NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
17364 | 2cka | 15098 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H LEU2028 H LEU2028 5.851 -15.963 1.680 2 HA LEU2028 HA LEU2028 3.506 -14.328 1.775 3 1HB LEU2028 2HB LEU2028 4.837 -16.060 3.863 4 2HB LEU2028 1HB LEU2028 3.508 -15.011 4.282 5 HG LEU2028 HG LEU2028 2.687 -17.246 4.024 6 1HD1 LEU2028 1HD1 LEU2028 1.199 -15.489 3.304 7 2HD1 LEU2028 3HD1 LEU2028 1.831 -15.598 1.661 8 3HD1 LEU2028 2HD1 LEU2028 0.956 -16.955 2.360 9 1HD2 LEU2028 2HD2 LEU2028 3.824 -17.207 1.230 10 2HD2 LEU2028 1HD2 LEU2028 4.404 -18.183 2.579 11 3HD2 LEU2028 3HD2 LEU2028 2.802 -18.479 1.902 12 H ASP2029 H ASP2029 4.310 -12.454 1.289 13 HA ASP2029 HA ASP2029 5.335 -10.719 3.345 14 1HB ASP2029 2HB ASP2029 7.342 -11.955 2.227 15 2HB ASP2029 1HB ASP2029 6.869 -11.152 0.744 16 H VAL2030 H VAL2030 5.926 -8.715 1.429 17 HA VAL2030 HA VAL2030 3.397 -8.512 -0.030 18 HB VAL2030 HB VAL2030 4.127 -6.694 1.633 19 1HG1 VAL2030 3HG1 VAL2030 6.488 -6.648 1.037 20 2HG1 VAL2030 2HG1 VAL2030 6.030 -5.999 -0.542 21 3HG1 VAL2030 1HG1 VAL2030 5.732 -5.047 0.910 22 1HG2 VAL2030 3HG2 VAL2030 2.382 -6.279 0.004 23 2HG2 VAL2030 2HG2 VAL2030 3.385 -4.839 0.212 24 3HG2 VAL2030 1HG2 VAL2030 3.604 -5.874 -1.201 25 H ASP2031 H ASP2031 6.797 -8.862 -0.194 26 HA ASP2031 HA ASP2031 8.191 -9.606 -1.692 27 1HB ASP2031 2HB ASP2031 6.382 -11.065 -2.465 28 2HB ASP2031 1HB ASP2031 5.865 -9.847 -3.614 29 H LEU2032 H LEU2032 6.932 -6.772 -1.836 30 HA LEU2032 HA LEU2032 7.812 -4.741 -2.279 31 1HB LEU2032 2HB LEU2032 10.202 -6.250 -3.269 32 2HB LEU2032 1HB LEU2032 10.143 -4.512 -3.056 33 HG LEU2032 HG LEU2032 9.829 -6.562 -0.866 34 1HD1 LEU2032 3HD1 LEU2032 12.102 -4.710 -1.521 35 2HD1 LEU2032 2HD1 LEU2032 11.996 -5.748 -0.095 36 3HD1 LEU2032 1HD1 LEU2032 12.086 -6.465 -1.705 37 1HD2 LEU2032 2HD2 LEU2032 9.914 -3.550 -0.760 38 2HD2 LEU2032 1HD2 LEU2032 8.546 -4.577 -0.347 39 3HD2 LEU2032 3HD2 LEU2032 10.001 -4.610 0.647 40 H GLU2033 H GLU2033 7.734 -6.815 -5.124 41 HA GLU2033 HA GLU2033 8.048 -4.545 -6.889 42 1HB GLU2033 2HB GLU2033 7.261 -7.393 -7.483 43 2HB GLU2033 1HB GLU2033 7.488 -6.147 -8.695 44 1HG GLU2033 2HG GLU2033 9.830 -5.938 -8.035 45 2HG GLU2033 1HG GLU2033 9.588 -7.212 -6.833 46 H THR2034 H THR2034 5.565 -5.695 -5.103 47 HA THR2034 HA THR2034 3.383 -5.373 -6.858 48 HB THR2034 HB THR2034 3.485 -6.571 -4.526 49 HG1 THR2034 1HG THR2034 1.615 -6.538 -5.629 50 1HG2 THR2034 3HG2 THR2034 2.786 -3.752 -3.719 51 2HG2 THR2034 2HG2 THR2034 2.531 -5.164 -2.703 52 3HG2 THR2034 1HG2 THR2034 4.174 -4.691 -3.175 53 H ARG2035 H ARG2035 1.698 -3.673 -6.629 54 HA ARG2035 HA ARG2035 2.913 -1.006 -6.381 55 1HB ARG2035 2HB ARG2035 0.188 -1.674 -7.528 56 2HB ARG2035 1HB ARG2035 1.097 -0.193 -7.742 57 1HG ARG2035 2HG ARG2035 1.720 -2.887 -8.944 58 2HG ARG2035 1HG ARG2035 1.089 -1.473 -9.782 59 1HD ARG2035 2HD ARG2035 3.789 -1.685 -8.457 60 2HD ARG2035 1HD ARG2035 3.478 -1.815 -10.184 61 HE ARG2035 HE ARG2035 2.584 0.646 -8.970 62 1HH1 ARG2035 1HH1 ARG2035 5.271 -1.023 -10.595 63 2HH1 ARG2035 2HH1 ARG2035 6.031 0.409 -11.099 64 1HH2 ARG2035 1HH2 ARG2035 3.679 2.591 -9.611 65 2HH2 ARG2035 2HH2 ARG2035 5.137 2.526 -10.500 66 H ILE2036 H ILE2036 2.527 -0.082 -4.450 67 HA ILE2036 HA ILE2036 0.267 -0.951 -2.849 68 HB ILE2036 HB ILE2036 2.433 1.068 -2.263 69 1HG1 ILE2036 2HG1 ILE2036 3.281 -1.179 -2.402 70 2HG1 ILE2036 1HG1 ILE2036 3.258 -0.592 -0.734 71 1HG2 ILE2036 2HG2 ILE2036 0.310 -0.032 -0.415 72 2HG2 ILE2036 1HG2 ILE2036 1.665 0.987 0.068 73 3HG2 ILE2036 3HG2 ILE2036 0.421 1.627 -1.006 74 1HD1 ILE2036 1HD1 ILE2036 1.250 -1.922 -0.297 75 2HD1 ILE2036 3HD1 ILE2036 1.271 -2.512 -1.957 76 3HD1 ILE2036 2HD1 ILE2036 2.574 -2.941 -0.861 77 HA PRO2037 HA PRO2037 -2.184 2.492 -4.364 78 1HB PRO2037 2HB PRO2037 -4.119 1.617 -2.357 79 2HB PRO2037 1HB PRO2037 -4.301 1.674 -4.109 80 1HG PRO2037 2HG PRO2037 -4.110 -0.630 -2.668 81 2HG PRO2037 1HG PRO2037 -3.627 -0.495 -4.373 82 1HD PRO2037 2HD PRO2037 -1.960 -0.608 -1.919 83 2HD PRO2037 1HD PRO2037 -1.611 -1.185 -3.562 84 H VAL2038 H VAL2038 -1.932 4.445 -3.553 85 HA VAL2038 HA VAL2038 -1.721 4.732 -0.652 86 HB VAL2038 HB VAL2038 -0.152 6.651 -1.046 87 1HG1 VAL2038 1HG1 VAL2038 0.774 3.971 -2.060 88 2HG1 VAL2038 3HG1 VAL2038 1.822 5.273 -1.496 89 3HG1 VAL2038 2HG1 VAL2038 0.712 4.485 -0.371 90 1HG2 VAL2038 2HG2 VAL2038 -0.079 5.554 -3.849 91 2HG2 VAL2038 1HG2 VAL2038 -0.723 7.122 -3.355 92 3HG2 VAL2038 3HG2 VAL2038 1.001 6.793 -3.209 93 H ILE2039 H ILE2039 -2.471 6.641 0.202 94 HA ILE2039 HA ILE2039 -4.190 8.183 -1.576 95 HB ILE2039 HB ILE2039 -5.635 6.591 -0.449 96 1HG1 ILE2039 2HG1 ILE2039 -5.943 9.337 0.804 97 2HG1 ILE2039 1HG1 ILE2039 -6.515 8.875 -0.789 98 1HG2 ILE2039 1HG2 ILE2039 -4.275 6.003 1.450 99 2HG2 ILE2039 3HG2 ILE2039 -4.511 7.606 2.152 100 3HG2 ILE2039 2HG2 ILE2039 -5.880 6.505 1.993 101 1HD1 ILE2039 3HD1 ILE2039 -7.472 7.739 1.829 102 2HD1 ILE2039 2HD1 ILE2039 -8.322 8.914 0.820 103 3HD1 ILE2039 1HD1 ILE2039 -8.053 7.277 0.228 104 H ASN2040 H ASN2040 -4.147 10.295 -1.252 105 HA ASN2040 HA ASN2040 -2.220 11.408 0.595 106 1HB ASN2040 2HB ASN2040 -2.785 12.412 -1.709 107 2HB ASN2040 1HB ASN2040 -4.309 12.919 -1.000 108 1HD2 ASN2040 1HD2 ASN2040 -0.968 13.651 -1.322 109 2HD2 ASN2040 2HD2 ASN2040 -0.992 15.062 -0.339 110 H LYS2041 H LYS2041 -2.714 11.699 2.653 111 HA LYS2041 HA LYS2041 -5.367 11.260 3.621 112 1HB LYS2041 2HB LYS2041 -2.899 12.116 5.131 113 2HB LYS2041 1HB LYS2041 -4.367 11.466 5.842 114 1HG LYS2041 2HG LYS2041 -2.514 9.984 3.969 115 2HG LYS2041 1HG LYS2041 -2.583 9.788 5.717 116 1HD LYS2041 2HD LYS2041 -4.950 9.277 3.903 117 2HD LYS2041 1HD LYS2041 -3.802 8.032 4.347 118 1HE LYS2041 2HE LYS2041 -5.402 9.651 6.322 119 2HE LYS2041 1HE LYS2041 -5.864 8.057 5.733 120 1HZ LYS2041 3HZ LYS2041 -3.812 7.167 6.663 121 2HZ LYS2041 2HZ LYS2041 -3.379 8.674 7.271 122 3HZ LYS2041 1HZ LYS2041 -4.757 7.895 7.853 123 H VAL2042 H VAL2042 -3.759 14.048 2.618 124 HA VAL2042 HA VAL2042 -5.305 15.817 4.351 125 HB VAL2042 HB VAL2042 -3.456 16.572 2.077 126 1HG1 VAL2042 3HG1 VAL2042 -4.954 18.348 2.740 127 2HG1 VAL2042 2HG1 VAL2042 -4.451 18.176 4.420 128 3HG1 VAL2042 1HG1 VAL2042 -3.298 18.738 3.207 129 1HG2 VAL2042 3HG2 VAL2042 -2.786 16.246 4.996 130 2HG2 VAL2042 2HG2 VAL2042 -2.174 15.274 3.657 131 3HG2 VAL2042 1HG2 VAL2042 -1.721 16.970 3.788 132 H ASP2043 H ASP2043 -4.735 15.314 0.923 133 HA ASP2043 HA ASP2043 -6.968 16.880 0.090 134 1HB ASP2043 2HB ASP2043 -5.001 16.853 -1.289 135 2HB ASP2043 1HB ASP2043 -5.047 15.098 -1.407 136 H GLY2044 H GLY2044 -6.166 13.439 -0.391 137 1HA GLY2044 1HA GLY2044 -9.041 12.946 -0.720 138 2HA GLY2044 2HA GLY2044 -8.012 11.904 0.255 139 H THR2045 H THR2045 -6.559 13.212 -2.556 140 HA THR2045 HA THR2045 -7.262 11.544 -4.598 141 HB THR2045 HB THR2045 -4.459 12.543 -3.995 142 HG1 THR2045 1HG THR2045 -6.230 14.153 -4.239 143 1HG2 THR2045 3HG2 THR2045 -4.454 10.764 -5.701 144 2HG2 THR2045 2HG2 THR2045 -5.676 11.648 -6.614 145 3HG2 THR2045 1HG2 THR2045 -4.066 12.333 -6.412 146 H LEU2046 H LEU2046 -7.303 9.427 -4.843 147 HA LEU2046 HA LEU2046 -5.495 7.710 -3.301 148 1HB LEU2046 2HB LEU2046 -7.886 7.281 -2.981 149 2HB LEU2046 1HB LEU2046 -8.106 7.111 -4.707 150 HG LEU2046 HG LEU2046 -6.655 5.085 -4.648 151 1HD1 LEU2046 1HD1 LEU2046 -5.384 5.582 -2.626 152 2HD1 LEU2046 3HD1 LEU2046 -6.852 5.404 -1.662 153 3HD1 LEU2046 2HD1 LEU2046 -6.184 4.015 -2.518 154 1HD2 LEU2046 2HD2 LEU2046 -9.078 5.022 -2.860 155 2HD2 LEU2046 1HD2 LEU2046 -9.070 4.876 -4.619 156 3HD2 LEU2046 3HD2 LEU2046 -8.325 3.622 -3.630 157 H LEU2047 H LEU2047 -3.951 6.650 -4.359 158 HA LEU2047 HA LEU2047 -3.897 6.782 -7.309 159 1HB LEU2047 2HB LEU2047 -1.609 6.346 -5.403 160 2HB LEU2047 1HB LEU2047 -1.500 6.608 -7.126 161 HG LEU2047 HG LEU2047 -2.320 8.634 -5.049 162 1HD1 LEU2047 2HD1 LEU2047 0.118 8.400 -6.789 163 2HD1 LEU2047 1HD1 LEU2047 -0.265 9.779 -5.754 164 3HD1 LEU2047 3HD1 LEU2047 0.043 8.195 -5.044 165 1HD2 LEU2047 3HD2 LEU2047 -2.091 8.909 -8.037 166 2HD2 LEU2047 2HD2 LEU2047 -3.574 8.996 -7.088 167 3HD2 LEU2047 1HD2 LEU2047 -2.338 10.241 -6.906 168 H VAL2048 H VAL2048 -4.048 4.930 -8.387 169 HA VAL2048 HA VAL2048 -3.252 2.445 -7.050 170 HB VAL2048 HB VAL2048 -5.138 1.234 -8.138 171 1HG1 VAL2048 3HG1 VAL2048 -5.986 3.461 -6.288 172 2HG1 VAL2048 2HG1 VAL2048 -6.942 2.021 -6.649 173 3HG1 VAL2048 1HG1 VAL2048 -5.392 1.870 -5.822 174 1HG2 VAL2048 1HG2 VAL2048 -6.127 3.996 -8.832 175 2HG2 VAL2048 3HG2 VAL2048 -5.583 2.756 -9.964 176 3HG2 VAL2048 2HG2 VAL2048 -7.049 2.501 -9.017 177 H GLY2049 H GLY2049 -2.924 0.640 -8.638 178 1HA GLY2049 1HA GLY2049 -2.551 1.238 -11.402 179 2HA GLY2049 2HA GLY2049 -2.057 -0.231 -10.567 180 H GLU2050 H GLU2050 -0.750 1.768 -12.501 181 HA GLU2050 HA GLU2050 1.798 1.744 -11.113 182 1HB GLU2050 2HB GLU2050 1.191 2.408 -13.991 183 2HB GLU2050 1HB GLU2050 2.800 2.380 -13.287 184 1HG GLU2050 2HG GLU2050 2.468 -0.020 -12.759 185 2HG GLU2050 1HG GLU2050 0.934 0.045 -13.627 186 H ASP2051 H ASP2051 -0.642 3.758 -11.221 187 HA ASP2051 HA ASP2051 0.790 6.258 -11.347 188 1HB ASP2051 2HB ASP2051 -1.707 5.757 -11.627 189 2HB ASP2051 1HB ASP2051 -1.790 5.740 -9.877 190 H ALA2052 H ALA2052 -0.140 3.817 -9.099 191 HA ALA2052 HA ALA2052 0.828 5.174 -6.757 192 1HB ALA2052 1HB ALA2052 0.201 3.045 -5.657 193 2HB ALA2052 2HB ALA2052 -0.191 2.367 -7.239 194 3HB ALA2052 3HB ALA2052 -1.125 3.725 -6.605 195 HA PRO2053 HA PRO2053 4.999 3.854 -7.419 196 1HB PRO2053 2HB PRO2053 5.905 3.805 -4.882 197 2HB PRO2053 1HB PRO2053 5.522 5.317 -5.714 198 1HG PRO2053 2HG PRO2053 3.840 3.727 -3.812 199 2HG PRO2053 1HG PRO2053 4.179 5.470 -3.798 200 1HD PRO2053 2HD PRO2053 1.902 4.517 -4.803 201 2HD PRO2053 1HD PRO2053 2.739 5.886 -5.568 202 H ARG2054 H ARG2054 6.567 2.186 -6.994 203 HA ARG2054 HA ARG2054 5.493 -0.444 -6.583 204 1HB ARG2054 2HB ARG2054 8.397 0.419 -6.443 205 2HB ARG2054 1HB ARG2054 7.801 -1.212 -6.674 206 1HG ARG2054 2HG ARG2054 6.954 -0.596 -8.858 207 2HG ARG2054 1HG ARG2054 7.493 1.063 -8.574 208 1HD ARG2054 2HD ARG2054 9.823 0.193 -8.327 209 2HD ARG2054 1HD ARG2054 9.230 -1.403 -8.776 210 HE ARG2054 HE ARG2054 8.768 0.791 -10.633 211 1HH1 ARG2054 1HH1 ARG2054 10.690 -2.133 -9.888 212 2HH1 ARG2054 2HH1 ARG2054 11.323 -2.242 -11.455 213 1HH2 ARG2054 1HH2 ARG2054 9.661 0.611 -12.713 214 2HH2 ARG2054 2HH2 ARG2054 10.723 -0.662 -13.128 215 H ARG2055 H ARG2055 5.882 -1.700 -4.805 216 HA ARG2055 HA ARG2055 5.791 -0.422 -2.292 217 1HB ARG2055 2HB ARG2055 4.817 -2.604 -2.589 218 2HB ARG2055 1HB ARG2055 6.377 -3.294 -2.977 219 1HG ARG2055 2HG ARG2055 5.627 -3.886 -0.791 220 2HG ARG2055 1HG ARG2055 7.133 -2.940 -0.705 221 1HD ARG2055 2HD ARG2055 5.723 -0.961 -0.110 222 2HD ARG2055 1HD ARG2055 4.319 -2.029 -0.167 223 HE ARG2055 HE ARG2055 6.425 -2.798 1.635 224 1HH1 ARG2055 1HH1 ARG2055 3.283 -1.164 1.301 225 2HH1 ARG2055 2HH1 ARG2055 2.896 -1.312 2.961 226 1HH2 ARG2055 1HH2 ARG2055 5.883 -2.936 3.872 227 2HH2 ARG2055 2HH2 ARG2055 4.410 -2.324 4.464 228 H ALA2056 H ALA2056 8.458 -1.684 -4.116 229 HA ALA2056 HA ALA2056 10.440 -1.658 -2.141 230 1HB ALA2056 3HB ALA2056 12.028 -1.613 -3.985 231 2HB ALA2056 1HB ALA2056 10.736 -1.168 -5.096 232 3HB ALA2056 2HB ALA2056 10.718 -2.748 -4.312 233 H GLU2057 H GLU2057 9.251 0.935 -4.256 234 HA GLU2057 HA GLU2057 11.289 2.762 -3.270 235 1HB GLU2057 2HB GLU2057 10.396 4.356 -4.867 236 2HB GLU2057 1HB GLU2057 10.600 2.803 -5.668 237 1HG GLU2057 2HG GLU2057 8.182 2.386 -5.331 238 2HG GLU2057 1HG GLU2057 8.042 4.004 -4.663 239 H LEU2058 H LEU2058 8.077 1.860 -2.677 240 HA LEU2058 HA LEU2058 6.699 4.020 -1.784 241 1HB LEU2058 2HB LEU2058 5.810 1.763 -2.122 242 2HB LEU2058 1HB LEU2058 6.658 1.192 -0.716 243 HG LEU2058 HG LEU2058 4.175 1.451 -0.483 244 1HD1 LEU2058 3HD1 LEU2058 5.815 3.051 1.450 245 2HD1 LEU2058 2HD1 LEU2058 4.187 2.435 1.733 246 3HD1 LEU2058 1HD1 LEU2058 5.527 1.311 1.503 247 1HD2 LEU2058 1HD2 LEU2058 4.825 4.386 -0.595 248 2HD2 LEU2058 3HD2 LEU2058 3.846 3.469 -1.741 249 3HD2 LEU2058 2HD2 LEU2058 3.283 3.702 -0.086 250 H GLU2059 H GLU2059 8.977 2.100 0.101 251 HA GLU2059 HA GLU2059 8.594 3.156 2.633 252 1HB GLU2059 2HB GLU2059 10.072 1.230 1.915 253 2HB GLU2059 1HB GLU2059 11.264 2.427 1.437 254 1HG GLU2059 2HG GLU2059 11.842 1.574 3.582 255 2HG GLU2059 1HG GLU2059 11.304 3.241 3.773 256 H MET2060 H MET2060 10.898 4.226 0.147 257 HA MET2060 HA MET2060 11.759 6.539 1.636 258 1HB MET2060 2HB MET2060 12.202 5.763 -1.242 259 2HB MET2060 1HB MET2060 12.942 7.149 -0.457 260 1HG MET2060 2HG MET2060 14.099 5.672 1.081 261 2HG MET2060 1HG MET2060 13.328 4.275 0.328 262 1HE MET2060 2HE MET2060 13.855 3.411 -2.108 263 2HE MET2060 1HE MET2060 13.402 4.980 -2.775 264 3HE MET2060 3HE MET2060 14.931 4.234 -3.233 265 H TRP2061 H TRP2061 9.451 5.857 -0.839 266 HA TRP2061 HA TRP2061 9.017 8.419 -1.879 267 1HB TRP2061 2HB TRP2061 8.320 6.168 -2.820 268 2HB TRP2061 1HB TRP2061 7.003 6.190 -1.656 269 HD1 TRP2061 HD TRP2061 8.266 8.072 -4.759 270 HE1 TRP2061 1HE TRP2061 6.248 9.178 -5.898 271 HE3 TRP2061 3HE TRP2061 4.686 6.979 -1.297 272 HZ2 TRP2061 2HZ TRP2061 3.504 9.548 -5.403 273 HZ3 TRP2061 3HZ TRP2061 2.386 7.748 -1.702 274 HH2 TRP2061 HH TRP2061 1.810 9.002 -3.713 275 H LEU2062 H LEU2062 7.359 6.631 0.709 276 HA LEU2062 HA LEU2062 5.585 8.733 1.367 277 1HB LEU2062 2HB LEU2062 6.448 6.342 2.971 278 2HB LEU2062 1HB LEU2062 5.209 7.464 3.502 279 HG LEU2062 HG LEU2062 5.099 5.606 1.128 280 1HD1 LEU2062 2HD1 LEU2062 3.496 5.725 3.675 281 2HD1 LEU2062 1HD1 LEU2062 3.202 4.629 2.325 282 3HD1 LEU2062 3HD1 LEU2062 4.700 4.509 3.242 283 1HD2 LEU2062 1HD2 LEU2062 3.072 7.646 2.026 284 2HD2 LEU2062 3HD2 LEU2062 4.017 7.712 0.540 285 3HD2 LEU2062 2HD2 LEU2062 2.830 6.433 0.769 286 H GLN2063 H GLN2063 8.825 7.969 2.440 287 HA GLN2063 HA GLN2063 8.898 9.647 4.680 288 1HB GLN2063 2HB GLN2063 11.082 8.815 2.785 289 2HB GLN2063 1HB GLN2063 11.358 9.716 4.261 290 1HG GLN2063 2HG GLN2063 10.450 7.853 5.562 291 2HG GLN2063 1HG GLN2063 10.170 6.959 4.070 292 1HE2 GLN2063 1HE2 GLN2063 12.544 8.151 6.273 293 2HE2 GLN2063 2HE2 GLN2063 13.870 7.215 5.701 294 H GLY2064 H GLY2064 9.249 10.324 1.277 295 1HA GLY2064 1HA GLY2064 9.657 12.299 0.140 296 2HA GLY2064 2HA GLY2064 10.236 12.991 1.647 297 H HIS2065 H HIS2065 7.077 11.551 1.398 298 HA HIS2065 HA HIS2065 5.854 14.116 1.832 299 1HB HIS2065 2HB HIS2065 5.179 12.384 -0.543 300 2HB HIS2065 1HB HIS2065 3.992 13.477 0.152 301 HD1 HIS2065 1HD HIS2065 4.113 15.913 -0.601 302 HD2 HIS2065 2HD HIS2065 7.472 13.690 -1.652 303 HE1 HIS2065 1HE HIS2065 5.490 17.378 -2.117 304 HA PRO2066 HA PRO2066 4.086 10.972 4.589 305 1HB PRO2066 2HB PRO2066 3.513 12.828 6.550 306 2HB PRO2066 1HB PRO2066 5.014 11.911 6.447 307 1HG PRO2066 2HG PRO2066 4.468 14.727 5.688 308 2HG PRO2066 1HG PRO2066 5.964 13.969 6.269 309 1HD PRO2066 2HD PRO2066 5.474 14.686 3.681 310 2HD PRO2066 1HD PRO2066 6.650 13.466 4.194 311 H GLU2067 H GLU2067 2.920 13.545 2.908 312 HA GLU2067 HA GLU2067 0.252 13.903 3.721 313 1HB GLU2067 2HB GLU2067 1.410 13.880 0.940 314 2HB GLU2067 1HB GLU2067 -0.165 14.508 1.380 315 1HG GLU2067 2HG GLU2067 0.848 16.263 2.655 316 2HG GLU2067 1HG GLU2067 2.457 15.579 2.366 317 H PHE2068 H PHE2068 1.884 11.499 1.778 318 HA PHE2068 HA PHE2068 -0.619 10.141 1.216 319 1HB PHE2068 2HB PHE2068 2.180 9.725 0.185 320 2HB PHE2068 1HB PHE2068 0.850 8.635 -0.156 321 HD1 PHE2068 1HD PHE2068 -0.977 9.322 -1.588 322 HD2 PHE2068 2HD PHE2068 2.357 11.863 -0.887 323 HE1 PHE2068 1HE PHE2068 -1.607 10.667 -3.541 324 HE2 PHE2068 2HE PHE2068 1.737 13.216 -2.842 325 HZ PHE2068 HZ PHE2068 -0.253 12.619 -4.171 326 H ALA2069 H ALA2069 -1.012 8.152 1.892 327 HA ALA2069 HA ALA2069 0.953 6.723 3.464 328 1HB ALA2069 2HB ALA2069 -0.411 7.934 5.104 329 2HB ALA2069 3HB ALA2069 -0.751 6.203 5.170 330 3HB ALA2069 1HB ALA2069 -1.876 7.297 4.363 331 H VAL2070 H VAL2070 -0.128 4.463 3.864 332 HA VAL2070 HA VAL2070 -0.779 3.491 1.279 333 HB VAL2070 HB VAL2070 -0.906 1.292 2.328 334 1HG1 VAL2070 3HG1 VAL2070 1.302 2.160 1.793 335 2HG1 VAL2070 2HG1 VAL2070 1.408 2.894 3.392 336 3HG1 VAL2070 1HG1 VAL2070 1.361 1.137 3.233 337 1HG2 VAL2070 2HG2 VAL2070 -0.650 2.751 4.969 338 2HG2 VAL2070 1HG2 VAL2070 -2.047 1.833 4.410 339 3HG2 VAL2070 3HG2 VAL2070 -0.536 1.005 4.762 340 H ASP2071 H ASP2071 -2.714 2.537 0.601 341 HA ASP2071 HA ASP2071 -5.078 3.736 1.468 342 1HB ASP2071 2HB ASP2071 -4.943 2.929 -0.773 343 2HB ASP2071 1HB ASP2071 -4.555 1.299 -0.226 344 HA PRO2072 HA PRO2072 -5.716 1.307 5.150 345 1HB PRO2072 2HB PRO2072 -8.466 2.338 4.981 346 2HB PRO2072 1HB PRO2072 -7.276 2.485 6.283 347 1HG PRO2072 2HG PRO2072 -7.926 4.569 4.729 348 2HG PRO2072 1HG PRO2072 -6.280 4.338 5.342 349 1HD PRO2072 2HD PRO2072 -7.382 3.815 2.618 350 2HD PRO2072 1HD PRO2072 -5.797 4.451 3.117 351 H ARG2073 H ARG2073 -7.799 1.160 2.314 352 HA ARG2073 HA ARG2073 -9.195 -1.132 3.277 353 1HB ARG2073 2HB ARG2073 -10.223 0.383 1.600 354 2HB ARG2073 1HB ARG2073 -9.002 -0.095 0.429 355 1HG ARG2073 2HG ARG2073 -11.063 -1.272 -0.013 356 2HG ARG2073 1HG ARG2073 -9.846 -2.419 0.558 357 1HD ARG2073 2HD ARG2073 -10.828 -2.193 2.852 358 2HD ARG2073 1HD ARG2073 -12.110 -1.216 2.145 359 HE ARG2073 HE ARG2073 -11.667 -3.861 1.054 360 1HH1 ARG2073 1HH1 ARG2073 -13.574 -1.856 3.237 361 2HH1 ARG2073 2HH1 ARG2073 -14.915 -2.899 3.282 362 1HH2 ARG2073 1HH2 ARG2073 -13.463 -5.315 1.113 363 2HH2 ARG2073 2HH2 ARG2073 -14.847 -4.947 2.026 364 H PHE2074 H PHE2074 -6.328 -0.533 1.430 365 HA PHE2074 HA PHE2074 -5.831 -3.207 0.658 366 1HB PHE2074 2HB PHE2074 -4.641 -1.255 -0.340 367 2HB PHE2074 1HB PHE2074 -3.820 -0.997 1.194 368 HD1 PHE2074 1HD PHE2074 -1.833 -2.154 1.694 369 HD2 PHE2074 2HD PHE2074 -4.243 -3.411 -1.581 370 HE1 PHE2074 1HE PHE2074 -0.062 -3.700 0.986 371 HE2 PHE2074 2HE PHE2074 -2.472 -4.958 -2.296 372 HZ PHE2074 HZ PHE2074 -0.379 -5.106 -1.011 373 H LEU2075 H LEU2075 -5.224 -1.369 3.547 374 HA LEU2075 HA LEU2075 -3.757 -3.422 4.865 375 1HB LEU2075 2HB LEU2075 -5.356 -1.135 6.018 376 2HB LEU2075 1HB LEU2075 -4.327 -2.194 6.968 377 HG LEU2075 HG LEU2075 -3.463 -0.251 4.839 378 1HD1 LEU2075 2HD1 LEU2075 -3.043 -0.305 7.816 379 2HD1 LEU2075 1HD1 LEU2075 -2.359 0.877 6.701 380 3HD1 LEU2075 3HD1 LEU2075 -4.105 0.787 6.926 381 1HD2 LEU2075 2HD2 LEU2075 -1.829 -2.164 6.508 382 2HD2 LEU2075 1HD2 LEU2075 -2.045 -2.227 4.762 383 3HD2 LEU2075 3HD2 LEU2075 -1.165 -0.883 5.491 384 H ALA2076 H ALA2076 -7.154 -2.560 4.706 385 HA ALA2076 HA ALA2076 -8.133 -4.581 6.405 386 1HB ALA2076 2HB ALA2076 -10.299 -4.190 5.339 387 2HB ALA2076 1HB ALA2076 -9.486 -2.658 5.657 388 3HB ALA2076 3HB ALA2076 -9.500 -3.324 4.025 389 H TYR2077 H TYR2077 -7.211 -4.569 3.063 390 HA TYR2077 HA TYR2077 -8.148 -7.127 2.332 391 1HB TYR2077 2HB TYR2077 -7.479 -5.396 0.708 392 2HB TYR2077 1HB TYR2077 -5.816 -5.520 1.257 393 HD1 TYR2077 1HD TYR2077 -4.366 -6.925 0.125 394 HD2 TYR2077 2HD TYR2077 -8.551 -7.595 -0.142 395 HE1 TYR2077 1HE TYR2077 -3.972 -8.708 -1.511 396 HE2 TYR2077 2HE TYR2077 -8.173 -9.372 -1.765 397 HH TYR2077 HH TYR2077 -6.485 -10.072 -3.360 398 H MET2078 H MET2078 -5.217 -5.992 3.892 399 HA MET2078 HA MET2078 -3.986 -8.566 3.911 400 1HB MET2078 2HB MET2078 -3.354 -6.048 5.444 401 2HB MET2078 1HB MET2078 -2.452 -7.542 5.661 402 1HG MET2078 2HG MET2078 -2.720 -5.984 3.094 403 2HG MET2078 1HG MET2078 -1.299 -6.040 4.139 404 1HE MET2078 1HE MET2078 -1.121 -6.634 1.045 405 2HE MET2078 3HE MET2078 0.276 -6.766 2.118 406 3HE MET2078 2HE MET2078 -0.113 -8.082 1.009 407 H GLU2079 H GLU2079 -6.140 -6.864 6.018 408 HA GLU2079 HA GLU2079 -6.081 -8.646 8.243 409 1HB GLU2079 2HB GLU2079 -8.449 -7.111 7.140 410 2HB GLU2079 1HB GLU2079 -8.324 -7.790 8.752 411 1HG GLU2079 2HG GLU2079 -6.662 -5.544 7.639 412 2HG GLU2079 1HG GLU2079 -8.027 -5.375 8.742 413 H ASP2080 H ASP2080 -7.888 -8.455 5.293 414 HA ASP2080 HA ASP2080 -9.605 -10.655 5.522 415 1HB ASP2080 2HB ASP2080 -9.784 -8.822 3.854 416 2HB ASP2080 1HB ASP2080 -8.380 -9.478 3.028 417 H ARG2081 H ARG2081 -6.365 -10.346 4.157 418 HA ARG2081 HA ARG2081 -6.154 -13.055 3.345 419 1HB ARG2081 2HB ARG2081 -4.729 -11.388 2.287 420 2HB ARG2081 1HB ARG2081 -4.008 -10.973 3.836 421 1HG ARG2081 2HG ARG2081 -2.952 -13.148 3.973 422 2HG ARG2081 1HG ARG2081 -3.756 -13.658 2.493 423 1HD ARG2081 2HD ARG2081 -1.843 -11.332 2.637 424 2HD ARG2081 1HD ARG2081 -1.353 -12.972 2.238 425 HE ARG2081 HE ARG2081 -3.489 -11.991 0.580 426 1HH1 ARG2081 1HH1 ARG2081 0.024 -11.948 0.972 427 2HH1 ARG2081 2HH1 ARG2081 0.336 -11.844 -0.705 428 1HH2 ARG2081 1HH2 ARG2081 -3.046 -11.810 -1.697 429 2HH2 ARG2081 2HH2 ARG2081 -1.445 -11.737 -2.252 430 H ARG2082 H ARG2082 -6.230 -14.659 4.671 431 HA ARG2082 HA ARG2082 -4.715 -14.525 7.136 432 1HB ARG2082 2HB ARG2082 -6.595 -15.791 8.244 433 2HB ARG2082 1HB ARG2082 -6.934 -14.116 7.856 434 1HG ARG2082 2HG ARG2082 -8.017 -15.074 5.720 435 2HG ARG2082 1HG ARG2082 -8.004 -16.609 6.598 436 1HD ARG2082 2HD ARG2082 -10.124 -15.433 6.911 437 2HD ARG2082 1HD ARG2082 -9.244 -15.570 8.434 438 HE ARG2082 HE ARG2082 -8.423 -13.186 7.603 439 1HH1 ARG2082 1HH1 ARG2082 -11.708 -14.449 7.637 440 2HH1 ARG2082 2HH1 ARG2082 -12.440 -12.938 7.951 441 1HH2 ARG2082 1HH2 ARG2082 -9.389 -11.114 8.002 442 2HH2 ARG2082 2HH2 ARG2082 -11.077 -10.984 8.157 443 H LYS2083 H LYS2083 -4.588 -16.824 8.088 444 HA LYS2083 HA LYS2083 -3.795 -18.530 5.846 445 1HB LYS2083 2HB LYS2083 -1.849 -19.209 7.344 446 2HB LYS2083 1HB LYS2083 -1.789 -17.622 6.598 447 1HG LYS2083 2HG LYS2083 -2.593 -16.630 8.719 448 2HG LYS2083 1HG LYS2083 -2.534 -18.225 9.460 449 1HD LYS2083 2HD LYS2083 -0.147 -18.343 9.139 450 2HD LYS2083 1HD LYS2083 -0.162 -16.862 8.191 451 1HE LYS2083 2HE LYS2083 0.641 -16.457 10.471 452 2HE LYS2083 1HE LYS2083 -0.846 -15.578 10.137 453 1HZ LYS2083 2HZ LYS2083 -0.679 -18.135 11.646 454 2HZ LYS2083 1HZ LYS2083 -0.826 -16.596 12.321 455 3HZ LYS2083 3HZ LYS2083 -2.076 -17.220 11.395 456 H GLN2084 H GLN2084 -5.602 -18.413 8.724 457 HA GLN2084 HA GLN2084 -6.026 -21.278 8.512 458 1HB GLN2084 2HB GLN2084 -5.537 -19.807 11.110 459 2HB GLN2084 1HB GLN2084 -6.167 -21.438 10.986 460 1HG GLN2084 2HG GLN2084 -4.076 -22.134 9.922 461 2HG GLN2084 1HG GLN2084 -3.452 -20.495 10.107 462 1HE2 GLN2084 1HE2 GLN2084 -2.481 -22.994 11.182 463 2HE2 GLN2084 2HE2 GLN2084 -2.433 -22.797 12.898 464 H LYS2085 H LYS2085 -8.093 -21.877 9.459 465 HA LYS2085 HA LYS2085 -9.971 -19.676 9.359 466 1HB LYS2085 2HB LYS2085 -10.422 -22.657 9.512 467 2HB LYS2085 1HB LYS2085 -11.713 -21.476 9.609 468 1HG LYS2085 2HG LYS2085 -11.054 -20.652 7.365 469 2HG LYS2085 1HG LYS2085 -9.886 -21.979 7.285 470 1HD LYS2085 2HD LYS2085 -11.653 -23.600 7.492 471 2HD LYS2085 1HD LYS2085 -12.847 -22.324 7.714 472 1HE LYS2085 2HE LYS2085 -12.334 -21.482 5.463 473 2HE LYS2085 1HE LYS2085 -11.199 -22.819 5.247 474 1HZ LYS2085 1HZ LYS2085 -14.107 -23.100 5.754 475 2HZ LYS2085 3HZ LYS2085 -13.357 -23.246 4.251 476 3HZ LYS2085 2HZ LYS2085 -13.021 -24.359 5.477 No H/Q in entry = 476 Start of MODEL 2 1 H LEU2028 H LEU2028 4.572 -14.302 -1.893 2 HA LEU2028 HA LEU2028 2.459 -15.290 -0.216 3 1HB LEU2028 2HB LEU2028 4.492 -13.143 0.392 4 2HB LEU2028 1HB LEU2028 3.435 -13.929 1.531 5 HG LEU2028 HG LEU2028 5.628 -15.311 -0.005 6 1HD1 LEU2028 2HD1 LEU2028 5.527 -14.386 2.860 7 2HD1 LEU2028 1HD1 LEU2028 6.791 -15.388 2.146 8 3HD1 LEU2028 3HD1 LEU2028 6.549 -13.737 1.575 9 1HD2 LEU2028 1HD2 LEU2028 3.862 -16.284 2.244 10 2HD2 LEU2028 3HD2 LEU2028 3.817 -16.827 0.565 11 3HD2 LEU2028 2HD2 LEU2028 5.231 -17.157 1.566 12 H ASP2029 H ASP2029 3.447 -11.907 -0.804 13 HA ASP2029 HA ASP2029 0.643 -11.164 -1.182 14 1HB ASP2029 2HB ASP2029 2.255 -10.035 1.133 15 2HB ASP2029 1HB ASP2029 0.673 -9.471 0.625 16 H VAL2030 H VAL2030 3.770 -9.749 -0.407 17 HA VAL2030 HA VAL2030 3.529 -8.143 -2.786 18 HB VAL2030 HB VAL2030 2.813 -6.528 -1.193 19 1HG1 VAL2030 3HG1 VAL2030 5.109 -7.313 0.571 20 2HG1 VAL2030 2HG1 VAL2030 3.961 -5.997 0.847 21 3HG1 VAL2030 1HG1 VAL2030 3.393 -7.678 0.851 22 1HG2 VAL2030 3HG2 VAL2030 4.594 -5.739 -2.694 23 2HG2 VAL2030 2HG2 VAL2030 4.518 -4.836 -1.176 24 3HG2 VAL2030 1HG2 VAL2030 5.769 -6.063 -1.431 25 H ASP2031 H ASP2031 5.130 -8.294 -4.013 26 HA ASP2031 HA ASP2031 7.564 -9.667 -3.142 27 1HB ASP2031 2HB ASP2031 7.897 -10.078 -5.541 28 2HB ASP2031 1HB ASP2031 6.301 -10.607 -5.034 29 H LEU2032 H LEU2032 6.928 -6.801 -2.728 30 HA LEU2032 HA LEU2032 7.985 -4.825 -2.568 31 1HB LEU2032 2HB LEU2032 10.321 -6.235 -3.841 32 2HB LEU2032 1HB LEU2032 10.384 -4.605 -3.213 33 HG LEU2032 HG LEU2032 9.797 -7.061 -1.553 34 1HD1 LEU2032 3HD1 LEU2032 12.305 -5.418 -1.820 35 2HD1 LEU2032 2HD1 LEU2032 12.037 -6.723 -0.658 36 3HD1 LEU2032 1HD1 LEU2032 12.066 -7.073 -2.389 37 1HD2 LEU2032 3HD2 LEU2032 10.350 -4.200 -0.759 38 2HD2 LEU2032 2HD2 LEU2032 8.792 -5.023 -0.645 39 3HD2 LEU2032 1HD2 LEU2032 10.147 -5.557 0.348 40 H GLU2033 H GLU2033 7.981 -6.268 -5.728 41 HA GLU2033 HA GLU2033 8.177 -3.661 -6.945 42 1HB GLU2033 2HB GLU2033 7.600 -6.330 -8.195 43 2HB GLU2033 1HB GLU2033 7.954 -4.839 -9.061 44 1HG GLU2033 2HG GLU2033 10.154 -4.820 -7.830 45 2HG GLU2033 1HG GLU2033 9.780 -6.475 -7.347 46 H THR2034 H THR2034 5.804 -5.425 -5.499 47 HA THR2034 HA THR2034 3.495 -5.051 -6.993 48 HB THR2034 HB THR2034 3.598 -4.750 -4.021 49 HG1 THR2034 1HG THR2034 4.343 -7.107 -5.515 50 1HG2 THR2034 3HG2 THR2034 1.415 -4.913 -5.155 51 2HG2 THR2034 2HG2 THR2034 1.906 -6.456 -5.869 52 3HG2 THR2034 1HG2 THR2034 1.714 -6.313 -4.124 53 H ARG2035 H ARG2035 2.318 -3.152 -7.350 54 HA ARG2035 HA ARG2035 3.306 -0.709 -6.183 55 1HB ARG2035 2HB ARG2035 1.281 -1.287 -8.336 56 2HB ARG2035 1HB ARG2035 1.386 0.308 -7.616 57 1HG ARG2035 2HG ARG2035 2.641 0.313 -9.651 58 2HG ARG2035 1HG ARG2035 3.764 0.420 -8.300 59 1HD ARG2035 2HD ARG2035 4.750 -1.075 -9.790 60 2HD ARG2035 1HD ARG2035 4.036 -2.098 -8.548 61 HE ARG2035 HE ARG2035 2.334 -1.653 -10.828 62 1HH1 ARG2035 1HH1 ARG2035 4.867 -3.783 -9.523 63 2HH1 ARG2035 2HH1 ARG2035 4.535 -5.050 -10.622 64 1HH2 ARG2035 1HH2 ARG2035 1.931 -3.296 -12.268 65 2HH2 ARG2035 2HH2 ARG2035 2.804 -4.784 -12.253 66 H ILE2036 H ILE2036 2.735 -0.256 -4.240 67 HA ILE2036 HA ILE2036 0.269 -1.244 -3.142 68 HB ILE2036 HB ILE2036 2.328 0.578 -1.882 69 1HG1 ILE2036 2HG1 ILE2036 3.434 -1.503 -2.497 70 2HG1 ILE2036 1HG1 ILE2036 3.195 -1.480 -0.760 71 1HG2 ILE2036 2HG2 ILE2036 0.175 0.638 -0.750 72 2HG2 ILE2036 1HG2 ILE2036 0.189 -1.115 -0.595 73 3HG2 ILE2036 3HG2 ILE2036 1.386 -0.142 0.263 74 1HD1 ILE2036 3HD1 ILE2036 1.270 -2.975 -1.045 75 2HD1 ILE2036 2HD1 ILE2036 1.574 -2.994 -2.782 76 3HD1 ILE2036 1HD1 ILE2036 2.766 -3.663 -1.677 77 HA PRO2037 HA PRO2037 -1.895 2.512 -4.311 78 1HB PRO2037 2HB PRO2037 -4.177 1.996 -2.888 79 2HB PRO2037 1HB PRO2037 -3.826 1.297 -4.468 80 1HG PRO2037 2HG PRO2037 -3.527 0.085 -1.761 81 2HG PRO2037 1HG PRO2037 -4.097 -0.659 -3.264 82 1HD PRO2037 2HD PRO2037 -1.605 -1.029 -2.288 83 2HD PRO2037 1HD PRO2037 -1.962 -1.044 -4.026 84 H VAL2038 H VAL2038 -2.042 4.464 -3.435 85 HA VAL2038 HA VAL2038 -1.849 4.732 -0.523 86 HB VAL2038 HB VAL2038 -0.295 6.635 -0.762 87 1HG1 VAL2038 3HG1 VAL2038 0.722 4.059 -1.916 88 2HG1 VAL2038 2HG1 VAL2038 1.723 5.364 -1.275 89 3HG1 VAL2038 1HG1 VAL2038 0.628 4.487 -0.204 90 1HG2 VAL2038 3HG2 VAL2038 -0.796 7.288 -3.054 91 2HG2 VAL2038 2HG2 VAL2038 0.933 6.982 -2.863 92 3HG2 VAL2038 1HG2 VAL2038 -0.098 5.781 -3.645 93 H ILE2039 H ILE2039 -2.415 6.867 0.218 94 HA ILE2039 HA ILE2039 -4.095 8.330 -1.644 95 HB ILE2039 HB ILE2039 -5.626 6.857 -0.455 96 1HG1 ILE2039 2HG1 ILE2039 -5.833 9.690 0.608 97 2HG1 ILE2039 1HG1 ILE2039 -6.399 9.143 -0.964 98 1HG2 ILE2039 1HG2 ILE2039 -4.321 6.340 1.508 99 2HG2 ILE2039 3HG2 ILE2039 -4.511 7.991 2.104 100 3HG2 ILE2039 2HG2 ILE2039 -5.915 6.931 1.985 101 1HD1 ILE2039 1HD1 ILE2039 -8.017 7.688 0.134 102 2HD1 ILE2039 3HD1 ILE2039 -7.445 8.247 1.706 103 3HD1 ILE2039 2HD1 ILE2039 -8.233 9.375 0.597 104 H ASN2040 H ASN2040 -4.010 10.451 -1.411 105 HA ASN2040 HA ASN2040 -2.141 11.619 0.489 106 1HB ASN2040 2HB ASN2040 -2.350 12.521 -1.865 107 2HB ASN2040 1HB ASN2040 -3.999 13.003 -1.493 108 1HD2 ASN2040 1HD2 ASN2040 -1.783 14.675 -2.361 109 2HD2 ASN2040 2HD2 ASN2040 -1.519 15.837 -1.129 110 H LYS2041 H LYS2041 -2.771 12.088 2.451 111 HA LYS2041 HA LYS2041 -5.470 11.773 3.313 112 1HB LYS2041 2HB LYS2041 -3.027 12.805 4.690 113 2HB LYS2041 1HB LYS2041 -4.557 12.510 5.494 114 1HG LYS2041 2HG LYS2041 -4.415 10.151 5.073 115 2HG LYS2041 1HG LYS2041 -2.991 10.376 4.049 116 1HD LYS2041 2HD LYS2041 -3.082 11.200 6.932 117 2HD LYS2041 1HD LYS2041 -2.556 9.589 6.423 118 1HE LYS2041 2HE LYS2041 -0.722 10.486 5.208 119 2HE LYS2041 1HE LYS2041 -1.316 12.129 5.341 120 1HZ LYS2041 1HZ LYS2041 -0.377 10.478 7.626 121 2HZ LYS2041 3HZ LYS2041 0.524 11.658 6.814 122 3HZ LYS2041 2HZ LYS2041 -0.847 12.108 7.666 123 H VAL2042 H VAL2042 -3.491 14.475 2.430 124 HA VAL2042 HA VAL2042 -5.110 16.432 3.756 125 HB VAL2042 HB VAL2042 -3.045 16.857 1.578 126 1HG1 VAL2042 1HG1 VAL2042 -4.175 18.747 3.633 127 2HG1 VAL2042 3HG1 VAL2042 -2.866 19.117 2.514 128 3HG1 VAL2042 2HG1 VAL2042 -4.485 18.778 1.899 129 1HG2 VAL2042 3HG2 VAL2042 -2.048 15.665 3.456 130 2HG2 VAL2042 2HG2 VAL2042 -1.457 17.327 3.393 131 3HG2 VAL2042 1HG2 VAL2042 -2.687 16.872 4.574 132 H ASP2043 H ASP2043 -4.511 15.557 0.395 133 HA ASP2043 HA ASP2043 -6.718 17.195 -0.522 134 1HB ASP2043 2HB ASP2043 -4.769 17.050 -1.948 135 2HB ASP2043 1HB ASP2043 -4.935 15.302 -2.055 136 H GLY2044 H GLY2044 -6.032 13.692 -0.552 137 1HA GLY2044 1HA GLY2044 -8.896 13.271 -1.076 138 2HA GLY2044 2HA GLY2044 -7.939 12.256 -0.004 139 H THR2045 H THR2045 -6.087 13.235 -2.576 140 HA THR2045 HA THR2045 -6.730 11.793 -4.831 141 HB THR2045 HB THR2045 -3.896 11.976 -3.874 142 HG1 THR2045 1HG THR2045 -5.705 14.105 -4.304 143 1HG2 THR2045 2HG2 THR2045 -4.363 11.044 -6.101 144 2HG2 THR2045 1HG2 THR2045 -5.225 12.515 -6.538 145 3HG2 THR2045 3HG2 THR2045 -3.492 12.572 -6.217 146 H LEU2046 H LEU2046 -7.005 9.591 -5.069 147 HA LEU2046 HA LEU2046 -5.416 7.804 -3.374 148 1HB LEU2046 2HB LEU2046 -7.849 7.529 -3.201 149 2HB LEU2046 1HB LEU2046 -7.955 7.300 -4.933 150 HG LEU2046 HG LEU2046 -6.560 5.242 -4.671 151 1HD1 LEU2046 1HD1 LEU2046 -7.065 5.679 -1.736 152 2HD1 LEU2046 3HD1 LEU2046 -6.410 4.211 -2.460 153 3HD1 LEU2046 2HD1 LEU2046 -5.500 5.716 -2.553 154 1HD2 LEU2046 2HD2 LEU2046 -9.171 5.328 -3.195 155 2HD2 LEU2046 1HD2 LEU2046 -8.960 5.114 -4.935 156 3HD2 LEU2046 3HD2 LEU2046 -8.397 3.869 -3.817 157 H LEU2047 H LEU2047 -3.836 6.675 -4.337 158 HA LEU2047 HA LEU2047 -3.775 6.607 -7.291 159 1HB LEU2047 2HB LEU2047 -1.412 6.227 -5.455 160 2HB LEU2047 1HB LEU2047 -1.425 6.436 -7.202 161 HG LEU2047 HG LEU2047 -2.001 8.553 -5.132 162 1HD1 LEU2047 1HD1 LEU2047 0.345 8.025 -5.343 163 2HD1 LEU2047 3HD1 LEU2047 0.254 8.236 -7.091 164 3HD1 LEU2047 2HD1 LEU2047 0.005 9.619 -6.025 165 1HD2 LEU2047 1HD2 LEU2047 -2.061 8.730 -8.141 166 2HD2 LEU2047 3HD2 LEU2047 -3.440 8.900 -7.056 167 3HD2 LEU2047 2HD2 LEU2047 -2.150 10.106 -7.037 168 H VAL2048 H VAL2048 -3.998 4.739 -8.198 169 HA VAL2048 HA VAL2048 -3.458 2.300 -6.665 170 HB VAL2048 HB VAL2048 -5.559 1.293 -7.654 171 1HG1 VAL2048 3HG1 VAL2048 -5.924 3.632 -5.789 172 2HG1 VAL2048 2HG1 VAL2048 -7.121 2.367 -6.047 173 3HG1 VAL2048 1HG1 VAL2048 -5.561 1.977 -5.322 174 1HG2 VAL2048 3HG2 VAL2048 -5.896 2.903 -9.455 175 2HG2 VAL2048 2HG2 VAL2048 -7.325 2.810 -8.422 176 3HG2 VAL2048 1HG2 VAL2048 -6.212 4.173 -8.272 177 H GLY2049 H GLY2049 -3.660 0.354 -8.246 178 1HA GLY2049 1HA GLY2049 -3.495 0.739 -11.043 179 2HA GLY2049 2HA GLY2049 -3.080 -0.727 -10.175 180 H GLU2050 H GLU2050 -1.868 1.532 -12.189 181 HA GLU2050 HA GLU2050 0.872 0.899 -11.345 182 1HB GLU2050 2HB GLU2050 -0.145 1.875 -14.018 183 2HB GLU2050 1HB GLU2050 1.548 1.620 -13.633 184 1HG GLU2050 2HG GLU2050 -0.610 -0.475 -13.745 185 2HG GLU2050 1HG GLU2050 0.691 -0.236 -14.908 186 H ASP2051 H ASP2051 -1.277 3.250 -11.009 187 HA ASP2051 HA ASP2051 0.465 5.530 -11.426 188 1HB ASP2051 2HB ASP2051 -2.072 5.359 -11.708 189 2HB ASP2051 1HB ASP2051 -2.150 5.439 -9.968 190 H ALA2052 H ALA2052 -0.555 3.370 -9.012 191 HA ALA2052 HA ALA2052 0.289 4.830 -6.734 192 1HB ALA2052 1HB ALA2052 -0.038 2.671 -5.564 193 2HB ALA2052 2HB ALA2052 -0.306 1.897 -7.133 194 3HB ALA2052 3HB ALA2052 -1.408 3.158 -6.560 195 HA PRO2053 HA PRO2053 4.614 3.946 -7.016 196 1HB PRO2053 2HB PRO2053 4.880 3.933 -4.111 197 2HB PRO2053 1HB PRO2053 5.452 5.129 -5.276 198 1HG PRO2053 2HG PRO2053 3.425 5.667 -3.586 199 2HG PRO2053 1HG PRO2053 3.478 6.320 -5.232 200 1HD PRO2053 2HD PRO2053 1.968 3.941 -4.201 201 2HD PRO2053 1HD PRO2053 1.402 5.276 -5.234 202 H ARG2054 H ARG2054 5.822 2.257 -7.280 203 HA ARG2054 HA ARG2054 5.408 -0.390 -6.633 204 1HB ARG2054 2HB ARG2054 6.928 0.610 -8.326 205 2HB ARG2054 1HB ARG2054 7.965 1.168 -7.037 206 1HG ARG2054 2HG ARG2054 8.345 -1.207 -6.427 207 2HG ARG2054 1HG ARG2054 7.423 -1.655 -7.877 208 1HD ARG2054 2HD ARG2054 9.023 -0.263 -9.220 209 2HD ARG2054 1HD ARG2054 9.990 -0.040 -7.770 210 HE ARG2054 HE ARG2054 9.467 -2.632 -9.033 211 1HH1 ARG2054 1HH1 ARG2054 11.781 -0.447 -7.287 212 2HH1 ARG2054 2HH1 ARG2054 13.072 -1.513 -7.520 213 1HH2 ARG2054 1HH2 ARG2054 11.375 -4.046 -9.301 214 2HH2 ARG2054 2HH2 ARG2054 12.842 -3.552 -8.624 215 H ARG2055 H ARG2055 5.752 -1.505 -4.705 216 HA ARG2055 HA ARG2055 5.877 -0.317 -2.261 217 1HB ARG2055 2HB ARG2055 5.090 -2.543 -2.389 218 2HB ARG2055 1HB ARG2055 6.582 -3.101 -3.103 219 1HG ARG2055 2HG ARG2055 6.350 -3.880 -0.853 220 2HG ARG2055 1HG ARG2055 7.736 -2.792 -0.998 221 1HD ARG2055 2HD ARG2055 6.240 -0.983 -0.060 222 2HD ARG2055 1HD ARG2055 5.047 -2.246 0.269 223 HE ARG2055 HE ARG2055 7.268 -3.239 1.371 224 1HH1 ARG2055 1HH1 ARG2055 5.365 -0.339 1.951 225 2HH1 ARG2055 2HH1 ARG2055 6.103 0.065 3.425 226 1HH2 ARG2055 1HH2 ARG2055 8.336 -2.711 3.386 227 2HH2 ARG2055 2HH2 ARG2055 7.906 -1.287 4.232 228 H ALA2056 H ALA2056 8.677 -1.715 -3.926 229 HA ALA2056 HA ALA2056 10.612 -1.345 -1.972 230 1HB ALA2056 3HB ALA2056 12.247 -1.385 -3.790 231 2HB ALA2056 1HB ALA2056 10.961 -1.069 -4.956 232 3HB ALA2056 2HB ALA2056 10.981 -2.584 -4.056 233 H GLU2057 H GLU2057 9.328 0.943 -4.283 234 HA GLU2057 HA GLU2057 11.198 3.052 -3.620 235 1HB GLU2057 2HB GLU2057 8.609 3.295 -5.144 236 2HB GLU2057 1HB GLU2057 10.018 4.329 -5.261 237 1HG GLU2057 2HG GLU2057 9.744 1.506 -6.244 238 2HG GLU2057 1HG GLU2057 9.840 2.964 -7.236 239 H LEU2058 H LEU2058 7.918 2.118 -3.118 240 HA LEU2058 HA LEU2058 6.615 4.281 -2.154 241 1HB LEU2058 2HB LEU2058 5.594 2.166 -2.801 242 2HB LEU2058 1HB LEU2058 6.308 1.398 -1.409 243 HG LEU2058 HG LEU2058 3.799 1.875 -1.381 244 1HD1 LEU2058 1HD1 LEU2058 4.984 1.153 0.602 245 2HD1 LEU2058 3HD1 LEU2058 5.449 2.820 0.946 246 3HD1 LEU2058 2HD1 LEU2058 3.751 2.346 0.996 247 1HD2 LEU2058 2HD2 LEU2058 4.831 4.635 -0.827 248 2HD2 LEU2058 1HD2 LEU2058 3.824 4.127 -2.182 249 3HD2 LEU2058 3HD2 LEU2058 3.178 4.094 -0.540 250 H GLU2059 H GLU2059 8.417 1.963 -0.120 251 HA GLU2059 HA GLU2059 7.591 3.274 2.251 252 1HB GLU2059 2HB GLU2059 8.270 0.938 2.299 253 2HB GLU2059 1HB GLU2059 9.915 1.389 1.861 254 1HG GLU2059 2HG GLU2059 10.349 2.324 3.915 255 2HG GLU2059 1HG GLU2059 8.644 2.526 4.286 256 H MET2060 H MET2060 10.328 3.680 0.242 257 HA MET2060 HA MET2060 11.673 5.591 1.931 258 1HB MET2060 2HB MET2060 11.931 5.117 -1.047 259 2HB MET2060 1HB MET2060 13.007 6.125 -0.095 260 1HG MET2060 2HG MET2060 13.714 4.158 1.178 261 2HG MET2060 1HG MET2060 12.631 3.155 0.218 262 1HE MET2060 3HE MET2060 12.971 2.659 -2.369 263 2HE MET2060 2HE MET2060 12.987 4.389 -2.726 264 3HE MET2060 1HE MET2060 14.268 3.348 -3.343 265 H TRP2061 H TRP2061 9.445 5.652 -0.711 266 HA TRP2061 HA TRP2061 9.373 8.377 -1.331 267 1HB TRP2061 2HB TRP2061 8.534 6.539 -2.751 268 2HB TRP2061 1HB TRP2061 7.233 6.277 -1.612 269 HD1 TRP2061 HD TRP2061 8.462 8.888 -4.142 270 HE1 TRP2061 1HE TRP2061 6.436 10.218 -4.953 271 HE3 TRP2061 3HE TRP2061 4.897 6.916 -1.056 272 HZ2 TRP2061 2HZ TRP2061 3.688 10.421 -4.383 273 HZ3 TRP2061 3HZ TRP2061 2.594 7.732 -1.265 274 HH2 TRP2061 HH TRP2061 2.004 9.448 -2.892 275 H LEU2062 H LEU2062 7.295 6.463 0.843 276 HA LEU2062 HA LEU2062 5.523 8.490 1.617 277 1HB LEU2062 2HB LEU2062 6.458 6.062 3.112 278 2HB LEU2062 1HB LEU2062 5.195 7.121 3.707 279 HG LEU2062 HG LEU2062 5.081 5.493 1.170 280 1HD1 LEU2062 1HD1 LEU2062 4.992 4.137 3.193 281 2HD1 LEU2062 3HD1 LEU2062 3.689 5.150 3.820 282 3HD1 LEU2062 2HD1 LEU2062 3.434 4.181 2.368 283 1HD2 LEU2062 2HD2 LEU2062 3.000 7.218 2.518 284 2HD2 LEU2062 1HD2 LEU2062 3.775 7.548 0.972 285 3HD2 LEU2062 3HD2 LEU2062 2.707 6.155 1.142 286 H GLN2063 H GLN2063 8.690 7.717 2.787 287 HA GLN2063 HA GLN2063 8.568 9.231 5.155 288 1HB GLN2063 2HB GLN2063 10.844 8.234 3.489 289 2HB GLN2063 1HB GLN2063 11.077 9.135 4.983 290 1HG GLN2063 2HG GLN2063 9.898 7.422 6.234 291 2HG GLN2063 1HG GLN2063 9.517 6.561 4.744 292 1HE2 GLN2063 1HE2 GLN2063 11.037 5.322 3.802 293 2HE2 GLN2063 2HE2 GLN2063 12.577 4.968 4.508 294 H GLY2064 H GLY2064 9.187 10.074 1.884 295 1HA GLY2064 1HA GLY2064 10.049 12.129 1.031 296 2HA GLY2064 2HA GLY2064 9.970 12.789 2.662 297 H HIS2065 H HIS2065 7.170 11.176 2.250 298 HA HIS2065 HA HIS2065 5.741 13.605 1.495 299 1HB HIS2065 2HB HIS2065 5.240 10.877 0.279 300 2HB HIS2065 1HB HIS2065 4.091 12.199 0.196 301 HD1 HIS2065 1HD HIS2065 7.292 10.986 -1.269 302 HD2 HIS2065 2HD HIS2065 4.746 14.240 -1.566 303 HE1 HIS2065 1HE HIS2065 7.987 12.228 -3.364 304 HA PRO2066 HA PRO2066 4.056 11.595 5.344 305 1HB PRO2066 2HB PRO2066 3.663 13.947 6.684 306 2HB PRO2066 1HB PRO2066 5.178 13.041 6.740 307 1HG PRO2066 2HG PRO2066 4.459 15.424 5.075 308 2HG PRO2066 1HG PRO2066 5.962 15.082 5.952 309 1HD PRO2066 2HD PRO2066 5.756 14.721 3.296 310 2HD PRO2066 1HD PRO2066 6.745 13.658 4.310 311 H GLU2067 H GLU2067 3.007 13.818 3.051 312 HA GLU2067 HA GLU2067 0.331 14.323 3.905 313 1HB GLU2067 2HB GLU2067 1.537 14.355 1.134 314 2HB GLU2067 1HB GLU2067 -0.039 15.003 1.561 315 1HG GLU2067 2HG GLU2067 1.010 16.660 2.980 316 2HG GLU2067 1HG GLU2067 2.596 15.977 2.632 317 H PHE2068 H PHE2068 1.934 11.699 2.322 318 HA PHE2068 HA PHE2068 -0.624 10.542 1.523 319 1HB PHE2068 2HB PHE2068 2.183 10.008 0.564 320 2HB PHE2068 1HB PHE2068 0.826 8.969 0.173 321 HD1 PHE2068 1HD PHE2068 2.094 12.446 -0.178 322 HD2 PHE2068 2HD PHE2068 -0.561 9.456 -1.641 323 HE1 PHE2068 1HE PHE2068 1.611 13.841 -2.139 324 HE2 PHE2068 2HE PHE2068 -1.059 10.853 -3.602 325 HZ PHE2068 HZ PHE2068 0.030 13.050 -3.856 326 H ALA2069 H ALA2069 -1.051 8.426 1.973 327 HA ALA2069 HA ALA2069 0.654 6.958 3.804 328 1HB ALA2069 2HB ALA2069 -2.262 7.626 4.305 329 2HB ALA2069 1HB ALA2069 -1.330 6.445 5.222 330 3HB ALA2069 3HB ALA2069 -0.893 8.150 5.285 331 H VAL2070 H VAL2070 -0.180 4.645 3.832 332 HA VAL2070 HA VAL2070 -0.923 3.964 1.174 333 HB VAL2070 HB VAL2070 -0.751 1.629 1.888 334 1HG1 VAL2070 1HG1 VAL2070 1.548 3.338 2.800 335 2HG1 VAL2070 3HG1 VAL2070 1.640 1.613 2.452 336 3HG1 VAL2070 2HG1 VAL2070 1.259 2.753 1.160 337 1HG2 VAL2070 2HG2 VAL2070 -0.226 2.764 4.632 338 2HG2 VAL2070 1HG2 VAL2070 -1.589 1.764 4.133 339 3HG2 VAL2070 3HG2 VAL2070 0.033 1.081 4.161 340 H ASP2071 H ASP2071 -2.682 2.740 0.536 341 HA ASP2071 HA ASP2071 -5.149 3.624 1.493 342 1HB ASP2071 2HB ASP2071 -4.940 2.961 -0.800 343 2HB ASP2071 1HB ASP2071 -4.399 1.360 -0.337 344 HA PRO2072 HA PRO2072 -5.541 0.912 5.018 345 1HB PRO2072 2HB PRO2072 -8.363 1.684 5.056 346 2HB PRO2072 1HB PRO2072 -7.101 1.961 6.260 347 1HG PRO2072 2HG PRO2072 -8.093 3.972 4.769 348 2HG PRO2072 1HG PRO2072 -6.396 3.917 5.270 349 1HD PRO2072 2HD PRO2072 -7.613 3.229 2.629 350 2HD PRO2072 1HD PRO2072 -6.115 4.119 3.017 351 H ARG2073 H ARG2073 -7.451 0.593 2.163 352 HA ARG2073 HA ARG2073 -8.894 -1.750 3.021 353 1HB ARG2073 2HB ARG2073 -8.387 -0.590 0.280 354 2HB ARG2073 1HB ARG2073 -9.524 -1.882 0.639 355 1HG ARG2073 2HG ARG2073 -11.039 -0.492 1.562 356 2HG ARG2073 1HG ARG2073 -9.811 0.624 2.155 357 1HD ARG2073 2HD ARG2073 -11.200 1.569 0.309 358 2HD ARG2073 1HD ARG2073 -9.476 1.542 -0.042 359 HE ARG2073 HE ARG2073 -11.412 -0.407 -1.062 360 1HH1 ARG2073 1HH1 ARG2073 -8.429 1.514 -1.503 361 2HH1 ARG2073 2HH1 ARG2073 -8.236 1.065 -3.132 362 1HH2 ARG2073 1HH2 ARG2073 -11.116 -0.984 -3.335 363 2HH2 ARG2073 2HH2 ARG2073 -9.781 -0.341 -4.191 364 H PHE2074 H PHE2074 -6.063 -0.957 1.098 365 HA PHE2074 HA PHE2074 -5.298 -3.599 0.544 366 1HB PHE2074 2HB PHE2074 -4.228 -1.695 -0.600 367 2HB PHE2074 1HB PHE2074 -3.482 -1.173 0.909 368 HD1 PHE2074 1HD PHE2074 -1.485 -2.233 1.711 369 HD2 PHE2074 2HD PHE2074 -3.566 -3.838 -1.639 370 HE1 PHE2074 1HE PHE2074 0.389 -3.764 1.284 371 HE2 PHE2074 2HE PHE2074 -1.692 -5.368 -2.074 372 HZ PHE2074 HZ PHE2074 0.284 -5.337 -0.608 373 H LEU2075 H LEU2075 -4.643 -1.455 3.234 374 HA LEU2075 HA LEU2075 -2.997 -3.161 4.716 375 1HB LEU2075 2HB LEU2075 -4.924 -1.064 5.692 376 2HB LEU2075 1HB LEU2075 -3.828 -1.921 6.748 377 HG LEU2075 HG LEU2075 -3.015 -0.111 4.479 378 1HD1 LEU2075 1HD1 LEU2075 -3.969 1.105 6.377 379 2HD1 LEU2075 3HD1 LEU2075 -2.872 0.257 7.465 380 3HD1 LEU2075 2HD1 LEU2075 -2.228 1.367 6.262 381 1HD2 LEU2075 3HD2 LEU2075 -1.373 -1.617 6.523 382 2HD2 LEU2075 2HD2 LEU2075 -1.386 -1.879 4.777 383 3HD2 LEU2075 1HD2 LEU2075 -0.746 -0.381 5.435 384 H ALA2076 H ALA2076 -6.498 -2.985 4.567 385 HA ALA2076 HA ALA2076 -7.091 -4.825 6.579 386 1HB ALA2076 3HB ALA2076 -9.236 -5.109 5.463 387 2HB ALA2076 1HB ALA2076 -8.591 -4.356 3.999 388 3HB ALA2076 2HB ALA2076 -8.755 -3.411 5.472 389 H TYR2077 H TYR2077 -6.357 -5.365 3.164 390 HA TYR2077 HA TYR2077 -6.539 -8.200 3.294 391 1HB TYR2077 2HB TYR2077 -5.306 -6.306 1.332 392 2HB TYR2077 1HB TYR2077 -4.980 -8.030 1.213 393 HD1 TYR2077 1HD TYR2077 -6.710 -9.579 0.629 394 HD2 TYR2077 2HD TYR2077 -7.514 -5.415 0.833 395 HE1 TYR2077 1HE TYR2077 -8.786 -9.937 -0.604 396 HE2 TYR2077 2HE TYR2077 -9.602 -5.757 -0.413 397 HH TYR2077 HH TYR2077 -10.862 -8.929 -1.018 398 H MET2078 H MET2078 -3.976 -5.911 3.836 399 HA MET2078 HA MET2078 -1.894 -7.858 3.923 400 1HB MET2078 2HB MET2078 -1.533 -5.440 3.399 401 2HB MET2078 1HB MET2078 -1.860 -5.067 5.085 402 1HG MET2078 2HG MET2078 0.057 -6.469 5.735 403 2HG MET2078 1HG MET2078 0.400 -6.751 4.033 404 1HE MET2078 3HE MET2078 2.858 -5.955 4.344 405 2HE MET2078 2HE MET2078 3.330 -4.412 5.059 406 3HE MET2078 1HE MET2078 2.578 -5.654 6.058 407 H GLU2079 H GLU2079 -4.042 -6.496 6.352 408 HA GLU2079 HA GLU2079 -2.621 -7.603 8.578 409 1HB GLU2079 2HB GLU2079 -5.515 -6.758 8.410 410 2HB GLU2079 1HB GLU2079 -4.646 -7.106 9.891 411 1HG GLU2079 2HG GLU2079 -3.101 -5.189 9.254 412 2HG GLU2079 1HG GLU2079 -4.309 -4.820 8.008 413 H ASP2080 H ASP2080 -5.302 -8.597 6.591 414 HA ASP2080 HA ASP2080 -5.944 -10.944 8.071 415 1HB ASP2080 2HB ASP2080 -7.500 -9.790 6.491 416 2HB ASP2080 1HB ASP2080 -6.488 -10.326 5.160 417 H ARG2081 H ARG2081 -4.184 -10.292 5.157 418 HA ARG2081 HA ARG2081 -2.625 -11.298 3.970 419 1HB ARG2081 2HB ARG2081 -1.417 -10.404 5.933 420 2HB ARG2081 1HB ARG2081 -1.479 -12.004 6.661 421 1HG ARG2081 2HG ARG2081 -0.182 -12.921 4.894 422 2HG ARG2081 1HG ARG2081 -0.231 -11.405 4.005 423 1HD ARG2081 2HD ARG2081 0.972 -10.356 5.954 424 2HD ARG2081 1HD ARG2081 1.199 -11.994 6.588 425 HE ARG2081 HE ARG2081 1.941 -11.910 3.905 426 1HH1 ARG2081 1HH1 ARG2081 3.158 -10.764 7.026 427 2HH1 ARG2081 2HH1 ARG2081 4.790 -10.776 6.544 428 1HH2 ARG2081 1HH2 ARG2081 4.160 -11.907 3.260 429 2HH2 ARG2081 2HH2 ARG2081 5.381 -11.401 4.345 430 H ARG2082 H ARG2082 -3.974 -12.885 3.032 431 HA ARG2082 HA ARG2082 -2.763 -15.440 3.270 432 1HB ARG2082 2HB ARG2082 -4.958 -16.673 3.561 433 2HB ARG2082 1HB ARG2082 -4.338 -15.880 4.995 434 1HG ARG2082 2HG ARG2082 -5.918 -14.039 4.647 435 2HG ARG2082 1HG ARG2082 -6.533 -14.857 3.213 436 1HD ARG2082 2HD ARG2082 -7.352 -16.687 4.519 437 2HD ARG2082 1HD ARG2082 -6.543 -16.088 5.965 438 HE ARG2082 HE ARG2082 -8.109 -14.037 5.244 439 1HH1 ARG2082 1HH1 ARG2082 -8.880 -17.464 5.813 440 2HH1 ARG2082 2HH1 ARG2082 -10.393 -17.124 6.517 441 1HH2 ARG2082 1HH2 ARG2082 -10.214 -13.639 6.182 442 2HH2 ARG2082 2HH2 ARG2082 -11.171 -14.970 6.698 443 H LYS2083 H LYS2083 -2.432 -16.041 1.313 444 HA LYS2083 HA LYS2083 -4.387 -15.279 -0.699 445 1HB LYS2083 2HB LYS2083 -2.638 -15.834 -2.408 446 2HB LYS2083 1HB LYS2083 -2.215 -14.502 -1.361 447 1HG LYS2083 2HG LYS2083 -0.229 -15.734 -1.691 448 2HG LYS2083 1HG LYS2083 -0.773 -16.148 -0.075 449 1HD LYS2083 2HD LYS2083 -1.633 -18.268 -0.871 450 2HD LYS2083 1HD LYS2083 -1.227 -17.840 -2.532 451 1HE LYS2083 2HE LYS2083 1.141 -17.743 -1.935 452 2HE LYS2083 1HE LYS2083 0.744 -18.157 -0.270 453 1HZ LYS2083 1HZ LYS2083 0.221 -19.931 -2.619 454 2HZ LYS2083 3HZ LYS2083 1.539 -20.025 -1.560 455 3HZ LYS2083 2HZ LYS2083 -0.010 -20.288 -0.972 456 H GLN2084 H GLN2084 -5.210 -16.828 -2.124 457 HA GLN2084 HA GLN2084 -4.783 -19.511 -1.109 458 1HB GLN2084 2HB GLN2084 -7.011 -18.643 -0.474 459 2HB GLN2084 1HB GLN2084 -7.393 -18.420 -2.173 460 1HG GLN2084 2HG GLN2084 -7.377 -20.760 -2.570 461 2HG GLN2084 1HG GLN2084 -6.700 -21.085 -0.978 462 1HE2 GLN2084 1HE2 GLN2084 -9.154 -22.031 -2.231 463 2HE2 GLN2084 2HE2 GLN2084 -10.437 -21.574 -1.171 464 H LYS2085 H LYS2085 -3.170 -19.744 -2.503 465 HA LYS2085 HA LYS2085 -3.945 -20.894 -4.960 466 1HB LYS2085 2HB LYS2085 -2.283 -19.644 -6.366 467 2HB LYS2085 1HB LYS2085 -3.670 -18.686 -5.899 468 1HG LYS2085 2HG LYS2085 -2.373 -17.468 -4.287 469 2HG LYS2085 1HG LYS2085 -0.992 -18.545 -4.513 470 1HD LYS2085 2HD LYS2085 -2.160 -16.773 -6.671 471 2HD LYS2085 1HD LYS2085 -0.777 -16.335 -5.668 472 1HE LYS2085 2HE LYS2085 0.474 -18.249 -6.525 473 2HE LYS2085 1HE LYS2085 -0.909 -18.751 -7.490 474 1HZ LYS2085 2HZ LYS2085 0.591 -16.209 -7.836 475 2HZ LYS2085 1HZ LYS2085 0.702 -17.569 -8.818 476 3HZ LYS2085 3HZ LYS2085 -0.730 -16.704 -8.744 No H/Q in entry = 476 Start of MODEL 3 1 H LEU2028 H LEU2028 8.162 -12.428 1.343 2 HA LEU2028 HA LEU2028 6.647 -11.863 2.917 3 1HB LEU2028 2HB LEU2028 6.305 -9.233 1.422 4 2HB LEU2028 1HB LEU2028 5.657 -9.586 3.009 5 HG LEU2028 HG LEU2028 8.601 -9.390 2.344 6 1HD1 LEU2028 3HD1 LEU2028 7.490 -7.225 2.178 7 2HD1 LEU2028 2HD1 LEU2028 6.797 -7.458 3.784 8 3HD1 LEU2028 1HD1 LEU2028 8.542 -7.297 3.592 9 1HD2 LEU2028 2HD2 LEU2028 7.172 -9.653 4.982 10 2HD2 LEU2028 1HD2 LEU2028 8.151 -10.897 4.205 11 3HD2 LEU2028 3HD2 LEU2028 8.905 -9.408 4.774 12 H ASP2029 H ASP2029 5.446 -10.414 -0.035 13 HA ASP2029 HA ASP2029 3.846 -12.549 -0.890 14 1HB ASP2029 2HB ASP2029 2.395 -11.830 1.067 15 2HB ASP2029 1HB ASP2029 2.203 -10.273 0.262 16 H VAL2030 H VAL2030 3.812 -9.065 -0.619 17 HA VAL2030 HA VAL2030 3.023 -8.527 -3.277 18 HB VAL2030 HB VAL2030 3.709 -6.200 -2.830 19 1HG1 VAL2030 1HG1 VAL2030 2.140 -7.486 -0.595 20 2HG1 VAL2030 3HG1 VAL2030 2.148 -5.765 -0.987 21 3HG1 VAL2030 2HG1 VAL2030 1.505 -6.923 -2.145 22 1HG2 VAL2030 2HG2 VAL2030 4.858 -7.398 -0.337 23 2HG2 VAL2030 1HG2 VAL2030 5.654 -6.361 -1.501 24 3HG2 VAL2030 3HG2 VAL2030 4.419 -5.694 -0.421 25 H ASP2031 H ASP2031 6.050 -9.359 -1.962 26 HA ASP2031 HA ASP2031 8.093 -9.687 -2.726 27 1HB ASP2031 2HB ASP2031 6.808 -10.944 -4.500 28 2HB ASP2031 1HB ASP2031 6.941 -9.525 -5.527 29 H LEU2032 H LEU2032 6.880 -6.996 -2.588 30 HA LEU2032 HA LEU2032 7.398 -4.852 -2.637 31 1HB LEU2032 2HB LEU2032 10.130 -5.749 -3.521 32 2HB LEU2032 1HB LEU2032 9.726 -4.112 -3.034 33 HG LEU2032 HG LEU2032 9.695 -6.581 -1.302 34 1HD1 LEU2032 2HD1 LEU2032 11.901 -5.721 -1.800 35 2HD1 LEU2032 1HD1 LEU2032 11.417 -4.122 -1.227 36 3HD1 LEU2032 3HD1 LEU2032 11.481 -5.482 -0.101 37 1HD2 LEU2032 1HD2 LEU2032 8.977 -3.737 -0.599 38 2HD2 LEU2032 3HD2 LEU2032 7.874 -5.117 -0.631 39 3HD2 LEU2032 2HD2 LEU2032 9.179 -5.057 0.551 40 H GLU2033 H GLU2033 6.936 -6.526 -5.295 41 HA GLU2033 HA GLU2033 7.475 -4.375 -7.185 42 1HB GLU2033 2HB GLU2033 6.608 -7.226 -7.531 43 2HB GLU2033 1HB GLU2033 6.634 -6.076 -8.866 44 1HG GLU2033 2HG GLU2033 9.008 -6.856 -7.190 45 2HG GLU2033 1HG GLU2033 8.639 -7.485 -8.800 46 H THR2034 H THR2034 4.840 -5.636 -5.367 47 HA THR2034 HA THR2034 2.694 -4.910 -6.986 48 HB THR2034 HB THR2034 2.857 -4.867 -3.975 49 HG1 THR2034 1HG THR2034 1.919 -7.014 -5.565 50 1HG2 THR2034 2HG2 THR2034 0.798 -3.843 -4.843 51 2HG2 THR2034 1HG2 THR2034 0.485 -5.279 -5.817 52 3HG2 THR2034 3HG2 THR2034 0.451 -5.385 -4.054 53 H ARG2035 H ARG2035 1.675 -3.042 -7.340 54 HA ARG2035 HA ARG2035 2.878 -0.564 -6.490 55 1HB ARG2035 2HB ARG2035 0.298 -1.012 -7.998 56 2HB ARG2035 1HB ARG2035 1.262 0.457 -7.963 57 1HG ARG2035 2HG ARG2035 2.013 -2.151 -9.279 58 2HG ARG2035 1HG ARG2035 1.484 -0.683 -10.090 59 1HD ARG2035 2HD ARG2035 3.992 -0.950 -8.430 60 2HD ARG2035 1HD ARG2035 3.935 -1.035 -10.183 61 HE ARG2035 HE ARG2035 2.815 1.379 -9.111 62 1HH1 ARG2035 1HH1 ARG2035 5.781 -0.209 -10.216 63 2HH1 ARG2035 2HH1 ARG2035 6.641 1.222 -10.468 64 1HH2 ARG2035 1HH2 ARG2035 3.977 3.345 -9.453 65 2HH2 ARG2035 2HH2 ARG2035 5.584 3.347 -10.054 66 H ILE2036 H ILE2036 2.233 0.431 -4.669 67 HA ILE2036 HA ILE2036 0.000 -0.762 -3.224 68 HB ILE2036 HB ILE2036 2.212 1.061 -2.274 69 1HG1 ILE2036 2HG1 ILE2036 2.959 -1.207 -2.744 70 2HG1 ILE2036 1HG1 ILE2036 2.933 -0.915 -1.007 71 1HG2 ILE2036 2HG2 ILE2036 -0.007 -0.186 -0.653 72 2HG2 ILE2036 1HG2 ILE2036 1.391 0.664 0.007 73 3HG2 ILE2036 3HG2 ILE2036 0.211 1.534 -0.975 74 1HD1 ILE2036 3HD1 ILE2036 0.794 -2.142 -0.885 75 2HD1 ILE2036 2HD1 ILE2036 0.921 -2.479 -2.612 76 3HD1 ILE2036 1HD1 ILE2036 2.117 -3.130 -1.501 77 HA PRO2037 HA PRO2037 -2.590 2.684 -4.317 78 1HB PRO2037 2HB PRO2037 -4.318 1.736 -2.168 79 2HB PRO2037 1HB PRO2037 -4.658 1.841 -3.891 80 1HG PRO2037 2HG PRO2037 -4.227 -0.464 -2.455 81 2HG PRO2037 1HG PRO2037 -4.113 -0.333 -4.222 82 1HD PRO2037 2HD PRO2037 -2.008 -0.642 -2.208 83 2HD PRO2037 1HD PRO2037 -1.943 -0.904 -3.963 84 H VAL2038 H VAL2038 -2.060 4.570 -3.561 85 HA VAL2038 HA VAL2038 -1.844 4.900 -0.670 86 HB VAL2038 HB VAL2038 -0.344 6.861 -1.110 87 1HG1 VAL2038 3HG1 VAL2038 0.590 4.168 -2.069 88 2HG1 VAL2038 2HG1 VAL2038 1.645 5.502 -1.594 89 3HG1 VAL2038 1HG1 VAL2038 0.574 4.752 -0.402 90 1HG2 VAL2038 1HG2 VAL2038 -0.950 7.289 -3.436 91 2HG2 VAL2038 3HG2 VAL2038 0.788 6.990 -3.288 92 3HG2 VAL2038 2HG2 VAL2038 -0.273 5.724 -3.901 93 H ILE2039 H ILE2039 -2.692 6.613 0.280 94 HA ILE2039 HA ILE2039 -4.751 8.002 -1.279 95 HB ILE2039 HB ILE2039 -5.599 6.270 0.318 96 1HG1 ILE2039 2HG1 ILE2039 -6.331 9.097 1.107 97 2HG1 ILE2039 1HG1 ILE2039 -6.954 8.231 -0.296 98 1HG2 ILE2039 1HG2 ILE2039 -4.397 8.061 2.424 99 2HG2 ILE2039 3HG2 ILE2039 -5.491 6.712 2.749 100 3HG2 ILE2039 2HG2 ILE2039 -3.902 6.416 2.034 101 1HD1 ILE2039 3HD1 ILE2039 -7.343 7.417 2.569 102 2HD1 ILE2039 2HD1 ILE2039 -8.546 8.233 1.562 103 3HD1 ILE2039 1HD1 ILE2039 -8.008 6.602 1.160 104 H ASN2040 H ASN2040 -4.981 10.154 -0.941 105 HA ASN2040 HA ASN2040 -2.829 11.788 -0.043 106 1HB ASN2040 2HB ASN2040 -5.219 12.521 -1.469 107 2HB ASN2040 1HB ASN2040 -5.546 12.817 0.146 108 1HD2 ASN2040 1HD2 ASN2040 -2.223 13.413 -0.524 109 2HD2 ASN2040 2HD2 ASN2040 -2.408 15.096 -0.593 110 H LYS2041 H LYS2041 -2.354 12.514 2.067 111 HA LYS2041 HA LYS2041 -3.973 11.852 4.300 112 1HB LYS2041 2HB LYS2041 -1.814 13.939 3.967 113 2HB LYS2041 1HB LYS2041 -2.803 13.911 5.402 114 1HG LYS2041 2HG LYS2041 -0.757 12.855 5.929 115 2HG LYS2041 1HG LYS2041 -1.982 11.592 5.822 116 1HD LYS2041 2HD LYS2041 -1.152 10.823 3.790 117 2HD LYS2041 1HD LYS2041 -0.209 12.288 3.521 118 1HE LYS2041 2HE LYS2041 0.289 10.226 5.672 119 2HE LYS2041 1HE LYS2041 1.220 10.398 4.185 120 1HZ LYS2041 3HZ LYS2041 1.785 12.763 5.049 121 2HZ LYS2041 2HZ LYS2041 1.071 12.249 6.485 122 3HZ LYS2041 1HZ LYS2041 2.409 11.436 5.919 123 H VAL2042 H VAL2042 -3.891 14.607 2.133 124 HA VAL2042 HA VAL2042 -5.572 16.265 3.687 125 HB VAL2042 HB VAL2042 -5.241 16.411 0.699 126 1HG1 VAL2042 2HG1 VAL2042 -5.949 18.534 2.714 127 2HG1 VAL2042 1HG1 VAL2042 -5.684 18.809 0.991 128 3HG1 VAL2042 3HG1 VAL2042 -7.029 17.804 1.532 129 1HG2 VAL2042 3HG2 VAL2042 -3.092 16.310 1.731 130 2HG2 VAL2042 2HG2 VAL2042 -3.380 17.936 1.091 131 3HG2 VAL2042 1HG2 VAL2042 -3.507 17.622 2.833 132 H ASP2043 H ASP2043 -6.388 14.510 0.557 133 HA ASP2043 HA ASP2043 -8.779 13.679 1.867 134 1HB ASP2043 2HB ASP2043 -9.166 16.075 1.163 135 2HB ASP2043 1HB ASP2043 -9.205 15.301 -0.451 136 H GLY2044 H GLY2044 -7.244 11.863 0.732 137 1HA GLY2044 1HA GLY2044 -9.602 10.703 -0.364 138 2HA GLY2044 2HA GLY2044 -8.138 9.863 0.102 139 H THR2045 H THR2045 -6.647 11.754 -1.629 140 HA THR2045 HA THR2045 -7.400 11.064 -4.170 141 HB THR2045 HB THR2045 -4.607 11.774 -3.248 142 HG1 THR2045 1HG THR2045 -5.431 13.941 -3.925 143 1HG2 THR2045 1HG2 THR2045 -4.819 10.966 -5.539 144 2HG2 THR2045 3HG2 THR2045 -6.039 12.212 -5.843 145 3HG2 THR2045 2HG2 THR2045 -4.366 12.677 -5.472 146 H LEU2046 H LEU2046 -7.440 8.823 -4.660 147 HA LEU2046 HA LEU2046 -5.431 7.149 -3.399 148 1HB LEU2046 2HB LEU2046 -7.790 6.486 -3.163 149 2HB LEU2046 1HB LEU2046 -7.917 6.361 -4.907 150 HG LEU2046 HG LEU2046 -6.135 4.605 -4.828 151 1HD1 LEU2046 1HD1 LEU2046 -6.652 4.738 -1.869 152 2HD1 LEU2046 3HD1 LEU2046 -5.754 3.475 -2.700 153 3HD1 LEU2046 2HD1 LEU2046 -5.145 5.128 -2.695 154 1HD2 LEU2046 2HD2 LEU2046 -8.487 4.059 -5.069 155 2HD2 LEU2046 1HD2 LEU2046 -7.636 2.847 -4.104 156 3HD2 LEU2046 3HD2 LEU2046 -8.662 4.042 -3.309 157 H LEU2047 H LEU2047 -3.782 6.621 -4.484 158 HA LEU2047 HA LEU2047 -3.812 6.714 -7.432 159 1HB LEU2047 2HB LEU2047 -1.452 6.517 -5.570 160 2HB LEU2047 1HB LEU2047 -1.398 6.778 -7.298 161 HG LEU2047 HG LEU2047 -2.361 8.730 -5.210 162 1HD1 LEU2047 2HD1 LEU2047 0.043 8.479 -5.282 163 2HD1 LEU2047 1HD1 LEU2047 0.038 8.765 -7.021 164 3HD1 LEU2047 3HD1 LEU2047 -0.443 10.052 -5.917 165 1HD2 LEU2047 1HD2 LEU2047 -2.225 9.038 -8.210 166 2HD2 LEU2047 3HD2 LEU2047 -3.691 8.966 -7.230 167 3HD2 LEU2047 2HD2 LEU2047 -2.585 10.326 -7.057 168 H VAL2048 H VAL2048 -3.757 4.865 -8.521 169 HA VAL2048 HA VAL2048 -2.764 2.475 -7.164 170 HB VAL2048 HB VAL2048 -4.469 1.076 -8.269 171 1HG1 VAL2048 1HG1 VAL2048 -5.691 3.242 -6.577 172 2HG1 VAL2048 3HG1 VAL2048 -6.427 1.678 -6.923 173 3HG1 VAL2048 2HG1 VAL2048 -4.923 1.762 -6.003 174 1HG2 VAL2048 3HG2 VAL2048 -5.712 3.678 -9.150 175 2HG2 VAL2048 2HG2 VAL2048 -4.981 2.459 -10.193 176 3HG2 VAL2048 1HG2 VAL2048 -6.464 2.091 -9.307 177 H GLY2049 H GLY2049 -2.277 0.753 -8.854 178 1HA GLY2049 1HA GLY2049 -1.963 1.561 -11.562 179 2HA GLY2049 2HA GLY2049 -1.285 0.115 -10.819 180 H GLU2050 H GLU2050 -0.283 2.518 -12.577 181 HA GLU2050 HA GLU2050 2.307 2.439 -11.326 182 1HB GLU2050 2HB GLU2050 1.507 3.786 -13.910 183 2HB GLU2050 1HB GLU2050 3.144 3.532 -13.342 184 1HG GLU2050 2HG GLU2050 1.173 1.417 -14.152 185 2HG GLU2050 1HG GLU2050 2.610 1.917 -15.037 186 H ASP2051 H ASP2051 -0.326 4.428 -11.263 187 HA ASP2051 HA ASP2051 0.911 6.937 -10.694 188 1HB ASP2051 2HB ASP2051 -1.706 5.720 -9.982 189 2HB ASP2051 1HB ASP2051 -1.326 7.404 -9.581 190 H ALA2052 H ALA2052 0.036 4.093 -8.991 191 HA ALA2052 HA ALA2052 0.688 5.131 -6.375 192 1HB ALA2052 2HB ALA2052 0.187 2.812 -5.681 193 2HB ALA2052 3HB ALA2052 -0.066 2.384 -7.380 194 3HB ALA2052 1HB ALA2052 -1.115 3.573 -6.606 195 HA PRO2053 HA PRO2053 4.885 3.942 -6.879 196 1HB PRO2053 2HB PRO2053 5.726 3.789 -4.340 197 2HB PRO2053 1HB PRO2053 5.262 5.333 -5.078 198 1HG PRO2053 2HG PRO2053 3.669 3.529 -3.303 199 2HG PRO2053 1HG PRO2053 3.858 5.295 -3.209 200 1HD PRO2053 2HD PRO2053 1.702 4.085 -4.342 201 2HD PRO2053 1HD PRO2053 2.317 5.656 -4.886 202 H ARG2054 H ARG2054 6.261 2.276 -6.796 203 HA ARG2054 HA ARG2054 5.430 -0.417 -6.550 204 1HB ARG2054 2HB ARG2054 7.149 0.418 -8.065 205 2HB ARG2054 1HB ARG2054 8.074 1.027 -6.712 206 1HG ARG2054 2HG ARG2054 8.395 -1.308 -5.980 207 2HG ARG2054 1HG ARG2054 7.616 -1.829 -7.490 208 1HD ARG2054 2HD ARG2054 9.275 -0.568 -8.777 209 2HD ARG2054 1HD ARG2054 10.063 -0.068 -7.289 210 HE ARG2054 HE ARG2054 9.875 -2.914 -7.936 211 1HH1 ARG2054 1HH1 ARG2054 12.001 -0.086 -7.095 212 2HH1 ARG2054 2HH1 ARG2054 13.380 -0.957 -7.513 213 1HH2 ARG2054 1HH2 ARG2054 11.811 -3.963 -8.373 214 2HH2 ARG2054 2HH2 ARG2054 13.324 -3.159 -8.226 215 H ARG2055 H ARG2055 5.665 -1.745 -4.650 216 HA ARG2055 HA ARG2055 5.819 -0.640 -2.129 217 1HB ARG2055 2HB ARG2055 5.868 -3.324 -3.123 218 2HB ARG2055 1HB ARG2055 7.042 -3.137 -1.823 219 1HG ARG2055 2HG ARG2055 4.103 -2.567 -1.674 220 2HG ARG2055 1HG ARG2055 4.957 -3.922 -0.959 221 1HD ARG2055 2HD ARG2055 5.313 -1.006 -0.203 222 2HD ARG2055 1HD ARG2055 4.424 -2.202 0.718 223 HE ARG2055 HE ARG2055 7.348 -2.125 0.363 224 1HH1 ARG2055 1HH1 ARG2055 4.530 -3.357 2.157 225 2HH1 ARG2055 2HH1 ARG2055 5.457 -3.871 3.488 226 1HH2 ARG2055 1HH2 ARG2055 8.585 -2.842 2.197 227 2HH2 ARG2055 2HH2 ARG2055 7.826 -3.545 3.525 228 H ALA2056 H ALA2056 8.521 -1.950 -3.992 229 HA ALA2056 HA ALA2056 10.499 -1.752 -2.085 230 1HB ALA2056 1HB ALA2056 12.090 -1.668 -3.928 231 2HB ALA2056 2HB ALA2056 10.796 -1.244 -5.047 232 3HB ALA2056 3HB ALA2056 10.804 -2.827 -4.274 233 H GLU2057 H GLU2057 9.094 0.788 -4.073 234 HA GLU2057 HA GLU2057 11.106 2.733 -3.257 235 1HB GLU2057 2HB GLU2057 8.658 3.138 -4.964 236 2HB GLU2057 1HB GLU2057 10.025 4.228 -4.797 237 1HG GLU2057 2HG GLU2057 9.993 1.527 -6.097 238 2HG