 9.990 15.282 -8.076 237 HZ3 LYS 29 HZ3 LYS 29 10.229 14.067 -9.150 238 H GLU 30 H GLU 30 7.208 9.894 -4.061 239 HA GLU 30 HA GLU 30 4.692 9.905 -2.798 240 HB2 GLU 30 HB2 GLU 30 5.002 7.476 -2.593 241 HB3 GLU 30 HB3 GLU 30 5.388 8.049 -4.224 242 HG2 GLU 30 HG2 GLU 30 7.654 7.750 -3.996 243 HG3 GLU 30 HG3 GLU 30 7.671 7.754 -2.279 244 H LEU 31 H LEU 31 7.904 9.696 -1.352 245 HA LEU 31 HA LEU 31 7.029 8.045 0.717 246 HB2 LEU 31 HB2 LEU 31 9.554 8.999 -0.256 247 HB3 LEU 31 HB3 LEU 31 9.528 9.380 1.475 248 HG LEU 31 HG LEU 31 9.193 7.161 2.127 249 HD11 LEU 31 HD11 LEU 31 7.790 6.188 0.306 250 HD12 LEU 31 HD12 LEU 31 9.133 6.403 -0.830 251 HD13 LEU 31 HD13 LEU 31 9.266 5.269 0.523 252 HD21 LEU 31 HD21 LEU 31 11.329 6.242 1.378 253 HD22 LEU 31 HD22 LEU 31 11.319 7.316 -0.036 254 HD23 LEU 31 HD23 LEU 31 11.477 7.999 1.583 255 H ASN 32 H ASN 32 8.629 11.021 1.540 256 HA ASN 32 HA ASN 32 8.170 12.661 3.102 257 HB2 ASN 32 HB2 ASN 32 6.119 12.854 0.864 258 HB3 ASN 32 HB3 ASN 32 6.757 14.193 1.823 259 HD21 ASN 32 HD21 ASN 32 7.296 12.418 -1.103 260 HD22 ASN 32 HD22 ASN 32 8.944 13.018 -1.309 261 H ILE 33 H ILE 33 7.019 10.477 4.260 262 HA ILE 33 HA ILE 33 5.757 9.708 5.871 263 HB ILE 33 HB ILE 33 6.018 12.273 6.588 264 HG12 ILE 33 HG12 ILE 33 5.977 10.153 7.896 265 HG13 ILE 33 HG13 ILE 33 5.502 11.635 8.709 266 HG21 ILE 33 HG21 ILE 33 3.930 13.126 5.573 267 HG22 ILE 33 HG22 ILE 33 2.988 12.001 6.540 268 HG23 ILE 33 HG23 ILE 33 3.957 13.275 7.315 269 HD11 ILE 33 HD11 ILE 33 3.632 9.437 7.784 270 HD12 ILE 33 HD12 ILE 33 4.144 9.804 9.440 271 HD13 ILE 33 HD13 ILE 33 3.113 10.951 8.544 272 H GLU 34 H GLU 34 4.003 11.480 3.403 273 HA GLU 34 HA GLU 34 1.422 10.669 3.816 274 HB2 GLU 34 HB2 GLU 34 2.954 10.967 1.211 275 HB3 GLU 34 HB3 GLU 34 1.203 10.726 1.291 276 HG2 GLU 34 HG2 GLU 34 1.036 12.737 2.795 277 HG3 GLU 34 HG3 GLU 34 2.748 13.040 2.515 278 H ASN 35 H ASN 35 4.026 8.700 2.538 279 HA ASN 35 HA ASN 35 2.097 6.396 2.161 280 HB2 ASN 35 HB2 ASN 35 2.914 7.329 -0.007 281 HB3 ASN 35 HB3 ASN 35 4.571 6.956 0.486 282 HD21 ASN 35 HD21 ASN 35 4.989 5.159 -1.239 283 HD22 ASN 35 HD22 ASN 35 3.806 3.921 -1.324 284 H ALA 36 H ALA 36 2.985 6.546 4.615 285 HA ALA 36 HA ALA 36 5.428 4.825 4.767 286 HB1 ALA 36 HB1 ALA 36 5.678 5.635 7.049 287 HB2 ALA 36 HB2 ALA 36 5.666 6.976 5.888 288 HB3 ALA 36 HB3 ALA 36 4.229 6.664 6.867 289 H HIS 37 H HIS 37 2.435 5.181 6.915 290 HA HIS 37 HA HIS 37 2.587 2.424 7.653 291 HB2 HIS 37 HB2 HIS 37 0.511 4.567 7.858 292 HB3 HIS 37 HB3 HIS 37 -0.104 2.928 7.812 293 HD1 HIS 37 HD1 HIS 37 3.030 4.232 9.726 294 HD2 HIS 37 HD2 HIS 37 -0.565 2.089 10.149 295 HE1 HIS 37 HE1 HIS 37 3.005 3.345 12.109 296 H LEU 38 H LEU 38 1.280 3.924 4.730 297 HA LEU 38 HA LEU 38 -0.099 1.479 3.920 298 HB2 LEU 38 HB2 LEU 38 0.735 3.583 1.949 299 HB3 LEU 38 HB3 LEU 38 -0.594 2.446 1.927 300 HG LEU 38 HG LEU 38 -1.446 4.612 2.170 301 HD11 LEU 38 HD11 LEU 38 -2.700 4.422 4.288 302 HD12 LEU 38 HD12 LEU 38 -2.537 2.834 3.482 303 HD13 LEU 38 HD13 LEU 38 -1.523 3.223 4.882 304 HD21 LEU 38 HD21 LEU 38 0.755 5.484 3.357 305 HD22 LEU 38 HD22 LEU 38 -0.787 6.315 3.494 306 HD23 LEU 38 HD23 LEU 38 -0.226 5.282 4.826 307 H PHE 39 H PHE 39 3.049 2.995 3.411 308 HA PHE 39 HA PHE 39 4.141 1.625 1.350 309 HB2 PHE 39 HB2 PHE 39 5.249 3.156 3.293 310 HB3 PHE 39 HB3 PHE 39 5.857 1.610 3.837 311 HD1 PHE 39 HD1 PHE 39 5.455 3.563 0.683 312 HD2 PHE 39 HD2 PHE 39 7.869 0.821 2.887 313 HE1 PHE 39 HE1 PHE 39 7.179 3.986 -0.910 314 HE2 PHE 39 HE2 PHE 39 9.634 1.026 1.137 315 HZ PHE 39 HZ PHE 39 9.337 2.652 -0.755 316 H LYS 40 H LYS 40 4.003 0.409 4.721 317 HA LYS 40 HA LYS 40 5.130 -2.102 3.990 318 HB2 LYS 40 HB2 LYS 40 4.598 -0.971 6.414 319 HB3 LYS 40 HB3 LYS 40 3.219 -2.073 6.291 320 HG2 LYS 40 HG2 LYS 40 5.312 -3.701 5.472 321 HG3 LYS 40 HG3 LYS 40 6.148 -2.634 6.592 322 HD2 LYS 40 HD2 LYS 40 3.723 -4.397 7.145 323 HD3 LYS 40 HD3 LYS 40 5.371 -4.656 7.716 324 HE2 LYS 40 HE2 LYS 40 5.032 -3.412 9.521 325 HE3 LYS 40 HE3 LYS 40 4.601 -2.003 8.537 326 HZ1 LYS 40 HZ1 LYS 40 2.852 -2.705 10.086 327 HZ2 LYS 40 HZ2 LYS 40 2.326 -2.752 8.527 328 HZ3 LYS 40 HZ3 LYS 40 2.712 -4.149 9.276 329 H LYS 41 H LYS 41 1.619 -1.046 4.129 330 HA LYS 41 HA LYS 41 0.693 -3.722 3.693 331 HB2 LYS 41 HB2 LYS 41 -0.577 -1.242 4.192 332 HB3 LYS 41 HB3 LYS 41 -0.947 -1.521 2.514 333 HG2 LYS 41 HG2 LYS 41 -1.445 -4.036 3.439 334 HG3 LYS 41 HG3 LYS 41 -1.779 -3.136 4.917 335 HD2 LYS 41 HD2 LYS 41 -3.019 -2.697 2.156 336 HD3 LYS 41 HD3 LYS 41 -3.772 -3.547 3.522 337 HE2 LYS 41 HE2 LYS 41 -3.922 -1.557 4.832 338 HE3 LYS 41 HE3 LYS 41 -2.921 -0.637 3.695 339 HZ1 LYS 41 HZ1 LYS 41 -5.334 -0.244 3.496 340 HZ2 LYS 41 HZ2 LYS 41 -4.593 -0.695 2.097 341 HZ3 LYS 41 HZ3 LYS 41 -5.518 -1.796 2.927 342 H TRP 42 H TRP 42 1.436 -1.039 1.444 343 HA TRP 42 HA TRP 42 0.642 -2.420 -0.921 344 HB2 TRP 42 HB2 TRP 42 0.719 -0.085 -1.038 345 HB3 TRP 42 HB3 TRP 42 2.292 -0.004 -0.287 346 HD1 TRP 42 HD1 TRP 42 1.082 -1.520 -3.747 347 HE1 TRP 42 HE1 TRP 42 2.611 -0.634 -5.517 348 HE3 TRP 42 HE3 TRP 42 4.416 0.847 -0.712 349 HZ2 TRP 42 HZ2 TRP 42 5.258 0.781 -5.613 350 HZ3 TRP 42 HZ3 TRP 42 6.476 1.758 -1.628 351 HH2 TRP 42 HH2 TRP 42 6.776 1.965 -4.134 352 H VAL 43 H VAL 43 4.065 -1.833 0.332 353 HA VAL 43 HA VAL 43 5.187 -3.558 -1.517 354 HB VAL 43 HB VAL 43 6.113 -2.956 1.322 355 HG11 VAL 43 HG11 VAL 43 8.325 -3.566 0.779 356 HG12 VAL 43 HG12 VAL 43 7.371 -4.904 0.156 357 HG13 VAL 43 HG13 VAL 43 8.002 -3.678 -0.954 358 HG21 VAL 43 HG21 VAL 43 7.551 -1.235 0.219 359 HG22 VAL 43 HG22 VAL 43 6.831 -1.644 -1.352 360 HG23 VAL 43 HG23 VAL 43 5.856 -0.907 -0.090 361 H PHE 44 H PHE 44 3.415 -4.522 1.455 362 HA PHE 44 HA PHE 44 4.147 -7.289 1.331 363 HB2 PHE 44 HB2 PHE 44 2.022 -5.623 2.705 364 HB3 PHE 44 HB3 PHE 44 1.828 -7.327 2.590 365 HD1 PHE 44 HD1 PHE 44 5.099 -5.475 3.206 366 HD2 PHE 44 HD2 PHE 44 2.011 -8.031 4.810 367 HE1 PHE 44 HE1 PHE 44 6.510 -5.953 5.149 368 HE2 PHE 44 HE2 PHE 44 3.422 -8.460 6.795 369 HZ PHE 44 HZ PHE 44 5.691 -7.448 6.966 370 H ASP 45 H ASP 45 1.112 -5.610 0.356 371 HA ASP 45 HA ASP 45 -0.017 -7.941 -0.801 372 HB2 ASP 45 HB2 ASP 45 -1.065 -5.767 0.171 373 HB3 ASP 45 HB3 ASP 45 -0.911 -5.142 -1.467 374 H GLU 46 H GLU 46 1.758 -5.241 -2.209 375 HA GLU 46 HA GLU 46 1.372 -5.811 -4.988 376 HB2 GLU 46 HB2 GLU 46 1.907 -3.604 -3.861 377 HB3 GLU 46 HB3 GLU 46 3.529 -4.211 -3.542 378 HG2 GLU 46 HG2 GLU 46 3.723 -2.783 -5.388 379 HG3 GLU 46 HG3 GLU 46 3.894 -4.410 -5.993 380 H PHE 47 H PHE 47 3.848 -6.883 -2.561 381 HA PHE 47 HA PHE 47 5.227 -8.233 -4.822 382 HB2 PHE 47 HB2 PHE 47 6.707 -7.042 -2.487 383 HB3 PHE 47 HB3 PHE 47 7.323 -7.758 -3.966 384 HD1 PHE 47 HD1 PHE 47 6.347 -6.556 -6.231 385 HD2 PHE 47 HD2 PHE 47 6.753 -4.742 -2.366 386 HE1 PHE 47 HE1 PHE 47 6.566 -4.332 -7.282 387 HE2 PHE 47 HE2 PHE 47 6.791 -2.436 -3.455 388 HZ PHE 47 HZ PHE 47 6.715 -2.271 -5.870 389 H LEU 48 H LEU 48 5.089 -8.221 -1.230 390 HA LEU 48 HA LEU 48 6.186 -10.851 -1.061 391 HB2 LEU 48 HB2 LEU 48 4.373 -9.454 0.955 392 HB3 LEU 48 HB3 LEU 48 5.397 -10.856 1.276 393 HG LEU 48 HG LEU 48 6.343 -8.060 0.546 394 HD11 LEU 48 HD11 LEU 48 6.340 -9.694 3.106 395 HD12 LEU 48 HD12 LEU 48 7.251 -8.182 2.926 396 HD13 LEU 48 HD13 LEU 48 5.486 -8.210 2.781 397 HD21 LEU 48 HD21 LEU 48 7.945 -9.526 -0.444 398 HD22 LEU 48 HD22 LEU 48 8.645 -8.969 1.071 399 HD23 LEU 48 HD23 LEU 48 7.948 -10.609 0.959 400 H ASN 49 H ASN 49 2.888 -9.739 -1.353 401 HA ASN 49 HA ASN 49 1.721 -12.413 -0.957 402 HB2 ASN 49 HB2 ASN 49 0.560 -9.801 -1.926 403 HB3 ASN 49 HB3 ASN 49 -0.359 -11.289 -1.941 404 HD21 ASN 49 HD21 ASN 49 1.703 -9.452 0.440 405 HD22 ASN 49 HD22 ASN 49 0.675 -9.817 1.806 406 H LYS 50 H LYS 50 3.078 -10.618 -3.755 407 HA LYS 50 HA LYS 50 2.121 -12.435 -5.741 408 HB2 LYS 50 HB2 LYS 50 3.643 -9.885 -5.357 409 HB3 LYS 50 HB3 LYS 50 4.446 -10.963 -6.467 410 HG2 LYS 50 HG2 LYS 50 3.111 -9.739 -7.756 411 HG3 LYS 50 HG3 LYS 50 2.164 -11.245 -7.575 412 HD2 LYS 50 HD2 LYS 50 0.877 -9.929 -5.767 413 HD3 LYS 50 HD3 LYS 50 1.694 -8.487 -6.377 414 HE2 LYS 50 HE2 LYS 50 -0.271 -10.307 -7.813 415 HE3 LYS 50 HE3 LYS 50 -0.420 -8.590 -7.435 416 HZ1 LYS 50 HZ1 LYS 50 0.072 -8.869 -9.750 417 HZ2 LYS 50 HZ2 LYS 50 1.385 -8.187 -9.064 418 HZ3 LYS 50 HZ3 LYS 50 1.371 -9.799 -9.449 419 H GLY 51 H GLY 51 4.363 -12.836 -3.224 420 HA2 GLY 51 HA2 GLY 51 5.723 -14.715 -2.910 421 HA3 GLY 51 HA3 GLY 51 5.615 -15.082 -4.634 422 H TYR 52 H TYR 52 6.492 -11.781 -4.230 423 HA TYR 52 HA TYR 52 9.166 -12.297 -5.216 424 HB2 TYR 52 HB2 TYR 52 7.839 -9.810 -4.131 425 HB3 TYR 52 HB3 TYR 52 9.530 -9.831 -4.619 426 HD1 TYR 52 HD1 TYR 52 10.189 -10.292 -6.965 427 HD2 TYR 52 HD2 TYR 52 6.103 -9.750 -5.819 428 HE1 TYR 52 HE1 TYR 52 9.570 -10.094 -9.341 429 HE2 TYR 52 HE2 TYR 52 5.442 -9.509 -8.180 430 HH TYR 52 HH TYR 52 6.134 -9.515 -10.349 431 H ASN 53 H ASN 53 11.040 -12.236 -4.204 432 HA ASN 53 HA ASN 53 11.220 -11.839 -1.263 433 HB2 ASN 53 HB2 ASN 53 11.533 -14.375 -2.808 434 HB3 ASN 53 HB3 ASN 53 12.880 -14.021 -1.759 435 HD21 ASN 53 HD21 ASN 53 9.529 -13.026 -0.838 436 HD22 ASN 53 HD22 ASN 53 9.295 -14.319 0.287 437 H LYS 54 H LYS 54 11.957 -10.127 -3.687 438 HA LYS 54 HA LYS 54 14.509 -9.422 -2.662 439 HB2 LYS 54 HB2 LYS 54 14.335 -10.540 -5.482 440 HB3 LYS 54 HB3 LYS 54 15.391 -9.179 -5.120 441 HG2 LYS 54 HG2 LYS 54 16.941 -10.388 -4.357 442 HG3 LYS 54 HG3 LYS 54 15.961 -11.055 -3.050 443 HD2 LYS 54 HD2 LYS 54 16.354 -12.110 -5.908 444 HD3 LYS 54 HD3 LYS 54 16.974 -12.856 -4.417 445 HE2 LYS 54 HE2 LYS 54 14.712 -13.406 -3.681 446 HE3 LYS 54 HE3 LYS 54 14.026 -12.447 -5.000 447 HZ1 LYS 54 HZ1 LYS 54 15.584 -14.915 -5.444 448 HZ2 LYS 54 HZ2 LYS 54 13.965 -14.769 -5.522 449 HZ3 LYS 54 HZ3 LYS 54 14.837 -13.953 -6.598 450 H ILE 55 H ILE 55 13.789 -7.498 -2.143 451 HA ILE 55 HA ILE 55 12.349 -5.834 -4.173 452 HB ILE 55 HB ILE 55 12.474 -5.746 -1.122 453 HG12 ILE 55 HG12 ILE 55 10.146 -5.829 -1.162 454 HG13 ILE 55 HG13 ILE 55 10.030 -5.412 -2.873 455 HG21 ILE 55 HG21 ILE 55 11.507 -3.730 -3.066 456 HG22 ILE 55 HG22 ILE 55 11.102 -3.655 -1.339 457 HG23 ILE 55 HG23 ILE 55 12.775 -3.453 -1.822 458 HD11 ILE 55 HD11 ILE 55 11.012 -8.100 -1.812 459 HD12 ILE 55 HD12 ILE 55 9.266 -7.687 -2.170 460 HD13 ILE 55 HD13 ILE 55 10.380 -7.625 -3.448 461 H PHE 56 H PHE 56 13.248 -3.961 -4.795 462 HA PHE 56 HA PHE 56 15.798 -3.204 -3.226 463 HB2 PHE 56 HB2 PHE 56 15.303 -2.870 -6.188 464 HB3 PHE 56 HB3 PHE 56 16.527 -1.950 -5.432 465 HD1 PHE 56 HD1 PHE 56 17.339 -4.486 -3.449 466 HD2 PHE 56 HD2 PHE 56 16.879 -3.883 -7.708 467 HE1 PHE 56 HE1 PHE 56 18.596 -6.485 -3.903 468 HE2 PHE 56 HE2 PHE 56 17.888 -5.998 -8.137 469 HZ PHE 56 HZ PHE 56 18.834 -7.354 -6.213 470 H LEU 57 H LEU 57 16.381 -0.926 -3.021 471 HA LEU 57 HA LEU 57 14.155 0.967 -3.709 472 HB2 LEU 57 HB2 LEU 57 14.157 0.641 -1.312 473 HB3 LEU 57 HB3 LEU 57 15.920 0.698 -1.273 474 HG LEU 57 HG LEU 57 15.931 3.068 -1.828 475 HD11 LEU 57 HD11 LEU 57 14.029 3.351 -3.241 476 HD12 LEU 57 HD12 LEU 57 12.931 2.716 -2.034 477 HD13 LEU 57 HD13 LEU 57 13.734 4.281 -1.786 478 HD21 LEU 57 HD21 LEU 57 14.872 3.954 0.233 479 HD22 LEU 57 HD22 LEU 57 14.047 2.409 0.474 480 HD23 LEU 57 HD23 LEU 57 15.812 2.510 0.552 481 H VAL 58 H VAL 58 14.858 2.591 -5.108 482 HA VAL 58 HA VAL 58 17.781 3.189 -5.252 483 HB VAL 58 HB VAL 58 15.431 3.945 -7.036 484 HG11 VAL 58 HG11 VAL 58 17.166 4.712 -8.657 485 HG12 VAL 58 HG12 VAL 58 17.183 5.629 -7.155 486 HG13 VAL 58 HG13 VAL 58 18.425 4.395 -7.443 487 HG21 VAL 58 HG21 VAL 58 17.665 1.968 -7.635 488 HG22 VAL 58 HG22 VAL 58 15.993 1.533 -7.227 489 HG23 VAL 58 HG23 VAL 58 16.323 2.428 -8.711 490 H LEU 59 H LEU 59 18.483 5.242 -4.481 491 HA LEU 59 HA LEU 59 16.330 7.108 -3.550 492 HB2 LEU 59 HB2 LEU 59 19.058 6.584 -2.289 493 HB3 LEU 59 HB3 LEU 59 17.853 7.814 -1.838 494 HG LEU 59 HG LEU 59 16.264 5.633 -1.644 495 HD11 LEU 59 HD11 LEU 59 17.556 3.878 -0.422 496 HD12 LEU 59 HD12 LEU 59 18.126 4.028 -2.096 497 HD13 LEU 59 HD13 LEU 59 19.052 4.741 -0.755 498 HD21 LEU 59 HD21 LEU 59 16.713 7.431 0.086 499 HD22 LEU 59 HD22 LEU 59 16.499 5.790 0.737 500 HD23 LEU 59 HD23 LEU 59 18.118 6.471 0.601 501 H SER 60 H SER 60 16.751 7.514 -6.030 502 HA SER 60 HA SER 60 19.137 9.270 -6.477 503 HB2 SER 60 HB2 SER 60 19.152 7.245 -7.805 504 HB3 SER 60 HB3 SER 60 17.466 7.478 -8.272 505 HG SER 60 HG SER 60 19.751 8.506 -9.387 506 H ASP 61 H ASP 61 15.590 8.957 -7.261 507 HA ASP 61 HA ASP 61 15.513 11.647 -8.394 508 HB2 ASP 61 HB2 ASP 61 13.908 9.853 -9.074 509 HB3 ASP 61 HB3 ASP 61 13.206 9.903 -7.467 510 H VAL 62 H VAL 62 14.505 10.052 -5.389 511 HA VAL 62 HA VAL 62 13.915 12.512 -3.951 512 HB VAL 62 HB VAL 62 13.015 10.045 -3.649 513 HG11 VAL 62 HG11 VAL 62 15.183 8.941 -3.355 514 HG12 VAL 62 HG12 VAL 62 15.428 9.811 -1.824 515 HG13 VAL 62 HG13 VAL 62 14.090 8.668 -1.990 516 HG21 VAL 62 HG21 VAL 62 12.544 10.458 -1.266 517 HG22 VAL 62 HG22 VAL 62 13.761 11.758 -1.272 518 HG23 VAL 62 HG23 VAL 62 12.287 11.895 -2.264 519 H GLU 63 H GLU 63 15.261 13.655 -2.629 520 HA GLU 63 HA GLU 63 18.128 13.053 -2.649 521 HB2 GLU 63 HB2 GLU 63 17.442 15.349 -2.720 522 HB3 GLU 63 HB3 GLU 63 16.430 15.149 -1.275 523 HG2 GLU 63 HG2 GLU 63 18.269 15.037 0.180 524 HG3 GLU 63 HG3 GLU 63 19.399 14.558 -1.084 525 H SER 64 H SER 64 15.323 12.643 -0.416 526 HA SER 64 HA SER 64 16.728 10.651 1.023 527 HB2 SER 64 HB2 SER 64 17.923 12.392 2.095 528 HB3 SER 64 HB3 SER 64 16.550 13.444 2.183 529 HG SER 64 HG SER 64 15.685 11.993 3.829 530 H ILE 65 H ILE 65 15.644 9.819 2.740 531 HA ILE 65 HA ILE 65 12.710 9.731 2.662 532 HB ILE 65 HB ILE 65 14.037 7.680 2.589 533 HG12 ILE 65 HG12 ILE 65 12.722 7.735 5.331 534 HG13 ILE 65 HG13 ILE 65 11.784 7.877 3.842 535 HG21 ILE 65 HG21 ILE 65 15.207 6.958 4.845 536 HG22 ILE 65 HG22 ILE 65 16.037 7.788 3.570 537 HG23 ILE 65 HG23 ILE 65 15.470 8.703 5.003 538 HD11 ILE 65 HD11 ILE 65 13.495 5.535 4.716 539 HD12 ILE 65 HD12 ILE 65 11.749 5.580 4.443 540 HD13 ILE 65 HD13 ILE 65 12.854 5.701 3.067 541 H ASP 66 H ASP 66 11.714 9.692 5.081 542 HA ASP 66 HA ASP 66 12.855 11.975 6.629 543 HB2 ASP 66 HB2 ASP 66 10.115 11.358 5.689 544 HB3 ASP 66 HB3 ASP 66 10.199 11.661 7.422 545 H SER 67 H SER 67 12.374 11.808 9.074 546 HA SER 67 HA SER 67 13.487 9.391 9.981 547 HB2 SER 67 HB2 SER 67 13.232 10.286 12.179 548 HB3 SER 67 HB3 SER 67 13.789 11.546 11.075 549 HG SER 67 HG SER 67 12.057 11.973 12.655 550 H PHE 68 H PHE 68 10.142 10.196 9.497 551 HA PHE 68 HA PHE 68 8.913 8.189 11.133 552 HB2 PHE 68 HB2 PHE 68 7.875 10.175 10.021 553 HB3 PHE 68 HB3 PHE 68 7.853 9.224 8.544 554 HD1 PHE 68 HD1 PHE 68 6.478 9.647 11.955 555 HD2 PHE 68 HD2 PHE 68 6.393 7.286 8.368 556 HE1 PHE 68 HE1 PHE 68 4.350 8.626 12.696 557 HE2 PHE 68 HE2 PHE 68 4.296 6.161 9.164 558 HZ PHE 68 HZ PHE 68 3.245 6.884 11.303 559 H SER 69 H SER 69 9.329 8.039 7.496 560 HA SER 69 HA SER 69 8.952 5.218 7.571 561 HB2 SER 69 HB2 SER 69 8.318 6.758 5.761 562 HB3 SER 69 HB3 SER 69 10.018 6.866 5.253 563 HG SER 69 HG SER 69 8.531 5.266 4.216 564 H LEU 70 H LEU 70 11.924 7.039 7.961 565 HA LEU 70 HA LEU 70 13.881 5.201 7.196 566 HB2 LEU 70 HB2 LEU 70 13.541 7.220 9.368 567 HB3 LEU 70 HB3 LEU 70 14.730 5.984 9.732 568 HG LEU 70 HG LEU 70 14.807 7.412 7.086 569 HD11 LEU 70 HD11 LEU 70 16.626 8.900 8.083 570 HD12 LEU 70 HD12 LEU 70 14.979 9.315 8.531 571 HD13 LEU 70 HD13 LEU 70 16.037 8.436 9.681 572 HD21 LEU 70 HD21 LEU 70 17.104 6.786 7.096 573 HD22 LEU 70 HD22 LEU 70 17.073 6.360 8.817 574 HD23 LEU 70 HD23 LEU 70 16.224 5.338 7.651 575 H GLY 71 H GLY 71 11.596 4.912 9.871 576 HA2 GLY 71 HA2 GLY 71 12.882 2.459 10.900 577 HA3 GLY 71 HA3 GLY 71 11.435 3.244 11.536 578 H VAL 72 H VAL 72 10.342 3.195 8.604 579 HA VAL 72 HA VAL 72 8.989 0.596 8.845 580 HB VAL 72 HB VAL 72 8.716 2.904 6.837 581 HG11 VAL 72 HG11 VAL 72 6.541 1.872 6.268 582 HG12 VAL 72 HG12 VAL 72 7.856 0.758 5.914 583 HG13 VAL 72 HG13 VAL 72 6.869 0.508 7.369 584 HG21 VAL 72 HG21 VAL 72 7.090 2.253 9.320 585 HG22 VAL 72 HG22 VAL 72 8.134 3.659 9.054 586 HG23 VAL 72 HG23 VAL 72 6.673 3.474 8.088 587 H ILE 73 H ILE 73 11.325 2.255 6.721 588 HA ILE 73 HA ILE 73 11.706 0.230 4.805 589 HB ILE 73 HB ILE 73 13.564 2.280 6.018 590 HG12 ILE 73 HG12 ILE 73 11.846 3.203 4.609 591 HG13 ILE 73 HG13 ILE 73 13.413 3.361 3.828 592 HG21 ILE 73 HG21 ILE 73 15.159 0.637 5.380 593 HG22 ILE 73 HG22 ILE 73 14.343 0.345 3.822 594 HG23 ILE 73 HG23 ILE 73 15.170 1.881 4.135 595 HD11 ILE 73 HD11 ILE 73 11.748 2.806 2.198 596 HD12 ILE 73 HD12 ILE 73 12.868 1.435 2.347 597 HD13 ILE 73 HD13 ILE 73 11.249 1.356 3.077 598 H VAL 74 H VAL 74 13.358 0.472 8.015 599 HA VAL 74 HA VAL 74 14.769 -1.985 7.601 