NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
7650 | 1ktm | 5266 | cing | recoord | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 915 H MET 915 10.118 -21.537 0.238 2 HA MET 915 HA MET 915 9.558 -19.865 1.978 3 1HB MET 915 1HB MET 915 11.455 -21.771 3.416 4 2HB MET 915 2HB MET 915 11.380 -20.092 3.912 5 1HG MET 915 1HG MET 915 8.927 -20.297 4.305 6 2HG MET 915 2HG MET 915 8.965 -21.961 3.758 7 1HE MET 915 1HE MET 915 8.523 -23.217 7.004 8 2HE MET 915 2HE MET 915 8.247 -23.190 5.246 9 3HE MET 915 3HE MET 915 9.642 -24.071 5.915 10 H ALA 916 H ALA 916 10.794 -19.884 -0.495 11 HA ALA 916 HA ALA 916 13.517 -18.944 -0.086 12 1HB ALA 916 1HB ALA 916 13.430 -20.380 -1.922 13 2HB ALA 916 2HB ALA 916 11.826 -19.801 -2.431 14 3HB ALA 916 3HB ALA 916 13.265 -18.790 -2.704 15 H ASN 917 H ASN 917 13.871 -16.997 -1.943 16 HA ASN 917 HA ASN 917 12.378 -14.868 -0.749 17 1HB ASN 917 1HB ASN 917 14.959 -14.980 -1.431 18 2HB ASN 917 2HB ASN 917 14.371 -14.511 -3.014 19 1HD2 ASN 917 1HD2 ASN 917 14.289 -13.661 0.420 20 2HD2 ASN 917 2HD2 ASN 917 14.125 -11.948 0.229 21 H LEU 918 H LEU 918 10.240 -15.105 -1.692 22 HA LEU 918 HA LEU 918 10.057 -15.189 -4.584 23 1HB LEU 918 1HB LEU 918 8.287 -15.737 -2.284 24 2HB LEU 918 2HB LEU 918 7.503 -15.033 -3.684 25 HG LEU 918 HG LEU 918 9.311 -17.366 -4.146 26 1HD1 LEU 918 1HD1 LEU 918 6.644 -18.315 -3.603 27 2HD1 LEU 918 2HD1 LEU 918 8.201 -18.850 -2.927 28 3HD1 LEU 918 3HD1 LEU 918 7.315 -17.506 -2.167 29 1HD2 LEU 918 1HD2 LEU 918 8.374 -17.270 -6.151 30 2HD2 LEU 918 2HD2 LEU 918 6.764 -17.524 -5.436 31 3HD2 LEU 918 3HD2 LEU 918 7.403 -15.874 -5.626 32 H ASP 919 H ASP 919 11.387 -12.900 -3.828 33 HA ASP 919 HA ASP 919 9.406 -10.828 -3.610 34 1HB ASP 919 1HB ASP 919 11.809 -10.962 -2.498 35 2HB ASP 919 2HB ASP 919 12.375 -10.387 -4.053 36 H ARG 920 H ARG 920 9.165 -12.347 -6.006 37 HA ARG 920 HA ARG 920 10.635 -10.954 -8.030 38 1HB ARG 920 1HB ARG 920 9.598 -13.525 -7.827 39 2HB ARG 920 2HB ARG 920 8.409 -12.756 -8.860 40 1HG ARG 920 1HG ARG 920 10.353 -11.913 -10.306 41 2HG ARG 920 2HG ARG 920 11.417 -12.923 -9.347 42 1HD ARG 920 1HD ARG 920 9.527 -14.784 -9.964 43 2HD ARG 920 2HD ARG 920 9.325 -13.729 -11.349 44 HE ARG 920 HE ARG 920 12.097 -14.080 -11.107 45 1HH1 ARG 920 2HH2 ARG 920 9.301 -16.202 -11.588 46 2HH1 ARG 920 1HH2 ARG 920 10.200 -17.395 -12.464 47 1HH2 ARG 920 1HH1 ARG 920 12.540 -17.052 -12.850 48 H SER 921 H SER 921 7.109 -11.831 -7.755 49 HA SER 921 HA SER 921 6.474 -9.405 -9.148 50 1HB SER 921 1HB SER 921 5.401 -11.888 -9.279 51 2HB SER 921 2HB SER 921 4.336 -11.214 -8.062 52 HG SER 921 HG SER 921 3.328 -10.669 -9.949 53 H ASN 922 H ASN 922 6.320 -10.827 -5.885 54 HA ASN 922 HA ASN 922 4.458 -9.115 -4.792 55 1HB ASN 922 1HB ASN 922 6.351 -11.110 -3.881 56 2HB ASN 922 2HB ASN 922 6.514 -9.711 -2.839 57 1HD2 ASN 922 1HD2 ASN 922 5.248 -12.513 -2.710 58 2HD2 ASN 922 2HD2 ASN 922 3.694 -12.258 -1.989 59 H ASP 923 H ASP 923 7.657 -8.567 -6.001 60 HA ASP 923 HA ASP 923 8.409 -6.536 -4.198 61 1HB ASP 923 1HB ASP 923 9.960 -7.910 -5.681 62 2HB ASP 923 2HB ASP 923 9.357 -7.014 -7.062 63 H LYS 924 H LYS 924 6.907 -6.736 -7.485 64 HA LYS 924 HA LYS 924 6.911 -4.004 -8.041 65 1HB LYS 924 1HB LYS 924 6.574 -5.779 -9.714 66 2HB LYS 924 2HB LYS 924 5.027 -6.180 -8.998 67 1HG LYS 924 1HG LYS 924 4.296 -4.719 -10.647 68 2HG LYS 924 2HG LYS 924 4.550 -3.565 -9.353 69 1HD LYS 924 1HD LYS 924 6.845 -3.086 -10.229 70 2HD LYS 924 2HD LYS 924 6.595 -4.243 -11.521 71 1HE LYS 924 1HE LYS 924 4.469 -2.820 -12.108 72 2HE LYS 924 2HE LYS 924 5.180 -1.587 -11.085 73 1HZ LYS 924 1HZ LYS 924 7.056 -2.682 -12.904 74 2HZ LYS 924 2HZ LYS 924 5.777 -2.023 -13.677 75 3HZ LYS 924 3HZ LYS 924 6.659 -1.120 -12.640 76 H VAL 925 H VAL 925 4.593 -6.117 -6.277 77 HA VAL 925 HA VAL 925 2.681 -4.040 -5.953 78 HB VAL 925 HB VAL 925 3.005 -6.565 -4.330 79 1HG1 VAL 925 1HG1 VAL 925 0.885 -6.242 -3.588 80 2HG1 VAL 925 2HG1 VAL 925 1.252 -4.538 -3.951 81 3HG1 VAL 925 3HG1 VAL 925 0.339 -5.521 -5.122 82 1HG2 VAL 925 1HG2 VAL 925 2.637 -6.347 -7.154 83 2HG2 VAL 925 2HG2 VAL 925 2.611 -7.807 -6.137 84 3HG2 VAL 925 3HG2 VAL 925 1.106 -6.906 -6.438 85 H TYR 926 H TYR 926 5.175 -5.573 -3.808 86 HA TYR 926 HA TYR 926 4.659 -3.883 -1.624 87 1HB TYR 926 1HB TYR 926 7.047 -5.516 -2.672 88 2HB TYR 926 2HB TYR 926 7.096 -4.734 -1.105 89 HD1 TYR 926 HD1 TYR 926 7.594 -7.219 -0.462 90 HD2 TYR 926 HD2 TYR 926 3.788 -5.827 -1.834 91 HE1 TYR 926 HE1 TYR 926 6.468 -9.245 0.583 92 HE2 TYR 926 HE2 TYR 926 2.675 -7.858 -0.785 93 HH TYR 926 HH TYR 926 3.870 -9.592 1.488 94 H GLU 927 H GLU 927 6.167 -3.289 -4.683 95 HA GLU 927 HA GLU 927 8.003 -1.354 -3.715 96 1HB GLU 927 1HB GLU 927 7.126 -2.397 -6.383 97 2HB GLU 927 2HB GLU 927 7.816 -0.787 -6.367 98 1HG GLU 927 1HG GLU 927 9.240 -2.991 -4.863 99 2HG GLU 927 2HG GLU 927 9.376 -2.940 -6.609 100 H ASN 928 H ASN 928 5.157 -1.025 -5.966 101 HA ASN 928 HA ASN 928 4.882 1.587 -6.007 102 1HB ASN 928 1HB ASN 928 3.251 -0.552 -6.654 103 2HB ASN 928 2HB ASN 928 2.303 0.194 -5.383 104 1HD2 ASN 928 1HD2 ASN 928 3.054 0.192 -8.626 105 2HD2 ASN 928 2HD2 ASN 928 2.404 1.724 -9.106 106 H VAL 929 H VAL 929 3.434 -0.588 -3.461 107 HA VAL 929 HA VAL 929 2.226 1.265 -1.889 108 HB VAL 929 HB VAL 929 3.762 -1.223 -1.122 109 1HG1 VAL 929 1HG1 VAL 929 2.768 -1.199 1.003 110 2HG1 VAL 929 2HG1 VAL 929 3.284 0.486 0.754 111 3HG1 VAL 929 3HG1 VAL 929 1.576 0.038 0.537 112 1HG2 VAL 929 1HG2 VAL 929 1.728 -1.249 -2.767 113 2HG2 VAL 929 2HG2 VAL 929 1.802 -2.428 -1.435 114 3HG2 VAL 929 3HG2 VAL 929 0.766 -0.987 -1.292 115 H THR 930 H THR 930 5.623 0.051 -1.397 116 HA THR 930 HA THR 930 6.259 2.008 0.506 117 HB THR 930 HB THR 930 8.650 1.237 -0.190 118 HG1 THR 930 HG1 THR 930 8.638 -0.024 -2.020 119 1HG2 THR 930 1HG2 THR 930 7.936 -1.325 0.277 120 2HG2 THR 930 2HG2 THR 930 7.920 -0.114 1.581 121 3HG2 THR 930 3HG2 THR 930 6.406 -0.550 0.753 122 H GLY 931 H GLY 931 7.430 1.820 -2.927 123 1HA GLY 931 1HA GLY 931 8.692 4.124 -3.242 124 2HA GLY 931 2HA GLY 931 7.572 3.518 -4.446 125 H LEU 932 H LEU 932 5.072 3.919 -3.615 126 HA LEU 932 HA LEU 932 4.691 6.653 -3.846 127 1HB LEU 932 1HB LEU 932 2.568 6.079 -4.109 128 2HB LEU 932 2HB LEU 932 3.158 4.430 -4.061 129 HG LEU 932 HG LEU 932 2.693 4.413 -1.583 130 1HD1 LEU 932 1HD1 LEU 932 2.136 7.200 -2.110 131 2HD1 LEU 932 2HD1 LEU 932 0.724 6.396 -1.384 132 3HD1 LEU 932 3HD1 LEU 932 2.300 6.343 -0.559 133 1HD2 LEU 932 1HD2 LEU 932 0.011 4.814 -2.365 134 2HD2 LEU 932 2HD2 LEU 932 0.876 4.218 -3.802 135 3HD2 LEU 932 3HD2 LEU 932 0.919 3.285 -2.287 136 H VAL 933 H VAL 933 4.653 4.506 -0.935 137 HA VAL 933 HA VAL 933 3.944 6.497 0.880 138 HB VAL 933 HB VAL 933 5.105 3.782 0.925 139 1HG1 VAL 933 1HG1 VAL 933 5.578 5.769 3.153 140 2HG1 VAL 933 2HG1 VAL 933 5.464 4.020 3.461 141 3HG1 VAL 933 3HG1 VAL 933 6.732 4.653 2.385 142 1HG2 VAL 933 1HG2 VAL 933 2.944 3.475 1.425 143 2HG2 VAL 933 2HG2 VAL 933 3.332 4.106 3.044 144 3HG2 VAL 933 3HG2 VAL 933 2.701 5.200 1.790 145 H LYS 934 H LYS 934 7.245 5.102 0.236 146 HA LYS 934 HA LYS 934 8.738 6.742 1.733 147 1HB LYS 934 1HB LYS 934 9.391 5.855 -1.093 148 2HB LYS 934 2HB LYS 934 10.550 6.384 0.110 149 1HG LYS 934 1HG LYS 934 8.923 4.367 1.350 150 2HG LYS 934 2HG LYS 934 9.369 3.758 -0.232 151 1HD LYS 934 1HD LYS 934 11.536 3.442 0.391 152 2HD LYS 934 2HD LYS 934 11.658 5.055 1.065 153 1HE LYS 934 1HE LYS 934 10.206 4.061 3.047 154 2HE LYS 934 2HE LYS 934 10.729 2.508 2.426 155 1HZ LYS 934 1HZ LYS 934 12.891 2.963 2.924 156 2HZ LYS 934 2HZ LYS 934 12.717 4.586 2.867 157 3HZ LYS 934 3HZ LYS 934 12.148 3.748 4.148 158 H ALA 935 H ALA 935 6.943 7.597 -1.207 159 HA ALA 935 HA ALA 935 8.255 10.152 -1.428 160 1HB ALA 935 1HB ALA 935 7.445 10.009 -3.519 161 2HB ALA 935 2HB ALA 935 6.745 8.428 -3.096 162 3HB ALA 935 3HB ALA 935 5.776 9.910 -2.909 163 H VAL 936 H VAL 936 5.000 8.867 -0.473 164 HA VAL 936 HA VAL 936 3.623 11.094 0.011 165 HB VAL 936 HB VAL 936 3.866 8.493 1.464 166 1HG1 VAL 936 1HG1 VAL 936 3.398 9.945 3.307 167 2HG1 VAL 936 2HG1 VAL 936 2.184 10.848 2.370 168 3HG1 VAL 936 3HG1 VAL 936 1.865 9.164 2.851 169 1HG2 VAL 936 1HG2 VAL 936 2.661 8.384 -0.578 170 2HG2 VAL 936 2HG2 VAL 936 1.436 8.379 0.713 171 3HG2 VAL 936 3HG2 VAL 936 1.750 9.868 -0.210 172 H ILE 937 H ILE 937 6.364 9.848 1.967 173 HA ILE 937 HA ILE 937 6.048 11.987 3.878 174 HB ILE 937 HB ILE 937 8.050 9.750 3.575 175 1HG1 ILE 937 1HG1 ILE 937 6.762 9.361 5.941 176 2HG1 ILE 937 2HG1 ILE 937 5.476 10.091 5.002 177 1HG2 ILE 937 1HG2 ILE 937 9.430 10.929 4.859 178 2HG2 ILE 937 2HG2 ILE 937 8.211 12.196 5.138 179 3HG2 ILE 937 3HG2 ILE 937 8.237 10.744 6.168 180 1HD1 ILE 937 1HD1 ILE 937 6.592 7.409 4.800 181 2HD1 ILE 937 2HD1 ILE 937 5.133 8.076 4.029 182 3HD1 ILE 937 3HD1 ILE 937 6.716 8.249 3.235 183 H GLU 938 H GLU 938 8.774 10.879 1.737 184 HA GLU 938 HA GLU 938 10.353 13.006 1.958 185 1HB GLU 938 1HB GLU 938 10.344 10.807 0.375 186 2HB GLU 938 2HB GLU 938 9.948 12.005 -0.841 187 1HG GLU 938 1HG GLU 938 12.118 12.644 -0.933 188 2HG GLU 938 2HG GLU 938 12.057 13.120 0.752 189 H MET 939 H MET 939 7.615 12.705 -0.412 190 HA MET 939 HA MET 939 7.900 15.097 -1.644 191 1HB MET 939 1HB MET 939 5.495 14.863 -2.188 192 2HB MET 939 2HB MET 939 6.237 13.276 -2.200 193 1HG MET 939 1HG MET 939 4.514 12.690 -0.808 194 2HG MET 939 2HG MET 939 5.477 13.447 0.444 195 1HE MET 939 1HE MET 939 1.991 14.773 -1.930 196 2HE MET 939 2HE MET 939 3.236 15.985 -2.315 197 3HE MET 939 3HE MET 939 3.572 14.255 -2.563 198 H SER 940 H SER 940 6.641 14.411 1.612 199 HA SER 940 HA SER 940 5.330 16.844 1.963 200 1HB SER 940 1HB SER 940 6.633 15.123 4.115 201 2HB SER 940 2HB SER 940 5.322 16.263 4.342 202 HG SER 940 HG SER 940 4.711 14.409 2.370 203 H SER 941 H SER 941 8.708 15.732 2.481 204 HA SER 941 HA SER 941 9.522 18.002 3.884 205 1HB SER 941 1HB SER 941 10.778 15.880 3.921 206 2HB SER 941 2HB SER 941 11.110 16.010 2.205 207 HG SER 941 HG SER 941 12.017 17.846 4.257 208 H LYS 942 H LYS 942 9.789 17.019 0.397 209 HA LYS 942 HA LYS 942 10.856 19.607 -0.289 210 1HB LYS 942 1HB LYS 942 11.060 18.696 -2.519 211 2HB LYS 942 2HB LYS 942 11.696 17.551 -1.355 212 1HG LYS 942 1HG LYS 942 10.027 16.004 -1.747 213 2HG LYS 942 2HG LYS 942 8.792 17.229 -1.964 214 1HD LYS 942 1HD LYS 942 10.949 17.041 -4.061 215 2HD LYS 942 2HD LYS 942 9.739 15.774 -4.029 216 1HE LYS 942 1HE LYS 942 8.355 17.157 -5.179 217 2HE LYS 942 2HE LYS 942 8.249 18.162 -3.747 218 1HZ LYS 942 1HZ LYS 942 10.117 18.441 -5.985 219 2HZ LYS 942 2HZ LYS 942 9.023 19.526 -5.443 220 3HZ LYS 942 3HZ LYS 942 10.360 19.205 -4.562 221 H ILE 943 H ILE 943 7.919 18.781 0.755 222 HA ILE 943 HA ILE 943 6.298 19.774 -1.383 223 HB ILE 943 HB ILE 943 5.951 18.398 1.105 224 1HG1 ILE 943 1HG1 ILE 943 5.139 18.021 -1.386 225 2HG1 ILE 943 2HG1 ILE 943 4.251 17.380 -0.018 226 1HG2 ILE 943 1HG2 ILE 943 4.335 20.926 0.769 227 2HG2 ILE 943 2HG2 ILE 943 3.740 19.524 1.691 228 3HG2 ILE 943 3HG2 ILE 943 5.232 20.353 2.196 229 1HD1 ILE 943 1HD1 ILE 943 3.653 20.032 -1.410 230 2HD1 ILE 943 2HD1 ILE 943 2.735 18.521 -1.617 231 3HD1 ILE 943 3HD1 ILE 943 2.740 19.351 -0.043 232 H GLN 944 H GLN 944 7.055 20.979 1.967 233 HA GLN 944 HA GLN 944 5.902 23.328 1.948 234 1HB GLN 944 1HB GLN 944 8.258 22.204 3.203 235 2HB GLN 944 2HB GLN 944 8.557 23.895 2.858 236 1HG GLN 944 1HG GLN 944 5.998 24.054 3.843 237 2HG GLN 944 2HG GLN 944 6.579 22.659 4.730 238 1HE2 GLN 944 1HE2 GLN 944 8.775 22.885 5.722 239 2HE2 GLN 944 2HE2 GLN 944 9.171 24.384 6.495 240 HA PRO 945 HA PRO 945 9.263 25.278 -0.771 241 1HB PRO 945 1HB PRO 945 11.148 23.703 -1.969 242 2HB PRO 945 2HB PRO 945 11.422 24.541 -0.455 243 1HG PRO 945 1HG PRO 945 10.909 21.667 -0.915 244 2HG PRO 945 2HG PRO 945 11.594 22.447 0.496 245 1HD PRO 945 1HD PRO 945 8.922 21.442 0.218 246 2HD PRO 945 2HD PRO 945 9.573 22.325 1.585 247 H ALA 946 H ALA 946 8.790 22.035 -2.097 248 HA ALA 946 HA ALA 946 8.597 22.429 -4.675 249 1HB ALA 946 1HB ALA 946 7.979 20.302 -3.990 250 2HB ALA 946 2HB ALA 946 6.845 20.909 -2.761 251 3HB ALA 946 3HB ALA 946 6.397 20.952 -4.483 252 HA PRO 947 HA PRO 947 5.825 25.766 -5.179 253 1HB PRO 947 1HB PRO 947 6.140 26.081 -7.876 254 2HB PRO 947 2HB PRO 947 7.214 26.804 -6.695 255 1HG PRO 947 1HG PRO 947 7.684 24.465 -8.440 256 2HG PRO 947 2HG PRO 947 8.854 25.449 -7.584 257 1HD PRO 947 1HD PRO 947 7.938 22.835 -6.839 258 2HD PRO 947 2HD PRO 947 9.020 23.866 -5.924 259 HA PRO 948 HA PRO 948 2.143 24.269 -6.688 260 1HB PRO 948 1HB PRO 948 0.979 26.294 -8.106 261 2HB PRO 948 2HB PRO 948 0.977 26.226 -6.355 262 1HG PRO 948 1HG PRO 948 2.595 27.937 -8.143 263 2HG PRO 948 2HG PRO 948 2.264 28.139 -6.434 264 1HD PRO 948 1HD PRO 948 4.697 27.175 -7.608 265 2HD PRO 948 2HD PRO 948 4.323 27.267 -5.899 266 H GLU 949 H GLU 949 4.510 25.100 -8.909 267 HA GLU 949 HA GLU 949 2.988 23.978 -11.089 268 1HB GLU 949 1HB GLU 949 4.864 24.694 -12.500 269 2HB GLU 949 2HB GLU 949 4.353 26.018 -11.473 270 1HG GLU 949 1HG GLU 949 6.225 25.726 -9.980 271 2HG GLU 949 2HG GLU 949 6.612 24.152 -10.646 272 H GLU 950 H GLU 950 5.512 23.157 -8.758 273 HA GLU 950 HA GLU 950 6.093 20.741 -10.258 274 1HB GLU 950 1HB GLU 950 7.720 22.511 -8.789 275 2HB GLU 950 2HB GLU 950 7.593 21.098 -7.760 276 1HG GLU 950 1HG GLU 950 9.150 20.085 -9.059 277 2HG GLU 950 2HG GLU 950 7.973 20.041 -10.356 278 H TYR 951 H TYR 951 4.078 21.925 -7.772 279 HA TYR 951 HA TYR 951 4.086 19.457 -6.244 280 1HB TYR 951 1HB TYR 951 3.876 21.670 -5.124 281 2HB TYR 951 2HB TYR 951 2.596 22.150 -6.220 282 HD1 TYR 951 HD1 TYR 951 2.935 18.891 -4.426 283 HD2 TYR 951 HD2 TYR 951 0.806 22.588 -4.752 284 HE1 TYR 951 HE1 TYR 951 1.197 18.044 -2.775 285 HE2 TYR 951 HE2 TYR 951 -0.925 21.729 -3.100 286 HH TYR 951 HH TYR 951 -0.909 18.402 -2.041 287 H VAL 952 H VAL 952 1.976 21.319 -8.503 288 HA VAL 952 HA VAL 952 -0.350 19.973 -8.300 289 HB VAL 952 HB VAL 952 1.108 21.432 -10.383 290 1HG1 VAL 952 1HG1 VAL 952 -0.518 20.790 -12.185 291 2HG1 VAL 952 2HG1 VAL 952 0.648 19.515 -11.757 292 3HG1 VAL 952 3HG1 VAL 952 -1.028 19.424 -11.165 293 1HG2 VAL 952 1HG2 VAL 952 -1.770 21.731 -10.390 294 2HG2 VAL 952 2HG2 VAL 952 -1.144 21.776 -8.724 295 3HG2 VAL 952 3HG2 VAL 952 -0.509 22.906 -9.944 296 HA PRO 953 HA PRO 953 1.430 16.489 -10.962 297 1HB PRO 953 1HB PRO 953 4.119 16.368 -11.434 298 2HB PRO 953 2HB PRO 953 2.979 17.072 -12.563 299 1HG PRO 953 1HG PRO 953 4.887 18.435 -10.763 300 2HG PRO 953 2HG PRO 953 4.062 19.071 -12.172 301 1HD PRO 953 1HD PRO 953 3.407 19.579 -9.426 302 2HD PRO 953 2HD PRO 953 2.514 20.119 -10.834 303 H MET 954 H MET 954 3.848 17.469 -8.592 304 HA MET 954 HA MET 954 4.786 15.197 -7.720 305 1HB MET 954 1HB MET 954 5.293 17.275 -6.562 306 2HB MET 954 2HB MET 954 3.615 17.526 -6.123 307 1HG MET 954 1HG MET 954 3.734 16.107 -4.306 308 2HG MET 954 2HG MET 954 4.772 14.962 -5.131 309 1HE MET 954 1HE MET 954 5.354 18.867 -4.844 310 2HE MET 954 2HE MET 954 4.526 18.387 -3.344 311 3HE MET 954 3HE MET 954 6.217 18.939 -3.289 312 H VAL 955 H VAL 955 1.634 16.480 -6.415 313 HA VAL 955 HA VAL 955 1.014 14.093 -5.073 314 HB VAL 955 HB VAL 955 -0.432 16.588 -5.870 315 1HG1 VAL 955 1HG1 VAL 955 -2.393 15.569 -4.469 316 2HG1 VAL 955 2HG1 VAL 955 -2.249 15.181 -6.200 317 3HG1 VAL 955 3HG1 VAL 955 -1.701 14.009 -4.977 318 1HG2 VAL 955 1HG2 VAL 955 -0.114 15.302 -3.145 319 2HG2 VAL 955 2HG2 VAL 955 1.102 16.393 -3.854 320 3HG2 VAL 955 3HG2 VAL 955 -0.544 16.986 -3.528 321 H LYS 956 H LYS 956 0.191 15.398 -8.331 322 HA LYS 956 HA LYS 956 -1.677 13.532 -9.072 323 1HB LYS 956 1HB LYS 956 -0.223 15.615 -10.280 324 2HB LYS 956 2HB LYS 956 0.096 14.204 -11.268 325 1HG LYS 956 1HG LYS 956 -2.192 13.872 -11.781 326 2HG LYS 956 2HG LYS 956 -2.743 14.761 -10.376 327 1HD LYS 956 1HD LYS 956 -3.142 16.177 -12.292 328 2HD LYS 956 2HD LYS 956 -1.793 16.878 -11.421 329 1HE LYS 956 1HE LYS 956 -0.189 16.076 -13.010 330 2HE LYS 956 2HE LYS 956 -1.308 14.909 -13.686 331 1HZ LYS 956 1HZ LYS 956 -2.105 16.438 -15.041 332 2HZ LYS 956 2HZ LYS 956 -2.314 17.545 -13.858 333 3HZ LYS 956 3HZ LYS 956 -0.869 17.413 -14.606 334 H GLU 957 H GLU 957 1.885 13.269 -8.883 335 HA GLU 957 HA GLU 957 2.068 10.893 -10.313 336 1HB GLU 957 1HB GLU 957 3.802 12.518 -8.537 337 2HB GLU 957 2HB GLU 957 4.190 10.809 -8.528 338 1HG GLU 957 1HG GLU 957 5.163 10.968 -10.570 339 2HG GLU 957 2HG GLU 957 3.689 11.612 -11.265 340 H VAL 958 H VAL 958 1.949 11.534 -6.735 341 HA VAL 958 HA VAL 958 2.071 8.941 -5.869 342 HB VAL 958 HB VAL 958 0.538 11.309 -4.783 343 1HG1 VAL 958 1HG1 VAL 958 -0.176 10.098 -3.043 344 2HG1 VAL 958 2HG1 VAL 958 0.277 8.649 -3.973 345 3HG1 VAL 958 3HG1 VAL 958 1.425 9.356 -2.810 346 1HG2 VAL 958 1HG2 VAL 958 2.979 11.636 -5.058 347 2HG2 VAL 958 2HG2 VAL 958 2.477 11.642 -3.350 348 3HG2 VAL 958 3HG2 VAL 958 3.269 10.205 -4.040 349 H GLY 959 H GLY 959 -0.734 10.800 -7.141 350 1HA GLY 959 1HA GLY 959 -2.668 8.801 -6.552 351 2HA GLY 959 2HA GLY 959 -2.839 10.164 -7.640 352 H LEU 960 H LEU 960 -0.554 9.562 -9.374 353 HA LEU 960 HA LEU 960 -1.836 7.817 -11.157 354 1HB LEU 960 1HB LEU 960 -0.564 9.171 -12.375 355 2HB LEU 960 2HB LEU 960 0.550 9.484 -11.060 356 HG LEU 960 HG LEU 960 1.845 7.533 -11.566 357 1HD1 LEU 960 1HD1 LEU 960 0.836 5.703 -12.315 358 2HD1 LEU 960 2HD1 LEU 960 -0.591 6.628 -12.841 359 3HD1 LEU 960 3HD1 LEU 960 0.807 6.452 -13.929 360 1HD2 LEU 960 1HD2 LEU 960 1.408 8.466 -14.350 361 2HD2 LEU 960 2HD2 LEU 960 1.777 9.714 -13.135 362 3HD2 LEU 960 3HD2 LEU 960 2.902 8.358 -13.387 363 H ALA 961 H ALA 961 0.852 7.410 -8.798 364 HA ALA 961 HA ALA 961 1.649 4.876 -9.577 365 1HB ALA 961 1HB ALA 961 1.628 6.334 -6.914 366 2HB ALA 961 2HB ALA 961 2.379 4.734 -7.126 367 3HB ALA 961 3HB ALA 961 2.984 6.130 -8.049 368 H LEU 962 H LEU 962 -1.014 5.964 -7.402 369 HA LEU 962 HA LEU 962 -1.735 3.512 -6.388 370 1HB LEU 962 1HB LEU 962 -2.876 6.166 -6.654 371 2HB LEU 962 2HB LEU 962 -4.109 4.927 -6.784 372 HG LEU 962 HG LEU 962 -4.034 5.524 -4.510 373 1HD1 LEU 962 1HD1 LEU 962 -3.413 2.919 -5.327 374 2HD1 LEU 962 2HD1 LEU 962 -2.355 3.239 -3.932 375 3HD1 LEU 962 3HD1 LEU 962 -4.118 3.431 -3.775 376 1HD2 LEU 962 1HD2 LEU 962 -2.238 6.189 -3.319 377 2HD2 LEU 962 2HD2 LEU 962 -1.171 4.946 -4.016 378 3HD2 LEU 962 3HD2 LEU 962 -1.528 6.429 -4.933 379 H ARG 963 H ARG 963 -2.945 5.147 -9.398 380 HA ARG 963 HA ARG 963 -4.717 3.380 -10.233 381 1HB ARG 963 1HB ARG 963 -3.416 5.490 -11.394 382 2HB ARG 963 2HB ARG 963 -2.721 4.183 -12.331 383 1HG ARG 963 1HG ARG 963 -4.610 4.052 -13.573 384 2HG ARG 963 2HG ARG 963 -5.536 3.655 -12.139 385 1HD ARG 963 1HD ARG 963 -6.614 5.639 -12.447 386 2HD ARG 963 2HD ARG 963 -5.154 6.409 -11.857 387 HE ARG 963 HE ARG 963 -4.800 5.848 -14.638 388 1HH1 ARG 963 2HH2 ARG 963 -6.700 7.939 -12.541 389 2HH1 ARG 963 1HH2 ARG 963 -6.869 9.190 -13.727 390 1HH2 ARG 963 2HH1 ARG 963 -5.022 7.497 -16.203 391 2HH2 ARG 963 1HH1 ARG 963 -5.908 8.937 -15.824 392 H THR 964 H THR 964 -1.170 3.173 -11.061 393 HA THR 964 HA THR 964 -1.348 0.633 -12.242 394 HB THR 964 HB THR 964 0.879 2.356 -11.073 395 HG1 THR 964 HG1 THR 964 1.101 2.727 -13.316 396 1HG2 THR 964 1HG2 THR 964 2.328 0.716 -12.536 397 2HG2 THR 964 2HG2 THR 964 1.905 0.207 -10.884 398 3HG2 THR 964 3HG2 THR 964 1.000 -0.440 -12.274 399 H LEU 965 H LEU 965 -0.803 1.687 -8.861 400 HA LEU 965 HA LEU 965 0.033 -0.730 -7.832 401 1HB LEU 965 1HB LEU 965 -0.019 1.517 -6.725 402 2HB LEU 965 2HB LEU 965 -1.739 1.301 -6.471 403 HG LEU 965 HG LEU 965 0.176 0.656 -4.668 404 1HD1 LEU 965 1HD1 LEU 965 -1.664 -0.943 -3.725 405 2HD1 LEU 965 2HD1 LEU 965 -1.985 0.801 -3.879 406 3HD1 LEU 965 3HD1 LEU 965 -2.624 -0.332 -5.094 407 1HD2 LEU 965 1HD2 LEU 965 -0.512 -1.984 -5.984 408 2HD2 LEU 965 2HD2 LEU 965 1.048 -1.144 -6.151 409 3HD2 LEU 965 3HD2 LEU 965 0.515 -1.719 -4.554 410 H LEU 966 H LEU 966 -3.326 0.536 -8.316 411 HA LEU 966 HA LEU 966 -4.711 -1.522 -7.180 412 1HB LEU 966 1HB LEU 966 -5.258 0.334 -9.466 413 2HB LEU 966 2HB LEU 966 -6.403 -0.936 -9.085 414 HG LEU 966 HG LEU 966 -6.456 -0.021 -6.710 415 1HD1 LEU 966 1HD1 LEU 966 -4.363 1.259 -6.815 416 2HD1 LEU 966 2HD1 LEU 966 -5.095 2.353 -8.013 417 3HD1 LEU 966 3HD1 LEU 966 -5.747 2.281 -6.358 418 1HD2 LEU 966 1HD2 LEU 966 -7.926 0.604 -8.955 419 2HD2 LEU 966 2HD2 LEU 966 -8.343 1.028 -7.277 420 3HD2 LEU 966 3HD2 LEU 966 -7.492 2.204 -8.307 421 H ALA 967 H ALA 967 -3.642 -1.280 -10.646 422 HA ALA 967 HA ALA 967 -4.541 -3.784 -11.402 423 1HB ALA 967 1HB ALA 967 -2.011 -2.865 -12.634 424 2HB ALA 967 2HB ALA 967 -3.591 -3.206 -13.381 425 3HB ALA 967 3HB ALA 967 -3.299 -1.637 -12.591 426 H THR 968 H THR 968 -1.399 -2.737 -9.955 427 HA THR 968 HA THR 968 -0.102 -5.195 -10.141 428 HB THR 968 HB THR 968 0.103 -2.862 -8.169 429 HG1 THR 968 HG1 THR 968 0.491 -2.667 -10.583 430 1HG2 THR 968 1HG2 THR 968 1.279 -4.777 -7.164 431 2HG2 THR 968 2HG2 THR 968 1.997 -5.201 -8.736 432 3HG2 THR 968 3HG2 THR 968 2.489 -3.704 -7.908 433 H VAL 969 H VAL 969 -2.376 -3.924 -7.663 434 HA VAL 969 HA VAL 969 -2.017 -5.957 -5.812 435 HB VAL 969 HB VAL 969 -4.566 -4.465 -6.455 436 1HG1 VAL 969 1HG1 VAL 969 -4.809 -6.340 -4.864 437 2HG1 VAL 969 2HG1 VAL 969 -3.541 -5.623 -3.840 438 3HG1 VAL 969 3HG1 VAL 969 -5.079 -4.761 -4.087 439 1HG2 VAL 969 1HG2 VAL 969 -3.065 -3.297 -4.295 440 2HG2 VAL 969 2HG2 VAL 969 -2.041 -3.387 -5.748 441 3HG2 VAL 969 3HG2 VAL 969 -3.612 -2.554 -5.817 442 H ASP 970 H ASP 970 -4.243 -5.704 -8.654 443 HA ASP 970 HA ASP 970 -5.710 -7.912 -8.289 444 1HB ASP 970 1HB ASP 970 -5.904 -6.318 -10.206 445 2HB ASP 970 2HB ASP 970 -4.437 -6.975 -10.904 446 H GLU 971 H GLU 971 -2.351 -7.619 -9.589 447 HA GLU 971 HA GLU 971 -2.165 -10.366 -10.222 448 1HB GLU 971 1HB GLU 971 -0.844 -8.372 -11.229 449 2HB GLU 971 2HB GLU 971 0.169 -8.465 -9.803 450 1HG GLU 971 1HG GLU 971 0.968 -10.639 -10.348 451 2HG GLU 971 2HG GLU 971 -0.374 -10.970 -11.425 452 H SER 972 H SER 972 -1.765 -8.417 -7.336 453 HA SER 972 HA SER 972 -0.082 -10.343 -6.062 454 1HB SER 972 1HB SER 972 -0.704 -7.613 -5.673 455 2HB SER 972 2HB SER 972 -1.378 -8.420 -4.271 456 HG SER 972 HG SER 972 1.031 -9.530 -4.632 457 H LEU 973 H LEU 973 -3.525 -9.538 -6.351 458 HA LEU 973 HA LEU 973 -4.676 -10.533 -4.153 459 1HB LEU 973 1HB LEU 973 -5.439 -9.946 -6.772 460 2HB LEU 973 2HB LEU 973 -5.979 -11.594 -6.519 461 HG LEU 973 HG LEU 973 -6.945 -9.066 -5.320 462 1HD1 LEU 973 1HD1 LEU 973 -9.019 -9.905 -5.785 463 2HD1 LEU 973 2HD1 LEU 973 -8.055 -10.775 -7.002 464 3HD1 LEU 973 3HD1 LEU 973 -8.532 -11.592 -5.494 465 1HD2 LEU 973 1HD2 LEU 973 -6.364 -11.477 -3.666 466 2HD2 LEU 973 2HD2 LEU 973 -6.369 -9.751 -3.228 467 3HD2 LEU 973 3HD2 LEU 973 -7.907 -10.632 -3.397 468 HA PRO 974 HA PRO 974 -3.991 -14.969 -5.622 469 1HB PRO 974 1HB PRO 974 -2.392 -15.480 -7.779 470 2HB PRO 974 2HB PRO 974 -4.137 -15.362 -7.886 471 1HG PRO 974 1HG PRO 974 -2.091 -13.407 -8.741 472 2HG PRO 974 2HG PRO 974 -3.777 -13.509 -9.211 473 1HD PRO 974 1HD PRO 974 -2.623 -11.658 -7.348 474 2HD PRO 974 2HD PRO 974 -4.324 -11.837 -7.731 475 H VAL 975 H VAL 975 -1.244 -12.865 -6.037 476 HA VAL 975 HA VAL 975 0.780 -14.555 -5.374 477 HB VAL 975 HB VAL 975 0.262 -11.654 -4.759 478 1HG1 VAL 975 1HG1 VAL 975 2.523 -13.384 -3.856 479 2HG1 VAL 975 2HG1 VAL 975 2.917 -11.757 -4.460 480 3HG1 VAL 975 3HG1 VAL 975 1.797 -11.950 -3.090 481 1HG2 VAL 975 1HG2 VAL 975 1.615 -11.191 -6.618 482 2HG2 VAL 975 2HG2 VAL 975 2.334 -12.819 -6.621 483 3HG2 VAL 975 3HG2 VAL 975 0.645 -12.591 -7.135 484 H LEU 976 H LEU 976 -1.866 -13.376 -3.358 485 HA LEU 976 HA LEU 976 -0.554 -14.587 -1.028 486 1HB LEU 976 1HB LEU 976 -2.813 -12.584 -1.117 487 2HB LEU 976 2HB LEU 976 -2.055 -13.231 0.324 488 HG LEU 976 HG LEU 976 -1.163 -11.072 0.032 489 1HD1 LEU 976 1HD1 LEU 976 1.177 -11.433 -0.134 490 2HD1 LEU 976 2HD1 LEU 976 0.474 -12.925 0.534 491 3HD1 LEU 976 3HD1 LEU 976 0.957 -12.857 -1.178 492 1HD2 LEU 976 1HD2 LEU 976 -0.410 -11.708 -2.829 493 2HD2 LEU 976 2HD2 LEU 976 -1.902 -10.858 -2.361 494 3HD2 LEU 976 3HD2 LEU 976 -0.315 -10.141 -1.989 495 HA PRO 977 HA PRO 977 -3.583 -17.658 -1.000 496 1HB PRO 977 1HB PRO 977 -3.804 -18.267 1.655 497 2HB PRO 977 2HB PRO 977 -2.494 -18.845 0.645 498 1HG PRO 977 1HG PRO 977 -2.454 -16.709 2.688 499 2HG PRO 977 2HG PRO 977 -1.106 -17.583 1.986 500 1HD PRO 977 1HD PRO 977 -1.935 -14.910 1.355 501 2HD PRO 977 2HD PRO 977 -0.662 -15.825 0.572 502 H ALA 978 H ALA 978 -5.774 -18.193 -0.866 503 HA ALA 978 HA ALA 978 -7.446 -15.993 -0.746 504 1HB ALA 978 1HB ALA 978 -8.576 -18.669 -0.071 505 2HB ALA 978 2HB ALA 978 -9.058 -17.507 -1.330 506 3HB ALA 978 3HB ALA 978 -7.649 -18.563 -1.587 507 H SER 979 H SER 979 -8.060 -14.745 0.941 508 HA SER 979 HA SER 979 -9.321 -15.444 3.116 509 1HB SER 979 1HB SER 979 -7.862 -16.877 4.187 510 2HB SER 979 2HB SER 979 -6.439 -16.146 3.472 511 HG SER 979 HG SER 979 -6.544 -14.429 4.975 512 H THR 980 H THR 980 -6.802 -13.520 1.604 513 HA THR 980 HA THR 980 -7.610 -11.215 3.255 514 HB THR 980 HB THR 980 -5.238 -11.907 3.596 515 HG1 THR 980 HG1 THR 980 -5.980 -9.595 3.383 516 1HG2 THR 980 1HG2 THR 980 -3.663 -11.509 1.628 517 2HG2 THR 980 2HG2 THR 980 -4.675 -12.963 1.454 518 3HG2 THR 980 3HG2 THR 980 -5.092 -11.477 0.568 519 H HIS 981 H HIS 981 -9.178 -12.156 1.057 520 HA HIS 981 HA HIS 981 -8.438 -10.528 -1.189 521 1HB HIS 981 1HB HIS 981 -11.105 -11.482 -1.425 522 2HB HIS 981 2HB HIS 981 -9.669 -12.011 -2.281 523 HD1 HIS 981 HD1 HIS 981 -11.207 -12.652 1.187 524 HD2 HIS 981 HD2 HIS 981 -9.189 -14.661 -1.892 525 HE1 HIS 981 HE1 HIS 981 -11.059 -15.095 1.906 526 H ARG 982 H ARG 982 -11.625 -10.737 0.522 527 HA ARG 982 HA ARG 982 -12.614 -8.405 -0.159 528 1HB ARG 982 1HB ARG 982 -13.778 -10.018 1.321 529 2HB ARG 982 2HB ARG 982 -12.698 -9.628 2.645 530 1HG ARG 982 1HG ARG 982 -14.695 -8.365 3.055 531 2HG ARG 982 2HG ARG 982 -13.519 -7.204 2.473 532 1HD ARG 982 1HD ARG 982 -15.523 -6.720 1.252 533 2HD ARG 982 2HD ARG 982 -14.496 -7.571 0.115 534 HE ARG 982 HE ARG 982 -16.031 -9.550 1.430 535 1HH1 ARG 982 2HH2 ARG 982 -16.600 -6.786 -0.672 536 2HH1 ARG 982 1HH2 ARG 982 -18.041 -7.449 -1.367 537 1HH2 ARG 982 2HH1 ARG 982 -17.932 -10.425 0.514 538 2HH2 ARG 982 1HH1 ARG 982 -18.804 -9.533 -0.688 539 H GLU 983 H GLU 983 -10.868 -8.776 3.024 540 HA GLU 983 HA GLU 983 -10.692 -6.239 3.750 541 1HB GLU 983 1HB GLU 983 -8.932 -8.617 4.093 542 2HB GLU 983 2HB GLU 983 -8.164 -7.081 4.443 543 1HG GLU 983 1HG GLU 983 -9.836 -6.512 6.104 544 2HG GLU 983 2HG GLU 983 -10.885 -7.822 5.599 545 H ILE 984 H ILE 984 -8.349 -7.879 1.510 546 HA ILE 984 HA ILE 984 -6.710 -5.708 1.068 547 HB ILE 984 HB ILE 984 -7.397 -8.208 -0.387 548 1HG1 ILE 984 1HG1 ILE 984 -4.828 -6.993 0.670 549 2HG1 ILE 984 2HG1 ILE 984 -5.777 -8.252 1.434 550 1HG2 ILE 984 1HG2 ILE 984 -5.609 -7.479 -2.113 551 2HG2 ILE 984 2HG2 ILE 984 -7.287 -6.920 -2.315 552 3HG2 ILE 984 3HG2 ILE 984 -6.059 -5.823 -1.640 553 1HD1 ILE 984 1HD1 ILE 984 -4.178 -9.541 0.331 554 2HD1 ILE 984 2HD1 ILE 984 -5.453 -9.492 -0.910 555 3HD1 ILE 984 3HD1 ILE 984 -4.050 -8.404 -1.032 556 H GLU 985 H GLU 985 -9.671 -6.744 -0.755 557 HA GLU 985 HA GLU 985 -9.598 -4.709 -2.589 558 1HB GLU 985 1HB GLU 985 -11.272 -6.854 -2.009 559 2HB GLU 985 2HB GLU 985 -12.319 -5.481 -1.714 560 1HG GLU 985 1HG GLU 985 -10.643 -5.675 -4.248 561 2HG GLU 985 2HG GLU 985 -12.218 -6.435 -4.138 562 H MET 986 H MET 986 -11.132 -4.848 0.682 563 HA MET 986 HA MET 986 -12.320 -2.333 0.483 564 1HB MET 986 1HB MET 986 -11.571 -4.257 2.711 565 2HB MET 986 2HB MET 986 -12.099 -2.646 3.156 566 1HG MET 986 1HG MET 986 -14.107 -3.146 1.478 567 2HG MET 986 2HG MET 986 -13.656 -4.820 1.730 568 1HE MET 986 1HE MET 986 -14.025 -1.503 3.414 569 2HE MET 986 2HE MET 986 -15.771 -1.849 3.422 570 3HE MET 986 3HE MET 986 -14.865 -1.809 4.953 571 H ALA 987 H ALA 987 -9.040 -3.410 1.242 572 HA ALA 987 HA ALA 987 -8.252 -1.048 2.607 573 1HB ALA 987 1HB ALA 987 -6.461 -2.338 3.027 574 2HB ALA 987 2HB ALA 987 -7.208 -3.616 2.039 575 3HB ALA 987 3HB ALA 987 -6.083 -2.457 1.292 576 H GLN 988 H GLN 988 -8.173 -2.215 -0.800 577 HA GLN 988 HA GLN 988 -6.571 -0.282 -1.848 578 1HB GLN 988 1HB GLN 988 -9.006 -1.649 -3.072 579 2HB GLN 988 2HB GLN 988 -7.853 -0.707 -3.996 580 1HG GLN 988 1HG GLN 988 -6.077 -2.318 -2.781 581 2HG GLN 988 2HG GLN 988 -7.470 -3.372 -2.632 582 1HE2 GLN 988 1HE2 GLN 988 -8.537 -4.129 -4.475 583 2HE2 GLN 988 2HE2 GLN 988 -7.785 -4.173 -6.035 584 H LYS 989 H LYS 989 -10.175 -0.222 -1.413 585 HA LYS 989 HA LYS 989 -10.505 2.349 -2.470 586 1HB LYS 989 1HB LYS 989 -12.214 0.438 -1.993 587 2HB LYS 989 2HB LYS 989 -12.325 1.146 -0.394 588 1HG LYS 989 1HG LYS 989 -12.438 3.204 -2.497 589 2HG LYS 989 2HG LYS 989 -13.695 2.001 -2.706 590 1HD LYS 989 1HD LYS 989 -13.517 2.659 0.111 591 2HD LYS 989 2HD LYS 989 -13.604 4.152 -0.803 592 1HE LYS 989 1HE LYS 989 -15.883 3.539 -0.397 593 2HE LYS 989 2HE LYS 989 -15.595 3.125 -2.075 594 1HZ LYS 989 1HZ LYS 989 -16.329 1.141 -1.463 595 2HZ LYS 989 2HZ LYS 989 -14.867 0.898 -0.778 596 3HZ LYS 989 3HZ LYS 989 -16.121 1.410 0.134 597 H LEU 990 H LEU 990 -9.425 1.135 0.672 598 HA LEU 990 HA LEU 990 -9.959 3.457 2.153 599 1HB LEU 990 1HB LEU 990 -9.134 0.941 2.706 600 2HB LEU 990 2HB LEU 990 -7.615 1.801 2.866 601 HG LEU 990 HG LEU 990 -10.173 2.320 4.400 602 1HD1 LEU 990 1HD1 LEU 990 -7.934 0.604 4.856 603 2HD1 LEU 990 2HD1 LEU 990 -7.919 1.899 6.077 604 3HD1 LEU 990 3HD1 LEU 990 -9.365 0.880 5.878 605 1HD2 LEU 990 1HD2 LEU 990 -9.115 4.454 3.887 606 2HD2 LEU 990 2HD2 LEU 990 -8.946 4.062 5.615 607 3HD2 LEU 990 3HD2 LEU 990 -7.561 3.853 4.516 608 H LEU 991 H LEU 991 -6.929 2.287 0.523 609 HA LEU 991 HA LEU 991 -5.410 4.523 1.111 610 1HB LEU 991 1HB LEU 991 -4.552 2.377 0.300 611 2HB LEU 991 2HB LEU 991 -5.266 2.672 -1.273 612 HG LEU 991 HG LEU 991 -3.700 4.273 -1.855 613 1HD1 LEU 991 1HD1 LEU 991 -2.123 5.257 -0.029 614 2HD1 LEU 991 2HD1 LEU 991 -3.773 5.897 -0.214 615 3HD1 LEU 991 3HD1 LEU 991 -3.406 4.748 1.095 616 1HD2 LEU 991 1HD2 LEU 991 -2.597 2.147 -1.780 617 2HD2 LEU 991 2HD2 LEU 991 -1.457 3.389 -1.209 618 3HD2 LEU 991 3HD2 LEU 991 -2.266 2.319 -0.039 619 H ASN 992 H ASN 992 -7.270 3.783 -1.925 620 HA ASN 992 HA ASN 992 -6.782 6.025 -3.279 621 1HB ASN 992 1HB ASN 992 -8.797 3.972 -3.287 622 2HB ASN 992 2HB ASN 992 -9.645 5.497 -3.444 623 1HD2 ASN 992 1HD2 ASN 992 -8.287 3.066 -5.114 624 2HD2 ASN 992 2HD2 ASN 992 -7.864 3.847 -6.601 625 H SER 993 H SER 993 -9.357 5.499 -0.763 626 HA SER 993 HA SER 993 -10.707 7.768 -0.832 627 1HB SER 993 1HB SER 993 -10.290 5.725 1.049 628 2HB SER 993 2HB SER 993 -9.906 7.184 1.940 629 HG SER 993 HG SER 993 -12.040 7.291 2.189 630 H ASP 994 H ASP 994 -7.879 7.424 1.441 631 HA ASP 994 HA ASP 994 -7.630 10.007 2.101 632 1HB ASP 994 1HB ASP 994 -5.894 7.641 2.034 633 2HB ASP 994 2HB ASP 994 -4.959 9.102 1.786 634 H LEU 995 H LEU 995 -6.315 8.275 -0.790 635 HA LEU 995 HA LEU 995 -4.703 10.276 -1.795 636 1HB LEU 995 1HB LEU 995 -5.946 7.810 -2.732 637 2HB LEU 995 2HB LEU 995 -5.772 8.997 -4.009 638 HG LEU 995 HG LEU 995 -3.883 7.277 -3.604 639 1HD1 LEU 995 1HD1 LEU 995 -2.964 10.147 -3.751 640 2HD1 LEU 995 2HD1 LEU 995 -2.305 8.713 -4.575 641 3HD1 LEU 995 3HD1 LEU 995 -3.881 9.377 -5.069 642 1HD2 LEU 995 1HD2 LEU 995 -3.896 8.524 -1.066 643 2HD2 LEU 995 2HD2 LEU 995 -2.779 7.283 -1.682 644 3HD2 LEU 995 3HD2 LEU 995 -2.385 9.008 -1.873 645 H ALA 996 H ALA 996 -8.126 9.524 -2.778 646 HA ALA 996 HA ALA 996 -8.555 11.628 -4.419 647 1HB ALA 996 1HB ALA 996 -10.781 11.084 -2.545 648 2HB ALA 996 2HB ALA 996 -10.711 10.923 -4.316 649 3HB ALA 996 3HB ALA 996 -10.062 9.631 -3.278 650 H GLU 997 H GLU 997 -8.959 11.600 -0.810 651 HA GLU 997 HA GLU 997 -9.673 14.291 -0.695 652 1HB GLU 997 1HB GLU 997 -9.968 12.399 1.065 653 2HB GLU 997 2HB GLU 997 -8.324 12.756 1.554 654 1HG GLU 997 1HG GLU 997 -9.414 14.228 2.966 655 2HG GLU 997 2HG GLU 997 -9.259 15.284 1.576 656 H LEU 998 H LEU 998 -6.577 12.606 -0.925 657 HA LEU 998 HA LEU 998 -5.028 14.804 0.035 658 1HB LEU 998 1HB LEU 998 -4.179 12.612 0.326 659 2HB LEU 998 2HB LEU 998 -4.385 12.219 -1.369 660 HG LEU 998 HG LEU 998 -2.549 14.473 -0.661 661 1HD1 LEU 998 1HD1 LEU 998 -1.540 11.637 -0.566 662 2HD1 LEU 998 2HD1 LEU 998 -0.751 13.135 -0.018 663 3HD1 LEU 998 3HD1 LEU 998 -2.124 12.466 0.896 664 1HD2 LEU 998 1HD2 LEU 998 -3.169 13.745 -3.024 665 2HD2 LEU 998 2HD2 LEU 998 -1.435 13.901 -2.653 666 3HD2 LEU 998 3HD2 LEU 998 -2.190 12.290 -2.716 667 H ILE 999 H ILE 999 -6.041 13.501 -3.168 668 HA ILE 999 HA ILE 999 -4.484 15.209 -4.715 669 HB ILE 999 HB ILE 999 -7.161 13.938 -5.297 670 1HG1 ILE 999 1HG1 ILE 999 -5.160 12.472 -4.585 671 2HG1 ILE 999 2HG1 ILE 999 -6.045 12.043 -6.036 672 1HG2 ILE 999 1HG2 ILE 999 -7.057 15.384 -7.044 673 2HG2 ILE 999 2HG2 ILE 999 -5.287 15.548 -6.956 674 3HG2 ILE 999 3HG2 ILE 999 -6.011 14.104 -7.702 675 1HD1 ILE 999 1HD1 ILE 999 -3.271 12.510 -5.831 676 2HD1 ILE 999 2HD1 ILE 999 -4.207 12.326 -7.334 677 3HD1 ILE 999 3HD1 ILE 999 -3.913 13.947 -6.662 678 H ASN1000 H ASN1000 -7.847 15.569 -3.422 679 HA ASN1000 HA ASN1000 -8.395 17.960 -4.622 680 1HB ASN1000 1HB ASN1000 -9.846 16.356 -3.079 681 2HB ASN1000 2HB ASN1000 -9.273 17.368 -1.768 682 1HD2 ASN1000 1HD2 ASN1000 -11.457 17.962 -1.430 683 2HD2 ASN1000 2HD2 ASN1000 -12.227 19.183 -2.388 684 H LYS1001 H LYS1001 -6.989 17.239 -1.339 685 HA LYS1001 HA LYS1001 -6.722 19.724 -0.327 686 1HB LYS1001 1HB LYS1001 -5.655 17.144 0.174 687 2HB LYS1001 2HB LYS1001 -4.298 18.253 0.186 688 1HG LYS1001 1HG LYS1001 -4.938 18.679 2.341 689 2HG LYS1001 2HG LYS1001 -6.140 19.722 1.606 690 1HD LYS1001 1HD LYS1001 -7.867 18.336 2.174 691 2HD LYS1001 2HD LYS1001 -7.001 16.897 1.673 692 1HE LYS1001 1HE LYS1001 -6.964 16.457 3.931 693 2HE LYS1001 2HE LYS1001 -5.560 17.505 3.907 694 1HZ LYS1001 1HZ LYS1001 -7.418 18.020 5.525 695 2HZ LYS1001 2HZ LYS1001 -6.799 19.271 4.677 696 3HZ LYS1001 3HZ LYS1001 -8.236 18.625 4.248 697 H MET1002 H MET1002 -4.628 18.146 -2.799 698 HA MET1002 HA MET1002 -2.771 20.228 -2.868 699 1HB MET1002 1HB MET1002 -2.297 17.964 -3.754 700 2HB MET1002 2HB MET1002 -3.602 18.101 -4.916 701 1HG MET1002 1HG MET1002 -2.142 20.339 -5.568 702 2HG MET1002 2HG MET1002 -0.859 19.292 -4.994 703 1HE MET1002 1HE MET1002 -3.195 20.356 -7.381 704 2HE MET1002 2HE MET1002 -2.826 19.449 -8.867 705 3HE MET1002 3HE MET1002 -4.101 18.873 -7.767 706 H LYS1003 H LYS1003 -5.415 19.349 -5.217 707 HA LYS1003 HA LYS1003 -5.217 21.371 -6.960 708 1HB LYS1003 1HB LYS1003 -7.290 19.567 -6.060 709 2HB LYS1003 2HB LYS1003 -7.986 21.125 -6.458 710 1HG LYS1003 1HG LYS1003 -6.560 21.016 -8.636 711 2HG LYS1003 2HG LYS1003 -6.304 19.327 -8.248 712 1HD LYS1003 1HD LYS1003 -8.217 19.137 -9.558 713 2HD LYS1003 2HD LYS1003 -8.960 19.295 -7.979 714 1HE LYS1003 1HE LYS1003 -10.083 21.105 -8.762 715 2HE LYS1003 2HE LYS1003 -8.556 21.963 -8.824 716 1HZ LYS1003 1HZ LYS1003 -8.857 20.234 -11.034 717 2HZ LYS1003 2HZ LYS1003 -10.102 21.286 -10.943 718 3HZ LYS1003 3HZ LYS1003 -8.568 21.841 -11.012 719 H LEU1004 H LEU1004 -6.272 21.578 -3.573 720 HA LEU1004 HA LEU1004 -7.189 24.290 -3.908 721 1HB LEU1004 1HB LEU1004 -6.772 22.752 -1.348 722 2HB LEU1004 2HB LEU1004 -7.752 24.184 -1.593 723 HG LEU1004 HG LEU1004 -8.362 21.594 -3.020 724 1HD1 LEU1004 1HD1 LEU1004 -9.990 22.182 -0.646 725 2HD1 LEU1004 2HD1 LEU1004 -9.321 20.641 -1.236 726 3HD1 LEU1004 3HD1 LEU1004 -8.302 21.748 -0.285 727 1HD2 LEU1004 1HD2 LEU1004 -10.604 22.516 -3.199 728 2HD2 LEU1004 2HD2 LEU1004 -10.111 23.955 -2.274 729 3HD2 LEU1004 3HD2 LEU1004 -9.409 23.645 -3.881 730 H ALA1005 H ALA1005 -4.543 22.620 -2.054 731 HA ALA1005 HA ALA1005 -3.242 24.789 -1.101 732 1HB ALA1005 1HB ALA1005 -2.243 