GLU2057 1HG GLU2057 10.215 3.089 -6.891 239 H LEU2058 H LEU2058 7.914 1.753 -2.573 240 HA LEU2058 HA LEU2058 6.551 3.909 -1.655 241 1HB LEU2058 2HB LEU2058 5.558 1.741 -2.015 242 2HB LEU2058 1HB LEU2058 6.502 1.036 -0.739 243 HG LEU2058 HG LEU2058 4.044 1.294 -0.301 244 1HD1 LEU2058 3HD1 LEU2058 5.859 2.640 1.668 245 2HD1 LEU2058 2HD1 LEU2058 4.242 2.032 2.009 246 3HD1 LEU2058 1HD1 LEU2058 5.525 0.914 1.542 247 1HD2 LEU2058 2HD2 LEU2058 4.728 4.226 -0.144 248 2HD2 LEU2058 1HD2 LEU2058 3.638 3.453 -1.294 249 3HD2 LEU2058 3HD2 LEU2058 3.219 3.510 0.418 250 H GLU2059 H GLU2059 8.863 2.013 0.258 251 HA GLU2059 HA GLU2059 8.213 3.307 2.663 252 1HB GLU2059 2HB GLU2059 10.363 2.394 3.548 253 2HB GLU2059 1HB GLU2059 9.298 1.200 2.829 254 1HG GLU2059 2HG GLU2059 10.658 1.211 0.802 255 2HG GLU2059 1HG GLU2059 11.719 2.417 1.535 256 H MET2060 H MET2060 11.025 3.955 0.518 257 HA MET2060 HA MET2060 11.901 6.210 1.998 258 1HB MET2060 2HB MET2060 13.407 5.052 0.459 259 2HB MET2060 1HB MET2060 12.355 5.440 -0.892 260 1HG MET2060 2HG MET2060 14.365 6.831 -0.865 261 2HG MET2060 1HG MET2060 12.898 7.783 -0.706 262 1HE MET2060 3HE MET2060 16.024 6.297 1.164 263 2HE MET2060 2HE MET2060 15.772 6.876 2.812 264 3HE MET2060 1HE MET2060 14.695 5.657 2.128 265 H TRP2061 H TRP2061 9.564 5.741 -0.477 266 HA TRP2061 HA TRP2061 9.192 8.397 -1.306 267 1HB TRP2061 2HB TRP2061 8.395 6.276 -2.436 268 2HB TRP2061 1HB TRP2061 7.145 6.177 -1.213 269 HD1 TRP2061 HD TRP2061 8.287 8.552 -4.044 270 HE1 TRP2061 1HE TRP2061 6.188 9.683 -5.017 271 HE3 TRP2061 3HE TRP2061 4.783 6.679 -0.826 272 HZ2 TRP2061 2HZ TRP2061 3.437 9.770 -4.499 273 HZ3 TRP2061 3HZ TRP2061 2.442 7.344 -1.144 274 HH2 TRP2061 HH TRP2061 1.789 8.853 -2.948 275 H LEU2062 H LEU2062 7.578 6.419 1.198 276 HA LEU2062 HA LEU2062 5.884 8.503 2.109 277 1HB LEU2062 2HB LEU2062 6.801 6.015 3.524 278 2HB LEU2062 1HB LEU2062 5.562 7.095 4.130 279 HG LEU2062 HG LEU2062 5.419 5.388 1.648 280 1HD1 LEU2062 2HD1 LEU2062 3.939 5.280 4.260 281 2HD1 LEU2062 1HD1 LEU2062 3.640 4.249 2.858 282 3HD1 LEU2062 3HD1 LEU2062 5.180 4.148 3.713 283 1HD2 LEU2062 1HD2 LEU2062 3.382 7.295 2.798 284 2HD2 LEU2062 3HD2 LEU2062 4.239 7.489 1.267 285 3HD2 LEU2062 2HD2 LEU2062 3.099 6.164 1.476 286 H GLN2063 H GLN2063 9.104 7.463 3.045 287 HA GLN2063 HA GLN2063 9.335 8.948 5.427 288 1HB GLN2063 2HB GLN2063 11.422 7.975 3.505 289 2HB GLN2063 1HB GLN2063 11.778 8.696 5.062 290 1HG GLN2063 2HG GLN2063 10.149 6.191 4.642 291 2HG GLN2063 1HG GLN2063 11.859 6.220 5.049 292 1HE2 GLN2063 1HE2 GLN2063 11.501 5.076 6.897 293 2HE2 GLN2063 2HE2 GLN2063 10.760 5.735 8.314 294 H GLY2064 H GLY2064 9.764 9.808 2.122 295 1HA GLY2064 1HA GLY2064 10.421 11.814 1.110 296 2HA GLY2064 2HA GLY2064 10.988 12.371 2.678 297 H HIS2065 H HIS2065 7.951 11.230 3.086 298 HA HIS2065 HA HIS2065 5.924 12.010 3.401 299 1HB HIS2065 2HB HIS2065 7.374 14.587 4.004 300 2HB HIS2065 1HB HIS2065 5.680 14.257 4.359 301 HD1 HIS2065 1HD HIS2065 9.140 13.488 5.546 302 HD2 HIS2065 2HD HIS2065 5.220 12.546 6.512 303 HE1 HIS2065 1HE HIS2065 9.218 12.420 7.827 304 HA PRO2066 HA PRO2066 5.159 13.941 -0.655 305 1HB PRO2066 2HB PRO2066 3.906 11.914 -1.837 306 2HB PRO2066 1HB PRO2066 5.663 11.862 -1.620 307 1HG PRO2066 2HG PRO2066 3.526 10.499 -0.029 308 2HG PRO2066 1HG PRO2066 5.084 9.865 -0.575 309 1HD PRO2066 2HD PRO2066 4.563 10.877 1.960 310 2HD PRO2066 1HD PRO2066 6.177 10.708 1.244 311 H GLU2067 H GLU2067 3.472 12.976 1.956 312 HA GLU2067 HA GLU2067 1.514 13.290 2.883 313 1HB GLU2067 2HB GLU2067 1.130 15.263 0.664 314 2HB GLU2067 1HB GLU2067 -0.016 15.076 2.000 315 1HG GLU2067 2HG GLU2067 2.894 15.661 2.249 316 2HG GLU2067 1HG GLU2067 1.609 16.871 2.391 317 H PHE2068 H PHE2068 1.896 11.220 1.225 318 HA PHE2068 HA PHE2068 -0.874 10.425 0.884 319 1HB PHE2068 2HB PHE2068 1.508 9.796 -0.862 320 2HB PHE2068 1HB PHE2068 0.084 8.771 -0.827 321 HD1 PHE2068 1HD PHE2068 1.161 12.296 -1.480 322 HD2 PHE2068 2HD PHE2068 -1.684 9.211 -2.192 323 HE1 PHE2068 1HE PHE2068 0.096 13.687 -3.204 324 HE2 PHE2068 2HE PHE2068 -2.767 10.611 -3.908 325 HZ PHE2068 HZ PHE2068 -1.877 12.843 -4.415 326 H ALA2069 H ALA2069 -1.248 8.309 1.603 327 HA ALA2069 HA ALA2069 0.926 6.960 3.034 328 1HB ALA2069 1HB ALA2069 -0.295 8.283 4.697 329 2HB ALA2069 2HB ALA2069 -0.634 6.563 4.922 330 3HB ALA2069 3HB ALA2069 -1.819 7.602 4.134 331 H VAL2070 H VAL2070 0.068 4.686 3.645 332 HA VAL2070 HA VAL2070 -0.907 3.482 1.271 333 HB VAL2070 HB VAL2070 -0.648 2.290 4.057 334 1HG1 VAL2070 1HG1 VAL2070 -0.956 0.906 1.387 335 2HG1 VAL2070 3HG1 VAL2070 -0.613 0.106 2.921 336 3HG1 VAL2070 2HG1 VAL2070 -2.143 0.942 2.695 337 1HG2 VAL2070 1HG2 VAL2070 1.488 3.113 3.204 338 2HG2 VAL2070 3HG2 VAL2070 1.467 1.351 3.245 339 3HG2 VAL2070 2HG2 VAL2070 1.256 2.202 1.715 340 H ASP2071 H ASP2071 -2.934 2.861 0.699 341 HA ASP2071 HA ASP2071 -5.191 4.002 1.836 342 1HB ASP2071 2HB ASP2071 -5.185 3.276 -0.460 343 2HB ASP2071 1HB ASP2071 -4.867 1.616 0.020 344 HA PRO2072 HA PRO2072 -5.586 1.466 5.460 345 1HB PRO2072 2HB PRO2072 -8.117 2.203 6.165 346 2HB PRO2072 1HB PRO2072 -6.673 3.178 6.470 347 1HG PRO2072 2HG PRO2072 -8.686 3.425 4.268 348 2HG PRO2072 1HG PRO2072 -7.927 4.705 5.231 349 1HD PRO2072 2HD PRO2072 -7.110 4.117 2.741 350 2HD PRO2072 1HD PRO2072 -5.968 4.644 3.996 351 H ARG2073 H ARG2073 -7.867 1.370 2.872 352 HA ARG2073 HA ARG2073 -9.232 -0.995 3.690 353 1HB ARG2073 2HB ARG2073 -10.460 0.295 2.256 354 2HB ARG2073 1HB ARG2073 -9.066 0.734 1.302 355 1HG ARG2073 2HG ARG2073 -9.123 -1.586 0.346 356 2HG ARG2073 1HG ARG2073 -10.680 -1.801 1.167 357 1HD ARG2073 2HD ARG2073 -10.789 -0.981 -1.230 358 2HD ARG2073 1HD ARG2073 -11.667 -0.020 -0.031 359 HE ARG2073 HE ARG2073 -8.992 0.904 -0.359 360 1HH1 ARG2073 1HH1 ARG2073 -11.994 0.973 -2.172 361 2HH1 ARG2073 2HH1 ARG2073 -11.838 2.612 -2.639 362 1HH2 ARG2073 1HH2 ARG2073 -8.789 3.118 -0.918 363 2HH2 ARG2073 2HH2 ARG2073 -9.962 3.853 -1.924 364 H PHE2074 H PHE2074 -6.449 -0.270 1.626 365 HA PHE2074 HA PHE2074 -6.029 -2.948 0.823 366 1HB PHE2074 2HB PHE2074 -4.984 -0.976 -0.326 367 2HB PHE2074 1HB PHE2074 -3.947 -0.754 1.078 368 HD1 PHE2074 1HD PHE2074 -4.752 -3.018 -1.715 369 HD2 PHE2074 2HD PHE2074 -2.000 -2.087 1.395 370 HE1 PHE2074 1HE PHE2074 -3.144 -4.610 -2.668 371 HE2 PHE2074 2HE PHE2074 -0.389 -3.679 0.449 372 HZ PHE2074 HZ PHE2074 -0.956 -4.946 -1.586 373 H LEU2075 H LEU2075 -4.963 -1.035 3.552 374 HA LEU2075 HA LEU2075 -3.294 -2.970 4.761 375 1HB LEU2075 2HB LEU2075 -4.983 -0.809 6.045 376 2HB LEU2075 1HB LEU2075 -3.771 -1.757 6.889 377 HG LEU2075 HG LEU2075 -3.233 0.174 4.636 378 1HD1 LEU2075 3HD1 LEU2075 -3.933 1.288 6.700 379 2HD1 LEU2075 2HD1 LEU2075 -2.709 0.390 7.596 380 3HD1 LEU2075 1HD1 LEU2075 -2.222 1.557 6.368 381 1HD2 LEU2075 3HD2 LEU2075 -1.354 -1.405 6.406 382 2HD2 LEU2075 2HD2 LEU2075 -1.613 -1.656 4.678 383 3HD2 LEU2075 1HD2 LEU2075 -0.876 -0.163 5.250 384 H ALA2076 H ALA2076 -6.739 -2.313 5.032 385 HA ALA2076 HA ALA2076 -7.412 -4.343 6.834 386 1HB ALA2076 3HB ALA2076 -9.701 -4.044 6.049 387 2HB ALA2076 2HB ALA2076 -8.903 -2.481 6.238 388 3HB ALA2076 1HB ALA2076 -9.110 -3.175 4.631 389 H TYR2077 H TYR2077 -7.176 -4.321 3.333 390 HA TYR2077 HA TYR2077 -7.995 -6.937 2.710 391 1HB TYR2077 2HB TYR2077 -7.703 -5.342 0.961 392 2HB TYR2077 1HB TYR2077 -6.040 -5.030 1.434 393 HD1 TYR2077 1HD TYR2077 -4.455 -5.868 0.032 394 HD2 TYR2077 2HD TYR2077 -8.101 -7.992 0.481 395 HE1 TYR2077 1HE TYR2077 -3.646 -7.563 -1.533 396 HE2 TYR2077 2HE TYR2077 -7.333 -9.677 -1.066 397 HH TYR2077 HH TYR2077 -5.692 -9.968 -2.839 398 H MET2078 H MET2078 -4.857 -5.722 3.708 399 HA MET2078 HA MET2078 -3.408 -8.123 3.448 400 1HB MET2078 2HB MET2078 -2.321 -5.945 3.773 401 2HB MET2078 1HB MET2078 -3.013 -5.839 5.386 402 1HG MET2078 2HG MET2078 -1.671 -7.745 6.095 403 2HG MET2078 1HG MET2078 -1.003 -7.892 4.474 404 1HE MET2078 3HE MET2078 -1.244 -5.664 7.697 405 2HE MET2078 2HE MET2078 -0.211 -4.295 7.287 406 3HE MET2078 1HE MET2078 -1.750 -4.524 6.454 407 H GLU2079 H GLU2079 -5.337 -6.827 6.080 408 HA GLU2079 HA GLU2079 -4.799 -8.977 7.906 409 1HB GLU2079 2HB GLU2079 -7.067 -6.979 7.920 410 2HB GLU2079 1HB GLU2079 -6.533 -7.962 9.276 411 1HG GLU2079 2HG GLU2079 -4.384 -6.779 9.261 412 2HG GLU2079 1HG GLU2079 -4.973 -5.795 7.917 413 H ASP2080 H ASP2080 -7.233 -8.158 5.583 414 HA ASP2080 HA ASP2080 -9.309 -9.930 6.141 415 1HB ASP2080 2HB ASP2080 -9.483 -8.054 4.565 416 2HB ASP2080 1HB ASP2080 -8.382 -8.879 3.473 417 H ARG2081 H ARG2081 -6.386 -10.365 4.321 418 HA ARG2081 HA ARG2081 -7.106 -12.932 3.310 419 1HB ARG2081 2HB ARG2081 -4.510 -11.457 3.370 420 2HB ARG2081 1HB ARG2081 -4.654 -13.082 2.723 421 1HG ARG2081 2HG ARG2081 -6.293 -12.293 1.101 422 2HG ARG2081 1HG ARG2081 -6.149 -10.662 1.760 423 1HD ARG2081 2HD ARG2081 -4.807 -11.035 -0.281 424 2HD ARG2081 1HD ARG2081 -3.858 -10.541 1.115 425 HE ARG2081 HE ARG2081 -3.936 -13.362 0.914 426 1HH1 ARG2081 1HH1 ARG2081 -2.560 -10.593 -0.788 427 2HH1 ARG2081 2HH1 ARG2081 -1.052 -11.331 -1.094 428 1HH2 ARG2081 1HH2 ARG2081 -1.872 -14.420 0.456 429 2HH2 ARG2081 2HH2 ARG2081 -0.670 -13.530 -0.358 430 H ARG2082 H ARG2082 -6.202 -12.016 6.380 431 HA ARG2082 HA ARG2082 -4.842 -14.498 6.861 432 1HB ARG2082 2HB ARG2082 -4.014 -12.572 8.120 433 2HB ARG2082 1HB ARG2082 -5.606 -12.276 8.780 434 1HG ARG2082 2HG ARG2082 -4.269 -13.258 10.503 435 2HG ARG2082 1HG ARG2082 -5.446 -14.460 9.996 436 1HD ARG2082 2HD ARG2082 -2.547 -14.368 9.129 437 2HD ARG2082 1HD ARG2082 -3.198 -15.409 10.388 438 HE ARG2082 HE ARG2082 -4.490 -15.755 7.850 439 1HH1 ARG2082 1HH1 ARG2082 -1.767 -16.848 9.832 440 2HH1 ARG2082 2HH1 ARG2082 -1.512 -18.247 8.898 441 1HH2 ARG2082 1HH2 ARG2082 -4.058 -17.640 6.540 442 2HH2 ARG2082 2HH2 ARG2082 -2.804 -18.680 6.997 443 H LYS2083 H LYS2083 -6.427 -15.919 6.301 444 HA LYS2083 HA LYS2083 -8.001 -17.453 6.672 445 1HB LYS2083 2HB LYS2083 -8.300 -16.134 9.378 446 2HB LYS2083 1HB LYS2083 -9.208 -17.559 8.895 447 1HG LYS2083 2HG LYS2083 -7.168 -18.826 8.655 448 2HG LYS2083 1HG LYS2083 -6.205 -17.392 8.979 449 1HD LYS2083 2HD LYS2083 -7.060 -17.279 11.236 450 2HD LYS2083 1HD LYS2083 -8.158 -18.623 10.914 451 1HE LYS2083 2HE LYS2083 -6.345 -20.150 10.664 452 2HE LYS2083 1HE LYS2083 -5.166 -18.838 10.675 453 1HZ LYS2083 1HZ LYS2083 -6.906 -19.527 12.975 454 2HZ LYS2083 3HZ LYS2083 -5.305 -20.032 12.783 455 3HZ LYS2083 2HZ LYS2083 -5.644 -18.385 12.911 456 H GLN2084 H GLN2084 -9.742 -17.519 5.552 457 HA GLN2084 HA GLN2084 -11.150 -15.110 4.941 458 1HB GLN2084 2HB GLN2084 -12.121 -17.905 4.326 459 2HB GLN2084 1HB GLN2084 -12.501 -16.432 3.469 460 1HG GLN2084 2HG GLN2084 -9.857 -17.883 3.473 461 2HG GLN2084 1HG GLN2084 -11.002 -17.788 2.151 462 1HE2 GLN2084 1HE2 GLN2084 -11.460 -14.866 2.643 463 2HE2 GLN2084 2HE2 GLN2084 -10.030 -14.096 2.078 464 H LYS2085 H LYS2085 -11.845 -18.044 6.753 465 HA LYS2085 HA LYS2085 -14.034 -16.616 8.067 466 1HB LYS2085 2HB LYS2085 -14.743 -18.697 6.855 467 2HB LYS2085 1HB LYS2085 -13.645 -19.616 7.869 468 1HG LYS2085 2HG LYS2085 -14.897 -18.998 9.856 469 2HG LYS2085 1HG LYS2085 -15.980 -18.006 8.886 470 1HD LYS2085 2HD LYS2085 -15.621 -20.977 8.541 471 2HD LYS2085 1HD LYS2085 -16.904 -20.260 9.505 472 1HE LYS2085 2HE LYS2085 -16.463 -19.974 6.521 473 2HE LYS2085 1HE LYS2085 -17.740 -20.873 7.325 474 1HZ LYS2085 2HZ LYS2085 -18.556 -18.719 8.238 475 2HZ LYS2085 1HZ LYS2085 -17.382 -17.936 7.303 476 3HZ LYS2085 3HZ LYS2085 -18.616 -18.799 6.574 No H/Q in entry = 476 Start of MODEL 4 1 H LEU2028 H LEU2028 -1.519 -12.271 -0.100 2 HA LEU2028 HA LEU2028 0.328 -11.466 -2.170 3 1HB LEU2028 2HB LEU2028 -1.445 -9.831 -0.345 4 2HB LEU2028 1HB LEU2028 -0.338 -9.121 -1.493 5 HG LEU2028 HG LEU2028 -2.513 -8.992 -2.417 6 1HD1 LEU2028 3HD1 LEU2028 -0.802 -9.495 -4.010 7 2HD1 LEU2028 2HD1 LEU2028 -1.058 -11.229 -3.775 8 3HD1 LEU2028 1HD1 LEU2028 -2.328 -10.240 -4.483 9 1HD2 LEU2028 2HD2 LEU2028 -2.796 -11.959 -1.956 10 2HD2 LEU2028 1HD2 LEU2028 -3.661 -10.678 -1.107 11 3HD2 LEU2028 3HD2 LEU2028 -3.948 -10.946 -2.827 12 H ASP2029 H ASP2029 2.340 -11.859 -1.564 13 HA ASP2029 HA ASP2029 3.275 -11.281 1.102 14 1HB ASP2029 2HB ASP2029 4.824 -12.035 -1.392 15 2HB ASP2029 1HB ASP2029 5.519 -11.883 0.213 16 H VAL2030 H VAL2030 3.008 -9.704 -1.892 17 HA VAL2030 HA VAL2030 3.339 -7.607 -2.597 18 HB VAL2030 HB VAL2030 4.457 -7.006 0.174 19 1HG1 VAL2030 3HG1 VAL2030 5.204 -5.412 -1.650 20 2HG1 VAL2030 2HG1 VAL2030 3.487 -4.969 -1.803 21 3HG1 VAL2030 1HG1 VAL2030 4.309 -4.706 -0.294 22 1HG2 VAL2030 2HG2 VAL2030 2.130 -7.632 0.259 23 2HG2 VAL2030 1HG2 VAL2030 2.335 -5.904 0.602 24 3HG2 VAL2030 3HG2 VAL2030 1.748 -6.426 -0.980 25 H ASP2031 H ASP2031 6.015 -8.475 -0.502 26 HA ASP2031 HA ASP2031 8.266 -8.719 -0.805 27 1HB ASP2031 2HB ASP2031 7.272 -10.696 -1.977 28 2HB ASP2031 1HB ASP2031 7.365 -9.810 -3.488 29 H LEU2032 H LEU2032 7.220 -6.186 -1.539 30 HA LEU2032 HA LEU2032 8.019 -4.200 -2.113 31 1HB LEU2032 2HB LEU2032 10.447 -5.626 -3.170 32 2HB LEU2032 1HB LEU2032 10.292 -3.888 -3.007 33 HG LEU2032 HG LEU2032 10.230 -5.859 -0.720 34 1HD1 LEU2032 1HD1 LEU2032 12.386 -3.984 -1.633 35 2HD1 LEU2032 3HD1 LEU2032 12.414 -4.967 -0.163 36 3HD1 LEU2032 2HD1 LEU2032 12.394 -5.747 -1.747 37 1HD2 LEU2032 3HD2 LEU2032 10.293 -2.837 -0.723 38 2HD2 LEU2032 2HD2 LEU2032 8.939 -3.857 -0.236 39 3HD2 LEU2032 1HD2 LEU2032 10.429 -3.872 0.699 40 H GLU2033 H GLU2033 7.577 -6.556 -4.610 41 HA GLU2033 HA GLU2033 7.884 -4.509 -6.649 42 1HB GLU2033 2HB GLU2033 7.442 -6.282 -8.314 43 2HB GLU2033 1HB GLU2033 8.778 -6.655 -7.252 44 1HG GLU2033 2HG GLU2033 7.622 -8.665 -7.567 45 2HG GLU2033 1HG GLU2033 7.154 -8.118 -5.961 46 H THR2034 H THR2034 5.433 -5.726 -4.790 47 HA THR2034 HA THR2034 3.226 -5.287 -6.507 48 HB THR2034 HB THR2034 3.588 -5.632 -3.556 49 HG1 THR2034 1HG THR2034 3.817 -7.390 -5.343 50 1HG2 THR2034 1HG2 THR2034 1.492 -4.375 -3.909 51 2HG2 THR2034 3HG2 THR2034 0.919 -5.663 -4.992 52 3HG2 THR2034 2HG2 THR2034 1.244 -5.993 -3.278 53 H ARG2035 H ARG2035 2.058 -3.487 -6.867 54 HA ARG2035 HA ARG2035 2.901 -0.867 -6.088 55 1HB ARG2035 2HB ARG2035 0.306 -1.834 -7.304 56 2HB ARG2035 1HB ARG2035 0.730 -0.155 -7.092 57 1HG ARG2035 2HG ARG2035 2.237 -2.089 -8.824 58 2HG ARG2035 1HG ARG2035 0.971 -1.004 -9.394 59 1HD ARG2035 2HD ARG2035 2.337 0.900 -8.530 60 2HD ARG2035 1HD ARG2035 3.631 -0.255 -8.198 61 HE ARG2035 HE ARG2035 2.775 -0.553 -10.846 62 1HH1 ARG2035 1HH1 ARG2035 4.256 1.981 -8.977 63 2HH1 ARG2035 2HH1 ARG2035 5.406 2.421 -10.167 64 1HH2 ARG2035 1HH2 ARG2035 4.212 0.141 -12.563 65 2HH2 ARG2035 2HH2 ARG2035 5.337 1.397 -12.269 66 H ILE2036 H ILE2036 2.666 -0.297 -3.893 67 HA ILE2036 HA ILE2036 0.211 -1.035 -2.574 68 HB ILE2036 HB ILE2036 2.519 0.688 -1.686 69 1HG1 ILE2036 2HG1 ILE2036 3.142 -1.624 -1.871 70 2HG1 ILE2036 1HG1 ILE2036 3.033 -1.175 -0.176 71 1HG2 ILE2036 1HG2 ILE2036 0.145 -0.224 -0.078 72 2HG2 ILE2036 3HG2 ILE2036 1.565 0.587 0.581 73 3HG2 ILE2036 2HG2 ILE2036 0.507 1.435 -0.552 74 1HD1 ILE2036 1HD1 ILE2036 0.854 -2.267 -0.045 75 2HD1 ILE2036 3HD1 ILE2036 1.018 -2.764 -1.735 76 3HD1 ILE2036 2HD1 ILE2036 2.154 -3.361 -0.525 77 HA PRO2037 HA PRO2037 -1.746 2.683 -4.125 78 1HB PRO2037 2HB PRO2037 -4.137 2.241 -2.835 79 2HB PRO2037 1HB PRO2037 -3.727 1.560 -4.404 80 1HG PRO2037 2HG PRO2037 -3.744 0.283 -1.733 81 2HG PRO2037 1HG PRO2037 -4.054 -0.429 -3.322 82 1HD PRO2037 2HD PRO2037 -1.724 -0.722 -1.890 83 2HD PRO2037 1HD PRO2037 -1.858 -0.925 -3.647 84 H VAL2038 H VAL2038 -1.748 4.636 -3.272 85 HA VAL2038 HA VAL2038 -1.867 4.888 -0.362 86 HB VAL2038 HB VAL2038 -0.275 6.839 -0.551 87 1HG1 VAL2038 3HG1 VAL2038 0.450 4.685 0.326 88 2HG1 VAL2038 2HG1 VAL2038 0.814 4.136 -1.316 89 3HG1 VAL2038 1HG1 VAL2038 1.728 5.470 -0.604 90 1HG2 VAL2038 2HG2 VAL2038 0.252 5.647 -3.277 91 2HG2 VAL2038 1HG2 VAL2038 -0.456 7.228 -2.953 92 3HG2 VAL2038 3HG2 VAL2038 1.219 6.904 -2.507 93 H ILE2039 H ILE2039 -2.802 6.671 0.446 94 HA ILE2039 HA ILE2039 -4.287 8.295 -1.484 95 HB ILE2039 HB ILE2039 -5.827 6.731 -0.385 96 1HG1 ILE2039 2HG1 ILE2039 -6.209 9.537 0.699 97 2HG1 ILE2039 1HG1 ILE2039 -6.635 9.015 -0.927 98 1HG2 ILE2039 3HG2 ILE2039 -4.605 6.258 1.644 99 2HG2 ILE2039 2HG2 ILE2039 -4.890 7.895 2.227 100 3HG2 ILE2039 1HG2 ILE2039 -6.244 6.782 2.035 101 1HD1 ILE2039 3HD1 ILE2039 -7.845 7.997 1.640 102 2HD1 ILE2039 2HD1 ILE2039 -8.587 9.136 0.516 103 3HD1 ILE2039 1HD1 ILE2039 -8.289 7.474 0.015 104 H ASN2040 H ASN2040 -4.195 10.394 -1.218 105 HA ASN2040 HA ASN2040 -2.330 11.567 0.610 106 1HB ASN2040 2HB ASN2040 -2.845 12.505 -1.659 107 2HB ASN2040 1HB ASN2040 -4.431 12.972 -1.054 108 1HD2 ASN2040 1HD2 ASN2040 -1.096 13.667 -1.103 109 2HD2 ASN2040 2HD2 ASN2040 -1.145 15.152 -0.257 110 H LYS2041 H LYS2041 -2.709 12.171 2.602 111 HA LYS2041 HA LYS2041 -5.157 11.614 3.871 112 1HB LYS2041 2HB LYS2041 -2.726 13.041 4.888 113 2HB LYS2041 1HB LYS2041 -4.053 12.471 5.891 114 1HG LYS2041 2HG LYS2041 -3.613 10.178 5.157 115 2HG LYS2041 1HG LYS2041 -2.280 10.759 4.168 116 1HD LYS2041 2HD LYS2041 -1.320 9.931 6.163 117 2HD LYS2041 1HD LYS2041 -1.297 11.695 6.234 118 1HE LYS2041 2HE LYS2041 -3.196 11.721 7.724 119 2HE LYS2041 1HE LYS2041 -3.395 9.980 7.558 120 1HZ LYS2041 2HZ LYS2041 -1.242 9.681 8.628 121 2HZ LYS2041 1HZ LYS2041 -1.059 11.338 8.811 122 3HZ LYS2041 3HZ LYS2041 -2.286 10.525 9.620 123 H VAL2042 H VAL2042 -3.899 14.493 2.450 124 HA VAL2042 HA VAL2042 -5.669 16.225 3.981 125 HB VAL2042 HB VAL2042 -3.824 16.965 1.700 126 1HG1 VAL2042 1HG1 VAL2042 -5.565 18.612 2.098 127 2HG1 VAL2042 3HG1 VAL2042 -5.132 18.680 3.806 128 3HG1 VAL2042 2HG1 VAL2042 -3.993 19.244 2.585 129 1HG2 VAL2042 1HG2 VAL2042 -3.311 17.065 4.670 130 2HG2 VAL2042 3HG2 VAL2042 -2.530 15.990 3.509 131 3HG2 VAL2042 2HG2 VAL2042 -2.247 17.729 3.429 132 H ASP2043 H ASP2043 -5.026 15.575 0.577 133 HA ASP2043 HA ASP2043 -7.468 16.867 -0.252 134 1HB ASP2043 2HB ASP2043 -5.506 17.137 -1.616 135 2HB ASP2043 1HB ASP2043 -5.364 15.393 -1.820 136 H GLY2044 H GLY2044 -6.259 13.552 -0.207 137 1HA GLY2044 1HA GLY2044 -8.977 12.656 -0.858 138 2HA GLY2044 2HA GLY2044 -7.752 11.703 -0.026 139 H THR2045 H THR2045 -5.965 13.116 -2.255 140 HA THR2045 HA THR2045 -6.563 11.917 -4.702 141 HB THR2045 HB THR2045 -3.770 12.429 -3.638 142 HG1 THR2045 1HG THR2045 -5.806 14.262 -4.157 143 1HG2 THR2045 2HG2 THR2045 -3.898 11.310 -5.820 144 2HG2 THR2045 1HG2 THR2045 -4.936 12.604 -6.425 145 3HG2 THR2045 3HG2 THR2045 -3.262 12.948 -5.989 146 H LEU2046 H LEU2046 -6.721 9.751 -5.032 147 HA LEU2046 HA LEU2046 -5.107 7.953 -3.381 148 1HB LEU2046 2HB LEU2046 -7.492 7.636 -3.138 149 2HB LEU2046 1HB LEU2046 -7.685 7.513 -4.873 150 HG LEU2046 HG LEU2046 -6.335 5.427 -4.818 151 1HD1 LEU2046 1HD1 LEU2046 -5.146 5.812 -2.706 152 2HD1 LEU2046 3HD1 LEU2046 -6.673 5.632 -1.837 153 3HD1 LEU2046 2HD1 LEU2046 -6.000 4.271 -2.726 154 1HD2 LEU2046 1HD2 LEU2046 -8.757 5.415 -4.889 155 2HD2 LEU2046 3HD2 LEU2046 -8.119 4.047 -3.978 156 3HD2 LEU2046 2HD2 LEU2046 -8.812 5.430 -3.122 157 H LEU2047 H LEU2047 -3.549 6.888 -4.335 158 HA LEU2047 HA LEU2047 -3.396 6.907 -7.270 159 1HB LEU2047 2HB LEU2047 -1.190 6.264 -5.311 160 2HB LEU2047 1HB LEU2047 -1.047 6.549 -7.035 161 HG LEU2047 HG LEU2047 -1.674 8.609 -4.919 162 1HD1 LEU2047 3HD1 LEU2047 0.640 7.894 -4.933 163 2HD1 LEU2047 2HD1 LEU2047 0.741 8.219 -6.665 164 3HD1 LEU2047 1HD1 LEU2047 0.484 9.546 -5.532 165 1HD2 LEU2047 3HD2 LEU2047 -1.387 8.939 -7.908 166 2HD2 LEU2047 2HD2 LEU2047 -2.866 9.149 -6.968 167 3HD2 LEU2047 1HD2 LEU2047 -1.516 10.254 -6.741 168 H VAL2048 H VAL2048 -3.979 5.046 -8.184 169 HA VAL2048 HA VAL2048 -3.366 2.552 -6.774 170 HB VAL2048 HB VAL2048 -5.407 1.508 -7.759 171 1HG1 VAL2048 2HG1 VAL2048 -5.950 3.862 -5.979 172 2HG1 VAL2048 1HG1 VAL2048 -7.036 2.494 -6.223 173 3HG1 VAL2048 3HG1 VAL2048 -5.467 2.249 -5.456 174 1HG2 VAL2048 2HG2 VAL2048 -5.788 3.041 -9.621 175 2HG2 VAL2048 1HG2 VAL2048 -7.222 2.929 -8.600 176 3HG2 VAL2048 3HG2 VAL2048 -6.169 4.340 -8.487 177 H GLY2049 H GLY2049 -3.105 0.706 -8.186 178 1HA GLY2049 1HA GLY2049 -2.907 1.045 -10.993 179 2HA GLY2049 2HA GLY2049 -2.328 -0.334 -10.057 180 H GLU2050 H GLU2050 -1.215 1.525 -12.238 181 HA GLU2050 HA GLU2050 1.484 1.415 -11.244 182 1HB GLU2050 2HB GLU2050 0.427 2.359 -13.910 183 2HB GLU2050 1HB GLU2050 2.120 2.124 -13.521 184 1HG GLU2050 2HG GLU2050 0.035 -0.058 -13.547 185 2HG GLU2050 1HG GLU2050 1.155 0.294 -14.855 186 H ASP2051 H ASP2051 -0.860 3.636 -10.966 187 HA ASP2051 HA ASP2051 0.706 6.050 -11.252 188 1HB ASP2051 2HB ASP2051 -1.744 5.744 -11.557 189 2HB ASP2051 1HB ASP2051 -1.900 5.604 -9.833 190 H ALA2052 H ALA2052 0.032 3.690 -8.905 191 HA ALA2052 HA ALA2052 0.988 5.257 -6.678 192 1HB ALA2052 2HB ALA2052 0.555 3.174 -5.395 193 2HB ALA2052 3HB ALA2052 0.119 2.365 -6.901 194 3HB ALA2052 1HB ALA2052 -0.858 3.707 -6.308 195 HA PRO2053 HA PRO2053 5.142 3.855 -7.451 196 1HB PRO2053 2HB PRO2053 5.682 3.866 -4.568 197 2HB PRO2053 1HB PRO2053 6.360 4.902 -5.826 198 1HG PRO2053 2HG PRO2053 4.634 5.845 -3.996 199 2HG PRO2053 1HG PRO2053 4.660 6.446 -5.662 200 1HD PRO2053 2HD PRO2053 2.789 4.478 -4.391 201 2HD PRO2053 1HD PRO2053 2.444 5.827 -5.501 202 H ARG2054 H ARG2054 6.442 1.994 -7.314 203 HA ARG2054 HA ARG2054 5.126 -0.356 -6.347 204 1HB ARG2054 2HB ARG2054 7.361 -1.462 -6.736 205 2HB ARG2054 1HB ARG2054 6.601 -0.806 -8.204 206 1HG ARG2054 2HG ARG2054 8.170 1.153 -7.821 207 2HG ARG2054 1HG ARG2054 8.948 0.153 -6.593 208 1HD ARG2054 2HD ARG2054 8.597 -0.622 -9.490 209 2HD ARG2054 1HD ARG2054 10.074 0.020 -8.766 210 HE ARG2054 HE ARG2054 10.168 -1.981 -7.399 211 1HH1 ARG2054 1HH1 ARG2054 8.041 -2.242 -10.290 212 2HH1 ARG2054 2HH1 ARG2054 8.353 -3.893 -10.475 213 1HH2 ARG2054 1HH2 ARG2054 10.493 -4.278 -7.713 214 2HH2 ARG2054 2HH2 ARG2054 9.749 -5.065 -9.022 215 H ARG2055 H ARG2055 5.780 -1.646 -4.593 216 HA ARG2055 HA ARG2055 6.040 -0.047 -2.372 217 1HB ARG2055 2HB ARG2055 5.023 -2.413 -2.653 218 2HB ARG2055 1HB ARG2055 6.617 -2.983 -2.221 219 1HG ARG2055 2HG ARG2055 5.087 -1.050 -0.515 220 2HG ARG2055 1HG ARG2055 4.911 -2.790 -0.345 221 1HD ARG2055 2HD ARG2055 7.198 -2.994 0.232 222 2HD ARG2055 1HD ARG2055 7.442 -1.284 -0.201 223 HE ARG2055 HE ARG2055 6.752 -0.681 1.853 224 1HH1 ARG2055 1HH1 ARG2055 5.501 -3.970 1.364 225 2HH1 ARG2055 2HH1 ARG2055 4.845 -4.087 2.930 226 1HH2 ARG2055 1HH2 ARG2055 5.917 -0.857 3.923 227 2HH2 ARG2055 2HH2 ARG2055 5.082 -2.249 4.448 228 H ALA2056 H ALA2056 8.528 -1.630 -4.203 229 HA ALA2056 HA ALA2056 10.650 -1.556 -2.415 230 1HB ALA2056 2HB ALA2056 12.080 -1.542 -4.372 231 2HB ALA2056 3HB ALA2056 10.712 -1.062 -5.378 232 3HB ALA2056 1HB ALA2056 10.724 -2.646 -4.609 233 H GLU2057 H GLU2057 9.335 0.992 -4.490 234 HA GLU2057 HA GLU2057 11.337 2.828 -3.375 235 1HB GLU2057 2HB GLU2057 10.589 4.443 -5.084 236 2HB GLU2057 1HB GLU2057 11.111 2.920 -5.801 237 1HG GLU2057 2HG GLU2057 8.735 2.301 -5.991 238 2HG GLU2057 1HG GLU2057 8.311 3.893 -5.368 239 H LEU2058 H LEU2058 8.161 1.902 -2.967 240 HA LEU2058 HA LEU2058 6.779 4.193 -2.292 241 1HB LEU2058 2HB LEU2058 5.786 1.954 -2.674 242 2HB LEU2058 1HB LEU2058 6.453 1.420 -1.152 243 HG LEU2058 HG LEU2058 3.974 1.881 -1.258 244 1HD1 LEU2058 3HD1 LEU2058 5.568 3.289 0.856 245 2HD1 LEU2058 2HD1 LEU2058 3.858 2.859 0.972 246 3HD1 LEU2058 1HD1 LEU2058 5.082 1.596 0.858 247 1HD2 LEU2058 1HD2 LEU2058 4.038 3.941 -2.528 248 2HD2 LEU2058 3HD2 LEU2058 3.252 4.185 -0.967 249 3HD2 LEU2058 2HD2 LEU2058 4.907 4.742 -1.213 250 H GLU2059 H GLU2059 8.749 2.140 -0.190 251 HA GLU2059 HA GLU2059 8.293 3.366 2.269 252 1HB GLU2059 2HB GLU2059 10.914 2.278 1.224 253 2HB GLU2059 1HB GLU2059 10.532 2.567 2.912 254 1HG GLU2059 2HG GLU2059 9.193 0.576 1.100 255 2HG GLU2059 1HG GLU2059 10.384 0.221 2.355 256 H MET2060 H MET2060 10.883 3.985 0.004 257 HA MET2060 HA MET2060 12.037 6.256 1.133 258 1HB MET2060 2HB MET2060 13.165 5.022 -0.605 259 2HB MET2060 1HB MET2060 11.872 5.331 -1.735 260 1HG MET2060 2HG MET2060 13.566 6.743 -2.452 261 2HG MET2060 1HG MET2060 12.522 7.804 -1.530 262 1HE MET2060 3HE MET2060 13.116 8.774 0.839 263 2HE MET2060 2HE MET2060 13.592 7.264 1.639 264 3HE MET2060 1HE MET2060 14.690 8.620 1.624 265 H TRP2061 H TRP2061 9.517 5.942 -1.282 266 HA TRP2061 HA TRP2061 9.118 8.598 -1.982 267 1HB TRP2061 2HB TRP2061 8.262 6.546 -3.139 268 2HB TRP2061 1HB TRP2061 7.073 6.385 -1.858 269 HD1 TRP2061 HD TRP2061 7.983 8.609 -4.824 270 HE1 TRP2061 1HE TRP2061 5.882 9.874 -5.564 271 HE3 TRP2061 3HE TRP2061 4.870 7.218 -1.051 272 HZ2 TRP2061 2HZ TRP2061 3.224 10.227 -4.653 273 HZ3 TRP2061 3HZ TRP2061 2.566 8.059 -1.060 274 HH2 TRP2061 HH TRP2061 1.770 9.534 -2.823 275 H LEU2062 H LEU2062 7.359 6.621 0.405 276 HA LEU2062 HA LEU2062 5.763 8.687 1.394 277 1HB LEU2062 2HB LEU2062 6.612 6.102 2.624 278 2HB LEU2062 1HB LEU2062 5.634 7.246 3.520 279 HG LEU2062 HG LEU2062 4.864 5.821 0.963 280 1HD1 LEU2062 1HD1 LEU2062 3.804 5.628 3.775 281 2HD1 LEU2062 3HD1 LEU2062 3.166 4.779 2.366 282 3HD1 LEU2062 2HD1 LEU2062 4.795 4.428 2.944 283 1HD2 LEU2062 3HD2 LEU2062 3.321 7.839 2.597 284 2HD2 LEU2062 2HD2 LEU2062 3.912 8.065 0.949 285 3HD2 LEU2062 1HD2 LEU2062 2.663 6.875 1.275 286 H GLN2063 H GLN2063 9.057 7.876 2.204 287 HA GLN2063 HA GLN2063 9.189 9.348 4.594 288 1HB GLN2063 2HB GLN2063 11.357 8.821 2.582 289 2HB GLN2063 1HB GLN2063 11.603 9.440 4.194 290 1HG GLN2063 2HG GLN2063 10.767 6.685 3.325 291 2HG GLN2063 1HG GLN2063 12.151 7.151 4.305 292 1HE2 GLN2063 1HE2 GLN2063 8.843 6.336 4.264 293 2HE2 GLN2063 2HE2 GLN2063 8.565 6.356 5.967 294 H GLY2064 H GLY2064 9.376 10.237 1.275 295 1HA GLY2064 1HA GLY2064 10.028 12.331 0.322 296 2HA GLY2064 2HA GLY2064 10.058 13.016 1.941 297 H HIS2065 H HIS2065 7.319 11.126 1.283 298 HA HIS2065 HA HIS2065 5.714 13.558 0.965 299 1HB HIS2065 2HB HIS2065 5.154 10.902 -0.420 300 2HB HIS2065 1HB HIS2065 4.117 12.318 -0.474 301 HD1 HIS2065 1HD HIS2065 4.694 14.116 -2.274 302 HD2 HIS2065 2HD HIS2065 7.534 11.090 -1.935 303 HE1 HIS2065 1HE HIS2065 6.252 14.403 -4.208 304 HA PRO2066 HA PRO2066 4.423 11.022 4.636 305 1HB PRO2066 2HB PRO2066 4.361 13.004 6.447 306 2HB PRO2066 1HB PRO2066 5.872 12.207 5.987 307 1HG PRO2066 2HG PRO2066 4.755 14.831 5.073 308 2HG PRO2066 1HG PRO2066 6.419 14.422 5.528 309 1HD PRO2066 2HD PRO2066 5.579 14.572 2.926 310 2HD PRO2066 1HD PRO2066 6.893 13.520 3.475 311 H GLU2067 H GLU2067 3.043 13.334 2.772 312 HA GLU2067 HA GLU2067 0.647 13.726 4.342 313 1HB GLU2067 2HB GLU2067 -0.135 15.054 2.419 314 2HB GLU2067 1HB GLU2067 1.425 15.590 3.031 315 1HG GLU2067 2HG GLU2067 2.527 14.427 1.192 316 2HG GLU2067 1HG GLU2067 0.953 13.893 0.601 317 H PHE2068 H PHE2068 1.805 11.305 2.436 318 HA PHE2068 HA PHE2068 -0.882 10.454 1.628 319 1HB PHE2068 2HB PHE2068 1.845 9.659 0.617 320 2HB PHE2068 1HB PHE2068 0.394 8.748 0.236 321 HD1 PHE2068 1HD PHE2068 -1.028 9.428 -1.497 322 HD2 PHE2068 2HD PHE2068 2.036 12.049 -0.151 323 HE1 PHE2068 1HE PHE2068 -1.423 10.879 -3.443 324 HE2 PHE2068 2HE PHE2068 1.649 13.506 -2.093 325 HZ PHE2068 HZ PHE2068 -0.082 12.920 -3.747 326 H ALA2069 H ALA2069 -1.512 8.332 2.099 327 HA ALA2069 HA ALA2069 0.057 6.954 4.165 328 1HB ALA2069 3HB ALA2069 -2.910 7.493 4.184 329 2HB ALA2069 2HB ALA2069 -2.055 6.475 5.339 330 3HB ALA2069 1HB ALA2069 -1.719 8.208 5.265 331 H VAL2070 H VAL2070 -0.370 4.683 4.239 332 HA VAL2070 HA VAL2070 -0.933 3.514 1.711 333 HB VAL2070 HB VAL2070 0.637 2.346 3.186 334 1HG1 VAL2070 2HG1 VAL2070 -1.634 2.005 5.121 335 2HG1 VAL2070 1HG1 VAL2070 -0.042 1.257 5.260 336 3HG1 VAL2070 3HG1 VAL2070 -0.199 3.011 5.341 337 1HG2 VAL2070 2HG2 VAL2070 -1.889 0.724 2.883 338 2HG2 VAL2070 1HG2 VAL2070 -0.621 0.915 1.673 339 3HG2 VAL2070 3HG2 VAL2070 -0.280 0.064 3.183 340 H ASP2071 H ASP2071 -2.738 2.667 0.884 341 HA ASP2071 HA ASP2071 -5.232 3.487 1.780 342 1HB ASP2071 2HB ASP2071 -4.794 2.887 -0.574 343 2HB ASP2071 1HB ASP2071 -4.550 1.220 -0.091 344 HA PRO2072 HA PRO2072 -5.808 0.592 5.117 345 1HB PRO2072 2HB PRO2072 -8.317 1.390 5.779 346 2HB PRO2072 1HB PRO2072 -6.864 2.290 6.243 347 1HG PRO2072 2HG PRO2072 -8.786 2.781 4.005 348 2HG PRO2072 1HG PRO2072 -8.004 3.948 5.083 349 1HD PRO2072 2HD PRO2072 -7.162 3.492 2.560 350 2HD PRO2072 1HD PRO2072 -6.052 3.954 3.868 351 H ARG2073 H ARG2073 -7.684 0.743 2.278 352 HA ARG2073 HA ARG2073 -9.459 -1.414 3.022 353 1HB ARG2073 2HB ARG2073 -9.095 0.183 0.496 354 2HB ARG2073 1HB ARG2073 -10.297 -1.096 0.669 355 1HG ARG2073 2HG ARG2073 -11.507 0.113 2.272 356 2HG ARG2073 1HG ARG2073 -10.169 1.221 2.565 357 1HD ARG2073 2HD ARG2073 -11.692 1.020 -0.026 358 2HD ARG2073 1HD ARG2073 -12.020 2.203 1.247 359 HE ARG2073 HE ARG2073 -9.301 2.116 0.190 360 1HH1 ARG2073 1HH1 ARG2073 -12.444 3.790 0.127 361 2HH1 ARG2073 2HH1 ARG2073 -11.775 5.222 -0.522 362 1HH2 ARG2073 1HH2 ARG2073 -8.464 4.030 -0.646 363 2HH2 ARG2073 2HH2 ARG2073 -9.490 5.383 -0.994 364 H PHE2074 H PHE2074 -6.669 -0.830 1.025 365 HA PHE2074 HA PHE2074 -6.411 -3.394 -0.102 366 1HB PHE2074 2HB PHE2074 -5.104 -1.519 -0.956 367 2HB PHE2074 1HB PHE2074 -4.294 -1.339 0.595 368 HD1 PHE2074 1HD PHE2074 -2.405 -2.672 1.155 369 HD2 PHE2074 2HD PHE2074 -4.614 -3.497 -2.383 370 HE1 PHE2074 1HE PHE2074 -0.632 -4.199 0.409 371 HE2 PHE2074 2HE PHE2074 -2.839 -5.030 -3.136 372 HZ PHE2074 HZ PHE2074 -0.848 -5.383 -1.740 373 H LEU2075 H LEU2075 -4.911 -1.977 2.784 374 HA LEU2075 HA LEU2075 -3.703 -4.392 3.500 375 1HB LEU2075 2HB LEU2075 -3.219 -3.315 5.698 376 2HB LEU2075 1HB LEU2075 -2.614 -2.507 4.275 377 HG LEU2075 HG LEU2075 -4.695 -1.016 4.548 378 1HD1 LEU2075 2HD1 LEU2075 -4.453 -2.137 7.336 379 2HD1 LEU2075 1HD1 LEU2075 -5.419 -0.740 6.875 380 3HD1 LEU2075 3HD1 LEU2075 -5.831 -2.340 6.255 381 1HD2 LEU2075 3HD2 LEU2075 -2.407 -0.408 4.771 382 2HD2 LEU2075 2HD2 LEU2075 -3.389 0.443 5.984 383 3HD2 LEU2075 1HD2 LEU2075 -2.387 -0.959 6.438 384 H ALA2076 H ALA2076 -6.849 -3.206 4.077 385 HA ALA2076 HA ALA2076 -7.557 -4.762 6.302 386 1HB ALA2076 3HB ALA2076 -9.865 -4.385 5.647 387 2HB ALA2076 1HB ALA2076 -9.335 -3.852 4.052 388 3HB ALA2076 2HB ALA2076 -8.925 -2.898 5.478 389 H TYR2077 H TYR2077 -7.051 -5.615 2.995 390 HA TYR2077 HA TYR2077 -8.714 -7.855 2.727 391 1HB TYR2077 2HB TYR2077 -7.477 -6.772 0.870 392 2HB TYR2077 1HB TYR2077 -5.980 -7.432 1.510 393 HD1 TYR2077 1HD TYR2077 -5.253 -9.540 0.788 394 HD2 TYR2077 2HD TYR2077 -9.321 -8.449 0.263 395 HE1 TYR2077 1HE TYR2077 -5.623 -11.587 -0.538 396 HE2 TYR2077 2HE TYR2077 -9.712 -10.475 -1.054 397 HH TYR2077 HH TYR2077 -8.332 -11.981 -2.456 398 H MET2078 H MET2078 -5.475 -7.574 4.120 399 HA MET2078 HA MET2078 -5.310 -10.417 4.529 400 1HB MET2078 2HB MET2078 -3.236 -10.066 5.716 401 2HB MET2078 1HB MET2078 -3.229 -9.098 4.255 402 1HG MET2078 2HG MET2078 -3.752 -7.105 5.595 403 2HG MET2078 1HG MET2078 -3.740 -8.095 7.050 404 1HE MET2078 1HE MET2078 -1.564 -9.349 7.964 405 2HE MET2078 3HE MET2078 -1.268 -10.096 6.394 406 3HE MET2078 2HE MET2078 0.025 -9.226 7.215 407 H GLU2079 H GLU2079 -6.471 -7.745 6.357 408 HA GLU2079 HA GLU2079 -6.543 -9.137 8.862 409 1HB GLU2079 2HB GLU2079 -7.798 -6.547 7.982 410 2HB GLU2079 1HB GLU2079 -7.913 -7.186 9.615 411 1HG GLU2079 2HG GLU2079 -5.403 -6.379 8.172 412 2HG GLU2079 1HG GLU2079 -6.183 -5.521 9.501 413 H ASP2080 H ASP2080 -8.810 -8.353 6.343 414 HA ASP2080 HA ASP2080 -11.089 -9.487 7.681 415 1HB ASP2080 2HB ASP2080 -11.262 -7.610 6.059 416 2HB ASP2080 1HB ASP2080 -10.744 -8.702 4.781 417 H ARG2081 H ARG2081 -8.703 -10.450 5.419 418 HA ARG2081 HA ARG2081 -8.035 -12.248 4.413 419 1HB ARG2081 2HB ARG2081 -7.963 -14.361 5.625 420 2HB ARG2081 1HB ARG2081 -7.649 -13.028 6.715 421 1HG ARG2081 2HG ARG2081 -9.985 -13.214 7.526 422 2HG ARG2081 1HG ARG2081 -10.192 -14.626 6.489 423 1HD ARG2081 2HD ARG2081 -9.690 -15.307 8.774 424 2HD ARG2081 1HD ARG2081 -8.380 -15.762 7.690 425 HE ARG2081 HE ARG2081 -7.043 -14.073 8.583 426 1HH1 ARG2081 1HH1 ARG2081 -10.131 -14.363 10.291 427 2HH1 ARG2081 2HH1 ARG2081 -9.602 -13.601 11.714 428 1HH2 ARG2081 1HH2 ARG2081 -6.293 -13.034 10.517 429 2HH2 ARG2081 2HH2 ARG2081 -7.328 -12.802 11.860 430 H ARG2082 H ARG2082 -8.679 -14.615 3.731 431 HA ARG2082 HA ARG2082 -11.069 -14.231 2.166 432 1HB ARG2082 2HB ARG2082 -9.007 -16.445 2.155 433 2HB ARG2082 1HB ARG2082 -10.340 -16.294 1.014 434 1HG ARG2082 2HG ARG2082 -9.429 -14.280 0.104 435 2HG ARG2082 1HG ARG2082 -8.191 -14.215 1.356 436 1HD ARG2082 2HD ARG2082 -7.240 -16.299 0.515 437 2HD ARG2082 1HD ARG2082 -8.480 -16.365 -0.736 438 HE ARG2082 HE ARG2082 -7.392 -13.987 -1.209 439 1HH1 ARG2082 1HH1 ARG2082 -5.748 -17.065 -0.532 440 2HH1 ARG2082 2HH1 ARG2082 -4.455 -16.734 -1.608 441 1HH2 ARG2082 1HH2 ARG2082 -5.592 -13.609 -2.674 442 2HH2 ARG2082 2HH2 ARG2082 -4.389 -14.791 -2.859 443 H LYS2083 H LYS2083 -12.835 -15.545 2.305 444 HA LYS2083 HA LYS2083 -13.047 -17.029 4.817 445 1HB LYS2083 2HB LYS2083 -15.140 -15.709 3.068 446 2HB LYS2083 1HB LYS2083 -15.570 -16.870 4.307 447 1HG LYS2083 2HG LYS2083 -15.910 -14.622 5.149 448 2HG LYS2083 1HG LYS2083 -14.594 -15.387 6.021 449 1HD LYS2083 2HD LYS2083 -14.009 -13.088 5.569 450 2HD LYS2083 1HD LYS2083 -12.988 -14.128 4.585 451 1HE LYS2083 2HE LYS2083 -14.487 -13.724 2.660 452 2HE LYS2083 1HE LYS2083 -15.448 -12.642 3.662 453 1HZ LYS2083 2HZ LYS2083 -12.554 -12.225 3.061 454 2HZ LYS2083 1HZ LYS2083 -13.841 -11.474 2.247 455 3HZ LYS2083 3HZ LYS2083 -13.533 -11.158 3.867 456 H GLN2084 H GLN2084 -14.290 -19.074 4.724 457 HA GLN2084 HA GLN2084 -13.453 -20.541 2.410 458 1HB GLN2084 2HB GLN2084 -13.316 -21.511 4.713 459 2HB GLN2084 1HB GLN2084 -15.074 -21.542 4.752 460 1HG GLN2084 2HG GLN2084 -15.104 -23.075 2.852 461 2HG GLN2084 1HG GLN2084 -13.347 -23.051 2.792 462 1HE2 GLN2084 1HE2 GLN2084 -13.094 -23.067 5.709 463 2HE2 GLN2084 2HE2 GLN2084 -13.505 -24.667 6.208 464 H LYS2085 H LYS2085 -14.635 -19.382 1.012 465 HA LYS2085 HA LYS2085 -17.453 -20.158 0.775 466 1HB LYS2085 2HB LYS2085 -17.654 -18.131 -0.688 467 2HB LYS2085 1HB LYS2085 -17.285 -17.745 0.985 468 1HG LYS2085 2HG LYS2085 -14.923 -17.433 0.386 469 2HG LYS2085 1HG LYS2085 -15.302 -17.822 -1.287 470 1HD LYS2085 2HD LYS2085 -16.484 -15.497 0.235 471 2HD LYS2085 1HD LYS2085 -15.078 -15.385 -0.820 472 1HE LYS2085 2HE LYS2085 -16.473 -16.198 -2.700 473 2HE LYS2085 1HE LYS2085 -17.867 -16.215 -1.624 474 1HZ LYS2085 3HZ LYS2085 -17.602 -13.790 -1.356 475 2HZ LYS2085 2HZ LYS2085 -16.314 -13.790 -2.425 476 3HZ LYS2085 1HZ LYS2085 -17.843 -14.238 -2.961 No H/Q in entry = 476 Start of MODEL 5 1 H LEU2028 H LEU2028 -1.704 -9.676 -5.922 2 HA LEU2028 HA LEU2028 -1.922 -8.355 -4.154 3 1HB LEU2028 2HB LEU2028 -3.550 -10.637 -3.018 4 2HB LEU2028 1HB LEU2028 -3.213 -9.206 -2.070 5 HG LEU2028 HG LEU2028 -4.447 -7.834 -3.726 6 1HD1 LEU2028 2HD1 LEU2028 -5.118 -10.454 -5.050 7 2HD1 LEU2028 1HD1 LEU2028 -5.836 -8.884 -5.432 8 3HD1 LEU2028 3HD1 LEU2028 -4.121 -9.173 -5.729 9 1HD2 LEU2028 3HD2 LEU2028 -5.987 -10.179 -2.648 10 2HD2 LEU2028 2HD2 LEU2028 -5.594 -8.689 -1.783 11 3HD2 LEU2028 1HD2 LEU2028 -6.676 -8.642 -3.172 12 H ASP2029 H ASP2029 -0.229 -11.094 -4.183 13 HA ASP2029 HA ASP2029 1.250 -10.866 -1.743 14 1HB ASP2029 2HB ASP2029 2.099 -12.038 -4.419 15 2HB ASP2029 1HB ASP2029 2.884 -12.324 -2.876 16 H VAL2030 H VAL2030 2.756 -9.316 -1.382 17 HA VAL2030 HA VAL2030 2.930 -7.358 -3.446 18 HB VAL2030 HB VAL2030 4.129 -7.193 -0.678 19 1HG1 VAL2030 3HG1 VAL2030 5.172 -5.670 -2.373 20 2HG1 VAL2030 2HG1 VAL2030 3.576 -4.932 -2.582 21 3HG1 VAL2030 1HG1 VAL2030 4.370 -4.840 -1.035 22 1HG2 VAL2030 3HG2 VAL2030 1.708 -7.389 -0.593 23 2HG2 VAL2030 2HG2 VAL2030 2.231 -5.765 -0.137 24 3HG2 VAL2030 1HG2 VAL2030 1.557 -6.058 -1.745 25 H ASP2031 H ASP2031 5.387 -8.908 -1.439 26 HA ASP2031 HA ASP2031 7.603 -9.074 -1.683 27 1HB ASP2031 2HB ASP2031 6.783 -11.110 -2.824 28 2HB ASP2031 1HB ASP2031 6.780 -10.254 -4.359 29 H LEU2032 H LEU2032 7.022 -6.605 -2.052 30 HA LEU2032 HA LEU2032 8.143 -4.713 -2.442 31 1HB LEU2032 2HB LEU2032 10.138 -6.500 -3.779 32 2HB LEU2032 1HB LEU2032 10.397 -4.784 -3.543 33 HG LEU2032 HG LEU2032 9.964 -6.788 -1.324 34 1HD1 LEU2032 1HD1 LEU2032 12.486 -5.447 -2.279 35 2HD1 LEU2032 3HD1 LEU2032 12.330 -6.450 -0.835 36 3HD1 LEU2032 2HD1 LEU2032 12.079 -7.161 -2.425 37 1HD2 LEU2032 3HD2 LEU2032 10.728 -3.876 -1.268 38 2HD2 LEU2032 2HD2 LEU2032 9.209 -4.576 -0.703 39 3HD2 LEU2032 1HD2 LEU2032 10.715 -4.959 0.122 40 H GLU2033 H GLU2033 7.652 -6.563 -5.441 41 HA GLU2033 HA GLU2033 7.902 -4.110 -6.982 42 1HB GLU2033 2HB GLU2033 6.995 -6.805 -7.967 43 2HB GLU2033 1HB GLU2033 7.432 -5.430 -8.962 44 1HG GLU2033 2HG GLU2033 9.724 -5.569 -7.927 45 2HG GLU2033 1HG GLU2033 9.219 -7.117 -7.249 46 H THR2034 H THR2034 5.370 -5.758 -5.470 47 HA THR2034 HA THR2034 3.271 -4.735 -7.060 48 HB THR2034 HB THR2034 3.426 -5.820 -4.293 49 HG1 THR2034 1HG THR2034 2.918 -7.751 -5.233 50 1HG2 THR2034 1HG2 THR2034 1.396 -4.442 -4.424 51 2HG2 THR2034 3HG2 THR2034 0.867 -5.334 -5.862 52 3HG2 THR2034 2HG2 THR2034 1.003 -6.148 -4.294 53 H ARG2035 H ARG2035 1.822 -3.036 -6.579 54 HA ARG2035 HA ARG2035 3.267 -0.751 -5.510 55 1HB ARG2035 2HB ARG2035 0.737 -0.921 -7.156 56 2HB ARG2035 1HB ARG2035 1.494 0.560 -6.624 57 1HG ARG2035 2HG ARG2035 1.961 0.214 -8.948 58 2HG ARG2035 1HG ARG2035 3.454 0.010 -8.040 59 1HD ARG2035 2HD ARG2035 3.454 -2.315 -8.375 60 2HD ARG2035 1HD ARG2035 1.747 -2.346 -8.805 61 HE ARG2035 HE ARG2035 2.566 -0.934 -10.789 62 1HH1 ARG2035 1HH1 ARG2035 4.559 -3.556 -9.423 63 2HH1 ARG2035 2HH1 ARG2035 5.129 -4.011 -10.970 64 1HH2 ARG2035 1HH2 ARG2035 3.387 -1.556 -12.774 65 2HH2 ARG2035 2HH2 ARG2035 4.447 -2.889 -12.901 66 H ILE2036 H ILE2036 2.775 -0.045 -3.548 67 HA ILE2036 HA ILE2036 0.394 -0.991 -2.239 68 HB ILE2036 HB ILE2036 2.502 0.958 -1.288 69 1HG1 ILE2036 2HG1 ILE2036 3.440 -1.245 -1.648 70 2HG1 ILE2036 1HG1 ILE2036 3.321 -0.908 0.072 71 1HG2 ILE2036 1HG2 ILE2036 0.414 1.318 -0.090 72 2HG2 ILE2036 3HG2 ILE2036 0.316 -0.404 0.286 73 3HG2 ILE2036 2HG2 ILE2036 1.609 0.580 0.975 74 1HD1 ILE2036 2HD1 ILE2036 1.323 -2.308 0.200 75 2HD1 ILE2036 1HD1 ILE2036 1.461 -2.660 -1.520 76 3HD1 ILE2036 3HD1 ILE2036 2.720 -3.201 -0.409 77 HA PRO2037 HA PRO2037 -1.874 2.553 -3.746 78 1HB PRO2037 2HB PRO2037 -4.196 1.973 -2.408 79 2HB PRO2037 1HB PRO2037 -3.737 1.231 -3.942 80 1HG PRO2037 2HG PRO2037 -3.512 0.161 -1.181 81 2HG PRO2037 1HG PRO2037 -3.967 -0.679 -2.672 82 1HD PRO2037 2HD PRO2037 -1.514 -0.863 -1.547 83 2HD PRO2037 1HD PRO2037 -1.781 -0.996 -3.297 84 H VAL2038 H VAL2038 -1.581 4.433 -2.916 85 HA VAL2038 HA VAL2038 -1.896 4.817 -0.037 86 HB VAL2038 HB VAL2038 -0.165 6.640 -0.187 87 1HG1 VAL2038 2HG1 VAL2038 0.344 4.455 0.781 88 2HG1 VAL2038 1HG1 VAL2038 0.812 3.853 -0.809 89 3HG1 VAL2038 3HG1 VAL2038 1.738 5.149 -0.046 90 1HG2 VAL2038 3HG2 VAL2038 0.436 5.341 -2.848 91 2HG2 VAL2038 2HG2 VAL2038 -0.179 6.976 -2.604 92 3HG2 VAL2038 1HG2 VAL2038 1.444 6.552 -2.053 93 H ILE2039 H ILE2039 -2.633 6.817 0.600 94 HA ILE2039 HA ILE2039 -3.791 8.428 -1.530 95 HB ILE2039 HB ILE2039 -5.572 6.962 -0.704 96 1HG1 ILE2039 2HG1 ILE2039 -5.944 9.810 0.261 97 2HG1 ILE2039 1HG1 ILE2039 -6.116 9.281 -1.406 98 1HG2 ILE2039 1HG2 ILE2039 -5.025 8.154 2.012 99 2HG2 ILE2039 3HG2 ILE2039 -6.393 7.114 1.610 100 3HG2 ILE2039 2HG2 ILE2039 -4.745 6.483 1.523 101 1HD1 ILE2039 2HD1 ILE2039 -7.986 7.845 -0.718 102 2HD1 ILE2039 1HD1 ILE2039 -7.814 8.457 0.924 103 3HD1 ILE2039 3HD1 ILE2039 -8.276 9.554 -0.377 104 H ASN2040 H ASN2040 -3.636 10.496 -1.257 105 HA ASN2040 HA ASN2040 -2.177 11.678 0.906 106 1HB ASN2040 2HB ASN2040 -2.267 12.700 -1.376 107 2HB ASN2040 1HB ASN2040 -3.989 12.972 -1.163 108 1HD2 ASN2040 1HD2 ASN2040 -1.885 14.880 -1.746 109 2HD2 ASN2040 2HD2 ASN2040 -1.911 16.042 -0.492 110 H LYS2041 H LYS2041 -3.022 11.737 2.843 111 HA LYS2041 HA LYS2041 -5.725 11.211 3.383 112 1HB LYS2041 2HB LYS2041 -5.180 11.652 5.749 113 2HB LYS2041 1HB LYS2041 -4.140 10.491 4.947 114 1HG LYS2041 2HG LYS2041 -2.421 12.181 4.719 115 2HG LYS2041 1HG LYS2041 -3.462 13.359 5.534 116 1HD LYS2041 2HD LYS2041 -3.566 11.914 7.477 117 2HD LYS2041 1HD LYS2041 -2.548 10.740 6.657 118 1HE LYS2041 2HE LYS2041 -1.238 12.060 8.267 119 2HE LYS2041 1HE LYS2041 -0.696 12.328 6.615 120 1HZ LYS2041 2HZ LYS2041 -2.567 14.196 7.985 121 2HZ LYS2041 1HZ LYS2041 -0.911 14.314 8.107 122 3HZ LYS2041 3HZ LYS2041 -1.605 14.485 6.603 123 H VAL2042 H VAL2042 -4.186 14.196 2.813 124 HA VAL2042 HA VAL2042 -6.308 15.686 4.123 125 HB VAL2042 HB VAL2042 -3.939 16.687 2.520 126 1HG1 VAL2042 1HG1 VAL2042 -5.790 18.283 2.489 127 2HG1 VAL2042 3HG1 VAL2042 -5.891 18.215 4.250 128 3HG1 VAL2042 2HG1 VAL2042 -4.459 18.889 3.472 129 1HG2 VAL2042 3HG2 VAL2042 -4.379 16.576 5.503 130 2HG2 VAL2042 2HG2 VAL2042 -3.248 15.591 4.572 131 3HG2 VAL2042 1HG2 VAL2042 -3.006 17.334 4.700 132 H ASP2043 H ASP2043 -4.988 15.263 0.877 133 HA ASP2043 HA ASP2043 -7.124 16.824 -0.275 134 1HB ASP2043 2HB ASP2043 -4.900 16.949 -1.239 135 2HB ASP2043 1HB ASP2043 -4.976 15.244 -1.667 136 H GLY2044 H GLY2044 -6.334 13.395 -0.127 137 1HA GLY2044 1HA GLY2044 -8.957 12.840 -1.271 138 2HA GLY2044 2HA GLY2044 -7.945 11.721 -0.355 139 H THR2045 H THR2045 -5.647 12.829 -2.057 140 HA THR2045 HA THR2045 -6.146 11.862 -4.689 141 HB THR2045 HB THR2045 -3.454 12.265 -3.362 142 HG1 THR2045 1HG THR2045 -5.372 14.144 -3.994 143 1HG2 THR2045 2HG2 THR2045 -3.428 11.117 -5.533 144 2HG2 THR2045 1HG2 THR2045 -4.322 12.451 -6.254 145 3HG2 THR2045 3HG2 THR2045 -2.686 12.715 -5.643 146 H LEU2046 H LEU2046 -6.696 9.687 -4.677 147 HA LEU2046 HA LEU2046 -5.062 7.822 -3.156 148 1HB LEU2046 2HB LEU2046 -7.475 7.521 -3.059 149 2HB LEU2046 1HB LEU2046 -7.558 7.418 -4.805 150 HG LEU2046 HG LEU2046 -6.217 5.334 -4.696 151 1HD1 LEU2046 1HD1 LEU2046 -5.112 5.681 -2.551 152 2HD1 LEU2046 3HD1 LEU2046 -6.671 5.533 -1.729 153 3HD1 LEU2046 2HD1 LEU2046 -5.988 4.151 -2.585 154 1HD2 LEU2046 3HD2 LEU2046 -8.622 5.248 -4.902 155 2HD2 LEU2046 2HD2 LEU2046 -8.037 3.919 -3.893 156 3HD2 LEU2046 1HD2 LEU2046 -8.789 5.331 -3.145 157 H LEU2047 H LEU2047 -3.461 6.763 -4.051 158 HA LEU2047 HA LEU2047 -3.215 6.766 -6.978 159 1HB LEU2047 2HB LEU2047 -1.065 6.484 -4.870 160 2HB LEU2047 1HB LEU2047 -0.804 6.473 -6.599 161 HG LEU2047 HG LEU2047 -1.764 8.827 -4.972 162 1HD1 LEU2047 3HD1 LEU2047 0.875 8.292 -6.327 163 2HD1 LEU2047 2HD1 LEU2047 0.412 9.794 -5.527 164 3HD1 LEU2047 1HD1 LEU2047 0.578 8.309 -4.588 165 1HD2 LEU2047 2HD2 LEU2047 -1.114 8.618 -7.913 166 2HD2 LEU2047 1HD2 LEU2047 -2.714 8.869 -7.222 167 3HD2 LEU2047 3HD2 LEU2047 -1.474 10.110 -7.050 168 H VAL2048 H VAL2048 -3.643 4.876 -7.862 169 HA VAL2048 HA VAL2048 -2.908 2.423 -6.452 170 HB VAL2048 HB VAL2048 -4.947 1.310 -7.353 171 1HG1 VAL2048 2HG1 VAL2048 -5.541 3.695 -5.622 172 2HG1 VAL2048 1HG1 VAL2048 -6.620 2.317 -5.855 173 3HG1 VAL2048 3HG1 VAL2048 -5.054 2.093 -5.077 174 1HG2 VAL2048 1HG2 VAL2048 -5.378 2.767 -9.255 175 2HG2 VAL2048 3HG2 VAL2048 -6.815 2.644 -8.236 176 3HG2 VAL2048 2HG2 VAL2048 -5.809 4.091 -8.169 177 H GLY2049 H GLY2049 -2.626 0.613 -7.974 178 1HA GLY2049 1HA GLY2049 -2.797 0.958 -10.770 179 2HA GLY2049 2HA GLY2049 -1.978 -0.348 -9.932 180 H GLU2050 H GLU2050 -1.482 1.951 -12.118 181 HA GLU2050 HA GLU2050 1.358 1.848 -11.585 182 1HB GLU2050 2HB GLU2050 -0.129 2.696 -14.064 183 2HB GLU2050 1HB GLU2050 1.624 2.713 -13.918 184 1HG GLU2050 2HG GLU2050 -0.159 0.294 -13.711 185 2HG GLU2050 1HG GLU2050 0.876 0.712 -15.074 186 H ASP2051 H ASP2051 -1.029 3.850 -10.890 187 HA ASP2051 HA ASP2051 0.514 6.284 -11.087 188 1HB ASP2051 2HB ASP2051 -2.186 5.558 -10.102 189 2HB ASP2051 1HB ASP2051 -1.527 7.152 -9.688 190 H ALA2052 H ALA2052 0.323 3.659 -9.105 191 HA ALA2052 HA ALA2052 1.344 5.125 -6.812 192 1HB ALA2052 3HB ALA2052 0.904 3.016 -5.564 193 2HB ALA2052 1HB ALA2052 0.252 2.313 -7.043 194 3HB ALA2052 2HB ALA2052 -0.555 3.687 -6.290 195 HA PRO2053 HA PRO2053 5.268 3.271 -7.975 196 1HB PRO2053 2HB PRO2053 6.323 3.623 -5.309 197 2HB PRO2053 1HB PRO2053 6.656 4.597 -6.740 198 1HG PRO2053 2HG PRO2053 5.275 5.510 -4.548 199 2HG PRO2053 1HG PRO2053 5.096 6.168 -6.181 200 1HD PRO2053 2HD PRO2053 3.350 4.237 -4.711 201 2HD PRO2053 1HD PRO2053 2.911 5.584 -5.787 202 H ARG2054 H ARG2054 6.759 1.533 -7.263 203 HA ARG2054 HA ARG2054 5.363 -0.806 -6.342 204 1HB ARG2054 2HB ARG2054 8.320 -0.265 -6.580 205 2HB ARG2054 1HB ARG2054 7.591 -1.836 -6.342 206 1HG ARG2054 2HG ARG2054 6.702 -1.834 -8.542 207 2HG ARG2054 1HG ARG2054 7.125 -0.124 -8.755 208 1HD ARG2054 2HD ARG2054 9.474 -0.647 -8.529 209 2HD ARG2054 1HD ARG2054 9.104 -2.333 -8.229 210 HE ARG2054 HE ARG2054 8.195 -2.342 -10.554 211 1HH1 ARG2054 1HH1 ARG2054 10.487 0.290 -9.808 212 2HH1 ARG2054 2HH1 ARG2054 11.369 0.094 -11.224 213 1HH2 ARG2054 1HH2 ARG2054 9.410 -2.563 -12.519 214 2HH2 ARG2054 2HH2 ARG2054 10.767 -1.561 -12.809 215 H ARG2055 H ARG2055 5.848 -1.893 -4.360 216 HA ARG2055 HA ARG2055 6.040 -0.391 -2.026 217 1HB ARG2055 2HB ARG2055 5.216 -2.692 -2.071 218 2HB ARG2055 1HB ARG2055 6.792 -3.277 -2.514 219 1HG ARG2055 2HG ARG2055 6.565 -3.718 -0.194 220 2HG ARG2055 1HG ARG2055 7.653 -2.324 -0.332 221 1HD ARG2055 2HD ARG2055 5.521 -0.922 -0.024 222 2HD ARG2055 1HD ARG2055 4.787 -2.421 0.537 223 HE ARG2055 HE ARG2055 6.790 -0.806 1.830 224 1HH1 ARG2055 1HH1 ARG2055 5.077 -3.956 1.987 225 2HH1 ARG2055 2HH1 ARG2055 5.294 -4.100 3.661 226 1HH2 ARG2055 1HH2 ARG2055 7.110 -1.091 4.056 227 2HH2 ARG2055 2HH2 ARG2055 6.484 -2.459 4.885 228 H ALA2056 H ALA2056 8.530 -1.924 -3.944 229 HA ALA2056 HA ALA2056 10.786 -1.537 -2.316 230 1HB ALA2056 1HB ALA2056 12.080 -1.918 -4.328 231 2HB ALA2056 2HB ALA2056 10.651 -1.634 -5.318 232 3HB ALA2056 3HB ALA2056 10.719 -3.037 -4.258 233 H GLU2057 H GLU2057 9.012 0.714 -4.182 234 HA GLU2057 HA GLU2057 11.228 2.671 -4.185 235 1HB GLU2057 2HB GLU2057 8.571 2.779 -5.615 236 2HB GLU2057 1HB GLU2057 9.971 3.810 -5.893 237 1HG GLU2057 2HG GLU2057 11.213 2.016 -6.816 238 2HG GLU2057 1HG GLU2057 10.008 0.840 -6.319 239 H LEU2058 H LEU2058 8.039 1.959 -3.116 240 HA LEU2058 HA LEU2058 6.908 4.335 -2.403 241 1HB LEU2058 2HB LEU2058 5.785 2.209 -2.480 242 2HB LEU2058 1HB LEU2058 6.662 1.688 -1.052 243 HG LEU2058 HG LEU2058 5.628 3.941 -0.138 244 1HD1 LEU2058 1HD1 LEU2058 3.605 3.022 -2.129 245 2HD1 LEU2058 3HD1 LEU2058 3.312 4.151 -0.805 246 3HD1 LEU2058 2HD1 LEU2058 4.465 4.569 -2.072 247 1HD2 LEU2058 3HD2 LEU2058 4.346 1.226 -0.154 248 2HD2 LEU2058 2HD2 LEU2058 5.532 1.914 0.972 249 3HD2 LEU2058 1HD2 LEU2058 3.894 2.568 0.926 250 H GLU2059 H GLU2059 8.951 2.234 -0.367 251 HA GLU2059 HA GLU2059 8.392 3.437 2.092 252 1HB GLU2059 2HB GLU2059 11.029 2.206 1.319 253 2HB GLU2059 1HB GLU2059 10.337 2.400 2.926 254 1HG GLU2059 2HG GLU2059 9.178 0.670 0.778 255 2HG GLU2059 1HG GLU2059 10.268 0.124 2.050 256 H MET2060 H MET2060 11.021 4.016 -0.112 257 HA MET2060 HA MET2060 12.180 6.183 1.359 258 1HB MET2060 2HB MET2060 12.527 5.393 -1.543 259 2HB MET2060 1HB MET2060 13.494 6.609 -0.727 260 1HG MET2060 2HG MET2060 14.353 4.945 0.803 261 2HG MET2060 1HG MET2060 13.344 3.710 0.083 262 1HE MET2060 2HE MET2060 15.400 2.127 -0.246 263 2HE MET2060 1HE MET2060 16.902 2.609 -1.039 264 3HE MET2060 3HE MET2060 16.450 3.328 0.505 265 H TRP2061 H TRP2061 9.824 5.913 -1.136 266 HA TRP2061 HA TRP2061 9.607 8.591 -1.960 267 1HB TRP2061 2HB TRP2061 8.761 6.660 -3.231 268 2HB TRP2061 1HB TRP2061 7.606 6.325 -1.957 269 HD1 TRP2061 HD TRP2061 8.263 8.752 -4.846 270 HE1 TRP2061 1HE TRP2061 6.027 9.875 -5.465 271 HE3 TRP2061 3HE TRP2061 5.351 6.976 -1.040 272 HZ2 TRP2061 2HZ TRP2061 3.403 9.996 -4.490 273 HZ3 TRP2061 3HZ TRP2061 2.992 7.640 -0.964 274 HH2 TRP2061 HH TRP2061 2.043 9.122 -2.649 275 H LEU2062 H LEU2062 7.803 6.706 0.460 276 HA LEU2062 HA LEU2062 5.997 8.593 1.360 277 1HB LEU2062 2HB LEU2062 7.395 6.435 2.918 278 2HB LEU2062 1HB LEU2062 6.032 7.348 3.520 279 HG LEU2062 HG LEU2062 5.961 5.580 1.081 280 1HD1 LEU2062 1HD1 LEU2062 6.333 4.291 3.114 281 2HD1 LEU2062 3HD1 LEU2062 4.964 5.102 3.880 282 3HD1 LEU2062 2HD1 LEU2062 4.702 4.042 2.494 283 1HD2 LEU2062 1HD2 LEU2062 3.759 6.944 2.635 284 2HD2 LEU2062 3HD2 LEU2062 4.301 7.374 1.012 285 3HD2 LEU2062 2HD2 LEU2062 3.528 5.818 1.301 286 H GLN2063 H GLN2063 9.395 8.313 2.179 287 HA GLN2063 HA GLN2063 9.377 9.910 4.464 288 1HB GLN2063 2HB GLN2063 11.186 8.346 3.677 289 2HB GLN2063 1HB GLN2063 11.627 9.561 2.497 290 1HG GLN2063 2HG GLN2063 12.142 11.132 4.209 291 2HG GLN2063 1HG GLN2063 11.568 10.003 5.442 292 1HE2 GLN2063 1HE2 GLN2063 12.845 8.263 6.012 293 2HE2 GLN2063 2HE2 GLN2063 14.494 8.123 5.567 294 H GLY2064 H GLY2064 9.480 10.672 1.052 295 1HA GLY2064 1HA GLY2064 10.008 12.780 0.063 296 2HA GLY2064 2HA GLY2064 9.879 13.517 1.652 297 H HIS2065 H HIS2065 7.339 11.447 1.374 298 HA HIS2065 HA HIS2065 5.518 13.593 0.576 299 1HB HIS2065 2HB HIS2065 5.310 10.699 -0.350 300 2HB HIS2065 1HB HIS2065 4.080 11.925 -0.612 301 HD1 HIS2065 1HD HIS2065 7.567 10.994 -1.713 302 HD2 HIS2065 2HD HIS2065 4.467 13.532 -2.799 303 HE1 HIS2065 1HE HIS2065 8.206 11.948 -3.955 304 HA PRO2066 HA PRO2066 4.731 11.672 4.701 305 1HB PRO2066 2HB PRO2066 4.174 13.934 6.023 306 2HB PRO2066 1HB PRO2066 5.828 13.430 5.658 307 1HG PRO2066 2HG PRO2066 4.089 15.382 4.191 308 2HG PRO2066 1HG PRO2066 5.780 15.568 4.699 309 1HD PRO2066 2HD PRO2066 5.119 14.889 2.191 310 2HD PRO2066 1HD PRO2066 6.569 14.250 2.981 311 H GLU2067 H GLU2067 2.617 13.491 2.651 312 HA GLU2067 HA GLU2067 0.438 13.155 4.548 313 1HB GLU2067 2HB GLU2067 0.438 14.551 1.881 314 2HB GLU2067 1HB GLU2067 -0.942 14.442 2.959 315 1HG GLU2067 2HG GLU2067 1.673 15.784 3.520 316 2HG GLU2067 1HG GLU2067 0.112 16.576 3.266 317 H PHE2068 H PHE2068 1.798 11.189 2.496 318 HA PHE2068 HA PHE2068 -0.722 10.060 1.570 319 1HB PHE2068 2HB PHE2068 2.117 9.581 0.694 320 2HB PHE2068 1HB PHE2068 0.797 8.523 0.214 321 HD1 PHE2068 1HD PHE2068 -0.698 9.136 -1.498 322 HD2 PHE2068 2HD PHE2068 2.093 11.977 -0.012 323 HE1 PHE2068 1HE PHE2068 -1.238 10.638 -3.372 324 HE2 PHE2068 2HE PHE2068 1.561 13.484 -1.886 325 HZ PHE2068 HZ PHE2068 -0.107 12.814 -3.567 326 H ALA2069 H ALA2069 -1.574 8.429 2.494 327 HA ALA2069 HA ALA2069 0.051 6.764 4.280 328 1HB ALA2069 3HB ALA2069 -2.823 7.639 4.652 329 2HB ALA2069 2HB ALA2069 -1.946 6.531 5.709 330 3HB ALA2069 1HB ALA2069 -1.443 8.218 5.579 331 H VAL2070 H VAL2070 -0.846 4.596 4.505 332 HA VAL2070 HA VAL2070 -1.411 3.467 1.975 333 HB VAL2070 HB VAL2070 -0.074 2.282 3.658 334 1HG1 VAL2070 1HG1 VAL2070 -1.212 2.964 5.675 335 2HG1 VAL2070 3HG1 VAL2070 -2.620 1.996 5.230 336 3HG1 VAL2070 2HG1 VAL2070 -1.080 1.209 5.599 337 1HG2 VAL2070 2HG2 VAL2070 -2.588 0.778 2.921 338 2HG2 VAL2070 1HG2 VAL2070 -1.135 0.931 1.932 339 3HG2 VAL2070 3HG2 VAL2070 -1.076 0.039 3.454 340 H ASP2071 H ASP2071 -3.211 2.645 1.106 341 HA ASP2071 HA ASP2071 -5.736 3.642 1.795 342 1HB ASP2071 2HB ASP2071 -5.272 3.079 -0.505 343 2HB ASP2071 1HB ASP2071 -4.861 1.437 -0.058 344 HA PRO2072 HA PRO2072 -6.988 0.818 4.990 345 1HB PRO2072 2HB PRO2072 -9.661 1.331 4.967 346 2HB PRO2072 1HB PRO2072 -8.465 2.428 5.667 347 1HG PRO2072 2HG PRO2072 -9.770 2.526 2.973 348 2HG PRO2072 1HG PRO2072 -9.485 3.845 4.123 349 1HD PRO2072 2HD PRO2072 -7.896 3.451 1.991 350 2HD PRO2072 1HD PRO2072 -7.258 4.045 3.537 351 H ARG2073 H ARG2073 -8.291 0.596 1.745 352 HA ARG2073 HA ARG2073 -9.806 -1.804 2.238 353 1HB ARG2073 2HB ARG2073 -10.334 -0.167 0.402 354 2HB ARG2073 1HB ARG2073 -8.842 -0.642 -0.387 355 1HG ARG2073 2HG ARG2073 -9.755 -2.982 -0.463 356 2HG ARG2073 1HG ARG2073 -11.296 -2.310 0.073 357 1HD ARG2073 2HD ARG2073 -9.788 -1.674 -2.454 358 2HD ARG2073 1HD ARG2073 -11.348 -2.474 -2.311 359 HE ARG2073 HE ARG2073 -10.942 0.308 -1.470 360 1HH1 ARG2073 1HH1 ARG2073 -12.771 -2.070 -3.358 361 2HH1 ARG2073 2HH1 ARG2073 -13.886 -0.932 -3.958 362 1HH2 ARG2073 1HH2 ARG2073 -12.445 1.848 -2.309 363 2HH2 ARG2073 2HH2 ARG2073 -13.697 1.357 -3.354 364 H PHE2074 H PHE2074 -6.696 -0.894 0.923 365 HA PHE2074 HA PHE2074 -5.786 -3.500 0.345 366 1HB PHE2074 2HB PHE2074 -4.615 -1.479 -0.443 367 2HB PHE2074 1HB PHE2074 -4.096 -1.130 1.205 368 HD1 PHE2074 1HD PHE2074 -3.832 -3.571 -1.559 369 HD2 PHE2074 2HD PHE2074 -2.172 -2.190 2.110 370 HE1 PHE2074 1HE PHE2074 -1.873 -5.016 -1.905 371 HE2 PHE2074 2HE PHE2074 -0.211 -3.639 1.763 372 HZ PHE2074 HZ PHE2074 -0.065 -5.047 -0.243 373 H LEU2075 H LEU2075 -5.793 -1.641 3.279 374 HA LEU2075 HA LEU2075 -4.327 -3.466 4.858 375 1HB LEU2075 2HB LEU2075 -6.466 -1.501 5.673 376 2HB LEU2075 1HB LEU2075 -5.447 -2.365 6.802 377 HG LEU2075 HG LEU2075 -4.516 -0.339 4.772 378 1HD1 LEU2075 2HD1 LEU2075 -5.723 0.649 6.645 379 2HD1 LEU2075 1HD1 LEU2075 -4.686 -0.219 7.770 380 3HD1 LEU2075 3HD1 LEU2075 -4.001 1.024 6.726 381 1HD2 LEU2075 1HD2 LEU2075 -2.973 -1.890 6.855 382 2HD2 LEU2075 3HD2 LEU2075 -2.811 -2.047 5.104 383 3HD2 LEU2075 2HD2 LEU2075 -2.338 -0.552 5.901 384 H ALA2076 H ALA2076 -7.703 -3.320 3.949 385 HA ALA2076 HA ALA2076 -8.605 -5.422 5.606 386 1HB ALA2076 2HB ALA2076 -10.540 -5.513 4.103 387 2HB ALA2076 3HB ALA2076 -9.681 -4.515 2.931 388 3HB ALA2076 1HB ALA2076 -10.136 -3.840 4.496 389 H TYR2077 H TYR2077 -7.276 -5.291 2.353 390 HA TYR2077 HA TYR2077 -7.514 -8.031 1.805 391 1HB TYR2077 2HB TYR2077 -5.686 -5.953 0.624 392 2HB TYR2077 1HB TYR2077 -5.635 -7.632 0.107 393 HD1 TYR2077 1HD TYR2077 -6.829 -4.583 -0.867 394 HD2 TYR2077 2HD TYR2077 -8.232 -8.550 -0.227 395 HE1 TYR2077 1HE TYR2077 -8.674 -4.179 -2.425 396 HE2 TYR2077 2HE TYR2077 -10.077 -8.153 -1.784 397 HH TYR2077 HH TYR2077 -10.169 -5.375 -3.806 398 H MET2078 H MET2078 -5.065 -6.254 3.491 399 HA MET2078 HA MET2078 -3.161 -8.315 3.731 400 1HB MET2078 2HB MET2078 -2.713 -5.956 4.375 401 2HB MET2078 1HB MET2078 -3.815 -6.132 5.728 402 1HG MET2078 2HG MET2078 -1.502 -6.295 6.460 403 2HG MET2078 1HG MET2078 -2.356 -7.818 6.720 404 1HE MET2078 3HE MET2078 0.261 -5.889 4.511 405 2HE MET2078 2HE MET2078 0.693 -7.102 3.310 406 3HE MET2078 1HE MET2078 -0.919 -6.385 3.302 407 H GLU2079 H GLU2079 -5.984 -7.471 5.694 408 HA GLU2079 HA GLU2079 -5.687 -9.540 7.615 409 1HB GLU2079 2HB GLU2079 -8.172 -8.109 6.697 410 2HB GLU2079 1HB GLU2079 -8.035 -9.105 8.136 411 1HG GLU2079 2HG GLU2079 -6.329 -7.524 8.985 412 2HG GLU2079 1HG GLU2079 -6.687 -6.488 7.596 413 H ASP2080 H ASP2080 -7.366 -9.226 4.603 414 HA ASP2080 HA ASP2080 -8.761 -11.628 4.509 415 1HB ASP2080 2HB ASP2080 -9.155 -9.863 2.892 416 2HB ASP2080 1HB ASP2080 -7.514 -10.024 2.276 417 H ARG2081 H ARG2081 -5.406 -10.921 3.734 418 HA ARG2081 HA ARG2081 -4.807 -13.506 2.658 419 1HB ARG2081 2HB ARG2081 -3.445 -11.467 2.154 420 2HB ARG2081 1HB ARG2081 -2.883 -11.485 3.822 421 1HG ARG2081 2HG ARG2081 -2.082 -13.864 3.351 422 2HG ARG2081 1HG ARG2081 -2.323 -13.483 1.655 423 1HD ARG2081 2HD ARG2081 -0.543 -11.986 3.565 424 2HD ARG2081 1HD ARG2081 -0.012 -13.156 2.365 425 HE ARG2081 HE ARG2081 -1.365 -11.274 0.947 426 1HH1 ARG2081 1HH1 ARG2081 1.366 -11.271 3.199 427 2HH1 ARG2081 2HH1 ARG2081 2.208 -9.999 2.448 428 1HH2 ARG2081 1HH2 ARG2081 -0.175 -9.464 -0.144 429 2HH2 ARG2081 2HH2 ARG2081 1.318 -8.987 0.538 430 H ARG2082 H ARG2082 -4.778 -12.064 5.809 431 HA ARG2082 HA ARG2082 -3.015 -13.621 7.252 432 1HB ARG2082 2HB ARG2082 -4.028 -11.585 8.128 433 2HB ARG2082 1HB ARG2082 -5.603 -12.349 8.159 434 1HG ARG2082 2HG ARG2082 -4.903 -13.810 9.954 435 2HG ARG2082 1HG ARG2082 -3.254 -13.185 9.855 436 1HD ARG2082 2HD ARG2082 -4.492 -12.155 11.711 437 2HD ARG2082 1HD ARG2082 -4.038 -10.962 10.501 438 HE ARG2082 HE ARG2082 -6.714 -12.146 10.442 439 1HH1 ARG2082 1HH1 ARG2082 -4.720 -9.259 10.965 440 2HH1 ARG2082 2HH1 ARG2082 -6.021 -8.173 10.987 441 1HH2 ARG2082 1HH2 ARG2082 -8.515 -10.644 10.398 442 2HH2 ARG2082 2HH2 ARG2082 -8.242 -8.968 10.569 443 H LYS2083 H LYS2083 -6.225 -14.455 6.228 444 HA LYS2083 HA LYS2083 -5.793 -17.146 7.321 445 1HB LYS2083 2HB LYS2083 -7.596 -16.076 8.609 446 2HB LYS2083 1HB LYS2083 -8.412 -15.650 7.111 447 1HG LYS2083 2HG LYS2083 -8.697 -18.063 6.615 448 2HG LYS2083 1HG LYS2083 -7.979 -18.437 8.177 449 1HD LYS2083 2HD LYS2083 -10.405 -18.552 8.325 450 2HD LYS2083 1HD LYS2083 -9.806 -17.204 9.288 451 1HE LYS2083 2HE LYS2083 -11.820 -16.592 8.022 452 2HE LYS2083 1HE LYS2083 -10.440 -15.633 7.518 453 1HZ LYS2083 3HZ LYS2083 -10.218 -17.118 5.570 454 2HZ LYS2083 2HZ LYS2083 -11.606 -17.967 6.017 455 3HZ LYS2083 1HZ LYS2083 -11.688 -16.358 5.615 456 H GLN2084 H GLN2084 -5.410 -18.424 5.606 457 HA GLN2084 HA GLN2084 -6.553 -17.861 3.009 458 1HB GLN2084 2HB GLN2084 -4.372 -19.057 3.190 459 2HB GLN2084 1HB GLN2084 -5.192 -20.367 4.034 460 1HG GLN2084 2HG GLN2084 -6.646 -20.607 1.977 461 2HG GLN2084 1HG GLN2084 -5.506 -19.540 1.169 462 1HE2 GLN2084 1HE2 GLN2084 -4.969 -21.180 -0.270 463 2HE2 GLN2084 2HE2 GLN2084 -3.980 -22.512 0.205 464 H LYS2085 H LYS2085 -6.789 -20.474 5.365 465 HA LYS2085 HA LYS2085 -9.677 -20.543 5.105 466 1HB LYS2085 2HB LYS2085 -7.959 -23.033 4.741 467 2HB LYS2085 1HB LYS2085 -9.696 -23.049 4.970 468 1HG LYS2085 2HG LYS2085 -9.951 -21.797 2.852 469 2HG LYS2085 1HG LYS2085 -8.206 -21.871 2.629 470 1HD LYS2085 2HD LYS2085 -9.259 -23.591 1.303 471 2HD LYS2085 1HD LYS2085 -8.365 -24.347 2.619 472 1HE LYS2085 2HE LYS2085 -10.581 -25.376 2.247 473 2HE LYS2085 1HE LYS2085 -10.425 -24.698 3.864 474 1HZ LYS2085 3HZ LYS2085 -11.778 -23.312 1.595 475 2HZ LYS2085 2HZ LYS2085 -12.571 -24.199 2.800 476 3HZ LYS2085 1HZ LYS2085 -11.730 -22.821 3.199 No H/Q in entry = 476 Start of MODEL 6 1 H LEU2028 H LEU2028 4.868 -11.681 3.041 2 HA LEU2028 HA LEU2028 4.281 -8.840 3.535 3 1HB LEU2028 2HB LEU2028 6.220 -10.011 1.530 4 2HB LEU2028 1HB LEU2028 5.749 -8.332 1.564 5 HG LEU2028 HG LEU2028 6.757 -8.254 3.913 6 1HD1 LEU2028 2HD1 LEU2028 6.877 -10.646 4.328 7 2HD1 LEU2028 1HD1 LEU2028 8.022 -10.826 3.003 8 3HD1 LEU2028 3HD1 LEU2028 8.470 -9.889 4.424 9 1HD2 LEU2028 1HD2 LEU2028 8.544 -8.767 1.544 10 2HD2 LEU2028 3HD2 LEU2028 7.814 -7.226 1.987 11 3HD2 LEU2028 2HD2 LEU2028 9.024 -7.964 3.035 12 H ASP2029 H ASP2029 3.663 -11.589 1.576 13 HA ASP2029 HA ASP2029 2.258 -12.134 -0.061 14 1HB ASP2029 2HB ASP2029 0.436 -10.967 1.149 15 2HB ASP2029 1HB ASP2029 0.904 -9.452 0.376 16 H VAL2030 H VAL2030 2.952 -8.752 -0.416 17 HA VAL2030 HA VAL2030 2.985 -8.727 -3.237 18 HB VAL2030 HB VAL2030 3.937 -6.528 -3.084 19 1HG1 VAL2030 2HG1 VAL2030 1.573 -6.719 -2.607 20 2HG1 VAL2030 1HG1 VAL2030 1.917 -6.979 -0.897 21 3HG1 VAL2030 3HG1 VAL2030 2.285 -5.424 -1.643 22 1HG2 VAL2030 1HG2 VAL2030 4.453 -7.127 -0.163 23 2HG2 VAL2030 3HG2 VAL2030 5.652 -6.830 -1.432 24 3HG2 VAL2030 2HG2 VAL2030 4.581 -5.531 -0.908 25 H ASP2031 H ASP2031 4.909 -8.159 -4.536 26 HA ASP2031 HA ASP2031 7.203 -9.804 -3.674 27 1HB ASP2031 2HB ASP2031 6.215 -9.227 -6.485 28 2HB ASP2031 1HB ASP2031 7.641 -10.176 -6.085 29 H LEU2032 H LEU2032 6.677 -7.047 -3.152 30 HA LEU2032 HA LEU2032 7.783 -5.114 -2.841 31 1HB LEU2032 2HB LEU2032 10.082 -6.457 -4.238 32 2HB LEU2032 1HB LEU2032 10.182 -4.907 -3.427 33 HG LEU2032 HG LEU2032 9.557 -7.540 -2.094 34 1HD1 LEU2032 1HD1 LEU2032 11.845 -7.366 -2.884 35 2HD1 LEU2032 3HD1 LEU2032 12.029 -5.838 -2.015 36 3HD1 LEU2032 2HD1 LEU2032 11.748 -7.338 -1.122 37 1HD2 LEU2032 2HD2 LEU2032 10.001 -4.790 -0.926 38 2HD2 LEU2032 1HD2 LEU2032 8.475 -5.673 -0.950 39 3HD2 LEU2032 3HD2 LEU2032 9.833 -6.278 0.002 40 H GLU2033 H GLU2033 7.857 -6.297 -6.081 41 HA GLU2033 HA GLU2033 8.177 -3.681 -7.242 42 1HB GLU2033 2HB GLU2033 7.587 -4.843 -9.395 43 2HB GLU2033 1HB GLU2033 8.955 -5.533 -8.551 44 1HG GLU2033 2HG GLU2033 7.702 -7.357 -9.401 45 2HG GLU2033 1HG GLU2033 7.397 -7.311 -7.678 46 H THR2034 H THR2034 5.729 -5.350 -5.838 47 HA THR2034 HA THR2034 3.446 -4.665 -7.231 48 HB THR2034 HB THR2034 3.537 -5.037 -4.294 49 HG1 THR2034 1HG THR2034 4.304 -6.853 -6.364 50 1HG2 THR2034 2HG2 THR2034 1.375 -4.905 -5.484 51 2HG2 THR2034 1HG2 THR2034 1.875 -6.238 -6.530 52 3HG2 THR2034 3HG2 THR2034 1.629 -6.515 -4.807 53 H ARG2035 H ARG2035 2.832 -2.703 -7.537 54 HA ARG2035 HA ARG2035 3.344 -0.437 -6.029 55 1HB ARG2035 2HB ARG2035 1.469 0.639 -7.320 56 2HB ARG2035 1HB ARG2035 2.766 -0.039 -8.286 57 1HG ARG2035 2HG ARG2035 0.042 -1.267 -7.817 58 2HG ARG2035 1HG ARG2035 0.523 -0.299 -9.207 59 1HD ARG2035 2HD ARG2035 1.512 -3.027 -8.409 60 2HD ARG2035 1HD ARG2035 0.595 -2.596 -9.847 61 HE ARG2035 HE ARG2035 2.803 -1.110 -10.161 62 1HH1 ARG2035 1HH1 ARG2035 2.476 -4.593 -9.417 63 2HH1 ARG2035 2HH1 ARG2035 3.961 -5.000 -10.134 64 1HH2 ARG2035 1HH2 ARG2035 4.779 -1.712 -11.171 65 2HH2 ARG2035 2HH2 ARG2035 5.283 -3.324 -11.221 66 H ILE2036 H ILE2036 2.885 -0.252 -4.013 67 HA ILE2036 HA ILE2036 0.457 -1.161 -2.817 68 HB ILE2036 HB ILE2036 2.514 0.797 -1.753 69 1HG1 ILE2036 2HG1 ILE2036 3.579 -1.311 -2.301 70 2HG1 ILE2036 1HG1 ILE2036 3.492 -1.113 -0.555 71 1HG2 ILE2036 1HG2 ILE2036 0.420 0.925 -0.530 72 2HG2 ILE2036 3HG2 ILE2036 0.443 -0.821 -0.275 73 3HG2 ILE2036 2HG2 ILE2036 1.678 0.196 0.469 74 1HD1 ILE2036 2HD1 ILE2036 1.559 -2.641 -0.516 75 2HD1 ILE2036 1HD1 ILE2036 1.728 -2.869 -2.255 76 3HD1 ILE2036 3HD1 ILE2036 3.016 -3.397 -1.170 77 HA PRO2037 HA PRO2037 -1.795 2.535 -4.145 78 1HB PRO2037 2HB PRO2037 -4.102 1.944 -2.800 79 2HB PRO2037 1HB PRO2037 -3.689 1.230 -4.361 80 1HG PRO2037 2HG PRO2037 -3.374 0.096 -1.621 81 2HG PRO2037 1HG PRO2037 -3.936 -0.709 -3.097 82 1HD PRO2037 2HD PRO2037 -1.452 -1.017 -2.136 83 2HD PRO2037 1HD PRO2037 -1.786 -1.024 -3.878 84 H VAL2038 H VAL2038 -1.845 4.441 -3.253 85 HA VAL2038 HA VAL2038 -1.747 4.656 -0.333 86 HB VAL2038 HB VAL2038 -0.211 6.612 -0.580 87 1HG1 VAL2038 1HG1 VAL2038 0.860 4.019 -1.673 88 2HG1 VAL2038 3HG1 VAL2038 1.833 5.331 -1.009 89 3HG1 VAL2038 2HG1 VAL2038 0.714 4.455 0.031 90 1HG2 VAL2038 2HG2 VAL2038 -0.702 7.193 -2.894 91 2HG2 VAL2038 1HG2 VAL2038 1.027 6.908 -2.685 92 3HG2 VAL2038 3HG2 VAL2038 0.017 5.675 -3.441 93 H ILE2039 H ILE2039 -2.560 6.603 0.505 94 HA ILE2039 HA ILE2039 -4.158 8.152 -1.374 95 HB ILE2039 HB ILE2039 -5.719 6.609 -0.309 96 1HG1 ILE2039 2HG1 ILE2039 -6.027 9.403 0.829 97 2HG1 ILE2039 1HG1 ILE2039 -6.503 8.907 -0.784 98 1HG2 ILE2039 1HG2 ILE2039 -4.745 7.679 2.338 99 2HG2 ILE2039 3HG2 ILE2039 -6.127 6.605 2.120 100 3HG2 ILE2039 2HG2 ILE2039 -4.504 6.052 1.707 101 1HD1 ILE2039 1HD1 ILE2039 -7.690 7.904 1.796 102 2HD1 ILE2039 3HD1 ILE2039 -8.417 9.074 0.696 103 3HD1 ILE2039 2HD1 ILE2039 -8.179 7.408 0.175 104 H ASN2040 H ASN2040 -3.986 10.216 -1.164 105 HA ASN2040 HA ASN2040 -2.273 11.389 0.848 106 1HB ASN2040 2HB ASN2040 -2.359 12.216 -1.518 107 2HB ASN2040 1HB ASN2040 -4.024 12.710 -1.254 108 1HD2 ASN2040 1HD2 ASN2040 -1.739 14.298 -2.047 109 2HD2 ASN2040 2HD2 ASN2040 -1.608 15.551 -0.884 110 H LYS2041 H LYS2041 -2.999 11.865 2.782 111 HA LYS2041 HA LYS2041 -5.724 11.584 3.501 112 1HB LYS2041 2HB LYS2041 -3.381 12.668 5.038 113 2HB LYS2041 1HB LYS2041 -4.979 12.441 5.732 114 1HG LYS2041 2HG LYS2041 -4.830 10.037 5.239 115 2HG LYS2041 1HG LYS2041 -3.205 10.289 4.591 116 1HD LYS2041 2HD LYS2041 -2.420 11.060 6.743 117 2HD LYS2041 1HD LYS2041 -4.061 10.983 7.386 118 1HE LYS2041 2HE LYS2041 -4.075 8.557 7.065 119 2HE LYS2041 1HE LYS2041 -2.444 8.639 6.406 120 1HZ LYS2041 1HZ LYS2041 -3.209 9.394 9.174 121 2HZ LYS2041 3HZ LYS2041 -2.466 7.953 8.714 122 3HZ LYS2041 2HZ LYS2041 -1.636 9.399 8.548 123 H VAL2042 H VAL2042 -3.884 14.295 2.506 124 HA VAL2042 HA VAL2042 -5.701 16.243 3.648 125 HB VAL2042 HB VAL2042 -3.465 16.658 1.652 126 1HG1 VAL2042 3HG1 VAL2042 -4.906 18.603 3.441 127 2HG1 VAL2042 2HG1 VAL2042 -3.513 18.993 2.432 128 3HG1 VAL2042 1HG1 VAL2042 -5.036 18.502 1.687 129 1HG2 VAL2042 1HG2 VAL2042 -2.600 15.659 3.692 130 2HG2 VAL2042 3HG2 VAL2042 -2.098 17.345 3.560 131 3HG2 VAL2042 2HG2 VAL2042 -3.410 16.900 4.651 132 H ASP2043 H ASP2043 -4.624 15.382 0.414 133 HA ASP2043 HA ASP2043 -6.658 16.927 -0.858 134 1HB ASP2043 2HB ASP2043 -4.642 14.983 -1.925 135 2HB ASP2043 1HB ASP2043 -5.816 15.795 -2.950 136 H GLY2044 H GLY2044 -6.270 13.505 -0.121 137 1HA GLY2044 1HA GLY2044 -9.035 13.080 -0.945 138 2HA GLY2044 2HA GLY2044 -8.050 12.036 0.084 139 H THR2045 H THR2045 -6.129 13.032 -2.304 140 HA THR2045 HA THR2045 -6.889 11.625 -4.548 141 HB THR2045 HB THR2045 -4.091 12.403 -3.715 142 HG1 THR2045 1HG THR2045 -4.724 14.335 -4.998 143 1HG2 THR2045 2HG2 THR2045 -4.225 10.953 -5.722 144 2HG2 THR2045 1HG2 THR2045 -5.361 12.087 -6.451 145 3HG2 THR2045 3HG2 THR2045 -3.699 12.584 -6.135 146 H LEU2046 H LEU2046 -7.188 9.505 -4.532 147 HA LEU2046 HA LEU2046 -5.412 7.718 -3.084 148 1HB LEU2046 2HB LEU2046 -7.818 7.379 -2.849 149 2HB LEU2046 1HB LEU2046 -7.994 7.265 -4.585 150 HG LEU2046 HG LEU2046 -6.644 5.182 -4.539 151 1HD1 LEU2046 3HD1 LEU2046 -5.396 5.554 -2.491 152 2HD1 LEU2046 2HD1 LEU2046 -6.885 5.440 -1.554 153 3HD1 LEU2046 1HD1 LEU2046 -6.282 4.031 -2.423 154 1HD2 LEU2046 1HD2 LEU2046 -9.112 5.191 -2.818 155 2HD2 LEU2046 3HD2 LEU2046 -9.061 5.082 -4.580 156 3HD2 LEU2046 2HD2 LEU2046 -8.407 3.773 -3.593 157 H LEU2047 H LEU2047 -3.872 6.639 -4.119 158 HA LEU2047 HA LEU2047 -3.815 6.726 -7.060 159 1HB LEU2047 2HB LEU2047 -1.537 6.456 -5.100 160 2HB LEU2047 1HB LEU2047 -1.380 6.477 -6.845 161 HG LEU2047 HG LEU2047 -2.284 8.790 -5.126 162 1HD1 LEU2047 2HD1 LEU2047 0.086 8.307 -4.893 163 2HD1 LEU2047 1HD1 LEU2047 0.275 8.334 -6.647 164 3HD1 LEU2047 3HD1 LEU2047 -0.167 9.806 -5.781 165 1HD2 LEU2047 2HD2 LEU2047 -1.806 8.634 -8.109 166 2HD2 LEU2047 1HD2 LEU2047 -3.367 8.841 -7.310 167 3HD2 LEU2047 3HD2 LEU2047 -2.147 10.105 -7.198 168 H VAL2048 H VAL2048 -4.315 4.872 -7.924 169 HA VAL2048 HA VAL2048 -3.497 2.416 -6.569 170 HB VAL2048 HB VAL2048 -5.495 1.282 -7.476 171 1HG1 VAL2048 1HG1 VAL2048 -5.598 2.126 -5.208 172 2HG1 VAL2048 3HG1 VAL2048 -6.177 3.680 -5.802 173 3HG1 VAL2048 2HG1 VAL2048 -7.182 2.241 -5.978 174 1HG2 VAL2048 2HG2 VAL2048 -5.917 2.705 -9.402 175 2HG2 VAL2048 1HG2 VAL2048 -7.370 2.578 -8.407 176 3HG2 VAL2048 3HG2 VAL2048 -6.377 4.038 -8.346 177 H GLY2049 H GLY2049 -3.254 0.611 -8.105 178 1HA GLY2049 1HA GLY2049 -3.123 1.174 -10.893 179 2HA GLY2049 2HA GLY2049 -2.556 -0.285 -10.078 180 H GLU2050 H GLU2050 -1.257 1.354 -12.133 181 HA GLU2050 HA GLU2050 1.215 1.424 -10.666 182 1HB GLU2050 2HB GLU2050 0.748 1.540 -13.634 183 2HB GLU2050 1HB GLU2050 2.341 1.543 -12.881 184 1HG GLU2050 2HG GLU2050 1.537 -0.612 -11.706 185 2HG GLU2050 1HG GLU2050 0.300 -0.641 -12.957 186 H ASP2051 H ASP2051 -0.892 3.564 -10.653 187 HA ASP2051 HA ASP2051 0.719 5.915 -11.212 188 1HB ASP2051 2HB ASP2051 -2.011 5.542 -9.953 189 2HB ASP2051 1HB ASP2051 -1.255 7.107 -10.222 190 H ALA2052 H ALA2052 0.110 3.617 -8.849 191 HA ALA2052 HA ALA2052 0.922 5.243 -6.587 192 1HB ALA2052 1HB ALA2052 0.377 3.191 -5.299 193 2HB ALA2052 2HB ALA2052 -0.006 2.368 -6.814 194 3HB ALA2052 3HB ALA2052 -0.973 3.743 -6.288 195 HA PRO2053 HA PRO2053 5.111 3.839 -6.948 196 1HB PRO2053 2HB PRO2053 5.960 3.893 -4.402 197 2HB PRO2053 1HB PRO2053 5.562 5.376 -5.282 198 1HG PRO2053 2HG PRO2053 3.891 3.834 -3.328 199 2HG PRO2053 1HG PRO2053 4.178 5.582 -3.412 200 1HD PRO2053 2HD PRO2053 1.944 4.429 -4.399 201 2HD PRO2053 1HD PRO2053 2.671 5.869 -5.135 202 H ARG2054 H ARG2054 6.490 2.062 -6.659 203 HA ARG2054 HA ARG2054 5.288 -0.467 -6.080 204 1HB ARG2054 2HB ARG2054 8.194 0.274 -6.363 205 2HB ARG2054 1HB ARG2054 7.527 -1.346 -6.407 206 1HG ARG2054 2HG ARG2054 6.435 -0.931 -8.456 207 2HG ARG2054 1HG ARG2054 6.806 0.797 -8.358 208 1HD ARG2054 2HD ARG2054 9.204 0.247 -8.422 209 2HD ARG2054 1HD ARG2054 8.781 -1.456 -8.629 210 HE ARG2054 HE ARG2054 8.167 -1.061 -10.753 211 1HH1 ARG2054 1HH1 ARG2054 8.652 2.117 -9.153 212 2HH1 ARG2054 2HH1 ARG2054 8.877 2.954 -10.604 213 1HH2 ARG2054 1HH2 ARG2054 8.458 0.136 -12.730 214 2HH2 ARG2054 2HH2 ARG2054 8.727 1.808 -12.702 215 H ARG2055 H ARG2055 5.750 -1.783 -4.350 216 HA ARG2055 HA ARG2055 6.015 -0.675 -1.824 217 1HB ARG2055 2HB ARG2055 5.030 -2.846 -2.130 218 2HB ARG2055 1HB ARG2055 6.526 -3.480 -2.782 219 1HG ARG2055 2HG ARG2055 6.193 -4.267 -0.582 220 2HG ARG2055 1HG ARG2055 7.582 -3.161 -0.616 221 1HD ARG2055 2HD ARG2055 5.984 -1.381 0.225 222 2HD ARG2055 1HD ARG2055 4.812 -2.676 0.489 223 HE ARG2055 HE ARG2055 7.423 -2.432 1.804 224 1HH1 ARG2055 1HH1 ARG2055 4.110 -3.735 1.895 225 2HH1 ARG2055 2HH1 ARG2055 4.262 -4.315 3.476 226 1HH2 ARG2055 1HH2 ARG2055 7.582 -3.204 3.951 227 2HH2 ARG2055 2HH2 ARG2055 6.252 -3.966 4.692 228 H ALA2056 H ALA2056 8.484 -1.903 -3.974 229 HA ALA2056 HA ALA2056 10.646 -1.938 -2.193 230 1HB ALA2056 1HB ALA2056 12.073 -1.931 -4.153 231 2HB ALA2056 2HB ALA2056 10.726 -1.397 -5.156 232 3HB ALA2056 3HB ALA2056 10.689 -2.997 -4.410 233 H GLU2057 H GLU2057 9.195 0.728 -3.958 234 HA GLU2057 HA GLU2057 11.390 2.482 -3.106 235 1HB GLU2057 2HB GLU2057 10.597 4.050 -4.760 236 2HB GLU2057 1HB GLU2057 10.791 2.475 -5.524 237 1HG GLU2057 2HG GLU2057 8.346 2.122 -5.277 238 2HG GLU2057 1HG GLU2057 8.215 3.750 -4.634 239 H LEU2058 H LEU2058 8.496 1.433 -2.075 240 HA LEU2058 HA LEU2058 6.910 3.635 -1.564 241 1HB LEU2058 2HB LEU2058 6.174 1.311 -1.527 242 2HB LEU2058 1HB LEU2058 7.094 1.002 -0.083 243 HG LEU2058 HG LEU2058 4.629 1.117 0.230 244 1HD1 LEU2058 1HD1 LEU2058 6.052 1.499 2.140 245 2HD1 LEU2058 3HD1 LEU2058 6.137 3.217 1.736 246 3HD1 LEU2058 2HD1 LEU2058 4.598 2.499 2.211 247 1HD2 LEU2058 3HD2 LEU2058 4.971 4.030 -0.453 248 2HD2 LEU2058 2HD2 LEU2058 4.094 2.825 -1.390 249 3HD2 LEU2058 1HD2 LEU2058 3.507 3.296 0.205 250 H GLU2059 H GLU2059 9.181 2.094 0.717 251 HA GLU2059 HA GLU2059 8.851 3.907 2.806 252 1HB GLU2059 2HB GLU2059 11.135 3.181 3.542 253 2HB GLU2059 1HB GLU2059 9.998 1.875 3.245 254 1HG GLU2059 2HG GLU2059 11.051 1.494 1.059 255 2HG GLU2059 1HG GLU2059 12.196 2.789 1.400 256 H MET2060 H MET2060 10.886 4.149 0.010 257 HA MET2060 HA MET2060 12.350 6.466 0.848 258 1HB MET2060 2HB MET2060 13.235 4.890 -0.817 259 2HB MET2060 1HB MET2060 11.905 5.271 -1.896 260 1HG MET2060 2HG MET2060 12.730 7.584 -2.056 261 2HG MET2060 1HG MET2060 14.096 7.144 -1.031 262 1HE MET2060 1HE MET2060 15.816 8.000 -2.824 263 2HE MET2060 3HE MET2060 15.800 7.512 -4.519 264 3HE MET2060 2HE MET2060 14.484 8.493 -3.866 265 H TRP2061 H TRP2061 9.565 5.812 -1.135 266 HA TRP2061 HA TRP2061 9.158 8.419 -2.114 267 1HB TRP2061 2HB TRP2061 8.332 6.277 -3.129 268 2HB TRP2061 1HB TRP2061 7.147 6.183 -1.837 269 HD1 TRP2061 HD TRP2061 8.042 8.284 -4.920 270 HE1 TRP2061 1HE TRP2061 5.914 9.487 -5.725 271 HE3 TRP2061 3HE TRP2061 4.897 6.997 -1.108 272 HZ2 TRP2061 2HZ TRP2061 3.269 9.841 -4.868 273 HZ3 TRP2061 3HZ TRP2061 2.582 7.812 -1.180 274 HH2 TRP2061 HH TRP2061 1.787 9.205 -3.018 275 H LEU2062 H LEU2062 7.563 6.582 0.516 276 HA LEU2062 HA LEU2062 5.832 8.645 1.301 277 1HB LEU2062 2HB LEU2062 6.809 6.255 2.823 278 2HB LEU2062 1HB LEU2062 5.713 7.419 3.525 279 HG LEU2062 HG LEU2062 5.177 5.618 1.170 280 1HD1 LEU2062 3HD1 LEU2062 5.077 4.554 3.357 281 2HD1 LEU2062 2HD1 LEU2062 3.967 5.803 3.919 282 3HD1 LEU2062 1HD1 LEU2062 3.472 4.691 2.641 283 1HD2 LEU2062 2HD2 LEU2062 3.424 7.744 2.399 284 2HD2 LEU2062 1HD2 LEU2062 4.105 7.787 0.777 285 3HD2 LEU2062 3HD2 LEU2062 2.908 6.565 1.197 286 H GLN2063 H GLN2063 9.149 8.061 2.213 287 HA GLN2063 HA GLN2063 9.321 9.691 4.432 288 1HB GLN2063 2HB GLN2063 11.101 8.198 3.574 289 2HB GLN2063 1HB GLN2063 11.350 9.300 2.232 290 1HG GLN2063 2HG GLN2063 11.978 11.048 3.760 291 2HG GLN2063 1HG GLN2063 11.703 9.952 5.121 292 1HE2 GLN2063 1HE2 GLN2063 13.807 10.756 2.469 293 2HE2 GLN2063 2HE2 GLN2063 15.117 9.760 2.966 294 H GLY2064 H GLY2064 9.291 10.470 1.000 295 1HA GLY2064 1HA GLY2064 9.746 12.594 0.023 296 2HA GLY2064 2HA GLY2064 9.565 13.328 1.613 297 H HIS2065 H HIS2065 7.131 11.311 1.665 298 HA HIS2065 HA HIS2065 5.200 13.258 0.699 299 1HB HIS2065 2HB HIS2065 5.254 10.365 -0.206 300 2HB HIS2065 1HB HIS2065 3.818 11.367 -0.324 301 HD1 HIS2065 1HD HIS2065 7.163 10.796 -1.888 302 HD2 HIS2065 2HD HIS2065 3.841 13.226 -2.370 303 HE1 HIS2065 1HE HIS2065 7.410 11.885 -4.177 304 HA PRO2066 HA PRO2066 4.314 10.996 4.706 305 1HB PRO2066 2HB PRO2066 4.306 13.047 6.440 306 2HB PRO2066 1HB PRO2066 5.804 12.257 5.923 307 1HG PRO2066 2HG PRO2066 4.598 14.824 4.993 308 2HG PRO2066 1HG PRO2066 6.296 14.435 5.331 309 1HD PRO2066 2HD PRO2066 5.214 14.496 2.810 310 2HD PRO2066 1HD PRO2066 6.626 13.524 3.260 311 H GLU2067 H GLU2067 2.743 13.355 2.904 312 HA GLU2067 HA GLU2067 0.404 13.458 4.617 313 1HB GLU2067 2HB GLU2067 0.690 14.476 1.783 314 2HB GLU2067 1HB GLU2067 -0.569 14.899 2.933 315 1HG GLU2067 2HG GLU2067 2.351 15.618 3.130 316 2HG GLU2067 1HG GLU2067 1.027 16.703 2.725 317 H PHE2068 H PHE2068 1.730 11.445 2.295 318 HA PHE2068 HA PHE2068 -0.815 10.224 1.550 319 1HB PHE2068 2HB PHE2068 2.019 9.809 0.581 320 2HB PHE2068 1HB PHE2068 0.672 8.792 0.100 321 HD1 PHE2068 1HD PHE2068 -0.667 9.384 -1.704 322 HD2 PHE2068 2HD PHE2068 1.950 12.279 -0.010 323 HE1 PHE2068 1HE PHE2068 -1.109 10.885 -3.601 324 HE2 PHE2068 2HE PHE2068 1.516 13.786 -1.902 325 HZ PHE2068 HZ PHE2068 -0.018 13.084 -3.705 326 H ALA2069 H ALA2069 -1.327 8.229 2.255 327 HA ALA2069 HA ALA2069 0.652 6.769 3.830 328 1HB ALA2069 3HB ALA2069 -0.724 7.987 5.427 329 2HB ALA2069 1HB ALA2069 -1.038 6.256 5.522 330 3HB ALA2069 2HB ALA2069 -2.185 7.318 4.697 331 H VAL2070 H VAL2070 -0.371 4.531 4.327 332 HA VAL2070 HA VAL2070 -0.886 3.384 1.795 333 HB VAL2070 HB VAL2070 0.482 2.210 3.428 334 1HG1 VAL2070 2HG1 VAL2070 -0.542 2.968 5.474 335 2HG1 VAL2070 1HG1 VAL2070 -1.978 2.006 5.142 336 3HG1 VAL2070 3HG1 VAL2070 -0.436 1.209 5.456 337 1HG2 VAL2070 3HG2 VAL2070 -2.082 0.705 2.873 338 2HG2 VAL2070 2HG2 VAL2070 -0.685 0.816 1.801 339 3HG2 VAL2070 1HG2 VAL2070 -0.550 -0.032 3.341 340 H ASP2071 H ASP2071 -2.679 2.611 0.926 341 HA ASP2071 HA ASP2071 -5.173 3.645 1.505 342 1HB ASP2071 2HB ASP2071 -4.719 2.922 -0.699 343 2HB ASP2071 1HB ASP2071 -4.272 1.314 -0.150 344 HA PRO2072 HA PRO2072 -6.478 1.141 5.003 345 1HB PRO2072 2HB PRO2072 -9.147 2.164 4.211 346 2HB PRO2072 1HB PRO2072 -8.316 2.252 5.774 347 1HG PRO2072 2HG PRO2072 -8.557 4.411 4.221 348 2HG PRO2072 1HG PRO2072 -7.083 4.110 5.158 349 1HD PRO2072 2HD PRO2072 -7.587 3.709 2.240 350 2HD PRO2072 1HD PRO2072 -6.142 4.322 3.079 351 H ARG2073 H ARG2073 -7.997 1.108 1.845 352 HA ARG2073 HA ARG2073 -9.527 -1.250 2.242 353 1HB ARG2073 2HB ARG2073 -10.081 0.306 0.482 354 2HB ARG2073 1HB ARG2073 -8.499 0.111 -0.244 355 1HG ARG2073 2HG ARG2073 -9.070 -2.248 -0.740 356 2HG ARG2073 1HG ARG2073 -10.693 -1.944 -0.113 357 1HD ARG2073 2HD ARG2073 -11.080 -0.263 -1.767 358 2HD ARG2073 1HD ARG2073 -9.411 -0.359 -2.311 359 HE ARG2073 HE ARG2073 -11.096 -2.721 -2.507 360 1HH1 ARG2073 1HH1 ARG2073 -9.331 -0.093 -4.093 361 2HH1 ARG2073 2HH1 ARG2073 -9.473 -0.742 -5.660 362 1HH2 ARG2073 1HH2 ARG2073 -11.217 -3.664 -4.677 363 2HH2 ARG2073 2HH2 ARG2073 -10.546 -2.832 -5.990 364 H PHE2074 H PHE2074 -6.331 -0.587 0.912 365 HA PHE2074 HA PHE2074 -5.642 -3.253 0.317 366 1HB PHE2074 2HB PHE2074 -4.417 -1.280 -0.544 367 2HB PHE2074 1HB PHE2074 -3.806 -0.963 1.075 368 HD1 PHE2074 1HD PHE2074 -3.853 -3.520 -1.602 369 HD2 PHE2074 2HD PHE2074 -1.804 -1.937 1.773 370 HE1 PHE2074 1HE PHE2074 -1.940 -4.987 -2.083 371 HE2 PHE2074 2HE PHE2074 0.106 -3.407 1.305 372 HZ PHE2074 HZ PHE2074 0.041 -4.931 -0.630 373 H LEU2075 H LEU2075 -5.345 -1.279 3.196 374 HA LEU2075 HA LEU2075 -4.001 -3.143 4.798 375 1HB LEU2075 2HB LEU2075 -6.041 -1.072 5.625 376 2HB LEU2075 1HB LEU2075 -5.059 -1.987 6.747 377 HG LEU2075 HG LEU2075 -4.056 0.019 4.731 378 1HD1 LEU2075 3HD1 LEU2075 -5.184 1.042 6.632 379 2HD1 LEU2075 2HD1 LEU2075 -4.176 0.115 7.739 380 3HD1 LEU2075 1HD1 LEU2075 -3.447 1.329 6.695 381 1HD2 LEU2075 1HD2 LEU2075 -2.559 -1.643 6.763 382 2HD2 LEU2075 3HD2 LEU2075 -2.424 -1.772 5.007 383 3HD2 LEU2075 2HD2 LEU2075 -1.869 -0.320 5.831 384 H ALA2076 H ALA2076 -7.423 -2.749 4.082 385 HA ALA2076 HA ALA2076 -8.414 -4.697 5.826 386 1HB ALA2076 1HB ALA2076 -10.407 -4.721 4.416 387 2HB ALA2076 2HB ALA2076 -9.524 -3.871 3.147 388 3HB ALA2076 3HB ALA2076 -9.847 -3.070 4.684 389 H TYR2077 H TYR2077 -6.939 -4.995 2.661 390 HA TYR2077 HA TYR2077 -7.516 -7.772 2.257 391 1HB TYR2077 2HB TYR2077 -6.879 -6.427 0.355 392 2HB TYR2077 1HB TYR2077 -5.374 -5.946 1.136 393 HD1 TYR2077 1HD TYR2077 -3.464 -6.996 0.378 394 HD2 TYR2077 2HD TYR2077 -7.153 -9.089 0.219 395 HE1 TYR2077 1HE TYR2077 -2.313 -8.919 -0.652 396 HE2 TYR2077 2HE TYR2077 -6.047 -11.003 -0.801 397 HH TYR2077 HH TYR2077 -2.596 -11.316 -0.992 398 H MET2078 H MET2078 -4.783 -5.996 3.566 399 HA MET2078 HA MET2078 -3.219 -8.285 4.132 400 1HB MET2078 2HB MET2078 -3.093 -5.474 5.207 401 2HB MET2078 1HB MET2078 -1.972 -6.726 5.723 402 1HG MET2078 2HG MET2078 -2.367 -5.800 2.886 403 2HG MET2078 1HG MET2078 -1.049 -5.309 3.950 404 1HE MET2078 1HE MET2078 0.648 -6.056 2.051 405 2HE MET2078 3HE MET2078 0.744 -7.689 1.400 406 3HE MET2078 2HE MET2078 -0.638 -6.669 1.008 407 H GLU2079 H GLU2079 -5.504 -6.480 6.038 408 HA GLU2079 HA GLU2079 -5.139 -7.923 8.452 409 1HB GLU2079 2HB GLU2079 -7.439 -6.238 7.482 410 2HB GLU2079 1HB GLU2079 -7.277 -6.853 9.121 411 1HG GLU2079 2HG GLU2079 -5.274 -5.076 7.776 412 2HG GLU2079 1HG GLU2079 -6.564 -4.486 8.816 413 H ASP2080 H ASP2080 -7.105 -8.389 5.651 414 HA ASP2080 HA ASP2080 -8.861 -10.370 6.641 415 1HB ASP2080 2HB ASP2080 -9.054 -9.053 4.461 416 2HB ASP2080 1HB ASP2080 -7.829 -10.117 3.799 417 H ARG2081 H ARG2081 -5.584 -10.414 5.478 418 HA ARG2081 HA ARG2081 -3.818 -11.841 5.812 419 1HB ARG2081 2HB ARG2081 -5.744 -13.475 7.480 420 2HB ARG2081 1HB ARG2081 -4.010 -13.683 7.429 421 1HG ARG2081 2HG ARG2081 -5.468 -11.281 8.514 422 2HG ARG2081 1HG ARG2081 -4.771 -12.588 9.466 423 1HD ARG2081 2HD ARG2081 -2.546 -11.969 8.487 424 2HD ARG2081 1HD ARG2081 -3.328 -10.540 7.799 425 HE ARG2081 HE ARG2081 -3.165 -11.161 10.668 426 1HH1 ARG2081 1HH1 ARG2081 -3.174 -8.738 8.095 427 2HH1 ARG2081 2HH1 ARG2081 -3.202 -7.412 9.190 428 1HH2 ARG2081 1HH2 ARG2081 -3.105 -9.308 12.114 429 2HH2 ARG2081 2HH2 ARG2081 -3.101 -7.740 11.475 430 H ARG2082 H ARG2082 -3.623 -14.624 5.936 431 HA ARG2082 HA ARG2082 -4.455 -15.424 3.314 432 1HB ARG2082 2HB ARG2082 -3.288 -17.047 5.596 433 2HB ARG2082 1HB ARG2082 -3.552 -17.652 3.972 434 1HG ARG2082 2HG ARG2082 -1.664 -15.440 4.745 435 2HG ARG2082 1HG ARG2082 -1.230 -17.100 4.320 436 1HD ARG2082 2HD ARG2082 -2.219 -16.745 2.078 437 2HD ARG2082 1HD ARG2082 -2.568 -15.077 2.520 438 HE ARG2082 HE ARG2082 0.169 -16.000 2.698 439 1HH1 ARG2082 1HH1 ARG2082 -2.233 -14.147 0.865 440 2HH1 ARG2082 2HH1 ARG2082 -1.100 -13.194 0.029 441 1HH2 ARG2082 1HH2 ARG2082 1.744 -14.750 1.460 442 2HH2 ARG2082 2HH2 ARG2082 1.209 -13.612 0.314 443 H LYS2083 H LYS2083 -6.356 -16.128 2.844 444 HA LYS2083 HA LYS2083 -8.142 -16.780 5.064 445 1HB LYS2083 2HB LYS2083 -8.403 -14.625 3.858 446 2HB LYS2083 1HB LYS2083 -8.746 -15.543 2.404 447 1HG LYS2083 2HG LYS2083 -10.755 -16.414 3.381 448 2HG LYS2083 1HG LYS2083 -10.382 -15.639 4.928 449 1HD LYS2083 2HD LYS2083 -10.268 -13.464 3.660 450 2HD LYS2083 1HD LYS2083 -10.976 -14.327 2.301 451 1HE LYS2083 2HE LYS2083 -12.974 -14.726 3.500 452 2HE LYS2083 1HE LYS2083 -12.231 -14.209 5.018 453 1HZ LYS2083 1HZ LYS2083 -11.935 -12.036 4.086 454 2HZ LYS2083 3HZ LYS2083 -12.733 -12.477 2.670 455 3HZ LYS2083 2HZ LYS2083 -13.587 -12.439 4.136 456 H GLN2084 H GLN2084 -9.416 -18.571 4.828 457 HA GLN2084 HA GLN2084 -8.732 -20.345 2.661 458 1HB GLN2084 2HB GLN2084 -8.986 -21.212 4.985 459 2HB GLN2084 1HB GLN2084 -10.697 -20.822 4.920 460 1HG GLN2084 2HG GLN2084 -10.920 -22.357 2.987 461 2HG GLN2084 1HG GLN2084 -9.233 -22.809 3.196 462 1HE2 GLN2084 1HE2 GLN2084 -9.465 -22.714 6.149 463 2HE2 GLN2084 2HE2 GLN2084 -10.353 -24.121 6.575 464 H LYS2085 H LYS2085 -9.582 -18.578 1.350 465 HA LYS2085 HA LYS2085 -12.165 -19.329 0.277 466 1HB LYS2085 2HB LYS2085 -11.318 -16.479 0.914 467 2HB LYS2085 1HB LYS2085 -12.597 -16.864 -0.221 468 1HG LYS2085 2HG LYS2085 -12.619 -17.589 2.711 469 2HG LYS2085 1HG LYS2085 -13.410 -16.176 2.011 470 1HD LYS2085 2HD LYS2085 -14.816 -17.643 0.637 471 2HD LYS2085 1HD LYS2085 -14.015 -19.058 1.321 472 1HE LYS2085 2HE LYS2085 -14.826 -18.483 3.531 473 2HE LYS2085 1HE LYS2085 -15.569 -17.014 2.905 474 1HZ LYS2085 2HZ LYS2085 -17.027 -18.399 1.553 475 2HZ LYS2085 1HZ LYS2085 -16.322 -19.793 2.167 476 3HZ LYS2085 3HZ LYS2085 -17.183 -18.762 3.181 No H/Q in entry = 476 Start of MODEL 7 1 H LEU2028 H LEU2028 8.045 -9.913 2.560 2 HA LEU2028 HA LEU2028 8.031 -11.731 1.287 3 1HB LEU2028 2HB LEU2028 8.205 -13.158 3.928 4 2HB LEU2028 1HB LEU2028 8.396 -13.956 2.386 5 HG LEU2028 HG LEU2028 10.538 -13.659 3.173 6 1HD1 LEU2028 2HD1 LEU2028 10.403 -13.061 0.869 7 2HD1 LEU2028 1HD1 LEU2028 10.091 -11.375 1.288 8 3HD1 LEU2028 3HD1 LEU2028 11.648 -12.107 1.673 9 1HD2 LEU2028 1HD2 LEU2028 9.862 -10.820 3.889 10 2HD2 LEU2028 3HD2 LEU2028 10.143 -12.153 5.009 11 3HD2 LEU2028 2HD2 LEU2028 11.465 -11.539 4.011 12 H ASP2029 H ASP2029 6.224 -11.406 0.369 13 HA ASP2029 HA ASP2029 4.445 -13.320 -0.262 14 1HB ASP2029 2HB ASP2029 3.400 -13.131 2.044 15 2HB ASP2029 1HB ASP2029 3.130 -11.417 1.747 16 H VAL2030 H VAL2030 4.718 -10.060 0.725 17 HA VAL2030 HA VAL2030 3.946 -8.996 -1.845 18 HB VAL2030 HB VAL2030 5.030 -7.728 0.711 19 1HG1 VAL2030 1HG1 VAL2030 4.338 -6.361 -1.880 20 2HG1 VAL2030 3HG1 VAL2030 4.699 -5.543 -0.363 21 3HG1 VAL2030 2HG1 VAL2030 5.950 -6.489 -1.173 22 1HG2 VAL2030 1HG2 VAL2030 2.385 -7.456 -0.710 23 2HG2 VAL2030 3HG2 VAL2030 2.685 -8.342 0.791 24 3HG2 VAL2030 2HG2 VAL2030 2.865 -6.586 0.745 25 H ASP2031 H ASP2031 5.355 -9.182 -3.430 26 HA ASP2031 HA ASP2031 8.096 -9.958 -2.886 27 1HB ASP2031 2HB ASP2031 6.559 -9.787 -5.477 28 2HB ASP2031 1HB ASP2031 8.199 -10.402 -5.308 29 H LEU2032 H LEU2032 7.020 -7.163 -2.669 30 HA LEU2032 HA LEU2032 7.857 -5.054 -2.760 31 1HB LEU2032 2HB LEU2032 10.251 -6.298 -4.101 32 2HB LEU2032 1HB LEU2032 10.152 -4.644 -3.532 33 HG LEU2032 HG LEU2032 9.972 -7.076 -1.753 34 1HD1 LEU2032 1HD1 LEU2032 12.163 -6.869 -2.765 35 2HD1 LEU2032 3HD1 LEU2032 12.259 -5.184 -2.250 36 3HD1 LEU2032 2HD1 LEU2032 12.219 -6.477 -1.046 37 1HD2 LEU2032 1HD2 LEU2032 10.228 -4.134 -1.134 38 2HD2 LEU2032 3HD2 LEU2032 8.811 -5.146 -0.845 39 3HD2 LEU2032 2HD2 LEU2032 10.301 -5.443 0.045 40 H GLU2033 H GLU2033 7.548 -6.813 -5.672 41 HA GLU2033 HA GLU2033 7.919 -4.581 -7.404 42 1HB GLU2033 2HB GLU2033 6.606 -7.224 -8.008 43 2HB GLU2033 1HB GLU2033 7.208 -6.068 -9.186 44 1HG GLU2033 2HG GLU2033 9.488 -6.436 -8.305 45 2HG GLU2033 1HG GLU2033 8.835 -7.668 -7.227 46 H THR2034 H THR2034 5.308 -5.710 -5.537 47 HA THR2034 HA THR2034 3.177 -4.802 -7.156 48 HB THR2034 HB THR2034 2.822 -6.402 -5.237 49 HG1 THR2034 1HG THR2034 0.974 -5.458 -5.845 50 1HG2 THR2034 2HG2 THR2034 4.342 -5.308 -3.645 51 2HG2 THR2034 1HG2 THR2034 3.229 -3.951 -3.534 52 3HG2 THR2034 3HG2 THR2034 2.725 -5.548 -2.968 53 H ARG2035 H ARG2035 1.835 -2.982 -6.692 54 HA ARG2035 HA ARG2035 3.418 -0.624 -5.992 55 1HB ARG2035 2HB ARG2035 0.774 -0.721 -7.433 56 2HB ARG2035 1HB ARG2035 1.942 0.588 -7.407 57 1HG ARG2035 2HG ARG2035 2.344 -2.071 -8.769 58 2HG ARG2035 1HG ARG2035 1.853 -0.583 -9.569 59 1HD ARG2035 2HD ARG2035 4.451 -0.988 -8.079 60 2HD ARG2035 1HD ARG2035 4.245 -1.114 -9.826 61 HE ARG2035 HE ARG2035 3.396 1.375 -8.631 62 1HH1 ARG2035 1HH1 ARG2035 6.101 -0.331 -10.215 63 2HH1 ARG2035 2HH1 ARG2035 6.810 1.103 -10.795 64 1HH2 ARG2035 1HH2 ARG2035 4.369 3.280 -9.441 65 2HH2 ARG2035 2HH2 ARG2035 5.803 3.209 -10.352 66 H ILE2036 H ILE2036 3.029 -0.227 -3.867 67 HA ILE2036 HA ILE2036 0.606 -1.037 -2.592 68 HB ILE2036 HB ILE2036 2.859 0.723 -1.578 69 1HG1 ILE2036 2HG1 ILE2036 3.559 -1.580 -2.027 70 2HG1 ILE2036 1HG1 ILE2036 3.563 -1.258 -0.299 71 1HG2 ILE2036 2HG2 ILE2036 0.820 1.232 -0.338 72 2HG2 ILE2036 1HG2 ILE2036 0.566 -0.481 -0.010 73 3HG2 ILE2036 3HG2 ILE2036 1.952 0.358 0.688 74 1HD1 ILE2036 1HD1 ILE2036 1.416 -2.456 -0.118 75 2HD1 ILE2036 3HD1 ILE2036 1.488 -2.815 -1.843 76 3HD1 ILE2036 2HD1 ILE2036 2.710 -3.463 -0.752 77 HA PRO2037 HA PRO2037 -1.504 2.635 -3.953 78 1HB PRO2037 2HB PRO2037 -3.913 2.041 -2.831 79 2HB PRO2037 1HB PRO2037 -3.345 1.324 -4.341 80 1HG PRO2037 2HG PRO2037 -3.314 0.208 -1.587 81 2HG PRO2037 1HG PRO2037 -3.724 -0.606 -3.112 82 1HD PRO2037 2HD PRO2037 -1.333 -0.864 -1.869 83 2HD PRO2037 1HD PRO2037 -1.512 -0.965 -3.635 84 H VAL2038 H VAL2038 -1.649 4.530 -3.048 85 HA VAL2038 HA VAL2038 -1.761 4.704 -0.133 86 HB VAL2038 HB VAL2038 -0.165 6.624 -0.212 87 1HG1 VAL2038 1HG1 VAL2038 0.942 4.005 -1.212 88 2HG1 VAL2038 3HG1 VAL2038 1.881 5.285 -0.447 89 3HG1 VAL2038 2HG1 VAL2038 0.636 4.436 0.470 90 1HG2 VAL2038 3HG2 VAL2038 -0.404 7.227 -2.557 91 2HG2 VAL2038 2HG2 VAL2038 1.290 6.891 -2.180 92 3HG2 VAL2038 1HG2 VAL2038 0.323 5.696 -3.041 93 H ILE2039 H ILE2039 -2.609 6.607 0.660 94 HA ILE2039 HA ILE2039 -4.045 8.228 -1.296 95 HB ILE2039 HB ILE2039 -5.654 6.643 -0.341 96 1HG1 ILE2039 2HG1 ILE2039 -6.071 9.430 0.786 97 2HG1 ILE2039 1HG1 ILE2039 -6.420 8.937 -0.864 98 1HG2 ILE2039 1HG2 ILE2039 -4.561 6.101 1.745 99 2HG2 ILE2039 3HG2 ILE2039 -4.868 7.726 2.356 100 3HG2 ILE2039 2HG2 ILE2039 -6.216 6.633 2.058 101 1HD1 ILE2039 3HD1 ILE2039 -7.767 7.887 1.614 102 2HD1 ILE2039 2HD1 ILE2039 -8.439 9.069 0.486 103 3HD1 ILE2039 1HD1 ILE2039 -8.137 7.415 -0.045 104 H ASN2040 H ASN2040 -3.981 10.330 -0.958 105 HA ASN2040 HA ASN2040 -2.285 11.462 1.075 106 1HB ASN2040 2HB ASN2040 -2.655 12.512 -1.209 107 2HB ASN2040 1HB ASN2040 -4.299 12.875 -0.709 108 1HD2 ASN2040 1HD2 ASN2040 -0.997 13.827 -0.545 109 2HD2 ASN2040 2HD2 ASN2040 -1.259 15.252 0.381 110 H LYS2041 H LYS2041 -2.948 11.763 3.123 111 HA LYS2041 HA LYS2041 -5.629 11.166 3.849 112 1HB LYS2041 2HB LYS2041 -3.278 12.085 5.441 113 2HB LYS2041 1HB LYS2041 -4.871 11.951 6.171 114 1HG LYS2041 2HG LYS2041 -3.321 9.712 4.876 115 2HG LYS2041 1HG LYS2041 -3.524 9.978 6.610 116 1HD LYS2041 2HD LYS2041 -6.033 9.827 6.191 117 2HD LYS2041 1HD LYS2041 -5.623 9.241 4.578 118 1HE LYS2041 2HE LYS2041 -6.057 7.368 6.025 119 2HE LYS2041 1HE LYS2041 -4.347 7.395 5.613 120 1HZ LYS2041 2HZ LYS2041 -5.525 8.417 8.133 121 2HZ LYS2041 1HZ LYS2041 -4.724 6.945 7.968 122 3HZ LYS2041 3HZ LYS2041 -3.885 8.400 7.779 123 H VAL2042 H VAL2042 -4.197 14.129 2.997 124 HA VAL2042 HA VAL2042 -6.210 15.627 4.442 125 HB VAL2042 HB VAL2042 -4.093 16.617 2.508 126 1HG1 VAL2042 2HG1 VAL2042 -5.975 18.152 2.685 127 2HG1 VAL2042 1HG1 VAL2042 -5.826 18.147 4.443 128 3HG1 VAL2042 3HG1 VAL2042 -4.537 18.828 3.447 129 1HG2 VAL2042 3HG2 VAL2042 -3.100 15.594 4.490 130 2HG2 VAL2042 2HG2 VAL2042 -2.874 17.345 4.514 131 3HG2 VAL2042 1HG2 VAL2042 -4.111 16.601 5.525 132 H ASP2043 H ASP2043 -5.188 15.308 1.057 133 HA ASP2043 HA ASP2043 -7.544 16.629 0.083 134 1HB ASP2043 2HB ASP2043 -5.457 16.929 -1.097 135 2HB ASP2043 1HB ASP2043 -5.319 15.197 -1.363 136 H GLY2044 H GLY2044 -6.396 13.292 0.098 137 1HA GLY2044 1HA GLY2044 -9.093 12.486 -0.709 138 2HA GLY2044 2HA GLY2044 -7.938 11.489 0.172 139 H THR2045 H THR2045 -6.145 13.026 -2.046 140 HA THR2045 HA THR2045 -6.595 11.761 -4.467 141 HB THR2045 HB THR2045 -3.888 12.487 -3.268 142 HG1 THR2045 1HG THR2045 -5.854 14.151 -3.848 143 1HG2 THR2045 3HG2 THR2045 -3.698 11.026 -5.238 144 2HG2 THR2045 2HG2 THR2045 -4.711 12.141 -6.157 145 3HG2 THR2045 1HG2 THR2045 -3.126 12.655 -5.596 146 H LEU2046 H LEU2046 -6.681 9.625 -4.849 147 HA LEU2046 HA LEU2046 -5.167 7.809 -3.140 148 1HB LEU2046 2HB LEU2046 -7.576 7.504 -3.071 149 2HB LEU2046 1HB LEU2046 -7.639 7.400 -4.819 150 HG LEU2046 HG LEU2046 -6.311 5.330 -4.705 151 1HD1 LEU2046 1HD1 LEU2046 -5.193 5.676 -2.579 152 2HD1 LEU2046 3HD1 LEU2046 -6.743 5.559 -1.738 153 3HD1 LEU2046 2HD1 LEU2046 -6.088 4.155 -2.575 154 1HD2 LEU2046 3HD2 LEU2046 -8.719 5.232 -4.895 155 2HD2 LEU2046 2HD2 LEU2046 -8.126 3.907 -3.894 156 3HD2 LEU2046 1HD2 LEU2046 -8.876 5.315 -3.139 157 H LEU2047 H LEU2047 -3.545 6.738 -4.041 158 HA LEU2047 HA LEU2047 -3.291 6.739 -6.979 159 1HB LEU2047 2HB LEU2047 -1.091 6.288 -4.960 160 2HB LEU2047 1HB LEU2047 -0.948 6.504 -6.695 161 HG LEU2047 HG LEU2047 -1.743 8.634 -4.708 162 1HD1 LEU2047 3HD1 LEU2047 0.610 8.077 -4.585 163 2HD1 LEU2047 2HD1 LEU2047 0.756 8.285 -6.332 164 3HD1 LEU2047 1HD1 LEU2047 0.379 9.668 -5.313 165 1HD2 LEU2047 1HD2 LEU2047 -1.341 8.823 -7.694 166 2HD2 LEU2047 3HD2 LEU2047 -2.877 8.983 -6.833 167 3HD2 LEU2047 2HD2 LEU2047 -1.611 10.186 -6.603 168 H VAL2048 H VAL2048 -3.803 4.927 -7.859 169 HA VAL2048 HA VAL2048 -3.146 2.425 -6.490 170 HB VAL2048 HB VAL2048 -5.266 1.407 -7.362 171 1HG1 VAL2048 1HG1 VAL2048 -5.590 3.697 -5.445 172 2HG1 VAL2048 3HG1 VAL2048 -6.786 2.430 -5.690 173 3HG1 VAL2048 2HG1 VAL2048 -5.199 2.021 -5.044 174 1HG2 VAL2048 3HG2 VAL2048 -6.040 4.270 -7.944 175 2HG2 VAL2048 2HG2 VAL2048 -5.770 3.000 -9.137 176 3HG2 VAL2048 1HG2 VAL2048 -7.128 2.882 -8.019 177 H GLY2049 H GLY2049 -3.251 0.562 -8.065 178 1HA GLY2049 1HA GLY2049 -3.076 1.160 -10.851 179 2HA GLY2049 2HA GLY2049 -2.752 -0.394 -10.080 180 H GLU2050 H GLU2050 -1.332 1.608 -12.018 181 HA GLU2050 HA GLU2050 1.286 0.932 -10.995 182 1HB GLU2050 2HB GLU2050 2.153 1.600 -13.156 183 2HB GLU2050 1HB GLU2050 0.851 0.441 -13.336 184 1HG GLU2050 2HG GLU2050 0.564 3.414 -13.703 185 2HG GLU2050 1HG GLU2050 0.888 2.219 -14.961 186 H ASP2051 H ASP2051 -0.781 3.441 -10.833 187 HA ASP2051 HA ASP2051 1.119 5.594 -10.947 188 1HB ASP2051 2HB ASP2051 -1.486 5.523 -11.229 189 2HB ASP2051 1HB ASP2051 -1.456 5.801 -9.508 190 H ALA2052 H ALA2052 -0.104 3.417 -8.648 191 HA ALA2052 HA ALA2052 0.734 4.814 -6.312 192 1HB ALA2052 3HB ALA2052 0.288 2.655 -5.201 193 2HB ALA2052 1HB ALA2052 0.014 1.917 -6.787 194 3HB ALA2052 2HB ALA2052 -1.052 3.209 -6.211 195 HA PRO2053 HA PRO2053 5.035 3.942 -6.681 196 1HB PRO2053 2HB PRO2053 5.730 3.916 -4.030 197 2HB PRO2053 1HB PRO2053 5.460 5.387 -4.967 198 1HG PRO2053 2HG PRO2053 3.612 3.965 -3.103 199 2HG PRO2053 1HG PRO2053 3.889 5.707 -3.286 200 1HD PRO2053 2HD PRO2053 1.747 4.461 -4.330 201 2HD PRO2053 1HD PRO2053 2.520 5.837 -5.145 202 H ARG2054 H ARG2054 6.424 2.280 -6.687 203 HA ARG2054 HA ARG2054 5.597 -0.370 -6.312 204 1HB ARG2054 2HB ARG2054 7.379 0.575 -7.831 205 2HB ARG2054 1HB ARG2054 8.394 0.768 -6.423 206 1HG ARG2054 2HG ARG2054 8.179 -1.682 -6.059 207 2HG ARG2054 1HG ARG2054 7.407 -1.754 -7.652 208 1HD ARG2054 2HD ARG2054 10.220 -0.897 -6.980 209 2HD ARG2054 1HD ARG2054 9.705 -2.177 -8.077 210 HE ARG2054 HE ARG2054 9.298 0.695 -8.568 211 1HH1 ARG2054 1HH1 ARG2054 10.175 -2.532 -9.787 212 2HH1 ARG2054 2HH1 ARG2054 10.385 -2.014 -11.384 213 1HH2 ARG2054 1HH2 ARG2054 9.580 1.378 -10.778 214 2HH2 ARG2054 2HH2 ARG2054 10.047 0.270 -11.966 215 H ARG2055 H ARG2055 5.899 -1.692 -4.518 216 HA ARG2055 HA ARG2055 6.140 -0.639 -1.969 217 1HB ARG2055 2HB ARG2055 5.173 -2.803 -2.210 218 2HB ARG2055 1HB ARG2055 6.624 -3.438 -2.962 219 1HG ARG2055 2HG ARG2055 6.394 -4.261 -0.710 220 2HG ARG2055 1HG ARG2055 7.817 -3.226 -0.853 221 1HD ARG2055 2HD ARG2055 6.361 -1.361 0.080 222 2HD ARG2055 1HD ARG2055 5.178 -2.620 0.468 223 HE ARG2055 HE ARG2055 7.860 -3.089 1.428 224 1HH1 ARG2055 1HH1 ARG2055 4.594 -1.877 2.284 225 2HH1 ARG2055 2HH1 ARG2055 4.928 -1.843 3.931 226 1HH2 ARG2055 1HH2 ARG2055 8.257 -3.038 3.738 227 2HH2 ARG2055 2HH2 ARG2055 7.045 -2.491 4.780 228 H ALA2056 H ALA2056 8.699 -1.889 -4.006 229 HA ALA2056 HA ALA2056 10.768 -1.893 -2.118 230 1HB ALA2056 1HB ALA2056 12.282 -1.986 -3.984 231 2HB ALA2056 2HB ALA2056 11.026 -1.395 -5.070 232 3HB ALA2056 3HB ALA2056 10.872 -2.990 -4.340 233 H GLU2057 H GLU2057 9.316 0.798 -3.835 234 HA GLU2057 HA GLU2057 11.484 2.534 -2.872 235 1HB GLU2057 2HB GLU2057 10.905 4.104 -4.614 236 2HB GLU2057 1HB GLU2057 11.133 2.519 -5.334 237 1HG GLU2057 2HG GLU2057 8.632 2.244 -5.283 238 2HG GLU2057 1HG GLU2057 8.539 3.912 -4.763 239 H LEU2058 H LEU2058 8.419 1.565 -2.208 240 HA LEU2058 HA LEU2058 6.810 3.750 -1.722 241 1HB LEU2058 2HB LEU2058 6.085 1.417 -1.641 242 2HB LEU2058 1HB LEU2058 7.020 1.138 -0.199 243 HG LEU2058 HG LEU2058 4.540 1.219 0.115 244 1HD1 LEU2058 2HD1 LEU2058 5.953 1.574 2.028 245 2HD1 LEU2058 1HD1 LEU2058 6.049 3.297 1.652 246 3HD1 LEU2058 3HD1 LEU2058 4.505 2.584 2.120 247 1HD2 LEU2058 2HD2 LEU2058 4.876 4.134 -0.546 248 2HD2 LEU2058 1HD2 LEU2058 3.971 2.924 -1.459 249 3HD2 LEU2058 3HD2 LEU2058 3.424 3.404 0.148 250 H GLU2059 H GLU2059 9.097 2.271 0.455 251 HA GLU2059 HA GLU2059 8.741 3.876 2.705 252 1HB GLU2059 2HB GLU2059 11.118 3.115 3.222 253 2HB GLU2059 1HB GLU2059 9.929 1.849 2.935 254 1HG GLU2059 2HG GLU2059 10.744 1.541 0.673 255 2HG GLU2059 1HG GLU2059 11.861 2.880 0.869 256 H MET2060 H MET2060 10.873 4.263 -0.060 257 HA MET2060 HA MET2060 12.207 6.612 0.901 258 1HB MET2060 2HB MET2060 12.120 5.330 -1.834 259 2HB MET2060 1HB MET2060 13.185 6.654 -1.394 260 1HG MET2060 2HG MET2060 14.321 5.243 0.222 261 2HG MET2060 1HG MET2060 13.196 3.932 -0.108 262 1HE MET2060 3HE MET2060 16.364 3.614 -0.171 263 2HE MET2060 2HE MET2060 15.248 2.289 -0.498 264 3HE MET2060 1HE MET2060 16.568 2.630 -1.620 265 H TRP2061 H TRP2061 9.483 5.881 -1.087 266 HA TRP2061 HA TRP2061 9.167 8.407 -2.296 267 1HB TRP2061 2HB TRP2061 8.205 6.268 -3.136 268 2HB TRP2061 1HB TRP2061 7.089 6.280 -1.776 269 HD1 TRP2061 HD TRP2061 7.844 8.112 -5.036 270 HE1 TRP2061 1HE TRP2061 5.763 9.380 -5.770 271 HE3 TRP2061 3HE TRP2061 4.955 7.287 -0.907 272 HZ2 TRP2061 2HZ TRP2061 3.189 9.983 -4.712 273 HZ3 TRP2061 3HZ TRP2061 2.704 8.249 -0.851 274 HH2 TRP2061 HH TRP2061 1.838 9.562 -2.714 275 H LEU2062 H LEU2062 7.679 6.875 0.533 276 HA LEU2062 HA LEU2062 6.043 9.019 1.306 277 1HB LEU2062 2HB LEU2062 7.257 6.822 2.977 278 2HB LEU2062 1HB LEU2062 6.089 7.972 3.590 279 HG LEU2062 HG LEU2062 5.584 5.982 1.372 280 1HD1 LEU2062 1HD1 LEU2062 5.813 4.932 3.556 281 2HD1 LEU2062 3HD1 LEU2062 4.614 6.051 4.218 282 3HD1 LEU2062 2HD1 LEU2062 4.149 4.882 2.981 283 1HD2 LEU2062 1HD2 LEU2062 3.716 7.904 2.763 284 2HD2 LEU2062 3HD2 LEU2062 4.249 8.011 1.085 285 3HD2 LEU2062 2HD2 LEU2062 3.237 6.667 1.603 286 H GLN2063 H GLN2063 9.402 8.387 1.891 287 HA GLN2063 HA GLN2063 10.056 10.216 3.843 288 1HB GLN2063 2HB GLN2063 11.550 8.557 2.828 289 2HB GLN2063 1HB GLN2063 11.534 9.458 1.334 290 1HG GLN2063 2HG GLN2063 12.491 11.378 2.564 291 2HG GLN2063 1HG GLN2063 12.693 10.283 3.941 292 1HE2 GLN2063 1HE2 GLN2063 14.284 8.708 3.865 293 2HE2 GLN2063 2HE2 GLN2063 15.470 8.653 2.615 294 H GLY2064 H GLY2064 9.320 10.693 0.441 295 1HA GLY2064 1HA GLY2064 9.758 12.684 -0.822 296 2HA GLY2064 2HA GLY2064 9.904 13.562 0.693 297 H HIS2065 H HIS2065 7.310 11.551 0.989 298 HA HIS2065 HA HIS2065 5.436 13.697 0.373 299 1HB HIS2065 2HB HIS2065 5.055 10.837 -0.595 300 2HB HIS2065 1HB HIS2065 3.863 12.119 -0.726 301 HD1 HIS2065 1HD HIS2065 7.028 10.860 -2.282 302 HD2 HIS2065 2HD HIS2065 4.290 13.941 -2.788 303 HE1 HIS2065 1HE HIS2065 7.526 11.878 -4.534 304 HA PRO2066 HA PRO2066 4.767 11.596 4.450 305 1HB PRO2066 2HB PRO2066 4.716 13.757 5.990 306 2HB PRO2066 1HB PRO2066 6.246 13.135 5.368 307 1HG PRO2066 2HG PRO2066 4.580 15.406 4.341 308 2HG PRO2066 1HG PRO2066 6.334 15.353 4.600 309 1HD PRO2066 2HD PRO2066 5.174 14.969 2.151 310 2HD PRO2066 1HD PRO2066 6.712 14.231 2.632 311 H GLU2067 H GLU2067 2.850 13.229 2.436 312 HA GLU2067 HA GLU2067 0.674 13.676 4.357 313 1HB GLU2067 2HB GLU2067 0.849 14.445 1.446 314 2HB GLU2067 1HB GLU2067 -0.403 14.931 2.578 315 1HG GLU2067 2HG GLU2067 1.281 16.136 3.896 316 2HG GLU2067 1HG GLU2067 2.507 15.674 2.716 317 H PHE2068 H PHE2068 1.815 11.188 2.746 318 HA PHE2068 HA PHE2068 -0.813 10.185 1.917 319 1HB PHE2068 2HB PHE2068 1.925 9.534 0.840 320 2HB PHE2068 1HB PHE2068 0.500 8.568 0.491 321 HD1 PHE2068 1HD PHE2068 1.995 11.924 0.088 322 HD2 PHE2068 2HD PHE2068 -0.996 9.197 -1.199 323 HE1 PHE2068 1HE PHE2068 1.509 13.376 -1.834 324 HE2 PHE2068 2HE PHE2068 -1.499 10.643 -3.122 325 HZ PHE2068 HZ PHE2068 -0.247 12.736 -3.445 326 H ALA2069 H ALA2069 -1.340 8.119 2.441 327 HA ALA2069 HA ALA2069 0.401 6.633 4.251 328 1HB ALA2069 1HB ALA2069 -2.500 7.311 4.738 329 2HB ALA2069 3HB ALA2069 -1.548 6.186 5.711 330 3HB ALA2069 2HB ALA2069 -1.130 7.902 5.684 331 H VAL2070 H VAL2070 -0.562 4.367 4.478 332 HA VAL2070 HA VAL2070 -1.012 3.320 1.896 333 HB VAL2070 HB VAL2070 0.089 1.972 3.655 334 1HG1 VAL2070 2HG1 VAL2070 -1.138 2.698 5.595 335 2HG1 VAL2070 1HG1 VAL2070 -2.591 1.876 5.012 336 3HG1 VAL2070 3HG1 VAL2070 -1.169 0.938 5.463 337 1HG2 VAL2070 3HG2 VAL2070 -2.475 0.700 2.686 338 2HG2 VAL2070 2HG2 VAL2070 -0.947 0.754 1.808 339 3HG2 VAL2070 1HG2 VAL2070 -1.073 -0.171 3.302 340 H ASP2071 H ASP2071 -2.791 2.653 0.849 341 HA ASP2071 HA ASP2071 -5.272 3.834 1.372 342 1HB ASP2071 2HB ASP2071 -4.639 3.254 -0.880 343 2HB ASP2071 1HB ASP2071 -4.487 1.562 -0.447 344 HA PRO2072 HA PRO2072 -6.797 1.058 4.561 345 1HB PRO2072 2HB PRO2072 -9.337 2.391 3.806 346 2HB PRO2072 1HB PRO2072 -8.596 2.212 5.405 347 1HG PRO2072 2HG PRO2072 -8.557 4.555 4.172 348 2HG PRO2072 1HG PRO2072 -7.135 3.981 5.064 349 1HD PRO2072 2HD PRO2072 -7.632 4.015 2.118 350 2HD PRO2072 1HD PRO2072 -6.154 4.391 3.035 351 H ARG2073 H ARG2073 -8.018 1.384 1.312 352 HA ARG2073 HA ARG2073 -9.841 -0.820 1.397 353 1HB ARG2073 2HB ARG2073 -8.452 0.525 -0.913 354 2HB ARG2073 1HB ARG2073 -9.729 -0.666 -1.075 355 1HG ARG2073 2HG ARG2073 -11.344 0.798 -0.198 356 2HG ARG2073 1HG ARG2073 -10.117 1.905 0.425 357 1HD ARG2073 2HD ARG2073 -11.188 2.746 -1.622 358 2HD ARG2073 1HD ARG2073 -9.456 2.496 -1.825 359 HE ARG2073 HE ARG2073 -11.597 0.813 -2.932 360 1HH1 ARG2073 1HH1 ARG2073 -8.113 1.610 -2.819 361 2HH1 ARG2073 2HH1 ARG2073 -7.798 0.933 -4.332 362 1HH2 ARG2073 1HH2 ARG2073 -11.107 -0.143 -4.973 363 2HH2 ARG2073 2HH2 ARG2073 -9.526 -0.096 -5.595 364 H PHE2074 H PHE2074 -6.443 -0.392 0.651 365 HA PHE2074 HA PHE2074 -6.013 -3.041 -0.299 366 1HB PHE2074 2HB PHE2074 -4.472 -1.210 -0.834 367 2HB PHE2074 1HB PHE2074 -4.044 -1.047 0.867 368 HD1 PHE2074 1HD PHE2074 -2.264 -2.290 1.748 369 HD2 PHE2074 2HD PHE2074 -3.959 -3.415 -1.992 370 HE1 PHE2074 1HE PHE2074 -0.461 -3.926 1.426 371 HE2 PHE2074 2HE PHE2074 -2.155 -5.054 -2.321 372 HZ PHE2074 HZ PHE2074 -0.401 -5.313 -0.609 373 H LEU2075 H LEU2075 -5.941 -1.441 2.759 374 HA LEU2075 HA LEU2075 -4.957 -3.644 4.262 375 1HB LEU2075 2HB LEU2075 -6.722 -1.360 5.178 376 2HB LEU2075 1HB LEU2075 -5.830 -2.440 6.235 377 HG LEU2075 HG LEU2075 -4.670 -0.398 4.338 378 1HD1 LEU2075 3HD1 LEU2075 -4.747 -0.517 7.341 379 2HD1 LEU2075 2HD1 LEU2075 -3.904 0.697 6.386 380 3HD1 LEU2075 1HD1 LEU2075 -5.665 0.587 6.319 381 1HD2 LEU2075 3HD2 LEU2075 -3.257 -2.292 6.223 382 2HD2 LEU2075 2HD2 LEU2075 -3.208 -2.354 4.461 383 3HD2 LEU2075 1HD2 LEU2075 -2.494 -0.988 5.313 384 H ALA2076 H ALA2076 -8.116 -2.613 3.176 385 HA ALA2076 HA ALA2076 -9.621 -4.599 4.536 386 1HB ALA2076 3HB ALA2076 -11.435 -4.019 2.975 387 2HB ALA2076 2HB ALA2076 -10.671 -2.567 3.625 388 3HB ALA2076 1HB ALA2076 -10.292 -3.110 1.991 389 H TYR2077 H TYR2077 -7.939 -4.487 1.451 390 HA TYR2077 HA TYR2077 -8.777 -7.002 0.500 391 1HB TYR2077 2HB TYR2077 -7.711 -5.423 -1.007 392 2HB TYR2077 1HB TYR2077 -6.237 -5.430 -0.037 393 HD1 TYR2077 1HD TYR2077 -4.494 -6.663 -0.846 394 HD2 TYR2077 2HD TYR2077 -8.453 -7.900 -1.740 395 HE1 TYR2077 1HE TYR2077 -3.599 -8.562 -2.120 396 HE2 TYR2077 2HE TYR2077 -7.590 -9.798 -3.026 397 HH TYR2077 HH TYR2077 -5.543 -10.490 -4.157 398 H MET2078 H MET2078 -6.274 -6.041 2.733 399 HA MET2078 HA MET2078 -5.095 -8.614 2.992 400 1HB MET2078 2HB MET2078 -4.023 -6.487 3.785 401 2HB MET2078 1HB MET2078 -5.215 -6.424 5.075 402 1HG MET2078 2HG MET2078 -3.111 -7.323 5.886 403 2HG MET2078 1HG MET2078 -4.390 -8.534 5.967 404 1HE MET2078 2HE MET2078 -1.178 -7.323 4.072 405 2HE MET2078 1HE MET2078 -1.057 -8.502 2.764 406 3HE MET2078 3HE MET2078 -2.369 -7.327 2.772 407 H GLU2079 H GLU2079 -7.728 -6.955 4.564 408 HA GLU2079 HA GLU2079 -8.420 -8.893 6.495 409 1HB GLU2079 2HB GLU2079 -10.114 -6.806 5.118 410 2HB GLU2079 1HB GLU2079 -10.611 -7.729 6.527 411 1HG GLU2079 2HG GLU2079 -8.221 -5.909 6.437 412 2HG GLU2079 1HG GLU2079 -9.804 -5.445 7.048 413 H ASP2080 H ASP2080 -9.214 -8.476 3.145 414 HA ASP2080 HA ASP2080 -11.267 -10.382 2.848 415 1HB ASP2080 2HB ASP2080 -10.689 -8.771 1.093 416 2HB ASP2080 1HB ASP2080 -9.126 -9.536 0.879 417 H ARG2081 H ARG2081 -7.789 -10.617 2.512 418 HA ARG2081 HA ARG2081 -7.810 -13.413 1.959 419 1HB ARG2081 2HB ARG2081 -5.549 -11.615 2.806 420 2HB ARG2081 1HB ARG2081 -5.360 -13.302 2.386 421 1HG ARG2081 2HG ARG2081 -6.074 -12.796 0.098 422 2HG ARG2081 1HG ARG2081 -6.262 -11.088 0.544 423 1HD ARG2081 2HD ARG2081 -3.956 -10.949 1.172 424 2HD ARG2081 1HD ARG2081 -3.727 -12.668 0.868 425 HE ARG2081 HE ARG2081 -4.567 -11.324 -1.482 426 1HH1 ARG2081 1HH1 ARG2081 -1.781 -11.715 0.654 427 2HH1 ARG2081 2HH1 ARG2081 -0.597 -11.476 -0.513 428 1HH2 ARG2081 1HH2 ARG2081 -2.991 -10.902 -3.146 429 2HH2 ARG2081 2HH2 ARG2081 -1.321 -10.983 -2.788 430 H ARG2082 H ARG2082 -6.116 -11.802 4.624 431 HA ARG2082 HA ARG2082 -5.386 -12.557 6.621 432 1HB ARG2082 2HB ARG2082 -8.268 -13.471 6.755 433 2HB ARG2082 1HB ARG2082 -7.204 -13.428 8.137 434 1HG ARG2082 2HG ARG2082 -6.997 -10.983 7.855 435 2HG ARG2082 1HG ARG2082 -8.143 -11.081 6.512 436 1HD ARG2082 2HD ARG2082 -9.762 -12.155 8.052 437 2HD ARG2082 1HD ARG2082 -8.630 -11.865 9.372 438 HE ARG2082 HE ARG2082 -8.902 -9.419 8.570 439 1HH1 ARG2082 1HH1 ARG2082 -11.386 -11.909 8.914 440 2HH1 ARG2082 2HH1 ARG2082 -12.694 -10.839 9.077 441 1HH2 ARG2082 1HH2 ARG2082 -10.708 -7.898 8.889 442 2HH2 ARG2082 2HH2 ARG2082 -12.297 -8.499 9.037 443 H LYS2083 H LYS2083 -6.057 -14.770 8.148 444 HA LYS2083 HA LYS2083 -5.654 -17.052 6.401 445 1HB LYS2083 2HB LYS2083 -3.517 -16.573 7.548 446 2HB LYS2083 1HB LYS2083 -4.343 -16.525 9.093 447 1HG LYS2083 2HG LYS2083 -3.055 -18.602 8.768 448 2HG LYS2083 1HG LYS2083 -4.769 -18.897 8.999 449 1HD LYS2083 2HD LYS2083 -3.838 -20.331 7.237 450 2HD LYS2083 1HD LYS2083 -5.056 -19.234 6.602 451 1HE LYS2083 2HE LYS2083 -3.367 -17.811 5.673 452 2HE LYS2083 1HE LYS2083 -2.086 -18.736 6.453 453 1HZ LYS2083 2HZ LYS2083 -3.950 -19.858 4.436 454 2HZ LYS2083 1HZ LYS2083 -2.414 -19.277 4.077 455 3HZ LYS2083 3HZ LYS2083 -2.590 -20.600 5.086 456 H GLN2084 H GLN2084 -7.967 -16.823 6.543 457 HA GLN2084 HA GLN2084 -8.957 -17.995 9.014 458 1HB GLN2084 2HB GLN2084 -11.156 -16.830 8.614 459 2HB GLN2084 1HB GLN2084 -9.816 -15.796 9.045 460 1HG GLN2084 2HG GLN2084 -11.080 -14.650 7.394 461 2HG GLN2084 1HG GLN2084 -9.609 -15.206 6.610 462 1HE2 GLN2084 1HE2 GLN2084 -9.775 -16.633 4.900 463 2HE2 GLN2084 2HE2 GLN2084 -11.290 -17.117 4.240 464 H LYS2085 H LYS2085 -11.226 -19.020 8.658 465 HA LYS2085 HA LYS2085 -10.706 -20.835 6.465 466 1HB LYS2085 2HB LYS2085 -12.178 -21.243 9.067 467 2HB LYS2085 1HB LYS2085 -12.339 -22.364 7.736 468 1HG LYS2085 2HG LYS2085 -10.703 -23.254 9.254 469 2HG LYS2085 1HG LYS2085 -9.870 -22.741 7.796 470 1HD LYS2085 2HD LYS2085 -8.519 -22.085 9.673 471 2HD LYS2085 1HD LYS2085 -9.252 -20.618 9.024 472 1HE LYS2085 2HE LYS2085 -10.975 -20.718 10.763 473 2HE LYS2085 1HE LYS2085 -10.229 -22.181 11.402 474 1HZ LYS2085 2HZ LYS2085 -8.213 -20.840 11.842 475 2HZ LYS2085 1HZ LYS2085 -9.020 -19.448 11.373 476 3HZ LYS2085 3HZ LYS2085 -9.552 -20.330 12.702 No H/Q in entry = 476 Start of MODEL 8 1 H LEU2028 H LEU2028 6.004 -11.851 5.366 2 HA LEU2028 HA LEU2028 8.059 -11.230 3.528 3 1HB LEU2028 2HB LEU2028 5.381 -12.566 3.150 4 2HB LEU2028 1HB LEU2028 6.508 -12.330 1.836 5 HG LEU2028 HG LEU2028 8.149 -13.781 3.043 6 1HD1 LEU2028 2HD1 LEU2028 7.357 -13.505 5.326 7 2HD1 LEU2028 1HD1 LEU2028 5.859 -14.336 4.918 8 3HD1 LEU2028 3HD1 LEU2028 7.393 -15.207 4.866 9 1HD2 LEU2028 3HD2 LEU2028 6.734 -14.679 1.288 10 2HD2 LEU2028 2HD2 LEU2028 7.000 -15.882 2.550 11 3HD2 LEU2028 1HD2 LEU2028 5.464 -15.016 2.465 12 H ASP2029 H ASP2029 5.024 -9.858 4.253 13 HA ASP2029 HA ASP2029 3.959 -7.980 3.696 14 1HB ASP2029 2HB ASP2029 6.296 -6.985 3.968 15 2HB ASP2029 1HB ASP2029 6.477 -7.092 2.229 16 H VAL2030 H VAL2030 5.771 -7.785 0.701 17 HA VAL2030 HA VAL2030 3.736 -9.157 -0.830 18 HB VAL2030 HB VAL2030 3.452 -7.258 -2.459 19 1HG1 VAL2030 1HG1 VAL2030 2.477 -6.627 0.315 20 2HG1 VAL2030 3HG1 VAL2030 1.848 -5.927 -1.177 21 3HG1 VAL2030 2HG1 VAL2030 1.676 -7.656 -0.872 22 1HG2 VAL2030 2HG2 VAL2030 4.771 -5.634 -0.308 23 2HG2 VAL2030 1HG2 VAL2030 5.426 -5.976 -1.909 24 3HG2 VAL2030 3HG2 VAL2030 3.985 -4.974 -1.738 25 H ASP2031 H ASP2031 4.542 -8.421 -3.383 26 HA ASP2031 HA ASP2031 7.009 -9.908 -3.539 27 1HB ASP2031 2HB ASP2031 5.212 -8.746 -5.648 28 2HB ASP2031 1HB ASP2031 6.704 -9.590 -6.022 29 H LEU2032 H LEU2032 6.871 -6.997 -2.625 30 HA LEU2032 HA LEU2032 8.164 -5.177 -2.575 31 1HB LEU2032 2HB LEU2032 10.082 -6.815 -4.218 32 2HB LEU2032 1HB LEU2032 10.468 -5.253 -3.524 33 HG LEU2032 HG LEU2032 9.782 -7.750 -1.972 34 1HD1 LEU2032 3HD1 LEU2032 11.952 -7.871 -3.027 35 2HD1 LEU2032 2HD1 LEU2032 12.385 -6.300 -2.344 36 3HD1 LEU2032 1HD1 LEU2032 12.113 -7.685 -1.277 37 1HD2 LEU2032 3HD2 LEU2032 10.610 -5.005 -1.014 38 2HD2 LEU2032 2HD2 LEU2032 9.029 -5.759 -0.787 39 3HD2 LEU2032 1HD2 LEU2032 10.447 -6.435 0.003 40 H GLU2033 H GLU2033 7.951 -6.371 -5.893 41 HA GLU2033 HA GLU2033 7.914 -3.604 -6.663 42 1HB GLU2033 2HB GLU2033 7.969 -6.060 -8.402 43 2HB GLU2033 1HB GLU2033 7.866 -4.415 -9.036 44 1HG GLU2033 2HG GLU2033 9.959 -3.940 -7.646 45 2HG GLU2033 1HG GLU2033 10.090 -5.682 -7.495 46 H THR2034 H THR2034 5.763 -5.429 -5.393 47 HA THR2034 HA THR2034 3.410 -5.076 -6.864 48 HB THR2034 HB THR2034 3.800 -5.062 -3.866 49 HG1 THR2034 1HG THR2034 3.325 -7.365 -5.431 50 1HG2 THR2034 2HG2 THR2034 1.506 -4.535 -4.606 51 2HG2 THR2034 1HG2 THR2034 1.472 -6.014 -5.562 52 3HG2 THR2034 3HG2 THR2034 1.571 -6.103 -3.804 53 H ARG2035 H ARG2035 2.267 -3.179 -7.167 54 HA ARG2035 HA ARG2035 3.287 -0.737 -6.023 55 1HB ARG2035 2HB ARG2035 1.034 -1.210 -7.972 56 2HB ARG2035 1HB ARG2035 1.603 0.367 -7.456 57 1HG ARG2035 2HG ARG2035 3.844 -0.209 -8.401 58 2HG ARG2035 1HG ARG2035 3.119 -1.683 -9.054 59 1HD ARG2035 2HD ARG2035 1.487 -0.332 -10.256 60 2HD ARG2035 1HD ARG2035 2.221 1.120 -9.585 61 HE ARG2035 HE ARG2035 3.535 -0.705 -11.489 62 1HH1 ARG2035 1HH1 ARG2035 3.235 2.554 -10.076 63 2HH1 ARG2035 2HH1 ARG2035 4.036 3.320 -11.364 64 1HH2 ARG2035 1HH2 ARG2035 4.673 0.403 -13.262 65 2HH2 ARG2035 2HH2 ARG2035 4.878 2.094 -13.172 66 H ILE2036 H ILE2036 2.754 -0.476 -3.989 67 HA ILE2036 HA ILE2036 0.263 -1.297 -2.868 68 HB ILE2036 HB ILE2036 2.397 0.536 -1.758 69 1HG1 ILE2036 2HG1 ILE2036 3.296 -1.676 -2.125 70 2HG1 ILE2036 1HG1 ILE2036 3.027 -1.402 -0.400 71 1HG2 ILE2036 2HG2 ILE2036 0.282 0.940 -0.636 72 2HG2 ILE2036 1HG2 ILE2036 0.108 -0.785 -0.310 73 3HG2 ILE2036 3HG2 ILE2036 1.416 0.130 0.445 74 1HD1 ILE2036 2HD1 ILE2036 0.983 -2.734 -0.506 75 2HD1 ILE2036 1HD1 ILE2036 1.263 -3.035 -2.218 76 3HD1 ILE2036 3HD1 ILE2036 2.395 -3.659 -1.020 77 HA PRO2037 HA PRO2037 -2.015 2.379 -4.057 78 1HB PRO2037 2HB PRO2037 -3.986 1.643 -2.059 79 2HB PRO2037 1HB PRO2037 -4.160 1.673 -3.809 80 1HG PRO2037 2HG PRO2037 -4.062 -0.582 -2.238 81 2HG PRO2037 1HG PRO2037 -3.736 -0.556 -3.984 82 1HD PRO2037 2HD PRO2037 -1.884 -0.816 -1.699 83 2HD PRO2037 1HD PRO2037 -1.685 -1.316 -3.388 84 H VAL2038 H VAL2038 -1.713 4.305 -3.271 85 HA VAL2038 HA VAL2038 -1.571 4.654 -0.370 86 HB VAL2038 HB VAL2038 0.082 6.532 -0.782 87 1HG1 VAL2038 2HG1 VAL2038 0.943 3.753 -1.568 88 2HG1 VAL2038 1HG1 VAL2038 2.015 5.046 -1.025 89 3HG1 VAL2038 3HG1 VAL2038 0.812 4.376 0.077 90 1HG2 VAL2038 2HG2 VAL2038 0.251 5.245 -3.505 91 2HG2 VAL2038 1HG2 VAL2038 -0.337 6.870 -3.150 92 3HG2 VAL2038 3HG2 VAL2038 1.363 6.467 -2.889 93 H ILE2039 H ILE2039 -2.471 6.473 0.439 94 HA ILE2039 HA ILE2039 -4.065 8.004 -1.487 95 HB ILE2039 HB ILE2039 -5.539 6.489 -0.282 96 1HG1 ILE2039 2HG1 ILE2039 -5.838 9.329 0.742 97 2HG1 ILE2039 1HG1 ILE2039 -6.421 8.730 -0.803 98 1HG2 ILE2039 2HG2 ILE2039 -4.203 6.045 1.678 99 2HG2 ILE2039 1HG2 ILE2039 -4.465 7.685 2.264 100 3HG2 ILE2039 3HG2 ILE2039 -5.823 6.563 2.153 101 1HD1 ILE2039 2HD1 ILE2039 -7.383 7.838 1.911 102 2HD1 ILE2039 1HD1 ILE2039 -8.223 8.937 0.815 103 3HD1 ILE2039 3HD1 ILE2039 -7.979 7.253 0.355 104 H ASN2040 H ASN2040 -4.004 10.144 -1.302 105 HA ASN2040 HA ASN2040 -2.219 11.349 0.636 106 1HB ASN2040 2HB ASN2040 -2.540 12.293 -1.741 107 2HB ASN2040 1HB ASN2040 -4.155 12.749 -1.249 108 1HD2 ASN2040 1HD2 ASN2040 -1.852 14.445 -2.106 109 2HD2 ASN2040 2HD2 ASN2040 -1.592 15.547 -0.818 110 H LYS2041 H LYS2041 -2.867 11.667 2.625 111 HA LYS2041 HA LYS2041 -5.547 11.216 3.395 112 1HB LYS2041 2HB LYS2041 -3.259 12.289 4.999 113 2HB LYS2041 1HB LYS2041 -4.795 11.729 5.643 114 1HG LYS2041 2HG LYS2041 -4.344 9.492 4.748 115 2HG LYS2041 1HG LYS2041 -2.785 10.061 4.148 116 1HD LYS2041 2HD LYS2041 -2.353 9.003 6.196 117 2HD LYS2041 1HD LYS2041 -2.269 10.752 6.463 118 1HE LYS2041 2HE LYS2041 -3.448 9.790 8.324 119 2HE LYS2041 1HE LYS2041 -4.610 10.669 7.343 120 1HZ LYS2041 2HZ LYS2041 -5.259 8.514 6.335 121 2HZ LYS2041 1HZ LYS2041 -4.172 7.741 7.359 122 3HZ LYS2041 3HZ LYS2041 -5.503 8.530 7.997 123 H VAL2042 H VAL2042 -3.775 14.047 2.600 124 HA VAL2042 HA VAL2042 -5.572 15.841 4.007 125 HB VAL2042 HB VAL2042 -3.424 16.540 1.988 126 1HG1 VAL2042 3HG1 VAL2042 -4.760 18.203 4.115 127 2HG1 VAL2042 2HG1 VAL2042 -3.431 18.735 3.085 128 3HG1 VAL2042 1HG1 VAL2042 -4.995 18.341 2.372 129 1HG2 VAL2042 3HG2 VAL2042 -2.424 15.275 3.808 130 2HG2 VAL2042 2HG2 VAL2042 -1.939 16.972 3.905 131 3HG2 VAL2042 1HG2 VAL2042 -3.183 16.342 4.990 132 H ASP2043 H ASP2043 -4.658 15.106 0.708 133 HA ASP2043 HA ASP2043 -6.757 16.711 -0.433 134 1HB ASP2043 2HB ASP2043 -4.694 16.591 -1.639 135 2HB ASP2043 1HB ASP2043 -4.737 14.835 -1.659 136 H GLY2044 H GLY2044 -6.072 13.194 -0.576 137 1HA GLY2044 1HA GLY2044 -8.949 12.816 -1.011 138 2HA GLY2044 2HA GLY2044 -7.972 11.766 0.003 139 H THR2045 H THR2045 -6.334 12.807 -2.789 140 HA THR2045 HA THR2045 -7.309 10.956 -4.652 141 HB THR2045 HB THR2045 -4.531 12.157 -4.506 142 HG1 THR2045 1HG THR2045 -6.224 13.687 -4.712 143 1HG2 THR2045 2HG2 THR2045 -5.963 10.841 -6.832 144 2HG2 THR2045 1HG2 THR2045 -4.401 11.661 -6.911 145 3HG2 THR2045 3HG2 THR2045 -4.578 10.187 -5.958 146 H LEU2046 H LEU2046 -7.223 8.863 -4.714 147 HA LEU2046 HA LEU2046 -5.255 7.396 -3.168 148 1HB LEU2046 2HB LEU2046 -7.613 6.766 -2.935 149 2HB LEU2046 1HB LEU2046 -7.737 6.535 -4.666 150 HG LEU2046 HG LEU2046 -6.129 4.660 -4.495 151 1HD1 LEU2046 1HD1 LEU2046 -4.968 5.325 -2.462 152 2HD1 LEU2046 3HD1 LEU2046 -6.439 5.037 -1.531 153 3HD1 LEU2046 2HD1 LEU2046 -5.625 3.695 -2.328 154 1HD2 LEU2046 1HD2 LEU2046 -8.590 4.424 -2.776 155 2HD2 LEU2046 3HD2 LEU2046 -8.513 4.240 -4.528 156 3HD2 LEU2046 2HD2 LEU2046 -7.689 3.079 -3.480 157 H LEU2047 H LEU2047 -3.580 6.508 -4.152 158 HA LEU2047 HA LEU2047 -3.425 6.604 -7.084 159 1HB LEU2047 2HB LEU2047 -1.214 6.141 -5.095 160 2HB LEU2047 1HB LEU2047 -1.034 6.376 -6.815 161 HG LEU2047 HG LEU2047 -1.820 8.424 -4.756 162 1HD1 LEU2047 3HD1 LEU2047 0.547 7.945 -4.864 163 2HD1 LEU2047 2HD1 LEU2047 0.545 8.235 -6.605 164 3HD1 LEU2047 1HD1 LEU2047 0.210 9.560 -5.490 165 1HD2 LEU2047 1HD2 LEU2047 -3.142 8.767 -6.817 166 2HD2 LEU2047 3HD2 LEU2047 -1.992 10.059 -6.517 167 3HD2 LEU2047 2HD2 LEU2047 -1.640 8.859 -7.751 168 H VAL2048 H VAL2048 -4.093 4.931 -8.012 169 HA VAL2048 HA VAL2048 -3.059 2.349 -7.165 170 HB VAL2048 HB VAL2048 -5.157 1.298 -8.080 171 1HG1 VAL2048 3HG1 VAL2048 -5.528 3.147 -5.741 172 2HG1 VAL2048 2HG1 VAL2048 -6.612 1.814 -6.150 173 3HG1 VAL2048 1HG1 VAL2048 -4.932 1.489 -5.706 174 1HG2 VAL2048 2HG2 VAL2048 -6.208 4.128 -8.056 175 2HG2 VAL2048 1HG2 VAL2048 -5.932 3.131 -9.483 176 3HG2 VAL2048 3HG2 VAL2048 -7.185 2.681 -8.322 177 H GLY2049 H GLY2049 -3.361 0.837 -9.187 178 1HA GLY2049 1HA GLY2049 -3.322 2.156 -11.715 179 2HA GLY2049 2HA GLY2049 -2.934 0.462 -11.428 180 H GLU2050 H GLU2050 -1.711 3.194 -12.605 181 HA GLU2050 HA GLU2050 1.015 2.285 -12.070 182 1HB GLU2050 2HB GLU2050 0.009 4.173 -14.204 183 2HB GLU2050 1HB GLU2050 1.639 3.527 -14.074 184 1HG GLU2050 2HG GLU2050 -0.846 1.904 -14.584 185 2HG GLU2050 1HG GLU2050 0.317 2.405 -15.804 186 H ASP2051 H ASP2051 -1.080 4.448 -10.930 187 HA ASP2051 HA ASP2051 0.663 6.723 -10.570 188 1HB ASP2051 2HB ASP2051 -2.007 5.911 -9.587 189 2HB ASP2051 1HB ASP2051 -1.194 7.283 -8.822 190 H ALA2052 H ALA2052 -0.116 3.845 -8.952 191 HA ALA2052 HA ALA2052 0.941 4.664 -6.408 192 1HB ALA2052 2HB ALA2052 0.410 2.356 -5.733 193 2HB ALA2052 3HB ALA2052 -0.010 1.976 -7.410 194 3HB ALA2052 1HB ALA2052 -0.949 3.176 -6.520 195 HA PRO2053 HA PRO2053 5.044 3.386 -7.581 196 1HB PRO2053 2HB PRO2053 6.279 3.776 -5.235 197 2HB PRO2053 1HB PRO2053 5.700 5.133 -6.213 198 1HG PRO2053 2HG PRO2053 4.486 3.893 -3.784 199 2HG PRO2053 1HG PRO2053 4.595 5.605 -4.235 200 1HD PRO2053 2HD PRO2053 2.349 4.026 -4.585 201 2HD PRO2053 1HD PRO2053 2.701 5.503 -5.505 202 H ARG2054 H ARG2054 6.624 1.755 -7.038 203 HA ARG2054 HA ARG2054 5.363 -0.646 -6.117 204 1HB ARG2054 2HB ARG2054 7.488 -1.751 -6.472 205 2HB ARG2054 1HB ARG2054 6.995 -0.891 -7.945 206 1HG ARG2054 2HG ARG2054 8.671 0.827 -7.328 207 2HG ARG2054 1HG ARG2054 9.110 -0.150 -5.921 208 1HD ARG2054 2HD ARG2054 9.610 -2.033 -7.498 209 2HD ARG2054 1HD ARG2054 9.384 -0.907 -8.833 210 HE ARG2054 HE ARG2054 11.270 0.172 -7.042 211 1HH1 ARG2054 1HH1 ARG2054 11.177 -2.547 -9.433 212 2HH1 ARG2054 2HH1 ARG2054 12.866 -2.451 -9.631 213 1HH2 ARG2054 1HH2 ARG2054 13.433 0.166 -7.378 214 2HH2 ARG2054 2HH2 ARG2054 14.203 -0.932 -8.442 215 H ARG2055 H ARG2055 5.836 -1.827 -4.357 216 HA ARG2055 HA ARG2055 6.092 -0.621 -1.928 217 1HB ARG2055 2HB ARG2055 5.237 -2.865 -2.290 218 2HB ARG2055 1HB ARG2055 6.845 -3.429 -2.684 219 1HG ARG2055 2HG ARG2055 6.200 -4.105 -0.481 220 2HG ARG2055 1HG ARG2055 7.560 -2.965 -0.400 221 1HD ARG2055 2HD ARG2055 6.048 -1.193 0.236 222 2HD ARG2055 1HD ARG2055 4.670 -2.268 -0.018 223 HE ARG2055 HE ARG2055 5.420 -3.588 1.827 224 1HH1 ARG2055 1HH1 ARG2055 6.838 -0.373 1.580 225 2HH1 ARG2055 2HH1 ARG2055 7.130 -0.153 3.224 226 1HH2 ARG2055 1HH2 ARG2055 5.803 -3.382 4.078 227 2HH2 ARG2055 2HH2 ARG2055 6.552 -1.980 4.739 228 H ALA2056 H ALA2056 8.688 -1.969 -3.879 229 HA ALA2056 HA ALA2056 10.795 -1.765 -2.077 230 1HB ALA2056 3HB ALA2056 12.266 -1.868 -4.008 231 2HB ALA2056 1HB ALA2056 10.925 -1.451 -5.075 232 3HB ALA2056 2HB ALA2056 10.917 -2.983 -4.199 233 H GLU2057 H GLU2057 9.357 0.742 -4.143 234 HA GLU2057 HA GLU2057 11.451 2.634 -3.276 235 1HB GLU2057 2HB GLU2057 9.104 3.194 -5.098 236 2HB GLU2057 1HB GLU2057 10.510 4.211 -4.840 237 1HG GLU2057 2HG GLU2057 10.374 1.587 -6.285 238 2HG GLU2057 1HG