600 HB VAL 74 HB VAL 74 13.925 -0.402 10.079 601 HG11 VAL 74 HG11 VAL 74 13.948 -2.679 10.909 602 HG12 VAL 74 HG12 VAL 74 15.487 -3.017 10.086 603 HG13 VAL 74 HG13 VAL 74 15.425 -1.870 11.448 604 HG21 VAL 74 HG21 VAL 74 15.728 0.511 8.656 605 HG22 VAL 74 HG22 VAL 74 16.346 0.037 10.239 606 HG23 VAL 74 HG23 VAL 74 16.648 -0.999 8.825 607 H ASN 75 H ASN 75 11.453 -1.329 8.922 608 HA ASN 75 HA ASN 75 10.847 -3.842 9.890 609 HB2 ASN 75 HB2 ASN 75 9.507 -1.482 9.578 610 HB3 ASN 75 HB3 ASN 75 8.843 -2.308 8.189 611 HD21 ASN 75 HD21 ASN 75 9.010 -2.207 11.703 612 HD22 ASN 75 HD22 ASN 75 7.770 -3.433 11.893 613 H ILE 76 H ILE 76 10.537 -2.640 6.540 614 HA ILE 76 HA ILE 76 9.514 -4.970 5.292 615 HB ILE 76 HB ILE 76 10.986 -2.464 4.470 616 HG12 ILE 76 HG12 ILE 76 8.296 -3.634 3.637 617 HG13 ILE 76 HG13 ILE 76 8.512 -2.490 4.967 618 HG21 ILE 76 HG21 ILE 76 10.408 -4.701 2.502 619 HG22 ILE 76 HG22 ILE 76 10.930 -3.057 2.087 620 HG23 ILE 76 HG23 ILE 76 12.004 -4.115 2.976 621 HD11 ILE 76 HD11 ILE 76 9.356 -0.787 3.487 622 HD12 ILE 76 HD12 ILE 76 9.120 -1.851 2.071 623 HD13 ILE 76 HD13 ILE 76 7.729 -1.351 3.036 624 H LEU 77 H LEU 77 12.868 -4.115 6.238 625 HA LEU 77 HA LEU 77 14.082 -6.244 4.655 626 HB2 LEU 77 HB2 LEU 77 15.313 -4.167 5.259 627 HB3 LEU 77 HB3 LEU 77 15.149 -4.524 6.947 628 HG LEU 77 HG LEU 77 17.362 -4.970 5.877 629 HD11 LEU 77 HD11 LEU 77 16.534 -5.889 8.110 630 HD12 LEU 77 HD12 LEU 77 16.402 -7.455 7.270 631 HD13 LEU 77 HD13 LEU 77 17.953 -6.602 7.353 632 HD21 LEU 77 HD21 LEU 77 17.799 -7.062 4.732 633 HD22 LEU 77 HD22 LEU 77 16.086 -7.500 4.766 634 HD23 LEU 77 HD23 LEU 77 16.633 -6.104 3.812 635 H LYS 78 H LYS 78 13.143 -5.758 8.062 636 HA LYS 78 HA LYS 78 14.088 -8.247 9.036 637 HB2 LYS 78 HB2 LYS 78 11.592 -6.750 9.977 638 HB3 LYS 78 HB3 LYS 78 12.483 -8.022 10.831 639 HG2 LYS 78 HG2 LYS 78 14.535 -6.507 10.664 640 HG3 LYS 78 HG3 LYS 78 13.439 -5.211 10.180 641 HD2 LYS 78 HD2 LYS 78 12.303 -5.249 12.278 642 HD3 LYS 78 HD3 LYS 78 12.926 -6.874 12.661 643 HE2 LYS 78 HE2 LYS 78 15.257 -5.877 12.668 644 HE3 LYS 78 HE3 LYS 78 14.480 -4.275 12.641 645 HZ1 LYS 78 HZ1 LYS 78 13.973 -6.374 14.673 646 HZ2 LYS 78 HZ2 LYS 78 15.018 -5.105 14.892 647 HZ3 LYS 78 HZ3 LYS 78 13.403 -4.841 14.707 648 H SER 79 H SER 79 10.860 -7.392 7.792 649 HA SER 79 HA SER 79 9.625 -9.881 7.958 650 HB2 SER 79 HB2 SER 79 8.523 -7.729 7.388 651 HB3 SER 79 HB3 SER 79 9.309 -7.742 5.799 652 HG SER 79 HG SER 79 8.135 -9.526 5.218 653 H ILE 80 H ILE 80 11.522 -8.527 5.203 654 HA ILE 80 HA ILE 80 11.195 -10.802 3.580 655 HB ILE 80 HB ILE 80 12.963 -8.360 3.597 656 HG12 ILE 80 HG12 ILE 80 10.849 -9.467 1.679 657 HG13 ILE 80 HG13 ILE 80 10.550 -8.264 2.933 658 HG21 ILE 80 HG21 ILE 80 14.398 -10.151 2.610 659 HG22 ILE 80 HG22 ILE 80 13.154 -10.405 1.348 660 HG23 ILE 80 HG23 ILE 80 13.965 -8.850 1.531 661 HD11 ILE 80 HD11 ILE 80 12.283 -7.896 0.455 662 HD12 ILE 80 HD12 ILE 80 10.721 -7.164 0.786 663 HD13 ILE 80 HD13 ILE 80 12.123 -6.699 1.773 664 H SER 81 H SER 81 13.937 -9.951 5.739 665 HA SER 81 HA SER 81 15.526 -12.244 5.351 666 HB2 SER 81 HB2 SER 81 14.962 -10.341 7.633 667 HB3 SER 81 HB3 SER 81 15.853 -11.841 7.964 668 HG SER 81 HG SER 81 17.373 -10.551 7.524 669 H SER 82 H SER 82 12.821 -11.784 7.742 670 HA SER 82 HA SER 82 12.898 -14.443 8.730 671 HB2 SER 82 HB2 SER 82 10.730 -12.304 8.683 672 HB3 SER 82 HB3 SER 82 10.659 -13.791 9.658 673 HG SER 82 HG SER 82 11.447 -12.194 10.941 674 H SER 83 H SER 83 11.600 -13.251 5.750 675 HA SER 83 HA SER 83 9.572 -15.368 5.459 676 HB2 SER 83 HB2 SER 83 10.653 -13.267 3.519 677 HB3 SER 83 HB3 SER 83 9.333 -14.388 3.193 678 HG SER 83 HG SER 83 9.453 -12.565 5.392 679 H GLY 84 H GLY 84 12.799 -14.505 4.105 680 HA2 GLY 84 HA2 GLY 84 14.101 -16.659 3.437 681 HA3 GLY 84 HA3 GLY 84 12.661 -16.963 2.451 682 H GLY 85 H GLY 85 12.964 -13.571 2.344 683 HA2 GLY 85 HA2 GLY 85 14.401 -13.744 -0.201 684 HA3 GLY 85 HA3 GLY 85 13.293 -12.490 0.349 685 H PHE 86 H PHE 86 15.082 -11.243 -0.537 686 HA PHE 86 HA PHE 86 16.731 -10.216 1.665 687 HB2 PHE 86 HB2 PHE 86 17.843 -11.490 -0.682 688 HB3 PHE 86 HB3 PHE 86 18.236 -9.791 -0.761 689 HD1 PHE 86 HD1 PHE 86 18.201 -12.507 1.833 690 HD2 PHE 86 HD2 PHE 86 20.153 -8.933 0.389 691 HE1 PHE 86 HE1 PHE 86 19.694 -12.545 3.793 692 HE2 PHE 86 HE2 PHE 86 21.555 -8.929 2.424 693 HZ PHE 86 HZ PHE 86 21.343 -10.722 4.117 694 H PHE 87 H PHE 87 17.508 -7.891 1.143 695 HA PHE 87 HA PHE 87 16.074 -6.518 -0.925 696 HB2 PHE 87 HB2 PHE 87 14.226 -6.385 0.467 697 HB3 PHE 87 HB3 PHE 87 15.184 -6.429 1.943 698 HD1 PHE 87 HD1 PHE 87 15.085 -4.002 -1.013 699 HD2 PHE 87 HD2 PHE 87 14.804 -4.614 3.237 700 HE1 PHE 87 HE1 PHE 87 14.784 -1.575 -0.667 701 HE2 PHE 87 HE2 PHE 87 14.512 -2.195 3.612 702 HZ PHE 87 HZ PHE 87 14.490 -0.651 1.619 703 H ALA 88 H ALA 88 17.108 -4.534 -1.387 704 HA ALA 88 HA ALA 88 19.133 -3.555 0.407 705 HB1 ALA 88 HB1 ALA 88 19.890 -4.679 -2.321 706 HB2 ALA 88 HB2 ALA 88 20.962 -3.801 -1.201 707 HB3 ALA 88 HB3 ALA 88 20.325 -5.400 -0.765 708 H LEU 89 H LEU 89 20.336 -1.669 -0.612 709 HA LEU 89 HA LEU 89 18.278 0.021 -1.954 710 HB2 LEU 89 HB2 LEU 89 20.444 1.151 -0.218 711 HB3 LEU 89 HB3 LEU 89 18.878 1.830 -0.635 712 HG LEU 89 HG LEU 89 19.548 -0.353 1.341 713 HD11 LEU 89 HD11 LEU 89 18.722 1.211 3.032 714 HD12 LEU 89 HD12 LEU 89 19.871 2.084 2.009 715 HD13 LEU 89 HD13 LEU 89 18.144 2.334 1.768 716 HD21 LEU 89 HD21 LEU 89 17.238 -0.477 2.034 717 HD22 LEU 89 HD22 LEU 89 16.772 0.547 0.669 718 HD23 LEU 89 HD23 LEU 89 17.492 -1.052 0.392 719 H VAL 90 H VAL 90 19.242 1.923 -3.141 720 HA VAL 90 HA VAL 90 21.800 1.349 -4.520 721 HB VAL 90 HB VAL 90 19.006 1.555 -5.729 722 HG11 VAL 90 HG11 VAL 90 20.326 2.775 -7.241 723 HG12 VAL 90 HG12 VAL 90 21.693 1.647 -7.078 724 HG13 VAL 90 HG13 VAL 90 20.198 1.168 -7.913 725 HG21 VAL 90 HG21 VAL 90 19.697 -0.675 -6.703 726 HG22 VAL 90 HG22 VAL 90 21.019 -0.680 -5.556 727 HG23 VAL 90 HG23 VAL 90 19.315 -0.637 -4.988 728 H SER 91 H SER 91 22.642 3.144 -5.631 729 HA SER 91 HA SER 91 23.248 5.253 -5.967 730 HB2 SER 91 HB2 SER 91 21.205 4.728 -7.489 731 HB3 SER 91 HB3 SER 91 20.336 5.883 -6.474 732 HG SER 91 HG SER 91 22.644 7.012 -7.162 733 HA PRO 92 HA PRO 92 21.664 6.837 -1.877 734 HB2 PRO 92 HB2 PRO 92 23.922 6.470 -0.372 735 HB3 PRO 92 HB3 PRO 92 22.591 5.308 -0.478 736 HG2 PRO 92 HG2 PRO 92 25.336 5.213 -1.661 737 HG3 PRO 92 HG3 PRO 92 24.201 3.866 -1.336 738 HD2 PRO 92 HD2 PRO 92 24.721 5.168 -3.825 739 HD3 PRO 92 HD3 PRO 92 23.493 3.910 -3.453 740 H ASN 93 H ASN 93 21.744 8.926 -3.072 741 HA ASN 93 HA ASN 93 24.055 10.532 -3.018 742 HB2 ASN 93 HB2 ASN 93 21.803 12.034 -1.799 743 HB3 ASN 93 HB3 ASN 93 22.798 12.461 -3.153 744 HD21 ASN 93 HD21 ASN 93 19.887 11.252 -2.020 745 HD22 ASN 93 HD22 ASN 93 19.109 10.806 -3.542 746 H GLU 94 H GLU 94 24.651 12.195 -1.445 747 HA GLU 94 HA GLU 94 25.513 10.831 0.887 748 HB2 GLU 94 HB2 GLU 94 26.926 12.417 -0.354 749 HB3 GLU 94 HB3 GLU 94 25.873 13.755 0.136 750 HG2 GLU 94 HG2 GLU 94 26.410 13.401 2.472 751 HG3 GLU 94 HG3 GLU 94 27.252 11.905 2.101 752 H LYS 95 H LYS 95 22.862 13.100 0.375 753 HA LYS 95 HA LYS 95 22.744 14.260 2.942 754 HB2 LYS 95 HB2 LYS 95 21.434 14.805 0.680 755 HB3 LYS 95 HB3 LYS 95 20.274 13.616 1.234 756 HG2 LYS 95 HG2 LYS 95 21.014 16.296 2.414 757 HG3 LYS 95 HG3 LYS 95 19.479 15.882 1.716 758 HD2 LYS 95 HD2 LYS 95 20.466 14.617 4.179 759 HD3 LYS 95 HD3 LYS 95 19.717 16.185 4.260 760 HE2 LYS 95 HE2 LYS 95 18.444 13.478 3.665 761 HE3 LYS 95 HE3 LYS 95 18.404 14.384 5.130 762 HZ1 LYS 95 HZ1 LYS 95 16.367 14.803 3.861 763 HZ2 LYS 95 HZ2 LYS 95 17.170 16.145 4.269 764 HZ3 LYS 95 HZ3 LYS 95 17.216 15.619 2.722 765 H VAL 96 H VAL 96 21.135 11.382 1.563 766 HA VAL 96 HA VAL 96 19.940 10.952 4.109 767 HB VAL 96 HB VAL 96 19.011 10.542 1.794 768 HG11 VAL 96 HG11 VAL 96 20.649 8.833 1.077 769 HG12 VAL 96 HG12 VAL 96 19.892 7.702 2.241 770 HG13 VAL 96 HG13 VAL 96 18.915 8.437 0.945 771 HG21 VAL 96 HG21 VAL 96 18.499 8.396 3.833 772 HG22 VAL 96 HG22 VAL 96 18.019 10.055 4.148 773 HG23 VAL 96 HG23 VAL 96 17.353 9.185 2.731 774 H GLU 97 H GLU 97 22.587 9.508 2.285 775 HA GLU 97 HA GLU 97 23.271 7.361 3.902 776 HB2 GLU 97 HB2 GLU 97 24.654 9.116 1.983 777 HB3 GLU 97 HB3 GLU 97 25.740 8.441 3.198 778 HG2 GLU 97 HG2 GLU 97 23.731 6.746 1.707 779 HG3 GLU 97 HG3 GLU 97 25.350 7.119 1.086 780 H ARG 98 H ARG 98 23.867 10.981 4.577 781 HA ARG 98 HA ARG 98 25.609 10.562 6.465 782 HB2 ARG 98 HB2 ARG 98 24.023 12.553 5.353 783 HB3 ARG 98 HB3 ARG 98 23.314 12.515 6.969 784 HG2 ARG 98 HG2 ARG 98 26.228 12.530 6.429 785 HG3 ARG 98 HG3 ARG 98 25.107 13.909 6.399 786 HD2 ARG 98 HD2 ARG 98 24.695 13.329 8.901 787 HD3 ARG 98 HD3 ARG 98 25.895 12.059 8.731 788 HE ARG 98 HE ARG 98 27.573 13.733 8.204 789 HH11 ARG 98 HH11 ARG 98 24.639 15.049 9.733 790 HH12 ARG 98 HH12 ARG 98 25.418 16.531 10.184 791 HH21 ARG 98 HH21 ARG 98 28.451 15.698 8.545 792 HH22 ARG 98 HH22 ARG 98 27.610 16.953 9.446 793 H VAL 99 H VAL 99 22.273 10.671 6.656 794 HA VAL 99 HA VAL 99 22.009 10.470 9.395 795 HB VAL 99 HB VAL 99 19.885 9.663 7.277 796 HG11 VAL 99 HG11 VAL 99 18.989 9.184 9.473 797 HG12 VAL 99 HG12 VAL 99 19.501 10.773 10.097 798 HG13 VAL 99 HG13 VAL 99 18.208 10.648 8.879 799 HG21 VAL 99 HG21 VAL 99 20.783 12.371 8.136 800 HG22 VAL 99 HG22 VAL 99 20.775 11.611 6.528 801 HG23 VAL 99 HG23 VAL 99 19.231 12.053 7.264 802 H LEU 100 H LEU 100 21.688 8.203 6.677 803 HA LEU 100 HA LEU 100 20.996 5.833 7.983 804 HB2 LEU 100 HB2 LEU 100 22.770 6.174 5.551 805 HB3 LEU 100 HB3 LEU 100 22.064 4.717 6.061 806 HG LEU 100 HG LEU 100 21.012 6.789 4.342 807 HD11 LEU 100 HD11 LEU 100 19.500 5.152 3.586 808 HD12 LEU 100 HD12 LEU 100 21.037 4.352 3.934 809 HD13 LEU 100 HD13 LEU 100 19.667 4.193 5.065 810 HD21 LEU 100 HD21 LEU 100 19.540 7.852 5.872 811 HD22 LEU 100 HD22 LEU 100 18.547 6.641 5.132 812 HD23 LEU 100 HD23 LEU 100 19.221 6.320 6.735 813 H SER 101 H SER 101 23.955 7.659 7.819 814 HA SER 101 HA SER 101 25.607 5.532 9.009 815 HB2 SER 101 HB2 SER 101 26.309 8.269 7.984 816 HB3 SER 101 HB3 SER 101 27.466 7.146 8.732 817 HG SER 101 HG SER 101 26.956 7.157 6.290 818 H LEU 102 H LEU 102 23.481 7.661 10.285 819 HA LEU 102 HA LEU 102 24.853 7.921 12.923 820 HB2 LEU 102 HB2 LEU 102 22.805 9.671 11.503 821 HB3 LEU 102 HB3 LEU 102 23.258 9.896 13.186 822 HG LEU 102 HG LEU 102 25.246 10.109 10.883 823 HD11 LEU 102 HD11 LEU 102 25.104 12.544 11.288 824 HD12 LEU 102 HD12 LEU 102 23.552 11.870 10.739 825 HD13 LEU 102 HD13 LEU 102 23.807 12.251 12.469 826 HD21 LEU 102 HD21 LEU 102 25.499 10.853 13.807 827 HD22 LEU 102 HD22 LEU 102 26.333 9.528 12.958 828 HD23 LEU 102 HD23 LEU 102 26.696 11.193 12.532 829 H THR 103 H THR 103 21.969 6.824 11.202 830 HA THR 103 HA THR 103 20.593 6.215 13.726 831 HB THR 103 HB THR 103 19.602 7.665 11.918 832 HG1 THR 103 HG1 THR 103 18.416 5.247 12.700 833 HG21 THR 103 HG21 THR 103 18.833 5.216 10.348 834 HG22 THR 103 HG22 THR 103 19.048 6.912 9.823 835 HG23 THR 103 HG23 THR 103 20.440 5.850 10.072 836 H ASN 104 H ASN 104 22.719 4.595 11.879 837 HA ASN 104 HA ASN 104 23.178 2.474 11.238 838 HB2 ASN 104 HB2 ASN 104 21.443 1.752 13.605 839 HB3 ASN 104 HB3 ASN 104 22.371 0.606 12.655 840 HD21 ASN 104 HD21 ASN 104 22.708 3.552 14.681 841 HD22 ASN 104 HD22 ASN 104 24.360 3.269 15.130 842 H LEU 105 H LEU 105 22.252 2.836 9.204 843 HA LEU 105 HA LEU 105 19.756 1.268 8.790 844 HB2 LEU 105 HB2 LEU 105 19.876 3.921 8.539 845 HB3 LEU 105 HB3 LEU 105 20.569 3.527 6.992 846 HG LEU 105 HG LEU 105 18.236 3.903 6.692 847 HD11 LEU 105 HD11 LEU 105 18.462 0.871 6.736 848 HD12 LEU 105 HD12 LEU 105 17.410 1.861 5.720 849 HD13 LEU 105 HD13 LEU 105 19.164 1.899 5.468 850 HD21 LEU 105 HD21 LEU 105 17.554 3.693 8.994 851 HD22 LEU 105 HD22 LEU 105 16.494 2.743 7.954 852 HD23 LEU 105 HD23 LEU 105 17.733 1.940 8.954 853 H ASP 106 H ASP 106 22.654 2.443 6.863 854 HA ASP 106 HA ASP 106 23.000 0.224 5.139 855 HB2 ASP 106 HB2 ASP 106 24.396 2.142 4.920 856 HB3 ASP 106 HB3 ASP 106 24.798 2.149 6.630 857 H ARG 107 H ARG 107 23.687 0.638 8.575 858 HA ARG 107 HA ARG 107 25.249 -1.764 8.759 859 HB2 ARG 107 HB2 ARG 107 23.994 -0.175 11.030 860 HB3 ARG 107 HB3 ARG 107 25.304 -1.367 11.175 861 HG2 ARG 107 HG2 ARG 107 26.571 -0.010 9.412 862 HG3 ARG 107 HG3 ARG 107 25.418 1.279 9.678 863 HD2 ARG 107 HD2 ARG 107 26.241 1.675 11.874 864 HD3 ARG 107 HD3 ARG 107 27.194 0.164 11.872 865 HE ARG 107 HE ARG 107 27.965 1.543 9.594 866 HH11 ARG 107 HH11 ARG 107 28.304 2.437 13.070 867 HH12 ARG 107 HH12 ARG 107 29.702 3.410 12.689 868 HH21 ARG 107 HH21 ARG 107 29.653 2.812 9.237 869 HH22 ARG 107 HH22 ARG 107 30.451 3.680 10.528 870 H ILE 108 H ILE 108 22.033 -1.520 8.144 871 HA ILE 108 HA ILE 108 21.378 -4.000 9.566 872 HB ILE 108 HB ILE 108 19.493 -1.672 9.055 873 HG12 ILE 108 HG12 ILE 108 21.114 -2.462 11.510 874 HG13 ILE 108 HG13 ILE 108 21.092 -0.905 10.690 875 HG21 ILE 108 HG21 ILE 108 18.471 -3.974 9.156 876 HG22 ILE 108 HG22 ILE 108 19.189 -4.168 10.777 877 HG23 ILE 108 HG23 ILE 108 17.948 -2.930 10.477 878 HD11 ILE 108 HD11 ILE 108 19.858 -0.626 12.712 879 HD12 ILE 108 HD12 ILE 108 18.656 -0.648 11.405 880 HD13 ILE 108 HD13 ILE 108 18.895 -2.078 12.438 881 H VAL 109 H VAL 109 20.901 -1.921 6.595 882 HA VAL 109 HA VAL 109 19.947 -4.300 5.128 883 HB VAL 109 HB VAL 109 19.586 -1.471 4.195 884 HG11 VAL 109 HG11 VAL 109 18.018 -4.049 3.826 885 HG12 VAL 109 HG12 VAL 109 17.529 -2.476 3.166 886 HG13 VAL 109 HG13 VAL 109 19.042 -3.210 2.645 887 HG21 VAL 109 HG21 VAL 109 18.567 -1.359 6.465 888 HG22 VAL 109 HG22 VAL 109 17.308 -1.351 5.226 889 HG23 VAL 109 HG23 VAL 109 17.632 -2.826 6.138 890 H LYS 110 H LYS 110 20.858 -4.627 3.036 891 HA LYS 110 HA LYS 110 23.630 -3.775 2.629 892 HB2 LYS 110 HB2 LYS 110 21.593 -5.400 1.118 893 HB3 LYS 110 HB3 LYS 110 23.138 -4.933 0.407 894 HG2 LYS 110 HG2 LYS 110 23.540 -6.031 3.099 895 HG3 LYS 110 HG3 LYS 110 22.666 -7.148 2.046 896 HD2 LYS 110 HD2 LYS 110 24.936 -7.706 1.797 897 HD3 LYS 110 HD3 LYS 110 24.480 -6.835 0.327 898 HE2 LYS 110 HE2 LYS 110 25.507 -4.751 1.209 899 HE3 LYS 110 HE3 LYS 110 25.887 -5.594 2.708 900 HZ1 LYS 110 HZ1 LYS 110 27.308 -7.098 1.237 901 HZ2 LYS 110 HZ2 LYS 110 27.096 -5.926 0.065 902 HZ3 LYS 110 HZ3 LYS 110 27.825 -5.577 1.470 903 H ILE 111 H ILE 111 24.370 -2.618 0.850 904 HA ILE 111 HA ILE 111 22.473 -0.748 -0.397 905 HB ILE 111 HB ILE 111 23.483 -0.066 1.928 906 HG12 ILE 111 HG12 ILE 111 24.048 2.268 0.200 907 HG13 ILE 111 HG13 ILE 111 22.501 1.520 -0.108 908 HG21 ILE 111 HG21 ILE 111 25.581 1.218 1.819 909 HG22 ILE 111 HG22 ILE 111 25.785 -0.515 1.601 910 HG23 ILE 111 HG23 ILE 111 25.871 0.593 0.187 911 HD11 ILE 111 HD11 ILE 111 23.534 2.410 2.640 912 HD12 ILE 111 HD12 ILE 111 22.250 3.192 1.700 913 HD13 ILE 111 HD13 ILE 111 22.025 1.542 2.378 914 H TYR 112 H TYR 112 23.347 0.209 -2.386 915 HA TYR 112 HA TYR 112 25.830 -0.941 -3.467 916 HB2 TYR 112 HB2 TYR 112 22.988 -1.312 -4.537 917 HB3 TYR 112 HB3 TYR 112 24.434 -1.641 -5.469 918 HD1 TYR 112 HD1 TYR 112 22.413 -2.827 -2.513 919 HD2 TYR 112 HD2 TYR 112 25.791 -3.535 -5.141 920 HE1 TYR 112 HE1 TYR 112 22.649 -5.191 -1.685 921 HE2 TYR 112 HE2 TYR 112 25.973 -5.859 -4.304 922 HH TYR 112 HH TYR 112 25.496 -7.092 -2.465 923 H ASP 113 H ASP 113 26.173 0.000 -5.705 924 HA ASP 113 HA ASP 113 25.618 2.919 -5.511 925 HB2 ASP 113 HB2 ASP 113 27.877 1.600 -6.412 926 HB3 ASP 113 HB3 ASP 113 27.093 1.926 -7.911 927 H THR 114 H THR 114 25.094 0.187 -7.727 928 HA THR 114 HA THR 114 23.043 1.742 -9.221 929 HB THR 114 HB THR 114 23.707 0.451 -11.164 930 HG1 THR 114 HG1 THR 114 25.976 -0.607 -10.031 931 HG21 THR 114 HG21 THR 114 26.188 1.641 -9.845 932 HG22 THR 114 HG22 THR 114 25.948 1.335 -11.579 933 HG23 THR 114 HG23 THR 114 24.947 2.535 -10.731 934 H ILE 115 H ILE 115 21.532 0.209 -10.342 935 HA ILE 115 HA ILE 115 20.422 -1.751 -8.427 936 HB ILE 115 HB ILE 115 19.769 -0.958 -11.272 937 HG12 ILE 115 HG12 ILE 115 18.876 0.414 -9.399 938 HG13 ILE 115 HG13 ILE 115 17.641 -0.318 -10.382 939 HG21 ILE 115 HG21 ILE 115 17.827 -2.625 -11.130 940 HG22 ILE 115 HG22 ILE 115 19.432 -3.332 -11.417 941 HG23 ILE 115 HG23 ILE 115 18.708 -3.400 -9.807 942 HD11 ILE 115 HD11 ILE 115 16.882 -1.717 -8.778 943 HD12 ILE 115 HD12 ILE 115 18.396 -1.859 -7.919 944 HD13 ILE 115 HD13 ILE 115 17.425 -0.389 -7.746 945 H SER 116 H SER 116 22.658 -1.809 -11.254 946 HA SER 116 HA SER 116 22.105 -4.590 -11.726 947 HB2 SER 116 HB2 SER 116 22.731 -3.036 -13.416 948 HB3 SER 116 HB3 SER 116 24.286 -2.710 -12.581 949 HG SER 116 HG SER 116 23.514 -4.857 -14.214 950 H GLU 117 H GLU 117 24.650 -2.803 -9.776 951 HA GLU 117 HA GLU 117 26.227 -5.126 -9.336 