22.861 -0.395 733 2HB ALA1005 2HB ALA1005 -2.497 22.035 -1.952 734 3HB ALA1005 3HB ALA1005 -1.149 23.183 -1.762 735 H GLN1006 H GLN1006 -3.213 23.495 -4.452 736 HA GLN1006 HA GLN1006 -1.118 24.942 -5.427 737 1HB GLN1006 1HB GLN1006 -2.593 23.129 -6.555 738 2HB GLN1006 2HB GLN1006 -3.669 24.437 -7.001 739 1HG GLN1006 1HG GLN1006 -1.090 25.375 -7.700 740 2HG GLN1006 2HG GLN1006 -1.083 23.686 -8.167 741 1HE2 GLN1006 1HE2 GLN1006 -1.591 26.641 -9.302 742 2HE2 GLN1006 2HE2 GLN1006 -2.784 26.373 -10.529 743 H GLN1007 H GLN1007 -4.491 25.935 -4.759 744 HA GLN1007 HA GLN1007 -3.890 28.546 -5.868 745 1HB GLN1007 1HB GLN1007 -6.060 27.207 -6.375 746 2HB GLN1007 2HB GLN1007 -6.566 27.633 -4.752 747 1HG GLN1007 1HG GLN1007 -5.889 30.102 -5.517 748 2HG GLN1007 2HG GLN1007 -6.097 29.445 -7.128 749 1HE2 GLN1007 1HE2 GLN1007 -7.746 31.298 -6.822 750 2HE2 GLN1007 2HE2 GLN1007 -9.354 30.824 -6.385 751 H TYR1008 H TYR1008 -4.417 26.789 -2.839 752 HA TYR1008 HA TYR1008 -4.666 29.243 -1.315 753 1HB TYR1008 1HB TYR1008 -4.672 26.213 -0.882 754 2HB TYR1008 2HB TYR1008 -4.509 27.263 0.512 755 HD1 TYR1008 HD1 TYR1008 -6.364 28.833 1.120 756 HD2 TYR1008 HD2 TYR1008 -6.788 25.918 -1.983 757 HE1 TYR1008 HE1 TYR1008 -8.892 29.086 1.218 758 HE2 TYR1008 HE2 TYR1008 -9.314 26.181 -1.875 759 HH TYR1008 HH TYR1008 -10.988 26.979 -0.673 760 H VAL1009 H VAL1009 -2.185 28.838 -2.874 761 HA VAL1009 HA VAL1009 -0.320 28.642 -0.610 762 HB VAL1009 HB VAL1009 -0.042 26.741 -2.049 763 1HG1 VAL1009 1HG1 VAL1009 0.404 26.884 -4.420 764 2HG1 VAL1009 2HG1 VAL1009 -1.117 27.739 -4.070 765 3HG1 VAL1009 3HG1 VAL1009 0.377 28.662 -4.362 766 1HG2 VAL1009 1HG2 VAL1009 1.969 28.464 -1.326 767 2HG2 VAL1009 2HG2 VAL1009 2.207 26.836 -2.005 768 3HG2 VAL1009 3HG2 VAL1009 2.266 28.262 -3.069 769 H MET1010 H MET1010 -1.009 30.105 -3.850 770 HA MET1010 HA MET1010 1.003 31.997 -3.704 771 1HB MET1010 1HB MET1010 -0.552 33.214 -5.403 772 2HB MET1010 2HB MET1010 -0.062 31.586 -5.829 773 1HG MET1010 1HG MET1010 -2.236 30.941 -5.915 774 2HG MET1010 2HG MET1010 -2.436 31.349 -4.223 775 1HE MET1010 1HE MET1010 -3.933 32.593 -3.468 776 2HE MET1010 2HE MET1010 -3.286 34.249 -3.543 777 3HE MET1010 3HE MET1010 -4.890 33.889 -4.224 778 H THR1011 H THR1011 -1.978 31.726 -1.951 779 HA THR1011 HA THR1011 -2.453 34.508 -1.566 780 HB THR1011 HB THR1011 -3.645 33.082 0.535 781 HG1 THR1011 HG1 THR1011 -4.332 31.145 -0.870 782 1HG2 THR1011 1HG2 THR1011 -5.520 33.785 -0.564 783 2HG2 THR1011 2HG2 THR1011 -4.475 34.339 -1.894 784 3HG2 THR1011 3HG2 THR1011 -5.163 32.698 -1.928 785 H SER1012 H SER1012 -1.643 32.145 1.038 786 HA SER1012 HA SER1012 0.752 33.199 1.751 787 1HB SER1012 1HB SER1012 -0.410 34.447 3.924 788 2HB SER1012 2HB SER1012 0.242 35.274 2.523 789 HG SER1012 HG SER1012 -1.982 35.897 3.067 790 H LEU1013 H LEU1013 -2.435 31.929 2.740 791 HA LEU1013 HA LEU1013 -1.380 30.661 5.091 792 1HB LEU1013 1HB LEU1013 -3.632 29.748 5.304 793 2HB LEU1013 2HB LEU1013 -3.622 31.491 5.126 794 HG LEU1013 HG LEU1013 -3.977 30.772 2.537 795 1HD1 LEU1013 1HD1 LEU1013 -4.598 28.398 4.113 796 2HD1 LEU1013 2HD1 LEU1013 -5.977 28.951 3.133 797 3HD1 LEU1013 3HD1 LEU1013 -4.416 28.596 2.353 798 1HD2 LEU1013 1HD2 LEU1013 -5.495 32.312 3.168 799 2HD2 LEU1013 2HD2 LEU1013 -6.562 30.897 3.326 800 3HD2 LEU1013 3HD2 LEU1013 -5.754 31.567 4.764 801 H GLN1014 H GLN1014 0.346 29.889 3.203 802 HA GLN1014 HA GLN1014 -0.570 27.538 1.891 803 1HB GLN1014 1HB GLN1014 1.123 28.902 0.805 804 2HB GLN1014 2HB GLN1014 2.179 28.812 2.201 805 1HG GLN1014 1HG GLN1014 1.650 26.111 1.566 806 2HG GLN1014 2HG GLN1014 1.831 26.888 0.005 807 1HE2 GLN1014 1HE2 GLN1014 3.339 26.033 3.011 808 2HE2 GLN1014 2HE2 GLN1014 4.981 26.384 2.586 809 H GLN1015 H GLN1015 2.137 28.099 4.266 810 HA GLN1015 HA GLN1015 2.651 25.569 4.909 811 1HB GLN1015 1HB GLN1015 3.051 26.593 7.333 812 2HB GLN1015 2HB GLN1015 4.052 27.074 5.977 813 1HG GLN1015 1HG GLN1015 2.979 29.163 5.741 814 2HG GLN1015 2HG GLN1015 1.505 28.614 6.512 815 1HE2 GLN1015 1HE2 GLN1015 1.634 28.040 8.818 816 2HE2 GLN1015 2HE2 GLN1015 2.644 28.979 9.866 817 H GLU1016 H GLU1016 -0.241 27.424 5.765 818 HA GLU1016 HA GLU1016 -1.062 25.791 7.876 819 1HB GLU1016 1HB GLU1016 -2.029 27.975 7.684 820 2HB GLU1016 2HB GLU1016 -2.510 27.711 6.020 821 1HG GLU1016 1HG GLU1016 -4.452 26.673 6.625 822 2HG GLU1016 2HG GLU1016 -3.652 25.680 7.827 823 H TYR1017 H TYR1017 -2.333 26.005 4.466 824 HA TYR1017 HA TYR1017 -3.838 23.647 4.670 825 1HB TYR1017 1HB TYR1017 -2.866 25.664 2.688 826 2HB TYR1017 2HB TYR1017 -3.083 24.081 1.967 827 HD1 TYR1017 HD1 TYR1017 -5.089 23.876 0.835 828 HD2 TYR1017 HD2 TYR1017 -5.002 26.147 4.460 829 HE1 TYR1017 HE1 TYR1017 -7.583 24.321 0.624 830 HE2 TYR1017 HE2 TYR1017 -7.496 26.585 4.237 831 HH TYR1017 HH TYR1017 -9.118 26.559 1.809 832 H LYS1018 H LYS1018 -0.474 24.324 3.591 833 HA LYS1018 HA LYS1018 0.037 21.880 2.395 834 1HB LYS1018 1HB LYS1018 1.407 24.173 2.696 835 2HB LYS1018 2HB LYS1018 2.213 23.223 3.927 836 1HG LYS1018 1HG LYS1018 3.221 21.846 2.394 837 2HG LYS1018 2HG LYS1018 1.784 21.735 1.398 838 1HD LYS1018 1HD LYS1018 2.569 24.409 1.078 839 2HD LYS1018 2HD LYS1018 4.098 23.555 1.153 840 1HE LYS1018 1HE LYS1018 3.380 22.028 -0.658 841 2HE LYS1018 2HE LYS1018 1.788 22.760 -0.684 842 1HZ LYS1018 1HZ LYS1018 3.084 23.726 -2.380 843 2HZ LYS1018 2HZ LYS1018 2.912 24.871 -1.228 844 3HZ LYS1018 3HZ LYS1018 4.325 24.065 -1.374 845 H LYS1019 H LYS1019 0.138 22.898 5.844 846 HA LYS1019 HA LYS1019 1.344 20.610 6.847 847 1HB LYS1019 1HB LYS1019 0.110 22.982 7.846 848 2HB LYS1019 2HB LYS1019 -0.586 21.624 8.707 849 1HG LYS1019 1HG LYS1019 1.308 21.928 10.007 850 2HG LYS1019 2HG LYS1019 1.974 20.818 8.826 851 1HD LYS1019 1HD LYS1019 2.082 23.827 8.386 852 2HD LYS1019 2HD LYS1019 3.301 23.009 9.343 853 1HE LYS1019 1HE LYS1019 2.583 22.113 6.517 854 2HE LYS1019 2HE LYS1019 3.818 23.316 6.829 855 1HZ LYS1019 1HZ LYS1019 3.993 20.871 8.352 856 2HZ LYS1019 2HZ LYS1019 4.331 20.759 6.758 857 3HZ LYS1019 3HZ LYS1019 5.183 21.782 7.703 858 H GLN1020 H GLN1020 -2.151 21.385 6.299 859 HA GLN1020 HA GLN1020 -3.290 19.224 7.371 860 1HB GLN1020 1HB GLN1020 -3.956 20.593 4.731 861 2HB GLN1020 2HB GLN1020 -5.019 19.432 5.501 862 1HG GLN1020 1HG GLN1020 -3.996 21.939 6.910 863 2HG GLN1020 2HG GLN1020 -5.506 21.893 6.023 864 1HE2 GLN1020 1HE2 GLN1020 -6.067 22.567 8.336 865 2HE2 GLN1020 2HE2 GLN1020 -6.590 21.313 9.409 866 H MET1021 H MET1021 -1.855 19.415 4.042 867 HA MET1021 HA MET1021 -2.475 16.916 3.201 868 1HB MET1021 1HB MET1021 -0.813 19.068 2.397 869 2HB MET1021 2HB MET1021 0.293 17.713 2.506 870 1HG MET1021 1HG MET1021 -2.352 17.597 0.981 871 2HG MET1021 2HG MET1021 -0.825 18.009 0.227 872 1HE MET1021 1HE MET1021 1.305 16.624 0.688 873 2HE MET1021 2HE MET1021 1.052 15.836 2.264 874 3HE MET1021 3HE MET1021 1.330 14.848 0.810 875 H LEU1022 H LEU1022 0.405 17.957 5.139 876 HA LEU1022 HA LEU1022 1.760 15.583 5.195 877 1HB LEU1022 1HB LEU1022 2.635 17.671 6.038 878 2HB LEU1022 2HB LEU1022 1.455 17.692 7.334 879 HG LEU1022 HG LEU1022 3.624 17.039 8.182 880 1HD1 LEU1022 1HD1 LEU1022 1.312 15.839 8.811 881 2HD1 LEU1022 2HD1 LEU1022 2.236 14.413 8.279 882 3HD1 LEU1022 3HD1 LEU1022 2.861 15.439 9.592 883 1HD2 LEU1022 1HD2 LEU1022 3.508 14.811 6.133 884 2HD2 LEU1022 2HD2 LEU1022 4.676 16.153 6.217 885 3HD2 LEU1022 3HD2 LEU1022 4.677 14.891 7.473 886 H THR1023 H THR1023 -0.952 16.678 7.326 887 HA THR1023 HA THR1023 -1.037 14.606 9.089 888 HB THR1023 HB THR1023 -3.535 15.763 7.783 889 HG1 THR1023 HG1 THR1023 -1.638 16.949 9.686 890 1HG2 THR1023 1HG2 THR1023 -4.515 15.343 9.820 891 2HG2 THR1023 2HG2 THR1023 -3.131 14.261 10.112 892 3HG2 THR1023 3HG2 THR1023 -3.092 15.937 10.710 893 H ALA1024 H ALA1024 -2.674 14.665 5.852 894 HA ALA1024 HA ALA1024 -3.667 12.079 6.026 895 1HB ALA1024 1HB ALA1024 -3.131 12.566 3.321 896 2HB ALA1024 2HB ALA1024 -4.623 12.983 4.197 897 3HB ALA1024 3HB ALA1024 -3.323 14.187 4.029 898 H ALA1025 H ALA1025 -0.512 13.352 4.814 899 HA ALA1025 HA ALA1025 0.507 11.074 3.711 900 1HB ALA1025 1HB ALA1025 2.559 12.167 3.829 901 2HB ALA1025 2HB ALA1025 1.428 13.529 4.015 902 3HB ALA1025 3HB ALA1025 2.229 12.836 5.445 903 H HIS1026 H HIS1026 0.067 11.932 7.150 904 HA HIS1026 HA HIS1026 1.707 9.900 8.169 905 1HB HIS1026 1HB HIS1026 0.475 12.058 9.214 906 2HB HIS1026 2HB HIS1026 -0.652 10.820 9.732 907 HD1 HIS1026 HD1 HIS1026 3.192 10.824 9.633 908 HD2 HIS1026 HD2 HIS1026 0.014 10.228 12.305 909 HE1 HIS1026 HE1 HIS1026 4.246 10.174 11.864 910 H ALA1027 H ALA1027 -1.911 10.112 7.842 911 HA ALA1027 HA ALA1027 -2.341 7.449 8.594 912 1HB ALA1027 1HB ALA1027 -4.030 9.283 8.628 913 2HB ALA1027 2HB ALA1027 -4.042 9.276 6.848 914 3HB ALA1027 3HB ALA1027 -4.601 7.846 7.748 915 H LEU1028 H LEU1028 -1.550 9.036 5.493 916 HA LEU1028 HA LEU1028 -2.269 6.999 3.772 917 1HB LEU1028 1HB LEU1028 -0.431 9.314 3.742 918 2HB LEU1028 2HB LEU1028 -0.086 8.056 2.571 919 HG LEU1028 HG LEU1028 -2.551 9.773 2.817 920 1HD1 LEU1028 1HD1 LEU1028 -0.384 9.349 0.792 921 2HD1 LEU1028 2HD1 LEU1028 -1.996 9.878 0.254 922 3HD1 LEU1028 3HD1 LEU1028 -1.082 10.859 1.424 923 1HD2 LEU1028 1HD2 LEU1028 -3.386 8.304 0.841 924 2HD2 LEU1028 2HD2 LEU1028 -2.308 7.068 1.532 925 3HD2 LEU1028 3HD2 LEU1028 -3.628 7.748 2.514 926 H ALA1029 H ALA1029 1.087 7.657 5.014 927 HA ALA1029 HA ALA1029 2.340 5.460 4.151 928 1HB ALA1029 1HB ALA1029 2.555 7.250 6.499 929 2HB ALA1029 2HB ALA1029 3.351 5.670 6.699 930 3HB ALA1029 3HB ALA1029 3.800 6.728 5.340 931 H VAL1030 H VAL1030 0.136 5.658 7.005 932 HA VAL1030 HA VAL1030 0.537 2.966 7.764 933 HB VAL1030 HB VAL1030 -1.434 5.137 8.394 934 1HG1 VAL1030 1HG1 VAL1030 -1.602 2.298 9.463 935 2HG1 VAL1030 2HG1 VAL1030 -2.610 3.682 9.952 936 3HG1 VAL1030 3HG1 VAL1030 -2.734 3.030 8.300 937 1HG2 VAL1030 1HG2 VAL1030 0.859 3.769 9.741 938 2HG2 VAL1030 2HG2 VAL1030 0.418 5.493 9.696 939 3HG2 VAL1030 3HG2 VAL1030 -0.471 4.375 10.757 940 H ASP1031 H ASP1031 -2.070 4.677 5.905 941 HA ASP1031 HA ASP1031 -3.736 2.640 5.477 942 1HB ASP1031 1HB ASP1031 -2.795 4.894 3.682 943 2HB ASP1031 2HB ASP1031 -3.953 3.734 3.062 944 H ALA1032 H ALA1032 -0.804 3.513 3.497 945 HA ALA1032 HA ALA1032 -1.013 1.408 1.681 946 1HB ALA1032 1HB ALA1032 1.305 1.975 1.141 947 2HB ALA1032 2HB ALA1032 0.370 3.465 1.413 948 3HB ALA1032 3HB ALA1032 1.472 2.862 2.675 949 H LYS1033 H LYS1033 0.349 1.646 4.977 950 HA LYS1033 HA LYS1033 1.750 -0.804 4.858 951 1HB LYS1033 1HB LYS1033 0.844 1.019 7.084 952 2HB LYS1033 2HB LYS1033 1.605 -0.521 7.427 953 1HG LYS1033 1HG LYS1033 2.903 1.379 5.453 954 2HG LYS1033 2HG LYS1033 3.089 1.662 7.173 955 1HD LYS1033 1HD LYS1033 3.868 -0.786 7.374 956 2HD LYS1033 2HD LYS1033 3.911 -0.833 5.623 957 1HE LYS1033 1HE LYS1033 5.314 1.502 6.129 958 2HE LYS1033 2HE LYS1033 5.751 0.535 7.524 959 1HZ LYS1033 1HZ LYS1033 6.551 0.227 4.843 960 2HZ LYS1033 2HZ LYS1033 7.162 -0.473 6.186 961 3HZ LYS1033 3HZ LYS1033 5.906 -1.164 5.405 962 H ASN1034 H ASN1034 -1.414 0.127 6.390 963 HA ASN1034 HA ASN1034 -2.131 -2.308 7.272 964 1HB ASN1034 1HB ASN1034 -3.367 0.151 7.051 965 2HB ASN1034 2HB ASN1034 -4.312 -0.772 5.900 966 1HD2 ASN1034 1HD2 ASN1034 -6.025 -0.317 7.449 967 2HD2 ASN1034 2HD2 ASN1034 -6.276 -1.379 8.794 968 H LEU1035 H LEU1035 -1.840 -1.134 3.965 969 HA LEU1035 HA LEU1035 -3.639 -2.897 2.717 970 1HB LEU1035 1HB LEU1035 -1.799 -0.842 1.997 971 2HB LEU1035 2HB LEU1035 -1.463 -2.242 0.999 972 HG LEU1035 HG LEU1035 -3.011 -0.771 -0.129 973 1HD1 LEU1035 1HD1 LEU1035 -3.311 -3.074 -0.653 974 2HD1 LEU1035 2HD1 LEU1035 -4.256 -3.357 0.828 975 3HD1 LEU1035 3HD1 LEU1035 -4.931 -2.356 -0.480 976 1HD2 LEU1035 1HD2 LEU1035 -4.079 0.479 1.518 977 2HD2 LEU1035 2HD2 LEU1035 -5.377 -0.557 0.879 978 3HD2 LEU1035 3HD2 LEU1035 -4.594 -0.963 2.424 979 H LEU1036 H LEU1036 -0.002 -3.011 2.737 980 HA LEU1036 HA LEU1036 -0.006 -5.729 1.952 981 1HB LEU1036 1HB LEU1036 1.791 -3.655 1.966 982 2HB LEU1036 2HB LEU1036 2.411 -4.682 3.244 983 HG LEU1036 HG LEU1036 1.988 -6.545 1.315 984 1HD1 LEU1036 1HD1 LEU1036 2.089 -5.812 -0.808 985 2HD1 LEU1036 2HD1 LEU1036 1.455 -4.300 -0.114 986 3HD1 LEU1036 3HD1 LEU1036 3.201 -4.480 -0.413 987 1HD2 LEU1036 1HD2 LEU1036 4.123 -5.535 2.683 988 2HD2 LEU1036 2HD2 LEU1036 4.204 -6.840 1.475 989 3HD2 LEU1036 3HD2 LEU1036 4.569 -5.164 1.000 990 H ASP1037 H ASP1037 0.295 -3.984 5.083 991 HA ASP1037 HA ASP1037 1.174 -5.793 6.750 992 1HB ASP1037 1HB ASP1037 0.096 -3.540 7.285 993 2HB ASP1037 2HB ASP1037 -1.466 -4.331 7.219 994 H VAL1038 H VAL1038 -2.267 -5.629 5.556 995 HA VAL1038 HA VAL1038 -3.133 -7.939 6.872 996 HB VAL1038 HB VAL1038 -4.281 -5.916 5.496 997 1HG1 VAL1038 1HG1 VAL1038 -3.713 -6.734 3.297 998 2HG1 VAL1038 2HG1 VAL1038 -4.385 -8.339 3.670 999 3HG1 VAL1038 3HG1 VAL1038 -5.465 -6.931 3.541 1000 1HG2 VAL1038 1HG2 VAL1038 -6.020 -6.733 6.625 1001 2HG2 VAL1038 2HG2 VAL1038 -6.150 -8.095 5.488 1002 3HG2 VAL1038 3HG2 VAL1038 -5.107 -8.231 6.924 1003 H ILE1039 H ILE1039 -1.890 -7.379 3.514 1004 HA ILE1039 HA ILE1039 -2.206 -9.959 2.595 1005 HB ILE1039 HB ILE1039 -0.487 -7.632 1.915 1006 1HG1 ILE1039 1HG1 ILE1039 -2.141 -9.277 0.022 1007 2HG1 ILE1039 2HG1 ILE1039 -2.940 -8.217 1.166 1008 1HG2 ILE1039 1HG2 ILE1039 0.223 -10.440 1.314 1009 2HG2 ILE1039 2HG2 ILE1039 0.242 -9.319 -0.069 1010 3HG2 ILE1039 3HG2 ILE1039 1.235 -8.977 1.369 1011 1HD1 ILE1039 1HD1 ILE1039 -0.760 -7.348 -0.789 1012 2HD1 ILE1039 2HD1 ILE1039 -2.505 -7.072 -1.002 1013 3HD1 ILE1039 3HD1 ILE1039 -1.637 -6.282 0.336 1014 H ASP1040 H ASP1040 0.510 -8.466 4.450 1015 HA ASP1040 HA ASP1040 2.274 -10.502 4.325 1016 1HB ASP1040 1HB ASP1040 1.687 -8.267 6.139 1017 2HB ASP1040 2HB ASP1040 2.361 -9.624 7.019 1018 H GLN1041 H GLN1041 -0.693 -10.128 6.318 1019 HA GLN1041 HA GLN1041 -0.160 -12.317 7.992 1020 1HB GLN1041 1HB GLN1041 -2.205 -10.300 7.676 1021 2HB GLN1041 2HB GLN1041 -2.988 -11.864 7.798 1022 1HG GLN1041 1HG GLN1041 -1.966 -12.338 9.923 1023 2HG GLN1041 2HG GLN1041 -0.783 -11.059 9.734 1024 1HE2 GLN1041 1HE2 GLN1041 -4.219 -11.754 10.128 1025 2HE2 GLN1041 2HE2 GLN1041 -4.672 -10.271 10.899 1026 H ALA1042 H ALA1042 -1.366 -11.964 4.721 1027 HA ALA1042 HA ALA1042 -2.705 -14.515 4.712 1028 1HB ALA1042 1HB ALA1042 -3.314 -13.944 2.493 1029 2HB ALA1042 2HB ALA1042 -3.320 -12.396 3.372 1030 3HB ALA1042 3HB ALA1042 -1.948 -12.816 2.318 1031 H ARG1043 H ARG1043 0.202 -13.060 3.077 1032 HA ARG1043 HA ARG1043 1.137 -15.130 1.765 1033 1HB ARG1043 1HB ARG1043 2.232 -12.829 2.148 1034 2HB ARG1043 2HB ARG1043 2.941 -13.489 3.608 1035 1HG ARG1043 1HG ARG1043 4.128 -15.217 2.318 1036 2HG ARG1043 2HG ARG1043 3.316 -14.731 0.843 1037 1HD ARG1043 1HD ARG1043 4.786 -13.023 0.480 1038 2HD ARG1043 2HD ARG1043 4.631 -12.436 2.123 1039 HE ARG1043 HE ARG1043 6.747 -14.126 1.100 1040 1HH1 ARG1043 2HH2 ARG1043 4.855 -13.472 3.994 1041 2HH1 ARG1043 1HH2 ARG1043 6.079 -14.042 5.079 1042 1HH2 ARG1043 2HH1 ARG1043 8.363 -14.879 2.531 1043 2HH2 ARG1043 1HH1 ARG1043 8.088 -14.847 4.241 1044 H LEU1044 H LEU1044 1.563 -14.593 5.326 1045 HA LEU1044 HA LEU1044 3.108 -16.889 5.768 1046 1HB LEU1044 1HB LEU1044 2.518 -16.531 8.128 1047 2HB LEU1044 2HB LEU1044 3.135 -15.100 7.326 1048 HG LEU1044 HG LEU1044 0.579 -14.541 6.990 1049 1HD1 LEU1044 1HD1 LEU1044 -0.810 -16.042 7.868 1050 2HD1 LEU1044 2HD1 LEU1044 0.504 -16.865 8.743 1051 3HD1 LEU1044 3HD1 LEU1044 -0.295 -15.447 9.465 1052 1HD2 LEU1044 1HD2 LEU1044 2.330 -14.147 9.391 1053 2HD2 LEU1044 2HD2 LEU1044 1.787 -12.976 8.166 1054 3HD2 LEU1044 3HD2 LEU1044 0.654 -13.548 9.414 1055 H LYS1045 H LYS1045 -0.448 -16.253 5.979 1056 HA LYS1045 HA LYS1045 -1.340 -18.566 7.005 1057 1HB LYS1045 1HB LYS1045 -2.722 -16.636 6.290 1058 2HB LYS1045 2HB LYS1045 -2.528 -17.121 4.618 1059 1HG LYS1045 1HG LYS1045 -3.953 -18.936 4.825 1060 2HG LYS1045 2HG LYS1045 -3.470 -19.269 6.476 1061 1HD LYS1045 1HD LYS1045 -4.834 -17.429 7.328 1062 2HD LYS1045 2HD LYS1045 -5.162 -16.849 5.707 1063 1HE LYS1045 1HE LYS1045 -7.120 -18.079 6.416 1064 2HE LYS1045 2HE LYS1045 -6.312 -19.067 5.215 1065 1HZ LYS1045 1HZ LYS1045 -6.930 -20.328 7.160 1066 2HZ LYS1045 2HZ LYS1045 -5.306 -20.320 6.987 1067 3HZ LYS1045 3HZ LYS1045 -6.012 -19.380 8.122 1068 H MET1046 H MET1046 0.280 -18.101 3.897 1069 HA MET1046 HA MET1046 -0.474 -20.735 3.030 1070 1HB MET1046 1HB MET1046 -0.332 -19.222 1.208 1071 2HB MET1046 2HB MET1046 1.026 -18.357 1.901 1072 1HG MET1046 1HG MET1046 2.552 -20.223 1.373 1073 2HG MET1046 2HG MET1046 1.213 -21.212 0.825 1074 1HE MET1046 1HE MET1046 1.964 -17.110 -0.784 1075 2HE MET1046 2HE MET1046 2.544 -17.808 0.747 1076 3HE MET1046 3HE MET1046 3.537 -17.940 -0.724 1077 H ILE1047 H ILE1047 2.531 -18.931 3.965 1078 HA ILE1047 HA ILE1047 4.394 -20.852 3.573 1079 HB ILE1047 HB ILE1047 4.058 -18.649 5.550 1080 1HG1 ILE1047 1HG1 ILE1047 6.520 -18.822 3.985 1081 2HG1 ILE1047 2HG1 ILE1047 5.090 -18.881 2.973 1082 1HG2 ILE1047 1HG2 ILE1047 6.438 -19.171 6.327 1083 2HG2 ILE1047 2HG2 ILE1047 5.117 -20.152 7.005 1084 3HG2 ILE1047 3HG2 ILE1047 6.148 -20.817 5.716 1085 1HD1 ILE1047 1HD1 ILE1047 4.209 -16.828 4.094 1086 2HD1 ILE1047 2HD1 ILE1047 5.680 -16.763 5.093 1087 3HD1 ILE1047 3HD1 ILE1047 5.791 -16.543 3.330 1088 H SER1048 H SER1048 2.909 -20.327 6.846 1089 HA SER1048 HA SER1048 3.609 -22.986 7.546 1090 1HB SER1048 1HB SER1048 3.016 -20.589 8.919 1091 2HB SER1048 2HB SER1048 1.717 -21.677 9.362 1092 HG SER1048 HG SER1048 3.808 -21.703 10.675 1093 H GLN1049 H GLN1049 2.341 -24.063 5.775 1094 HA GLN1049 HA GLN1049 -0.096 -24.983 6.784 1095 1HB GLN1049 1HB GLN1049 -0.319 -22.601 5.245 1096 2HB GLN1049 2HB GLN1049 -0.858 -23.894 4.192 1097 1HG GLN1049 1HG GLN1049 -1.856 -23.611 7.059 1098 2HG GLN1049 2HG GLN1049 -2.647 -22.816 5.713 1099 1HE2 GLN1049 1HE2 GLN1049 -4.457 -24.134 6.462 1100 2HE2 GLN1049 2HE2 GLN1049 -4.650 -25.747 5.859 1101 H SER1050 H SER1050 1.311 -24.334 3.484 1102 HA SER1050 HA SER1050 2.319 -26.898 3.213 1103 1HB SER1050 1HB SER1050 -0.305 -27.218 3.095 1104 2HB SER1050 2HB SER1050 -0.137 -26.571 1.474 1105 HG SER1050 HG SER1050 1.346 -28.843 2.494 1106 H ARG1051 H ARG1051 4.090 -25.690 2.368 1107 HA ARG1051 HA ARG1051 3.666 -23.813 0.315 1108 1HB ARG1051 1HB ARG1051 5.668 -24.185 2.094 1109 2HB ARG1051 2HB ARG1051 6.370 -25.083 0.762 1110 1HG ARG1051 1HG ARG1051 5.297 -22.246 0.438 1111 2HG ARG1051 2HG ARG1051 6.959 -22.578 0.884 1112 1HD ARG1051 1HD ARG1051 6.309 -24.243 -1.387 1113 2HD ARG1051 2HD ARG1051 5.779 -22.612 -1.749 1114 HE ARG1051 HE ARG1051 8.024 -21.866 -1.693 1115 1HH1 ARG1051 2HH2 ARG1051 7.802 -25.188 -0.554 1116 2HH1 ARG1051 1HH2 ARG1051 9.513 -25.453 -0.602 1117 1HH2 ARG1051 2HH1 ARG1051 10.281 -22.215 -1.756 1118 2HH2 ARG1051 1HH1 ARG1051 10.933 -23.751 -1.290 1119 HA PRO1052 HA PRO1052 3.664 -26.856 -2.871 1120 1HB PRO1052 1HB PRO1052 3.107 -25.186 -4.961 1121 2HB PRO1052 2HB PRO1052 1.869 -25.882 -3.935 1122 1HG PRO1052 1HG PRO1052 2.907 -23.115 -3.969 1123 2HG PRO1052 2HG PRO1052 1.416 -23.719 -3.275 1124 1HD PRO1052 1HD PRO1052 3.808 -23.014 -1.857 1125 2HD PRO1052 2HD PRO1052 2.358 -23.726 -1.178 1126 H HIS1053 H HIS1053 4.848 -23.985 -4.495 1127 HA HIS1053 HA HIS1053 6.982 -25.469 -5.589 1128 1HB HIS1053 1HB HIS1053 5.970 -22.678 -5.706 1129 2HB HIS1053 2HB HIS1053 7.672 -22.893 -6.065 1130 HD1 HIS1053 HD1 HIS1053 4.419 -24.659 -7.122 1131 HD2 HIS1053 HD2 HIS1053 8.055 -23.313 -8.724 1132 HE1 HIS1053 HE1 HIS1053 4.340 -25.185 -9.618 Start of MODEL 2 1 H MET 915 H MET 915 17.065 -20.913 -14.264 2 HA MET 915 HA MET 915 17.062 -20.205 -12.067 3 1HB MET 915 1HB MET 915 17.841 -17.829 -12.270 4 2HB MET 915 2HB MET 915 18.484 -18.810 -13.572 5 1HG MET 915 1HG MET 915 15.850 -17.404 -14.028 6 2HG MET 915 2HG MET 915 17.313 -16.440 -14.055 7 1HE MET 915 1HE MET 915 19.121 -17.332 -17.176 8 2HE MET 915 2HE MET 915 18.726 -16.137 -15.917 9 3HE MET 915 3HE MET 915 19.596 -17.629 -15.487 10 H ALA 916 H ALA 916 16.410 -17.761 -10.892 11 HA ALA 916 HA ALA 916 13.803 -18.170 -10.075 12 1HB ALA 916 1HB ALA 916 14.061 -15.821 -9.144 13 2HB ALA 916 2HB ALA 916 15.368 -16.951 -8.715 14 3HB ALA 916 3HB ALA 916 15.625 -15.737 -9.990 15 H ASN 917 H ASN 917 12.006 -18.101 -11.331 16 HA ASN 917 HA ASN 917 12.003 -16.392 -13.621 17 1HB ASN 917 1HB ASN 917 9.635 -17.396 -13.890 18 2HB ASN 917 2HB ASN 917 10.960 -18.542 -13.942 19 1HD2 ASN 917 1HD2 ASN 917 8.602 -17.023 -11.780 20 2HD2 ASN 917 2HD2 ASN 917 8.396 -18.356 -10.693 21 H LEU 918 H LEU 918 10.711 -14.483 -13.836 22 HA LEU 918 HA LEU 918 9.835 -13.318 -11.366 23 1HB LEU 918 1HB LEU 918 9.866 -12.341 -14.222 24 2HB LEU 918 2HB LEU 918 9.283 -11.387 -12.873 25 HG LEU 918 HG LEU 918 11.723 -12.032 -11.916 26 1HD1 LEU 918 1HD1 LEU 918 11.836 -12.525 -14.824 27 2HD1 LEU 918 2HD1 LEU 918 13.123 -11.479 -14.178 28 3HD1 LEU 918 3HD1 LEU 918 12.883 -13.111 -13.509 29 1HD2 LEU 918 1HD2 LEU 918 12.081 -9.821 -12.021 30 2HD2 LEU 918 2HD2 LEU 918 11.844 -9.759 -13.784 31 3HD2 LEU 918 3HD2 LEU 918 10.435 -9.757 -12.697 32 H ASP 919 H ASP 919 8.223 -15.089 -10.934 33 HA ASP 919 HA ASP 919 5.872 -14.833 -12.604 34 1HB ASP 919 1HB ASP 919 6.655 -17.116 -12.071 35 2HB ASP 919 2HB ASP 919 6.601 -16.766 -10.355 36 H ARG 920 H ARG 920 6.654 -15.196 -9.052 37 HA ARG 920 HA ARG 920 4.281 -13.727 -8.423 38 1HB ARG 920 1HB ARG 920 6.034 -15.628 -7.078 39 2HB ARG 920 2HB ARG 920 5.841 -14.211 -6.065 40 1HG ARG 920 1HG ARG 920 3.295 -14.420 -6.508 41 2HG ARG 920 2HG ARG 920 3.642 -15.998 -7.187 42 1HD ARG 920 1HD ARG 920 4.780 -15.361 -4.464 43 2HD ARG 920 2HD ARG 920 3.060 -15.680 -4.575 44 HE ARG 920 HE ARG 920 4.262 -17.744 -6.040 45 1HH1 ARG 920 2HH2 ARG 920 4.458 -16.564 -2.705 46 2HH1 ARG 920 1HH2 ARG 920 4.845 -18.118 -2.046 47 1HH2 ARG 920 1HH1 ARG 920 5.025 -20.003 -3.515 48 H SER 921 H SER 921 4.998 -11.639 -9.380 49 HA SER 921 HA SER 921 7.335 -10.410 -8.422 50 1HB SER 921 1HB SER 921 5.121 -8.706 -9.485 51 2HB SER 921 2HB SER 921 6.821 -8.718 -9.910 52 HG SER 921 HG SER 921 4.679 -10.245 -10.962 53 H ASN 922 H ASN 922 6.472 -11.115 -6.063 54 HA ASN 922 HA ASN 922 4.484 -9.511 -4.938 55 1HB ASN 922 1HB ASN 922 5.350 -10.392 -2.767 56 2HB ASN 922 2HB ASN 922 5.203 -11.679 -3.947 57 1HD2 ASN 922 1HD2 ASN 922 7.216 -10.063 -1.793 58 2HD2 ASN 922 2HD2 ASN 922 8.744 -10.756 -2.224 59 H ASP 923 H ASP 923 7.859 -9.047 -5.753 60 HA ASP 923 HA ASP 923 8.430 -7.135 -3.764 61 1HB ASP 923 1HB ASP 923 9.737 -8.298 -6.158 62 2HB ASP 923 2HB ASP 923 10.160 -6.618 -5.899 63 H LYS 924 H LYS 924 7.038 -7.179 -7.050 64 HA LYS 924 HA LYS 924 7.369 -4.434 -7.607 65 1HB LYS 924 1HB LYS 924 7.000 -6.209 -9.306 66 2HB LYS 924 2HB LYS 924 5.359 -6.410 -8.727 67 1HG LYS 924 1HG LYS 924 4.628 -4.544 -9.817 68 2HG LYS 924 2HG LYS 924 5.980 -3.581 -9.256 69 1HD LYS 924 1HD LYS 924 7.083 -3.819 -11.230 70 2HD LYS 924 2HD LYS 924 6.894 -5.561 -11.204 71 1HE LYS 924 1HE LYS 924 4.607 -5.364 -12.138 72 2HE LYS 924 2HE LYS 924 4.702 -3.615 -12.072 73 1HZ LYS 924 1HZ LYS 924 6.194 -5.435 -13.800 74 2HZ LYS 924 2HZ LYS 924 5.289 -4.142 -14.218 75 3HZ LYS 924 3HZ LYS 924 6.748 -3.925 -13.517 76 H VAL 925 H VAL 925 4.639 -6.392 -6.253 77 HA VAL 925 HA VAL 925 2.902 -4.216 -5.969 78 HB VAL 925 HB VAL 925 2.998 -6.734 -4.305 79 1HG1 VAL 925 1HG1 VAL 925 1.298 -4.562 -4.161 80 2HG1 VAL 925 2HG1 VAL 925 0.402 -5.696 -5.198 81 3HG1 VAL 925 3HG1 VAL 925 0.940 -6.205 -3.580 82 1HG2 VAL 925 1HG2 VAL 925 1.208 -6.912 -6.561 83 2HG2 VAL 925 2HG2 VAL 925 2.862 -6.570 -7.123 84 3HG2 VAL 925 3HG2 VAL 925 2.547 -7.988 -6.093 85 H TYR 926 H TYR 926 5.430 -5.644 -3.847 86 HA TYR 926 HA TYR 926 4.774 -3.980 -1.632 87 1HB TYR 926 1HB TYR 926 7.036 -5.801 -2.593 88 2HB TYR 926 2HB TYR 926 7.290 -4.839 -1.150 89 HD1 TYR 926 HD1 TYR 926 4.074 -6.422 -2.164 90 HD2 TYR 926 HD2 TYR 926 7.437 -6.561 0.477 91 HE1 TYR 926 HE1 TYR 926 2.914 -8.202 -0.769 92 HE2 TYR 926 HE2 TYR 926 6.265 -8.341 1.863 93 HH TYR 926 HH TYR 926 3.427 -8.861 2.097 94 H GLU 927 H GLU 927 6.708 -3.632 -4.564 95 HA GLU 927 HA GLU 927 8.430 -1.666 -3.567 96 1HB GLU 927 1HB GLU 927 7.609 -2.630 -6.305 97 2HB GLU 927 2HB GLU 927 8.513 -1.134 -6.184 98 1HG GLU 927 1HG GLU 927 9.570 -3.420 -4.563 99 2HG GLU 927 2HG GLU 927 9.682 -3.609 -6.302 100 H ASN 928 H ASN 928 5.681 -1.314 -5.934 101 HA ASN 928 HA ASN 928 5.522 1.334 -6.006 102 1HB ASN 928 1HB ASN 928 3.050 -0.444 -5.694 103 2HB ASN 928 2HB ASN 928 3.140 1.073 -6.565 104 1HD2 ASN 928 1HD2 ASN 928 4.857 1.163 -8.301 105 2HD2 ASN 928 2HD2 ASN 928 5.012 -0.210 -9.345 106 H VAL 929 H VAL 929 3.747 -0.819 -3.651 107 HA VAL 929 HA VAL 929 2.427 0.972 -2.160 108 HB VAL 929 HB VAL 929 3.996 -1.462 -1.306 109 1HG1 VAL 929 1HG1 VAL 929 2.025 -1.233 0.565 110 2HG1 VAL 929 2HG1 VAL 929 3.704 -0.689 0.797 111 3HG1 VAL 929 3HG1 VAL 929 2.451 0.477 0.309 112 1HG2 VAL 929 1HG2 VAL 929 1.983 -2.669 -1.552 113 2HG2 VAL 929 2HG2 VAL 929 1.002 -1.186 -1.636 114 3HG2 VAL 929 3HG2 VAL 929 2.070 -1.624 -2.991 115 H THR 930 H THR 930 5.857 -0.041 -1.482 116 HA THR 930 HA THR 930 6.230 2.012 0.434 117 HB THR 930 HB THR 930 8.711 1.254 -0.034 118 HG1 THR 930 HG1 THR 930 8.792 -0.487 -1.505 119 1HG2 THR 930 1HG2 THR 930 6.510 -0.713 0.773 120 2HG2 THR 930 2HG2 THR 930 8.245 -1.088 0.898 121 3HG2 THR 930 3HG2 THR 930 7.549 0.238 1.861 122 H GLY 931 H GLY 931 7.719 1.635 -2.858 123 1HA GLY 931 1HA GLY 931 8.982 3.945 -3.184 124 2HA GLY 931 2HA GLY 931 8.004 3.237 -4.454 125 H LEU 932 H LEU 932 5.381 3.563 -3.422 126 HA LEU 932 HA LEU 932 5.000 6.324 -3.995 127 1HB LEU 932 1HB LEU 932 2.951 5.685 -4.523 128 2HB LEU 932 2HB LEU 932 3.545 4.048 -4.326 129 HG LEU 932 HG LEU 932 2.762 4.125 -1.933 130 1HD1 LEU 932 1HD1 LEU 932 2.384 6.181 -1.126 131 2HD1 LEU 932 2HD1 LEU 932 2.091 6.874 -2.739 132 3HD1 LEU 932 3HD1 LEU 932 0.786 6.011 -1.891 133 1HD2 LEU 932 1HD2 LEU 932 0.969 3.046 -2.671 134 2HD2 LEU 932 2HD2 LEU 932 0.232 4.555 -3.261 135 3HD2 LEU 932 3HD2 LEU 932 1.345 3.641 -4.306 136 H VAL 933 H VAL 933 4.506 4.221 -1.081 137 HA VAL 933 HA VAL 933 3.568 6.169 0.612 138 HB VAL 933 HB VAL 933 4.812 3.527 0.794 139 1HG1 VAL 933 1HG1 VAL 933 6.394 4.344 2.293 140 2HG1 VAL 933 2HG1 VAL 933 5.287 5.571 2.955 141 3HG1 VAL 933 3HG1 VAL 933 5.063 3.854 3.368 142 1HG2 VAL 933 1HG2 VAL 933 2.599 3.291 1.164 143 2HG2 VAL 933 2HG2 VAL 933 3.013 3.725 2.840 144 3HG2 VAL 933 3HG2 VAL 933 2.407 4.970 1.722 145 H LYS 934 H LYS 934 6.999 5.183 -0.036 146 HA LYS 934 HA LYS 934 8.203 6.921 1.720 147 1HB LYS 934 1HB LYS 934 9.175 5.933 -0.978 148 2HB LYS 934 2HB LYS 934 10.185 6.699 0.231 149 1HG LYS 934 1HG LYS 934 8.720 4.634 1.579 150 2HG LYS 934 2HG LYS 934 9.312 3.934 0.086 151 1HD LYS 934 1HD LYS 934 11.274 3.634 1.211 152 2HD LYS 934 2HD LYS 934 11.540 5.343 0.930 153 1HE LYS 934 1HE LYS 934 11.659 5.533 3.201 154 2HE LYS 934 2HE LYS 934 9.912 5.398 3.181 155 1HZ LYS 934 1HZ LYS 934 10.145 3.524 4.280 156 2HZ LYS 934 2HZ LYS 934 10.913 2.841 3.012 157 3HZ LYS 934 3HZ LYS 934 11.774 3.583 4.184 158 H ALA 935 H ALA 935 7.040 7.477 -1.648 159 HA ALA 935 HA ALA 935 8.043 10.113 -1.787 160 1HB ALA 935 1HB ALA 935 6.941 10.183 -3.865 161 2HB ALA 935 2HB ALA 935 7.306 8.454 -3.655 162 3HB ALA 935 3HB ALA 935 5.664 9.062 -3.333 163 H VAL 936 H VAL 936 4.791 8.699 -1.028 164 HA VAL 936 HA VAL 936 3.272 10.878 -0.784 165 HB VAL 936 HB VAL 936 3.502 8.372 0.837 166 1HG1 VAL 936 1HG1 VAL 936 2.703 9.713 2.567 167 2HG1 VAL 936 2HG1 VAL 936 1.769 10.756 1.467 168 3HG1 VAL 936 3HG1 VAL 936 1.205 9.105 1.821 169 1HG2 VAL 936 1HG2 VAL 936 1.380 7.838 -0.224 170 2HG2 VAL 936 2HG2 VAL 936 1.296 9.464 -0.942 171 3HG2 VAL 936 3HG2 VAL 936 2.564 8.328 -1.460 172 H ILE 937 H ILE 937 5.810 9.807 1.538 173 HA ILE 937 HA ILE 937 5.257 12.066 3.246 174 HB ILE 937 HB ILE 937 7.252 9.808 3.333 175 1HG1 ILE 937 1HG1 ILE 937 5.761 9.628 5.589 176 2HG1 ILE 937 2HG1 ILE 937 4.577 10.334 4.508 177 1HG2 ILE 937 1HG2 ILE 937 7.103 11.183 5.827 178 2HG2 ILE 937 2HG2 ILE 937 8.513 10.924 4.772 179 3HG2 ILE 937 3HG2 ILE 937 7.493 12.367 4.557 180 1HD1 ILE 937 1HD1 ILE 937 6.192 8.098 3.355 181 2HD1 ILE 937 2HD1 ILE 937 5.054 7.657 4.651 182 3HD1 ILE 937 3HD1 ILE 937 4.459 8.458 3.178 183 H GLU 938 H GLU 938 8.207 10.849 1.495 184 HA GLU 938 HA GLU 938 9.844 12.859 1.748 185 1HB GLU 938 1HB GLU 938 9.397 10.839 -0.243 186 2HB GLU 938 2HB GLU 938 9.801 12.318 -1.090 187 1HG GLU 938 1HG GLU 938 11.977 11.862 -0.622 188 2HG GLU 938 2HG GLU 938 11.623 12.307 1.036 189 H MET 939 H MET 939 6.884 12.931 -0.279 190 HA MET 939 HA MET 939 7.341 15.218 -1.673 191 1HB MET 939 1HB MET 939 5.280 13.467 -1.456 192 2HB MET 939 2HB MET 939 4.610 14.733 -0.446 193 1HG MET 939 1HG MET 939 5.407 16.268 -2.546 194 2HG MET 939 2HG MET 939 5.172 14.756 -3.400 195 1HE MET 939 1HE MET 939 1.919 13.890 -1.312 196 2HE MET 939 2HE MET 939 2.003 13.552 -3.057 197 3HE MET 939 3HE MET 939 3.422 13.259 -2.025 198 H SER 940 H SER 940 5.297 15.077 1.339 199 HA SER 940 HA SER 940 4.991 17.674 1.766 200 1HB SER 940 1HB SER 940 5.733 15.779 4.029 201 2HB SER 940 2HB SER 940 4.671 17.169 4.115 202 HG SER 940 HG SER 940 3.866 14.730 3.763 203 H SER 941 H SER 941 7.983 15.798 2.152 204 HA SER 941 HA SER 941 9.330 17.659 3.737 205 1HB SER 941 1HB SER 941 9.875 15.149 3.114 206 2HB SER 941 2HB SER 941 10.729 15.848 1.753 207 HG SER 941 HG SER 941 11.311 17.107 4.188 208 H LYS 942 H LYS 942 9.125 17.095 0.168 209 HA LYS 942 HA LYS 942 10.578 19.613 -0.216 210 1HB LYS 942 1HB LYS 942 10.821 18.725 -2.590 211 2HB LYS 942 2HB LYS 942 11.736 17.910 -1.339 212 1HG LYS 942 1HG LYS 942 10.528 15.960 -1.531 213 2HG LYS 942 2HG LYS 942 9.008 16.800 -1.762 214 1HD LYS 942 1HD LYS 942 10.547 17.399 -4.077 215 2HD LYS 942 2HD LYS 942 10.826 15.696 -3.769 216 1HE LYS 942 1HE LYS 942 8.037 16.085 -3.350 217 2HE LYS 942 2HE LYS 942 8.421 17.009 -4.789 218 1HZ LYS 942 1HZ LYS 942 7.915 14.511 -4.957 219 2HZ LYS 942 2HZ LYS 942 9.103 15.146 -5.881 220 3HZ LYS 942 3HZ LYS 942 9.478 14.311 -4.528 221 H ILE 943 H ILE 943 7.671 19.170 0.604 222 HA ILE 943 HA ILE 943 6.311 20.133 -1.782 223 HB ILE 943 HB ILE 943 5.562 18.333 0.060 224 1HG1 ILE 943 1HG1 ILE 943 4.517 19.249 -2.190 225 2HG1 ILE 943 2HG1 ILE 943 3.591 18.258 -1.081 226 1HG2 ILE 943 1HG2 ILE 943 3.782 19.413 1.467 227 2HG2 ILE 943 2HG2 ILE 943 5.456 19.788 1.944 228 3HG2 ILE 943 3HG2 ILE 943 4.496 20.988 1.046 229 1HD1 ILE 943 1HD1 ILE 943 2.315 20.059 -0.301 230 2HD1 ILE 943 2HD1 ILE 943 3.576 21.253 -0.689 231 3HD1 ILE 943 3HD1 ILE 943 2.591 20.544 -1.991 232 H GLN 944 H GLN 944 6.880 21.083 1.675 233 HA GLN 944 HA GLN 944 5.650 23.421 1.770 234 1HB GLN 944 1HB GLN 944 7.846 22.180 3.138 235 2HB GLN 944 2HB GLN 944 8.287 23.855 2.872 236 1HG GLN 944 1HG GLN 944 5.936 24.468 3.773 237 2HG GLN 944 2HG GLN 944 5.803 22.798 4.286 238 1HE2 GLN 944 1HE2 GLN 944 7.636 21.937 5.587 239 2HE2 GLN 944 2HE2 GLN 944 8.344 22.959 6.793 240 HA PRO 945 HA PRO 945 9.176 25.587 -0.545 241 1HB PRO 945 1HB PRO 945 11.168 24.120 -1.706 242 2HB PRO 945 2HB PRO 945 11.315 24.848 -0.118 243 1HG PRO 945 1HG PRO 945 10.880 22.010 -0.823 244 2HG PRO 945 2HG PRO 945 11.445 22.691 0.689 245 1HD PRO 945 1HD PRO 945 8.816 21.686 0.136 246 2HD PRO 945 2HD PRO 945 9.349 22.472 1.608 247 H ALA 946 H ALA 946 8.877 22.447 -2.144 248 HA ALA 946 HA ALA 946 8.856 23.075 -4.696 249 1HB ALA 946 1HB ALA 946 6.732 21.477 -4.787 250 2HB ALA 946 2HB ALA 946 8.319 20.865 -4.260 251 3HB ALA 946 3HB ALA 946 7.083 21.291 -3.052 252 HA PRO 947 HA PRO 947 5.926 26.259 -5.181 253 1HB PRO 947 1HB PRO 947 6.212 26.634 -7.873 254 2HB PRO 947 2HB PRO 947 7.271 27.368 -6.686 255 1HG PRO 947 1HG PRO 947 7.801 25.077 -8.477 256 2HG PRO 947 2HG PRO 947 8.947 26.081 -7.610 257 1HD PRO 947 1HD PRO 947 8.117 23.426 -6.910 258 2HD PRO 947 2HD PRO 947 9.172 24.473 -5.982 259 HA PRO 948 HA PRO 948 2.281 24.666 -6.679 260 1HB PRO 948 1HB PRO 948 1.023 26.694 -8.009 261 2HB PRO 948 2HB PRO 948 1.050 26.566 -6.261 262 1HG PRO 948 1HG PRO 948 2.577 28.397 -8.010 263 2HG PRO 948 2HG PRO 948 2.265 28.526 -6.290 264 1HD PRO 948 1HD PRO 948 4.713 27.694 -7.532 265 2HD PRO 948 2HD PRO 948 4.362 27.714 -5.815 266 H GLU 949 H GLU 949 4.469 25.864 -8.989 267 HA GLU 949 HA GLU 949 2.994 24.707 -11.154 268 1HB GLU 949 1HB GLU 949 5.238 26.556 -10.828 269 2HB GLU 949 2HB GLU 949 5.608 25.339 -12.034 270 1HG GLU 949 1HG GLU 949 2.972 26.869 -12.035 271 2HG GLU 949 2HG GLU 949 4.396 27.470 -12.860 272 H GLU 950 H GLU 950 5.239 23.674 -8.747 273 HA GLU 950 HA GLU 950 5.999 21.415 -10.427 274 1HB GLU 950 1HB GLU 950 7.574 23.126 -8.806 275 2HB GLU 950 2HB GLU 950 7.487 21.616 -7.920 276 1HG GLU 950 1HG GLU 950 9.304 21.164 -9.309 277 2HG GLU 950 2HG GLU 950 8.004 20.524 -10.294 278 H TYR 951 H TYR 951 3.780 22.366 -8.118 279 HA TYR 951 HA TYR 951 3.879 19.894 -6.584 280 1HB TYR 951 1HB TYR 951 3.465 22.267 -5.648 281 2HB TYR 951 2HB TYR 951 1.995 22.335 -6.599 282 HD1 TYR 951 HD1 TYR 951 2.956 19.161 -5.036 283 HD2 TYR 951 HD2 TYR 951 0.668 22.745 -4.566 284 HE1 TYR 951 HE1 TYR 951 1.665 18.094 -3.123 285 HE2 TYR 951 HE2 TYR 951 -0.615 21.666 -2.655 286 HH TYR 951 HH TYR 951 -0.218 19.879 -1.005 287 H VAL 952 H VAL 952 1.933 21.584 -9.078 288 HA VAL 952 HA VAL 952 -0.346 20.047 -8.979 289 HB VAL 952 HB VAL 952 1.038 21.790 -10.888 290 1HG1 VAL 952 1HG1 VAL 952 -0.625 21.069 -12.737 291 2HG1 VAL 952 2HG1 VAL 952 0.856 20.108 -12.507 292 3HG1 VAL 952 3HG1 VAL 952 -0.696 19.520 -11.863 293 1HG2 VAL 952 1HG2 VAL 952 -1.434 21.650 -9.406 294 2HG2 VAL 952 2HG2 VAL 952 -0.682 23.042 -10.220 295 3HG2 VAL 952 3HG2 VAL 952 -1.773 21.965 -11.124 296 HA PRO 953 HA PRO 953 1.943 16.968 -11.757 297 1HB PRO 953 1HB PRO 953 4.661 17.120 -11.991 298 2HB PRO 953 2HB PRO 953 3.558 17.813 -13.163 299 1HG PRO 953 1HG PRO 953 5.173 19.184 -11.101 300 2HG PRO 953 2HG PRO 953 4.413 19.859 -12.529 301 1HD PRO 953 1HD PRO 953 3.486 20.080 -9.823 302 2HD PRO 953 2HD PRO 953 2.667 20.655 -11.262 303 H MET 954 H MET 954 4.166 17.919 -9.183 304 HA MET 954 HA MET 954 5.162 15.639 -8.404 305 1HB MET 954 1HB MET 954 4.337 18.115 -7.113 306 2HB MET 954 2HB MET 954 4.033 16.795 -6.001 307 1HG MET 954 1HG MET 954 6.294 16.234 -5.813 308 2HG MET 954 2HG MET 954 6.680 16.778 -7.434 309 1HE MET 954 1HE MET 954 4.934 19.761 -4.720 310 2HE MET 954 2HE MET 954 4.740 17.996 -4.598 311 3HE MET 954 3HE MET 954 5.969 18.826 -3.614 312 H VAL 955 H VAL 955 2.045 16.684 -6.842 313 HA VAL 955 HA VAL 955 1.435 14.213 -5.792 314 HB VAL 955 HB VAL 955 -0.179 16.621 -6.582 315 1HG1 VAL 955 1HG1 VAL 955 -1.918 15.143 -6.810 316 2HG1 VAL 955 2HG1 VAL 955 -1.185 13.937 -5.724 317 3HG1 VAL 955 3HG1 VAL 955 -1.967 15.386 -5.047 318 1HG2 VAL 955 1HG2 VAL 955 -0.446 16.793 -4.101 319 2HG2 VAL 955 2HG2 VAL 955 0.638 15.392 -3.930 320 3HG2 VAL 955 3HG2 VAL 955 1.243 16.902 -4.652 321 H LYS 956 H LYS 956 0.285 15.701 -8.901 322 HA LYS 956 HA LYS 956 -1.335 13.795 -9.831 323 1HB LYS 956 1HB LYS 956 0.668 15.581 -11.164 324 2HB LYS 956 2HB LYS 956 -0.147 14.369 -12.132 325 1HG LYS 956 1HG LYS 956 -1.632 16.328 -10.322 326 2HG LYS 956 2HG LYS 956 -1.309 16.648 -12.015 327 1HD LYS 956 1HD LYS 956 -3.052 15.347 -12.664 328 2HD LYS 956 2HD LYS 956 -2.443 13.982 -11.749 329 1HE LYS 956 1HE LYS 956 -3.796 14.416 -9.923 330 2HE LYS 956 2HE LYS 956 -3.680 16.154 -10.109 331 1HZ LYS 956 1HZ LYS 956 -5.868 15.333 -10.644 332 2HZ LYS 956 2HZ LYS 956 -5.185 16.010 -11.964 333 3HZ LYS 956 3HZ LYS 956 -5.272 14.385 -11.833 334 H GLU 957 H GLU 957 2.183 13.540 -9.385 335 HA GLU 957 HA GLU 957 2.440 11.208 -10.932 336 1HB GLU 957 1HB GLU 957 4.188 13.006 -9.811 337 2HB GLU 957 2HB GLU 957 4.372 11.659 -8.706 338 1HG GLU 957 1HG GLU 957 4.483 11.268 -11.724 