GLU2057 10.726 3.172 -6.962 239 H LEU2058 H LEU2058 8.321 1.653 -2.619 240 HA LEU2058 HA LEU2058 6.835 3.794 -1.874 241 1HB LEU2058 2HB LEU2058 6.043 1.507 -2.126 242 2HB LEU2058 1HB LEU2058 6.898 1.027 -0.686 243 HG LEU2058 HG LEU2058 4.412 1.172 -0.494 244 1HD1 LEU2058 3HD1 LEU2058 5.980 2.914 1.370 245 2HD1 LEU2058 2HD1 LEU2058 4.365 2.283 1.678 246 3HD1 LEU2058 1HD1 LEU2058 5.728 1.175 1.506 247 1HD2 LEU2058 2HD2 LEU2058 4.922 4.126 -0.722 248 2HD2 LEU2058 1HD2 LEU2058 4.002 3.117 -1.844 249 3HD2 LEU2058 3HD2 LEU2058 3.404 3.394 -0.207 250 H GLU2059 H GLU2059 9.112 2.056 0.247 251 HA GLU2059 HA GLU2059 8.539 3.300 2.675 252 1HB GLU2059 2HB GLU2059 11.182 2.341 1.595 253 2HB GLU2059 1HB GLU2059 10.916 2.822 3.264 254 1HG GLU2059 2HG GLU2059 9.427 0.614 1.880 255 2HG GLU2059 1HG GLU2059 10.888 0.407 2.854 256 H MET2060 H MET2060 11.068 4.173 0.401 257 HA MET2060 HA MET2060 11.796 6.562 1.765 258 1HB MET2060 2HB MET2060 12.427 5.672 -1.053 259 2HB MET2060 1HB MET2060 13.113 7.101 -0.293 260 1HG MET2060 2HG MET2060 14.143 5.706 1.424 261 2HG MET2060 1HG MET2060 13.443 4.272 0.677 262 1HE MET2060 1HE MET2060 15.865 3.159 0.631 263 2HE MET2060 3HE MET2060 17.277 3.924 -0.105 264 3HE MET2060 2HE MET2060 16.553 4.616 1.351 265 H TRP2061 H TRP2061 9.633 5.889 -0.899 266 HA TRP2061 HA TRP2061 9.240 8.564 -1.670 267 1HB TRP2061 2HB TRP2061 8.628 6.642 -3.108 268 2HB TRP2061 1HB TRP2061 7.330 6.231 -1.992 269 HD1 TRP2061 HD TRP2061 8.334 8.958 -4.515 270 HE1 TRP2061 1HE TRP2061 6.186 10.185 -5.274 271 HE3 TRP2061 3HE TRP2061 4.950 6.747 -1.373 272 HZ2 TRP2061 2HZ TRP2061 3.466 10.209 -4.638 273 HZ3 TRP2061 3HZ TRP2061 2.613 7.437 -1.518 274 HH2 TRP2061 HH TRP2061 1.880 9.128 -3.114 275 H LEU2062 H LEU2062 7.509 6.517 0.658 276 HA LEU2062 HA LEU2062 5.569 8.456 1.296 277 1HB LEU2062 2HB LEU2062 6.536 6.079 2.850 278 2HB LEU2062 1HB LEU2062 5.305 7.156 3.472 279 HG LEU2062 HG LEU2062 5.118 5.414 1.019 280 1HD1 LEU2062 1HD1 LEU2062 4.860 4.252 3.131 281 2HD1 LEU2062 3HD1 LEU2062 3.610 5.404 3.622 282 3HD1 LEU2062 2HD1 LEU2062 3.339 4.337 2.238 283 1HD2 LEU2062 2HD2 LEU2062 3.138 7.406 2.118 284 2HD2 LEU2062 1HD2 LEU2062 3.958 7.508 0.566 285 3HD2 LEU2062 3HD2 LEU2062 2.792 6.223 0.862 286 H GLN2063 H GLN2063 8.784 7.970 2.494 287 HA GLN2063 HA GLN2063 8.625 9.739 4.671 288 1HB GLN2063 2HB GLN2063 10.972 9.127 2.876 289 2HB GLN2063 1HB GLN2063 11.064 9.906 4.444 290 1HG GLN2063 2HG GLN2063 10.177 7.864 5.482 291 2HG GLN2063 1HG GLN2063 10.152 7.099 3.894 292 1HE2 GLN2063 1HE2 GLN2063 12.145 8.260 6.469 293 2HE2 GLN2063 2HE2 GLN2063 13.613 7.524 5.925 294 H GLY2064 H GLY2064 9.213 10.201 1.248 295 1HA GLY2064 1HA GLY2064 9.534 12.101 -0.037 296 2HA GLY2064 2HA GLY2064 9.805 13.009 1.441 297 H HIS2065 H HIS2065 6.912 11.247 1.459 298 HA HIS2065 HA HIS2065 5.397 13.690 1.132 299 1HB HIS2065 2HB HIS2065 4.842 11.174 -0.430 300 2HB HIS2065 1HB HIS2065 3.571 12.310 -0.030 301 HD1 HIS2065 1HD HIS2065 3.567 14.616 -1.351 302 HD2 HIS2065 2HD HIS2065 6.587 11.942 -2.426 303 HE1 HIS2065 1HE HIS2065 4.465 15.418 -3.528 304 HA PRO2066 HA PRO2066 4.039 11.413 4.854 305 1HB PRO2066 2HB PRO2066 3.549 13.704 6.296 306 2HB PRO2066 1HB PRO2066 5.092 12.850 6.291 307 1HG PRO2066 2HG PRO2066 4.301 15.330 4.851 308 2HG PRO2066 1HG PRO2066 5.872 14.848 5.516 309 1HD PRO2066 2HD PRO2066 5.206 14.775 2.866 310 2HD PRO2066 1HD PRO2066 6.483 13.793 3.607 311 H GLU2067 H GLU2067 2.762 13.610 2.723 312 HA GLU2067 HA GLU2067 0.084 14.040 3.535 313 1HB GLU2067 2HB GLU2067 1.163 13.611 0.756 314 2HB GLU2067 1HB GLU2067 -0.350 14.391 1.173 315 1HG GLU2067 2HG GLU2067 0.795 16.261 2.082 316 2HG GLU2067 1HG GLU2067 2.352 15.434 1.962 317 H PHE2068 H PHE2068 1.738 11.503 1.771 318 HA PHE2068 HA PHE2068 -0.731 10.032 1.354 319 1HB PHE2068 2HB PHE2068 2.027 9.744 0.163 320 2HB PHE2068 1HB PHE2068 0.740 8.580 -0.096 321 HD1 PHE2068 1HD PHE2068 1.756 12.092 -0.705 322 HD2 PHE2068 2HD PHE2068 -0.928 8.952 -1.707 323 HE1 PHE2068 1HE PHE2068 0.977 13.383 -2.646 324 HE2 PHE2068 2HE PHE2068 -1.717 10.244 -3.645 325 HZ PHE2068 HZ PHE2068 -0.771 12.452 -4.121 326 H ALA2069 H ALA2069 -1.046 8.087 2.138 327 HA ALA2069 HA ALA2069 1.043 6.761 3.667 328 1HB ALA2069 1HB ALA2069 -0.288 7.989 5.320 329 2HB ALA2069 2HB ALA2069 -0.580 6.256 5.462 330 3HB ALA2069 3HB ALA2069 -1.769 7.287 4.667 331 H VAL2070 H VAL2070 0.237 4.474 4.128 332 HA VAL2070 HA VAL2070 -0.566 3.288 1.705 333 HB VAL2070 HB VAL2070 0.871 2.081 3.278 334 1HG1 VAL2070 2HG1 VAL2070 -1.475 2.058 5.155 335 2HG1 VAL2070 1HG1 VAL2070 0.028 1.153 5.386 336 3HG1 VAL2070 3HG1 VAL2070 0.045 2.919 5.378 337 1HG2 VAL2070 2HG2 VAL2070 -1.788 0.688 2.947 338 2HG2 VAL2070 1HG2 VAL2070 -0.468 0.708 1.777 339 3HG2 VAL2070 3HG2 VAL2070 -0.262 -0.108 3.327 340 H ASP2071 H ASP2071 -2.515 2.561 0.985 341 HA ASP2071 HA ASP2071 -4.803 3.830 1.848 342 1HB ASP2071 2HB ASP2071 -4.665 3.123 -0.395 343 2HB ASP2071 1HB ASP2071 -4.378 1.451 0.078 344 HA PRO2072 HA PRO2072 -5.889 1.363 5.414 345 1HB PRO2072 2HB PRO2072 -8.435 2.843 5.219 346 2HB PRO2072 1HB PRO2072 -7.270 2.756 6.547 347 1HG PRO2072 2HG PRO2072 -7.540 4.966 5.053 348 2HG PRO2072 1HG PRO2072 -5.970 4.455 5.697 349 1HD PRO2072 2HD PRO2072 -7.065 4.176 2.928 350 2HD PRO2072 1HD PRO2072 -5.422 4.576 3.494 351 H ARG2073 H ARG2073 -7.706 1.642 2.469 352 HA ARG2073 HA ARG2073 -9.633 -0.375 3.077 353 1HB ARG2073 2HB ARG2073 -10.121 1.221 1.342 354 2HB ARG2073 1HB ARG2073 -8.644 0.824 0.490 355 1HG ARG2073 2HG ARG2073 -9.572 -1.442 0.069 356 2HG ARG2073 1HG ARG2073 -11.092 -0.894 0.782 357 1HD ARG2073 2HD ARG2073 -11.304 0.836 -0.881 358 2HD ARG2073 1HD ARG2073 -9.720 0.448 -1.533 359 HE ARG2073 HE ARG2073 -11.659 -1.688 -1.556 360 1HH1 ARG2073 1HH1 ARG2073 -10.054 0.899 -3.346 361 2HH1 ARG2073 2HH1 ARG2073 -10.502 0.342 -4.888 362 1HH2 ARG2073 1HH2 ARG2073 -12.323 -2.476 -3.720 363 2HH2 ARG2073 2HH2 ARG2073 -11.849 -1.602 -5.095 364 H PHE2074 H PHE2074 -6.694 -0.301 1.088 365 HA PHE2074 HA PHE2074 -6.367 -2.970 0.547 366 1HB PHE2074 2HB PHE2074 -4.921 -1.264 -0.421 367 2HB PHE2074 1HB PHE2074 -4.234 -0.900 1.151 368 HD1 PHE2074 1HD PHE2074 -4.509 -3.562 -1.424 369 HD2 PHE2074 2HD PHE2074 -2.340 -2.056 1.920 370 HE1 PHE2074 1HE PHE2074 -2.722 -5.204 -1.844 371 HE2 PHE2074 2HE PHE2074 -0.555 -3.695 1.504 372 HZ PHE2074 HZ PHE2074 -0.744 -5.272 -0.375 373 H LEU2075 H LEU2075 -5.332 -1.234 3.442 374 HA LEU2075 HA LEU2075 -4.057 -3.349 4.774 375 1HB LEU2075 2HB LEU2075 -5.628 -1.082 5.995 376 2HB LEU2075 1HB LEU2075 -4.551 -2.139 6.876 377 HG LEU2075 HG LEU2075 -3.758 -0.168 4.731 378 1HD1 LEU2075 3HD1 LEU2075 -3.291 -0.186 7.704 379 2HD1 LEU2075 2HD1 LEU2075 -2.628 0.988 6.566 380 3HD1 LEU2075 1HD1 LEU2075 -4.370 0.891 6.824 381 1HD2 LEU2075 3HD2 LEU2075 -2.057 -2.041 6.390 382 2HD2 LEU2075 2HD2 LEU2075 -2.317 -2.131 4.645 383 3HD2 LEU2075 1HD2 LEU2075 -1.449 -0.764 5.333 384 H ALA2076 H ALA2076 -7.432 -2.310 4.995 385 HA ALA2076 HA ALA2076 -8.221 -4.321 6.828 386 1HB ALA2076 1HB ALA2076 -10.506 -3.626 6.300 387 2HB ALA2076 3HB ALA2076 -9.462 -2.223 6.537 388 3HB ALA2076 2HB ALA2076 -9.912 -2.722 4.908 389 H TYR2077 H TYR2077 -8.137 -4.125 3.355 390 HA TYR2077 HA TYR2077 -9.620 -6.464 2.804 391 1HB TYR2077 2HB TYR2077 -9.209 -4.642 1.177 392 2HB TYR2077 1HB TYR2077 -7.512 -5.090 1.135 393 HD1 TYR2077 1HD TYR2077 -6.784 -6.548 -0.524 394 HD2 TYR2077 2HD TYR2077 -10.870 -6.579 0.624 395 HE1 TYR2077 1HE TYR2077 -7.268 -8.165 -2.318 396 HE2 TYR2077 2HE TYR2077 -11.368 -8.181 -1.143 397 HH TYR2077 HH TYR2077 -10.466 -8.857 -3.232 398 H MET2078 H MET2078 -6.178 -5.787 3.123 399 HA MET2078 HA MET2078 -5.183 -8.267 2.357 400 1HB MET2078 2HB MET2078 -3.799 -6.247 2.575 401 2HB MET2078 1HB MET2078 -3.997 -6.301 4.319 402 1HG MET2078 2HG MET2078 -2.743 -8.356 4.442 403 2HG MET2078 1HG MET2078 -2.653 -8.445 2.686 404 1HE MET2078 2HE MET2078 -1.480 -6.495 5.907 405 2HE MET2078 1HE MET2078 -0.482 -5.220 5.209 406 3HE MET2078 3HE MET2078 -2.225 -5.212 4.958 407 H GLU2079 H GLU2079 -6.246 -7.162 5.561 408 HA GLU2079 HA GLU2079 -5.452 -9.634 6.753 409 1HB GLU2079 2HB GLU2079 -6.596 -8.844 8.800 410 2HB GLU2079 1HB GLU2079 -5.427 -7.694 8.181 411 1HG GLU2079 2HG GLU2079 -7.123 -6.269 7.381 412 2HG GLU2079 1HG GLU2079 -8.362 -7.499 7.611 413 H ASP2080 H ASP2080 -8.452 -8.399 5.388 414 HA ASP2080 HA ASP2080 -10.115 -10.453 6.469 415 1HB ASP2080 2HB ASP2080 -10.909 -8.232 5.417 416 2HB ASP2080 1HB ASP2080 -10.649 -9.008 3.863 417 H ARG2081 H ARG2081 -8.264 -10.011 3.611 418 HA ARG2081 HA ARG2081 -8.820 -12.227 2.072 419 1HB ARG2081 2HB ARG2081 -7.452 -10.543 1.176 420 2HB ARG2081 1HB ARG2081 -6.372 -10.570 2.551 421 1HG ARG2081 2HG ARG2081 -5.517 -12.741 1.808 422 2HG ARG2081 1HG ARG2081 -6.581 -12.652 0.401 423 1HD ARG2081 2HD ARG2081 -5.437 -10.815 -0.495 424 2HD ARG2081 1HD ARG2081 -4.645 -10.452 1.042 425 HE ARG2081 HE ARG2081 -3.807 -12.951 0.367 426 1HH1 ARG2081 1HH1 ARG2081 -3.632 -9.806 -1.356 427 2HH1 ARG2081 2HH1 ARG2081 -2.087 -10.123 -1.967 428 1HH2 ARG2081 1HH2 ARG2081 -1.730 -13.297 -0.448 429 2HH2 ARG2081 2HH2 ARG2081 -0.970 -12.145 -1.453 430 H ARG2082 H ARG2082 -6.281 -11.934 4.591 431 HA ARG2082 HA ARG2082 -6.191 -14.826 4.574 432 1HB ARG2082 2HB ARG2082 -4.110 -14.683 5.945 433 2HB ARG2082 1HB ARG2082 -3.973 -13.936 4.369 434 1HG ARG2082 2HG ARG2082 -4.080 -11.740 5.344 435 2HG ARG2082 1HG ARG2082 -4.441 -12.421 6.933 436 1HD ARG2082 2HD ARG2082 -1.898 -12.847 5.360 437 2HD ARG2082 1HD ARG2082 -2.078 -11.798 6.769 438 HE ARG2082 HE ARG2082 -2.938 -14.193 7.664 439 1HH1 ARG2082 1HH1 ARG2082 0.097 -13.177 6.142 440 2HH1 ARG2082 2HH1 ARG2082 1.034 -14.373 6.895 441 1HH2 ARG2082 1HH2 ARG2082 -1.664 -15.800 8.695 442 2HH2 ARG2082 2HH2 ARG2082 0.019 -15.908 8.382 443 H LYS2083 H LYS2083 -8.112 -15.088 5.455 444 HA LYS2083 HA LYS2083 -8.214 -15.395 8.272 445 1HB LYS2083 2HB LYS2083 -8.765 -12.975 8.083 446 2HB LYS2083 1HB LYS2083 -10.011 -13.363 6.914 447 1HG LYS2083 2HG LYS2083 -11.268 -14.555 8.646 448 2HG LYS2083 1HG LYS2083 -10.002 -14.180 9.818 449 1HD LYS2083 2HD LYS2083 -11.838 -12.608 10.084 450 2HD LYS2083 1HD LYS2083 -10.421 -11.774 9.463 451 1HE LYS2083 2HE LYS2083 -11.367 -11.876 7.187 452 2HE LYS2083 1HE LYS2083 -12.782 -12.698 7.833 453 1HZ LYS2083 3HZ LYS2083 -11.932 -10.018 8.739 454 2HZ LYS2083 2HZ LYS2083 -12.975 -10.222 7.453 455 3HZ LYS2083 1HZ LYS2083 -13.420 -10.739 9.006 456 H GLN2084 H GLN2084 -9.702 -17.026 8.646 457 HA GLN2084 HA GLN2084 -10.695 -18.379 6.355 458 1HB GLN2084 2HB GLN2084 -11.086 -18.917 9.301 459 2HB GLN2084 1HB GLN2084 -11.777 -19.926 8.049 460 1HG GLN2084 2HG GLN2084 -9.794 -20.982 8.860 461 2HG GLN2084 1HG GLN2084 -9.485 -20.394 7.232 462 1HE2 GLN2084 1HE2 GLN2084 -7.296 -20.400 7.535 463 2HE2 GLN2084 2HE2 GLN2084 -6.474 -19.269 8.542 464 H LYS2085 H LYS2085 -12.373 -16.999 9.165 465 HA LYS2085 HA LYS2085 -14.471 -16.146 7.394 466 1HB LYS2085 2HB LYS2085 -15.197 -18.406 7.907 467 2HB LYS2085 1HB LYS2085 -14.995 -18.126 9.620 468 1HG LYS2085 2HG LYS2085 -17.348 -18.138 9.076 469 2HG LYS2085 1HG LYS2085 -16.880 -16.516 9.554 470 1HD LYS2085 2HD LYS2085 -16.930 -17.249 6.643 471 2HD LYS2085 1HD LYS2085 -18.446 -16.921 7.465 472 1HE LYS2085 2HE LYS2085 -16.096 -15.011 7.263 473 2HE LYS2085 1HE LYS2085 -17.568 -14.934 6.301 474 1HZ LYS2085 3HZ LYS2085 -18.794 -14.637 8.479 475 2HZ LYS2085 2HZ LYS2085 -17.293 -14.447 9.232 476 3HZ LYS2085 1HZ LYS2085 -17.757 -13.375 8.068 No H/Q in entry = 476 Start of MODEL 9 1 H LEU2028 H LEU2028 1.825 -12.659 3.877 2 HA LEU2028 HA LEU2028 4.614 -13.289 3.499 3 1HB LEU2028 2HB LEU2028 2.264 -13.478 1.595 4 2HB LEU2028 1HB LEU2028 3.849 -14.158 1.298 5 HG LEU2028 HG LEU2028 1.980 -15.038 3.506 6 1HD1 LEU2028 3HD1 LEU2028 1.105 -15.597 1.295 7 2HD1 LEU2028 2HD1 LEU2028 2.651 -16.330 0.864 8 3HD1 LEU2028 1HD1 LEU2028 1.665 -17.044 2.136 9 1HD2 LEU2028 3HD2 LEU2028 4.348 -15.374 4.037 10 2HD2 LEU2028 2HD2 LEU2028 3.536 -16.912 3.744 11 3HD2 LEU2028 1HD2 LEU2028 4.576 -16.212 2.503 12 H ASP2029 H ASP2029 2.356 -10.936 2.712 13 HA ASP2029 HA ASP2029 2.366 -8.872 1.886 14 1HB ASP2029 2HB ASP2029 4.585 -8.833 3.267 15 2HB ASP2029 1HB ASP2029 5.379 -8.946 1.702 16 H VAL2030 H VAL2030 4.079 -7.736 -0.067 17 HA VAL2030 HA VAL2030 3.043 -9.265 -2.308 18 HB VAL2030 HB VAL2030 3.268 -7.188 -3.598 19 1HG1 VAL2030 2HG1 VAL2030 1.789 -6.853 -0.988 20 2HG1 VAL2030 1HG1 VAL2030 1.516 -5.899 -2.444 21 3HG1 VAL2030 3HG1 VAL2030 1.173 -7.630 -2.446 22 1HG2 VAL2030 1HG2 VAL2030 4.207 -5.970 -0.996 23 2HG2 VAL2030 3HG2 VAL2030 5.179 -6.193 -2.448 24 3HG2 VAL2030 2HG2 VAL2030 3.819 -5.072 -2.464 25 H ASP2031 H ASP2031 4.523 -8.560 -4.399 26 HA ASP2031 HA ASP2031 7.025 -9.948 -3.801 27 1HB ASP2031 2HB ASP2031 7.087 -10.593 -6.129 28 2HB ASP2031 1HB ASP2031 5.483 -10.924 -5.508 29 H LEU2032 H LEU2032 6.575 -7.112 -3.359 30 HA LEU2032 HA LEU2032 7.723 -5.180 -3.328 31 1HB LEU2032 2HB LEU2032 9.870 -6.690 -4.789 32 2HB LEU2032 1HB LEU2032 10.052 -5.078 -4.134 33 HG LEU2032 HG LEU2032 9.527 -7.577 -2.534 34 1HD1 LEU2032 2HD1 LEU2032 11.760 -7.477 -3.474 35 2HD1 LEU2032 1HD1 LEU2032 11.981 -5.861 -2.804 36 3HD1 LEU2032 3HD1 LEU2032 11.796 -7.247 -1.726 37 1HD2 LEU2032 2HD2 LEU2032 10.006 -4.730 -1.647 38 2HD2 LEU2032 1HD2 LEU2032 8.501 -5.638 -1.475 39 3HD2 LEU2032 3HD2 LEU2032 9.939 -6.135 -0.583 40 H GLU2033 H GLU2033 7.711 -6.593 -6.542 41 HA GLU2033 HA GLU2033 7.864 -4.035 -7.820 42 1HB GLU2033 2HB GLU2033 7.336 -6.818 -8.812 43 2HB GLU2033 1HB GLU2033 7.100 -5.434 -9.863 44 1HG GLU2033 2HG GLU2033 9.268 -6.471 -10.211 45 2HG GLU2033 1HG GLU2033 9.431 -4.823 -9.627 46 H THR2034 H THR2034 5.505 -5.677 -6.235 47 HA THR2034 HA THR2034 3.131 -5.061 -7.575 48 HB THR2034 HB THR2034 3.318 -5.046 -4.629 49 HG1 THR2034 1HG THR2034 3.996 -7.412 -6.140 50 1HG2 THR2034 1HG2 THR2034 1.757 -6.707 -6.622 51 2HG2 THR2034 3HG2 THR2034 1.533 -6.738 -4.876 52 3HG2 THR2034 2HG2 THR2034 1.158 -5.275 -5.776 53 H ARG2035 H ARG2035 1.770 -3.222 -7.216 54 HA ARG2035 HA ARG2035 3.148 -0.994 -5.960 55 1HB ARG2035 2HB ARG2035 1.538 0.514 -7.163 56 2HB ARG2035 1HB ARG2035 2.693 -0.321 -8.182 57 1HG ARG2035 2HG ARG2035 -0.072 -1.388 -7.789 58 2HG ARG2035 1HG ARG2035 0.259 -0.079 -8.926 59 1HD ARG2035 2HD ARG2035 1.932 -1.492 -10.029 60 2HD ARG2035 1HD ARG2035 1.527 -2.818 -8.946 61 HE ARG2035 HE ARG2035 -0.836 -2.099 -10.064 62 1HH1 ARG2035 1HH1 ARG2035 2.252 -3.391 -11.195 63 2HH1 ARG2035 2HH1 ARG2035 1.677 -3.813 -12.738 64 1HH2 ARG2035 1HH2 ARG2035 -1.664 -2.781 -12.168 65 2HH2 ARG2035 2HH2 ARG2035 -0.594 -3.502 -13.281 66 H ILE2036 H ILE2036 2.512 -0.245 -4.177 67 HA ILE2036 HA ILE2036 0.079 -1.289 -3.031 68 HB ILE2036 HB ILE2036 2.213 0.504 -1.852 69 1HG1 ILE2036 2HG1 ILE2036 3.111 -1.667 -2.366 70 2HG1 ILE2036 1HG1 ILE2036 2.900 -1.489 -0.626 71 1HG2 ILE2036 2HG2 ILE2036 0.080 0.804 -0.703 72 2HG2 ILE2036 1HG2 ILE2036 -0.041 -0.936 -0.463 73 3HG2 ILE2036 3HG2 ILE2036 1.246 -0.030 0.330 74 1HD1 ILE2036 2HD1 ILE2036 0.852 -2.836 -0.758 75 2HD1 ILE2036 1HD1 ILE2036 1.112 -3.055 -2.484 76 3HD1 ILE2036 3HD1 ILE2036 2.267 -3.720 -1.326 77 HA PRO2037 HA PRO2037 -2.167 2.385 -4.168 78 1HB PRO2037 2HB PRO2037 -4.347 1.923 -2.548 79 2HB PRO2037 1HB PRO2037 -4.135 1.156 -4.122 80 1HG PRO2037 2HG PRO2037 -3.601 0.065 -1.404 81 2HG PRO2037 1HG PRO2037 -4.283 -0.741 -2.827 82 1HD PRO2037 2HD PRO2037 -1.723 -1.064 -2.036 83 2HD PRO2037 1HD PRO2037 -2.209 -1.145 -3.739 84 H VAL2038 H VAL2038 -1.739 4.293 -3.368 85 HA VAL2038 HA VAL2038 -1.629 4.610 -0.457 86 HB VAL2038 HB VAL2038 0.013 6.463 -0.792 87 1HG1 VAL2038 1HG1 VAL2038 0.893 3.783 -1.852 88 2HG1 VAL2038 3HG1 VAL2038 1.958 5.047 -1.238 89 3HG1 VAL2038 2HG1 VAL2038 0.812 4.263 -0.154 90 1HG2 VAL2038 3HG2 VAL2038 0.105 5.443 -3.628 91 2HG2 VAL2038 2HG2 VAL2038 -0.499 7.018 -3.103 92 3HG2 VAL2038 1HG2 VAL2038 1.209 6.629 -2.930 93 H ILE2039 H ILE2039 -2.342 6.589 0.361 94 HA ILE2039 HA ILE2039 -3.998 8.081 -1.509 95 HB ILE2039 HB ILE2039 -5.460 6.438 -0.437 96 1HG1 ILE2039 2HG1 ILE2039 -5.977 9.222 0.650 97 2HG1 ILE2039 1HG1 ILE2039 -6.367 8.688 -0.979 98 1HG2 ILE2039 2HG2 ILE2039 -4.237 6.022 1.609 99 2HG2 ILE2039 1HG2 ILE2039 -4.605 7.644 2.188 100 3HG2 ILE2039 3HG2 ILE2039 -5.902 6.467 1.978 101 1HD1 ILE2039 2HD1 ILE2039 -7.944 7.060 -0.049 102 2HD1 ILE2039 1HD1 ILE2039 -7.552 7.616 1.574 103 3HD1 ILE2039 3HD1 ILE2039 -8.334 8.712 0.434 104 H ASN2040 H ASN2040 -4.005 10.140 -1.251 105 HA ASN2040 HA ASN2040 -2.356 11.469 0.736 106 1HB ASN2040 2HB ASN2040 -2.555 12.308 -1.620 107 2HB ASN2040 1HB ASN2040 -4.270 12.560 -1.371 108 1HD2 ASN2040 1HD2 ASN2040 -2.288 14.492 -2.208 109 2HD2 ASN2040 2HD2 ASN2040 -2.322 15.733 -1.024 110 H LYS2041 H LYS2041 -3.147 11.943 2.711 111 HA LYS2041 HA LYS2041 -5.892 11.376 3.326 112 1HB LYS2041 2HB LYS2041 -3.739 12.600 5.042 113 2HB LYS2041 1HB LYS2041 -5.337 12.152 5.617 114 1HG LYS2041 2HG LYS2041 -4.864 9.815 4.999 115 2HG LYS2041 1HG LYS2041 -3.237 10.297 4.518 116 1HD LYS2041 2HD LYS2041 -2.780 11.076 6.780 117 2HD LYS2041 1HD LYS2041 -4.417 10.645 7.266 118 1HE LYS2041 2HE LYS2041 -3.935 8.293 6.735 119 2HE LYS2041 1HE LYS2041 -2.301 8.745 6.273 120 1HZ LYS2041 3HZ LYS2041 -1.964 9.546 8.561 121 2HZ LYS2041 2HZ LYS2041 -3.502 8.980 8.958 122 3HZ LYS2041 1HZ LYS2041 -2.310 7.888 8.491 123 H VAL2042 H VAL2042 -4.121 14.247 2.625 124 HA VAL2042 HA VAL2042 -6.068 16.027 3.758 125 HB VAL2042 HB VAL2042 -3.834 16.660 1.810 126 1HG1 VAL2042 2HG1 VAL2042 -5.365 18.450 3.689 127 2HG1 VAL2042 1HG1 VAL2042 -3.992 18.934 2.698 128 3HG1 VAL2042 3HG1 VAL2042 -5.497 18.420 1.930 129 1HG2 VAL2042 3HG2 VAL2042 -2.930 15.593 3.810 130 2HG2 VAL2042 2HG2 VAL2042 -2.506 17.300 3.779 131 3HG2 VAL2042 1HG2 VAL2042 -3.806 16.729 4.830 132 H ASP2043 H ASP2043 -5.004 15.235 0.509 133 HA ASP2043 HA ASP2043 -7.252 16.651 -0.624 134 1HB ASP2043 2HB ASP2043 -4.957 15.189 -1.898 135 2HB ASP2043 1HB ASP2043 -6.284 15.873 -2.832 136 H GLY2044 H GLY2044 -6.382 13.281 -0.134 137 1HA GLY2044 1HA GLY2044 -9.085 12.534 -0.900 138 2HA GLY2044 2HA GLY2044 -7.913 11.544 -0.040 139 H THR2045 H THR2045 -6.041 12.708 -2.227 140 HA THR2045 HA THR2045 -6.799 11.515 -4.627 141 HB THR2045 HB THR2045 -4.008 12.221 -3.703 142 HG1 THR2045 1HG THR2045 -5.580 14.073 -5.086 143 1HG2 THR2045 2HG2 THR2045 -5.341 12.261 -6.432 144 2HG2 THR2045 1HG2 THR2045 -3.682 12.758 -6.090 145 3HG2 THR2045 3HG2 THR2045 -4.162 11.074 -5.887 146 H LEU2046 H LEU2046 -6.916 9.347 -4.893 147 HA LEU2046 HA LEU2046 -5.178 7.601 -3.323 148 1HB LEU2046 2HB LEU2046 -7.582 7.168 -3.190 149 2HB LEU2046 1HB LEU2046 -7.666 7.012 -4.932 150 HG LEU2046 HG LEU2046 -6.187 5.018 -4.774 151 1HD1 LEU2046 1HD1 LEU2046 -6.623 5.337 -1.820 152 2HD1 LEU2046 3HD1 LEU2046 -5.906 3.927 -2.601 153 3HD1 LEU2046 2HD1 LEU2046 -5.085 5.489 -2.672 154 1HD2 LEU2046 3HD2 LEU2046 -8.757 4.904 -3.211 155 2HD2 LEU2046 2HD2 LEU2046 -8.577 4.768 -4.965 156 3HD2 LEU2046 1HD2 LEU2046 -7.912 3.519 -3.913 157 H LEU2047 H LEU2047 -3.523 6.686 -4.285 158 HA LEU2047 HA LEU2047 -3.333 6.853 -7.214 159 1HB LEU2047 2HB LEU2047 -1.135 6.425 -5.196 160 2HB LEU2047 1HB LEU2047 -0.928 6.597 -6.923 161 HG LEU2047 HG LEU2047 -1.836 8.728 -5.001 162 1HD1 LEU2047 2HD1 LEU2047 0.663 8.435 -6.648 163 2HD1 LEU2047 1HD1 LEU2047 0.253 9.829 -5.649 164 3HD1 LEU2047 3HD1 LEU2047 0.542 8.257 -4.900 165 1HD2 LEU2047 3HD2 LEU2047 -1.476 8.873 -7.993 166 2HD2 LEU2047 2HD2 LEU2047 -3.006 8.977 -7.118 167 3HD2 LEU2047 1HD2 LEU2047 -1.798 10.241 -6.926 168 H VAL2048 H VAL2048 -3.826 5.146 -8.208 169 HA VAL2048 HA VAL2048 -3.008 2.554 -7.122 170 HB VAL2048 HB VAL2048 -5.015 1.525 -8.180 171 1HG1 VAL2048 3HG1 VAL2048 -5.658 3.653 -6.157 172 2HG1 VAL2048 2HG1 VAL2048 -6.684 2.271 -6.543 173 3HG1 VAL2048 1HG1 VAL2048 -5.098 2.016 -5.813 174 1HG2 VAL2048 1HG2 VAL2048 -5.480 3.218 -9.872 175 2HG2 VAL2048 3HG2 VAL2048 -6.904 2.930 -8.876 176 3HG2 VAL2048 2HG2 VAL2048 -5.927 4.376 -8.619 177 H GLY2049 H GLY2049 -2.903 0.922 -8.895 178 1HA GLY2049 1HA GLY2049 -2.730 1.844 -11.592 179 2HA GLY2049 2HA GLY2049 -2.322 0.235 -11.001 180 H GLU2050 H GLU2050 -0.932 2.098 -12.842 181 HA GLU2050 HA GLU2050 1.658 1.617 -11.656 182 1HB GLU2050 2HB GLU2050 0.948 2.537 -14.435 183 2HB GLU2050 1HB GLU2050 2.556 2.081 -13.889 184 1HG GLU2050 2HG GLU2050 1.680 -0.180 -13.367 185 2HG GLU2050 1HG GLU2050 0.143 0.302 -14.087 186 H ASP2051 H ASP2051 -0.346 3.964 -11.293 187 HA ASP2051 HA ASP2051 1.544 6.185 -11.435 188 1HB ASP2051 2HB ASP2051 -1.337 5.903 -10.721 189 2HB ASP2051 1HB ASP2051 -0.487 7.426 -10.455 190 H ALA2052 H ALA2052 0.574 3.729 -9.424 191 HA ALA2052 HA ALA2052 1.028 5.117 -6.931 192 1HB ALA2052 3HB ALA2052 0.453 2.918 -5.935 193 2HB ALA2052 1HB ALA2052 0.313 2.247 -7.561 194 3HB ALA2052 2HB ALA2052 -0.795 3.512 -7.029 195 HA PRO2053 HA PRO2053 5.284 4.005 -6.783 196 1HB PRO2053 2HB PRO2053 5.657 3.670 -4.108 197 2HB PRO2053 1HB PRO2053 5.480 5.255 -4.863 198 1HG PRO2053 2HG PRO2053 3.427 3.602 -3.445 199 2HG PRO2053 1HG PRO2053 3.742 5.344 -3.322 200 1HD PRO2053 2HD PRO2053 1.728 4.350 -4.799 201 2HD PRO2053 1HD PRO2053 2.624 5.806 -5.285 202 H ARG2054 H ARG2054 6.537 2.253 -6.857 203 HA ARG2054 HA ARG2054 5.474 -0.365 -6.675 204 1HB ARG2054 2HB ARG2054 7.185 0.367 -8.272 205 2HB ARG2054 1HB ARG2054 8.243 0.815 -6.954 206 1HG ARG2054 2HG ARG2054 8.484 -1.504 -6.348 207 2HG ARG2054 1HG ARG2054 7.384 -1.960 -7.664 208 1HD ARG2054 2HD ARG2054 8.885 -1.034 -9.312 209 2HD ARG2054 1HD ARG2054 9.939 -0.405 -8.059 210 HE ARG2054 HE ARG2054 9.761 -3.195 -7.786 211 1HH1 ARG2054 1HH1 ARG2054 11.002 -0.844 -10.139 212 2HH1 ARG2054 2HH1 ARG2054 12.335 -1.801 -10.580 213 1HH2 ARG2054 1HH2 ARG2054 11.564 -4.496 -8.427 214 2HH2 ARG2054 2HH2 ARG2054 12.680 -3.899 -9.597 215 H ARG2055 H ARG2055 5.807 -1.834 -4.897 216 HA ARG2055 HA ARG2055 5.957 -0.707 -2.376 217 1HB ARG2055 2HB ARG2055 4.951 -2.907 -2.713 218 2HB ARG2055 1HB ARG2055 6.529 -3.589 -3.073 219 1HG ARG2055 2HG ARG2055 5.923 -4.154 -0.832 220 2HG ARG2055 1HG ARG2055 7.264 -2.982 -0.772 221 1HD ARG2055 2HD ARG2055 5.345 -1.233 -0.529 222 2HD ARG2055 1HD ARG2055 4.365 -2.646 -0.140 223 HE ARG2055 HE ARG2055 6.477 -1.462 1.457 224 1HH1 ARG2055 1HH1 ARG2055 4.371 -4.297 1.143 225 2HH1 ARG2055 2HH1 ARG2055 4.214 -4.570 2.773 226 1HH2 ARG2055 1HH2 ARG2055 6.151 -1.736 3.779 227 2HH2 ARG2055 2HH2 ARG2055 5.226 -3.054 4.333 228 H ALA2056 H ALA2056 8.534 -1.933 -4.306 229 HA ALA2056 HA ALA2056 10.565 -2.071 -2.388 230 1HB ALA2056 2HB ALA2056 12.131 -1.952 -4.246 231 2HB ALA2056 3HB ALA2056 10.858 -1.342 -5.300 232 3HB ALA2056 1HB ALA2056 10.759 -2.985 -4.662 233 H GLU2057 H GLU2057 9.152 0.752 -3.931 234 HA GLU2057 HA GLU2057 11.347 2.428 -2.899 235 1HB GLU2057 2HB GLU2057 10.691 4.087 -4.487 236 2HB GLU2057 1HB GLU2057 10.717 2.553 -5.341 237 1HG GLU2057 2HG GLU2057 8.261 2.403 -5.071 238 2HG GLU2057 1HG GLU2057 8.277 3.992 -4.322 239 H LEU2058 H LEU2058 8.399 1.311 -2.092 240 HA LEU2058 HA LEU2058 6.725 3.430 -1.569 241 1HB LEU2058 2HB LEU2058 6.051 1.115 -1.698 242 2HB LEU2058 1HB LEU2058 6.871 0.739 -0.209 243 HG LEU2058 HG LEU2058 4.379 0.801 -0.077 244 1HD1 LEU2058 2HD1 LEU2058 5.652 1.082 1.952 245 2HD1 LEU2058 1HD1 LEU2058 5.731 2.823 1.666 246 3HD1 LEU2058 3HD1 LEU2058 4.177 2.053 1.986 247 1HD2 LEU2058 2HD2 LEU2058 3.951 2.600 -1.623 248 2HD2 LEU2058 1HD2 LEU2058 3.226 2.951 -0.057 249 3HD2 LEU2058 3HD2 LEU2058 4.720 3.756 -0.533 250 H GLU2059 H GLU2059 9.095 2.017 0.685 251 HA GLU2059 HA GLU2059 8.210 3.557 2.869 252 1HB GLU2059 2HB GLU2059 9.528 1.549 3.209 253 2HB GLU2059 1HB GLU2059 10.898 2.283 2.389 254 1HG GLU2059 2HG GLU2059 11.168 3.887 4.142 255 2HG GLU2059 1HG GLU2059 9.687 3.343 4.923 256 H MET2060 H MET2060 10.975 4.052 0.705 257 HA MET2060 HA MET2060 11.711 6.562 1.805 258 1HB MET2060 2HB MET2060 12.248 5.394 -0.921 259 2HB MET2060 1HB MET2060 12.884 6.934 -0.402 260 1HG MET2060 2HG MET2060 13.479 4.348 1.028 261 2HG MET2060 1HG MET2060 14.449 4.944 -0.307 262 1HE MET2060 2HE MET2060 13.601 5.101 3.450 263 2HE MET2060 1HE MET2060 14.473 6.523 4.030 264 3HE MET2060 3HE MET2060 12.975 6.725 3.149 265 H TRP2061 H TRP2061 9.444 5.664 -0.660 266 HA TRP2061 HA TRP2061 8.923 8.221 -1.677 267 1HB TRP2061 2HB TRP2061 8.243 6.008 -2.693 268 2HB TRP2061 1HB TRP2061 6.980 5.910 -1.473 269 HD1 TRP2061 HD TRP2061 7.945 7.783 -4.651 270 HE1 TRP2061 1HE TRP2061 5.882 8.996 -5.561 271 HE3 TRP2061 3HE TRP2061 4.736 6.932 -0.765 272 HZ2 TRP2061 2HZ TRP2061 3.243 9.539 -4.746 273 HZ3 TRP2061 3HZ TRP2061 2.463 7.842 -0.916 274 HH2 TRP2061 HH TRP2061 1.732 9.116 -2.865 275 H LEU2062 H LEU2062 7.234 6.327 0.846 276 HA LEU2062 HA LEU2062 5.423 8.347 1.560 277 1HB LEU2062 2HB LEU2062 6.446 6.015 3.144 278 2HB LEU2062 1HB LEU2062 5.252 7.123 3.784 279 HG LEU2062 HG LEU2062 4.920 5.319 1.378 280 1HD1 LEU2062 1HD1 LEU2062 4.844 4.170 3.521 281 2HD1 LEU2062 3HD1 LEU2062 3.623 5.309 4.096 282 3HD1 LEU2062 2HD1 LEU2062 3.255 4.226 2.753 283 1HD2 LEU2062 2HD2 LEU2062 2.965 7.255 2.631 284 2HD2 LEU2062 1HD2 LEU2062 3.709 7.428 1.044 285 3HD2 LEU2062 3HD2 LEU2062 2.599 6.098 1.356 286 H GLN2063 H GLN2063 8.682 7.801 2.608 287 HA GLN2063 HA GLN2063 8.743 9.609 4.742 288 1HB GLN2063 2HB GLN2063 10.865 8.689 2.838 289 2HB GLN2063 1HB GLN2063 11.201 9.754 4.192 290 1HG GLN2063 2HG GLN2063 10.056 6.976 4.352 291 2HG GLN2063 1HG GLN2063 11.714 7.446 4.735 292 1HE2 GLN2063 1HE2 GLN2063 12.110 8.645 6.597 293 2HE2 GLN2063 2HE2 GLN2063 10.964 8.709 7.881 294 H GLY2064 H GLY2064 8.884 10.123 1.310 295 1HA GLY2064 1HA GLY2064 9.446 12.071 0.130 296 2HA GLY2064 2HA GLY2064 9.579 12.942 1.656 297 H HIS2065 H HIS2065 6.815 11.065 1.529 298 HA HIS2065 HA HIS2065 5.185 13.388 0.824 299 1HB HIS2065 2HB HIS2065 4.678 10.523 -0.030 300 2HB HIS2065 1HB HIS2065 3.490 11.805 -0.156 301 HD1 HIS2065 1HD HIS2065 3.601 13.253 -2.272 302 HD2 HIS2065 2HD HIS2065 6.932 10.815 -1.768 303 HE1 HIS2065 1HE HIS2065 4.889 13.381 -4.410 304 HA PRO2066 HA PRO2066 4.145 11.717 4.991 305 1HB PRO2066 2HB PRO2066 3.739 14.164 6.144 306 2HB PRO2066 1HB PRO2066 5.303 13.352 6.089 307 1HG PRO2066 2HG PRO2066 4.266 15.568 4.392 308 2HG PRO2066 1HG PRO2066 5.911 15.262 4.982 309 1HD PRO2066 2HD PRO2066 5.068 14.750 2.438 310 2HD PRO2066 1HD PRO2066 6.411 13.914 3.237 311 H GLU2067 H GLU2067 2.551 13.897 2.852 312 HA GLU2067 HA GLU2067 0.045 13.984 4.253 313 1HB GLU2067 2HB GLU2067 0.502 14.582 1.321 314 2HB GLU2067 1HB GLU2067 -0.801 15.169 2.342 315 1HG GLU2067 2HG GLU2067 2.107 15.936 2.511 316 2HG GLU2067 1HG GLU2067 0.784 16.942 1.930 317 H PHE2068 H PHE2068 1.624 11.791 2.240 318 HA PHE2068 HA PHE2068 -0.826 10.391 1.503 319 1HB PHE2068 2HB PHE2068 2.005 10.198 0.516 320 2HB PHE2068 1HB PHE2068 0.837 8.927 0.214 321 HD1 PHE2068 1HD PHE2068 -0.706 9.096 -1.514 322 HD2 PHE2068 2HD PHE2068 1.560 12.513 -0.394 323 HE1 PHE2068 1HE PHE2068 -1.478 10.263 -3.535 324 HE2 PHE2068 2HE PHE2068 0.793 13.681 -2.412 325 HZ PHE2068 HZ PHE2068 -0.726 12.556 -3.988 326 H ALA2069 H ALA2069 -1.032 8.238 1.955 327 HA ALA2069 HA ALA2069 0.841 6.977 3.767 328 1HB ALA2069 1HB ALA2069 -0.717 8.118 5.223 329 2HB ALA2069 2HB ALA2069 -0.980 6.375 5.283 330 3HB ALA2069 3HB ALA2069 -2.084 7.403 4.367 331 H VAL2070 H VAL2070 -0.009 4.688 4.094 332 HA VAL2070 HA VAL2070 -0.655 3.621 1.529 333 HB VAL2070 HB VAL2070 0.936 2.375 2.867 334 1HG1 VAL2070 2HG1 VAL2070 -1.183 2.208 4.990 335 2HG1 VAL2070 1HG1 VAL2070 0.367 1.361 5.021 336 3HG1 VAL2070 3HG1 VAL2070 0.324 3.120 5.063 337 1HG2 VAL2070 2HG2 VAL2070 -0.532 0.978 1.501 338 2HG2 VAL2070 1HG2 VAL2070 -0.076 0.138 2.986 339 3HG2 VAL2070 3HG2 VAL2070 -1.679 0.865 2.832 340 H ASP2071 H ASP2071 -2.538 2.643 0.908 341 HA ASP2071 HA ASP2071 -4.968 3.674 1.652 342 1HB ASP2071 2HB ASP2071 -4.453 2.463 -0.451 343 2HB ASP2071 1HB ASP2071 -4.408 0.959 0.451 344 HA PRO2072 HA PRO2072 -5.453 1.651 5.646 345 1HB PRO2072 2HB PRO2072 -7.975 2.587 6.164 346 2HB PRO2072 1HB PRO2072 -6.507 3.526 6.433 347 1HG PRO2072 2HG PRO2072 -8.422 3.623 4.140 348 2HG PRO2072 1HG PRO2072 -7.601 4.955 4.966 349 1HD PRO2072 2HD PRO2072 -6.796 4.002 2.578 350 2HD PRO2072 1HD PRO2072 -5.651 4.649 3.773 351 H ARG2073 H ARG2073 -7.647 1.382 3.021 352 HA ARG2073 HA ARG2073 -9.222 -0.769 4.045 353 1HB ARG2073 2HB ARG2073 -10.246 0.517 2.400 354 2HB ARG2073 1HB ARG2073 -8.796 0.586 1.428 355 1HG ARG2073 2HG ARG2073 -9.165 -1.889 0.990 356 2HG ARG2073 1HG ARG2073 -10.775 -1.652 1.681 357 1HD ARG2073 2HD ARG2073 -10.735 -1.420 -0.777 358 2HD ARG2073 1HD ARG2073 -11.269 0.051 0.046 359 HE ARG2073 HE ARG2073 -8.656 0.549 -0.231 360 1HH1 ARG2073 1HH1 ARG2073 -10.951 -0.660 -2.632 361 2HH1 ARG2073 2HH1 ARG2073 -10.119 0.030 -3.956 362 1HH2 ARG2073 1HH2 ARG2073 -7.625 1.576 -1.968 363 2HH2 ARG2073 2HH2 ARG2073 -8.183 1.333 -3.581 364 H PHE2074 H PHE2074 -6.427 -0.425 1.915 365 HA PHE2074 HA PHE2074 -6.012 -3.174 1.435 366 1HB PHE2074 2HB PHE2074 -4.926 -1.318 0.098 367 2HB PHE2074 1HB PHE2074 -3.913 -0.982 1.494 368 HD1 PHE2074 1HD PHE2074 -1.927 -2.197 1.866 369 HD2 PHE2074 2HD PHE2074 -4.732 -3.543 -1.042 370 HE1 PHE2074 1HE PHE2074 -0.290 -3.845 1.052 371 HE2 PHE2074 2HE PHE2074 -3.098 -5.186 -1.863 372 HZ PHE2074 HZ PHE2074 -0.877 -5.343 -0.819 373 H LEU2075 H LEU2075 -5.055 -1.047 4.028 374 HA LEU2075 HA LEU2075 -3.376 -2.861 5.418 375 1HB LEU2075 2HB LEU2075 -5.066 -0.602 6.474 376 2HB LEU2075 1HB LEU2075 -3.905 -1.488 7.436 377 HG LEU2075 HG LEU2075 -3.253 0.233 5.041 378 1HD1 LEU2075 3HD1 LEU2075 -2.796 0.637 7.987 379 2HD1 LEU2075 2HD1 LEU2075 -2.216 1.704 6.712 380 3HD1 LEU2075 1HD1 LEU2075 -3.947 1.527 6.998 381 1HD2 LEU2075 2HD2 LEU2075 -1.480 -1.279 6.957 382 2HD2 LEU2075 1HD2 LEU2075 -1.707 -1.636 5.247 383 3HD2 LEU2075 3HD2 LEU2075 -0.917 -0.138 5.740 384 H ALA2076 H ALA2076 -6.836 -2.283 5.501 385 HA ALA2076 HA ALA2076 -7.408 -4.162 7.540 386 1HB ALA2076 3HB ALA2076 -9.733 -4.001 6.762 387 2HB ALA2076 2HB ALA2076 -8.998 -2.405 6.922 388 3HB ALA2076 1HB ALA2076 -9.190 -3.136 5.325 389 H TYR2077 H TYR2077 -7.136 -4.324 4.078 390 HA TYR2077 HA TYR2077 -8.051 -6.898 3.472 391 1HB TYR2077 2HB TYR2077 -7.336 -5.107 1.861 392 2HB TYR2077 1HB TYR2077 -5.668 -5.499 2.254 393 HD1 TYR2077 1HD TYR2077 -8.728 -6.666 0.655 394 HD2 TYR2077 2HD TYR2077 -4.626 -7.489 1.353 395 HE1 TYR2077 1HE TYR2077 -8.807 -8.376 -1.054 396 HE2 TYR2077 2HE TYR2077 -4.667 -9.220 -0.382 397 HH TYR2077 HH TYR2077 -7.161 -9.520 -2.616 398 H MET2078 H MET2078 -4.995 -5.841 4.813 399 HA MET2078 HA MET2078 -3.541 -8.260 4.648 400 1HB MET2078 2HB MET2078 -3.339 -6.040 6.690 401 2HB MET2078 1HB MET2078 -2.169 -7.332 6.511 402 1HG MET2078 2HG MET2078 -1.612 -6.538 4.279 403 2HG MET2078 1HG MET2078 -2.825 -5.265 4.421 404 1HE MET2078 3HE MET2078 0.306 -4.814 3.697 405 2HE MET2078 2HE MET2078 -0.878 -3.508 3.745 406 3HE MET2078 1HE MET2078 0.639 -3.356 4.633 407 H GLU2079 H GLU2079 -5.679 -6.961 7.103 408 HA GLU2079 HA GLU2079 -5.291 -9.057 9.010 409 1HB GLU2079 2HB GLU2079 -7.284 -6.827 8.753 410 2HB GLU2079 1HB GLU2079 -7.284 -7.961 10.093 411 1HG GLU2079 2HG GLU2079 -4.921 -6.267 9.358 412 2HG GLU2079 1HG GLU2079 -6.153 -5.767 10.519 413 H ASP2080 H ASP2080 -7.698 -8.199 6.640 414 HA ASP2080 HA ASP2080 -9.510 -10.250 7.322 415 1HB ASP2080 2HB ASP2080 -9.268 -8.561 4.854 416 2HB ASP2080 1HB ASP2080 -10.481 -9.826 5.000 417 H ARG2081 H ARG2081 -6.891 -10.057 5.014 418 HA ARG2081 HA ARG2081 -5.644 -11.608 3.964 419 1HB ARG2081 2HB ARG2081 -7.263 -13.720 5.413 420 2HB ARG2081 1HB ARG2081 -5.700 -13.947 4.643 421 1HG ARG2081 2HG ARG2081 -4.574 -12.726 6.309 422 2HG ARG2081 1HG ARG2081 -6.077 -12.026 6.922 423 1HD ARG2081 2HD ARG2081 -5.212 -14.901 7.102 424 2HD ARG2081 1HD ARG2081 -5.333 -13.749 8.429 425 HE ARG2081 HE ARG2081 -7.809 -13.923 7.124 426 1HH1 ARG2081 1HH1 ARG2081 -5.797 -15.724 9.401 427 2HH1 ARG2081 2HH1 ARG2081 -7.054 -16.721 9.958 428 1HH2 ARG2081 1HH2 ARG2081 -9.541 -15.294 7.868 429 2HH2 ARG2081 2HH2 ARG2081 -9.273 -16.435 9.091 430 H ARG2082 H ARG2082 -8.861 -13.038 4.242 431 HA ARG2082 HA ARG2082 -9.032 -13.054 1.324 432 1HB ARG2082 2HB ARG2082 -8.942 -15.342 2.377 433 2HB ARG2082 1HB ARG2082 -10.394 -14.940 3.272 434 1HG ARG2082 2HG ARG2082 -11.687 -14.845 1.269 435 2HG ARG2082 1HG ARG2082 -10.240 -15.007 0.272 436 1HD ARG2082 2HD ARG2082 -11.395 -17.144 0.402 437 2HD ARG2082 1HD ARG2082 -9.850 -17.239 1.237 438 HE ARG2082 HE ARG2082 -12.259 -16.690 2.792 439 1HH1 ARG2082 1HH1 ARG2082 -9.647 -18.966 2.028 440 2HH1 ARG2082 2HH1 ARG2082 -10.038 -20.059 3.259 441 1HH2 ARG2082 1HH2 ARG2082 -12.810 -18.149 4.420 442 2HH2 ARG2082 2HH2 ARG2082 -11.931 -19.588 4.692 443 H LYS2083 H LYS2083 -9.820 -11.036 1.288 444 HA LYS2083 HA LYS2083 -12.105 -10.322 2.948 445 1HB LYS2083 2HB LYS2083 -10.047 -8.891 2.809 446 2HB LYS2083 1HB LYS2083 -10.447 -8.580 1.133 447 1HG LYS2083 2HG LYS2083 -12.507 -7.494 1.794 448 2HG LYS2083 1HG LYS2083 -12.181 -7.878 3.487 449 1HD LYS2083 2HD LYS2083 -10.107 -6.552 3.357 450 2HD LYS2083 1HD LYS2083 -10.522 -6.100 1.699 451 1HE LYS2083 2HE LYS2083 -11.146 -4.343 3.276 452 2HE LYS2083 1HE LYS2083 -12.565 -5.044 2.504 453 1HZ LYS2083 2HZ LYS2083 -11.601 -5.891 5.191 454 2HZ LYS2083 1HZ LYS2083 -12.801 -4.705 4.924 455 3HZ LYS2083 3HZ LYS2083 -13.039 -6.293 4.459 456 H GLN2084 H GLN2084 -11.303 -11.152 -0.278 457 HA GLN2084 HA GLN2084 -13.674 -9.943 -1.389 458 1HB GLN2084 2HB GLN2084 -11.780 -11.965 -2.586 459 2HB GLN2084 1HB GLN2084 -13.059 -11.126 -3.458 460 1HG GLN2084 2HG GLN2084 -11.946 -8.992 -3.000 461 2HG GLN2084 1HG GLN2084 -10.644 -9.846 -2.187 462 1HE2 GLN2084 1HE2 GLN2084 -10.752 -12.061 -4.164 463 2HE2 GLN2084 2HE2 GLN2084 -10.017 -11.411 -5.580 464 H LYS2085 H LYS2085 -15.592 -10.839 -1.564 465 HA LYS2085 HA LYS2085 -17.326 -12.213 -1.399 466 1HB LYS2085 2HB LYS2085 -15.279 -14.362 -1.936 467 2HB LYS2085 1HB LYS2085 -17.010 -14.650 -1.844 468 1HG LYS2085 2HG LYS2085 -17.413 -13.316 -3.779 469 2HG LYS2085 1HG LYS2085 -15.747 -12.731 -3.789 470 1HD LYS2085 2HD LYS2085 -16.108 -14.450 -5.488 471 2HD LYS2085 1HD LYS2085 -14.939 -14.967 -4.283 472 1HE LYS2085 2HE LYS2085 -16.766 -16.252 -3.157 473 2HE LYS2085 1HE LYS2085 -17.845 -15.793 -4.474 474 1HZ LYS2085 1HZ LYS2085 -15.346 -17.364 -4.743 475 2HZ LYS2085 3HZ LYS2085 -16.893 -17.999 -4.764 476 3HZ LYS2085 2HZ LYS2085 -16.399 -16.993 -6.013 No H/Q in entry = 476 Start of MODEL 10 1 H LEU2028 H LEU2028 5.112 -9.379 7.962 2 HA LEU2028 HA LEU2028 4.142 -10.993 5.720 3 1HB LEU2028 2HB LEU2028 2.710 -8.834 7.255 4 2HB LEU2028 1HB LEU2028 2.066 -9.644 5.838 5 HG LEU2028 HG LEU2028 2.696 -10.964 8.480 6 1HD1 LEU2028 3HD1 LEU2028 0.764 -9.491 8.594 7 2HD1 LEU2028 2HD1 LEU2028 0.074 -10.292 7.180 8 3HD1 LEU2028 1HD1 LEU2028 0.277 -11.187 8.681 9 1HD2 LEU2028 2HD2 LEU2028 1.443 -12.063 5.964 10 2HD2 LEU2028 1HD2 LEU2028 3.016 -12.506 6.625 11 3HD2 LEU2028 3HD2 LEU2028 1.543 -12.911 7.507 12 H ASP2029 H ASP2029 5.631 -10.382 4.285 13 HA ASP2029 HA ASP2029 5.515 -7.580 3.447 14 1HB ASP2029 2HB ASP2029 7.710 -8.028 4.335 15 2HB ASP2029 1HB ASP2029 7.846 -9.508 3.395 16 H VAL2030 H VAL2030 5.738 -7.226 1.180 17 HA VAL2030 HA VAL2030 4.361 -9.323 -0.360 18 HB VAL2030 HB VAL2030 3.775 -7.494 -1.952 19 1HG1 VAL2030 1HG1 VAL2030 2.231 -8.136 -0.188 20 2HG1 VAL2030 3HG1 VAL2030 2.997 -6.976 0.909 21 3HG1 VAL2030 2HG1 VAL2030 2.146 -6.405 -0.535 22 1HG2 VAL2030 2HG2 VAL2030 5.049 -5.711 0.127 23 2HG2 VAL2030 1HG2 VAL2030 5.641 -5.998 -1.516 24 3HG2 VAL2030 3HG2 VAL2030 4.107 -5.171 -1.262 25 H ASP2031 H ASP2031 7.451 -8.625 0.105 26 HA ASP2031 HA ASP2031 9.332 -9.049 -0.929 27 1HB ASP2031 2HB ASP2031 7.576 -10.166 -3.121 28 2HB ASP2031 1HB ASP2031 9.333 -10.201 -3.204 29 H LEU2032 H LEU2032 7.570 -6.675 -1.478 30 HA LEU2032 HA LEU2032 7.883 -4.537 -2.245 31 1HB LEU2032 2HB LEU2032 10.596 -5.492 -3.125 32 2HB LEU2032 1HB LEU2032 10.082 -3.826 -3.004 33 HG LEU2032 HG LEU2032 10.416 -5.737 -0.695 34 1HD1 LEU2032 2HD1 LEU2032 12.069 -3.397 -1.603 35 2HD1 LEU2032 1HD1 LEU2032 12.302 -4.309 -0.109 36 3HD1 LEU2032 3HD1 LEU2032 12.517 -5.104 -1.667 37 1HD2 LEU2032 3HD2 LEU2032 9.654 -2.816 -0.761 38 2HD2 LEU2032 2HD2 LEU2032 8.688 -4.178 -0.171 39 3HD2 LEU2032 1HD2 LEU2032 10.138 -3.700 0.687 40 H GLU2033 H GLU2033 7.803 -7.087 -4.334 41 HA GLU2033 HA GLU2033 8.336 -5.675 -6.764 42 1HB GLU2033 2HB GLU2033 7.757 -7.800 -7.852 43 2HB GLU2033 1HB GLU2033 8.983 -7.971 -6.600 44 1HG GLU2033 2HG GLU2033 7.506 -9.001 -5.124 45 2HG GLU2033 1HG GLU2033 6.090 -8.449 -6.018 46 H THR2034 H THR2034 5.780 -5.195 -4.982 47 HA THR2034 HA THR2034 3.954 -5.341 -7.266 48 HB THR2034 HB THR2034 3.326 -6.840 -5.282 49 HG1 THR2034 1HG THR2034 1.619 -6.475 -6.457 50 1HG2 THR2034 1HG2 THR2034 4.004 -5.333 -3.487 51 2HG2 THR2034 3HG2 THR2034 2.763 -4.182 -3.973 52 3HG2 THR2034 2HG2 THR2034 2.302 -5.762 -3.336 53 H ARG2035 H ARG2035 2.115 -3.591 -6.896 54 HA ARG2035 HA ARG2035 3.444 -1.090 -6.139 55 1HB ARG2035 2HB ARG2035 1.324 -1.568 -8.231 56 2HB ARG2035 1HB ARG2035 1.845 0.030 -7.713 57 1HG ARG2035 2HG ARG2035 4.146 -0.552 -8.385 58 2HG ARG2035 1HG ARG2035 3.542 -2.082 -9.013 59 1HD ARG2035 2HD ARG2035 2.645 0.632 -9.844 60 2HD ARG2035 1HD ARG2035 3.836 -0.342 -10.721 61 HE ARG2035 HE ARG2035 1.141 -1.395 -10.261 62 1HH1 ARG2035 1HH1 ARG2035 3.576 -0.183 -12.569 63 2HH1 ARG2035 2HH1 ARG2035 2.686 -0.686 -13.933 64 1HH2 ARG2035 1HH2 ARG2035 -0.049 -2.029 -12.174 65 2HH2 ARG2035 2HH2 ARG2035 0.605 -1.702 -13.717 66 H ILE2036 H ILE2036 2.640 -0.095 -4.450 67 HA ILE2036 HA ILE2036 0.237 -1.219 -3.249 68 HB ILE2036 HB ILE2036 2.338 0.607 -2.087 69 1HG1 ILE2036 2HG1 ILE2036 3.208 -1.597 -2.585 70 2HG1 ILE2036 1HG1 ILE2036 3.102 -1.331 -0.839 71 1HG2 ILE2036 3HG2 ILE2036 0.206 0.921 -0.960 72 2HG2 ILE2036 2HG2 ILE2036 0.077 -0.820 -0.692 73 3HG2 ILE2036 1HG2 ILE2036 1.355 0.099 0.097 74 1HD1 ILE2036 3HD1 ILE2036 1.077 -2.701 -0.786 75 2HD1 ILE2036 2HD1 ILE2036 1.227 -2.970 -2.526 76 3HD1 ILE2036 1HD1 ILE2036 2.462 -3.586 -1.429 77 HA PRO2037 HA PRO2037 -1.960 2.503 -4.415 78 1HB PRO2037 2HB PRO2037 -4.198 1.974 -2.907 79 2HB PRO2037 1HB PRO2037 -3.907 1.298 -4.513 80 1HG PRO2037 2HG PRO2037 -3.503 0.046 -1.835 81 2HG PRO2037 1HG PRO2037 -4.137 -0.674 -3.325 82 1HD PRO2037 2HD PRO2037 -1.617 -1.066 -2.460 83 2HD PRO2037 1HD PRO2037 -2.032 -1.038 -4.185 84 H VAL2038 H VAL2038 -1.950 4.434 -3.497 85 HA VAL2038 HA VAL2038 -1.693 4.626 -0.585 86 HB VAL2038 HB VAL2038 -0.203 6.617 -0.911 87 1HG1 VAL2038 3HG1 VAL2038 0.843 4.021 -2.013 88 2HG1 VAL2038 2HG1 VAL2038 1.813 5.364 -1.398 89 3HG1 VAL2038 1HG1 VAL2038 0.749 4.475 -0.306 90 1HG2 VAL2038 2HG2 VAL2038 -0.788 7.143 -3.211 91 2HG2 VAL2038 1HG2 VAL2038 0.951 6.888 -3.067 92 3HG2 VAL2038 3HG2 VAL2038 -0.075 5.628 -3.754 93 H ILE2039 H ILE2039 -2.370 6.655 0.279 94 HA ILE2039 HA ILE2039 -4.199 8.078 -1.484 95 HB ILE2039 HB ILE2039 -5.549 6.480 -0.199 96 1HG1 ILE2039 2HG1 ILE2039 -5.931 9.317 0.803 97 2HG1 ILE2039 1HG1 ILE2039 -6.514 8.697 -0.733 98 1HG2 ILE2039 2HG2 ILE2039 -4.420 7.790 2.270 99 2HG2 ILE2039 1HG2 ILE2039 -5.738 6.618 2.248 100 3HG2 ILE2039 3HG2 ILE2039 -4.122 6.138 1.723 101 1HD1 ILE2039 3HD1 ILE2039 -7.981 7.144 0.466 102 2HD1 ILE2039 2HD1 ILE2039 -7.393 7.789 2.000 103 3HD1 ILE2039 1HD1 ILE2039 -8.298 8.827 0.896 104 H ASN2040 H ASN2040 -4.183 10.181 -1.259 105 HA ASN2040 HA ASN2040 -2.302 11.416 0.562 106 1HB ASN2040 2HB ASN2040 -2.639 12.301 -1.762 107 2HB ASN2040 1HB ASN2040 -4.300 12.698 -1.352 108 1HD2 ASN2040 1HD2 ASN2040 -2.140 14.430 -2.278 109 2HD2 ASN2040 2HD2 ASN2040 -1.954 15.646 -1.074 110 H LYS2041 H LYS2041 -2.815 11.879 2.551 111 HA LYS2041 HA LYS2041 -5.445 11.471 3.529 112 1HB LYS2041 2HB LYS2041 -2.934 12.363 4.887 113 2HB LYS2041 1HB LYS2041 -4.451 12.035 5.726 114 1HG LYS2041 2HG LYS2041 -4.432 9.750 4.939 115 2HG LYS2041 1HG LYS2041 -2.968 10.057 4.012 116 1HD LYS2041 2HD LYS2041 -2.448 8.895 6.051 117 2HD LYS2041 1HD LYS2041 -1.780 10.532 6.078 118 1HE LYS2041 2HE LYS2041 -3.585 11.273 7.518 119 2HE LYS2041 1HE LYS2041 -4.354 9.688 7.398 120 1HZ LYS2041 3HZ LYS2041 -2.428 8.734 8.507 121 2HZ LYS2041 2HZ LYS2041 -1.728 10.256 8.667 122 3HZ LYS2041 1HZ LYS2041 -3.170 9.898 9.467 123 H VAL2042 H VAL2042 -3.715 14.223 2.486 124 HA VAL2042 HA VAL2042 -5.351 16.112 3.959 125 HB VAL2042 HB VAL2042 -3.285 16.623 1.801 126 1HG1 VAL2042 3HG1 VAL2042 -4.508 18.501 3.821 127 2HG1 VAL2042 2HG1 VAL2042 -3.210 18.909 2.702 128 3HG1 VAL2042 1HG1 VAL2042 -4.810 18.498 2.086 129 1HG2 VAL2042 3HG2 VAL2042 -2.268 15.493 3.702 130 2HG2 VAL2042 2HG2 VAL2042 -1.737 17.173 3.626 131 3HG2 VAL2042 1HG2 VAL2042 -2.959 16.687 4.802 132 H ASP2043 H ASP2043 -4.732 15.229 0.610 133 HA ASP2043 HA ASP2043 -6.982 16.810 -0.355 134 1HB ASP2043 2HB ASP2043 -5.008 16.705 -1.767 135 2HB ASP2043 1HB ASP2043 -5.118 14.948 -1.844 136 H GLY2044 H GLY2044 -6.138 13.366 -0.484 137 1HA GLY2044 1HA GLY2044 -9.014 12.787 -0.842 138 2HA GLY2044 2HA GLY2044 -7.929 11.795 0.119 139 H THR2045 H THR2045 -6.304 12.951 -2.526 140 HA THR2045 HA THR2045 -6.994 11.441 -4.717 141 HB THR2045 HB THR2045 -4.114 11.830 -3.897 142 HG1 THR2045 1HG THR2045 -6.005 13.794 -4.244 143 1HG2 THR2045 3HG2 THR2045 -4.546 10.583 -5.968 144 2HG2 THR2045 2HG2 THR2045 -5.508 11.931 -6.574 145 3HG2 THR2045 1HG2 THR2045 -3.781 12.138 -6.301 146 H LEU2046 H LEU2046 -7.228 9.238 -4.875 147 HA LEU2046 HA LEU2046 -5.478 7.551 -3.268 148 1HB LEU2046 2HB LEU2046 -7.914 7.171 -3.036 149 2HB LEU2046 1HB LEU2046 -8.033 6.895 -4.759 150 HG LEU2046 HG LEU2046 -6.557 4.902 -4.491 151 1HD1 LEU2046 1HD1 LEU2046 -5.431 5.512 -2.424 152 2HD1 LEU2046 3HD1 LEU2046 -6.962 5.408 -1.555 153 3HD1 LEU2046 2HD1 LEU2046 -6.253 3.960 -2.264 154 1HD2 LEU2046 1HD2 LEU2046 -8.966 4.691 -4.615 155 2HD2 LEU2046 3HD2 LEU2046 -8.276 3.480 -3.535 156 3HD2 LEU2046 2HD2 LEU2046 -9.088 4.903 -2.866 157 H LEU2047 H LEU2047 -3.898 6.606 -4.284 158 HA LEU2047 HA LEU2047 -3.799 6.655 -7.246 159 1HB LEU2047 2HB LEU2047 -1.553 6.430 -5.247 160 2HB LEU2047 1HB LEU2047 -1.381 6.515 -6.985 161 HG LEU2047 HG LEU2047 -2.381 8.741 -5.200 162 1HD1 LEU2047 3HD1 LEU2047 0.205 8.408 -6.705 163 2HD1 LEU2047 2HD1 LEU2047 -0.298 9.859 -5.833 164 3HD1 LEU2047 1HD1 LEU2047 -0.002 8.354 -4.958 165 1HD2 LEU2047 3HD2 LEU2047 -3.431 8.779 -7.429 166 2HD2 LEU2047 2HD2 LEU2047 -2.333 10.133 -7.189 167 3HD2 LEU2047 1HD2 LEU2047 -1.831 8.753 -8.168 168 H VAL2048 H VAL2048 -4.180 4.843 -8.206 169 HA VAL2048 HA VAL2048 -3.319 2.391 -6.879 170 HB VAL2048 HB VAL2048 -5.318 1.206 -7.658 171 1HG1 VAL2048 3HG1 VAL2048 -5.453 2.198 -5.443 172 2HG1 VAL2048 2HG1 VAL2048 -6.078 3.686 -6.148 173 3HG1 VAL2048 1HG1 VAL2048 -7.030 2.210 -6.231 174 1HG2 VAL2048 3HG2 VAL2048 -5.791 2.512 -9.671 175 2HG2 VAL2048 2HG2 VAL2048 -7.229 2.373 -8.662 176 3HG2 VAL2048 1HG2 VAL2048 -6.298 3.874 -8.672 177 H GLY2049 H GLY2049 -2.851 0.659 -8.388 178 1HA GLY2049 1HA GLY2049 -3.014 1.120 -11.196 179 2HA GLY2049 2HA GLY2049 -2.253 -0.240 -10.389 180 H GLU2050 H GLU2050 -1.687 2.353 -12.318 181 HA GLU2050 HA GLU2050 1.168 2.115 -11.847 182 1HB GLU2050 2HB GLU2050 -0.305 3.490 -14.084 183 2HB GLU2050 1HB GLU2050 1.434 3.248 -13.999 184 1HG GLU2050 2HG GLU2050 1.073 0.828 -14.039 185 2HG GLU2050 1HG GLU2050 -0.659 1.102 -14.184 186 H ASP2051 H ASP2051 -1.292 4.086 -11.015 187 HA ASP2051 HA ASP2051 0.225 6.530 -10.844 188 1HB ASP2051 2HB ASP2051 -2.394 5.589 -9.867 189 2HB ASP2051 1HB ASP2051 -1.799 7.178 -9.363 190 H ALA2052 H ALA2052 -0.168 3.690 -9.123 191 HA ALA2052 HA ALA2052 0.637 4.840 -6.606 192 1HB ALA2052 2HB ALA2052 0.148 2.586 -5.727 193 2HB ALA2052 3HB ALA2052 -0.262 2.059 -7.370 194 3HB ALA2052 1HB ALA2052 -1.214 3.325 -6.586 195 HA PRO2053 HA PRO2053 4.821 3.790 -7.745 196 1HB PRO2053 2HB PRO2053 5.477 3.929 -4.888 197 2HB PRO2053 1HB PRO2053 6.048 4.935 -6.219 198 1HG PRO2053 2HG PRO2053 4.344 5.882 -4.379 199 2HG PRO2053 1HG PRO2053 4.249 6.378 -6.079 200 1HD PRO2053 2HD PRO2053 2.588 4.374 -4.593 201 2HD PRO2053 1HD PRO2053 2.105 5.642 -5.751 202 H ARG2054 H ARG2054 6.454 2.255 -7.414 203 HA ARG2054 HA ARG2054 5.677 -0.400 -6.941 204 1HB ARG2054 2HB ARG2054 7.430 0.210 -8.483 205 2HB ARG2054 1HB ARG2054 8.324 1.040 -7.228 206 1HG ARG2054 2HG ARG2054 9.415 -0.977 -7.683 207 2HG ARG2054 1HG ARG2054 8.612 -1.140 -6.120 208 1HD ARG2054 2HD ARG2054 8.284 -3.134 -7.357 209 2HD ARG2054 1HD ARG2054 6.763 -2.247 -7.192 210 HE ARG2054 HE ARG2054 8.176 -1.643 -9.625 211 1HH1 ARG2054 1HH1 ARG2054 5.807 -3.874 -8.248 212 2HH1 ARG2054 2HH1 ARG2054 5.193 -4.374 -9.737 213 1HH2 ARG2054 1HH2 ARG2054 7.329 -2.351 -11.682 214 2HH2 ARG2054 2HH2 ARG2054 6.097 -3.537 -11.736 215 H ARG2055 H ARG2055 5.881 -1.596 -5.010 216 HA ARG2055 HA ARG2055 6.082 -0.253 -2.575 217 1HB ARG2055 2HB ARG2055 4.951 -2.399 -2.666 218 2HB ARG2055 1HB ARG2055 6.425 -3.195 -3.159 219 1HG ARG2055 2HG ARG2055 5.829 -3.617 -0.799 220 2HG ARG2055 1HG ARG2055 7.415 -2.869 -1.003 221 1HD ARG2055 2HD ARG2055 6.383 -0.672 -0.454 222 2HD ARG2055 1HD ARG2055 4.867 -1.510 -0.121 223 HE ARG2055 HE ARG2055 5.801 -2.469 1.759 224 1HH1 ARG2055 1HH1 ARG2055 8.263 -0.497 0.095 225 2HH1 ARG2055 2HH1 ARG2055 9.161 -0.200 1.499 226 1HH2 ARG2055 1HH2 ARG2055 7.109 -2.022 3.711 227 2HH2 ARG2055 2HH2 ARG2055 8.484 -1.002 3.589 228 H ALA2056 H ALA2056 8.585 -1.750 -4.470 229 HA ALA2056 HA ALA2056 10.655 -1.694 -2.590 230 1HB ALA2056 1HB ALA2056 12.157 -1.891 -4.453 231 2HB ALA2056 2HB ALA2056 10.923 -1.301 -5.562 232 3HB ALA2056 3HB ALA2056 10.728 -2.871 -4.781 233 H GLU2057 H GLU2057 9.275 0.887 -4.510 234 HA GLU2057 HA GLU2057 11.426 2.702 -3.574 235 1HB GLU2057 2HB GLU2057 10.734 4.253 -5.272 236 2HB GLU2057 1HB GLU2057 10.828 2.668 -6.022 237 1HG GLU2057 2HG GLU2057 8.362 2.457 -5.742 238 2HG GLU2057 1HG GLU2057 8.342 4.105 -5.138 239 H LEU2058 H LEU2058 8.385 1.721 -2.764 240 HA LEU2058 HA LEU2058 6.918 4.081 -2.424 241 1HB LEU2058 2HB LEU2058 5.954 1.844 -2.620 242 2HB LEU2058 1HB LEU2058 6.490 1.490 -0.988 243 HG LEU2058 HG LEU2058 5.192 3.670 -0.435 244 1HD1 LEU2058 2HD1 LEU2058 3.837 2.795 -2.948 245 2HD1 LEU2058 1HD1 LEU2058 3.161 3.902 -1.757 246 3HD1 LEU2058 3HD1 LEU2058 4.635 4.338 -2.617 247 1HD2 LEU2058 3HD2 LEU2058 3.939 0.975 -0.879 248 2HD2 LEU2058 2HD2 LEU2058 4.699 1.643 0.579 249 3HD2 LEU2058 1HD2 LEU2058 3.183 2.321 0.003 250 H GLU2059 H GLU2059 8.887 2.308 -0.080 251 HA GLU2059 HA GLU2059 7.701 3.498 2.194 252 1HB GLU2059 2HB GLU2059 8.974 1.378 2.154 253 2HB GLU2059 1HB GLU2059 10.450 2.313 1.958 254 1HG GLU2059 2HG GLU2059 10.163 3.304 4.090 255 2HG GLU2059 1HG GLU2059 8.574 2.553 4.265 256 H MET2060 H MET2060 10.762 4.095 0.637 257 HA MET2060 HA MET2060 11.431 6.406 2.101 258 1HB MET2060 2HB MET2060 12.330 5.627 -0.685 259 2HB MET2060 1HB MET2060 13.049 6.906 0.275 260 1HG MET2060 2HG MET2060 14.472 5.007 0.420 261 2HG MET2060 1HG MET2060 13.672 5.181 1.978 262 1HE MET2060 3HE MET2060 14.333 2.718 2.695 263 2HE MET2060 2HE MET2060 14.047 1.291 1.702 264 3HE MET2060 1HE MET2060 15.201 2.515 1.172 265 H TRP2061 H TRP2061 9.394 5.904 -0.644 266 HA TRP2061 HA TRP2061 9.173 8.619 -1.412 267 1HB TRP2061 2HB TRP2061 8.593 6.725 -2.915 268 2HB TRP2061 1HB TRP2061 7.228 6.345 -1.877 269 HD1 TRP2061 HD TRP2061 8.454 9.126 -4.241 270 HE1 TRP2061 1HE TRP2061 6.402 10.379 -5.140 271 HE3 TRP2061 3HE TRP2061 4.824 6.803 -1.502 272 HZ2 TRP2061 2HZ TRP2061 3.615 10.381 -4.757 273 HZ3 TRP2061 3HZ TRP2061 2.494 7.494 -1.826 274 HH2 TRP2061 HH TRP2061 1.901 9.243 -3.422 275 H LEU2062 H LEU2062 7.079 6.481 0.579 276 HA LEU2062 HA LEU2062 5.237 8.464 1.369 277 1HB LEU2062 2HB LEU2062 6.111 5.941 2.765 278 2HB LEU2062 1HB LEU2062 4.775 6.927 3.302 279 HG LEU2062 HG LEU2062 4.928 5.466 0.667 280 1HD1 LEU2062 2HD1 LEU2062 3.333 4.912 3.168 281 2HD1 LEU2062 1HD1 LEU2062 3.201 4.031 1.644 282 3HD1 LEU2062 3HD1 LEU2062 4.696 3.962 2.578 283 1HD2 LEU2062 3HD2 LEU2062 2.698 7.054 1.935 284 2HD2 LEU2062 2HD2 LEU2062 3.598 7.487 0.482 285 3HD2 LEU2062 1HD2 LEU2062 2.554 6.074 0.476 286 H GLN2063 H GLN2063 8.310 7.478 2.700 287 HA GLN2063 HA GLN2063 8.256 8.829 5.133 288 1HB GLN2063 2HB GLN2063 9.804 7.045 4.392 289 2HB GLN2063 1HB GLN2063 10.570 8.204 3.325 290 1HG GLN2063 2HG GLN2063 11.244 9.523 5.227 291 2HG GLN2063 1HG GLN2063 10.464 8.355 6.307 292 1HE2 GLN2063 1HE2 GLN2063 12.348 7.747 7.313 293 2HE2 GLN2063 2HE2 GLN2063 13.577 6.823 6.528 294 H GLY2064 H GLY2064 8.991 9.873 1.875 295 1HA GLY2064 1HA GLY2064 10.078 11.865 1.190 296 2HA GLY2064 2HA GLY2064 9.927 12.473 2.828 297 H HIS2065 H HIS2065 7.007 11.194 2.286 298 HA HIS2065 HA HIS2065 5.848 13.761 1.584 299 1HB HIS2065 2HB HIS2065 5.124 11.201 0.114 300 2HB HIS2065 1HB HIS2065 4.210 12.698 0.034 301 HD1 HIS2065 1HD HIS2065 7.071 10.932 -1.440 302 HD2 HIS2065 2HD HIS2065 5.588 14.802 -1.346 303 HE1 HIS2065 1HE HIS2065 8.145 12.147 -3.379 304 HA PRO2066 HA PRO2066 3.903 11.560 5.120 305 1HB PRO2066 2HB PRO2066 3.370 13.807 6.576 306 2HB PRO2066 1HB PRO2066 4.916 12.955 6.628 307 1HG PRO2066 2HG PRO2066 4.163 15.429 5.137 308 2HG PRO2066 1HG PRO2066 5.679 15.037 5.969 309 1HD PRO2066 2HD PRO2066 5.348 14.902 3.267 310 2HD PRO2066 1HD PRO2066 6.504 13.900 4.159 311 H GLU2067 H GLU2067 2.800 13.836 2.914 312 HA GLU2067 HA GLU2067 0.091 14.135 3.764 313 1HB GLU2067 2HB GLU2067 1.224 14.334 0.961 314 2HB GLU2067 1HB GLU2067 -0.376 14.850 1.440 315 1HG GLU2067 2HG GLU2067 0.983 16.776 1.205 316 2HG GLU2067 1HG GLU2067 0.697 16.531 2.928 317 H PHE2068 H PHE2068 1.877 11.780 2.027 318 HA PHE2068 HA PHE2068 -0.558 10.351 1.255 319 1HB PHE2068 2HB PHE2068 2.283 10.116 0.266 320 2HB PHE2068 1HB PHE2068 1.019 8.974 -0.155 321 HD1 PHE2068 1HD PHE2068 2.167 12.455 -0.536 322 HD2 PHE2068 2HD PHE2068 -0.613 9.489 -1.785 323 HE1 PHE2068 1HE PHE2068 1.522 13.874 -2.443 324 HE2 PHE2068 2HE PHE2068 -1.269 10.903 -3.694 325 HZ PHE2068 HZ PHE2068 -0.197 13.097 -4.022 326 H ALA2069 H ALA2069 -0.964 8.378 1.990 327 HA ALA2069 HA ALA2069 1.056 6.989 3.564 328 1HB ALA2069 3HB ALA2069 -0.361 8.168 5.183 329 2HB ALA2069 1HB ALA2069 -0.643 6.426 5.259 330 3HB ALA2069 2HB ALA2069 -1.797 7.473 4.432 331 H VAL2070 H VAL2070 0.373 4.720 3.846 332 HA VAL2070 HA VAL2070 -0.411 3.583 1.386 333 HB VAL2070 HB VAL2070 1.086 2.392 2.919 334 1HG1 VAL2070 1HG1 VAL2070 -1.277 2.185 4.755 335 2HG1 VAL2070 3HG1 VAL2070 0.264 1.360 4.987 336 3HG1 VAL2070 2HG1 VAL2070 0.186 3.121 5.036 337 1HG2 VAL2070 2HG2 VAL2070 -0.198 1.018 1.369 338 2HG2 VAL2070 1HG2 VAL2070 0.073 0.156 2.886 339 3HG2 VAL2070 3HG2 VAL2070 -1.499 0.879 2.554 340 H ASP2071 H ASP2071 -2.311 2.694 0.686 341 HA ASP2071 HA ASP2071 -4.721 3.767 1.516 342 1HB ASP2071 2HB ASP2071 -4.535 2.944 -0.722 343 2HB ASP2071 1HB ASP2071 -4.105 1.340 -0.155 344 HA PRO2072 HA PRO2072 -5.462 1.327 5.186 345 1HB PRO2072 2HB PRO2072 -7.893 2.399 5.755 346 2HB PRO2072 1HB PRO2072 -6.363 3.198 6.133 347 1HG PRO2072 2HG PRO2072 -8.237 3.665 3.849 348 2HG PRO2072 1HG PRO2072 -7.342 4.842 4.820 349 1HD PRO2072 2HD PRO2072 -6.561 4.075 2.353 350 2HD PRO2072 1HD PRO2072 -5.408 4.556 3.618 351 H ARG2073 H ARG2073 -7.449 1.544 2.398 352 HA ARG2073 HA ARG2073 -9.344 -0.480 3.070 353 1HB ARG2073 2HB ARG2073 -9.837 1.135 1.379 354 2HB ARG2073 1HB ARG2073 -8.374 0.751 0.503 355 1HG ARG2073 2HG ARG2073 -9.409 -1.551 0.135 356 2HG ARG2073 1HG ARG2073 -10.921 -0.815 0.691 357 1HD ARG2073 2HD ARG2073 -10.684 -0.711 -1.766 358 2HD ARG2073 1HD ARG2073 -10.756 0.891 -1.020 359 HE ARG2073 HE ARG2073 -8.085 0.342 -1.109 360 1HH1 ARG2073 1HH1 ARG2073 -10.578 0.725 -3.556 361 2HH1 ARG2073 2HH1 ARG2073 -9.484 1.051 -4.814 362 1HH2 ARG2073 1HH2 ARG2073 -6.645 0.758 -2.670 363 2HH2 ARG2073 2HH2 ARG2073 -7.106 1.004 -4.315 364 H PHE2074 H PHE2074 -6.303 -0.351 1.260 365 HA PHE2074 HA PHE2074 -6.073 -3.090 0.695 366 1HB PHE2074 2HB PHE2074 -4.746 -1.426 -0.499 367 2HB PHE2074 1HB PHE2074 -3.948 -0.952 0.992 368 HD1 PHE2074 1HD PHE2074 -4.394 -3.827 -1.324 369 HD2 PHE2074 2HD PHE2074 -1.944 -1.964 1.617 370 HE1 PHE2074 1HE PHE2074 -2.610 -5.461 -1.772 371 HE2 PHE2074 2HE PHE2074 -0.164 -3.595 1.175 372 HZ PHE2074 HZ PHE2074 -0.493 -5.347 -0.523 373 H LEU2075 H LEU2075 -4.856 -1.125 3.384 374 HA LEU2075 HA LEU2075 -3.510 -3.142 4.796 375 1HB LEU2075 2HB LEU2075 -5.031 -0.787 5.905 376 2HB LEU2075 1HB LEU2075 -3.961 -1.801 6.840 377 HG LEU2075 HG LEU2075 -3.159 0.001 4.561 378 1HD1 LEU2075 3HD1 LEU2075 -2.742 0.158 7.537 379 2HD1 LEU2075 2HD1 LEU2075 -1.983 1.227 6.367 380 3HD1 LEU2075 1HD1 LEU2075 -3.740 1.225 6.557 381 1HD2 LEU2075 2HD2 LEU2075 -1.481 -1.769 6.351 382 2HD2 LEU2075 1HD2 LEU2075 -1.749 -1.998 4.625 383 3HD2 LEU2075 3HD2 LEU2075 -0.853 -0.593 5.196 384 H ALA2076 H ALA2076 -6.887 -2.120 5.005 385 HA ALA2076 HA ALA2076 -7.655 -3.981 6.954 386 1HB ALA2076 3HB ALA2076 -9.936 -3.537 6.209 387 2HB ALA2076 2HB ALA2076 -9.014 -2.045 6.394 388 3HB ALA2076 1HB ALA2076 -9.311 -2.709 4.784 389 H TYR2077 H TYR2077 -7.586 -4.130 3.421 390 HA TYR2077 HA TYR2077 -8.805 -6.629 3.141 391 1HB TYR2077 2HB TYR2077 -8.521 -5.179 1.213 392 2HB TYR2077 1HB TYR2077 -6.768 -5.257 1.371 393 HD1 TYR2077 1HD TYR2077 -9.708 -7.477 0.932 394 HD2 TYR2077 2HD TYR2077 -5.603 -6.807 0.113 395 HE1 TYR2077 1HE TYR2077 -9.673 -9.487 -0.451 396 HE2 TYR2077 2HE TYR2077 -5.548 -8.823 -1.297 397 HH TYR2077 HH TYR2077 -8.372 -10.391 -2.291 398 H MET2078 H MET2078 -5.442 -5.777 3.768 399 HA MET2078 HA MET2078 -4.384 -8.368 3.428 400 1HB MET2078 2HB MET2078 -3.408 -6.163 5.259 401 2HB MET2078 1HB MET2078 -2.516 -7.631 4.903 402 1HG MET2078 2HG MET2078 -2.453 -6.967 2.523 403 2HG MET2078 1HG MET2078 -3.261 -5.463 2.950 404 1HE MET2078 1HE MET2078 -0.002 -7.616 3.265 405 2HE MET2078 3HE MET2078 1.002 -6.630 4.327 406 3HE MET2078 2HE MET2078 -0.433 -7.424 4.968 407 H GLU2079 H GLU2079 -5.645 -6.731 6.261 408 HA GLU2079 HA GLU2079 -5.185 -8.833 8.110 409 1HB GLU2079 2HB GLU2079 -7.177 -6.567 8.180 410 2HB GLU2079 1HB GLU2079 -6.731 -7.574 9.548 411 1HG GLU2079 2HG GLU2079 -4.837 -5.785 8.042 412 2HG GLU2079 1HG GLU2079 -5.647 -5.360 9.546 413 H ASP2080 H ASP2080 -8.060 -7.714 6.423 414 HA ASP2080 HA ASP2080 -9.873 -9.599 7.528 415 1HB ASP2080 2HB ASP2080 -10.695 -7.502 6.839 416 2HB ASP2080 1HB ASP2080 -9.992 -7.674 5.247 417 H ARG2081 H ARG2081 -8.411 -9.290 4.334 418 HA ARG2081 HA ARG2081 -8.235 -10.579 2.557 419 1HB ARG2081 2HB ARG2081 -8.315 -12.782 4.606 420 2HB ARG2081 1HB ARG2081 -8.119 -13.108 2.893 421 1HG ARG2081 2HG ARG2081 -6.269 -11.432 4.578 422 2HG ARG2081 1HG ARG2081 -5.983 -13.106 4.093 423 1HD ARG2081 2HD ARG2081 -6.120 -12.363 1.712 424 2HD ARG2081 1HD ARG2081 -6.216 -10.700 2.283 425 HE ARG2081 HE ARG2081 -3.973 -11.954 3.404 426 1HH1 ARG2081 1HH1 ARG2081 -5.063 -10.665 0.255 427 2HH1 ARG2081 2HH1 ARG2081 -3.479 -10.386 -0.293 428 1HH2 ARG2081 1HH2 ARG2081 -1.874 -11.573 2.614 429 2HH2 ARG2081 2HH2 ARG2081 -1.611 -10.894 1.072 430 H ARG2082 H ARG2082 -10.117 -9.862 1.565 431 HA ARG2082 HA ARG2082 -12.444 -11.555 1.724 432 1HB ARG2082 2HB ARG2082 -11.749 -9.336 -0.233 433 2HB ARG2082 1HB ARG2082 -13.212 -10.281 -0.340 434 1HG ARG2082 2HG ARG2082 -12.454 -8.472 1.945 435 2HG ARG2082 1HG ARG2082 -13.566 -8.056 0.648 436 1HD ARG2082 2HD ARG2082 -14.962 -8.685 2.440 437 2HD ARG2082 1HD ARG2082 -14.912 -10.123 1.417 438 HE ARG2082 HE ARG2082 -12.951 -9.965 3.515 439 1HH1 ARG2082 1HH1 ARG2082 -16.216 -11.085 2.772 440 2HH1 ARG2082 2HH1 ARG2082 -16.215 -12.312 3.963 441 1HH2 ARG2082 1HH2 ARG2082 -12.951 -11.617 5.112 442 2HH2 ARG2082 2HH2 ARG2082 -14.306 -12.614 5.351 443 H LYS2083 H LYS2083 -11.557 -13.558 1.303 444 HA LYS2083 HA LYS2083 -10.996 -14.013 -1.540 445 1HB LYS2083 2HB LYS2083 -9.729 -15.379 0.844 446 2HB LYS2083 1HB LYS2083 -9.555 -15.947 -0.808 447 1HG LYS2083 2HG LYS2083 -8.666 -13.223 0.140 448 2HG LYS2083 1HG LYS2083 -7.617 -14.633 0.100 449 1HD LYS2083 2HD LYS2083 -9.004 -13.413 -2.310 450 2HD LYS2083 1HD LYS2083 -7.319 -13.149 -1.870 451 1HE LYS2083 2HE LYS2083 -6.934 -15.608 -2.092 452 2HE LYS2083 1HE LYS2083 -8.596 -15.781 -2.648 453 1HZ LYS2083 3HZ LYS2083 -8.001 -14.288 -4.547 454 2HZ LYS2083 2HZ LYS2083 -6.404 -14.301 -4.002 455 3HZ LYS2083 1HZ LYS2083 -7.106 -15.711 -4.503 456 H GLN2084 H GLN2084 -12.978 -14.565 -2.050 457 HA GLN2084 HA GLN2084 -14.789 -15.792 -2.426 458 1HB GLN2084 2HB GLN2084 -13.279 -17.995 -1.021 459 2HB GLN2084 1HB GLN2084 -14.817 -18.222 -1.831 460 1HG GLN2084 2HG GLN2084 -13.767 -17.533 -3.950 461 2HG GLN2084 1HG GLN2084 -12.224 -17.381 -3.104 462 1HE2 GLN2084 1HE2 GLN2084 -11.240 -18.944 -4.311 463 2HE2 GLN2084 2HE2 GLN2084 -11.590 -20.623 -4.156 464 H LYS2085 H LYS2085 -16.221 -14.590 -1.263 465 HA LYS2085 HA LYS2085 -16.755 -15.494 1.446 466 1HB LYS2085 2HB LYS2085 -18.424 -13.752 1.615 467 2HB LYS2085 1HB LYS2085 -16.985 -13.045 0.909 468 1HG LYS2085 2HG LYS2085 -17.997 -12.999 -1.267 469 2HG LYS2085 1HG LYS2085 -19.374 -13.943 -0.693 470 1HD LYS2085 2HD LYS2085 -19.943 -12.107 0.855 471 2HD LYS2085 1HD LYS2085 -18.601 -11.172 0.203 472 1HE LYS2085 2HE LYS2085 -19.635 -11.118 -1.969 473 2HE LYS2085 1HE LYS2085 -20.926 -12.188 -1.437 474 1HZ LYS2085 2HZ LYS2085 -21.611 -10.455 0.139 475 2HZ LYS2085 1HZ LYS2085 -20.404 -9.436 -0.450 476 3HZ LYS2085 