952 HB2 GLU 117 HB2 GLU 117 25.717 -2.452 -8.022 953 HB3 GLU 117 HB3 GLU 117 26.796 -3.631 -7.242 954 HG2 GLU 117 HG2 GLU 117 28.414 -3.509 -8.884 955 HG3 GLU 117 HG3 GLU 117 27.250 -3.029 -10.134 956 H ALA 118 H ALA 118 23.108 -4.086 -8.173 957 HA ALA 118 HA ALA 118 23.275 -5.608 -5.654 958 HB1 ALA 118 HB1 ALA 118 20.904 -4.082 -6.852 959 HB2 ALA 118 HB2 ALA 118 21.140 -4.671 -5.182 960 HB3 ALA 118 HB3 ALA 118 22.142 -3.343 -5.849 961 H MET 119 H MET 119 21.413 -5.433 -8.687 962 HA MET 119 HA MET 119 19.648 -7.328 -8.133 963 HB2 MET 119 HB2 MET 119 20.037 -5.573 -10.225 964 HB3 MET 119 HB3 MET 119 20.736 -6.946 -10.971 965 HG2 MET 119 HG2 MET 119 18.049 -7.309 -9.668 966 HG3 MET 119 HG3 MET 119 18.103 -6.184 -11.025 967 HE1 MET 119 HE1 MET 119 19.235 -6.963 -13.364 968 HE2 MET 119 HE2 MET 119 20.426 -8.166 -12.833 969 HE3 MET 119 HE3 MET 119 19.134 -8.637 -13.946 970 H GLU 120 H GLU 120 22.824 -7.853 -9.338 971 HA GLU 120 HA GLU 120 22.429 -10.776 -9.660 972 HB2 GLU 120 HB2 GLU 120 24.068 -10.536 -11.308 973 HB3 GLU 120 HB3 GLU 120 23.446 -8.954 -11.352 974 HG2 GLU 120 HG2 GLU 120 25.605 -8.352 -11.189 975 HG3 GLU 120 HG3 GLU 120 25.354 -8.521 -9.458 976 H GLU 121 H GLU 121 23.806 -8.511 -7.362 977 HA GLU 121 HA GLU 121 25.522 -10.588 -6.216 978 HB2 GLU 121 HB2 GLU 121 26.093 -8.170 -6.101 979 HB3 GLU 121 HB3 GLU 121 24.743 -7.875 -5.044 980 HG2 GLU 121 HG2 GLU 121 25.656 -9.116 -3.294 981 HG3 GLU 121 HG3 GLU 121 26.738 -10.058 -4.330 982 H VAL 122 H VAL 122 22.613 -8.786 -5.129 983 HA VAL 122 HA VAL 122 21.984 -9.787 -2.686 984 HB VAL 122 HB VAL 122 20.198 -9.205 -5.088 985 HG11 VAL 122 HG11 VAL 122 19.077 -10.241 -3.136 986 HG12 VAL 122 HG12 VAL 122 19.778 -8.945 -2.119 987 HG13 VAL 122 HG13 VAL 122 18.582 -8.566 -3.396 988 HG21 VAL 122 HG21 VAL 122 22.072 -7.468 -4.086 989 HG22 VAL 122 HG22 VAL 122 20.578 -7.103 -4.911 990 HG23 VAL 122 HG23 VAL 122 20.679 -7.057 -3.110 991 H ARG 123 H ARG 123 21.442 -11.185 -5.787 992 HA ARG 123 HA ARG 123 19.914 -13.535 -5.344 993 HB2 ARG 123 HB2 ARG 123 22.267 -12.953 -7.142 994 HB3 ARG 123 HB3 ARG 123 21.231 -14.351 -7.408 995 HG2 ARG 123 HG2 ARG 123 19.922 -11.662 -7.246 996 HG3 ARG 123 HG3 ARG 123 21.013 -11.939 -8.590 997 HD2 ARG 123 HD2 ARG 123 18.498 -12.375 -8.957 998 HD3 ARG 123 HD3 ARG 123 19.685 -13.542 -9.550 999 HE ARG 123 HE ARG 123 18.746 -14.143 -6.882 1000 HH11 ARG 123 HH11 ARG 123 18.184 -14.529 -10.336 1001 HH12 ARG 123 HH12 ARG 123 17.359 -16.031 -10.246 1002 HH21 ARG 123 HH21 ARG 123 17.471 -16.170 -6.669 1003 HH22 ARG 123 HH22 ARG 123 16.866 -16.916 -8.107 1004 H ARG 124 H ARG 124 23.237 -12.971 -4.490 1005 HA ARG 124 HA ARG 124 23.377 -15.351 -2.864 1006 HB2 ARG 124 HB2 ARG 124 25.415 -16.255 -3.973 1007 HB3 ARG 124 HB3 ARG 124 24.035 -16.335 -5.043 1008 HG2 ARG 124 HG2 ARG 124 25.810 -13.880 -5.172 1009 HG3 ARG 124 HG3 ARG 124 26.424 -15.393 -5.802 1010 HD2 ARG 124 HD2 ARG 124 23.858 -15.186 -6.924 1011 HD3 ARG 124 HD3 ARG 124 24.413 -13.538 -6.916 1012 HE ARG 124 HE ARG 124 26.505 -14.420 -8.067 1013 HH11 ARG 124 HH11 ARG 124 23.341 -16.101 -8.558 1014 HH12 ARG 124 HH12 ARG 124 23.584 -16.081 -10.283 1015 HH21 ARG 124 HH21 ARG 124 26.789 -14.698 -10.206 1016 HH22 ARG 124 HH22 ARG 124 25.621 -15.523 -11.217 1017 H LYS 125 H LYS 125 23.448 -12.588 -2.198 1018 HA LYS 125 HA LYS 125 26.037 -11.540 -1.995 1019 HB2 LYS 125 HB2 LYS 125 25.028 -9.835 -0.592 1020 HB3 LYS 125 HB3 LYS 125 23.869 -10.327 -1.794 1021 HG2 LYS 125 HG2 LYS 125 22.551 -10.308 0.094 1022 HG3 LYS 125 HG3 LYS 125 23.013 -12.009 0.045 1023 HD2 LYS 125 HD2 LYS 125 25.094 -10.777 1.520 1024 HD3 LYS 125 HD3 LYS 125 23.660 -9.898 2.025 1025 HE2 LYS 125 HE2 LYS 125 22.572 -12.017 2.699 1026 HE3 LYS 125 HE3 LYS 125 23.908 -12.937 2.013 1027 HZ1 LYS 125 HZ1 LYS 125 24.189 -11.049 4.266 1028 HZ2 LYS 125 HZ2 LYS 125 24.167 -12.724 4.360 1029 HZ3 LYS 125 HZ3 LYS 125 25.379 -11.939 3.570 Start of MODEL 19 1 H1 MET 1 H1 MET 1 -4.001 21.156 11.550 2 HA MET 1 HA MET 1 -4.950 19.210 10.334 3 HB2 MET 1 HB2 MET 1 -2.780 20.884 9.065 4 HB3 MET 1 HB3 MET 1 -3.597 19.616 8.148 5 HG2 MET 1 HG2 MET 1 -4.650 21.821 7.828 6 HG3 MET 1 HG3 MET 1 -5.752 20.606 8.461 7 HE1 MET 1 HE1 MET 1 -7.068 24.056 9.875 8 HE2 MET 1 HE2 MET 1 -6.124 23.910 8.379 9 HE3 MET 1 HE3 MET 1 -7.385 22.710 8.752 10 H GLY 2 H GLY 2 -4.558 17.085 9.464 11 HA2 GLY 2 HA2 GLY 2 -3.396 15.206 8.940 12 HA3 GLY 2 HA3 GLY 2 -1.887 16.076 9.179 13 H SER 3 H SER 3 -4.420 14.162 10.748 14 HA SER 3 HA SER 3 -2.536 13.220 12.761 15 HB2 SER 3 HB2 SER 3 -3.546 15.344 13.713 16 HB3 SER 3 HB3 SER 3 -5.132 14.588 13.586 17 HG SER 3 HG SER 3 -2.981 14.115 15.295 18 H ASP 4 H ASP 4 -2.763 11.120 12.036 19 HA ASP 4 HA ASP 4 -5.376 10.215 11.023 20 HB2 ASP 4 HB2 ASP 4 -4.161 8.926 9.535 21 HB3 ASP 4 HB3 ASP 4 -3.089 10.308 9.696 22 H LYS 5 H LYS 5 -5.461 7.701 11.140 23 HA LYS 5 HA LYS 5 -4.144 5.874 12.341 24 HB2 LYS 5 HB2 LYS 5 -5.454 7.312 14.633 25 HB3 LYS 5 HB3 LYS 5 -5.625 5.590 14.644 26 HG2 LYS 5 HG2 LYS 5 -3.265 5.180 14.564 27 HG3 LYS 5 HG3 LYS 5 -2.899 6.871 14.275 28 HD2 LYS 5 HD2 LYS 5 -4.485 6.560 16.739 29 HD3 LYS 5 HD3 LYS 5 -3.101 5.480 16.764 30 HE2 LYS 5 HE2 LYS 5 -2.616 7.677 17.806 31 HE3 LYS 5 HE3 LYS 5 -1.540 7.290 16.466 32 HZ1 LYS 5 HZ1 LYS 5 -2.279 9.560 16.388 33 HZ2 LYS 5 HZ2 LYS 5 -2.824 8.783 15.062 34 HZ3 LYS 5 HZ3 LYS 5 -3.867 9.101 16.277 35 H ILE 6 H ILE 6 -5.130 3.901 12.206 36 HA ILE 6 HA ILE 6 -6.500 2.389 11.311 37 HB ILE 6 HB ILE 6 -8.396 3.613 13.340 38 HG12 ILE 6 HG12 ILE 6 -7.650 1.335 14.477 39 HG13 ILE 6 HG13 ILE 6 -6.294 1.396 13.391 40 HG21 ILE 6 HG21 ILE 6 -9.555 1.421 13.277 41 HG22 ILE 6 HG22 ILE 6 -9.692 2.259 11.747 42 HG23 ILE 6 HG23 ILE 6 -8.534 0.918 11.912 43 HD11 ILE 6 HD11 ILE 6 -5.993 2.324 15.767 44 HD12 ILE 6 HD12 ILE 6 -5.439 3.370 14.465 45 HD13 ILE 6 HD13 ILE 6 -6.999 3.692 15.272 46 H HIS 7 H HIS 7 -6.662 2.706 9.173 47 HA HIS 7 HA HIS 7 -9.171 3.609 8.187 48 HB2 HIS 7 HB2 HIS 7 -8.290 5.284 6.623 49 HB3 HIS 7 HB3 HIS 7 -8.136 5.772 8.292 50 HD1 HIS 7 HD1 HIS 7 -6.388 7.403 6.621 51 HD2 HIS 7 HD2 HIS 7 -5.220 3.538 7.827 52 HE1 HIS 7 HE1 HIS 7 -3.826 7.362 6.576 53 H HIS 8 H HIS 8 -9.067 3.490 5.631 54 HA HIS 8 HA HIS 8 -7.028 1.820 4.509 55 HB2 HIS 8 HB2 HIS 8 -8.588 0.053 3.729 56 HB3 HIS 8 HB3 HIS 8 -8.394 0.068 5.467 57 HD1 HIS 8 HD1 HIS 8 -11.158 0.327 2.838 58 HD2 HIS 8 HD2 HIS 8 -10.492 0.946 6.958 59 HE1 HIS 8 HE1 HIS 8 -13.421 0.582 3.890 60 H HIS 9 H HIS 9 -7.778 1.404 2.115 61 HA HIS 9 HA HIS 9 -8.591 2.011 0.129 62 HB2 HIS 9 HB2 HIS 9 -10.710 1.868 1.623 63 HB3 HIS 9 HB3 HIS 9 -10.792 3.605 1.430 64 HD1 HIS 9 HD1 HIS 9 -13.050 1.669 0.381 65 HD2 HIS 9 HD2 HIS 9 -9.792 3.072 -1.915 66 HE1 HIS 9 HE1 HIS 9 -13.705 1.400 -2.053 67 H HIS 10 H HIS 10 -6.661 3.895 1.578 68 HA HIS 10 HA HIS 10 -6.658 5.713 -0.758 69 HB2 HIS 10 HB2 HIS 10 -6.060 6.504 2.108 70 HB3 HIS 10 HB3 HIS 10 -5.277 7.274 0.771 71 HD1 HIS 10 HD1 HIS 10 -6.389 9.424 -0.127 72 HD2 HIS 10 HD2 HIS 10 -8.846 6.633 1.776 73 HE1 HIS 10 HE1 HIS 10 -8.676 10.514 -0.017 74 H HIS 11 H HIS 11 -5.251 4.492 -1.928 75 HA HIS 11 HA HIS 11 -2.510 4.190 -1.050 76 HB2 HIS 11 HB2 HIS 11 -2.433 1.743 -1.540 77 HB3 HIS 11 HB3 HIS 11 -3.200 2.182 -0.028 78 HD1 HIS 11 HD1 HIS 11 -3.829 0.133 -3.023 79 HD2 HIS 11 HD2 HIS 11 -6.000 2.055 0.011 80 HE1 HIS 11 HE1 HIS 11 -6.231 -0.760 -3.183 81 H HIS 12 H HIS 12 -1.465 4.953 -2.788 82 HA HIS 12 HA HIS 12 -2.039 4.233 -5.484 83 HB2 HIS 12 HB2 HIS 12 -2.923 6.200 -6.347 84 HB3 HIS 12 HB3 HIS 12 -3.887 5.988 -4.903 85 HD1 HIS 12 HD1 HIS 12 -1.303 7.455 -3.084 86 HD2 HIS 12 HD2 HIS 12 -3.439 8.763 -6.476 87 HE1 HIS 12 HE1 HIS 12 -1.001 9.962 -3.192 88 H MET 13 H MET 13 -0.635 5.821 -6.942 89 HA MET 13 HA MET 13 1.353 6.727 -7.504 90 HB2 MET 13 HB2 MET 13 0.892 8.010 -4.822 91 HB3 MET 13 HB3 MET 13 2.487 8.160 -5.537 92 HG2 MET 13 HG2 MET 13 0.028 8.850 -7.146 93 HG3 MET 13 HG3 MET 13 0.732 9.987 -5.993 94 HE1 MET 13 HE1 MET 13 1.040 11.783 -7.852 95 HE2 MET 13 HE2 MET 13 1.945 11.528 -9.363 96 HE3 MET 13 HE3 MET 13 0.404 10.689 -9.100 97 H PHE 14 H PHE 14 1.900 4.471 -7.638 98 HA PHE 14 HA PHE 14 3.887 3.572 -5.596 99 HB2 PHE 14 HB2 PHE 14 2.509 1.905 -7.706 100 HB3 PHE 14 HB3 PHE 14 3.424 1.361 -6.308 101 HD1 PHE 14 HD1 PHE 14 2.266 2.687 -3.994 102 HD2 PHE 14 HD2 PHE 14 0.336 1.208 -7.562 103 HE1 PHE 14 HE1 PHE 14 0.145 2.427 -2.752 104 HE2 PHE 14 HE2 PHE 14 -1.802 1.011 -6.326 105 HZ PHE 14 HZ PHE 14 -1.909 1.626 -3.931 106 HA PRO 15 HA PRO 15 6.400 4.636 -9.351 107 HB2 PRO 15 HB2 PRO 15 8.458 5.932 -8.191 108 HB3 PRO 15 HB3 PRO 15 6.859 6.701 -8.362 109 HG2 PRO 15 HG2 PRO 15 7.979 5.331 -5.885 110 HG3 PRO 15 HG3 PRO 15 7.166 6.913 -5.995 111 HD2 PRO 15 HD2 PRO 15 5.863 4.596 -5.310 112 HD3 PRO 15 HD3 PRO 15 5.082 5.961 -6.169 113 H TYR 16 H TYR 16 6.934 2.430 -9.860 114 HA TYR 16 HA TYR 16 9.474 1.546 -8.700 115 HB2 TYR 16 HB2 TYR 16 8.653 -0.507 -7.784 116 HB3 TYR 16 HB3 TYR 16 7.722 0.777 -7.124 117 HD1 TYR 16 HD1 TYR 16 7.664 -2.124 -9.368 118 HD2 TYR 16 HD2 TYR 16 5.400 0.970 -7.512 119 HE1 TYR 16 HE1 TYR 16 5.561 -3.343 -9.939 120 HE2 TYR 16 HE2 TYR 16 3.249 -0.278 -8.013 121 HH TYR 16 HH TYR 16 2.398 -2.447 -8.613 122 H LYS 17 H LYS 17 9.939 -0.898 -9.717 123 HA LYS 17 HA LYS 17 8.965 -1.137 -12.458 124 HB2 LYS 17 HB2 LYS 17 11.413 0.095 -12.034 125 HB3 LYS 17 HB3 LYS 17 11.838 -1.611 -11.777 126 HG2 LYS 17 HG2 LYS 17 10.626 -1.962 -14.042 127 HG3 LYS 17 HG3 LYS 17 11.032 -0.259 -14.293 128 HD2 LYS 17 HD2 LYS 17 13.158 -0.934 -14.899 129 HD3 LYS 17 HD3 LYS 17 13.404 -1.580 -13.257 130 HE2 LYS 17 HE2 LYS 17 13.767 -3.360 -14.669 131 HE3 LYS 17 HE3 LYS 17 12.204 -3.605 -13.844 132 HZ1 LYS 17 HZ1 LYS 17 12.566 -2.690 -16.656 133 HZ2 LYS 17 HZ2 LYS 17 12.205 -4.206 -16.218 134 HZ3 LYS 17 HZ3 LYS 17 11.115 -3.010 -15.948 135 H ILE 18 H ILE 18 9.509 -3.384 -13.170 136 HA ILE 18 HA ILE 18 10.202 -5.321 -11.020 137 HB ILE 18 HB ILE 18 8.114 -5.670 -13.197 138 HG12 ILE 18 HG12 ILE 18 7.346 -5.641 -10.269 139 HG13 ILE 18 HG13 ILE 18 7.432 -4.121 -11.146 140 HG21 ILE 18 HG21 ILE 18 9.260 -7.739 -12.520 141 HG22 ILE 18 HG22 ILE 18 8.849 -7.451 -10.825 142 HG23 ILE 18 HG23 ILE 18 7.580 -7.787 -12.026 143 HD11 ILE 18 HD11 ILE 18 5.764 -6.461 -12.101 144 HD12 ILE 18 HD12 ILE 18 5.141 -5.101 -11.175 145 HD13 ILE 18 HD13 ILE 18 5.823 -4.832 -12.791 146 H VAL 19 H VAL 19 12.054 -6.347 -11.661 147 HA VAL 19 HA VAL 19 12.810 -6.513 -14.511 148 HB VAL 19 HB VAL 19 15.049 -7.226 -13.492 149 HG11 VAL 19 HG11 VAL 19 14.246 -4.372 -12.908 150 HG12 VAL 19 HG12 VAL 19 15.886 -4.992 -13.045 151 HG13 VAL 19 HG13 VAL 19 14.843 -5.023 -14.467 152 HG21 VAL 19 HG21 VAL 19 14.291 -7.708 -11.213 153 HG22 VAL 19 HG22 VAL 19 15.600 -6.508 -11.248 154 HG23 VAL 19 HG23 VAL 19 13.934 -5.974 -10.998 155 H ASP 20 H ASP 20 14.353 -8.790 -14.258 156 HA ASP 20 HA ASP 20 13.228 -11.059 -14.708 157 HB2 ASP 20 HB2 ASP 20 15.520 -10.431 -12.830 158 HB3 ASP 20 HB3 ASP 20 14.986 -12.100 -13.017 159 H ASP 21 H ASP 21 13.938 -10.558 -11.237 160 HA ASP 21 HA ASP 21 11.234 -11.504 -10.476 161 HB2 ASP 21 HB2 ASP 21 13.746 -12.822 -9.407 162 HB3 ASP 21 HB3 ASP 21 12.046 -13.196 -9.050 163 H VAL 22 H VAL 22 12.833 -8.934 -10.237 164 HA VAL 22 HA VAL 22 12.735 -8.660 -7.291 165 HB VAL 22 HB VAL 22 14.945 -7.366 -8.953 166 HG11 VAL 22 HG11 VAL 22 14.138 -7.303 -6.071 167 HG12 VAL 22 HG12 VAL 22 15.831 -7.186 -6.476 168 HG13 VAL 22 HG13 VAL 22 14.691 -5.997 -7.121 169 HG21 VAL 22 HG21 VAL 22 15.029 -9.905 -7.274 170 HG22 VAL 22 HG22 VAL 22 15.465 -9.696 -8.976 171 HG23 VAL 22 HG23 VAL 22 16.476 -8.969 -7.738 172 H VAL 23 H VAL 23 12.235 -6.494 -6.636 173 HA VAL 23 HA VAL 23 10.829 -4.906 -8.713 174 HB VAL 23 HB VAL 23 10.232 -5.317 -5.773 175 HG11 VAL 23 HG11 VAL 23 8.256 -3.993 -6.127 176 HG12 VAL 23 HG12 VAL 23 9.655 -3.031 -6.585 177 HG13 VAL 23 HG13 VAL 23 8.635 -3.768 -7.847 178 HG21 VAL 23 HG21 VAL 23 8.736 -6.286 -8.248 179 HG22 VAL 23 HG22 VAL 23 9.624 -7.306 -7.097 180 HG23 VAL 23 HG23 VAL 23 8.189 -6.456 -6.568 181 H ILE 24 H ILE 24 11.475 -2.870 -8.928 182 HA ILE 24 HA ILE 24 13.669 -1.803 -7.197 183 HB ILE 24 HB ILE 24 12.868 -1.237 -10.080 184 HG12 ILE 24 HG12 ILE 24 15.335 -1.789 -10.488 185 HG13 ILE 24 HG13 ILE 24 15.314 -2.475 -8.833 186 HG21 ILE 24 HG21 ILE 24 14.884 0.346 -10.022 187 HG22 ILE 24 HG22 ILE 24 13.384 0.861 -9.271 188 HG23 ILE 24 HG23 ILE 24 14.695 0.271 -8.246 189 HD11 ILE 24 HD11 ILE 24 13.519 -3.383 -11.067 190 HD12 ILE 24 HD12 ILE 24 15.176 -4.010 -10.722 191 HD13 ILE 24 HD13 ILE 24 13.905 -4.216 -9.517 192 H LEU 25 H LEU 25 12.647 -0.600 -5.632 193 HA LEU 25 HA LEU 25 10.122 0.857 -6.256 194 HB2 LEU 25 HB2 LEU 25 11.723 0.494 -3.669 195 HB3 LEU 25 HB3 LEU 25 10.110 1.181 -3.807 196 HG LEU 25 HG LEU 25 10.842 -1.712 -4.526 197 HD11 LEU 25 HD11 LEU 25 11.004 -1.210 -2.082 198 HD12 LEU 25 HD12 LEU 25 9.251 -0.908 -2.100 199 HD13 LEU 25 HD13 LEU 25 9.897 -2.506 -2.596 200 HD21 LEU 25 HD21 LEU 25 8.478 -2.173 -4.544 201 HD22 LEU 25 HD22 LEU 25 8.094 -0.490 -4.144 202 HD23 LEU 25 HD23 LEU 25 8.821 -0.900 -5.706 203 H MET 26 H MET 26 10.421 3.137 -6.681 204 HA MET 26 HA MET 26 13.171 4.267 -6.323 205 HB2 MET 26 HB2 MET 26 11.336 4.334 -8.716 206 HB3 MET 26 HB3 MET 26 12.483 5.650 -8.419 207 HG2 MET 26 HG2 MET 26 14.361 4.215 -8.436 208 HG3 MET 26 HG3 MET 26 13.367 2.770 -8.398 209 HE1 MET 26 HE1 MET 26 11.170 3.672 -10.900 210 HE2 MET 26 HE2 MET 26 11.972 2.590 -12.061 211 HE3 MET 26 HE3 MET 26 11.757 2.076 -10.374 212 HA PRO 27 HA PRO 27 10.024 6.836 -4.105 213 HB2 PRO 27 HB2 PRO 27 11.700 8.023 -2.306 214 HB3 PRO 27 HB3 PRO 27 11.105 6.336 -2.085 215 HG2 PRO 27 HG2 PRO 27 13.717 7.250 -3.367 216 HG3 PRO 27 HG3 PRO 27 13.525 6.098 -2.023 217 HD2 PRO 27 HD2 PRO 27 13.742 5.242 -4.573 218 HD3 PRO 27 HD3 PRO 27 12.530 4.453 -3.535 219 H ASN 28 H ASN 28 9.809 9.138 -3.889 220 HA ASN 28 HA ASN 28 11.680 10.830 -5.436 221 HB2 ASN 28 HB2 ASN 28 9.878 11.456 -7.073 222 HB3 ASN 28 HB3 ASN 28 10.594 9.889 -7.221 223 HD21 ASN 28 HD21 ASN 28 7.438 11.275 -5.773 224 HD22 ASN 28 HD22 ASN 28 6.667 9.732 -6.128 225 H LYS 29 H LYS 29 8.285 11.050 -4.448 226 HA LYS 29 HA LYS 29 8.811 13.271 -2.631 227 HB2 LYS 29 HB2 LYS 29 7.191 14.814 -3.688 228 HB3 LYS 29 HB3 LYS 29 8.721 14.637 -4.511 229 HG2 LYS 29 HG2 LYS 29 6.479 12.874 -5.443 230 HG3 LYS 29 HG3 LYS 29 6.310 14.592 -5.747 231 HD2 LYS 29 HD2 LYS 29 8.162 14.739 -7.164 232 HD3 LYS 29 HD3 LYS 29 8.906 13.279 -6.519 233 HE2 LYS 29 HE2 LYS 29 6.852 12.032 -7.395 234 HE3 LYS 29 HE3 LYS 29 6.437 13.491 -8.292 235 HZ1 LYS 29 HZ1 LYS 29 7.620 11.993 -9.701 236 HZ2 LYS 29 HZ2 LYS 29 8.641 13.279 -9.402 237 HZ3 LYS 29 HZ3 LYS 29 8.886 11.825 -8.723 238 H GLU 30 H GLU 30 7.436 10.487 -3.066 239 HA GLU 30 HA GLU 30 4.732 10.753 -2.076 240 HB2 GLU 30 HB2 GLU 30 4.866 8.286 -2.231 241 HB3 GLU 30 HB3 GLU 30 5.456 9.028 -3.727 242 HG2 GLU 30 HG2 GLU 30 7.779 8.781 -3.005 243 HG3 GLU 30 HG3 GLU 30 7.295 8.184 -1.444 244 H LEU 31 H LEU 31 7.680 11.154 -0.538 245 HA LEU 31 HA LEU 31 7.203 9.253 1.679 246 HB2 LEU 31 HB2 LEU 31 9.679 10.835 0.878 247 HB3 LEU 31 HB3 LEU 31 9.538 9.688 2.191 248 HG LEU 31 HG LEU 31 9.405 9.033 -0.764 249 HD11 LEU 31 HD11 LEU 31 11.661 9.507 0.014 250 HD12 LEU 31 HD12 LEU 31 11.432 8.487 1.436 251 HD13 LEU 31 HD13 LEU 31 11.511 7.746 -0.145 252 HD21 LEU 31 HD21 LEU 31 7.916 7.471 0.557 253 HD22 LEU 31 HD22 LEU 31 9.314 6.694 -0.161 254 HD23 LEU 31 HD23 LEU 31 9.317 7.076 1.583 255 H ASN 32 H ASN 32 5.764 10.317 3.013 256 HA ASN 32 HA ASN 32 6.372 12.944 4.147 257 HB2 ASN 32 HB2 ASN 32 4.340 14.016 3.112 258 HB3 ASN 32 HB3 ASN 32 5.727 13.780 2.079 259 HD21 ASN 32 HD21 ASN 32 5.177 13.094 0.039 260 HD22 ASN 32 HD22 ASN 32 4.090 11.750 -0.193 261 H ILE 33 H ILE 33 5.680 10.253 5.110 262 HA ILE 33 HA ILE 33 4.720 9.339 6.887 263 HB ILE 33 HB ILE 33 4.553 12.077 7.503 264 HG12 ILE 33 HG12 ILE 33 5.729 10.194 8.681 265 HG13 ILE 33 HG13 ILE 33 4.999 11.444 9.675 266 HG21 ILE 33 HG21 ILE 33 2.661 12.192 9.076 267 HG22 ILE 33 HG22 ILE 33 2.147 12.162 7.383 268 HG23 ILE 33 HG23 ILE 33 2.000 10.699 8.398 269 HD11 ILE 33 HD11 ILE 33 4.663 9.145 10.583 270 HD12 ILE 33 HD12 ILE 33 3.153 10.009 10.317 271 HD13 ILE 33 HD13 ILE 33 3.650 8.764 9.160 272 H GLU 34 H GLU 34 2.324 11.216 5.077 273 HA GLU 34 HA GLU 34 0.039 9.705 5.774 274 HB2 GLU 34 HB2 GLU 34 0.635 11.373 3.297 275 HB3 GLU 34 HB3 GLU 34 -0.973 10.876 3.841 276 HG2 GLU 34 HG2 GLU 34 -0.466 12.064 6.050 277 HG3 GLU 34 HG3 GLU 34 0.947 12.777 5.252 278 H ASN 35 H ASN 35 2.561 8.732 3.912 279 HA ASN 35 HA ASN 35 1.062 6.508 2.532 280 HB2 ASN 35 HB2 ASN 35 1.732 8.152 0.887 