339 2HG GLU 957 2HG GLU 957 5.908 11.712 -10.806 340 H VAL 958 H VAL 958 2.442 11.773 -7.333 341 HA VAL 958 HA VAL 958 2.554 9.188 -6.507 342 HB VAL 958 HB VAL 958 1.972 11.727 -5.430 343 1HG1 VAL 958 1HG1 VAL 958 -0.417 11.076 -5.451 344 2HG1 VAL 958 2HG1 VAL 958 -0.021 9.645 -4.469 345 3HG1 VAL 958 3HG1 VAL 958 0.217 11.278 -3.800 346 1HG2 VAL 958 1HG2 VAL 958 3.483 9.591 -4.769 347 2HG2 VAL 958 2HG2 VAL 958 3.096 10.907 -3.634 348 3HG2 VAL 958 3HG2 VAL 958 2.159 9.394 -3.596 349 H GLY 959 H GLY 959 -0.307 11.036 -7.682 350 1HA GLY 959 1HA GLY 959 -2.287 9.184 -7.067 351 2HA GLY 959 2HA GLY 959 -2.330 10.350 -8.375 352 H LEU 960 H LEU 960 -0.118 9.457 -9.957 353 HA LEU 960 HA LEU 960 -1.354 7.444 -11.437 354 1HB LEU 960 1HB LEU 960 0.749 9.238 -11.740 355 2HB LEU 960 2HB LEU 960 1.517 7.667 -11.851 356 HG LEU 960 HG LEU 960 -0.844 8.563 -13.528 357 1HD1 LEU 960 1HD1 LEU 960 2.024 9.015 -13.810 358 2HD1 LEU 960 2HD1 LEU 960 1.320 8.177 -15.214 359 3HD1 LEU 960 3HD1 LEU 960 0.653 9.740 -14.684 360 1HD2 LEU 960 1HD2 LEU 960 -0.540 6.563 -14.808 361 2HD2 LEU 960 2HD2 LEU 960 0.909 6.118 -13.874 362 3HD2 LEU 960 3HD2 LEU 960 -0.691 6.108 -13.094 363 H ALA 961 H ALA 961 1.342 7.366 -9.035 364 HA ALA 961 HA ALA 961 2.099 4.754 -9.319 365 1HB ALA 961 1HB ALA 961 1.851 6.453 -6.804 366 2HB ALA 961 2HB ALA 961 2.794 4.948 -6.928 367 3HB ALA 961 3HB ALA 961 3.253 6.369 -7.897 368 H LEU 962 H LEU 962 -0.436 6.052 -7.053 369 HA LEU 962 HA LEU 962 -1.280 3.655 -6.050 370 1HB LEU 962 1HB LEU 962 -2.775 6.211 -6.618 371 2HB LEU 962 2HB LEU 962 -3.493 4.860 -5.764 372 HG LEU 962 HG LEU 962 -0.896 5.714 -4.667 373 1HD1 LEU 962 1HD1 LEU 962 -2.392 7.817 -5.515 374 2HD1 LEU 962 2HD1 LEU 962 -3.037 7.583 -3.872 375 3HD1 LEU 962 3HD1 LEU 962 -1.294 7.855 -4.114 376 1HD2 LEU 962 1HD2 LEU 962 -3.165 5.786 -2.870 377 2HD2 LEU 962 2HD2 LEU 962 -3.149 4.285 -3.826 378 3HD2 LEU 962 3HD2 LEU 962 -1.728 4.736 -2.855 379 H ARG 963 H ARG 963 -2.434 5.354 -9.037 380 HA ARG 963 HA ARG 963 -4.389 3.664 -9.746 381 1HB ARG 963 1HB ARG 963 -3.068 5.773 -10.946 382 2HB ARG 963 2HB ARG 963 -2.579 4.456 -11.993 383 1HG ARG 963 1HG ARG 963 -4.574 4.719 -13.052 384 2HG ARG 963 2HG ARG 963 -5.312 3.974 -11.649 385 1HD ARG 963 1HD ARG 963 -6.505 6.005 -11.832 386 2HD ARG 963 2HD ARG 963 -5.305 6.385 -10.613 387 HE ARG 963 HE ARG 963 -4.251 7.850 -12.119 388 1HH1 ARG 963 2HH2 ARG 963 -6.540 5.818 -13.855 389 2HH1 ARG 963 1HH2 ARG 963 -6.411 6.714 -15.332 390 1HH2 ARG 963 2HH1 ARG 963 -4.080 9.033 -14.067 391 2HH2 ARG 963 1HH1 ARG 963 -5.002 8.555 -15.453 392 H THR 964 H THR 964 -0.915 3.424 -10.837 393 HA THR 964 HA THR 964 -1.227 0.922 -12.072 394 HB THR 964 HB THR 964 1.139 2.527 -10.995 395 HG1 THR 964 HG1 THR 964 1.257 2.924 -13.300 396 1HG2 THR 964 1HG2 THR 964 2.582 1.043 -12.353 397 2HG2 THR 964 2HG2 THR 964 1.758 0.078 -11.105 398 3HG2 THR 964 3HG2 THR 964 1.176 0.041 -12.786 399 H LEU 965 H LEU 965 -0.404 1.872 -8.714 400 HA LEU 965 HA LEU 965 0.387 -0.669 -7.873 401 1HB LEU 965 1HB LEU 965 0.949 1.228 -6.585 402 2HB LEU 965 2HB LEU 965 -0.721 1.745 -6.457 403 HG LEU 965 HG LEU 965 0.196 -0.865 -5.254 404 1HD1 LEU 965 1HD1 LEU 965 1.234 1.635 -4.521 405 2HD1 LEU 965 2HD1 LEU 965 -0.003 1.254 -3.299 406 3HD1 LEU 965 3HD1 LEU 965 1.324 0.109 -3.610 407 1HD2 LEU 965 1HD2 LEU 965 -2.209 0.905 -5.026 408 2HD2 LEU 965 2HD2 LEU 965 -2.098 -0.865 -5.184 409 3HD2 LEU 965 3HD2 LEU 965 -1.719 -0.084 -3.630 410 H LEU 966 H LEU 966 -2.816 0.869 -8.279 411 HA LEU 966 HA LEU 966 -4.315 -0.954 -6.830 412 1HB LEU 966 1HB LEU 966 -4.807 1.315 -8.203 413 2HB LEU 966 2HB LEU 966 -5.464 0.143 -9.329 414 HG LEU 966 HG LEU 966 -6.295 -0.179 -6.496 415 1HD1 LEU 966 1HD1 LEU 966 -8.140 1.673 -7.388 416 2HD1 LEU 966 2HD1 LEU 966 -6.855 1.958 -6.189 417 3HD1 LEU 966 3HD1 LEU 966 -6.583 2.368 -7.900 418 1HD2 LEU 966 1HD2 LEU 966 -8.523 -0.154 -8.137 419 2HD2 LEU 966 2HD2 LEU 966 -7.248 -0.836 -9.175 420 3HD2 LEU 966 3HD2 LEU 966 -7.616 -1.590 -7.605 421 H ALA 967 H ALA 967 -3.471 -0.953 -10.363 422 HA ALA 967 HA ALA 967 -4.709 -3.375 -10.935 423 1HB ALA 967 1HB ALA 967 -4.079 -1.899 -12.707 424 2HB ALA 967 2HB ALA 967 -2.381 -1.868 -12.175 425 3HB ALA 967 3HB ALA 967 -3.063 -3.348 -12.890 426 H THR 968 H THR 968 -1.386 -2.585 -9.772 427 HA THR 968 HA THR 968 -0.260 -5.096 -10.013 428 HB THR 968 HB THR 968 0.180 -3.045 -7.781 429 HG1 THR 968 HG1 THR 968 1.283 -3.329 -10.486 430 1HG2 THR 968 1HG2 THR 968 2.623 -3.764 -8.323 431 2HG2 THR 968 2HG2 THR 968 1.638 -4.930 -7.407 432 3HG2 THR 968 3HG2 THR 968 1.900 -5.163 -9.152 433 H VAL 969 H VAL 969 -2.318 -3.771 -7.367 434 HA VAL 969 HA VAL 969 -2.041 -5.888 -5.619 435 HB VAL 969 HB VAL 969 -4.579 -4.328 -6.085 436 1HG1 VAL 969 1HG1 VAL 969 -3.292 -5.506 -3.600 437 2HG1 VAL 969 2HG1 VAL 969 -4.759 -4.499 -3.612 438 3HG1 VAL 969 3HG1 VAL 969 -4.761 -6.085 -4.421 439 1HG2 VAL 969 1HG2 VAL 969 -1.922 -3.324 -5.427 440 2HG2 VAL 969 2HG2 VAL 969 -3.412 -2.437 -5.826 441 3HG2 VAL 969 3HG2 VAL 969 -3.108 -2.958 -4.152 442 H ASP 970 H ASP 970 -4.304 -5.432 -8.400 443 HA ASP 970 HA ASP 970 -5.904 -7.551 -8.056 444 1HB ASP 970 1HB ASP 970 -5.919 -5.852 -9.951 445 2HB ASP 970 2HB ASP 970 -4.622 -6.753 -10.711 446 H GLU 971 H GLU 971 -2.583 -7.446 -9.502 447 HA GLU 971 HA GLU 971 -2.581 -10.190 -10.147 448 1HB GLU 971 1HB GLU 971 -0.511 -7.988 -10.081 449 2HB GLU 971 2HB GLU 971 0.015 -9.648 -10.276 450 1HG GLU 971 1HG GLU 971 -1.999 -9.621 -12.112 451 2HG GLU 971 2HG GLU 971 -1.571 -7.922 -12.151 452 H SER 972 H SER 972 -2.029 -8.331 -7.243 453 HA SER 972 HA SER 972 -0.400 -10.360 -6.049 454 1HB SER 972 1HB SER 972 -0.554 -7.683 -5.649 455 2HB SER 972 2HB SER 972 -1.671 -8.198 -4.401 456 HG SER 972 HG SER 972 0.529 -9.809 -4.296 457 H LEU 973 H LEU 973 -3.798 -9.420 -6.291 458 HA LEU 973 HA LEU 973 -4.947 -10.368 -4.056 459 1HB LEU 973 1HB LEU 973 -5.746 -9.683 -6.633 460 2HB LEU 973 2HB LEU 973 -6.346 -11.316 -6.422 461 HG LEU 973 HG LEU 973 -7.209 -8.793 -5.158 462 1HD1 LEU 973 1HD1 LEU 973 -8.597 -11.431 -5.705 463 2HD1 LEU 973 2HD1 LEU 973 -9.381 -9.927 -5.164 464 3HD1 LEU 973 3HD1 LEU 973 -8.597 -9.998 -6.761 465 1HD2 LEU 973 1HD2 LEU 973 -6.511 -9.532 -3.100 466 2HD2 LEU 973 2HD2 LEU 973 -8.131 -10.264 -3.184 467 3HD2 LEU 973 3HD2 LEU 973 -6.690 -11.250 -3.528 468 HA PRO 974 HA PRO 974 -4.506 -14.805 -5.620 469 1HB PRO 974 1HB PRO 974 -2.935 -15.350 -7.788 470 2HB PRO 974 2HB PRO 974 -4.672 -15.144 -7.892 471 1HG PRO 974 1HG PRO 974 -2.532 -13.275 -8.708 472 2HG PRO 974 2HG PRO 974 -4.220 -13.283 -9.178 473 1HD PRO 974 1HD PRO 974 -2.976 -11.531 -7.278 474 2HD PRO 974 2HD PRO 974 -4.684 -11.617 -7.663 475 H VAL 975 H VAL 975 -1.629 -12.873 -6.065 476 HA VAL 975 HA VAL 975 0.281 -14.684 -5.396 477 HB VAL 975 HB VAL 975 -0.062 -11.746 -4.888 478 1HG1 VAL 975 1HG1 VAL 975 2.614 -12.130 -4.456 479 2HG1 VAL 975 2HG1 VAL 975 1.399 -11.892 -3.177 480 3HG1 VAL 975 3HG1 VAL 975 1.913 -13.537 -3.622 481 1HG2 VAL 975 1HG2 VAL 975 2.228 -12.253 -6.409 482 2HG2 VAL 975 2HG2 VAL 975 1.040 -13.451 -6.976 483 3HG2 VAL 975 3HG2 VAL 975 0.641 -11.716 -7.011 484 H LEU 976 H LEU 976 -2.164 -13.147 -3.310 485 HA LEU 976 HA LEU 976 -0.998 -14.594 -1.037 486 1HB LEU 976 1HB LEU 976 -2.895 -12.248 -0.961 487 2HB LEU 976 2HB LEU 976 -2.084 -13.002 0.397 488 HG LEU 976 HG LEU 976 -0.917 -11.005 -0.002 489 1HD1 LEU 976 1HD1 LEU 976 0.448 -13.175 0.206 490 2HD1 LEU 976 2HD1 LEU 976 0.816 -12.946 -1.521 491 3HD1 LEU 976 3HD1 LEU 976 1.284 -11.701 -0.338 492 1HD2 LEU 976 1HD2 LEU 976 -0.246 -10.128 -2.090 493 2HD2 LEU 976 2HD2 LEU 976 -0.568 -11.664 -2.930 494 3HD2 LEU 976 3HD2 LEU 976 -1.921 -10.689 -2.311 495 HA PRO 977 HA PRO 977 -4.508 -17.112 -1.114 496 1HB PRO 977 1HB PRO 977 -4.400 -18.185 1.397 497 2HB PRO 977 2HB PRO 977 -3.425 -18.768 0.063 498 1HG PRO 977 1HG PRO 977 -2.605 -17.115 2.373 499 2HG PRO 977 2HG PRO 977 -1.603 -18.050 1.281 500 1HD PRO 977 1HD PRO 977 -1.961 -15.204 1.270 501 2HD PRO 977 2HD PRO 977 -1.051 -16.151 0.109 502 H ALA 978 H ALA 978 -6.381 -17.840 0.671 503 HA ALA 978 HA ALA 978 -8.049 -15.615 0.644 504 1HB ALA 978 1HB ALA 978 -8.475 -18.211 0.885 505 2HB ALA 978 2HB ALA 978 -8.389 -17.858 2.627 506 3HB ALA 978 3HB ALA 978 -9.607 -17.047 1.613 507 H SER 979 H SER 979 -9.221 -15.235 3.083 508 HA SER 979 HA SER 979 -8.973 -14.483 5.145 509 1HB SER 979 1HB SER 979 -6.600 -15.855 4.977 510 2HB SER 979 2HB SER 979 -6.001 -14.219 5.167 511 HG SER 979 HG SER 979 -7.651 -14.131 7.032 512 H THR 980 H THR 980 -6.602 -13.302 2.686 513 HA THR 980 HA THR 980 -7.270 -10.552 3.510 514 HB THR 980 HB THR 980 -4.865 -11.314 3.802 515 HG1 THR 980 HG1 THR 980 -5.710 -9.380 1.773 516 1HG2 THR 980 1HG2 THR 980 -3.500 -11.489 1.713 517 2HG2 THR 980 2HG2 THR 980 -4.680 -12.818 1.811 518 3HG2 THR 980 3HG2 THR 980 -4.991 -11.429 0.741 519 H HIS 981 H HIS 981 -9.115 -11.998 1.945 520 HA HIS 981 HA HIS 981 -8.581 -11.288 -0.790 521 1HB HIS 981 1HB HIS 981 -10.669 -12.823 0.690 522 2HB HIS 981 2HB HIS 981 -11.131 -12.110 -0.843 523 HD1 HIS 981 HD1 HIS 981 -11.355 -14.798 -1.436 524 HD2 HIS 981 HD2 HIS 981 -7.486 -13.222 -1.051 525 HE1 HIS 981 HE1 HIS 981 -9.789 -16.461 -2.573 526 H ARG 982 H ARG 982 -11.655 -10.748 1.013 527 HA ARG 982 HA ARG 982 -12.263 -8.475 -0.361 528 1HB ARG 982 1HB ARG 982 -13.938 -9.706 0.943 529 2HB ARG 982 2HB ARG 982 -13.088 -9.380 2.441 530 1HG ARG 982 1HG ARG 982 -13.748 -6.922 0.921 531 2HG ARG 982 2HG ARG 982 -15.165 -7.842 1.385 532 1HD ARG 982 1HD ARG 982 -13.843 -7.956 3.749 533 2HD ARG 982 2HD ARG 982 -13.128 -6.479 3.134 534 HE ARG 982 HE ARG 982 -15.198 -5.388 3.364 535 1HH1 ARG 982 2HH2 ARG 982 -15.651 -8.864 3.669 536 2HH1 ARG 982 1HH2 ARG 982 -17.295 -8.732 4.198 537 1HH2 ARG 982 2HH1 ARG 982 -17.367 -5.213 4.062 538 2HH2 ARG 982 1HH1 ARG 982 -18.278 -6.642 4.422 539 H GLU 983 H GLU 983 -10.865 -8.805 2.986 540 HA GLU 983 HA GLU 983 -10.687 -6.269 3.732 541 1HB GLU 983 1HB GLU 983 -9.587 -8.639 4.591 542 2HB GLU 983 2HB GLU 983 -8.141 -7.765 4.127 543 1HG GLU 983 1HG GLU 983 -8.369 -6.206 5.813 544 2HG GLU 983 2HG GLU 983 -10.116 -6.155 5.677 545 H ILE 984 H ILE 984 -8.514 -7.921 1.375 546 HA ILE 984 HA ILE 984 -6.751 -5.747 1.085 547 HB ILE 984 HB ILE 984 -7.140 -8.390 0.003 548 1HG1 ILE 984 1HG1 ILE 984 -4.696 -6.599 -0.014 549 2HG1 ILE 984 2HG1 ILE 984 -5.233 -7.506 1.386 550 1HG2 ILE 984 1HG2 ILE 984 -6.576 -6.176 -1.965 551 2HG2 ILE 984 2HG2 ILE 984 -5.970 -7.832 -2.208 552 3HG2 ILE 984 3HG2 ILE 984 -7.720 -7.533 -2.096 553 1HD1 ILE 984 1HD1 ILE 984 -4.116 -9.309 0.598 554 2HD1 ILE 984 2HD1 ILE 984 -5.232 -9.356 -0.787 555 3HD1 ILE 984 3HD1 ILE 984 -3.712 -8.436 -0.900 556 H GLU 985 H GLU 985 -9.725 -6.800 -0.671 557 HA GLU 985 HA GLU 985 -9.568 -4.882 -2.650 558 1HB GLU 985 1HB GLU 985 -11.234 -6.986 -2.080 559 2HB GLU 985 2HB GLU 985 -12.293 -5.643 -1.700 560 1HG GLU 985 1HG GLU 985 -10.745 -5.381 -4.249 561 2HG GLU 985 2HG GLU 985 -11.954 -6.649 -4.229 562 H MET 986 H MET 986 -10.834 -4.775 0.696 563 HA MET 986 HA MET 986 -12.083 -2.262 0.327 564 1HB MET 986 1HB MET 986 -11.834 -4.323 2.370 565 2HB MET 986 2HB MET 986 -11.459 -2.777 3.105 566 1HG MET 986 1HG MET 986 -13.791 -2.515 1.358 567 2HG MET 986 2HG MET 986 -14.043 -3.816 2.505 568 1HE MET 986 1HE MET 986 -13.102 -3.608 4.887 569 2HE MET 986 2HE MET 986 -11.918 -2.282 4.989 570 3HE MET 986 3HE MET 986 -13.435 -2.194 5.916 571 H ALA 987 H ALA 987 -8.898 -3.435 1.464 572 HA ALA 987 HA ALA 987 -8.054 -1.002 2.598 573 1HB ALA 987 1HB ALA 987 -6.819 -3.583 1.703 574 2HB ALA 987 2HB ALA 987 -5.739 -2.193 1.970 575 3HB ALA 987 3HB ALA 987 -6.770 -2.786 3.294 576 H GLN 988 H GLN 988 -8.507 -2.100 -0.689 577 HA GLN 988 HA GLN 988 -6.590 -0.304 -1.780 578 1HB GLN 988 1HB GLN 988 -8.697 -2.156 -2.911 579 2HB GLN 988 2HB GLN 988 -7.944 -0.967 -3.955 580 1HG GLN 988 1HG GLN 988 -6.063 -2.546 -2.246 581 2HG GLN 988 2HG GLN 988 -6.905 -3.462 -3.480 582 1HE2 GLN 988 1HE2 GLN 988 -4.905 -0.621 -2.877 583 2HE2 GLN 988 2HE2 GLN 988 -4.172 -0.513 -4.443 584 H LYS 989 H LYS 989 -10.185 -0.448 -1.422 585 HA LYS 989 HA LYS 989 -10.688 1.935 -2.810 586 1HB LYS 989 1HB LYS 989 -12.390 0.232 -2.421 587 2HB LYS 989 2HB LYS 989 -12.296 0.483 -0.689 588 1HG LYS 989 1HG LYS 989 -12.895 2.828 -2.519 589 2HG LYS 989 2HG LYS 989 -14.175 1.710 -2.092 590 1HD LYS 989 1HD LYS 989 -12.603 2.514 0.266 591 2HD LYS 989 2HD LYS 989 -13.287 3.901 -0.559 592 1HE LYS 989 1HE LYS 989 -15.237 3.438 0.516 593 2HE LYS 989 2HE LYS 989 -15.408 2.066 -0.560 594 1HZ LYS 989 1HZ LYS 989 -14.788 0.656 1.043 595 2HZ LYS 989 2HZ LYS 989 -13.686 1.661 1.709 596 3HZ LYS 989 3HZ LYS 989 -15.272 1.844 2.054 597 H LEU 990 H LEU 990 -9.888 1.188 0.608 598 HA LEU 990 HA LEU 990 -10.453 3.727 1.625 599 1HB LEU 990 1HB LEU 990 -9.758 1.326 2.653 600 2HB LEU 990 2HB LEU 990 -8.234 2.175 2.814 601 HG LEU 990 HG LEU 990 -10.899 3.038 3.969 602 1HD1 LEU 990 1HD1 LEU 990 -10.290 2.153 5.953 603 2HD1 LEU 990 2HD1 LEU 990 -9.302 1.086 4.926 604 3HD1 LEU 990 3HD1 LEU 990 -8.562 2.503 5.709 605 1HD2 LEU 990 1HD2 LEU 990 -10.113 5.103 4.126 606 2HD2 LEU 990 2HD2 LEU 990 -8.746 4.504 5.095 607 3HD2 LEU 990 3HD2 LEU 990 -8.601 4.613 3.324 608 H LEU 991 H LEU 991 -7.435 2.286 0.248 609 HA LEU 991 HA LEU 991 -5.770 4.432 0.729 610 1HB LEU 991 1HB LEU 991 -4.937 2.302 0.047 611 2HB LEU 991 2HB LEU 991 -5.815 2.367 -1.468 612 HG LEU 991 HG LEU 991 -4.397 4.200 -2.253 613 1HD1 LEU 991 1HD1 LEU 991 -3.733 4.438 0.528 614 2HD1 LEU 991 2HD1 LEU 991 -2.246 4.183 -0.417 615 3HD1 LEU 991 3HD1 LEU 991 -3.341 5.526 -0.825 616 1HD2 LEU 991 1HD2 LEU 991 -3.302 2.446 -3.092 617 2HD2 LEU 991 2HD2 LEU 991 -2.115 2.721 -1.794 618 3HD2 LEU 991 3HD2 LEU 991 -3.418 1.530 -1.570 619 H ASN 992 H ASN 992 -7.810 3.738 -2.193 620 HA ASN 992 HA ASN 992 -7.111 5.973 -3.588 621 1HB ASN 992 1HB ASN 992 -8.684 3.911 -4.172 622 2HB ASN 992 2HB ASN 992 -9.974 4.941 -3.583 623 1HD2 ASN 992 1HD2 ASN 992 -7.669 4.336 -6.073 624 2HD2 ASN 992 2HD2 ASN 992 -8.171 5.548 -7.204 625 H SER 993 H SER 993 -10.122 5.440 -1.585 626 HA SER 993 HA SER 993 -11.196 7.868 -1.689 627 1HB SER 993 1HB SER 993 -11.561 5.597 -0.139 628 2HB SER 993 2HB SER 993 -11.148 6.791 1.076 629 HG SER 993 HG SER 993 -13.199 7.159 -0.938 630 H ASP 994 H ASP 994 -8.778 6.820 0.828 631 HA ASP 994 HA ASP 994 -8.541 9.295 1.998 632 1HB ASP 994 1HB ASP 994 -7.247 6.713 2.121 633 2HB ASP 994 2HB ASP 994 -5.994 7.938 2.075 634 H LEU 995 H LEU 995 -7.124 7.851 -0.931 635 HA LEU 995 HA LEU 995 -4.973 9.657 -1.209 636 1HB LEU 995 1HB LEU 995 -4.531 7.885 -2.486 637 2HB LEU 995 2HB LEU 995 -6.222 7.483 -2.714 638 HG LEU 995 HG LEU 995 -6.398 9.220 -4.468 639 1HD1 LEU 995 1HD1 LEU 995 -4.517 10.411 -5.306 640 2HD1 LEU 995 2HD1 LEU 995 -4.550 10.656 -3.543 641 3HD1 LEU 995 3HD1 LEU 995 -3.393 9.509 -4.261 642 1HD2 LEU 995 1HD2 LEU 995 -4.832 6.771 -4.605 643 2HD2 LEU 995 2HD2 LEU 995 -6.058 7.415 -5.724 644 3HD2 LEU 995 3HD2 LEU 995 -4.362 7.939 -5.862 645 H ALA 996 H ALA 996 -8.201 9.455 -2.873 646 HA ALA 996 HA ALA 996 -8.049 11.711 -4.363 647 1HB ALA 996 1HB ALA 996 -10.316 11.433 -4.633 648 2HB ALA 996 2HB ALA 996 -9.943 9.870 -3.868 649 3HB ALA 996 3HB ALA 996 -10.606 11.203 -2.892 650 H GLU 997 H GLU 997 -8.990 11.449 -0.874 651 HA GLU 997 HA GLU 997 -9.620 14.079 -0.500 652 1HB GLU 997 1HB GLU 997 -9.735 11.959 1.082 653 2HB GLU 997 2HB GLU 997 -8.169 12.511 1.642 654 1HG GLU 997 1HG GLU 997 -9.646 13.609 3.116 655 2HG GLU 997 2HG GLU 997 -9.316 14.850 1.924 656 H LEU 998 H LEU 998 -6.434 12.457 -0.624 657 HA LEU 998 HA LEU 998 -4.997 14.696 0.372 658 1HB LEU 998 1HB LEU 998 -4.231 12.366 0.535 659 2HB LEU 998 2HB LEU 998 -4.077 12.290 -1.209 660 HG LEU 998 HG LEU 998 -2.540 14.282 0.471 661 1HD1 LEU 998 1HD1 LEU 998 -1.560 12.456 1.373 662 2HD1 LEU 998 2HD1 LEU 998 -2.054 11.387 0.039 663 3HD1 LEU 998 3HD1 LEU 998 -0.655 12.469 -0.159 664 1HD2 LEU 998 1HD2 LEU 998 -2.550 13.465 -2.400 665 2HD2 LEU 998 2HD2 LEU 998 -2.343 15.070 -1.660 666 3HD2 LEU 998 3HD2 LEU 998 -0.996 13.906 -1.653 667 H ILE 999 H ILE 999 -5.743 13.374 -2.910 668 HA ILE 999 HA ILE 999 -4.233 15.114 -4.393 669 HB ILE 999 HB ILE 999 -6.938 13.914 -4.995 670 1HG1 ILE 999 1HG1 ILE 999 -4.852 12.456 -4.373 671 2HG1 ILE 999 2HG1 ILE 999 -5.879 12.014 -5.723 672 1HG2 ILE 999 1HG2 ILE 999 -6.575 15.730 -6.521 673 2HG2 ILE 999 2HG2 ILE 999 -4.903 15.204 -6.830 674 3HG2 ILE 999 3HG2 ILE 999 -6.267 14.202 -7.379 675 1HD1 ILE 999 1HD1 ILE 999 -4.332 12.895 -7.337 676 2HD1 ILE 999 2HD1 ILE 999 -3.413 13.765 -6.085 677 3HD1 ILE 999 3HD1 ILE 999 -3.345 11.988 -6.165 678 H ASN1000 H ASN1000 -7.591 15.557 -3.113 679 HA ASN1000 HA ASN1000 -8.061 17.984 -4.264 680 1HB ASN1000 1HB ASN1000 -9.599 16.437 -2.800 681 2HB ASN1000 2HB ASN1000 -8.941 17.299 -1.423 682 1HD2 ASN1000 1HD2 ASN1000 -11.168 17.913 -1.089 683 2HD2 ASN1000 2HD2 ASN1000 -11.829 19.291 -1.905 684 H LYS1001 H LYS1001 -6.771 17.206 -0.940 685 HA LYS1001 HA LYS1001 -6.388 19.676 0.058 686 1HB LYS1001 1HB LYS1001 -4.701 17.179 0.293 687 2HB LYS1001 2HB LYS1001 -4.343 18.631 1.207 688 1HG LYS1001 1HG LYS1001 -7.205 17.883 1.318 689 2HG LYS1001 2HG LYS1001 -6.153 16.635 1.955 690 1HD LYS1001 1HD LYS1001 -5.242 18.072 3.626 691 2HD LYS1001 2HD LYS1001 -5.758 19.525 2.793 692 1HE LYS1001 1HE LYS1001 -7.945 17.636 3.587 693 2HE LYS1001 2HE LYS1001 -7.113 18.433 4.907 694 1HZ LYS1001 1HZ LYS1001 -8.730 19.921 4.351 695 2HZ LYS1001 2HZ LYS1001 -7.483 20.513 3.478 696 3HZ LYS1001 3HZ LYS1001 -8.648 19.633 2.745 697 H MET1002 H MET1002 -4.484 18.049 -2.496 698 HA MET1002 HA MET1002 -2.519 20.106 -2.494 699 1HB MET1002 1HB MET1002 -1.905 17.826 -3.173 700 2HB MET1002 2HB MET1002 -3.192 17.771 -4.361 701 1HG MET1002 1HG MET1002 -1.522 20.087 -4.900 702 2HG MET1002 2HG MET1002 -0.495 18.677 -4.735 703 1HE MET1002 1HE MET1002 -3.031 20.595 -6.430 704 2HE MET1002 2HE MET1002 -1.824 20.514 -7.735 705 3HE MET1002 3HE MET1002 -3.424 19.768 -7.955 706 H LYS1003 H LYS1003 -5.332 19.149 -4.557 707 HA LYS1003 HA LYS1003 -4.972 20.985 -6.580 708 1HB LYS1003 1HB LYS1003 -7.212 19.383 -5.488 709 2HB LYS1003 2HB LYS1003 -7.683 20.787 -6.424 710 1HG LYS1003 1HG LYS1003 -5.555 18.884 -7.465 711 2HG LYS1003 2HG LYS1003 -7.255 18.516 -7.675 712 1HD LYS1003 1HD LYS1003 -6.154 21.229 -8.488 713 2HD LYS1003 2HD LYS1003 -6.006 19.852 -9.562 714 1HE LYS1003 1HE LYS1003 -8.670 19.667 -8.850 715 2HE LYS1003 2HE LYS1003 -8.436 21.403 -8.794 716 1HZ LYS1003 1HZ LYS1003 -7.303 20.075 -11.078 717 2HZ LYS1003 2HZ LYS1003 -8.935 20.078 -11.009 718 3HZ LYS1003 3HZ LYS1003 -8.114 21.490 -10.990 719 H LEU1004 H LEU1004 -6.015 21.422 -3.235 720 HA LEU1004 HA LEU1004 -6.972 24.101 -3.805 721 1HB LEU1004 1HB LEU1004 -6.746 22.745 -1.125 722 2HB LEU1004 2HB LEU1004 -7.723 24.134 -1.555 723 HG LEU1004 HG LEU1004 -8.168 21.383 -2.735 724 1HD1 LEU1004 1HD1 LEU1004 -8.490 22.000 -0.062 725 2HD1 LEU1004 2HD1 LEU1004 -10.115 22.258 -0.739 726 3HD1 LEU1004 3HD1 LEU1004 -9.304 20.688 -0.947 727 1HD2 LEU1004 1HD2 LEU1004 -10.154 23.643 -2.511 728 2HD2 LEU1004 2HD2 LEU1004 -9.044 23.489 -3.893 729 3HD2 LEU1004 3HD2 LEU1004 -10.214 22.194 -3.544 730 H ALA1005 H ALA1005 -4.374 22.442 -1.897 731 HA ALA1005 HA ALA1005 -3.137 24.666 -0.892 732 1HB ALA1005 1HB ALA1005 -1.026 23.060 -1.294 733 2HB ALA1005 2HB ALA1005 -2.268 22.698 -0.072 734 3HB ALA1005 3HB ALA1005 -2.315 21.888 -1.656 735 H GLN1006 H GLN1006 -3.275 23.463 -4.215 736 HA GLN1006 HA GLN1006 -1.007 24.738 -5.167 737 1HB GLN1006 1HB GLN1006 -2.408 22.957 -6.331 738 2HB GLN1006 2HB GLN1006 -3.582 24.202 -6.707 739 1HG GLN1006 1HG GLN1006 -0.675 24.644 -7.435 740 2HG GLN1006 2HG GLN1006 -1.660 23.604 -8.444 741 1HE2 GLN1006 1HE2 GLN1006 -0.564 25.896 -9.428 742 2HE2 GLN1006 2HE2 GLN1006 -1.785 27.075 -9.773 743 H GLN1007 H GLN1007 -4.318 25.877 -4.493 744 HA GLN1007 HA GLN1007 -3.609 28.445 -5.651 745 1HB GLN1007 1HB GLN1007 -5.831 27.128 -6.153 746 2HB GLN1007 2HB GLN1007 -6.353 27.721 -4.589 747 1HG GLN1007 1HG GLN1007 -5.245 29.994 -5.846 748 2HG GLN1007 2HG GLN1007 -6.096 29.168 -7.137 749 1HE2 GLN1007 1HE2 GLN1007 -8.245 29.221 -7.243 750 2HE2 GLN1007 2HE2 GLN1007 -9.302 29.960 -6.086 751 H TYR1008 H TYR1008 -4.169 26.723 -2.632 752 HA TYR1008 HA TYR1008 -4.467 29.176 -1.116 753 1HB TYR1008 1HB TYR1008 -4.468 26.150 -0.711 754 2HB TYR1008 2HB TYR1008 -4.234 27.162 0.700 755 HD1 TYR1008 HD1 TYR1008 -6.035 28.853 1.312 756 HD2 TYR1008 HD2 TYR1008 -6.632 25.806 -1.631 757 HE1 TYR1008 HE1 TYR1008 -8.553 29.141 1.515 758 HE2 TYR1008 HE2 TYR1008 -9.148 26.104 -1.418 759 HH TYR1008 HH TYR1008 -10.687 27.962 -0.733 760 H VAL1009 H VAL1009 -1.935 28.507 -2.707 761 HA VAL1009 HA VAL1009 -0.081 28.410 -0.431 762 HB VAL1009 HB VAL1009 0.272 26.577 -1.896 763 1HG1 VAL1009 1HG1 VAL1009 -0.935 27.338 -3.859 764 2HG1 VAL1009 2HG1 VAL1009 0.294 28.587 -4.172 765 3HG1 VAL1009 3HG1 VAL1009 0.717 26.865 -4.323 766 1HG2 VAL1009 1HG2 VAL1009 2.232 28.716 -1.662 767 2HG2 VAL1009 2HG2 VAL1009 2.442 26.954 -1.514 768 3HG2 VAL1009 3HG2 VAL1009 2.511 27.727 -3.116 769 H MET1010 H MET1010 -0.863 30.027 -3.568 770 HA MET1010 HA MET1010 1.146 31.955 -3.277 771 1HB MET1010 1HB MET1010 -0.225 33.130 -5.097 772 2HB MET1010 2HB MET1010 0.189 31.470 -5.475 773 1HG MET1010 1HG MET1010 -2.027 31.076 -5.796 774 2HG MET1010 2HG MET1010 -2.247 31.251 -4.066 775 1HE MET1010 1HE MET1010 -3.886 32.180 -3.390 776 2HE MET1010 2HE MET1010 -3.695 33.929 -3.119 777 3HE MET1010 3HE MET1010 -4.972 33.330 -4.206 778 H THR1011 H THR1011 -1.826 31.485 -1.631 779 HA THR1011 HA THR1011 -2.524 34.232 -1.272 780 HB THR1011 HB THR1011 -3.362 31.530 -0.177 781 HG1 THR1011 HG1 THR1011 -5.401 32.644 -1.039 782 1HG2 THR1011 1HG2 THR1011 -5.184 33.492 0.763 783 2HG2 THR1011 2HG2 THR1011 -4.126 32.470 1.765 784 3HG2 THR1011 3HG2 THR1011 -3.579 34.085 1.253 785 H SER1012 H SER1012 -1.803 31.973 1.426 786 HA SER1012 HA SER1012 0.530 33.204 2.218 787 1HB SER1012 1HB SER1012 -1.519 34.978 2.621 788 2HB SER1012 2HB SER1012 -1.553 34.125 4.152 789 HG SER1012 HG SER1012 -0.060 35.688 4.543 790 H LEU1013 H LEU1013 -2.563 31.621 3.098 791 HA LEU1013 HA LEU1013 -1.429 30.351 5.409 792 1HB LEU1013 1HB LEU1013 -3.611 29.205 5.499 793 2HB LEU1013 2HB LEU1013 -3.715 30.954 5.503 794 HG LEU1013 HG LEU1013 -3.954 30.352 2.814 795 1HD1 LEU1013 1HD1 LEU1013 -4.621 27.968 4.308 796 2HD1 LEU1013 2HD1 LEU1013 -6.046 28.595 3.445 797 3HD1 LEU1013 3HD1 LEU1013 -4.552 28.231 2.549 798 1HD2 LEU1013 1HD2 LEU1013 -5.250 32.030 3.947 799 2HD2 LEU1013 2HD2 LEU1013 -6.360 30.890 3.150 800 3HD2 LEU1013 3HD2 LEU1013 -6.098 30.795 4.908 801 H GLN1014 H GLN1014 0.373 29.804 3.508 802 HA GLN1014 HA GLN1014 -0.319 27.449 2.082 803 1HB GLN1014 1HB GLN1014 1.286 28.814 1.004 804 2HB GLN1014 2HB GLN1014 2.210 29.065 2.472 805 1HG GLN1014 1HG GLN1014 2.014 26.208 1.750 806 2HG GLN1014 2HG GLN1014 2.756 27.164 0.481 807 1HE2 GLN1014 1HE2 GLN1014 4.767 26.289 0.781 808 2HE2 GLN1014 2HE2 GLN1014 5.783 26.642 2.138 809 H GLN1015 H GLN1015 2.079 28.175 4.727 810 HA GLN1015 HA GLN1015 2.859 25.649 5.230 811 1HB GLN1015 1HB GLN1015 3.035 26.563 7.714 812 2HB GLN1015 2HB GLN1015 4.036 27.241 6.445 813 1HG GLN1015 1HG GLN1015 2.771 29.218 6.300 814 2HG GLN1015 2HG GLN1015 1.313 28.459 6.908 815 1HE2 GLN1015 1HE2 GLN1015 2.486 30.902 7.783 816 2HE2 GLN1015 2HE2 GLN1015 2.906 30.748 9.457 817 H GLU1016 H GLU1016 -0.283 27.088 5.819 818 HA GLU1016 HA GLU1016 -1.066 25.328 7.862 819 1HB GLU1016 1HB GLU1016 -2.097 27.600 7.232 820 2HB GLU1016 2HB GLU1016 -2.899 26.776 5.910 821 1HG GLU1016 1HG GLU1016 -3.783 25.109 7.703 822 2HG GLU1016 2HG GLU1016 -3.241 26.275 8.894 823 H TYR1017 H TYR1017 -2.002 25.508 4.345 824 HA TYR1017 HA TYR1017 -3.310 23.034 4.339 825 1HB TYR1017 1HB TYR1017 -2.187 25.112 2.473 826 2HB TYR1017 2HB TYR1017 -2.333 23.522 1.750 827 HD1 TYR1017 HD1 TYR1017 -4.518 22.528 1.316 828 HD2 TYR1017 HD2 TYR1017 -4.185 26.370 3.167 829 HE1 TYR1017 HE1 TYR1017 -6.984 22.963 0.873 830 HE2 TYR1017 HE2 TYR1017 -6.652 26.793 2.718 831 HH TYR1017 HH TYR1017 -8.462 26.059 1.798 832 H LYS1018 H LYS1018 0.050 23.806 4.541 833 HA LYS1018 HA LYS1018 0.986 21.527 3.095 834 1HB LYS1018 1HB LYS1018 2.079 23.920 4.115 835 2HB LYS1018 2HB LYS1018 2.893 22.628 4.974 836 1HG LYS1018 1HG LYS1018 4.225 22.525 3.116 837 2HG LYS1018 2HG LYS1018 2.909 21.594 2.428 838 1HD LYS1018 1HD LYS1018 3.172 24.630 2.194 839 2HD LYS1018 2HD LYS1018 3.679 23.498 0.956 840 1HE LYS1018 1HE LYS1018 0.841 23.386 2.022 841 2HE LYS1018 2HE LYS1018 1.272 24.590 0.824 842 1HZ LYS1018 1HZ LYS1018 0.481 22.563 -0.181 843 2HZ LYS1018 2HZ LYS1018 2.037 22.825 -0.603 844 3HZ LYS1018 3HZ LYS1018 1.674 21.694 0.518 845 H LYS1019 H LYS1019 0.447 22.408 6.555 846 HA LYS1019 HA LYS1019 1.389 19.882 7.477 847 1HB LYS1019 1HB LYS1019 0.333 22.385 8.635 848 2HB LYS1019 2HB LYS1019 -0.067 20.940 9.543 849 1HG LYS1019 1HG LYS1019 2.015 21.307 10.464 850 2HG LYS1019 2HG LYS1019 2.542 20.386 9.068 851 1HD LYS1019 1HD LYS1019 2.196 23.278 8.501 852 2HD LYS1019 2HD LYS1019 3.403 22.953 9.729 853 1HE LYS1019 1HE LYS1019 3.326 21.654 6.963 854 2HE LYS1019 2HE LYS1019 4.381 22.976 7.423 855 1HZ LYS1019 1HZ LYS1019 4.564 20.846 9.259 856 2HZ LYS1019 2HZ LYS1019 4.879 20.325 7.744 857 3HZ LYS1019 3HZ LYS1019 5.745 21.554 8.382 858 H GLN1020 H GLN1020 -1.466 20.963 5.910 859 HA GLN1020 HA GLN1020 -3.266 19.258 7.255 860 1HB GLN1020 1HB GLN1020 -3.363 20.789 4.633 861 2HB GLN1020 2HB GLN1020 -4.680 19.742 5.122 862 1HG GLN1020 1HG GLN1020 -3.642 21.759 7.118 863 2HG GLN1020 2HG GLN1020 -4.639 22.337 5.798 864 1HE2 GLN1020 1HE2 GLN1020 -4.580 20.980 8.856 865 2HE2 GLN1020 2HE2 GLN1020 -6.239 20.508 9.020 866 H MET1021 H MET1021 -2.018 19.162 3.831 867 HA MET1021 HA MET1021 -2.880 16.644 3.279 868 1HB MET1021 1HB MET1021 -1.184 16.710 1.460 869 2HB MET1021 2HB MET1021 -1.915 18.293 1.640 870 1HG MET1021 1HG MET1021 0.346 18.885 1.583 871 2HG MET1021 2HG MET1021 0.112 18.729 3.313 872 1HE MET1021 1HE MET1021 2.114 15.659 0.536 873 2HE MET1021 2HE MET1021 0.337 15.756 0.589 874 3HE MET1021 3HE MET1021 1.290 17.164 0.062 875 H LEU1022 H LEU1022 0.003 17.698 5.094 876 HA LEU1022 HA LEU1022 1.451 15.329 4.983 877 1HB LEU1022 1HB LEU1022 2.409 17.400 5.723 878 2HB LEU1022 2HB LEU1022 1.292 17.503 7.070 879 HG LEU1022 HG LEU1022 3.503 16.842 7.825 880 1HD1 LEU1022 1HD1 LEU1022 1.989 14.293 8.146 881 2HD1 LEU1022 2HD1 LEU1022 2.796 15.315 9.359 882 3HD1 LEU1022 3HD1 LEU1022 1.217 15.800 8.697 883 1HD2 LEU1022 1HD2 LEU1022 3.248 14.803 5.663 884 2HD2 LEU1022 2HD2 LEU1022 4.655 15.762 6.183 885 3HD2 LEU1022 3HD2 LEU1022 4.134 14.354 7.141 886 H THR1023 H THR1023 -0.893 16.487 7.509 887 HA THR1023 HA THR1023 -0.868 14.341 9.164 888 HB THR1023 HB THR1023 -3.481 15.643 8.320 889 HG1 THR1023 HG1 THR1023 -1.072 16.713 9.604 890 1HG2 THR1023 1HG2 THR1023 -3.655 14.296 10.333 891 2HG2 THR1023 2HG2 THR1023 -2.110 14.921 10.956 892 3HG2 THR1023 3HG2 THR1023 -3.534 15.986 10.878 893 H ALA1024 H ALA1024 -2.756 14.618 6.093 894 HA ALA1024 HA ALA1024 -3.970 12.111 6.339 895 1HB ALA1024 1HB ALA1024 -3.267 13.350 3.681 896 2HB ALA1024 2HB ALA1024 -4.765 12.532 4.186 897 3HB ALA1024 3HB ALA1024 -4.409 14.177 4.766 898 H ALA1025 H ALA1025 -0.917 13.198 4.726 899 HA ALA1025 HA ALA1025 -0.224 10.818 3.544 900 1HB ALA1025 1HB ALA1025 1.018 13.342 4.284 901 2HB ALA1025 2HB ALA1025 2.160 11.993 4.490 902 3HB ALA1025 3HB ALA1025 1.379 12.264 2.914 903 H HIS1026 H HIS1026 -0.264 11.750 6.953 904 HA HIS1026 HA HIS1026 1.539 9.784 7.842 905 1HB HIS1026 1HB HIS1026 0.353 11.957 8.951 906 2HB HIS1026 2HB HIS1026 -0.631 10.689 9.654 907 HD1 HIS1026 HD1 HIS1026 3.115 10.412 8.973 908 HD2 HIS1026 HD2 HIS1026 0.447 10.684 12.199 909 HE1 HIS1026 HE1 HIS1026 4.499 10.022 11.081 910 H ALA1027 H ALA1027 -2.096 9.941 7.872 911 HA ALA1027 HA ALA1027 -2.328 7.235 8.685 912 1HB ALA1027 1HB ALA1027 -3.969 9.200 8.999 913 2HB ALA1027 2HB ALA1027 -4.453 8.906 7.312 914 3HB ALA1027 3HB ALA1027 -4.662 7.628 8.533 915 H LEU1028 H LEU1028 -2.206 8.981 5.567 916 HA LEU1028 HA LEU1028 -3.167 6.903 3.968 917 1HB LEU1028 1HB LEU1028 -1.612 9.403 3.581 918 2HB LEU1028 2HB LEU1028 -1.541 8.216 2.294 919 HG LEU1028 HG LEU1028 -3.361 10.144 2.349 920 1HD1 LEU1028 1HD1 LEU1028 -2.985 8.393 0.598 921 2HD1 LEU1028 2HD1 LEU1028 -4.116 7.343 1.485 922 3HD1 LEU1028 3HD1 LEU1028 -4.683 8.887 0.806 923 1HD2 LEU1028 1HD2 LEU1028 -4.231 9.362 4.577 924 2HD2 LEU1028 2HD2 LEU1028 -5.455 9.537 3.297 925 3HD2 LEU1028 3HD2 LEU1028 -4.862 7.920 3.746 926 H ALA1029 H ALA1029 0.280 7.943 4.497 927 HA ALA1029 HA ALA1029 1.551 5.946 3.233 928 1HB ALA1029 1HB ALA1029 2.206 7.231 5.912 929 2HB ALA1029 2HB ALA1029 3.355 6.265 4.958 930 3HB ALA1029 3HB ALA1029 2.712 7.788 4.299 931 H VAL1030 H VAL1030 -0.036 5.790 6.460 932 HA VAL1030 HA VAL1030 0.865 3.138 6.964 933 HB VAL1030 HB VAL1030 -1.011 5.102 8.206 934 1HG1 VAL1030 1HG1 VAL1030 -1.527 3.331 9.963 935 2HG1 VAL1030 2HG1 VAL1030 -2.369 3.166 8.403 936 3HG1 VAL1030 3HG1 VAL1030 -0.972 2.128 8.774 937 1HG2 VAL1030 1HG2 VAL1030 0.863 5.472 9.366 938 2HG2 VAL1030 2HG2 VAL1030 0.615 3.883 10.129 939 3HG2 VAL1030 3HG2 VAL1030 1.649 4.027 8.687 940 H ASP1031 H ASP1031 -2.251 4.637 5.872 941 HA ASP1031 HA ASP1031 -3.862 2.562 5.776 942 1HB ASP1031 1HB ASP1031 -4.464 4.780 4.904 943 2HB ASP1031 2HB ASP1031 -3.364 4.593 3.553 944 H ALA1032 H ALA1032 -1.458 3.422 3.170 945 HA ALA1032 HA ALA1032 -1.931 1.241 1.530 946 1HB ALA1032 1HB ALA1032 0.866 2.176 1.664 947 2HB ALA1032 2HB ALA1032 -0.280 2.192 0.303 948 3HB ALA1032 3HB ALA1032 -0.327 3.489 1.521 949 H LYS1033 H LYS1033 0.281 1.657 4.352 950 HA LYS1033 HA LYS1033 1.626 -0.746 4.113 951 1HB LYS1033 1HB LYS1033 1.959 1.320 5.685 952 2HB LYS1033 2HB LYS1033 0.919 0.440 6.786 953 1HG LYS1033 1HG LYS1033 2.890 -0.529 7.460 954 2HG LYS1033 2HG LYS1033 2.611 -1.582 6.087 955 1HD LYS1033 1HD LYS1033 3.978 -0.025 4.649 956 2HD LYS1033 2HD LYS1033 4.298 0.966 6.058 957 1HE LYS1033 1HE LYS1033 5.725 -0.610 7.029 958 2HE LYS1033 2HE LYS1033 4.906 -1.972 6.293 959 1HZ LYS1033 1HZ LYS1033 6.224 -0.121 4.508 960 2HZ LYS1033 2HZ LYS1033 7.185 -1.082 5.414 961 3HZ LYS1033 3HZ LYS1033 6.085 -1.745 4.405 962 H ASN1034 H ASN1034 -1.573 0.037 5.552 963 HA ASN1034 HA ASN1034 -2.008 -2.332 6.830 964 1HB ASN1034 1HB ASN1034 -3.469 -0.040 6.370 965 2HB ASN1034 2HB ASN1034 -4.340 -1.164 5.346 966 1HD2 ASN1034 1HD2 ASN1034 -5.729 -0.160 7.318 967 2HD2 ASN1034 2HD2 ASN1034 -5.985 -1.273 8.620 968 H LEU1035 H LEU1035 -2.638 -1.327 3.402 969 HA LEU1035 HA LEU1035 -4.015 -3.471 2.473 970 1HB LEU1035 1HB LEU1035 -3.271 -1.317 1.320 971 2HB LEU1035 2HB LEU1035 -1.783 -2.158 0.936 972 HG LEU1035 HG LEU1035 -4.431 -3.372 0.182 973 1HD1 LEU1035 1HD1 LEU1035 -3.754 -2.172 -2.128 974 2HD1 LEU1035 2HD1 LEU1035 -4.885 -1.467 -0.947 975 3HD1 LEU1035 3HD1 LEU1035 -3.185 -0.941 -0.975 976 1HD2 LEU1035 1HD2 LEU1035 -1.573 -3.643 -0.718 977 2HD2 LEU1035 2HD2 LEU1035 -2.716 -4.896 -0.179 978 3HD2 LEU1035 3HD2 LEU1035 -2.919 -4.133 -1.774 979 H LEU1036 H LEU1036 -0.399 -3.160 2.637 980 HA LEU1036 HA LEU1036 -0.022 -5.852 1.829 981 1HB LEU1036 1HB LEU1036 1.514 -3.576 1.991 982 2HB LEU1036 2HB LEU1036 2.156 -4.552 3.296 983 HG LEU1036 HG LEU1036 2.043 -6.391 1.267 984 1HD1 LEU1036 1HD1 LEU1036 1.513 -4.102 -0.101 985 2HD1 LEU1036 2HD1 LEU1036 3.287 -4.171 -0.225 986 3HD1 LEU1036 3HD1 LEU1036 2.301 -5.539 -0.795 987 1HD2 LEU1036 1HD2 LEU1036 3.975 -6.394 2.498 988 2HD2 LEU1036 2HD2 LEU1036 4.562 -5.667 0.983 989 3HD2 LEU1036 3HD2 LEU1036 4.189 -4.631 2.382 990 H ASP1037 H ASP1037 -0.140 -4.104 4.974 991 HA ASP1037 HA ASP1037 0.807 -5.876 6.676 992 1HB ASP1037 1HB ASP1037 -0.539 -3.664 7.060 993 2HB ASP1037 2HB ASP1037 -1.957 -4.689 7.134 994 H VAL1038 H VAL1038 -2.665 -5.839 5.539 995 HA VAL1038 HA VAL1038 -3.427 -8.214 6.724 996 HB VAL1038 HB VAL1038 -4.998 -6.619 5.872 997 1HG1 VAL1038 1HG1 VAL1038 -5.334 -6.507 3.317 998 2HG1 VAL1038 2HG1 VAL1038 -3.968 -5.608 4.020 999 3HG1 VAL1038 3HG1 VAL1038 -3.684 -7.166 3.207 1000 1HG2 VAL1038 1HG2 VAL1038 -6.212 -8.533 5.890 1001 2HG2 VAL1038 2HG2 VAL1038 -6.197 -8.310 4.124 1002 3HG2 VAL1038 3HG2 VAL1038 -5.035 -9.419 4.892 1003 H ILE1039 H ILE1039 -1.827 -7.561 3.570 1004 HA ILE1039 HA ILE1039 -2.056 -10.159 2.568 1005 HB ILE1039 HB ILE1039 -0.390 -7.757 2.008 1006 1HG1 ILE1039 1HG1 ILE1039 -2.172 -9.503 0.282 1007 2HG1 ILE1039 2HG1 ILE1039 -2.670 -8.027 1.085 1008 1HG2 ILE1039 1HG2 ILE1039 1.397 -9.038 1.528 1009 2HG2 ILE1039 2HG2 ILE1039 0.438 -10.534 1.424 1010 3HG2 ILE1039 3HG2 ILE1039 0.483 -9.409 0.046 1011 1HD1 ILE1039 1HD1 ILE1039 -0.453 -7.096 -0.203 1012 2HD1 ILE1039 2HD1 ILE1039 -0.941 -8.389 -1.324 1013 3HD1 ILE1039 3HD1 ILE1039 -2.079 -7.080 -0.927 1014 H ASP1040 H ASP1040 0.455 -8.547 4.602 1015 HA ASP1040 HA ASP1040 2.327 -10.487 4.584 1016 1HB ASP1040 1HB ASP1040 1.582 -8.249 6.266 1017 2HB ASP1040 2HB ASP1040 2.054 -9.578 7.305 1018 H GLN1041 H GLN1041 -0.733 -10.244 6.483 1019 HA GLN1041 HA GLN1041 -0.192 -12.478 8.092 1020 1HB GLN1041 1HB GLN1041 -2.757 -10.988 7.412 1021 2HB GLN1041 2HB GLN1041 -2.720 -12.328 8.541 1022 1HG GLN1041 1HG GLN1041 -0.693 -10.908 9.609 1023 2HG GLN1041 2HG GLN1041 -1.512 -9.578 8.814 1024 1HE2 GLN1041 1HE2 GLN1041 -2.211 -8.577 10.631 1025 2HE2 GLN1041 2HE2 GLN1041 -3.420 -9.204 11.701 1026 H ALA1042 H ALA1042 -1.303 -12.046 4.805 1027 HA ALA1042 HA ALA1042 -2.583 -14.632 4.687 1028 1HB ALA1042 1HB ALA1042 -3.249 -12.473 3.426 1029 2HB ALA1042 2HB ALA1042 -1.868 -12.828 2.361 1030 3HB ALA1042 3HB ALA1042 -3.208 -13.991 2.498 1031 H ARG1043 H ARG1043 0.475 -13.025 3.670 1032 HA ARG1043 HA ARG1043 1.466 -14.980 2.087 1033 1HB ARG1043 1HB ARG1043 2.437 -12.637 2.807 1034 2HB ARG1043 2HB ARG1043 3.231 -13.524 4.093 1035 1HG ARG1043 1HG ARG1043 4.790 -14.385 2.675 1036 2HG ARG1043 2HG ARG1043 3.573 -14.890 1.519 1037 1HD ARG1043 1HD ARG1043 4.209 -13.192 0.153 1038 2HD ARG1043 2HD ARG1043 3.643 -12.044 1.351 1039 HE ARG1043 HE ARG1043 5.861 -11.639 1.982 1040 1HH1 ARG1043 2HH2 ARG1043 5.713 -14.641 0.151 1041 2HH1 ARG1043 1HH2 ARG1043 7.433 -14.824 0.066 1042 1HH2 ARG1043 2HH1 ARG1043 8.131 -11.880 1.871 1043 2HH2 ARG1043 1HH1 ARG1043 8.818 -13.243 1.051 1044 H LEU1044 H LEU1044 1.601 -14.678 5.689 1045 HA LEU1044 HA LEU1044 3.221 -16.948 6.078 1046 1HB LEU1044 1HB LEU1044 2.440 -16.755 8.425 1047 2HB LEU1044 2HB LEU1044 3.153 -15.300 7.757 1048 HG LEU1044 HG LEU1044 0.546 -14.793 7.239 1049 1HD1 LEU1044 1HD1 LEU1044 -0.592 -15.415 9.503 1050 2HD1 LEU1044 2HD1 LEU1044 -0.546 -16.598 8.174 1051 3HD1 LEU1044 3HD1 LEU1044 0.602 -16.734 9.528 1052 1HD2 LEU1044 1HD2 LEU1044 0.609 -13.590 9.550 1053 2HD2 LEU1044 2HD2 LEU1044 2.287 -14.180 9.607 1054 3HD2 LEU1044 3HD2 LEU1044 1.760 -13.123 8.275 1055 H LYS1045 H LYS1045 -0.354 -16.404 6.106 1056 HA LYS1045 HA LYS1045 -1.255 -18.782 6.955 1057 1HB LYS1045 1HB LYS1045 -2.212 -16.847 4.883 1058 2HB LYS1045 2HB LYS1045 -3.038 -18.386 5.019 1059 1HG LYS1045 1HG LYS1045 -2.790 -17.646 7.687 1060 2HG LYS1045 2HG LYS1045 -2.999 -16.091 6.906 1061 1HD LYS1045 1HD LYS1045 -5.093 -16.796 5.875 1062 2HD LYS1045 2HD LYS1045 -4.838 -18.462 6.356 1063 1HE LYS1045 1HE LYS1045 -5.079 -16.195 8.384 1064 2HE LYS1045 2HE LYS1045 -6.470 -17.092 7.808 1065 1HZ LYS1045 1HZ LYS1045 -5.108 -17.848 9.882 1066 2HZ LYS1045 2HZ LYS1045 -5.808 -18.939 8.890 1067 3HZ LYS1045 3HZ LYS1045 -4.211 -18.627 8.762 1068 H MET1046 H MET1046 0.550 -18.130 3.984 1069 HA MET1046 HA MET1046 -0.080 -20.734 2.946 1070 1HB MET1046 1HB MET1046 0.137 -19.017 1.275 1071 2HB MET1046 2HB MET1046 