3HZ LYS2085 -21.669 -9.909 -1.454 No H/Q in entry = 476 Start of MODEL 11 1 H LEU2028 H LEU2028 -2.483 -11.123 -6.498 2 HA LEU2028 HA LEU2028 0.272 -11.595 -7.097 3 1HB LEU2028 2HB LEU2028 -1.317 -9.027 -7.066 4 2HB LEU2028 1HB LEU2028 0.328 -9.178 -7.633 5 HG LEU2028 HG LEU2028 -2.106 -10.451 -8.886 6 1HD1 LEU2028 3HD1 LEU2028 -1.998 -8.052 -9.254 7 2HD1 LEU2028 2HD1 LEU2028 -0.339 -8.203 -9.829 8 3HD1 LEU2028 1HD1 LEU2028 -1.659 -8.930 -10.745 9 1HD2 LEU2028 1HD2 LEU2028 0.789 -10.522 -9.757 10 2HD2 LEU2028 3HD2 LEU2028 -0.156 -11.892 -9.166 11 3HD2 LEU2028 2HD2 LEU2028 -0.578 -11.124 -10.692 12 H ASP2029 H ASP2029 1.221 -12.172 -5.239 13 HA ASP2029 HA ASP2029 1.010 -10.734 -2.821 14 1HB ASP2029 2HB ASP2029 1.960 -12.983 -2.751 15 2HB ASP2029 1HB ASP2029 3.296 -12.489 -3.786 16 H VAL2030 H VAL2030 2.348 -9.230 -1.928 17 HA VAL2030 HA VAL2030 2.885 -7.189 -3.688 18 HB VAL2030 HB VAL2030 3.889 -7.430 -0.860 19 1HG1 VAL2030 1HG1 VAL2030 5.043 -5.677 -2.116 20 2HG1 VAL2030 3HG1 VAL2030 3.488 -4.966 -2.550 21 3HG1 VAL2030 2HG1 VAL2030 4.001 -5.006 -0.865 22 1HG2 VAL2030 1HG2 VAL2030 1.367 -6.196 -1.931 23 2HG2 VAL2030 3HG2 VAL2030 1.490 -7.674 -0.967 24 3HG2 VAL2030 2HG2 VAL2030 1.924 -6.115 -0.257 25 H ASP2031 H ASP2031 5.158 -9.152 -1.821 26 HA ASP2031 HA ASP2031 7.405 -9.490 -1.914 27 1HB ASP2031 2HB ASP2031 6.341 -11.035 -3.656 28 2HB ASP2031 1HB ASP2031 6.931 -9.905 -4.875 29 H LEU2032 H LEU2032 6.856 -6.825 -2.011 30 HA LEU2032 HA LEU2032 7.979 -4.864 -2.061 31 1HB LEU2032 2HB LEU2032 10.251 -6.364 -3.339 32 2HB LEU2032 1HB LEU2032 10.343 -4.771 -2.627 33 HG LEU2032 HG LEU2032 9.785 -7.342 -1.157 34 1HD1 LEU2032 2HD1 LEU2032 12.184 -5.536 -1.159 35 2HD1 LEU2032 1HD1 LEU2032 11.947 -6.947 -0.122 36 3HD1 LEU2032 3HD1 LEU2032 12.076 -7.149 -1.870 37 1HD2 LEU2032 3HD2 LEU2032 10.053 -4.527 -0.137 38 2HD2 LEU2032 2HD2 LEU2032 8.589 -5.517 -0.123 39 3HD2 LEU2032 1HD2 LEU2032 9.971 -5.977 0.868 40 H GLU2033 H GLU2033 7.705 -6.545 -5.091 41 HA GLU2033 HA GLU2033 8.323 -4.136 -6.610 42 1HB GLU2033 2HB GLU2033 7.652 -6.938 -7.460 43 2HB GLU2033 1HB GLU2033 7.967 -5.619 -8.585 44 1HG GLU2033 2HG GLU2033 10.192 -5.370 -7.799 45 2HG GLU2033 1HG GLU2033 9.897 -6.471 -6.457 46 H THR2034 H THR2034 5.547 -5.691 -5.429 47 HA THR2034 HA THR2034 3.663 -4.717 -7.285 48 HB THR2034 HB THR2034 3.600 -5.680 -4.487 49 HG1 THR2034 1HG THR2034 3.604 -7.495 -5.593 50 1HG2 THR2034 1HG2 THR2034 1.690 -4.146 -4.640 51 2HG2 THR2034 3HG2 THR2034 1.117 -4.988 -6.089 52 3HG2 THR2034 2HG2 THR2034 1.151 -5.813 -4.519 53 H ARG2035 H ARG2035 2.420 -2.910 -7.268 54 HA ARG2035 HA ARG2035 3.535 -0.629 -5.894 55 1HB ARG2035 2HB ARG2035 1.587 -0.951 -8.168 56 2HB ARG2035 1HB ARG2035 1.797 0.602 -7.371 57 1HG ARG2035 2HG ARG2035 3.119 0.562 -9.377 58 2HG ARG2035 1HG ARG2035 4.193 0.549 -7.989 59 1HD ARG2035 2HD ARG2035 5.124 -0.985 -9.502 60 2HD ARG2035 1HD ARG2035 4.298 -1.978 -8.311 61 HE ARG2035 HE ARG2035 2.668 -1.399 -10.606 62 1HH1 ARG2035 1HH1 ARG2035 5.057 -3.686 -9.260 63 2HH1 ARG2035 2HH1 ARG2035 4.857 -4.801 -10.525 64 1HH2 ARG2035 1HH2 ARG2035 2.501 -2.875 -12.312 65 2HH2 ARG2035 2HH2 ARG2035 3.338 -4.369 -12.327 66 H ILE2036 H ILE2036 2.836 -0.195 -3.951 67 HA ILE2036 HA ILE2036 0.299 -1.116 -2.978 68 HB ILE2036 HB ILE2036 2.354 0.679 -1.668 69 1HG1 ILE2036 2HG1 ILE2036 3.304 -1.500 -2.061 70 2HG1 ILE2036 1HG1 ILE2036 2.907 -1.310 -0.351 71 1HG2 ILE2036 3HG2 ILE2036 0.183 1.028 -0.632 72 2HG2 ILE2036 2HG2 ILE2036 -0.017 -0.709 -0.408 73 3HG2 ILE2036 1HG2 ILE2036 1.246 0.151 0.466 74 1HD1 ILE2036 2HD1 ILE2036 0.894 -2.649 -0.664 75 2HD1 ILE2036 1HD1 ILE2036 1.302 -2.868 -2.364 76 3HD1 ILE2036 3HD1 ILE2036 2.352 -3.538 -1.112 77 HA PRO2037 HA PRO2037 -1.883 2.597 -4.258 78 1HB PRO2037 2HB PRO2037 -4.203 2.006 -2.915 79 2HB PRO2037 1HB PRO2037 -3.790 1.341 -4.497 80 1HG PRO2037 2HG PRO2037 -3.508 0.106 -1.793 81 2HG PRO2037 1HG PRO2037 -4.063 -0.633 -3.307 82 1HD PRO2037 2HD PRO2037 -1.589 -1.003 -2.341 83 2HD PRO2037 1HD PRO2037 -1.902 -0.925 -4.088 84 H VAL2038 H VAL2038 -1.888 4.507 -3.369 85 HA VAL2038 HA VAL2038 -1.911 4.752 -0.449 86 HB VAL2038 HB VAL2038 -0.273 6.646 -0.652 87 1HG1 VAL2038 3HG1 VAL2038 0.735 3.956 -1.559 88 2HG1 VAL2038 2HG1 VAL2038 1.712 5.260 -0.869 89 3HG1 VAL2038 1HG1 VAL2038 0.476 4.472 0.110 90 1HG2 VAL2038 3HG2 VAL2038 0.115 5.574 -3.450 91 2HG2 VAL2038 2HG2 VAL2038 -0.545 7.151 -3.024 92 3HG2 VAL2038 1HG2 VAL2038 1.140 6.779 -2.669 93 H ILE2039 H ILE2039 -2.712 6.713 0.331 94 HA ILE2039 HA ILE2039 -4.031 8.415 -1.643 95 HB ILE2039 HB ILE2039 -5.771 6.869 -0.617 96 1HG1 ILE2039 2HG1 ILE2039 -6.028 9.816 0.105 97 2HG1 ILE2039 1HG1 ILE2039 -6.385 9.124 -1.464 98 1HG2 ILE2039 1HG2 ILE2039 -4.967 8.290 1.907 99 2HG2 ILE2039 3HG2 ILE2039 -6.397 7.261 1.761 100 3HG2 ILE2039 2HG2 ILE2039 -4.778 6.567 1.575 101 1HD1 ILE2039 1HD1 ILE2039 -7.879 8.587 1.098 102 2HD1 ILE2039 3HD1 ILE2039 -8.354 9.683 -0.201 103 3HD1 ILE2039 2HD1 ILE2039 -8.284 7.939 -0.504 104 H ASN2040 H ASN2040 -4.337 10.486 -0.934 105 HA ASN2040 HA ASN2040 -2.474 11.839 0.551 106 1HB ASN2040 2HB ASN2040 -5.295 12.465 -0.172 107 2HB ASN2040 1HB ASN2040 -4.559 13.472 0.982 108 1HD2 ASN2040 1HD2 ASN2040 -1.805 13.218 -0.261 109 2HD2 ASN2040 2HD2 ASN2040 -1.971 14.288 -1.592 110 H LYS2041 H LYS2041 -2.153 12.305 2.559 111 HA LYS2041 HA LYS2041 -3.501 11.187 4.816 112 1HB LYS2041 2HB LYS2041 -1.592 13.517 4.537 113 2HB LYS2041 1HB LYS2041 -2.123 12.870 6.078 114 1HG LYS2041 2HG LYS2041 -0.855 11.062 4.081 115 2HG LYS2041 1HG LYS2041 0.160 12.140 5.039 116 1HD LYS2041 2HD LYS2041 -1.822 10.174 6.206 117 2HD LYS2041 1HD LYS2041 -0.104 9.849 5.970 118 1HE LYS2041 2HE LYS2041 -1.256 12.043 7.707 119 2HE LYS2041 1HE LYS2041 -0.553 10.527 8.259 120 1HZ LYS2041 3HZ LYS2041 0.929 12.628 6.751 121 2HZ LYS2041 2HZ LYS2041 1.030 12.344 8.401 122 3HZ LYS2041 1HZ LYS2041 1.561 11.173 7.325 123 H VAL2042 H VAL2042 -4.031 13.843 2.782 124 HA VAL2042 HA VAL2042 -5.692 15.387 4.601 125 HB VAL2042 HB VAL2042 -5.379 15.671 1.594 126 1HG1 VAL2042 2HG1 VAL2042 -7.284 16.866 2.486 127 2HG1 VAL2042 1HG1 VAL2042 -6.258 17.672 3.670 128 3HG1 VAL2042 3HG1 VAL2042 -6.046 18.002 1.949 129 1HG2 VAL2042 1HG2 VAL2042 -3.741 16.986 3.757 130 2HG2 VAL2042 3HG2 VAL2042 -3.182 15.790 2.582 131 3HG2 VAL2042 2HG2 VAL2042 -3.684 17.393 2.039 132 H ASP2043 H ASP2043 -5.785 12.845 2.366 133 HA ASP2043 HA ASP2043 -7.249 11.373 1.720 134 1HB ASP2043 2HB ASP2043 -9.030 12.811 3.585 135 2HB ASP2043 1HB ASP2043 -9.645 11.606 2.430 136 H GLY2044 H GLY2044 -7.017 11.884 -0.218 137 1HA GLY2044 1HA GLY2044 -8.088 13.943 -1.563 138 2HA GLY2044 2HA GLY2044 -9.384 12.738 -1.536 139 H THR2045 H THR2045 -5.980 13.162 -2.222 140 HA THR2045 HA THR2045 -6.261 12.026 -4.805 141 HB THR2045 HB THR2045 -3.879 12.844 -3.170 142 HG1 THR2045 1HG THR2045 -4.197 14.749 -3.999 143 1HG2 THR2045 2HG2 THR2045 -3.219 11.207 -4.864 144 2HG2 THR2045 1HG2 THR2045 -3.993 12.171 -6.130 145 3HG2 THR2045 3HG2 THR2045 -2.587 12.807 -5.265 146 H LEU2046 H LEU2046 -6.644 9.934 -4.970 147 HA LEU2046 HA LEU2046 -5.110 8.031 -3.359 148 1HB LEU2046 2HB LEU2046 -7.538 7.763 -3.245 149 2HB LEU2046 1HB LEU2046 -7.636 7.683 -4.990 150 HG LEU2046 HG LEU2046 -6.296 5.588 -4.907 151 1HD1 LEU2046 2HD1 LEU2046 -5.216 5.876 -2.754 152 2HD1 LEU2046 1HD1 LEU2046 -6.785 5.755 -1.951 153 3HD1 LEU2046 3HD1 LEU2046 -6.125 4.365 -2.808 154 1HD2 LEU2046 3HD2 LEU2046 -8.918 5.590 -3.423 155 2HD2 LEU2046 2HD2 LEU2046 -8.678 5.474 -5.164 156 3HD2 LEU2046 1HD2 LEU2046 -8.143 4.164 -4.120 157 H LEU2047 H LEU2047 -3.612 6.854 -4.318 158 HA LEU2047 HA LEU2047 -3.421 6.845 -7.255 159 1HB LEU2047 2HB LEU2047 -1.225 6.551 -5.203 160 2HB LEU2047 1HB LEU2047 -1.024 6.529 -6.940 161 HG LEU2047 HG LEU2047 -1.840 8.910 -5.272 162 1HD1 LEU2047 2HD1 LEU2047 0.496 8.315 -5.013 163 2HD1 LEU2047 1HD1 LEU2047 0.702 8.296 -6.762 164 3HD1 LEU2047 3HD1 LEU2047 0.335 9.810 -5.935 165 1HD2 LEU2047 2HD2 LEU2047 -2.905 8.981 -7.481 166 2HD2 LEU2047 1HD2 LEU2047 -1.636 10.196 -7.350 167 3HD2 LEU2047 3HD2 LEU2047 -1.337 8.709 -8.244 168 H VAL2048 H VAL2048 -4.212 5.005 -7.922 169 HA VAL2048 HA VAL2048 -3.362 2.579 -6.515 170 HB VAL2048 HB VAL2048 -5.371 1.422 -7.397 171 1HG1 VAL2048 1HG1 VAL2048 -6.034 3.843 -5.755 172 2HG1 VAL2048 3HG1 VAL2048 -7.052 2.420 -5.928 173 3HG1 VAL2048 2HG1 VAL2048 -5.478 2.284 -5.143 174 1HG2 VAL2048 2HG2 VAL2048 -6.235 4.161 -8.313 175 2HG2 VAL2048 1HG2 VAL2048 -5.837 2.792 -9.348 176 3HG2 VAL2048 3HG2 VAL2048 -7.259 2.723 -8.304 177 H GLY2049 H GLY2049 -3.159 0.705 -7.977 178 1HA GLY2049 1HA GLY2049 -3.069 1.171 -10.780 179 2HA GLY2049 2HA GLY2049 -2.558 -0.284 -9.931 180 H GLU2050 H GLU2050 -1.454 1.838 -11.944 181 HA GLU2050 HA GLU2050 1.251 1.424 -10.974 182 1HB GLU2050 2HB GLU2050 0.325 2.334 -13.686 183 2HB GLU2050 1HB GLU2050 1.938 1.794 -13.242 184 1HG GLU2050 2HG GLU2050 -0.534 0.083 -13.167 185 2HG GLU2050 1HG GLU2050 0.669 0.093 -14.456 186 H ASP2051 H ASP2051 -0.935 3.702 -10.624 187 HA ASP2051 HA ASP2051 0.721 6.038 -11.024 188 1HB ASP2051 2HB ASP2051 -1.855 5.532 -9.604 189 2HB ASP2051 1HB ASP2051 -1.104 7.131 -9.610 190 H ALA2052 H ALA2052 0.008 3.699 -8.654 191 HA ALA2052 HA ALA2052 1.159 5.151 -6.465 192 1HB ALA2052 3HB ALA2052 0.599 3.109 -5.201 193 2HB ALA2052 1HB ALA2052 0.121 2.323 -6.713 194 3HB ALA2052 2HB ALA2052 -0.771 3.732 -6.130 195 HA PRO2053 HA PRO2053 5.191 3.462 -7.304 196 1HB PRO2053 2HB PRO2053 6.125 3.723 -4.625 197 2HB PRO2053 1HB PRO2053 6.309 4.877 -5.946 198 1HG PRO2053 2HG PRO2053 4.781 5.307 -3.675 199 2HG PRO2053 1HG PRO2053 4.583 6.163 -5.210 200 1HD PRO2053 2HD PRO2053 3.035 3.851 -4.117 201 2HD PRO2053 1HD PRO2053 2.462 5.276 -5.013 202 H ARG2054 H ARG2054 6.708 1.794 -6.897 203 HA ARG2054 HA ARG2054 5.681 -0.754 -6.150 204 1HB ARG2054 2HB ARG2054 8.487 0.275 -6.512 205 2HB ARG2054 1HB ARG2054 8.105 -1.403 -6.175 206 1HG ARG2054 2HG ARG2054 7.104 -1.697 -8.263 207 2HG ARG2054 1HG ARG2054 7.004 0.049 -8.547 208 1HD ARG2054 2HD ARG2054 9.588 -1.292 -8.057 209 2HD ARG2054 1HD ARG2054 8.931 -1.243 -9.719 210 HE ARG2054 HE ARG2054 9.034 1.273 -8.317 211 1HH1 ARG2054 1HH1 ARG2054 10.831 -0.895 -10.452 212 2HH1 ARG2054 2HH1 ARG2054 11.922 0.312 -10.973 213 1HH2 ARG2054 1HH2 ARG2054 10.476 2.905 -9.020 214 2HH2 ARG2054 2HH2 ARG2054 11.681 2.541 -10.184 215 H ARG2055 H ARG2055 5.902 -1.838 -4.269 216 HA ARG2055 HA ARG2055 5.894 -0.613 -1.843 217 1HB ARG2055 2HB ARG2055 5.077 -2.825 -2.218 218 2HB ARG2055 1HB ARG2055 6.680 -3.407 -2.588 219 1HG ARG2055 2HG ARG2055 5.908 -4.114 -0.411 220 2HG ARG2055 1HG ARG2055 7.344 -3.076 -0.279 221 1HD ARG2055 2HD ARG2055 5.928 -1.204 0.340 222 2HD ARG2055 1HD ARG2055 4.498 -2.205 0.084 223 HE ARG2055 HE ARG2055 4.880 -3.303 2.028 224 1HH1 ARG2055 1HH1 ARG2055 7.690 -1.275 1.359 225 2HH1 ARG2055 2HH1 ARG2055 8.169 -1.145 2.979 226 1HH2 ARG2055 1HH2 ARG2055 5.510 -3.111 4.233 227 2HH2 ARG2055 2HH2 ARG2055 6.896 -2.221 4.671 228 H ALA2056 H ALA2056 8.756 -1.856 -3.506 229 HA ALA2056 HA ALA2056 10.560 -1.544 -1.347 230 1HB ALA2056 2HB ALA2056 12.314 -1.821 -3.002 231 2HB ALA2056 3HB ALA2056 11.152 -1.540 -4.301 232 3HB ALA2056 1HB ALA2056 11.013 -2.978 -3.290 233 H GLU2057 H GLU2057 9.669 0.627 -4.038 234 HA GLU2057 HA GLU2057 11.530 2.640 -3.078 235 1HB GLU2057 2HB GLU2057 10.886 3.932 -5.004 236 2HB GLU2057 1HB GLU2057 11.045 2.266 -5.530 237 1HG GLU2057 2HG GLU2057 8.568 2.043 -5.282 238 2HG GLU2057 1HG GLU2057 8.509 3.771 -4.983 239 H LEU2058 H LEU2058 8.272 1.793 -2.721 240 HA LEU2058 HA LEU2058 6.821 4.036 -2.219 241 1HB LEU2058 2HB LEU2058 5.904 1.799 -2.432 242 2HB LEU2058 1HB LEU2058 6.658 1.302 -0.951 243 HG LEU2058 HG LEU2058 4.157 1.604 -0.935 244 1HD1 LEU2058 3HD1 LEU2058 5.380 1.427 1.127 245 2HD1 LEU2058 2HD1 LEU2058 5.717 3.158 1.099 246 3HD1 LEU2058 1HD1 LEU2058 4.059 2.584 1.288 247 1HD2 LEU2058 2HD2 LEU2058 4.899 4.521 -0.977 248 2HD2 LEU2058 1HD2 LEU2058 4.006 3.645 -2.219 249 3HD2 LEU2058 3HD2 LEU2058 3.294 3.871 -0.621 250 H GLU2059 H GLU2059 8.882 2.363 0.065 251 HA GLU2059 HA GLU2059 8.121 3.785 2.390 252 1HB GLU2059 2HB GLU2059 10.836 2.595 1.830 253 2HB GLU2059 1HB GLU2059 10.051 2.794 3.397 254 1HG GLU2059 2HG GLU2059 8.296 1.268 2.655 255 2HG GLU2059 1HG GLU2059 9.184 0.980 1.178 256 H MET2060 H MET2060 10.666 4.178 0.116 257 HA MET2060 HA MET2060 11.870 6.484 1.315 258 1HB MET2060 2HB MET2060 12.117 5.535 -1.551 259 2HB MET2060 1HB MET2060 13.181 6.680 -0.747 260 1HG MET2060 2HG MET2060 12.833 3.777 -0.031 261 2HG MET2060 1HG MET2060 14.197 4.479 -0.894 262 1HE MET2060 1HE MET2060 15.728 3.205 0.876 263 2HE MET2060 3HE MET2060 15.655 3.478 2.618 264 3HE MET2060 2HE MET2060 14.330 2.645 1.801 265 H TRP2061 H TRP2061 9.523 5.930 -1.189 266 HA TRP2061 HA TRP2061 9.258 8.573 -2.095 267 1HB TRP2061 2HB TRP2061 8.450 6.553 -3.314 268 2HB TRP2061 1HB TRP2061 7.184 6.369 -2.110 269 HD1 TRP2061 HD TRP2061 8.285 8.709 -4.944 270 HE1 TRP2061 1HE TRP2061 6.265 10.022 -5.762 271 HE3 TRP2061 3HE TRP2061 4.881 7.153 -1.459 272 HZ2 TRP2061 2HZ TRP2061 3.536 10.355 -5.041 273 HZ3 TRP2061 3HZ TRP2061 2.591 8.015 -1.608 274 HH2 TRP2061 HH TRP2061 1.934 9.579 -3.355 275 H LEU2062 H LEU2062 7.550 6.734 0.417 276 HA LEU2062 HA LEU2062 5.783 8.817 1.131 277 1HB LEU2062 2HB LEU2062 6.703 6.421 2.704 278 2HB LEU2062 1HB LEU2062 5.514 7.560 3.295 279 HG LEU2062 HG LEU2062 5.226 5.767 0.887 280 1HD1 LEU2062 2HD1 LEU2062 3.857 5.777 3.568 281 2HD1 LEU2062 1HD1 LEU2062 3.487 4.712 2.211 282 3HD1 LEU2062 3HD1 LEU2062 5.054 4.602 3.011 283 1HD2 LEU2062 1HD2 LEU2062 3.286 7.758 2.073 284 2HD2 LEU2062 3HD2 LEU2062 4.073 7.881 0.496 285 3HD2 LEU2062 2HD2 LEU2062 2.918 6.593 0.808 286 H GLN2063 H GLN2063 9.013 8.028 2.201 287 HA GLN2063 HA GLN2063 9.215 9.909 4.255 288 1HB GLN2063 2HB GLN2063 11.247 8.821 2.310 289 2HB GLN2063 1HB GLN2063 11.676 9.944 3.587 290 1HG GLN2063 2HG GLN2063 10.297 7.336 4.115 291 2HG GLN2063 1HG GLN2063 12.048 7.491 4.054 292 1HE2 GLN2063 1HE2 GLN2063 12.196 6.863 6.190 293 2HE2 GLN2063 2HE2 GLN2063 11.800 7.914 7.503 294 H GLY2064 H GLY2064 9.809 10.193 0.783 295 1HA GLY2064 1HA GLY2064 10.117 12.028 -0.555 296 2HA GLY2064 2HA GLY2064 10.423 12.977 0.888 297 H HIS2065 H HIS2065 7.456 11.236 0.775 298 HA HIS2065 HA HIS2065 6.019 13.757 0.429 299 1HB HIS2065 2HB HIS2065 5.253 11.174 -0.974 300 2HB HIS2065 1HB HIS2065 4.300 12.647 -0.976 301 HD1 HIS2065 1HD HIS2065 7.183 11.014 -2.646 302 HD2 HIS2065 2HD HIS2065 5.373 14.747 -2.544 303 HE1 HIS2065 1HE HIS2065 8.140 12.306 -4.579 304 HA PRO2066 HA PRO2066 4.564 11.452 4.143 305 1HB PRO2066 2HB PRO2066 4.451 13.602 5.787 306 2HB PRO2066 1HB PRO2066 5.942 12.696 5.496 307 1HG PRO2066 2HG PRO2066 5.042 15.292 4.302 308 2HG PRO2066 1HG PRO2066 6.656 14.797 4.858 309 1HD PRO2066 2HD PRO2066 5.905 14.830 2.246 310 2HD PRO2066 1HD PRO2066 7.138 13.744 2.902 311 H GLU2067 H GLU2067 3.225 13.546 2.034 312 HA GLU2067 HA GLU2067 0.756 14.009 3.485 313 1HB GLU2067 2HB GLU2067 0.028 15.235 1.474 314 2HB GLU2067 1HB GLU2067 1.561 15.826 2.101 315 1HG GLU2067 2HG GLU2067 2.739 14.581 0.347 316 2HG GLU2067 1HG GLU2067 1.187 14.016 -0.266 317 H PHE2068 H PHE2068 1.968 11.380 2.225 318 HA PHE2068 HA PHE2068 -0.620 10.396 1.314 319 1HB PHE2068 2HB PHE2068 2.101 9.818 0.176 320 2HB PHE2068 1HB PHE2068 0.741 8.731 -0.067 321 HD1 PHE2068 1HD PHE2068 2.125 12.046 -0.839 322 HD2 PHE2068 2HD PHE2068 -1.024 9.285 -1.544 323 HE1 PHE2068 1HE PHE2068 1.411 13.368 -2.788 324 HE2 PHE2068 2HE PHE2068 -1.753 10.600 -3.485 325 HZ PHE2068 HZ PHE2068 -0.533 12.647 -4.115 326 H ALA2069 H ALA2069 -1.064 8.248 1.820 327 HA ALA2069 HA ALA2069 0.707 6.758 3.562 328 1HB ALA2069 3HB ALA2069 -0.549 8.096 5.148 329 2HB ALA2069 1HB ALA2069 -1.120 6.430 5.207 330 3HB ALA2069 2HB ALA2069 -2.067 7.663 4.362 331 H VAL2070 H VAL2070 -0.375 4.601 3.966 332 HA VAL2070 HA VAL2070 -1.062 3.401 1.528 333 HB VAL2070 HB VAL2070 0.030 2.153 3.338 334 1HG1 VAL2070 2HG1 VAL2070 -2.510 2.495 4.873 335 2HG1 VAL2070 1HG1 VAL2070 -1.177 1.423 5.324 336 3HG1 VAL2070 3HG1 VAL2070 -0.929 3.167 5.249 337 1HG2 VAL2070 3HG2 VAL2070 -2.682 0.983 2.709 338 2HG2 VAL2070 2HG2 VAL2070 -1.226 0.822 1.722 339 3HG2 VAL2070 1HG2 VAL2070 -1.296 0.083 3.324 340 H ASP2071 H ASP2071 -2.962 2.713 0.639 341 HA ASP2071 HA ASP2071 -5.351 4.048 1.208 342 1HB ASP2071 2HB ASP2071 -5.052 3.303 -1.024 343 2HB ASP2071 1HB ASP2071 -4.714 1.659 -0.505 344 HA PRO2072 HA PRO2072 -6.919 1.684 4.664 345 1HB PRO2072 2HB PRO2072 -9.533 2.747 3.768 346 2HB PRO2072 1HB PRO2072 -8.740 2.889 5.342 347 1HG PRO2072 2HG PRO2072 -8.879 4.970 3.690 348 2HG PRO2072 1HG PRO2072 -7.424 4.670 4.662 349 1HD PRO2072 2HD PRO2072 -7.909 4.141 1.757 350 2HD PRO2072 1HD PRO2072 -6.468 4.774 2.590 351 H ARG2073 H ARG2073 -8.366 1.441 1.434 352 HA ARG2073 HA ARG2073 -10.040 -0.777 2.105 353 1HB ARG2073 2HB ARG2073 -10.559 0.590 0.150 354 2HB ARG2073 1HB ARG2073 -9.017 0.172 -0.582 355 1HG ARG2073 2HG ARG2073 -9.757 -2.201 -0.622 356 2HG ARG2073 1HG ARG2073 -11.343 -1.669 -0.069 357 1HD ARG2073 2HD ARG2073 -11.584 -0.276 -2.051 358 2HD ARG2073 1HD ARG2073 -9.961 -0.739 -2.565 359 HE ARG2073 HE ARG2073 -11.666 -2.994 -2.189 360 1HH1 ARG2073 1HH1 ARG2073 -10.738 -0.487 -4.524 361 2HH1 ARG2073 2HH1 ARG2073 -11.272 -1.385 -5.872 362 1HH2 ARG2073 1HH2 ARG2073 -12.367 -4.186 -4.024 363 2HH2 ARG2073 2HH2 ARG2073 -12.188 -3.513 -5.593 364 H PHE2074 H PHE2074 -6.904 -0.414 0.599 365 HA PHE2074 HA PHE2074 -6.255 -3.070 0.118 366 1HB PHE2074 2HB PHE2074 -4.903 -1.214 -0.700 367 2HB PHE2074 1HB PHE2074 -4.438 -0.792 0.941 368 HD1 PHE2074 1HD PHE2074 -4.176 -3.457 -1.624 369 HD2 PHE2074 2HD PHE2074 -2.550 -1.756 1.920 370 HE1 PHE2074 1HE PHE2074 -2.212 -4.923 -1.828 371 HE2 PHE2074 2HE PHE2074 -0.590 -3.217 1.731 372 HZ PHE2074 HZ PHE2074 -0.415 -4.808 -0.148 373 H LEU2075 H LEU2075 -5.670 -1.190 3.067 374 HA LEU2075 HA LEU2075 -4.609 -3.457 4.356 375 1HB LEU2075 2HB LEU2075 -4.666 -2.081 6.446 376 2HB LEU2075 1HB LEU2075 -3.702 -1.472 5.122 377 HG LEU2075 HG LEU2075 -5.828 -0.030 4.678 378 1HD1 LEU2075 1HD1 LEU2075 -7.259 -1.093 6.350 379 2HD1 LEU2075 3HD1 LEU2075 -6.118 -0.652 7.620 380 3HD1 LEU2075 2HD1 LEU2075 -6.984 0.605 6.742 381 1HD2 LEU2075 2HD2 LEU2075 -3.631 0.703 5.194 382 2HD2 LEU2075 1HD2 LEU2075 -4.816 1.693 6.082 383 3HD2 LEU2075 3HD2 LEU2075 -3.896 0.415 6.907 384 H ALA2076 H ALA2076 -7.800 -2.252 4.007 385 HA ALA2076 HA ALA2076 -9.033 -3.542 6.173 386 1HB ALA2076 1HB ALA2076 -11.125 -3.275 4.952 387 2HB ALA2076 2HB ALA2076 -10.232 -2.920 3.473 388 3HB ALA2076 3HB ALA2076 -10.156 -1.807 4.839 389 H TYR2077 H TYR2077 -8.062 -4.709 3.015 390 HA TYR2077 HA TYR2077 -9.437 -7.176 3.281 391 1HB TYR2077 2HB TYR2077 -7.124 -6.442 1.477 392 2HB TYR2077 1HB TYR2077 -7.922 -8.012 1.439 393 HD1 TYR2077 1HD TYR2077 -10.607 -7.799 1.333 394 HD2 TYR2077 2HD TYR2077 -7.849 -4.895 -0.093 395 HE1 TYR2077 1HE TYR2077 -12.344 -6.895 -0.156 396 HE2 TYR2077 2HE TYR2077 -9.580 -3.986 -1.586 397 HH TYR2077 HH TYR2077 -12.885 -4.893 -1.296 398 H MET2078 H MET2078 -6.353 -6.055 4.325 399 HA MET2078 HA MET2078 -5.413 -8.623 5.176 400 1HB MET2078 2HB MET2078 -4.517 -5.825 5.889 401 2HB MET2078 1HB MET2078 -3.743 -7.272 6.507 402 1HG MET2078 2HG MET2078 -3.146 -7.946 4.252 403 2HG MET2078 1HG MET2078 -3.976 -6.540 3.595 404 1HE MET2078 2HE MET2078 -1.701 -6.070 2.232 405 2HE MET2078 1HE MET2078 -0.131 -5.838 3.002 406 3HE MET2078 3HE MET2078 -0.897 -7.425 3.021 407 H GLU2079 H GLU2079 -7.266 -6.022 6.589 408 HA GLU2079 HA GLU2079 -7.341 -6.960 9.254 409 1HB GLU2079 2HB GLU2079 -7.882 -4.652 8.498 410 2HB GLU2079 1HB GLU2079 -9.310 -5.273 7.691 411 1HG GLU2079 2HG GLU2079 -9.927 -4.226 9.747 412 2HG GLU2079 1HG GLU2079 -10.203 -5.965 9.859 413 H ASP2080 H ASP2080 -9.303 -7.458 6.388 414 HA ASP2080 HA ASP2080 -11.289 -9.091 7.575 415 1HB ASP2080 2HB ASP2080 -11.646 -7.948 5.428 416 2HB ASP2080 1HB ASP2080 -10.394 -8.929 4.685 417 H ARG2081 H ARG2081 -8.112 -9.687 6.415 418 HA ARG2081 HA ARG2081 -8.476 -12.574 6.364 419 1HB ARG2081 2HB ARG2081 -7.187 -11.422 4.559 420 2HB ARG2081 1HB ARG2081 -6.000 -10.937 5.751 421 1HG ARG2081 2HG ARG2081 -5.281 -13.189 6.068 422 2HG ARG2081 1HG ARG2081 -6.642 -13.819 5.139 423 1HD ARG2081 2HD ARG2081 -4.596 -13.873 3.823 424 2HD ARG2081 1HD ARG2081 -5.760 -12.757 3.127 425 HE ARG2081 HE ARG2081 -3.658 -11.705 4.868 426 1HH1 ARG2081 1HH1 ARG2081 -5.109 -11.861 1.631 427 2HH1 ARG2081 2HH1 ARG2081 -4.006 -10.777 0.927 428 1HH2 ARG2081 1HH2 ARG2081 -2.139 -10.184 3.883 429 2HH2 ARG2081 2HH2 ARG2081 -2.285 -9.809 2.226 430 H ARG2082 H ARG2082 -8.218 -10.617 8.860 431 HA ARG2082 HA ARG2082 -6.594 -12.535 10.394 432 1HB ARG2082 2HB ARG2082 -5.896 -10.749 11.910 433 2HB ARG2082 1HB ARG2082 -5.454 -10.292 10.276 434 1HG ARG2082 2HG ARG2082 -7.438 -8.854 10.154 435 2HG ARG2082 1HG ARG2082 -7.845 -9.298 11.805 436 1HD ARG2082 2HD ARG2082 -6.750 -7.134 11.751 437 2HD ARG2082 1HD ARG2082 -5.742 -8.311 12.588 438 HE ARG2082 HE ARG2082 -4.615 -8.497 10.301 439 1HH1 ARG2082 1HH1 ARG2082 -6.042 -5.417 11.434 440 2HH1 ARG2082 2HH1 ARG2082 -4.769 -4.488 10.805 441 1HH2 ARG2082 1HH2 ARG2082 -2.907 -7.100 9.391 442 2HH2 ARG2082 2HH2 ARG2082 -3.001 -5.438 9.633 443 H LYS2083 H LYS2083 -7.379 -12.727 12.688 444 HA LYS2083 HA LYS2083 -8.997 -13.052 14.273 445 1HB LYS2083 2HB LYS2083 -9.205 -10.518 14.008 446 2HB LYS2083 1HB LYS2083 -10.508 -10.802 12.876 447 1HG LYS2083 2HG LYS2083 -11.805 -11.889 14.707 448 2HG LYS2083 1HG LYS2083 -10.507 -11.464 15.826 449 1HD LYS2083 2HD LYS2083 -12.172 -9.531 14.204 450 2HD LYS2083 1HD LYS2083 -12.378 -9.876 15.915 451 1HE LYS2083 2HE LYS2083 -9.920 -8.656 14.650 452 2HE LYS2083 1HE LYS2083 -11.169 -7.775 15.523 453 1HZ LYS2083 2HZ LYS2083 -9.402 -9.867 16.691 454 2HZ LYS2083 1HZ LYS2083 -9.260 -8.204 16.911 455 3HZ LYS2083 3HZ LYS2083 -10.610 -9.008 17.509 456 H GLN2084 H GLN2084 -11.588 -13.535 14.373 457 HA GLN2084 HA GLN2084 -12.167 -15.166 12.051 458 1HB GLN2084 2HB GLN2084 -13.710 -14.848 14.647 459 2HB GLN2084 1HB GLN2084 -14.108 -15.982 13.372 460 1HG GLN2084 2HG GLN2084 -13.064 -17.236 15.068 461 2HG GLN2084 1HG GLN2084 -11.860 -17.048 13.796 462 1HE2 GLN2084 1HE2 GLN2084 -10.151 -17.354 15.140 463 2HE2 GLN2084 2HE2 GLN2084 -9.664 -16.254 16.367 464 H LYS2085 H LYS2085 -12.934 -13.944 10.427 465 HA LYS2085 HA LYS2085 -14.720 -11.772 11.172 466 1HB LYS2085 2HB LYS2085 -13.462 -12.265 8.461 467 2HB LYS2085 1HB LYS2085 -14.385 -10.850 8.940 468 1HG LYS2085 2HG LYS2085 -11.756 -11.686 10.145 469 2HG LYS2085 1HG LYS2085 -11.939 -10.476 8.890 470 1HD LYS2085 2HD LYS2085 -13.314 -10.210 11.567 471 2HD LYS2085 1HD LYS2085 -11.646 -9.716 11.341 472 1HE LYS2085 2HE LYS2085 -13.030 -7.769 11.125 473 2HE LYS2085 1HE LYS2085 -12.423 -8.174 9.526 474 1HZ LYS2085 2HZ LYS2085 -15.139 -8.841 10.540 475 2HZ LYS2085 1HZ LYS2085 -14.750 -7.521 9.577 476 3HZ LYS2085 3HZ LYS2085 -14.568 -9.059 8.959 No H/Q in entry = 476 Start of MODEL 12 1 H LEU2028 H LEU2028 1.045 -8.051 2.035 2 HA LEU2028 HA LEU2028 0.417 -10.594 3.318 3 1HB LEU2028 2HB LEU2028 -1.316 -10.935 1.463 4 2HB LEU2028 1HB LEU2028 -1.730 -9.878 2.789 5 HG LEU2028 HG LEU2028 -1.169 -7.927 1.293 6 1HD1 LEU2028 3HD1 LEU2028 0.226 -9.036 -0.347 7 2HD1 LEU2028 2HD1 LEU2028 -1.144 -10.012 -0.874 8 3HD1 LEU2028 1HD1 LEU2028 -1.161 -8.264 -1.115 9 1HD2 LEU2028 2HD2 LEU2028 -3.376 -9.773 0.424 10 2HD2 LEU2028 1HD2 LEU2028 -3.447 -8.581 1.724 11 3HD2 LEU2028 3HD2 LEU2028 -3.269 -8.054 0.052 12 H ASP2029 H ASP2029 2.759 -9.531 2.139 13 HA ASP2029 HA ASP2029 4.523 -10.027 0.868 14 1HB ASP2029 2HB ASP2029 3.710 -12.448 1.568 15 2HB ASP2029 1HB ASP2029 3.299 -12.576 -0.138 16 H VAL2030 H VAL2030 4.956 -8.935 -0.889 17 HA VAL2030 HA VAL2030 3.068 -9.144 -3.147 18 HB VAL2030 HB VAL2030 3.307 -6.790 -3.602 19 1HG1 VAL2030 1HG1 VAL2030 2.339 -7.353 -0.798 20 2HG1 VAL2030 3HG1 VAL2030 1.966 -5.892 -1.709 21 3HG1 VAL2030 2HG1 VAL2030 1.393 -7.461 -2.280 22 1HG2 VAL2030 3HG2 VAL2030 4.863 -6.639 -1.019 23 2HG2 VAL2030 2HG2 VAL2030 5.471 -6.316 -2.641 24 3HG2 VAL2030 1HG2 VAL2030 4.277 -5.239 -1.920 25 H ASP2031 H ASP2031 6.111 -9.741 -2.294 26 HA ASP2031 HA ASP2031 8.101 -10.059 -3.283 27 1HB ASP2031 2HB ASP2031 6.538 -11.289 -4.917 28 2HB ASP2031 1HB ASP2031 6.680 -9.886 -5.962 29 H LEU2032 H LEU2032 7.026 -7.399 -2.887 30 HA LEU2032 HA LEU2032 7.712 -5.278 -2.840 31 1HB LEU2032 2HB LEU2032 10.201 -6.281 -4.187 32 2HB LEU2032 1HB LEU2032 9.992 -4.678 -3.518 33 HG LEU2032 HG LEU2032 9.960 -7.254 -1.955 34 1HD1 LEU2032 2HD1 LEU2032 12.158 -6.636 -2.750 35 2HD1 LEU2032 1HD1 LEU2032 11.963 -5.019 -2.078 36 3HD1 LEU2032 3HD1 LEU2032 12.033 -6.415 -0.999 37 1HD2 LEU2032 2HD2 LEU2032 9.701 -4.391 -1.029 38 2HD2 LEU2032 1HD2 LEU2032 8.454 -5.635 -0.938 39 3HD2 LEU2032 3HD2 LEU2032 9.924 -5.786 0.026 40 H GLU2033 H GLU2033 7.486 -6.621 -6.048 41 HA GLU2033 HA GLU2033 7.750 -3.982 -7.164 42 1HB GLU2033 2HB GLU2033 7.280 -4.946 -9.375 43 2HB GLU2033 1HB GLU2033 8.596 -5.753 -8.544 44 1HG GLU2033 2HG GLU2033 7.274 -7.659 -8.114 45 2HG GLU2033 1HG GLU2033 5.794 -6.816 -8.581 46 H THR2034 H THR2034 5.107 -5.681 -5.880 47 HA THR2034 HA THR2034 3.047 -4.477 -7.391 48 HB THR2034 HB THR2034 2.979 -5.263 -4.499 49 HG1 THR2034 1HG THR2034 2.776 -6.749 -6.909 50 1HG2 THR2034 1HG2 THR2034 0.998 -4.011 -5.206 51 2HG2 THR2034 3HG2 THR2034 0.743 -5.132 -6.545 52 3HG2 THR2034 2HG2 THR2034 0.570 -5.689 -4.881 53 H ARG2035 H ARG2035 2.029 -2.559 -7.182 54 HA ARG2035 HA ARG2035 3.440 -0.537 -5.650 55 1HB ARG2035 2HB ARG2035 1.149 -0.205 -7.613 56 2HB ARG2035 1HB ARG2035 2.066 1.089 -6.869 57 1HG ARG2035 2HG ARG2035 2.895 0.943 -9.057 58 2HG ARG2035 1HG ARG2035 4.106 0.118 -8.081 59 1HD ARG2035 2HD ARG2035 3.086 -2.022 -8.681 60 2HD ARG2035 1HD ARG2035 1.911 -1.168 -9.682 61 HE ARG2035 HE ARG2035 4.311 -0.369 -10.620 62 1HH1 ARG2035 1HH1 ARG2035 2.702 -3.486 -10.128 63 2HH1 ARG2035 2HH1 ARG2035 3.559 -4.321 -11.333 64 1HH2 ARG2035 1HH2 ARG2035 5.508 -1.547 -12.389 65 2HH2 ARG2035 2HH2 ARG2035 5.182 -3.187 -12.619 66 H ILE2036 H ILE2036 2.751 0.146 -3.790 67 HA ILE2036 HA ILE2036 0.312 -0.946 -2.728 68 HB ILE2036 HB ILE2036 2.350 0.896 -1.451 69 1HG1 ILE2036 2HG1 ILE2036 3.343 -1.259 -1.929 70 2HG1 ILE2036 1HG1 ILE2036 3.046 -1.115 -0.200 71 1HG2 ILE2036 3HG2 ILE2036 0.193 1.151 -0.355 72 2HG2 ILE2036 2HG2 ILE2036 0.081 -0.596 -0.137 73 3HG2 ILE2036 1HG2 ILE2036 1.331 0.317 0.704 74 1HD1 ILE2036 2HD1 ILE2036 1.034 -2.501 -0.447 75 2HD1 ILE2036 1HD1 ILE2036 1.378 -2.685 -2.157 76 3HD1 ILE2036 3HD1 ILE2036 2.499 -3.345 -0.963 77 HA PRO2037 HA PRO2037 -2.101 2.610 -3.926 78 1HB PRO2037 2HB PRO2037 -4.249 2.017 -2.275 79 2HB PRO2037 1HB PRO2037 -4.038 1.378 -3.902 80 1HG PRO2037 2HG PRO2037 -3.468 0.116 -1.274 81 2HG PRO2037 1HG PRO2037 -4.082 -0.622 -2.761 82 1HD PRO2037 2HD PRO2037 -1.533 -0.896 -1.937 83 2HD PRO2037 1HD PRO2037 -1.970 -0.856 -3.660 84 H VAL2038 H VAL2038 -1.514 4.453 -3.158 85 HA VAL2038 HA VAL2038 -1.597 4.921 -0.272 86 HB VAL2038 HB VAL2038 0.018 6.829 -0.728 87 1HG1 VAL2038 2HG1 VAL2038 0.962 4.041 -1.408 88 2HG1 VAL2038 1HG1 VAL2038 1.990 5.381 -0.886 89 3HG1 VAL2038 3HG1 VAL2038 0.785 4.711 0.212 90 1HG2 VAL2038 3HG2 VAL2038 0.265 5.447 -3.405 91 2HG2 VAL2038 2HG2 VAL2038 -0.387 7.060 -3.130 92 3HG2 VAL2038 1HG2 VAL2038 1.319 6.733 -2.822 93 H ILE2039 H ILE2039 -2.599 6.731 0.469 94 HA ILE2039 HA ILE2039 -4.097 8.204 -1.554 95 HB ILE2039 HB ILE2039 -5.644 6.606 -0.608 96 1HG1 ILE2039 2HG1 ILE2039 -6.183 9.366 0.524 97 2HG1 ILE2039 1HG1 ILE2039 -6.473 8.882 -1.140 98 1HG2 ILE2039 3HG2 ILE2039 -4.518 6.133 1.483 99 2HG2 ILE2039 2HG2 ILE2039 -4.952 7.725 2.100 100 3HG2 ILE2039 1HG2 ILE2039 -6.212 6.539 1.758 101 1HD1 ILE2039 2HD1 ILE2039 -7.846 7.776 1.293 102 2HD1 ILE2039 1HD1 ILE2039 -8.520 8.930 0.145 103 3HD1 ILE2039 3HD1 ILE2039 -8.146 7.290 -0.378 104 H ASN2040 H ASN2040 -4.286 10.239 -1.337 105 HA ASN2040 HA ASN2040 -2.676 11.736 0.483 106 1HB ASN2040 2HB ASN2040 -3.218 12.461 -1.862 107 2HB ASN2040 1HB ASN2040 -4.893 12.654 -1.381 108 1HD2 ASN2040 1HD2 ASN2040 -2.959 14.549 -2.472 109 2HD2 ASN2040 2HD2 ASN2040 -2.826 15.822 -1.315 110 H LYS2041 H LYS2041 -3.239 12.007 2.514 111 HA LYS2041 HA LYS2041 -5.892 11.410 3.404 112 1HB LYS2041 2HB LYS2041 -3.450 12.299 4.912 113 2HB LYS2041 1HB LYS2041 -4.977 11.929 5.696 114 1HG LYS2041 2HG LYS2041 -3.311 10.016 4.044 115 2HG LYS2041 1HG LYS2041 -3.419 10.031 5.801 116 1HD LYS2041 2HD LYS2041 -5.728 9.476 3.903 117 2HD LYS2041 1HD LYS2041 -4.826 8.275 4.814 118 1HE LYS2041 2HE LYS2041 -5.587 9.192 6.899 119 2HE LYS2041 1HE LYS2041 -6.371 10.537 6.081 120 1HZ LYS2041 3HZ LYS2041 -7.171 7.676 5.806 121 2HZ LYS2041 2HZ LYS2041 -7.970 8.849 6.704 122 3HZ LYS2041 1HZ LYS2041 -7.870 8.988 5.032 123 H VAL2042 H VAL2042 -4.441 14.236 2.385 124 HA VAL2042 HA VAL2042 -6.133 15.989 3.949 125 HB VAL2042 HB VAL2042 -4.328 16.634 1.590 126 1HG1 VAL2042 2HG1 VAL2042 -6.007 18.352 1.964 127 2HG1 VAL2042 1HG1 VAL2042 -5.550 18.454 3.663 128 3HG1 VAL2042 3HG1 VAL2042 -4.407 18.947 2.412 129 1HG2 VAL2042 1HG2 VAL2042 -3.032 15.678 3.410 130 2HG2 VAL2042 3HG2 VAL2042 -2.691 17.400 3.255 131 3HG2 VAL2042 2HG2 VAL2042 -3.742 16.824 4.546 132 H ASP2043 H ASP2043 -5.656 15.213 0.537 133 HA ASP2043 HA ASP2043 -8.211 16.405 -0.170 134 1HB ASP2043 2HB ASP2043 -6.486 16.829 -1.740 135 2HB ASP2043 1HB ASP2043 -6.071 15.121 -1.848 136 H GLY2044 H GLY2044 -6.781 13.179 -0.586 137 1HA GLY2044 1HA GLY2044 -9.510 12.184 -1.025 138 2HA GLY2044 2HA GLY2044 -8.322 11.314 -0.065 139 H THR2045 H THR2045 -6.773 12.827 -2.565 140 HA THR2045 HA THR2045 -7.138 11.247 -4.812 141 HB THR2045 HB THR2045 -4.507 12.423 -3.851 142 HG1 THR2045 1HG THR2045 -6.670 13.796 -4.330 143 1HG2 THR2045 1HG2 THR2045 -5.464 11.718 -6.632 144 2HG2 THR2045 3HG2 THR2045 -3.938 12.515 -6.248 145 3HG2 THR2045 2HG2 THR2045 -4.225 10.860 -5.715 146 H LEU2046 H LEU2046 -7.120 9.080 -4.818 147 HA LEU2046 HA LEU2046 -5.117 7.586 -3.292 148 1HB LEU2046 2HB LEU2046 -7.458 6.902 -3.044 149 2HB LEU2046 1HB LEU2046 -7.602 6.699 -4.777 150 HG LEU2046 HG LEU2046 -5.913 4.863 -4.635 151 1HD1 LEU2046 1HD1 LEU2046 -4.863 5.503 -2.519 152 2HD1 LEU2046 3HD1 LEU2046 -6.362 5.081 -1.677 153 3HD1 LEU2046 2HD1 LEU2046 -5.441 3.837 -2.520 154 1HD2 LEU2046 2HD2 LEU2046 -8.432 4.528 -3.031 155 2HD2 LEU2046 1HD2 LEU2046 -8.271 4.379 -4.782 156 3HD2 LEU2046 3HD2 LEU2046 -7.476 3.215 -3.719 157 H LEU2047 H LEU2047 -3.437 6.694 -4.293 158 HA LEU2047 HA LEU2047 -3.353 6.737 -7.235 159 1HB LEU2047 2HB LEU2047 -1.059 6.287 -5.325 160 2HB LEU2047 1HB LEU2047 -0.984 6.606 -7.048 161 HG LEU2047 HG LEU2047 -1.784 8.572 -4.905 162 1HD1 LEU2047 3HD1 LEU2047 0.593 8.123 -4.935 163 2HD1 LEU2047 2HD1 LEU2047 0.642 8.441 -6.668 164 3HD1 LEU2047 1HD1 LEU2047 0.260 9.745 -5.545 165 1HD2 LEU2047 2HD2 LEU2047 -1.552 8.968 -7.886 166 2HD2 LEU2047 1HD2 LEU2047 -3.040 9.000 -6.944 167 3HD2 LEU2047 3HD2 LEU2047 -1.817 10.244 -6.700 168 H VAL2048 H VAL2048 -3.367 4.866 -8.328 169 HA VAL2048 HA VAL2048 -2.825 2.374 -6.914 170 HB VAL2048 HB VAL2048 -4.796 1.293 -8.027 171 1HG1 VAL2048 1HG1 VAL2048 -5.501 3.533 -6.148 172 2HG1 VAL2048 3HG1 VAL2048 -6.522 2.144 -6.509 173 3HG1 VAL2048 2HG1 VAL2048 -4.976 1.913 -5.689 174 1HG2 VAL2048 1HG2 VAL2048 -5.609 4.130 -8.655 175 2HG2 VAL2048 3HG2 VAL2048 -5.172 2.882 -9.825 176 3HG2 VAL2048 2HG2 VAL2048 -6.631 2.710 -8.847 177 H GLY2049 H GLY2049 -2.458 0.596 -8.418 178 1HA GLY2049 1HA GLY2049 -2.351 0.988 -11.215 179 2HA GLY2049 2HA GLY2049 -1.643 -0.349 -10.315 180 H GLU2050 H GLU2050 -0.893 1.978 -12.384 181 HA GLU2050 HA GLU2050 1.915 1.883 -11.645 182 1HB GLU2050 2HB GLU2050 0.536 2.980 -14.085 183 2HB GLU2050 1HB GLU2050 2.272 2.804 -13.883 184 1HG GLU2050 2HG GLU2050 2.122 0.447 -13.866 185 2HG GLU2050 1HG GLU2050 0.365 0.485 -13.756 186 H ASP2051 H ASP2051 -0.592 3.793 -10.974 187 HA ASP2051 HA ASP2051 0.883 6.292 -11.042 188 1HB ASP2051 2HB ASP2051 -1.510 6.029 -11.639 189 2HB ASP2051 1HB ASP2051 -1.858 5.727 -9.950 190 H ALA2052 H ALA2052 0.467 3.668 -9.085 191 HA ALA2052 HA ALA2052 1.121 5.146 -6.669 192 1HB ALA2052 1HB ALA2052 0.673 2.973 -5.520 193 2HB ALA2052 2HB ALA2052 0.260 2.272 -7.093 194 3HB ALA2052 3HB ALA2052 -0.715 3.579 -6.425 195 HA PRO2053 HA PRO2053 5.277 3.625 -7.326 196 1HB PRO2053 2HB PRO2053 5.933 3.786 -4.519 197 2HB PRO2053 1HB PRO2053 6.375 4.906 -5.807 198 1HG PRO2053 2HG PRO2053 4.644 5.554 -3.786 199 2HG PRO2053 1HG PRO2053 4.586 6.288 -5.395 200 1HD PRO2053 2HD PRO2053 2.927 4.054 -4.270 201 2HD PRO2053 1HD PRO2053 2.425 5.452 -5.244 202 H ARG2054 H ARG2054 6.370 1.729 -7.325 203 HA ARG2054 HA ARG2054 5.293 -0.739 -6.431 204 1HB ARG2054 2HB ARG2054 8.133 0.073 -7.012 205 2HB ARG2054 1HB ARG2054 7.610 -1.574 -6.733 206 1HG ARG2054 2HG ARG2054 6.406 -1.621 -8.741 207 2HG ARG2054 1HG ARG2054 6.519 0.136 -8.926 208 1HD ARG2054 2HD ARG2054 8.915 -1.587 -8.705 209 2HD ARG2054 1HD ARG2054 8.179 -1.276 -10.313 210 HE ARG2054 HE ARG2054 8.574 1.130 -8.991 211 1HH1 ARG2054 1HH1 ARG2054 10.619 -1.465 -10.283 212 2HH1 ARG2054 2HH1 ARG2054 11.955 -0.488 -10.577 213 1HH2 ARG2054 1HH2 ARG2054 10.389 2.489 -9.322 214 2HH2 ARG2054 2HH2 ARG2054 11.845 1.893 -9.953 215 H ARG2055 H ARG2055 5.648 -1.861 -4.549 216 HA ARG2055 HA ARG2055 6.129 -0.518 -2.209 217 1HB ARG2055 2HB ARG2055 4.992 -2.672 -2.304 218 2HB ARG2055 1HB ARG2055 6.475 -3.473 -2.725 219 1HG ARG2055 2HG ARG2055 5.773 -3.725 -0.328 220 2HG ARG2055 1HG ARG2055 7.421 -3.114 -0.557 221 1HD ARG2055 2HD ARG2055 6.660 -0.855 -0.120 222 2HD ARG2055 1HD ARG2055 4.991 -1.393 -0.025 223 HE ARG2055 HE ARG2055 5.497 -2.452 2.044 224 1HH1 ARG2055 1HH1 ARG2055 8.340 -0.629 0.891 225 2HH1 ARG2055 2HH1 ARG2055 8.794 -0.175 2.491 226 1HH2 ARG2055 1HH2 ARG2055 6.186 -1.777 4.153 227 2HH2 ARG2055 2HH2 ARG2055 7.587 -0.831 4.338 228 H ALA2056 H ALA2056 8.471 -2.106 -4.232 229 HA ALA2056 HA ALA2056 10.706 -2.056 -2.576 230 1HB ALA2056 2HB ALA2056 12.025 -2.276 -4.583 231 2HB ALA2056 3HB ALA2056 10.674 -1.712 -5.563 232 3HB ALA2056 1HB ALA2056 10.574 -3.262 -4.733 233 H GLU2057 H GLU2057 9.430 0.470 -4.757 234 HA GLU2057 HA GLU2057 11.599 2.308 -3.978 235 1HB GLU2057 2HB GLU2057 10.835 3.717 -5.776 236 2HB GLU2057 1HB GLU2057 10.900 2.068 -6.379 237 1HG GLU2057 2HG GLU2057 8.429 1.927 -5.905 238 2HG GLU2057 1HG GLU2057 8.473 3.653 -5.600 239 H LEU2058 H LEU2058 8.361 1.631 -3.316 240 HA LEU2058 HA LEU2058 7.122 3.988 -2.631 241 1HB LEU2058 2HB LEU2058 6.016 1.846 -2.954 242 2HB LEU2058 1HB LEU2058 6.831 1.202 -1.561 243 HG LEU2058 HG LEU2058 4.357 1.653 -1.373 244 1HD1 LEU2058 2HD1 LEU2058 5.704 1.191 0.559 245 2HD1 LEU2058 1HD1 LEU2058 6.136 2.897 0.694 246 3HD1 LEU2058 3HD1 LEU2058 4.460 2.387 0.924 247 1HD2 LEU2058 3HD2 LEU2058 5.295 4.512 -1.201 248 2HD2 LEU2058 2HD2 LEU2058 4.258 3.812 -2.445 249 3HD2 LEU2058 1HD2 LEU2058 3.678 3.937 -0.786 250 H GLU2059 H GLU2059 9.383 2.096 -0.739 251 HA GLU2059 HA GLU2059 8.789 3.106 1.801 252 1HB GLU2059 2HB GLU2059 10.277 1.139 1.214 253 2HB GLU2059 1HB GLU2059 11.524 2.317 0.836 254 1HG GLU2059 2HG GLU2059 11.906 1.520 3.002 255 2HG GLU2059 1HG GLU2059 11.342 3.186 3.137 256 H MET2060 H MET2060 11.207 4.102 -0.574 257 HA MET2060 HA MET2060 12.330 6.289 0.716 258 1HB MET2060 2HB MET2060 11.871 5.728 -2.190 259 2HB MET2060 1HB MET2060 12.631 7.218 -1.662 260 1HG MET2060 2HG MET2060 13.622 4.463 -1.022 261 2HG MET2060 1HG MET2060 14.235 5.482 -2.329 262 1HE MET2060 1HE MET2060 16.080 4.193 -0.172 263 2HE MET2060 3HE MET2060 16.676 5.282 -1.425 264 3HE MET2060 2HE MET2060 17.113 5.556 0.264 265 H TRP2061 H TRP2061 9.501 6.185 -1.327 266 HA TRP2061 HA TRP2061 9.043 8.967 -1.348 267 1HB TRP2061 2HB TRP2061 8.226 7.243 -2.997 268 2HB TRP2061 1HB TRP2061 7.032 6.767 -1.802 269 HD1 TRP2061 HD TRP2061 8.062 9.927 -3.769 270 HE1 TRP2061 1HE TRP2061 5.918 11.272 -4.274 271 HE3 TRP2061 3HE TRP2061 4.710 7.042 -1.251 272 HZ2 TRP2061 2HZ TRP2061 3.184 11.112 -3.687 273 HZ3 TRP2061 3HZ TRP2061 2.350 7.705 -1.273 274 HH2 TRP2061 HH TRP2061 1.609 9.694 -2.466 275 H LEU2062 H LEU2062 7.650 6.310 0.589 276 HA LEU2062 HA LEU2062 6.110 8.076 2.112 277 1HB LEU2062 2HB LEU2062 6.755 5.198 2.564 278 2HB LEU2062 1HB LEU2062 5.852 6.133 3.743 279 HG LEU2062 HG LEU2062 5.031 5.499 0.911 280 1HD1 LEU2062 2HD1 LEU2062 4.779 3.724 2.523 281 2HD1 LEU2062 1HD1 LEU2062 3.837 4.784 3.573 282 3HD1 LEU2062 3HD1 LEU2062 3.206 4.326 1.984 283 1HD2 LEU2062 1HD2 LEU2062 3.669 7.278 2.946 284 2HD2 LEU2062 3HD2 LEU2062 4.296 7.769 1.367 285 3HD2 LEU2062 2HD2 LEU2062 2.922 6.676 1.472 286 H GLN2063 H GLN2063 9.408 7.058 2.554 287 HA GLN2063 HA GLN2063 9.748 7.853 5.183 288 1HB GLN2063 2HB GLN2063 11.615 8.256 2.840 289 2HB GLN2063 1HB GLN2063 12.067 8.509 4.510 290 1HG GLN2063 2HG GLN2063 11.237 5.893 3.274 291 2HG GLN2063 1HG GLN2063 12.887 6.387 3.632 292 1HE2 GLN2063 1HE2 GLN2063 9.909 5.297 4.913 293 2HE2 GLN2063 2HE2 GLN2063 10.441 4.927 6.497 294 H GLY2064 H GLY2064 9.553 9.792 2.270 295 1HA GLY2064 1HA GLY2064 9.499 12.088 2.023 296 2HA GLY2064 2HA GLY2064 9.978 12.245 3.710 297 H HIS2065 H HIS2065 7.318 10.326 2.669 298 HA HIS2065 HA HIS2065 5.087 10.732 2.425 299 1HB HIS2065 2HB HIS2065 3.911 10.791 4.626 300 2HB HIS2065 1HB HIS2065 5.155 9.561 4.511 301 HD1 HIS2065 1HD HIS2065 7.232 9.870 6.083 302 HD2 HIS2065 2HD HIS2065 4.282 12.748 6.531 303 HE1 HIS2065 1HE HIS2065 7.739 11.077 8.259 304 HA PRO2066 HA PRO2066 4.857 15.129 1.658 305 1HB PRO2066 2HB PRO2066 2.900 14.146 -0.334 306 2HB PRO2066 1HB PRO2066 4.275 15.229 -0.557 307 1HG PRO2066 2HG PRO2066 4.332 12.700 -1.434 308 2HG PRO2066 1HG PRO2066 5.782 13.493 -0.784 309 1HD PRO2066 2HD PRO2066 3.981 11.483 0.488 310 2HD PRO2066 1HD PRO2066 5.749 11.659 0.604 311 H GLU2067 H GLU2067 2.003 13.176 1.184 312 HA GLU2067 HA GLU2067 0.590 14.162 3.448 313 1HB GLU2067 2HB GLU2067 -1.226 15.299 2.066 314 2HB GLU2067 1HB GLU2067 0.292 16.176 2.187 315 1HG GLU2067 2HG GLU2067 0.863 15.119 -0.072 316 2HG GLU2067 1HG GLU2067 -0.848 14.704 -0.162 317 H PHE2068 H PHE2068 1.427 11.802 2.119 318 HA PHE2068 HA PHE2068 -1.155 10.527 1.511 319 1HB PHE2068 2HB PHE2068 1.547 10.026 0.284 320 2HB PHE2068 1HB PHE2068 0.210 8.900 0.152 321 HD1 PHE2068 1HD PHE2068 -1.250 9.079 -1.618 322 HD2 PHE2068 2HD PHE2068 1.123 12.456 -0.579 323 HE1 PHE2068 1HE PHE2068 -2.011 10.233 -3.640 324 HE2 PHE2068 2HE PHE2068 0.358 13.614 -2.607 325 HZ PHE2068 HZ PHE2068 -1.212 12.489 -4.142 326 H ALA2069 H ALA2069 -1.450 8.472 2.252 327 HA ALA2069 HA ALA2069 0.593 7.207 3.897 328 1HB ALA2069 2HB ALA2069 -0.838 8.426 5.487 329 2HB ALA2069 3HB ALA2069 -1.102 6.689 5.630 330 3HB ALA2069 1HB ALA2069 -2.270 7.687 4.767 331 H VAL2070 H VAL2070 -0.295 4.879 4.396 332 HA VAL2070 HA VAL2070 -0.958 3.716 1.877 333 HB VAL2070 HB VAL2070 -0.841 2.420 4.631 334 1HG1 VAL2070 1HG1 VAL2070 -2.133 1.063 3.061 335 2HG1 VAL2070 3HG1 VAL2070 -0.810 1.130 1.899 336 3HG1 VAL2070 2HG1 VAL2070 -0.592 0.290 3.436 337 1HG2 VAL2070 2HG2 VAL2070 1.298 3.417 3.971 338 2HG2 VAL2070 1HG2 VAL2070 1.389 1.654 3.969 339 3HG2 VAL2070 3HG2 VAL2070 1.242 2.536 2.449 340 H ASP2071 H ASP2071 -2.848 2.965 1.135 341 HA ASP2071 HA ASP2071 -5.288 3.952 1.970 342 1HB ASP2071 2HB ASP2071 -5.032 3.207 -0.284 343 2HB ASP2071 1HB ASP2071 -4.591 1.589 0.239 344 HA PRO2072 HA PRO2072 -6.077 1.510 5.659 345 1HB PRO2072 2HB PRO2072 -8.821 2.553 5.183 346 2HB PRO2072 1HB PRO2072 -7.838 2.616 6.648 347 1HG PRO2072 2HG PRO2072 -8.165 4.788 5.182 348 2HG PRO2072 1HG PRO2072 -6.583 4.414 5.885 349 1HD PRO2072 2HD PRO2072 -7.533 4.065 3.069 350 2HD PRO2072 1HD PRO2072 -5.963 4.643 3.681 351 H ARG2073 H ARG2073 -8.024 1.401 2.768 352 HA ARG2073 HA ARG2073 -9.515 -0.900 3.474 353 1HB ARG2073 2HB ARG2073 -10.363 0.654 1.838 354 2HB ARG2073 1HB ARG2073 -8.945 0.481 0.843 355 1HG ARG2073 2HG ARG2073 -10.885 -1.767 1.319 356 2HG ARG2073 1HG ARG2073 -11.120 -0.585 0.029 357 1HD ARG2073 2HD ARG2073 -8.930 -2.636 0.350 358 2HD ARG2073 1HD ARG2073 -10.065 -2.436 -0.984 359 HE ARG2073 HE ARG2073 -8.104 -0.313 -0.450 360 1HH1 ARG2073 1HH1 ARG2073 -9.168 -2.897 -2.623 361 2HH1 ARG2073 2HH1 ARG2073 -8.178 -2.349 -3.906 362 1HH2 ARG2073 1HH2 ARG2073 -6.805 0.340 -2.086 363 2HH2 ARG2073 2HH2 ARG2073 -6.759 -0.480 -3.606 364 H PHE2074 H PHE2074 -6.596 -0.414 1.539 365 HA PHE2074 HA PHE2074 -6.101 -3.098 0.927 366 1HB PHE2074 2HB PHE2074 -4.941 -1.299 -0.242 367 2HB PHE2074 1HB PHE2074 -4.164 -0.795 1.256 368 HD1 PHE2074 1HD PHE2074 -4.396 -3.559 -1.198 369 HD2 PHE2074 2HD PHE2074 -2.128 -1.728 1.904 370 HE1 PHE2074 1HE PHE2074 -2.502 -5.046 -1.709 371 HE2 PHE2074 2HE PHE2074 -0.241 -3.200 1.401 372 HZ PHE2074 HZ PHE2074 -0.418 -4.867 -0.412 373 H LEU2075 H LEU2075 -4.888 -1.125 3.616 374 HA LEU2075 HA LEU2075 -3.505 -3.311 4.674 375 1HB LEU2075 2HB LEU2075 -3.097 -1.945 6.706 376 2HB LEU2075 1HB LEU2075 -2.533 -1.293 5.191 377 HG LEU2075 HG LEU2075 -4.725 0.068 5.264 378 1HD1 LEU2075 1HD1 LEU2075 -4.362 -0.596 8.186 379 2HD1 LEU2075 3HD1 LEU2075 -5.419 0.660 7.546 380 3HD1 LEU2075 2HD1 LEU2075 -5.740 -1.036 7.180 381 1HD2 LEU2075 3HD2 LEU2075 -2.482 0.837 5.315 382 2HD2 LEU2075 2HD2 LEU2075 -3.501 1.833 6.382 383 3HD2 LEU2075 1HD2 LEU2075 -2.395 0.606 7.054 384 H ALA2076 H ALA2076 -6.752 -2.359 5.083 385 HA ALA2076 HA ALA2076 -7.246 -4.003 7.358 386 1HB ALA2076 1HB ALA2076 -9.618 -3.792 6.734 387 2HB ALA2076 2HB ALA2076 -9.150 -3.088 5.187 388 3HB ALA2076 3HB ALA2076 -8.811 -2.224 6.685 389 H TYR2077 H TYR2077 -7.160 -4.478 3.885 390 HA TYR2077 HA TYR2077 -8.463 -6.943 3.755 391 1HB TYR2077 2HB TYR2077 -8.121 -5.541 1.767 392 2HB TYR2077 1HB TYR2077 -6.388 -5.814 1.870 393 HD1 TYR2077 1HD TYR2077 -9.547 -7.776 1.685 394 HD2 TYR2077 2HD TYR2077 -5.484 -7.462 0.546 395 HE1 TYR2077 1HE TYR2077 -9.792 -9.808 0.339 396 HE2 TYR2077 2HE TYR2077 -5.699 -9.496 -0.816 397 HH TYR2077 HH TYR2077 -8.701 -10.872 -1.581 398 H MET2078 H MET2078 -5.086 -6.200 4.381 399 HA MET2078 HA MET2078 -4.056 -8.771 3.965 400 1HB MET2078 2HB MET2078 -2.155 -8.181 5.425 401 2HB MET2078 1HB MET2078 -2.536 -6.903 4.282 402 1HG MET2078 2HG MET2078 -3.659 -5.648 6.034 403 2HG MET2078 1HG MET2078 -3.355 -6.945 7.176 404 1HE MET2078 2HE MET2078 -1.047 -7.470 8.266 405 2HE MET2078 1HE MET2078 -0.397 -7.837 6.667 406 3HE MET2078 3HE MET2078 0.476 -6.751 7.748 407 H GLU2079 H GLU2079 -5.412 -7.442 6.960 408 HA GLU2079 HA GLU2079 -5.069 -9.962 8.241 409 1HB GLU2079 2HB GLU2079 -6.190 -8.922 10.209 410 2HB GLU2079 1HB GLU2079 -4.737 -8.107 9.676 411 1HG GLU2079 2HG GLU2079 -6.186 -6.430 8.537 412 2HG GLU2079 1HG GLU2079 -7.581 -7.222 9.277 413 H ASP2080 H ASP2080 -7.615 -8.354 6.586 414 HA ASP2080 HA ASP2080 -9.715 -10.081 7.432 415 1HB ASP2080 2HB ASP2080 -10.193 -7.897 6.399 416 2HB ASP2080 1HB ASP2080 -9.473 -8.450 4.892 417 H ARG2081 H ARG2081 -7.260 -10.314 5.003 418 HA ARG2081 HA ARG2081 -8.285 -12.612 3.674 419 1HB ARG2081 2HB ARG2081 -6.519 -11.007 2.776 420 2HB ARG2081 1HB ARG2081 -5.397 -11.680 3.935 421 1HG ARG2081 2HG ARG2081 -6.716 -13.374 1.823 422 2HG ARG2081 1HG ARG2081 -5.250 -12.457 1.513 423 1HD ARG2081 2HD ARG2081 -5.583 -14.578 3.637 424 2HD ARG2081 1HD ARG2081 -4.792 -14.812 2.082 425 HE ARG2081 HE ARG2081 -3.838 -13.120 4.283 426 1HH1 ARG2081 1HH1 ARG2081 -3.162 -14.833 1.229 427 2HH1 ARG2081 2HH1 ARG2081 -1.473 -14.721 1.400 428 1HH2 ARG2081 1HH2 ARG2081 -1.493 -12.952 4.449 429 2HH2 ARG2081 2HH2 ARG2081 -0.508 -13.654 3.226 430 H ARG2082 H ARG2082 -8.800 -14.279 4.909 431 HA ARG2082 HA ARG2082 -6.948 -15.408 6.856 432 1HB ARG2082 2HB ARG2082 -8.350 -13.517 7.824 433 2HB ARG2082 1HB ARG2082 -9.753 -14.494 7.474 434 1HG ARG2082 2HG ARG2082 -8.891 -16.208 9.015 435 2HG ARG2082 1HG ARG2082 -7.531 -15.138 9.387 436 1HD ARG2082 2HD ARG2082 -10.455 -14.620 9.865 437 2HD ARG2082 1HD ARG2082 -9.191 -14.811 11.087 438 HE ARG2082 HE ARG2082 -8.247 -12.742 9.788 439 1HH1 ARG2082 1HH1 ARG2082 -11.544 -13.314 10.962 440 2HH1 ARG2082 2HH1 ARG2082 -12.029 -11.692 10.885 441 1HH2 ARG2082 1HH2 ARG2082 -8.874 -10.529 9.695 442 2HH2 ARG2082 2HH2 ARG2082 -10.446 -10.014 10.126 443 H LYS2083 H LYS2083 -7.947 -17.552 7.561 444 HA LYS2083 HA LYS2083 -9.180 -18.916 5.404 445 1HB LYS2083 2HB LYS2083 -8.652 -19.705 8.260 446 2HB LYS2083 1HB LYS2083 -9.599 -20.740 7.213 447 1HG LYS2083 2HG LYS2083 -7.328 -21.521 7.288 448 2HG LYS2083 1HG LYS2083 -7.679 -20.902 5.677 449 1HD LYS2083 2HD LYS2083 -6.509 -18.819 6.235 450 2HD LYS2083 1HD LYS2083 -6.168 -19.446 7.850 451 1HE LYS2083 2HE LYS2083 -4.241 -19.726 6.422 452 2HE LYS2083 1HE LYS2083 -4.906 -21.305 6.842 453 1HZ LYS2083 1HZ LYS2083 -6.039 -21.263 4.624 454 2HZ LYS2083 3HZ LYS2083 -5.163 -19.847 4.274 455 3HZ LYS2083 2HZ LYS2083 -4.355 -21.290 4.574 456 H GLN2084 H GLN2084 -11.196 -19.337 4.943 457 HA GLN2084 HA GLN2084 -13.231 -17.753 6.275 458 1HB GLN2084 2HB GLN2084 -13.389 -19.468 3.784 459 2HB GLN2084 1HB GLN2084 -14.556 -18.262 4.293 460 1HG GLN2084 2HG GLN2084 -12.975 -16.486 3.917 461 2HG GLN2084 1HG GLN2084 -11.700 -17.649 3.570 462 1HE2 GLN2084 1HE2 GLN2084 -15.023 -17.888 2.418 463 2HE2 GLN2084 2HE2 GLN2084 -14.625 -17.694 0.754 464 H LYS2085 H LYS2085 -15.452 -18.928 6.399 465 HA LYS2085 HA LYS2085 -15.041 -21.295 8.035 466 1HB LYS2085 2HB LYS2085 -17.386 -21.114 8.633 467 2HB LYS2085 1HB LYS2085 -16.610 -19.544 8.793 468 1HG LYS2085 2HG LYS2085 -17.602 -18.809 6.707 469 2HG LYS2085 1HG LYS2085 -18.304 -20.402 6.449 470 1HD LYS2085 2HD LYS2085 -18.977 -18.482 8.687 471 2HD LYS2085 1HD LYS2085 -19.988 -18.854 7.291 472 1HE LYS2085 2HE LYS2085 -19.969 -21.265 8.075 473 2HE LYS2085 1HE LYS2085 -19.198 -20.686 9.540 474 1HZ LYS2085 2HZ LYS2085 -21.140 -19.295 9.973 475 2HZ LYS2085 1HZ LYS2085 -21.864 -19.856 8.564 476 3HZ LYS2085 3HZ LYS2085 -21.559 -20.918 9.824 No H/Q in entry = 476 Start of MODEL 13 1 H LEU2028 H LEU2028 -1.762 -9.847 -4.817 2 HA LEU2028 HA LEU2028 -1.241 -7.139 -4.117 3 1HB LEU2028 2HB LEU2028 -3.521 -8.194 -4.552 4 2HB LEU2028 1HB LEU2028 -3.388 -8.886 -2.945 5 HG LEU2028 HG LEU2028 -3.237 -6.637 -1.994 6 1HD1 LEU2028 3HD1 LEU2028 -3.726 -5.753 -4.839 7 2HD1 LEU2028 2HD1 LEU2028 -3.804 -4.694 -3.434 8 3HD1 LEU2028 1HD1 LEU2028 -2.272 -5.445 -3.894 9 1HD2 LEU2028 2HD2 LEU2028 -5.385 -7.741 -2.164 10 2HD2 LEU2028 1HD2 LEU2028 -5.565 -5.998 -2.392 11 3HD2 LEU2028 3HD2 LEU2028 -5.610 -7.080 -3.785 12 H ASP2029 H ASP2029 -0.638 -10.206 -2.759 13 HA ASP2029 HA ASP2029 0.246 -9.025 -0.281 14 1HB ASP2029 2HB ASP2029 1.285 -11.315 0.189 15 2HB ASP2029 1HB ASP2029 -0.461 -11.305 0.029 16 H VAL2030 H VAL2030 1.677 -7.674 -0.527 17 HA VAL2030 HA VAL2030 3.489 -7.784 -2.760 18 HB VAL2030 HB VAL2030 3.099 -5.605 -0.745 19 1HG1 VAL2030 3HG1 VAL2030 4.483 -5.666 -3.392 20 2HG1 VAL2030 2HG1 VAL2030 4.034 -4.176 -2.556 21 3HG1 VAL2030 1HG1 VAL2030 5.163 -5.321 -1.818 22 1HG2 VAL2030 2HG2 VAL2030 1.825 -6.179 -3.340 23 2HG2 VAL2030 1HG2 VAL2030 1.026 -6.020 -1.787 24 3HG2 VAL2030 3HG2 VAL2030 1.746 -4.585 -2.561 25 H ASP2031 H ASP2031 5.414 -8.568 -2.603 26 HA ASP2031 HA ASP2031 6.889 -8.678 -0.147 27 1HB ASP2031 2HB ASP2031 7.839 -8.949 -3.017 28 2HB ASP2031 1HB ASP2031 8.877 -9.157 -1.618 29 H LEU2032 H LEU2032 6.901 -6.906 -2.987 30 HA LEU2032 HA LEU2032 7.425 -4.418 -2.032 31 1HB LEU2032 2HB LEU2032 9.842 -4.008 -2.553 32 2HB LEU2032 1HB LEU2032 9.477 -4.904 -1.099 33 HG LEU2032 HG LEU2032 10.002 -6.997 -2.519 34 1HD1 LEU2032 2HD1 LEU2032 10.031 -5.903 -4.688 35 2HD1 LEU2032 1HD1 LEU2032 11.404 -4.924 -4.185 36 3HD1 LEU2032 3HD1 LEU2032 11.580 -6.678 -4.331 37 1HD2 LEU2032 1HD2 LEU2032 11.321 -6.177 -0.672 38 2HD2 LEU2032 3HD2 LEU2032 12.340 -6.824 -1.954 39 3HD2 LEU2032 2HD2 LEU2032 12.173 -5.069 -1.754 40 H GLU2033 H GLU2033 7.292 -6.453 -4.777 41 HA GLU2033 HA GLU2033 8.168 -4.381 -6.617 42 1HB GLU2033 2HB GLU2033 6.878 -7.020 -7.246 43 2HB GLU2033 1HB GLU2033 7.716 -5.968 -8.367 44 1HG GLU2033 2HG GLU2033 9.794 -6.318 -7.061 45 2HG GLU2033 1HG GLU2033 8.915 -7.499 -6.084 46 H THR2034 H THR2034 5.280 -5.362 -5.169 47 HA THR2034 HA THR2034 3.547 -4.544 -7.281 48 HB THR2034 HB THR2034 2.965 -5.080 -4.407 49 HG1 THR2034 1HG THR2034 2.259 -7.202 -5.516 50 1HG2 THR2034 2HG2 THR2034 1.113 -5.200 -6.808 51 2HG2 THR2034 1HG2 THR2034 0.728 -5.686 -5.139 52 3HG2 THR2034 3HG2 THR2034 1.103 -4.011 -5.489 53 H ARG2035 H ARG2035 2.141 -2.788 -7.229 54 HA ARG2035 HA ARG2035 3.297 -0.426 -6.074 55 1HB ARG2035 2HB ARG2035 1.023 -0.858 -8.021 56 2HB ARG2035 1HB ARG2035 1.471 0.718 -7.395 57 1HG ARG2035 2HG ARG2035 2.407 0.461 -9.588 58 2HG ARG2035 1HG ARG2035 3.713 0.451 -8.410 59 1HD ARG2035 2HD ARG2035 3.791 -2.005 -8.554 60 2HD ARG2035 1HD ARG2035 2.514 -1.965 -9.770 61 HE ARG2035 HE ARG2035 4.497 -0.289 -10.647 62 1HH1 ARG2035 1HH1 ARG2035 4.214 -3.790 -9.946 63 2HH1 ARG2035 2HH1 ARG2035 5.394 -4.234 -11.064 64 1HH2 ARG2035 1HH2 ARG2035 6.086 -0.953 -12.220 65 2HH2 ARG2035 2HH2 ARG2035 6.475 -2.599 -12.387 66 H ILE2036 H ILE2036 2.698 0.303 -4.223 67 HA ILE2036 HA ILE2036 0.415 -0.816 -2.860 68 HB ILE2036 HB ILE2036 2.385 1.276 -1.952 69 1HG1 ILE2036 2HG1 ILE2036 3.478 -0.843 -2.386 70 2HG1 ILE2036 1HG1 ILE2036 3.446 -0.525 -0.653 71 1HG2 ILE2036 2HG2 ILE2036 0.319 1.436 -0.682 72 2HG2 ILE2036 1HG2 ILE2036 0.380 -0.288 -0.325 73 3HG2 ILE2036 3HG2 ILE2036 1.610 0.791 0.337 74 1HD1 ILE2036 1HD1 ILE2036 1.559 -2.078 -0.432 75 2HD1 ILE2036 3HD1 ILE2036 1.636 -2.393 -2.165 76 3HD1 ILE2036 2HD1 ILE2036 2.982 -2.855 -1.129 77 HA PRO2037 HA PRO2037 -2.092 2.656 -4.114 78 1HB PRO2037 2HB PRO2037 -4.279 1.936 -2.613 79 2HB PRO2037 1HB PRO2037 -3.921 1.275 -4.209 80 1HG PRO2037 2HG PRO2037 -3.432 0.082 -1.529 81 2HG PRO2037 1HG PRO2037 -3.966 -0.698 -3.027 82 1HD PRO2037 2HD PRO2037 -1.433 -0.823 -2.096 83 2HD PRO2037 1HD PRO2037 -1.828 -0.890 -3.826 84 H VAL2038 H VAL2038 -1.850 4.542 -3.225 85 HA VAL2038 HA VAL2038 -1.887 4.759 -0.311 86 HB VAL2038 HB VAL2038 -0.247 6.673 -0.526 87 1HG1 VAL2038 3HG1 VAL2038 0.422 4.475 0.311 88 2HG1 VAL2038 2HG1 VAL2038 0.759 3.951 -1.342 89 3HG1 VAL2038 1HG1 VAL2038 1.708 5.249 -0.614 90 1HG2 VAL2038 3HG2 VAL2038 -0.488 7.066 -2.929 91 2HG2 VAL2038 2HG2 VAL2038 1.194 6.728 -2.520 92 3HG2 VAL2038 1HG2 VAL2038 0.198 5.480 -3.264 93 H ILE2039 H ILE2039 -2.696 6.611 0.550 94 HA ILE2039 HA ILE2039 -4.366 8.135 -1.319 95 HB ILE2039 HB ILE2039 -5.708 6.681 0.172 96 1HG1 ILE2039 2HG1 ILE2039 -6.016 9.635 0.795 97 2HG1 ILE2039 1HG1 ILE2039 -6.625 8.827 -0.641 98 1HG2 ILE2039 1HG2 ILE2039 -4.237 6.591 2.128 99 2HG2 ILE2039 3HG2 ILE2039 -4.521 8.300 2.445 100 3HG2 ILE2039 2HG2 ILE2039 -5.841 7.151 2.605 101 1HD1 ILE2039 1HD1 ILE2039 -8.112 7.481 0.754 102 2HD1 ILE2039 3HD1 ILE2039 -7.495 8.301 2.188 103 3HD1 ILE2039 2HD1 ILE2039 -8.392 9.205 0.966 104 H ASN2040 H ASN2040 -4.184 10.248 -1.298 105 HA ASN2040 HA ASN2040 -2.259 11.547 0.424 106 1HB ASN2040 2HB ASN2040 -2.738 12.400 -1.916 107 2HB ASN2040 1HB ASN2040 -4.358 12.806 -1.339 108 1HD2 ASN2040 1HD2 ASN2040 -0.975 13.661 -1.163 109 2HD2 ASN2040 2HD2 ASN2040 -1.217 15.196 -0.442 110 H LYS2041 H LYS2041 -2.694 12.213 2.376 111 HA LYS2041 HA LYS2041 -5.118 11.636 3.677 112 1HB LYS2041 2HB LYS2041 -3.102 13.664 4.586 113 2HB LYS2041 1HB LYS2041 -4.196 12.727 5.585 114 1HG LYS2041 2HG LYS2041 -2.937 10.734 5.217 115 2HG LYS2041 1HG LYS2041 -1.956 11.521 3.972 116 1HD LYS2041 2HD LYS2041 -1.340 13.207 5.764 117 2HD LYS2041 1HD LYS2041 -2.049 12.048 6.895 118 1HE LYS2041 2HE LYS2041 -0.418 10.416 6.387 119 2HE LYS2041 1HE LYS2041 0.153 11.319 4.982 120 1HZ LYS2041 3HZ LYS2041 0.871 13.094 6.512 121 2HZ LYS2041 2HZ LYS2041 0.432 12.138 7.822 122 3HZ LYS2041 1HZ LYS2041 1.683 11.651 6.826 123 H VAL2042 H VAL2042 -3.843 14.566 2.293 124 HA VAL2042 HA VAL2042 -5.649 16.358 3.554 125 HB VAL2042 HB VAL2042 -3.867 16.803 1.164 126 1HG1 VAL2042 1HG1 VAL2042 -5.547 18.523 1.397 127 2HG1 VAL2042 3HG1 VAL2042 -5.105 18.762 3.087 128 3HG1 VAL2042 2HG1 VAL2042 -3.953 19.159 1.808 129 1HG2 VAL2042 2HG2 VAL2042 -3.293 17.207 4.096 130 2HG2 VAL2042 1HG2 VAL2042 -2.565 15.995 3.047 131 3HG2 VAL2042 3HG2 VAL2042 -2.237 17.704 2.772 132 H ASP2043 H ASP2043 -5.253 15.326 0.185 133 HA ASP2043 HA ASP2043 -7.757 16.617 -0.478 134 1HB ASP2043 2HB ASP2043 -5.957 16.934 -2.036 135 2HB ASP2043 1HB ASP2043 -5.772 15.192 -2.236 136 H GLY2044 H GLY2044 -6.504 13.333 -0.353 137 1HA GLY2044 1HA GLY2044 -9.248 12.386 -0.786 138 2HA GLY2044 2HA GLY2044 -7.995 11.524 0.103 139 H THR2045 H THR2045 -6.447 12.828 -2.439 140 HA THR2045 HA THR2045 -7.067 11.389 -4.705 141 HB THR2045 HB THR2045 -4.262 12.041 -3.804 142 HG1 THR2045 1HG THR2045 -6.408 13.807 -4.338 143 1HG2 THR2045 3HG2 THR2045 -5.618 12.122 -6.511 144 2HG2 THR2045 2HG2 THR2045 -3.935 12.535 -6.191 145 3HG2 THR2045 1HG2 THR2045 -4.497 10.881 -5.953 146 H LEU2046 H LEU2046 -7.104 9.179 -4.935 147 HA LEU2046 HA LEU2046 -5.326 7.586 -3.242 148 1HB LEU2046 2HB LEU2046 -7.753 7.153 -2.967 149 2HB LEU2046 1HB LEU2046 -7.860 6.756 -4.669 150 HG LEU2046 HG LEU2046 -6.288 4.860 -4.266 151 1HD1 LEU2046 3HD1 LEU2046 -6.743 5.527 -1.371 152 2HD1 LEU2046 2HD1 LEU2046 -5.964 4.068 -1.985 153 3HD1 LEU2046 1HD1 LEU2046 -5.210 5.639 -2.241 154 1HD2 LEU2046 1HD2 LEU2046 -8.859 4.855 -2.702 155 2HD2 LEU2046 3HD2 LEU2046 -8.652 4.465 -4.414 156 3HD2 LEU2046 2HD2 LEU2046 -7.944 3.423 -3.178 157 H LEU2047 H LEU2047 -3.724 6.673 -4.197 158 HA LEU2047 HA LEU2047 -3.567 6.644 -7.144 159 1HB LEU2047 2HB LEU2047 -1.396 6.225 -5.098 160 2HB LEU2047 1HB LEU2047 -1.187 6.393 -6.827 161 HG LEU2047 HG LEU2047 -2.071 8.542 -4.909 162 1HD1 LEU2047 2HD1 LEU2047 0.474 8.159 -6.465 163 2HD1 LEU2047 1HD1 LEU2047 0.061 9.597 -5.526 164 3HD1 LEU2047 3HD1 LEU2047 0.273 8.047 -4.721 165 1HD2 LEU2047 2HD2 LEU2047 -1.633 8.702 -7.893 166 2HD2 LEU2047 1HD2 LEU2047 -3.187 8.835 -7.059 167 3HD2 LEU2047 3HD2 LEU2047 -1.947 10.067 -6.827 168 H VAL2048 H VAL2048 -4.086 4.823 -8.073 169 HA VAL2048 HA VAL2048 -3.267 2.322 -6.770 170 HB VAL2048 HB VAL2048 -5.308 1.205 -7.629 171 1HG1 VAL2048 2HG1 VAL2048 -5.912 3.579 -5.882 172 2HG1 VAL2048 1HG1 VAL2048 -6.950 2.165 -6.075 173 3HG1 VAL2048 3HG1 VAL2048 -5.359 1.998 -5.341 174 1HG2 VAL2048 3HG2 VAL2048 -5.784 2.679 -9.507 175 2HG2 VAL2048 2HG2 VAL2048 -7.202 2.513 -8.471 176 3HG2 VAL2048 1HG2 VAL2048 -6.215 3.975 -8.393 177 H GLY2049 H GLY2049 -3.011 0.522 -8.293 178 1HA GLY2049 1HA GLY2049 -3.287 0.770 -11.072 179 2HA GLY2049 2HA GLY2049 -2.400 -0.485 -10.236 180 H GLU2050 H GLU2050 -2.202 2.368 -12.063 181 HA GLU2050 HA GLU2050 0.682 1.984 -12.254 182 1HB GLU2050 2HB GLU2050 0.528 3.270 -14.360 183 2HB GLU2050 1HB GLU2050 -0.467 1.821 -14.358 184 1HG GLU2050 2HG GLU2050 -2.447 3.158 -13.925 185 2HG GLU2050 1HG GLU2050 -1.458 4.619 -13.875 186 H ASP2051 H ASP2051 -1.485 4.077 -10.862 187 HA ASP2051 HA ASP2051 0.404 6.295 -10.916 188 1HB ASP2051 2HB ASP2051 -2.388 5.925 -10.247 189 2HB ASP2051 1HB ASP2051 -1.580 7.267 -9.398 190 H ALA2052 H ALA2052 -0.244 3.653 -9.126 191 HA ALA2052 HA ALA2052 0.527 4.804 -6.597 192 1HB ALA2052 2HB ALA2052 0.184 2.485 -5.749 193 2HB ALA2052 3HB ALA2052 -0.201 1.986 -7.402 194 3HB ALA2052 1HB ALA2052 -1.219 3.164 -6.579 195 HA PRO2053 HA PRO2053 4.763 3.659 -7.483 196 1HB PRO2053 2HB PRO2053 5.489 3.916 -4.700 197 2HB PRO2053 1HB PRO2053 5.800 5.040 -6.021 198 1HG PRO2053 2HG PRO2053 4.089 5.612 -3.973 199 2HG PRO2053 1HG PRO2053 3.894 6.257 -5.606 200 1HD PRO2053 2HD PRO2053 2.524 3.902 -4.345 201 2HD PRO2053 1HD PRO2053 1.832 5.240 -5.298 202 H ARG2054 H ARG2054 6.206 1.966 -7.347 203 HA ARG2054 HA ARG2054 5.396 -0.570 -6.464 204 1HB ARG2054 2HB ARG2054 6.898 -0.279 -8.335 205 2HB ARG2054 1HB ARG2054 8.010 0.655 -7.359 206 1HG ARG2054 2HG ARG2054 8.431 -1.372 -6.020 207 2HG ARG2054 1HG ARG2054 7.445 -2.275 -7.180 208 1HD ARG2054 2HD ARG2054 9.873 -0.643 -7.936 209 2HD ARG2054 1HD ARG2054 9.937 -2.363 -7.590 210 HE ARG2054 HE ARG2054 8.653 -2.773 -9.530 211 1HH1 ARG2054 1HH1 ARG2054 9.447 0.736 -9.321 212 2HH1 ARG2054 2HH1 ARG2054 9.612 0.873 -11.002 213 1HH2 ARG2054 1HH2 ARG2054 8.867 -2.440 -11.835 214 2HH2 ARG2054 2HH2 ARG2054 9.260 -0.895 -12.440 215 H ARG2055 H ARG2055 5.740 -1.493 -4.507 216 HA ARG2055 HA ARG2055 6.074 0.020 -2.297 217 1HB ARG2055 2HB ARG2055 5.040 -2.142 -2.252 218 2HB ARG2055 1HB ARG2055 6.579 -2.907 -2.523 219 1HG ARG2055 2HG ARG2055 7.427 -2.101 -0.385 220 2HG ARG2055 1HG ARG2055 5.953 -1.186 -0.112 221 1HD ARG2055 2HD ARG2055 4.699 -3.283 -0.083 222 2HD ARG2055 1HD ARG2055 6.215 -4.180 -0.239 223 HE ARG2055 HE ARG2055 6.436 -2.400 1.900 224 1HH1 ARG2055 1HH1 ARG2055 4.820 -5.512 1.187 225 2HH1 ARG2055 2HH1 ARG2055 4.669 -5.914 2.830 226 1HH2 ARG2055 1HH2 ARG2055 6.171 -2.997 4.108 227 2HH2 ARG2055 2HH2 ARG2055 5.447 -4.471 4.526 228 H ALA2056 H ALA2056 8.639 -1.714 -3.946 229 HA ALA2056 HA ALA2056 10.725 -1.494 -2.129 230 1HB ALA2056 2HB ALA2056 12.211 -1.794 -4.035 231 2HB ALA2056 3HB ALA2056 10.903 -1.372 -5.137 232 3HB ALA2056 1HB ALA2056 10.799 -2.844 -4.174 233 H GLU2057 H GLU2057 9.327 0.918 -4.177 234 HA GLU2057 HA GLU2057 11.484 2.868 -3.706 235 1HB GLU2057 2HB GLU2057 8.992 3.122 -5.412 236 2HB GLU2057 1HB GLU2057 10.436 4.125 -5.490 237 1HG GLU2057 2HG