281 HB3 ASN 35 HB3 ASN 35 3.339 8.256 1.603 282 HD21 ASN 35 HD21 ASN 35 4.640 7.544 -0.027 283 HD22 ASN 35 HD22 ASN 35 4.458 5.960 -0.826 284 H ALA 36 H ALA 36 3.043 7.223 5.131 285 HA ALA 36 HA ALA 36 5.227 5.347 4.618 286 HB1 ALA 36 HB1 ALA 36 5.499 7.443 6.000 287 HB2 ALA 36 HB2 ALA 36 4.378 6.771 7.189 288 HB3 ALA 36 HB3 ALA 36 5.942 5.990 6.885 289 H HIS 37 H HIS 37 2.501 5.405 7.065 290 HA HIS 37 HA HIS 37 3.168 2.739 7.879 291 HB2 HIS 37 HB2 HIS 37 1.634 4.657 8.995 292 HB3 HIS 37 HB3 HIS 37 0.356 3.747 8.192 293 HD1 HIS 37 HD1 HIS 37 -0.697 2.605 10.340 294 HD2 HIS 37 HD2 HIS 37 3.491 2.270 10.016 295 HE1 HIS 37 HE1 HIS 37 0.054 0.970 12.158 296 H LEU 38 H LEU 38 1.338 3.976 5.233 297 HA LEU 38 HA LEU 38 -0.126 1.560 4.569 298 HB2 LEU 38 HB2 LEU 38 0.425 4.036 2.865 299 HB3 LEU 38 HB3 LEU 38 -0.785 2.791 2.611 300 HG LEU 38 HG LEU 38 -1.923 4.656 3.424 301 HD11 LEU 38 HD11 LEU 38 -3.042 3.829 5.344 302 HD12 LEU 38 HD12 LEU 38 -2.553 2.446 4.361 303 HD13 LEU 38 HD13 LEU 38 -1.639 2.848 5.833 304 HD21 LEU 38 HD21 LEU 38 0.065 5.829 4.454 305 HD22 LEU 38 HD22 LEU 38 -1.484 5.989 5.291 306 HD23 LEU 38 HD23 LEU 38 -0.274 4.910 5.951 307 H PHE 39 H PHE 39 2.801 3.219 3.485 308 HA PHE 39 HA PHE 39 3.691 2.009 1.304 309 HB2 PHE 39 HB2 PHE 39 4.912 3.463 3.248 310 HB3 PHE 39 HB3 PHE 39 5.595 1.945 3.661 311 HD1 PHE 39 HD1 PHE 39 4.872 3.836 0.475 312 HD2 PHE 39 HD2 PHE 39 7.758 1.722 2.924 313 HE1 PHE 39 HE1 PHE 39 6.648 4.766 -0.903 314 HE2 PHE 39 HE2 PHE 39 9.562 2.564 1.461 315 HZ PHE 39 HZ PHE 39 9.023 4.169 -0.423 316 H LYS 40 H LYS 40 4.102 0.602 4.529 317 HA LYS 40 HA LYS 40 5.283 -1.833 3.647 318 HB2 LYS 40 HB2 LYS 40 5.576 -0.930 5.886 319 HB3 LYS 40 HB3 LYS 40 3.861 -1.105 6.252 320 HG2 LYS 40 HG2 LYS 40 5.226 -3.582 5.322 321 HG3 LYS 40 HG3 LYS 40 5.869 -2.953 6.828 322 HD2 LYS 40 HD2 LYS 40 2.860 -3.220 6.512 323 HD3 LYS 40 HD3 LYS 40 3.827 -4.645 6.869 324 HE2 LYS 40 HE2 LYS 40 4.765 -3.665 8.869 325 HE3 LYS 40 HE3 LYS 40 4.020 -2.106 8.507 326 HZ1 LYS 40 HZ1 LYS 40 2.563 -4.593 9.137 327 HZ2 LYS 40 HZ2 LYS 40 2.764 -3.288 10.122 328 HZ3 LYS 40 HZ3 LYS 40 1.853 -3.147 8.747 329 H LYS 41 H LYS 41 1.843 -0.960 4.232 330 HA LYS 41 HA LYS 41 0.809 -3.585 3.762 331 HB2 LYS 41 HB2 LYS 41 -0.255 -1.063 4.484 332 HB3 LYS 41 HB3 LYS 41 -0.931 -1.340 2.894 333 HG2 LYS 41 HG2 LYS 41 -1.037 -3.352 5.187 334 HG3 LYS 41 HG3 LYS 41 -2.315 -2.197 4.845 335 HD2 LYS 41 HD2 LYS 41 -1.375 -4.219 2.768 336 HD3 LYS 41 HD3 LYS 41 -2.632 -4.580 3.946 337 HE2 LYS 41 HE2 LYS 41 -4.147 -3.053 3.085 338 HE3 LYS 41 HE3 LYS 41 -2.911 -2.058 2.311 339 HZ1 LYS 41 HZ1 LYS 41 -3.378 -4.795 1.345 340 HZ2 LYS 41 HZ2 LYS 41 -4.340 -3.533 0.854 341 HZ3 LYS 41 HZ3 LYS 41 -2.733 -3.495 0.565 342 H TRP 42 H TRP 42 1.358 -0.785 1.545 343 HA TRP 42 HA TRP 42 0.491 -2.102 -0.811 344 HB2 TRP 42 HB2 TRP 42 0.678 0.182 -1.074 345 HB3 TRP 42 HB3 TRP 42 2.221 0.270 -0.240 346 HD1 TRP 42 HD1 TRP 42 1.133 -1.496 -3.567 347 HE1 TRP 42 HE1 TRP 42 2.960 -1.121 -5.292 348 HE3 TRP 42 HE3 TRP 42 4.268 1.391 -0.769 349 HZ2 TRP 42 HZ2 TRP 42 5.631 0.153 -5.383 350 HZ3 TRP 42 HZ3 TRP 42 6.387 2.131 -1.618 351 HH2 TRP 42 HH2 TRP 42 7.108 1.536 -4.030 352 H VAL 43 H VAL 43 3.996 -1.607 0.112 353 HA VAL 43 HA VAL 43 5.027 -3.356 -1.714 354 HB VAL 43 HB VAL 43 5.915 -2.720 1.125 355 HG11 VAL 43 HG11 VAL 43 7.622 -4.028 -1.030 356 HG12 VAL 43 HG12 VAL 43 8.172 -3.387 0.531 357 HG13 VAL 43 HG13 VAL 43 7.094 -4.784 0.495 358 HG21 VAL 43 HG21 VAL 43 5.839 -0.777 -0.368 359 HG22 VAL 43 HG22 VAL 43 7.519 -1.201 -0.075 360 HG23 VAL 43 HG23 VAL 43 6.752 -1.641 -1.614 361 H PHE 44 H PHE 44 3.497 -4.374 1.420 362 HA PHE 44 HA PHE 44 4.210 -7.088 1.270 363 HB2 PHE 44 HB2 PHE 44 2.061 -5.464 2.620 364 HB3 PHE 44 HB3 PHE 44 1.906 -7.178 2.557 365 HD1 PHE 44 HD1 PHE 44 5.233 -5.443 3.001 366 HD2 PHE 44 HD2 PHE 44 1.974 -7.577 4.889 367 HE1 PHE 44 HE1 PHE 44 6.577 -5.721 5.054 368 HE2 PHE 44 HE2 PHE 44 3.302 -7.719 6.964 369 HZ PHE 44 HZ PHE 44 5.558 -6.834 7.040 370 H ASP 45 H ASP 45 1.198 -5.446 0.341 371 HA ASP 45 HA ASP 45 0.062 -7.880 -0.771 372 HB2 ASP 45 HB2 ASP 45 -0.902 -5.138 -0.147 373 HB3 ASP 45 HB3 ASP 45 -1.681 -5.880 -1.525 374 H GLU 46 H GLU 46 1.907 -5.292 -2.182 375 HA GLU 46 HA GLU 46 1.052 -5.921 -4.901 376 HB2 GLU 46 HB2 GLU 46 1.624 -3.628 -3.911 377 HB3 GLU 46 HB3 GLU 46 3.309 -4.135 -3.930 378 HG2 GLU 46 HG2 GLU 46 3.095 -2.914 -5.896 379 HG3 GLU 46 HG3 GLU 46 2.912 -4.564 -6.484 380 H PHE 47 H PHE 47 3.834 -6.716 -2.760 381 HA PHE 47 HA PHE 47 5.021 -8.254 -5.014 382 HB2 PHE 47 HB2 PHE 47 6.671 -6.775 -2.965 383 HB3 PHE 47 HB3 PHE 47 7.162 -7.474 -4.505 384 HD1 PHE 47 HD1 PHE 47 5.598 -6.498 -6.579 385 HD2 PHE 47 HD2 PHE 47 6.550 -4.460 -2.915 386 HE1 PHE 47 HE1 PHE 47 5.255 -4.327 -7.699 387 HE2 PHE 47 HE2 PHE 47 6.115 -2.271 -4.011 388 HZ PHE 47 HZ PHE 47 5.535 -2.198 -6.419 389 H LEU 48 H LEU 48 5.249 -7.881 -1.425 390 HA LEU 48 HA LEU 48 6.678 -10.254 -1.091 391 HB2 LEU 48 HB2 LEU 48 4.755 -9.037 0.932 392 HB3 LEU 48 HB3 LEU 48 6.009 -10.225 1.288 393 HG LEU 48 HG LEU 48 6.373 -7.350 0.422 394 HD11 LEU 48 HD11 LEU 48 7.411 -6.986 2.538 395 HD12 LEU 48 HD12 LEU 48 6.007 -8.022 2.886 396 HD13 LEU 48 HD13 LEU 48 7.609 -8.737 2.825 397 HD21 LEU 48 HD21 LEU 48 8.529 -9.490 0.618 398 HD22 LEU 48 HD22 LEU 48 8.085 -8.549 -0.814 399 HD23 LEU 48 HD23 LEU 48 8.839 -7.736 0.563 400 H ASN 49 H ASN 49 3.160 -9.901 -0.817 401 HA ASN 49 HA ASN 49 2.641 -12.702 -0.229 402 HB2 ASN 49 HB2 ASN 49 0.731 -10.617 -1.404 403 HB3 ASN 49 HB3 ASN 49 0.302 -12.247 -0.987 404 HD21 ASN 49 HD21 ASN 49 1.519 -9.179 0.475 405 HD22 ASN 49 HD22 ASN 49 0.967 -9.630 2.104 406 H LYS 50 H LYS 50 2.811 -10.797 -3.268 407 HA LYS 50 HA LYS 50 2.257 -12.779 -5.153 408 HB2 LYS 50 HB2 LYS 50 3.465 -10.041 -4.964 409 HB3 LYS 50 HB3 LYS 50 4.129 -10.993 -6.264 410 HG2 LYS 50 HG2 LYS 50 2.421 -9.948 -7.241 411 HG3 LYS 50 HG3 LYS 50 1.690 -11.532 -6.872 412 HD2 LYS 50 HD2 LYS 50 0.665 -10.400 -4.835 413 HD3 LYS 50 HD3 LYS 50 1.296 -8.855 -5.457 414 HE2 LYS 50 HE2 LYS 50 -0.603 -10.747 -6.912 415 HE3 LYS 50 HE3 LYS 50 -1.072 -9.263 -6.068 416 HZ1 LYS 50 HZ1 LYS 50 0.784 -9.268 -8.361 417 HZ2 LYS 50 HZ2 LYS 50 -0.831 -9.074 -8.487 418 HZ3 LYS 50 HZ3 LYS 50 0.034 -7.963 -7.638 419 H GLY 51 H GLY 51 4.757 -12.965 -2.993 420 HA2 GLY 51 HA2 GLY 51 6.288 -14.741 -2.908 421 HA3 GLY 51 HA3 GLY 51 6.082 -15.011 -4.638 422 H TYR 52 H TYR 52 6.678 -11.658 -4.118 423 HA TYR 52 HA TYR 52 9.395 -11.972 -5.185 424 HB2 TYR 52 HB2 TYR 52 7.825 -9.533 -4.344 425 HB3 TYR 52 HB3 TYR 52 9.500 -9.471 -4.857 426 HD1 TYR 52 HD1 TYR 52 10.181 -10.181 -7.107 427 HD2 TYR 52 HD2 TYR 52 6.054 -9.877 -6.010 428 HE1 TYR 52 HE1 TYR 52 9.554 -10.195 -9.531 429 HE2 TYR 52 HE2 TYR 52 5.384 -9.849 -8.373 430 HH TYR 52 HH TYR 52 6.437 -10.705 -10.624 431 H ASN 53 H ASN 53 11.102 -12.271 -3.999 432 HA ASN 53 HA ASN 53 11.034 -11.667 -1.074 433 HB2 ASN 53 HB2 ASN 53 11.732 -14.217 -2.469 434 HB3 ASN 53 HB3 ASN 53 12.754 -13.735 -1.121 435 HD21 ASN 53 HD21 ASN 53 11.938 -15.641 0.093 436 HD22 ASN 53 HD22 ASN 53 10.365 -15.527 0.837 437 H LYS 54 H LYS 54 11.892 -10.159 -3.525 438 HA LYS 54 HA LYS 54 14.486 -9.274 -2.491 439 HB2 LYS 54 HB2 LYS 54 14.006 -10.521 -5.186 440 HB3 LYS 54 HB3 LYS 54 15.107 -9.175 -5.051 441 HG2 LYS 54 HG2 LYS 54 16.735 -10.339 -4.105 442 HG3 LYS 54 HG3 LYS 54 15.689 -11.086 -2.903 443 HD2 LYS 54 HD2 LYS 54 15.954 -11.982 -5.830 444 HD3 LYS 54 HD3 LYS 54 16.825 -12.719 -4.473 445 HE2 LYS 54 HE2 LYS 54 14.737 -13.412 -3.413 446 HE3 LYS 54 HE3 LYS 54 13.791 -12.524 -4.597 447 HZ1 LYS 54 HZ1 LYS 54 13.919 -14.920 -5.041 448 HZ2 LYS 54 HZ2 LYS 54 14.522 -14.055 -6.314 449 HZ3 LYS 54 HZ3 LYS 54 15.531 -14.829 -5.298 450 H ILE 55 H ILE 55 14.430 -7.066 -2.513 451 HA ILE 55 HA ILE 55 12.733 -5.422 -4.332 452 HB ILE 55 HB ILE 55 12.611 -5.554 -1.319 453 HG12 ILE 55 HG12 ILE 55 10.130 -4.859 -2.152 454 HG13 ILE 55 HG13 ILE 55 10.686 -5.416 -3.695 455 HG21 ILE 55 HG21 ILE 55 11.585 -3.285 -1.378 456 HG22 ILE 55 HG22 ILE 55 13.283 -3.266 -1.712 457 HG23 ILE 55 HG23 ILE 55 12.128 -3.118 -3.060 458 HD11 ILE 55 HD11 ILE 55 10.056 -7.490 -3.119 459 HD12 ILE 55 HD12 ILE 55 11.276 -7.498 -1.819 460 HD13 ILE 55 HD13 ILE 55 9.621 -6.911 -1.513 461 H PHE 56 H PHE 56 13.797 -3.352 -4.644 462 HA PHE 56 HA PHE 56 16.232 -2.860 -3.066 463 HB2 PHE 56 HB2 PHE 56 15.922 -2.254 -6.026 464 HB3 PHE 56 HB3 PHE 56 17.319 -1.860 -5.025 465 HD1 PHE 56 HD1 PHE 56 17.558 -4.396 -3.397 466 HD2 PHE 56 HD2 PHE 56 16.792 -3.757 -7.619 467 HE1 PHE 56 HE1 PHE 56 18.502 -6.581 -3.956 468 HE2 PHE 56 HE2 PHE 56 17.808 -5.935 -8.170 469 HZ PHE 56 HZ PHE 56 18.645 -7.394 -6.315 470 H LEU 57 H LEU 57 16.780 -0.675 -2.654 471 HA LEU 57 HA LEU 57 14.650 1.310 -3.288 472 HB2 LEU 57 HB2 LEU 57 14.747 0.659 -0.949 473 HB3 LEU 57 HB3 LEU 57 16.487 0.968 -0.899 474 HG LEU 57 HG LEU 57 16.119 3.375 -1.082 475 HD11 LEU 57 HD11 LEU 57 13.722 4.185 -1.139 476 HD12 LEU 57 HD12 LEU 57 14.311 3.465 -2.645 477 HD13 LEU 57 HD13 LEU 57 13.246 2.539 -1.574 478 HD21 LEU 57 HD21 LEU 57 15.886 2.378 1.167 479 HD22 LEU 57 HD22 LEU 57 14.847 3.791 0.959 480 HD23 LEU 57 HD23 LEU 57 14.141 2.155 0.880 481 H VAL 58 H VAL 58 16.132 1.382 -5.333 482 HA VAL 58 HA VAL 58 18.418 2.743 -5.616 483 HB VAL 58 HB VAL 58 15.798 3.005 -7.213 484 HG11 VAL 58 HG11 VAL 58 18.620 3.699 -8.156 485 HG12 VAL 58 HG12 VAL 58 17.188 3.564 -9.189 486 HG13 VAL 58 HG13 VAL 58 17.254 4.809 -7.957 487 HG21 VAL 58 HG21 VAL 58 18.127 1.116 -7.537 488 HG22 VAL 58 HG22 VAL 58 16.478 0.733 -7.020 489 HG23 VAL 58 HG23 VAL 58 16.769 1.322 -8.663 490 H LEU 59 H LEU 59 18.885 4.838 -4.688 491 HA LEU 59 HA LEU 59 16.689 6.684 -4.072 492 HB2 LEU 59 HB2 LEU 59 19.586 6.513 -3.253 493 HB3 LEU 59 HB3 LEU 59 18.519 7.801 -2.715 494 HG LEU 59 HG LEU 59 17.413 5.048 -2.313 495 HD11 LEU 59 HD11 LEU 59 19.792 5.921 -0.641 496 HD12 LEU 59 HD12 LEU 59 18.736 4.520 -0.339 497 HD13 LEU 59 HD13 LEU 59 19.757 4.565 -1.777 498 HD21 LEU 59 HD21 LEU 59 17.719 7.427 -0.475 499 HD22 LEU 59 HD22 LEU 59 16.291 7.034 -1.465 500 HD23 LEU 59 HD23 LEU 59 16.765 5.961 -0.148 501 H SER 60 H SER 60 18.480 6.235 -6.861 502 HA SER 60 HA SER 60 19.401 8.721 -7.608 503 HB2 SER 60 HB2 SER 60 18.022 6.543 -9.217 504 HB3 SER 60 HB3 SER 60 18.745 7.971 -9.957 505 HG SER 60 HG SER 60 20.659 7.302 -9.558 506 H ASP 61 H ASP 61 15.981 7.905 -7.203 507 HA ASP 61 HA ASP 61 15.162 10.183 -8.902 508 HB2 ASP 61 HB2 ASP 61 13.780 7.827 -7.712 509 HB3 ASP 61 HB3 ASP 61 12.853 9.332 -7.777 510 H VAL 62 H VAL 62 16.292 9.891 -5.716 511 HA VAL 62 HA VAL 62 14.668 12.156 -4.683 512 HB VAL 62 HB VAL 62 13.912 9.771 -4.064 513 HG11 VAL 62 HG11 VAL 62 16.299 9.941 -2.186 514 HG12 VAL 62 HG12 VAL 62 14.956 8.791 -2.075 515 HG13 VAL 62 HG13 VAL 62 16.032 8.753 -3.475 516 HG21 VAL 62 HG21 VAL 62 13.203 10.402 -1.886 517 HG22 VAL 62 HG22 VAL 62 14.438 11.689 -1.813 518 HG23 VAL 62 HG23 VAL 62 13.107 11.803 -2.980 519 H GLU 63 H GLU 63 15.681 13.399 -3.013 520 HA GLU 63 HA GLU 63 18.634 13.323 -2.984 521 HB2 GLU 63 HB2 GLU 63 17.342 15.454 -3.056 522 HB3 GLU 63 HB3 GLU 63 16.576 15.038 -1.529 523 HG2 GLU 63 HG2 GLU 63 18.425 16.562 -1.061 524 HG3 GLU 63 HG3 GLU 63 18.824 14.981 -0.403 525 H SER 64 H SER 64 15.791 12.822 -0.790 526 HA SER 64 HA SER 64 17.297 10.868 0.685 527 HB2 SER 64 HB2 SER 64 16.905 13.674 1.684 528 HB3 SER 64 HB3 SER 64 16.713 12.380 2.848 529 HG SER 64 HG SER 64 18.880 12.482 1.050 530 H ILE 65 H ILE 65 16.267 10.025 2.410 531 HA ILE 65 HA ILE 65 13.387 9.610 2.212 532 HB ILE 65 HB ILE 65 15.332 7.900 2.626 533 HG12 ILE 65 HG12 ILE 65 13.048 7.624 4.578 534 HG13 ILE 65 HG13 ILE 65 12.842 7.567 2.817 535 HG21 ILE 65 HG21 ILE 65 16.269 9.248 4.569 536 HG22 ILE 65 HG22 ILE 65 14.873 8.677 5.505 537 HG23 ILE 65 HG23 ILE 65 16.033 7.501 4.823 538 HD11 ILE 65 HD11 ILE 65 14.393 5.715 2.632 539 HD12 ILE 65 HD12 ILE 65 14.509 5.661 4.419 540 HD13 ILE 65 HD13 ILE 65 12.944 5.408 3.602 541 H ASP 66 H ASP 66 12.339 9.762 4.647 542 HA ASP 66 HA ASP 66 12.696 12.643 5.240 543 HB2 ASP 66 HB2 ASP 66 10.665 11.498 3.901 544 HB3 ASP 66 HB3 ASP 66 10.066 11.187 5.483 545 H SER 67 H SER 67 10.562 12.368 7.145 546 HA SER 67 HA SER 67 11.399 11.780 9.719 547 HB2 SER 67 HB2 SER 67 9.411 13.082 8.618 548 HB3 SER 67 HB3 SER 67 8.647 11.517 8.391 549 HG SER 67 HG SER 67 9.315 12.922 10.732 550 H PHE 68 H PHE 68 9.158 10.188 10.319 551 HA PHE 68 HA PHE 68 9.560 7.796 11.141 552 HB2 PHE 68 HB2 PHE 68 7.362 8.971 10.985 553 HB3 PHE 68 HB3 PHE 68 7.273 8.576 9.303 554 HD1 PHE 68 HD1 PHE 68 8.271 6.163 12.043 555 HD2 PHE 68 HD2 PHE 68 5.334 7.347 9.128 556 HE1 PHE 68 HE1 PHE 68 7.160 3.980 12.258 557 HE2 PHE 68 HE2 PHE 68 4.111 5.248 9.465 558 HZ PHE 68 HZ PHE 68 5.085 3.488 10.996 559 H SER 69 H SER 69 9.275 8.278 7.639 560 HA SER 69 HA SER 69 8.789 5.553 6.857 561 HB2 SER 69 HB2 SER 69 8.265 7.303 5.404 562 HB3 SER 69 HB3 SER 69 9.867 8.038 5.639 563 HG SER 69 HG SER 69 9.081 5.793 4.088 564 H LEU 70 H LEU 70 11.786 7.340 7.662 565 HA LEU 70 HA LEU 70 13.675 5.459 6.711 566 HB2 LEU 70 HB2 LEU 70 14.156 7.774 7.457 567 HB3 LEU 70 HB3 LEU 70 13.560 7.420 9.064 568 HG LEU 70 HG LEU 70 15.496 6.027 9.562 569 HD11 LEU 70 HD11 LEU 70 16.558 6.832 6.823 570 HD12 LEU 70 HD12 LEU 70 17.452 5.967 8.067 571 HD13 LEU 70 HD13 LEU 70 16.067 5.186 7.287 572 HD21 LEU 70 HD21 LEU 70 16.323 8.734 8.393 573 HD22 LEU 70 HD22 LEU 70 15.490 8.510 9.942 574 HD23 LEU 70 HD23 LEU 70 17.100 7.846 9.719 575 H GLY 71 H GLY 71 11.428 5.144 9.363 576 HA2 GLY 71 HA2 GLY 71 12.804 2.739 10.450 577 HA3 GLY 71 HA3 GLY 71 11.419 3.597 11.132 578 H VAL 72 H VAL 72 10.100 3.713 8.361 579 HA VAL 72 HA VAL 72 8.648 1.208 8.485 580 HB VAL 72 HB VAL 72 8.701 3.419 6.368 581 HG11 VAL 72 HG11 VAL 72 6.681 1.162 6.729 582 HG12 VAL 72 HG12 VAL 72 6.642 2.490 5.543 583 HG13 VAL 72 HG13 VAL 72 7.883 1.255 5.416 584 HG21 VAL 72 HG21 VAL 72 6.853 2.801 8.710 585 HG22 VAL 72 HG22 VAL 72 7.893 4.223 8.516 586 HG23 VAL 72 HG23 VAL 72 6.505 3.979 7.440 587 H ILE 73 H ILE 73 11.171 2.574 6.408 588 HA ILE 73 HA ILE 73 11.583 0.469 4.591 589 HB ILE 73 HB ILE 73 13.278 2.649 5.786 590 HG12 ILE 73 HG12 ILE 73 13.588 3.275 3.462 591 HG13 ILE 73 HG13 ILE 73 12.927 1.775 2.912 592 HG21 ILE 73 HG21 ILE 73 14.975 0.905 5.816 593 HG22 ILE 73 HG22 ILE 73 14.506 0.375 4.183 594 HG23 ILE 73 HG23 ILE 73 15.267 1.950 4.419 595 HD11 ILE 73 HD11 ILE 73 10.662 2.418 3.689 596 HD12 ILE 73 HD12 ILE 73 11.326 3.963 4.263 597 HD13 ILE 73 HD13 ILE 73 11.349 3.580 2.547 598 H VAL 74 H VAL 74 12.979 0.764 7.892 599 HA VAL 74 HA VAL 74 14.201 -1.867 7.802 600 HB VAL 74 HB VAL 74 13.325 0.046 10.058 601 HG11 VAL 74 HG11 VAL 74 14.848 -2.560 10.379 602 HG12 VAL 74 HG12 VAL 74 14.650 -1.310 11.635 603 HG13 VAL 74 HG13 VAL 74 13.232 -2.168 11.029 604 HG21 VAL 74 HG21 VAL 74 15.756 0.428 10.317 605 HG22 VAL 74 HG22 VAL 74 16.065 -0.657 8.945 606 HG23 VAL 74 HG23 VAL 74 15.183 0.865 8.706 607 H ASN 75 H ASN 75 10.882 -0.790 9.185 608 HA ASN 75 HA ASN 75 10.129 -3.253 10.037 609 HB2 ASN 75 HB2 ASN 75 8.848 -0.839 9.632 610 HB3 ASN 75 HB3 ASN 75 8.160 -1.723 8.298 611 HD21 ASN 75 HD21 ASN 75 8.354 -1.358 11.716 612 HD22 ASN 75 HD22 ASN 75 7.152 -2.521 12.163 613 H ILE 76 H ILE 76 9.834 -2.075 6.663 614 HA ILE 76 HA ILE 76 8.789 -4.440 5.500 615 HB ILE 76 HB ILE 76 10.434 -2.115 4.386 616 HG12 ILE 76 HG12 ILE 76 7.453 -2.777 4.097 617 HG13 ILE 76 HG13 ILE 76 8.084 -1.541 5.174 618 HG21 ILE 76 HG21 ILE 76 9.003 -4.351 2.884 619 HG22 ILE 76 HG22 ILE 76 9.736 -2.895 2.163 620 HG23 ILE 76 HG23 ILE 76 10.762 -4.062 2.952 621 HD11 ILE 76 HD11 ILE 76 7.204 -0.460 3.288 622 HD12 ILE 76 HD12 ILE 76 8.960 -0.233 3.304 623 HD13 ILE 76 HD13 ILE 76 8.203 -1.383 2.173 624 H LEU 77 H LEU 77 12.130 -3.571 6.443 625 HA LEU 77 HA LEU 77 13.534 -5.630 4.927 626 HB2 LEU 77 HB2 LEU 77 14.789 -3.814 5.533 627 HB3 LEU 77 HB3 LEU 77 14.282 -3.910 7.198 628 HG LEU 77 HG LEU 77 15.300 -6.072 7.522 629 HD11 LEU 77 HD11 LEU 77 16.638 -5.693 4.761 630 HD12 LEU 77 HD12 LEU 77 16.961 -6.991 5.906 631 HD13 LEU 77 HD13 LEU 77 15.411 -6.943 5.073 632 HD21 LEU 77 HD21 LEU 77 16.874 -3.877 6.476 633 HD22 LEU 77 HD22 LEU 77 16.253 -4.156 8.145 634 HD23 LEU 77 HD23 LEU 77 17.528 -5.234 7.494 635 H LYS 78 H LYS 78 12.406 -5.207 8.319 636 HA LYS 78 HA LYS 78 13.288 -7.753 9.252 637 HB2 LYS 78 HB2 LYS 78 10.910 -6.158 10.325 638 HB3 LYS 78 HB3 LYS 78 11.839 -7.414 11.158 639 HG2 LYS 78 HG2 LYS 78 13.892 -5.852 10.712 640 HG3 LYS 78 HG3 LYS 78 12.699 -4.612 10.408 641 HD2 LYS 78 HD2 LYS 78 11.870 -4.704 12.645 642 HD3 LYS 78 HD3 LYS 78 12.717 -6.234 12.982 