1.557 -18.329 2.037 1072 1HG MET1046 1HG MET1046 2.921 -20.272 1.379 1073 2HG MET1046 2HG MET1046 1.509 -21.107 0.762 1074 1HE MET1046 1HE MET1046 2.992 -17.097 -0.912 1075 2HE MET1046 2HE MET1046 1.496 -17.154 0.050 1076 3HE MET1046 3HE MET1046 3.042 -17.650 0.779 1077 H ILE1047 H ILE1047 2.907 -18.913 3.954 1078 HA ILE1047 HA ILE1047 4.716 -20.934 3.691 1079 HB ILE1047 HB ILE1047 4.490 -18.589 5.541 1080 1HG1 ILE1047 1HG1 ILE1047 6.826 -18.731 3.840 1081 2HG1 ILE1047 2HG1 ILE1047 5.375 -18.988 2.891 1082 1HG2 ILE1047 1HG2 ILE1047 6.704 -20.655 5.538 1083 2HG2 ILE1047 2HG2 ILE1047 6.843 -19.029 6.250 1084 3HG2 ILE1047 3HG2 ILE1047 5.655 -20.185 6.897 1085 1HD1 ILE1047 1HD1 ILE1047 4.509 -16.916 4.426 1086 2HD1 ILE1047 2HD1 ILE1047 6.253 -16.562 4.405 1087 3HD1 ILE1047 3HD1 ILE1047 5.351 -16.684 2.875 1088 H SER1048 H SER1048 2.424 -20.305 6.399 1089 HA SER1048 HA SER1048 3.453 -22.289 8.049 1090 1HB SER1048 1HB SER1048 1.501 -20.328 8.240 1091 2HB SER1048 2HB SER1048 0.535 -21.790 8.252 1092 HG SER1048 HG SER1048 1.348 -22.380 10.180 1093 H GLN1049 H GLN1049 0.646 -22.257 5.741 1094 HA GLN1049 HA GLN1049 0.408 -25.111 6.087 1095 1HB GLN1049 1HB GLN1049 -1.379 -22.951 5.404 1096 2HB GLN1049 2HB GLN1049 -1.397 -24.107 4.087 1097 1HG GLN1049 1HG GLN1049 -1.666 -25.938 5.917 1098 2HG GLN1049 2HG GLN1049 -2.012 -24.625 7.024 1099 1HE2 GLN1049 1HE2 GLN1049 -4.101 -24.733 7.408 1100 2HE2 GLN1049 2HE2 GLN1049 -5.373 -24.750 6.232 1101 H SER1050 H SER1050 2.383 -25.816 5.071 1102 HA SER1050 HA SER1050 2.155 -26.497 2.458 1103 1HB SER1050 1HB SER1050 2.824 -23.754 2.616 1104 2HB SER1050 2HB SER1050 4.335 -24.554 2.230 1105 HG SER1050 HG SER1050 2.060 -25.419 0.773 1106 H ARG1051 H ARG1051 5.043 -24.929 4.007 1107 HA ARG1051 HA ARG1051 6.274 -27.553 3.977 1108 1HB ARG1051 1HB ARG1051 7.377 -24.715 4.050 1109 2HB ARG1051 2HB ARG1051 8.399 -26.078 4.459 1110 1HG ARG1051 1HG ARG1051 7.444 -27.071 2.159 1111 2HG ARG1051 2HG ARG1051 7.135 -25.383 1.804 1112 1HD ARG1051 1HD ARG1051 9.625 -24.987 2.548 1113 2HD ARG1051 2HD ARG1051 9.807 -26.721 2.367 1114 HE ARG1051 HE ARG1051 9.748 -26.455 0.046 1115 1HH1 ARG1051 2HH2 ARG1051 8.369 -23.591 1.555 1116 2HH1 ARG1051 1HH2 ARG1051 8.226 -22.719 0.066 1117 1HH2 ARG1051 2HH1 ARG1051 9.558 -25.305 -1.919 1118 2HH2 ARG1051 1HH1 ARG1051 8.906 -23.701 -1.924 1119 HA PRO1052 HA PRO1052 5.994 -27.541 8.347 1120 1HB PRO1052 1HB PRO1052 7.470 -29.780 8.875 1121 2HB PRO1052 2HB PRO1052 5.780 -29.833 8.412 1122 1HG PRO1052 1HG PRO1052 8.167 -30.481 6.792 1123 2HG PRO1052 2HG PRO1052 6.495 -30.921 6.508 1124 1HD PRO1052 1HD PRO1052 7.979 -28.867 5.167 1125 2HD PRO1052 2HD PRO1052 6.277 -29.231 4.966 1126 H HIS1053 H HIS1053 7.023 -25.516 8.663 1127 HA HIS1053 HA HIS1053 9.889 -25.805 9.096 1128 1HB HIS1053 1HB HIS1053 8.579 -23.923 7.708 1129 2HB HIS1053 2HB HIS1053 8.507 -23.167 9.287 1130 HD1 HIS1053 HD1 HIS1053 10.263 -22.269 6.698 1131 HD2 HIS1053 HD2 HIS1053 11.645 -24.139 10.189 1132 HE1 HIS1053 HE1 HIS1053 12.744 -21.700 6.879 Start of MODEL 3 1 H MET 915 H MET 915 7.752 -23.386 2.351 2 HA MET 915 HA MET 915 9.018 -21.266 2.783 3 1HB MET 915 1HB MET 915 11.056 -23.265 3.034 4 2HB MET 915 2HB MET 915 11.435 -22.403 1.557 5 1HG MET 915 1HG MET 915 11.229 -20.219 2.849 6 2HG MET 915 2HG MET 915 11.012 -21.154 4.315 7 1HE MET 915 1HE MET 915 13.777 -19.337 2.309 8 2HE MET 915 2HE MET 915 13.002 -19.006 3.876 9 3HE MET 915 3HE MET 915 14.711 -19.499 3.815 10 H ALA 916 H ALA 916 7.775 -20.471 1.091 11 HA ALA 916 HA ALA 916 8.349 -21.545 -1.574 12 1HB ALA 916 1HB ALA 916 6.131 -21.388 -1.900 13 2HB ALA 916 2HB ALA 916 5.956 -20.916 -0.193 14 3HB ALA 916 3HB ALA 916 6.145 -19.667 -1.447 15 H ASN 917 H ASN 917 9.948 -20.448 -2.603 16 HA ASN 917 HA ASN 917 10.388 -17.709 -1.895 17 1HB ASN 917 1HB ASN 917 11.847 -19.860 -3.374 18 2HB ASN 917 2HB ASN 917 12.112 -18.247 -4.005 19 1HD2 ASN 917 1HD2 ASN 917 14.287 -18.460 -3.334 20 2HD2 ASN 917 2HD2 ASN 917 14.766 -18.187 -1.692 21 H LEU 918 H LEU 918 8.118 -17.161 -2.832 22 HA LEU 918 HA LEU 918 8.374 -16.724 -5.725 23 1HB LEU 918 1HB LEU 918 6.083 -17.806 -4.131 24 2HB LEU 918 2HB LEU 918 5.761 -16.855 -5.567 25 HG LEU 918 HG LEU 918 7.403 -18.510 -6.744 26 1HD1 LEU 918 1HD1 LEU 918 8.292 -20.093 -5.468 27 2HD1 LEU 918 2HD1 LEU 918 7.272 -19.632 -4.084 28 3HD1 LEU 918 3HD1 LEU 918 6.665 -20.793 -5.290 29 1HD2 LEU 918 1HD2 LEU 918 4.758 -19.708 -5.951 30 2HD2 LEU 918 2HD2 LEU 918 4.840 -18.235 -6.946 31 3HD2 LEU 918 3HD2 LEU 918 5.591 -19.742 -7.523 32 H ASP 919 H ASP 919 9.488 -14.764 -4.531 33 HA ASP 919 HA ASP 919 7.392 -12.867 -3.837 34 1HB ASP 919 1HB ASP 919 9.175 -11.565 -2.731 35 2HB ASP 919 2HB ASP 919 9.134 -13.202 -2.108 36 H ARG 920 H ARG 920 7.731 -13.473 -6.576 37 HA ARG 920 HA ARG 920 9.596 -11.580 -7.644 38 1HB ARG 920 1HB ARG 920 7.797 -13.735 -8.768 39 2HB ARG 920 2HB ARG 920 8.334 -12.470 -9.856 40 1HG ARG 920 1HG ARG 920 10.411 -13.772 -8.101 41 2HG ARG 920 2HG ARG 920 9.782 -14.709 -9.442 42 1HD ARG 920 1HD ARG 920 10.725 -13.314 -11.050 43 2HD ARG 920 2HD ARG 920 10.560 -11.876 -10.062 44 HE ARG 920 HE ARG 920 12.725 -12.240 -9.286 45 1HH1 ARG 920 2HH2 ARG 920 11.409 -15.348 -10.362 46 2HH1 ARG 920 1HH2 ARG 920 12.880 -16.214 -10.069 47 1HH2 ARG 920 1HH1 ARG 920 14.782 -15.038 -9.208 48 H SER 921 H SER 921 6.016 -12.228 -7.766 49 HA SER 921 HA SER 921 5.535 -9.741 -9.037 50 1HB SER 921 1HB SER 921 3.861 -12.013 -7.986 51 2HB SER 921 2HB SER 921 3.068 -10.475 -8.261 52 HG SER 921 HG SER 921 4.728 -11.699 -10.279 53 H ASN 922 H ASN 922 5.508 -11.054 -5.715 54 HA ASN 922 HA ASN 922 4.088 -8.919 -4.594 55 1HB ASN 922 1HB ASN 922 4.669 -9.905 -2.475 56 2HB ASN 922 2HB ASN 922 4.537 -11.258 -3.581 57 1HD2 ASN 922 1HD2 ASN 922 5.944 -11.409 -1.223 58 2HD2 ASN 922 2HD2 ASN 922 7.638 -11.593 -1.533 59 H ASP 923 H ASP 923 7.166 -9.130 -6.028 60 HA ASP 923 HA ASP 923 8.606 -7.530 -4.201 61 1HB ASP 923 1HB ASP 923 9.286 -9.160 -6.294 62 2HB ASP 923 2HB ASP 923 9.389 -7.605 -7.094 63 H LYS 924 H LYS 924 6.907 -7.073 -7.373 64 HA LYS 924 HA LYS 924 7.560 -4.340 -7.619 65 1HB LYS 924 1HB LYS 924 6.165 -6.362 -9.115 66 2HB LYS 924 2HB LYS 924 5.170 -4.922 -9.041 67 1HG LYS 924 1HG LYS 924 8.081 -4.462 -9.576 68 2HG LYS 924 2HG LYS 924 7.193 -5.274 -10.851 69 1HD LYS 924 1HD LYS 924 5.660 -3.448 -11.110 70 2HD LYS 924 2HD LYS 924 6.100 -2.744 -9.567 71 1HE LYS 924 1HE LYS 924 8.107 -3.020 -11.845 72 2HE LYS 924 2HE LYS 924 7.070 -1.617 -11.687 73 1HZ LYS 924 1HZ LYS 924 8.295 -2.227 -9.231 74 2HZ LYS 924 2HZ LYS 924 9.427 -2.053 -10.395 75 3HZ LYS 924 3HZ LYS 924 8.366 -0.847 -10.100 76 H VAL 925 H VAL 925 4.454 -5.999 -6.705 77 HA VAL 925 HA VAL 925 2.976 -3.828 -6.083 78 HB VAL 925 HB VAL 925 3.150 -6.483 -4.646 79 1HG1 VAL 925 1HG1 VAL 925 1.985 -4.717 -3.313 80 2HG1 VAL 925 2HG1 VAL 925 0.835 -4.519 -4.658 81 3HG1 VAL 925 3HG1 VAL 925 0.932 -6.071 -3.790 82 1HG2 VAL 925 1HG2 VAL 925 2.463 -5.956 -7.273 83 2HG2 VAL 925 2HG2 VAL 925 1.989 -7.392 -6.336 84 3HG2 VAL 925 3HG2 VAL 925 0.888 -5.998 -6.447 85 H TYR 926 H TYR 926 5.276 -5.543 -3.857 86 HA TYR 926 HA TYR 926 4.905 -3.803 -1.707 87 1HB TYR 926 1HB TYR 926 7.078 -5.670 -2.787 88 2HB TYR 926 2HB TYR 926 7.395 -4.755 -1.326 89 HD1 TYR 926 HD1 TYR 926 4.201 -6.374 -2.412 90 HD2 TYR 926 HD2 TYR 926 7.453 -6.376 0.367 91 HE1 TYR 926 HE1 TYR 926 3.031 -8.161 -1.033 92 HE2 TYR 926 HE2 TYR 926 6.273 -8.163 1.737 93 HH TYR 926 HH TYR 926 3.298 -8.761 1.733 94 H GLU 927 H GLU 927 7.091 -3.687 -4.558 95 HA GLU 927 HA GLU 927 8.640 -1.583 -3.547 96 1HB GLU 927 1HB GLU 927 8.229 -2.848 -6.258 97 2HB GLU 927 2HB GLU 927 9.114 -1.340 -6.157 98 1HG GLU 927 1HG GLU 927 9.897 -3.452 -4.179 99 2HG GLU 927 2HG GLU 927 10.281 -3.793 -5.855 100 H ASN 928 H ASN 928 5.962 -1.696 -6.006 101 HA ASN 928 HA ASN 928 5.848 0.922 -6.605 102 1HB ASN 928 1HB ASN 928 3.451 -0.930 -6.134 103 2HB ASN 928 2HB ASN 928 3.417 0.533 -7.097 104 1HD2 ASN 928 1HD2 ASN 928 4.896 0.674 -8.935 105 2HD2 ASN 928 2HD2 ASN 928 5.252 -0.748 -9.858 106 H VAL 929 H VAL 929 4.558 -0.833 -3.737 107 HA VAL 929 HA VAL 929 3.040 1.307 -2.713 108 HB VAL 929 HB VAL 929 4.279 -1.112 -1.386 109 1HG1 VAL 929 1HG1 VAL 929 2.578 -0.767 0.379 110 2HG1 VAL 929 2HG1 VAL 929 3.740 0.578 0.285 111 3HG1 VAL 929 3HG1 VAL 929 2.105 0.764 -0.395 112 1HG2 VAL 929 1HG2 VAL 929 2.431 -1.156 -3.355 113 2HG2 VAL 929 2HG2 VAL 929 2.482 -2.342 -2.029 114 3HG2 VAL 929 3HG2 VAL 929 1.364 -0.960 -1.944 115 H THR 930 H THR 930 6.246 -0.044 -1.637 116 HA THR 930 HA THR 930 6.892 1.864 0.190 117 HB THR 930 HB THR 930 9.324 1.280 -0.744 118 HG1 THR 930 HG1 THR 930 9.096 0.111 -2.606 119 1HG2 THR 930 1HG2 THR 930 7.786 0.046 1.129 120 2HG2 THR 930 2HG2 THR 930 7.779 -1.228 -0.115 121 3HG2 THR 930 3HG2 THR 930 9.322 -0.654 0.564 122 H GLY 931 H GLY 931 7.945 2.004 -3.285 123 1HA GLY 931 1HA GLY 931 9.027 4.522 -3.245 124 2HA GLY 931 2HA GLY 931 8.262 3.777 -4.634 125 H LEU 932 H LEU 932 5.600 3.550 -3.165 126 HA LEU 932 HA LEU 932 4.624 6.105 -3.959 127 1HB LEU 932 1HB LEU 932 2.974 4.693 -4.403 128 2HB LEU 932 2HB LEU 932 3.575 3.481 -3.289 129 HG LEU 932 HG LEU 932 2.499 4.704 -1.409 130 1HD1 LEU 932 1HD1 LEU 932 1.129 6.568 -1.680 131 2HD1 LEU 932 2HD1 LEU 932 2.533 6.927 -2.713 132 3HD1 LEU 932 3HD1 LEU 932 1.014 6.355 -3.443 133 1HD2 LEU 932 1HD2 LEU 932 1.092 3.383 -3.635 134 2HD2 LEU 932 2HD2 LEU 932 1.073 3.040 -1.889 135 3HD2 LEU 932 3HD2 LEU 932 0.052 4.339 -2.553 136 H VAL 933 H VAL 933 4.550 4.321 -0.788 137 HA VAL 933 HA VAL 933 3.746 6.548 0.681 138 HB VAL 933 HB VAL 933 4.610 5.203 2.614 139 1HG1 VAL 933 1HG1 VAL 933 2.317 4.978 1.401 140 2HG1 VAL 933 2HG1 VAL 933 2.970 3.432 0.810 141 3HG1 VAL 933 3HG1 VAL 933 2.813 3.721 2.559 142 1HG2 VAL 933 1HG2 VAL 933 6.475 4.135 1.258 143 2HG2 VAL 933 2HG2 VAL 933 5.541 3.038 2.303 144 3HG2 VAL 933 3HG2 VAL 933 5.232 3.075 0.550 145 H LYS 934 H LYS 934 6.950 5.375 -0.384 146 HA LYS 934 HA LYS 934 8.528 6.895 1.304 147 1HB LYS 934 1HB LYS 934 8.997 5.947 -1.536 148 2HB LYS 934 2HB LYS 934 10.237 6.665 -0.527 149 1HG LYS 934 1HG LYS 934 8.807 4.560 0.929 150 2HG LYS 934 2HG LYS 934 9.448 3.942 -0.580 151 1HD LYS 934 1HD LYS 934 11.164 3.659 1.114 152 2HD LYS 934 2HD LYS 934 11.702 4.921 0.023 153 1HE LYS 934 1HE LYS 934 11.218 6.659 1.588 154 2HE LYS 934 2HE LYS 934 10.152 5.639 2.534 155 1HZ LYS 934 1HZ LYS 934 12.123 5.720 3.710 156 2HZ LYS 934 2HZ LYS 934 12.210 4.271 2.962 157 3HZ LYS 934 3HZ LYS 934 13.070 5.537 2.392 158 H ALA 935 H ALA 935 6.848 7.739 -1.759 159 HA ALA 935 HA ALA 935 8.022 10.352 -1.822 160 1HB ALA 935 1HB ALA 935 7.287 10.263 -3.946 161 2HB ALA 935 2HB ALA 935 6.690 8.621 -3.607 162 3HB ALA 935 3HB ALA 935 5.607 10.020 -3.410 163 H VAL 936 H VAL 936 4.872 8.864 -0.872 164 HA VAL 936 HA VAL 936 3.306 10.986 -0.468 165 HB VAL 936 HB VAL 936 3.768 8.489 1.128 166 1HG1 VAL 936 1HG1 VAL 936 1.824 8.953 2.512 167 2HG1 VAL 936 2HG1 VAL 936 3.041 10.233 2.738 168 3HG1 VAL 936 3HG1 VAL 936 1.606 10.536 1.728 169 1HG2 VAL 936 1HG2 VAL 936 1.601 9.501 -0.732 170 2HG2 VAL 936 2HG2 VAL 936 2.698 8.118 -0.963 171 3HG2 VAL 936 3HG2 VAL 936 1.418 8.042 0.271 172 H ILE 937 H ILE 937 6.074 9.980 1.607 173 HA ILE 937 HA ILE 937 5.600 12.208 3.380 174 HB ILE 937 HB ILE 937 7.673 10.020 3.285 175 1HG1 ILE 937 1HG1 ILE 937 5.567 10.482 5.396 176 2HG1 ILE 937 2HG1 ILE 937 5.208 9.582 3.936 177 1HG2 ILE 937 1HG2 ILE 937 8.686 10.835 5.224 178 2HG2 ILE 937 2HG2 ILE 937 8.469 12.284 4.213 179 3HG2 ILE 937 3HG2 ILE 937 7.354 11.966 5.564 180 1HD1 ILE 937 1HD1 ILE 937 5.892 7.982 5.618 181 2HD1 ILE 937 2HD1 ILE 937 7.222 8.103 4.443 182 3HD1 ILE 937 3HD1 ILE 937 7.344 8.933 6.012 183 H GLU 938 H GLU 938 8.479 11.084 1.460 184 HA GLU 938 HA GLU 938 10.043 13.154 1.576 185 1HB GLU 938 1HB GLU 938 9.641 11.059 -0.277 186 2HB GLU 938 2HB GLU 938 9.723 12.505 -1.263 187 1HG GLU 938 1HG GLU 938 11.983 12.384 -1.072 188 2HG GLU 938 2HG GLU 938 11.791 12.886 0.596 189 H MET 939 H MET 939 6.993 13.084 -0.332 190 HA MET 939 HA MET 939 7.262 15.371 -1.745 191 1HB MET 939 1HB MET 939 5.315 13.947 -2.035 192 2HB MET 939 2HB MET 939 4.872 14.079 -0.344 193 1HG MET 939 1HG MET 939 4.480 16.579 -0.727 194 2HG MET 939 2HG MET 939 4.732 16.300 -2.439 195 1HE MET 939 1HE MET 939 3.861 14.256 -3.477 196 2HE MET 939 2HE MET 939 2.693 13.153 -2.710 197 3HE MET 939 3HE MET 939 2.122 14.426 -3.816 198 H SER 940 H SER 940 5.356 15.239 1.354 199 HA SER 940 HA SER 940 5.036 17.832 1.766 200 1HB SER 940 1HB SER 940 5.825 15.805 3.906 201 2HB SER 940 2HB SER 940 5.030 17.335 4.218 202 HG SER 940 HG SER 940 3.265 16.553 2.773 203 H SER 941 H SER 941 8.070 16.002 2.071 204 HA SER 941 HA SER 941 9.455 17.897 3.569 205 1HB SER 941 1HB SER 941 9.999 15.382 2.873 206 2HB SER 941 2HB SER 941 10.841 16.143 1.538 207 HG SER 941 HG SER 941 11.774 15.771 3.999 208 H LYS 942 H LYS 942 9.207 17.268 0.005 209 HA LYS 942 HA LYS 942 10.545 19.836 -0.442 210 1HB LYS 942 1HB LYS 942 10.935 19.003 -2.726 211 2HB LYS 942 2HB LYS 942 11.646 17.966 -1.507 212 1HG LYS 942 1HG LYS 942 10.176 16.220 -1.920 213 2HG LYS 942 2HG LYS 942 8.841 17.288 -2.307 214 1HD LYS 942 1HD LYS 942 10.859 17.703 -4.313 215 2HD LYS 942 2HD LYS 942 10.680 15.971 -4.116 216 1HE LYS 942 1HE LYS 942 8.288 16.079 -4.557 217 2HE LYS 942 2HE LYS 942 8.285 17.829 -4.460 218 1HZ LYS 942 1HZ LYS 942 8.387 17.443 -6.691 219 2HZ LYS 942 2HZ LYS 942 9.976 17.629 -6.360 220 3HZ LYS 942 3HZ LYS 942 9.355 16.133 -6.569 221 H ILE 943 H ILE 943 7.690 19.359 0.477 222 HA ILE 943 HA ILE 943 6.229 20.238 -1.884 223 HB ILE 943 HB ILE 943 5.590 18.453 0.027 224 1HG1 ILE 943 1HG1 ILE 943 4.489 19.068 -2.211 225 2HG1 ILE 943 2HG1 ILE 943 3.482 18.368 -0.959 226 1HG2 ILE 943 1HG2 ILE 943 3.802 19.509 1.435 227 2HG2 ILE 943 2HG2 ILE 943 5.467 19.970 1.864 228 3HG2 ILE 943 3HG2 ILE 943 4.440 21.097 0.946 229 1HD1 ILE 943 1HD1 ILE 943 2.832 20.652 -2.294 230 2HD1 ILE 943 2HD1 ILE 943 2.283 20.307 -0.636 231 3HD1 ILE 943 3HD1 ILE 943 3.701 21.349 -0.907 232 H GLN 944 H GLN 944 6.889 21.252 1.537 233 HA GLN 944 HA GLN 944 5.594 23.578 1.592 234 1HB GLN 944 1HB GLN 944 7.705 22.356 3.050 235 2HB GLN 944 2HB GLN 944 8.259 23.981 2.702 236 1HG GLN 944 1HG GLN 944 6.270 24.965 3.713 237 2HG GLN 944 2HG GLN 944 5.492 23.400 3.846 238 1HE2 GLN 944 1HE2 GLN 944 5.298 24.172 6.094 239 2HE2 GLN 944 2HE2 GLN 944 6.565 23.811 7.219 240 HA PRO 945 HA PRO 945 9.146 25.710 -0.724 241 1HB PRO 945 1HB PRO 945 11.107 24.212 -1.897 242 2HB PRO 945 2HB PRO 945 11.275 24.939 -0.311 243 1HG PRO 945 1HG PRO 945 10.793 22.107 -1.010 244 2HG PRO 945 2HG PRO 945 11.379 22.781 0.497 245 1HD PRO 945 1HD PRO 945 8.731 21.815 -0.037 246 2HD PRO 945 2HD PRO 945 9.286 22.595 1.431 247 H ALA 946 H ALA 946 8.742 22.571 -2.298 248 HA ALA 946 HA ALA 946 8.723 23.215 -4.861 249 1HB ALA 946 1HB ALA 946 8.191 21.002 -4.430 250 2HB ALA 946 2HB ALA 946 6.971 21.421 -3.203 251 3HB ALA 946 3HB ALA 946 6.598 21.617 -4.933 252 HA PRO 947 HA PRO 947 5.773 26.365 -5.366 253 1HB PRO 947 1HB PRO 947 5.871 26.585 -8.088 254 2HB PRO 947 2HB PRO 947 7.024 27.362 -7.022 255 1HG PRO 947 1HG PRO 947 7.387 24.966 -8.715 256 2HG PRO 947 2HG PRO 947 8.608 25.993 -7.989 257 1HD PRO 947 1HD PRO 947 7.789 23.398 -7.083 258 2HD PRO 947 2HD PRO 947 8.925 24.474 -6.293 259 HA PRO 948 HA PRO 948 2.005 24.765 -6.511 260 1HB PRO 948 1HB PRO 948 0.689 26.740 -7.866 261 2HB PRO 948 2HB PRO 948 0.838 26.711 -6.120 262 1HG PRO 948 1HG PRO 948 2.267 28.407 -8.075 263 2HG PRO 948 2HG PRO 948 2.080 28.642 -6.348 264 1HD PRO 948 1HD PRO 948 4.420 27.690 -7.707 265 2HD PRO 948 2HD PRO 948 4.192 27.814 -5.974 266 H GLU 949 H GLU 949 4.098 25.697 -8.995 267 HA GLU 949 HA GLU 949 2.438 24.512 -11.010 268 1HB GLU 949 1HB GLU 949 4.532 26.417 -10.974 269 2HB GLU 949 2HB GLU 949 5.199 25.036 -11.820 270 1HG GLU 949 1HG GLU 949 2.759 25.109 -13.017 271 2HG GLU 949 2HG GLU 949 2.893 26.803 -12.586 272 H GLU 950 H GLU 950 5.036 23.618 -8.814 273 HA GLU 950 HA GLU 950 5.546 21.220 -10.360 274 1HB GLU 950 1HB GLU 950 7.278 22.885 -9.047 275 2HB GLU 950 2HB GLU 950 7.000 21.692 -7.794 276 1HG GLU 950 1HG GLU 950 7.578 20.725 -10.599 277 2HG GLU 950 2HG GLU 950 8.908 21.337 -9.635 278 H TYR 951 H TYR 951 3.421 22.320 -8.000 279 HA TYR 951 HA TYR 951 3.446 19.891 -6.412 280 1HB TYR 951 1HB TYR 951 3.054 22.391 -5.676 281 2HB TYR 951 2HB TYR 951 1.504 22.276 -6.485 282 HD1 TYR 951 HD1 TYR 951 1.930 19.081 -5.304 283 HD2 TYR 951 HD2 TYR 951 1.234 23.036 -3.827 284 HE1 TYR 951 HE1 TYR 951 0.897 18.118 -3.189 285 HE2 TYR 951 HE2 TYR 951 0.204 22.059 -1.718 286 HH TYR 951 HH TYR 951 -1.031 19.649 -1.269 287 H VAL 952 H VAL 952 1.300 21.656 -8.735 288 HA VAL 952 HA VAL 952 -0.892 20.040 -8.621 289 HB VAL 952 HB VAL 952 0.368 21.852 -10.564 290 1HG1 VAL 952 1HG1 VAL 952 -1.461 19.624 -11.469 291 2HG1 VAL 952 2HG1 VAL 952 -1.391 21.185 -12.322 292 3HG1 VAL 952 3HG1 VAL 952 0.070 20.178 -12.187 293 1HG2 VAL 952 1HG2 VAL 952 -1.465 22.339 -8.833 294 2HG2 VAL 952 2HG2 VAL 952 -1.711 22.959 -10.483 295 3HG2 VAL 952 3HG2 VAL 952 -2.570 21.496 -9.945 296 HA PRO 953 HA PRO 953 1.306 17.100 -11.613 297 1HB PRO 953 1HB PRO 953 3.999 17.337 -12.016 298 2HB PRO 953 2HB PRO 953 2.803 18.028 -13.095 299 1HG PRO 953 1HG PRO 953 4.511 19.391 -11.103 300 2HG PRO 953 2HG PRO 953 3.641 20.081 -12.459 301 1HD PRO 953 1HD PRO 953 2.886 20.205 -9.695 302 2HD PRO 953 2HD PRO 953 1.960 20.793 -11.062 303 H MET 954 H MET 954 3.768 18.010 -9.241 304 HA MET 954 HA MET 954 4.796 15.706 -8.590 305 1HB MET 954 1HB MET 954 5.433 17.545 -7.230 306 2HB MET 954 2HB MET 954 3.774 18.005 -6.899 307 1HG MET 954 1HG MET 954 3.557 16.509 -5.136 308 2HG MET 954 2HG MET 954 4.602 15.312 -5.875 309 1HE MET 954 1HE MET 954 4.313 18.685 -4.144 310 2HE MET 954 2HE MET 954 5.971 19.096 -3.645 311 3HE MET 954 3HE MET 954 5.503 19.212 -5.358 312 H VAL 955 H VAL 955 1.572 16.794 -7.311 313 HA VAL 955 HA VAL 955 1.070 14.438 -5.886 314 HB VAL 955 HB VAL 955 -0.477 16.788 -6.860 315 1HG1 VAL 955 1HG1 VAL 955 -1.652 14.114 -6.352 316 2HG1 VAL 955 2HG1 VAL 955 -2.436 15.474 -5.511 317 3HG1 VAL 955 3HG1 VAL 955 -2.284 15.492 -7.285 318 1HG2 VAL 955 1HG2 VAL 955 0.743 15.917 -4.437 319 2HG2 VAL 955 2HG2 VAL 955 -0.130 17.435 -4.756 320 3HG2 VAL 955 3HG2 VAL 955 -1.012 16.011 -4.154 321 H LYS 956 H LYS 956 -0.103 15.553 -9.142 322 HA LYS 956 HA LYS 956 -1.609 13.475 -9.883 323 1HB LYS 956 1HB LYS 956 0.060 15.451 -11.251 324 2HB LYS 956 2HB LYS 956 -0.117 13.975 -12.177 325 1HG LYS 956 1HG LYS 956 -1.989 15.311 -12.814 326 2HG LYS 956 2HG LYS 956 -2.649 14.126 -11.704 327 1HD LYS 956 1HD LYS 956 -1.849 16.202 -9.999 328 2HD LYS 956 2HD LYS 956 -2.437 17.060 -11.409 329 1HE LYS 956 1HE LYS 956 -4.457 15.282 -11.201 330 2HE LYS 956 2HE LYS 956 -3.937 15.241 -9.528 331 1HZ LYS 956 1HZ LYS 956 -5.624 16.984 -10.264 332 2HZ LYS 956 2HZ LYS 956 -4.424 17.449 -9.259 333 3HZ LYS 956 3HZ LYS 956 -4.341 17.808 -10.850 334 H GLU 957 H GLU 957 1.936 13.489 -9.491 335 HA GLU 957 HA GLU 957 2.372 11.070 -10.802 336 1HB GLU 957 1HB GLU 957 3.975 13.021 -9.774 337 2HB GLU 957 2HB GLU 957 4.152 11.815 -8.515 338 1HG GLU 957 1HG GLU 957 4.430 11.025 -11.434 339 2HG GLU 957 2HG GLU 957 5.778 11.758 -10.589 340 H VAL 958 H VAL 958 2.200 11.836 -7.245 341 HA VAL 958 HA VAL 958 2.398 9.295 -6.285 342 HB VAL 958 HB VAL 958 2.048 11.735 -5.234 343 1HG1 VAL 958 1HG1 VAL 958 -0.410 11.657 -5.803 344 2HG1 VAL 958 2HG1 VAL 958 -0.577 10.357 -4.600 345 3HG1 VAL 958 3HG1 VAL 958 -0.039 11.976 -4.092 346 1HG2 VAL 958 1HG2 VAL 958 1.315 9.249 -3.665 347 2HG2 VAL 958 2HG2 VAL 958 2.974 9.606 -4.202 348 3HG2 VAL 958 3HG2 VAL 958 2.141 10.716 -3.087 349 H GLY 959 H GLY 959 -0.469 10.967 -7.668 350 1HA GLY 959 1HA GLY 959 -2.391 9.043 -6.991 351 2HA GLY 959 2HA GLY 959 -2.479 10.194 -8.310 352 H LEU 960 H LEU 960 -0.125 9.345 -9.789 353 HA LEU 960 HA LEU 960 -1.277 7.280 -11.294 354 1HB LEU 960 1HB LEU 960 0.886 9.112 -11.484 355 2HB LEU 960 2HB LEU 960 1.530 7.510 -11.786 356 HG LEU 960 HG LEU 960 -0.983 8.082 -13.219 357 1HD1 LEU 960 1HD1 LEU 960 -0.387 10.214 -13.707 358 2HD1 LEU 960 2HD1 LEU 960 1.346 9.919 -13.431 359 3HD1 LEU 960 3HD1 LEU 960 0.583 9.388 -14.949 360 1HD2 LEU 960 1HD2 LEU 960 -0.181 6.315 -14.297 361 2HD2 LEU 960 2HD2 LEU 960 1.070 7.374 -14.991 362 3HD2 LEU 960 3HD2 LEU 960 1.401 6.469 -13.494 363 H ALA 961 H ALA 961 1.229 7.360 -8.722 364 HA ALA 961 HA ALA 961 2.167 4.776 -8.997 365 1HB ALA 961 1HB ALA 961 1.895 6.728 -6.708 366 2HB ALA 961 2HB ALA 961 2.526 5.089 -6.420 367 3HB ALA 961 3HB ALA 961 3.362 6.179 -7.552 368 H LEU 962 H LEU 962 -0.632 6.048 -7.075 369 HA LEU 962 HA LEU 962 -1.367 3.640 -5.935 370 1HB LEU 962 1HB LEU 962 -3.028 6.031 -6.738 371 2HB LEU 962 2HB LEU 962 -3.616 4.710 -5.748 372 HG LEU 962 HG LEU 962 -1.120 5.915 -4.751 373 1HD1 LEU 962 1HD1 LEU 962 -3.419 7.630 -5.448 374 2HD1 LEU 962 2HD1 LEU 962 -2.817 7.805 -3.782 375 3HD1 LEU 962 3HD1 LEU 962 -1.712 8.044 -5.157 376 1HD2 LEU 962 1HD2 LEU 962 -3.431 5.948 -2.988 377 2HD2 LEU 962 2HD2 LEU 962 -3.206 4.360 -3.759 378 3HD2 LEU 962 3HD2 LEU 962 -1.878 5.094 -2.828 379 H ARG 963 H ARG 963 -2.429 5.149 -9.056 380 HA ARG 963 HA ARG 963 -4.241 3.317 -9.798 381 1HB ARG 963 1HB ARG 963 -2.145 4.610 -11.616 382 2HB ARG 963 2HB ARG 963 -3.669 3.936 -12.157 383 1HG ARG 963 1HG ARG 963 -4.129 5.823 -9.974 384 2HG ARG 963 2HG ARG 963 -3.183 6.587 -11.236 385 1HD ARG 963 1HD ARG 963 -5.417 4.961 -12.306 386 2HD ARG 963 2HD ARG 963 -5.962 6.255 -11.257 387 HE ARG 963 HE ARG 963 -3.963 7.252 -13.084 388 1HH1 ARG 963 2HH2 ARG 963 -7.334 6.247 -12.960 389 2HH1 ARG 963 1HH2 ARG 963 -7.813 7.245 -14.292 390 1HH2 ARG 963 2HH1 ARG 963 -4.595 8.568 -14.842 391 2HH2 ARG 963 1HH1 ARG 963 -6.245 8.574 -15.370 392 H THR 964 H THR 964 -0.674 3.231 -10.533 393 HA THR 964 HA THR 964 -0.733 0.711 -11.775 394 HB THR 964 HB THR 964 1.436 2.399 -10.434 395 HG1 THR 964 HG1 THR 964 1.786 2.838 -12.718 396 1HG2 THR 964 1HG2 THR 964 1.653 -0.145 -12.126 397 2HG2 THR 964 2HG2 THR 964 3.002 0.988 -11.867 398 3HG2 THR 964 3HG2 THR 964 2.307 0.102 -10.489 399 H LEU 965 H LEU 965 -0.365 1.718 -8.357 400 HA LEU 965 HA LEU 965 0.513 -0.684 -7.332 401 1HB LEU 965 1HB LEU 965 0.447 1.406 -6.099 402 2HB LEU 965 2HB LEU 965 -1.305 1.402 -6.121 403 HG LEU 965 HG LEU 965 -0.047 0.654 -3.982 404 1HD1 LEU 965 1HD1 LEU 965 -2.255 -1.135 -5.027 405 2HD1 LEU 965 2HD1 LEU 965 -1.871 -0.756 -3.331 406 3HD1 LEU 965 3HD1 LEU 965 -2.504 0.514 -4.406 407 1HD2 LEU 965 1HD2 LEU 965 0.091 -1.930 -5.561 408 2HD2 LEU 965 2HD2 LEU 965 1.479 -0.919 -5.091 409 3HD2 LEU 965 3HD2 LEU 965 0.493 -1.714 -3.840 410 H LEU 966 H LEU 966 -2.803 0.410 -8.200 411 HA LEU 966 HA LEU 966 -4.175 -1.730 -7.087 412 1HB LEU 966 1HB LEU 966 -4.699 0.230 -9.283 413 2HB LEU 966 2HB LEU 966 -5.790 -1.125 -9.072 414 HG LEU 966 HG LEU 966 -5.986 -0.378 -6.618 415 1HD1 LEU 966 1HD1 LEU 966 -5.553 2.000 -6.186 416 2HD1 LEU 966 2HD1 LEU 966 -4.057 1.108 -6.553 417 3HD1 LEU 966 3HD1 LEU 966 -4.796 2.152 -7.790 418 1HD2 LEU 966 1HD2 LEU 966 -7.527 1.614 -7.412 419 2HD2 LEU 966 2HD2 LEU 966 -7.160 0.953 -9.024 420 3HD2 LEU 966 3HD2 LEU 966 -7.926 -0.078 -7.792 421 H ALA 967 H ALA 967 -3.040 -1.280 -10.514 422 HA ALA 967 HA ALA 967 -3.778 -3.750 -11.445 423 1HB ALA 967 1HB ALA 967 -1.451 -3.221 -12.809 424 2HB ALA 967 2HB ALA 967 -3.032 -2.493 -13.181 425 3HB ALA 967 3HB ALA 967 -1.864 -1.612 -12.168 426 H THR 968 H THR 968 -0.522 -2.791 -10.130 427 HA THR 968 HA THR 968 0.646 -5.274 -10.209 428 HB THR 968 HB THR 968 2.060 -4.290 -8.319 429 HG1 THR 968 HG1 THR 968 1.077 -2.612 -7.248 430 1HG2 THR 968 1HG2 THR 968 2.779 -2.243 -9.546 431 2HG2 THR 968 2HG2 THR 968 2.547 -3.594 -10.681 432 3HG2 THR 968 3HG2 THR 968 1.309 -2.323 -10.547 433 H VAL 969 H VAL 969 -1.463 -3.893 -7.626 434 HA VAL 969 HA VAL 969 -1.184 -6.005 -5.849 435 HB VAL 969 HB VAL 969 -3.204 -3.869 -6.377 436 1HG1 VAL 969 1HG1 VAL 969 -4.473 -4.667 -4.339 437 2HG1 VAL 969 2HG1 VAL 969 -4.680 -5.657 -5.804 438 3HG1 VAL 969 3HG1 VAL 969 -3.607 -6.214 -4.497 439 1HG2 VAL 969 1HG2 VAL 969 -2.491 -3.004 -4.296 440 2HG2 VAL 969 2HG2 VAL 969 -1.756 -4.550 -3.809 441 3HG2 VAL 969 3HG2 VAL 969 -1.008 -3.576 -5.097 442 H ASP 970 H ASP 970 -3.328 -5.546 -8.700 443 HA ASP 970 HA ASP 970 -5.051 -7.583 -8.308 444 1HB ASP 970 1HB ASP 970 -4.613 -5.846 -10.318 445 2HB ASP 970 2HB ASP 970 -3.835 -7.235 -11.049 446 H GLU 971 H GLU 971 -1.626 -7.623 -9.351 447 HA GLU 971 HA GLU 971 -1.729 -10.377 -10.089 448 1HB GLU 971 1HB GLU 971 0.399 -8.239 -9.986 449 2HB GLU 971 2HB GLU 971 0.898 -9.915 -10.086 450 1HG GLU 971 1HG GLU 971 -0.926 -10.011 -12.045 451 2HG GLU 971 2HG GLU 971 -0.664 -8.279 -12.089 452 H SER 972 H SER 972 -1.188 -8.475 -7.199 453 HA SER 972 HA SER 972 0.282 -10.560 -5.903 454 1HB SER 972 1HB SER 972 -0.265 -7.748 -5.455 455 2HB SER 972 2HB SER 972 -0.683 -8.643 -4.009 456 HG SER 972 HG SER 972 1.775 -9.343 -5.243 457 H LEU 973 H LEU 973 -3.050 -9.301 -6.127 458 HA LEU 973 HA LEU 973 -4.277 -10.243 -3.944 459 1HB LEU 973 1HB LEU 973 -4.999 -9.738 -6.716 460 2HB LEU 973 2HB LEU 973 -5.986 -11.000 -6.005 461 HG LEU 973 HG LEU 973 -5.885 -8.095 -5.416 462 1HD1 LEU 973 1HD1 LEU 973 -8.024 -10.235 -5.428 463 2HD1 LEU 973 2HD1 LEU 973 -8.319 -8.546 -4.947 464 3HD1 LEU 973 3HD1 LEU 973 -7.774 -8.919 -6.600 465 1HD2 LEU 973 1HD2 LEU 973 -6.935 -8.604 -3.117 466 2HD2 LEU 973 2HD2 LEU 973 -6.110 -10.176 -3.251 467 3HD2 LEU 973 3HD2 LEU 973 -5.164 -8.669 -3.277 468 HA PRO 974 HA PRO 974 -4.214 -14.643 -5.670 469 1HB PRO 974 1HB PRO 974 -2.674 -15.241 -7.847 470 2HB PRO 974 2HB PRO 974 -4.386 -14.882 -7.954 471 1HG PRO 974 1HG PRO 974 -2.085 -13.176 -8.686 472 2HG PRO 974 2HG PRO 974 -3.763 -13.022 -9.167 473 1HD PRO 974 1HD PRO 974 -2.392 -11.454 -7.195 474 2HD PRO 974 2HD PRO 974 -4.097 -11.379 -7.594 475 H VAL 975 H VAL 975 -1.197 -12.920 -5.970 476 HA VAL 975 HA VAL 975 0.556 -14.919 -5.376 477 HB VAL 975 HB VAL 975 0.469 -11.995 -4.663 478 1HG1 VAL 975 1HG1 VAL 975 2.752 -12.072 -3.919 479 2HG1 VAL 975 2HG1 VAL 975 1.829 -13.262 -2.970 480 3HG1 VAL 975 3HG1 VAL 975 2.877 -13.806 -4.302 481 1HG2 VAL 975 1HG2 VAL 975 1.810 -11.656 -6.529 482 2HG2 VAL 975 2HG2 VAL 975 2.407 -13.333 -6.539 483 3HG2 VAL 975 3HG2 VAL 975 0.746 -12.976 -7.071 484 H LEU 976 H LEU 976 -1.910 -13.448 -3.330 485 HA LEU 976 HA LEU 976 -0.788 -14.880 -1.028 486 1HB LEU 976 1HB LEU 976 -2.786 -12.614 -1.096 487 2HB LEU 976 2HB LEU 976 -2.156 -13.394 0.342 488 HG LEU 976 HG LEU 976 -0.993 -11.355 0.137 489 1HD1 LEU 976 1HD1 LEU 976 0.337 -13.651 0.371 490 2HD1 LEU 976 2HD1 LEU 976 1.097 -13.061 -1.127 491 3HD1 LEU 976 3HD1 LEU 976 1.155 -12.070 0.350 492 1HD2 LEU 976 1HD2 LEU 976 -0.260 -12.016 -2.725 493 2HD2 LEU 976 2HD2 LEU 976 -1.619 -10.967 -2.256 494 3HD2 LEU 976 3HD2 LEU 976 0.048 -10.503 -1.839 495 HA PRO 977 HA PRO 977 -4.158 -17.572 -1.108 496 1HB PRO 977 1HB PRO 977 -4.492 -18.207 1.529 497 2HB PRO 977 2HB PRO 977 -3.243 -18.914 0.524 498 1HG PRO 977 1HG PRO 977 -2.987 -16.841 2.616 499 2HG PRO 977 2HG PRO 977 -1.739 -17.852 1.913 500 1HD PRO 977 1HD PRO 977 -2.239 -15.087 1.333 501 2HD PRO 977 2HD PRO 977 -1.069 -16.128 0.547 502 H ALA 978 H ALA 978 -6.393 -18.157 -0.087 503 HA ALA 978 HA ALA 978 -8.076 -16.101 -0.651 504 1HB ALA 978 1HB ALA 978 -8.192 -18.722 0.603 505 2HB ALA 978 2HB ALA 978 -9.340 -17.602 1.376 506 3HB ALA 978 3HB ALA 978 -9.418 -17.884 -0.380 507 H SER 979 H SER 979 -9.705 -15.124 1.090 508 HA SER 979 HA SER 979 -10.049 -13.775 2.759 509 1HB SER 979 1HB SER 979 -7.506 -14.843 4.062 510 2HB SER 979 2HB SER 979 -8.794 -13.968 4.867 511 HG SER 979 HG SER 979 -9.772 -16.175 3.493 512 H THR 980 H THR 980 -8.298 -13.135 0.399 513 HA THR 980 HA THR 980 -6.781 -10.908 1.595 514 HB THR 980 HB THR 980 -5.546 -11.215 -0.758 515 HG1 THR 980 HG1 THR 980 -6.480 -12.984 -1.712 516 1HG2 THR 980 1HG2 THR 980 -4.232 -11.668 1.211 517 2HG2 THR 980 2HG2 THR 980 -5.271 -13.035 1.677 518 3HG2 THR 980 3HG2 THR 980 -4.185 -13.181 0.275 519 H HIS 981 H HIS 981 -8.324 -11.863 -1.552 520 HA HIS 981 HA HIS 981 -8.655 -9.404 -2.577 521 1HB HIS 981 1HB HIS 981 -10.910 -10.473 -3.477 522 2HB HIS 981 2HB HIS 981 -9.335 -10.999 -4.036 523 HD1 HIS 981 HD1 HIS 981 -11.815 -11.996 -1.275 524 HD2 HIS 981 HD2 HIS 981 -9.011 -13.703 -3.886 525 HE1 HIS 981 HE1 HIS 981 -11.951 -14.519 -0.920 526 H ARG 982 H ARG 982 -10.294 -10.796 0.220 527 HA ARG 982 HA ARG 982 -12.395 -8.905 0.178 528 1HB ARG 982 1HB ARG 982 -12.852 -10.995 1.280 529 2HB ARG 982 2HB ARG 982 -11.373 -10.923 2.217 530 1HG ARG 982 1HG ARG 982 -12.392 -9.756 3.877 531 2HG ARG 982 2HG ARG 982 -12.978 -8.549 2.750 532 1HD ARG 982 1HD ARG 982 -14.818 -9.789 3.984 533 2HD ARG 982 2HD ARG 982 -14.963 -9.854 2.239 534 HE ARG 982 HE ARG 982 -13.414 -12.103 3.123 535 1HH1 ARG 982 2HH2 ARG 982 -16.718 -10.892 3.172 536 2HH1 ARG 982 1HH2 ARG 982 -17.431 -12.469 3.249 537 1HH2 ARG 982 2HH1 ARG 982 -14.354 -14.184 3.224 538 2HH2 ARG 982 1HH1 ARG 982 -16.077 -14.354 3.278 539 H GLU 983 H GLU 983 -9.776 -9.522 2.642 540 HA GLU 983 HA GLU 983 -10.056 -7.098 3.893 541 1HB GLU 983 1HB GLU 983 -7.690 -8.997 3.662 542 2HB GLU 983 2HB GLU 983 -7.644 -7.575 4.684 543 1HG GLU 983 1HG GLU 983 -9.985 -8.561 5.572 544 2HG GLU 983 2HG GLU 983 -9.320 -10.067 4.972 545 H ILE 984 H ILE 984 -7.921 -8.088 1.155 546 HA ILE 984 HA ILE 984 -6.444 -5.742 1.001 547 HB ILE 984 HB ILE 984 -7.103 -8.008 -0.802 548 1HG1 ILE 984 1HG1 ILE 984 -4.541 -7.961 -0.940 549 2HG1 ILE 984 2HG1 ILE 984 -4.596 -6.753 0.328 550 1HG2 ILE 984 1HG2 ILE 984 -6.099 -5.333 -1.755 551 2HG2 ILE 984 2HG2 ILE 984 -5.627 -6.845 -2.568 552 3HG2 ILE 984 3HG2 ILE 984 -7.345 -6.390 -2.461 553 1HD1 ILE 984 1HD1 ILE 984 -4.345 -8.870 1.436 554 2HD1 ILE 984 2HD1 ILE 984 -6.043 -8.394 1.677 555 3HD1 ILE 984 3HD1 ILE 984 -5.627 -9.615 0.451 556 H GLU 985 H GLU 985 -9.740 -6.554 -0.065 557 HA GLU 985 HA GLU 985 -10.001 -4.357 -1.780 558 1HB GLU 985 1HB GLU 985 -11.635 -6.552 -0.815 559 2HB GLU 985 2HB GLU 985 -12.566 -5.070 -0.741 560 1HG GLU 985 1HG GLU 985 -10.980 -5.362 -3.238 561 2HG GLU 985 2HG GLU 985 -12.192 -6.609 -3.023 562 H MET 986 H MET 986 -10.608 -4.905 1.717 563 HA MET 986 HA MET 986 -12.005 -2.549 2.158 564 1HB MET 986 1HB MET 986 -10.349 -4.464 3.846 565 2HB MET 986 2HB MET 986 -10.932 -2.984 4.581 566 1HG MET 986 1HG MET 986 -13.209 -3.944 3.268 567 2HG MET 986 2HG MET 986 -12.435 -5.419 3.814 568 1HE MET 986 1HE MET 986 -15.003 -2.758 6.222 569 2HE MET 986 2HE MET 986 -14.353 -2.303 4.629 570 3HE MET 986 3HE MET 986 -15.292 -3.805 4.812 571 H ALA 987 H ALA 987 -8.491 -3.327 2.173 572 HA ALA 987 HA ALA 987 -7.744 -0.756 3.156 573 1HB ALA 987 1HB ALA 987 -6.097 -2.265 3.653 574 2HB ALA 987 2HB ALA 987 -6.428 -3.262 2.216 575 3HB ALA 987 3HB ALA 987 -5.479 -1.764 2.061 576 H GLN 988 H GLN 988 -8.235 -2.307 -0.029 577 HA GLN 988 HA GLN 988 -6.914 -0.437 -1.555 578 1HB GLN 988 1HB GLN 988 -9.160 -2.388 -2.041 579 2HB GLN 988 2HB GLN 988 -8.808 -1.208 -3.288 580 1HG GLN 988 1HG GLN 988 -6.332 -2.398 -2.269 581 2HG GLN 988 2HG GLN 988 -7.438 -3.645 -2.809 582 1HE2 GLN 988 1HE2 GLN 988 -8.650 -2.990 -4.911 583 2HE2 GLN 988 2HE2 GLN 988 -7.654 -2.421 -6.209 584 H LYS 989 H LYS 989 -10.187 -0.430 -0.103 585 HA LYS 989 HA LYS 989 -10.977 1.928 -1.530 586 1HB LYS 989 1HB LYS 989 -12.230 -0.118 0.048 587 2HB LYS 989 2HB LYS 989 -12.649 1.443 0.724 588 1HG LYS 989 1HG LYS 989 -14.220 1.560 -0.922 589 2HG LYS 989 2HG LYS 989 -12.889 1.935 -1.999 590 1HD LYS 989 1HD LYS 989 -12.743 -0.280 -2.818 591 2HD LYS 989 2HD LYS 989 -13.519 -0.966 -1.404 592 1HE LYS 989 1HE LYS 989 -15.575 -0.786 -2.355 593 2HE LYS 989 2HE LYS 989 -15.335 0.917 -2.692 594 1HZ LYS 989 1HZ LYS 989 -14.401 0.437 -4.728 595 2HZ LYS 989 2HZ LYS 989 -14.056 -1.116 -4.356 596 3HZ LYS 989 3HZ LYS 989 -15.601 -0.666 -4.630 597 H LEU 990 H LEU 990 -9.284 1.109 1.450 598 HA LEU 990 HA LEU 990 -9.779 3.574 2.757 599 1HB LEU 990 1HB LEU 990 -8.684 1.109 3.399 600 2HB LEU 990 2HB LEU 990 -7.313 2.198 3.478 601 HG LEU 990 HG LEU 990 -9.926 2.580 4.968 602 1HD1 LEU 990 1HD1 LEU 990 -7.638 0.919 5.542 603 2HD1 LEU 990 2HD1 LEU 990 -7.811 2.189 6.776 604 3HD1 LEU 990 3HD1 LEU 990 -9.170 1.093 6.430 605 1HD2 LEU 990 1HD2 LEU 990 -7.314 4.080 5.288 606 2HD2 LEU 990 2HD2 LEU 990 -8.725 4.682 4.385 607 3HD2 LEU 990 3HD2 LEU 990 -8.850 4.383 6.135 608 H LEU 991 H LEU 991 -6.887 2.250 0.995 609 HA LEU 991 HA LEU 991 -5.350 4.514 1.117 610 1HB LEU 991 1HB LEU 991 -4.539 2.360 0.385 611 2HB LEU 991 2HB LEU 991 -5.554 2.413 -1.042 612 HG LEU 991 HG LEU 991 -4.266 4.217 -1.989 613 1HD1 LEU 991 1HD1 LEU 991 -2.023 4.573 -0.390 614 2HD1 LEU 991 2HD1 LEU 991 -3.366 5.719 -0.615 615 3HD1 LEU 991 3HD1 LEU 991 -3.382 4.589 0.760 616 1HD2 LEU 991 1HD2 LEU 991 -3.277 2.256 -2.656 617 2HD2 LEU 991 2HD2 LEU 991 -1.903 3.072 -1.874 618 3HD2 LEU 991 3HD2 LEU 991 -2.796 1.801 -1.004 619 H ASN 992 H ASN 992 -7.437 3.536 -1.700 620 HA ASN 992 HA ASN 992 -7.191 5.699 -3.200 621 1HB ASN 992 1HB ASN 992 -9.219 3.647 -2.799 622 2HB ASN 992 2HB ASN 992 -10.021 5.167 -3.140 623 1HD2 ASN 992 1HD2 ASN 992 -9.561 6.297 -5.061 624 2HD2 ASN 992 2HD2 ASN 992 -8.928 5.505 -6.465 625 H SER 993 H SER 993 -9.667 5.273 -0.552 626 HA SER 993 HA SER 993 -10.918 7.619 -0.656 627 1HB SER 993 1HB SER 993 -10.353 5.621 1.404 628 2HB SER 993 2HB SER 993 -10.478 7.218 2.115 629 HG SER 993 HG SER 993 -12.442 5.838 0.505 630 H ASP 994 H ASP 994 -8.170 7.093 1.680 631 HA ASP 994 HA ASP 994 -7.800 9.707 2.283 632 1HB ASP 994 1HB ASP 994 -6.713 7.747 3.410 633 2HB ASP 994 2HB ASP 994 -5.663 7.538 2.023 634 H LEU 995 H LEU 995 -6.671 7.768 -0.508 635 HA LEU 995 HA LEU 995 -4.681 9.466 -1.446 636 1HB LEU 995 1HB LEU 995 -4.511 7.593 -2.617 637 2HB LEU 995 2HB LEU 995 -6.191 7.164 -2.362 638 HG LEU 995 HG LEU 995 -6.866 8.602 -4.237 639 1HD1 LEU 995 1HD1 LEU 995 -3.990 9.384 -4.162 640 2HD1 LEU 995 2HD1 LEU 995 -4.785 9.276 -5.751 641 3HD1 LEU 995 3HD1 LEU 995 -5.441 10.358 -4.499 642 1HD2 LEU 995 1HD2 LEU 995 -5.000 6.316 -4.542 643 2HD2 LEU 995 2HD2 LEU 995 -6.676 6.523 -5.103 644 3HD2 LEU 995 3HD2 LEU 995 -5.337 7.271 -6.006 645 H ALA 996 H ALA 996 -8.156 9.228 -2.498 646 HA ALA 996 HA ALA 996 -8.069 11.463 -4.144 647 1HB ALA 996 1HB ALA 996 -10.635 11.411 -3.581 648 2HB ALA 996 2HB ALA 996 -9.898 10.039 -4.444 649 3HB ALA 996 3HB ALA 996 -10.223 9.921 -2.698 650 H GLU 997 H GLU 997 -9.035 11.118 -0.665 651 HA GLU 997 HA GLU 997 -9.784 13.703 -0.259 652 1HB GLU 997 1HB GLU 997 -10.085 11.849 1.370 653 2HB GLU 997 2HB GLU 997 -8.361 11.830 1.684 654 1HG GLU 997 1HG GLU 997 -8.968 13.232 3.412 655 2HG GLU 997 2HG GLU 997 -8.810 14.456 2.168 656 H LEU 998 H LEU 998 -6.550 12.317 -0.645 657 HA LEU 998 HA LEU 998 -5.195 14.565 0.481 658 1HB LEU 998 1HB LEU 998 -4.080 12.524 0.642 659 2HB LEU 998 2HB LEU 998 -4.391 12.101 -1.030 660 HG LEU 998 HG LEU 998 -2.008 12.730 -0.420 661 1HD1 LEU 998 1HD1 LEU 998 -2.792 14.595 -2.582 662 2HD1 LEU 998 2HD1 LEU 998 -1.612 13.263 -2.575 663 3HD1 LEU 998 3HD1 LEU 998 -3.348 12.913 -2.757 664 1HD2 LEU 998 1HD2 LEU 998 -3.353 15.383 -0.018 665 2HD2 LEU 998 2HD2 LEU 998 -2.103 14.578 0.960 666 3HD2 LEU 998 3HD2 LEU 998 -1.674 15.310 -0.605 667 H ILE 999 H ILE 999 -5.768 13.313 -2.879 668 HA ILE 999 HA ILE 999 -4.485 15.223 -4.296 669 HB ILE 999 HB ILE 999 -7.098 13.821 -4.835 670 1HG1 ILE 999 1HG1 ILE 999 -5.121 12.383 -4.561 671 2HG1 ILE 999 2HG1 ILE 999 -5.761 12.331 -6.192 672 1HG2 ILE 999 1HG2 ILE 999 -5.981 14.530 -7.287 673 2HG2 ILE 999 2HG2 