GLU2057 11.729 2.204 -6.310 238 2HG GLU2057 1HG GLU2057 10.270 1.215 -6.178 239 H LEU2058 H LEU2058 8.145 2.151 -3.274 240 HA LEU2058 HA LEU2058 6.900 4.380 -2.371 241 1HB LEU2058 2HB LEU2058 5.887 2.204 -2.959 242 2HB LEU2058 1HB LEU2058 6.589 1.574 -1.488 243 HG LEU2058 HG LEU2058 4.081 1.997 -1.572 244 1HD1 LEU2058 1HD1 LEU2058 5.670 3.052 0.742 245 2HD1 LEU2058 3HD1 LEU2058 3.964 2.609 0.785 246 3HD1 LEU2058 2HD1 LEU2058 5.181 1.377 0.462 247 1HD2 LEU2058 3HD2 LEU2058 5.029 4.807 -1.119 248 2HD2 LEU2058 2HD2 LEU2058 4.077 4.207 -2.480 249 3HD2 LEU2058 1HD2 LEU2058 3.379 4.234 -0.863 250 H GLU2059 H GLU2059 8.695 2.055 -0.295 251 HA GLU2059 HA GLU2059 7.918 3.333 2.082 252 1HB GLU2059 2HB GLU2059 9.789 2.162 3.212 253 2HB GLU2059 1HB GLU2059 8.782 1.092 2.255 254 1HG GLU2059 2HG GLU2059 10.467 0.893 0.587 255 2HG GLU2059 1HG GLU2059 11.411 2.198 1.307 256 H MET2060 H MET2060 10.699 3.842 0.060 257 HA MET2060 HA MET2060 11.959 5.761 1.770 258 1HB MET2060 2HB MET2060 12.349 5.299 -1.207 259 2HB MET2060 1HB MET2060 13.410 6.245 -0.174 260 1HG MET2060 2HG MET2060 13.958 4.251 1.108 261 2HG MET2060 1HG MET2060 12.885 3.291 0.090 262 1HE MET2060 2HE MET2060 15.797 2.363 0.630 263 2HE MET2060 1HE MET2060 14.724 1.530 -0.495 264 3HE MET2060 3HE MET2060 16.365 1.948 -0.989 265 H TRP2061 H TRP2061 9.773 5.858 -0.916 266 HA TRP2061 HA TRP2061 9.635 8.620 -1.362 267 1HB TRP2061 2HB TRP2061 8.791 6.876 -2.895 268 2HB TRP2061 1HB TRP2061 7.539 6.475 -1.739 269 HD1 TRP2061 HD TRP2061 8.608 9.437 -3.975 270 HE1 TRP2061 1HE TRP2061 6.485 10.686 -4.697 271 HE3 TRP2061 3HE TRP2061 5.182 6.838 -1.243 272 HZ2 TRP2061 2HZ TRP2061 3.702 10.576 -4.176 273 HZ3 TRP2061 3HZ TRP2061 2.816 7.462 -1.412 274 HH2 TRP2061 HH TRP2061 2.093 9.301 -2.846 275 H LEU2062 H LEU2062 7.820 6.490 0.812 276 HA LEU2062 HA LEU2062 6.119 8.500 1.842 277 1HB LEU2062 2HB LEU2062 6.938 5.864 3.032 278 2HB LEU2062 1HB LEU2062 5.779 6.939 3.779 279 HG LEU2062 HG LEU2062 5.467 5.540 1.126 280 1HD1 LEU2062 1HD1 LEU2062 5.231 4.074 3.058 281 2HD1 LEU2062 3HD1 LEU2062 4.054 5.184 3.767 282 3HD1 LEU2062 2HD1 LEU2062 3.675 4.341 2.267 283 1HD2 LEU2062 3HD2 LEU2062 3.583 7.404 2.582 284 2HD2 LEU2062 2HD2 LEU2062 4.384 7.716 1.038 285 3HD2 LEU2062 1HD2 LEU2062 3.176 6.446 1.157 286 H GLN2063 H GLN2063 9.348 7.504 2.696 287 HA GLN2063 HA GLN2063 9.434 8.638 5.259 288 1HB GLN2063 2HB GLN2063 11.647 8.167 3.297 289 2HB GLN2063 1HB GLN2063 11.876 8.619 4.971 290 1HG GLN2063 2HG GLN2063 10.813 6.039 3.824 291 2HG GLN2063 1HG GLN2063 12.232 6.265 4.837 292 1HE2 GLN2063 1HE2 GLN2063 8.850 5.848 4.728 293 2HE2 GLN2063 2HE2 GLN2063 8.548 5.681 6.416 294 H GLY2064 H GLY2064 9.831 10.039 2.132 295 1HA GLY2064 1HA GLY2064 10.220 12.256 1.463 296 2HA GLY2064 2HA GLY2064 10.872 12.562 3.064 297 H HIS2065 H HIS2065 7.877 11.166 3.314 298 HA HIS2065 HA HIS2065 5.827 11.734 3.784 299 1HB HIS2065 2HB HIS2065 7.097 14.222 4.936 300 2HB HIS2065 1HB HIS2065 5.420 13.735 5.158 301 HD1 HIS2065 1HD HIS2065 4.932 12.004 6.986 302 HD2 HIS2065 2HD HIS2065 8.986 12.560 6.254 303 HE1 HIS2065 1HE HIS2065 6.146 10.779 8.812 304 HA PRO2066 HA PRO2066 4.703 14.421 0.337 305 1HB PRO2066 2HB PRO2066 3.555 12.589 -1.230 306 2HB PRO2066 1HB PRO2066 5.311 12.740 -1.163 307 1HG PRO2066 2HG PRO2066 3.546 10.701 0.104 308 2HG PRO2066 1HG PRO2066 5.161 10.502 -0.590 309 1HD PRO2066 2HD PRO2066 4.553 10.785 2.126 310 2HD PRO2066 1HD PRO2066 6.157 10.957 1.401 311 H GLU2067 H GLU2067 3.330 12.863 2.813 312 HA GLU2067 HA GLU2067 1.441 12.963 3.950 313 1HB GLU2067 2HB GLU2067 0.554 14.979 1.891 314 2HB GLU2067 1HB GLU2067 -0.352 14.589 3.354 315 1HG GLU2067 2HG GLU2067 2.395 15.666 3.157 316 2HG GLU2067 1HG GLU2067 0.969 16.573 3.720 317 H PHE2068 H PHE2068 1.920 11.085 2.196 318 HA PHE2068 HA PHE2068 -0.781 10.200 1.494 319 1HB PHE2068 2HB PHE2068 1.883 9.451 0.318 320 2HB PHE2068 1HB PHE2068 0.468 8.436 0.117 321 HD1 PHE2068 1HD PHE2068 1.656 11.935 -0.451 322 HD2 PHE2068 2HD PHE2068 -0.987 8.814 -1.616 323 HE1 PHE2068 1HE PHE2068 0.980 13.236 -2.414 324 HE2 PHE2068 2HE PHE2068 -1.677 10.121 -3.569 325 HZ PHE2068 HZ PHE2068 -0.701 12.323 -3.977 326 H ALA2069 H ALA2069 -1.514 8.374 2.304 327 HA ALA2069 HA ALA2069 0.160 6.947 4.252 328 1HB ALA2069 2HB ALA2069 -2.809 7.531 4.373 329 2HB ALA2069 1HB ALA2069 -1.917 6.558 5.539 330 3HB ALA2069 3HB ALA2069 -1.567 8.280 5.378 331 H VAL2070 H VAL2070 -0.607 4.661 4.533 332 HA VAL2070 HA VAL2070 -0.887 3.463 1.949 333 HB VAL2070 HB VAL2070 -0.912 2.164 4.700 334 1HG1 VAL2070 3HG1 VAL2070 -1.871 0.702 3.000 335 2HG1 VAL2070 2HG1 VAL2070 -0.454 0.931 1.981 336 3HG1 VAL2070 1HG1 VAL2070 -0.301 0.095 3.529 337 1HG2 VAL2070 1HG2 VAL2070 1.165 3.383 4.323 338 2HG2 VAL2070 3HG2 VAL2070 1.455 1.644 4.281 339 3HG2 VAL2070 2HG2 VAL2070 1.385 2.562 2.777 340 H ASP2071 H ASP2071 -2.680 2.682 1.025 341 HA ASP2071 HA ASP2071 -5.207 3.471 1.708 342 1HB ASP2071 2HB ASP2071 -4.805 2.805 -0.518 343 2HB ASP2071 1HB ASP2071 -4.231 1.222 -0.022 344 HA PRO2072 HA PRO2072 -6.182 0.901 5.201 345 1HB PRO2072 2HB PRO2072 -8.844 1.594 5.273 346 2HB PRO2072 1HB PRO2072 -7.549 2.549 6.003 347 1HG PRO2072 2HG PRO2072 -8.969 2.936 3.412 348 2HG PRO2072 1HG PRO2072 -8.397 4.145 4.571 349 1HD PRO2072 2HD PRO2072 -7.113 3.597 2.278 350 2HD PRO2072 1HD PRO2072 -6.253 4.104 3.748 351 H ARG2073 H ARG2073 -7.949 0.898 2.180 352 HA ARG2073 HA ARG2073 -9.487 -1.443 2.561 353 1HB ARG2073 2HB ARG2073 -9.999 0.035 0.748 354 2HB ARG2073 1HB ARG2073 -8.372 -0.098 0.108 355 1HG ARG2073 2HG ARG2073 -8.939 -2.586 -0.204 356 2HG ARG2073 1HG ARG2073 -10.613 -2.075 0.013 357 1HD ARG2073 2HD ARG2073 -9.998 -2.107 -2.376 358 2HD ARG2073 1HD ARG2073 -10.390 -0.476 -1.820 359 HE ARG2073 HE ARG2073 -7.784 -0.400 -1.493 360 1HH1 ARG2073 1HH1 ARG2073 -9.539 -1.692 -4.285 361 2HH1 ARG2073 2HH1 ARG2073 -8.265 -1.418 -5.380 362 1HH2 ARG2073 1HH2 ARG2073 -6.115 -0.051 -2.891 363 2HH2 ARG2073 2HH2 ARG2073 -6.174 -0.455 -4.554 364 H PHE2074 H PHE2074 -6.399 -0.878 0.939 365 HA PHE2074 HA PHE2074 -5.640 -3.424 0.252 366 1HB PHE2074 2HB PHE2074 -4.438 -1.469 -0.486 367 2HB PHE2074 1HB PHE2074 -3.956 -1.081 1.156 368 HD1 PHE2074 1HD PHE2074 -1.996 -2.032 2.097 369 HD2 PHE2074 2HD PHE2074 -3.499 -3.479 -1.606 370 HE1 PHE2074 1HE PHE2074 0.080 -3.303 1.759 371 HE2 PHE2074 2HE PHE2074 -1.422 -4.752 -1.948 372 HZ PHE2074 HZ PHE2074 0.363 -4.666 -0.279 373 H LEU2075 H LEU2075 -4.859 -1.715 3.264 374 HA LEU2075 HA LEU2075 -3.553 -3.970 4.273 375 1HB LEU2075 2HB LEU2075 -3.466 -2.771 6.453 376 2HB LEU2075 1HB LEU2075 -2.735 -1.965 5.086 377 HG LEU2075 HG LEU2075 -5.014 -0.710 5.028 378 1HD1 LEU2075 3HD1 LEU2075 -4.885 -1.621 7.901 379 2HD1 LEU2075 2HD1 LEU2075 -5.944 -0.361 7.272 380 3HD1 LEU2075 1HD1 LEU2075 -6.144 -2.031 6.731 381 1HD2 LEU2075 3HD2 LEU2075 -2.839 0.185 5.370 382 2HD2 LEU2075 2HD2 LEU2075 -4.006 0.991 6.445 383 3HD2 LEU2075 1HD2 LEU2075 -2.890 -0.245 7.073 384 H ALA2076 H ALA2076 -6.876 -2.974 4.484 385 HA ALA2076 HA ALA2076 -7.535 -4.822 6.561 386 1HB ALA2076 1HB ALA2076 -9.840 -4.366 6.020 387 2HB ALA2076 3HB ALA2076 -8.927 -2.859 6.109 388 3HB ALA2076 2HB ALA2076 -9.357 -3.534 4.529 389 H TYR2077 H TYR2077 -7.508 -4.925 3.056 390 HA TYR2077 HA TYR2077 -8.754 -7.465 2.753 391 1HB TYR2077 2HB TYR2077 -8.514 -5.821 0.911 392 2HB TYR2077 1HB TYR2077 -6.770 -6.090 0.933 393 HD1 TYR2077 1HD TYR2077 -5.820 -8.118 0.051 394 HD2 TYR2077 2HD TYR2077 -10.016 -7.549 0.130 395 HE1 TYR2077 1HE TYR2077 -6.092 -10.047 -1.433 396 HE2 TYR2077 2HE TYR2077 -10.320 -9.467 -1.348 397 HH TYR2077 HH TYR2077 -7.851 -11.679 -1.935 398 H MET2078 H MET2078 -5.375 -6.414 2.865 399 HA MET2078 HA MET2078 -4.181 -8.933 2.564 400 1HB MET2078 2HB MET2078 -2.987 -6.757 2.399 401 2HB MET2078 1HB MET2078 -3.157 -6.551 4.132 402 1HG MET2078 2HG MET2078 -1.803 -8.570 4.486 403 2HG MET2078 1HG MET2078 -1.592 -8.711 2.742 404 1HE MET2078 2HE MET2078 1.019 -8.771 2.968 405 2HE MET2078 1HE MET2078 1.957 -7.591 3.882 406 3HE MET2078 3HE MET2078 0.864 -8.687 4.724 407 H GLU2079 H GLU2079 -5.608 -7.370 5.253 408 HA GLU2079 HA GLU2079 -4.589 -8.967 7.338 409 1HB GLU2079 2HB GLU2079 -5.478 -6.692 7.610 410 2HB GLU2079 1HB GLU2079 -7.076 -7.288 7.211 411 1HG GLU2079 2HG GLU2079 -6.887 -7.015 9.534 412 2HG GLU2079 1HG GLU2079 -7.002 -8.737 9.173 413 H ASP2080 H ASP2080 -7.280 -9.305 5.124 414 HA ASP2080 HA ASP2080 -9.000 -10.931 6.611 415 1HB ASP2080 2HB ASP2080 -9.700 -9.952 4.488 416 2HB ASP2080 1HB ASP2080 -8.563 -10.986 3.622 417 H ARG2081 H ARG2081 -6.369 -11.882 4.481 418 HA ARG2081 HA ARG2081 -6.813 -14.652 5.059 419 1HB ARG2081 2HB ARG2081 -4.432 -13.373 3.697 420 2HB ARG2081 1HB ARG2081 -4.789 -15.094 3.739 421 1HG ARG2081 2HG ARG2081 -6.942 -14.583 2.558 422 2HG ARG2081 1HG ARG2081 -6.357 -12.935 2.352 423 1HD ARG2081 2HD ARG2081 -5.107 -15.463 1.276 424 2HD ARG2081 1HD ARG2081 -5.923 -14.200 0.358 425 HE ARG2081 HE ARG2081 -3.571 -13.436 1.882 426 1HH1 ARG2081 1HH1 ARG2081 -4.940 -14.174 -1.321 427 2HH1 ARG2081 2HH1 ARG2081 -3.596 -13.586 -2.171 428 1HH2 ARG2081 1HH2 ARG2081 -1.775 -12.678 0.734 429 2HH2 ARG2081 2HH2 ARG2081 -1.696 -12.725 -0.976 430 H ARG2082 H ARG2082 -5.855 -15.873 6.524 431 HA ARG2082 HA ARG2082 -4.994 -14.669 8.840 432 1HB ARG2082 2HB ARG2082 -4.418 -16.918 9.686 433 2HB ARG2082 1HB ARG2082 -5.991 -16.867 8.923 434 1HG ARG2082 2HG ARG2082 -5.023 -17.908 6.906 435 2HG ARG2082 1HG ARG2082 -3.464 -17.972 7.710 436 1HD ARG2082 2HD ARG2082 -4.426 -19.433 9.465 437 2HD ARG2082 1HD ARG2082 -5.981 -19.352 8.652 438 HE ARG2082 HE ARG2082 -4.425 -20.255 6.695 439 1HH1 ARG2082 1HH1 ARG2082 -4.615 -21.400 10.053 440 2HH1 ARG2082 2HH1 ARG2082 -4.379 -23.031 9.677 441 1HH2 ARG2082 1HH2 ARG2082 -4.078 -22.519 6.166 442 2HH2 ARG2082 2HH2 ARG2082 -4.065 -23.688 7.391 443 H LYS2083 H LYS2083 -3.311 -13.654 9.333 444 HA LYS2083 HA LYS2083 -0.784 -13.792 8.007 445 1HB LYS2083 2HB LYS2083 -1.478 -12.742 10.765 446 2HB LYS2083 1HB LYS2083 -0.013 -12.381 9.865 447 1HG LYS2083 2HG LYS2083 -2.774 -11.644 8.947 448 2HG LYS2083 1HG LYS2083 -1.735 -10.571 9.883 449 1HD LYS2083 2HD LYS2083 -0.071 -10.639 8.107 450 2HD LYS2083 1HD LYS2083 -1.074 -11.765 7.194 451 1HE LYS2083 2HE LYS2083 -1.241 -9.382 6.457 452 2HE LYS2083 1HE LYS2083 -2.777 -10.135 6.889 453 1HZ LYS2083 1HZ LYS2083 -1.205 -8.391 8.719 454 2HZ LYS2083 3HZ LYS2083 -2.466 -7.869 7.743 455 3HZ LYS2083 2HZ LYS2083 -2.810 -8.963 8.942 456 H GLN2084 H GLN2084 -2.037 -14.744 11.136 457 HA GLN2084 HA GLN2084 0.111 -16.587 11.593 458 1HB GLN2084 2HB GLN2084 -0.850 -15.448 13.523 459 2HB GLN2084 1HB GLN2084 -2.457 -16.000 13.090 460 1HG GLN2084 2HG GLN2084 -1.520 -17.213 15.013 461 2HG GLN2084 1HG GLN2084 -1.880 -18.275 13.660 462 1HE2 GLN2084 1HE2 GLN2084 -0.473 -19.809 14.592 463 2HE2 GLN2084 2HE2 GLN2084 1.245 -19.634 14.495 464 H LYS2085 H LYS2085 -0.081 -17.799 9.811 465 HA LYS2085 HA LYS2085 -2.455 -19.181 9.207 466 1HB LYS2085 2HB LYS2085 -0.978 -20.561 7.637 467 2HB LYS2085 1HB LYS2085 -0.963 -18.829 7.364 468 1HG LYS2085 2HG LYS2085 1.183 -18.821 8.778 469 2HG LYS2085 1HG LYS2085 1.208 -20.554 8.549 470 1HD LYS2085 2HD LYS2085 1.372 -18.425 6.414 471 2HD LYS2085 1HD LYS2085 2.655 -19.508 6.922 472 1HE LYS2085 2HE LYS2085 1.960 -20.455 4.914 473 2HE LYS2085 1HE LYS2085 1.040 -21.387 6.083 474 1HZ LYS2085 2HZ LYS2085 0.005 -19.063 4.528 475 2HZ LYS2085 1HZ LYS2085 -0.313 -20.669 4.198 476 3HZ LYS2085 3HZ LYS2085 -0.900 -19.992 5.611 No H/Q in entry = 476 Start of MODEL 14 1 H LEU2028 H LEU2028 10.110 -9.094 4.829 2 HA LEU2028 HA LEU2028 7.470 -8.449 5.279 3 1HB LEU2028 2HB LEU2028 9.290 -7.353 3.137 4 2HB LEU2028 1HB LEU2028 7.827 -6.582 3.706 5 HG LEU2028 HG LEU2028 10.289 -7.090 5.382 6 1HD1 LEU2028 3HD1 LEU2028 9.228 -4.557 4.160 7 2HD1 LEU2028 2HD1 LEU2028 10.573 -4.655 5.296 8 3HD1 LEU2028 1HD1 LEU2028 10.707 -5.402 3.704 9 1HD2 LEU2028 3HD2 LEU2028 7.743 -5.585 6.016 10 2HD2 LEU2028 2HD2 LEU2028 8.258 -7.109 6.739 11 3HD2 LEU2028 1HD2 LEU2028 9.183 -5.640 7.038 12 H ASP2029 H ASP2029 5.719 -9.278 4.552 13 HA ASP2029 HA ASP2029 5.400 -11.167 2.524 14 1HB ASP2029 2HB ASP2029 3.917 -11.097 4.388 15 2HB ASP2029 1HB ASP2029 3.404 -9.467 3.985 16 H VAL2030 H VAL2030 4.938 -7.702 2.408 17 HA VAL2030 HA VAL2030 3.589 -7.585 -0.096 18 HB VAL2030 HB VAL2030 5.328 -5.460 1.262 19 1HG1 VAL2030 2HG1 VAL2030 5.029 -4.950 -1.061 20 2HG1 VAL2030 1HG1 VAL2030 3.275 -5.023 -0.843 21 3HG1 VAL2030 3HG1 VAL2030 4.228 -3.801 0.001 22 1HG2 VAL2030 2HG2 VAL2030 3.467 -6.207 2.668 23 2HG2 VAL2030 1HG2 VAL2030 3.250 -4.544 2.120 24 3HG2 VAL2030 3HG2 VAL2030 2.354 -5.852 1.352 25 H ASP2031 H ASP2031 6.778 -8.294 0.769 26 HA ASP2031 HA ASP2031 8.671 -8.895 -0.260 27 1HB ASP2031 2HB ASP2031 6.905 -10.263 -1.566 28 2HB ASP2031 1HB ASP2031 7.194 -9.118 -2.870 29 H LEU2032 H LEU2032 7.417 -6.120 -0.735 30 HA LEU2032 HA LEU2032 8.127 -4.096 -1.271 31 1HB LEU2032 2HB LEU2032 10.699 -5.354 -2.205 32 2HB LEU2032 1HB LEU2032 10.430 -3.649 -1.902 33 HG LEU2032 HG LEU2032 10.433 -5.856 0.149 34 1HD1 LEU2032 1HD1 LEU2032 12.306 -3.569 -0.325 35 2HD1 LEU2032 3HD1 LEU2032 12.356 -4.679 1.045 36 3HD1 LEU2032 2HD1 LEU2032 12.624 -5.290 -0.588 37 1HD2 LEU2032 2HD2 LEU2032 9.898 -2.923 0.448 38 2HD2 LEU2032 1HD2 LEU2032 8.774 -4.231 0.791 39 3HD2 LEU2032 3HD2 LEU2032 10.208 -4.011 1.804 40 H GLU2033 H GLU2033 7.819 -6.487 -3.648 41 HA GLU2033 HA GLU2033 8.168 -4.593 -5.813 42 1HB GLU2033 2HB GLU2033 7.801 -6.501 -7.311 43 2HB GLU2033 1HB GLU2033 9.043 -6.835 -6.129 44 1HG GLU2033 2HG GLU2033 7.820 -8.832 -6.297 45 2HG GLU2033 1HG GLU2033 7.245 -8.077 -4.816 46 H THR2034 H THR2034 5.696 -5.717 -3.842 47 HA THR2034 HA THR2034 3.490 -5.414 -5.562 48 HB THR2034 HB THR2034 3.949 -5.616 -2.629 49 HG1 THR2034 1HG THR2034 3.961 -7.388 -4.376 50 1HG2 THR2034 1HG2 THR2034 1.923 -4.246 -2.873 51 2HG2 THR2034 3HG2 THR2034 1.161 -5.539 -3.836 52 3HG2 THR2034 2HG2 THR2034 1.649 -5.800 -2.138 53 H ARG2035 H ARG2035 2.334 -3.641 -6.083 54 HA ARG2035 HA ARG2035 3.299 -1.022 -5.351 55 1HB ARG2035 2HB ARG2035 1.003 -1.874 -7.097 56 2HB ARG2035 1HB ARG2035 1.524 -0.215 -6.865 57 1HG ARG2035 2HG ARG2035 3.721 -0.817 -7.831 58 2HG ARG2035 1HG ARG2035 3.090 -2.433 -8.170 59 1HD ARG2035 2HD ARG2035 1.317 -1.480 -9.500 60 2HD ARG2035 1HD ARG2035 1.885 0.137 -9.091 61 HE ARG2035 HE ARG2035 3.454 -1.776 -10.687 62 1HH1 ARG2035 1HH1 ARG2035 2.474 1.534 -9.997 63 2HH1 ARG2035 2HH1 ARG2035 3.023 2.190 -11.473 64 1HH2 ARG2035 1HH2 ARG2035 4.230 -0.883 -12.761 65 2HH2 ARG2035 2HH2 ARG2035 4.058 0.774 -13.068 66 H ILE2036 H ILE2036 2.808 -0.171 -3.547 67 HA ILE2036 HA ILE2036 0.389 -0.808 -2.131 68 HB ILE2036 HB ILE2036 2.611 1.156 -1.528 69 1HG1 ILE2036 2HG1 ILE2036 3.330 -1.175 -1.476 70 2HG1 ILE2036 1HG1 ILE2036 3.345 -0.479 0.140 71 1HG2 ILE2036 1HG2 ILE2036 0.540 1.876 -0.452 72 2HG2 ILE2036 3HG2 ILE2036 0.347 0.271 0.259 73 3HG2 ILE2036 2HG2 ILE2036 1.698 1.298 0.744 74 1HD1 ILE2036 3HD1 ILE2036 1.182 -1.591 0.581 75 2HD1 ILE2036 2HD1 ILE2036 1.278 -2.340 -1.009 76 3HD1 ILE2036 1HD1 ILE2036 2.487 -2.726 0.217 77 HA PRO2037 HA PRO2037 -1.651 2.721 -4.069 78 1HB PRO2037 2HB PRO2037 -4.001 1.888 -2.562 79 2HB PRO2037 1HB PRO2037 -3.755 1.919 -4.309 80 1HG PRO2037 2HG PRO2037 -3.965 -0.378 -2.876 81 2HG PRO2037 1HG PRO2037 -3.056 -0.250 -4.392 82 1HD PRO2037 2HD PRO2037 -2.060 -0.262 -1.575 83 2HD PRO2037 1HD PRO2037 -1.364 -1.003 -3.035 84 H VAL2038 H VAL2038 -1.485 4.626 -3.196 85 HA VAL2038 HA VAL2038 -1.763 4.847 -0.294 86 HB VAL2038 HB VAL2038 -0.203 6.820 -0.421 87 1HG1 VAL2038 1HG1 VAL2038 0.504 4.615 0.394 88 2HG1 VAL2038 3HG1 VAL2038 0.953 4.155 -1.250 89 3HG1 VAL2038 2HG1 VAL2038 1.806 5.465 -0.424 90 1HG2 VAL2038 2HG2 VAL2038 0.356 5.703 -3.174 91 2HG2 VAL2038 1HG2 VAL2038 -0.352 7.275 -2.815 92 3HG2 VAL2038 3HG2 VAL2038 1.321 6.938 -2.366 93 H ILE2039 H ILE2039 -2.746 6.549 0.575 94 HA ILE2039 HA ILE2039 -4.206 8.281 -1.270 95 HB ILE2039 HB ILE2039 -5.779 6.645 -0.360 96 1HG1 ILE2039 2HG1 ILE2039 -6.168 9.358 0.938 97 2HG1 ILE2039 1HG1 ILE2039 -6.581 8.953 -0.721 98 1HG2 ILE2039 1HG2 ILE2039 -4.908 7.563 2.371 99 2HG2 ILE2039 3HG2 ILE2039 -6.275 6.489 2.054 100 3HG2 ILE2039 2HG2 ILE2039 -4.632 5.973 1.658 101 1HD1 ILE2039 2HD1 ILE2039 -8.252 7.360 0.088 102 2HD1 ILE2039 1HD1 ILE2039 -7.833 7.771 1.750 103 3HD1 ILE2039 3HD1 ILE2039 -8.553 8.987 0.696 104 H ASN2040 H ASN2040 -3.929 10.313 -0.909 105 HA ASN2040 HA ASN2040 -2.193 11.275 1.149 106 1HB ASN2040 2HB ASN2040 -2.539 12.414 -1.070 107 2HB ASN2040 1HB ASN2040 -4.122 12.927 -0.491 108 1HD2 ASN2040 1HD2 ASN2040 -0.748 13.429 -0.345 109 2HD2 ASN2040 2HD2 ASN2040 -0.765 14.839 0.637 110 H LYS2041 H LYS2041 -2.662 11.832 3.141 111 HA LYS2041 HA LYS2041 -5.133 11.225 4.281 112 1HB LYS2041 2HB LYS2041 -2.821 12.790 5.361 113 2HB LYS2041 1HB LYS2041 -4.207 12.253 6.309 114 1HG LYS2041 2HG LYS2041 -3.688 9.945 5.834 115 2HG LYS2041 1HG LYS2041 -2.374 10.436 4.782 116 1HD LYS2041 2HD LYS2041 -1.453 9.722 6.832 117 2HD LYS2041 1HD LYS2041 -1.273 11.477 6.718 118 1HE LYS2041 2HE LYS2041 -3.520 10.167 8.255 119 2HE LYS2041 1HE LYS2041 -1.968 10.483 9.011 120 1HZ LYS2041 1HZ LYS2041 -2.337 12.875 8.509 121 2HZ LYS2041 3HZ LYS2041 -3.884 12.523 7.945 122 3HZ LYS2041 2HZ LYS2041 -3.494 12.236 9.531 123 H VAL2042 H VAL2042 -3.749 14.251 3.210 124 HA VAL2042 HA VAL2042 -5.803 15.826 4.496 125 HB VAL2042 HB VAL2042 -3.536 16.697 2.687 126 1HG1 VAL2042 2HG1 VAL2042 -5.340 18.317 2.761 127 2HG1 VAL2042 1HG1 VAL2042 -5.294 18.313 4.523 128 3HG1 VAL2042 3HG1 VAL2042 -3.917 18.926 3.605 129 1HG2 VAL2042 3HG2 VAL2042 -3.715 16.658 5.699 130 2HG2 VAL2042 2HG2 VAL2042 -2.681 15.640 4.696 131 3HG2 VAL2042 1HG2 VAL2042 -2.404 17.379 4.767 132 H ASP2043 H ASP2043 -4.628 15.450 1.174 133 HA ASP2043 HA ASP2043 -6.873 16.843 0.032 134 1HB ASP2043 2HB ASP2043 -4.700 16.955 -1.055 135 2HB ASP2043 1HB ASP2043 -4.690 15.211 -1.267 136 H GLY2044 H GLY2044 -5.843 13.476 0.125 137 1HA GLY2044 1HA GLY2044 -8.560 12.710 -0.688 138 2HA GLY2044 2HA GLY2044 -7.424 11.696 0.202 139 H THR2045 H THR2045 -5.453 13.033 -1.918 140 HA THR2045 HA THR2045 -5.902 12.023 -4.445 141 HB THR2045 HB THR2045 -3.197 12.025 -3.137 142 HG1 THR2045 1HG THR2045 -4.910 14.237 -3.633 143 1HG2 THR2045 3HG2 THR2045 -4.180 12.862 -5.876 144 2HG2 THR2045 2HG2 THR2045 -2.502 12.915 -5.338 145 3HG2 THR2045 1HG2 THR2045 -3.334 11.365 -5.491 146 H LEU2046 H LEU2046 -6.371 9.865 -4.824 147 HA LEU2046 HA LEU2046 -4.879 7.885 -3.280 148 1HB LEU2046 2HB LEU2046 -7.238 7.663 -2.960 149 2HB LEU2046 1HB LEU2046 -7.541 7.686 -4.679 150 HG LEU2046 HG LEU2046 -6.323 5.514 -4.853 151 1HD1 LEU2046 3HD1 LEU2046 -4.988 5.691 -2.798 152 2HD1 LEU2046 2HD1 LEU2046 -6.474 5.526 -1.854 153 3HD1 LEU2046 1HD1 LEU2046 -5.930 4.197 -2.866 154 1HD2 LEU2046 2HD2 LEU2046 -8.731 5.595 -4.789 155 2HD2 LEU2046 1HD2 LEU2046 -8.132 4.171 -3.937 156 3HD2 LEU2046 3HD2 LEU2046 -8.702 5.572 -3.021 157 H LEU2047 H LEU2047 -3.401 6.830 -4.231 158 HA LEU2047 HA LEU2047 -3.231 6.799 -7.185 159 1HB LEU2047 2HB LEU2047 -1.041 6.426 -5.143 160 2HB LEU2047 1HB LEU2047 -0.837 6.454 -6.881 161 HG LEU2047 HG LEU2047 -1.641 8.788 -5.142 162 1HD1 LEU2047 1HD1 LEU2047 0.697 8.185 -4.919 163 2HD1 LEU2047 3HD1 LEU2047 0.889 8.218 -6.672 164 3HD1 LEU2047 2HD1 LEU2047 0.530 9.705 -5.795 165 1HD2 LEU2047 1HD2 LEU2047 -2.724 8.924 -7.337 166 2HD2 LEU2047 3HD2 LEU2047 -1.453 10.137 -7.184 167 3HD2 LEU2047 2HD2 LEU2047 -1.167 8.677 -8.126 168 H VAL2048 H VAL2048 -3.814 4.971 -8.036 169 HA VAL2048 HA VAL2048 -3.220 2.494 -6.581 170 HB VAL2048 HB VAL2048 -5.269 1.485 -7.585 171 1HG1 VAL2048 3HG1 VAL2048 -5.736 3.885 -5.850 172 2HG1 VAL2048 2HG1 VAL2048 -6.940 2.631 -6.152 173 3HG1 VAL2048 1HG1 VAL2048 -5.436 2.236 -5.314 174 1HG2 VAL2048 1HG2 VAL2048 -5.555 2.983 -9.497 175 2HG2 VAL2048 3HG2 VAL2048 -7.028 2.922 -8.527 176 3HG2 VAL2048 2HG2 VAL2048 -5.949 4.312 -8.406 177 H GLY2049 H GLY2049 -2.677 0.707 -7.883 178 1HA GLY2049 1HA GLY2049 -2.927 0.504 -10.622 179 2HA GLY2049 2HA GLY2049 -1.812 -0.410 -9.634 180 H GLU2050 H GLU2050 -2.138 1.857 -12.028 181 HA GLU2050 HA GLU2050 0.566 1.779 -12.788 182 1HB GLU2050 2HB GLU2050 -1.472 3.828 -13.617 183 2HB GLU2050 1HB GLU2050 -0.013 3.377 -14.480 184 1HG GLU2050 2HG GLU2050 -0.916 1.157 -14.878 185 2HG GLU2050 1HG GLU2050 -2.377 1.579 -13.993 186 H ASP2051 H ASP2051 -1.209 4.140 -11.033 187 HA ASP2051 HA ASP2051 1.084 5.933 -10.991 188 1HB ASP2051 2HB ASP2051 -1.722 6.055 -10.366 189 2HB ASP2051 1HB ASP2051 -0.705 7.302 -9.588 190 H ALA2052 H ALA2052 0.254 3.324 -9.214 191 HA ALA2052 HA ALA2052 1.114 4.569 -6.734 192 1HB ALA2052 3HB ALA2052 0.333 2.492 -5.655 193 2HB ALA2052 1HB ALA2052 -0.134 1.858 -7.241 194 3HB ALA2052 2HB ALA2052 -0.940 3.285 -6.590 195 HA PRO2053 HA PRO2053 5.001 2.722 -7.918 196 1HB PRO2053 2HB PRO2053 6.114 3.497 -5.364 197 2HB PRO2053 1HB PRO2053 6.446 4.173 -6.957 198 1HG PRO2053 2HG PRO2053 5.110 5.499 -4.956 199 2HG PRO2053 1HG PRO2053 4.966 5.864 -6.675 200 1HD PRO2053 2HD PRO2053 3.080 4.372 -4.902 201 2HD PRO2053 1HD PRO2053 2.766 5.426 -6.295 202 H ARG2054 H ARG2054 6.233 0.958 -7.373 203 HA ARG2054 HA ARG2054 5.103 -1.057 -5.745 204 1HB ARG2054 2HB ARG2054 7.178 -2.241 -6.092 205 2HB ARG2054 1HB ARG2054 6.612 -1.589 -7.651 206 1HG ARG2054 2HG ARG2054 8.318 0.290 -6.979 207 2HG ARG2054 1HG ARG2054 8.969 -0.984 -5.943 208 1HD ARG2054 2HD ARG2054 8.769 -0.882 -8.922 209 2HD ARG2054 1HD ARG2054 10.168 -1.206 -7.908 210 HE ARG2054 HE ARG2054 7.953 -3.110 -8.061 211 1HH1 ARG2054 1HH1 ARG2054 11.416 -2.432 -8.406 212 2HH1 ARG2054 2HH1 ARG2054 11.813 -3.974 -8.989 213 1HH2 ARG2054 1HH2 ARG2054 8.506 -5.275 -8.913 214 2HH2 ARG2054 2HH2 ARG2054 10.135 -5.632 -9.250 215 H ARG2055 H ARG2055 5.775 -1.774 -3.717 216 HA ARG2055 HA ARG2055 6.142 0.161 -1.869 217 1HB ARG2055 2HB ARG2055 5.240 -1.935 -1.235 218 2HB ARG2055 1HB ARG2055 6.702 -2.783 -1.666 219 1HG ARG2055 2HG ARG2055 6.425 -2.590 0.730 220 2HG ARG2055 1HG ARG2055 7.886 -1.749 0.178 221 1HD ARG2055 2HD ARG2055 6.380 0.361 0.197 222 2HD ARG2055 1HD ARG2055 5.287 -0.615 1.187 223 HE ARG2055 HE ARG2055 7.824 -0.857 2.248 224 1HH1 ARG2055 1HH1 ARG2055 5.267 1.610 2.084 225 2HH1 ARG2055 2HH1 ARG2055 5.961 2.553 3.320 226 1HH2 ARG2055 1HH2 ARG2055 8.732 0.488 3.911 227 2HH2 ARG2055 2HH2 ARG2055 7.963 1.953 4.318 228 H ALA2056 H ALA2056 8.740 -1.657 -3.420 229 HA ALA2056 HA ALA2056 10.884 -0.783 -1.859 230 1HB ALA2056 1HB ALA2056 12.291 -1.342 -3.749 231 2HB ALA2056 2HB ALA2056 10.894 -1.336 -4.823 232 3HB ALA2056 3HB ALA2056 11.033 -2.568 -3.571 233 H GLU2057 H GLU2057 9.291 0.770 -4.636 234 HA GLU2057 HA GLU2057 11.144 3.027 -4.489 235 1HB GLU2057 2HB GLU2057 8.692 2.615 -6.212 236 2HB GLU2057 1HB GLU2057 9.776 3.993 -6.333 237 1HG GLU2057 2HG GLU2057 11.614 2.435 -6.909 238 2HG GLU2057 1HG GLU2057 10.447 1.114 -6.877 239 H LEU2058 H LEU2058 7.950 2.193 -3.585 240 HA LEU2058 HA LEU2058 6.829 4.681 -3.053 241 1HB LEU2058 2HB LEU2058 5.619 2.492 -3.340 242 2HB LEU2058 1HB LEU2058 6.241 2.019 -1.786 243 HG LEU2058 HG LEU2058 3.790 2.727 -1.999 244 1HD1 LEU2058 1HD1 LEU2058 5.522 3.878 0.160 245 2HD1 LEU2058 3HD1 LEU2058 3.775 3.656 0.249 246 3HD1 LEU2058 2HD1 LEU2058 4.835 2.253 0.109 247 1HD2 LEU2058 3HD2 LEU2058 4.156 4.799 -3.201 248 2HD2 LEU2058 2HD2 LEU2058 3.357 5.102 -1.661 249 3HD2 LEU2058 1HD2 LEU2058 5.080 5.440 -1.845 250 H GLU2059 H GLU2059 8.885 2.651 -1.047 251 HA GLU2059 HA GLU2059 8.556 3.883 1.447 252 1HB GLU2059 2HB GLU2059 9.813 1.810 1.078 253 2HB GLU2059 1HB GLU2059 11.068 2.707 0.237 254 1HG GLU2059 2HG GLU2059 11.580 3.913 2.302 255 2HG GLU2059 1HG GLU2059 10.310 3.017 3.132 256 H MET2060 H MET2060 10.959 4.527 -1.031 257 HA MET2060 HA MET2060 12.095 6.801 0.211 258 1HB MET2060 2HB MET2060 12.187 5.944 -2.682 259 2HB MET2060 1HB MET2060 13.176 7.225 -1.998 260 1HG MET2060 2HG MET2060 13.237 4.318 -1.209 261 2HG MET2060 1HG MET2060 14.428 5.149 -2.207 262 1HE MET2060 3HE MET2060 16.079 7.015 -1.294 263 2HE MET2060 2HE MET2060 14.719 7.963 -0.687 264 3HE MET2060 1HE MET2060 16.084 7.607 0.369 265 H TRP2061 H TRP2061 9.403 6.369 -1.854 266 HA TRP2061 HA TRP2061 9.094 9.080 -2.659 267 1HB TRP2061 2HB TRP2061 8.138 7.090 -3.849 268 2HB TRP2061 1HB TRP2061 7.022 6.878 -2.512 269 HD1 TRP2061 HD TRP2061 7.792 9.282 -5.395 270 HE1 TRP2061 1HE TRP2061 5.658 10.602 -5.935 271 HE3 TRP2061 3HE TRP2061 4.834 7.644 -1.547 272 HZ2 TRP2061 2HZ TRP2061 3.063 10.897 -4.879 273 HZ3 TRP2061 3HZ TRP2061 2.553 8.498 -1.400 274 HH2 TRP2061 HH TRP2061 1.689 10.087 -3.024 275 H LEU2062 H LEU2062 7.518 7.050 -0.165 276 HA LEU2062 HA LEU2062 5.978 9.070 1.028 277 1HB LEU2062 2HB LEU2062 7.077 6.533 2.209 278 2HB LEU2062 1HB LEU2062 6.035 7.621 3.095 279 HG LEU2062 HG LEU2062 5.308 6.063 0.619 280 1HD1 LEU2062 1HD1 LEU2062 4.393 5.874 3.481 281 2HD1 LEU2062 3HD1 LEU2062 3.754 4.954 2.118 282 3HD1 LEU2062 2HD1 LEU2062 5.429 4.722 2.627 283 1HD2 LEU2062 3HD2 LEU2062 3.655 7.994 2.254 284 2HD2 LEU2062 2HD2 LEU2062 4.179 8.219 0.582 285 3HD2 LEU2062 1HD2 LEU2062 3.040 6.942 0.982 286 H GLN2063 H GLN2063 9.291 8.197 1.450 287 HA GLN2063 HA GLN2063 9.924 9.583 3.733 288 1HB GLN2063 2HB GLN2063 11.398 8.091 2.433 289 2HB GLN2063 1HB GLN2063 11.533 9.333 1.205 290 1HG GLN2063 2HG GLN2063 12.490 10.830 2.892 291 2HG GLN2063 1HG GLN2063 12.456 9.478 4.032 292 1HE2 GLN2063 1HE2 GLN2063 13.957 10.816 1.230 293 2HE2 GLN2063 2HE2 GLN2063 15.284 9.722 1.169 294 H GLY2064 H GLY2064 9.409 10.772 0.454 295 1HA GLY2064 1HA GLY2064 9.622 12.919 -0.413 296 2HA GLY2064 2HA GLY2064 10.236 13.465 1.142 297 H HIS2065 H HIS2065 7.326 11.626 1.089 298 HA HIS2065 HA HIS2065 5.821 13.947 1.916 299 1HB HIS2065 2HB HIS2065 5.042 12.320 -0.503 300 2HB HIS2065 1HB HIS2065 3.848 13.206 0.429 301 HD1 HIS2065 1HD HIS2065 3.844 15.835 0.171 302 HD2 HIS2065 2HD HIS2065 6.743 13.845 -2.079 303 HE1 HIS2065 1HE HIS2065 4.735 17.503 -1.446 304 HA PRO2066 HA PRO2066 4.751 10.313 4.468 305 1HB PRO2066 2HB PRO2066 4.847 11.578 6.836 306 2HB PRO2066 1HB PRO2066 6.321 11.052 6.011 307 1HG PRO2066 2HG PRO2066 5.066 13.775 6.074 308 2HG PRO2066 1HG PRO2066 6.774 13.330 6.285 309 1HD PRO2066 2HD PRO2066 5.740 14.262 3.946 310 2HD PRO2066 1HD PRO2066 7.116 13.143 4.024 311 H GLU2067 H GLU2067 3.192 12.783 3.329 312 HA GLU2067 HA GLU2067 0.932 13.014 5.121 313 1HB GLU2067 2HB GLU2067 0.068 14.552 3.370 314 2HB GLU2067 1HB GLU2067 1.659 14.994 3.986 315 1HG GLU2067 2HG GLU2067 2.692 14.015 2.004 316 2HG GLU2067 1HG GLU2067 1.097 13.584 1.387 317 H PHE2068 H PHE2068 1.891 10.767 2.983 318 HA PHE2068 HA PHE2068 -0.817 10.136 2.099 319 1HB PHE2068 2HB PHE2068 1.868 9.244 1.056 320 2HB PHE2068 1HB PHE2068 0.356 8.481 0.587 321 HD1 PHE2068 1HD PHE2068 2.179 11.722 0.541 322 HD2 PHE2068 2HD PHE2068 -0.933 9.358 -1.140 323 HE1 PHE2068 1HE PHE2068 1.921 13.359 -1.279 324 HE2 PHE2068 2HE PHE2068 -1.209 10.993 -2.951 325 HZ PHE2068 HZ PHE2068 0.222 12.997 -3.027 326 H ALA2069 H ALA2069 -1.785 8.362 2.708 327 HA ALA2069 HA ALA2069 -0.430 6.624 4.644 328 1HB ALA2069 1HB ALA2069 -3.338 7.387 4.333 329 2HB ALA2069 3HB ALA2069 -2.736 6.187 5.467 330 3HB ALA2069 2HB ALA2069 -2.261 7.879 5.642 331 H VAL2070 H VAL2070 -1.640 4.407 4.601 332 HA VAL2070 HA VAL2070 -1.537 3.514 1.845 333 HB VAL2070 HB VAL2070 -0.278 2.206 3.487 334 1HG1 VAL2070 1HG1 VAL2070 -2.901 1.717 4.856 335 2HG1 VAL2070 3HG1 VAL2070 -1.386 0.905 5.252 336 3HG1 VAL2070 2HG1 VAL2070 -1.538 2.648 5.483 337 1HG2 VAL2070 1HG2 VAL2070 -1.191 0.971 1.585 338 2HG2 VAL2070 3HG2 VAL2070 -1.143 -0.052 3.022 339 3HG2 VAL2070 2HG2 VAL2070 -2.668 0.651 2.486 340 H ASP2071 H ASP2071 -3.245 2.632 0.720 341 HA ASP2071 HA ASP2071 -5.801 3.568 1.296 342 1HB ASP2071 2HB ASP2071 -5.161 3.067 -0.968 343 2HB ASP2071 1HB ASP2071 -4.932 1.365 -0.571 344 HA PRO2072 HA PRO2072 -7.066 0.615 4.411 345 1HB PRO2072 2HB PRO2072 -9.754 1.677 3.839 346 2HB PRO2072 1HB PRO2072 -8.872 1.625 5.370 347 1HG PRO2072 2HG PRO2072 -9.204 3.924 4.068 348 2HG PRO2072 1HG PRO2072 -7.678 3.556 4.891 349 1HD PRO2072 2HD PRO2072 -8.335 3.409 1.973 350 2HD PRO2072 1HD PRO2072 -6.879 4.023 2.794 351 H ARG2073 H ARG2073 -8.472 0.767 1.192 352 HA ARG2073 HA ARG2073 -10.027 -1.604 1.660 353 1HB ARG2073 2HB ARG2073 -10.818 0.141 0.087 354 2HB ARG2073 1HB ARG2073 -9.433 -0.172 -0.944 355 1HG ARG2073 2HG ARG2073 -11.502 -1.196 -1.786 356 2HG ARG2073 1HG ARG2073 -10.259 -2.397 -1.434 357 1HD ARG2073 2HD ARG2073 -12.512 -3.083 -0.673 358 2HD ARG2073 1HD ARG2073 -11.351 -2.984 0.644 359 HE ARG2073 HE ARG2073 -12.743 -0.542 0.402 360 1HH1 ARG2073 1HH1 ARG2073 -13.350 -3.875 1.421 361 2HH1 ARG2073 2HH1 ARG2073 -14.469 -3.463 2.628 362 1HH2 ARG2073 1HH2 ARG2073 -14.333 0.034 2.026 363 2HH2 ARG2073 2HH2 ARG2073 -15.093 -1.186 2.930 364 H PHE2074 H PHE2074 -6.984 -0.723 0.220 365 HA PHE2074 HA PHE2074 -6.231 -3.292 -0.667 366 1HB PHE2074 2HB PHE2074 -4.945 -1.246 -1.264 367 2HB PHE2074 1HB PHE2074 -4.442 -1.091 0.414 368 HD1 PHE2074 1HD PHE2074 -4.271 -3.360 -2.517 369 HD2 PHE2074 2HD PHE2074 -2.502 -2.151 1.161 370 HE1 PHE2074 1HE PHE2074 -2.320 -4.780 -2.992 371 HE2 PHE2074 2HE PHE2074 -0.551 -3.571 0.690 372 HZ PHE2074 HZ PHE2074 -0.459 -4.884 -1.391 373 H LEU2075 H LEU2075 -6.063 -1.695 2.439 374 HA LEU2075 HA LEU2075 -4.704 -3.754 3.820 375 1HB LEU2075 2HB LEU2075 -6.691 -1.741 4.878 376 2HB LEU2075 1HB LEU2075 -5.698 -2.774 5.881 377 HG LEU2075 HG LEU2075 -4.702 -0.590 4.050 378 1HD1 LEU2075 3HD1 LEU2075 -5.818 0.256 6.052 379 2HD1 LEU2075 2HD1 LEU2075 -4.809 -0.785 7.054 380 3HD1 LEU2075 1HD1 LEU2075 -4.077 0.526 6.138 381 1HD2 LEU2075 2HD2 LEU2075 -3.195 -2.418 5.925 382 2HD2 LEU2075 1HD2 LEU2075 -3.097 -2.432 4.166 383 3HD2 LEU2075 3HD2 LEU2075 -2.510 -1.036 5.070 384 H ALA2076 H ALA2076 -8.127 -3.139 3.253 385 HA ALA2076 HA ALA2076 -9.134 -5.308 4.731 386 1HB ALA2076 1HB ALA2076 -11.209 -4.992 3.534 387 2HB ALA2076 3HB ALA2076 -10.527 -3.429 3.982 388 3HB ALA2076 2HB ALA2076 -10.389 -4.004 2.317 389 H TYR2077 H TYR2077 -7.631 -5.198 1.670 390 HA TYR2077 HA TYR2077 -8.532 -7.686 0.670 391 1HB TYR2077 2HB TYR2077 -7.491 -5.995 -0.794 392 2HB TYR2077 1HB TYR2077 -5.971 -6.178 0.070 393 HD1 TYR2077 1HD TYR2077 -4.408 -7.733 -0.688 394 HD2 TYR2077 2HD TYR2077 -8.456 -8.108 -1.874 395 HE1 TYR2077 1HE TYR2077 -3.785 -9.586 -2.184 396 HE2 TYR2077 2HE TYR2077 -7.871 -9.959 -3.375 397 HH TYR2077 HH TYR2077 -4.893 -11.549 -3.231 398 H MET2078 H MET2078 -6.092 -6.720 2.959 399 HA MET2078 HA MET2078 -4.629 -9.150 2.866 400 1HB MET2078 2HB MET2078 -4.662 -6.959 4.930 401 2HB MET2078 1HB MET2078 -3.604 -8.360 5.011 402 1HG MET2078 2HG MET2078 -3.643 -6.279 2.838 403 2HG MET2078 1HG MET2078 -2.440 -6.441 4.117 404 1HE MET2078 3HE MET2078 -1.612 -6.220 1.101 405 2HE MET2078 2HE MET2078 -0.428 -6.498 2.377 406 3HE MET2078 1HE MET2078 -0.423 -7.517 0.939 407 H GLU2079 H GLU2079 -7.457 -8.178 4.641 408 HA GLU2079 HA GLU2079 -7.434 -10.254 6.595 409 1HB GLU2079 2HB GLU2079 -9.688 -8.725 5.333 410 2HB GLU2079 1HB GLU2079 -9.997 -10.013 6.476 411 1HG GLU2079 2HG GLU2079 -10.132 -7.902 7.522 412 2HG GLU2079 1HG GLU2079 -8.730 -8.779 8.163 413 H ASP2080 H ASP2080 -8.993 -9.956 3.558 414 HA ASP2080 HA ASP2080 -10.013 -12.580 3.225 415 1HB ASP2080 2HB ASP2080 -10.673 -10.584 1.891 416 2HB ASP2080 1HB ASP2080 -9.089 -10.587 1.140 417 H ARG2081 H ARG2081 -7.181 -10.989 1.985 418 HA ARG2081 HA ARG2081 -5.145 -11.461 1.460 419 1HB ARG2081 2HB ARG2081 -5.141 -12.342 3.804 420 2HB ARG2081 1HB ARG2081 -5.335 -13.953 3.131 421 1HG ARG2081 2HG ARG2081 -3.203 -13.928 2.155 422 2HG ARG2081 1HG ARG2081 -3.058 -12.177 2.329 423 1HD ARG2081 2HD ARG2081 -3.128 -14.175 4.586 424 2HD ARG2081 1HD ARG2081 -1.690 -13.355 3.980 425 HE ARG2081 HE ARG2081 -3.757 -11.535 4.784 426 1HH1 ARG2081 1HH1 ARG2081 -1.146 -13.532 6.093 427 2HH1 ARG2081 2HH1 ARG2081 -0.846 -12.543 7.438 428 1HH2 ARG2081 1HH2 ARG2081 -3.388 -10.151 6.668 429 2HH2 ARG2081 2HH2 ARG2081 -2.164 -10.575 7.759 430 H ARG2082 H ARG2082 -6.512 -14.742 1.392 431 HA ARG2082 HA ARG2082 -5.940 -14.695 -1.430 432 1HB ARG2082 2HB ARG2082 -4.936 -16.861 0.392 433 2HB ARG2082 1HB ARG2082 -5.158 -17.113 -1.327 434 1HG ARG2082 2HG ARG2082 -3.594 -15.155 -1.690 435 2HG ARG2082 1HG ARG2082 -3.237 -15.239 0.037 436 1HD ARG2082 2HD ARG2082 -2.861 -17.483 -1.955 437 2HD ARG2082 1HD ARG2082 -1.584 -16.457 -1.314 438 HE ARG2082 HE ARG2082 -1.847 -17.460 0.780 439 1HH1 ARG2082 1HH1 ARG2082 -3.914 -19.035 -1.662 440 2HH1 ARG2082 2HH1 ARG2082 -3.947 -20.528 -0.831 441 1HH2 ARG2082 1HH2 ARG2082 -1.931 -19.554 1.871 442 2HH2 ARG2082 2HH2 ARG2082 -2.825 -20.818 1.162 443 H LYS2083 H LYS2083 -8.014 -14.409 -1.745 444 HA LYS2083 HA LYS2083 -9.465 -16.819 -2.135 445 1HB LYS2083 2HB LYS2083 -10.121 -16.118 0.196 446 2HB LYS2083 1HB LYS2083 -10.728 -14.610 -0.468 447 1HG LYS2083 2HG LYS2083 -12.359 -15.879 -1.812 448 2HG LYS2083 1HG LYS2083 -11.752 -17.376 -1.105 449 1HD LYS2083 2HD LYS2083 -13.043 -15.099 0.408 450 2HD LYS2083 1HD LYS2083 -13.802 -16.636 0.007 451 1HE LYS2083 2HE LYS2083 -12.126 -17.811 1.366 452 2HE LYS2083 1HE LYS2083 -11.367 -16.275 1.754 453 1HZ LYS2083 3HZ LYS2083 -13.426 -15.576 2.797 454 2HZ LYS2083 2HZ LYS2083 -14.111 -17.096 2.525 455 3HZ LYS2083 1HZ LYS2083 -12.782 -16.935 3.544 456 H GLN2084 H GLN2084 -9.700 -13.293 -1.920 457 HA GLN2084 HA GLN2084 -9.855 -11.674 -3.403 458 1HB GLN2084 2HB GLN2084 -8.101 -12.765 -4.669 459 2HB GLN2084 1HB GLN2084 -9.283 -13.794 -5.466 460 1HG GLN2084 2HG GLN2084 -10.243 -11.860 -6.577 461 2HG GLN2084 1HG GLN2084 -9.124 -10.803 -5.730 462 1HE2 GLN2084 1HE2 GLN2084 -8.141 -13.917 -6.964 463 2HE2 GLN2084 2HE2 GLN2084 -7.142 -13.314 -8.225 464 H LYS2085 H LYS2085 -11.695 -10.748 -3.460 465 HA LYS2085 HA LYS2085 -13.917 -12.066 -4.803 466 1HB LYS2085 2HB LYS2085 -15.348 -10.311 -3.638 467 2HB LYS2085 1HB LYS2085 -14.579 -11.470 -2.569 468 1HG LYS2085 2HG LYS2085 -12.857 -9.805 -2.031 469 2HG LYS2085 1HG LYS2085 -13.650 -8.642 -3.093 470 1HD LYS2085 2HD LYS2085 -14.308 -8.139 -0.846 471 2HD LYS2085 1HD LYS2085 -15.695 -8.875 -1.641 472 1HE LYS2085 2HE LYS2085 -15.485 -9.786 0.578 473 2HE LYS2085 1HE LYS2085 -15.082 -11.046 -0.583 474 1HZ LYS2085 1HZ LYS2085 -13.130 -9.407 0.954 475 2HZ LYS2085 3HZ LYS2085 -13.574 -10.985 1.299 476 3HZ LYS2085 2HZ LYS2085 -12.719 -10.673 -0.104 No H/Q in entry = 476 Start of MODEL 15 1 H LEU2028 H LEU2028 5.986 -5.800 6.844 2 HA LEU2028 HA LEU2028 5.327 -5.105 4.154 3 1HB LEU2028 2HB LEU2028 7.903 -6.103 5.398 4 2HB LEU2028 1HB LEU2028 7.746 -5.715 3.704 5 HG LEU2028 HG LEU2028 7.328 -3.338 4.312 6 1HD1 LEU2028 3HD1 LEU2028 6.403 -3.685 6.545 7 2HD1 LEU2028 2HD1 LEU2028 7.984 -4.220 7.117 8 3HD1 LEU2028 1HD1 LEU2028 7.761 -2.554 6.574 9 1HD2 LEU2028 2HD2 LEU2028 9.553 -4.121 3.753 10 2HD2 LEU2028 1HD2 LEU2028 9.617 -2.843 4.968 11 3HD2 LEU2028 3HD2 LEU2028 9.848 -4.526 5.445 12 H ASP2029 H ASP2029 3.763 -6.754 4.121 13 HA ASP2029 HA ASP2029 4.220 -9.523 3.973 14 1HB ASP2029 2HB ASP2029 1.967 -8.538 4.029 15 2HB ASP2029 1HB ASP2029 2.230 -7.854 2.431 16 H VAL2030 H VAL2030 4.251 -7.057 1.631 17 HA VAL2030 HA VAL2030 5.722 -8.741 -0.218 18 HB VAL2030 HB VAL2030 3.682 -8.108 -1.236 19 1HG1 VAL2030 2HG1 VAL2030 3.062 -6.303 0.316 20 2HG1 VAL2030 1HG1 VAL2030 4.244 -5.242 -0.440 21 3HG1 VAL2030 3HG1 VAL2030 2.840 -5.806 -1.354 22 1HG2 VAL2030 1HG2 VAL2030 5.613 -7.899 -2.688 23 2HG2 VAL2030 3HG2 VAL2030 4.384 -6.717 -3.124 24 3HG2 VAL2030 2HG2 VAL2030 5.808 -6.208 -2.218 25 H ASP2031 H ASP2031 7.709 -8.170 -0.522 26 HA ASP2031 HA ASP2031 8.770 -6.000 0.975 27 1HB ASP2031 2HB ASP2031 10.123 -7.939 -0.885 28 2HB ASP2031 1HB ASP2031 10.974 -6.704 0.030 29 H LEU2032 H LEU2032 7.990 -6.573 -2.205 30 HA LEU2032 HA LEU2032 8.245 -3.841 -2.954 31 1HB LEU2032 2HB LEU2032 10.188 -4.022 -4.533 32 2HB LEU2032 1HB LEU2032 10.538 -3.948 -2.820 33 HG LEU2032 HG LEU2032 10.775 -6.507 -2.974 34 1HD1 LEU2032 2HD1 LEU2032 9.739 -6.719 -5.156 35 2HD1 LEU2032 1HD1 LEU2032 11.070 -5.822 -5.871 36 3HD1 LEU2032 3HD1 LEU2032 11.377 -7.402 -5.132 37 1HD2 LEU2032 3HD2 LEU2032 12.721 -4.676 -4.335 38 2HD2 LEU2032 2HD2 LEU2032 12.619 -5.007 -2.607 39 3HD2 LEU2032 1HD2 LEU2032 13.097 -6.290 -3.728 40 H GLU2033 H GLU2033 7.498 -7.023 -4.066 41 HA GLU2033 HA GLU2033 7.350 -6.294 -6.794 42 1HB GLU2033 2HB GLU2033 6.587 -8.775 -5.338 43 2HB GLU2033 1HB GLU2033 6.175 -8.561 -7.036 44 1HG GLU2033 2HG GLU2033 8.964 -8.417 -5.893 45 2HG GLU2033 1HG GLU2033 8.267 -9.794 -6.739 46 H THR2034 H THR2034 5.301 -4.967 -4.803 47 HA THR2034 HA THR2034 3.245 -5.081 -6.867 48 HB THR2034 HB THR2034 2.460 -6.466 -4.812 49 HG1 THR2034 1HG THR2034 0.693 -4.288 -5.029 50 1HG2 THR2034 2HG2 THR2034 3.391 -4.935 -3.101 51 2HG2 THR2034 1HG2 THR2034 2.241 -3.711 -3.613 52 3HG2 THR2034 3HG2 THR2034 1.649 -5.205 -2.894 53 H ARG2035 H ARG2035 1.730 -3.211 -6.605 54 HA ARG2035 HA ARG2035 3.231 -0.799 -5.971 55 1HB ARG2035 2HB ARG2035 0.494 -1.153 -7.251 56 2HB ARG2035 1HB ARG2035 1.309 0.376 -7.015 57 1HG ARG2035 2HG ARG2035 1.503 -0.169 -9.312 58 2HG ARG2035 1HG ARG2035 3.085 -0.450 -8.590 59 1HD ARG2035 2HD ARG2035 2.699 -2.836 -8.566 60 2HD ARG2035 1HD ARG2035 1.041 -2.610 -9.119 61 HE ARG2035 HE ARG2035 2.407 -1.428 -11.062 62 1HH1 ARG2035 1HH1 ARG2035 2.958 -4.617 -9.588 63 2HH1 ARG2035 2HH1 ARG2035 3.544 -5.321 -11.029 64 1HH2 ARG2035 1HH2 ARG2035 3.197 -2.371 -12.961 65 2HH2 ARG2035 2HH2 ARG2035 3.677 -4.003 -13.021 66 H ILE2036 H ILE2036 2.745 0.268 -4.101 67 HA ILE2036 HA ILE2036 0.577 -0.808 -2.486 68 HB ILE2036 HB ILE2036 2.605 1.341 -1.792 69 1HG1 ILE2036 2HG1 ILE2036 3.707 -0.792 -2.164 70 2HG1 ILE2036 1HG1 ILE2036 3.742 -0.394 -0.453 71 1HG2 ILE2036 3HG2 ILE2036 0.580 1.537 -0.448 72 2HG2 ILE2036 2HG2 ILE2036 0.693 -0.165 -0.001 73 3HG2 ILE2036 1HG2 ILE2036 1.921 0.972 0.546 74 1HD1 ILE2036 1HD1 ILE2036 1.886 -1.962 -0.078 75 2HD1 ILE2036 3HD1 ILE2036 1.913 -2.382 -1.793 76 3HD1 ILE2036 2HD1 ILE2036 3.303 -2.742 -0.777 77 HA PRO2037 HA PRO2037 -1.819 2.610 -4.122 78 1HB PRO2037 2HB PRO2037 -4.229 1.906 -3.060 79 2HB PRO2037 1HB PRO2037 -3.531 1.145 -4.485 80 1HG PRO2037 2HG PRO2037 -3.518 0.145 -1.677 81 2HG PRO2037 1HG PRO2037 -3.814 -0.754 -3.179 82 1HD PRO2037 2HD PRO2037 -1.425 -0.751 -1.857 83 2HD PRO2037 1HD PRO2037 -1.563 -0.990 -3.610 84 H VAL2038 H VAL2038 -1.676 4.468 -3.244 85 HA VAL2038 HA VAL2038 -1.971 4.710 -0.347 86 HB VAL2038 HB VAL2038 -0.392 6.649 -0.472 87 1HG1 VAL2038 2HG1 VAL2038 0.393 4.459 0.282 88 2HG1 VAL2038 1HG1 VAL2038 0.721 3.995 -1.386 89 3HG1 VAL2038 3HG1 VAL2038 1.653 5.289 -0.632 90 1HG2 VAL2038 1HG2 VAL2038 0.113 5.616 -3.264 91 2HG2 VAL2038 3HG2 VAL2038 -0.604 7.171 -2.842 92 3HG2 VAL2038 2HG2 VAL2038 1.082 6.839 -2.441 93 H ILE2039 H ILE2039 -2.799 6.653 0.413 94 HA ILE2039 HA ILE2039 -4.299 8.206 -1.553 95 HB ILE2039 HB ILE2039 -5.844 6.653 -0.431 96 1HG1 ILE2039 2HG1 ILE2039 -6.245 9.496 0.531 97 2HG1 ILE2039 1HG1 ILE2039 -6.638 8.904 -1.076 98 1HG2 ILE2039 1HG2 ILE2039 -4.944 7.961 2.131 99 2HG2 ILE2039 3HG2 ILE2039 -6.308 6.845 1.999 100 3HG2 ILE2039 2HG2 ILE2039 -4.669 6.279 1.662 101 1HD1 ILE2039 2HD1 ILE2039 -7.902 7.971 1.496 102 2HD1 ILE2039 1HD1 ILE2039 -8.618 9.091 0.331 103 3HD1 ILE2039 3HD1 ILE2039 -8.313 7.415 -0.125 104 H ASN2040 H ASN2040 -4.070 10.288 -1.351 105 HA ASN2040 HA ASN2040 -2.182 11.385 0.491 106 1HB ASN2040 2HB ASN2040 -2.556 12.380 -1.764 107 2HB ASN2040 1HB ASN2040 -4.168 12.869 -1.245 108 1HD2 ASN2040 1HD2 ASN2040 -0.747 13.483 -0.912 109 2HD2 ASN2040 2HD2 ASN2040 -0.919 15.008 -0.148 110 H LYS2041 H LYS2041 -2.496 12.216 2.419 111 HA LYS2041 HA LYS2041 -4.902 11.731 3.755 112 1HB LYS2041 2HB LYS2041 -2.471 13.230 4.619 113 2HB LYS2041 1HB LYS2041 -3.821 12.810 5.664 114 1HG LYS2041 2HG LYS2041 -3.423 10.447 5.284 115 2HG LYS2041 1HG LYS2041 -2.112 10.830 4.165 116 1HD LYS2041 2HD LYS2041 -1.175 10.257 6.288 117 2HD LYS2041 1HD LYS2041 -0.950 11.988 5.971 118 1HE LYS2041 2HE LYS2041 -2.993 12.416 7.392 119 2HE LYS2041 1HE LYS2041 -2.976 10.706 7.805 120 1HZ LYS2041 1HZ LYS2041 -0.809 12.644 8.356 121 2HZ LYS2041 3HZ LYS2041 -1.918 12.070 9.480 122 3HZ LYS2041 2HZ LYS2041 -0.800 11.011 8.813 123 H VAL2042 H VAL2042 -3.720 14.582 2.163 124 HA VAL2042 HA VAL2042 -5.487 16.303 3.697 125 HB VAL2042 HB VAL2042 -3.595 17.037 1.457 126 1HG1 VAL2042 1HG1 VAL2042 -5.014 18.741 3.486 127 2HG1 VAL2042 3HG1 VAL2042 -3.814 19.312 2.331 128 3HG1 VAL2042 2HG1 VAL2042 -5.353 18.670 1.757 129 1HG2 VAL2042 2HG2 VAL2042 -3.206 17.169 4.446 130 2HG2 VAL2042 1HG2 VAL2042 -2.353 16.107 3.326 131 3HG2 VAL2042 3HG2 VAL2042 -2.103 17.854 3.252 132 H ASP2043 H ASP2043 -4.989 15.354 0.325 133 HA ASP2043 HA ASP2043 -7.482 16.688 -0.407 134 1HB ASP2043 2HB ASP2043 -5.564 16.976 -1.896 135 2HB ASP2043 1HB ASP2043 -5.496 15.237 -2.148 136 H GLY2044 H GLY2044 -6.267 13.442 0.004 137 1HA GLY2044 1HA GLY2044 -8.968 12.453 -0.461 138 2HA GLY2044 2HA GLY2044 -7.639 11.570 0.294 139 H THR2045 H THR2045 -6.026 12.800 -2.044 140 HA THR2045 HA THR2045 -6.847 11.673 -4.445 141 HB THR2045 HB THR2045 -3.997 12.117 -3.587 142 HG1 THR2045 1HG THR2045 -6.079 13.994 -4.085 143 1HG2 THR2045 3HG2 THR2045 -5.417 12.418 -6.243 144 2HG2 THR2045 2HG2 THR2045 -3.708 12.745 -5.953 145 3HG2 THR2045 1HG2 THR2045 -4.331 11.102 -5.799 146 H LEU2046 H LEU2046 -7.215 9.500 -4.569 147 HA LEU2046 HA LEU2046 -5.378 7.671 -3.279 148 1HB LEU2046 2HB LEU2046 -7.695 7.128 -2.961 149 2HB LEU2046 1HB LEU2046 -8.038 7.290 -4.660 150 HG LEU2046 HG LEU2046 -8.102 4.908 -3.800 151 1HD1 LEU2046 1HD1 LEU2046 -7.879 5.408 -6.113 152 2HD1 LEU2046 3HD1 LEU2046 -6.126 5.252 -5.950 153 3HD1 LEU2046 2HD1 LEU2046 -7.203 3.886 -5.599 154 1HD2 LEU2046 1HD2 LEU2046 -6.240 5.039 -2.212 155 2HD2 LEU2046 3HD2 LEU2046 -6.047 3.727 -3.373 156 3HD2 LEU2046 2HD2 LEU2046 -5.116 5.205 -3.563 157 H LEU2047 H LEU2047 -4.056 6.360 -4.283 158 HA LEU2047 HA LEU2047 -3.766 6.525 -7.215 159 1HB LEU2047 2HB LEU2047 -1.549 6.347 -5.180 160 2HB LEU2047 1HB LEU2047 -1.370 6.443 -6.917 161 HG LEU2047 HG LEU2047 -2.370 8.654 -5.118 162 1HD1 LEU2047 2HD1 LEU2047 0.001 8.224 -4.855 163 2HD1 LEU2047 1HD1 LEU2047 0.223 8.317 -6.607 164 3HD1 LEU2047 3HD1 LEU2047 -0.268 9.748 -5.700 165 1HD2 LEU2047 2HD2 LEU2047 -3.399 8.762 -7.347 166 2HD2 LEU2047 1HD2 LEU2047 -2.249 10.071 -7.102 167 3HD2 LEU2047 3HD2 LEU2047 -1.793 8.682 -8.086 168 H VAL2048 H VAL2048 -4.649 4.654 -7.730 169 HA VAL2048 HA VAL2048 -3.309 2.255 -6.666 170 HB VAL2048 HB VAL2048 -5.163 0.941 -7.802 171 1HG1 VAL2048 3HG1 VAL2048 -5.645 2.777 -5.525 172 2HG1 VAL2048 2HG1 VAL2048 -6.876 1.586 -5.995 173 3HG1 VAL2048 1HG1 VAL2048 -5.259 1.071 -5.479 174 1HG2 VAL2048 3HG2 VAL2048 -5.960 2.694 -9.315 175 2HG2 VAL2048 2HG2 VAL2048 -7.268 2.111 -8.286 176 3HG2 VAL2048 1HG2 VAL2048 -6.485 3.653 -7.934 177 H GLY2049 H GLY2049 -3.118 0.455 -8.349 178 1HA GLY2049 1HA GLY2049 -2.963 1.032 -11.091 179 2HA GLY2049 2HA GLY2049 -2.194 -0.318 -10.268 180 H GLU2050 H GLU2050 -1.448 1.933 -12.324 181 HA GLU2050 HA GLU2050 1.262 1.993 -11.393 182 1HB GLU2050 2HB GLU2050 0.029 2.801 -14.013 183 2HB GLU2050 1HB GLU2050 1.714 3.088 -13.618 184 1HG GLU2050 2HG GLU2050 0.406 0.388 -13.614 185 2HG GLU2050 1HG GLU2050 1.390 1.047 -14.929 186 H ASP2051 H ASP2051 -1.285 3.939 -10.897 187 HA ASP2051 HA ASP2051 0.111 6.453 -10.855 188 1HB ASP2051 2HB ASP2051 -2.482 5.432 -9.831 189 2HB ASP2051 1HB ASP2051 -1.929 7.026 -9.320 190 H ALA2052 H ALA2052 -0.266 3.730 -8.905 191 HA ALA2052 HA ALA2052 0.539 5.003 -6.454 192 1HB ALA2052 1HB ALA2052 0.300 2.730 -5.525 193 2HB ALA2052 2HB ALA2052 -0.051 2.127 -7.155 194 3HB ALA2052 3HB ALA2052 -1.135 3.288 -6.389 195 HA PRO2053 HA PRO2053 4.821 4.168 -7.216 196 1HB PRO2053 2HB PRO2053 5.768 4.268 -4.684 197 2HB PRO2053 1HB PRO2053 5.272 5.717 -5.559 198 1HG PRO2053 2HG PRO2053 3.796 4.152 -3.492 199 2HG PRO2053 1HG PRO2053 3.894 5.911 -3.702 200 1HD PRO2053 2HD PRO2053 1.766 4.402 -4.505 201 2HD PRO2053 1HD PRO2053 2.238 5.925 -5.286 202 H ARG2054 H ARG2054 6.433 2.584 -6.840 203 HA ARG2054 HA ARG2054 5.384 -0.060 -6.483 204 1HB ARG2054 2HB ARG2054 8.233 0.894 -6.657 205 2HB ARG2054 1HB ARG2054 7.682 -0.760 -6.802 206 1HG ARG2054 2HG ARG2054 6.639 -0.331 -8.855 207 2HG ARG2054 1HG ARG2054 6.822 1.417 -8.650 208 1HD ARG2054 2HD ARG2054 9.255 1.127 -8.653 209 2HD ARG2054 1HD ARG2054 9.041 -0.594 -8.957 210 HE ARG2054 HE ARG2054 8.007 0.005 -11.049 211 1HH1 ARG2054 1HH1 ARG2054 9.787 2.652 -9.466 212 2HH1 ARG2054 2HH1 ARG2054 10.343 3.310 -10.921 213 1HH2 ARG2054 1HH2 ARG2054 8.738 0.977 -13.047 214 2HH2 ARG2054 2HH2 ARG2054 9.732 2.363 -13.007 215 H ARG2055 H ARG2055 5.784 -1.401 -4.770 216 HA ARG2055 HA ARG2055 6.118 -0.240 -2.260 217 1HB ARG2055 2HB ARG2055 4.939 -2.323 -2.351 218 2HB ARG2055 1HB ARG2055 6.267 -3.109 -3.163 219 1HG ARG2055 2HG ARG2055 5.927 -3.783 -0.853 220 2HG ARG2055 1HG ARG2055 7.558 -3.167 -1.161 221 1HD ARG2055 2HD ARG2055 6.363 -0.924 -0.259 222 2HD ARG2055 1HD ARG2055 5.389 -2.132 0.596 223 HE ARG2055 HE ARG2055 7.940 -2.956 0.918 224 1HH1 ARG2055 1HH1 ARG2055 6.073 -0.171 2.072 225 2HH1 ARG2055 2HH1 ARG2055 7.291 0.378 3.109 226 1HH2 ARG2055 1HH2 ARG2055 9.613 -2.145 2.327 227 2HH2 ARG2055 2HH2 ARG2055 9.398 -0.727 3.220 228 H ALA2056 H ALA2056 8.488 -1.554 -4.468 229 HA ALA2056 HA ALA2056 10.765 -1.787 -2.933 230 1HB ALA2056 3HB ALA2056 10.583 -2.306 -5.370 231 2HB ALA2056 1HB ALA2056 12.014 -1.359 -4.954 232 3HB ALA2056 2HB ALA2056 10.618 -0.581 -5.688 233 H GLU2057 H GLU2057 9.234 1.150 -4.115 234 HA GLU2057 HA GLU2057 11.376 2.735 -2.863 235 1HB GLU2057 2HB GLU2057 10.813 4.471 -4.526 236 2HB GLU2057 1HB GLU2057 11.354 2.969 -5.272 237 1HG GLU2057 2HG GLU2057 8.989 2.416 -5.673 238 2HG GLU2057 1HG GLU2057 8.552 4.002 -5.046 239 H LEU2058 H LEU2058 8.527 1.698 -2.062 240 HA LEU2058 HA LEU2058 6.787 3.880 -1.893 241 1HB LEU2058 2HB LEU2058 6.008 1.613 -1.745 242 2HB LEU2058 1HB LEU2058 6.880 1.332 -0.255 243 HG LEU2058 HG LEU2058 4.375 1.513 -0.066 244 1HD1 LEU2058 3HD1 LEU2058 5.734 1.847 1.896 245 2HD1 LEU2058 2HD1 LEU2058 5.890 3.559 1.515 246 3HD1 LEU2058 1HD1 LEU2058 4.310 2.890 1.926 247 1HD2 LEU2058 3HD2 LEU2058 4.867 4.410 -0.737 248 2HD2 LEU2058 2HD2 LEU2058 3.967 3.231 -1.696 249 3HD2 LEU2058 1HD2 LEU2058 3.350 3.741 -0.129 250 H GLU2059 H GLU2059 8.783 2.534 0.730 251 HA GLU2059 HA GLU2059 8.045 4.632 2.478 252 1HB GLU2059 2HB GLU2059 9.890 3.803 3.920 253 2HB GLU2059 1HB GLU2059 8.673 2.598 3.501 254 1HG GLU2059 2HG GLU2059 10.218 1.691 1.825 255 2HG GLU2059 1HG GLU2059 11.418 2.895 2.306 256 H MET2060 H MET2060 10.624 4.221 0.278 257 HA MET2060 HA MET2060 12.260 6.394 1.142 258 1HB MET2060 2HB MET2060 11.976 5.239 -1.642 259 2HB MET2060 1HB MET2060 13.254 6.324 -1.125 260 1HG MET2060 2HG MET2060 12.759 3.553 -0.068 261 2HG MET2060 1HG MET2060 13.993 4.020 -1.235 262 1HE MET2060 3HE MET2060 14.550 2.381 1.439 263 2HE MET2060 2HE MET2060 15.826 2.817 0.304 264 3HE MET2060 1HE MET2060 16.021 3.158 2.023 265 H TRP2061 H TRP2061 9.553 6.118 -1.018 266 HA TRP2061 HA TRP2061 9.552 8.778 -1.985 267 1HB TRP2061 2HB TRP2061 8.496 6.835 -3.118 268 2HB TRP2061 1HB TRP2061 7.340 6.724 -1.805 269 HD1 TRP2061 HD TRP2061 8.357 9.249 -4.575 270 HE1 TRP2061 1HE TRP2061 6.205 10.458 -5.341 271 HE3 TRP2061 3HE TRP2061 5.050 7.168 -1.291 272 HZ2 TRP2061 2HZ TRP2061 3.490 10.498 -4.650 273 HZ3 TRP2061 3HZ TRP2061 2.692 7.836 -1.414 274 HH2 TRP2061 HH TRP2061 1.928 9.465 -3.060 275 H LEU2062 H LEU2062 7.748 7.064 0.555 276 HA LEU2062 HA LEU2062 6.321 9.284 1.544 277 1HB LEU2062 2HB LEU2062 7.130 6.751 2.969 278 2HB LEU2062 1HB LEU2062 6.073 7.957 3.662 279 HG LEU2062 HG LEU2062 5.500 6.268 1.227 280 1HD1 LEU2062 1HD1 LEU2062 5.364 5.059 3.334 281 2HD1 LEU2062 3HD1 LEU2062 4.287 6.290 3.985 282 3HD1 LEU2062 2HD1 LEU2062 3.764 5.289 2.631 283 1HD2 LEU2062 1HD2 LEU2062 3.797 8.368 2.580 284 2HD2 LEU2062 3HD2 LEU2062 4.495 8.476 0.961 285 3HD2 LEU2062 2HD2 LEU2062 3.256 7.277 1.309 286 H GLN2063 H GLN2063 9.531 8.139 2.240 287 HA GLN2063 HA GLN2063 10.148 9.622 4.482 288 1HB GLN2063 2HB GLN2063 11.458 7.782 3.393 289 2HB GLN2063 1HB GLN2063 11.936 8.925 2.158 290 1HG GLN2063 2HG GLN2063 13.089 10.264 3.792 291 2HG GLN2063 1HG GLN2063 12.541 9.176 5.074 292 1HE2 GLN2063 1HE2 GLN2063 14.645 8.652 5.667 293 2HE2 GLN2063 2HE2 GLN2063 15.659 7.627 4.722 294 H GLY2064 H GLY2064 9.900 10.554 1.140 295 1HA GLY2064 1HA GLY2064 10.654 12.591 0.142 296 2HA GLY2064 2HA GLY2064 10.935 13.226 1.755 297 H HIS2065 H HIS2065 7.970 11.611 1.461 298 HA HIS2065 HA HIS2065 6.519 14.093 1.584 299 1HB HIS2065 2HB HIS2065 6.821 13.563 -0.888 300 2HB HIS2065 1HB HIS2065 5.888 12.099 -0.615 301 HD1 HIS2065 1HD HIS2065 5.441 15.360 -1.918 302 HD2 HIS2065 2HD HIS2065 3.240 12.952 0.633 303 HE1 HIS2065 1HE HIS2065 3.083 16.202 -2.038 304 HA PRO2066 HA PRO2066 4.874 10.652 4.178 305 1HB PRO2066 2HB PRO2066 4.666 11.988 6.447 306 2HB PRO2066 1HB PRO2066 6.265 11.567 5.813 307 1HG PRO2066 2HG PRO2066 4.775 14.162 5.550 308 2HG PRO2066 1HG PRO2066 6.449 13.908 6.098 309 1HD PRO2066 2HD PRO2066 5.833 14.604 3.529 310 2HD PRO2066 1HD PRO2066 7.219 13.583 3.941 311 H GLU2067 H GLU2067 3.375 12.955 2.616 312 HA GLU2067 HA GLU2067 1.044 13.391 4.287 313 1HB GLU2067 2HB GLU2067 1.547 14.240 1.440 314 2HB GLU2067 1HB GLU2067 0.247 14.808 2.475 315 1HG GLU2067 2HG GLU2067 3.179 15.221 2.981 316 2HG GLU2067 1HG GLU2067 2.090 16.418 2.289 317 H PHE2068 H PHE2068 1.913 10.784 2.678 318 HA PHE2068 HA PHE2068 -0.800 10.229 1.728 319 1HB PHE2068 2HB PHE2068 1.843 9.225 0.712 320 2HB PHE2068 1HB PHE2068 0.367 8.316 0.433 321 HD1 PHE2068 1HD PHE2068 -1.080 8.900 -1.305 322 HD2 PHE2068 2HD PHE2068 2.003 11.576 -0.171 323 HE1 PHE2068 1HE PHE2068 -1.544 10.258 -3.300 324 HE2 PHE2068 2HE PHE2068 1.550 12.952 -2.163 325 HZ PHE2068 HZ PHE2068 -0.228 12.292 -3.731 326 H ALA2069 H ALA2069 -1.806 8.429 2.335 327 HA ALA2069 HA ALA2069 -0.533 6.799 4.412 328 1HB ALA2069 2HB ALA2069 -3.442 7.568 4.084 329 2HB ALA2069 1HB ALA2069 -2.808 6.474 5.314 330 3HB ALA2069 3HB ALA2069 -2.346 8.178 5.323 331 H VAL2070 H VAL2070 -1.608 4.583 4.454 332 HA VAL2070 HA VAL2070 -1.586 3.577 1.743 333 HB VAL2070 HB VAL2070 -0.321 2.380 3.500 334 1HG1 VAL2070 2HG1 VAL2070 -1.727 2.864 5.402 335 2HG1 VAL2070 1HG1 VAL2070 -2.972 1.780 4.777 336 3HG1 VAL2070 3HG1 VAL2070 -1.398 1.136 5.256 337 1HG2 VAL2070 3HG2 VAL2070 -2.612 0.735 2.422 338 2HG2 VAL2070 2HG2 VAL2070 -1.091 1.067 1.599 339 3HG2 VAL2070 1HG2 VAL2070 -1.105 0.091 3.069 340 H ASP2071 H ASP2071 -3.285 2.590 0.678 341 HA ASP2071 HA ASP2071 -5.883 3.439 1.200 342 1HB ASP2071 2HB ASP2071 -5.242 2.754 -1.040 343 2HB ASP2071 1HB ASP2071 -4.927 1.119 -0.476 344 HA PRO2072 HA PRO2072 -7.125 0.817 4.545 345 1HB PRO2072 2HB PRO2072 -9.841 1.009 4.087 346 2HB PRO2072 1HB PRO2072 -8.864 2.172 5.000 347 1HG PRO2072 2HG PRO2072 -9.778 2.277 2.157 348 2HG PRO2072 1HG PRO2072 -9.701 3.583 3.356 349 1HD PRO2072 2HD PRO2072 -7.879 3.332 1.439 350 2HD PRO2072 1HD PRO2072 -7.416 3.858 3.075 351 H ARG2073 H ARG2073 -8.262 0.164 1.242 352 HA ARG2073 HA ARG2073 -9.121 -2.422 2.111 353 1HB ARG2073 2HB ARG2073 -9.188 -1.141 -0.605 354 2HB ARG2073 1HB ARG2073 -9.502 -2.866 -0.402 355 1HG ARG2073 2HG ARG2073 -11.274 -2.318 1.207 356 2HG ARG2073 1HG ARG2073 -10.994 -0.611 0.898 357 1HD ARG2073 2HD ARG2073 -11.693 -0.880 -1.402 358 2HD ARG2073 1HD ARG2073 -11.840 -2.630 -1.185 359 HE ARG2073 HE ARG2073 -13.379 -1.450 0.761 360 1HH1 ARG2073 1HH1 ARG2073 -13.497 -1.628 -2.804 361 2HH1 ARG2073 2HH1 ARG2073 -15.179 -1.425 -2.869 362 1HH2 ARG2073 1HH2 ARG2073 -15.671 -1.186 0.619 363 2HH2 ARG2073 2HH2 ARG2073 -16.448 -1.189 -0.895 364 H PHE2074 H PHE2074 -6.235 -1.083 0.950 365 HA PHE2074 HA PHE2074 -5.135 -3.602 0.195 366 1HB PHE2074 2HB PHE2074 -4.089 -1.496 -0.549 367 2HB PHE2074 1HB PHE2074 -3.647 -1.105 1.114 368 HD1 PHE2074 1HD PHE2074 -3.116 -3.523 -1.636 369 HD2 PHE2074 2HD PHE2074 -1.664 -2.000 2.063 370 HE1 PHE2074 1HE PHE2074 -1.041 -4.809 -1.928 371 HE2 PHE2074 2HE PHE2074 0.416 -3.274 1.775 372 HZ PHE2074 HZ PHE2074 0.731 -4.682 -0.221 373 H LEU2075 H LEU2075 -5.486 -1.802 3.131 374 HA LEU2075 HA LEU2075 -4.001 -3.494 4.845 375 1HB LEU2075 2HB LEU2075 -6.462 -1.851 5.450 376 2HB LEU2075 1HB LEU2075 -5.431 -2.584 6.661 377 HG LEU2075 HG LEU2075 -4.653 -0.370 4.763 378 1HD1 LEU2075 2HD1 LEU2075 -6.180 0.351 6.511 379 2HD1 LEU2075 1HD1 LEU2075 -5.134 -0.367 7.736 380 3HD1 LEU2075 3HD1 LEU2075 -4.558 0.994 6.774 381 1HD2 LEU2075 2HD2 LEU2075 -3.088 -1.733 6.959 382 2HD2 LEU2075 1HD2 LEU2075 -2.744 -1.803 5.233 383 3HD2 LEU2075 3HD2 LEU2075 -2.583 -0.277 6.101 384 H ALA2076 H ALA2076 -7.277 -3.581 3.630 385 HA ALA2076 HA ALA2076 -8.150 -5.834 5.102 386 1HB ALA2076 1HB ALA2076 -9.975 -5.981 3.466 387 2HB ALA2076 2HB ALA2076 -9.124 -4.855 2.413 388 3HB ALA2076 3HB ALA2076 -9.726 -4.312 3.984 389 H TYR2077 H TYR2077 -6.589 -5.477 1.968 390 HA TYR2077 HA TYR2077 -6.550 -8.179 1.186 391 1HB TYR2077 2HB TYR2077 -4.896 -5.798 0.477 392 2HB TYR2077 1HB TYR2077 -4.326 -7.383 -0.011 393 HD1 TYR2077 1HD TYR2077 -4.691 -7.722 -2.229 394 HD2 TYR2077 2HD TYR2077 -7.710 -5.759 0.018 395 HE1 TYR2077 1HE TYR2077 -6.132 -7.683 -4.205 396 HE2 TYR2077 2HE TYR2077 -9.157 -5.708 -1.961 397 HH TYR2077 HH TYR2077 -8.997 -5.843 -4.362 398 H MET2078 H MET2078 -4.486 -6.361 3.287 399 HA MET2078 HA MET2078 -2.479 -8.300 3.648 400 1HB MET2078 2HB MET2078 -2.046 -5.996 4.207 401 2HB MET2078 1HB MET2078 -3.406 -5.945 5.305 402 1HG MET2078 2HG MET2078 -1.001 -7.674 5.823 403 2HG MET2078 1HG MET2078 -1.049 -5.978 6.285 404 1HE MET2078 2HE MET2078 -0.597 -6.527 8.816 405 2HE MET2078 1HE MET2078 -1.504 -7.735 9.726 406 3HE MET2078 3HE MET2078 -0.453 -8.236 8.401 407 H GLU2079 H GLU2079 -5.553 -7.722 5.250 408 HA GLU2079 HA GLU2079 -5.262 -9.674 7.325 409 1HB GLU2079 2HB GLU2079 -7.800 -8.644 6.072 410 2HB GLU2079 1HB GLU2079 -7.641 -9.411 7.633 411 1HG GLU2079 2HG GLU2079 -6.371 -7.496 8.433 412 2HG GLU2079 1HG GLU2079 -6.545 -6.736 6.847 413 H ASP2080 H ASP2080 -7.011 -9.502 4.290 414 HA ASP2080 HA ASP2080 -8.171 -12.038 4.296 415 1HB ASP2080 2HB ASP2080 -9.053 -10.322 2.890 416 2HB ASP2080 1HB ASP2080 -7.529 -10.180 2.018 417 H ARG2081 H ARG2081 -5.073 -10.947 3.188 418 HA ARG2081 HA ARG2081 -3.187 -12.007 2.547 419 1HB ARG2081 2HB ARG2081 -4.586 -14.658 3.121 420 2HB ARG2081 1HB ARG2081 -2.860 -14.412 2.931 421 1HG ARG2081 2HG ARG2081 -4.496 -13.238 5.170 422 2HG ARG2081 1HG ARG2081 -3.598 -14.751 5.285 423 1HD ARG2081 2HD ARG2081 -2.402 -12.067 4.634 424 2HD ARG2081 1HD ARG2081 -2.412 -12.801 6.239 425 HE ARG2081 HE ARG2081 -1.255 -14.721 4.953 426 1HH1 ARG2081 1HH1 ARG2081 -0.671 -11.268 4.627 427 2HH1 ARG2081 2HH1 ARG2081 0.899 -11.468 3.968 428 1HH2 ARG2081 1HH2 ARG2081 0.937 -14.971 4.166 429 2HH2 ARG2081 2HH2 ARG2081 1.862 -13.586 3.802 430 H ARG2082 H ARG2082 -5.648 -14.311 1.539 431 HA ARG2082 HA ARG2082 -5.800 -13.462 -1.157 432 1HB ARG2082 2HB ARG2082 -3.477 -14.551 -1.002 433 2HB ARG2082 1HB ARG2082 -4.308 -16.071 -0.737 434 1HG ARG2082 2HG ARG2082 -3.668 -15.921 -3.045 435 2HG ARG2082 1HG ARG2082 -5.426 -15.780 -2.933 436 1HD ARG2082 2HD ARG2082 -5.217 -13.326 -3.069 437 2HD ARG2082 1HD ARG2082 -3.471 -13.506 -3.240 438 HE ARG2082 HE ARG2082 -5.157 -14.874 -5.150 439 1HH1 ARG2082 1HH1 ARG2082 -3.031 -12.088 -4.476 440 2HH1 ARG2082 2HH1 ARG2082 -2.866 -11.648 -6.104 441 1HH2 ARG2082 1HH2 ARG2082 -4.938 -14.198 -7.439 442 2HH2 ARG2082 2HH2 ARG2082 -3.980 -12.845 -7.792 443 H LYS2083 H LYS2083 -7.377 -14.333 1.227 444 HA LYS2083 HA LYS2083 -8.263 -17.001 0.656 445 1HB LYS2083 2HB LYS2083 -8.856 -15.092 2.881 446 2HB LYS2083 1HB LYS2083 -9.935 -16.443 2.598 447 1HG LYS2083 2HG LYS2083 -8.290 -16.938 4.352 448 2HG LYS2083 1HG LYS2083 -8.096 -18.015 2.974 449 1HD LYS2083 2HD LYS2083 -6.203 -16.669 2.199 450 2HD LYS2083 1HD LYS2083 -6.446 -15.562 3.541 451 1HE LYS2083 2HE LYS2083 -5.774 -18.485 3.835 452 2HE LYS2083 1HE LYS2083 -4.598 -17.173 3.885 453 1HZ LYS2083 3HZ LYS2083 -5.885 -16.283 5.835 454 2HZ LYS2083 2HZ LYS2083 -6.794 -17.708 5.812 455 3HZ LYS2083 1HZ LYS2083 -5.152 -17.779 6.094 456 H GLN2084 H GLN2084 -10.182 -13.967 0.993 457 HA GLN2084 HA GLN2084 -11.868 -15.016 -1.110 458 1HB GLN2084 2HB GLN2084 -12.655 -16.152 0.887 459 2HB GLN2084 1HB GLN2084 -12.877 -14.609 1.689 460 1HG GLN2084 2HG GLN2084 -14.575 -13.996 0.130 461 2HG GLN2084 1HG GLN2084 -14.315 -15.483 -0.787 462 1HE2 GLN2084 1HE2 GLN2084 -15.032 -17.393 0.030 463 2HE2 GLN2084 2HE2 GLN2084 -16.155 -17.530 1.325 464 H LYS2085 H LYS2085 -12.309 -13.387 -2.376 465 HA LYS2085 HA LYS2085 -12.120 -10.635 -1.432 466 1HB LYS2085 2HB LYS2085 -12.557 -11.717 -4.227 467 2HB LYS2085 1HB LYS2085 -12.133 -10.065 -3.804 468 1HG LYS2085 2HG LYS2085 -10.421 -12.521 -3.509 469 2HG LYS2085 1HG LYS2085 -10.171 -11.174 -4.614 470 1HD LYS2085 2HD LYS2085 -9.851 -9.676 -2.670 471 2HD LYS2085 1HD LYS2085 -10.051 -11.064 -1.600 472 1HE LYS2085 2HE LYS2085 -8.104 -12.125 -2.727 473 2HE LYS2085 1HE LYS2085 -7.864 -10.625 -3.619 474 1HZ LYS2085 1HZ LYS2085 -7.715 -9.515 -1.395 475 2HZ LYS2085 3HZ LYS2085 -7.666 -11.067 -0.710 476 3HZ LYS2085 