643 HE2 LYS 78 HE2 LYS 78 14.707 -4.400 12.134 644 HE3 LYS 78 HE3 LYS 78 13.648 -3.456 13.182 645 HZ1 LYS 78 HZ1 LYS 78 15.503 -4.550 14.318 646 HZ2 LYS 78 HZ2 LYS 78 14.056 -5.068 14.945 647 HZ3 LYS 78 HZ3 LYS 78 14.963 -6.014 13.911 648 H SER 79 H SER 79 10.592 -6.839 7.352 649 HA SER 79 HA SER 79 9.070 -9.315 7.778 650 HB2 SER 79 HB2 SER 79 8.708 -6.995 5.856 651 HB3 SER 79 HB3 SER 79 7.589 -8.366 6.038 652 HG SER 79 HG SER 79 7.313 -7.889 8.140 653 H ILE 80 H ILE 80 11.012 -7.955 5.007 654 HA ILE 80 HA ILE 80 10.888 -10.369 3.462 655 HB ILE 80 HB ILE 80 12.769 -7.990 3.598 656 HG12 ILE 80 HG12 ILE 80 10.812 -9.128 1.545 657 HG13 ILE 80 HG13 ILE 80 10.512 -7.752 2.615 658 HG21 ILE 80 HG21 ILE 80 13.102 -10.246 1.572 659 HG22 ILE 80 HG22 ILE 80 14.032 -8.754 1.662 660 HG23 ILE 80 HG23 ILE 80 14.205 -9.913 2.946 661 HD11 ILE 80 HD11 ILE 80 11.024 -7.005 0.399 662 HD12 ILE 80 HD12 ILE 80 12.330 -6.496 1.492 663 HD13 ILE 80 HD13 ILE 80 12.548 -7.864 0.353 664 H SER 81 H SER 81 13.144 -9.288 5.981 665 HA SER 81 HA SER 81 14.766 -11.624 6.035 666 HB2 SER 81 HB2 SER 81 15.586 -9.533 6.851 667 HB3 SER 81 HB3 SER 81 14.255 -9.318 7.971 668 HG SER 81 HG SER 81 15.061 -11.313 8.993 669 H SER 82 H SER 82 11.476 -11.293 7.000 670 HA SER 82 HA SER 82 11.668 -13.593 8.862 671 HB2 SER 82 HB2 SER 82 10.339 -11.564 9.509 672 HB3 SER 82 HB3 SER 82 9.224 -11.917 8.177 673 HG SER 82 HG SER 82 9.892 -13.628 10.342 674 H SER 83 H SER 83 10.129 -12.502 5.764 675 HA SER 83 HA SER 83 8.855 -14.931 5.161 676 HB2 SER 83 HB2 SER 83 9.850 -12.603 3.485 677 HB3 SER 83 HB3 SER 83 9.056 -14.010 2.769 678 HG SER 83 HG SER 83 7.191 -13.454 3.687 679 H GLY 84 H GLY 84 12.238 -13.972 4.620 680 HA2 GLY 84 HA2 GLY 84 13.812 -15.885 4.199 681 HA3 GLY 84 HA3 GLY 84 12.552 -16.519 3.117 682 H GLY 85 H GLY 85 13.639 -13.031 3.186 683 HA2 GLY 85 HA2 GLY 85 14.700 -13.493 0.449 684 HA3 GLY 85 HA3 GLY 85 13.485 -12.265 0.811 685 H PHE 86 H PHE 86 15.345 -11.112 -0.217 686 HA PHE 86 HA PHE 86 17.136 -9.932 1.835 687 HB2 PHE 86 HB2 PHE 86 17.916 -11.315 -0.652 688 HB3 PHE 86 HB3 PHE 86 18.567 -9.698 -0.525 689 HD1 PHE 86 HD1 PHE 86 18.106 -12.339 2.179 690 HD2 PHE 86 HD2 PHE 86 20.794 -9.719 0.082 691 HE1 PHE 86 HE1 PHE 86 19.805 -12.691 3.928 692 HE2 PHE 86 HE2 PHE 86 22.490 -10.046 1.875 693 HZ PHE 86 HZ PHE 86 21.992 -11.513 3.800 694 H PHE 87 H PHE 87 17.699 -7.719 1.444 695 HA PHE 87 HA PHE 87 16.269 -6.297 -0.675 696 HB2 PHE 87 HB2 PHE 87 14.510 -6.199 0.847 697 HB3 PHE 87 HB3 PHE 87 15.569 -6.201 2.247 698 HD1 PHE 87 HD1 PHE 87 15.494 -3.832 -0.790 699 HD2 PHE 87 HD2 PHE 87 15.233 -4.339 3.517 700 HE1 PHE 87 HE1 PHE 87 15.079 -1.435 -0.473 701 HE2 PHE 87 HE2 PHE 87 14.670 -1.970 3.821 702 HZ PHE 87 HZ PHE 87 14.642 -0.467 1.781 703 H ALA 88 H ALA 88 17.323 -4.369 -1.158 704 HA ALA 88 HA ALA 88 19.447 -3.440 0.618 705 HB1 ALA 88 HB1 ALA 88 20.525 -5.240 -0.689 706 HB2 ALA 88 HB2 ALA 88 20.026 -4.465 -2.186 707 HB3 ALA 88 HB3 ALA 88 21.169 -3.633 -1.091 708 H LEU 89 H LEU 89 20.573 -1.501 -0.417 709 HA LEU 89 HA LEU 89 18.480 0.171 -1.741 710 HB2 LEU 89 HB2 LEU 89 20.637 1.485 -0.188 711 HB3 LEU 89 HB3 LEU 89 18.978 1.981 -0.480 712 HG LEU 89 HG LEU 89 20.094 0.081 1.564 713 HD11 LEU 89 HD11 LEU 89 20.101 2.571 1.967 714 HD12 LEU 89 HD12 LEU 89 18.335 2.569 1.836 715 HD13 LEU 89 HD13 LEU 89 19.141 1.688 3.169 716 HD21 LEU 89 HD21 LEU 89 17.148 0.368 1.030 717 HD22 LEU 89 HD22 LEU 89 18.130 -1.105 1.083 718 HD23 LEU 89 HD23 LEU 89 17.836 -0.222 2.556 719 H VAL 90 H VAL 90 19.514 2.083 -2.992 720 HA VAL 90 HA VAL 90 22.020 1.358 -4.250 721 HB VAL 90 HB VAL 90 20.946 0.129 -5.746 722 HG11 VAL 90 HG11 VAL 90 19.048 -0.601 -6.232 723 HG12 VAL 90 HG12 VAL 90 19.353 -0.552 -4.533 724 HG13 VAL 90 HG13 VAL 90 18.272 0.619 -5.212 725 HG21 VAL 90 HG21 VAL 90 20.039 2.552 -7.047 726 HG22 VAL 90 HG22 VAL 90 21.632 1.797 -7.156 727 HG23 VAL 90 HG23 VAL 90 20.247 0.932 -7.783 728 H SER 91 H SER 91 23.002 2.942 -5.471 729 HA SER 91 HA SER 91 23.640 5.009 -5.931 730 HB2 SER 91 HB2 SER 91 21.681 4.186 -7.536 731 HB3 SER 91 HB3 SER 91 20.844 5.586 -6.875 732 HG SER 91 HG SER 91 21.947 6.621 -8.273 733 HA PRO 92 HA PRO 92 21.471 6.970 -2.236 734 HB2 PRO 92 HB2 PRO 92 23.442 6.812 -0.354 735 HB3 PRO 92 HB3 PRO 92 22.317 5.462 -0.686 736 HG2 PRO 92 HG2 PRO 92 25.172 5.795 -1.594 737 HG3 PRO 92 HG3 PRO 92 24.304 4.297 -1.102 738 HD2 PRO 92 HD2 PRO 92 24.732 5.116 -3.721 739 HD3 PRO 92 HD3 PRO 92 23.516 3.932 -3.144 740 H ASN 93 H ASN 93 22.230 9.024 -1.093 741 HA ASN 93 HA ASN 93 24.349 10.441 -2.605 742 HB2 ASN 93 HB2 ASN 93 22.150 12.161 -1.540 743 HB3 ASN 93 HB3 ASN 93 23.192 12.372 -2.925 744 HD21 ASN 93 HD21 ASN 93 20.197 11.366 -1.792 745 HD22 ASN 93 HD22 ASN 93 19.450 10.825 -3.300 746 H GLU 94 H GLU 94 24.938 12.445 -1.277 747 HA GLU 94 HA GLU 94 26.165 11.338 1.035 748 HB2 GLU 94 HB2 GLU 94 27.206 13.023 -0.432 749 HB3 GLU 94 HB3 GLU 94 26.025 14.234 0.059 750 HG2 GLU 94 HG2 GLU 94 26.969 14.554 2.096 751 HG3 GLU 94 HG3 GLU 94 27.489 12.877 2.273 752 H LYS 95 H LYS 95 23.383 13.406 0.567 753 HA LYS 95 HA LYS 95 22.914 14.271 3.256 754 HB2 LYS 95 HB2 LYS 95 21.961 14.973 0.821 755 HB3 LYS 95 HB3 LYS 95 20.711 13.879 1.268 756 HG2 LYS 95 HG2 LYS 95 21.545 15.903 3.377 757 HG3 LYS 95 HG3 LYS 95 20.949 16.572 1.877 758 HD2 LYS 95 HD2 LYS 95 19.011 16.417 3.098 759 HD3 LYS 95 HD3 LYS 95 19.062 15.041 2.003 760 HE2 LYS 95 HE2 LYS 95 18.062 14.391 4.064 761 HE3 LYS 95 HE3 LYS 95 19.557 13.496 3.916 762 HZ1 LYS 95 HZ1 LYS 95 20.525 15.168 5.476 763 HZ2 LYS 95 HZ2 LYS 95 19.058 15.918 5.568 764 HZ3 LYS 95 HZ3 LYS 95 19.198 14.404 6.115 765 H VAL 96 H VAL 96 22.138 11.317 1.479 766 HA VAL 96 HA VAL 96 20.288 10.506 3.564 767 HB VAL 96 HB VAL 96 20.423 10.098 0.829 768 HG11 VAL 96 HG11 VAL 96 22.138 8.315 0.971 769 HG12 VAL 96 HG12 VAL 96 21.067 7.381 2.016 770 HG13 VAL 96 HG13 VAL 96 20.586 7.746 0.343 771 HG21 VAL 96 HG21 VAL 96 18.473 8.859 0.977 772 HG22 VAL 96 HG22 VAL 96 18.856 8.219 2.595 773 HG23 VAL 96 HG23 VAL 96 18.437 9.924 2.389 774 H GLU 97 H GLU 97 23.532 9.605 2.361 775 HA GLU 97 HA GLU 97 24.085 7.425 4.031 776 HB2 GLU 97 HB2 GLU 97 25.708 9.550 2.616 777 HB3 GLU 97 HB3 GLU 97 26.512 8.352 3.607 778 HG2 GLU 97 HG2 GLU 97 24.533 7.525 1.450 779 HG3 GLU 97 HG3 GLU 97 26.189 7.926 1.037 780 H ARG 98 H ARG 98 24.124 10.946 4.713 781 HA ARG 98 HA ARG 98 25.803 10.685 6.962 782 HB2 ARG 98 HB2 ARG 98 25.640 12.901 7.237 783 HB3 ARG 98 HB3 ARG 98 25.084 12.755 5.575 784 HG2 ARG 98 HG2 ARG 98 23.559 14.177 6.373 785 HG3 ARG 98 HG3 ARG 98 22.742 12.612 6.558 786 HD2 ARG 98 HD2 ARG 98 22.894 12.679 8.899 787 HD3 ARG 98 HD3 ARG 98 24.387 13.624 8.837 788 HE ARG 98 HE ARG 98 22.333 15.268 7.848 789 HH11 ARG 98 HH11 ARG 98 23.770 14.028 10.841 790 HH12 ARG 98 HH12 ARG 98 23.178 15.338 11.808 791 HH21 ARG 98 HH21 ARG 98 21.751 17.097 9.097 792 HH22 ARG 98 HH22 ARG 98 22.209 17.185 10.754 793 H VAL 99 H VAL 99 22.547 9.840 6.623 794 HA VAL 99 HA VAL 99 21.963 9.963 9.550 795 HB VAL 99 HB VAL 99 20.140 9.265 7.196 796 HG11 VAL 99 HG11 VAL 99 19.223 8.636 9.381 797 HG12 VAL 99 HG12 VAL 99 19.510 10.270 10.006 798 HG13 VAL 99 HG13 VAL 99 18.316 10.003 8.721 799 HG21 VAL 99 HG21 VAL 99 19.338 11.578 7.282 800 HG22 VAL 99 HG22 VAL 99 20.844 11.941 8.219 801 HG23 VAL 99 HG23 VAL 99 20.943 11.234 6.573 802 H LEU 100 H LEU 100 22.026 7.963 6.587 803 HA LEU 100 HA LEU 100 21.033 5.591 7.705 804 HB2 LEU 100 HB2 LEU 100 22.921 6.043 5.358 805 HB3 LEU 100 HB3 LEU 100 22.296 4.498 5.793 806 HG LEU 100 HG LEU 100 21.238 6.371 4.012 807 HD11 LEU 100 HD11 LEU 100 21.120 3.907 3.885 808 HD12 LEU 100 HD12 LEU 100 19.829 3.928 5.108 809 HD13 LEU 100 HD13 LEU 100 19.576 4.704 3.537 810 HD21 LEU 100 HD21 LEU 100 20.010 7.556 5.804 811 HD22 LEU 100 HD22 LEU 100 18.951 6.809 4.630 812 HD23 LEU 100 HD23 LEU 100 19.178 6.052 6.229 813 H SER 101 H SER 101 23.976 7.259 8.339 814 HA SER 101 HA SER 101 25.299 4.612 9.053 815 HB2 SER 101 HB2 SER 101 26.624 6.482 7.952 816 HB3 SER 101 HB3 SER 101 26.558 7.317 9.512 817 HG SER 101 HG SER 101 27.795 4.916 8.758 818 H LEU 102 H LEU 102 24.327 7.626 10.466 819 HA LEU 102 HA LEU 102 24.864 7.321 13.171 820 HB2 LEU 102 HB2 LEU 102 22.714 8.894 11.645 821 HB3 LEU 102 HB3 LEU 102 23.058 9.059 13.336 822 HG LEU 102 HG LEU 102 24.019 10.711 11.533 823 HD11 LEU 102 HD11 LEU 102 23.957 11.120 13.872 824 HD12 LEU 102 HD12 LEU 102 25.207 9.887 14.184 825 HD13 LEU 102 HD13 LEU 102 25.614 11.382 13.299 826 HD21 LEU 102 HD21 LEU 102 26.196 8.737 12.206 827 HD22 LEU 102 HD22 LEU 102 25.565 9.070 10.568 828 HD23 LEU 102 HD23 LEU 102 26.479 10.308 11.436 829 H THR 103 H THR 103 21.801 6.834 11.458 830 HA THR 103 HA THR 103 20.419 5.868 13.805 831 HB THR 103 HB THR 103 19.680 7.295 11.756 832 HG1 THR 103 HG1 THR 103 18.154 5.336 13.033 833 HG21 THR 103 HG21 THR 103 18.898 4.645 10.562 834 HG22 THR 103 HG22 THR 103 18.768 6.288 9.870 835 HG23 THR 103 HG23 THR 103 20.343 5.538 10.052 836 H ASN 104 H ASN 104 22.753 4.440 12.092 837 HA ASN 104 HA ASN 104 23.449 2.499 11.320 838 HB2 ASN 104 HB2 ASN 104 21.848 1.251 13.547 839 HB3 ASN 104 HB3 ASN 104 23.220 0.552 12.725 840 HD21 ASN 104 HD21 ASN 104 24.613 3.479 12.918 841 HD22 ASN 104 HD22 ASN 104 25.096 3.491 14.566 842 H LEU 105 H LEU 105 22.293 2.915 9.397 843 HA LEU 105 HA LEU 105 20.018 1.091 8.897 844 HB2 LEU 105 HB2 LEU 105 19.997 3.791 8.590 845 HB3 LEU 105 HB3 LEU 105 20.675 3.342 7.054 846 HG LEU 105 HG LEU 105 18.379 3.610 6.708 847 HD11 LEU 105 HD11 LEU 105 17.490 1.478 6.001 848 HD12 LEU 105 HD12 LEU 105 19.244 1.465 5.696 849 HD13 LEU 105 HD13 LEU 105 18.561 0.614 7.100 850 HD21 LEU 105 HD21 LEU 105 16.605 2.622 8.023 851 HD22 LEU 105 HD22 LEU 105 17.804 1.927 9.148 852 HD23 LEU 105 HD23 LEU 105 17.633 3.688 8.975 853 H ASP 106 H ASP 106 22.897 2.611 7.317 854 HA ASP 106 HA ASP 106 23.193 0.573 5.319 855 HB2 ASP 106 HB2 ASP 106 25.105 1.692 4.717 856 HB3 ASP 106 HB3 ASP 106 24.173 3.005 5.430 857 H ARG 107 H ARG 107 24.143 0.878 8.664 858 HA ARG 107 HA ARG 107 26.155 -1.197 8.588 859 HB2 ARG 107 HB2 ARG 107 24.634 -0.159 11.020 860 HB3 ARG 107 HB3 ARG 107 26.115 -1.104 11.013 861 HG2 ARG 107 HG2 ARG 107 27.195 0.869 9.713 862 HG3 ARG 107 HG3 ARG 107 25.723 1.758 10.126 863 HD2 ARG 107 HD2 ARG 107 27.029 2.453 11.823 864 HD3 ARG 107 HD3 ARG 107 26.287 1.067 12.608 865 HE ARG 107 HE ARG 107 29.069 1.483 11.795 866 HH11 ARG 107 HH11 ARG 107 26.831 -0.996 13.060 867 HH12 ARG 107 HH12 ARG 107 27.956 -2.276 12.680 868 HH21 ARG 107 HH21 ARG 107 30.687 -0.076 12.221 869 HH22 ARG 107 HH22 ARG 107 30.247 -1.723 12.535 870 H ILE 108 H ILE 108 22.925 -1.505 8.139 871 HA ILE 108 HA ILE 108 22.739 -4.204 9.354 872 HB ILE 108 HB ILE 108 20.663 -1.979 9.197 873 HG12 ILE 108 HG12 ILE 108 22.501 -2.989 11.369 874 HG13 ILE 108 HG13 ILE 108 22.173 -1.344 10.856 875 HG21 ILE 108 HG21 ILE 108 19.666 -4.256 8.955 876 HG22 ILE 108 HG22 ILE 108 20.389 -4.687 10.521 877 HG23 ILE 108 HG23 ILE 108 19.160 -3.406 10.422 878 HD11 ILE 108 HD11 ILE 108 20.370 -3.107 12.548 879 HD12 ILE 108 HD12 ILE 108 21.321 -1.701 13.064 880 HD13 ILE 108 HD13 ILE 108 19.954 -1.477 11.969 881 H VAL 109 H VAL 109 21.666 -1.936 6.703 882 HA VAL 109 HA VAL 109 20.799 -4.314 5.191 883 HB VAL 109 HB VAL 109 20.179 -1.500 4.330 884 HG11 VAL 109 HG11 VAL 109 18.680 -4.157 4.192 885 HG12 VAL 109 HG12 VAL 109 18.094 -2.629 3.511 886 HG13 VAL 109 HG13 VAL 109 19.561 -3.367 2.866 887 HG21 VAL 109 HG21 VAL 109 17.945 -1.795 5.641 888 HG22 VAL 109 HG22 VAL 109 18.823 -3.026 6.588 889 HG23 VAL 109 HG23 VAL 109 19.376 -1.355 6.596 890 H LYS 110 H LYS 110 21.444 -4.607 3.081 891 HA LYS 110 HA LYS 110 24.076 -3.720 2.329 892 HB2 LYS 110 HB2 LYS 110 21.863 -5.291 1.048 893 HB3 LYS 110 HB3 LYS 110 23.343 -4.926 0.171 894 HG2 LYS 110 HG2 LYS 110 23.899 -5.916 2.894 895 HG3 LYS 110 HG3 LYS 110 22.930 -7.059 1.963 896 HD2 LYS 110 HD2 LYS 110 25.211 -7.605 1.547 897 HD3 LYS 110 HD3 LYS 110 24.589 -6.907 0.122 898 HE2 LYS 110 HE2 LYS 110 26.807 -6.008 0.459 899 HE3 LYS 110 HE3 LYS 110 25.682 -4.690 0.711 900 HZ1 LYS 110 HZ1 LYS 110 26.744 -6.243 2.997 901 HZ2 LYS 110 HZ2 LYS 110 27.566 -4.991 2.302 902 HZ3 LYS 110 HZ3 LYS 110 26.134 -4.696 2.996 903 H ILE 111 H ILE 111 24.672 -2.644 0.423 904 HA ILE 111 HA ILE 111 22.731 -0.716 -0.640 905 HB ILE 111 HB ILE 111 23.920 -0.009 1.615 906 HG12 ILE 111 HG12 ILE 111 24.212 2.330 -0.131 907 HG13 ILE 111 HG13 ILE 111 22.716 1.482 -0.428 908 HG21 ILE 111 HG21 ILE 111 26.039 0.864 -0.353 909 HG22 ILE 111 HG22 ILE 111 25.928 1.314 1.364 910 HG23 ILE 111 HG23 ILE 111 26.226 -0.378 0.914 911 HD11 ILE 111 HD11 ILE 111 22.401 3.155 1.370 912 HD12 ILE 111 HD12 ILE 111 22.247 1.515 2.063 913 HD13 ILE 111 HD13 ILE 111 23.737 2.450 2.297 914 H TYR 112 H TYR 112 23.365 0.113 -2.708 915 HA TYR 112 HA TYR 112 25.824 -1.044 -3.913 916 HB2 TYR 112 HB2 TYR 112 22.923 -1.319 -4.803 917 HB3 TYR 112 HB3 TYR 112 24.304 -1.729 -5.807 918 HD1 TYR 112 HD1 TYR 112 25.802 -3.550 -5.280 919 HD2 TYR 112 HD2 TYR 112 22.315 -2.819 -2.813 920 HE1 TYR 112 HE1 TYR 112 26.020 -5.809 -4.334 921 HE2 TYR 112 HE2 TYR 112 22.524 -5.187 -1.953 922 HH TYR 112 HH TYR 112 23.591 -7.100 -1.954 923 H ASP 113 H ASP 113 26.230 -0.141 -6.163 924 HA ASP 113 HA ASP 113 25.756 2.783 -6.080 925 HB2 ASP 113 HB2 ASP 113 27.778 1.036 -7.304 926 HB3 ASP 113 HB3 ASP 113 27.078 2.126 -8.492 927 H THR 114 H THR 114 25.267 0.092 -8.418 928 HA THR 114 HA THR 114 22.981 1.637 -9.543 929 HB THR 114 HB THR 114 23.404 0.382 -11.605 930 HG1 THR 114 HG1 THR 114 25.683 -0.637 -10.268 931 HG21 THR 114 HG21 THR 114 25.988 1.637 -10.596 932 HG22 THR 114 HG22 THR 114 25.467 1.444 -12.278 933 HG23 THR 114 HG23 THR 114 24.589 2.540 -11.207 934 H ILE 115 H ILE 115 21.409 0.108 -10.719 935 HA ILE 115 HA ILE 115 20.227 -1.854 -8.919 936 HB ILE 115 HB ILE 115 19.756 -0.857 -11.733 937 HG12 ILE 115 HG12 ILE 115 18.670 0.270 -9.863 938 HG13 ILE 115 HG13 ILE 115 17.484 -0.555 -10.869 939 HG21 ILE 115 HG21 ILE 115 19.582 -3.164 -12.246 940 HG22 ILE 115 HG22 ILE 115 18.757 -3.543 -10.732 941 HG23 ILE 115 HG23 ILE 115 17.922 -2.603 -12.002 942 HD11 ILE 115 HD11 ILE 115 18.439 -1.431 -8.117 943 HD12 ILE 115 HD12 ILE 115 16.835 -0.972 -8.622 944 HD13 ILE 115 HD13 ILE 115 17.531 -2.483 -9.210 945 H SER 116 H SER 116 22.496 -1.951 -11.698 946 HA SER 116 HA SER 116 21.987 -4.721 -12.065 947 HB2 SER 116 HB2 SER 116 22.591 -3.327 -13.839 948 HB3 SER 116 HB3 SER 116 24.104 -2.808 -13.028 949 HG SER 116 HG SER 116 24.992 -4.732 -13.392 950 H GLU 117 H GLU 117 24.372 -2.865 -10.130 951 HA GLU 117 HA GLU 117 26.066 -5.082 -9.479 952 HB2 GLU 117 HB2 GLU 117 25.466 -2.302 -8.478 953 HB3 GLU 117 HB3 GLU 117 26.514 -3.356 -7.506 954 HG2 GLU 117 HG2 GLU 117 28.156 -3.540 -9.140 955 HG3 GLU 117 HG3 GLU 117 27.074 -3.020 -10.444 956 H ALA 118 H ALA 118 22.859 -4.142 -8.521 957 HA ALA 118 HA ALA 118 23.117 -5.400 -5.852 958 HB1 ALA 118 HB1 ALA 118 21.886 -3.266 -6.189 959 HB2 ALA 118 HB2 ALA 118 20.650 -4.168 -7.089 960 HB3 ALA 118 HB3 ALA 118 21.021 -4.600 -5.376 961 H MET 119 H MET 119 21.379 -5.572 -8.954 962 HA MET 119 HA MET 119 19.645 -7.429 -8.295 963 HB2 MET 119 HB2 MET 119 20.092 -5.887 -10.519 964 HB3 MET 119 HB3 MET 119 20.756 -7.342 -11.157 965 HG2 MET 119 HG2 MET 119 18.031 -7.372 -9.829 966 HG3 MET 119 HG3 MET 119 18.178 -6.693 -11.426 967 HE1 MET 119 HE1 MET 119 18.742 -9.703 -13.752 968 HE2 MET 119 HE2 MET 119 18.127 -8.046 -13.602 969 HE3 MET 119 HE3 MET 119 19.843 -8.388 -13.274 970 H GLU 120 H GLU 120 22.814 -8.214 -9.679 971 HA GLU 120 HA GLU 120 22.289 -11.157 -9.528 972 HB2 GLU 120 HB2 GLU 120 24.552 -11.264 -10.538 973 HB3 GLU 120 HB3 GLU 120 23.489 -10.220 -11.495 974 HG2 GLU 120 HG2 GLU 120 24.534 -8.226 -10.422 975 HG3 GLU 120 HG3 GLU 120 25.554 -9.266 -9.445 976 H GLU 121 H GLU 121 23.620 -8.682 -7.474 977 HA GLU 121 HA GLU 121 25.472 -10.578 -6.272 978 HB2 GLU 121 HB2 GLU 121 25.965 -8.140 -6.600 979 HB3 GLU 121 HB3 GLU 121 24.752 -7.746 -5.396 980 HG2 GLU 121 HG2 GLU 121 26.077 -8.320 -3.672 981 HG3 GLU 121 HG3 GLU 121 26.615 -9.811 -4.400 982 H VAL 122 H VAL 122 22.635 -8.630 -5.163 983 HA VAL 122 HA VAL 122 22.188 -9.461 -2.665 984 HB VAL 122 HB VAL 122 20.180 -9.177 -4.929 985 HG11 VAL 122 HG11 VAL 122 20.016 -8.561 -1.988 986 HG12 VAL 122 HG12 VAL 122 18.673 -8.455 -3.166 987 HG13 VAL 122 HG13 VAL 122 19.332 -10.021 -2.750 988 HG21 VAL 122 HG21 VAL 122 20.634 -6.762 -3.310 989 HG22 VAL 122 HG22 VAL 122 22.061 -7.228 -4.223 990 HG23 VAL 122 HG23 VAL 122 20.543 -7.047 -5.083 991 H ARG 123 H ARG 123 21.400 -11.110 -5.624 992 HA ARG 123 HA ARG 123 19.813 -13.266 -4.651 993 HB2 ARG 123 HB2 ARG 123 21.724 -12.990 -6.985 994 HB3 ARG 123 HB3 ARG 123 20.894 -14.529 -6.639 995 HG2 ARG 123 HG2 ARG 123 18.718 -13.285 -6.689 996 HG3 ARG 123 HG3 ARG 123 19.567 -11.854 -7.241 997 HD2 ARG 123 HD2 ARG 123 20.098 -14.366 -8.800 998 HD3 ARG 123 HD3 ARG 123 18.447 -13.761 -8.888 999 HE ARG 123 HE ARG 123 19.824 -11.508 -9.362 1000 HH11 ARG 123 HH11 ARG 123 19.914 -14.731 -10.912 1001 HH12 ARG 123 HH12 ARG 123 20.380 -14.119 -12.446 1002 HH21 ARG 123 HH21 ARG 123 20.401 -10.736 -11.451 1003 HH22 ARG 123 HH22 ARG 123 20.852 -11.863 -12.703 1004 H ARG 124 H ARG 124 23.354 -12.895 -4.552 1005 HA ARG 124 HA ARG 124 23.488 -15.160 -2.723 1006 HB2 ARG 124 HB2 ARG 124 25.585 -15.953 -3.600 1007 HB3 ARG 124 HB3 ARG 124 24.285 -16.118 -4.769 1008 HG2 ARG 124 HG2 ARG 124 26.107 -13.714 -4.844 1009 HG3 ARG 124 HG3 ARG 124 26.637 -15.269 -5.505 1010 HD2 ARG 124 HD2 ARG 124 24.525 -15.255 -6.965 1011 HD3 ARG 124 HD3 ARG 124 24.297 -13.590 -6.480 1012 HE ARG 124 HE ARG 124 26.086 -12.922 -7.784 1013 HH11 ARG 124 HH11 ARG 124 25.967 -16.510 -7.785 1014 HH12 ARG 124 HH12 ARG 124 27.175 -16.633 -9.023 1015 HH21 ARG 124 HH21 ARG 124 27.678 -13.135 -9.322 1016 HH22 ARG 124 HH22 ARG 124 28.289 -14.669 -9.857 1017 H LYS 125 H LYS 125 22.961 -12.644 -1.874 1018 HA LYS 125 HA LYS 125 25.280 -12.422 -0.095 1019 HB2 LYS 125 HB2 LYS 125 23.137 -10.498 -1.035 1020 HB3 LYS 125 HB3 LYS 125 24.224 -10.078 0.267 1021 HG2 LYS 125 HG2 LYS 125 25.317 -11.086 -2.371 1022 HG3 LYS 125 HG3 LYS 125 24.843 -9.402 -2.181 1023 HD2 LYS 125 HD2 LYS 125 26.708 -10.451 -0.078 1024 HD3 LYS 125 HD3 LYS 125 27.325 -10.478 -1.733 1025 HE2 LYS 125 HE2 LYS 125 26.435 -7.991 -1.828 1026 HE3 LYS 125 HE3 LYS 125 26.496 -8.098 -0.069 1027 HZ1 LYS 125 HZ1 LYS 125 28.494 -7.220 -1.208 1028 HZ2 LYS 125 HZ2 LYS 125 28.840 -8.459 -0.195 1029 HZ3 LYS 125 HZ3 LYS 125 28.789 -8.678 -1.846 Start of MODEL 20 1 H1 MET 1 H1 MET 1 -28.763 0.799 14.563 2 HA MET 1 HA MET 1 -26.946 -0.715 15.133 3 HB2 MET 1 HB2 MET 1 -28.675 -1.183 12.785 4 HB3 MET 1 HB3 MET 1 -27.174 -2.111 12.739 5 HG2 MET 1 HG2 MET 1 -28.594 -3.509 13.848 6 HG3 MET 1 HG3 MET 1 -27.621 -2.813 15.139 7 HE1 MET 1 HE1 MET 1 -30.871 -4.080 14.284 8 HE2 MET 1 HE2 MET 1 -30.122 -4.417 15.858 9 HE3 MET 1 HE3 MET 1 -31.704 -3.610 15.777 10 H GLY 2 H GLY 2 -26.270 -0.541 11.583 11 HA2 GLY 2 HA2 GLY 2 -23.445 -0.014 12.236 12 HA3 GLY 2 HA3 GLY 2 -24.131 -0.562 10.693 13 H SER 3 H SER 3 -22.655 1.231 10.006 14 HA SER 3 HA SER 3 -24.242 3.650 9.496 15 HB2 SER 3 HB2 SER 3 -21.318 3.764 10.351 16 HB3 SER 3 HB3 SER 3 -22.341 5.131 9.885 17 HG SER 3 HG SER 3 -23.719 4.285 11.737 18 H ASP 4 H ASP 4 -21.415 1.597 8.793 19 HA ASP 4 HA ASP 4 -20.253 1.116 7.022 20 HB2 ASP 4 HB2 ASP 4 -22.384 -0.184 6.814 21 HB3 ASP 4 HB3 ASP 4 -22.910 0.968 5.584 22 H LYS 5 H LYS 5 -19.088 3.071 6.838 23 HA LYS 5 HA LYS 5 -19.441 4.187 4.181 24 HB2 LYS 5 HB2 LYS 5 -20.526 5.842 5.888 25 HB3 LYS 5 HB3 LYS 5 -18.873 6.164 6.424 26 HG2 LYS 5 HG2 LYS 5 -18.662 6.305 3.635 27 HG3 LYS 5 HG3 LYS 5 -20.284 6.921 3.900 28 HD2 LYS 5 HD2 LYS 5 -17.758 7.981 5.241 29 HD3 LYS 5 HD3 LYS 5 -18.445 8.626 3.750 30 HE2 LYS 5 HE2 LYS 5 -20.561 9.165 4.977 31 HE3 LYS 5 HE3 LYS 5 -19.791 8.615 6.482 32 HZ1 LYS 5 HZ1 LYS 5 -18.679 10.801 4.794 33 HZ2 LYS 5 HZ2 LYS 5 -19.626 11.047 6.121 34 HZ3 LYS 5 HZ3 LYS 5 -18.147 10.325 6.243 35 H ILE 6 H ILE 6 -17.510 3.856 3.215 36 HA ILE 6 HA ILE 6 -15.003 4.143 4.728 37 HB ILE 6 HB ILE 6 -14.197 2.081 3.522 38 HG12 ILE 6 HG12 ILE 6 -16.316 1.879 2.011 39 HG13 ILE 6 HG13 ILE 6 -15.534 0.438 2.625 40 HG21 ILE 6 HG21 ILE 6 -16.220 1.682 5.735 41 HG22 ILE 6 HG22 ILE 6 -14.951 0.530 5.276 42 HG23 ILE 6 HG23 ILE 6 -14.512 2.116 5.928 43 HD11 ILE 6 HD11 ILE 6 -18.048 0.384 2.638 44 HD12 ILE 6 HD12 ILE 6 -17.302 0.014 4.191 45 HD13 ILE 6 HD13 ILE 6 -18.055 1.603 3.905 46 H HIS 7 H HIS 7 -13.400 5.020 3.468 47 HA HIS 7 HA HIS 7 -14.071 5.829 0.673 48 HB2 HIS 7 HB2 HIS 7 -11.827 6.745 2.532 49 HB3 HIS 7 HB3 HIS 7 -12.122 7.319 0.894 50 HD1 HIS 7 HD1 HIS 7 -14.670 8.508 0.564 51 HD2 HIS 7 HD2 HIS 7 -12.899 8.268 4.377 52 HE1 HIS 7 HE1 HIS 7 -15.886 10.215 2.043 53 H HIS 8 H HIS 8 -12.362 5.456 -0.968 54 HA HIS 8 HA HIS 8 -9.927 4.375 -0.505 55 HB2 HIS 8 HB2 HIS 8 -11.714 2.218 -0.333 56 HB3 HIS 8 HB3 HIS 8 -11.199 2.153 -1.970 57 HD1 HIS 8 HD1 HIS 8 -7.931 2.850 -1.479 58 HD2 HIS 8 HD2 HIS 8 -10.418 0.291 0.831 59 HE1 HIS 8 HE1 HIS 8 -6.445 1.179 -0.440 60 H HIS 9 H HIS 9 -9.301 3.175 -2.847 61 HA HIS 9 HA HIS 9 -8.858 3.341 -4.996 62 HB2 HIS 9 HB2 HIS 9 -11.743 4.129 -4.989 63 HB3 HIS 9 HB3 HIS 9 -10.840 4.600 -6.396 64 HD1 HIS 9 HD1 HIS 9 -11.010 1.167 -4.438 65 HD2 HIS 9 HD2 HIS 9 -10.973 2.927 -8.272 66 HE1 HIS 9 HE1 HIS 9 -11.365 -0.704 -6.100 67 H HIS 10 H HIS 10 -8.842 5.129 -6.897 68 HA HIS 10 HA HIS 10 -7.982 7.041 -7.702 69 HB2 HIS 10 HB2 HIS 10 -9.853 7.880 -5.829 70 HB3 HIS 10 HB3 HIS 10 -8.411 8.767 -5.381 71 HD1 HIS 10 HD1 HIS 10 -7.265 9.871 -8.035 72 HD2 HIS 10 HD2 HIS 10 -11.388 9.320 -7.261 73 HE1 HIS 10 HE1 HIS 10 -8.503 11.356 -9.639 74 H HIS 11 H HIS 11 -6.336 5.228 -5.846 75 HA HIS 11 HA HIS 11 -3.969 6.992 -6.067 76 HB2 HIS 11 HB2 HIS 11 -4.881 5.650 -3.605 77 HB3 HIS 11 HB3 HIS 11 -3.229 5.263 -4.063 78 HD1 HIS 11 HD1 HIS 11 -4.921 7.809 -2.086 79 HD2 HIS 11 HD2 HIS 11 -1.692 7.626 -4.782 80 HE1 HIS 11 HE1 HIS 11 -3.502 9.862 -1.655 81 H HIS 12 H HIS 12 -3.215 6.244 -7.900 82 HA HIS 12 HA HIS 12 -1.963 3.627 -7.813 83 HB2 HIS 12 HB2 HIS 12 -3.818 4.344 -10.107 84 HB3 HIS 12 HB3 HIS 12 -2.485 3.228 -10.274 85 HD1 HIS 12 HD1 HIS 12 -2.744 0.996 -8.284 86 HD2 HIS 12 HD2 HIS 12 -5.964 3.078 -9.991 87 HE1 HIS 12 HE1 HIS 12 -4.756 -0.568 -8.192 88 H MET 13 H MET 13 -0.169 5.115 -7.416 89 HA MET 13 HA MET 13 0.830 6.426 -9.919 90 HB2 MET 13 HB2 MET 13 0.807 7.483 -7.095 91 HB3 MET 13 HB3 MET 13 2.189 7.836 -8.136 92 HG2 MET 13 HG2 MET 13 0.769 8.871 -9.791 93 HG3 MET 13 HG3 MET 13 -0.684 8.485 -8.855 94 HE1 MET 13 HE1 MET 13 -1.701 10.246 -7.029 95 HE2 MET 13 HE2 MET 13 -0.660 9.028 -6.258 96 HE3 MET 13 HE3 MET 13 -0.525 10.726 -5.784 97 H PHE 14 H PHE 14 1.811 5.289 -6.694 98 HA PHE 14 HA PHE 14 3.756 4.323 -5.990 99 HB2 PHE 14 HB2 PHE 14 2.564 2.148 -7.704 100 HB3 PHE 14 HB3 PHE 14 3.466 2.003 -6.189 101 HD1 PHE 14 HD1 PHE 14 2.393 3.003 -4.046 102 HD2 PHE 14 HD2 PHE 14 0.219 2.120 -7.662 103 HE1 PHE 14 HE1 PHE 14 0.278 2.875 -2.768 104 HE2 PHE 14 HE2 PHE 14 -1.890 1.936 -6.333 105 HZ PHE 14 HZ PHE 14 -1.862 2.338 -3.905 106 HA PRO 15 HA PRO 15 6.385 4.766 -9.756 107 HB2 PRO 15 HB2 PRO 15 8.357 6.335 -8.748 108 HB3 PRO 15 HB3 PRO 15 6.759 6.938 -9.244 109 HG2 PRO 15 HG2 PRO 15 7.668 6.289 -6.437 110 HG3 PRO 15 HG3 PRO 15 6.812 7.747 -7.029 111 HD2 PRO 15 HD2 PRO 15 5.522 5.628 -5.883 112 HD3 PRO 15 HD3 PRO 15 4.767 6.625 -7.160 113 H TYR 16 H TYR 16 6.905 2.581 -9.875 114 HA TYR 16 HA TYR 16 9.509 1.840 -8.867 115 HB2 TYR 16 HB2 TYR 16 8.756 -0.087 -7.594 116 HB3 TYR 16 HB3 TYR 16 7.883 1.299 -7.020 117 HD1 TYR 16 HD1 TYR 16 7.566 -1.657 -9.331 118 HD2 TYR 16 HD2 TYR 16 5.541 1.311 -6.981 119 HE1 TYR 16 HE1 TYR 16 5.447 -2.655 -9.934 120 HE2 TYR 16 HE2 TYR 16 3.395 0.038 -7.292 121 HH TYR 16 HH TYR 16 3.099 -2.959 -8.995 122 H LYS 17 H LYS 17 9.952 -0.452 -9.665 123 HA LYS 17 HA LYS 17 8.660 -1.148 -12.242 124 HB2 LYS 17 HB2 LYS 17 10.799 0.286 -12.448 125 HB3 LYS 17 HB3 LYS 17 11.636 -1.098 -11.721 126 HG2 LYS 17 HG2 LYS 17 10.068 -1.961 -13.952 127 HG3 LYS 17 HG3 LYS 17 11.115 -0.638 -14.441 128 HD2 LYS 17 HD2 LYS 17 12.135 -3.028 -12.864 129 HD3 LYS 17 HD3 LYS 17 11.884 -3.093 -14.572 130 HE2 LYS 17 HE2 LYS 17 13.593 -0.853 -13.556 131 HE3 LYS 17 HE3 LYS 17 14.261 -2.499 -13.525 132 HZ1 LYS 17 HZ1 LYS 17 13.241 -1.068 -15.894 133 HZ2 LYS 17 HZ2 LYS 17 14.786 -1.465 -15.608 134 HZ3 LYS 17 HZ3 LYS 17 13.720 -2.661 -15.921 135 H ILE 18 H ILE 18 9.622 -3.377 -12.893 136 HA ILE 18 HA ILE 18 10.628 -5.120 -10.803 137 HB ILE 18 HB ILE 18 8.013 -5.735 -12.232 138 HG12 ILE 18 HG12 ILE 18 8.975 -5.763 -9.360 139 HG13 ILE 18 HG13 ILE 18 7.712 -4.721 -10.078 140 HG21 ILE 18 HG21 ILE 18 9.877 -7.785 -10.943 141 HG22 ILE 18 HG22 ILE 18 8.225 -8.098 -11.521 142 HG23 ILE 18 HG23 ILE 18 9.443 -7.668 -12.668 143 HD11 ILE 18 HD11 ILE 18 6.291 -6.802 -10.307 144 HD12 ILE 18 HD12 ILE 18 7.552 -7.668 -9.374 145 HD13 ILE 18 HD13 ILE 18 6.658 -6.317 -8.660 146 H VAL 19 H VAL 19 12.216 -6.482 -11.669 147 HA VAL 19 HA VAL 19 12.638 -6.534 -14.588 148 HB VAL 19 HB VAL 19 14.946 -7.062 -13.987 149 HG11 VAL 19 HG11 VAL 19 13.925 -4.504 -12.804 150 HG12 VAL 19 HG12 VAL 19 15.633 -4.817 -13.103 151 HG13 VAL 19 HG13 VAL 19 14.481 -4.758 -14.453 152 HG21 VAL 19 HG21 VAL 19 14.984 -8.075 -11.864 153 HG22 VAL 19 HG22 VAL 19 15.740 -6.508 -11.618 154 HG23 VAL 19 HG23 VAL 19 14.070 -6.750 -11.117 155 H ASP 20 H ASP 20 14.471 -8.910 -13.927 156 HA ASP 20 HA ASP 20 13.234 -11.048 -14.667 157 HB2 ASP 20 HB2 ASP 20 15.256 -10.933 -12.388 158 HB3 ASP 20 HB3 ASP 20 14.898 -12.337 -13.400 159 H ASP 21 H ASP 21 13.802 -10.649 -11.192 160 HA ASP 21 HA ASP 21 11.129 -11.665 -10.404 161 HB2 ASP 21 HB2 ASP 21 13.768 -12.805 -9.394 162 HB3 ASP 21 HB3 ASP 21 12.136 -13.281 -8.913 163 H VAL 22 H VAL 22 12.704 -9.019 -10.301 164 HA VAL 22 HA VAL 22 12.829 -8.658 -7.358 165 HB VAL 22 HB VAL 22 14.984 -7.481 -9.203 166 HG11 VAL 22 HG11 VAL 22 16.037 -7.372 -6.803 167 HG12 VAL 22 HG12 VAL 22 14.911 -6.116 -7.360 168 HG13 VAL 22 HG13 VAL 22 14.370 -7.376 -6.273 169 HG21 VAL 22 HG21 VAL 22 15.053 -9.995 -7.468 170 HG22 VAL 22 HG22 VAL 22 15.305 -9.896 -9.222 171 HG23 VAL 22 HG23 VAL 22 16.479 -9.177 -8.144 172 H VAL 23 H VAL 23 12.238 -6.611 -6.675 173 HA VAL 23 HA VAL 23 10.753 -4.954 -8.636 174 HB VAL 23 HB VAL 23 10.820 -4.959 -5.630 175 HG11 VAL 23 HG11 VAL 23 8.540 -4.010 -7.378 176 HG12 VAL 23 HG12 VAL 23 8.795 -3.780 -5.629 177 HG13 VAL 23 HG13 VAL 23 9.799 -2.928 -6.789 178 HG21 VAL 23 HG21 VAL 23 10.040 -7.251 -6.413 179 HG22 VAL 23 HG22 VAL 23 8.913 -6.330 -5.446 180 HG23 VAL 23 HG23 VAL 23 8.671 -6.426 -7.193 181 H ILE 24 H ILE 24 11.189 -2.674 -8.694 182 HA ILE 24 HA ILE 24 13.500 -1.678 -7.100 183 HB ILE 24 HB ILE 24 12.938 -1.141 -10.045 184 HG12 ILE 24 HG12 ILE 24 15.368 -2.137 -10.184 185 HG13 ILE 24 HG13 ILE 24 14.996 -2.861 -8.619 186 HG21 ILE 24 HG21 ILE 24 15.095 -0.170 -8.141 187 HG22 ILE 24 HG22 ILE 24 15.127 0.075 -9.910 188 HG23 ILE 24 HG23 ILE 24 13.850 0.793 -8.938 189 HD11 ILE 24 HD11 ILE 24 13.201 -4.189 -9.815 190 HD12 ILE 24 HD12 ILE 24 13.574 -3.231 -11.244 191 HD13 ILE 24 HD13 ILE 24 14.794 -4.365 -10.509 192 H LEU 25 H LEU 25 12.146 -0.638 -5.520 193 HA LEU 25 HA LEU 25 10.059 1.163 -5.988 194 HB2 LEU 25 HB2 LEU 25 11.958 0.222 -3.841 195 HB3 LEU 25 HB3 LEU 25 11.105 1.713 -3.558 196 HG LEU 25 HG LEU 25 9.271 0.777 -3.068 197 HD11 LEU 25 HD11 LEU 25 9.335 -1.226 -5.330 198 HD12 LEU 25 HD12 LEU 25 8.062 -1.120 -4.103 199 HD13 LEU 25 HD13 LEU 25 8.349 0.233 -5.151 200 HD21 LEU 25 HD21 LEU 25 10.115 -2.060 -3.033 201 HD22 LEU 25 HD22 LEU 25 11.064 -0.920 -2.082 202 HD23 LEU 25 HD23 LEU 25 9.309 -1.090 -1.795 203 H MET 26 H MET 26 10.408 3.069 -7.183 204 HA MET 26 HA MET 26 13.164 4.316 -7.110 205 HB2 MET 26 HB2 MET 26 10.990 4.426 -9.280 206 HB3 MET 26 HB3 MET 26 12.586 5.200 -9.304 207 HG2 MET 26 HG2 MET 26 13.488 2.808 -9.016 208 HG3 MET 26 HG3 MET 26 11.864 2.293 -9.448 209 HE1 MET 26 HE1 MET 26 15.370 3.433 -10.790 210 HE2 MET 26 HE2 MET 26 14.877 4.500 -12.132 211 HE3 MET 26 HE3 MET 26 14.458 4.926 -10.475 212 HA PRO 27 HA PRO 27 9.611 7.043 -5.304 213 HB2 PRO 27 HB2 PRO 27 11.081 8.028 -3.111 214 HB3 PRO 27 HB3 PRO 27 10.015 6.612 -3.115 215 HG2 PRO 27 HG2 PRO 27 12.909 6.626 -2.806 216 HG3 PRO 27 HG3 PRO 27 11.793 5.268 -2.840 217 HD2 PRO 27 HD2 PRO 27 13.391 6.419 -5.054 218 HD3 PRO 27 HD3 PRO 27 12.870 4.735 -4.774 219 H ASN 28 H ASN 28 9.755 9.409 -4.519 220 HA ASN 28 HA ASN 28 11.750 11.125 -5.731 221 HB2 ASN 28 HB2 ASN 28 10.152 12.247 -7.308 222 HB3 ASN 28 HB3 ASN 28 10.731 10.663 -7.760 223 HD21 ASN 28 HD21 ASN 28 7.703 12.406 -6.770 224 HD22 ASN 28 HD22 ASN 28 6.711 11.055 -7.284 225 H LYS 29 H LYS 29 8.273 11.559 -5.206 226 HA LYS 29 HA LYS 29 8.669 13.296 -2.833 227 HB2 LYS 29 HB2 LYS 29 7.477 14.137 -5.513 228 HB3 LYS 29 HB3 LYS 29 6.964 14.868 -4.008 229 HG2 LYS 29 HG2 LYS 29 8.538 16.351 -4.399 230 HG3 LYS 29 HG3 LYS 29 9.559 15.199 -3.575 231 HD2 LYS 29 HD2 LYS 29 10.709 16.077 -5.471 232 HD3 LYS 29 HD3 LYS 29 10.371 14.384 -5.829 233 HE2 LYS 29 HE2 LYS 29 8.627 14.951 -7.375 234 HE3 LYS 29 HE3 LYS 29 8.486 16.597 -6.736 235 HZ1 LYS 29 HZ1 LYS 29 10.563 17.148 -7.731 236 HZ2 LYS 29 HZ2 LYS 29 10.829 15.580 -8.221 237 HZ3 LYS 29 HZ3 LYS 29 9.627 16.412 -8.896 238 H GLU 30 H GLU 30 7.723 10.559 -3.228 239 HA GLU 30 HA GLU 30 4.786 10.708 -2.740 240 HB2 GLU 30 HB2 GLU 30 6.729 8.534 -3.506 241 HB3 GLU 30 HB3 GLU 30 5.238 8.106 -2.659 242 HG2 GLU 30 HG2 GLU 30 4.511 9.898 -4.771 243 HG3 GLU 30 HG3 GLU 30 5.696 8.775 -5.416 244 H LEU 31 H LEU 31 7.700 10.860 -0.887 245 HA LEU 31 HA LEU 31 6.589 9.102 1.235 246 HB2 LEU 31 HB2 LEU 31 9.139 10.701 1.044 247 HB3 LEU 31 HB3 LEU 31 8.588 9.894 2.484 248 HG LEU 31 HG LEU 31 9.332 7.975 1.974 249 HD11 LEU 31 HD11 LEU 31 7.584 7.831 -0.241 250 HD12 LEU 31 HD12 LEU 31 9.177 7.301 -0.791 251 HD13 LEU 31 HD13 LEU 31 8.387 6.570 0.624 252 HD21 LEU 31 HD21 LEU 31 10.756 9.370 -0.316 253 HD22 LEU 31 HD22 LEU 31 11.297 9.237 1.364 254 HD23 LEU 31 HD23 LEU 31 11.213 7.805 0.352 255 H ASN 32 H ASN 32 4.626 10.304 1.241 256 HA ASN 32 HA ASN 32 4.634 12.941 2.571 257 HB2 ASN 32 HB2 ASN 32 2.226 12.999 1.814 258 HB3 ASN 32 HB3 ASN 32 3.485 13.093 0.602 259 HD21 ASN 32 HD21 ASN 32 3.194 11.852 -1.153 260 HD22 ASN 32 HD22 ASN 32 2.559 10.237 -1.144 261 H ILE 33 H ILE 33 5.277 11.412 4.533 262 HA ILE 33 HA ILE 33 4.888 10.405 6.476 263 HB ILE 33 HB ILE 33 2.533 12.284 6.438 264 HG12 ILE 33 HG12 ILE 33 5.031 13.006 6.601 265 HG13 ILE 33 HG13 ILE 33 3.880 13.667 7.761 266 HG21 ILE 33 HG21 ILE 33 2.462 11.800 8.981 267 HG22 ILE 33 HG22 ILE 33 1.687 10.641 7.926 268 HG23 ILE 33 HG23 ILE 33 3.298 10.284 8.606 269 HD11 ILE 33 HD11 ILE 33 4.674 12.248 9.517 270 HD12 ILE 33 HD12 ILE 33 5.568 11.231 8.393 271 HD13 ILE 33 HD13 ILE 33 6.117 12.902 8.715 272 H GLU 34 H GLU 34 1.527 10.372 5.260 273 HA GLU 34 HA GLU 34 0.983 7.839 6.541 274 HB2 GLU 34 HB2 GLU 34 -0.463 9.378 4.360 275 HB3 GLU 34 HB3 GLU 34 -1.109 7.986 5.248 276 HG2 GLU 34 HG2 GLU 34 -0.619 9.420 7.397 277 HG3 GLU 34 HG3 GLU 34 -0.529 10.788 6.257 278 H ASN 35 H ASN 35 2.278 8.769 3.473 279 HA ASN 35 HA ASN 35 2.087 6.476 1.896 280 HB2 ASN 35 HB2 ASN 35 3.373 8.320 1.097 281 HB3 ASN 35 HB3 ASN 35 4.425 8.307 2.523 282 HD21 ASN 35 HD21 ASN 35 3.789 6.729 -0.584 283 HD22 ASN 35 HD22 ASN 35 5.182 5.689 -0.579 284 H ALA 36 H ALA 36 3.957 6.908 4.928 285 HA ALA 36 HA ALA 36 5.361 4.435 4.874 286 HB1 ALA 36 HB1 ALA 36 4.493 6.255 7.140 287 HB2 ALA 36 HB2 ALA 36 5.267 4.704 7.419 288 HB3 ALA 36 HB3 ALA 36 6.105 5.915 6.492 289 H HIS 37 H HIS 37 2.067 5.272 6.099 290 HA HIS 37 HA HIS 37 1.842 2.853 7.674 291 HB2 HIS 37 HB2 HIS 37 -0.151 4.979 6.801 292 HB3 HIS 37 HB3 HIS 37 -0.649 3.527 7.658 293 HD1 HIS 37 HD1 HIS 37 -1.039 6.420 8.898 294 HD2 HIS 37 HD2 HIS 37 2.022 3.661 9.758 295 HE1 HIS 37 HE1 HIS 37 -0.223 6.924 11.277 296 H LEU 38 H LEU 38 0.568 3.857 4.380 297 HA LEU 38 HA LEU 38 -0.416 1.116 4.080 298 HB2 LEU 38 HB2 LEU 38 -1.561 1.755 2.321 299 HB3 LEU 38 HB3 LEU 38 -1.433 3.299 3.122 300 HG LEU 38 HG LEU 38 -1.267 3.607 0.868 301 HD11 LEU 38 HD11 LEU 38 0.619 4.651 2.529 302 HD12 LEU 38 HD12 LEU 38 1.610 4.074 1.174 303 HD13 LEU 38 HD13 LEU 38 0.249 5.198 0.905 304 HD21 LEU 38 HD21 LEU 38 1.235 1.984 0.428 305 HD22 LEU 38 HD22 LEU 38 -0.352 1.198 0.434 306 HD23 LEU 38 HD23 LEU 38 -0.016 2.507 -0.708 307 H PHE 39 H PHE 39 2.595 2.811 3.466 308 HA PHE 39 HA PHE 39 3.775 1.531 1.441 309 HB2 PHE 39 HB2 PHE 39 4.810 2.993 3.518 310 HB3 PHE 39 HB3 PHE 39 5.433 1.440 3.958 311 HD1 PHE 39 HD1 PHE 39 5.193 3.742 0.922 312 HD2 PHE 39 HD2 PHE 39 7.445 0.807 3.134 313 HE1 PHE 39 HE1 PHE 39 7.123 4.160 -0.514 314 HE2 PHE 39 HE2 PHE 39 9.297 1.010 1.507 315 HZ PHE 39 HZ PHE 39 9.126 2.661 -0.347 316 H LYS 40 H LYS 40 3.655 0.205 4.764 317 HA LYS 40 HA LYS 40 4.879 -2.256 4.148 318 HB2 LYS 40 HB2 LYS 40 4.348 -1.281 6.468 319 HB3 LYS 40 HB3 LYS 40 2.700 -1.922 6.256 320 HG2 LYS 40 HG2 LYS 40 4.143 -4.092 5.557 321 HG3 LYS 40 HG3 LYS 40 5.347 -3.326 6.580 322 HD2 LYS 40 HD2 LYS 40 4.294 -4.744 8.059 323 HD3 LYS 40 HD3 LYS 40 3.358 -3.259 8.328 324 HE2 LYS 40 HE2 LYS 40 1.566 -4.072 6.869 325 HE3 LYS 40 HE3 LYS 40 2.562 -5.437 6.325 326 HZ1 LYS 40 HZ1 LYS 40 0.929 -6.092 7.980 327 HZ2 LYS 40 HZ2 LYS 40 2.449 -6.361 8.535 328 HZ3 LYS 40 HZ3 LYS 40 1.590 -5.087 9.092 329 H LYS 41 H LYS 41 1.366 -1.431 4.166 330 HA LYS 41 HA LYS 41 0.499 -4.064 3.542 331 HB2 LYS 41 HB2 LYS 41 -0.738 -1.456 3.949 332 HB3 LYS 41 HB3 LYS 41 -1.261 -2.033 2.387 333 HG2 LYS 41 HG2 LYS 41 -1.785 -4.294 3.502 334 HG3 LYS 41 HG3 LYS 41 -1.579 -3.468 5.046 335 HD2 LYS 41 HD2 LYS 41 -3.401 -1.947 4.558 336 HD3 LYS 41 HD3 LYS 41 -3.531 -2.528 2.885 337 HE2 LYS 41 HE2 LYS 41 -3.705 -4.617 5.023 338 HE3 LYS 41 HE3 LYS 41 -5.038 -3.460 4.991 339 HZ1 LYS 41 HZ1 LYS 41 -5.548 -4.096 2.786 340 HZ2 LYS 41 HZ2 LYS 41 -4.166 -4.968 2.614 341 HZ3 LYS 41 HZ3 LYS 41 -5.354 -5.500 3.623 342 H TRP 42 H TRP 42 1.225 -1.292 1.389 343 HA TRP 42 HA TRP 42 0.590 -2.649 -1.039 344 HB2 TRP 42 HB2 TRP 42 0.668 -0.338 -1.238 345 HB3 TRP 42 HB3 TRP 42 2.139 -0.197 -0.277 346 HD1 TRP 42 HD1 TRP 42 1.382 -1.879 -3.724 347 HE1 TRP 42 HE1 TRP 42 3.341 -1.376 -5.287 348 HE3 TRP 42 HE3 TRP 42 4.206 0.975 -0.573 349 HZ2 TRP 42 HZ2 TRP 42 5.869 0.037 -5.140 350 HZ3 TRP 42 HZ3 TRP 42 6.318 1.908 -1.299 351 HH2 TRP 42 HH2 TRP 42 7.170 1.513 -3.654 352 H VAL 43 H VAL 43 3.941 -1.901 0.260 353 HA VAL 43 HA VAL 43 5.263 -3.503 -1.528 354 HB VAL 43 HB VAL 43 5.939 -2.924 1.391 355 HG11 VAL 43 HG11 VAL 43 8.224 -3.360 0.962 356 HG12 VAL 43 HG12 VAL 43 7.371 -4.799 0.420 357 HG13 VAL 43 HG13 VAL 43 7.962 -3.619 -0.766 358 HG21 VAL 43 HG21 VAL 43 7.436 -1.159 0.404 359 HG22 VAL 43 HG22 VAL 43 6.756 -1.519 -1.198 360 HG23 VAL 43 HG23 VAL 43 5.738 -0.856 0.074 361 H PHE 44 H PHE 44 3.623 -4.628 1.489 362 HA PHE 44 HA PHE 44 4.487 -7.293 1.353 363 HB2 PHE 44 HB2 PHE 44 2.203 -5.823 2.636 364 HB3 PHE 44 HB3 PHE 44 2.059 -7.516 2.427 365 HD1 PHE 44 HD1 PHE 44 5.064 -5.486 3.594 366 HD2 PHE 44 HD2 PHE 44 2.149 -8.540 4.471 367 HE1 PHE 44 HE1 PHE 44 6.026 -5.769 5.883 368 HE2 PHE 44 HE2 PHE 44 3.096 -8.825 6.718 369 HZ PHE 44 HZ PHE 44 5.070 -7.453 7.431 370 H ASP 45 H ASP 45 1.404 -5.903 0.400 371 HA ASP 45 HA ASP 45 0.156 -8.192 -0.754 372 HB2 ASP 45 HB2 ASP 45 -1.044 -6.077 -0.197 373 HB3 ASP 45 HB3 ASP 45 -0.284 -5.285 -1.577 374 H GLU 46 H GLU 46 2.075 -5.674 -2.235 375 HA GLU 46 HA GLU 46 1.536 -6.482 -4.937 376 HB2 GLU 46 HB2 GLU 46 1.601 -4.177 -3.954 377 HB3 GLU 46 HB3 GLU 46 3.342 -4.334 -3.719 378 HG2 GLU 46 HG2 GLU 46 2.238 -2.975 -5.697 379 HG3 GLU 46 HG3 GLU 46 3.766 -3.756 -5.873 380 H PHE 47 H PHE 47 4.203 -6.952 -2.578 381 HA PHE 47 HA PHE 47 5.538 -8.512 -4.708 382 HB2 PHE 47 HB2 PHE 47 7.217 -7.172 -2.636 383 HB3 PHE 47 HB3 PHE 47 7.589 -7.761 -4.252 384 HD1 PHE 47 HD1 PHE 47 6.150 -6.426 -6.213 385 HD2 PHE 47 HD2 PHE 47 7.257 -4.923 -2.337 386 HE1 PHE 47 HE1 PHE 47 5.841 -4.106 -7.026 387 HE2 PHE 47 HE2 PHE 47 6.851 -2.596 -3.119 388 HZ PHE 47 HZ PHE 47 6.176 -2.190 -5.494 389 H LEU 48 H LEU 48 5.674 -8.013 -1.135 390 HA LEU 48 HA LEU 48 7.010 -10.463 -0.770 391 HB2 LEU 48 HB2 LEU 48 5.255 -9.112 1.317 392 HB3 LEU 48 HB3 LEU 48 6.621 -10.200 1.611 393 HG LEU 48 HG LEU 48 6.697 -7.363 0.545 394 HD11 LEU 48 HD11 LEU 48 6.495 -7.748 3.006 395 HD12 LEU 48 HD12 LEU 48 8.074 -8.572 2.952 396 HD13 LEU 48 HD13 LEU 48 7.934 -6.863 2.426 397 HD21 LEU 48 HD21 LEU 48 9.144 -7.545 0.544 398 HD22 LEU 48 HD22 LEU 48 9.020 -9.306 0.755 399 HD23 LEU 48 HD23 LEU 48 8.404 -8.535 -0.729 400 H ASN 49 H ASN 49 3.662 -9.700 -0.168 401 HA ASN 49 HA ASN 49 2.718 -12.355 0.534 402 HB2 ASN 49 HB2 ASN 49 1.579 -9.618 0.172 403 HB3 ASN 49 HB3 ASN 49 0.478 -10.892 -0.227 404 HD21 ASN 49 HD21 ASN 49 0.344 -8.941 2.049 405 HD22 ASN 49 HD22 ASN 49 0.277 -9.991 3.455 406 H LYS 50 H LYS 50 3.161 -10.489 -2.403 407 HA LYS 50 HA LYS 50 1.743 -12.271 -4.190 408 HB2 LYS 50 HB2 LYS 50 3.357 -9.842 -4.351 409 HB3 LYS 50 HB3 LYS 50 3.995 -10.980 -5.496 410 HG2 LYS 50 HG2 LYS 50 1.130 -11.009 -5.771 411 HG3 LYS 50 HG3 LYS 50 1.636 -9.322 -5.554 412 HD2 LYS 50 HD2 LYS 50 3.255 -9.587 -7.418 413 HD3 LYS 50 HD3 LYS 50 2.615 -11.212 -7.722 414 HE2 LYS 50 HE2 LYS 50 1.138 -8.551 -7.894 415 HE3 LYS 50 HE3 LYS 50 1.612 -9.580 -9.248 416 HZ1 LYS 50 HZ1 LYS 50 0.040 -11.244 -8.477 417 HZ2 LYS 50 HZ2 LYS 50 -0.363 -10.307 -7.170 418 HZ3 LYS 50 HZ3 LYS 50 -0.723 -9.797 -8.676 419 H GLY 51 H GLY 51 4.826 -12.447 -2.523 420 HA2 GLY 51 HA2 GLY 51 5.689 -14.694 -2.209 421 HA3 GLY 51 HA3 GLY 51 5.482 -14.991 -3.933 422 H TYR 52 H TYR 52 6.561 -11.806 -3.744 423 HA TYR 52 HA TYR 52 9.168 -12.476 -4.717 424 HB2 TYR 52 HB2 TYR 52 7.930 -9.860 -3.922 425 HB3 TYR 52 HB3 TYR 52 9.584 -9.974 -4.464 426 HD1 TYR 52 HD1 TYR 52 6.069 -10.420 -5.586 427 HD2 TYR 52 HD2 TYR 52 10.200 -10.299 -6.762 428 HE1 TYR 52 HE1 TYR 52 5.371 -10.379 -7.935 429 HE2 TYR 52 HE2 TYR 52 9.524 -10.380 -9.146 430 HH TYR 52 HH TYR 52 6.223 -9.995 -10.261 431 H ASN 53 H ASN 53 11.156 -11.889 -3.855 432 HA ASN 53 HA ASN 53 11.335 -11.657 -0.879 433 HB2 ASN 53 HB2 ASN 53 12.563 -13.679 -2.765 434 HB3 ASN 53 HB3 ASN 53 13.344 -13.292 -1.254 435 HD21 ASN 53 HD21 ASN 53 11.503 -13.334 0.793 436 HD22 ASN 53 HD22 ASN 53 10.837 -14.969 0.719 437 H LYS 54 H LYS 54 12.009 -10.025 -3.705 438 HA LYS 54 HA LYS 54 14.574 -8.984 -2.642 439 HB2 LYS 54 HB2 LYS 54 14.045 -10.282 -5.300 440 HB3 LYS 54 HB3 LYS 54 15.270 -9.045 -5.136 441 HG2 LYS 54 HG2 LYS 54 16.721 -10.294 -4.021 442 HG3 LYS 54 HG3 LYS 54 15.536 -11.100 -3.020 443 HD2 LYS 54 HD2 LYS 54 15.908 -11.795 -5.957 444 HD3 LYS 54 HD3 LYS 54 16.793 -12.587 -4.638 445 HE2 LYS 54 HE2 LYS 54 14.801 -13.442 -3.647 446 HE3 LYS 54 HE3 LYS 54 13.775 -12.352 -4.588 447 HZ1 LYS 54 HZ1 LYS 54 15.347 -14.587 -5.725 448 HZ2 LYS 54 HZ2 LYS 54 13.747 -14.607 -5.483 449 HZ3 LYS 54 HZ3 LYS 54 14.373 -13.607 -6.597 450 H ILE 55 H ILE 55 14.542 -6.853 -2.550 451 HA ILE 55 HA ILE 55 12.846 -5.200 -4.324 452 HB ILE 55 HB ILE 55 12.708 -5.498 -1.298 453 HG12 ILE 55 HG12 ILE 55 10.185 -4.883 -2.174 454 HG13 ILE 55 HG13 ILE 55 10.837 -5.495 -3.652 455 HG21 ILE 55 HG21 ILE 55 11.491 -3.298 -1.127 456 HG22 ILE 55 HG22 ILE 55 13.224 -3.166 -1.392 457 HG23 ILE 55 HG23 ILE 55 12.112 -2.896 -2.702 458 HD11 ILE 55 HD11 ILE 55 10.239 -6.940 -1.141 459 HD12 ILE 55 HD12 ILE 55 9.921 -7.417 -2.811 460 HD13 ILE 55 HD13 ILE 55 11.540 -7.587 -2.096 461 H PHE 56 H PHE 56 13.680 -3.050 -4.472 462 HA PHE 56 HA PHE 56 16.313 -2.457 -3.323 463 HB2 PHE 56 HB2 PHE 56 15.612 -2.340 -6.280 464 HB3 PHE 56 HB3 PHE 56 17.060 -1.687 -5.539 465 HD1 PHE 56 HD1 PHE 56 17.628 -3.986 -3.548 466 HD2 PHE 56 HD2 PHE 56 16.578 -3.924 -7.769 467 HE1 PHE 56 HE1 PHE 56 18.870 -6.058 -3.934 468 HE2 PHE 56 HE2 PHE 56 17.753 -6.029 -8.118 469 HZ PHE 56 HZ PHE 56 18.927 -7.125 -6.191 470 H LEU 57 H LEU 57 16.221 -0.456 -2.445 471 HA LEU 57 HA LEU 57 14.060 1.410 -3.309 472 HB2 LEU 57 HB2 LEU 57 14.337 1.021 -0.886 473 HB3 LEU 57 HB3 LEU 57 16.068 1.384 -1.013 474 HG LEU 57 HG LEU 57 15.597 3.729 -1.571 475 HD11 LEU 57 HD11 LEU 57 13.537 3.608 -2.786 476 HD12 LEU 57 HD12 LEU 57 12.701 2.805 -1.453 477 HD13 LEU 57 HD13 LEU 57 13.204 4.506 -1.302 478 HD21 LEU 57 HD21 LEU 57 14.609 4.381 0.623 479 HD22 LEU 57 HD22 LEU 57 14.182 2.672 0.892 480 HD23 LEU 57 HD23 LEU 57 15.877 3.158 0.752 481 H VAL 58 H VAL 58 14.581 2.852 -4.899 482 HA VAL 58 HA VAL 58 17.407 3.566 -5.242 483 HB VAL 58 HB VAL 58 16.954 3.976 -7.323 484 HG11 VAL 58 HG11 VAL 58 14.502 2.401 -7.156 485 HG12 VAL 58 HG12 VAL 58 15.623 2.638 -8.511 486 HG13 VAL 58 HG13 VAL 58 16.152 1.778 -7.067 487 HG21 VAL 58 HG21 VAL 58 15.049 5.061 -8.342 488 HG22 VAL 58 HG22 VAL 58 14.678 5.590 -6.665 489 HG23 VAL 58 HG23 VAL 58 16.249 5.934 -7.399 490 H LEU 59 H LEU 59 18.206 5.672 -5.148 491 HA LEU 59 HA LEU 59 16.429 7.665 -3.824 492 HB2 LEU 59 HB2 LEU 59 19.341 7.129 -3.140 493 HB3 LEU 59 HB3 LEU 59 18.277 8.328 -2.432 494 HG LEU 59 HG LEU 59 16.758 6.125 -1.933 495 HD11 LEU 59 HD11 LEU 59 19.652 5.129 -1.821 496 HD12 LEU 59 HD12 LEU 59 18.242 4.319 -1.105 497 HD13 LEU 59 HD13 LEU 59 18.378 4.475 -2.859 498 HD21 LEU 59 HD21 LEU 59 17.538 6.117 0.296 499 HD22 LEU 59 HD22 LEU 59 19.102 6.810 -0.209 500 HD23 LEU 59 HD23 LEU 59 17.619 7.795 -0.331 501 H SER 60 H SER 60 17.870 7.108 -6.682 502 HA SER 60 HA SER 60 19.571 9.237 -7.162 503 HB2 SER 60 HB2 SER 60 18.551 7.196 -8.664 504 HB3 SER 60 HB3 SER 60 17.717 8.570 -9.407 505 HG SER 60 HG SER 60 19.798 9.517 -9.719 506 H ASP 61 H ASP 61 15.979 9.325 -7.162 507 HA ASP 61 HA ASP 61 15.948 12.193 -7.887 508 HB2 ASP 61 HB2 ASP 61 14.424 10.316 -8.793 509 HB3 ASP 61 HB3 ASP 61 13.600 10.401 -7.231 510 H VAL 62 H VAL 62 16.293 10.393 -4.993 511 HA VAL 62 HA VAL 62 14.513 12.195 -3.451 512 HB VAL 62 HB VAL 62 15.424 9.455 -2.511 513 HG11 VAL 62 HG11 VAL 62 13.561 9.770 -0.929 514 HG12 VAL 62 HG12 VAL 62 14.651 11.163 -0.835 515 HG13 VAL 62 HG13 VAL 62 13.103 11.290 -1.718 516 HG21 VAL 62 HG21 VAL 62 14.135 8.944 -4.471 517 HG22 VAL 62 HG22 VAL 62 13.090 8.747 -3.065 518 HG23 VAL 62 HG23 VAL 62 12.940 10.202 -4.072 519 H GLU 63 H GLU 63 15.626 13.681 -2.370 520 HA GLU 63 HA GLU 63 18.530 13.350 -2.048 521 HB2 GLU 63 HB2 GLU 63 18.392 15.574 -2.179 522 HB3 GLU 63 HB3 GLU 63 16.657 15.505 -2.224 523 HG2 GLU 63 HG2 GLU 63 16.393 15.805 0.110 524 HG3 GLU 63 HG3 GLU 63 18.127 15.548 0.414 525 H SER 64 H SER 64 15.493 13.230 -0.023 526 HA SER 64 HA SER 64 17.095 11.965 2.052 527 HB2 SER 64 HB2 SER 64 16.623 13.665 3.756 528 HB3 SER 64 HB3 SER 64 17.502 14.386 2.413 529 HG SER 64 HG SER 64 15.498 15.190 1.634 530 H ILE 65 H ILE 65 15.849 11.501 4.103 531 HA ILE 65 HA ILE 65 13.038 11.121 3.573 532 HB ILE 65 HB ILE 65 14.168 9.093 2.915 533 HG12 ILE 65 HG12 ILE 65 13.132 8.285 5.591 534 HG13 ILE 65 HG13 ILE 65 11.999 9.101 4.520 535 HG21 ILE 65 HG21 ILE 65 15.307 8.998 5.755 536 HG22 ILE 65 HG22 ILE 65 15.374 7.657 4.595 537 HG23 ILE 65 HG23 ILE 65 16.201 9.154 4.229 538 HD11 ILE 65 HD11 ILE 65 12.307 6.496 4.391 539 HD12 ILE 65 HD12 ILE 65 12.052 7.455 2.912 540 HD13 ILE 65 HD13 ILE 65 13.667 6.871 3.345 541 H ASP 66 H ASP 66 11.835 10.835 5.530 542 HA ASP 66 HA ASP 66 12.892 12.537 7.721 543 HB2 ASP 66 HB2 ASP 66 10.228 11.812 6.608 544 HB3 ASP 66 HB3 ASP 66 10.281 11.814 8.362 545 H SER 67 H SER 67 12.433 11.815 9.940 546 HA SER 67 HA SER 67 13.176 9.066 10.431 547 HB2 SER 67 HB2 SER 67 13.036 9.648 12.764 548 HB3 SER 67 HB3 SER 67 14.021 10.761 11.850 549 HG SER 67 HG SER 67 12.000 12.137 11.810 550 H PHE 68 H PHE 68 10.198 10.217 9.371 551 HA PHE 68 HA PHE 68 8.718 7.994 10.526 552 HB2 PHE 68 HB2 PHE 68 6.960 8.952 9.585 553 HB3 PHE 68 HB3 PHE 68 7.890 10.371 9.515 554 HD1 PHE 68 HD1 PHE 68 6.818 7.475 7.699 555 HD2 PHE 68 HD2 PHE 68 8.154 11.554 7.381 556 HE1 PHE 68 HE1 PHE 68 6.259 7.454 5.171 557 HE2 PHE 68 HE2 PHE 68 7.612 11.533 4.944 558 HZ PHE 68 HZ PHE 68 6.657 9.475 3.828 559 H SER 69 H SER 69 9.684 8.481 7.094 560 HA SER 69 HA SER 69 8.981 5.765 6.809 561 HB2 SER 69 HB2 SER 69 10.272 6.474 4.442 562 HB3 SER 69 HB3 SER 69 8.573 6.547 4.833 563 HG SER 69 HG SER 69 8.681 8.666 5.245 564 H LEU 70 H LEU 70 12.031 7.284 7.342 565 HA LEU 70 HA LEU 70 13.930 5.557 6.433 566 HB2 LEU 70 HB2 LEU 70 14.279 7.662 7.730 567 HB3 LEU 70 HB3 LEU 70 13.532 6.916 9.139 568 HG LEU 70 HG LEU 70 15.475 5.313 9.251 569 HD11 LEU 70 HD11 LEU 70 16.677 7.278 7.239 570 HD12 LEU 70 HD12 LEU 70 17.533 5.954 8.051 571 HD13 LEU 70 HD13 LEU 70 16.229 5.592 6.890 572 HD21 LEU 70 HD21 LEU 70 15.252 8.062 10.067 573 HD22 LEU 70 HD22 LEU 70 16.144 6.768 10.824 574 HD23 LEU 70 HD23 LEU 70 16.936 7.787 9.611 575 H GLY 71 H GLY 71 11.723 4.985 9.176 576 HA2 GLY 71 HA2 GLY 71 13.133 2.401 9.646 577 HA3 GLY 71 HA3 GLY 71 12.252 3.211 10.878 578 H VAL 72 H VAL 72 10.620 3.339 7.934 579 HA VAL 72 HA VAL 72 8.842 1.036 8.392 580 HB VAL 72 HB VAL 72 9.124 3.145 6.222 581 HG11 VAL 72 HG11 VAL 72 7.002 2.514 5.360 582 HG12 VAL 72 HG12 VAL 72 8.133 1.149 5.302 583 HG13 VAL 72 HG13 VAL 72 6.846 1.193 6.548 584 HG21 VAL 72 HG21 VAL 72 7.405 4.342 7.020 585 HG22 VAL 72 HG22 VAL 72 6.762 3.068 8.102 586 HG23 VAL 72 HG23 VAL 72 8.224 3.996 8.532 587 H ILE 73 H ILE 73 11.390 2.399 6.225 588 HA ILE 73 HA ILE 73 11.591 0.262 4.427 589 HB ILE 73 HB ILE 73 13.389 2.507 5.414 590 HG12 ILE 73 HG12 ILE 73 12.801 2.219 2.525 591 HG13 ILE 73 HG13 ILE 73 11.320 2.184 3.441 592 HG21 ILE 73 HG21 ILE 73 14.936 1.994 3.453 593 HG22 ILE 73 HG22 ILE 73 15.095 0.956 4.890 594 HG23 ILE 73 HG23 ILE 73 14.169 0.383 3.495 595 HD11 ILE 73 HD11 ILE 73 12.790 4.461 2.700 596 HD12 ILE 73 HD12 ILE 73 11.370 4.355 3.778 597 HD13 ILE 73 HD13 ILE 73 13.005 4.343 4.451 598 H VAL 74 H VAL 74 13.758 0.786 7.277 599 HA VAL 74 HA VAL 74 14.950 -1.768 7.319 600 HB VAL 74 HB VAL 74 15.280 0.316 8.681 601 HG11 VAL 74 HG11 VAL 74 14.219 0.776 10.586 602 HG12 VAL 74 HG12 VAL 74 13.001 0.449 9.211 603 HG13 VAL 74 HG13 VAL 74 13.269 -0.766 10.540 604 HG21 VAL 74 HG21 VAL 74 14.781 -2.435 10.023 605 HG22 VAL 74 HG22 VAL 74 16.275 -2.037 9.050 606 HG23 VAL 74 HG23 VAL 74 15.982 -1.216 10.650 607 H ASN 75 H ASN 75 11.906 -0.878 8.871 608 HA ASN 75 HA ASN 75 11.393 -3.348 9.990 609 HB2 ASN 75 HB2 ASN 75 9.875 -1.031 9.518 610 HB3 ASN 75 HB3 ASN 75 9.112 -2.289 8.576 611 HD21 ASN 75 HD21 ASN 75 9.160 -0.787 11.559 612 HD22 ASN 75 HD22 ASN 75 8.718 -2.193 12.592 613 H ILE 76 H ILE 76 10.577 -2.367 6.686 614 HA ILE 76 HA ILE 76 9.569 -4.783 5.735 615 HB ILE 76 HB ILE 76 10.875 -2.351 4.516 616 HG12 ILE 76 HG12 ILE 76 8.061 -3.437 4.203 617 HG13 ILE 76 HG13 ILE 76 8.517 -2.219 5.443 618 HG21 ILE 76 HG21 ILE 76 10.395 -3.145 2.256 619 HG22 ILE 76 HG22 ILE 76 11.603 -4.131 3.031 620 HG23 ILE 76 HG23 ILE 76 9.925 -4.723 2.934 621 HD11 ILE 76 HD11 ILE 76 8.838 -1.710 2.474 622 HD12 ILE 76 HD12 ILE 76 7.469 -1.269 3.469 623 HD13 ILE 76 HD13 ILE 76 9.081 -0.617 3.822 624 H LEU 77 H LEU 77 12.961 -3.689 6.078 625 HA LEU 77 HA LEU 77 14.254 -5.943 4.756 626 HB2 LEU 77 HB2 LEU 77 15.604 -4.026 5.127 627 HB3 LEU 77 HB3 LEU 77 15.187 -3.945 6.802 628 HG LEU 77 HG LEU 77 16.329 -5.901 7.333 629 HD11 LEU 77 HD11 LEU 77 16.995 -6.151 4.327 630 HD12 LEU 77 HD12 LEU 77 17.779 -7.130 5.601 631 HD13 LEU 77 HD13 LEU 77 16.081 -7.357 5.234 632 HD21 LEU 77 HD21 LEU 77 17.884 -4.309 5.408 633 HD22 LEU 77 HD22 LEU 77 17.438 -3.770 7.053 634 HD23 LEU 77 HD23 LEU 77 18.514 -5.205 6.826 635 H LYS 78 H LYS 78 13.384 -5.171 8.162 636 HA LYS 78 HA LYS 78 14.234 -7.690 9.248 637 HB2 LYS 78 HB2 LYS 78 12.139 -5.873 10.502 638 HB3 LYS 78 HB3 LYS 78 13.256 -7.006 11.278 639 HG2 LYS 78 HG2 LYS 78 15.184 -5.537 10.499 640 HG3 LYS 78 HG3 LYS 78 13.946 -4.389 10.024 641 HD2 LYS 78 HD2 LYS 78 13.006 -4.318 12.280 642 HD3 LYS 78 HD3 LYS 78 14.379 -5.379 12.824 643 HE2 LYS 78 HE2 LYS 78 15.885 -3.453 12.055 644 HE3 LYS 78 HE3 LYS 78 14.393 -2.511 11.847 645 HZ1 LYS 78 HZ1 LYS 78 13.948 -2.833 14.195 646 HZ2 LYS 78 HZ2 LYS 78 15.373 -3.635 14.398 647 HZ3 LYS 78 HZ3 LYS 78 15.395 -2.056 13.958 648 H SER 79 H SER 79 11.925 -7.226 7.172 649 HA SER 79 HA SER 79 10.019 -9.318 8.211 650 HB2 SER 79 HB2 SER 79 8.901 -7.186 7.680 651 HB3 SER 79 HB3 SER 79 9.619 -7.198 6.069 652 HG SER 79 HG SER 79 7.815 -9.146 7.065 653 H ILE 80 H ILE 80 11.683 -8.163 5.202 654 HA ILE 80 HA ILE 80 11.475 -10.592 3.778 655 HB ILE 80 HB ILE 80 13.483 -8.301 3.654 656 HG12 ILE 80 HG12 ILE 80 11.165 -9.090 1.810 657 HG13 ILE 80 HG13 ILE 80 11.025 -7.862 3.064 658 HG21 ILE 80 HG21 ILE 80 13.054 -10.541 1.629 659 HG22 ILE 80 HG22 ILE 80 14.215 -9.197 1.487 660 HG23 ILE 80 HG23 ILE 80 14.462 -10.402 2.717 661 HD11 ILE 80 HD11 ILE 80 11.419 -6.914 0.857 662 HD12 ILE 80 HD12 ILE 80 12.722 -6.474 1.986 663 HD13 ILE 80 HD13 ILE 80 12.962 -7.703 0.708 664 H SER 81 H SER 81 14.078 -9.445 6.023 665 HA SER 81 HA SER 81 15.622 -11.832 5.752 666 HB2 SER 81 HB2 SER 81 15.669 -9.410 7.502 667 HB3 SER 81 HB3 SER 81 16.422 -10.875 8.155 668 HG SER 81 HG SER 81 17.768 -11.000 6.501 669 H SER 82 H SER 82 12.671 -11.261 7.537 670 HA SER 82 HA SER 82 13.054 -13.683 9.156 671 HB2 SER 82 HB2 SER 82 10.635 -11.904 8.764 672 HB3 SER 82 HB3 SER 82 10.748 -13.310 9.846 673 HG SER 82 HG SER 82 11.581 -12.069 11.227 674 H SER 83 H SER 83 11.590 -12.671 6.115 675 HA SER 83 HA SER 83 10.046 -15.056 5.724 676 HB2 SER 83 HB2 SER 83 10.930 -12.897 3.755 677 HB3 SER 83 HB3 SER 83 9.701 -14.132 3.450 678 HG SER 83 HG SER 83 9.668 -12.171 5.537 679 H GLY 84 H GLY 84 13.033 -13.870 4.038 680 HA2 GLY 84 HA2 GLY 84 14.587 -16.052 3.744 681 HA3 GLY 84 HA3 GLY 84 13.206 -16.498 2.730 682 H GLY 85 H GLY 85 14.418 -13.067 2.937 683 HA2 GLY 85 HA2 GLY 85 15.242 -13.355 0.080 684 HA3 GLY 85 HA3 GLY 85 14.052 -12.182 0.624 685 