ILE 999 -7.440 15.215 -6.533 674 3HG2 ILE 999 3HG2 ILE 999 -5.862 16.005 -6.298 675 1HD1 ILE 999 1HD1 ILE 999 -3.227 13.639 -5.188 676 2HD1 ILE 999 2HD1 ILE 999 -3.464 12.577 -6.597 677 3HD1 ILE 999 3HD1 ILE 999 -4.012 14.269 -6.656 678 H ASN1000 H ASN1000 -7.690 15.472 -2.680 679 HA ASN1000 HA ASN1000 -8.431 17.877 -3.764 680 1HB ASN1000 1HB ASN1000 -9.876 16.381 -2.331 681 2HB ASN1000 2HB ASN1000 -8.943 16.848 -0.922 682 1HD2 ASN1000 1HD2 ASN1000 -10.934 17.575 -0.034 683 2HD2 ASN1000 2HD2 ASN1000 -11.586 19.130 -0.431 684 H LYS1001 H LYS1001 -6.944 17.214 -0.492 685 HA LYS1001 HA LYS1001 -6.507 19.781 0.294 686 1HB LYS1001 1HB LYS1001 -5.447 17.127 0.956 687 2HB LYS1001 2HB LYS1001 -4.301 18.415 1.267 688 1HG LYS1001 1HG LYS1001 -5.473 18.502 3.264 689 2HG LYS1001 2HG LYS1001 -6.453 19.618 2.334 690 1HD LYS1001 1HD LYS1001 -8.235 18.156 2.184 691 2HD LYS1001 2HD LYS1001 -7.206 16.744 2.037 692 1HE LYS1001 1HE LYS1001 -7.242 16.341 4.288 693 2HE LYS1001 2HE LYS1001 -6.957 18.024 4.686 694 1HZ LYS1001 1HZ LYS1001 -9.558 17.388 3.615 695 2HZ LYS1001 2HZ LYS1001 -9.243 16.834 5.118 696 3HZ LYS1001 3HZ LYS1001 -9.146 18.432 4.800 697 H MET1002 H MET1002 -4.969 18.005 -2.307 698 HA MET1002 HA MET1002 -2.741 19.814 -2.380 699 1HB MET1002 1HB MET1002 -2.002 17.746 -3.161 700 2HB MET1002 2HB MET1002 -3.601 17.265 -3.693 701 1HG MET1002 1HG MET1002 -2.072 17.559 -5.630 702 2HG MET1002 2HG MET1002 -3.402 18.697 -5.707 703 1HE MET1002 1HE MET1002 -2.715 21.407 -6.250 704 2HE MET1002 2HE MET1002 -1.134 21.229 -7.047 705 3HE MET1002 3HE MET1002 -2.397 19.999 -7.292 706 H LYS1003 H LYS1003 -5.547 18.920 -4.513 707 HA LYS1003 HA LYS1003 -5.088 20.754 -6.505 708 1HB LYS1003 1HB LYS1003 -7.191 18.986 -5.670 709 2HB LYS1003 2HB LYS1003 -7.900 20.524 -6.120 710 1HG LYS1003 1HG LYS1003 -6.113 20.250 -8.167 711 2HG LYS1003 2HG LYS1003 -6.391 18.557 -7.810 712 1HD LYS1003 1HD LYS1003 -8.014 19.240 -9.488 713 2HD LYS1003 2HD LYS1003 -8.878 18.960 -7.988 714 1HE LYS1003 1HE LYS1003 -9.342 21.220 -7.660 715 2HE LYS1003 2HE LYS1003 -7.870 21.753 -8.447 716 1HZ LYS1003 1HZ LYS1003 -10.314 20.777 -9.734 717 2HZ LYS1003 2HZ LYS1003 -9.626 22.251 -9.878 718 3HZ LYS1003 3HZ LYS1003 -8.908 20.945 -10.548 719 H LEU1004 H LEU1004 -6.301 21.212 -3.209 720 HA LEU1004 HA LEU1004 -7.305 23.839 -3.752 721 1HB LEU1004 1HB LEU1004 -6.706 22.620 -1.064 722 2HB LEU1004 2HB LEU1004 -7.820 23.920 -1.440 723 HG LEU1004 HG LEU1004 -8.334 21.288 -2.742 724 1HD1 LEU1004 1HD1 LEU1004 -8.635 20.066 -0.913 725 2HD1 LEU1004 2HD1 LEU1004 -7.829 21.356 0.012 726 3HD1 LEU1004 3HD1 LEU1004 -9.602 21.347 -0.142 727 1HD2 LEU1004 1HD2 LEU1004 -9.877 22.953 -3.309 728 2HD2 LEU1004 2HD2 LEU1004 -10.706 21.988 -2.063 729 3HD2 LEU1004 3HD2 LEU1004 -9.983 23.558 -1.638 730 H ALA1005 H ALA1005 -4.424 22.425 -2.062 731 HA ALA1005 HA ALA1005 -3.185 24.612 -1.163 732 1HB ALA1005 1HB ALA1005 -1.277 22.986 -2.634 733 2HB ALA1005 2HB ALA1005 -1.534 23.113 -0.877 734 3HB ALA1005 3HB ALA1005 -2.492 21.959 -1.836 735 H GLN1006 H GLN1006 -3.169 23.469 -4.602 736 HA GLN1006 HA GLN1006 -1.474 25.149 -5.730 737 1HB GLN1006 1HB GLN1006 -3.187 23.435 -6.755 738 2HB GLN1006 2HB GLN1006 -4.219 24.834 -6.974 739 1HG GLN1006 1HG GLN1006 -1.354 25.045 -7.894 740 2HG GLN1006 2HG GLN1006 -2.449 24.070 -8.854 741 1HE2 GLN1006 1HE2 GLN1006 -1.137 26.999 -8.640 742 2HE2 GLN1006 2HE2 GLN1006 -2.360 28.005 -9.341 743 H GLN1007 H GLN1007 -4.853 25.981 -4.745 744 HA GLN1007 HA GLN1007 -4.321 28.725 -5.482 745 1HB GLN1007 1HB GLN1007 -6.528 27.332 -5.936 746 2HB GLN1007 2HB GLN1007 -6.922 27.752 -4.280 747 1HG GLN1007 1HG GLN1007 -7.260 29.975 -4.776 748 2HG GLN1007 2HG GLN1007 -5.931 30.035 -5.917 749 1HE2 GLN1007 1HE2 GLN1007 -9.297 29.398 -5.422 750 2HE2 GLN1007 2HE2 GLN1007 -9.786 29.269 -7.079 751 H TYR1008 H TYR1008 -4.816 26.599 -2.657 752 HA TYR1008 HA TYR1008 -4.865 28.855 -0.842 753 1HB TYR1008 1HB TYR1008 -4.949 25.789 -0.731 754 2HB TYR1008 2HB TYR1008 -4.800 26.713 0.750 755 HD1 TYR1008 HD1 TYR1008 -6.659 28.162 1.522 756 HD2 TYR1008 HD2 TYR1008 -7.041 25.688 -1.947 757 HE1 TYR1008 HE1 TYR1008 -9.186 28.428 1.602 758 HE2 TYR1008 HE2 TYR1008 -9.567 25.963 -1.856 759 HH TYR1008 HH TYR1008 -11.262 26.461 -0.196 760 H VAL1009 H VAL1009 -2.484 28.760 -2.441 761 HA VAL1009 HA VAL1009 -0.550 28.147 -0.322 762 HB VAL1009 HB VAL1009 -0.540 27.374 -3.217 763 1HG1 VAL1009 1HG1 VAL1009 1.529 28.259 -3.424 764 2HG1 VAL1009 2HG1 VAL1009 1.767 28.388 -1.665 765 3HG1 VAL1009 3HG1 VAL1009 2.028 26.831 -2.486 766 1HG2 VAL1009 1HG2 VAL1009 -1.132 25.881 -1.141 767 2HG2 VAL1009 2HG2 VAL1009 -0.117 25.231 -2.450 768 3HG2 VAL1009 3HG2 VAL1009 0.634 25.801 -0.940 769 H MET1010 H MET1010 -1.251 29.938 -3.392 770 HA MET1010 HA MET1010 0.731 31.645 -3.550 771 1HB MET1010 1HB MET1010 -1.307 33.411 -3.967 772 2HB MET1010 2HB MET1010 -0.945 32.125 -5.102 773 1HG MET1010 1HG MET1010 -2.831 30.911 -4.544 774 2HG MET1010 2HG MET1010 -2.728 31.324 -2.845 775 1HE MET1010 1HE MET1010 -5.465 33.552 -2.372 776 2HE MET1010 2HE MET1010 -5.712 31.899 -2.983 777 3HE MET1010 3HE MET1010 -4.367 32.245 -1.869 778 H THR1011 H THR1011 -1.692 31.598 -0.943 779 HA THR1011 HA THR1011 -0.469 34.016 0.198 780 HB THR1011 HB THR1011 -2.946 34.034 -0.219 781 HG1 THR1011 HG1 THR1011 -2.090 33.684 2.569 782 1HG2 THR1011 1HG2 THR1011 -3.888 31.916 0.103 783 2HG2 THR1011 2HG2 THR1011 -2.740 31.494 1.396 784 3HG2 THR1011 3HG2 THR1011 -4.112 32.575 1.741 785 H SER1012 H SER1012 -0.174 34.036 2.594 786 HA SER1012 HA SER1012 1.611 32.214 3.366 787 1HB SER1012 1HB SER1012 -0.172 34.134 4.753 788 2HB SER1012 2HB SER1012 0.393 32.836 5.785 789 HG SER1012 HG SER1012 2.599 33.466 4.631 790 H LEU1013 H LEU1013 -1.940 31.928 3.427 791 HA LEU1013 HA LEU1013 -2.436 29.980 5.196 792 1HB LEU1013 1HB LEU1013 -3.749 31.137 3.080 793 2HB LEU1013 2HB LEU1013 -3.665 29.458 2.585 794 HG LEU1013 HG LEU1013 -5.755 29.981 3.756 795 1HD1 LEU1013 1HD1 LEU1013 -5.697 27.819 4.248 796 2HD1 LEU1013 2HD1 LEU1013 -3.926 27.854 4.423 797 3HD1 LEU1013 3HD1 LEU1013 -4.965 28.237 5.816 798 1HD2 LEU1013 1HD2 LEU1013 -5.904 30.715 5.974 799 2HD2 LEU1013 2HD2 LEU1013 -4.189 30.370 6.304 800 3HD2 LEU1013 3HD2 LEU1013 -4.636 31.735 5.252 801 H GLN1014 H GLN1014 -0.505 29.717 2.242 802 HA GLN1014 HA GLN1014 -0.532 27.184 1.576 803 1HB GLN1014 1HB GLN1014 1.043 28.841 0.647 804 2HB GLN1014 2HB GLN1014 1.981 28.823 2.128 805 1HG GLN1014 1HG GLN1014 1.778 26.097 1.374 806 2HG GLN1014 2HG GLN1014 2.052 26.954 -0.130 807 1HE2 GLN1014 1HE2 GLN1014 3.947 28.023 -0.507 808 2HE2 GLN1014 2HE2 GLN1014 5.359 27.878 0.486 809 H GLN1015 H GLN1015 1.949 28.192 4.035 810 HA GLN1015 HA GLN1015 2.683 25.837 4.935 811 1HB GLN1015 1HB GLN1015 3.230 26.885 7.069 812 2HB GLN1015 2HB GLN1015 3.492 28.044 5.781 813 1HG GLN1015 1HG GLN1015 1.264 29.072 6.238 814 2HG GLN1015 2HG GLN1015 0.975 27.900 7.508 815 1HE2 GLN1015 1HE2 GLN1015 1.487 28.437 9.487 816 2HE2 GLN1015 2HE2 GLN1015 2.590 29.676 9.986 817 H GLU1016 H GLU1016 -0.399 27.487 5.785 818 HA GLU1016 HA GLU1016 -1.195 25.833 7.806 819 1HB GLU1016 1HB GLU1016 -2.276 27.974 6.435 820 2HB GLU1016 2HB GLU1016 -3.349 26.680 5.941 821 1HG GLU1016 1HG GLU1016 -4.368 26.662 7.967 822 2HG GLU1016 2HG GLU1016 -2.837 26.442 8.791 823 H TYR1017 H TYR1017 -1.977 25.559 4.262 824 HA TYR1017 HA TYR1017 -3.280 23.076 4.544 825 1HB TYR1017 1HB TYR1017 -2.131 24.913 2.432 826 2HB TYR1017 2HB TYR1017 -2.362 23.252 1.925 827 HD1 TYR1017 HD1 TYR1017 -4.140 26.217 3.312 828 HD2 TYR1017 HD2 TYR1017 -4.514 22.437 1.342 829 HE1 TYR1017 HE1 TYR1017 -6.595 26.691 2.853 830 HE2 TYR1017 HE2 TYR1017 -6.968 22.924 0.890 831 HH TYR1017 HH TYR1017 -8.735 24.818 2.402 832 H LYS1018 H LYS1018 0.116 24.051 4.114 833 HA LYS1018 HA LYS1018 1.148 21.715 3.081 834 1HB LYS1018 1HB LYS1018 2.326 23.778 4.957 835 2HB LYS1018 2HB LYS1018 3.263 22.462 4.278 836 1HG LYS1018 1HG LYS1018 1.810 24.663 2.745 837 2HG LYS1018 2HG LYS1018 3.541 24.411 2.842 838 1HD LYS1018 1HD LYS1018 2.936 22.007 1.840 839 2HD LYS1018 2HD LYS1018 1.477 22.820 1.310 840 1HE LYS1018 1HE LYS1018 3.563 24.616 0.647 841 2HE LYS1018 2HE LYS1018 4.208 23.036 0.252 842 1HZ LYS1018 1HZ LYS1018 1.748 22.858 -0.720 843 2HZ LYS1018 2HZ LYS1018 2.026 24.452 -0.946 844 3HZ LYS1018 3HZ LYS1018 3.035 23.346 -1.599 845 H LYS1019 H LYS1019 0.210 22.568 6.439 846 HA LYS1019 HA LYS1019 1.308 20.195 7.548 847 1HB LYS1019 1HB LYS1019 -0.294 22.514 8.480 848 2HB LYS1019 2HB LYS1019 -0.498 21.031 9.390 849 1HG LYS1019 1HG LYS1019 1.339 22.035 10.474 850 2HG LYS1019 2HG LYS1019 2.120 20.904 9.388 851 1HD LYS1019 1HD LYS1019 1.565 23.710 8.404 852 2HD LYS1019 2HD LYS1019 2.905 23.456 9.505 853 1HE LYS1019 1HE LYS1019 2.656 21.604 7.133 854 2HE LYS1019 2HE LYS1019 3.214 23.240 6.842 855 1HZ LYS1019 1HZ LYS1019 4.993 22.914 8.321 856 2HZ LYS1019 2HZ LYS1019 4.400 21.502 8.888 857 3HZ LYS1019 3HZ LYS1019 4.967 21.595 7.359 858 H GLN1020 H GLN1020 -1.953 21.240 6.411 859 HA GLN1020 HA GLN1020 -3.373 19.093 7.278 860 1HB GLN1020 1HB GLN1020 -3.742 20.542 4.620 861 2HB GLN1020 2HB GLN1020 -4.973 19.635 5.478 862 1HG GLN1020 1HG GLN1020 -3.629 22.225 6.357 863 2HG GLN1020 2HG GLN1020 -5.324 21.976 5.990 864 1HE2 GLN1020 1HE2 GLN1020 -3.021 22.153 8.383 865 2HE2 GLN1020 2HE2 GLN1020 -3.881 21.445 9.710 866 H MET1021 H MET1021 -1.837 19.489 3.998 867 HA MET1021 HA MET1021 -2.442 17.047 3.014 868 1HB MET1021 1HB MET1021 -0.878 19.227 2.265 869 2HB MET1021 2HB MET1021 0.348 17.992 2.466 870 1HG MET1021 1HG MET1021 -1.881 16.815 1.043 871 2HG MET1021 2HG MET1021 -1.485 18.336 0.268 872 1HE MET1021 1HE MET1021 1.633 15.037 1.111 873 2HE MET1021 2HE MET1021 0.874 16.051 2.362 874 3HE MET1021 3HE MET1021 -0.101 14.857 1.471 875 H LEU1022 H LEU1022 0.280 17.952 5.196 876 HA LEU1022 HA LEU1022 1.661 15.549 5.069 877 1HB LEU1022 1HB LEU1022 2.491 17.669 6.012 878 2HB LEU1022 2HB LEU1022 1.406 17.484 7.375 879 HG LEU1022 HG LEU1022 3.766 16.859 7.850 880 1HD1 LEU1022 1HD1 LEU1022 2.076 14.388 8.136 881 2HD1 LEU1022 2HD1 LEU1022 3.229 15.114 9.281 882 3HD1 LEU1022 3HD1 LEU1022 1.652 15.889 8.993 883 1HD2 LEU1022 1HD2 LEU1022 4.855 15.044 6.887 884 2HD2 LEU1022 2HD2 LEU1022 3.350 14.354 6.234 885 3HD2 LEU1022 3HD2 LEU1022 4.048 15.819 5.503 886 H THR1023 H THR1023 -1.121 16.595 7.108 887 HA THR1023 HA THR1023 -1.232 14.467 8.839 888 HB THR1023 HB THR1023 -3.703 15.703 7.566 889 HG1 THR1023 HG1 THR1023 -1.622 16.799 9.320 890 1HG2 THR1023 1HG2 THR1023 -3.975 16.054 10.222 891 2HG2 THR1023 2HG2 THR1023 -4.412 14.506 9.459 892 3HG2 THR1023 3HG2 THR1023 -2.842 14.682 10.278 893 H ALA1024 H ALA1024 -2.649 14.679 5.516 894 HA ALA1024 HA ALA1024 -3.737 12.089 5.607 895 1HB ALA1024 1HB ALA1024 -4.431 12.571 3.471 896 2HB ALA1024 2HB ALA1024 -4.032 14.224 3.997 897 3HB ALA1024 3HB ALA1024 -2.873 13.299 3.011 898 H ALA1025 H ALA1025 -0.598 13.434 4.428 899 HA ALA1025 HA ALA1025 0.407 11.182 3.231 900 1HB ALA1025 1HB ALA1025 2.615 12.320 4.410 901 2HB ALA1025 2HB ALA1025 1.853 12.903 2.911 902 3HB ALA1025 3HB ALA1025 1.447 13.661 4.470 903 H HIS1026 H HIS1026 -0.033 11.944 6.679 904 HA HIS1026 HA HIS1026 1.690 9.931 7.630 905 1HB HIS1026 1HB HIS1026 0.724 12.017 8.817 906 2HB HIS1026 2HB HIS1026 -0.691 11.029 9.119 907 HD1 HIS1026 HD1 HIS1026 3.093 10.855 9.722 908 HD2 HIS1026 HD2 HIS1026 -0.515 9.524 11.398 909 HE1 HIS1026 HE1 HIS1026 3.705 9.703 11.915 910 H ALA1027 H ALA1027 -1.932 10.111 7.348 911 HA ALA1027 HA ALA1027 -2.313 7.425 8.076 912 1HB ALA1027 1HB ALA1027 -3.948 9.591 6.756 913 2HB ALA1027 2HB ALA1027 -4.577 7.928 6.837 914 3HB ALA1027 3HB ALA1027 -4.180 8.804 8.335 915 H LEU1028 H LEU1028 -1.608 9.090 4.998 916 HA LEU1028 HA LEU1028 -2.364 7.099 3.241 917 1HB LEU1028 1HB LEU1028 -0.480 9.390 3.227 918 2HB LEU1028 2HB LEU1028 -0.243 8.173 1.988 919 HG LEU1028 HG LEU1028 -2.690 9.881 2.467 920 1HD1 LEU1028 1HD1 LEU1028 -1.418 9.624 -0.201 921 2HD1 LEU1028 2HD1 LEU1028 -2.118 11.043 0.614 922 3HD1 LEU1028 3HD1 LEU1028 -0.486 10.482 1.049 923 1HD2 LEU1028 1HD2 LEU1028 -3.567 8.628 0.385 924 2HD2 LEU1028 2HD2 LEU1028 -2.414 7.356 0.852 925 3HD2 LEU1028 3HD2 LEU1028 -3.703 7.845 1.977 926 H ALA1029 H ALA1029 1.048 7.733 4.329 927 HA ALA1029 HA ALA1029 2.244 5.534 3.410 928 1HB ALA1029 1HB ALA1029 2.544 7.143 5.934 929 2HB ALA1029 2HB ALA1029 3.536 5.680 5.724 930 3HB ALA1029 3HB ALA1029 3.640 7.003 4.538 931 H VAL1030 H VAL1030 0.152 5.726 6.343 932 HA VAL1030 HA VAL1030 0.584 3.030 7.079 933 HB VAL1030 HB VAL1030 -1.258 5.252 7.831 934 1HG1 VAL1030 1HG1 VAL1030 -2.750 3.293 7.650 935 2HG1 VAL1030 2HG1 VAL1030 -1.674 2.382 8.735 936 3HG1 VAL1030 3HG1 VAL1030 -2.538 3.817 9.337 937 1HG2 VAL1030 1HG2 VAL1030 0.915 3.625 9.084 938 2HG2 VAL1030 2HG2 VAL1030 0.619 5.379 9.136 939 3HG2 VAL1030 3HG2 VAL1030 -0.355 4.282 10.144 940 H ASP1031 H ASP1031 -2.148 4.747 5.409 941 HA ASP1031 HA ASP1031 -3.842 2.764 5.025 942 1HB ASP1031 1HB ASP1031 -2.872 4.785 2.954 943 2HB ASP1031 2HB ASP1031 -4.298 3.794 2.718 944 H ALA1032 H ALA1032 -1.200 3.582 2.635 945 HA ALA1032 HA ALA1032 -1.473 1.363 1.037 946 1HB ALA1032 1HB ALA1032 0.622 1.998 0.131 947 2HB ALA1032 2HB ALA1032 -0.072 3.514 0.752 948 3HB ALA1032 3HB ALA1032 1.187 2.666 1.682 949 H LYS1033 H LYS1033 0.106 1.753 4.210 950 HA LYS1033 HA LYS1033 1.537 -0.683 4.095 951 1HB LYS1033 1HB LYS1033 1.990 1.342 5.570 952 2HB LYS1033 2HB LYS1033 0.657 0.810 6.576 953 1HG LYS1033 1HG LYS1033 2.690 -1.279 5.868 954 2HG LYS1033 2HG LYS1033 3.235 -0.009 6.946 955 1HD LYS1033 1HD LYS1033 0.957 -0.509 8.229 956 2HD LYS1033 2HD LYS1033 1.028 -2.038 7.375 957 1HE LYS1033 1HE LYS1033 2.865 -2.787 8.570 958 2HE LYS1033 2HE LYS1033 3.581 -1.191 8.685 959 1HZ LYS1033 1HZ LYS1033 1.983 -2.503 10.551 960 2HZ LYS1033 2HZ LYS1033 2.749 -1.069 10.702 961 3HZ LYS1033 3HZ LYS1033 1.226 -1.124 10.113 962 H ASN1034 H ASN1034 -1.523 0.283 5.806 963 HA ASN1034 HA ASN1034 -2.165 -2.073 6.878 964 1HB ASN1034 1HB ASN1034 -3.475 0.160 6.908 965 2HB ASN1034 2HB ASN1034 -4.199 -0.336 5.391 966 1HD2 ASN1034 1HD2 ASN1034 -5.258 0.109 8.152 967 2HD2 ASN1034 2HD2 ASN1034 -6.151 -1.318 8.560 968 H LEU1035 H LEU1035 -2.263 -1.082 3.454 969 HA LEU1035 HA LEU1035 -3.968 -3.056 2.473 970 1HB LEU1035 1HB LEU1035 -2.851 -0.889 1.439 971 2HB LEU1035 2HB LEU1035 -1.671 -2.047 0.859 972 HG LEU1035 HG LEU1035 -4.631 -2.397 0.367 973 1HD1 LEU1035 1HD1 LEU1035 -2.888 -0.382 -0.745 974 2HD1 LEU1035 2HD1 LEU1035 -3.437 -1.505 -2.012 975 3HD1 LEU1035 3HD1 LEU1035 -4.628 -0.651 -1.003 976 1HD2 LEU1035 1HD2 LEU1035 -4.012 -3.947 -1.299 977 2HD2 LEU1035 2HD2 LEU1035 -2.306 -3.439 -1.256 978 3HD2 LEU1035 3HD2 LEU1035 -3.004 -4.332 0.117 979 H LEU1036 H LEU1036 -0.342 -2.985 2.201 980 HA LEU1036 HA LEU1036 -0.201 -5.714 1.577 981 1HB LEU1036 1HB LEU1036 1.466 -3.598 1.405 982 2HB LEU1036 2HB LEU1036 2.134 -4.386 2.821 983 HG LEU1036 HG LEU1036 1.800 -6.477 1.009 984 1HD1 LEU1036 1HD1 LEU1036 1.850 -4.051 -0.486 985 2HD1 LEU1036 2HD1 LEU1036 3.395 -4.897 -0.745 986 3HD1 LEU1036 3HD1 LEU1036 1.857 -5.730 -1.076 987 1HD2 LEU1036 1HD2 LEU1036 4.432 -5.865 0.742 988 2HD2 LEU1036 2HD2 LEU1036 4.022 -4.949 2.212 989 3HD2 LEU1036 3HD2 LEU1036 3.727 -6.703 2.145 990 H ASP1037 H ASP1037 -0.010 -3.870 4.654 991 HA ASP1037 HA ASP1037 0.997 -5.582 6.363 992 1HB ASP1037 1HB ASP1037 -0.317 -3.353 6.743 993 2HB ASP1037 2HB ASP1037 -1.735 -4.366 6.926 994 H VAL1038 H VAL1038 -2.469 -5.626 5.229 995 HA VAL1038 HA VAL1038 -3.204 -7.935 6.606 996 HB VAL1038 HB VAL1038 -4.253 -6.628 4.093 997 1HG1 VAL1038 1HG1 VAL1038 -4.791 -9.217 4.780 998 2HG1 VAL1038 2HG1 VAL1038 -6.079 -8.351 5.651 999 3HG1 VAL1038 3HG1 VAL1038 -5.906 -8.152 3.891 1000 1HG2 VAL1038 1HG2 VAL1038 -4.621 -6.202 6.996 1001 2HG2 VAL1038 2HG2 VAL1038 -4.830 -5.078 5.632 1002 3HG2 VAL1038 3HG2 VAL1038 -6.122 -6.233 6.040 1003 H ILE1039 H ILE1039 -1.820 -7.411 3.315 1004 HA ILE1039 HA ILE1039 -2.063 -10.017 2.414 1005 HB ILE1039 HB ILE1039 -0.328 -7.679 1.778 1006 1HG1 ILE1039 1HG1 ILE1039 -2.271 -9.362 0.168 1007 2HG1 ILE1039 2HG1 ILE1039 -2.618 -7.812 0.907 1008 1HG2 ILE1039 1HG2 ILE1039 1.388 -9.003 1.212 1009 2HG2 ILE1039 2HG2 ILE1039 0.399 -10.482 1.258 1010 3HG2 ILE1039 3HG2 ILE1039 0.380 -9.443 -0.187 1011 1HD1 ILE1039 1HD1 ILE1039 -2.075 -7.135 -1.258 1012 2HD1 ILE1039 2HD1 ILE1039 -0.479 -7.016 -0.480 1013 3HD1 ILE1039 3HD1 ILE1039 -0.880 -8.436 -1.476 1014 H ASP1040 H ASP1040 0.565 -8.423 4.318 1015 HA ASP1040 HA ASP1040 2.371 -10.410 4.322 1016 1HB ASP1040 1HB ASP1040 2.409 -8.103 5.497 1017 2HB ASP1040 2HB ASP1040 1.588 -8.876 6.838 1018 H GLN1041 H GLN1041 -0.672 -10.082 6.217 1019 HA GLN1041 HA GLN1041 -0.118 -12.357 7.819 1020 1HB GLN1041 1HB GLN1041 -2.408 -10.439 7.471 1021 2HB GLN1041 2HB GLN1041 -2.757 -11.985 8.218 1022 1HG GLN1041 1HG GLN1041 -0.470 -11.305 9.578 1023 2HG GLN1041 2HG GLN1041 -1.112 -9.709 9.245 1024 1HE2 GLN1041 1HE2 GLN1041 -2.889 -8.977 10.266 1025 2HE2 GLN1041 2HE2 GLN1041 -3.748 -9.828 11.506 1026 H ALA1042 H ALA1042 -1.474 -11.744 4.650 1027 HA ALA1042 HA ALA1042 -2.988 -14.186 4.563 1028 1HB ALA1042 1HB ALA1042 -2.261 -12.006 2.584 1029 2HB ALA1042 2HB ALA1042 -3.124 -13.482 2.088 1030 3HB ALA1042 3HB ALA1042 -3.853 -12.384 3.284 1031 H ARG1043 H ARG1043 0.136 -12.909 3.259 1032 HA ARG1043 HA ARG1043 0.810 -15.025 1.721 1033 1HB ARG1043 1HB ARG1043 2.069 -12.815 2.043 1034 2HB ARG1043 2HB ARG1043 2.754 -13.484 3.511 1035 1HG ARG1043 1HG ARG1043 3.871 -15.265 2.279 1036 2HG ARG1043 2HG ARG1043 3.004 -14.874 0.807 1037 1HD ARG1043 1HD ARG1043 4.409 -13.130 0.285 1038 2HD ARG1043 2HD ARG1043 4.497 -12.570 1.944 1039 HE ARG1043 HE ARG1043 6.348 -14.396 0.631 1040 1HH1 ARG1043 2HH2 ARG1043 4.985 -13.500 3.749 1041 2HH1 ARG1043 1HH2 ARG1043 6.333 -14.101 4.655 1042 1HH2 ARG1043 2HH1 ARG1043 8.127 -15.189 1.826 1043 2HH2 ARG1043 1HH1 ARG1043 8.132 -15.069 3.554 1044 H LEU1044 H LEU1044 1.438 -14.525 5.262 1045 HA LEU1044 HA LEU1044 2.842 -16.899 5.661 1046 1HB LEU1044 1HB LEU1044 2.348 -16.536 8.025 1047 2HB LEU1044 2HB LEU1044 2.943 -15.096 7.224 1048 HG LEU1044 HG LEU1044 0.436 -14.444 6.999 1049 1HD1 LEU1044 1HD1 LEU1044 -0.477 -15.552 9.390 1050 2HD1 LEU1044 2HD1 LEU1044 -1.031 -15.938 7.743 1051 3HD1 LEU1044 3HD1 LEU1044 0.245 -16.917 8.506 1052 1HD2 LEU1044 1HD2 LEU1044 2.039 -14.379 9.557 1053 2HD2 LEU1044 2HD2 LEU1044 1.843 -13.107 8.327 1054 3HD2 LEU1044 3HD2 LEU1044 0.477 -13.542 9.383 1055 H LYS1045 H LYS1045 -0.675 -16.120 5.767 1056 HA LYS1045 HA LYS1045 -1.724 -18.326 6.859 1057 1HB LYS1045 1HB LYS1045 -2.611 -16.243 5.178 1058 2HB LYS1045 2HB LYS1045 -3.157 -17.723 4.416 1059 1HG LYS1045 1HG LYS1045 -4.902 -17.513 5.902 1060 2HG LYS1045 2HG LYS1045 -3.795 -18.330 6.987 1061 1HD LYS1045 1HD LYS1045 -3.157 -16.295 8.069 1062 2HD LYS1045 2HD LYS1045 -3.765 -15.301 6.761 1063 1HE LYS1045 1HE LYS1045 -5.743 -15.110 7.852 1064 2HE LYS1045 2HE LYS1045 -5.997 -16.833 7.665 1065 1HZ LYS1045 1HZ LYS1045 -5.343 -15.414 9.982 1066 2HZ LYS1045 2HZ LYS1045 -5.749 -16.989 9.831 1067 3HZ LYS1045 3HZ LYS1045 -4.186 -16.533 9.705 1068 H MET1046 H MET1046 0.016 -18.107 3.771 1069 HA MET1046 HA MET1046 -0.799 -20.735 3.005 1070 1HB MET1046 1HB MET1046 -0.380 -19.133 1.227 1071 2HB MET1046 2HB MET1046 1.153 -18.645 1.924 1072 1HG MET1046 1HG MET1046 1.215 -21.510 1.434 1073 2HG MET1046 2HG MET1046 0.685 -20.698 -0.025 1074 1HE MET1046 1HE MET1046 3.249 -18.166 -0.838 1075 2HE MET1046 2HE MET1046 1.557 -18.275 -0.295 1076 3HE MET1046 3HE MET1046 2.810 -17.663 0.812 1077 H ILE1047 H ILE1047 2.268 -19.116 4.079 1078 HA ILE1047 HA ILE1047 3.942 -21.269 3.970 1079 HB ILE1047 HB ILE1047 3.781 -18.844 5.715 1080 1HG1 ILE1047 1HG1 ILE1047 6.216 -19.255 4.206 1081 2HG1 ILE1047 2HG1 ILE1047 4.821 -19.434 3.161 1082 1HG2 ILE1047 1HG2 ILE1047 4.903 -19.926 7.329 1083 2HG2 ILE1047 2HG2 ILE1047 5.354 -21.276 6.259 1084 3HG2 ILE1047 3HG2 ILE1047 6.294 -19.764 6.230 1085 1HD1 ILE1047 1HD1 ILE1047 5.364 -17.066 5.011 1086 2HD1 ILE1047 2HD1 ILE1047 5.529 -17.074 3.239 1087 3HD1 ILE1047 3HD1 ILE1047 3.922 -17.251 3.984 1088 H SER1048 H SER1048 1.578 -20.379 6.544 1089 HA SER1048 HA SER1048 2.254 -22.872 7.864 1090 1HB SER1048 1HB SER1048 1.894 -20.400 8.935 1091 2HB SER1048 2HB SER1048 0.244 -20.982 9.037 1092 HG SER1048 HG SER1048 0.793 -22.442 10.545 1093 H GLN1049 H GLN1049 1.097 -23.663 5.654 1094 HA GLN1049 HA GLN1049 -1.773 -23.648 6.042 1095 1HB GLN1049 1HB GLN1049 -1.850 -24.615 3.745 1096 2HB GLN1049 2HB GLN1049 -0.988 -23.090 3.793 1097 1HG GLN1049 1HG GLN1049 0.859 -24.083 2.937 1098 2HG GLN1049 2HG GLN1049 0.936 -25.164 4.314 1099 1HE2 GLN1049 1HE2 GLN1049 1.305 -25.396 1.298 1100 2HE2 GLN1049 2HE2 GLN1049 0.399 -26.798 0.838 1101 H SER1050 H SER1050 1.078 -25.635 6.457 1102 HA SER1050 HA SER1050 -0.171 -27.517 7.943 1103 1HB SER1050 1HB SER1050 -1.396 -28.634 6.356 1104 2HB SER1050 2HB SER1050 -0.403 -28.063 5.029 1105 HG SER1050 HG SER1050 -0.026 -30.335 6.729 1106 H ARG1051 H ARG1051 2.081 -27.864 5.096 1107 HA ARG1051 HA ARG1051 3.926 -29.365 6.417 1108 1HB ARG1051 1HB ARG1051 3.646 -28.384 3.859 1109 2HB ARG1051 2HB ARG1051 5.000 -27.417 4.409 1110 1HG ARG1051 1HG ARG1051 6.291 -29.421 4.977 1111 2HG ARG1051 2HG ARG1051 4.909 -30.456 4.679 1112 1HD ARG1051 1HD ARG1051 5.150 -29.027 2.276 1113 2HD ARG1051 2HD ARG1051 6.818 -29.279 2.751 1114 HE ARG1051 HE ARG1051 5.050 -31.288 1.736 1115 1HH1 ARG1051 2HH2 ARG1051 7.485 -30.857 4.239 1116 2HH1 ARG1051 1HH2 ARG1051 7.939 -32.529 4.264 1117 1HH2 ARG1051 2HH1 ARG1051 5.649 -33.493 1.768 1118 2HH2 ARG1051 1HH1 ARG1051 6.888 -34.038 2.849 1119 HA PRO1052 HA PRO1052 5.736 -26.336 9.030 1120 1HB PRO1052 1HB PRO1052 7.607 -27.927 10.229 1121 2HB PRO1052 2HB PRO1052 5.941 -27.836 10.765 1122 1HG PRO1052 1HG PRO1052 7.285 -29.987 9.246 1123 2HG PRO1052 2HG PRO1052 5.782 -30.052 10.145 1124 1HD PRO1052 1HD PRO1052 6.072 -29.898 7.296 1125 2HD PRO1052 2HD PRO1052 4.572 -29.846 8.202 1126 H HIS1053 H HIS1053 8.289 -28.508 7.906 1127 HA HIS1053 HA HIS1053 9.672 -26.084 7.021 1128 1HB HIS1053 1HB HIS1053 11.713 -27.086 7.534 1129 2HB HIS1053 2HB HIS1053 10.672 -27.524 8.874 1130 HD1 HIS1053 HD1 HIS1053 13.097 -28.985 6.716 1131 HD2 HIS1053 HD2 HIS1053 9.426 -30.284 8.276 1132 HE1 HIS1053 HE1 HIS1053 13.109 -31.531 6.546 Start of MODEL 4 1 H MET 915 H MET 915 18.606 -14.656 -5.325 2 HA MET 915 HA MET 915 19.783 -16.915 -6.264 3 1HB MET 915 1HB MET 915 20.052 -16.688 -3.388 4 2HB MET 915 2HB MET 915 18.900 -17.971 -3.699 5 1HG MET 915 1HG MET 915 20.505 -19.128 -5.172 6 2HG MET 915 2HG MET 915 21.637 -17.797 -5.048 7 1HE MET 915 1HE MET 915 23.319 -19.525 -4.560 8 2HE MET 915 2HE MET 915 23.585 -20.310 -2.985 9 3HE MET 915 3HE MET 915 22.411 -20.995 -4.134 10 H ALA 916 H ALA 916 17.242 -16.154 -3.765 11 HA ALA 916 HA ALA 916 15.331 -17.908 -4.553 12 1HB ALA 916 1HB ALA 916 14.900 -15.021 -3.682 13 2HB ALA 916 2HB ALA 916 13.742 -16.363 -3.519 14 3HB ALA 916 3HB ALA 916 15.257 -16.377 -2.585 15 H ASN 917 H ASN 917 14.605 -18.363 -6.571 16 HA ASN 917 HA ASN 917 14.763 -16.421 -8.606 17 1HB ASN 917 1HB ASN 917 14.018 -19.287 -8.338 18 2HB ASN 917 2HB ASN 917 13.087 -18.454 -9.567 19 1HD2 ASN 917 1HD2 ASN 917 14.566 -20.335 -10.525 20 2HD2 ASN 917 2HD2 ASN 917 16.009 -19.780 -11.306 21 H LEU 918 H LEU 918 13.356 -14.734 -7.510 22 HA LEU 918 HA LEU 918 10.514 -15.351 -7.916 23 1HB LEU 918 1HB LEU 918 11.919 -14.146 -5.588 24 2HB LEU 918 2HB LEU 918 10.368 -13.465 -6.034 25 HG LEU 918 HG LEU 918 9.670 -16.057 -6.025 26 1HD1 LEU 918 1HD1 LEU 918 11.334 -16.258 -3.618 27 2HD1 LEU 918 2HD1 LEU 918 10.958 -17.469 -4.866 28 3HD1 LEU 918 3HD1 LEU 918 12.258 -16.284 -5.139 29 1HD2 LEU 918 1HD2 LEU 918 9.246 -13.818 -4.405 30 2HD2 LEU 918 2HD2 LEU 918 8.316 -15.336 -4.419 31 3HD2 LEU 918 3HD2 LEU 918 9.668 -15.131 -3.280 32 H ASP 919 H ASP 919 9.911 -14.310 -9.740 33 HA ASP 919 HA ASP 919 11.313 -12.283 -10.898 34 1HB ASP 919 1HB ASP 919 8.287 -12.502 -11.099 35 2HB ASP 919 2HB ASP 919 9.411 -12.001 -12.346 36 H ARG 920 H ARG 920 9.708 -10.085 -11.446 37 HA ARG 920 HA ARG 920 9.763 -8.746 -8.937 38 1HB ARG 920 1HB ARG 920 9.087 -7.833 -11.774 39 2HB ARG 920 2HB ARG 920 9.059 -6.745 -10.401 40 1HG ARG 920 1HG ARG 920 11.467 -7.319 -9.928 41 2HG ARG 920 2HG ARG 920 11.483 -8.346 -11.348 42 1HD ARG 920 1HD ARG 920 11.029 -6.425 -12.817 43 2HD ARG 920 2HD ARG 920 10.796 -5.370 -11.437 44 HE ARG 920 HE ARG 920 13.389 -6.589 -11.247 45 1HH1 ARG 920 2HH2 ARG 920 11.654 -4.158 -13.153 46 2HH1 ARG 920 1HH2 ARG 920 13.085 -3.262 -13.542 47 1HH2 ARG 920 1HH1 ARG 920 15.203 -4.015 -12.712 48 H SER 921 H SER 921 7.868 -10.629 -8.557 49 HA SER 921 HA SER 921 5.318 -9.640 -9.402 50 1HB SER 921 1HB SER 921 6.376 -12.093 -8.066 51 2HB SER 921 2HB SER 921 4.743 -11.640 -7.619 52 HG SER 921 HG SER 921 5.672 -12.755 -9.974 53 H ASN 922 H ASN 922 6.122 -10.891 -6.116 54 HA ASN 922 HA ASN 922 4.494 -8.954 -4.924 55 1HB ASN 922 1HB ASN 922 5.359 -9.917 -2.781 56 2HB ASN 922 2HB ASN 922 4.888 -11.181 -3.899 57 1HD2 ASN 922 1HD2 ASN 922 7.297 -9.980 -1.918 58 2HD2 ASN 922 2HD2 ASN 922 8.644 -10.930 -2.450 59 H ASP 923 H ASP 923 7.631 -8.825 -6.246 60 HA ASP 923 HA ASP 923 8.872 -7.227 -4.282 61 1HB ASP 923 1HB ASP 923 10.155 -8.574 -5.920 62 2HB ASP 923 2HB ASP 923 9.470 -7.656 -7.246 63 H LYS 924 H LYS 924 7.229 -6.697 -7.473 64 HA LYS 924 HA LYS 924 7.658 -3.927 -7.567 65 1HB LYS 924 1HB LYS 924 6.791 -5.790 -9.323 66 2HB LYS 924 2HB LYS 924 5.252 -5.079 -8.881 67 1HG LYS 924 1HG LYS 924 6.885 -2.833 -9.208 68 2HG LYS 924 2HG LYS 924 7.479 -3.918 -10.450 69 1HD LYS 924 1HD LYS 924 5.148 -4.223 -11.303 70 2HD LYS 924 2HD LYS 924 4.548 -3.147 -10.057 71 1HE LYS 924 1HE LYS 924 6.150 -1.358 -11.002 72 2HE LYS 924 2HE LYS 924 6.422 -2.435 -12.357 73 1HZ LYS 924 1HZ LYS 924 3.677 -1.861 -11.622 74 2HZ LYS 924 2HZ LYS 924 4.522 -0.687 -12.382 75 3HZ LYS 924 3HZ LYS 924 4.320 -2.142 -13.097 76 H VAL 925 H VAL 925 4.773 -5.884 -6.546 77 HA VAL 925 HA VAL 925 3.143 -3.815 -5.830 78 HB VAL 925 HB VAL 925 3.453 -6.445 -4.372 79 1HG1 VAL 925 1HG1 VAL 925 1.881 -4.476 -3.571 80 2HG1 VAL 925 2HG1 VAL 925 0.832 -5.078 -4.877 81 3HG1 VAL 925 3HG1 VAL 925 1.318 -6.165 -3.554 82 1HG2 VAL 925 1HG2 VAL 925 3.305 -7.121 -6.602 83 2HG2 VAL 925 2HG2 VAL 925 1.608 -7.133 -6.065 84 3HG2 VAL 925 3HG2 VAL 925 2.222 -5.779 -7.043 85 H TYR 926 H TYR 926 5.546 -5.546 -3.723 86 HA TYR 926 HA TYR 926 5.140 -3.923 -1.490 87 1HB TYR 926 1HB TYR 926 7.365 -5.657 -2.680 88 2HB TYR 926 2HB TYR 926 7.668 -4.801 -1.181 89 HD1 TYR 926 HD1 TYR 926 7.797 -6.486 0.442 90 HD2 TYR 926 HD2 TYR 926 4.526 -6.491 -2.316 91 HE1 TYR 926 HE1 TYR 926 6.697 -8.376 1.739 92 HE2 TYR 926 HE2 TYR 926 3.438 -8.382 -1.011 93 HH TYR 926 HH TYR 926 5.135 -9.967 1.618 94 H GLU 927 H GLU 927 7.092 -3.489 -4.440 95 HA GLU 927 HA GLU 927 8.672 -1.432 -3.334 96 1HB GLU 927 1HB GLU 927 8.218 -2.610 -6.060 97 2HB GLU 927 2HB GLU 927 8.933 -1.012 -5.990 98 1HG GLU 927 1HG GLU 927 10.074 -3.068 -4.122 99 2HG GLU 927 2HG GLU 927 10.399 -3.300 -5.828 100 H ASN 928 H ASN 928 6.003 -1.418 -5.815 101 HA ASN 928 HA ASN 928 5.776 1.266 -6.053 102 1HB ASN 928 1HB ASN 928 4.429 -0.891 -7.065 103 2HB ASN 928 2HB ASN 928 3.209 -0.305 -5.951 104 1HD2 ASN 928 1HD2 ASN 928 5.537 0.921 -8.352 105 2HD2 ASN 928 2HD2 ASN 928 4.498 2.095 -9.088 106 H VAL 929 H VAL 929 4.893 -0.862 -3.386 107 HA VAL 929 HA VAL 929 2.948 0.851 -2.212 108 HB VAL 929 HB VAL 929 4.531 -1.544 -1.297 109 1HG1 VAL 929 1HG1 VAL 929 4.179 -0.970 0.834 110 2HG1 VAL 929 2HG1 VAL 929 3.194 0.435 0.359 111 3HG1 VAL 929 3HG1 VAL 929 2.437 -1.167 0.527 112 1HG2 VAL 929 1HG2 VAL 929 1.560 -1.507 -1.360 113 2HG2 VAL 929 2HG2 VAL 929 2.386 -1.428 -2.935 114 3HG2 VAL 929 3HG2 VAL 929 2.705 -2.786 -1.829 115 H THR 930 H THR 930 6.494 0.352 -1.921 116 HA THR 930 HA THR 930 6.659 2.281 0.231 117 HB THR 930 HB THR 930 9.109 1.693 0.036 118 HG1 THR 930 HG1 THR 930 9.679 0.658 -1.850 119 1HG2 THR 930 1HG2 THR 930 7.095 -0.606 0.029 120 2HG2 THR 930 2HG2 THR 930 8.836 -0.865 0.294 121 3HG2 THR 930 3HG2 THR 930 7.900 0.127 1.437 122 H GLY 931 H GLY 931 6.956 2.177 -3.291 123 1HA GLY 931 1HA GLY 931 8.493 4.494 -3.658 124 2HA GLY 931 2HA GLY 931 7.367 3.789 -4.801 125 H LEU 932 H LEU 932 4.884 4.067 -3.923 126 HA LEU 932 HA LEU 932 4.376 6.803 -4.123 127 1HB LEU 932 1HB LEU 932 2.222 6.196 -4.306 128 2HB LEU 932 2HB LEU 932 2.954 4.631 -4.597 129 HG LEU 932 HG LEU 932 1.046 4.422 -3.117 130 1HD1 LEU 932 1HD1 LEU 932 2.098 2.719 -2.168 131 2HD1 LEU 932 2HD1 LEU 932 3.665 3.470 -2.555 132 3HD1 LEU 932 3HD1 LEU 932 2.869 3.821 -1.002 133 1HD2 LEU 932 1HD2 LEU 932 1.768 6.862 -2.102 134 2HD2 LEU 932 2HD2 LEU 932 0.563 5.762 -1.390 135 3HD2 LEU 932 3HD2 LEU 932 2.237 5.758 -0.787 136 H VAL 933 H VAL 933 4.621 4.575 -1.315 137 HA VAL 933 HA VAL 933 3.679 6.430 0.576 138 HB VAL 933 HB VAL 933 5.152 3.841 0.576 139 1HG1 VAL 933 1HG1 VAL 933 5.444 3.896 3.012 140 2HG1 VAL 933 2HG1 VAL 933 6.406 5.168 2.221 141 3HG1 VAL 933 3HG1 VAL 933 4.886 5.586 3.049 142 1HG2 VAL 933 1HG2 VAL 933 3.155 3.027 1.173 143 2HG2 VAL 933 2HG2 VAL 933 2.984 4.211 2.491 144 3HG2 VAL 933 3HG2 VAL 933 2.493 4.645 0.836 145 H LYS 934 H LYS 934 6.975 5.567 -0.634 146 HA LYS 934 HA LYS 934 8.413 7.156 1.109 147 1HB LYS 934 1HB LYS 934 8.877 5.992 -1.605 148 2HB LYS 934 2HB LYS 934 9.996 7.213 -1.036 149 1HG LYS 934 1HG LYS 934 10.376 5.901 1.056 150 2HG LYS 934 2HG LYS 934 9.240 4.686 0.507 151 1HD LYS 934 1HD LYS 934 10.991 4.933 -1.668 152 2HD LYS 934 2HD LYS 934 12.054 5.118 -0.288 153 1HE LYS 934 1HE LYS 934 10.558 2.993 0.575 154 2HE LYS 934 2HE LYS 934 10.464 2.731 -1.155 155 1HZ LYS 934 1HZ LYS 934 12.551 2.068 -1.163 156 2HZ LYS 934 2HZ LYS 934 13.086 3.401 -0.386 157 3HZ LYS 934 3HZ LYS 934 12.558 2.115 0.470 158 H ALA 935 H ALA 935 6.949 7.956 -2.104 159 HA ALA 935 HA ALA 935 7.856 10.633 -2.051 160 1HB ALA 935 1HB ALA 935 7.370 9.769 -4.177 161 2HB ALA 935 2HB ALA 935 5.842 9.032 -3.637 162 3HB ALA 935 3HB ALA 935 5.956 10.797 -3.841 163 H VAL 936 H VAL 936 4.773 8.977 -1.144 164 HA VAL 936 HA VAL 936 3.108 11.000 -0.684 165 HB VAL 936 HB VAL 936 3.674 8.421 0.651 166 1HG1 VAL 936 1HG1 VAL 936 2.189 10.662 1.999 167 2HG1 VAL 936 2HG1 VAL 936 1.647 8.981 2.219 168 3HG1 VAL 936 3HG1 VAL 936 3.297 9.452 2.692 169 1HG2 VAL 936 1HG2 VAL 936 1.463 7.885 -0.037 170 2HG2 VAL 936 2HG2 VAL 936 1.039 9.598 -0.269 171 3HG2 VAL 936 3HG2 VAL 936 2.188 8.808 -1.376 172 H ILE 937 H ILE 937 5.946 10.123 1.354 173 HA ILE 937 HA ILE 937 5.360 12.292 3.167 174 HB ILE 937 HB ILE 937 7.513 10.191 3.017 175 1HG1 ILE 937 1HG1 ILE 937 5.705 10.520 5.356 176 2HG1 ILE 937 2HG1 ILE 937 4.966 9.943 3.876 177 1HG2 ILE 937 1HG2 ILE 937 8.480 11.029 5.033 178 2HG2 ILE 937 2HG2 ILE 937 8.419 12.369 3.863 179 3HG2 ILE 937 3HG2 ILE 937 7.228 12.286 5.183 180 1HD1 ILE 937 1HD1 ILE 937 5.745 7.880 4.394 181 2HD1 ILE 937 2HD1 ILE 937 7.384 8.490 4.061 182 3HD1 ILE 937 3HD1 ILE 937 6.739 8.532 5.719 183 H GLU 938 H GLU 938 8.286 11.367 1.212 184 HA GLU 938 HA GLU 938 9.677 13.589 1.364 185 1HB GLU 938 1HB GLU 938 9.571 11.396 -0.402 186 2HB GLU 938 2HB GLU 938 9.519 12.793 -1.458 187 1HG GLU 938 1HG GLU 938 11.785 12.852 -1.221 188 2HG GLU 938 2HG GLU 938 11.477 13.552 0.355 189 H MET 939 H MET 939 6.754 13.146 -0.699 190 HA MET 939 HA MET 939 6.816 15.342 -2.213 191 1HB MET 939 1HB MET 939 4.558 13.958 -0.700 192 2HB MET 939 2HB MET 939 4.198 15.340 -1.717 193 1HG MET 939 1HG MET 939 5.918 13.591 -3.231 194 2HG MET 939 2HG MET 939 4.664 12.597 -2.515 195 1HE MET 939 1HE MET 939 2.417 13.841 -2.073 196 2HE MET 939 2HE MET 939 2.239 15.502 -2.688 197 3HE MET 939 3HE MET 939 1.421 14.154 -3.514 198 H SER 940 H SER 940 5.230 15.256 1.068 199 HA SER 940 HA SER 940 4.658 17.889 1.237 200 1HB SER 940 1HB SER 940 4.631 15.662 2.957 201 2HB SER 940 2HB SER 940 5.628 16.830 3.802 202 HG SER 940 HG SER 940 3.172 17.730 2.642 203 H SER 941 H SER 941 7.769 16.206 1.863 204 HA SER 941 HA SER 941 9.027 18.420 3.015 205 1HB SER 941 1HB SER 941 10.825 17.013 3.215 206 2HB SER 941 2HB SER 941 9.642 15.788 2.802 207 HG SER 941 HG SER 941 10.501 15.543 0.818 208 H LYS 942 H LYS 942 8.934 17.050 -0.338 209 HA LYS 942 HA LYS 942 10.468 19.319 -1.300 210 1HB LYS 942 1HB LYS 942 10.671 18.108 -3.342 211 2HB LYS 942 2HB LYS 942 10.961 16.978 -2.035 212 1HG LYS 942 1HG LYS 942 8.978 15.814 -2.399 213 2HG LYS 942 2HG LYS 942 8.119 17.230 -2.971 214 1HD LYS 942 1HD LYS 942 10.361 15.927 -4.576 215 2HD LYS 942 2HD LYS 942 8.687 15.433 -4.736 216 1HE LYS 942 1HE LYS 942 8.395 17.117 -6.228 217 2HE LYS 942 2HE LYS 942 8.605 18.257 -4.914 218 1HZ LYS 942 1HZ LYS 942 10.182 18.240 -6.964 219 2HZ LYS 942 2HZ LYS 942 10.747 18.616 -5.479 220 3HZ LYS 942 3HZ LYS 942 10.995 17.123 -6.093 221 H ILE 943 H ILE 943 7.629 19.443 -0.124 222 HA ILE 943 HA ILE 943 6.187 20.333 -2.499 223 HB ILE 943 HB ILE 943 5.478 19.272 0.138 224 1HG1 ILE 943 1HG1 ILE 943 3.837 19.421 -2.398 225 2HG1 ILE 943 2HG1 ILE 943 5.112 18.242 -2.169 226 1HG2 ILE 943 1HG2 ILE 943 4.610 21.339 0.737 227 2HG2 ILE 943 2HG2 ILE 943 4.132 21.740 -0.929 228 3HG2 ILE 943 3HG2 ILE 943 3.214 20.524 -0.009 229 1HD1 ILE 943 1HD1 ILE 943 3.160 18.485 0.085 230 2HD1 ILE 943 2HD1 ILE 943 2.531 17.800 -1.432 231 3HD1 ILE 943 3HD1 ILE 943 3.914 17.032 -0.616 232 H GLN 944 H GLN 944 6.840 21.516 0.880 233 HA GLN 944 HA GLN 944 6.059 24.063 0.521 234 1HB GLN 944 1HB GLN 944 7.874 22.627 2.338 235 2HB GLN 944 2HB GLN 944 8.339 24.305 2.141 236 1HG GLN 944 1HG GLN 944 5.495 24.312 2.397 237 2HG GLN 944 2HG GLN 944 6.080 23.191 3.610 238 1HE2 GLN 944 1HE2 GLN 944 5.680 26.428 2.695 239 2HE2 GLN 944 2HE2 GLN 944 6.506 27.208 4.002 240 HA PRO 945 HA PRO 945 10.353 25.058 -1.253 241 1HB PRO 945 1HB PRO 945 11.983 23.018 -2.058 242 2HB PRO 945 2HB PRO 945 12.122 23.794 -0.493 243 1HG PRO 945 1HG PRO 945 10.998 21.141 -1.152 244 2HG PRO 945 2HG PRO 945 11.532 21.752 0.402 245 1HD PRO 945 1HD PRO 945 8.821 21.469 -0.492 246 2HD PRO 945 2HD PRO 945 9.359 22.187 1.013 247 H ALA 946 H ALA 946 8.233 22.749 -2.470 248 HA ALA 946 HA ALA 946 9.063 23.228 -5.209 249 1HB ALA 946 1HB ALA 946 6.937 21.687 -5.513 250 2HB ALA 946 2HB ALA 946 8.467 20.997 -4.920 251 3HB ALA 946 3HB ALA 946 7.161 21.384 -3.774 252 HA PRO 947 HA PRO 947 6.208 26.471 -5.636 253 1HB PRO 947 1HB PRO 947 6.372 26.823 -8.341 254 2HB PRO 947 2HB PRO 947 7.525 27.509 -7.214 255 1HG PRO 947 1HG PRO 947 7.852 25.190 -9.017 256 2HG PRO 947 2HG PRO 947 9.087 26.141 -8.216 257 1HD PRO 947 1HD PRO 947 8.169 23.531 -7.458 258 2HD PRO 947 2HD PRO 947 9.320 24.530 -6.592 259 HA PRO 948 HA PRO 948 2.419 25.040 -6.924 260 1HB PRO 948 1HB PRO 948 1.176 27.135 -8.163 261 2HB PRO 948 2HB PRO 948 1.298 26.988 -6.422 262 1HG PRO 948 1HG PRO 948 2.801 28.768 -8.241 263 2HG PRO 948 2HG PRO 948 2.593 28.894 -6.505 264 1HD PRO 948 1HD PRO 948 4.928 27.970 -7.892 265 2HD PRO 948 2HD PRO 948 4.677 27.987 -6.158 266 H GLU 949 H GLU 949 4.488 26.219 -9.367 267 HA GLU 949 HA GLU 949 2.852 25.112 -11.438 268 1HB GLU 949 1HB GLU 949 5.083 26.955 -11.248 269 2HB GLU 949 2HB GLU 949 5.475 25.703 -12.410 270 1HG GLU 949 1HG GLU 949 2.867 26.237 -13.117 271 2HG GLU 949 2HG GLU 949 3.366 27.813 -12.535 272 H GLU 950 H GLU 950 5.057 23.918 -9.134 273 HA GLU 950 HA GLU 950 5.690 21.678 -10.895 274 1HB GLU 950 1HB GLU 950 7.468 23.325 -9.490 275 2HB GLU 950 2HB GLU 950 7.347 21.907 -8.468 276 1HG GLU 950 1HG GLU 950 8.853 20.930 -9.864 277 2HG GLU 950 2HG GLU 950 7.543 20.789 -11.020 278 H TYR 951 H TYR 951 3.677 22.697 -8.437 279 HA TYR 951 HA TYR 951 3.811 20.236 -6.893 280 1HB TYR 951 1HB TYR 951 3.499 22.644 -5.982 281 2HB TYR 951 2HB TYR 951 1.959 22.699 -6.817 282 HD1 TYR 951 HD1 TYR 951 2.448 19.402 -5.671 283 HD2 TYR 951 HD2 TYR 951 1.379 23.308 -4.292 284 HE1 TYR 951 HE1 TYR 951 1.310 18.381 -3.640 285 HE2 TYR 951 HE2 TYR 951 0.245 22.275 -2.266 286 HH TYR 951 HH TYR 951 -0.429 18.960 -2.073 287 H VAL 952 H VAL 952 1.633 22.013 -9.153 288 HA VAL 952 HA VAL 952 -0.617 20.492 -8.931 289 HB VAL 952 HB VAL 952 0.606 22.288 -10.848 290 1HG1 VAL 952 1HG1 VAL 952 -1.146 20.069 -11.957 291 2HG1 VAL 952 2HG1 VAL 952 -0.747 21.577 -12.814 292 3HG1 VAL 952 3HG1 VAL 952 0.542 20.423 -12.395 293 1HG2 VAL 952 1HG2 VAL 952 -1.298 22.819 -9.360 294 2HG2 VAL 952 2HG2 VAL 952 -1.682 23.095 -11.076 295 3HG2 VAL 952 3HG2 VAL 952 -2.302 21.646 -10.247 296 HA PRO 953 HA PRO 953 1.392 17.362 -11.863 297 1HB PRO 953 1HB PRO 953 4.083 17.471 -12.325 298 2HB PRO 953 2HB PRO 953 2.897 18.176 -13.404 299 1HG PRO 953 1HG PRO 953 4.699 19.531 -11.493 300 2HG PRO 953 2HG PRO 953 3.832 20.211 -12.856 301 1HD PRO 953 1HD PRO 953 3.139 20.460 -10.084 302 2HD PRO 953 2HD PRO 953 2.211 21.040 -11.453 303 H MET 954 H MET 954 3.860 18.281 -9.508 304 HA MET 954 HA MET 954 4.870 15.990 -8.798 305 1HB MET 954 1HB MET 954 4.416 18.500 -7.550 306 2HB MET 954 2HB MET 954 3.828 17.338 -6.378 307 1HG MET 954 1HG MET 954 6.204 16.146 -7.162 308 2HG MET 954 2HG MET 954 6.614 17.843 -7.304 309 1HE MET 954 1HE MET 954 4.602 18.866 -4.129 310 2HE MET 954 2HE MET 954 6.250 19.513 -4.315 311 3HE MET 954 3HE MET 954 5.193 19.348 -5.737 312 H VAL 955 H VAL 955 1.620 17.096 -7.605 313 HA VAL 955 HA VAL 955 1.106 14.727 -6.179 314 HB VAL 955 HB VAL 955 0.005 17.229 -6.410 315 1HG1 VAL 955 1HG1 VAL 955 -2.402 16.801 -7.001 316 2HG1 VAL 955 2HG1 VAL 955 -1.278 16.739 -8.379 317 3HG1 VAL 955 3HG1 VAL 955 -1.899 15.230 -7.669 318 1HG2 VAL 955 1HG2 VAL 955 -0.684 14.707 -4.977 319 2HG2 VAL 955 2HG2 VAL 955 -0.251 16.311 -4.338 320 3HG2 VAL 955 3HG2 VAL 955 -1.894 16.013 -4.954 321 H LYS 956 H LYS 956 0.095 15.900 -9.459 322 HA LYS 956 HA LYS 956 -1.525 13.923 -10.252 323 1HB LYS 956 1HB LYS 956 0.043 15.931 -11.488 324 2HB LYS 956 2HB LYS 956 0.351 14.454 -12.379 325 1HG LYS 956 1HG LYS 956 -1.595 15.551 -13.360 326 2HG LYS 956 2HG LYS 956 -2.130 14.077 -12.577 327 1HD LYS 956 1HD LYS 956 -2.970 15.300 -10.650 328 2HD LYS 956 2HD LYS 956 -2.198 16.783 -11.173 329 1HE LYS 956 1HE LYS 956 -3.853 15.891 -13.348 330 2HE LYS 956 2HE LYS 956 -4.815 15.762 -11.888 331 1HZ LYS 956 1HZ LYS 956 -3.250 18.174 -12.368 332 2HZ LYS 956 2HZ LYS 956 -4.689 17.981 -13.116 333 3HZ LYS 956 3HZ LYS 956 -4.611 17.991 -11.485 334 H GLU 957 H GLU 957 2.007 13.720 -9.762 335 HA GLU 957 HA GLU 957 2.251 11.215 -11.006 336 1HB GLU 957 1HB GLU 957 3.972 13.156 -9.836 337 2HB GLU 957 2HB GLU 957 4.265 11.671 -8.953 338 1HG GLU 957 1HG GLU 957 4.269 11.883 -12.002 339 2HG GLU 957 2HG GLU 957 5.713 11.935 -11.010 340 H VAL 958 H VAL 958 2.135 12.248 -7.521 341 HA VAL 958 HA VAL 958 2.324 9.827 -6.322 342 HB VAL 958 HB VAL 958 1.822 12.371 -5.551 343 1HG1 VAL 958 1HG1 VAL 958 -0.290 12.420 -4.292 344 2HG1 VAL 958 2HG1 VAL 958 -0.576 12.221 -6.038 345 3HG1 VAL 958 3HG1 VAL 958 -0.720 10.822 -4.947 346 1HG2 VAL 958 1HG2 VAL 958 2.822 11.372 -3.819 347 2HG2 VAL 958 2HG2 VAL 958 1.202 10.886 -3.267 348 3HG2 VAL 958 3HG2 VAL 958 2.170 9.779 -4.270 349 H GLY 959 H GLY 959 -0.567 11.300 -7.890 350 1HA GLY 959 1HA GLY 959 -2.454 9.399 -7.112 351 2HA GLY 959 2HA GLY 959 -2.517 10.402 -8.548 352 H LEU 960 H LEU 960 -0.209 9.510 -9.958 353 HA LEU 960 HA LEU 960 -1.232 7.245 -11.217 354 1HB LEU 960 1HB LEU 960 0.806 9.139 -11.622 355 2HB LEU 960 2HB LEU 960 1.603 7.579 -11.634 356 HG LEU 960 HG LEU 960 -0.882 7.788 -13.252 357 1HD1 LEU 960 1HD1 LEU 960 0.923 8.703 -15.079 358 2HD1 LEU 960 2HD1 LEU 960 -0.264 9.715 -14.221 359 3HD1 LEU 960 3HD1 LEU 960 1.408 9.604 -13.622 360 1HD2 LEU 960 1HD2 LEU 960 1.443 6.755 -14.603 361 2HD2 LEU 960 2HD2 LEU 960 1.288 6.014 -12.993 362 3HD2 LEU 960 3HD2 LEU 960 -0.066 5.929 -14.145 363 H ALA 961 H ALA 961 1.522 7.634 -8.890 364 HA ALA 961 HA ALA 961 2.352 5.028 -8.823 365 1HB ALA 961 1HB ALA 961 3.139 7.265 -7.624 366 2HB ALA 961 2HB ALA 961 2.180 6.612 -6.274 367 3HB ALA 961 3HB ALA 961 3.537 5.672 -6.939 368 H LEU 962 H LEU 962 -0.259 6.609 -6.863 369 HA LEU 962 HA LEU 962 -0.935 4.380 -5.374 370 1HB LEU 962 1HB LEU 962 -2.485 6.792 -6.288 371 2HB LEU 962 2HB LEU 962 -3.207 5.558 -5.276 372 HG LEU 962 HG LEU 962 -0.616 6.705 -4.353 373 1HD1 LEU 962 1HD1 LEU 962 -2.867 8.383 -5.030 374 2HD1 LEU 962 2HD1 LEU 962 -2.559 8.419 -3.277 375 3HD1 LEU 962 3HD1 LEU 962 -1.256 8.829 -4.419 376 1HD2 LEU 962 1HD2 LEU 962 -2.920 6.504 -2.532 377 2HD2 LEU 962 2HD2 LEU 962 -2.429 4.967 -3.284 378 3HD2 LEU 962 3HD2 LEU 962 -1.248 5.919 -2.352 379 H ARG 963 H ARG 963 -2.308 5.550 -8.524 380 HA ARG 963 HA ARG 963 -4.169 3.644 -8.863 381 1HB ARG 963 1HB ARG 963 -3.222 5.673 -10.397 382 2HB ARG 963 2HB ARG 963 -2.484 4.341 -11.265 383 1HG ARG 963 1HG ARG 963 -4.460 3.922 -12.289 384 2HG ARG 963 2HG ARG 963 -5.180 3.545 -10.736 385 1HD ARG 963 1HD ARG 963 -6.537 5.341 -11.155 386 2HD ARG 963 2HD ARG 963 -5.169 6.305 -10.636 387 HE ARG 963 HE ARG 963 -4.917 7.036 -12.835 388 1HH1 ARG 963 2HH2 ARG 963 -6.658 3.978 -12.865 389 2HH1 ARG 963 1HH2 ARG 963 -6.933 4.004 -14.574 390 1HH2 ARG 963 2HH1 ARG 963 -5.280 7.071 -15.091 391 2HH2 ARG 963 1HH1 ARG 963 -6.144 5.776 -15.850 392 H THR 964 H THR 964 -0.712 3.507 -10.006 393 HA THR 964 HA THR 964 -0.758 0.982 -11.098 394 HB THR 964 HB THR 964 1.380 2.652 -9.699 395 HG1 THR 964 HG1 THR 964 0.835 1.748 -12.438 396 1HG2 THR 964 1HG2 THR 964 1.515 -0.146 -10.770 397 2HG2 THR 964 2HG2 THR 964 2.761 0.974 -11.372 398 3HG2 THR 964 3HG2 THR 964 2.600 0.678 -9.624 399 H LEU 965 H LEU 965 -0.646 1.951 -7.671 400 HA LEU 965 HA LEU 965 0.200 -0.451 -6.599 401 1HB LEU 965 1HB LEU 965 -0.638 2.010 -5.677 402 2HB LEU 965 2HB LEU 965 -1.875 0.929 -5.066 403 HG LEU 965 HG LEU 965 0.098 -0.509 -4.191 404 1HD1 LEU 965 1HD1 LEU 965 2.204 0.365 -4.020 405 2HD1 LEU 965 2HD1 LEU 965 1.702 1.068 -5.576 406 3HD1 LEU 965 3HD1 LEU 965 1.638 2.051 -4.094 407 1HD2 LEU 965 1HD2 LEU 965 -1.515 0.788 -2.814 408 2HD2 LEU 965 2HD2 LEU 965 0.113 0.684 -2.102 409 3HD2 LEU 965 3HD2 LEU 965 -0.414 2.184 -2.902 410 H LEU 966 H LEU 966 -3.164 0.682 -7.352 411 HA LEU 966 HA LEU 966 -4.533 -1.502 -6.469 412 1HB LEU 966 1HB LEU 966 -5.008 0.323 -8.820 413 2HB LEU 966 2HB LEU 966 -6.158 -0.905 -8.330 414 HG LEU 966 HG LEU 966 -6.963 1.040 -7.341 415 1HD1 LEU 966 1HD1 LEU 966 -6.972 0.616 -5.048 416 2HD1 LEU 966 2HD1 LEU 966 -6.576 -0.963 -5.769 417 3HD1 LEU 966 3HD1 LEU 966 -5.289 0.034 -5.048 418 1HD2 LEU 966 1HD2 LEU 966 -4.465 2.071 -7.687 419 2HD2 LEU 966 2HD2 LEU 966 -5.784 2.870 -6.798 420 3HD2 LEU 966 3HD2 LEU 966 -4.548 1.943 -5.914 421 H ALA 967 H ALA 967 -2.809 -1.056 -9.608 422 HA ALA 967 HA ALA 967 -3.614 -3.547 -10.657 423 1HB ALA 967 1HB ALA 967 -1.189 -1.820 -11.302 424 2HB ALA 967 2HB ALA 967 -1.887 -3.090 -12.336 425 3HB ALA 967 3HB ALA 967 -2.815 -1.610 -11.995 426 H THR 968 H THR 968 -0.373 -2.464 -9.398 427 HA THR 968 HA THR 968 0.872 -4.877 -9.355 428 HB THR 968 HB THR 968 2.301 -3.833 -7.626 429 HG1 THR 968 HG1 THR 968 1.077 -2.728 -6.148 430 1HG2 THR 968 1HG2 THR 968 3.013 -2.278 -9.139 431 2HG2 THR 968 2HG2 THR 968 1.478 -2.449 -10.023 432 3HG2 THR 968 3HG2 THR 968 1.626 -1.243 -8.722 433 H VAL 969 H VAL 969 -1.456 -3.612 -6.919 434 HA VAL 969 HA VAL 969 -1.120 -5.614 -5.044 435 HB VAL 969 HB VAL 969 -3.515 -3.960 -5.850 436 1HG1 VAL 969 1HG1 VAL 969 -3.226 -6.076 -3.765 437 2HG1 VAL 969 2HG1 VAL 969 -4.096 -4.590 -3.313 438 3HG1 VAL 969 3HG1 VAL 969 -4.656 -5.565 -4.693 439 1HG2 VAL 969 1HG2 VAL 969 -1.109 -3.336 -4.492 440 2HG2 VAL 969 2HG2 VAL 969 -2.552 -2.314 -4.696 441 3HG2 VAL 969 3HG2 VAL 969 -2.397 -3.360 -3.264 442 H ASP 970 H ASP 970 -3.290 -5.461 -7.939 443 HA ASP 970 HA ASP 970 -4.636 -7.773 -7.536 444 1HB ASP 970 1HB ASP 970 -4.684 -5.959 -9.474 445 2HB ASP 970 2HB ASP 970 -3.589 -7.056 -10.291 446 H GLU 971 H GLU 971 -1.251 -7.236 -8.305 447 HA GLU 971 HA GLU 971 -0.843 -9.808 -9.453 448 1HB GLU 971 1HB GLU 971 0.503 -7.485 -9.685 449 2HB GLU 971 2HB GLU 971 1.437 -8.174 -8.372 450 1HG GLU 971 1HG GLU 971 2.173 -10.007 -9.667 451 2HG GLU 971 2HG GLU 971 0.822 -9.900 -10.779 452 H SER 972 H SER 972 -1.032 -8.438 -6.253 453 HA SER 972 HA SER 972 0.565 -10.536 -5.109 454 1HB SER 972 1HB SER 972 -0.766 -9.140 -3.042 455 2HB SER 972 2HB SER 972 0.895 -8.929 -3.559 456 HG SER 972 HG SER 972 -0.567 -6.970 -3.577 457 H LEU 973 H LEU 973 -2.688 -9.984 -6.102 458 HA LEU 973 HA LEU 973 -4.129 -11.287 -4.117 459 1HB LEU 973 1HB LEU 973 -4.517 -10.461 -6.910 460 2HB LEU 973 2HB LEU 973 -5.487 -11.838 -6.428 461 HG LEU 973 HG LEU 973 -5.493 -9.552 -4.538 462 1HD1 LEU 973 1HD1 LEU 973 -5.915 -7.970 -6.044 463 2HD1 LEU 973 2HD1 LEU 973 -6.036 -9.154 -7.368 464 3HD1 LEU 973 3HD1 LEU 973 -7.458 -8.799 -6.358 465 1HD2 LEU 973 1HD2 LEU 973 -7.548 -10.327 -3.966 466 2HD2 LEU 973 2HD2 LEU 973 -7.966 -10.794 -5.632 467 3HD2 LEU 973 3HD2 LEU 973 -6.889 -11.827 -4.661 468 HA PRO 974 HA PRO 974 -3.190 -15.243 -6.530 469 1HB PRO 974 1HB PRO 974 -1.278 -15.235 -8.483 470 2HB PRO 974 2HB PRO 974 -2.990 -15.061 -8.816 471 1HG PRO 974 1HG PRO 974 -0.877 -12.995 -8.847 472 2HG PRO 974 2HG PRO 974 -2.471 -12.945 -9.573 473 1HD PRO 974 1HD PRO 974 -1.643 -11.634 -7.160 474 2HD PRO 974 2HD PRO 974 -3.264 -11.681 -7.824 475 H VAL 975 H VAL 975 -0.350 -13.216 -6.175 476 HA VAL 975 HA VAL 975 1.394 -15.256 -5.455 477 HB VAL 975 HB VAL 975 1.248 -12.303 -4.907 478 1HG1 VAL 975 1HG1 VAL 975 3.844 -12.926 -4.319 479 2HG1 VAL 975 2HG1 VAL 975 2.568 -12.644 -3.110 480 3HG1 VAL 975 3HG1 VAL 975 2.980 -14.305 -3.597 481 1HG2 VAL 975 1HG2 VAL 975 2.027 -13.796 -7.120 482 2HG2 VAL 975 2HG2 VAL 975 2.415 -12.087 -6.806 483 3HG2 VAL 975 3HG2 VAL 975 3.565 -13.362 -6.337 484 H LEU 976 H LEU 976 -1.266 -13.719 -3.735 485 HA LEU 976 HA LEU 976 -0.367 -15.006 -1.258 486 1HB LEU 976 1HB LEU 976 -2.055 -12.612 -1.864 487 2HB LEU 976 2HB LEU 976 -2.327 -13.496 -0.376 488 HG LEU 976 HG LEU 976 -0.661 -11.425 -0.542 489 1HD1 LEU 976 1HD1 LEU 976 0.595 -12.458 1.424 490 2HD1 LEU 976 2HD1 LEU 976 -1.177 -12.348 1.556 491 3HD1 LEU 976 3HD1 LEU 976 -0.408 -13.904 1.160 492 1HD2 LEU 976 1HD2 LEU 976 0.745 -12.598 -2.259 493 2HD2 LEU 976 2HD2 LEU 976 1.630 -12.019 -0.827 494 3HD2 LEU 976 3HD2 LEU 976 1.229 -13.746 -0.988 495 HA PRO 977 HA PRO 977 -3.655 -17.792 -1.466 496 1HB PRO 977 1HB PRO 977 -4.440 -18.093 1.134 497 2HB PRO 977 2HB PRO 977 -3.016 -18.867 0.467 498 1HG PRO 977 1HG PRO 977 -3.182 -16.530 2.270 499 2HG PRO 977 2HG PRO 977 -1.808 -17.566 1.938 500 1HD PRO 977 1HD PRO 977 -2.256 -14.926 0.909 501 2HD PRO 977 2HD PRO 977 -0.942 -16.006 0.488 502 H ALA 978 H ALA 978 -6.028 -18.334 -0.653 503 HA ALA 978 HA ALA 978 -7.507 -16.061 -1.566 504 1HB ALA 978 1HB ALA 978 -8.554 -17.930 -2.341 505 2HB ALA 978 2HB ALA 978 -7.957 -18.944 -1.005 506 3HB ALA 978 3HB ALA 978 -9.369 -17.888 -0.759 507 H SER 979 H SER 979 -6.240 -15.032 0.550 508 HA SER 979 HA SER 979 -8.379 -14.897 2.507 509 1HB SER 979 1HB SER 979 -5.962 -16.196 3.025 510 2HB SER 979 2HB SER 979 -5.684 -14.596 3.682 511 HG SER 979 HG SER 979 -6.868 -16.477 4.973 512 H THR 980 H THR 980 -6.815 -13.341 0.149 513 HA THR 980 HA THR 980 -6.641 -10.811 1.652 514 HB THR 980 HB THR 980 -4.697 -10.287 0.459 515 HG1 THR 980 HG1 THR 980 -4.670 -10.756 -1.742 516 1HG2 THR 980 1HG2 THR 980 -4.288 -13.136 -0.321 517 2HG2 THR 980 2HG2 THR 980 -3.257 -12.079 0.673 518 3HG2 THR 980 3HG2 THR 980 -4.661 -12.895 1.403 519 H HIS 981 H HIS 981 -9.120 -11.846 0.742 520 HA HIS 981 HA HIS 981 -9.625 -10.562 -1.782 521 1HB HIS 981 1HB HIS 981 -11.296 -12.170 0.150 522 2HB HIS 981 2HB HIS 981 -12.020 -11.327 -1.205 523 HD1 HIS 981 HD1 HIS 981 -12.656 -13.915 -1.875 524 HD2 HIS 981 HD2 HIS 981 -8.635 -12.778 -2.249 525 HE1 HIS 981 HE1 HIS 981 -11.561 -15.649 -3.393 526 H ARG 982 H ARG 982 -12.252 -10.283 0.438 527 HA ARG 982 HA ARG 982 -12.656 -7.681 0.084 528 1HB ARG 982 1HB ARG 982 -14.231 -9.191 1.269 529 2HB ARG 982 2HB ARG 982 -13.151 -9.281 2.646 530 1HG ARG 982 1HG ARG 982 -13.377 -6.628 2.638 531 2HG ARG 982 2HG ARG 982 -14.828 -6.941 1.705 532 1HD ARG 982 1HD ARG 982 -14.222 -8.165 4.442 533 2HD ARG 982 2HD ARG 982 -15.277 -6.791 4.174 534 HE ARG 982 HE ARG 982 -16.240 -8.808 2.468 535 1HH1 ARG 982 2HH2 ARG 982 -15.760 -8.407 5.931 536 2HH1 ARG 982 1HH2 ARG 982 -17.058 -9.469 6.363 537 1HH2 ARG 982 2HH1 ARG 982 -17.953 -10.208 3.038 538 2HH2 ARG 982 1HH1 ARG 982 -18.314 -10.500 4.706 539 H GLU 983 H GLU 983 -10.330 -9.223 2.306 540 HA GLU 983 HA GLU 983 -9.847 -7.045 3.936 541 1HB GLU 983 1HB GLU 983 -8.590 -9.640 3.334 542 2HB GLU 983 2HB GLU 983 -7.408 -8.417 3.760 543 1HG GLU 983 1HG GLU 983 -8.347 -8.060 5.907 544 2HG GLU 983 2HG GLU 983 -9.909 -8.705 5.445 545 H ILE 984 H ILE 984 -8.431 -8.045 0.776 546 HA ILE 984 HA ILE 984 -6.513 -5.941 0.775 547 HB ILE 984 HB ILE 984 -7.513 -7.887 -1.293 548 1HG1 ILE 984 1HG1 ILE 984 -6.115 -8.728 0.598 549 2HG1 ILE 984 2HG1 ILE 984 -5.417 -8.983 -0.990 550 1HG2 ILE 984 1HG2 ILE 984 -6.880 -6.341 -2.809 551 2HG2 ILE 984 2HG2 ILE 984 -5.868 -5.449 -1.647 552 3HG2 ILE 984 3HG2 ILE 984 -5.250 -6.935 -2.409 553 1HD1 ILE 984 1HD1 ILE 984 -4.108 -7.804 1.147 554 2HD1 ILE 984 2HD1 ILE 984 -3.635 -7.622 -0.560 555 3HD1 ILE 984 3HD1 ILE 984 -4.653 -6.386 0.218 556 H GLU 985 H GLU 985 -9.838 -6.435 -0.471 557 HA GLU 985 HA GLU 985 -9.838 -4.106 -2.023 558 1HB GLU 985 1HB GLU 985 -12.008 -5.900 -0.894 559 2HB GLU 985 2HB GLU 985 -12.425 -4.440 -1.768 560 1HG GLU 985 1HG GLU 985 -10.424 -5.749 -3.334 561 2HG GLU 985 2HG GLU 985 -11.532 -7.006 -2.819 562 H MET 986 H MET 986 -10.284 -4.776 1.412 563 HA MET 986 HA MET 986 -11.721 -2.431 1.990 564 1HB MET 986 1HB MET 986 -10.399 -4.677 3.427 565 2HB MET 986 2HB MET 986 -10.326 -3.173 4.323 566 1HG MET 986 1HG MET 986 -12.958 -3.142 3.474 567 2HG MET 986 2HG MET 986 -12.690 -4.865 3.653 568 1HE MET 986 1HE MET 986 -12.368 -1.453 5.025 569 2HE MET 986 2HE MET 986 -13.906 -1.822 5.841 570 3HE MET 986 3HE MET 986 -12.423 -1.590 6.798 571 H ALA 987 H ALA 987 -8.226 -3.337 2.052 572 HA ALA 987 HA ALA 987 -7.467 -0.752 3.046 573 1HB ALA 987 1HB ALA 987 -5.811 -3.036 1.899 574 2HB ALA 987 2HB ALA 987 -5.195 -1.649 2.828 575 3HB ALA 987 3HB ALA 987 -6.253 -2.847 3.612 576 H GLN 988 H GLN 988 -8.219 -2.216 -0.027 577 HA GLN 988 HA GLN 988 -6.548 -0.504 -1.544 578 1HB GLN 988 1HB GLN 988 -8.808 -2.415 -2.210 579 2HB GLN 988 2HB GLN 988 -8.116 -1.384 -3.446 580 1HG GLN 988 1HG GLN 988 -6.065 -2.765 -1.814 581 2HG GLN 988 2HG GLN 988 -7.123 -3.874 -2.663 582 1HE2 GLN 988 1HE2 GLN 988 -7.364 -3.691 -4.944 583 2HE2 GLN 988 2HE2 GLN 988 -6.105 -3.030 -5.932 584 H LYS 989 H LYS 989 -10.102 -0.681 -0.828 585 HA LYS 989 HA LYS 989 -10.802 1.581 -2.292 586 1HB LYS 989 1HB LYS 989 -12.394 -0.120 -1.523 587 2HB LYS 989 2HB LYS 989 -12.120 0.345 0.144 588 1HG LYS 989 1HG LYS 989 -12.985 2.618 -0.304 589 2HG LYS 989 2HG LYS 989 -13.154 2.251 -2.010 590 1HD LYS 989 1HD LYS 989 -14.842 0.515 -1.513 591 2HD LYS 989 2HD LYS 989 -14.615 0.743 0.210 592 1HE LYS 989 1HE LYS 989 -16.213 2.352 0.167 593 2HE LYS 989 2HE LYS 989 -15.149 3.342 -0.813 594 1HZ LYS 989 1HZ LYS 989 -16.701 3.102 -2.351 595 2HZ LYS 989 2HZ LYS 989 -16.156 1.579 -2.575 596 3HZ LYS 989 3HZ LYS 989 -17.435 1.853 -1.598 597 H LEU 990 H LEU 990 -9.543 1.153 1.036 598 HA LEU 990 HA LEU 990 -10.037 3.781 1.878 599 1HB LEU 990 1HB LEU 990 -9.061 1.426 2.967 600 2HB LEU 990 2HB LEU 990 -7.684 2.507 3.035 601 HG LEU 990 HG LEU 990 -10.421 3.176 4.148 602 1HD1 LEU 990 1HD1 LEU 990 -8.954 2.894 6.356 603 2HD1 LEU 990 2HD1 LEU 990 -9.855 1.544 5.625 604 3HD1 LEU 990 3HD1 LEU 990 -8.109 1.714 5.325 605 1HD2 LEU 990 1HD2 LEU 990 -9.668 5.236 4.463 606 2HD2 LEU 990 2HD2 LEU 990 -8.244 4.622 5.337 607 3HD2 LEU 990 3HD2 LEU 990 -8.190 4.810 3.568 608 H LEU 991 H LEU 991 -7.108 2.199 0.438 609 HA LEU 991 HA LEU 991 -5.391 4.291 0.498 610 1HB LEU 991 1HB LEU 991 -4.832 2.056 -0.258 611 2HB LEU 991 2HB LEU 991 -5.812 2.259 -1.696 612 HG LEU 991 HG LEU 991 -4.253 4.220 -2.284 613 1HD1 LEU 991 1HD1 LEU 991 -2.945 3.162 0.153 614 2HD1 LEU 991 2HD1 LEU 991 -1.873 3.519 -1.222 615 3HD1 LEU 991 3HD1 LEU 991 -2.922 4.794 -0.556 616 1HD2 LEU 991 1HD2 LEU 991 -4.099 2.363 -3.667 617 2HD2 LEU 991 2HD2 LEU 991 -2.437 2.539 -3.056 618 3HD2 LEU 991 3HD2 LEU 991 -3.515 1.306 -2.360 619 H ASN 992 H ASN 992 -7.476 3.550 -2.389 620 HA ASN 992 HA ASN 992 -7.000 5.840 -3.718 621 1HB ASN 992 1HB ASN 992 -8.454 3.773 -4.370 622 2HB ASN 992 2HB ASN 992 -9.782 4.587 -3.568 623 1HD2 ASN 992 1HD2 ASN 992 -10.238 4.082 -6.063 624 2HD2 ASN 992 2HD2 ASN 992 -10.093 5.460 -7.102 625 H SER 993 H SER 993 -9.901 5.162 -1.601 626 HA SER 993 HA SER 993 -11.094 7.525 -1.618 627 1HB SER 993 1HB SER 993 -11.807 5.500 -0.319 628 2HB SER 993 2HB SER 993 -10.597 5.866 0.894 629 HG SER 993 HG SER 993 -13.095 7.071 0.421 630 H ASP 994 H ASP 994 -8.538 6.629 0.824 631 HA ASP 994 HA ASP 994 -8.348 9.128 1.929 632 1HB ASP 994 1HB ASP 994 -6.844 6.618 1.943 633 2HB ASP 994 2HB ASP 994 -5.741 7.979 1.992 634 H LEU 995 H LEU 995 -6.738 7.598 -0.908 635 HA LEU 995 HA LEU 995 -4.737 9.431 -1.364 636 1HB LEU 995 1HB LEU 995 -4.404 7.800 -2.818 637 2HB LEU 995 2HB LEU 995 -6.084 7.304 -2.781 638 HG LEU 995 HG LEU 995 -6.642 9.019 -4.460 639 1HD1 LEU 995 1HD1 LEU 995 -3.959 9.960 -3.827 640 2HD1 LEU 995 2HD1 LEU 995 -4.212 9.764 -5.578 641 3HD1 LEU 995 3HD1 LEU 995 -5.311 10.795 -4.630 642 1HD2 LEU 995 1HD2 LEU 995 -4.911 7.974 -6.261 643 2HD2 LEU 995 2HD2 LEU 995 -4.755 6.794 -4.938 644 3HD2 LEU 995 3HD2 LEU 995 -6.352 7.128 -5.647 645 H ALA 996 H ALA 996 -8.088 9.412 -2.776 646 HA ALA 996 HA ALA 996 -7.880 11.812 -4.108 647 1HB ALA 996 1HB ALA 996 -10.320 11.777 -4.101 648 2HB ALA 996 2HB ALA 996 -9.706 10.120 -4.317 649 3HB ALA 996 3HB ALA 996 -10.330 10.639 -2.732 650 H GLU 997 H GLU 997 -8.860 11.128 -0.694 651 HA GLU 997 HA GLU 997 -9.593 13.665 -0.019 652 1HB GLU 997 1HB GLU 997 -9.889 11.628 1.396 653 2HB GLU 997 2HB GLU 997 -8.169 11.612 1.731 654 1HG GLU 997 1HG GLU 997 -8.731 12.874 3.555 655 2HG GLU 997 2HG GLU 997 -8.768 14.205 2.416 656 H LEU 998 H LEU 998 -6.349 12.240 -0.410 657 HA LEU 998 HA LEU 998 -5.016 14.427 0.854 658 1HB LEU 998 1HB LEU 998 -4.125 12.150 0.838 659 2HB LEU 998 2HB LEU 998 -3.997 12.195 -0.909 660 HG LEU 998 HG LEU 998 -2.578 14.344 0.588 661 1HD1 LEU 998 1HD1 LEU 998 -0.709 12.272 0.497 662 2HD1 LEU 998 2HD1 LEU 998 -1.466 12.980 1.944 663 3HD1 LEU 998 3HD1 LEU 998 -2.175 11.534 1.186 664 1HD2 LEU 998 1HD2 LEU 998 -0.814 13.615 -1.181 665 2HD2 LEU 998 2HD2 LEU 998 -2.179 12.751 -1.928 666 3HD2 LEU 998 3HD2 LEU 998 -2.261 14.514 -1.697 667 H ILE 999 H ILE 999 -5.548 13.326 -2.560 668 HA ILE 999 HA ILE 999 -4.170 15.364 -3.795 669 HB ILE 999 HB ILE 999 -6.584 13.767 -4.635 670 1HG1 ILE 999 1HG1 ILE 999 -4.426 12.571 -4.174 671 2HG1 ILE 999 2HG1 ILE 999 -5.050 12.380 -5.801 672 1HG2 ILE 999 1HG2 ILE 999 -5.590 14.532 -6.987 673 2HG2 ILE 999 2HG2 ILE 999 -6.851 15.454 -6.134 674 3HG2 ILE 999 3HG2 ILE 999 -5.151 15.970 -6.035 675 1HD1 ILE 999 1HD1 ILE 999 -3.192 13.314 -6.703 676 2HD1 ILE 999 2HD1 ILE 999 -3.327 14.738 -5.643 677 3HD1 ILE 999 3HD1 ILE 999 -2.475 13.282 -5.074 678 H ASN1000 H ASN1000 -7.655 15.233 -2.802 679 HA ASN1000 HA ASN1000 -8.475 17.584 -3.785 680 1HB ASN1000 1HB ASN1000 -9.935 16.011 -2.528 681 2HB ASN1000 2HB ASN1000 -9.100 16.387 -1.035 682 1HD2 ASN1000 1HD2 ASN1000 -9.532 18.223 0.074 683 2HD2 ASN1000 2HD2 ASN1000 -10.798 19.339 -0.319 684 H LYS1001 H LYS1001 -6.896 16.966 -0.560 685 HA LYS1001 HA LYS1001 -6.891 19.550 0.380 686 1HB LYS1001 1HB LYS1001 -5.937 17.075 1.207 687 2HB LYS1001 2HB LYS1001 -4.480 18.038 1.069 688 1HG LYS1001 1HG LYS1001 -5.077 18.701 3.195 689 2HG LYS1001 2HG LYS1001 -6.037 19.872 2.313 690 1HD LYS1001 1HD LYS1001 -7.971 18.197 2.364 691 2HD LYS1001 2HD LYS1001 -7.001 17.199 3.428 692 1HE LYS1001 1HE LYS1001 -7.202 18.660 5.227 693 2HE LYS1001 2HE LYS1001 -7.274 20.084 4.208 694 1HZ LYS1001 1HZ LYS1001 -9.509 19.066 3.495 695 2HZ LYS1001 2HZ LYS1001 -9.412 18.238 4.899 696 3HZ LYS1001 3HZ LYS1001 -9.413 19.871 4.912 697 H MET1002 H MET1002 -4.466 17.863 -1.710 698 HA MET1002 HA MET1002 -2.713 20.007 -1.811 699 1HB MET1002 1HB MET1002 -1.986 17.795 -2.510 700 2HB MET1002 2HB MET1002 -3.307 17.637 -3.649 701 1HG MET1002 1HG MET1002 -1.342 19.908 -4.020 702 2HG MET1002 2HG MET1002 -0.852 18.291 -4.484 703 1HE MET1002 1HE MET1002 -1.887 21.303 -5.448 704 2HE MET1002 2HE MET1002 -1.349 20.680 -7.026 705 3HE MET1002 3HE MET1002 -3.030 21.224 -6.809 706 H LYS1003 H LYS1003 -5.336 18.966 -4.098 707 HA LYS1003 HA LYS1003 -5.023 20.755 -6.083 708 1HB LYS1003 1HB LYS1003 -7.181 19.159 -4.995 709 2HB LYS1003 2HB LYS1003 -7.801 20.683 -5.597 710 1HG LYS1003 1HG LYS1003 -6.323 20.223 -7.712 711 2HG LYS1003 2HG LYS1003 -6.212 18.579 -7.113 712 1HD LYS1003 1HD LYS1003 -8.985 19.486 -7.010 713 2HD LYS1003 2HD LYS1003 -8.339 19.731 -8.620 714 1HE LYS1003 1HE LYS1003 -7.681 17.382 -8.796 715 2HE LYS1003 2HE LYS1003 -8.055 17.094 -7.108 716 1HZ LYS1003 1HZ LYS1003 -10.247 18.192 -8.540 717 2HZ LYS1003 2HZ LYS1003 -9.754 16.766 -9.163 718 3HZ LYS1003 3HZ LYS1003 -10.187 16.864 -7.592 719 H LEU1004 H LEU1004 -6.458 21.363 -2.835 720 HA LEU1004 HA LEU1004 -7.061 24.082 -3.498 721 1HB LEU1004 1HB LEU1004 -6.964 22.868 -0.746 722 2HB LEU1004 2HB LEU1004 -7.892 24.249 -1.297 723 HG LEU1004 HG LEU1004 -8.387 21.473 -2.377 724 1HD1 LEU1004 1HD1 LEU1004 -8.967 20.878 -0.293 725 2HD1 LEU1004 2HD1 LEU1004 -9.055 22.561 0.279 726 3HD1 LEU1004 3HD1 LEU1004 -10.424 21.851 -0.609 727 1HD2 LEU1004 1HD2 LEU1004 -10.740 22.582 -2.586 728 2HD2 LEU1004 2HD2 LEU1004 -9.826 24.105 -2.462 729 3HD2 LEU1004 3HD2 LEU1004 -9.469 22.957 -3.774 730 H ALA1005 H ALA1005 -4.426 22.256 -1.911 731 HA ALA1005 HA ALA1005 -3.106 24.318 -0.671 732 1HB ALA1005 1HB ALA1005 -1.941 21.928 -2.159 733 2HB ALA1005 2HB ALA1005 -1.115 22.883 -0.904 734 3HB ALA1005 3HB ALA1005 -2.549 21.914 -0.486 735 H GLN1006 H GLN1006 -3.658 23.751 -4.077 736 HA GLN1006 HA GLN1006 -1.459 25.468 -4.805 737 1HB GLN1006 1HB GLN1006 -2.239 23.312 -6.065 738 2HB GLN1006 2HB GLN1006 -3.521 24.317 -6.711 739 1HG GLN1006 1HG GLN1006 -0.784 25.507 -6.861 740 2HG GLN1006 2HG GLN1006 -1.026 24.078 -7.845 741 1HE2 GLN1006 1HE2 GLN1006 -0.518 26.569 -8.916 742 2HE2 GLN1006 2HE2 GLN1006 -1.896 27.142 -9.796 743 H GLN1007 H GLN1007 -4.909 25.563 -4.185 744 HA GLN1007 HA GLN1007 -5.143 28.082 -5.591 745 1HB GLN1007 1HB GLN1007 -6.886 26.131 -5.653 746 2HB GLN1007 2HB GLN1007 -7.366 26.691 -4.064 747 1HG GLN1007 1HG GLN1007 -8.716 28.171 -5.143 748 2HG GLN1007 2HG GLN1007 -7.259 29.070 -5.514 749 1HE2 GLN1007 1HE2 GLN1007 -6.387 29.044 -7.531 750 2HE2 GLN1007 2HE2 GLN1007 -7.152 28.345 -8.920 751 H TYR1008 H TYR1008 -4.289 26.877 -2.521 752 HA TYR1008 HA TYR1008 -5.338 29.238 -1.141 753 1HB TYR1008 1HB TYR1008 -4.793 26.402 -0.600 754 2HB TYR1008 2HB TYR1008 -3.841 27.372 0.506 755 HD1 TYR1008 HD1 TYR1008 -4.862 27.274 2.595 756 HD2 TYR1008 HD2 TYR1008 -7.296 27.882 -0.870 757 HE1 TYR1008 HE1 TYR1008 -6.906 27.579 4.075 758 HE2 TYR1008 HE2 TYR1008 -9.332 28.186 0.622 759 HH TYR1008 HH TYR1008 -9.971 27.363 2.981 760 H VAL1009 H VAL1009 -2.328 27.488 -2.029 761 HA VAL1009 HA VAL1009 -0.465 28.697 -0.527 762 HB VAL1009 HB VAL1009 0.099 27.023 -2.108 763 1HG1 VAL1009 1HG1 VAL1009 -0.322 27.029 -4.365 764 2HG1 VAL1009 2HG1 VAL1009 -1.676 28.040 -3.803 765 3HG1 VAL1009 3HG1 VAL1009 -0.223 28.802 -4.494 766 1HG2 VAL1009 1HG2 VAL1009 1.594 29.335 -1.764 767 2HG2 VAL1009 2HG2 VAL1009 2.177 27.795 -2.440 768 3HG2 VAL1009 3HG2 VAL1009 1.612 29.087 -3.527 769 H MET1010 H MET1010 -2.174 30.112 -3.370 770 HA MET1010 HA MET1010 -0.822 32.299 -3.890 771 1HB MET1010 1HB MET1010 -3.292 33.420 -3.864 772 2HB MET1010 2HB MET1010 -2.858 32.198 -5.043 773 1HG MET1010 1HG MET1010 -4.292 30.656 -4.145 774 2HG MET1010 2HG MET1010 -3.787 31.007 -2.504 775 1HE MET1010 1HE MET1010 -5.351 31.272 -1.105 776 2HE MET1010 2HE MET1010 -6.754 32.367 -1.101 777 3HE MET1010 3HE MET1010 -6.848 30.803 -1.946 778 H THR1011 H THR1011 -2.560 31.666 -0.846 779 HA THR1011 HA THR1011 -1.973 34.385 0.073 780 HB THR1011 HB THR1011 -3.574 33.806 1.869 781 HG1 THR1011 HG1 THR1011 -4.429 31.545 1.711 782 1HG2 THR1011 1HG2 THR1011 -5.523 32.830 0.381 783 2HG2 THR1011 2HG2 THR1011 -4.885 34.443 -0.018 784 3HG2 THR1011 3HG2 THR1011 -4.371 33.025 -0.962 785 H SER1012 H SER1012 -2.124 33.010 2.893 786 HA SER1012 HA SER1012 0.701 32.280 2.869 787 1HB SER1012 1HB SER1012 -0.652 34.361 4.302 788 2HB SER1012 2HB SER1012 -0.181 33.157 5.485 789 HG SER1012 HG SER1012 1.612 34.450 5.318 790 H LEU1013 H LEU1013 -2.434 31.137 3.198 791 HA LEU1013 HA LEU1013 -2.235 29.550 5.512 792 1HB LEU1013 1HB LEU1013 -4.016 29.682 3.121 793 2HB LEU1013 2HB LEU1013 -4.079 28.252 4.132 794 HG LEU1013 HG LEU1013 -5.777 30.037 4.643 795 1HD1 LEU1013 1HD1 LEU1013 -4.812 30.000 7.242 796 2HD1 LEU1013 2HD1 LEU1013 -5.844 28.770 6.473 797 3HD1 LEU1013 3HD1 LEU1013 -4.077 28.561 6.494 798 1HD2 LEU1013 1HD2 LEU1013 -4.579 32.053 4.368 799 2HD2 LEU1013 2HD2 LEU1013 -4.928 31.924 6.109 800 3HD2 LEU1013 3HD2 LEU1013 -3.300 31.542 5.497 801 H GLN1014 H GLN1014 -0.571 29.438 2.535 802 HA GLN1014 HA GLN1014 -0.425 26.948 1.717 803 1HB GLN1014 1HB GLN1014 1.000 28.728 0.827 804 2HB GLN1014 2HB GLN1014 1.931 28.789 2.310 805 1HG GLN1014 1HG GLN1014 1.922 26.053 1.384 806 2HG GLN1014 2HG GLN1014 2.327 27.079 0.022 807 1HE2 GLN1014 1HE2 GLN1014 4.354 27.610 -0.221 808 2HE2 GLN1014 2HE2 GLN1014 5.586 27.644 0.997 809 H GLN1015 H GLN1015 2.209 27.887 4.005 810 HA GLN1015 HA GLN1015 2.937 25.479 4.794 811 1HB GLN1015 1HB GLN1015 3.298 26.673 7.155 812 2HB GLN1015 2HB GLN1015 4.230 27.142 5.748 813 1HG GLN1015 1HG GLN1015 3.008 29.128 5.420 814 2HG GLN1015 2HG GLN1015 1.579 28.510 6.224 815 1HE2 GLN1015 1HE2 GLN1015 1.335 28.685 8.390 816 2HE2 GLN1015 2HE2 GLN1015 2.411 29.545 9.440 817 H GLU1016 H GLU1016 -0.053 27.153 5.744 818 HA GLU1016 HA GLU1016 -0.649 25.501 7.914 819 1HB GLU1016 1HB GLU1016 -1.710 27.805 6.834 820 2HB GLU1016 2HB GLU1016 -2.935 26.636 6.384 821 1HG GLU1016 1HG GLU1016 -3.735 26.615 8.503 822 2HG GLU1016 2HG GLU1016 -2.179 26.083 9.109 823 H TYR1017 H TYR1017 -1.837 25.512 4.476 824 HA TYR1017 HA TYR1017 -3.303 23.113 4.789 825 1HB TYR1017 1HB TYR1017 -2.375 25.069 2.703 826 2HB TYR1017 2HB TYR1017 -2.638 23.455 2.075 827 HD1 TYR1017 HD1 TYR1017 -4.530 23.914 0.696 828 HD2 TYR1017 HD2 TYR1017 -4.597 24.988 4.837 829 HE1 TYR1017 HE1 TYR1017 -7.023 24.386 0.540 830 HE2 TYR1017 HE2 TYR1017 -7.090 25.456 4.667 831 HH TYR1017 HH TYR1017 -8.865 25.314 3.426 832 H LYS1018 H LYS1018 0.087 23.861 4.161 833 HA LYS1018 HA LYS1018 0.774 21.509 2.812 834 1HB LYS1018 1HB LYS1018 2.049 23.850 3.668 835 2HB LYS1018 2HB LYS1018 2.882 22.567 4.523 836 1HG LYS1018 1HG LYS1018 4.015 22.807 2.414 837 2HG LYS1018 2HG LYS1018 3.085 21.326 2.297 838 1HD LYS1018 1HD LYS1018 1.900 22.135 0.540 839 2HD LYS1018 2HD LYS1018 1.418 23.551 1.454 840 1HE LYS1018 1HE LYS1018 3.347 24.800 0.770 841 2HE LYS1018 2HE LYS1018 4.204 23.362 0.250 842 1HZ LYS1018 1HZ LYS1018 1.677 24.022 -1.030 843 2HZ LYS1018 2HZ LYS1018 3.016 24.854 -1.456 844 3HZ LYS1018 3HZ LYS1018 2.969 23.232 -1.641 845 H LYS1019 H LYS1019 0.532 22.349 6.306 846 HA LYS1019 HA LYS1019 1.566 19.850 7.160 847 1HB LYS1019 1HB LYS1019 0.575 22.327 8.355 848 2HB LYS1019 2HB LYS1019 0.069 20.911 9.254 849 1HG LYS1019 1HG LYS1019 2.171 21.319 10.205 850 2HG LYS1019 2HG LYS1019 2.581 20.138 8.978 851 1HD LYS1019 1HD LYS1019 2.599 22.959 8.019 852 2HD LYS1019 2HD LYS1019 3.794 22.609 9.252 853 1HE LYS1019 1HE LYS1019 3.551 20.582 7.055 854 2HE LYS1019 2HE LYS1019 4.198 22.142 6.588 855 1HZ LYS1019 1HZ LYS1019 5.255 20.284 8.580 856 2HZ LYS1019 2HZ LYS1019 6.013 20.926 7.284 857 3HZ LYS1019 3HZ LYS1019 5.694 21.857 8.588 858 H GLN1020 H GLN1020 -1.636 21.126 6.272 859 HA GLN1020 HA GLN1020 -3.185 19.221 7.493 860 1HB GLN1020 1HB GLN1020 -3.558 20.788 4.913 861 2HB GLN1020 2HB GLN1020 -4.809 19.740 5.552 862 1HG GLN1020 1HG GLN1020 -3.604 21.656 7.512 863 2HG GLN1020 2HG GLN1020 -4.547 22.384 6.227 864 1HE2 GLN1020 1HE2 GLN1020 -6.334 22.977 7.262 865 2HE2 GLN1020 2HE2 GLN1020 -7.427 21.922 8.094 866 H MET1021 H MET1021 -2.067 19.258 4.024 867 HA MET1021 HA MET1021 -2.959 16.712 3.472 868 1HB MET1021 1HB MET1021 -1.486 16.905 1.482 869 2HB MET1021 2HB MET1021 -2.249 18.452 1.791 870 1HG MET1021 1HG MET1021 -0.256 19.417 2.652 871 2HG MET1021 2HG MET1021 0.458 17.861 3.025 872 1HE MET1021 1HE MET1021 1.146 16.156 1.393 873 2HE MET1021 2HE MET1021 -0.119 16.201 0.141 874 3HE MET1021 3HE MET1021 1.586 16.437 -0.309 875 H LEU1022 H LEU1022 -0.116 17.833 5.221 876 HA LEU1022 HA LEU1022 1.469 15.530 4.833 877 1HB LEU1022 1HB LEU1022 2.270 17.781 5.519 878 2HB LEU1022 2HB LEU1022 1.519 17.544 7.084 879 HG LEU1022 HG LEU1022 4.012 17.133 6.946 880 1HD1 LEU1022 1HD1 LEU1022 3.970 15.289 8.499 881 2HD1 LEU1022 2HD1 LEU1022 2.569 16.344 8.800 882 3HD1 LEU1022 3HD1 LEU1022 2.352 14.802 7.939 883 1HD2 LEU1022 1HD2 LEU1022 3.458 15.670 4.730 884 2HD2 LEU1022 2HD2 LEU1022 4.940 15.505 5.701 885 3HD2 LEU1022 3HD2 LEU1022 3.581 14.384 5.954 886 H THR1023 H THR1023 -0.860 16.574 7.398 887 HA THR1023 HA THR1023 -0.520 14.466 9.133 888 HB THR1023 HB THR1023 -3.255 15.627 8.512 889 HG1 THR1023 HG1 THR1023 -0.912 16.894 9.748 890 1HG2 THR1023 1HG2 THR1023 -2.810 14.177 10.577 891 2HG2 THR1023 2HG2 THR1023 -1.654 15.420 11.112 892 3HG2 THR1023 3HG2 THR1023 -3.380 15.822 10.946 893 H ALA1024 H ALA1024 -2.623 14.629 6.200 894 HA ALA1024 HA ALA1024 -3.707 12.066 6.570 895 1HB ALA1024 1HB ALA1024 -4.437 14.073 5.066 896 2HB ALA1024 2HB ALA1024 -3.304 13.383 3.879 897 3HB ALA1024 3HB ALA1024 -4.680 12.416 4.463 898 H ALA1025 H ALA1025 -0.827 13.310 4.782 899 HA ALA1025 HA ALA1025 -0.122 10.998 3.476 900 1HB ALA1025 1HB ALA1025 1.508 12.397 2.824 901 2HB ALA1025 2HB ALA1025 0.988 13.561 4.067 902 3HB ALA1025 3HB ALA1025 2.229 12.344 4.451 903 H HIS1026 H HIS1026 0.136 11.880 6.911 904 HA HIS1026 HA HIS1026 2.011 9.913 7.600 905 1HB HIS1026 1HB HIS1026 0.670 12.013 8.862 906 2HB HIS1026 2HB HIS1026 0.109 10.585 9.708 907 HD1 HIS1026 HD1 HIS1026 2.084 12.815 10.887 908 HD2 HIS1026 HD2 HIS1026 3.187 9.044 9.417 909 HE1 HIS1026 HE1 HIS1026 4.321 12.248 11.978 910 H ALA1027 H ALA1027 -1.610 10.005 7.947 911 HA ALA1027 HA ALA1027 -1.747 7.293 8.733 912 1HB ALA1027 1HB ALA1027 -3.878 7.877 9.185 913 2HB ALA1027 2HB ALA1027 -3.427 9.524 8.682 914 3HB ALA1027 3HB ALA1027 -4.166 8.406 7.510 915 H LEU1028 H LEU1028 -1.867 9.051 5.618 916 HA LEU1028 HA LEU1028 -2.892 6.979 4.067 917 1HB LEU1028 1HB LEU1028 -1.413 9.502 3.632 918 2HB LEU1028 2HB LEU1028 -1.294 8.319 2.344 919 HG LEU1028 HG LEU1028 -3.216 10.178 2.462 920 1HD1 LEU1028 1HD1 LEU1028 -4.373 8.978 0.792 921 2HD1 LEU1028 2HD1 LEU1028 -2.672 8.471 0.662 922 3HD1 LEU1028 3HD1 LEU1028 -3.860 7.405 1.449 923 1HD2 LEU1028 1HD2 LEU1028 -4.039 9.160 4.644 924 2HD2 LEU1028 2HD2 LEU1028 -5.258 9.442 3.378 925 3HD2 LEU1028 3HD2 LEU1028 -4.636 7.799 3.664 926 H ALA1029 H ALA1029 0.583 8.005 4.413 927 HA ALA1029 HA ALA1029 1.795 6.037 3.073 928 1HB ALA1029 1HB ALA1029 3.717 6.505 4.379 929 2HB ALA1029 2HB ALA1029 2.752 7.999 4.450 930 3HB ALA1029 3HB ALA1029 2.749 6.871 5.827 931 H VAL1030 H VAL1030 0.453 5.802 6.420 932 HA VAL1030 HA VAL1030 1.314 3.127 6.775 933 HB VAL1030 HB VAL1030 -0.549 5.023 8.162 934 1HG1 VAL1030 1HG1 VAL1030 -1.099 3.355 9.837 935 2HG1 VAL1030 2HG1 VAL1030 -1.632 2.788 8.236 936 3HG1 VAL1030 3HG1 VAL1030 -0.152 2.123 8.970 937 1HG2 VAL1030 1HG2 VAL1030 1.860 5.252 8.537 938 2HG2 VAL1030 2HG2 VAL1030 1.036 4.711 10.019 939 3HG2 VAL1030 3HG2 VAL1030 1.957 3.546 9.036 940 H ASP1031 H ASP1031 -1.769 4.702 5.738 941 HA ASP1031 HA ASP1031 -3.457 2.676 5.713 942 1HB ASP1031 1HB ASP1031 -3.463 5.133 4.596 943 2HB ASP1031 2HB ASP1031 -3.215 4.210 3.127 944 H ALA1032 H ALA1032 -1.107 3.445 3.028 945 HA ALA1032 HA ALA1032 -1.670 1.278 1.417 946 1HB ALA1032 1HB ALA1032 -0.329 3.237 0.754 947 2HB ALA1032 2HB ALA1032 0.967 2.734 1.866 948 3HB ALA1032 3HB ALA1032 0.564 1.726 0.455 949 H LYS1033 H LYS1033 0.599 1.601 4.207 950 HA LYS1033 HA LYS1033 1.857 -0.835 3.970 951 1HB LYS1033 1HB LYS1033 2.338 1.133 5.536 952 2HB LYS1033 2HB LYS1033 1.121 0.460 6.601 953 1HG LYS1033 1HG LYS1033 3.544 -1.092 5.573 954 2HG LYS1033 2HG LYS1033 3.476 -0.298 7.133 955 1HD LYS1033 1HD LYS1033 1.238 -1.720 7.430 956 2HD LYS1033 2HD LYS1033 1.938 -2.720 6.173 957 1HE LYS1033 1HE LYS1033 3.176 -3.753 7.770 958 2HE LYS1033 2HE LYS1033 4.076 -2.263 7.969 959 1HZ LYS1033 1HZ LYS1033 1.942 -1.709 9.392 960 2HZ LYS1033 2HZ LYS1033 1.949 -3.331 9.587 961 3HZ LYS1033 3HZ LYS1033 3.252 -2.450 10.027 962 H ASN1034 H ASN1034 -1.114 -0.034 5.906 963 HA ASN1034 HA ASN1034 -1.660 -2.411 6.936 964 1HB ASN1034 1HB ASN1034 -3.819 -0.793 5.500 965 2HB ASN1034 2HB ASN1034 -4.011 -1.764 6.946 966 1HD2 ASN1034 1HD2 ASN1034 -4.774 0.905 6.740 967 2HD2 ASN1034 2HD2 ASN1034 -3.821 1.877 7.811 968 H LEU1035 H LEU1035 -2.256 -1.308 3.544 969 HA LEU1035 HA LEU1035 -3.773 -3.366 2.596 970 1HB LEU1035 1HB LEU1035 -2.879 -1.188 1.509 971 2HB LEU1035 2HB LEU1035 -1.530 -2.180 0.991 972 HG LEU1035 HG LEU1035 -4.432 -2.773 0.351 973 1HD1 LEU1035 1HD1 LEU1035 -3.570 -0.638 -0.649 974 2HD1 LEU1035 2HD1 LEU1035 -2.349 -1.607 -1.509 975 3HD1 LEU1035 3HD1 LEU1035 -4.081 -1.870 -1.828 976 1HD2 LEU1035 1HD2 LEU1035 -1.835 -4.108 -0.335 977 2HD2 LEU1035 2HD2 LEU1035 -3.387 -4.819 0.169 978 3HD2 LEU1035 3HD2 LEU1035 -3.197 -4.173 -1.479 979 H LEU1036 H LEU1036 -0.149 -3.198 2.317 980 HA LEU1036 HA LEU1036 0.045 -5.916 1.617 981 1HB LEU1036 1HB LEU1036 1.664 -3.734 1.499 982 2HB LEU1036 2HB LEU1036 2.384 -4.601 2.840 983 HG LEU1036 HG LEU1036 1.952 -6.536 0.829 984 1HD1 LEU1036 1HD1 LEU1036 1.677 -4.515 -0.682 985 2HD1 LEU1036 2HD1 LEU1036 3.396 -4.170 -0.373 986 3HD1 LEU1036 3HD1 LEU1036 2.921 -5.697 -1.153 987 1HD2 LEU1036 1HD2 LEU1036 3.833 -7.019 1.946 988 2HD2 LEU1036 2HD2 LEU1036 4.630 -6.006 0.718 989 3HD2 LEU1036 3HD2 LEU1036 4.189 -5.310 2.296 990 H ASP1037 H ASP1037 0.213 -4.113 4.716 991 HA ASP1037 HA ASP1037 1.291 -5.880 6.364 992 1HB ASP1037 1HB ASP1037 0.148 -3.638 6.893 993 2HB ASP1037 2HB ASP1037 -1.370 -4.511 6.962 994 H VAL1038 H VAL1038 -2.087 -5.907 5.053 995 HA VAL1038 HA VAL1038 -2.904 -8.183 6.519 996 HB VAL1038 HB VAL1038 -3.957 -6.799 4.049 997 1HG1 VAL1038 1HG1 VAL1038 -4.593 -9.410 4.960 998 2HG1 VAL1038 2HG1 VAL1038 -5.960 -8.359 5.402 999 3HG1 VAL1038 3HG1 VAL1038 -5.417 -8.449 3.709 1000 1HG2 VAL1038 1HG2 VAL1038 -3.952 -5.573 6.265 1001 2HG2 VAL1038 2HG2 VAL1038 -5.547 -5.772 5.500 1002 3HG2 VAL1038 3HG2 VAL1038 -5.079 -6.813 6.865 1003 H ILE1039 H ILE1039 -1.397 -7.623 3.311 1004 HA ILE1039 HA ILE1039 -1.768 -10.163 2.268 1005 HB ILE1039 HB ILE1039 0.032 -7.864 1.798 1006 1HG1 ILE1039 1HG1 ILE1039 -1.613 -9.608 -0.060 1007 2HG1 ILE1039 2HG1 ILE1039 -2.194 -8.151 0.721 1008 1HG2 ILE1039 1HG2 ILE1039 1.392 -9.094 0.159 1009 2HG2 ILE1039 2HG2 ILE1039 1.667 -9.662 1.823 1010 3HG2 ILE1039 3HG2 ILE1039 0.664 -10.622 0.710 1011 1HD1 ILE1039 1HD1 ILE1039 -0.164 -6.947 -0.352 1012 2HD1 ILE1039 2HD1 ILE1039 0.010 -8.406 -1.357 1013 3HD1 ILE1039 