2HZ LYS2085 -6.445 -10.574 -1.777 No H/Q in entry = 476 Start of MODEL 16 1 H LEU2028 H LEU2028 5.895 -15.081 1.711 2 HA LEU2028 HA LEU2028 5.433 -14.172 3.656 3 1HB LEU2028 2HB LEU2028 6.935 -11.783 2.614 4 2HB LEU2028 1HB LEU2028 6.482 -12.040 4.286 5 HG LEU2028 HG LEU2028 8.371 -13.789 2.699 6 1HD1 LEU2028 2HD1 LEU2028 8.918 -11.802 4.894 7 2HD1 LEU2028 1HD1 LEU2028 10.100 -12.886 4.168 8 3HD1 LEU2028 3HD1 LEU2028 9.347 -11.627 3.189 9 1HD2 LEU2028 3HD2 LEU2028 7.566 -13.890 5.611 10 2HD2 LEU2028 2HD2 LEU2028 7.187 -15.091 4.373 11 3HD2 LEU2028 1HD2 LEU2028 8.854 -14.846 4.871 12 H ASP2029 H ASP2029 5.091 -11.092 1.970 13 HA ASP2029 HA ASP2029 2.229 -11.235 2.444 14 1HB ASP2029 2HB ASP2029 2.083 -9.124 3.689 15 2HB ASP2029 1HB ASP2029 3.047 -10.301 4.563 16 H VAL2030 H VAL2030 4.867 -9.196 1.299 17 HA VAL2030 HA VAL2030 3.306 -8.695 -1.102 18 HB VAL2030 HB VAL2030 4.910 -6.552 0.409 19 1HG1 VAL2030 2HG1 VAL2030 3.453 -6.344 -2.155 20 2HG1 VAL2030 1HG1 VAL2030 4.163 -4.998 -1.255 21 3HG1 VAL2030 3HG1 VAL2030 5.197 -6.267 -1.921 22 1HG2 VAL2030 2HG2 VAL2030 2.722 -6.949 1.413 23 2HG2 VAL2030 1HG2 VAL2030 2.845 -5.355 0.647 24 3HG2 VAL2030 3HG2 VAL2030 1.975 -6.654 -0.164 25 H ASP2031 H ASP2031 4.805 -8.344 -2.977 26 HA ASP2031 HA ASP2031 7.372 -9.635 -2.364 27 1HB ASP2031 2HB ASP2031 5.690 -10.965 -3.709 28 2HB ASP2031 1HB ASP2031 5.903 -9.790 -5.002 29 H LEU2032 H LEU2032 7.026 -6.840 -2.216 30 HA LEU2032 HA LEU2032 8.180 -4.957 -2.659 31 1HB LEU2032 2HB LEU2032 9.954 -6.838 -4.177 32 2HB LEU2032 1HB LEU2032 10.337 -5.147 -3.987 33 HG LEU2032 HG LEU2032 10.022 -7.117 -1.714 34 1HD1 LEU2032 2HD1 LEU2032 12.501 -5.918 -2.941 35 2HD1 LEU2032 1HD1 LEU2032 12.447 -6.934 -1.500 36 3HD1 LEU2032 3HD1 LEU2032 11.988 -7.602 -3.064 37 1HD2 LEU2032 2HD2 LEU2032 10.977 -4.251 -1.755 38 2HD2 LEU2032 1HD2 LEU2032 9.472 -4.830 -1.045 39 3HD2 LEU2032 3HD2 LEU2032 11.024 -5.320 -0.356 40 H GLU2033 H GLU2033 7.885 -6.656 -5.758 41 HA GLU2033 HA GLU2033 7.827 -4.201 -7.241 42 1HB GLU2033 2HB GLU2033 7.259 -5.627 -9.199 43 2HB GLU2033 1HB GLU2033 8.682 -6.177 -8.331 44 1HG GLU2033 2HG GLU2033 7.398 -7.934 -7.266 45 2HG GLU2033 1HG GLU2033 5.924 -7.345 -8.024 46 H THR2034 H THR2034 5.577 -5.779 -5.459 47 HA THR2034 HA THR2034 3.110 -5.432 -6.665 48 HB THR2034 HB THR2034 3.951 -5.183 -3.797 49 HG1 THR2034 1HG THR2034 3.498 -7.376 -5.508 50 1HG2 THR2034 1HG2 THR2034 1.574 -4.571 -4.177 51 2HG2 THR2034 3HG2 THR2034 1.306 -6.169 -4.911 52 3HG2 THR2034 2HG2 THR2034 1.790 -6.022 -3.209 53 H ARG2035 H ARG2035 1.894 -3.593 -7.016 54 HA ARG2035 HA ARG2035 3.050 -1.006 -6.395 55 1HB ARG2035 2HB ARG2035 0.437 -1.565 -7.825 56 2HB ARG2035 1HB ARG2035 1.370 -0.086 -7.863 57 1HG ARG2035 2HG ARG2035 2.174 -2.720 -9.094 58 2HG ARG2035 1HG ARG2035 1.531 -1.328 -9.955 59 1HD ARG2035 2HD ARG2035 4.119 -1.390 -8.404 60 2HD ARG2035 1HD ARG2035 3.975 -1.561 -10.150 61 HE ARG2035 HE ARG2035 2.876 0.868 -8.977 62 1HH1 ARG2035 1HH1 ARG2035 5.487 -0.638 -10.833 63 2HH1 ARG2035 2HH1 ARG2035 6.257 0.834 -11.197 64 1HH2 ARG2035 1HH2 ARG2035 3.939 2.856 -9.503 65 2HH2 ARG2035 2HH2 ARG2035 5.371 2.868 -10.448 66 H ILE2036 H ILE2036 2.739 -0.723 -4.201 67 HA ILE2036 HA ILE2036 0.234 -1.241 -2.954 68 HB ILE2036 HB ILE2036 2.665 0.275 -1.992 69 1HG1 ILE2036 2HG1 ILE2036 3.070 -2.090 -2.355 70 2HG1 ILE2036 1HG1 ILE2036 3.060 -1.723 -0.630 71 1HG2 ILE2036 1HG2 ILE2036 0.706 1.086 -0.791 72 2HG2 ILE2036 3HG2 ILE2036 0.237 -0.567 -0.402 73 3HG2 ILE2036 2HG2 ILE2036 1.718 0.119 0.274 74 1HD1 ILE2036 1HD1 ILE2036 0.757 -2.592 -0.502 75 2HD1 ILE2036 3HD1 ILE2036 0.855 -3.055 -2.200 76 3HD1 ILE2036 2HD1 ILE2036 1.924 -3.808 -1.013 77 HA PRO2037 HA PRO2037 -1.697 2.572 -4.256 78 1HB PRO2037 2HB PRO2037 -3.809 2.005 -2.358 79 2HB PRO2037 1HB PRO2037 -3.876 1.998 -4.115 80 1HG PRO2037 2HG PRO2037 -4.017 -0.220 -2.499 81 2HG PRO2037 1HG PRO2037 -3.577 -0.255 -4.217 82 1HD PRO2037 2HD PRO2037 -1.884 -0.542 -1.808 83 2HD PRO2037 1HD PRO2037 -1.646 -1.142 -3.462 84 H VAL2038 H VAL2038 -1.713 4.553 -3.471 85 HA VAL2038 HA VAL2038 -1.424 4.946 -0.588 86 HB VAL2038 HB VAL2038 0.062 6.905 -1.071 87 1HG1 VAL2038 1HG1 VAL2038 1.100 4.255 -2.036 88 2HG1 VAL2038 3HG1 VAL2038 2.084 5.624 -1.511 89 3HG1 VAL2038 2HG1 VAL2038 1.028 4.809 -0.359 90 1HG2 VAL2038 1HG2 VAL2038 0.126 5.750 -3.851 91 2HG2 VAL2038 3HG2 VAL2038 -0.563 7.304 -3.380 92 3HG2 VAL2038 2HG2 VAL2038 1.179 7.034 -3.260 93 H ILE2039 H ILE2039 -2.225 6.952 0.145 94 HA ILE2039 HA ILE2039 -3.905 8.405 -1.755 95 HB ILE2039 HB ILE2039 -5.356 6.699 -0.557 96 1HG1 ILE2039 2HG1 ILE2039 -5.910 9.630 0.060 97 2HG1 ILE2039 1HG1 ILE2039 -6.279 8.823 -1.450 98 1HG2 ILE2039 1HG2 ILE2039 -4.568 8.307 1.905 99 2HG2 ILE2039 3HG2 ILE2039 -5.848 7.103 1.864 100 3HG2 ILE2039 2HG2 ILE2039 -4.165 6.644 1.598 101 1HD1 ILE2039 2HD1 ILE2039 -7.543 8.245 1.219 102 2HD1 ILE2039 1HD1 ILE2039 -8.205 9.228 -0.098 103 3HD1 ILE2039 3HD1 ILE2039 -7.973 7.492 -0.332 104 H ASN2040 H ASN2040 -4.338 10.488 -1.100 105 HA ASN2040 HA ASN2040 -2.631 12.008 0.507 106 1HB ASN2040 2HB ASN2040 -5.492 12.394 -0.317 107 2HB ASN2040 1HB ASN2040 -4.876 13.443 0.854 108 1HD2 ASN2040 1HD2 ASN2040 -2.068 13.440 -0.243 109 2HD2 ASN2040 2HD2 ASN2040 -2.186 14.467 -1.609 110 H LYS2041 H LYS2041 -2.550 12.405 2.691 111 HA LYS2041 HA LYS2041 -4.235 10.774 4.296 112 1HB LYS2041 2HB LYS2041 -2.327 12.941 5.204 113 2HB LYS2041 1HB LYS2041 -3.217 11.871 6.262 114 1HG LYS2041 2HG LYS2041 -2.025 9.962 4.993 115 2HG LYS2041 1HG LYS2041 -0.909 11.236 4.469 116 1HD LYS2041 2HD LYS2041 -0.686 11.904 6.860 117 2HD LYS2041 1HD LYS2041 -1.711 10.497 7.205 118 1HE LYS2041 2HE LYS2041 0.706 10.130 7.648 119 2HE LYS2041 1HE LYS2041 0.020 8.969 6.531 120 1HZ LYS2041 3HZ LYS2041 1.602 11.374 5.767 121 2HZ LYS2041 2HZ LYS2041 2.235 9.827 5.922 122 3HZ LYS2041 1HZ LYS2041 1.131 10.148 4.711 123 H VAL2042 H VAL2042 -4.582 13.746 2.835 124 HA VAL2042 HA VAL2042 -6.612 14.845 4.600 125 HB VAL2042 HB VAL2042 -6.237 15.406 1.621 126 1HG1 VAL2042 1HG1 VAL2042 -8.371 16.183 2.471 127 2HG1 VAL2042 3HG1 VAL2042 -7.556 17.080 3.752 128 3HG1 VAL2042 2HG1 VAL2042 -7.335 17.550 2.064 129 1HG2 VAL2042 1HG2 VAL2042 -4.960 16.820 3.960 130 2HG2 VAL2042 3HG2 VAL2042 -4.150 15.903 2.682 131 3HG2 VAL2042 2HG2 VAL2042 -4.963 17.417 2.299 132 H ASP2043 H ASP2043 -6.247 12.503 2.266 133 HA ASP2043 HA ASP2043 -7.390 10.860 1.454 134 1HB ASP2043 2HB ASP2043 -9.639 11.790 3.146 135 2HB ASP2043 1HB ASP2043 -9.605 10.354 2.092 136 H GLY2044 H GLY2044 -7.220 11.583 -0.384 137 1HA GLY2044 1HA GLY2044 -8.482 13.472 -1.653 138 2HA GLY2044 2HA GLY2044 -9.710 12.189 -1.710 139 H THR2045 H THR2045 -6.359 12.903 -2.295 140 HA THR2045 HA THR2045 -6.458 11.798 -4.919 141 HB THR2045 HB THR2045 -4.131 12.678 -3.224 142 HG1 THR2045 1HG THR2045 -4.722 14.549 -3.713 143 1HG2 THR2045 2HG2 THR2045 -3.418 11.193 -5.038 144 2HG2 THR2045 1HG2 THR2045 -4.283 12.185 -6.214 145 3HG2 THR2045 3HG2 THR2045 -2.890 12.850 -5.347 146 H LEU2046 H LEU2046 -6.855 9.658 -4.915 147 HA LEU2046 HA LEU2046 -5.123 7.871 -3.389 148 1HB LEU2046 2HB LEU2046 -7.541 7.413 -3.403 149 2HB LEU2046 1HB LEU2046 -7.532 7.352 -5.152 150 HG LEU2046 HG LEU2046 -6.025 5.358 -4.998 151 1HD1 LEU2046 1HD1 LEU2046 -6.700 5.493 -2.073 152 2HD1 LEU2046 3HD1 LEU2046 -5.911 4.142 -2.886 153 3HD1 LEU2046 2HD1 LEU2046 -5.106 5.710 -2.796 154 1HD2 LEU2046 1HD2 LEU2046 -8.714 5.130 -3.663 155 2HD2 LEU2046 3HD2 LEU2046 -8.404 5.101 -5.400 156 3HD2 LEU2046 2HD2 LEU2046 -7.802 3.798 -4.376 157 H LEU2047 H LEU2047 -3.608 6.664 -4.417 158 HA LEU2047 HA LEU2047 -3.417 6.924 -7.339 159 1HB LEU2047 2HB LEU2047 -1.140 6.755 -5.362 160 2HB LEU2047 1HB LEU2047 -0.984 6.832 -7.099 161 HG LEU2047 HG LEU2047 -2.009 9.049 -5.320 162 1HD1 LEU2047 3HD1 LEU2047 0.379 8.696 -5.112 163 2HD1 LEU2047 2HD1 LEU2047 0.558 8.772 -6.866 164 3HD1 LEU2047 1HD1 LEU2047 0.043 10.203 -5.968 165 1HD2 LEU2047 2HD2 LEU2047 -3.097 9.084 -7.518 166 2HD2 LEU2047 1HD2 LEU2047 -1.974 10.433 -7.330 167 3HD2 LEU2047 3HD2 LEU2047 -1.513 9.037 -8.297 168 H VAL2048 H VAL2048 -3.571 5.082 -8.339 169 HA VAL2048 HA VAL2048 -2.754 2.629 -6.971 170 HB VAL2048 HB VAL2048 -4.662 1.417 -7.964 171 1HG1 VAL2048 1HG1 VAL2048 -5.450 3.755 -6.250 172 2HG1 VAL2048 3HG1 VAL2048 -6.492 2.379 -6.586 173 3HG1 VAL2048 2HG1 VAL2048 -4.981 2.130 -5.720 174 1HG2 VAL2048 3HG2 VAL2048 -5.075 2.868 -9.896 175 2HG2 VAL2048 2HG2 VAL2048 -6.558 2.606 -8.973 176 3HG2 VAL2048 1HG2 VAL2048 -5.675 4.126 -8.821 177 H GLY2049 H GLY2049 -2.309 0.872 -8.511 178 1HA GLY2049 1HA GLY2049 -2.157 1.366 -11.311 179 2HA GLY2049 2HA GLY2049 -1.450 0.000 -10.456 180 H GLU2050 H GLU2050 -0.641 2.409 -12.426 181 HA GLU2050 HA GLU2050 2.074 2.415 -11.440 182 1HB GLU2050 2HB GLU2050 0.867 3.378 -14.009 183 2HB GLU2050 1HB GLU2050 2.569 3.561 -13.613 184 1HG GLU2050 2HG GLU2050 2.879 1.206 -13.531 185 2HG GLU2050 1HG GLU2050 1.146 0.920 -13.699 186 H ASP2051 H ASP2051 -0.538 4.293 -11.023 187 HA ASP2051 HA ASP2051 0.856 6.810 -10.771 188 1HB ASP2051 2HB ASP2051 -1.846 5.790 -10.131 189 2HB ASP2051 1HB ASP2051 -1.354 7.313 -9.383 190 H ALA2052 H ALA2052 0.307 4.008 -8.956 191 HA ALA2052 HA ALA2052 1.226 5.222 -6.461 192 1HB ALA2052 2HB ALA2052 0.585 3.038 -5.490 193 2HB ALA2052 3HB ALA2052 0.106 2.480 -7.094 194 3HB ALA2052 1HB ALA2052 -0.764 3.811 -6.335 195 HA PRO2053 HA PRO2053 5.202 3.442 -7.427 196 1HB PRO2053 2HB PRO2053 6.371 3.435 -5.022 197 2HB PRO2053 1HB PRO2053 5.956 4.958 -5.822 198 1HG PRO2053 2HG PRO2053 4.498 3.497 -3.658 199 2HG PRO2053 1HG PRO2053 4.848 5.231 -3.793 200 1HD PRO2053 2HD PRO2053 2.443 4.113 -4.471 201 2HD PRO2053 1HD PRO2053 3.076 5.603 -5.199 202 H ARG2054 H ARG2054 6.698 1.649 -6.729 203 HA ARG2054 HA ARG2054 5.232 -0.807 -6.204 204 1HB ARG2054 2HB ARG2054 8.218 -0.360 -6.239 205 2HB ARG2054 1HB ARG2054 7.377 -1.892 -6.364 206 1HG ARG2054 2HG ARG2054 6.543 -1.312 -8.528 207 2HG ARG2054 1HG ARG2054 7.226 0.313 -8.366 208 1HD ARG2054 2HD ARG2054 9.465 -0.694 -8.157 209 2HD ARG2054 1HD ARG2054 8.748 -2.278 -8.426 210 HE ARG2054 HE ARG2054 8.237 -0.324 -10.476 211 1HH1 ARG2054 1HH1 ARG2054 10.321 -2.982 -9.392 212 2HH1 ARG2054 2HH1 ARG2054 10.951 -3.320 -10.931 213 1HH2 ARG2054 1HH2 ARG2054 9.149 -0.759 -12.606 214 2HH2 ARG2054 2HH2 ARG2054 10.289 -2.012 -12.799 215 H ARG2055 H ARG2055 5.785 -2.133 -4.352 216 HA ARG2055 HA ARG2055 5.864 -0.742 -1.910 217 1HB ARG2055 2HB ARG2055 4.919 -2.970 -2.020 218 2HB ARG2055 1HB ARG2055 6.477 -3.651 -2.452 219 1HG ARG2055 2HG ARG2055 5.921 -4.092 -0.163 220 2HG ARG2055 1HG ARG2055 7.360 -3.049 -0.265 221 1HD ARG2055 2HD ARG2055 5.782 -1.109 0.161 222 2HD ARG2055 1HD ARG2055 4.529 -2.313 0.469 223 HE ARG2055 HE ARG2055 6.991 -2.057 2.044 224 1HH1 ARG2055 1HH1 ARG2055 3.524 -2.871 1.856 225 2HH1 ARG2055 2HH1 ARG2055 3.314 -3.022 3.527 226 1HH2 ARG2055 1HH2 ARG2055 6.670 -2.206 4.376 227 2HH2 ARG2055 2HH2 ARG2055 5.138 -2.601 4.996 228 H ALA2056 H ALA2056 8.367 -2.133 -3.860 229 HA ALA2056 HA ALA2056 10.537 -1.927 -2.087 230 1HB ALA2056 2HB ALA2056 11.924 -2.103 -4.049 231 2HB ALA2056 3HB ALA2056 10.555 -1.694 -5.085 232 3HB ALA2056 1HB ALA2056 10.560 -3.208 -4.182 233 H GLU2057 H GLU2057 8.826 0.474 -3.869 234 HA GLU2057 HA GLU2057 10.933 2.486 -3.445 235 1HB GLU2057 2HB GLU2057 8.316 2.720 -4.912 236 2HB GLU2057 1HB GLU2057 9.640 3.872 -4.941 237 1HG GLU2057 2HG GLU2057 11.014 2.286 -6.138 238 2HG GLU2057 1HG GLU2057 9.742 1.070 -6.028 239 H LEU2058 H LEU2058 7.893 1.383 -2.415 240 HA LEU2058 HA LEU2058 6.383 3.523 -1.748 241 1HB LEU2058 2HB LEU2058 5.682 1.202 -1.855 242 2HB LEU2058 1HB LEU2058 6.517 0.846 -0.367 243 HG LEU2058 HG LEU2058 4.035 0.949 -0.195 244 1HD1 LEU2058 2HD1 LEU2058 5.350 1.310 1.810 245 2HD1 LEU2058 1HD1 LEU2058 5.419 3.037 1.434 246 3HD1 LEU2058 3HD1 LEU2058 3.874 2.282 1.815 247 1HD2 LEU2058 3HD2 LEU2058 4.419 3.869 -0.783 248 2HD2 LEU2058 2HD2 LEU2058 3.596 2.683 -1.802 249 3HD2 LEU2058 1HD2 LEU2058 2.921 3.123 -0.233 250 H GLU2059 H GLU2059 8.680 1.957 0.522 251 HA GLU2059 HA GLU2059 7.853 3.603 2.666 252 1HB GLU2059 2HB GLU2059 8.964 1.471 3.097 253 2HB GLU2059 1HB GLU2059 10.435 2.070 2.344 254 1HG GLU2059 2HG GLU2059 10.710 3.715 4.058 255 2HG GLU2059 1HG GLU2059 9.166 3.271 4.773 256 H MET2060 H MET2060 10.584 3.735 0.540 257 HA MET2060 HA MET2060 11.735 6.118 1.557 258 1HB MET2060 2HB MET2060 11.869 4.986 -1.234 259 2HB MET2060 1HB MET2060 12.896 6.271 -0.629 260 1HG MET2060 2HG MET2060 13.892 4.776 0.976 261 2HG MET2060 1HG MET2060 12.802 3.480 0.494 262 1HE MET2060 3HE MET2060 12.803 2.381 -1.920 263 2HE MET2060 2HE MET2060 12.767 3.949 -2.738 264 3HE MET2060 1HE MET2060 13.978 2.757 -3.177 265 H TRP2061 H TRP2061 9.369 5.475 -0.928 266 HA TRP2061 HA TRP2061 9.129 8.060 -1.983 267 1HB TRP2061 2HB TRP2061 8.321 5.909 -3.031 268 2HB TRP2061 1HB TRP2061 6.997 5.915 -1.876 269 HD1 TRP2061 HD TRP2061 8.287 7.767 -4.962 270 HE1 TRP2061 1HE TRP2061 6.354 9.103 -5.987 271 HE3 TRP2061 3HE TRP2061 4.778 6.998 -1.338 272 HZ2 TRP2061 2HZ TRP2061 3.688 9.755 -5.348 273 HZ3 TRP2061 3HZ TRP2061 2.563 8.019 -1.621 274 HH2 TRP2061 HH TRP2061 2.029 9.365 -3.581 275 H LEU2062 H LEU2062 7.166 6.367 0.488 276 HA LEU2062 HA LEU2062 5.495 8.563 1.067 277 1HB LEU2062 2HB LEU2062 6.235 6.173 2.725 278 2HB LEU2062 1HB LEU2062 5.076 7.376 3.256 279 HG LEU2062 HG LEU2062 4.794 5.543 0.875 280 1HD1 LEU2062 1HD1 LEU2062 3.360 5.706 3.510 281 2HD1 LEU2062 3HD1 LEU2062 2.948 4.611 2.194 282 3HD1 LEU2062 2HD1 LEU2062 4.496 4.445 3.025 283 1HD2 LEU2062 1HD2 LEU2062 2.924 7.655 1.958 284 2HD2 LEU2062 3HD2 LEU2062 3.757 7.706 0.404 285 3HD2 LEU2062 2HD2 LEU2062 2.529 6.482 0.704 286 H GLN2063 H GLN2063 8.609 7.632 2.281 287 HA GLN2063 HA GLN2063 8.693 9.338 4.504 288 1HB GLN2063 2HB GLN2063 10.397 7.507 3.206 289 2HB GLN2063 1HB GLN2063 11.282 9.022 3.305 290 1HG GLN2063 2HG GLN2063 11.723 7.613 5.216 291 2HG GLN2063 1HG GLN2063 10.917 9.111 5.682 292 1HE2 GLN2063 1HE2 GLN2063 9.279 6.299 4.281 293 2HE2 GLN2063 2HE2 GLN2063 8.374 5.918 5.680 294 H GLY2064 H GLY2064 8.977 9.931 1.134 295 1HA GLY2064 1HA GLY2064 9.994 11.804 0.086 296 2HA GLY2064 2HA GLY2064 9.948 12.648 1.632 297 H HIS2065 H HIS2065 7.085 11.252 1.675 298 HA HIS2065 HA HIS2065 5.734 13.531 0.491 299 1HB HIS2065 2HB HIS2065 5.101 10.661 -0.233 300 2HB HIS2065 1HB HIS2065 3.986 11.991 -0.494 301 HD1 HIS2065 1HD HIS2065 7.018 10.378 -1.882 302 HD2 HIS2065 2HD HIS2065 4.729 13.766 -2.528 303 HE1 HIS2065 1HE HIS2065 7.695 11.246 -4.158 304 HA PRO2066 HA PRO2066 4.157 12.357 4.647 305 1HB PRO2066 2HB PRO2066 3.639 14.943 5.415 306 2HB PRO2066 1HB PRO2066 5.173 14.114 5.689 307 1HG PRO2066 2HG PRO2066 4.446 16.097 3.586 308 2HG PRO2066 1HG PRO2066 5.980 15.881 4.448 309 1HD PRO2066 2HD PRO2066 5.532 15.041 1.903 310 2HD PRO2066 1HD PRO2066 6.696 14.268 2.995 311 H GLU2067 H GLU2067 2.902 14.260 2.087 312 HA GLU2067 HA GLU2067 0.246 14.460 3.119 313 1HB GLU2067 2HB GLU2067 -0.336 15.355 0.907 314 2HB GLU2067 1HB GLU2067 1.051 16.180 1.615 315 1HG GLU2067 2HG GLU2067 2.532 14.849 0.177 316 2HG GLU2067 1HG GLU2067 1.115 14.058 -0.509 317 H PHE2068 H PHE2068 1.926 11.895 1.892 318 HA PHE2068 HA PHE2068 -0.538 10.620 1.009 319 1HB PHE2068 2HB PHE2068 2.242 10.311 -0.101 320 2HB PHE2068 1HB PHE2068 1.016 9.071 -0.321 321 HD1 PHE2068 1HD PHE2068 -0.957 9.506 -1.641 322 HD2 PHE2068 2HD PHE2068 2.152 12.385 -1.326 323 HE1 PHE2068 1HE PHE2068 -1.859 10.688 -3.598 324 HE2 PHE2068 2HE PHE2068 1.260 13.575 -3.283 325 HZ PHE2068 HZ PHE2068 -0.748 12.726 -4.424 326 H ALA2069 H ALA2069 -0.682 8.408 1.466 327 HA ALA2069 HA ALA2069 1.156 7.221 3.356 328 1HB ALA2069 2HB ALA2069 -0.398 8.507 4.735 329 2HB ALA2069 3HB ALA2069 -0.635 6.763 4.956 330 3HB ALA2069 1HB ALA2069 -1.754 7.707 3.962 331 H VAL2070 H VAL2070 0.462 4.955 3.666 332 HA VAL2070 HA VAL2070 -0.391 3.747 1.271 333 HB VAL2070 HB VAL2070 1.007 2.540 2.892 334 1HG1 VAL2070 2HG1 VAL2070 0.148 3.464 4.956 335 2HG1 VAL2070 1HG1 VAL2070 -1.372 2.598 4.730 336 3HG1 VAL2070 3HG1 VAL2070 0.121 1.703 5.016 337 1HG2 VAL2070 2HG2 VAL2070 -0.354 1.164 1.405 338 2HG2 VAL2070 1HG2 VAL2070 -0.175 0.380 2.973 339 3HG2 VAL2070 3HG2 VAL2070 -1.680 1.200 2.566 340 H ASP2071 H ASP2071 -2.410 2.965 0.642 341 HA ASP2071 HA ASP2071 -4.642 4.380 1.538 342 1HB ASP2071 2HB ASP2071 -4.616 3.490 -0.700 343 2HB ASP2071 1HB ASP2071 -4.497 1.842 -0.089 344 HA PRO2072 HA PRO2072 -5.470 2.226 5.297 345 1HB PRO2072 2HB PRO2072 -7.914 3.342 5.816 346 2HB PRO2072 1HB PRO2072 -6.375 4.161 6.112 347 1HG PRO2072 2HG PRO2072 -8.261 4.449 3.809 348 2HG PRO2072 1HG PRO2072 -7.368 5.705 4.687 349 1HD PRO2072 2HD PRO2072 -6.564 4.771 2.291 350 2HD PRO2072 1HD PRO2072 -5.413 5.302 3.530 351 H ARG2073 H ARG2073 -7.584 2.207 2.551 352 HA ARG2073 HA ARG2073 -9.290 0.178 3.619 353 1HB ARG2073 2HB ARG2073 -10.156 1.833 2.039 354 2HB ARG2073 1HB ARG2073 -9.028 1.273 0.818 355 1HG ARG2073 2HG ARG2073 -10.178 -0.800 0.599 356 2HG ARG2073 1HG ARG2073 -11.179 -0.455 2.013 357 1HD ARG2073 2HD ARG2073 -11.161 1.156 -0.535 358 2HD ARG2073 1HD ARG2073 -12.385 -0.039 -0.102 359 HE ARG2073 HE ARG2073 -12.549 1.487 2.001 360 1HH1 ARG2073 1HH1 ARG2073 -12.156 2.599 -1.337 361 2HH1 ARG2073 2HH1 ARG2073 -13.010 4.040 -1.105 362 1HH2 ARG2073 1HH2 ARG2073 -13.695 3.489 2.322 363 2HH2 ARG2073 2HH2 ARG2073 -13.879 4.592 1.037 364 H PHE2074 H PHE2074 -6.599 0.355 1.360 365 HA PHE2074 HA PHE2074 -6.467 -2.359 0.701 366 1HB PHE2074 2HB PHE2074 -5.093 -0.574 -0.436 367 2HB PHE2074 1HB PHE2074 -4.105 -0.479 1.014 368 HD1 PHE2074 1HD PHE2074 -5.227 -2.784 -1.649 369 HD2 PHE2074 2HD PHE2074 -2.265 -1.877 1.266 370 HE1 PHE2074 1HE PHE2074 -3.791 -4.560 -2.562 371 HE2 PHE2074 2HE PHE2074 -0.832 -3.654 0.364 372 HZ PHE2074 HZ PHE2074 -1.589 -4.996 -1.552 373 H LEU2075 H LEU2075 -5.116 -0.597 3.432 374 HA LEU2075 HA LEU2075 -3.735 -2.682 4.702 375 1HB LEU2075 2HB LEU2075 -5.295 -0.432 5.979 376 2HB LEU2075 1HB LEU2075 -4.178 -1.472 6.829 377 HG LEU2075 HG LEU2075 -3.469 0.489 4.646 378 1HD1 LEU2075 3HD1 LEU2075 -4.083 1.552 6.762 379 2HD1 LEU2075 2HD1 LEU2075 -2.925 0.528 7.607 380 3HD1 LEU2075 1HD1 LEU2075 -2.357 1.716 6.438 381 1HD2 LEU2075 3HD2 LEU2075 -1.720 -1.316 6.319 382 2HD2 LEU2075 2HD2 LEU2075 -1.998 -1.454 4.584 383 3HD2 LEU2075 1HD2 LEU2075 -1.142 -0.058 5.229 384 H ALA2076 H ALA2076 -7.075 -1.615 5.095 385 HA ALA2076 HA ALA2076 -7.863 -3.627 6.881 386 1HB ALA2076 1HB ALA2076 -10.149 -2.959 6.341 387 2HB ALA2076 3HB ALA2076 -9.120 -1.543 6.566 388 3HB ALA2076 2HB ALA2076 -9.560 -2.064 4.940 389 H TYR2077 H TYR2077 -7.795 -3.460 3.401 390 HA TYR2077 HA TYR2077 -9.324 -5.728 2.780 391 1HB TYR2077 2HB TYR2077 -8.631 -3.829 1.271 392 2HB TYR2077 1HB TYR2077 -7.039 -4.563 1.199 393 HD1 TYR2077 1HD TYR2077 -10.609 -5.422 0.643 394 HD2 TYR2077 2HD TYR2077 -6.579 -5.965 -0.592 395 HE1 TYR2077 1HE TYR2077 -11.384 -6.716 -1.281 396 HE2 TYR2077 2HE TYR2077 -7.347 -7.272 -2.528 397 HH TYR2077 HH TYR2077 -10.607 -7.321 -3.471 398 H MET2078 H MET2078 -5.839 -5.309 3.308 399 HA MET2078 HA MET2078 -5.146 -7.962 2.632 400 1HB MET2078 2HB MET2078 -3.655 -5.963 4.312 401 2HB MET2078 1HB MET2078 -3.024 -7.561 3.937 402 1HG MET2078 2HG MET2078 -3.221 -6.974 1.521 403 2HG MET2078 1HG MET2078 -3.631 -5.333 2.015 404 1HE MET2078 1HE MET2078 -1.970 -3.717 3.339 405 2HE MET2078 3HE MET2078 -1.729 -4.932 4.602 406 3HE MET2078 2HE MET2078 -0.339 -4.174 3.835 407 H GLU2079 H GLU2079 -5.982 -6.501 5.701 408 HA GLU2079 HA GLU2079 -5.537 -8.964 7.109 409 1HB GLU2079 2HB GLU2079 -6.573 -7.797 9.055 410 2HB GLU2079 1HB GLU2079 -5.206 -6.935 8.365 411 1HG GLU2079 2HG GLU2079 -6.725 -5.429 7.231 412 2HG GLU2079 1HG GLU2079 -8.105 -6.306 7.885 413 H ASP2080 H ASP2080 -8.217 -7.344 5.613 414 HA ASP2080 HA ASP2080 -10.378 -8.885 6.477 415 1HB ASP2080 2HB ASP2080 -10.646 -6.830 5.161 416 2HB ASP2080 1HB ASP2080 -9.886 -7.602 3.781 417 H ARG2081 H ARG2081 -7.848 -9.481 4.243 418 HA ARG2081 HA ARG2081 -6.965 -11.387 3.453 419 1HB ARG2081 2HB ARG2081 -9.362 -12.703 4.714 420 2HB ARG2081 1HB ARG2081 -8.204 -13.606 3.748 421 1HG ARG2081 2HG ARG2081 -6.520 -13.368 5.304 422 2HG ARG2081 1HG ARG2081 -7.238 -11.917 6.004 423 1HD ARG2081 2HD ARG2081 -8.500 -14.637 6.204 424 2HD ARG2081 1HD ARG2081 -7.396 -13.985 7.420 425 HE ARG2081 HE ARG2081 -9.221 -12.034 7.089 426 1HH1 ARG2081 1HH1 ARG2081 -9.613 -15.491 7.791 427 2HH1 ARG2081 2HH1 ARG2081 -10.877 -15.278 8.884 428 1HH2 ARG2081 1HH2 ARG2081 -10.995 -11.722 8.588 429 2HH2 ARG2081 2HH2 ARG2081 -11.691 -13.056 9.371 430 H ARG2082 H ARG2082 -8.947 -9.590 2.242 431 HA ARG2082 HA ARG2082 -9.493 -9.112 0.135 432 1HB ARG2082 2HB ARG2082 -7.484 -10.315 -0.554 433 2HB ARG2082 1HB ARG2082 -8.369 -11.826 -0.546 434 1HG ARG2082 2HG ARG2082 -9.714 -11.098 -2.403 435 2HG ARG2082 1HG ARG2082 -8.965 -9.501 -2.349 436 1HD ARG2082 2HD ARG2082 -7.581 -12.107 -2.949 437 2HD ARG2082 1HD ARG2082 -7.953 -10.819 -4.099 438 HE ARG2082 HE ARG2082 -6.432 -9.789 -1.971 439 1HH1 ARG2082 1HH1 ARG2082 -6.045 -11.817 -4.832 440 2HH1 ARG2082 2HH1 ARG2082 -4.379 -11.508 -5.011 441 1HH2 ARG2082 1HH2 ARG2082 -4.173 -9.336 -2.204 442 2HH2 ARG2082 2HH2 ARG2082 -3.274 -10.029 -3.472 443 H LYS2083 H LYS2083 -10.254 -12.545 0.542 444 HA LYS2083 HA LYS2083 -12.162 -13.761 0.400 445 1HB LYS2083 2HB LYS2083 -13.533 -11.108 0.813 446 2HB LYS2083 1HB LYS2083 -14.322 -12.671 0.905 447 1HG LYS2083 2HG LYS2083 -13.139 -13.242 2.875 448 2HG LYS2083 1HG LYS2083 -12.043 -11.865 2.691 449 1HD LYS2083 2HD LYS2083 -13.935 -10.337 2.957 450 2HD LYS2083 1HD LYS2083 -15.008 -11.720 3.166 451 1HE LYS2083 2HE LYS2083 -13.969 -12.317 5.213 452 2HE LYS2083 1HE LYS2083 -12.646 -11.180 4.944 453 1HZ LYS2083 3HZ LYS2083 -15.477 -10.350 5.275 454 2HZ LYS2083 2HZ LYS2083 -14.325 -10.352 6.528 455 3HZ LYS2083 1HZ LYS2083 -14.108 -9.373 5.179 456 H GLN2084 H GLN2084 -13.278 -10.783 -1.126 457 HA GLN2084 HA GLN2084 -13.848 -12.318 -3.552 458 1HB GLN2084 2HB GLN2084 -15.576 -10.190 -2.303 459 2HB GLN2084 1HB GLN2084 -15.857 -10.909 -3.878 460 1HG GLN2084 2HG GLN2084 -16.139 -13.097 -2.791 461 2HG GLN2084 1HG GLN2084 -15.951 -12.310 -1.222 462 1HE2 GLN2084 1HE2 GLN2084 -17.943 -12.698 -3.991 463 2HE2 GLN2084 2HE2 GLN2084 -19.394 -12.052 -3.326 464 H LYS2085 H LYS2085 -13.435 -11.312 -5.431 465 HA LYS2085 HA LYS2085 -12.005 -8.849 -5.139 466 1HB LYS2085 2HB LYS2085 -11.246 -9.356 -7.582 467 2HB LYS2085 1HB LYS2085 -10.539 -10.234 -6.247 468 1HG LYS2085 2HG LYS2085 -10.887 -11.853 -7.901 469 2HG LYS2085 1HG LYS2085 -12.217 -12.090 -6.783 470 1HD LYS2085 2HD LYS2085 -13.688 -10.824 -8.322 471 2HD LYS2085 1HD LYS2085 -12.336 -10.648 -9.441 472 1HE LYS2085 2HE LYS2085 -12.165 -13.133 -9.525 473 2HE LYS2085 1HE LYS2085 -13.627 -13.219 -8.545 474 1HZ LYS2085 1HZ LYS2085 -14.801 -12.006 -10.350 475 2HZ LYS2085 3HZ LYS2085 -13.380 -12.071 -11.267 476 3HZ LYS2085 2HZ LYS2085 -14.159 -13.486 -10.846 No H/Q in entry = 476 Start of MODEL 17 1 H LEU2028 H LEU2028 8.625 -9.656 5.140 2 HA LEU2028 HA LEU2028 8.008 -7.569 3.268 3 1HB LEU2028 2HB LEU2028 8.080 -9.178 1.490 4 2HB LEU2028 1HB LEU2028 9.482 -9.413 2.495 5 HG LEU2028 HG LEU2028 7.030 -11.182 2.406 6 1HD1 LEU2028 2HD1 LEU2028 8.355 -11.363 0.417 7 2HD1 LEU2028 1HD1 LEU2028 9.810 -11.629 1.372 8 3HD1 LEU2028 3HD1 LEU2028 8.516 -12.825 1.390 9 1HD2 LEU2028 3HD2 LEU2028 9.589 -11.501 3.973 10 2HD2 LEU2028 2HD2 LEU2028 7.971 -11.214 4.603 11 3HD2 LEU2028 1HD2 LEU2028 8.338 -12.745 3.801 12 H ASP2029 H ASP2029 6.207 -6.786 4.000 13 HA ASP2029 HA ASP2029 3.824 -8.168 4.533 14 1HB ASP2029 2HB ASP2029 2.732 -5.887 3.882 15 2HB ASP2029 1HB ASP2029 3.808 -5.931 5.270 16 H VAL2030 H VAL2030 5.289 -7.123 1.640 17 HA VAL2030 HA VAL2030 3.684 -8.927 0.077 18 HB VAL2030 HB VAL2030 3.507 -7.206 -1.796 19 1HG1 VAL2030 3HG1 VAL2030 1.983 -6.552 0.723 20 2HG1 VAL2030 2HG1 VAL2030 1.546 -5.997 -0.892 21 3HG1 VAL2030 1HG1 VAL2030 1.507 -7.721 -0.505 22 1HG2 VAL2030 3HG2 VAL2030 4.208 -5.298 0.419 23 2HG2 VAL2030 2HG2 VAL2030 5.180 -5.685 -1.002 24 3HG2 VAL2030 1HG2 VAL2030 3.642 -4.837 -1.188 25 H ASP2031 H ASP2031 4.829 -8.761 -2.289 26 HA ASP2031 HA ASP2031 7.588 -9.435 -1.689 27 1HB ASP2031 2HB ASP2031 5.998 -9.773 -4.251 28 2HB ASP2031 1HB ASP2031 7.645 -10.340 -4.003 29 H LEU2032 H LEU2032 6.556 -6.668 -1.910 30 HA LEU2032 HA LEU2032 7.458 -4.626 -2.215 31 1HB LEU2032 2HB LEU2032 9.843 -6.082 -3.311 32 2HB LEU2032 1HB LEU2032 9.802 -4.376 -2.925 33 HG LEU2032 HG LEU2032 9.467 -6.628 -0.936 34 1HD1 LEU2032 2HD1 LEU2032 11.719 -6.507 -1.813 35 2HD1 LEU2032 1HD1 LEU2032 11.791 -4.782 -1.448 36 3HD1 LEU2032 3HD1 LEU2032 11.672 -5.959 -0.136 37 1HD2 LEU2032 3HD2 LEU2032 9.671 -3.639 -0.529 38 2HD2 LEU2032 2HD2 LEU2032 8.254 -4.649 -0.225 39 3HD2 LEU2032 1HD2 LEU2032 9.697 -4.847 0.756 40 H GLU2033 H GLU2033 6.917 -6.546 -4.975 41 HA GLU2033 HA GLU2033 7.569 -4.325 -6.727 42 1HB GLU2033 2HB GLU2033 7.165 -5.938 -8.618 43 2HB GLU2033 1HB GLU2033 8.486 -6.348 -7.545 44 1HG GLU2033 2HG GLU2033 7.382 -8.367 -8.073 45 2HG GLU2033 1HG GLU2033 6.932 -7.981 -6.422 46 H THR2034 H THR2034 4.935 -5.214 -5.085 47 HA THR2034 HA THR2034 2.943 -4.740 -7.069 48 HB THR2034 HB THR2034 2.599 -6.162 -5.002 49 HG1 THR2034 1HG THR2034 0.609 -5.798 -5.050 50 1HG2 THR2034 3HG2 THR2034 3.691 -4.710 -3.384 51 2HG2 THR2034 2HG2 THR2034 2.445 -3.486 -3.629 52 3HG2 THR2034 1HG2 THR2034 2.027 -5.041 -2.909 53 H ARG2035 H ARG2035 1.432 -3.001 -6.987 54 HA ARG2035 HA ARG2035 2.654 -0.418 -6.455 55 1HB ARG2035 2HB ARG2035 0.107 -1.226 -7.873 56 2HB ARG2035 1HB ARG2035 0.630 0.430 -7.651 57 1HG ARG2035 2HG ARG2035 2.194 -1.647 -9.163 58 2HG ARG2035 1HG ARG2035 1.085 -0.485 -9.903 59 1HD ARG2035 2HD ARG2035 2.436 1.340 -8.886 60 2HD ARG2035 1HD ARG2035 3.592 0.131 -8.347 61 HE ARG2035 HE ARG2035 3.214 -0.193 -11.082 62 1HH1 ARG2035 1HH1 ARG2035 4.325 2.411 -9.004 63 2HH1 ARG2035 2HH1 ARG2035 5.627 2.878 -10.000 64 1HH2 ARG2035 1HH2 ARG2035 4.901 0.525 -12.541 65 2HH2 ARG2035 2HH2 ARG2035 5.963 1.776 -12.070 66 H ILE2036 H ILE2036 2.442 0.008 -4.327 67 HA ILE2036 HA ILE2036 0.209 -0.728 -2.763 68 HB ILE2036 HB ILE2036 2.360 1.344 -2.289 69 1HG1 ILE2036 2HG1 ILE2036 3.198 -0.926 -2.462 70 2HG1 ILE2036 1HG1 ILE2036 3.349 -0.341 -0.809 71 1HG2 ILE2036 1HG2 ILE2036 0.407 1.895 -0.938 72 2HG2 ILE2036 3HG2 ILE2036 0.352 0.241 -0.332 73 3HG2 ILE2036 2HG2 ILE2036 1.710 1.282 0.086 74 1HD1 ILE2036 1HD1 ILE2036 1.318 -1.643 -0.222 75 2HD1 ILE2036 3HD1 ILE2036 1.278 -2.275 -1.870 76 3HD1 ILE2036 2HD1 ILE2036 2.636 -2.651 -0.822 77 HA PRO2037 HA PRO2037 -2.472 2.594 -4.189 78 1HB PRO2037 2HB PRO2037 -4.290 1.747 -2.061 79 2HB PRO2037 1HB PRO2037 -4.539 1.692 -3.804 80 1HG PRO2037 2HG PRO2037 -4.184 -0.516 -2.253 81 2HG PRO2037 1HG PRO2037 -3.757 -0.452 -3.971 82 1HD PRO2037 2HD PRO2037 -2.015 -0.310 -1.563 83 2HD PRO2037 1HD PRO2037 -1.702 -1.021 -3.163 84 H VAL2038 H VAL2038 -1.927 4.531 -3.534 85 HA VAL2038 HA VAL2038 -1.808 5.024 -0.661 86 HB VAL2038 HB VAL2038 -0.290 6.948 -1.147 87 1HG1 VAL2038 2HG1 VAL2038 0.699 4.252 -2.031 88 2HG1 VAL2038 1HG1 VAL2038 1.702 5.621 -1.535 89 3HG1 VAL2038 3HG1 VAL2038 0.618 4.858 -0.373 90 1HG2 VAL2038 1HG2 VAL2038 -0.861 7.318 -3.489 91 2HG2 VAL2038 3HG2 VAL2038 0.873 7.034 -3.309 92 3HG2 VAL2038 2HG2 VAL2038 -0.177 5.749 -3.914 93 H ILE2039 H ILE2039 -2.848 6.647 0.175 94 HA ILE2039 HA ILE2039 -4.555 8.166 -1.657 95 HB ILE2039 HB ILE2039 -5.881 6.507 -0.490 96 1HG1 ILE2039 2HG1 ILE2039 -6.380 9.273 0.631 97 2HG1 ILE2039 1HG1 ILE2039 -6.918 8.684 -0.937 98 1HG2 ILE2039 3HG2 ILE2039 -4.857 7.708 2.075 99 2HG2 ILE2039 2HG2 ILE2039 -6.143 6.508 1.967 100 3HG2 ILE2039 1HG2 ILE2039 -4.501 6.094 1.456 101 1HD1 ILE2039 1HD1 ILE2039 -7.783 7.623 1.740 102 2HD1 ILE2039 3HD1 ILE2039 -8.713 8.685 0.686 103 3HD1 ILE2039 2HD1 ILE2039 -8.333 7.039 0.170 104 H ASN2040 H ASN2040 -4.416 10.249 -1.502 105 HA ASN2040 HA ASN2040 -2.707 11.572 0.395 106 1HB ASN2040 2HB ASN2040 -3.256 12.531 -1.907 107 2HB ASN2040 1HB ASN2040 -4.867 12.854 -1.285 108 1HD2 ASN2040 1HD2 ASN2040 -1.545 13.734 -1.153 109 2HD2 ASN2040 2HD2 ASN2040 -1.759 15.204 -0.288 110 H LYS2041 H LYS2041 -3.243 12.322 2.373 111 HA LYS2041 HA LYS2041 -5.776 11.460 3.341 112 1HB LYS2041 2HB LYS2041 -3.638 13.012 4.802 113 2HB LYS2041 1HB LYS2041 -5.050 12.287 5.547 114 1HG LYS2041 2HG LYS2041 -2.819 10.810 4.144 115 2HG LYS2041 1HG LYS2041 -3.069 10.906 5.883 116 1HD LYS2041 2HD LYS2041 -5.016 9.637 3.926 117 2HD LYS2041 1HD LYS2041 -3.830 8.756 4.873 118 1HE LYS2041 2HE LYS2041 -6.052 10.433 6.041 119 2HE LYS2041 1HE LYS2041 -6.108 8.686 5.836 120 1HZ LYS2041 2HZ LYS2041 -4.171 8.524 7.333 121 2HZ LYS2041 1HZ LYS2041 -4.226 10.189 7.591 122 3HZ LYS2041 3HZ LYS2041 -5.512 9.203 8.063 123 H VAL2042 H VAL2042 -4.517 14.633 2.458 124 HA VAL2042 HA VAL2042 -6.800 15.868 3.678 125 HB VAL2042 HB VAL2042 -4.544 16.907 3.488 126 1HG1 VAL2042 2HG1 VAL2042 -5.321 17.553 0.716 127 2HG1 VAL2042 1HG1 VAL2042 -4.001 18.341 1.598 128 3HG1 VAL2042 3HG1 VAL2042 -3.941 16.603 1.267 129 1HG2 VAL2042 3HG2 VAL2042 -6.922 18.516 2.673 130 2HG2 VAL2042 2HG2 VAL2042 -6.383 18.172 4.318 131 3HG2 VAL2042 1HG2 VAL2042 -5.419 19.226 3.273 132 H ASP2043 H ASP2043 -5.729 15.363 0.474 133 HA ASP2043 HA ASP2043 -8.210 16.386 -0.672 134 1HB ASP2043 2HB ASP2043 -6.142 16.532 -2.005 135 2HB ASP2043 1HB ASP2043 -6.078 14.775 -2.092 136 H GLY2044 H GLY2044 -6.780 13.190 -0.462 137 1HA GLY2044 1HA GLY2044 -9.485 12.099 -0.777 138 2HA GLY2044 2HA GLY2044 -8.147 11.279 0.022 139 H THR2045 H THR2045 -6.685 12.607 -2.513 140 HA THR2045 HA THR2045 -7.446 11.123 -4.754 141 HB THR2045 HB THR2045 -4.628 12.004 -4.076 142 HG1 THR2045 1HG THR2045 -6.857 13.585 -4.472 143 1HG2 THR2045 2HG2 THR2045 -6.055 11.652 -6.719 144 2HG2 THR2045 1HG2 THR2045 -4.404 12.235 -6.519 145 3HG2 THR2045 3HG2 THR2045 -4.820 10.583 -6.060 146 H LEU2046 H LEU2046 -7.532 8.909 -4.768 147 HA LEU2046 HA LEU2046 -5.444 7.401 -3.376 148 1HB LEU2046 2HB LEU2046 -7.747 6.729 -2.894 149 2HB LEU2046 1HB LEU2046 -8.046 6.489 -4.604 150 HG LEU2046 HG LEU2046 -6.237 4.724 -4.553 151 1HD1 LEU2046 3HD1 LEU2046 -5.152 5.365 -2.483 152 2HD1 LEU2046 2HD1 LEU2046 -6.611 4.919 -1.587 153 3HD1 LEU2046 1HD1 LEU2046 -5.696 3.689 -2.445 154 1HD2 LEU2046 2HD2 LEU2046 -8.710 4.271 -2.914 155 2HD2 LEU2046 1HD2 LEU2046 -8.562 4.163 -4.674 156 3HD2 LEU2046 3HD2 LEU2046 -7.702 3.012 -3.650 157 H LEU2047 H LEU2047 -3.822 6.802 -4.518 158 HA LEU2047 HA LEU2047 -3.982 6.795 -7.442 159 1HB LEU2047 2HB LEU2047 -1.576 6.543 -5.635 160 2HB LEU2047 1HB LEU2047 -1.525 6.628 -7.382 161 HG LEU2047 HG LEU2047 -2.390 8.834 -5.513 162 1HD1 LEU2047 1HD1 LEU2047 0.014 8.460 -5.502 163 2HD1 LEU2047 3HD1 LEU2047 0.046 8.548 -7.263 164 3HD1 LEU2047 2HD1 LEU2047 -0.378 9.972 -6.316 165 1HD2 LEU2047 1HD2 LEU2047 -2.193 8.812 -8.531 166 2HD2 LEU2047 3HD2 LEU2047 -3.674 8.947 -7.578 167 3HD2 LEU2047 2HD2 LEU2047 -2.478 10.235 -7.533 168 H VAL2048 H VAL2048 -4.041 5.001 -8.575 169 HA VAL2048 HA VAL2048 -3.305 2.511 -7.262 170 HB VAL2048 HB VAL2048 -5.185 1.344 -8.389 171 1HG1 VAL2048 2HG1 VAL2048 -5.472 2.043 -6.080 172 2HG1 VAL2048 1HG1 VAL2048 -6.078 3.605 -6.611 173 3HG1 VAL2048 3HG1 VAL2048 -7.005 2.142 -6.957 174 1HG2 VAL2048 2HG2 VAL2048 -5.530 2.877 -10.254 175 2HG2 VAL2048 1HG2 VAL2048 -7.040 2.641 -9.370 176 3HG2 VAL2048 3HG2 VAL2048 -6.107 4.122 -9.148 177 H GLY2049 H GLY2049 -2.671 0.835 -8.745 178 1HA GLY2049 1HA GLY2049 -2.465 1.386 -11.539 179 2HA GLY2049 2HA GLY2049 -1.815 -0.012 -10.691 180 H GLU2050 H GLU2050 -0.667 1.768 -12.743 181 HA GLU2050 HA GLU2050 1.976 1.848 -11.637 182 1HB GLU2050 2HB GLU2050 0.975 2.843 -14.310 183 2HB GLU2050 1HB GLU2050 2.667 2.710 -13.858 184 1HG GLU2050 2HG GLU2050 0.738 0.402 -14.091 185 2HG GLU2050 1HG GLU2050 1.903 0.886 -15.314 186 H ASP2051 H ASP2051 -0.504 3.950 -11.531 187 HA ASP2051 HA ASP2051 0.944 6.439 -11.520 188 1HB ASP2051 2HB ASP2051 -1.768 5.571 -10.714 189 2HB ASP2051 1HB ASP2051 -1.267 7.258 -10.504 190 H ALA2052 H ALA2052 0.352 3.889 -9.359 191 HA ALA2052 HA ALA2052 0.811 5.528 -7.008 192 1HB ALA2052 3HB ALA2052 0.280 3.456 -5.775 193 2HB ALA2052 1HB ALA2052 0.109 2.608 -7.311 194 3HB ALA2052 2HB ALA2052 -1.006 3.910 -6.893 195 HA PRO2053 HA PRO2053 5.115 4.356 -6.988 196 1HB PRO2053 2HB PRO2053 4.953 4.250 -4.039 197 2HB PRO2053 1HB PRO2053 5.961 5.279 -5.064 198 1HG PRO2053 2HG PRO2053 3.878 6.284 -3.721 199 2HG PRO2053 1HG PRO2053 4.290 6.854 -5.349 200 1HD PRO2053 2HD PRO2053 2.149 4.940 -4.501 201 2HD PRO2053 1HD PRO2053 2.085 6.261 -5.695 202 H ARG2054 H ARG2054 6.298 2.469 -6.901 203 HA ARG2054 HA ARG2054 4.924 0.052 -6.337 204 1HB ARG2054 2HB ARG2054 6.599 0.325 -8.131 205 2HB ARG2054 1HB ARG2054 7.822 0.703 -6.933 206 1HG ARG2054 2HG ARG2054 7.596 -1.522 -6.020 207 2HG ARG2054 1HG ARG2054 6.387 -1.899 -7.256 208 1HD ARG2054 2HD ARG2054 9.239 -1.068 -7.786 209 2HD ARG2054 1HD ARG2054 8.646 -2.726 -7.878 210 HE ARG2054 HE ARG2054 7.025 -1.399 -9.571 211 1HH1 ARG2054 1HH1 ARG2054 10.556 -1.488 -9.303 212 2HH1 ARG2054 2HH1 ARG2054 10.835 -1.306 -10.964 213 1HH2 ARG2054 1HH2 ARG2054 7.396 -1.162 -11.886 214 2HH2 ARG2054 2HH2 ARG2054 8.984 -1.121 -12.471 215 H ARG2055 H ARG2055 5.351 -1.294 -4.568 216 HA ARG2055 HA ARG2055 5.613 -0.178 -2.078 217 1HB ARG2055 2HB ARG2055 4.627 -2.322 -2.319 218 2HB ARG2055 1HB ARG2055 6.083 -2.983 -3.016 219 1HG ARG2055 2HG ARG2055 5.663 -3.770 -0.786 220 2HG ARG2055 1HG ARG2055 7.196 -2.891 -0.900 221 1HD ARG2055 2HD ARG2055 6.123 -0.955 0.165 222 2HD ARG2055 1HD ARG2055 4.596 -1.842 0.242 223 HE ARG2055 HE ARG2055 5.415 -3.159 1.927 224 1HH1 ARG2055 1HH1 ARG2055 8.057 -1.044 0.757 225 2HH1 ARG2055 2HH1 ARG2055 9.055 -1.383 2.112 226 1HH2 ARG2055 1HH2 ARG2055 6.819 -3.582 3.682 227 2HH2 ARG2055 2HH2 ARG2055 8.346 -2.814 3.819 228 H ALA2056 H ALA2056 8.246 -1.475 -4.023 229 HA ALA2056 HA ALA2056 10.298 -1.358 -2.120 230 1HB ALA2056 3HB ALA2056 11.813 -1.343 -4.041 231 2HB ALA2056 1HB ALA2056 10.460 -0.950 -5.105 232 3HB ALA2056 2HB ALA2056 10.500 -2.504 -4.277 233 H GLU2057 H GLU2057 8.987 1.101 -4.283 234 HA GLU2057 HA GLU2057 10.979 3.116 -3.690 235 1HB GLU2057 2HB GLU2057 8.254 3.462 -4.920 236 2HB GLU2057 1HB GLU2057 9.615 4.562 -5.022 237 1HG GLU2057 2HG GLU2057 10.798 2.998 -6.412 238 2HG GLU2057 1HG GLU2057 9.493 1.822 -6.236 239 H LEU2058 H LEU2058 7.634 2.421 -3.013 240 HA LEU2058 HA LEU2058 6.646 4.645 -1.786 241 1HB LEU2058 2HB LEU2058 5.362 2.675 -2.511 242 2HB LEU2058 1HB LEU2058 6.056 1.739 -1.222 243 HG LEU2058 HG LEU2058 3.632 2.463 -0.980 244 1HD1 LEU2058 1HD1 LEU2058 4.864 1.571 0.895 245 2HD1 LEU2058 3HD1 LEU2058 5.510 3.174 1.248 246 3HD1 LEU2058 2HD1 LEU2058 3.782 2.868 1.412 247 1HD2 LEU2058 3HD2 LEU2058 4.941 5.092 -0.370 248 2HD2 LEU2058 2HD2 LEU2058 3.869 4.747 -1.729 249 3HD2 LEU2058 1HD2 LEU2058 3.247 4.701 -0.079 250 H GLU2059 H GLU2059 8.480 2.097 -0.371 251 HA GLU2059 HA GLU2059 8.233 2.651 2.346 252 1HB GLU2059 2HB GLU2059 9.078 0.609 1.342 253 2HB GLU2059 1HB GLU2059 10.478 1.469 0.753 254 1HG GLU2059 2HG GLU2059 11.240 1.821 3.011 255 2HG GLU2059 1HG GLU2059 9.784 1.029 3.629 256 H MET2060 H MET2060 10.782 3.587 0.089 257 HA MET2060 HA MET2060 12.125 5.320 1.948 258 1HB MET2060 2HB MET2060 13.261 4.044 0.099 259 2HB MET2060 1HB MET2060 12.472 5.089 -1.058 260 1HG MET2060 2HG MET2060 14.358 6.117 1.045 261 2HG MET2060 1HG MET2060 14.907 5.571 -0.535 262 1HE MET2060 2HE MET2060 16.127 7.878 -0.868 263 2HE MET2060 1HE MET2060 15.346 9.451 -0.704 264 3HE MET2060 3HE MET2060 15.570 8.425 0.714 265 H TRP2061 H TRP2061 9.771 5.627 -0.533 266 HA TRP2061 HA TRP2061 9.796 8.347 -1.161 267 1HB TRP2061 2HB TRP2061 8.619 6.488 -2.348 268 2HB TRP2061 1HB TRP2061 7.459 6.450 -1.042 269 HD1 TRP2061 HD TRP2061 8.646 8.865 -3.831 270 HE1 TRP2061 1HE TRP2061 6.590 10.222 -4.606 271 HE3 TRP2061 3HE TRP2061 5.219 7.182 -0.449 272 HZ2 TRP2061 2HZ TRP2061 3.887 10.531 -3.882 273 HZ3 TRP2061 3HZ TRP2061 2.928 8.053 -0.560 274 HH2 TRP2061 HH TRP2061 2.283 9.693 -2.240 275 H LEU2062 H LEU2062 7.677 6.624 1.136 276 HA LEU2062 HA LEU2062 6.318 8.805 2.172 277 1HB LEU2062 2HB LEU2062 7.058 6.211 3.475 278 2HB LEU2062 1HB LEU2062 5.982 7.379 4.223 279 HG LEU2062 HG LEU2062 5.480 5.865 1.653 280 1HD1 LEU2062 1HD1 LEU2062 4.252 5.624 4.393 281 2HD1 LEU2062 3HD1 LEU2062 3.742 4.739 2.957 282 3HD1 LEU2062 2HD1 LEU2062 5.348 4.467 3.636 283 1HD2 LEU2062 2HD2 LEU2062 3.698 7.783 3.171 284 2HD2 LEU2062 1HD2 LEU2062 4.426 8.079 1.592 285 3HD2 LEU2062 3HD2 LEU2062 3.218 6.811 1.779 286 H GLN2063 H GLN2063 9.474 7.630 2.996 287 HA GLN2063 HA GLN2063 9.844 8.802 5.465 288 1HB GLN2063 2HB GLN2063 11.264 7.060 4.535 289 2HB GLN2063 1HB GLN2063 11.808 8.163 3.286 290 1HG GLN2063 2HG GLN2063 12.817 9.573 4.981 291 2HG GLN2063 1HG GLN2063 12.314 8.417 6.220 292 1HE2 GLN2063 1HE2 GLN2063 13.438 7.445 3.051 293 2HE2 GLN2063 2HE2 GLN2063 14.915 6.730 3.573 294 H GLY2064 H GLY2064 10.474 10.111 2.263 295 1HA GLY2064 1HA GLY2064 11.595 12.188 1.866 296 2HA GLY2064 2HA GLY2064 11.301 12.634 3.545 297 H HIS2065 H HIS2065 8.667 11.209 2.079 298 HA HIS2065 HA HIS2065 7.081 13.620 1.854 299 1HB HIS2065 2HB HIS2065 8.350 13.798 -0.271 300 2HB HIS2065 1HB HIS2065 7.981 12.126 -0.648 301 HD1 HIS2065 1HD HIS2065 6.626 15.590 -0.969 302 HD2 HIS2065 2HD HIS2065 5.277 11.694 -1.497 303 HE1 HIS2065 1HE HIS2065 4.573 15.748 -2.383 304 HA PRO2066 HA PRO2066 4.598 10.114 2.583 305 1HB PRO2066 2HB PRO2066 3.097 11.401 4.542 306 2HB PRO2066 1HB PRO2066 4.440 10.303 4.861 307 1HG PRO2066 2HG PRO2066 4.323 13.196 5.178 308 2HG PRO2066 1HG PRO2066 5.553 12.061 5.748 309 1HD PRO2066 2HD PRO2066 5.695 13.845 3.485 310 2HD PRO2066 1HD PRO2066 6.920 12.717 4.077 311 H GLU2067 H GLU2067 3.128 13.153 3.334 312 HA GLU2067 HA GLU2067 1.100 14.061 2.913 313 1HB GLU2067 2HB GLU2067 2.285 13.889 0.156 314 2HB GLU2067 1HB GLU2067 0.787 14.765 0.482 315 1HG GLU2067 2HG GLU2067 1.948 16.147 2.129 316 2HG GLU2067 1HG GLU2067 3.436 15.264 1.812 317 H PHE2068 H PHE2068 1.498 11.268 1.168 318 HA PHE2068 HA PHE2068 -1.322 10.573 1.083 319 1HB PHE2068 2HB PHE2068 1.223 9.552 -0.047 320 2HB PHE2068 1HB PHE2068 -0.331 8.731 -0.288 321 HD1 PHE2068 1HD PHE2068 -1.645 9.346 -2.139 322 HD2 PHE2068 2HD PHE2068 1.535 11.887 -0.925 323 HE1 PHE2068 1HE PHE2068 -1.958 10.698 -4.172 324 HE2 PHE2068 2HE PHE2068 1.242 13.244 -2.964 325 HZ PHE2068 HZ PHE2068 -0.509 12.644 -4.587 326 H ALA2069 H ALA2069 -1.565 8.266 1.669 327 HA ALA2069 HA ALA2069 0.418 7.171 3.476 328 1HB ALA2069 2HB ALA2069 -1.181 8.398 4.906 329 2HB ALA2069 3HB ALA2069 -1.286 6.645 5.140 330 3HB ALA2069 1HB ALA2069 -2.496 7.479 4.164 331 H VAL2070 H VAL2070 -0.078 4.880 3.825 332 HA VAL2070 HA VAL2070 -0.941 3.656 1.415 333 HB VAL2070 HB VAL2070 0.817 2.579 2.712 334 1HG1 VAL2070 2HG1 VAL2070 -1.204 2.270 4.919 335 2HG1 VAL2070 1HG1 VAL2070 0.412 1.560 4.908 336 3HG1 VAL2070 3HG1 VAL2070 0.216 3.312 4.936 337 1HG2 VAL2070 1HG2 VAL2070 -0.609 1.088 1.406 338 2HG2 VAL2070 3HG2 VAL2070 -0.037 0.283 2.868 339 3HG2 VAL2070 2HG2 VAL2070 -1.689 0.896 2.784 340 H ASP2071 H ASP2071 -2.878 2.794 0.880 341 HA ASP2071 HA ASP2071 -5.184 3.636 2.157 342 1HB ASP2071 2HB ASP2071 -5.281 2.985 -0.161 343 2HB ASP2071 1HB ASP2071 -4.805 1.335 0.235 344 HA PRO2072 HA PRO2072 -5.246 1.014 5.650 345 1HB PRO2072 2HB PRO2072 -7.783 1.608 6.495 346 2HB PRO2072 1HB PRO2072 -6.366 2.621 6.780 347 1HG PRO2072 2HG PRO2072 -8.510 2.899 4.735 348 2HG PRO2072 1HG PRO2072 -7.672 4.153 5.658 349 1HD PRO2072 2HD PRO2072 -7.085 3.569 3.072 350 2HD PRO2072 1HD PRO2072 -5.882 4.191 4.226 351 H ARG2073 H ARG2073 -7.594 0.664 3.049 352 HA ARG2073 HA ARG2073 -8.666 -1.721 4.269 353 1HB ARG2073 2HB ARG2073 -9.963 -0.066 2.704 354 2HB ARG2073 1HB ARG2073 -9.158 -0.899 1.388 355 1HG ARG2073 2HG ARG2073 -10.931 -2.250 3.430 356 2HG ARG2073 1HG ARG2073 -11.483 -1.683 1.862 357 1HD ARG2073 2HD ARG2073 -10.240 -3.316 0.728 358 2HD ARG2073 1HD ARG2073 -9.216 -3.628 2.127 359 HE ARG2073 HE ARG2073 -11.964 -4.176 2.627 360 1HH1 ARG2073 1HH1 ARG2073 -9.089 -5.580 1.091 361 2HH1 ARG2073 2HH1 ARG2073 -9.543 -7.187 1.474 362 1HH2 ARG2073 1HH2 ARG2073 -12.523 -6.382 3.121 363 2HH2 ARG2073 2HH2 ARG2073 -11.476 -7.652 2.649 364 H PHE2074 H PHE2074 -6.310 -0.788 1.879 365 HA PHE2074 HA PHE2074 -5.747 -3.413 0.982 366 1HB PHE2074 2HB PHE2074 -4.924 -1.308 -0.173 367 2HB PHE2074 1HB PHE2074 -3.752 -1.131 1.127 368 HD1 PHE2074 1HD PHE2074 -4.913 -3.602 -1.392 369 HD2 PHE2074 2HD PHE2074 -1.653 -2.069 0.867 370 HE1 PHE2074 1HE PHE2074 -3.384 -5.083 -2.606 371 HE2 PHE2074 2HE PHE2074 -0.115 -3.550 -0.354 372 HZ PHE2074 HZ PHE2074 -0.978 -5.059 -2.090 373 H LEU2075 H LEU2075 -4.572 -1.513 3.685 374 HA LEU2075 HA LEU2075 -2.704 -3.377 4.706 375 1HB LEU2075 2HB LEU2075 -4.449 -1.428 6.211 376 2HB LEU2075 1HB LEU2075 -3.131 -2.328 6.926 377 HG LEU2075 HG LEU2075 -2.881 -0.210 4.790 378 1HD1 LEU2075 3HD1 LEU2075 -2.132 -0.239 7.708 379 2HD1 LEU2075 2HD1 LEU2075 -1.756 1.051 6.569 380 3HD1 LEU2075 1HD1 LEU2075 -3.436 0.689 6.970 381 1HD2 LEU2075 2HD2 LEU2075 -0.771 -1.828 6.224 382 2HD2 LEU2075 1HD2 LEU2075 -1.175 -1.939 4.513 383 3HD2 LEU2075 3HD2 LEU2075 -0.459 -0.461 5.154 384 H ALA2076 H ALA2076 -6.152 -3.040 5.116 385 HA ALA2076 HA ALA2076 -6.539 -5.093 6.993 386 1HB ALA2076 1HB ALA2076 -8.884 -5.027 6.343 387 2HB ALA2076 2HB ALA2076 -8.472 -4.135 4.882 388 3HB ALA2076 3HB ALA2076 -8.243 -3.385 6.460 389 H TYR2077 H TYR2077 -6.401 -5.090 3.488 390 HA TYR2077 HA TYR2077 -7.181 -7.752 3.059 391 1HB TYR2077 2HB TYR2077 -7.002 -6.036 1.265 392 2HB TYR2077 1HB TYR2077 -5.247 -6.120 1.394 393 HD1 TYR2077 1HD TYR2077 -8.247 -8.115 0.642 394 HD2 TYR2077 2HD TYR2077 -4.044 -7.772 0.206 395 HE1 TYR2077 1HE TYR2077 -8.275 -10.003 -0.909 396 HE2 TYR2077 2HE TYR2077 -4.047 -9.672 -1.364 397 HH TYR2077 HH TYR2077 -5.425 -11.583 -1.901 398 H MET2078 H MET2078 -4.067 -6.308 3.766 399 HA MET2078 HA MET2078 -2.434 -8.565 3.375 400 1HB MET2078 2HB MET2078 -2.072 -6.260 5.284 401 2HB MET2078 1HB MET2078 -0.848 -7.477 4.976 402 1HG MET2078 2HG MET2078 -0.733 -6.767 2.646 403 2HG MET2078 1HG MET2078 -1.979 -5.552 2.956 404 1HE MET2078 2HE MET2078 0.928 -4.927 1.704 405 2HE MET2078 1HE MET2078 -0.295 -3.685 1.961 406 3HE MET2078 3HE MET2078 1.344 -3.446 2.565 407 H GLU2079 H GLU2079 -4.139 -7.449 6.265 408 HA GLU2079 HA GLU2079 -3.201 -9.698 7.760 409 1HB GLU2079 2HB GLU2079 -4.734 -8.893 9.570 410 2HB GLU2079 1HB GLU2079 -3.514 -7.746 9.057 411 1HG GLU2079 2HG GLU2079 -5.127 -6.510 7.803 412 2HG GLU2079 1HG GLU2079 -6.369 -7.717 8.138 413 H ASP2080 H ASP2080 -6.149 -8.897 6.016 414 HA ASP2080 HA ASP2080 -7.790 -11.024 6.795 415 1HB ASP2080 2HB ASP2080 -7.541 -9.505 4.233 416 2HB ASP2080 1HB ASP2080 -8.473 -10.986 4.240 417 H ARG2081 H ARG2081 -5.241 -10.824 4.415 418 HA ARG2081 HA ARG2081 -3.960 -12.373 3.341 419 1HB ARG2081 2HB ARG2081 -4.985 -14.227 5.526 420 2HB ARG2081 1HB ARG2081 -3.616 -14.559 4.477 421 1HG ARG2081 2HG ARG2081 -2.389 -12.700 5.451 422 2HG ARG2081 1HG ARG2081 -3.784 -12.278 6.435 423 1HD ARG2081 2HD ARG2081 -3.645 -14.437 7.568 424 2HD ARG2081 1HD ARG2081 -2.241 -14.859 6.590 425 HE ARG2081 HE ARG2081 -1.577 -12.496 7.743 426 1HH1 ARG2081 1HH1 ARG2081 -2.585 -15.646 9.016 427 2HH1 ARG2081 2HH1 ARG2081 -1.687 -15.512 10.455 428 1HH2 ARG2081 1HH2 ARG2081 -0.332 -12.326 9.756 429 2HH2 ARG2081 2HH2 ARG2081 -0.434 -13.581 10.898 430 H ARG2082 H ARG2082 -4.521 -15.138 2.851 431 HA ARG2082 HA ARG2082 -6.881 -14.792 1.259 432 1HB ARG2082 2HB ARG2082 -4.938 -17.081 1.455 433 2HB ARG2082 1HB ARG2082 -6.401 -17.146 0.480 434 1HG ARG2082 2HG ARG2082 -5.613 -15.228 -0.818 435 2HG ARG2082 1HG ARG2082 -4.134 -15.200 0.144 436 1HD ARG2082 2HD ARG2082 -3.861 -16.378 -2.023 437 2HD ARG2082 1HD ARG2082 -3.531 -17.386 -0.618 438 HE ARG2082 HE ARG2082 -5.650 -18.423 -0.904 439 1HH1 ARG2082 1HH1 ARG2082 -4.618 -16.476 -3.710 440 2HH1 ARG2082 2HH1 ARG2082 -5.551 -17.353 -4.821 441 1HH2 ARG2082 1HH2 ARG2082 -6.930 -19.615 -2.480 442 2HH2 ARG2082 2HH2 ARG2082 -6.867 -19.188 -4.121 443 H LYS2083 H LYS2083 -7.968 -14.431 3.289 444 HA LYS2083 HA LYS2083 -9.599 -14.890 4.671 445 1HB LYS2083 2HB LYS2083 -9.735 -17.489 3.153 446 2HB LYS2083 1HB LYS2083 -10.816 -17.149 4.497 447 1HG LYS2083 2HG LYS2083 -10.540 -15.291 2.149 448 2HG LYS2083 1HG LYS2083 -11.696 -16.624 2.173 449 1HD LYS2083 2HD LYS2083 -12.853 -15.719 4.029 450 2HD LYS2083 1HD LYS2083 -11.584 -14.553 4.365 451 1HE LYS2083 2HE LYS2083 -13.282 -14.563 1.865 452 2HE LYS2083 1HE LYS2083 -13.640 -13.600 3.292 453 1HZ LYS2083 3HZ LYS2083 -11.522 -12.450 2.999 454 2HZ LYS2083 2HZ LYS2083 -11.186 -13.348 1.602 455 3HZ LYS2083 1HZ LYS2083 -12.481 -12.300 1.633 456 H GLN2084 H GLN2084 -8.204 -14.535 6.288 457 HA GLN2084 HA GLN2084 -6.967 -16.555 7.820 458 1HB GLN2084 2HB GLN2084 -6.920 -14.873 9.616 459 2HB GLN2084 1HB GLN2084 -6.386 -14.190 8.088 460 1HG GLN2084 2HG GLN2084 -8.496 -13.081 7.784 461 2HG GLN2084 1HG GLN2084 -9.167 -13.879 9.201 462 1HE2 GLN2084 1HE2 GLN2084 -8.917 -11.054 8.649 463 2HE2 GLN2084 2HE2 GLN2084 -7.931 -10.410 9.914 464 H LYS2085 H LYS2085 -7.687 -17.224 9.999 465 HA LYS2085 HA LYS2085 -9.041 -18.251 11.417 466 1HB LYS2085 2HB LYS2085 -10.279 -16.001 11.413 467 2HB LYS2085 1HB LYS2085 -11.407 -16.724 10.283 468 1HG LYS2085 2HG LYS2085 -12.382 -16.851 12.458 469 2HG LYS2085 1HG LYS2085 -11.875 -18.482 12.015 470 1HD LYS2085 2HD LYS2085 -9.831 -18.214 13.329 471 2HD LYS2085 1HD LYS2085 -10.327 -16.583 13.765 472 1HE LYS2085 2HE LYS2085 -10.838 -18.047 15.590 473 2HE LYS2085 1HE LYS2085 -12.344 -17.539 14.839 474 1HZ LYS2085 1HZ LYS2085 -12.447 -19.701 13.693 475 2HZ LYS2085 3HZ LYS2085 -10.983 -20.146 14.433 476 3HZ LYS2085 2HZ LYS2085 -12.341 -19.881 15.359 No H/Q in entry = 476 Start of MODEL 18 1 H LEU2028 H LEU2028 0.332 -15.029 -0.764 2 HA LEU2028 HA LEU2028 3.055 -14.438 -1.002 3 1HB LEU2028 2HB LEU2028 0.707 -13.088 -2.286 4 2HB LEU2028 1HB LEU2028 2.376 -12.819 -2.721 5 HG LEU2028 HG LEU2028 0.908 -15.445 -3.006 6 1HD1 LEU2028 2HD1 LEU2028 0.130 -13.739 -4.558 7 2HD1 LEU2028 1HD1 LEU2028 1.790 -13.440 -5.066 8 3HD1 LEU2028 3HD1 LEU2028 1.040 -15.002 -5.394 9 1HD2 LEU2028 2HD2 LEU2028 3.685 -14.618 -3.853 10 2HD2 LEU2028 1HD2 LEU2028 3.285 -15.792 -2.600 11 3HD2 LEU2028 3HD2 LEU2028 2.896 -16.133 -4.284 12 H ASP2029 H ASP2029 4.206 -12.679 -0.813 13 HA ASP2029 HA ASP2029 3.301 -10.628 1.074 14 1HB ASP2029 2HB ASP2029 5.391 -11.902 1.672 15 2HB ASP2029 1HB ASP2029 6.105 -11.410 0.144 16 H VAL2030 H VAL2030 4.221 -8.423 0.409 17 HA VAL2030 HA VAL2030 3.430 -7.843 -2.239 18 HB VAL2030 HB VAL2030 4.353 -5.535 -1.779 19 1HG1 VAL2030 3HG1 VAL2030 2.504 -6.719 0.288 20 2HG1 VAL2030 2HG1 VAL2030 2.694 -4.996 -0.039 21 3HG1 VAL2030 1HG1 VAL2030 2.040 -6.070 -1.279 22 1HG2 VAL2030 3HG2 VAL2030 5.017 -6.788 0.875 23 2HG2 VAL2030 2HG2 VAL2030 6.147 -6.093 -0.290 24 3HG2 VAL2030 1HG2 VAL2030 4.987 -5.053 0.548 25 H ASP2031 H ASP2031 6.442 -8.613 -0.760 26 HA ASP2031 HA ASP2031 8.539 -8.993 -1.486 27 1HB ASP2031 2HB ASP2031 7.127 -10.712 -2.715 28 2HB ASP2031 1HB ASP2031 7.256 -9.678 -4.131 29 H LEU2032 H LEU2032 7.465 -6.373 -1.888 30 HA LEU2032 HA LEU2032 8.190 -4.333 -2.463 31 1HB LEU2032 2HB LEU2032 10.566 -5.744 -3.642 32 2HB LEU2032 1HB LEU2032 10.437 -4.011 -3.403 33 HG LEU2032 HG LEU2032 10.441 -6.088 -1.213 34 1HD1 LEU2032 1HD1 LEU2032 12.590 -5.888 -2.293 35 2HD1 LEU2032 3HD1 LEU2032 12.554 -4.135 -2.084 36 3HD1 LEU2032 2HD1 LEU2032 12.635 -5.193 -0.671 37 1HD2 LEU2032 1HD2 LEU2032 10.432 -3.074 -1.091 38 2HD2 LEU2032 3HD2 LEU2032 9.138 -4.158 -0.567 39 3HD2 LEU2032 2HD2 LEU2032 10.682 -4.150 0.281 40 H GLU2033 H GLU2033 7.082 -6.449 -4.761 41 HA GLU2033 HA GLU2033 7.530 -4.570 -6.988 42 1HB GLU2033 2HB GLU2033 6.273 -7.307 -7.006 43 2HB GLU2033 1HB GLU2033 6.489 -6.289 -8.418 44 1HG GLU2033 2HG GLU2033 8.942 -6.406 -8.032 45 2HG GLU2033 1HG GLU2033 8.621 -7.566 -6.738 46 H THR2034 H THR2034 5.119 -5.482 -4.751 47 HA THR2034 HA THR2034 2.797 -5.012 -6.211 48 HB THR2034 HB THR2034 3.233 -4.555 -3.269 49 HG1 THR2034 1HG THR2034 2.530 -6.950 -4.618 50 1HG2 THR2034 1HG2 THR2034 0.796 -5.450 -4.823 51 2HG2 THR2034 3HG2 THR2034 0.923 -5.290 -3.070 52 3HG2 THR2034 2HG2 THR2034 1.028 -3.853 -4.091 53 H ARG2035 H ARG2035 1.727 -3.240 -6.730 54 HA ARG2035 HA ARG2035 2.785 -0.632 -6.131 55 1HB ARG2035 2HB ARG2035 0.370 -1.579 -7.678 56 2HB ARG2035 1HB ARG2035 0.794 0.112 -7.482 57 1HG ARG2035 2HG ARG2035 2.576 -1.945 -8.764 58 2HG ARG2035 1HG ARG2035 1.519 -0.836 -9.648 59 1HD ARG2035 2HD ARG2035 2.685 1.057 -8.648 60 2HD ARG2035 1HD ARG2035 3.741 -0.043 -7.774 61 HE ARG2035 HE ARG2035 4.438 -0.835 -10.025 62 1HH1 ARG2035 1HH1 ARG2035 3.342 2.494 -9.454 63 2HH1 ARG2035 2HH1 ARG2035 4.239 3.166 -10.724 64 1HH2 ARG2035 1HH2 ARG2035 5.754 0.123 -11.750 65 2HH2 ARG2035 2HH2 ARG2035 5.644 1.789 -12.043 66 H ILE2036 H ILE2036 2.515 -0.065 -4.094 67 HA ILE2036 HA ILE2036 0.264 -0.787 -2.510 68 HB ILE2036 HB ILE2036 2.330 1.367 -2.019 69 1HG1 ILE2036 2HG1 ILE2036 3.445 -0.767 -2.293 70 2HG1 ILE2036 1HG1 ILE2036 3.437 -0.288 -0.598 71 1HG2 ILE2036 3HG2 ILE2036 0.366 1.655 -0.614 72 2HG2 ILE2036 2HG2 ILE2036 0.482 -0.024 -0.087 73 3HG2 ILE2036 1HG2 ILE2036 1.744 1.124 0.354 74 1HD1 ILE2036 2HD1 ILE2036 1.622 -1.851 -0.153 75 2HD1 ILE2036 1HD1 ILE2036 1.605 -2.326 -1.848 76 3HD1 ILE2036 3HD1 ILE2036 3.013 -2.677 -0.847 77 HA PRO2037 HA PRO2037 -2.244 2.622 -4.079 78 1HB PRO2037 2HB PRO2037 -4.313 1.667 -2.270 79 2HB PRO2037 1HB PRO2037 -4.320 1.683 -4.032 80 1HG PRO2037 2HG PRO2037 -4.165 -0.570 -2.504 81 2HG PRO2037 1HG PRO2037 -3.571 -0.459 -4.172 82 1HD PRO2037 2HD PRO2037 -2.072 -0.420 -1.596 83 2HD PRO2037 1HD PRO2037 -1.600 -1.065 -3.180 84 H VAL2038 H VAL2038 -1.888 4.487 -3.238 85 HA VAL2038 HA VAL2038 -1.996 4.777 -0.328 86 HB VAL2038 HB VAL2038 -0.346 6.645 -0.559 87 1HG1 VAL2038 1HG1 VAL2038 0.610 3.956 -1.526 88 2HG1 VAL2038 3HG1 VAL2038 1.628 5.222 -0.841 89 3HG1 VAL2038 2HG1 VAL2038 0.400 4.444 0.156 90 1HG2 VAL2038 3HG2 VAL2038 -0.701 7.160 -2.921 91 2HG2 VAL2038 2HG2 VAL2038 0.997 6.793 -2.614 92 3HG2 VAL2038 1HG2 VAL2038 -0.045 5.588 -3.368 93 H ILE2039 H ILE2039 -2.893 6.615 0.476 94 HA ILE2039 HA ILE2039 -4.341 8.225 -1.478 95 HB ILE2039 HB ILE2039 -5.933 6.696 -0.424 96 1HG1 ILE2039 2HG1 ILE2039 -6.289 9.500 0.662 97 2HG1 ILE2039 1HG1 ILE2039 -6.658 9.011 -0.984 98 1HG2 ILE2039 3HG2 ILE2039 -4.773 6.214 1.645 99 2HG2 ILE2039 2HG2 ILE2039 -5.044 7.862 2.208 100 3HG2 ILE2039 1HG2 ILE2039 -6.413 6.770 1.989 101 1HD1 ILE2039 1HD1 ILE2039 -7.992 7.984 1.504 102 2HD1 ILE2039 3HD1 ILE2039 -8.661 9.160 0.374 103 3HD1 ILE2039 2HD1 ILE2039 -8.380 7.499 -0.147 104 H ASN2040 H ASN2040 -4.219 10.310 -1.248 105 HA ASN2040 HA ASN2040 -2.340 11.471 0.567 106 1HB ASN2040 2HB ASN2040 -2.834 12.432 -1.696 107 2HB ASN2040 1HB ASN2040 -4.432 12.878 -1.111 108 1HD2 ASN2040 1HD2 ASN2040 -1.034 13.605 -0.988 109 2HD2 ASN2040 2HD2 ASN2040 -1.217 15.132 -0.229 110 H LYS2041 H LYS2041 -2.689 12.132 2.550 111 HA LYS2041 HA LYS2041 -5.102 11.519 3.843 112 1HB LYS2041 2HB LYS2041 -2.746 13.086 4.821 113 2HB LYS2041 1HB LYS2041 -4.039 12.429 5.825 114 1HG LYS2041 2HG LYS2041 -3.450 10.178 5.176 115 2HG LYS2041 1HG LYS2041 -2.211 10.797 4.085 116 1HD LYS2041 2HD LYS2041 -1.138 10.079 6.073 117 2HD LYS2041 1HD LYS2041 -1.130 11.849 6.011 118 1HE LYS2041 2HE LYS2041 -3.025 11.918 7.563 119 2HE LYS2041 1HE LYS2041 -3.048 10.154 7.611 120 1HZ LYS2041 3HZ LYS2041 -0.770 10.256 8.531 121 2HZ LYS2041 2HZ LYS2041 -0.895 11.936 8.584 122 3HZ LYS2041 1HZ LYS2041 -1.908 11.006 9.515 123 H VAL2042 H VAL2042 -3.946 14.422 2.396 124 HA VAL2042 HA VAL2042 -5.737 16.116 3.929 125 HB VAL2042 HB VAL2042 -3.822 16.847 1.697 126 1HG1 VAL2042 2HG1 VAL2042 -5.594 18.485 1.952 127 2HG1 VAL2042 1HG1 VAL2042 -5.264 18.597 3.679 128 3HG1 VAL2042 3HG1 VAL2042 -4.057 19.145 2.515 129 1HG2 VAL2042 2HG2 VAL2042 -2.629 15.939 3.612 130 2HG2 VAL2042 1HG2 VAL2042 -2.347 17.672 3.475 131 3HG2 VAL2042 3HG2 VAL2042 -3.469 17.056 4.688 132 H ASP2043 H ASP2043 -5.121 15.453 0.502 133 HA ASP2043 HA ASP2043 -7.561 16.749 -0.339 134 1HB ASP2043 2HB ASP2043 -5.579 16.868 -1.750 135 2HB ASP2043 1HB ASP2043 -5.551 15.114 -1.898 136 H GLY2044 H GLY2044 -6.392 13.418 -0.202 137 1HA GLY2044 1HA GLY2044 -9.141 12.515 -0.661 138 2HA GLY2044 2HA GLY2044 -7.878 11.594 0.146 139 H THR2045 H THR2045 -6.176 12.836 -2.214 140 HA THR2045 HA THR2045 -6.967 11.562 -4.592 141 HB THR2045 HB THR2045 -4.121 12.142 -3.736 142 HG1 THR2045 1HG THR2045 -6.210 13.915 -4.108 143 1HG2 THR2045 1HG2 THR2045 -4.376 10.941 -5.864 144 2HG2 THR2045 3HG2 THR2045 -5.475 12.192 -6.442 145 3HG2 THR2045 2HG2 THR2045 -3.783 12.580 -6.135 146 H LEU2046 H LEU2046 -7.203 9.370 -4.763 147 HA LEU2046 HA LEU2046 -5.420 7.609 -3.254 148 1HB LEU2046 2HB LEU2046 -7.816 7.169 -3.082 149 2HB LEU2046 1HB LEU2046 -7.943 7.045 -4.824 150 HG LEU2046 HG LEU2046 -6.435 5.050 -4.711 151 1HD1 LEU2046 3HD1 LEU2046 -5.383 5.475 -2.564 152 2HD1 LEU2046 2HD1 LEU2046 -6.936 5.260 -1.753 153 3HD1 LEU2046 1HD1 LEU2046 -6.179 3.901 -2.576 154 1HD2 LEU2046 1HD2 LEU2046 -8.836 4.821 -4.954 155 2HD2 LEU2046 3HD2 LEU2046 -8.191 3.533 -3.935 156 3HD2 LEU2046 2HD2 LEU2046 -9.037 4.897 -3.199 157 H LEU2047 H LEU2047 -3.805 6.652 -4.235 158 HA LEU2047 HA LEU2047 -3.663 6.723 -7.177 159 1HB LEU2047 2HB LEU2047 -1.448 6.328 -5.169 160 2HB LEU2047 1HB LEU2047 -1.268 6.456 -6.906 161 HG LEU2047 HG LEU2047 -2.150 8.648 -5.039 162 1HD1 LEU2047 1HD1 LEU2047 0.377 8.286 -6.636 163 2HD1 LEU2047 3HD1 LEU2047 -0.046 9.715 -5.690 164 3HD1 LEU2047 2HD1 LEU2047 0.217 8.167 -4.884 165 1HD2 LEU2047 1HD2 LEU2047 -3.289 8.835 -7.191 166 2HD2 LEU2047 3HD2 LEU2047 -2.091 10.106 -6.993 167 3HD2 LEU2047 2HD2 LEU2047 -1.740 8.725 -8.032 168 H VAL2048 H VAL2048 -3.868 4.963 -8.240 169 HA VAL2048 HA VAL2048 -3.328 2.406 -6.930 170 HB VAL2048 HB VAL2048 -5.275 1.407 -8.173 171 1HG1 VAL2048 2HG1 VAL2048 -5.974 3.576 -6.202 172 2HG1 VAL2048 1HG1 VAL2048 -7.017 2.221 -6.645 173 3HG1 VAL2048 3HG1 VAL2048 -5.489 1.927 -5.811 174 1HG2 VAL2048 1HG2 VAL2048 -5.533 3.145 -9.884 175 2HG2 VAL2048 3HG2 VAL2048 -7.043 2.879 -9.014 176 3HG2 VAL2048 2HG2 VAL2048 -6.051 4.289 -8.645 177 H GLY2049 H GLY2049 -3.280 0.624 -8.700 178 1HA GLY2049 1HA GLY2049 -2.729 1.188 -11.364 179 2HA GLY2049 2HA GLY2049 -2.187 -0.234 -10.493 180 H GLU2050 H GLU2050 -1.032 1.960 -12.428 181 HA GLU2050 HA GLU2050 1.572 1.781 -11.187 182 1HB GLU2050 2HB GLU2050 0.819 2.651 -13.966 183 2HB GLU2050 1HB GLU2050 2.462 2.448 -13.369 184 1HG GLU2050 2HG GLU2050 2.061 0.098 -12.997 185 2HG GLU2050 1HG GLU2050 0.392 0.284 -13.530 186 H ASP2051 H ASP2051 -0.766 3.893 -10.893 187 HA ASP2051 HA ASP2051 0.971 6.224 -10.835 188 1HB ASP2051 2HB ASP2051 -1.899 5.734 -10.299 189 2HB ASP2051 1HB ASP2051 -1.167 7.272 -9.812 190 H ALA2052 H ALA2052 -0.140 3.684 -8.962 191 HA ALA2052 HA ALA2052 0.426 4.922 -6.445 192 1HB ALA2052 3HB ALA2052 0.005 2.638 -5.561 193 2HB ALA2052 1HB ALA2052 -0.185 2.063 -7.223 194 3HB ALA2052 2HB ALA2052 -1.310 3.259 -6.560 195 HA PRO2053 HA PRO2053 4.755 4.050 -6.833 196 1HB PRO2053 2HB PRO2053 4.947 3.754 -3.931 197 2HB PRO2053 1HB PRO2053 5.630 5.008 -4.966 198 1HG PRO2053 2HG PRO2053 3.597 5.514 -3.280 199 2HG PRO2053 1HG PRO2053 3.742 6.326 -4.847 200 1HD PRO2053 2HD PRO2053 2.004 4.018 -4.068 201 2HD PRO2053 1HD PRO2053 1.626 5.455 -5.051 202 H ARG2054 H ARG2054 6.139 2.318 -6.929 203 HA ARG2054 HA ARG2054 5.132 -0.253 -6.304 204 1HB ARG2054 2HB ARG2054 6.606 0.065 -8.223 205 2HB ARG2054 1HB ARG2054 7.853 0.753 -7.194 206 1HG ARG2054 2HG ARG2054 8.115 -1.343 -6.068 207 2HG ARG2054 1HG ARG2054 6.833 -2.054 -7.051 208 1HD ARG2054 2HD ARG2054 8.172 -1.850 -9.043 209 2HD ARG2054 1HD ARG2054 9.388 -0.905 -8.177 210 HE ARG2054 HE ARG2054 9.487 -3.081 -6.755 211 1HH1 ARG2054 1HH1 ARG2054 9.166 -3.030 -10.302 212 2HH1 ARG2054 2HH1 ARG2054 10.112 -4.424 -10.508 213 1HH2 ARG2054 1HH2 ARG2054 10.851 -4.961 -7.121 214 2HH2 ARG2054 2HH2 ARG2054 11.052 -5.509 -8.726 215 H ARG2055 H ARG2055 5.610 -1.473 -4.553 216 HA ARG2055 HA ARG2055 6.054 -0.364 -2.105 217 1HB ARG2055 2HB ARG2055 5.080 -2.547 -2.526 218 2HB ARG2055 1HB ARG2055 6.647 -3.179 -2.978 219 1HG ARG2055 2HG ARG2055 5.892 -3.861 -0.780 220 2HG ARG2055 1HG ARG2055 7.425 -2.964 -0.700 221 1HD ARG2055 2HD ARG2055 6.369 -1.099 0.250 222 2HD ARG2055 1HD ARG2055 4.786 -1.616 -0.313 223 HE ARG2055 HE ARG2055 5.382 -3.562 1.407 224 1HH1 ARG2055 1HH1 ARG2055 5.952 -0.140 1.900 225 2HH1 ARG2055 2HH1 ARG2055 5.327 -0.104 3.487 226 1HH2 ARG2055 1HH2 ARG2055 4.466 -3.519 3.602 227 2HH2 ARG2055 2HH2 ARG2055 4.449 -2.041 4.456 228 H ALA2056 H ALA2056 8.552 -1.545 -4.290 229 HA ALA2056 HA ALA2056 10.743 -1.480 -2.547 230 1HB ALA2056 2HB ALA2056 12.127 -1.377 -4.529 231 2HB ALA2056 3HB ALA2056 10.747 -0.865 -5.497 232 3HB ALA2056 1HB ALA2056 10.782 -2.484 -4.805 233 H GLU2057 H GLU2057 9.167 1.149 -4.319 234 HA GLU2057 HA GLU2057 11.279 3.012 -3.505 235 1HB GLU2057 2HB GLU2057 10.267 4.609 -5.000 236 2HB GLU2057 1HB GLU2057 10.408 3.078 -5.851 237 1HG GLU2057 2HG GLU2057 8.029 2.631 -5.384 238 2HG GLU2057 1HG GLU2057 7.912 4.194 -4.593 239 H LEU2058 H LEU2058 8.289 1.876 -2.556 240 HA LEU2058 HA LEU2058 6.933 4.112 -1.639 241 1HB LEU2058 2HB LEU2058 6.003 1.830 -1.996 242 2HB LEU2058 1HB LEU2058 6.809 1.286 -0.551 243 HG LEU2058 HG LEU2058 4.343 1.628 -0.343 244 1HD1 LEU2058 3HD1 LEU2058 6.009 3.326 1.478 245 2HD1 LEU2058 2HD1 LEU2058 4.363 2.789 1.792 246 3HD1 LEU2058 1HD1 LEU2058 5.666 1.609 1.653 247 1HD2 LEU2058 3HD2 LEU2058 4.088 3.575 -1.760 248 2HD2 LEU2058 2HD2 LEU2058 3.462 3.898 -0.144 249 3HD2 LEU2058 1HD2 LEU2058 5.029 4.547 -0.627 250 H GLU2059 H GLU2059 9.319 2.113 0.035 251 HA GLU2059 HA GLU2059 9.125 3.297 2.560 252 1HB GLU2059 2HB GLU2059 11.452 2.485 2.941 253 2HB GLU2059 1HB GLU2059 10.385 1.246 2.311 254 1HG GLU2059 2HG GLU2059 11.384 1.469 0.112 255 2HG GLU2059 1HG GLU2059 12.367 2.817 0.681 256 H MET2060 H MET2060 10.961 4.222 -0.235 257 HA MET2060 HA MET2060 12.407 6.339 1.044 258 1HB MET2060 2HB MET2060 11.952 5.825 -1.903 259 2HB MET2060 1HB MET2060 13.129 6.937 -1.224 260 1HG MET2060 2HG MET2060 14.326 5.060 -0.222 261 2HG MET2060 1HG MET2060 13.120 3.951 -0.871 262 1HE MET2060 3HE MET2060 16.228 3.581 -1.337 263 2HE MET2060 2HE MET2060 15.005 2.492 -1.992 264 3HE MET2060 1HE MET2060 16.256 3.154 -3.049 265 H TRP2061 H TRP2061 9.592 5.991 -0.938 266 HA TRP2061 HA TRP2061 9.171 8.677 -1.612 267 1HB TRP2061 2HB TRP2061 8.289 6.639 -2.794 268 2HB TRP2061 1HB TRP2061 7.127 6.460 -1.490 269 HD1 TRP2061 HD TRP2061 8.089 9.058 -4.178 270 HE1 TRP2061 1HE TRP2061 5.942 10.266 -4.929 271 HE3 TRP2061 3HE TRP2061 4.789 6.885 -0.963 272 HZ2 TRP2061 2HZ TRP2061 3.217 10.281 -4.256 273 HZ3 TRP2061 3HZ TRP2061 2.431 7.543 -1.084 274 HH2 TRP2061 HH TRP2061 1.664 9.206 -2.695 275 H LEU2062 H LEU2062 7.643 6.621 0.899 276 HA LEU2062 HA LEU2062 6.036 8.725 1.908 277 1HB LEU2062 2HB LEU2062 6.884 6.135 3.134 278 2HB LEU2062 1HB LEU2062 5.832 7.259 3.971 279 HG LEU2062 HG LEU2062 5.254 5.686 1.463 280 1HD1 LEU2062 3HD1 LEU2062 3.992 5.722 4.198 281 2HD1 LEU2062 2HD1 LEU2062 3.456 4.749 2.829 282 3HD1 LEU2062 1HD1 LEU2062 5.045 4.466 3.544 283 1HD2 LEU2062 1HD2 LEU2062 3.560 7.820 2.774 284 2HD2 LEU2062 3HD2 LEU2062 4.289 7.913 1.170 285 3HD2 LEU2062 2HD2 LEU2062 3.024 6.732 1.499 286 H GLN2063 H GLN2063 9.275 7.630 2.703 287 HA GLN2063 HA GLN2063 9.545 9.153 5.063 288 1HB GLN2063 2HB GLN2063 10.938 7.191 4.291 289 2HB GLN2063 1HB GLN2063 11.700 8.289 3.158 290 1HG GLN2063 2HG GLN2063 12.411 9.699 5.000 291 2HG GLN2063 1HG GLN2063 11.685 8.556 6.131 292 1HE2 GLN2063 1HE2 GLN2063 13.404 7.622 3.242 293 2HE2 GLN2063 2HE2 GLN2063 14.751 6.914 4.046 294 H GLY2064 H GLY2064 9.655 9.832 1.722 295 1HA GLY2064 1HA GLY2064 10.206 11.710 0.493 296 2HA GLY2064 2HA GLY2064 11.111 12.310 1.878 297 H HIS2065 H HIS2065 8.135 11.495 2.984 298 HA HIS2065 HA HIS2065 6.348 12.511 3.718 299 1HB HIS2065 2HB HIS2065 7.880 15.102 3.401 300 2HB HIS2065 1HB HIS2065 6.391 14.854 4.302 301 HD1 HIS2065 1HD HIS2065 9.868 15.177 4.886 302 HD2 HIS2065 2HD HIS2065 6.867 12.750 6.415 303 HE1 HIS2065 1HE HIS2065 10.703 14.367 7.119 304 HA PRO2066 HA PRO2066 4.600 13.962 -0.211 305 1HB PRO2066 2HB PRO2066 3.330 11.775 -1.042 306 2HB PRO2066 1HB PRO2066 5.079 11.915 -1.210 307 1HG PRO2066 2HG PRO2066 3.507 10.338 0.765 308 2HG PRO2066 1HG PRO2066 5.054 9.951 -0.008 309 1HD PRO2066 2HD PRO2066 4.669 11.059 2.566 310 2HD PRO2066 1HD PRO2066 6.208 10.911 1.702 311 H GLU2067 H GLU2067 3.459 12.782 2.735 312 HA GLU2067 HA GLU2067 1.645 13.005 4.013 313 1HB GLU2067 2HB GLU2067 0.643 14.947 1.925 314 2HB GLU2067 1HB GLU2067 -0.005 14.766 3.551 315 1HG GLU2067 2HG GLU2067 2.740 15.648 2.792 316 2HG GLU2067 1HG GLU2067 1.468 16.684 3.469 317 H PHE2068 H PHE2068 1.834 11.074 2.059 318 HA PHE2068 HA PHE2068 -0.990 10.345 1.643 319 1HB PHE2068 2HB PHE2068 1.529 9.351 0.311 320 2HB PHE2068 1HB PHE2068 0.015 8.475 0.213 321 HD1 PHE2068 1HD PHE2068 1.409 11.873 -0.456 322 HD2 PHE2068 2HD PHE2068 -1.367 8.868 -1.570 323 HE1 PHE2068 1HE PHE2068 0.816 13.169 -2.454 324 HE2 PHE2068 2HE PHE2068 -1.983 10.163 -3.563 325 HZ PHE2068 HZ PHE2068 -0.889 12.318 -4.013 326 H ALA2069 H ALA2069 -1.672 8.273 2.249 327 HA ALA2069 HA ALA2069 0.079 6.778 4.063 328 1HB ALA2069 3HB ALA2069 -2.846 7.420 4.517 329 2HB ALA2069 2HB ALA2069 -1.870 6.350 5.520 330 3HB ALA2069 1HB ALA2069 -1.492 8.071 5.438 331 H VAL2070 H VAL2070 -0.713 4.527 4.285 332 HA VAL2070 HA VAL2070 -1.312 3.472 1.705 333 HB VAL2070 HB VAL2070 0.252 2.301 3.157 334 1HG1 VAL2070 2HG1 VAL2070 -0.637 2.881 5.326 335 2HG1 VAL2070 1HG1 VAL2070 -2.040 1.848 5.050 336 3HG1 VAL2070 3HG1 VAL2070 -0.431 1.137 5.191 337 1HG2 VAL2070 2HG2 VAL2070 -0.965 0.917 1.556 338 2HG2 VAL2070 1HG2 VAL2070 -0.633 0.002 3.029 339 3HG2 VAL2070 3HG2 VAL2070 -2.245 0.654 2.740 340 H ASP2071 H ASP2071 -3.167 2.579 0.922 341 HA ASP2071 HA ASP2071 -5.615 3.424 1.935 342 1HB ASP2071 2HB ASP2071 -5.507 3.096 -0.374 343 2HB ASP2071 1HB ASP2071 -4.823 1.485 -0.194 344 HA PRO2072 HA PRO2072 -6.488 0.362 5.092 345 1HB PRO2072 2HB PRO2072 -9.282 1.247 4.640 346 2HB PRO2072 1HB PRO2072 -8.345 1.205 6.133 347 1HG PRO2072 2HG PRO2072 -8.826 3.521 4.948 348 2HG PRO2072 1HG PRO2072 -7.241 3.183 5.654 349 1HD PRO2072 2HD PRO2072 -8.076 3.096 2.776 350 2HD PRO2072 1HD PRO2072 -6.612 3.777 3.529 351 H ARG2073 H ARG2073 -8.128 0.425 1.979 352 HA ARG2073 HA ARG2073 -9.444 -2.088 2.419 353 1HB ARG2073 2HB ARG2073 -10.331 -0.454 0.801 354 2HB ARG2073 1HB ARG2073 -8.863 -0.602 -0.150 355 1HG ARG2073 2HG ARG2073 -9.413 -2.899 -0.690 356 2HG ARG2073 1HG ARG2073 -10.842 -2.826 0.345 357 1HD ARG2073 2HD ARG2073 -10.325 -1.139 -2.096 358 2HD ARG2073 1HD ARG2073 -11.442 -2.502 -2.004 359 HE ARG2073 HE ARG2073 -12.464 -1.057 -0.118 360 1HH1 ARG2073 1HH1 ARG2073 -11.312 0.033 -3.261 361 2HH1 ARG2073 2HH1 ARG2073 -12.186 1.483 -3.285 362 1HH2 ARG2073 1HH2 ARG2073 -13.737 0.912 -0.139 363 2HH2 ARG2073 2HH2 ARG2073 -13.625 1.996 -1.453 364 H PHE2074 H PHE2074 -6.495 -0.989 0.903 365 HA PHE2074 HA PHE2074 -5.597 -3.535 0.115 366 1HB PHE2074 2HB PHE2074 -4.618 -1.446 -0.761 367 2HB PHE2074 1HB PHE2074 -3.928 -1.112 0.822 368 HD1 PHE2074 1HD PHE2074 -1.854 -2.000 1.429 369 HD2 PHE2074 2HD PHE2074 -3.895 -3.549 -1.967 370 HE1 PHE2074 1HE PHE2074 0.127 -3.329 0.848 371 HE2 PHE2074 2HE PHE2074 -1.913 -4.878 -2.556 372 HZ PHE2074 HZ PHE2074 0.101 -4.769 -1.145 373 H LEU2075 H LEU2075 -5.303 -1.717 3.099 374 HA LEU2075 HA LEU2075 -3.583 -3.479 4.446 375 1HB LEU2075 2HB LEU2075 -5.796 -1.757 5.566 376 2HB LEU2075 1HB LEU2075 -4.651 -2.630 6.560 377 HG LEU2075 HG LEU2075 -3.965 -0.405 4.631 378 1HD1 LEU2075 1HD1 LEU2075 -5.142 0.394 6.628 379 2HD1 LEU2075 3HD1 LEU2075 -3.991 -0.466 7.648 380 3HD1 LEU2075 2HD1 LEU2075 -3.449 0.875 6.648 381 1HD2 LEU2075 1HD2 LEU2075 -2.230 -1.977 6.543 382 2HD2 LEU2075 3HD2 LEU2075 -2.143 -2.007 4.779 383 3HD2 LEU2075 2HD2 LEU2075 -1.727 -0.542 5.660 384 H ALA2076 H ALA2076 -7.091 -3.481 4.182 385 HA ALA2076 HA ALA2076 -7.544 -5.791 5.710 386 1HB ALA2076 2HB ALA2076 -9.728 -5.878 4.634 387 2HB ALA2076 1HB ALA2076 -9.323 -4.224 5.093 388 3HB ALA2076 3HB ALA2076 -9.184 -4.727 3.408 389 H TYR2077 H TYR2077 -6.820 -5.320 2.311 390 HA TYR2077 HA TYR2077 -7.049 -8.012 1.477 391 1HB TYR2077 2HB TYR2077 -7.048 -6.179 -0.120 392 2HB TYR2077 1HB TYR2077 -5.433 -5.705 0.384 393 HD1 TYR2077 1HD TYR2077 -7.158 -8.780 -0.835 394 HD2 TYR2077 2HD TYR2077 -3.733 -6.277 -1.035 395 HE1 TYR2077 1HE TYR2077 -6.217 -10.232 -2.549 396 HE2 TYR2077 2HE TYR2077 -2.762 -7.722 -2.765 397 HH TYR2077 HH TYR2077 -2.931 -9.929 -3.567 398 H MET2078 H MET2078 -4.354 -6.161 2.792 399 HA MET2078 HA MET2078 -2.408 -8.198 2.486 400 1HB MET2078 2HB MET2078 -1.813 -5.836 2.880 401 2HB MET2078 1HB MET2078 -2.480 -5.939 4.500 402 1HG MET2078 2HG MET2078 -0.790 -7.634 5.071 403 2HG MET2078 1HG MET2078 -0.107 -7.475 3.456 404 1HE MET2078 2HE MET2078 1.082 -5.271 2.565 405 2HE MET2078 1HE MET2078 -0.326 -4.293 2.969 406 3HE MET2078 3HE MET2078 1.276 -3.802 3.518 407 H GLU2079 H GLU2079 -4.580 -7.343 5.116 408 HA GLU2079 HA GLU2079 -3.660 -9.346 6.905 409 1HB GLU2079 2HB GLU2079 -6.294 -7.871 6.832 410 2HB GLU2079 1HB GLU2079 -5.718 -8.865 8.166 411 1HG GLU2079 2HG GLU2079 -4.426 -6.360 7.134 412 2HG GLU2079 1HG GLU2079 -5.376 -6.507 8.609 413 H ASP2080 H ASP2080 -6.035 -9.259 4.386 414 HA ASP2080 HA ASP2080 -7.535 -11.568 4.814 415 1HB ASP2080 2HB ASP2080 -8.033 -9.970 3.038 416 2HB ASP2080 1HB ASP2080 -6.535 -10.370 2.220 417 H ARG2081 H ARG2081 -4.265 -11.198 3.783 418 HA ARG2081 HA ARG2081 -4.140 -13.892 2.720 419 1HB ARG2081 2HB ARG2081 -1.873 -11.904 2.846 420 2HB ARG2081 1HB ARG2081 -1.973 -13.351 1.864 421 1HG ARG2081 2HG ARG2081 -3.461 -10.759 1.518 422 2HG ARG2081 1HG ARG2081 -2.326 -11.523 0.416 423 1HD ARG2081 2HD ARG2081 -5.066 -12.557 1.140 424 2HD ARG2081 1HD ARG2081 -4.649 -11.716 -0.346 425 HE ARG2081 HE ARG2081 -2.984 -13.745 -0.467 426 1HH1 ARG2081 1HH1 ARG2081 -6.419 -13.755 0.501 427 2HH1 ARG2081 2HH1 ARG2081 -6.754 -15.241 -0.273 428 1HH2 ARG2081 1HH2 ARG2081 -3.482 -15.828 -1.479 429 2HH2 ARG2081 2HH2 ARG2081 -5.077 -16.432 -1.413 430 H ARG2082 H ARG2082 -4.266 -13.116 5.775 431 HA ARG2082 HA ARG2082 -1.898 -14.043 6.982 432 1HB ARG2082 2HB ARG2082 -4.764 -14.376 7.889 433 2HB ARG2082 1HB ARG2082 -3.399 -14.867 8.876 434 1HG ARG2082 2HG ARG2082 -2.627 -12.540 8.930 435 2HG ARG2082 1HG ARG2082 -4.010 -12.067 7.940 436 1HD ARG2082 2HD ARG2082 -4.458 -11.599 10.285 437 2HD ARG2082 1HD ARG2082 -5.527 -12.871 9.705 438 HE ARG2082 HE ARG2082 -3.365 -14.167 10.754 439 1HH1 ARG2082 1HH1 ARG2082 -5.832 -11.936 12.068 440 2HH1 ARG2082 2HH1 ARG2082 -5.688 -12.495 13.646 441 1HH2 ARG2082 1HH2 ARG2082 -3.222 -14.965 12.940 442 2HH2 ARG2082 2HH2 ARG2082 -4.162 -14.264 14.167 443 H LYS2083 H LYS2083 -4.783 -15.867 6.119 444 HA LYS2083 HA LYS2083 -3.263 -17.838 4.846 445 1HB LYS2083 2HB LYS2083 -4.063 -19.821 6.038 446 2HB LYS2083 1HB LYS2083 -3.114 -18.819 7.118 447 1HG LYS2083 2HG LYS2083 -5.038 -18.123 8.301 448 2HG LYS2083 1HG LYS2083 -6.118 -18.770 7.062 449 1HD LYS2083 2HD LYS2083 -6.031 -20.214 9.070 450 2HD LYS2083 1HD LYS2083 -5.451 -21.042 7.630 451 1HE LYS2083 2HE LYS2083 -3.136 -20.627 8.322 452 2HE LYS2083 1HE LYS2083 -3.728 -19.754 9.733 453 1HZ LYS2083 2HZ LYS2083 -4.732 -21.810 10.523 454 2HZ LYS2083 1HZ LYS2083 -4.182 -22.639 9.176 455 3HZ LYS2083 3HZ LYS2083 -3.079 -22.015 10.284 456 H GLN2084 H GLN2084 -4.457 -18.833 3.354 457 HA GLN2084 HA GLN2084 -7.206 -17.865 3.180 458 1HB GLN2084 2HB GLN2084 -5.766 -17.165 1.313 459 2HB GLN2084 1HB GLN2084 -5.370 -18.848 0.992 460 1HG GLN2084 2HG GLN2084 -7.702 -19.315 0.456 461 2HG GLN2084 1HG GLN2084 -8.124 -17.641 0.799 462 1HE2 GLN2084 1HE2 GLN2084 -6.578 -19.794 -1.426 463 2HE2 GLN2084 2HE2 GLN2084 -6.440 -18.663 -2.715 464 H LYS2085 H LYS2085 -8.751 -19.301 3.327 465 HA LYS2085 HA LYS2085 -8.099 -22.079 3.555 466 1HB LYS2085 2HB LYS2085 -10.801 -20.718 3.449 467 2HB LYS2085 1HB LYS2085 -10.492 -22.388 3.903 468 1HG LYS2085 2HG LYS2085 -9.211 -21.614 5.847 469 2HG LYS2085 1HG LYS2085 -9.568 -19.946 5.401 470 1HD LYS2085 2HD LYS2085 -11.095 -20.645 7.124 471 2HD LYS2085 1HD LYS2085 -11.982 -20.459 5.614 472 1HE LYS2085 2HE LYS2085 -11.924 -22.869 5.249 473 2HE LYS2085 1HE LYS2085 -10.971 -23.080 6.718 474 1HZ LYS2085 3HZ LYS2085 -12.840 -22.179 7.971 475 2HZ LYS2085 2HZ LYS2085 -13.746 -22.067 6.551 476 3HZ LYS2085 1HZ LYS2085 -13.264 -23.571 7.119 No H/Q in entry = 476 Start of MODEL 19 1 H LEU2028 H LEU2028 6.443 -12.939 2.998 2 HA LEU2028 HA LEU2028 4.713 -12.508 4.411 3 1HB LEU2028 2HB LEU2028 6.814 -11.394 6.295 4 2HB LEU2028 1HB LEU2028 5.163 -11.776 6.732 5 HG LEU2028 HG LEU2028 7.332 -13.736 5.971 6 1HD1 LEU2028 2HD1 LEU2028 7.567 -12.831 8.199 7 2HD1 LEU2028 1HD1 LEU2028 5.897 -13.257 8.568 8 3HD1 LEU2028 3HD1 LEU2028 7.084 -14.525 8.261 9 1HD2 LEU2028 1HD2 LEU2028 4.453 -14.275 6.708 10 2HD2 LEU2028 3HD2 LEU2028 5.182 -14.518 5.120 11 3HD2 LEU2028 2HD2 LEU2028 5.705 -15.494 6.493 12 H ASP2029 H ASP2029 5.712 -10.697 2.481 13 HA ASP2029 HA ASP2029 4.189 -8.339 3.127 14 1HB ASP2029 2HB ASP2029 6.702 -7.921 3.768 15 2HB ASP2029 1HB ASP2029 7.034 -8.076 2.052 16 H VAL2030 H VAL2030 4.978 -7.064 0.677 17 HA VAL2030 HA VAL2030 3.746 -8.979 -1.126 18 HB VAL2030 HB VAL2030 3.475 -7.092 -2.696 19 1HG1 VAL2030 2HG1 VAL2030 1.735 -7.515 -1.067 20 2HG1 VAL2030 1HG1 VAL2030 2.564 -6.477 0.099 21 3HG1 VAL2030 3HG1 VAL2030 1.895 -5.782 -1.379 22 1HG2 VAL2030 1HG2 VAL2030 5.472 -5.832 -2.111 23 2HG2 VAL2030 3HG2 VAL2030 4.034 -4.823 -2.000 24 3HG2 VAL2030 2HG2 VAL2030 4.777 -5.459 -0.531 25 H ASP2031 H ASP2031 4.728 -8.083 -3.567 26 HA ASP2031 HA ASP2031 7.225 -9.584 -3.557 27 1HB ASP2031 2HB ASP2031 5.292 -10.234 -4.988 28 2HB ASP2031 1HB ASP2031 5.442 -8.709 -5.837 29 H LEU2032 H LEU2032 7.014 -6.649 -2.795 30 HA LEU2032 HA LEU2032 8.162 -4.711 -2.966 31 1HB LEU2032 2HB LEU2032 10.030 -6.380 -4.615 32 2HB LEU2032 1HB LEU2032 10.335 -4.696 -4.272 33 HG LEU2032 HG LEU2032 10.079 -6.848 -2.166 34 1HD1 LEU2032 1HD1 LEU2032 12.493 -5.489 -3.346 35 2HD1 LEU2032 3HD1 LEU2032 12.508 -6.599 -1.977 36 3HD1 LEU2032 2HD1 LEU2032 12.026 -7.175 -3.575 37 1HD2 LEU2032 2HD2 LEU2032 11.002 -3.973 -2.014 38 2HD2 LEU2032 1HD2 LEU2032 9.489 -4.594 -1.365 39 3HD2 LEU2032 3HD2 LEU2032 11.023 -5.133 -0.686 40 H GLU2033 H GLU2033 7.839 -6.144 -6.157 41 HA GLU2033 HA GLU2033 7.801 -3.562 -7.404 42 1HB GLU2033 2HB GLU2033 7.094 -6.259 -8.550 43 2HB GLU2033 1HB GLU2033 7.362 -4.784 -9.472 44 1HG GLU2033 2HG GLU2033 9.684 -4.727 -8.582 45 2HG GLU2033 1HG GLU2033 9.391 -6.304 -7.853 46 H THR2034 H THR2034 5.571 -5.482 -5.784 47 HA THR2034 HA THR2034 3.149 -4.886 -7.007 48 HB THR2034 HB THR2034 3.659 -5.054 -4.033 49 HG1 THR2034 1HG THR2034 3.014 -7.429 -5.073 50 1HG2 THR2034 1HG2 THR2034 1.348 -4.535 -4.719 51 2HG2 THR2034 3HG2 THR2034 1.335 -5.962 -5.757 52 3HG2 THR2034 2HG2 THR2034 1.446 -6.147 -4.006 53 H ARG2035 H ARG2035 2.091 -2.979 -7.135 54 HA ARG2035 HA ARG2035 3.292 -0.589 -5.991 55 1HB ARG2035 2HB ARG2035 0.804 -0.848 -7.708 56 2HB ARG2035 1HB ARG2035 1.550 0.650 -7.221 57 1HG ARG2035 2HG ARG2035 2.097 0.289 -9.516 58 2HG ARG2035 1HG ARG2035 3.561 0.002 -8.587 59 1HD ARG2035 2HD ARG2035 3.391 -2.341 -8.866 60 2HD ARG2035 1HD ARG2035 1.722 -2.225 -9.415 61 HE ARG2035 HE ARG2035 2.796 -0.947 -11.364 62 1HH1 ARG2035 1HH1 ARG2035 4.535 -3.570 -9.739 63 2HH1 ARG2035 2HH1 ARG2035 5.093 -4.284 -11.174 64 1HH2 ARG2035 1HH2 ARG2035 3.581 -1.906 -13.329 65 2HH2 ARG2035 2HH2 ARG2035 4.579 -3.302 -13.256 66 H ILE2036 H ILE2036 2.840 -0.054 -3.991 67 HA ILE2036 HA ILE2036 0.423 -1.011 -2.755 68 HB ILE2036 HB ILE2036 2.465 0.906 -1.606 69 1HG1 ILE2036 2HG1 ILE2036 3.580 -1.170 -2.251 70 2HG1 ILE2036 1HG1 ILE2036 3.486 -1.000 -0.501 71 1HG2 ILE2036 1HG2 ILE2036 0.363 0.911 -0.423 72 2HG2 ILE2036 3HG2 ILE2036 0.427 -0.844 -0.256 73 3HG2 ILE2036 2HG2 ILE2036 1.624 0.164 0.561 74 1HD1 ILE2036 3HD1 ILE2036 1.601 -2.572 -0.483 75 2HD1 ILE2036 2HD1 ILE2036 1.771 -2.768 -2.229 76 3HD1 ILE2036 1HD1 ILE2036 3.070 -3.284 -1.154 77 HA PRO2037 HA PRO2037 -1.780 2.689 -4.089 78 1HB PRO2037 2HB PRO2037 -4.025 2.193 -2.575 79 2HB PRO2037 1HB PRO2037 -3.743 1.530 -4.182 80 1HG PRO2037 2HG PRO2037 -3.338 0.273 -1.515 81 2HG PRO2037 1HG PRO2037 -3.956 -0.451 -3.008 82 1HD PRO2037 2HD PRO2037 -1.464 -0.867 -2.134 83 2HD PRO2037 1HD PRO2037 -1.842 -0.774 -3.867 84 H VAL2038 H VAL2038 -1.941 4.640 -3.262 85 HA VAL2038 HA VAL2038 -1.768 4.992 -0.371 86 HB VAL2038 HB VAL2038 -0.250 6.962 -0.746 87 1HG1 VAL2038 1HG1 VAL2038 0.606 4.847 0.103 88 2HG1 VAL2038 3HG1 VAL2038 0.852 4.278 -1.551 89 3HG1 VAL2038 2HG1 VAL2038 1.781 5.650 -0.931 90 1HG2 VAL2038 3HG2 VAL2038 -0.663 7.281 -3.140 91 2HG2 VAL2038 2HG2 VAL2038 1.057 7.068 -2.835 92 3HG2 VAL2038 1HG2 VAL2038 0.100 5.735 -3.487 93 H ILE2039 H ILE2039 -2.585 6.945 0.384 94 HA ILE2039 HA ILE2039 -4.225 8.402 -1.546 95 HB ILE2039 HB ILE2039 -5.719 6.848 -0.424 96 1HG1 ILE2039 2HG1 ILE2039 -6.119 9.660 0.648 97 2HG1 ILE2039 1HG1 ILE2039 -6.596 9.095 -0.948 98 1HG2 ILE2039 3HG2 ILE2039 -4.760 8.009 2.187 99 2HG2 ILE2039 2HG2 ILE2039 -6.106 6.883 2.008 100 3HG2 ILE2039 1HG2 ILE2039 -4.470 6.377 1.585 101 1HD1 ILE2039 1HD1 ILE2039 -7.701 8.104 1.670 102 2HD1 ILE2039 3HD1 ILE2039 -8.496 9.225 0.564 103 3HD1 ILE2039 2HD1 ILE2039 -8.191 7.560 0.068 104 H ASN2040 H ASN2040 -4.008 10.482 -1.440 105 HA ASN2040 HA ASN2040 -2.319 11.769 0.523 106 1HB ASN2040 2HB ASN2040 -2.500 12.631 -1.828 107 2HB ASN2040 1HB ASN2040 -4.169 13.064 -1.496 108 1HD2 ASN2040 1HD2 ASN2040 -0.848 13.856 -0.932 109 2HD2 ASN2040 2HD2 ASN2040 -1.136 15.394 -0.229 110 H LYS2041 H LYS2041 -2.922 12.516 2.401 111 HA LYS2041 HA LYS2041 -5.597 12.019 3.254 112 1HB LYS2041 2HB LYS2041 -3.349 13.343 4.736 113 2HB LYS2041 1HB LYS2041 -4.838 12.719 5.436 114 1HG LYS2041 2HG LYS2041 -2.720 11.077 4.047 115 2HG LYS2041 1HG LYS2041 -2.949 11.195 5.785 116 1HD LYS2041 2HD LYS2041 -5.116 10.176 3.937 117 2HD LYS2041 1HD LYS2041 -3.881 9.125 4.592 118 1HE LYS2041 2HE LYS2041 -5.837 8.919 5.960 119 2HE LYS2041 1HE LYS2041 -4.607 9.767 6.880 120 1HZ LYS2041 2HZ LYS2041 -6.899 11.104 5.511 121 2HZ LYS2041 1HZ LYS2041 -6.814 10.671 7.144 122 3HZ LYS2041 3HZ LYS2041 -5.750 11.815 6.553 123 H VAL2042 H VAL2042 -4.036 14.788 2.036 124 HA VAL2042 HA VAL2042 -5.788 16.659 3.381 125 HB VAL2042 HB VAL2042 -3.742 17.171 1.210 126 1HG1 VAL2042 2HG1 VAL2042 -5.061 19.069 3.152 127 2HG1 VAL2042 1HG1 VAL2042 -3.783 19.490 2.014 128 3HG1 VAL2042 3HG1 VAL2042 -5.357 18.973 1.415 129 1HG2 VAL2042 2HG2 VAL2042 -3.443 17.336 4.208 130 2HG2 VAL2042 1HG2 VAL2042 -2.687 16.153 3.144 131 3HG2 VAL2042 3HG2 VAL2042 -2.233 17.851 3.034 132 H ASP2043 H ASP2043 -5.174 15.592 0.064 133 HA ASP2043 HA ASP2043 -7.572 16.989 -0.867 134 1HB ASP2043 2HB ASP2043 -5.663 17.309 -2.255 135 2HB ASP2043 1HB ASP2043 -5.356 15.578 -2.340 136 H GLY2044 H GLY2044 -6.388 13.726 -0.442 137 1HA GLY2044 1HA GLY2044 -9.027 12.731 -1.172 138 2HA GLY2044 2HA GLY2044 -7.762 11.831 -0.327 139 H THR2045 H THR2045 -5.769 12.862 -2.280 140 HA THR2045 HA THR2045 -6.426 11.844 -4.849 141 HB THR2045 HB THR2045 -3.639 12.132 -3.743 142 HG1 THR2045 1HG THR2045 -5.558 14.179 -4.252 143 1HG2 THR2045 1HG2 THR2045 -3.923 11.312 -6.053 144 2HG2 THR2045 3HG2 THR2045 -4.869 12.748 -6.446 145 3HG2 THR2045 2HG2 THR2045 -3.163 12.905 -6.032 146 H LEU2046 H LEU2046 -6.926 9.698 -4.935 147 HA LEU2046 HA LEU2046 -5.311 7.825 -3.397 148 1HB LEU2046 2HB LEU2046 -7.714 7.596 -3.156 149 2HB LEU2046 1HB LEU2046 -7.904 7.466 -4.895 150 HG LEU2046 HG LEU2046 -6.686 5.336 -4.862 151 1HD1 LEU2046 2HD1 LEU2046 -6.713 5.674 -1.874 152 2HD1 LEU2046 1HD1 LEU2046 -6.278 4.190 -2.728 153 3HD1 LEU2046 3HD1 LEU2046 -5.293 5.639 -2.916 154 1HD2 LEU2046 1HD2 LEU2046 -9.041 5.462 -2.993 155 2HD2 LEU2046 3HD2 LEU2046 -9.101 5.334 -4.754 156 3HD2 LEU2046 2HD2 LEU2046 -8.438 4.007 -3.791 157 H LEU2047 H LEU2047 -3.804 6.717 -4.321 158 HA LEU2047 HA LEU2047 -3.690 6.612 -7.260 159 1HB LEU2047 2HB LEU2047 -1.455 6.329 -5.246 160 2HB LEU2047 1HB LEU2047 -1.278 6.275 -6.986 161 HG LEU2047 HG LEU2047 -2.089 8.688 -5.358 162 1HD1 LEU2047 3HD1 LEU2047 0.260 8.126 -5.116 163 2HD1 LEU2047 2HD1 LEU2047 0.441 8.075 -6.870 164 3HD1 LEU2047 1HD1 LEU2047 0.060 9.599 -6.065 165 1HD2 LEU2047 1HD2 LEU2047 -3.180 8.698 -7.554 166 2HD2 LEU2047 3HD2 LEU2047 -1.925 9.933 -7.457 167 3HD2 LEU2047 2HD2 LEU2047 -1.618 8.441 -8.334 168 H VAL2048 H VAL2048 -4.303 4.732 -8.040 169 HA VAL2048 HA VAL2048 -3.592 2.279 -6.598 170 HB VAL2048 HB VAL2048 -5.713 1.253 -7.468 171 1HG1 VAL2048 2HG1 VAL2048 -6.035 3.602 -5.617 172 2HG1 VAL2048 1HG1 VAL2048 -7.213 2.299 -5.806 173 3HG1 VAL2048 3HG1 VAL2048 -5.607 1.956 -5.164 174 1HG2 VAL2048 3HG2 VAL2048 -6.398 4.111 -8.148 175 2HG2 VAL2048 2HG2 VAL2048 -6.187 2.780 -9.284 176 3HG2 VAL2048 1HG2 VAL2048 -7.543 2.770 -8.158 177 H GLY2049 H GLY2049 -3.850 0.359 -8.173 178 1HA GLY2049 1HA GLY2049 -3.556 0.820 -10.958 179 2HA GLY2049 2HA GLY2049 -3.196 -0.682 -10.102 180 H GLU2050 H GLU2050 -1.852 1.676 -11.948 181 HA GLU2050 HA GLU2050 0.743 1.277 -10.685 182 1HB GLU2050 2HB GLU2050 0.146 1.882 -13.584 183 2HB GLU2050 1HB GLU2050 1.758 1.747 -12.895 184 1HG GLU2050 2HG GLU2050 1.174 -0.597 -12.233 185 2HG GLU2050 1HG GLU2050 -0.303 -0.415 -13.174 186 H ASP2051 H ASP2051 -1.580 3.411 -10.630 187 HA ASP2051 HA ASP2051 -0.215 5.873 -11.094 188 1HB ASP2051 2HB ASP2051 -2.649 5.143 -9.461 189 2HB ASP2051 1HB ASP2051 -2.060 6.792 -9.567 190 H ALA2052 H ALA2052 -0.385 3.546 -8.648 191 HA ALA2052 HA ALA2052 0.854 5.204 -6.636 192 1HB ALA2052 2HB ALA2052 0.581 3.207 -5.211 193 2HB ALA2052 3HB ALA2052 -0.050 2.323 -6.603 194 3HB ALA2052 1HB ALA2052 -0.932 3.710 -5.970 195 HA PRO2053 HA PRO2053 4.904 3.660 -7.837 196 1HB PRO2053 2HB PRO2053 5.784 4.080 -5.066 197 2HB PRO2053 1HB PRO2053 6.312 4.898 -6.538 198 1HG PRO2053 2HG PRO2053 4.814 6.146 -4.676 199 2HG PRO2053 1HG PRO2053 4.659 6.497 -6.404 200 1HD PRO2053 2HD PRO2053 2.906 4.800 -4.660 201 2HD PRO2053 1HD PRO2053 2.476 5.967 -5.930 202 H ARG2054 H ARG2054 6.358 1.934 -7.411 203 HA ARG2054 HA ARG2054 5.139 -0.407 -6.315 204 1HB ARG2054 2HB ARG2054 7.432 -1.428 -6.693 205 2HB ARG2054 1HB ARG2054 6.570 -0.883 -8.143 206 1HG ARG2054 2HG ARG2054 7.951 1.206 -7.940 207 2HG ARG2054 1HG ARG2054 8.863 0.381 -6.684 208 1HD ARG2054 2HD ARG2054 9.644 -1.260 -8.182 209 2HD ARG2054 1HD ARG2054 8.505 -0.765 -9.445 210 HE ARG2054 HE ARG2054 10.008 1.447 -8.844 211 1HH1 ARG2054 1HH1 ARG2054 10.702 -1.792 -10.162 212 2HH1 ARG2054 2HH1 ARG2054 12.017 -1.263 -11.098 213 1HH2 ARG2054 1HH2 ARG2054 11.783 2.144 -10.180 214 2HH2 ARG2054 2HH2 ARG2054 12.634 1.016 -11.125 215 H ARG2055 H ARG2055 5.733 -1.600 -4.602 216 HA ARG2055 HA ARG2055 5.924 -0.438 -2.142 217 1HB ARG2055 2HB ARG2055 5.170 -2.665 -2.449 218 2HB ARG2055 1HB ARG2055 6.704 -3.161 -3.111 219 1HG ARG2055 2HG ARG2055 6.398 -4.066 -0.941 220 2HG ARG2055 1HG ARG2055 7.724 -2.890 -0.904 221 1HD ARG2055 2HD ARG2055 6.308 -1.289 0.179 222 2HD ARG2055 1HD ARG2055 4.897 -2.320 -0.067 223 HE ARG2055 HE ARG2055 6.131 -3.962 1.406 224 1HH1 ARG2055 1HH1 ARG2055 6.542 -0.457 1.789 225 2HH1 ARG2055 2HH1 ARG2055 6.762 -0.531 3.463 226 1HH2 ARG2055 1HH2 ARG2055 6.392 -4.069 3.652 227 2HH2 ARG2055 2HH2 ARG2055 6.729 -2.658 4.567 228 H ALA2056 H ALA2056 8.571 -1.731 -4.071 229 HA ALA2056 HA ALA2056 10.671 -1.547 -2.288 230 1HB ALA2056 3HB ALA2056 12.137 -1.501 -4.232 231 2HB ALA2056 1HB ALA2056 10.773 -1.070 -5.264 232 3HB ALA2056 2HB ALA2056 10.818 -2.646 -4.476 233 H GLU2057 H GLU2057 9.306 0.955 -4.362 234 HA GLU2057 HA GLU2057 11.271 2.921 -3.393 235 1HB GLU2057 2HB GLU2057 8.981 3.317 -5.326 236 2HB GLU2057 1HB GLU2057 10.309 4.426 -5.036 237 1HG GLU2057 2HG GLU2057 11.863 2.713 -5.913 238 2HG GLU2057 1HG GLU2057 10.455 1.716 -6.294 239 H LEU2058 H LEU2058 7.947 2.089 -3.233 240 HA LEU2058 HA LEU2058 6.701 4.366 -2.353 241 1HB LEU2058 2HB LEU2058 5.712 2.265 -3.267 242 2HB LEU2058 1HB LEU2058 5.993 1.521 -1.718 243 HG LEU2058 HG LEU2058 3.635 2.260 -2.316 244 1HD1 LEU2058 3HD1 LEU2058 4.834 3.223 0.277 245 2HD1 LEU2058 2HD1 LEU2058 3.116 2.955 -0.022 246 3HD1 LEU2058 1HD1 LEU2058 4.241 1.596 -0.053 247 1HD2 LEU2058 1HD2 LEU2058 4.291 4.447 -3.184 248 2HD2 LEU2058 3HD2 LEU2058 3.054 4.537 -1.939 249 3HD2 LEU2058 2HD2 LEU2058 4.727 4.945 -1.544 250 H GLU2059 H GLU2059 8.307 1.879 -0.377 251 HA GLU2059 HA GLU2059 7.305 2.810 2.072 252 1HB GLU2059 2HB GLU2059 9.170 1.573 3.140 253 2HB GLU2059 1HB GLU2059 8.267 0.610 1.988 254 1HG GLU2059 2HG GLU2059 10.024 0.795 0.371 255 2HG GLU2059 1HG GLU2059 10.894 1.945 1.384 256 H MET2060 H MET2060 10.255 3.677 0.350 257 HA MET2060 HA MET2060 11.215 5.454 2.382 258 1HB MET2060 2HB MET2060 12.756 4.465 0.772 259 2HB MET2060 1HB MET2060 11.911 5.235 -0.561 260 1HG MET2060 2HG MET2060 12.574 7.439 0.334 261 2HG MET2060 1HG MET2060 13.466 6.628 1.618 262 1HE MET2060 1HE MET2060 15.655 5.177 1.213 263 2HE MET2060 3HE MET2060 14.769 4.136 0.098 264 3HE MET2060 2HE MET2060 16.319 4.822 -0.380 265 H TRP2061 H TRP2061 9.306 5.729 -0.504 266 HA TRP2061 HA TRP2061 9.220 8.500 -0.808 267 1HB TRP2061 2HB TRP2061 8.530 6.820 -2.495 268 2HB TRP2061 1HB TRP2061 7.127 6.442 -1.512 269 HD1 TRP2061 HD TRP2061 8.584 9.370 -3.565 270 HE1 TRP2061 1HE TRP2061 6.622 10.766 -4.453 271 HE3 TRP2061 3HE TRP2061 4.754 6.967 -1.202 272 HZ2 TRP2061 2HZ TRP2061 3.792 10.823 -4.202 273 HZ3 TRP2061 3HZ TRP2061 2.468 7.747 -1.576 274 HH2 TRP2061 HH TRP2061 1.998 9.637 -3.047 275 H LEU2062 H LEU2062 7.059 6.308 0.985 276 HA LEU2062 HA LEU2062 5.318 8.329 1.917 277 1HB LEU2062 2HB LEU2062 5.952 5.616 3.030 278 2HB LEU2062 1HB LEU2062 4.758 6.677 3.747 279 HG LEU2062 HG LEU2062 4.653 5.451 0.990 280 1HD1 LEU2062 1HD1 LEU2062 3.011 4.983 3.478 281 2HD1 LEU2062 3HD1 LEU2062 2.729 4.254 1.898 282 3HD1 LEU2062 2HD1 LEU2062 4.205 3.881 2.793 283 1HD2 LEU2062 1HD2 LEU2062 2.720 7.300 2.392 284 2HD2 LEU2062 3HD2 LEU2062 3.636 7.658 0.926 285 3HD2 LEU2062 2HD2 LEU2062 2.380 6.424 0.911 286 H GLN2063 H GLN2063 8.298 7.030 3.226 287 HA GLN2063 HA GLN2063 8.089 8.252 5.750 288 1HB GLN2063 2HB GLN2063 10.456 7.243 4.215 289 2HB GLN2063 1HB GLN2063 10.542 7.843 5.863 290 1HG GLN2063 2HG GLN2063 8.957 5.468 4.875 291 2HG GLN2063 1HG GLN2063 10.429 5.417 5.839 292 1HE2 GLN2063 1HE2 GLN2063 10.326 5.944 7.992 293 2HE2 GLN2063 2HE2 GLN2063 8.849 6.017 8.879 294 H GLY2064 H GLY2064 9.248 9.388 2.704 295 1HA GLY2064 1HA GLY2064 9.990 11.480 2.022 296 2HA GLY2064 2HA GLY2064 10.574 11.709 3.665 297 H HIS2065 H HIS2065 7.341 10.907 3.474 298 HA HIS2065 HA HIS2065 5.438 11.870 4.045 299 1HB HIS2065 2HB HIS2065 6.594 12.921 5.945 300 2HB HIS2065 1HB HIS2065 7.082 14.268 4.928 301 HD1 HIS2065 1HD HIS2065 5.446 16.221 4.784 302 HD2 HIS2065 2HD HIS2065 3.762 12.805 6.446 303 HE1 HIS2065 1HE HIS2065 3.176 16.899 5.628 304 HA PRO2066 HA PRO2066 4.911 14.191 0.228 305 1HB PRO2066 2HB PRO2066 3.660 12.318 -1.201 306 2HB PRO2066 1HB PRO2066 5.409 12.257 -0.995 307 1HG PRO2066 2HG PRO2066 3.297 10.637 0.329 308 2HG PRO2066 1HG PRO2066 4.932 10.160 -0.156 309 1HD PRO2066 2HD PRO2066 4.075 10.915 2.422 310 2HD PRO2066 1HD PRO2066 5.758 10.728 1.885 311 H GLU2067 H GLU2067 3.219 13.142 2.742 312 HA GLU2067 HA GLU2067 1.274 13.606 3.738 313 1HB GLU2067 2HB GLU2067 0.524 15.178 1.270 314 2HB GLU2067 1HB GLU2067 -0.295 15.258 2.825 315 1HG GLU2067 2HG GLU2067 1.690 16.171 3.867 316 2HG GLU2067 1HG GLU2067 2.575 16.021 2.352 317 H PHE2068 H PHE2068 1.743 11.582 1.594 318 HA PHE2068 HA PHE2068 -1.004 10.596 1.285 319 1HB PHE2068 2HB PHE2068 1.580 9.717 -0.054 320 2HB PHE2068 1HB PHE2068 0.072 8.846 -0.165 321 HD1 PHE2068 1HD PHE2068 1.498 12.221 -0.865 322 HD2 PHE2068 2HD PHE2068 -1.308 9.226 -1.958 323 HE1 PHE2068 1HE PHE2068 0.924 13.503 -2.888 324 HE2 PHE2068 2HE PHE2068 -1.895 10.503 -3.973 325 HZ PHE2068 HZ PHE2068 -0.780 12.639 -4.444 326 H ALA2069 H ALA2069 -1.551 8.690 2.187 327 HA ALA2069 HA ALA2069 0.451 7.426 3.919 328 1HB ALA2069 2HB ALA2069 -1.299 8.602 5.203 329 2HB ALA2069 3HB ALA2069 -1.360 6.855 5.446 330 3HB ALA2069 1HB ALA2069 -2.522 7.638 4.375 331 H VAL2070 H VAL2070 0.038 5.119 4.211 332 HA VAL2070 HA VAL2070 -0.514 3.878 1.724 333 HB VAL2070 HB VAL2070 1.180 2.905 3.185 334 1HG1 VAL2070 3HG1 VAL2070 -1.028 2.390 5.164 335 2HG1 VAL2070 2HG1 VAL2070 0.624 1.782 5.298 336 3HG1 VAL2070 1HG1 VAL2070 0.311 3.520 5.352 337 1HG2 VAL2070 1HG2 VAL2070 0.014 1.363 1.704 338 2HG2 VAL2070 3HG2 VAL2070 0.488 0.557 3.198 339 3HG2 VAL2070 2HG2 VAL2070 -1.187 1.051 2.957 340 H ASP2071 H ASP2071 -2.303 2.952 0.972 341 HA ASP2071 HA ASP2071 -4.809 3.581 2.009 342 1HB ASP2071 2HB ASP2071 -4.541 3.074 -0.366 343 2HB ASP2071 1HB ASP2071 -4.003 1.453 0.030 344 HA PRO2072 HA PRO2072 -4.863 0.541 5.264 345 1HB PRO2072 2HB PRO2072 -7.370 1.106 6.179 346 2HB PRO2072 1HB PRO2072 -5.941 2.066 6.577 347 1HG PRO2072 2HG PRO2072 -8.081 2.587 4.565 348 2HG PRO2072 1HG PRO2072 -7.243 3.726 5.629 349 1HD PRO2072 2HD PRO2072 -6.639 3.440 2.999 350 2HD PRO2072 1HD PRO2072 -5.442 3.917 4.216 351 H ARG2073 H ARG2073 -6.994 0.591 2.563 352 HA ARG2073 HA ARG2073 -8.401 -1.779 3.398 353 1HB ARG2073 2HB ARG2073 -9.525 -0.064 2.003 354 2HB ARG2073 1HB ARG2073 -8.388 -0.401 0.705 355 1HG ARG2073 2HG ARG2073 -9.253 -2.622 0.451 356 2HG ARG2073 1HG ARG2073 -10.282 -2.421 1.868 357 1HD ARG2073 2HD ARG2073 -11.450 -0.582 0.705 358 2HD ARG2073 1HD ARG2073 -10.464 -0.898 -0.718 359 HE ARG2073 HE ARG2073 -11.478 -3.034 -0.907 360 1HH1 ARG2073 1HH1 ARG2073 -13.064 -0.924 1.450 361 2HH1 ARG2073 2HH1 ARG2073 -14.590 -1.669 1.299 362 1HH2 ARG2073 1HH2 ARG2073 -13.585 -4.040 -1.113 363 2HH2 ARG2073 2HH2 ARG2073 -14.889 -3.469 -0.182 364 H PHE2074 H PHE2074 -5.754 -0.914 1.308 365 HA PHE2074 HA PHE2074 -5.340 -3.536 0.329 366 1HB PHE2074 2HB PHE2074 -4.399 -1.495 -0.748 367 2HB PHE2074 1HB PHE2074 -3.274 -1.336 0.597 368 HD1 PHE2074 1HD PHE2074 -1.337 -2.771 0.768 369 HD2 PHE2074 2HD PHE2074 -4.199 -3.339 -2.326 370 HE1 PHE2074 1HE PHE2074 0.214 -4.286 -0.390 371 HE2 PHE2074 2HE PHE2074 -2.649 -4.855 -3.491 372 HZ PHE2074 HZ PHE2074 -0.439 -5.331 -2.517 373 H LEU2075 H LEU2075 -4.297 -1.794 3.173 374 HA LEU2075 HA LEU2075 -2.399 -3.611 4.144 375 1HB LEU2075 2HB LEU2075 -4.333 -1.899 5.711 376 2HB LEU2075 1HB LEU2075 -3.001 -2.774 6.427 377 HG LEU2075 HG LEU2075 -2.765 -0.499 4.457 378 1HD1 LEU2075 2HD1 LEU2075 -3.479 0.192 6.707 379 2HD1 LEU2075 1HD1 LEU2075 -2.106 -0.674 7.391 380 3HD1 LEU2075 3HD1 LEU2075 -1.831 0.723 6.354 381 1HD2 LEU2075 2HD2 LEU2075 -0.642 -2.101 5.885 382 2HD2 LEU2075 1HD2 LEU2075 -0.950 -2.094 4.149 383 3HD2 LEU2075 3HD2 LEU2075 -0.352 -0.638 4.947 384 H ALA2076 H ALA2076 -5.866 -3.690 4.200 385 HA ALA2076 HA ALA2076 -6.215 -5.843 5.962 386 1HB ALA2076 2HB ALA2076 -8.427 -6.099 4.968 387 2HB ALA2076 3HB ALA2076 -7.949 -5.078 3.615 388 3HB ALA2076 1HB ALA2076 -8.061 -4.394 5.236 389 H TYR2077 H TYR2077 -5.300 -5.760 2.575 390 HA TYR2077 HA TYR2077 -5.670 -8.562 2.126 391 1HB TYR2077 2HB TYR2077 -4.008 -6.540 0.607 392 2HB TYR2077 1HB TYR2077 -4.215 -8.209 0.109 393 HD1 TYR2077 1HD TYR2077 -7.020 -8.751 0.377 394 HD2 TYR2077 2HD TYR2077 -5.105 -5.160 -0.846 395 HE1 TYR2077 1HE TYR2077 -9.006 -8.146 -0.936 396 HE2 TYR2077 2HE TYR2077 -7.090 -4.534 -2.148 397 HH TYR2077 HH TYR2077 -8.929 -5.729 -3.248 398 H MET2078 H MET2078 -3.100 -6.558 3.304 399 HA MET2078 HA MET2078 -1.084 -8.578 3.202 400 1HB MET2078 2HB MET2078 -0.533 -6.176 3.294 401 2HB MET2078 1HB MET2078 -1.223 -6.072 4.904 402 1HG MET2078 2HG MET2078 0.497 -7.571 5.762 403 2HG MET2078 1HG MET2078 1.170 -7.745 4.145 404 1HE MET2078 1HE MET2078 2.373 -5.774 2.820 405 2HE MET2078 3HE MET2078 0.980 -4.713 3.024 406 3HE MET2078 2HE MET2078 2.587 -4.143 3.456 407 H GLU2079 H GLU2079 -3.488 -7.590 5.523 408 HA GLU2079 HA GLU2079 -2.585 -9.352 7.600 409 1HB GLU2079 2HB GLU2079 -5.349 -8.188 7.253 410 2HB GLU2079 1HB GLU2079 -4.656 -8.836 8.729 411 1HG GLU2079 2HG GLU2079 -2.963 -6.990 8.620 412 2HG GLU2079 1HG GLU2079 -3.918 -6.300 7.308 413 H ASP2080 H ASP2080 -4.761 -9.484 4.924 414 HA ASP2080 HA ASP2080 -6.206 -11.820 5.430 415 1HB ASP2080 2HB ASP2080 -6.733 -10.315 3.583 416 2HB ASP2080 1HB ASP2080 -5.214 -10.719 2.801 417 H ARG2081 H ARG2081 -3.095 -11.424 3.747 418 HA ARG2081 HA ARG2081 -2.665 -14.273 3.902 419 1HB ARG2081 2HB ARG2081 -0.853 -12.038 2.949 420 2HB ARG2081 1HB ARG2081 -0.318 -13.703 3.069 421 1HG ARG2081 2HG ARG2081 -2.113 -14.331 1.468 422 2HG ARG2081 1HG ARG2081 -2.488 -12.618 1.287 423 1HD ARG2081 2HD ARG2081 -0.233 -12.182 0.480 424 2HD ARG2081 1HD ARG2081 0.212 -13.864 0.744 425 HE ARG2081 HE ARG2081 -2.017 -13.456 -1.028 426 1HH1 ARG2081 1HH1 ARG2081 1.503 -13.752 -0.848 427 2HH1 ARG2081 2HH1 ARG2081 1.721 -14.269 -2.446 428 1HH2 ARG2081 1HH2 ARG2081 -1.747 -14.143 -3.281 429 2HH2 ARG2081 2HH2 ARG2081 -0.191 -14.434 -3.898 430 H ARG2082 H ARG2082 -2.968 -14.459 6.055 431 HA ARG2082 HA ARG2082 -1.056 -13.184 7.841 432 1HB ARG2082 2HB ARG2082 -3.516 -13.032 8.223 433 2HB ARG2082 1HB ARG2082 -3.538 -14.757 8.499 434 1HG ARG2082 2HG ARG2082 -2.198 -14.500 10.475 435 2HG ARG2082 1HG ARG2082 -2.005 -12.767 10.157 436 1HD ARG2082 2HD ARG2082 -4.421 -12.468 10.309 437 2HD ARG2082 1HD ARG2082 -4.625 -14.184 10.636 438 HE ARG2082 HE ARG2082 -2.945 -13.308 12.580 439 1HH1 ARG2082 1HH1 ARG2082 -6.141 -12.234 11.446 440 2HH1 ARG2082 2HH1 ARG2082 -6.682 -11.793 12.991 441 1HH2 ARG2082 1HH2 ARG2082 -3.727 -12.663 14.703 442 2HH2 ARG2082 2HH2 ARG2082 -5.312 -12.013 14.855 443 H LYS2083 H LYS2083 0.585 -14.548 6.976 444 HA LYS2083 HA LYS2083 2.025 -16.238 6.973 445 1HB LYS2083 2HB LYS2083 1.093 -16.405 9.847 446 2HB LYS2083 1HB LYS2083 2.456 -17.325 9.236 447 1HG LYS2083 2HG LYS2083 3.288 -15.378 10.372 448 2HG LYS2083 1HG LYS2083 3.584 -15.182 8.650 449 1HD LYS2083 2HD LYS2083 1.566 -13.736 8.514 450 2HD LYS2083 1HD LYS2083 1.361 -13.900 10.259 451 1HE LYS2083 2HE LYS2083 3.549 -12.859 10.602 452 2HE LYS2083 1HE LYS2083 3.752 -12.703 8.858 453 1HZ LYS2083 1HZ LYS2083 1.606 -11.377 10.448 454 2HZ LYS2083 3HZ LYS2083 3.002 -10.639 9.907 455 3HZ LYS2083 2HZ LYS2083 1.870 -11.172 8.800 456 H GLN2084 H GLN2084 0.625 -17.256 5.416 457 HA GLN2084 HA GLN2084 0.267 -19.985 6.063 458 1HB GLN2084 2HB GLN2084 -2.163 -19.951 5.125 459 2HB GLN2084 1HB GLN2084 -1.903 -19.509 6.798 460 1HG GLN2084 2HG GLN2084 -3.543 -18.037 5.812 461 2HG GLN2084 1HG GLN2084 -2.091 -17.125 6.180 462 1HE2 GLN2084 1HE2 GLN2084 -4.183 -18.328 3.682 463 2HE2 GLN2084 2HE2 GLN2084 -3.500 -17.444 2.391 464 H LYS2085 H LYS2085 -0.413 -21.213 4.115 465 HA LYS2085 HA LYS2085 0.478 -19.881 1.639 466 1HB LYS2085 2HB LYS2085 2.109 -21.595 2.469 467 2HB LYS2085 1HB LYS2085 0.816 -22.789 2.432 468 1HG LYS2085 2HG LYS2085 0.622 -22.307 -0.054 469 2HG LYS2085 1HG LYS2085 2.130 -21.408 0.102 470 1HD LYS2085 2HD LYS2085 3.214 -23.444 0.993 471 2HD LYS2085 1HD LYS2085 1.710 -24.328 0.734 472 1HE LYS2085 2HE LYS2085 3.440 -23.039 -1.392 473 2HE LYS2085 1HE LYS2085 3.262 -24.756 -1.083 474 1HZ LYS2085 1HZ LYS2085 0.894 -24.575 -1.776 475 2HZ LYS2085 3HZ LYS2085 1.143 -22.939 -2.145 476 3HZ LYS2085 2HZ LYS2085 1.963 -24.130 -2.962 No H/Q in entry = 476 Start of MODEL 20 1 H LEU2028 H LEU2028 9.377 -11.190 5.099 2 HA LEU2028 HA LEU2028 6.523 -11.297 4.966 3 1HB LEU2028 2HB LEU2028 8.317 -9.947 6.980 4 2HB LEU2028 1HB LEU2028 6.612 -10.300 7.202 5 HG LEU2028 HG LEU2028 8.842 -12.329 6.976 6 1HD1 LEU2028 3HD1 LEU2028 8.907 -11.123 9.071 7 2HD1 LEU2028 2HD1 LEU2028 7.198 -11.467 9.345 8 3HD1 LEU2028 1HD1 LEU2028 8.371 -12.784 9.327 9 1HD2 LEU2028 2HD2 LEU2028 5.899 -12.717 7.510 10 2HD2 LEU2028 1HD2 LEU2028 6.765 -13.207 6.052 11 3HD2 LEU2028 3HD2 LEU2028 7.132 -13.978 7.596 12 H ASP2029 H ASP2029 6.563 -10.049 2.978 13 HA ASP2029 HA ASP2029 6.031 -7.225 3.388 14 1HB ASP2029 2HB ASP2029 8.445 -7.275 2.825 15 2HB ASP2029 1HB ASP2029 8.130 -8.251 1.389 16 H VAL2030 H VAL2030 5.525 -6.575 0.776 17 HA VAL2030 HA VAL2030 3.436 -8.448 0.009 18 HB VAL2030 HB VAL2030 3.146 -5.880 0.279 19 1HG1 VAL2030 1HG1 VAL2030 4.565 -5.834 -2.337 20 2HG1 VAL2030 3HG1 VAL2030 3.587 -4.519 -1.695 21 3HG1 VAL2030 2HG1 VAL2030 5.035 -5.046 -0.829 22 1HG2 VAL2030 3HG2 VAL2030 2.177 -7.273 -2.195 23 2HG2 VAL2030 2HG2 VAL2030 1.383 -7.165 -0.618 24 3HG2 VAL2030 1HG2 VAL2030 1.574 -5.719 -1.605 25 H ASP2031 H ASP2031 6.420 -8.510 -0.268 26 HA ASP2031 HA ASP2031 7.927 -9.607 -1.434 27 1HB ASP2031 2HB ASP2031 5.571 -10.385 -3.111 28 2HB ASP2031 1HB ASP2031 7.196 -10.741 -3.684 29 H LEU2032 H LEU2032 7.018 -6.810 -1.985 30 HA LEU2032 HA LEU2032 7.694 -4.976 -3.342 31 1HB LEU2032 2HB LEU2032 10.006 -6.845 -3.881 32 2HB LEU2032 1HB LEU2032 9.988 -5.114 -4.159 33 HG LEU2032 HG LEU2032 9.835 -6.464 -1.461 34 1HD1 LEU2032 1HD1 LEU2032 12.059 -4.922 -2.778 35 2HD1 LEU2032 3HD1 LEU2032 12.063 -5.528 -1.122 36 3HD1 LEU2032 2HD1 LEU2032 12.033 -6.658 -2.474 37 1HD2 LEU2032 3HD2 LEU2032 9.963 -3.548 -2.213 38 2HD2 LEU2032 2HD2 LEU2032 8.598 -4.375 -1.460 39 3HD2 LEU2032 1HD2 LEU2032 10.105 -4.180 -0.569 40 H GLU2033 H GLU2033 6.162 -7.246 -4.619 41 HA GLU2033 HA GLU2033 6.784 -6.526 -7.418 42 1HB GLU2033 2HB GLU2033 5.486 -8.606 -7.976 43 2HB GLU2033 1HB GLU2033 7.021 -8.872 -7.158 44 1HG GLU2033 2HG GLU2033 5.904 -9.279 -5.080 45 2HG GLU2033 1HG GLU2033 4.349 -8.826 -5.771 46 H THR2034 H THR2034 4.573 -6.215 -4.938 47 HA THR2034 HA THR2034 2.262 -5.761 -6.669 48 HB THR2034 HB THR2034 2.576 -5.909 -3.686 49 HG1 THR2034 1HG THR2034 2.901 -7.934 -4.104 50 1HG2 THR2034 1HG2 THR2034 0.526 -4.757 -4.396 51 2HG2 THR2034 3HG2 THR2034 0.060 -6.168 -5.367 52 3HG2 THR2034 2HG2 THR2034 0.197 -6.280 -3.598 53 H ARG2035 H ARG2035 1.867 -3.584 -7.185 54 HA ARG2035 HA ARG2035 3.318 -1.458 -5.977 55 1HB ARG2035 2HB ARG2035 0.844 -1.348 -7.702 56 2HB ARG2035 1HB ARG2035 1.708 0.073 -7.156 57 1HG ARG2035 2HG ARG2035 3.732 -0.832 -8.299 58 2HG ARG2035 1HG ARG2035 2.694 -2.077 -8.999 59 1HD ARG2035 2HD ARG2035 1.259 -0.312 -9.918 60 2HD ARG2035 1HD ARG2035 2.378 0.885 -9.260 61 HE ARG2035 HE ARG2035 3.238 -1.131 -11.198 62 1HH1 ARG2035 1HH1 ARG2035 3.150 2.289 -10.145 63 2HH1 ARG2035 2HH1 ARG2035 3.927 2.840 -11.560 64 1HH2 ARG2035 1HH2 ARG2035 4.321 -0.295 -13.115 65 2HH2 ARG2035 2HH2 ARG2035 4.588 1.381 -13.252 66 H ILE2036 H ILE2036 2.550 0.258 -4.690 67 HA ILE2036 HA ILE2036 0.656 -0.770 -2.715 68 HB ILE2036 HB ILE2036 2.708 1.422 -2.443 69 1HG1 ILE2036 2HG1 ILE2036 3.804 -0.757 -2.842 70 2HG1 ILE2036 1HG1 ILE2036 4.107 -0.197 -1.198 71 1HG2 ILE2036 3HG2 ILE2036 1.065 -0.024 -0.356 72 2HG2 ILE2036 2HG2 ILE2036 2.334 1.149 -0.005 73 3HG2 ILE2036 1HG2 ILE2036 0.876 1.654 -0.863 74 1HD1 ILE2036 2HD1 ILE2036 2.368 -1.760 -0.435 75 2HD1 ILE2036 1HD1 ILE2036 2.182 -2.323 -2.098 76 3HD1 ILE2036 3HD1 ILE2036 3.720 -2.547 -1.260 77 HA PRO2037 HA PRO2037 -1.916 2.632 -4.212 78 1HB PRO2037 2HB PRO2037 -3.881 1.802 -2.258 79 2HB PRO2037 1HB PRO2037 -3.978 1.711 -4.011 80 1HG PRO2037 2HG PRO2037 -3.743 -0.432 -2.299 81 2HG PRO2037 1HG PRO2037 -3.368 -0.481 -4.031 82 1HD PRO2037 2HD PRO2037 -1.560 -0.386 -1.684 83 2HD PRO2037 1HD PRO2037 -1.282 -1.040 -3.310 84 H VAL2038 H VAL2038 -1.662 4.574 -3.429 85 HA VAL2038 HA VAL2038 -1.492 4.887 -0.528 86 HB VAL2038 HB VAL2038 -0.007 6.852 -0.889 87 1HG1 VAL2038 1HG1 VAL2038 1.002 4.242 -2.007 88 2HG1 VAL2038 3HG1 VAL2038 2.011 5.564 -1.416 89 3HG1 VAL2038 2HG1 VAL2038 0.946 4.709 -0.305 90 1HG2 VAL2038 3HG2 VAL2038 -0.641 7.374 -3.191 91 2HG2 VAL2038 2HG2 VAL2038 1.103 7.137 -3.059 92 3HG2 VAL2038 1HG2 VAL2038 0.088 5.864 -3.736 93 H ILE2039 H ILE2039 -2.323 6.735 0.360 94 HA ILE2039 HA ILE2039 -4.276 8.083 -1.352 95 HB ILE2039 HB ILE2039 -5.357 6.411 0.157 96 1HG1 ILE2039 2HG1 ILE2039 -6.024 9.290 0.839 97 2HG1 ILE2039 1HG1 ILE2039 -6.569 8.434 -0.596 98 1HG2 ILE2039 2HG2 ILE2039 -4.295 8.153 2.405 99 2HG2 ILE2039 1HG2 ILE2039 -5.468 6.853 2.599 100 3HG2 ILE2039 3HG2 ILE2039 -3.825 6.497 2.065 101 1HD1 ILE2039 3HD1 ILE2039 -7.820 6.876 0.818 102 2HD1 ILE2039 2HD1 ILE2039 -7.275 7.752 2.248 103 3HD1 ILE2039 1HD1 ILE2039 -8.318 8.550 1.075 104 H ASN2040 H ASN2040 -4.346 10.193 -1.189 105 HA ASN2040 HA ASN2040 -2.443 11.684 0.403 106 1HB ASN2040 2HB ASN2040 -3.389 12.570 -1.775 107 2HB ASN2040 1HB ASN2040 -4.947 12.712 -0.954 108 1HD2 ASN2040 1HD2 ASN2040 -1.810 14.084 -1.365 109 2HD2 ASN2040 2HD2 ASN2040 -2.097 15.507 -0.448 110 H LYS2041 H LYS2041 -2.688 12.197 2.422 111 HA LYS2041 HA LYS2041 -4.707 11.062 3.965 112 1HB LYS2041 2HB LYS2041 -2.834 13.287 4.695 113 2HB LYS2041 1HB LYS2041 -3.780 12.334 5.821 114 1HG LYS2041 2HG LYS2041 -2.534 10.342 5.221 115 2HG LYS2041 1HG LYS2041 -1.621 11.265 4.017 116 1HD LYS2041 2HD LYS2041 -0.815 12.745 5.770 117 2HD LYS2041 1HD LYS2041 -1.731 11.803 6.956 118 1HE LYS2041 2HE LYS2041 -0.365 9.864 6.500 119 2HE LYS2041 1HE LYS2041 0.521 10.751 5.252 120 1HZ LYS2041 2HZ LYS2041 0.446 11.475 8.130 121 2HZ LYS2041 1HZ LYS2041 1.714 10.658 7.377 122 3HZ LYS2041 3HZ LYS2041 1.347 12.241 6.933 123 H VAL2042 H VAL2042 -4.554 14.194 2.487 124 HA VAL2042 HA VAL2042 -6.723 15.152 4.193 125 HB VAL2042 HB VAL2042 -5.061 16.663 2.183 126 1HG1 VAL2042 2HG1 VAL2042 -7.232 17.711 2.568 127 2HG1 VAL2042 1HG1 VAL2042 -6.955 17.664 4.311 128 3HG1 VAL2042 3HG1 VAL2042 -5.942 18.678 3.282 129 1HG2 VAL2042 3HG2 VAL2042 -4.801 16.496 5.184 130 2HG2 VAL2042 2HG2 VAL2042 -3.667 15.886 3.980 131 3HG2 VAL2042 1HG2 VAL2042 -3.920 17.625 4.151 132 H ASP2043 H ASP2043 -5.876 15.148 0.726 133 HA ASP2043 HA ASP2043 -8.545 15.994 0.077 134 1HB ASP2043 2HB ASP2043 -6.546 16.867 -1.119 135 2HB ASP2043 1HB ASP2043 -6.326 15.277 -1.841 136 H GLY2044 H GLY2044 -6.905 12.932 0.119 137 1HA GLY2044 1HA GLY2044 -9.454 11.718 -0.549 138 2HA GLY2044 2HA GLY2044 -8.067 10.921 0.189 139 H THR2045 H THR2045 -6.510 12.433 -2.038 140 HA THR2045 HA THR2045 -7.165 11.274 -4.447 141 HB THR2045 HB THR2045 -4.371 11.948 -3.530 142 HG1 THR2045 1HG THR2045 -4.938 14.106 -4.115 143 1HG2 THR2045 3HG2 THR2045 -5.779 12.220 -6.196 144 2HG2 THR2045 2HG2 THR2045 -4.112 12.674 -5.854 145 3HG2 THR2045 1HG2 THR2045 -4.595 10.978 -5.784 146 H LEU2046 H LEU2046 -7.153 9.094 -4.848 147 HA LEU2046 HA LEU2046 -5.322 7.424 -3.285 148 1HB LEU2046 2HB LEU2046 -7.697 6.957 -2.915 149 2HB LEU2046 1HB LEU2046 -7.914 6.676 -4.632 150 HG LEU2046 HG LEU2046 -6.383 4.739 -4.486 151 1HD1 LEU2046 3HD1 LEU2046 -6.496 5.258 -1.526 152 2HD1 LEU2046 2HD1 LEU2046 -5.817 3.824 -2.302 153 3HD1 LEU2046 1HD1 LEU2046 -5.070 5.400 -2.556 154 1HD2 LEU2046 1HD2 LEU2046 -8.775 4.428 -4.357 155 2HD2 LEU2046 3HD2 LEU2046 -7.928 3.260 -3.340 156 3HD2 LEU2046 2HD2 LEU2046 -8.725 4.662 -2.606 157 H LEU2047 H LEU2047 -3.726 6.595 -4.311 158 HA LEU2047 HA LEU2047 -3.699 6.582 -7.263 159 1HB LEU2047 2HB LEU2047 -1.391 6.304 -5.350 160 2HB LEU2047 1HB LEU2047 -1.294 6.434 -7.090 161 HG LEU2047 HG LEU2047 -2.112 8.597 -5.158 162 1HD1 LEU2047 2HD1 LEU2047 0.262 8.169 -5.237 163 2HD1 LEU2047 1HD1 LEU2047 0.254 8.332 -6.990 164 3HD1 LEU2047 3HD1 LEU2047 -0.117 9.729 -5.978 165 1HD2 LEU2047 3HD2 LEU2047 -2.024 8.671 -8.179 166 2HD2 LEU2047 2HD2 LEU2047 -3.463 8.803 -7.164 167 3HD2 LEU2047 1HD2 LEU2047 -2.248 10.074 -7.128 168 H VAL2048 H VAL2048 -4.328 4.863 -8.107 169 HA VAL2048 HA VAL2048 -3.296 2.321 -7.091 170 HB VAL2048 HB VAL2048 -5.346 1.214 -7.976 171 1HG1 VAL2048 3HG1 VAL2048 -5.875 3.344 -5.915 172 2HG1 VAL2048 2HG1 VAL2048 -6.921 1.955 -6.217 173 3HG1 VAL2048 1HG1 VAL2048 -5.279 1.713 -5.617 174 1HG2 VAL2048 2HG2 VAL2048 -6.369 4.029 -8.364 175 2HG2 VAL2048 1HG2 VAL2048 -6.012 2.867 -9.644 176 3HG2 VAL2048 3HG2 VAL2048 -7.339 2.564 -8.518 177 H GLY2049 H GLY2049 -3.280 0.671 -8.884 178 1HA GLY2049 1HA GLY2049 -3.376 1.543 -11.571 179 2HA GLY2049 2HA GLY2049 -2.759 -0.005 -11.004 180 H GLU2050 H GLU2050 -1.803 2.150 -12.942 181 HA GLU2050 HA GLU2050 0.964 1.792 -12.239 182 1HB GLU2050 2HB GLU2050 1.475 2.656 -14.461 183 2HB GLU2050 1HB GLU2050 0.260 1.396 -14.546 184 1HG GLU2050 2HG GLU2050 -1.491 3.101 -14.777 185 2HG GLU2050 1HG GLU2050 -0.258 4.358 -14.726 186 H ASP2051 H ASP2051 -1.179 3.998 -11.344 187 HA ASP2051 HA ASP2051 0.738 6.186 -11.305 188 1HB ASP2051 2HB ASP2051 -2.132 5.916 -10.773 189 2HB ASP2051 1HB ASP2051 -1.296 7.337 -10.107 190 H ALA2052 H ALA2052 0.022 3.537 -9.500 191 HA ALA2052 HA ALA2052 0.420 4.857 -6.991 192 1HB ALA2052 1HB ALA2052 0.166 2.585 -6.037 193 2HB ALA2052 2HB ALA2052 -0.010 1.946 -7.689 194 3HB ALA2052 3HB ALA2052 -1.174 3.124 -7.043 195 HA PRO2053 HA PRO2053 4.799 4.849 -7.180 196 1HB PRO2053 2HB PRO2053 4.666 4.181 -4.287 197 2HB PRO2053 1HB PRO2053 5.516 5.498 -5.101 198 1HG PRO2053 2HG PRO2053 3.290 6.004 -3.795 199 2HG PRO2053 1HG PRO2053 3.581 6.751 -5.374 200 1HD PRO2053 2HD PRO2053 1.821 4.436 -4.681 201 2HD PRO2053 1HD PRO2053 1.544 5.804 -5.784 202 H ARG2054 H ARG2054 6.694 3.626 -6.983 203 HA ARG2054 HA ARG2054 6.427 0.884 -7.353 204 1HB ARG2054 2HB ARG2054 8.173 2.362 -8.358 205 2HB ARG2054 1HB ARG2054 8.862 2.550 -6.757 206 1HG ARG2054 2HG ARG2054 9.424 0.249 -6.650 207 2HG ARG2054 1HG ARG2054 8.564 -0.070 -8.163 208 1HD ARG2054 2HD ARG2054 10.994 1.713 -7.861 209 2HD ARG2054 1HD ARG2054 11.002 0.079 -8.518 210 HE ARG2054 HE ARG2054 9.374 1.040 -10.203 211 1HH1 ARG2054 1HH1 ARG2054 12.094 2.932 -8.838 212 2HH1 ARG2054 2HH1 ARG2054 12.177 3.963 -10.184 213 1HH2 ARG2054 1HH2 ARG2054 9.568 2.482 -12.022 214 2HH2 ARG2054 2HH2 ARG2054 10.728 3.730 -11.998 215 H ARG2055 H ARG2055 6.247 -0.498 -5.934 216 HA ARG2055 HA ARG2055 5.871 -0.211 -3.260 217 1HB ARG2055 2HB ARG2055 6.247 -2.716 -3.109 218 2HB ARG2055 1HB ARG2055 5.024 -2.152 -4.231 219 1HG ARG2055 2HG ARG2055 7.792 -2.705 -5.226 220 2HG ARG2055 1HG ARG2055 6.698 -4.039 -4.894 221 1HD ARG2055 2HD ARG2055 5.155 -3.322 -6.562 222 2HD ARG2055 1HD ARG2055 5.942 -1.773 -6.793 223 HE ARG2055 HE ARG2055 7.864 -3.603 -7.356 224 1HH1 ARG2055 1HH1 ARG2055 4.547 -3.214 -8.641 225 2HH1 ARG2055 2HH1 ARG2055 4.959 -3.626 -10.220 226 1HH2 ARG2055 1HH2 ARG2055 8.410 -4.189 -9.579 227 2HH2 ARG2055 2HH2 ARG2055 7.193 -4.235 -10.760 228 H ALA2056 H ALA2056 8.911 -1.363 -4.733 229 HA ALA2056 HA ALA2056 10.349 -1.601 -2.359 230 1HB ALA2056 2HB ALA2056 11.388 -0.919 -5.096 231 2HB ALA2056 3HB ALA2056 11.064 -2.543 -4.490 232 3HB ALA2056 1HB ALA2056 12.341 -1.569 -3.757 233 H GLU2057 H GLU2057 9.493 1.309 -4.099 234 HA GLU2057 HA GLU2057 11.576 2.854 -2.727 235 1HB GLU2057 2HB GLU2057 9.578 3.813 -4.773 236 2HB GLU2057 1HB GLU2057 10.987 4.680 -4.187 237 1HG GLU2057 2HG GLU2057 10.914 2.219 -5.866 238 2HG GLU2057 1HG GLU2057 11.444 3.822 -6.360 239 H LEU2058 H LEU2058 8.322 2.073 -2.614 240 HA LEU2058 HA LEU2058 7.008 4.281 -1.678 241 1HB LEU2058 2HB LEU2058 5.950 2.220 -2.439 242 2HB LEU2058 1HB LEU2058 6.558 1.359 -1.056 243 HG LEU2058 HG LEU2058 4.103 1.917 -1.069 244 1HD1 LEU2058 2HD1 LEU2058 5.184 1.231 0.975 245 2HD1 LEU2058 1HD1 LEU2058 5.682 2.892 1.290 246 3HD1 LEU2058 3HD1 LEU2058 3.970 2.467 1.298 247 1HD2 LEU2058 2HD2 LEU2058 5.134 4.689 -0.530 248 2HD2 LEU2058 1HD2 LEU2058 4.219 4.164 -1.944 249 3HD2 LEU2058 3HD2 LEU2058 3.458 4.173 -0.352 250 H GLU2059 H GLU2059 8.921 1.984 0.135 251 HA GLU2059 HA GLU2059 8.261 2.666 2.751 252 1HB GLU2059 2HB GLU2059 11.062 1.965 1.857 253 2HB GLU2059 1HB GLU2059 10.299 1.590 3.391 254 1HG GLU2059 2HG GLU2059 8.708 0.130 2.155 255 2HG GLU2059 1HG GLU2059 9.667 0.379 0.710 256 H MET2060 H MET2060 10.924 3.811 0.789 257 HA MET2060 HA MET2060 11.828 5.891 2.509 258 1HB MET2060 2HB MET2060 13.274 4.884 0.854 259 2HB MET2060 1HB MET2060 12.229 5.435 -0.449 260 1HG MET2060 2HG MET2060 12.777 7.767 0.166 261 2HG MET2060 1HG MET2060 13.897 7.146 1.378 262 1HE MET2060 1HE MET2060 16.055 5.732 0.798 263 2HE MET2060 3HE MET2060 15.118 4.584 -0.158 264 3HE MET2060 2HE MET2060 16.563 5.322 -0.837 265 H TRP2061 H TRP2061 9.607 5.783 -0.180 266 HA TRP2061 HA TRP2061 9.363 8.516 -0.740 267 1HB TRP2061 2HB TRP2061 8.598 6.545 -2.138 268 2HB TRP2061 1HB TRP2061 7.230 6.403 -1.045 269 HD1 TRP2061 HD TRP2061 8.762 9.014 -3.458 270 HE1 TRP2061 1HE TRP2061 6.835 10.314 -4.545 271 HE3 TRP2061 3HE TRP2061 4.843 6.928 -0.916 272 HZ2 TRP2061 2HZ TRP2061 4.024 10.444 -4.358 273 HZ3 TRP2061 3HZ TRP2061 2.574 7.701 -1.432 274 HH2 TRP2061 HH TRP2061 2.171 9.418 -3.119 275 H LEU2062 H LEU2062 7.467 6.407 1.389 276 HA LEU2062 HA LEU2062 5.764 8.457 2.330 277 1HB LEU2062 2HB LEU2062 6.467 5.812 3.552 278 2HB LEU2062 1HB LEU2062 5.238 6.883 4.197 279 HG LEU2062 HG LEU2062 5.206 5.441 1.556 280 1HD1 LEU2062 3HD1 LEU2062 4.673 4.070 3.473 281 2HD1 LEU2062 2HD1 LEU2062 3.464 5.247 3.998 282 3HD1 LEU2062 1HD1 LEU2062 3.247 4.367 2.479 283 1HD2 LEU2062 3HD2 LEU2062 3.241 7.454 2.660 284 2HD2 LEU2062 2HD2 LEU2062 4.231 7.622 1.208 285 3HD2 LEU2062 1HD2 LEU2062 2.952 6.416 1.262 286 H GLN2063 H GLN2063 8.899 7.347 3.371 287 HA GLN2063 HA GLN2063 8.949 8.615 5.874 288 1HB GLN2063 2HB GLN2063 11.169 7.869 3.994 289 2HB GLN2063 1HB GLN2063 11.429 8.474 5.620 290 1HG GLN2063 2HG GLN2063 10.004 5.933 4.840 291 2HG GLN2063 1HG GLN2063 11.604 6.054 5.568 292 1HE2 GLN2063 1HE2 GLN2063 11.771 6.526 7.735 293 2HE2 GLN2063 2HE2 GLN2063 10.439 6.425 8.824 294 H GLY2064 H GLY2064 9.564 9.785 2.671 295 1HA GLY2064 1HA GLY2064 9.975 11.936 1.872 296 2HA GLY2064 2HA GLY2064 10.608 12.338 3.465 297 H HIS2065 H HIS2065 7.491 11.009 3.043 298 HA HIS2065 HA HIS2065 5.403 11.614 3.359 299 1HB HIS2065 2HB HIS2065 6.167 12.315 5.614 300 2HB HIS2065 1HB HIS2065 6.454 13.940 5.004 301 HD1 HIS2065 1HD HIS2065 4.541 15.496 5.602 302 HD2 HIS2065 2HD HIS2065 3.284 11.572 5.041 303 HE1 HIS2065 1HE HIS2065 2.064 15.498 5.994 304 HA PRO2066 HA PRO2066 5.005 14.694 0.041 305 1HB PRO2066 2HB PRO2066 4.151 13.087 -1.819 306 2HB PRO2066 1HB PRO2066 5.807 12.852 -1.238 307 1HG PRO2066 2HG PRO2066 3.314 11.426 -0.394 308 2HG PRO2066 1HG PRO2066 4.844 10.681 -0.959 309 1HD PRO2066 2HD PRO2066 4.121 11.053 1.666 310 2HD PRO2066 1HD PRO2066 5.812 11.001 1.116 311 H GLU2067 H GLU2067 3.120 13.740 2.255 312 HA GLU2067 HA GLU2067 1.018 14.291 2.997 313 1HB GLU2067 2HB GLU2067 0.273 14.810 0.117 314 2HB GLU2067 1HB GLU2067 -0.783 15.031 1.496 315 1HG GLU2067 2HG GLU2067 0.638 16.836 2.294 316 2HG GLU2067 1HG GLU2067 1.729 16.582 0.927 317 H PHE2068 H PHE2068 1.866 11.933 0.916 318 HA PHE2068 HA PHE2068 -0.699 10.558 1.054 319 1HB PHE2068 2HB PHE2068 1.798 9.951 -0.527 320 2HB PHE2068 1HB PHE2068 0.427 8.862 -0.431 321 HD1 PHE2068 1HD PHE2068 -1.424 9.138 -1.822 322 HD2 PHE2068 2HD PHE2068 1.439 12.259 -1.516 323 HE1 PHE2068 1HE PHE2068 -2.495 10.296 -3.705 324 HE2 PHE2068 2HE PHE2068 0.375 13.420 -3.396 325 HZ PHE2068 HZ PHE2068 -1.596 12.442 -4.495 326 H ALA2069 H ALA2069 -0.905 8.508 1.803 327 HA ALA2069 HA ALA2069 1.232 7.271 3.349 328 1HB ALA2069 1HB ALA2069 -0.086 8.525 4.988 329 2HB ALA2069 2HB ALA2069 -0.398 6.795 5.169 330 3HB ALA2069 3HB ALA2069 -1.574 7.828 4.352 331 H VAL2070 H VAL2070 0.164 4.960 4.005 332 HA VAL2070 HA VAL2070 -0.562 3.822 1.510 333 HB VAL2070 HB VAL2070 -0.731 1.690 2.716 334 1HG1 VAL2070 3HG1 VAL2070 1.444 2.417 1.919 335 2HG1 VAL2070 2HG1 VAL2070 1.726 3.255 3.454 336 3HG1 VAL2070 1HG1 VAL2070 1.599 1.500 3.422 337 1HG2 VAL2070 2HG2 VAL2070 -0.218 3.341 5.197 338 2HG2 VAL2070 1HG2 VAL2070 -1.650 2.380 4.838 339 3HG2 VAL2070 3HG2 VAL2070 -0.106 1.583 5.127 340 H ASP2071 H ASP2071 -2.479 2.848 0.909 341 HA ASP2071 HA ASP2071 -4.822 4.064 1.863 342 1HB ASP2071 2HB ASP2071 -4.892 3.531 -0.385 343 2HB ASP2071 1HB ASP2071 -4.163 1.952 -0.136 344 HA PRO2072 HA PRO2072 -5.718 1.393 5.336 345 1HB PRO2072 2HB PRO2072 -8.489 2.320 4.823 346 2HB PRO2072 1HB PRO2072 -7.529 2.374 6.309 347 1HG PRO2072 2HG PRO2072 -7.983 4.587 4.878 348 2HG PRO2072 1HG PRO2072 -6.436 4.310 5.696 349 1HD PRO2072 2HD PRO2072 -7.118 4.067 2.803 350 2HD PRO2072 1HD PRO2072 -5.628 4.631 3.586 351 H ARG2073 H ARG2073 -7.414 1.281 2.258 352 HA ARG2073 HA ARG2073 -8.823 -1.149 2.842 353 1HB ARG2073 2HB ARG2073 -9.539 0.606 1.173 354 2HB ARG2073 1HB ARG2073 -8.191 0.131 0.169 355 1HG ARG2073 2HG ARG2073 -9.186 -2.099 -0.073 356 2HG ARG2073 1HG ARG2073 -10.560 -1.569 0.904 357 1HD ARG2073 2HD ARG2073 -9.678 -0.409 -1.746 358 2HD ARG2073 1HD ARG2073 -11.118 -1.384 -1.454 359 HE ARG2073 HE ARG2073 -11.495 0.672 0.217 360 1HH1 ARG2073 1HH1 ARG2073 -10.769 0.580 -3.249 361 2HH1 ARG2073 2HH1 ARG2073 -11.422 2.124 -3.559 362 1HH2 ARG2073 1HH2 ARG2073 -12.402 2.757 -0.223 363 2HH2 ARG2073 2HH2 ARG2073 -12.375 3.413 -1.794 364 H PHE2074 H PHE2074 -5.823 -0.216 1.321 365 HA PHE2074 HA PHE2074 -4.870 -2.786 0.640 366 1HB PHE2074 2HB PHE2074 -3.814 -0.861 -0.352 367 2HB PHE2074 1HB PHE2074 -3.432 -0.187 1.226 368 HD1 PHE2074 1HD PHE2074 -2.732 -3.167 -0.894 369 HD2 PHE2074 2HD PHE2074 -1.324 -0.502 2.103 370 HE1 PHE2074 1HE PHE2074 -0.538 -4.252 -0.972 371 HE2 PHE2074 2HE PHE2074 0.874 -1.586 2.036 372 HZ PHE2074 HZ PHE2074 1.267 -3.471 0.494 373 H LEU2075 H LEU2075 -4.681 -0.865 3.562 374 HA LEU2075 HA LEU2075 -3.037 -2.636 5.013 375 1HB LEU2075 2HB LEU2075 -5.139 -0.693 5.963 376 2HB LEU2075 1HB LEU2075 -4.138 -1.616 7.074 377 HG LEU2075 HG LEU2075 -3.181 0.429 5.081 378 1HD1 LEU2075 1HD1 LEU2075 -4.378 1.410 6.972 379 2HD1 LEU2075 3HD1 LEU2075 -3.357 0.506 8.089 380 3HD1 LEU2075 2HD1 LEU2075 -2.653 1.753 7.062 381 1HD2 LEU2075 1HD2 LEU2075 -1.692 -1.224 7.122 382 2HD2 LEU2075 3HD2 LEU2075 -1.495 -1.295 5.367 383 3HD2 LEU2075 2HD2 LEU2075 -1.013 0.145 6.265 384 H ALA2076 H ALA2076 -6.497 -2.587 4.479 385 HA ALA2076 HA ALA2076 -7.014 -4.846 6.131 386 1HB ALA2076 2HB ALA2076 -9.175 -4.943 5.087 387 2HB ALA2076 1HB ALA2076 -8.786 -3.273 5.496 388 3HB ALA2076 3HB ALA2076 -8.661 -3.823 3.818 389 H TYR2077 H TYR2077 -6.184 -4.379 2.779 390 HA TYR2077 HA TYR2077 -6.408 -6.967 1.731 391 1HB TYR2077 2HB TYR2077 -5.840 -5.103 0.314 392 2HB TYR2077 1HB TYR2077 -4.381 -4.788 1.242 393 HD1 TYR2077 1HD TYR2077 -5.968 -7.495 -0.739 394 HD2 TYR2077 2HD TYR2077 -2.386 -5.551 0.420 395 HE1 TYR2077 1HE TYR2077 -4.723 -8.919 -2.240 396 HE2 TYR2077 2HE TYR2077 -1.101 -6.973 -1.108 397 HH TYR2077 HH TYR2077 -2.509 -8.750 -3.514 398 H MET2078 H MET2078 -3.678 -5.526 3.480 399 HA MET2078 HA MET2078 -2.057 -7.832 3.487 400 1HB MET2078 2HB MET2078 -2.214 -5.530 5.417 401 2HB MET2078 1HB MET2078 -1.092 -6.852 5.655 402 1HG MET2078 2HG MET2078 -0.103 -6.300 3.437 403 2HG MET2078 1HG MET2078 -1.149 -4.876 3.392 404 1HE MET2078 3HE MET2078 1.157 -3.470 3.062 405 2HE MET2078 2HE MET2078 2.474 -3.472 4.236 406 3HE MET2078 1HE MET2078 2.145 -4.915 3.276 407 H GLU2079 H GLU2079 -4.207 -6.582 5.951 408 HA GLU2079 HA GLU2079 -3.859 -8.549 7.899 409 1HB GLU2079 2HB GLU2079 -4.708 -6.306 8.286 410 2HB GLU2079 1HB GLU2079 -6.150 -6.660 7.354 411 1HG GLU2079 2HG GLU2079 -6.618 -6.636 9.701 412 2HG GLU2079 1HG GLU2079 -6.838 -8.251 9.051 413 H ASP2080 H ASP2080 -6.185 -8.326 5.262 414 HA ASP2080 HA ASP2080 -7.797 -10.511 6.128 415 1HB ASP2080 2HB ASP2080 -8.678 -8.709 4.698 416 2HB ASP2080 1HB ASP2080 -7.621 -9.249 3.403 417 H ARG2081 H ARG2081 -5.258 -10.146 3.685 418 HA ARG2081 HA ARG2081 -5.727 -12.791 2.728 419 1HB ARG2081 2HB ARG2081 -3.294 -11.108 2.130 420 2HB ARG2081 1HB ARG2081 -3.841 -12.521 1.246 421 1HG ARG2081 2HG ARG2081 -5.113 -9.792 1.339 422 2HG ARG2081 1HG ARG2081 -4.370 -10.588 -0.037 423 1HD ARG2081 2HD ARG2081 -6.217 -12.298 0.071 424 2HD ARG2081 1HD ARG2081 -6.969 -11.304 1.320 425 HE ARG2081 HE ARG2081 -6.384 -10.288 -1.377 426 1HH1 ARG2081 1HH1 ARG2081 -8.745 -10.613 1.322 427 2HH1 ARG2081 2HH1 ARG2081 -9.879 -9.635 0.548 428 1HH2 ARG2081 1HH2 ARG2081 -8.015 -8.941 -2.356 429 2HH2 ARG2081 2HH2 ARG2081 -9.485 -8.664 -1.534 430 H ARG2082 H ARG2082 -2.555 -11.616 3.907 431 HA ARG2082 HA ARG2082 -2.494 -13.494 6.004 432 1HB ARG2082 2HB ARG2082 -0.720 -15.037 5.188 433 2HB ARG2082 1HB ARG2082 -2.248 -15.203 4.353 434 1HG ARG2082 2HG ARG2082 -1.310 -13.926 2.460 435 2HG ARG2082 1HG ARG2082 0.246 -13.867 3.304 436 1HD ARG2082 2HD ARG2082 0.297 -16.327 3.354 437 2HD ARG2082 1HD ARG2082 -1.247 -16.366 2.513 438 HE ARG2082 HE ARG2082 1.047 -15.078 1.239 439 1HH1 ARG2082 1HH1 ARG2082 -1.233 -17.793 1.321 440 2HH1 ARG2082 2HH1 ARG2082 -0.886 -18.334 -0.245 441 1HH2 ARG2082 1HH2 ARG2082 1.581 -15.868 -0.914 442 2HH2 ARG2082 2HH2 ARG2082 0.772 -17.216 -1.542 443 H LYS2083 H LYS2083 -1.799 -10.680 5.469 444 HA LYS2083 HA LYS2083 0.876 -10.829 6.645 445 1HB LYS2083 2HB LYS2083 -0.255 -8.677 4.851 446 2HB LYS2083 1HB LYS2083 1.086 -8.362 5.926 447 1HG LYS2083 2HG LYS2083 2.024 -8.707 3.814 448 2HG LYS2083 1HG LYS2083 2.315 -10.197 4.694 449 1HD LYS2083 2HD LYS2083 0.501 -11.287 3.509 450 2HD LYS2083 1HD LYS2083 0.079 -9.768 2.705 451 1HE LYS2083 2HE LYS2083 2.303 -9.704 1.673 452 2HE LYS2083 1HE LYS2083 2.704 -11.221 2.462 453 1HZ LYS2083 2HZ LYS2083 0.578 -10.849 0.408 454 2HZ LYS2083 1HZ LYS2083 2.090 -11.526 0.188 455 3HZ LYS2083 3HZ LYS2083 0.985 -12.310 1.161 456 H GLN2084 H GLN2084 0.139 -10.958 8.732 457 HA GLN2084 HA GLN2084 -1.856 -9.155 9.725 458 1HB GLN2084 2HB GLN2084 -1.407 -10.195 11.905 459 2HB GLN2084 1HB GLN2084 -1.687 -11.379 10.642 460 1HG GLN2084 2HG GLN2084 0.762 -11.705 10.475 461 2HG GLN2084 1HG GLN2084 0.959 -10.595 11.825 462 1HE2 GLN2084 1HE2 GLN2084 -0.232 -13.668 10.840 463 2HE2 GLN2084 2HE2 GLN2084 -0.355 -14.376 12.413 464 H LYS2085 H LYS2085 0.689 -8.098 8.659 465 HA LYS2085 HA LYS2085 2.130 -6.399 8.916 466 1HB LYS2085 2HB LYS2085 0.366 -5.601 11.241 467 2HB LYS2085 1HB LYS2085 1.550 -4.563 10.455 468 1HG LYS2085 2HG LYS2085 0.276 -4.718 8.353 469 2HG LYS2085 1HG LYS2085 -0.913 -5.728 9.169 470 1HD LYS2085 2HD LYS2085 -0.228 -2.879 9.901 471 2HD LYS2085 1HD LYS2085 -1.636 -3.371 8.973 472 1HE LYS2085 2HE LYS2085 -1.014 -4.100 11.839 473 2HE LYS2085 1HE LYS2085 -2.218 -2.939 11.307 474 1HZ LYS2085 3HZ LYS2085 -3.413 -4.796 10.217 475 2HZ LYS2085 2HZ LYS2085 -2.314 -5.898 10.888 476 3HZ LYS2085 1HZ LYS2085 -3.282 -4.988 11.874 No H/Q in entry = 476
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