H PHE 86 H PHE 86 15.577 -10.698 -0.405 686 HA PHE 86 HA PHE 86 17.620 -9.678 1.466 687 HB2 PHE 86 HB2 PHE 86 18.133 -10.684 -1.308 688 HB3 PHE 86 HB3 PHE 86 18.821 -9.145 -0.892 689 HD1 PHE 86 HD1 PHE 86 18.726 -12.738 0.006 690 HD2 PHE 86 HD2 PHE 86 20.835 -8.986 0.611 691 HE1 PHE 86 HE1 PHE 86 20.512 -13.911 1.259 692 HE2 PHE 86 HE2 PHE 86 22.549 -10.182 1.880 693 HZ PHE 86 HZ PHE 86 22.435 -12.647 2.177 694 H PHE 87 H PHE 87 17.843 -7.403 1.338 695 HA PHE 87 HA PHE 87 16.493 -6.005 -0.831 696 HB2 PHE 87 HB2 PHE 87 14.609 -5.910 0.457 697 HB3 PHE 87 HB3 PHE 87 15.491 -5.991 1.978 698 HD1 PHE 87 HD1 PHE 87 15.598 -3.440 -0.918 699 HD2 PHE 87 HD2 PHE 87 14.867 -4.267 3.258 700 HE1 PHE 87 HE1 PHE 87 15.326 -1.049 -0.454 701 HE2 PHE 87 HE2 PHE 87 14.737 -1.801 3.778 702 HZ PHE 87 HZ PHE 87 15.026 -0.205 1.779 703 H ALA 88 H ALA 88 17.318 -3.971 -1.205 704 HA ALA 88 HA ALA 88 19.558 -2.948 0.341 705 HB1 ALA 88 HB1 ALA 88 19.917 -3.980 -2.480 706 HB2 ALA 88 HB2 ALA 88 21.125 -3.170 -1.439 707 HB3 ALA 88 HB3 ALA 88 20.487 -4.779 -1.017 708 H LEU 89 H LEU 89 20.553 -0.999 -1.049 709 HA LEU 89 HA LEU 89 18.303 0.419 -2.326 710 HB2 LEU 89 HB2 LEU 89 20.095 2.297 -1.051 711 HB3 LEU 89 HB3 LEU 89 18.359 2.186 -1.077 712 HG LEU 89 HG LEU 89 20.183 0.911 0.958 713 HD11 LEU 89 HD11 LEU 89 19.878 3.362 1.108 714 HD12 LEU 89 HD12 LEU 89 18.126 3.138 1.176 715 HD13 LEU 89 HD13 LEU 89 19.164 2.494 2.473 716 HD21 LEU 89 HD21 LEU 89 18.501 -0.625 0.977 717 HD22 LEU 89 HD22 LEU 89 17.930 0.525 2.183 718 HD23 LEU 89 HD23 LEU 89 17.239 0.533 0.541 719 H VAL 90 H VAL 90 19.103 2.441 -3.614 720 HA VAL 90 HA VAL 90 21.395 1.612 -5.310 721 HB VAL 90 HB VAL 90 18.489 2.163 -6.074 722 HG11 VAL 90 HG11 VAL 90 19.282 1.255 -8.353 723 HG12 VAL 90 HG12 VAL 90 19.609 2.923 -7.886 724 HG13 VAL 90 HG13 VAL 90 20.902 1.714 -7.758 725 HG21 VAL 90 HG21 VAL 90 18.082 -0.045 -6.594 726 HG22 VAL 90 HG22 VAL 90 19.732 -0.564 -6.120 727 HG23 VAL 90 HG23 VAL 90 18.574 0.039 -4.934 728 H SER 91 H SER 91 22.357 3.293 -6.405 729 HA SER 91 HA SER 91 23.079 5.396 -6.676 730 HB2 SER 91 HB2 SER 91 21.129 5.004 -8.341 731 HB3 SER 91 HB3 SER 91 20.210 6.128 -7.334 732 HG SER 91 HG SER 91 21.159 7.232 -8.992 733 HA PRO 92 HA PRO 92 21.360 6.654 -2.478 734 HB2 PRO 92 HB2 PRO 92 23.490 6.059 -0.852 735 HB3 PRO 92 HB3 PRO 92 22.340 4.831 -1.389 736 HG2 PRO 92 HG2 PRO 92 25.046 5.520 -2.575 737 HG3 PRO 92 HG3 PRO 92 24.385 3.891 -2.213 738 HD2 PRO 92 HD2 PRO 92 24.326 5.008 -4.706 739 HD3 PRO 92 HD3 PRO 92 23.102 3.854 -4.087 740 H ASN 93 H ASN 93 23.144 7.958 -0.761 741 HA ASN 93 HA ASN 93 24.700 9.846 -2.217 742 HB2 ASN 93 HB2 ASN 93 23.421 11.828 -1.310 743 HB3 ASN 93 HB3 ASN 93 22.775 10.981 -2.681 744 HD21 ASN 93 HD21 ASN 93 21.482 12.716 -0.526 745 HD22 ASN 93 HD22 ASN 93 20.090 11.774 -0.108 746 H GLU 94 H GLU 94 25.998 11.029 -0.802 747 HA GLU 94 HA GLU 94 26.888 9.661 1.485 748 HB2 GLU 94 HB2 GLU 94 28.227 11.128 0.070 749 HB3 GLU 94 HB3 GLU 94 27.317 12.542 0.622 750 HG2 GLU 94 HG2 GLU 94 28.171 12.330 2.847 751 HG3 GLU 94 HG3 GLU 94 28.939 10.766 2.472 752 H LYS 95 H LYS 95 24.321 11.914 1.204 753 HA LYS 95 HA LYS 95 24.120 12.750 3.994 754 HB2 LYS 95 HB2 LYS 95 23.418 14.148 2.189 755 HB3 LYS 95 HB3 LYS 95 22.334 12.993 1.535 756 HG2 LYS 95 HG2 LYS 95 21.865 13.873 4.390 757 HG3 LYS 95 HG3 LYS 95 21.550 15.024 3.079 758 HD2 LYS 95 HD2 LYS 95 19.786 13.949 2.264 759 HD3 LYS 95 HD3 LYS 95 20.416 12.346 2.511 760 HE2 LYS 95 HE2 LYS 95 18.926 14.053 4.503 761 HE3 LYS 95 HE3 LYS 95 18.521 12.450 3.728 762 HZ1 LYS 95 HZ1 LYS 95 20.816 12.113 5.194 763 HZ2 LYS 95 HZ2 LYS 95 19.637 12.744 6.180 764 HZ3 LYS 95 HZ3 LYS 95 19.350 11.402 5.250 765 H VAL 96 H VAL 96 22.653 10.351 1.865 766 HA VAL 96 HA VAL 96 20.885 9.165 3.980 767 HB VAL 96 HB VAL 96 21.762 8.525 1.142 768 HG11 VAL 96 HG11 VAL 96 20.470 6.320 1.480 769 HG12 VAL 96 HG12 VAL 96 22.163 6.390 1.993 770 HG13 VAL 96 HG13 VAL 96 20.886 6.551 3.187 771 HG21 VAL 96 HG21 VAL 96 19.701 9.863 1.952 772 HG22 VAL 96 HG22 VAL 96 19.458 8.625 0.772 773 HG23 VAL 96 HG23 VAL 96 19.072 8.252 2.480 774 H GLU 97 H GLU 97 24.243 8.527 2.752 775 HA GLU 97 HA GLU 97 24.629 6.460 4.659 776 HB2 GLU 97 HB2 GLU 97 26.675 8.400 3.525 777 HB3 GLU 97 HB3 GLU 97 27.004 6.891 4.358 778 HG2 GLU 97 HG2 GLU 97 25.158 6.257 2.195 779 HG3 GLU 97 HG3 GLU 97 26.409 7.323 1.550 780 H ARG 98 H ARG 98 24.655 10.028 4.975 781 HA ARG 98 HA ARG 98 25.911 10.025 7.495 782 HB2 ARG 98 HB2 ARG 98 25.768 12.264 7.440 783 HB3 ARG 98 HB3 ARG 98 25.257 11.959 5.800 784 HG2 ARG 98 HG2 ARG 98 23.682 13.448 6.370 785 HG3 ARG 98 HG3 ARG 98 22.874 11.929 6.847 786 HD2 ARG 98 HD2 ARG 98 23.301 12.136 9.089 787 HD3 ARG 98 HD3 ARG 98 24.486 13.449 8.827 788 HE ARG 98 HE ARG 98 21.763 14.042 7.901 789 HH11 ARG 98 HH11 ARG 98 23.937 14.123 10.690 790 HH12 ARG 98 HH12 ARG 98 23.222 15.537 11.378 791 HH21 ARG 98 HH21 ARG 98 20.902 15.926 8.695 792 HH22 ARG 98 HH22 ARG 98 21.296 16.525 10.270 793 H VAL 99 H VAL 99 22.556 9.262 6.633 794 HA VAL 99 HA VAL 99 21.832 9.730 9.459 795 HB VAL 99 HB VAL 99 20.632 10.876 7.435 796 HG11 VAL 99 HG11 VAL 99 20.374 9.134 5.956 797 HG12 VAL 99 HG12 VAL 99 19.303 8.233 7.075 798 HG13 VAL 99 HG13 VAL 99 18.784 9.781 6.413 799 HG21 VAL 99 HG21 VAL 99 18.384 10.724 8.476 800 HG22 VAL 99 HG22 VAL 99 18.827 9.227 9.303 801 HG23 VAL 99 HG23 VAL 99 19.591 10.769 9.758 802 H LEU 100 H LEU 100 21.845 7.445 6.819 803 HA LEU 100 HA LEU 100 20.741 5.247 8.272 804 HB2 LEU 100 HB2 LEU 100 22.181 5.570 5.553 805 HB3 LEU 100 HB3 LEU 100 21.918 4.036 6.243 806 HG LEU 100 HG LEU 100 19.528 5.073 6.633 807 HD11 LEU 100 HD11 LEU 100 19.143 5.986 4.098 808 HD12 LEU 100 HD12 LEU 100 18.322 6.017 5.638 809 HD13 LEU 100 HD13 LEU 100 19.883 6.994 5.406 810 HD21 LEU 100 HD21 LEU 100 20.530 3.125 4.645 811 HD22 LEU 100 HD22 LEU 100 19.108 3.044 5.756 812 HD23 LEU 100 HD23 LEU 100 18.988 3.863 4.227 813 H SER 101 H SER 101 23.925 6.733 8.416 814 HA SER 101 HA SER 101 25.027 4.107 9.347 815 HB2 SER 101 HB2 SER 101 26.469 5.766 8.159 816 HB3 SER 101 HB3 SER 101 26.312 6.851 9.541 817 HG SER 101 HG SER 101 27.850 4.696 9.139 818 H LEU 102 H LEU 102 23.990 7.211 10.465 819 HA LEU 102 HA LEU 102 24.675 7.030 13.162 820 HB2 LEU 102 HB2 LEU 102 22.810 8.775 11.498 821 HB3 LEU 102 HB3 LEU 102 22.984 8.962 13.220 822 HG LEU 102 HG LEU 102 24.294 10.507 11.715 823 HD11 LEU 102 HD11 LEU 102 25.335 9.065 14.139 824 HD12 LEU 102 HD12 LEU 102 26.060 10.560 13.492 825 HD13 LEU 102 HD13 LEU 102 24.391 10.585 14.117 826 HD21 LEU 102 HD21 LEU 102 26.159 8.185 12.077 827 HD22 LEU 102 HD22 LEU 102 25.345 8.593 10.562 828 HD23 LEU 102 HD23 LEU 102 26.531 9.739 11.243 829 H THR 103 H THR 103 21.441 6.538 11.630 830 HA THR 103 HA THR 103 20.337 5.806 14.257 831 HB THR 103 HB THR 103 18.993 7.197 12.797 832 HG1 THR 103 HG1 THR 103 18.177 4.584 13.300 833 HG21 THR 103 HG21 THR 103 18.977 6.939 10.588 834 HG22 THR 103 HG22 THR 103 19.776 5.350 10.683 835 HG23 THR 103 HG23 THR 103 18.015 5.493 10.784 836 H ASN 104 H ASN 104 22.404 4.203 12.367 837 HA ASN 104 HA ASN 104 22.844 2.195 11.593 838 HB2 ASN 104 HB2 ASN 104 21.171 1.147 13.878 839 HB3 ASN 104 HB3 ASN 104 22.285 0.223 12.879 840 HD21 ASN 104 HD21 ASN 104 22.256 3.051 15.160 841 HD22 ASN 104 HD22 ASN 104 23.790 2.608 15.851 842 H LEU 105 H LEU 105 21.874 2.501 9.702 843 HA LEU 105 HA LEU 105 19.347 1.093 9.029 844 HB2 LEU 105 HB2 LEU 105 19.423 3.689 9.249 845 HB3 LEU 105 HB3 LEU 105 19.897 3.374 7.627 846 HG LEU 105 HG LEU 105 17.550 3.579 7.506 847 HD11 LEU 105 HD11 LEU 105 16.435 1.511 7.053 848 HD12 LEU 105 HD12 LEU 105 18.102 1.324 6.481 849 HD13 LEU 105 HD13 LEU 105 17.593 0.568 7.997 850 HD21 LEU 105 HD21 LEU 105 16.013 2.626 9.151 851 HD22 LEU 105 HD22 LEU 105 17.412 1.999 10.074 852 HD23 LEU 105 HD23 LEU 105 17.186 3.750 9.838 853 H ASP 106 H ASP 106 22.372 2.528 7.553 854 HA ASP 106 HA ASP 106 22.251 0.746 5.273 855 HB2 ASP 106 HB2 ASP 106 24.193 1.751 4.577 856 HB3 ASP 106 HB3 ASP 106 23.635 3.024 5.653 857 H ARG 107 H ARG 107 23.391 0.562 8.537 858 HA ARG 107 HA ARG 107 25.262 -1.589 8.122 859 HB2 ARG 107 HB2 ARG 107 23.911 -0.912 10.775 860 HB3 ARG 107 HB3 ARG 107 25.481 -1.684 10.498 861 HG2 ARG 107 HG2 ARG 107 26.122 0.576 9.328 862 HG3 ARG 107 HG3 ARG 107 24.692 1.226 10.130 863 HD2 ARG 107 HD2 ARG 107 25.942 1.604 11.941 864 HD3 ARG 107 HD3 ARG 107 26.074 -0.145 12.185 865 HE ARG 107 HE ARG 107 27.944 0.708 10.211 866 HH11 ARG 107 HH11 ARG 107 27.557 0.848 13.795 867 HH12 ARG 107 HH12 ARG 107 29.192 1.315 14.028 868 HH21 ARG 107 HH21 ARG 107 30.063 1.383 10.609 869 HH22 ARG 107 HH22 ARG 107 30.575 1.747 12.210 870 H ILE 108 H ILE 108 21.845 -1.470 8.126 871 HA ILE 108 HA ILE 108 21.472 -4.173 9.221 872 HB ILE 108 HB ILE 108 19.367 -2.125 8.427 873 HG12 ILE 108 HG12 ILE 108 20.771 -0.854 9.935 874 HG13 ILE 108 HG13 ILE 108 19.204 -1.216 10.614 875 HG21 ILE 108 HG21 ILE 108 18.017 -3.290 10.160 876 HG22 ILE 108 HG22 ILE 108 18.596 -4.435 8.944 877 HG23 ILE 108 HG23 ILE 108 19.392 -4.364 10.497 878 HD11 ILE 108 HD11 ILE 108 21.822 -2.598 11.352 879 HD12 ILE 108 HD12 ILE 108 20.900 -1.397 12.303 880 HD13 ILE 108 HD13 ILE 108 20.221 -2.995 12.042 881 H VAL 109 H VAL 109 20.620 -1.881 6.586 882 HA VAL 109 HA VAL 109 19.883 -4.018 4.812 883 HB VAL 109 HB VAL 109 19.987 -1.112 3.958 884 HG11 VAL 109 HG11 VAL 109 17.759 -1.734 2.876 885 HG12 VAL 109 HG12 VAL 109 19.120 -2.648 2.273 886 HG13 VAL 109 HG13 VAL 109 17.988 -3.389 3.403 887 HG21 VAL 109 HG21 VAL 109 18.756 -1.189 6.270 888 HG22 VAL 109 HG22 VAL 109 17.955 -0.445 4.890 889 HG23 VAL 109 HG23 VAL 109 17.493 -2.067 5.407 890 H LYS 110 H LYS 110 20.744 -3.000 2.292 891 HA LYS 110 HA LYS 110 23.680 -2.945 2.309 892 HB2 LYS 110 HB2 LYS 110 21.632 -4.604 0.820 893 HB3 LYS 110 HB3 LYS 110 23.025 -4.074 -0.101 894 HG2 LYS 110 HG2 LYS 110 23.540 -5.251 2.589 895 HG3 LYS 110 HG3 LYS 110 22.898 -6.335 1.352 896 HD2 LYS 110 HD2 LYS 110 25.280 -6.500 1.142 897 HD3 LYS 110 HD3 LYS 110 24.672 -5.669 -0.231 898 HE2 LYS 110 HE2 LYS 110 26.706 -4.635 0.420 899 HE3 LYS 110 HE3 LYS 110 25.450 -3.478 0.832 900 HZ1 LYS 110 HZ1 LYS 110 25.716 -4.143 3.165 901 HZ2 LYS 110 HZ2 LYS 110 26.833 -5.288 2.749 902 HZ3 LYS 110 HZ3 LYS 110 27.159 -3.718 2.545 903 H ILE 111 H ILE 111 24.402 -1.951 0.111 904 HA ILE 111 HA ILE 111 22.501 -0.125 -1.087 905 HB ILE 111 HB ILE 111 24.187 0.633 1.100 906 HG12 ILE 111 HG12 ILE 111 23.109 2.811 -0.609 907 HG13 ILE 111 HG13 ILE 111 21.957 1.606 -0.084 908 HG21 ILE 111 HG21 ILE 111 25.583 2.444 0.249 909 HG22 ILE 111 HG22 ILE 111 26.130 0.860 -0.304 910 HG23 ILE 111 HG23 ILE 111 25.256 1.925 -1.422 911 HD11 ILE 111 HD11 ILE 111 22.123 3.521 1.492 912 HD12 ILE 111 HD12 ILE 111 22.450 1.938 2.237 913 HD13 ILE 111 HD13 ILE 111 23.797 3.043 1.852 914 H TYR 112 H TYR 112 23.145 0.378 -3.199 915 HA TYR 112 HA TYR 112 25.660 -0.727 -4.308 916 HB2 TYR 112 HB2 TYR 112 22.788 -1.315 -5.104 917 HB3 TYR 112 HB3 TYR 112 24.169 -1.713 -6.121 918 HD1 TYR 112 HD1 TYR 112 25.827 -3.423 -5.413 919 HD2 TYR 112 HD2 TYR 112 22.159 -2.649 -3.295 920 HE1 TYR 112 HE1 TYR 112 26.026 -5.648 -4.371 921 HE2 TYR 112 HE2 TYR 112 22.328 -4.969 -2.281 922 HH TYR 112 HH TYR 112 23.562 -6.877 -2.061 923 H ASP 113 H ASP 113 25.691 -0.162 -6.766 924 HA ASP 113 HA ASP 113 25.135 2.754 -6.905 925 HB2 ASP 113 HB2 ASP 113 27.143 0.884 -8.085 926 HB3 ASP 113 HB3 ASP 113 26.571 2.146 -9.151 927 H THR 114 H THR 114 24.686 -0.234 -8.908 928 HA THR 114 HA THR 114 22.336 1.114 -10.189 929 HB THR 114 HB THR 114 23.012 0.173 -12.313 930 HG1 THR 114 HG1 THR 114 25.481 -0.574 -11.116 931 HG21 THR 114 HG21 THR 114 23.748 2.456 -11.761 932 HG22 THR 114 HG22 THR 114 25.282 1.816 -11.124 933 HG23 THR 114 HG23 THR 114 24.891 1.619 -12.834 934 H ILE 115 H ILE 115 20.976 -0.565 -11.441 935 HA ILE 115 HA ILE 115 20.032 -2.298 -9.309 936 HB ILE 115 HB ILE 115 19.182 -1.789 -12.175 937 HG12 ILE 115 HG12 ILE 115 18.713 0.087 -10.743 938 HG13 ILE 115 HG13 ILE 115 17.208 -0.734 -11.143 939 HG21 ILE 115 HG21 ILE 115 18.531 -4.063 -11.748 940 HG22 ILE 115 HG22 ILE 115 17.881 -3.651 -10.150 941 HG23 ILE 115 HG23 ILE 115 17.084 -3.060 -11.638 942 HD11 ILE 115 HD11 ILE 115 17.247 -0.021 -8.805 943 HD12 ILE 115 HD12 ILE 115 17.192 -1.798 -8.881 944 HD13 ILE 115 HD13 ILE 115 18.699 -0.963 -8.499 945 H SER 116 H SER 116 21.943 -2.666 -12.293 946 HA SER 116 HA SER 116 21.655 -5.517 -12.183 947 HB2 SER 116 HB2 SER 116 22.177 -4.222 -14.205 948 HB3 SER 116 HB3 SER 116 23.803 -3.882 -13.563 949 HG SER 116 HG SER 116 24.167 -6.136 -13.574 950 H GLU 117 H GLU 117 23.906 -3.138 -10.592 951 HA GLU 117 HA GLU 117 25.742 -5.126 -9.661 952 HB2 GLU 117 HB2 GLU 117 25.139 -2.218 -9.304 953 HB3 GLU 117 HB3 GLU 117 25.845 -2.981 -7.899 954 HG2 GLU 117 HG2 GLU 117 27.826 -3.587 -9.041 955 HG3 GLU 117 HG3 GLU 117 27.082 -3.334 -10.630 956 H ALA 118 H ALA 118 22.441 -4.677 -8.963 957 HA ALA 118 HA ALA 118 22.818 -5.595 -6.147 958 HB1 ALA 118 HB1 ALA 118 20.727 -4.594 -5.624 959 HB2 ALA 118 HB2 ALA 118 21.745 -3.381 -6.419 960 HB3 ALA 118 HB3 ALA 118 20.429 -4.157 -7.331 961 H MET 119 H MET 119 21.113 -6.081 -9.270 962 HA MET 119 HA MET 119 19.175 -7.738 -8.299 963 HB2 MET 119 HB2 MET 119 19.685 -6.547 -10.750 964 HB3 MET 119 HB3 MET 119 20.243 -8.154 -11.119 965 HG2 MET 119 HG2 MET 119 17.858 -8.644 -9.784 966 HG3 MET 119 HG3 MET 119 17.545 -7.092 -10.553 967 HE1 MET 119 HE1 MET 119 17.941 -6.761 -13.216 968 HE2 MET 119 HE2 MET 119 19.435 -7.727 -13.383 969 HE3 MET 119 HE3 MET 119 18.017 -8.108 -14.373 970 H GLU 120 H GLU 120 22.217 -8.788 -9.827 971 HA GLU 120 HA GLU 120 21.686 -11.618 -9.052 972 HB2 GLU 120 HB2 GLU 120 23.569 -12.122 -10.434 973 HB3 GLU 120 HB3 GLU 120 22.462 -11.077 -11.334 974 HG2 GLU 120 HG2 GLU 120 23.960 -9.110 -10.820 975 HG3 GLU 120 HG3 GLU 120 25.052 -10.196 -9.961 976 H GLU 121 H GLU 121 23.157 -8.836 -7.699 977 HA GLU 121 HA GLU 121 25.284 -10.425 -6.463 978 HB2 GLU 121 HB2 GLU 121 25.471 -8.080 -7.506 979 HB3 GLU 121 HB3 GLU 121 24.620 -7.508 -6.069 980 HG2 GLU 121 HG2 GLU 121 26.927 -7.191 -5.666 981 HG3 GLU 121 HG3 GLU 121 26.430 -8.534 -4.635 982 H VAL 122 H VAL 122 22.535 -8.391 -5.374 983 HA VAL 122 HA VAL 122 22.662 -8.824 -2.590 984 HB VAL 122 HB VAL 122 21.104 -7.406 -4.186 985 HG11 VAL 122 HG11 VAL 122 19.310 -9.790 -3.629 986 HG12 VAL 122 HG12 VAL 122 18.735 -8.207 -4.101 987 HG13 VAL 122 HG13 VAL 122 19.786 -9.078 -5.207 988 HG21 VAL 122 HG21 VAL 122 21.321 -6.825 -1.995 989 HG22 VAL 122 HG22 VAL 122 19.582 -7.152 -2.123 990 HG23 VAL 122 HG23 VAL 122 20.695 -8.349 -1.412 991 H ARG 123 H ARG 123 21.595 -11.048 -5.106 992 HA ARG 123 HA ARG 123 20.394 -13.027 -3.577 993 HB2 ARG 123 HB2 ARG 123 22.281 -13.307 -5.946 994 HB3 ARG 123 HB3 ARG 123 21.195 -14.565 -5.414 995 HG2 ARG 123 HG2 ARG 123 19.692 -12.108 -5.924 996 HG3 ARG 123 HG3 ARG 123 20.748 -12.446 -7.290 997 HD2 ARG 123 HD2 ARG 123 18.550 -13.426 -7.620 998 HD3 ARG 123 HD3 ARG 123 19.779 -14.687 -7.479 999 HE ARG 123 HE ARG 123 18.762 -14.084 -4.904 1000 HH11 ARG 123 HH11 ARG 123 17.582 -15.613 -7.941 1001 HH12 ARG 123 HH12 ARG 123 16.401 -16.584 -7.128 1002 HH21 ARG 123 HH21 ARG 123 17.158 -15.505 -3.873 1003 HH22 ARG 123 HH22 ARG 123 16.264 -16.634 -4.853 1004 H ARG 124 H ARG 124 23.889 -12.276 -3.840 1005 HA ARG 124 HA ARG 124 24.487 -14.127 -1.677 1006 HB2 ARG 124 HB2 ARG 124 26.213 -15.342 -2.916 1007 HB3 ARG 124 HB3 ARG 124 24.599 -15.698 -3.488 1008 HG2 ARG 124 HG2 ARG 124 26.251 -13.560 -4.842 1009 HG3 ARG 124 HG3 ARG 124 26.570 -15.266 -5.128 1010 HD2 ARG 124 HD2 ARG 124 23.748 -14.912 -5.470 1011 HD3 ARG 124 HD3 ARG 124 24.535 -13.587 -6.327 1012 HE ARG 124 HE ARG 124 25.755 -16.152 -6.857 1013 HH11 ARG 124 HH11 ARG 124 23.527 -13.665 -8.077 1014 HH12 ARG 124 HH12 ARG 124 23.162 -14.568 -9.532 1015 HH21 ARG 124 HH21 ARG 124 25.313 -17.223 -8.950 1016 HH22 ARG 124 HH22 ARG 124 24.215 -16.424 -10.041 1017 H LYS 125 H LYS 125 24.565 -11.303 -1.952 1018 HA LYS 125 HA LYS 125 26.971 -10.114 -2.168 1019 HB2 LYS 125 HB2 LYS 125 26.179 -8.362 -0.847 1020 HB3 LYS 125 HB3 LYS 125 24.741 -9.123 -1.495 1021 HG2 LYS 125 HG2 LYS 125 24.089 -8.841 0.675 1022 HG3 LYS 125 HG3 LYS 125 24.745 -10.482 0.748 1023 HD2 LYS 125 HD2 LYS 125 26.860 -8.543 1.316 1024 HD3 LYS 125 HD3 LYS 125 25.447 -8.174 2.311 1025 HE2 LYS 125 HE2 LYS 125 25.427 -10.240 3.358 1026 HE3 LYS 125 HE3 LYS 125 26.631 -10.923 2.256 1027 HZ1 LYS 125 HZ1 LYS 125 28.296 -9.660 3.169 1028 HZ2 LYS 125 HZ2 LYS 125 27.299 -8.592 3.916 1029 HZ3 LYS 125 HZ3 LYS 125 27.488 -10.141 4.474
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