3HD1 ILE1039 -1.483 -7.440 -1.441 1014 H ASP1040 H ASP1040 0.960 -8.830 4.251 1015 HA ASP1040 HA ASP1040 2.532 -11.021 4.263 1016 1HB ASP1040 1HB ASP1040 2.798 -8.679 5.405 1017 2HB ASP1040 2HB ASP1040 1.999 -9.405 6.785 1018 H GLN1041 H GLN1041 -0.329 -10.221 6.332 1019 HA GLN1041 HA GLN1041 -0.065 -12.505 7.947 1020 1HB GLN1041 1HB GLN1041 -1.989 -10.271 7.604 1021 2HB GLN1041 2HB GLN1041 -2.722 -11.759 8.166 1022 1HG GLN1041 1HG GLN1041 -2.072 -10.801 10.198 1023 2HG GLN1041 2HG GLN1041 -0.687 -11.820 9.862 1024 1HE2 GLN1041 1HE2 GLN1041 -1.850 -8.666 10.351 1025 2HE2 GLN1041 2HE2 GLN1041 -0.391 -7.773 10.079 1026 H ALA1042 H ALA1042 -1.559 -11.803 4.815 1027 HA ALA1042 HA ALA1042 -3.284 -14.064 4.810 1028 1HB ALA1042 1HB ALA1042 -2.459 -11.873 2.992 1029 2HB ALA1042 2HB ALA1042 -2.904 -13.392 2.178 1030 3HB ALA1042 3HB ALA1042 -4.065 -12.592 3.265 1031 H ARG1043 H ARG1043 -0.033 -13.302 3.399 1032 HA ARG1043 HA ARG1043 0.389 -15.530 1.996 1033 1HB ARG1043 1HB ARG1043 1.976 -13.565 2.314 1034 2HB ARG1043 2HB ARG1043 2.455 -14.248 3.854 1035 1HG ARG1043 1HG ARG1043 4.020 -15.448 2.730 1036 2HG ARG1043 2HG ARG1043 2.710 -16.415 2.083 1037 1HD ARG1043 1HD ARG1043 3.069 -15.592 -0.004 1038 2HD ARG1043 2HD ARG1043 2.857 -13.948 0.565 1039 HE ARG1043 HE ARG1043 5.372 -15.234 -0.017 1040 1HH1 ARG1043 2HH2 ARG1043 3.898 -12.947 2.215 1041 2HH1 ARG1043 1HH2 ARG1043 5.383 -12.119 2.547 1042 1HH2 ARG1043 2HH1 ARG1043 7.331 -14.142 0.421 1043 2HH2 ARG1043 1HH1 ARG1043 7.348 -12.803 1.520 1044 H LEU1044 H LEU1044 1.470 -15.115 5.458 1045 HA LEU1044 HA LEU1044 2.305 -17.628 5.966 1046 1HB LEU1044 1HB LEU1044 1.527 -17.178 8.333 1047 2HB LEU1044 2HB LEU1044 2.644 -16.036 7.610 1048 HG LEU1044 HG LEU1044 0.355 -14.782 6.991 1049 1HD1 LEU1044 1HD1 LEU1044 -0.327 -16.633 9.242 1050 2HD1 LEU1044 2HD1 LEU1044 -1.013 -14.990 9.231 1051 3HD1 LEU1044 3HD1 LEU1044 -1.314 -16.089 7.864 1052 1HD2 LEU1044 1HD2 LEU1044 0.672 -13.703 9.408 1053 2HD2 LEU1044 2HD2 LEU1044 2.168 -14.666 9.352 1054 3HD2 LEU1044 3HD2 LEU1044 1.840 -13.456 8.088 1055 H LYS1045 H LYS1045 -1.100 -16.434 5.962 1056 HA LYS1045 HA LYS1045 -2.420 -18.536 6.986 1057 1HB LYS1045 1HB LYS1045 -3.137 -16.283 5.692 1058 2HB LYS1045 2HB LYS1045 -3.513 -17.448 4.439 1059 1HG LYS1045 1HG LYS1045 -5.378 -18.115 5.542 1060 2HG LYS1045 2HG LYS1045 -4.445 -18.497 6.975 1061 1HD LYS1045 1HD LYS1045 -4.592 -16.181 7.769 1062 2HD LYS1045 2HD LYS1045 -5.331 -15.663 6.267 1063 1HE LYS1045 1HE LYS1045 -7.295 -15.962 7.419 1064 2HE LYS1045 2HE LYS1045 -7.085 -17.642 6.966 1065 1HZ LYS1045 1HZ LYS1045 -7.173 -17.942 9.155 1066 2HZ LYS1045 2HZ LYS1045 -5.603 -17.492 9.162 1067 3HZ LYS1045 3HZ LYS1045 -6.766 -16.405 9.527 1068 H MET1046 H MET1046 -0.623 -18.416 3.924 1069 HA MET1046 HA MET1046 -1.700 -20.961 3.134 1070 1HB MET1046 1HB MET1046 -1.304 -19.461 1.304 1071 2HB MET1046 2HB MET1046 0.223 -18.910 1.965 1072 1HG MET1046 1HG MET1046 1.260 -21.118 1.484 1073 2HG MET1046 2HG MET1046 -0.272 -21.732 0.896 1074 1HE MET1046 1HE MET1046 0.958 -17.825 -0.290 1075 2HE MET1046 2HE MET1046 1.914 -18.780 0.868 1076 3HE MET1046 3HE MET1046 2.472 -18.600 -0.813 1077 H ILE1047 H ILE1047 1.546 -19.547 3.962 1078 HA ILE1047 HA ILE1047 3.071 -21.780 3.760 1079 HB ILE1047 HB ILE1047 3.150 -19.399 5.576 1080 1HG1 ILE1047 1HG1 ILE1047 5.443 -19.867 3.872 1081 2HG1 ILE1047 2HG1 ILE1047 3.967 -19.941 2.931 1082 1HG2 ILE1047 1HG2 ILE1047 4.196 -20.838 7.041 1083 2HG2 ILE1047 2HG2 ILE1047 4.854 -21.862 5.742 1084 3HG2 ILE1047 3HG2 ILE1047 5.568 -20.264 6.064 1085 1HD1 ILE1047 1HD1 ILE1047 4.922 -17.659 4.706 1086 2HD1 ILE1047 2HD1 ILE1047 4.620 -17.631 2.952 1087 3HD1 ILE1047 3HD1 ILE1047 3.256 -17.755 4.088 1088 H SER1048 H SER1048 1.214 -20.715 6.694 1089 HA SER1048 HA SER1048 1.631 -23.383 7.746 1090 1HB SER1048 1HB SER1048 1.475 -20.748 8.900 1091 2HB SER1048 2HB SER1048 0.157 -21.697 9.560 1092 HG SER1048 HG SER1048 1.905 -22.111 10.895 1093 H GLN1049 H GLN1049 0.105 -24.458 6.298 1094 HA GLN1049 HA GLN1049 -2.520 -24.412 7.349 1095 1HB GLN1049 1HB GLN1049 -1.977 -22.744 5.059 1096 2HB GLN1049 2HB GLN1049 -2.981 -24.079 4.529 1097 1HG GLN1049 1HG GLN1049 -3.590 -22.263 6.910 1098 2HG GLN1049 2HG GLN1049 -4.338 -22.136 5.331 1099 1HE2 GLN1049 1HE2 GLN1049 -4.153 -23.864 8.313 1100 2HE2 GLN1049 2HE2 GLN1049 -5.494 -24.936 8.084 1101 H SER1050 H SER1050 -2.048 -26.626 7.779 1102 HA SER1050 HA SER1050 -1.649 -28.738 7.358 1103 1HB SER1050 1HB SER1050 -4.044 -28.416 6.649 1104 2HB SER1050 2HB SER1050 -3.506 -28.224 4.993 1105 HG SER1050 HG SER1050 -2.360 -30.477 5.718 1106 H ARG1051 H ARG1051 0.622 -28.621 6.808 1107 HA ARG1051 HA ARG1051 1.444 -28.039 4.209 1108 1HB ARG1051 1HB ARG1051 2.851 -27.922 6.343 1109 2HB ARG1051 2HB ARG1051 2.940 -29.672 6.319 1110 1HG ARG1051 1HG ARG1051 4.895 -29.170 5.162 1111 2HG ARG1051 2HG ARG1051 3.783 -29.296 3.814 1112 1HD ARG1051 1HD ARG1051 3.499 -26.864 3.726 1113 2HD ARG1051 2HD ARG1051 4.391 -26.654 5.220 1114 HE ARG1051 HE ARG1051 6.035 -28.063 3.328 1115 1HH1 ARG1051 2HH2 ARG1051 4.726 -24.858 3.956 1116 2HH1 ARG1051 1HH2 ARG1051 6.012 -24.033 3.141 1117 1HH2 ARG1051 2HH1 ARG1051 7.733 -26.976 2.252 1118 2HH2 ARG1051 1HH1 ARG1051 7.734 -25.246 2.165 1119 HA PRO1052 HA PRO1052 0.543 -32.004 2.529 1120 1HB PRO1052 1HB PRO1052 1.301 -31.495 -0.047 1121 2HB PRO1052 2HB PRO1052 -0.283 -31.091 0.583 1122 1HG PRO1052 1HG PRO1052 1.996 -29.298 0.010 1123 2HG PRO1052 2HG PRO1052 0.305 -28.890 0.226 1124 1HD PRO1052 1HD PRO1052 2.417 -28.519 2.131 1125 2HD PRO1052 2HD PRO1052 0.709 -28.220 2.387 1126 H HIS1053 H HIS1053 3.423 -30.736 0.923 1127 HA HIS1053 HA HIS1053 4.644 -33.292 1.112 1128 1HB HIS1053 1HB HIS1053 5.070 -30.803 -0.273 1129 2HB HIS1053 2HB HIS1053 6.570 -31.303 0.484 1130 HD1 HIS1053 HD1 HIS1053 7.213 -31.560 -2.194 1131 HD2 HIS1053 HD2 HIS1053 4.628 -34.420 -0.541 1132 HE1 HIS1053 HE1 HIS1053 7.244 -33.556 -3.784 Start of MODEL 5 1 H MET 915 H MET 915 11.303 -21.784 2.305 2 HA MET 915 HA MET 915 10.154 -19.705 1.631 3 1HB MET 915 1HB MET 915 12.554 -18.558 2.156 4 2HB MET 915 2HB MET 915 12.829 -18.890 0.458 5 1HG MET 915 1HG MET 915 11.838 -16.807 0.232 6 2HG MET 915 2HG MET 915 10.380 -17.779 0.213 7 1HE MET 915 1HE MET 915 8.673 -17.075 1.061 8 2HE MET 915 2HE MET 915 8.544 -17.665 2.736 9 3HE MET 915 3HE MET 915 8.399 -15.924 2.391 10 H ALA 916 H ALA 916 9.257 -19.824 -0.452 11 HA ALA 916 HA ALA 916 10.450 -21.884 -2.143 12 1HB ALA 916 1HB ALA 916 8.188 -22.362 -1.657 13 2HB ALA 916 2HB ALA 916 7.693 -20.664 -1.853 14 3HB ALA 916 3HB ALA 916 8.134 -21.632 -3.279 15 H ASN 917 H ASN 917 9.472 -21.208 -4.639 16 HA ASN 917 HA ASN 917 11.221 -19.036 -5.249 17 1HB ASN 917 1HB ASN 917 10.001 -21.307 -6.658 18 2HB ASN 917 2HB ASN 917 9.820 -19.839 -7.598 19 1HD2 ASN 917 1HD2 ASN 917 11.284 -20.024 -9.142 20 2HD2 ASN 917 2HD2 ASN 917 12.986 -20.256 -8.925 21 H LEU 918 H LEU 918 10.423 -16.929 -5.200 22 HA LEU 918 HA LEU 918 7.631 -16.557 -6.036 23 1HB LEU 918 1HB LEU 918 9.124 -15.502 -3.676 24 2HB LEU 918 2HB LEU 918 7.927 -14.472 -4.436 25 HG LEU 918 HG LEU 918 6.922 -17.179 -3.939 26 1HD1 LEU 918 1HD1 LEU 918 8.126 -17.388 -1.995 27 2HD1 LEU 918 2HD1 LEU 918 8.175 -15.633 -1.700 28 3HD1 LEU 918 3HD1 LEU 918 6.675 -16.544 -1.401 29 1HD2 LEU 918 1HD2 LEU 918 5.919 -14.478 -3.003 30 2HD2 LEU 918 2HD2 LEU 918 5.565 -15.197 -4.592 31 3HD2 LEU 918 3HD2 LEU 918 5.001 -16.000 -3.107 32 H ASP 919 H ASP 919 7.667 -15.678 -8.035 33 HA ASP 919 HA ASP 919 9.838 -14.523 -9.185 34 1HB ASP 919 1HB ASP 919 6.959 -14.737 -9.718 35 2HB ASP 919 2HB ASP 919 7.589 -13.213 -10.312 36 H ARG 920 H ARG 920 9.196 -11.994 -10.219 37 HA ARG 920 HA ARG 920 9.506 -10.397 -7.860 38 1HB ARG 920 1HB ARG 920 10.142 -10.159 -10.748 39 2HB ARG 920 2HB ARG 920 9.547 -8.661 -10.061 40 1HG ARG 920 1HG ARG 920 11.386 -8.391 -8.682 41 2HG ARG 920 2HG ARG 920 11.566 -10.111 -8.399 42 1HD ARG 920 1HD ARG 920 12.087 -9.723 -11.182 43 2HD ARG 920 2HD ARG 920 12.930 -8.430 -10.353 44 HE ARG 920 HE ARG 920 13.290 -11.087 -9.135 45 1HH1 ARG 920 2HH2 ARG 920 14.564 -8.733 -11.457 46 2HH1 ARG 920 1HH2 ARG 920 16.162 -9.401 -11.446 47 1HH2 ARG 920 1HH1 ARG 920 16.630 -11.302 -10.064 48 H SER 921 H SER 921 6.879 -11.566 -8.225 49 HA SER 921 HA SER 921 5.250 -9.496 -9.347 50 1HB SER 921 1HB SER 921 3.367 -11.005 -8.774 51 2HB SER 921 2HB SER 921 4.611 -11.846 -9.677 52 HG SER 921 HG SER 921 5.201 -13.009 -7.905 53 H ASN 922 H ASN 922 5.556 -11.159 -6.118 54 HA ASN 922 HA ASN 922 3.935 -9.336 -4.805 55 1HB ASN 922 1HB ASN 922 4.761 -10.385 -2.754 56 2HB ASN 922 2HB ASN 922 4.609 -11.640 -3.968 57 1HD2 ASN 922 1HD2 ASN 922 6.448 -12.460 -5.004 58 2HD2 ASN 922 2HD2 ASN 922 8.034 -12.333 -4.318 59 H ASP 923 H ASP 923 7.218 -9.202 -5.980 60 HA ASP 923 HA ASP 923 8.225 -7.429 -4.038 61 1HB ASP 923 1HB ASP 923 9.604 -8.909 -5.563 62 2HB ASP 923 2HB ASP 923 9.143 -7.893 -6.915 63 H LYS 924 H LYS 924 6.580 -7.202 -7.224 64 HA LYS 924 HA LYS 924 7.085 -4.494 -7.714 65 1HB LYS 924 1HB LYS 924 6.377 -5.986 -9.472 66 2HB LYS 924 2HB LYS 924 4.879 -6.352 -8.640 67 1HG LYS 924 1HG LYS 924 3.937 -4.638 -9.793 68 2HG LYS 924 2HG LYS 924 4.861 -3.548 -8.779 69 1HD LYS 924 1HD LYS 924 6.097 -2.892 -10.561 70 2HD LYS 924 2HD LYS 924 6.636 -4.539 -10.823 71 1HE LYS 924 1HE LYS 924 3.866 -4.209 -11.723 72 2HE LYS 924 2HE LYS 924 4.905 -3.023 -12.486 73 1HZ LYS 924 1HZ LYS 924 5.237 -5.936 -12.507 74 2HZ LYS 924 2HZ LYS 924 4.977 -4.951 -13.784 75 3HZ LYS 924 3HZ LYS 924 6.411 -4.915 -13.003 76 H VAL 925 H VAL 925 4.199 -6.149 -6.252 77 HA VAL 925 HA VAL 925 2.822 -3.815 -5.659 78 HB VAL 925 HB VAL 925 2.773 -6.383 -4.074 79 1HG1 VAL 925 1HG1 VAL 925 1.453 -4.270 -3.373 80 2HG1 VAL 925 2HG1 VAL 925 0.424 -4.625 -4.781 81 3HG1 VAL 925 3HG1 VAL 925 0.583 -5.820 -3.470 82 1HG2 VAL 925 1HG2 VAL 925 2.331 -6.049 -6.884 83 2HG2 VAL 925 2HG2 VAL 925 2.138 -7.511 -5.887 84 3HG2 VAL 925 3HG2 VAL 925 0.770 -6.391 -6.100 85 H TYR 926 H TYR 926 5.251 -5.696 -3.757 86 HA TYR 926 HA TYR 926 5.058 -4.106 -1.449 87 1HB TYR 926 1HB TYR 926 7.071 -5.972 -2.803 88 2HB TYR 926 2HB TYR 926 7.545 -5.148 -1.331 89 HD1 TYR 926 HD1 TYR 926 7.708 -6.894 0.235 90 HD2 TYR 926 HD2 TYR 926 4.194 -6.568 -2.183 91 HE1 TYR 926 HE1 TYR 926 6.585 -8.713 1.610 92 HE2 TYR 926 HE2 TYR 926 3.082 -8.389 -0.799 93 HH TYR 926 HH TYR 926 4.011 -9.254 2.117 94 H GLU 927 H GLU 927 6.780 -3.724 -4.535 95 HA GLU 927 HA GLU 927 8.604 -1.824 -3.534 96 1HB GLU 927 1HB GLU 927 7.800 -2.869 -6.233 97 2HB GLU 927 2HB GLU 927 8.629 -1.326 -6.192 98 1HG GLU 927 1HG GLU 927 9.798 -3.527 -4.511 99 2HG GLU 927 2HG GLU 927 9.945 -3.703 -6.249 100 H ASN 928 H ASN 928 5.804 -1.474 -5.842 101 HA ASN 928 HA ASN 928 5.706 1.173 -6.009 102 1HB ASN 928 1HB ASN 928 3.207 -0.531 -5.540 103 2HB ASN 928 2HB ASN 928 3.298 0.952 -6.469 104 1HD2 ASN 928 1HD2 ASN 928 5.128 0.886 -8.188 105 2HD2 ASN 928 2HD2 ASN 928 5.149 -0.509 -9.215 106 H VAL 929 H VAL 929 4.135 -0.884 -3.447 107 HA VAL 929 HA VAL 929 2.844 0.981 -1.987 108 HB VAL 929 HB VAL 929 4.348 -1.514 -1.291 109 1HG1 VAL 929 1HG1 VAL 929 4.711 -0.475 0.747 110 2HG1 VAL 929 2HG1 VAL 929 3.224 0.498 0.640 111 3HG1 VAL 929 3HG1 VAL 929 3.125 -1.240 1.015 112 1HG2 VAL 929 1HG2 VAL 929 1.622 -1.533 -0.475 113 2HG2 VAL 929 2HG2 VAL 929 1.686 -0.820 -2.104 114 3HG2 VAL 929 3HG2 VAL 929 2.384 -2.431 -1.810 115 H THR 930 H THR 930 6.330 0.041 -1.550 116 HA THR 930 HA THR 930 6.795 2.164 0.287 117 HB THR 930 HB THR 930 9.144 1.354 0.076 118 HG1 THR 930 HG1 THR 930 9.329 -0.428 -1.609 119 1HG2 THR 930 1HG2 THR 930 8.512 -0.445 1.335 120 2HG2 THR 930 2HG2 THR 930 6.876 -0.391 0.637 121 3HG2 THR 930 3HG2 THR 930 8.159 -1.320 -0.174 122 H GLY 931 H GLY 931 6.707 1.910 -3.208 123 1HA GLY 931 1HA GLY 931 8.463 3.985 -3.882 124 2HA GLY 931 2HA GLY 931 7.105 3.413 -4.830 125 H LEU 932 H LEU 932 4.866 4.219 -4.183 126 HA LEU 932 HA LEU 932 4.781 6.955 -4.201 127 1HB LEU 932 1HB LEU 932 2.524 6.733 -4.193 128 2HB LEU 932 2HB LEU 932 3.005 5.122 -4.689 129 HG LEU 932 HG LEU 932 1.194 5.006 -3.089 130 1HD1 LEU 932 1HD1 LEU 932 2.918 3.927 -1.152 131 2HD1 LEU 932 2HD1 LEU 932 2.130 3.081 -2.505 132 3HD1 LEU 932 3HD1 LEU 932 3.766 3.752 -2.708 133 1HD2 LEU 932 1HD2 LEU 932 0.983 6.294 -1.286 134 2HD2 LEU 932 2HD2 LEU 932 2.619 5.895 -0.709 135 3HD2 LEU 932 3HD2 LEU 932 2.387 7.207 -1.890 136 H VAL 933 H VAL 933 4.798 4.685 -1.418 137 HA VAL 933 HA VAL 933 4.198 6.572 0.546 138 HB VAL 933 HB VAL 933 5.487 3.885 0.419 139 1HG1 VAL 933 1HG1 VAL 933 6.921 4.581 2.071 140 2HG1 VAL 933 2HG1 VAL 933 5.815 5.848 2.655 141 3HG1 VAL 933 3HG1 VAL 933 5.510 4.143 3.065 142 1HG2 VAL 933 1HG2 VAL 933 2.910 5.007 1.051 143 2HG2 VAL 933 2HG2 VAL 933 3.381 3.301 0.858 144 3HG2 VAL 933 3HG2 VAL 933 3.522 4.089 2.448 145 H LYS 934 H LYS 934 7.429 5.260 -0.495 146 HA LYS 934 HA LYS 934 9.046 6.758 1.041 147 1HB LYS 934 1HB LYS 934 9.259 5.629 -1.712 148 2HB LYS 934 2HB LYS 934 10.494 6.769 -1.218 149 1HG LYS 934 1HG LYS 934 10.803 5.388 0.910 150 2HG LYS 934 2HG LYS 934 9.709 4.199 0.232 151 1HD LYS 934 1HD LYS 934 11.628 3.277 -0.622 152 2HD LYS 934 2HD LYS 934 11.428 4.484 -1.877 153 1HE LYS 934 1HE LYS 934 12.802 5.558 0.511 154 2HE LYS 934 2HE LYS 934 13.660 4.208 -0.204 155 1HZ LYS 934 1HZ LYS 934 13.610 5.328 -2.305 156 2HZ LYS 934 2HZ LYS 934 12.728 6.560 -1.698 157 3HZ LYS 934 3HZ LYS 934 14.261 6.325 -1.187 158 H ALA 935 H ALA 935 7.128 7.841 -1.770 159 HA ALA 935 HA ALA 935 8.387 10.425 -1.790 160 1HB ALA 935 1HB ALA 935 7.257 8.996 -3.723 161 2HB ALA 935 2HB ALA 935 5.779 9.809 -3.155 162 3HB ALA 935 3HB ALA 935 7.162 10.773 -3.728 163 H VAL 936 H VAL 936 5.227 8.981 -0.770 164 HA VAL 936 HA VAL 936 3.805 11.122 -0.069 165 HB VAL 936 HB VAL 936 4.215 8.445 1.197 166 1HG1 VAL 936 1HG1 VAL 936 2.358 10.582 2.298 167 2HG1 VAL 936 2HG1 VAL 936 2.401 8.875 2.800 168 3HG1 VAL 936 3HG1 VAL 936 3.803 9.929 3.106 169 1HG2 VAL 936 1HG2 VAL 936 2.092 7.947 0.314 170 2HG2 VAL 936 2HG2 VAL 936 1.664 9.665 0.129 171 3HG2 VAL 936 3HG2 VAL 936 2.876 8.929 -0.946 172 H ILE 937 H ILE 937 6.665 9.827 1.684 173 HA ILE 937 HA ILE 937 6.395 11.827 3.739 174 HB ILE 937 HB ILE 937 8.238 9.539 3.173 175 1HG1 ILE 937 1HG1 ILE 937 7.201 9.906 5.876 176 2HG1 ILE 937 2HG1 ILE 937 5.916 9.876 4.685 177 1HG2 ILE 937 1HG2 ILE 937 8.876 11.977 4.755 178 2HG2 ILE 937 2HG2 ILE 937 9.290 10.402 5.474 179 3HG2 ILE 937 3HG2 ILE 937 9.946 10.854 3.882 180 1HD1 ILE 937 1HD1 ILE 937 6.520 7.591 5.549 181 2HD1 ILE 937 2HD1 ILE 937 6.711 7.739 3.785 182 3HD1 ILE 937 3HD1 ILE 937 8.142 7.792 4.842 183 H GLU 938 H GLU 938 9.096 10.975 1.457 184 HA GLU 938 HA GLU 938 10.610 13.105 1.709 185 1HB GLU 938 1HB GLU 938 10.305 11.095 -0.208 186 2HB GLU 938 2HB GLU 938 10.146 12.560 -1.155 187 1HG GLU 938 1HG GLU 938 12.413 12.691 -1.144 188 2HG GLU 938 2HG GLU 938 12.300 13.139 0.546 189 H MET 939 H MET 939 7.588 12.995 -0.280 190 HA MET 939 HA MET 939 7.682 15.382 -1.477 191 1HB MET 939 1HB MET 939 5.397 13.866 -0.133 192 2HB MET 939 2HB MET 939 5.076 15.357 -0.996 193 1HG MET 939 1HG MET 939 6.013 14.417 -3.075 194 2HG MET 939 2HG MET 939 6.518 12.964 -2.235 195 1HE MET 939 1HE MET 939 3.541 15.322 -2.433 196 2HE MET 939 2HE MET 939 2.115 14.258 -2.497 197 3HE MET 939 3HE MET 939 3.029 14.431 -0.980 198 H SER 940 H SER 940 6.189 14.836 1.803 199 HA SER 940 HA SER 940 5.574 17.380 2.385 200 1HB SER 940 1HB SER 940 5.865 16.737 4.791 201 2HB SER 940 2HB SER 940 4.987 15.538 3.861 202 HG SER 940 HG SER 940 7.778 15.440 4.627 203 H SER 941 H SER 941 8.791 15.787 2.554 204 HA SER 941 HA SER 941 10.097 17.768 3.953 205 1HB SER 941 1HB SER 941 10.852 15.367 3.188 206 2HB SER 941 2HB SER 941 11.428 16.175 1.743 207 HG SER 941 HG SER 941 12.542 17.692 3.380 208 H LYS 942 H LYS 942 10.208 17.145 0.360 209 HA LYS 942 HA LYS 942 11.076 19.882 -0.034 210 1HB LYS 942 1HB LYS 942 11.751 19.217 -2.165 211 2HB LYS 942 2HB LYS 942 12.089 17.818 -1.166 212 1HG LYS 942 1HG LYS 942 10.765 16.554 -2.499 213 2HG LYS 942 2HG LYS 942 9.382 17.527 -2.040 214 1HD LYS 942 1HD LYS 942 10.624 19.193 -3.872 215 2HD LYS 942 2HD LYS 942 11.016 17.616 -4.527 216 1HE LYS 942 1HE LYS 942 8.648 16.983 -4.604 217 2HE LYS 942 2HE LYS 942 8.181 18.434 -3.739 218 1HZ LYS 942 1HZ LYS 942 9.589 19.366 -5.840 219 2HZ LYS 942 2HZ LYS 942 8.775 18.108 -6.491 220 3HZ LYS 942 3HZ LYS 942 7.960 19.308 -5.742 221 H ILE 943 H ILE 943 8.371 19.330 1.048 222 HA ILE 943 HA ILE 943 6.676 20.005 -1.222 223 HB ILE 943 HB ILE 943 6.347 18.666 1.331 224 1HG1 ILE 943 1HG1 ILE 943 5.843 18.011 -1.181 225 2HG1 ILE 943 2HG1 ILE 943 4.905 17.358 0.147 226 1HG2 ILE 943 1HG2 ILE 943 3.972 19.520 1.640 227 2HG2 ILE 943 2HG2 ILE 943 5.286 20.592 2.182 228 3HG2 ILE 943 3HG2 ILE 943 4.452 20.915 0.643 229 1HD1 ILE 943 1HD1 ILE 943 3.667 18.409 -1.938 230 2HD1 ILE 943 2HD1 ILE 943 3.045 18.723 -0.300 231 3HD1 ILE 943 3HD1 ILE 943 4.025 19.955 -1.131 232 H GLN 944 H GLN 944 7.288 21.211 2.157 233 HA GLN 944 HA GLN 944 5.964 23.511 2.045 234 1HB GLN 944 1HB GLN 944 8.269 22.483 3.516 235 2HB GLN 944 2HB GLN 944 8.412 24.214 3.289 236 1HG GLN 944 1HG GLN 944 5.762 24.045 3.987 237 2HG GLN 944 2HG GLN 944 6.394 22.664 4.862 238 1HE2 GLN 944 1HE2 GLN 944 8.239 22.984 6.266 239 2HE2 GLN 944 2HE2 GLN 944 8.450 24.488 7.099 240 HA PRO 945 HA PRO 945 9.561 25.560 -0.284 241 1HB PRO 945 1HB PRO 945 11.506 24.003 -1.407 242 2HB PRO 945 2HB PRO 945 11.680 24.774 0.157 243 1HG PRO 945 1HG PRO 945 11.163 21.930 -0.460 244 2HG PRO 945 2HG PRO 945 11.754 22.641 1.029 245 1HD PRO 945 1HD PRO 945 9.095 21.693 0.516 246 2HD PRO 945 2HD PRO 945 9.656 22.509 1.962 247 H ALA 946 H ALA 946 8.919 22.389 -1.680 248 HA ALA 946 HA ALA 946 8.986 22.899 -4.292 249 1HB ALA 946 1HB ALA 946 7.249 21.250 -2.518 250 2HB ALA 946 2HB ALA 946 6.677 21.477 -4.188 251 3HB ALA 946 3HB ALA 946 8.279 20.763 -3.885 252 HA PRO 947 HA PRO 947 6.264 26.264 -4.836 253 1HB PRO 947 1HB PRO 947 6.666 26.625 -7.515 254 2HB PRO 947 2HB PRO 947 7.714 27.308 -6.288 255 1HG PRO 947 1HG PRO 947 8.200 24.994 -8.064 256 2HG PRO 947 2HG PRO 947 9.359 25.942 -7.154 257 1HD PRO 947 1HD PRO 947 8.379 23.330 -6.489 258 2HD PRO 947 2HD PRO 947 9.449 24.326 -5.521 259 HA PRO 948 HA PRO 948 2.605 24.851 -6.475 260 1HB PRO 948 1HB PRO 948 1.504 26.931 -7.866 261 2HB PRO 948 2HB PRO 948 1.456 26.814 -6.118 262 1HG PRO 948 1HG PRO 948 3.142 28.552 -7.814 263 2HG PRO 948 2HG PRO 948 2.768 28.711 -6.109 264 1HD PRO 948 1HD PRO 948 5.219 27.747 -7.247 265 2HD PRO 948 2HD PRO 948 4.801 27.797 -5.545 266 H GLU 949 H GLU 949 5.027 25.744 -8.624 267 HA GLU 949 HA GLU 949 3.554 24.694 -10.868 268 1HB GLU 949 1HB GLU 949 5.795 26.500 -10.490 269 2HB GLU 949 2HB GLU 949 6.271 25.212 -11.579 270 1HG GLU 949 1HG GLU 949 3.986 25.663 -12.786 271 2HG GLU 949 2HG GLU 949 3.962 27.166 -11.885 272 H GLU 950 H GLU 950 5.927 23.736 -8.458 273 HA GLU 950 HA GLU 950 6.513 21.353 -10.022 274 1HB GLU 950 1HB GLU 950 8.177 23.071 -8.523 275 2HB GLU 950 2HB GLU 950 8.031 21.635 -7.530 276 1HG GLU 950 1HG GLU 950 9.553 20.617 -8.864 277 2HG GLU 950 2HG GLU 950 8.379 20.650 -10.165 278 H TYR 951 H TYR 951 4.513 22.543 -7.536 279 HA TYR 951 HA TYR 951 4.477 20.057 -6.034 280 1HB TYR 951 1HB TYR 951 4.316 22.225 -4.850 281 2HB TYR 951 2HB TYR 951 3.093 22.801 -5.965 282 HD1 TYR 951 HD1 TYR 951 0.770 21.824 -5.875 283 HD2 TYR 951 HD2 TYR 951 3.731 20.952 -2.912 284 HE1 TYR 951 HE1 TYR 951 -1.045 21.018 -4.288 285 HE2 TYR 951 HE2 TYR 951 1.905 20.149 -1.335 286 HH TYR 951 HH TYR 951 -0.734 20.783 -1.167 287 H VAL 952 H VAL 952 2.436 21.981 -8.296 288 HA VAL 952 HA VAL 952 0.071 20.668 -8.086 289 HB VAL 952 HB VAL 952 1.527 22.181 -10.135 290 1HG1 VAL 952 1HG1 VAL 952 0.980 20.248 -11.515 291 2HG1 VAL 952 2HG1 VAL 952 -0.715 20.309 -10.972 292 3HG1 VAL 952 3HG1 VAL 952 -0.049 21.630 -11.963 293 1HG2 VAL 952 1HG2 VAL 952 -0.180 23.642 -9.865 294 2HG2 VAL 952 2HG2 VAL 952 -1.419 22.365 -9.877 295 3HG2 VAL 952 3HG2 VAL 952 -0.495 22.694 -8.392 296 HA PRO 953 HA PRO 953 1.810 17.268 -10.884 297 1HB PRO 953 1HB PRO 953 4.500 17.126 -11.343 298 2HB PRO 953 2HB PRO 953 3.378 17.891 -12.451 299 1HG PRO 953 1HG PRO 953 5.292 19.154 -10.586 300 2HG PRO 953 2HG PRO 953 4.486 19.856 -11.975 301 1HD PRO 953 1HD PRO 953 3.820 20.266 -9.216 302 2HD PRO 953 2HD PRO 953 2.944 20.874 -10.607 303 H MET 954 H MET 954 4.269 18.098 -8.494 304 HA MET 954 HA MET 954 5.128 15.761 -7.707 305 1HB MET 954 1HB MET 954 5.081 18.270 -6.611 306 2HB MET 954 2HB MET 954 4.004 17.470 -5.483 307 1HG MET 954 1HG MET 954 6.057 15.617 -5.664 308 2HG MET 954 2HG MET 954 6.938 17.118 -5.869 309 1HE MET 954 1HE MET 954 6.500 19.189 -3.011 310 2HE MET 954 2HE MET 954 6.020 19.155 -4.725 311 3HE MET 954 3HE MET 954 4.779 19.082 -3.452 312 H VAL 955 H VAL 955 1.960 17.120 -6.543 313 HA VAL 955 HA VAL 955 1.265 14.799 -5.115 314 HB VAL 955 HB VAL 955 -0.248 17.181 -6.169 315 1HG1 VAL 955 1HG1 VAL 955 -1.334 14.636 -5.250 316 2HG1 VAL 955 2HG1 VAL 955 -1.861 15.994 -4.227 317 3HG1 VAL 955 3HG1 VAL 955 -2.159 16.033 -5.982 318 1HG2 VAL 955 1HG2 VAL 955 1.460 17.164 -4.158 319 2HG2 VAL 955 2HG2 VAL 955 -0.074 18.060 -4.043 320 3HG2 VAL 955 3HG2 VAL 955 0.083 16.462 -3.274 321 H LYS 956 H LYS 956 0.242 16.070 -8.361 322 HA LYS 956 HA LYS 956 -1.472 14.126 -9.103 323 1HB LYS 956 1HB LYS 956 0.533 15.765 -10.631 324 2HB LYS 956 2HB LYS 956 -0.412 14.550 -11.467 325 1HG LYS 956 1HG LYS 956 -1.886 16.420 -9.621 326 2HG LYS 956 2HG LYS 956 -1.297 17.081 -11.134 327 1HD LYS 956 1HD LYS 956 -3.144 16.216 -12.129 328 2HD LYS 956 2HD LYS 956 -2.442 14.627 -11.897 329 1HE LYS 956 1HE LYS 956 -4.155 14.115 -10.502 330 2HE LYS 956 2HE LYS 956 -3.559 15.317 -9.374 331 1HZ LYS 956 1HZ LYS 956 -5.843 15.703 -10.075 332 2HZ LYS 956 2HZ LYS 956 -4.877 16.962 -10.462 333 3HZ LYS 956 3HZ LYS 956 -5.358 15.915 -11.620 334 H GLU 957 H GLU 957 2.107 13.938 -8.959 335 HA GLU 957 HA GLU 957 2.370 11.558 -10.318 336 1HB GLU 957 1HB GLU 957 4.001 13.229 -8.520 337 2HB GLU 957 2HB GLU 957 4.387 11.526 -8.374 338 1HG GLU 957 1HG GLU 957 5.743 11.973 -10.181 339 2HG GLU 957 2HG GLU 957 4.270 11.679 -11.082 340 H VAL 958 H VAL 958 2.352 12.078 -6.710 341 HA VAL 958 HA VAL 958 2.403 9.548 -5.845 342 HB VAL 958 HB VAL 958 1.931 11.968 -4.750 343 1HG1 VAL 958 1HG1 VAL 958 -0.198 12.060 -3.655 344 2HG1 VAL 958 2HG1 VAL 958 -0.500 11.798 -5.389 345 3HG1 VAL 958 3HG1 VAL 958 -0.640 10.441 -4.247 346 1HG2 VAL 958 1HG2 VAL 958 1.538 10.642 -2.573 347 2HG2 VAL 958 2HG2 VAL 958 1.660 9.190 -3.596 348 3HG2 VAL 958 3HG2 VAL 958 3.031 10.321 -3.489 349 H GLY 959 H GLY 959 -0.403 11.236 -7.329 350 1HA GLY 959 1HA GLY 959 -2.367 9.332 -6.812 351 2HA GLY 959 2HA GLY 959 -2.337 10.452 -8.159 352 H LEU 960 H LEU 960 -0.150 9.686 -9.675 353 HA LEU 960 HA LEU 960 -1.118 7.565 -11.128 354 1HB LEU 960 1HB LEU 960 0.883 9.427 -11.366 355 2HB LEU 960 2HB LEU 960 1.791 7.934 -11.239 356 HG LEU 960 HG LEU 960 -0.374 8.531 -13.274 357 1HD1 LEU 960 1HD1 LEU 960 1.972 9.660 -13.407 358 2HD1 LEU 960 2HD1 LEU 960 2.516 8.047 -13.927 359 3HD1 LEU 960 3HD1 LEU 960 1.266 8.906 -14.857 360 1HD2 LEU 960 1HD2 LEU 960 -0.081 6.412 -14.200 361 2HD2 LEU 960 2HD2 LEU 960 1.441 6.128 -13.321 362 3HD2 LEU 960 3HD2 LEU 960 -0.109 6.105 -12.447 363 H ALA 961 H ALA 961 1.477 7.599 -8.600 364 HA ALA 961 HA ALA 961 2.206 4.961 -8.755 365 1HB ALA 961 1HB ALA 961 1.946 6.259 -6.063 366 2HB ALA 961 2HB ALA 961 3.319 5.380 -6.778 367 3HB ALA 961 3HB ALA 961 2.975 7.053 -7.279 368 H LEU 962 H LEU 962 -0.381 6.444 -6.674 369 HA LEU 962 HA LEU 962 -1.256 4.072 -5.555 370 1HB LEU 962 1HB LEU 962 -2.758 6.619 -6.170 371 2HB LEU 962 2HB LEU 962 -3.366 5.327 -5.154 372 HG LEU 962 HG LEU 962 -0.702 6.340 -4.377 373 1HD1 LEU 962 1HD1 LEU 962 -2.342 8.247 -3.203 374 2HD1 LEU 962 2HD1 LEU 962 -1.163 8.514 -4.510 375 3HD1 LEU 962 3HD1 LEU 962 -2.873 8.210 -4.901 376 1HD2 LEU 962 1HD2 LEU 962 -2.659 6.474 -2.306 377 2HD2 LEU 962 2HD2 LEU 962 -2.903 4.962 -3.213 378 3HD2 LEU 962 3HD2 LEU 962 -1.312 5.327 -2.504 379 H ARG 963 H ARG 963 -2.347 5.771 -8.563 380 HA ARG 963 HA ARG 963 -4.386 4.154 -9.226 381 1HB ARG 963 1HB ARG 963 -2.276 5.358 -11.089 382 2HB ARG 963 2HB ARG 963 -3.825 4.745 -11.631 383 1HG ARG 963 1HG ARG 963 -3.943 6.712 -9.380 384 2HG ARG 963 2HG ARG 963 -3.383 7.355 -10.910 385 1HD ARG 963 1HD ARG 963 -5.564 5.822 -11.709 386 2HD ARG 963 2HD ARG 963 -6.092 6.404 -10.143 387 HE ARG 963 HE ARG 963 -6.214 8.580 -11.009 388 1HH1 ARG 963 2HH2 ARG 963 -4.338 6.560 -13.196 389 2HH1 ARG 963 1HH2 ARG 963 -4.259 7.761 -14.441 390 1HH2 ARG 963 2HH1 ARG 963 -6.110 10.165 -12.652 391 2HH2 ARG 963 1HH1 ARG 963 -5.273 9.825 -14.130 392 H THR 964 H THR 964 -0.887 3.724 -10.136 393 HA THR 964 HA THR 964 -1.261 1.281 -11.471 394 HB THR 964 HB THR 964 1.107 2.708 -10.172 395 HG1 THR 964 HG1 THR 964 1.406 3.201 -12.416 396 1HG2 THR 964 1HG2 THR 964 1.071 0.185 -11.912 397 2HG2 THR 964 2HG2 THR 964 2.523 1.153 -11.564 398 3HG2 THR 964 3HG2 THR 964 1.688 0.295 -10.246 399 H LEU 965 H LEU 965 -0.546 2.075 -8.037 400 HA LEU 965 HA LEU 965 0.048 -0.454 -7.158 401 1HB LEU 965 1HB LEU 965 0.184 1.725 -5.923 402 2HB LEU 965 2HB LEU 965 -1.546 1.627 -5.661 403 HG LEU 965 HG LEU 965 0.253 0.775 -3.879 404 1HD1 LEU 965 1HD1 LEU 965 -1.811 0.728 -2.987 405 2HD1 LEU 965 2HD1 LEU 965 -2.555 0.066 -4.463 406 3HD1 LEU 965 3HD1 LEU 965 -1.709 -1.016 -3.331 407 1HD2 LEU 965 1HD2 LEU 965 -0.351 -1.734 -5.467 408 2HD2 LEU 965 2HD2 LEU 965 1.220 -0.900 -5.411 409 3HD2 LEU 965 3HD2 LEU 965 0.546 -1.629 -3.933 410 H LEU 966 H LEU 966 -3.201 1.121 -7.483 411 HA LEU 966 HA LEU 966 -4.744 -0.882 -6.476 412 1HB LEU 966 1HB LEU 966 -5.132 1.185 -8.599 413 2HB LEU 966 2HB LEU 966 -6.370 -0.034 -8.370 414 HG LEU 966 HG LEU 966 -6.425 0.643 -5.917 415 1HD1 LEU 966 1HD1 LEU 966 -4.934 3.083 -6.916 416 2HD1 LEU 966 2HD1 LEU 966 -5.537 2.780 -5.269 417 3HD1 LEU 966 3HD1 LEU 966 -4.216 1.787 -5.929 418 1HD2 LEU 966 1HD2 LEU 966 -7.500 3.011 -6.725 419 2HD2 LEU 966 2HD2 LEU 966 -7.460 2.106 -8.258 420 3HD2 LEU 966 3HD2 LEU 966 -8.310 1.430 -6.847 421 H ALA 967 H ALA 967 -3.732 -0.510 -9.950 422 HA ALA 967 HA ALA 967 -4.819 -2.920 -10.795 423 1HB ALA 967 1HB ALA 967 -2.748 -0.981 -11.761 424 2HB ALA 967 2HB ALA 967 -2.811 -2.582 -12.538 425 3HB ALA 967 3HB ALA 967 -4.249 -1.533 -12.543 426 H THR 968 H THR 968 -1.519 -2.101 -9.551 427 HA THR 968 HA THR 968 -0.362 -4.590 -9.917 428 HB THR 968 HB THR 968 0.144 -2.695 -7.575 429 HG1 THR 968 HG1 THR 968 0.985 -2.619 -10.387 430 1HG2 THR 968 1HG2 THR 968 1.654 -4.818 -9.035 431 2HG2 THR 968 2HG2 THR 968 2.545 -3.294 -8.808 432 3HG2 THR 968 3HG2 THR 968 1.912 -4.174 -7.396 433 H VAL 969 H VAL 969 -2.364 -3.373 -7.176 434 HA VAL 969 HA VAL 969 -2.025 -5.554 -5.516 435 HB VAL 969 HB VAL 969 -4.523 -3.892 -5.884 436 1HG1 VAL 969 1HG1 VAL 969 -4.681 -4.275 -3.375 437 2HG1 VAL 969 2HG1 VAL 969 -4.981 -5.696 -4.405 438 3HG1 VAL 969 3HG1 VAL 969 -3.416 -5.512 -3.576 439 1HG2 VAL 969 1HG2 VAL 969 -3.359 -2.091 -5.280 440 2HG2 VAL 969 2HG2 VAL 969 -2.931 -2.898 -3.753 441 3HG2 VAL 969 3HG2 VAL 969 -1.868 -3.057 -5.172 442 H ASP 970 H ASP 970 -4.391 -4.994 -8.193 443 HA ASP 970 HA ASP 970 -5.954 -7.150 -7.874 444 1HB ASP 970 1HB ASP 970 -6.143 -5.383 -9.662 445 2HB ASP 970 2HB ASP 970 -4.814 -6.135 -10.521 446 H GLU 971 H GLU 971 -2.654 -6.920 -9.305 447 HA GLU 971 HA GLU 971 -2.641 -9.588 -10.220 448 1HB GLU 971 1HB GLU 971 -0.551 -7.422 -9.889 449 2HB GLU 971 2HB GLU 971 -0.057 -9.054 -10.293 450 1HG GLU 971 1HG GLU 971 -2.062 -8.761 -12.112 451 2HG GLU 971 2HG GLU 971 -1.612 -7.077 -11.933 452 H SER 972 H SER 972 -2.066 -7.994 -7.151 453 HA SER 972 HA SER 972 -0.481 -10.147 -6.138 454 1HB SER 972 1HB SER 972 -0.783 -7.466 -5.474 455 2HB SER 972 2HB SER 972 -1.680 -8.257 -4.193 456 HG SER 972 HG SER 972 0.930 -7.936 -4.273 457 H LEU 973 H LEU 973 -3.871 -9.092 -6.229 458 HA LEU 973 HA LEU 973 -5.043 -10.241 -4.128 459 1HB LEU 973 1HB LEU 973 -5.819 -9.333 -6.638 460 2HB LEU 973 2HB LEU 973 -6.430 -10.974 -6.578 461 HG LEU 973 HG LEU 973 -7.325 -8.567 -5.153 462 1HD1 LEU 973 1HD1 LEU 973 -9.318 -10.437 -4.988 463 2HD1 LEU 973 2HD1 LEU 973 -9.071 -9.308 -6.342 464 3HD1 LEU 973 3HD1 LEU 973 -8.432 -10.967 -6.438 465 1HD2 LEU 973 1HD2 LEU 973 -6.549 -9.397 -3.147 466 2HD2 LEU 973 2HD2 LEU 973 -8.181 -10.103 -3.221 467 3HD2 LEU 973 3HD2 LEU 973 -6.763 -11.095 -3.637 468 HA PRO 974 HA PRO 974 -4.646 -14.541 -6.045 469 1HB PRO 974 1HB PRO 974 -3.096 -14.925 -8.263 470 2HB PRO 974 2HB PRO 974 -4.832 -14.694 -8.335 471 1HG PRO 974 1HG PRO 974 -2.678 -12.787 -9.016 472 2HG PRO 974 2HG PRO 974 -4.370 -12.741 -9.471 473 1HD PRO 974 1HD PRO 974 -3.094 -11.159 -7.448 474 2HD PRO 974 2HD PRO 974 -4.805 -11.198 -7.824 475 H VAL 975 H VAL 975 -1.753 -12.605 -6.354 476 HA VAL 975 HA VAL 975 0.138 -14.495 -5.840 477 HB VAL 975 HB VAL 975 -0.096 -11.617 -4.958 478 1HG1 VAL 975 1HG1 VAL 975 1.649 -13.418 -3.822 479 2HG1 VAL 975 2HG1 VAL 975 2.616 -12.740 -5.154 480 3HG1 VAL 975 3HG1 VAL 975 1.904 -11.659 -3.932 481 1HG2 VAL 975 1HG2 VAL 975 1.695 -12.717 -7.122 482 2HG2 VAL 975 2HG2 VAL 975 -0.014 -12.344 -7.448 483 3HG2 VAL 975 3HG2 VAL 975 1.087 -11.060 -6.895 484 H LEU 976 H LEU 976 -2.247 -13.041 -3.622 485 HA LEU 976 HA LEU 976 -1.043 -14.559 -1.427 486 1HB LEU 976 1HB LEU 976 -3.225 -12.516 -1.150 487 2HB LEU 976 2HB LEU 976 -2.100 -13.100 0.060 488 HG LEU 976 HG LEU 976 -1.060 -11.146 -0.303 489 1HD1 LEU 976 1HD1 LEU 976 -0.015 -12.035 -2.949 490 2HD1 LEU 976 2HD1 LEU 976 0.843 -11.401 -1.525 491 3HD1 LEU 976 3HD1 LEU 976 0.273 -13.087 -1.542 492 1HD2 LEU 976 1HD2 LEU 976 -2.895 -11.019 -2.551 493 2HD2 LEU 976 2HD2 LEU 976 -2.251 -9.718 -1.521 494 3HD2 LEU 976 3HD2 LEU 976 -1.325 -10.274 -2.936 495 HA PRO 977 HA PRO 977 -4.319 -17.364 -1.552 496 1HB PRO 977 1HB PRO 977 -4.349 -18.292 1.018 497 2HB PRO 977 2HB PRO 977 -3.203 -18.845 -0.187 498 1HG PRO 977 1HG PRO 977 -2.761 -17.004 2.083 499 2HG PRO 977 2HG PRO 977 -1.578 -17.891 1.143 500 1HD PRO 977 1HD PRO 977 -2.195 -15.098 0.930 501 2HD PRO 977 2HD PRO 977 -1.097 -16.009 -0.087 502 H ALA 978 H ALA 978 -6.528 -17.646 -1.349 503 HA ALA 978 HA ALA 978 -7.949 -15.369 -0.753 504 1HB ALA 978 1HB ALA 978 -8.539 -17.645 -1.972 505 2HB ALA 978 2HB ALA 978 -9.167 -18.095 -0.369 506 3HB ALA 978 3HB ALA 978 -9.819 -16.669 -1.212 507 H SER 979 H SER 979 -8.047 -14.288 1.150 508 HA SER 979 HA SER 979 -9.240 -15.231 3.352 509 1HB SER 979 1HB SER 979 -7.211 -15.541 4.931 510 2HB SER 979 2HB SER 979 -7.622 -16.876 3.873 511 HG SER 979 HG SER 979 -5.981 -15.843 2.338 512 H THR 980 H THR 980 -6.684 -13.254 1.890 513 HA THR 980 HA THR 980 -7.230 -11.137 3.863 514 HB THR 980 HB THR 980 -4.869 -11.909 3.766 515 HG1 THR 980 HG1 THR 980 -5.423 -9.425 2.300 516 1HG2 THR 980 1HG2 THR 980 -4.596 -12.748 1.504 517 2HG2 THR 980 2HG2 THR 980 -5.194 -11.225 0.804 518 3HG2 THR 980 3HG2 THR 980 -3.605 -11.273 1.605 519 H HIS 981 H HIS 981 -8.296 -12.209 0.928 520 HA HIS 981 HA HIS 981 -8.066 -10.117 -0.798 521 1HB HIS 981 1HB HIS 981 -10.192 -12.177 -0.302 522 2HB HIS 981 2HB HIS 981 -10.490 -10.906 -1.470 523 HD1 HIS 981 HD1 HIS 981 -10.133 -11.896 -3.733 524 HD2 HIS 981 HD2 HIS 981 -7.195 -13.118 -1.000 525 HE1 HIS 981 HE1 HIS 981 -8.476 -13.318 -5.053 526 H ARG 982 H ARG 982 -11.079 -10.634 1.162 527 HA ARG 982 HA ARG 982 -12.246 -8.323 0.830 528 1HB ARG 982 1HB ARG 982 -12.190 -10.318 2.949 529 2HB ARG 982 2HB ARG 982 -12.391 -8.734 3.672 530 1HG ARG 982 1HG ARG 982 -14.490 -8.437 2.776 531 2HG ARG 982 2HG ARG 982 -14.058 -9.177 1.247 532 1HD ARG 982 1HD ARG 982 -14.765 -11.262 1.907 533 2HD ARG 982 2HD ARG 982 -14.079 -11.097 3.511 534 HE ARG 982 HE ARG 982 -16.813 -10.699 2.854 535 1HH1 ARG 982 2HH2 ARG 982 -14.277 -9.070 4.670 536 2HH1 ARG 982 1HH2 ARG 982 -15.377 -8.312 5.773 537 1HH2 ARG 982 2HH1 ARG 982 -18.264 -9.699 4.309 538 2HH2 ARG 982 1HH1 ARG 982 -17.660 -8.673 5.566 539 H GLU 983 H GLU 983 -10.035 -8.819 3.692 540 HA GLU 983 HA GLU 983 -9.900 -6.274 4.519 541 1HB GLU 983 1HB GLU 983 -7.847 -8.502 4.520 542 2HB GLU 983 2HB GLU 983 -7.451 -6.943 5.217 543 1HG GLU 983 1HG GLU 983 -9.462 -7.101 6.704 544 2HG GLU 983 2HG GLU 983 -9.849 -8.663 6.011 545 H ILE 984 H ILE 984 -7.987 -7.807 1.871 546 HA ILE 984 HA ILE 984 -6.320 -5.607 1.404 547 HB ILE 984 HB ILE 984 -7.048 -8.129 0.058 548 1HG1 ILE 984 1HG1 ILE 984 -4.339 -6.818 0.249 549 2HG1 ILE 984 2HG1 ILE 984 -5.067 -7.591 1.643 550 1HG2 ILE 984 1HG2 ILE 984 -6.045 -5.727 -1.473 551 2HG2 ILE 984 2HG2 ILE 984 -5.734 -7.399 -1.998 552 3HG2 ILE 984 3HG2 ILE 984 -7.407 -6.807 -1.856 553 1HD1 ILE 984 1HD1 ILE 984 -3.918 -8.809 -0.802 554 2HD1 ILE 984 2HD1 ILE 984 -4.110 -9.497 0.829 555 3HD1 ILE 984 3HD1 ILE 984 -5.478 -9.509 -0.309 556 H GLU 985 H GLU 985 -9.566 -6.540 0.160 557 HA GLU 985 HA GLU 985 -9.706 -4.579 -1.781 558 1HB GLU 985 1HB GLU 985 -11.535 -6.451 -0.439 559 2HB GLU 985 2HB GLU 985 -12.337 -4.954 -0.870 560 1HG GLU 985 1HG GLU 985 -12.591 -6.209 -2.839 561 2HG GLU 985 2HG GLU 985 -11.165 -5.260 -3.208 562 H MET 986 H MET 986 -10.662 -4.573 1.705 563 HA MET 986 HA MET 986 -11.723 -1.972 1.583 564 1HB MET 986 1HB MET 986 -10.988 -4.001 3.697 565 2HB MET 986 2HB MET 986 -11.163 -2.343 4.239 566 1HG MET 986 1HG MET 986 -13.434 -2.447 4.095 567 2HG MET 986 2HG MET 986 -13.369 -3.052 2.451 568 1HE MET 986 1HE MET 986 -13.735 -6.506 2.372 569 2HE MET 986 2HE MET 986 -15.223 -5.575 2.667 570 3HE MET 986 3HE MET 986 -13.904 -4.863 1.707 571 H ALA 987 H ALA 987 -8.489 -3.269 1.779 572 HA ALA 987 HA ALA 987 -7.325 -1.062 3.149 573 1HB ALA 987 1HB ALA 987 -6.407 -3.407 3.037 574 2HB ALA 987 2HB ALA 987 -6.022 -3.119 1.324 575 3HB ALA 987 3HB ALA 987 -5.234 -2.146 2.589 576 H GLN 988 H GLN 988 -8.226 -1.842 -0.192 577 HA GLN 988 HA GLN 988 -6.561 0.131 -1.331 578 1HB GLN 988 1HB GLN 988 -8.982 -1.376 -2.406 579 2HB GLN 988 2HB GLN 988 -8.013 -0.289 -3.380 580 1HG GLN 988 1HG GLN 988 -6.371 -2.246 -1.889 581 2HG GLN 988 2HG GLN 988 -7.515 -3.015 -2.972 582 1HE2 GLN 988 1HE2 GLN 988 -5.082 -0.443 -2.786 583 2HE2 GLN 988 2HE2 GLN 988 -4.503 -0.559 -4.415 584 H LYS 989 H LYS 989 -10.025 -0.066 -0.340 585 HA LYS 989 HA LYS 989 -10.754 2.441 -1.359 586 1HB LYS 989 1HB LYS 989 -12.207 0.447 -0.581 587 2HB LYS 989 2HB LYS 989 -12.034 1.113 1.030 588 1HG LYS 989 1HG LYS 989 -12.695 3.388 -0.371 589 2HG LYS 989 2HG LYS 989 -13.549 2.182 -1.313 590 1HD LYS 989 1HD LYS 989 -14.210 1.361 1.223 591 2HD LYS 989 2HD LYS 989 -14.023 3.082 1.500 592 1HE LYS 989 1HE LYS 989 -15.687 2.025 -0.821 593 2HE LYS 989 2HE LYS 989 -16.375 2.218 0.779 594 1HZ LYS 989 1HZ LYS 989 -15.213 4.311 -0.912 595 2HZ LYS 989 2HZ LYS 989 -16.752 4.197 -0.378 596 3HZ LYS 989 3HZ LYS 989 -15.549 4.549 0.668 597 H LEU 990 H LEU 990 -8.969 1.415 1.506 598 HA LEU 990 HA LEU 990 -9.397 3.821 2.958 599 1HB LEU 990 1HB LEU 990 -8.422 1.300 3.494 600 2HB LEU 990 2HB LEU 990 -6.977 2.290 3.559 601 HG LEU 990 HG LEU 990 -9.505 2.720 5.174 602 1HD1 LEU 990 1HD1 LEU 990 -8.659 1.325 6.673 603 2HD1 LEU 990 2HD1 LEU 990 -7.295 0.981 5.582 604 3HD1 LEU 990 3HD1 LEU 990 -7.174 2.300 6.771 605 1HD2 LEU 990 1HD2 LEU 990 -8.848 4.838 5.352 606 2HD2 LEU 990 2HD2 LEU 990 -7.470 4.235 6.304 607 3HD2 LEU 990 3HD2 LEU 990 -7.292 4.506 4.554 608 H LEU 991 H LEU 991 -6.538 2.487 1.147 609 HA LEU 991 HA LEU 991 -5.013 4.793 1.343 610 1HB LEU 991 1HB LEU 991 -4.170 2.581 0.734 611 2HB LEU 991 2HB LEU 991 -5.030 2.654 -0.791 612 HG LEU 991 HG LEU 991 -3.646 4.703 -1.360 613 1HD1 LEU 991 1HD1 LEU 991 -1.791 5.336 -0.123 614 2HD1 LEU 991 2HD1 LEU 991 -3.002 4.995 1.136 615 3HD1 LEU 991 3HD1 LEU 991 -1.732 3.800 0.775 616 1HD2 LEU 991 1HD2 LEU 991 -3.256 2.259 -2.086 617 2HD2 LEU 991 2HD2 LEU 991 -1.935 3.433 -2.300 618 3HD2 LEU 991 3HD2 LEU 991 -1.897 2.289 -0.937 619 H ASN 992 H ASN 992 -7.121 3.672 -1.399 620 HA ASN 992 HA ASN 992 -6.784 5.722 -3.066 621 1HB ASN 992 1HB ASN 992 -8.317 3.703 -3.365 622 2HB ASN 992 2HB ASN 992 -9.510 4.510 -2.367 623 1HD2 ASN 992 1HD2 ASN 992 -10.802 6.028 -3.196 624 2HD2 ASN 992 2HD2 ASN 992 -10.771 6.599 -4.830 625 H SER 993 H SER 993 -8.994 5.539 -0.195 626 HA SER 993 HA SER 993 -10.355 7.849 -0.498 627 1HB SER 993 1HB SER 993 -9.714 6.019 1.666 628 2HB SER 993 2HB SER 993 -9.715 7.661 2.278 629 HG SER 993 HG SER 993 -11.860 6.628 0.641 630 H ASP 994 H ASP 994 -7.591 7.615 1.853 631 HA ASP 994 HA ASP 994 -7.191 10.252 2.148 632 1HB ASP 994 1HB ASP 994 -5.530 7.798 2.409 633 2HB ASP 994 2HB ASP 994 -4.592 9.266 2.222 634 H LEU 995 H LEU 995 -6.257 8.107 -0.539 635 HA LEU 995 HA LEU 995 -4.273 9.676 -1.702 636 1HB LEU 995 1HB LEU 995 -4.211 7.726 -2.749 637 2HB LEU 995 2HB LEU 995 -5.878 7.353 -2.357 638 HG LEU 995 HG LEU 995 -6.683 8.536 -4.295 639 1HD1 LEU 995 1HD1 LEU 995 -4.493 9.244 -5.837 640 2HD1 LEU 995 2HD1 LEU 995 -5.574 10.350 -4.956 641 3HD1 LEU 995 3HD1 LEU 995 -4.057 9.801 -4.203 642 1HD2 LEU 995 1HD2 LEU 995 -4.653 7.228 -5.842 643 2HD2 LEU 995 2HD2 LEU 995 -5.014 6.252 -4.398 644 3HD2 LEU 995 3HD2 LEU 995 -6.325 6.716 -5.508 645 H ALA 996 H ALA 996 -7.775 9.413 -2.658 646 HA ALA 996 HA ALA 996 -7.798 11.461 -4.460 647 1HB ALA 996 1HB ALA 996 -10.263 11.653 -3.713 648 2HB ALA 996 2HB ALA 996 -9.701 10.062 -4.279 649 3HB ALA 996 3HB ALA 996 -9.874 10.376 -2.536 650 H GLU 997 H GLU 997 -8.689 11.709 -0.939 651 HA GLU 997 HA GLU 997 -9.097 14.352 -0.822 652 1HB GLU 997 1HB GLU 997 -9.305 12.637 1.045 653 2HB GLU 997 2HB GLU 997 -7.576 12.776 1.299 654 1HG GLU 997 1HG GLU 997 -8.191 14.416 2.785 655 2HG GLU 997 2HG GLU 997 -8.229 15.422 1.351 656 H LEU 998 H LEU 998 -5.977 12.645 -1.081 657 HA LEU 998 HA LEU 998 -4.388 14.901 -0.433 658 1HB LEU 998 1HB LEU 998 -3.802 12.420 -0.322 659 2HB LEU 998 2HB LEU 998 -3.558 12.503 -2.056 660 HG LEU 998 HG LEU 998 -1.419 12.737 -1.152 661 1HD1 LEU 998 1HD1 LEU 998 -2.195 14.544 -2.827 662 2HD1 LEU 998 2HD1 LEU 998 -2.117 15.651 -1.435 663 3HD1 LEU 998 3HD1 LEU 998 -0.657 14.780 -1.962 664 1HD2 LEU 998 1HD2 LEU 998 -0.798 14.131 0.713 665 2HD2 LEU 998 2HD2 LEU 998 -2.441 14.807 0.810 666 3HD2 LEU 998 3HD2 LEU 998 -2.162 13.091 1.188 667 H ILE 999 H ILE 999 -5.367 13.317 -3.547 668 HA ILE 999 HA ILE 999 -4.051 15.089 -5.214 669 HB ILE 999 HB ILE 999 -6.587 13.504 -5.627 670 1HG1 ILE 999 1HG1 ILE 999 -4.493 12.251 -4.987 671 2HG1 ILE 999 2HG1 ILE 999 -5.227 11.783 -6.508 672 1HG2 ILE 999 1HG2 ILE 999 -5.013 14.077 -8.008 673 2HG2 ILE 999 2HG2 ILE 999 -6.759 14.256 -7.715 674 3HG2 ILE 999 3HG2 ILE 999 -5.639 15.556 -7.242 675 1HD1 ILE 999 1HD1 ILE 999 -3.522 12.733 -7.796 676 2HD1 ILE 999 2HD1 ILE 999 -3.105 13.930 -6.546 677 3HD1 ILE 999 3HD1 ILE 999 -2.609 12.232 -6.352 678 H ASN1000 H ASN1000 -7.423 15.199 -3.890 679 HA ASN1000 HA ASN1000 -8.179 17.484 -5.190 680 1HB ASN1000 1HB ASN1000 -9.433 15.782 -3.513 681 2HB ASN1000 2HB ASN1000 -9.058 17.018 -2.329 682 1HD2 ASN1000 1HD2 ASN1000 -11.636 16.395 -2.914 683 2HD2 ASN1000 2HD2 ASN1000 -12.422 17.690 -3.753 684 H LYS1001 H LYS1001 -6.826 17.031 -1.833 685 HA LYS1001 HA LYS1001 -6.765 19.573 -0.949 686 1HB LYS1001 1HB LYS1001 -5.032 17.182 -0.535 687 2HB LYS1001 2HB LYS1001 -4.425 18.716 0.055 688 1HG LYS1001 1HG LYS1001 -7.091 18.779 0.878 689 2HG LYS1001 2HG LYS1001 -6.692 17.081 1.044 690 1HD LYS1001 1HD LYS1001 -4.490 18.704 2.053 691 2HD LYS1001 2HD LYS1001 -5.987 19.214 2.807 692 1HE LYS1001 1HE LYS1001 -5.588 16.253 2.606 693 2HE LYS1001 2HE LYS1001 -4.491 17.092 3.684 694 1HZ LYS1001 1HZ LYS1001 -7.235 16.555 4.024 695 2HZ LYS1001 2HZ LYS1001 -6.140 17.061 5.126 696 3HZ LYS1001 3HZ LYS1001 -6.939 18.151 4.209 697 H MET1002 H MET1002 -4.420 18.028 -3.220 698 HA MET1002 HA MET1002 -2.731 20.223 -3.360 699 1HB MET1002 1HB MET1002 -2.066 17.991 -4.158 700 2HB MET1002 2HB MET1002 -3.383 17.953 -5.313 701 1HG MET1002 1HG MET1002 -1.960 20.334 -5.921 702 2HG MET1002 2HG MET1002 -0.718 19.142 -5.593 703 1HE MET1002 1HE MET1002 -1.700 20.151 -9.171 704 2HE MET1002 2HE MET1002 -3.431 19.826 -8.910 705 3HE MET1002 3HE MET1002 -2.531 20.836 -7.754 706 H LYS1003 H LYS1003 -5.534 19.212 -5.421 707 HA LYS1003 HA LYS1003 -5.327 21.182 -7.334 708 1HB LYS1003 1HB LYS1003 -7.301 19.250 -6.427 709 2HB LYS1003 2HB LYS1003 -8.069 20.738 -6.941 710 1HG LYS1003 1HG LYS1003 -6.478 20.590 -9.027 711 2HG LYS1003 2HG LYS1003 -6.234 18.923 -8.545 712 1HD LYS1003 1HD LYS1003 -8.048 18.832 -10.089 713 2HD LYS1003 2HD LYS1003 -8.808 18.690 -8.516 714 1HE LYS1003 1HE LYS1003 -9.947 20.649 -8.776 715 2HE LYS1003 2HE LYS1003 -8.510 21.508 -9.294 716 1HZ LYS1003 1HZ LYS1003 -8.849 20.858 -11.474 717 2HZ LYS1003 2HZ LYS1003 -9.879 19.650 -11.090 718 3HZ LYS1003 3HZ LYS1003 -10.359 21.205 -10.956 719 H LEU1004 H LEU1004 -6.146 21.411 -3.943 720 HA LEU1004 HA LEU1004 -7.393 24.009 -4.322 721 1HB LEU1004 1HB LEU1004 -6.860 22.565 -1.732 722 2HB LEU1004 2HB LEU1004 -7.973 23.887 -2.022 723 HG LEU1004 HG LEU1004 -8.294 21.177 -3.327 724 1HD1 LEU1004 1HD1 LEU1004 -8.280 20.903 -0.880 725 2HD1 LEU1004 2HD1 LEU1004 -9.569 22.124 -0.745 726 3HD1 LEU1004 3HD1 LEU1004 -9.883 20.588 -1.587 727 1HD2 LEU1004 1HD2 LEU1004 -10.495 21.855 -3.851 728 2HD2 LEU1004 2HD2 LEU1004 -10.399 23.276 -2.783 729 3HD2 LEU1004 3HD2 LEU1004 -9.444 23.226 -4.285 730 H ALA1005 H ALA1005 -4.458 22.475 -2.893 731 HA ALA1005 HA ALA1005 -3.341 24.714 -1.756 732 1HB ALA1005 1HB ALA1005 -1.343 23.046 -3.046 733 2HB ALA1005 2HB ALA1005 -1.734 23.205 -1.317 734 3HB ALA1005 3HB ALA1005 -2.624 22.041 -2.327 735 H GLN1006 H GLN1006 -3.975 24.007 -5.106 736 HA GLN1006 HA GLN1006 -1.938 25.819 -6.013 737 1HB GLN1006 1HB GLN1006 -2.631 23.669 -7.226 738 2HB GLN1006 2HB GLN1006 -4.125 24.478 -7.656 739 1HG GLN1006 1HG GLN1006 -2.000 26.297 -8.288 740 2HG GLN1006 2HG GLN1006 -1.506 24.726 -8.887 741 1HE2 GLN1006 1HE2 GLN1006 -1.948 26.672 -10.661 742 2HE2 GLN1006 2HE2 GLN1006 -3.399 26.414 -11.571 743 H GLN1007 H GLN1007 -5.386 25.763 -5.239 744 HA GLN1007 HA GLN1007 -5.697 28.360 -6.498 745 1HB GLN1007 1HB GLN1007 -7.354 26.258 -6.656 746 2HB GLN1007 2HB GLN1007 -7.973 26.914 -5.154 747 1HG GLN1007 1HG GLN1007 -7.570 29.055 -7.109 748 2HG GLN1007 2HG GLN1007 -8.579 27.793 -7.786 749 1HE2 GLN1007 1HE2 GLN1007 -9.687 30.177 -7.431 750 2HE2 GLN1007 2HE2 GLN1007 -10.808 30.201 -6.111 751 H TYR1008 H TYR1008 -4.701 27.065 -3.581 752 HA TYR1008 HA TYR1008 -5.918 29.255 -2.041 753 1HB TYR1008 1HB TYR1008 -5.020 26.393 -1.575 754 2HB TYR1008 2HB TYR1008 -4.791 27.498 -0.234 755 HD1 TYR1008 HD1 TYR1008 -7.292 25.826 -2.368 756 HD2 TYR1008 HD2 TYR1008 -6.683 28.374 1.014 757 HE1 TYR1008 HE1 TYR1008 -9.717 25.502 -1.678 758 HE2 TYR1008 HE2 TYR1008 -9.110 28.041 1.693 759 HH TYR1008 HH TYR1008 -11.098 27.346 0.973 760 H VAL1009 H VAL1009 -3.076 28.241 -3.623 761 HA VAL1009 HA VAL1009 -1.192 29.151 -1.693 762 HB VAL1009 HB VAL1009 -0.497 27.504 -3.225 763 1HG1 VAL1009 1HG1 VAL1009 -1.942 27.553 -5.040 764 2HG1 VAL1009 2HG1 VAL1009 -1.716 29.298 -5.311 765 3HG1 VAL1009 3HG1 VAL1009 -0.429 28.152 -5.761 766 1HG2 VAL1009 1HG2 VAL1009 0.993 29.443 -4.738 767 2HG2 VAL1009 2HG2 VAL1009 0.816 30.014 -3.062 768 3HG2 VAL1009 3HG2 VAL1009 1.530 28.416 -3.387 769 H MET1010 H MET1010 -2.940 30.553 -4.495 770 HA MET1010 HA MET1010 -1.602 32.757 -5.036 771 1HB MET1010 1HB MET1010 -4.097 33.838 -4.976 772 2HB MET1010 2HB MET1010 -3.639 32.650 -6.180 773 1HG MET1010 1HG MET1010 -5.026 31.052 -5.304 774 2HG MET1010 2HG MET1010 -4.535 31.395 -3.658 775 1HE MET1010 1HE MET1010 -7.866 31.299 -3.166 776 2HE MET1010 2HE MET1010 -6.222 31.249 -2.487 777 3HE MET1010 3HE MET1010 -7.292 32.626 -2.128 778 H THR1011 H THR1011 -3.207 32.047 -1.958 779 HA THR1011 HA THR1011 -2.614 34.776 -1.035 780 HB THR1011 HB THR1011 -4.299 34.288 0.698 781 HG1 THR1011 HG1 THR1011 -4.562 31.716 -0.657 782 1HG2 THR1011 1HG2 THR1011 -6.291 33.595 -0.718 783 2HG2 THR1011 2HG2 THR1011 -5.354 34.929 -1.434 784 3HG2 THR1011 3HG2 THR1011 -5.165 33.273 -2.059 785 H SER1012 H SER1012 -3.050 32.388 1.408 786 HA SER1012 HA SER1012 -0.281 31.724 1.549 787 1HB SER1012 1HB SER1012 -1.140 34.094 2.844 788 2HB SER1012 2HB SER1012 -1.013 32.903 4.123 789 HG SER1012 HG SER1012 1.127 32.919 3.959 790 H LEU1013 H LEU1013 -3.075 30.519 1.392 791 HA LEU1013 HA LEU1013 -3.462 29.323 3.978 792 1HB LEU1013 1HB LEU1013 -4.931 29.627 1.494 793 2HB LEU1013 2HB LEU1013 -5.013 27.980 2.086 794 HG LEU1013 HG LEU1013 -6.889 29.430 2.832 795 1HD1 LEU1013 1HD1 LEU1013 -5.210 28.473 5.161 796 2HD1 LEU1013 2HD1 LEU1013 -6.983 28.598 5.066 797 3HD1 LEU1013 3HD1 LEU1013 -6.121 27.394 4.079 798 1HD2 LEU1013 1HD2 LEU1013 -6.627 31.412 3.817 799 2HD2 LEU1013 2HD2 LEU1013 -5.403 30.785 4.947 800 3HD2 LEU1013 3HD2 LEU1013 -4.921 31.317 3.317 801 H GLN1014 H GLN1014 -1.719 28.666 0.993 802 HA GLN1014 HA GLN1014 -1.580 26.049 0.783 803 1HB GLN1014 1HB GLN1014 1.063 26.541 0.500 804 2HB GLN1014 2HB GLN1014 -0.124 27.038 -0.689 805 1HG GLN1014 1HG GLN1014 0.113 29.267 -0.194 806 2HG GLN1014 2HG GLN1014 0.207 28.980 1.532 807 1HE2 GLN1014 1HE2 GLN1014 2.093 29.089 2.519 808 2HE2 GLN1014 2HE2 GLN1014 3.651 29.178 1.766 809 H GLN1015 H GLN1015 0.554 27.897 3.087 810 HA GLN1015 HA GLN1015 1.820 25.869 4.254 811 1HB GLN1015 1HB GLN1015 1.811 27.291 6.365 812 2HB GLN1015 2HB GLN1015 2.317 28.122 4.908 813 1HG GLN1015 1HG GLN1015 -0.246 28.766 4.696 814 2HG GLN1015 2HG GLN1015 -0.312 28.359 6.399 815 1HE2 GLN1015 1HE2 GLN1015 0.006 29.945 7.745 816 2HE2 GLN1015 2HE2 GLN1015 0.930 31.386 7.480 817 H GLU1016 H GLU1016 -1.485 27.066 5.150 818 HA GLU1016 HA GLU1016 -1.904 25.371 7.249 819 1HB GLU1016 1HB GLU1016 -3.342 27.337 6.102 820 2HB GLU1016 2HB GLU1016 -4.199 25.979 5.401 821 1HG GLU1016 1HG GLU1016 -4.674 25.051 7.625 822 2HG GLU1016 2HG GLU1016 -3.660 26.256 8.394 823 H TYR1017 H TYR1017 -2.830 24.893 3.763 824 HA TYR1017 HA TYR1017 -3.857 22.324 4.098 825 1HB TYR1017 1HB TYR1017 -2.630 24.055 1.906 826 2HB TYR1017 2HB TYR1017 -2.959 22.377 1.523 827 HD1 TYR1017 HD1 TYR1017 -5.115 21.702 0.862 828 HD2 TYR1017 HD2 TYR1017 -4.598 25.488 2.787 829 HE1 TYR1017 HE1 TYR1017 -7.533 22.299 0.352 830 HE2 TYR1017 HE2 TYR1017 -7.018 26.072 2.271 831 HH TYR1017 HH TYR1017 -9.271 23.944 1.554 832 H LYS1018 H LYS1018 -0.521 23.509 3.427 833 HA LYS1018 HA LYS1018 0.680 21.173 2.708 834 1HB LYS1018 1HB LYS1018 1.788 23.391 4.455 835 2HB LYS1018 2HB LYS1018 2.748 22.167 3.650 836 1HG LYS1018 1HG LYS1018 1.004 23.262 1.659 837 2HG LYS1018 2HG LYS1018 1.644 24.624 2.556 838 1HD LYS1018 1HD LYS1018 3.977 23.611 2.253 839 2HD LYS1018 2HD LYS1018 3.256 22.429 1.178 840 1HE LYS1018 1HE LYS1018 2.652 25.332 0.643 841 2HE LYS1018 2HE LYS1018 4.268 24.766 0.272 842 1HZ LYS1018 1HZ LYS1018 3.462 23.292 -1.267 843 2HZ LYS1018 2HZ LYS1018 1.956 23.239 -0.638 844 3HZ LYS1018 3HZ LYS1018 2.445 24.553 -1.475 845 H LYS1019 H LYS1019 -0.388 22.250 5.949 846 HA LYS1019 HA LYS1019 0.887 20.044 7.254 847 1HB LYS1019 1HB LYS1019 -0.661 22.438 8.015 848 2HB LYS1019 2HB LYS1019 -0.941 21.045 9.039 849 1HG LYS1019 1HG LYS1019 0.932 21.965 10.086 850 2HG LYS1019 2HG LYS1019 1.706 20.824 9.004 851 1HD LYS1019 1HD LYS1019 1.167 23.655 8.059 852 2HD LYS1019 2HD LYS1019 2.546 23.335 9.092 853 1HE LYS1019 1HE LYS1019 2.303 21.396 6.865 854 2HE LYS1019 2HE LYS1019 2.494 23.048 6.312 855 1HZ LYS1019 1HZ LYS1019 4.523 23.210 7.291 856 2HZ LYS1019 2HZ LYS1019 4.225 22.089 8.440 857 3HZ LYS1019 3HZ LYS1019 4.539 21.623 6.907 858 H GLN1020 H GLN1020 -2.229 20.749 5.719 859 HA GLN1020 HA GLN1020 -3.693 18.753 6.964 860 1HB GLN1020 1HB GLN1020 -4.011 19.888 4.150 861 2HB GLN1020 2HB GLN1020 -5.238 18.994 5.026 862 1HG GLN1020 1HG GLN1020 -3.985 21.539 6.143 863 2HG GLN1020 2HG GLN1020 -5.394 21.576 5.102 864 1HE2 GLN1020 1HE2 GLN1020 -4.788 22.127 8.042 865 2HE2 GLN1020 2HE2 GLN1020 -6.040 21.314 8.920 866 H MET1021 H MET1021 -2.140 18.752 3.667 867 HA MET1021 HA MET1021 -2.634 16.094 3.166 868 1HB MET1021 1HB MET1021 -0.886 16.368 1.411 869 2HB MET1021 2HB MET1021 -1.890 17.803 1.481 870 1HG MET1021 1HG MET1021 0.164 18.863 1.547 871 2HG MET1021 2HG MET1021 0.004 18.567 3.266 872 1HE MET1021 1HE MET1021 0.825 15.553 0.560 873 2HE MET1021 2HE MET1021 1.031 17.209 -0.061 874 3HE MET1021 3HE MET1021 2.457 16.184 0.235 875 H LEU1022 H LEU1022 -0.095 17.672 5.088 876 HA LEU1022 HA LEU1022 1.784 15.639 5.117 877 1HB LEU1022 1HB LEU1022 1.986 17.999 5.959 878 2HB LEU1022 2HB LEU1022 1.101 17.505 7.388 879 HG LEU1022 HG LEU1022 3.563 17.597 7.699 880 1HD1 LEU1022 1HD1 LEU1022 2.949 14.717 8.065 881 2HD1 LEU1022 2HD1 LEU1022 3.528 15.933 9.229 882 3HD1 LEU1022 3HD1 LEU1022 1.805 15.875 8.785 883 1HD2 LEU1022 1HD2 LEU1022 3.941 16.667 5.294 884 2HD2 LEU1022 2HD2 LEU1022 5.078 16.247 6.596 885 3HD2 LEU1022 3HD2 LEU1022 3.836 15.078 6.088 886 H THR1023 H THR1023 -1.063 16.218 7.284 887 HA THR1023 HA THR1023 -0.650 14.022 8.939 888 HB THR1023 HB THR1023 -3.177 15.502 8.041 889 HG1 THR1023 HG1 THR1023 -1.433 16.688 9.165 890 1HG2 THR1023 1HG2 THR1023 -4.020 14.731 10.327 891 2HG2 THR1023 2HG2 THR1023 -3.905 13.426 9.121 892 3HG2 THR1023 3HG2 THR1023 -2.653 13.592 10.376 893 H ALA1024 H ALA1024 -2.302 14.269 5.756 894 HA ALA1024 HA ALA1024 -3.344 11.669 5.799 895 1HB ALA1024 1HB ALA1024 -2.916 13.869 3.857 896 2HB ALA1024 2HB ALA1024 -2.986 12.240 3.144 897 3HB ALA1024 3HB ALA1024 -4.344 12.841 4.126 898 H ALA1025 H ALA1025 -0.159 13.040 4.913 899 HA ALA1025 HA ALA1025 0.830 10.792 3.581 900 1HB ALA1025 1HB ALA1025 1.812 13.076 3.522 901 2HB ALA1025 2HB ALA1025 2.304 12.892 5.223 902 3HB ALA1025 3HB ALA1025 3.013 11.841 3.973 903 H HIS1026 H HIS1026 0.422 11.599 7.023 904 HA HIS1026 HA HIS1026 2.158 9.554 7.937 905 1HB HIS1026 1HB HIS1026 1.005 11.773 9.045 906 2HB HIS1026 2HB HIS1026 0.012 10.504 9.734 907 HD1 HIS1026 HD1 HIS1026 1.556 11.860 11.807 908 HD2 HIS1026 HD2 HIS1026 3.288 8.803 9.517 909 HE1 HIS1026 HE1 HIS1026 3.534 10.987 13.161 910 H ALA1027 H ALA1027 -1.441 9.909 7.649 911 HA ALA1027 HA ALA1027 -1.965 7.297 8.574 912 1HB ALA1027 1HB ALA1027 -3.413 9.590 8.065 913 2HB ALA1027 2HB ALA1027 -3.925 8.523 6.736 914 3HB ALA1027 3HB ALA1027 -4.116 7.995 8.425 915 H LEU1028 H LEU1028 -1.223 8.744 5.393 916 HA LEU1028 HA LEU1028 -2.090 6.678 3.774 917 1HB LEU1028 1HB LEU1028 -0.086 8.868 3.579 918 2HB LEU1028 2HB LEU1028 0.006 7.582 2.392 919 HG LEU1028 HG LEU1028 -2.290 9.479 2.901 920 1HD1 LEU1028 1HD1 LEU1028 -0.082 9.650 1.230 921 2HD1 LEU1028 2HD1 LEU1028 -1.389 9.094 0.157 922 3HD1 LEU1028 3HD1 LEU1028 -1.589 10.588 1.102 923 1HD2 LEU1028 1HD2 LEU1028 -3.528 7.575 2.547 924 2HD2 LEU1028 2HD2 LEU1028 -3.297 8.148 0.878 925 3HD2 LEU1028 3HD2 LEU1028 -2.290 6.824 1.512 926 H ALA1029 H ALA1029 1.347 7.252 4.821 927 HA ALA1029 HA ALA1029 2.466 4.969 4.003 928 1HB ALA1029 1HB ALA1029 4.174 5.779 5.222 929 2HB ALA1029 2HB ALA1029 3.060 7.029 5.826 930 3HB ALA1029 3HB ALA1029 3.287 5.521 6.743 931 H VAL1030 H VAL1030 0.472 5.383 6.991 932 HA VAL1030 HA VAL1030 0.789 2.705 7.821 933 HB VAL1030 HB VAL1030 -0.956 5.027 8.511 934 1HG1 VAL1030 1HG1 VAL1030 -1.464 2.164 9.370 935 2HG1 VAL1030 2HG1 VAL1030 -2.085 3.582 10.248 936 3HG1 VAL1030 3HG1 VAL1030 -2.592 3.283 8.568 937 1HG2 VAL1030 1HG2 VAL1030 0.061 3.887 10.822 938 2HG2 VAL1030 2HG2 VAL1030 1.345 3.595 9.624 939 3HG2 VAL1030 3HG2 VAL1030 0.769 5.252 9.926 940 H ASP1031 H ASP1031 -1.788 4.473 5.990 941 HA ASP1031 HA ASP1031 -3.597 2.502 5.777 942 1HB ASP1031 1HB ASP1031 -2.700 4.735 3.974 943 2HB ASP1031 2HB ASP1031 -3.774 3.543 3.270 944 H ALA1032 H ALA1032 -0.888 3.223 3.437 945 HA ALA1032 HA ALA1032 -1.276 1.025 1.797 946 1HB ALA1032 1HB ALA1032 0.772 3.076 2.306 947 2HB ALA1032 2HB ALA1032 1.451 1.537 1.723 948 3HB ALA1032 3HB ALA1032 0.210 2.382 0.767 949 H LYS1033 H LYS1033 0.026 1.288 5.047 950 HA LYS1033 HA LYS1033 1.595 -1.067 4.962 951 1HB LYS1033 1HB LYS1033 1.178 1.060 6.732 952 2HB LYS1033 2HB LYS1033 0.582 -0.343 7.595 953 1HG LYS1033 1HG LYS1033 2.941 -0.180 8.086 954 2HG LYS1033 2HG LYS1033 2.746 -1.547 7.006 955 1HD LYS1033 1HD LYS1033 3.187 0.231 5.091 956 2HD LYS1033 2HD LYS1033 3.857 1.206 6.384 957 1HE LYS1033 1HE LYS1033 5.657 -0.236 6.741 958 2HE LYS1033 2HE LYS1033 4.762 -1.659 6.246 959 1HZ LYS1033 1HZ LYS1033 6.205 0.234 4.629 960 2HZ LYS1033 2HZ LYS1033 5.996 -1.372 4.418 961 3HZ LYS1033 3HZ LYS1033 4.816 -0.331 3.982 962 H ASN1034 H ASN1034 -1.589 -0.385 6.589 963 HA ASN1034 HA ASN1034 -2.201 -2.863 7.333 964 1HB ASN1034 1HB ASN1034 -4.534 -2.185 7.294 965 2HB ASN1034 2HB ASN1034 -3.602 -0.735 7.610 966 1HD2 ASN1034 1HD2 ASN1034 -4.409 0.933 6.612 967 2HD2 ASN1034 2HD2 ASN1034 -5.039 0.996 5.000 968 H LEU1035 H LEU1035 -2.037 -1.546 4.052 969 HA LEU1035 HA LEU1035 -3.687 -3.390 2.746 970 1HB LEU1035 1HB LEU1035 -2.772 -1.175 1.923 971 2HB LEU1035 2HB LEU1035 -1.263 -2.007 1.606 972 HG LEU1035 HG LEU1035 -3.907 -2.843 0.393 973 1HD1 LEU1035 1HD1 LEU1035 -2.032 -1.584 -1.440 974 2HD1 LEU1035 2HD1 LEU1035 -3.767 -1.277 -1.181 975 3HD1 LEU1035 3HD1 LEU1035 -2.558 -0.474 -0.151 976 1HD2 LEU1035 1HD2 LEU1035 -2.739 -4.669 -0.130 977 2HD2 LEU1035 2HD2 LEU1035 -1.853 -3.637 -1.278 978 3HD2 LEU1035 3HD2 LEU1035 -1.195 -3.926 0.351 979 H LEU1036 H LEU1036 -0.050 -3.300 2.793 980 HA LEU1036 HA LEU1036 0.103 -5.990 1.931 981 1HB LEU1036 1HB LEU1036 1.774 -3.837 1.969 982 2HB LEU1036 2HB LEU1036 2.437 -4.798 3.276 983 HG LEU1036 HG LEU1036 2.001 -6.599 1.140 984 1HD1 LEU1036 1HD1 LEU1036 2.737 -5.679 -0.802 985 2HD1 LEU1036 2HD1 LEU1036 1.980 -4.233 -0.091 986 3HD1 LEU1036 3HD1 LEU1036 3.742 -4.460 0.018 987 1HD2 LEU1036 1HD2 LEU1036 4.679 -6.226 1.125 988 2HD2 LEU1036 2HD2 LEU1036 4.266 -5.500 2.696 989 3HD2 LEU1036 3HD2 LEU1036 3.811 -7.185 2.348 990 H ASP1037 H ASP1037 0.297 -4.319 5.112 991 HA ASP1037 HA ASP1037 1.257 -6.179 6.709 992 1HB ASP1037 1HB ASP1037 0.203 -3.951 7.347 993 2HB ASP1037 2HB ASP1037 -1.370 -4.720 7.255 994 H VAL1038 H VAL1038 -2.196 -5.989 5.560 995 HA VAL1038 HA VAL1038 -3.030 -8.348 6.822 996 HB VAL1038 HB VAL1038 -4.099 -6.903 4.390 997 1HG1 VAL1038 1HG1 VAL1038 -5.871 -8.292 4.330 998 2HG1 VAL1038 2HG1 VAL1038 -4.812 -9.419 5.211 999 3HG1 VAL1038 3HG1 VAL1038 -5.970 -8.405 6.104 1000 1HG2 VAL1038 1HG2 VAL1038 -5.352 -6.676 7.092 1001 2HG2 VAL1038 2HG2 VAL1038 -3.838 -5.786 6.801 1002 3HG2 VAL1038 3HG2 VAL1038 -5.257 -5.491 5.767 1003 H ILE1039 H ILE1039 -1.555 -7.640 3.627 1004 HA ILE1039 HA ILE1039 -2.004 -10.142 2.487 1005 HB ILE1039 HB ILE1039 -0.017 -7.940 2.044 1006 1HG1 ILE1039 1HG1 ILE1039 -2.248 -9.052 0.318 1007 2HG1 ILE1039 2HG1 ILE1039 -2.397 -7.658 1.370 1008 1HG2 ILE1039 1HG2 ILE1039 0.199 -9.578 -0.179 1009 2HG2 ILE1039 2HG2 ILE1039 1.413 -9.367 1.106 1010 3HG2 ILE1039 3HG2 ILE1039 0.254 -10.715 1.189 1011 1HD1 ILE1039 1HD1 ILE1039 -0.565 -7.956 -1.047 1012 2HD1 ILE1039 2HD1 ILE1039 -1.916 -6.815 -0.839 1013 3HD1 ILE1039 3HD1 ILE1039 -0.427 -6.614 0.115 1014 H ASP1040 H ASP1040 0.635 -8.886 4.596 1015 HA ASP1040 HA ASP1040 2.373 -10.936 4.394 1016 1HB ASP1040 1HB ASP1040 2.096 -8.715 6.004 1017 2HB ASP1040 2HB ASP1040 1.845 -9.991 7.179 1018 H GLN1041 H GLN1041 -0.570 -10.616 6.488 1019 HA GLN1041 HA GLN1041 -0.211 -12.984 7.878 1020 1HB GLN1041 1HB GLN1041 -2.241 -12.484 8.853 1021 2HB GLN1041 2HB GLN1041 -1.894 -10.916 8.151 1022 1HG GLN1041 1HG GLN1041 -3.971 -11.145 7.208 1023 2HG GLN1041 2HG GLN1041 -3.122 -12.107 6.014 1024 1HE2 GLN1041 1HE2 GLN1041 -5.847 -12.088 7.519 1025 2HE2 GLN1041 2HE2 GLN1041 -6.124 -13.753 7.907 1026 H ALA1042 H ALA1042 -1.319 -12.306 4.611 1027 HA ALA1042 HA ALA1042 -2.745 -14.759 4.286 1028 1HB ALA1042 1HB ALA1042 -2.868 -12.423 3.022 1029 2HB ALA1042 2HB ALA1042 -1.624 -13.172 1.993 1030 3HB ALA1042 3HB ALA1042 -3.217 -13.945 2.170 1031 H ARG1043 H ARG1043 0.409 -13.476 2.998 1032 HA ARG1043 HA ARG1043 1.329 -15.509 1.664 1033 1HB ARG1043 1HB ARG1043 2.531 -13.331 2.523 1034 2HB ARG1043 2HB ARG1043 3.114 -14.336 3.835 1035 1HG ARG1043 1HG ARG1043 4.315 -15.788 2.345 1036 2HG ARG1043 2HG ARG1043 3.453 -15.198 0.938 1037 1HD ARG1043 1HD ARG1043 5.389 -13.956 0.677 1038 2HD ARG1043 2HD ARG1043 4.528 -12.845 1.724 1039 HE ARG1043 HE ARG1043 6.843 -14.502 2.453 1040 1HH1 ARG1043 2HH2 ARG1043 4.117 -12.629 3.655 1041 2HH1 ARG1043 1HH2 ARG1043 4.818 -12.373 5.218 1042 1HH2 ARG1043 2HH1 ARG1043 7.767 -14.165 4.515 1043 2HH2 ARG1043 1HH1 ARG1043 6.908 -13.252 5.711 1044 H LEU1044 H LEU1044 2.017 -15.267 5.241 1045 HA LEU1044 HA LEU1044 3.042 -17.764 5.594 1046 1HB LEU1044 1HB LEU1044 1.959 -17.473 7.956 1047 2HB LEU1044 2HB LEU1044 3.289 -16.463 7.423 1048 HG LEU1044 HG LEU1044 0.816 -15.206 6.666 1049 1HD1 LEU1044 1HD1 LEU1044 0.346 -16.773 8.868 1050 2HD1 LEU1044 2HD1 LEU1044 0.800 -15.216 9.602 1051 3HD1 LEU1044 3HD1 LEU1044 -0.545 -15.293 8.439 1052 1HD2 LEU1044 1HD2 LEU1044 2.964 -14.071 6.963 1053 2HD2 LEU1044 2HD2 LEU1044 1.701 -13.357 7.995 1054 3HD2 LEU1044 3HD2 LEU1044 2.924 -14.438 8.705 1055 H LYS1045 H LYS1045 -0.432 -16.757 5.647 1056 HA LYS1045 HA LYS1045 -1.601 -19.065 6.422 1057 1HB LYS1045 1HB LYS1045 -2.610 -16.794 5.725 1058 2HB LYS1045 2HB LYS1045 -2.665 -17.452 4.102 1059 1HG LYS1045 1HG LYS1045 -3.706 -19.364 6.088 1060 2HG LYS1045 2HG LYS1045 -4.579 -17.845 6.132 1061 1HD LYS1045 1HD LYS1045 -4.799 -18.012 3.580 1062 2HD LYS1045 2HD LYS1045 -4.142 -19.632 3.698 1063 1HE LYS1045 1HE LYS1045 -6.272 -19.327 5.656 1064 2HE LYS1045 2HE LYS1045 -6.859 -18.813 4.087 1065 1HZ LYS1045 1HZ LYS1045 -7.058 -21.217 4.554 1066 2HZ LYS1045 2HZ LYS1045 -6.260 -20.879 3.169 1067 3HZ LYS1045 3HZ LYS1045 -5.430 -21.343 4.497 1068 H MET1046 H MET1046 0.231 -18.457 3.474 1069 HA MET1046 HA MET1046 -0.803 -20.810 2.209 1070 1HB MET1046 1HB MET1046 0.325 -18.436 1.315 1071 2HB MET1046 2HB MET1046 1.707 -19.507 1.203 1072 1HG MET1046 1HG MET1046 0.690 -20.887 -0.412 1073 2HG MET1046 2HG MET1046 -0.934 -20.480 0.103 1074 1HE MET1046 1HE MET1046 1.731 -17.238 -1.729 1075 2HE MET1046 2HE MET1046 1.128 -17.145 -0.057 1076 3HE MET1046 3HE MET1046 2.204 -18.478 -0.542 1077 H ILE1047 H ILE1047 2.301 -19.691 3.703 1078 HA ILE1047 HA ILE1047 3.687 -22.082 3.210 1079 HB ILE1047 HB ILE1047 4.082 -19.838 5.185 1080 1HG1 ILE1047 1HG1 ILE1047 6.146 -19.978 3.264 1081 2HG1 ILE1047 2HG1 ILE1047 4.653 -20.200 2.373 1082 1HG2 ILE1047 1HG2 ILE1047 5.119 -21.751 6.178 1083 2HG2 ILE1047 2HG2 ILE1047 5.850 -22.232 4.628 1084 3HG2 ILE1047 3HG2 ILE1047 6.397 -20.750 5.448 1085 1HD1 ILE1047 1HD1 ILE1047 5.256 -17.920 4.313 1086 2HD1 ILE1047 2HD1 ILE1047 5.171 -17.803 2.539 1087 3HD1 ILE1047 3HD1 ILE1047 3.702 -18.159 3.479 1088 H SER1048 H SER1048 2.491 -20.825 6.406 1089 HA SER1048 HA SER1048 2.675 -23.362 7.558 1090 1HB SER1048 1HB SER1048 1.985 -20.662 8.367 1091 2HB SER1048 2HB SER1048 0.806 -21.775 9.033 1092 HG SER1048 HG SER1048 3.100 -21.278 10.113 1093 H GLN1049 H GLN1049 1.467 -24.564 5.787 1094 HA GLN1049 HA GLN1049 -0.976 -25.371 6.655 1095 1HB GLN1049 1HB GLN1049 -1.276 -22.861 5.431 1096 2HB GLN1049 2HB GLN1049 -1.754 -23.989 4.178 1097 1HG GLN1049 1HG GLN1049 -3.787 -23.881 5.253 1098 2HG GLN1049 2HG GLN1049 -3.073 -25.121 6.265 1099 1HE2 GLN1049 1HE2 GLN1049 -3.102 -24.808 8.352 1100 2HE2 GLN1049 2HE2 GLN1049 -3.238 -23.297 9.187 1101 H SER1050 H SER1050 -2.270 -26.159 4.258 1102 HA SER1050 HA SER1050 -0.243 -27.947 3.258 1103 1HB SER1050 1HB SER1050 -2.313 -28.984 3.981 1104 2HB SER1050 2HB SER1050 -3.277 -27.885 3.015 1105 HG SER1050 HG SER1050 -2.228 -28.833 1.088 1106 H ARG1051 H ARG1051 0.863 -26.179 2.019 1107 HA ARG1051 HA ARG1051 -0.344 -24.635 0.152 1108 1HB ARG1051 1HB ARG1051 2.118 -24.650 0.953 1109 2HB ARG1051 2HB ARG1051 2.404 -25.912 -0.228 1110 1HG ARG1051 1HG ARG1051 0.957 -23.558 -1.323 1111 2HG ARG1051 2HG ARG1051 2.565 -23.185 -0.734 1112 1HD ARG1051 1HD ARG1051 3.623 -24.581 -2.300 1113 2HD ARG1051 2HD ARG1051 2.239 -25.646 -2.451 1114 HE ARG1051 HE ARG1051 1.321 -24.216 -4.081 1115 1HH1 ARG1051 2HH2 ARG1051 4.004 -22.614 -2.463 1116 2HH1 ARG1051 1HH2 ARG1051 4.057 -21.293 -3.582 1117 1HH2 ARG1051 2HH1 ARG1051 1.390 -22.473 -5.557 1118 2HH2 ARG1051 1HH1 ARG1051 2.560 -21.212 -5.354 1119 HA PRO1052 HA PRO1052 -1.511 -27.843 -2.674 1120 1HB PRO1052 1HB PRO1052 -3.276 -26.362 -4.142 1121 2HB PRO1052 2HB PRO1052 -3.726 -27.217 -2.680 1122 1HG PRO1052 1HG PRO1052 -3.297 -24.319 -3.075 1123 2HG PRO1052 2HG PRO1052 -4.141 -25.136 -1.775 1124 1HD PRO1052 1HD PRO1052 -1.511 -23.997 -1.664 1125 2HD PRO1052 2HD PRO1052 -2.310 -24.916 -0.403 1126 H HIS1053 H HIS1053 -1.653 -28.119 -5.139 1127 HA HIS1053 HA HIS1053 0.852 -27.330 -6.094 1128 1HB HIS1053 1HB HIS1053 0.341 -28.564 -7.988 1129 2HB HIS1053 2HB HIS1053 -0.612 -29.340 -6.739 1130 HD1 HIS1053 HD1 HIS1053 -2.812 -30.014 -7.690 1131 HD2 HIS1053 HD2 HIS1053 -1.544 -26.297 -9.162 1132 HE1 HIS1053 HE1 HIS1053 -4.667 -29.187 -9.234 Start of MODEL 6 1 H MET 915 H MET 915 2.035 -23.899 -7.508 2 HA MET 915 HA MET 915 3.066 -22.541 -9.014 3 1HB MET 915 1HB MET 915 1.501 -20.566 -7.601 4 2HB MET 915 2HB MET 915 3.159 -20.001 -7.581 5 1HG MET 915 1HG MET 915 3.190 -19.603 -9.846 6 2HG MET 915 2HG MET 915 2.312 -21.073 -10.219 7 1HE MET 915 1HE MET 915 0.144 -21.481 -10.271 8 2HE MET 915 2HE MET 915 -0.808 -20.776 -8.943 9 3HE MET 915 3HE MET 915 -1.135 -20.295 -10.625 10 H ALA 916 H ALA 916 5.242 -22.892 -8.951 11 HA ALA 916 HA ALA 916 6.548 -22.603 -6.343 12 1HB ALA 916 1HB ALA 916 8.223 -23.924 -8.221 13 2HB ALA 916 2HB ALA 916 7.360 -24.638 -6.838 14 3HB ALA 916 3HB ALA 916 6.587 -24.590 -8.441 15 H ASN 917 H ASN 917 6.946 -21.934 -9.885 16 HA ASN 917 HA ASN 917 9.157 -20.221 -9.298 17 1HB ASN 917 1HB ASN 917 8.969 -19.777 -11.852 18 2HB ASN 917 2HB ASN 917 9.353 -21.418 -11.370 19 1HD2 ASN 917 1HD2 ASN 917 8.494 -21.519 -13.698 20 2HD2 ASN 917 2HD2 ASN 917 6.818 -21.913 -13.888 21 H LEU 918 H LEU 918 8.672 -18.170 -8.487 22 HA LEU 918 HA LEU 918 6.400 -16.778 -9.723 23 1HB LEU 918 1HB LEU 918 7.243 -16.824 -6.825 24 2HB LEU 918 2HB LEU 918 6.140 -15.638 -7.495 25 HG LEU 918 HG LEU 918 4.947 -17.954 -8.314 26 1HD1 LEU 918 1HD1 LEU 918 5.239 -19.725 -6.942 27 2HD1 LEU 918 2HD1 LEU 918 6.847 -18.995 -6.717 28 3HD1 LEU 918 3HD1 LEU 918 5.566 -18.712 -5.515 29 1HD2 LEU 918 1HD2 LEU 918 4.238 -15.817 -6.855 30 2HD2 LEU 918 2HD2 LEU 918 3.222 -17.270 -7.017 31 3HD2 LEU 918 3HD2 LEU 918 4.240 -17.052 -5.574 32 H ASP 919 H ASP 919 7.240 -15.264 -11.056 33 HA ASP 919 HA ASP 919 9.816 -14.398 -10.986 34 1HB ASP 919 1HB ASP 919 7.362 -13.740 -12.372 35 2HB ASP 919 2HB ASP 919 8.155 -12.240 -11.935 36 H ARG 920 H ARG 920 9.955 -11.611 -10.937 37 HA ARG 920 HA ARG 920 9.636 -11.129 -8.137 38 1HB ARG 920 1HB ARG 920 10.936 -9.560 -10.411 39 2HB ARG 920 2HB ARG 920 10.831 -8.917 -8.784 40 1HG ARG 920 1HG ARG 920 11.856 -11.687 -8.829 41 2HG ARG 920 2HG ARG 920 12.853 -10.594 -9.768 42 1HD ARG 920 1HD ARG 920 13.805 -9.939 -7.808 43 2HD ARG 920 2HD ARG 920 12.302 -9.115 -7.442 44 HE ARG 920 HE ARG 920 11.936 -11.842 -6.742 45 1HH1 ARG 920 2HH2 ARG 920 13.928 -9.101 -5.705 46 2HH1 ARG 920 1HH2 ARG 920 14.071 -9.663 -4.073 47 1HH2 ARG 920 1HH1 ARG 920 13.002 -11.712 -3.439 48 H SER 921 H SER 921 7.108 -11.356 -9.220 49 HA SER 921 HA SER 921 6.217 -8.745 -9.999 50 1HB SER 921 1HB SER 921 5.108 -11.507 -9.969 51 2HB SER 921 2HB SER 921 3.929 -10.248 -9.659 52 HG SER 921 HG SER 921 4.882 -9.167 -11.650 53 H ASN 922 H ASN 922 6.118 -10.974 -7.192 54 HA ASN 922 HA ASN 922 4.201 -9.588 -5.748 55 1HB ASN 922 1HB ASN 922 4.986 -10.897 -3.836 56 2HB ASN 922 2HB ASN 922 5.075 -11.924 -5.254 57 1HD2 ASN 922 1HD2 ASN 922 6.949 -12.777 -5.866 58 2HD2 ASN 922 2HD2 ASN 922 8.495 -12.466 -5.148 59 H ASP 923 H ASP 923 7.616 -9.038 -6.443 60 HA ASP 923 HA ASP 923 8.111 -7.419 -4.180 61 1HB ASP 923 1HB ASP 923 9.939 -8.573 -5.354 62 2HB ASP 923 2HB ASP 923 9.551 -7.749 -6.851 63 H LYS 924 H LYS 924 7.193 -6.976 -7.641 64 HA LYS 924 HA LYS 924 7.532 -4.233 -7.820 65 1HB LYS 924 1HB LYS 924 7.131 -5.841 -9.696 66 2HB LYS 924 2HB LYS 924 5.447 -5.931 -9.221 67 1HG LYS 924 1HG LYS 924 5.553 -3.277 -9.367 68 2HG LYS 924 2HG LYS 924 6.968 -3.572 -10.358 69 1HD LYS 924 1HD LYS 924 4.971 -5.386 -11.293 70 2HD LYS 924 2HD LYS 924 4.153 -3.854 -11.060 71 1HE LYS 924 1HE LYS 924 4.961 -3.543 -13.223 72 2HE LYS 924 2HE LYS 924 6.291 -2.858 -12.310 73 1HZ LYS 924 1HZ LYS 924 6.689 -5.598 -12.507 74 2HZ LYS 924 2HZ LYS 924 6.346 -5.042 -14.004 75 3HZ LYS 924 3HZ LYS 924 7.586 -4.399 -13.159 76 H VAL 925 H VAL 925 4.663 -6.179 -6.773 77 HA VAL 925 HA VAL 925 2.948 -4.043 -6.380 78 HB VAL 925 HB VAL 925 3.146 -6.672 -4.896 79 1HG1 VAL 925 1HG1 VAL 925 1.011 -4.549 -5.027 80 2HG1 VAL 925 2HG1 VAL 925 0.580 -6.254 -4.753 81 3HG1 VAL 925 3HG1 VAL 925 1.660 -5.415 -3.614 82 1HG2 VAL 925 1HG2 VAL 925 1.407 -7.404 -6.552 83 2HG2 VAL 925 2HG2 VAL 925 1.707 -5.898 -7.453 84 3HG2 VAL 925 3HG2 VAL 925 3.011 -7.094 -7.259 85 H TYR 926 H TYR 926 5.344 -5.581 -4.147 86 HA TYR 926 HA TYR 926 4.703 -3.861 -1.987 87 1HB TYR 926 1HB TYR 926 6.978 -5.727 -2.853 88 2HB TYR 926 2HB TYR 926 7.124 -4.818 -1.361 89 HD1 TYR 926 HD1 TYR 926 3.765 -5.871 -2.260 90 HD2 TYR 926 HD2 TYR 926 7.336 -7.043 -0.217 91 HE1 TYR 926 HE1 TYR 926 2.474 -7.681 -1.028 92 HE2 TYR 926 HE2 TYR 926 6.033 -8.850 1.009 93 HH TYR 926 HH TYR 926 2.602 -9.398 0.292 94 H GLU 927 H GLU 927 6.753 -3.603 -4.849 95 HA GLU 927 HA GLU 927 8.469 -1.653 -3.768 96 1HB GLU 927 1HB GLU 927 7.846 -2.658 -6.554 97 2HB GLU 927 2HB GLU 927 8.847 -1.234 -6.351 98 1HG GLU 927 1HG GLU 927 9.464 -3.744 -4.763 99 2HG GLU 927 2HG GLU 927 9.972 -3.629 -6.437 100 H ASN 928 H ASN 928 5.430 -1.594 -5.707 101 HA ASN 928 HA ASN 928 5.440 1.113 -6.226 102 1HB ASN 928 1HB ASN 928 3.791 -1.020 -6.837 103 2HB ASN 928 2HB ASN 928 2.785 -0.167 -5.683 104 1HD2 ASN 928 1HD2 ASN 928 4.681 0.188 -8.641 105 2HD2 ASN 928 2HD2 ASN 928 3.781 1.493 -9.339 106 H VAL 929 H VAL 929 3.781 -0.838 -3.630 107 HA VAL 929 HA VAL 929 2.534 1.174 -2.281 108 HB VAL 929 HB VAL 929 3.780 -1.428 -1.449 109 1HG1 VAL 929 1HG1 VAL 929 2.104 -0.731 0.651 110 2HG1 VAL 929 2HG1 VAL 929 3.884 -0.737 0.681 111 3HG1 VAL 929 3HG1 VAL 929 3.005 0.769 0.321 112 1HG2 VAL 929 1HG2 VAL 929 1.603 -2.264 -1.457 113 2HG2 VAL 929 2HG2 VAL 929 0.873 -0.650 -1.283 114 3HG2 VAL 929 3HG2 VAL 929 1.598 -1.136 -2.834 115 H THR 930 H THR 930 5.924 -0.032 -1.794 116 HA THR 930 HA THR 930 6.571 1.805 0.214 117 HB THR 930 HB THR 930 8.969 1.201 -0.768 118 HG1 THR 930 HG1 THR 930 8.640 0.156 -2.692 119 1HG2 THR 930 1HG2 THR 930 8.687 -0.222 1.022 120 2HG2 THR 930 2HG2 THR 930 6.962 -0.471 0.657 121 3HG2 THR 930 3HG2 THR 930 8.200 -1.414 -0.206 122 H GLY 931 H GLY 931 7.320 1.942 -3.336 123 1HA GLY 931 1HA GLY 931 8.510 4.429 -3.361 124 2HA GLY 931 2HA GLY 931 7.622 3.710 -4.690 125 H LEU 932 H LEU 932 5.101 3.552 -2.919 126 HA LEU 932 HA LEU 932 4.111 6.124 -3.670 127 1HB LEU 932 1HB LEU 932 2.265 4.945 -3.830 128 2HB LEU 932 2HB LEU 932 3.074 3.546 -3.153 129 HG LEU 932 HG LEU 932 2.449 4.255 -0.884 130 1HD1 LEU 932 1HD1 LEU 932 1.935 6.760 -2.168 131 2HD1 LEU 932 2HD1 LEU 932 0.436 6.189 -1.397 132 3HD1 LEU 932 3HD1 LEU 932 1.923 6.360 -0.433 133 1HD2 LEU 932 1HD2 LEU 932 0.257 3.931 -2.932 134 2HD2 LEU 932 2HD2 LEU 932 0.957 2.715 -1.836 135 3HD2 LEU 932 3HD2 LEU 932 -0.078 4.009 -1.186 136 H VAL 933 H VAL 933 4.355 4.354 -0.500 137 HA VAL 933 HA VAL 933 3.729 6.625 1.018 138 HB VAL 933 HB VAL 933 4.611 5.272 2.892 139 1HG1 VAL 933 1HG1 VAL 933 2.287 5.014 1.928 140 2HG1 VAL 933 2HG1 VAL 933 2.892 3.592 1.045 141 3HG1 VAL 933 3HG1 VAL 933 2.903 3.604 2.825 142 1HG2 VAL 933 1HG2 VAL 933 5.271 3.191 0.782 143 2HG2 VAL 933 2HG2 VAL 933 6.475 4.205 1.613 144 3HG2 VAL 933 3HG2 VAL 933 5.490 3.050 2.543 145 H LYS 934 H LYS 934 6.772 5.310 -0.318 146 HA LYS 934 HA LYS 934 8.542 6.796 1.223 147 1HB LYS 934 1HB LYS 934 8.707 5.625 -1.559 148 2HB LYS 934 2HB LYS 934 10.054 6.471 -0.824 149 1HG LYS 934 1HG LYS 934 8.822 4.480 0.989 150 2HG LYS 934 2HG LYS 934 9.448 3.764 -0.483 151 1HD LYS 934 1HD LYS 934 11.585 3.989 0.242 152 2HD LYS 934 2HD LYS 934 11.367 5.709 0.499 153 1HE LYS 934 1HE LYS 934 9.992 4.127 2.567 154 2HE LYS 934 2HE LYS 934 11.701 3.746 2.497 155 1HZ LYS 934 1HZ LYS 934 12.239 5.989 2.826 156 2HZ LYS 934 2HZ LYS 934 10.709 6.505 2.579 157 3HZ LYS 934 3HZ LYS 934 11.077 5.658 3.925 158 H ALA 935 H ALA 935 6.625 7.623 -1.692 159 HA ALA 935 HA ALA 935 7.899 10.216 -1.855 160 1HB ALA 935 1HB ALA 935 7.224 10.076 -3.995 161 2HB ALA 935 2HB ALA 935 6.594 8.451 -3.635 162 3HB ALA 935 3HB ALA 935 5.528 9.870 -3.496 163 H VAL 936 H VAL 936 4.697 8.759 -1.010 164 HA VAL 936 HA VAL 936 3.152 10.904 -0.657 165 HB VAL 936 HB VAL 936 3.099 8.274 0.078 166 1HG1 VAL 936 1HG1 VAL 936 2.817 9.859 2.652 167 2HG1 VAL 936 2HG1 VAL 936 2.623 8.102 2.437 168 3HG1 VAL 936 3HG1 VAL 936 4.225 8.851 2.235 169 1HG2 VAL 936 1HG2 VAL 936 1.103 9.199 -0.637 170 2HG2 VAL 936 2HG2 VAL 936 0.782 8.977 1.099 171 3HG2 VAL 936 3HG2 VAL 936 1.219 10.585 0.474 172 H ILE 937 H ILE 937 5.865 9.880 1.468 173 HA ILE 937 HA ILE 937 5.340 12.068 3.276 174 HB ILE 937 HB ILE 937 7.446 9.912 3.166 175 1HG1 ILE 937 1HG1 ILE 937 5.605 10.109 5.460 176 2HG1 ILE 937 2HG1 ILE 937 4.812 9.761 3.937 177 1HG2 ILE 937 1HG2 ILE 937 7.848 12.372 4.302 178 2HG2 ILE 937 2HG2 ILE 937 7.184 11.437 5.663 179 3HG2 ILE 937 3HG2 ILE 937 8.634 10.858 4.809 180 1HD1 ILE 937 1HD1 ILE 937 5.377 7.600 4.548 181 2HD1 ILE 937 2HD1 ILE 937 6.870 8.035 3.681 182 3HD1 ILE 937 3HD1 ILE 937 6.815 8.122 5.458 183 H GLU 938 H GLU 938 8.274 11.022 1.397 184 HA GLU 938 HA GLU 938 9.814 13.092 1.565 185 1HB GLU 938 1HB GLU 938 9.715 11.018 -0.156 186 2HB GLU 938 2HB GLU 938 9.262 12.284 -1.278 187 1HG GLU 938 1HG GLU 938 11.455 12.822 -1.479 188 2HG GLU 938 2HG GLU 938 11.432 13.371 0.185 189 H MET 939 H MET 939 6.787 13.068 -0.390 190 HA MET 939 HA MET 939 7.013 15.362 -1.748 191 1HB MET 939 1HB MET 939 4.900 13.635 -0.769 192 2HB MET 939 2HB MET 939 4.370 15.289 -0.537 193 1HG MET 939 1HG MET 939 4.838 15.797 -2.931 194 2HG MET 939 2HG MET 939 5.433 14.167 -3.176 195 1HE MET 939 1HE MET 939 1.092 15.227 -2.037 196 2HE MET 939 2HE MET 939 2.357 15.063 -0.795 197 3HE MET 939 3HE MET 939 2.480 16.341 -2.028 198 H SER 940 H SER 940 5.155 15.308 1.376 199 HA SER 940 HA SER 940 4.982 17.919 1.788 200 1HB SER 940 1HB SER 940 5.302 15.581 3.653 201 2HB SER 940 2HB SER 940 5.366 17.185 4.355 202 HG SER 940 HG SER 940 3.218 16.113 2.731 203 H SER 941 H SER 941 7.895 15.900 2.140 204 HA SER 941 HA SER 941 9.397 17.642 3.665 205 1HB SER 941 1HB SER 941 9.798 15.152 2.750 206 2HB SER 941 2HB SER 941 10.703 15.992 1.506 207 HG SER 941 HG SER 941 11.501 15.387 4.011 208 H LYS 942 H LYS 942 9.206 17.211 0.058 209 HA LYS 942 HA LYS 942 10.538 19.810 -0.206 210 1HB LYS 942 1HB LYS 942 11.355 19.116 -2.282 211 2HB LYS 942 2HB LYS 942 11.527 17.701 -1.263 212 1HG LYS 942 1HG LYS 942 10.052 16.486 -2.508 213 2HG LYS 942 2HG LYS 942 8.881 17.789 -2.550 214 1HD LYS 942 1HD LYS 942 10.983 18.712 -4.192 215 2HD LYS 942 2HD LYS 942 10.867 17.005 -4.574 216 1HE LYS 942 1HE LYS 942 8.703 17.191 -5.432 217 2HE LYS 942 2HE LYS 942 8.280 18.529 -4.382 218 1HZ LYS 942 1HZ LYS 942 8.724 18.975 -6.834 219 2HZ LYS 942 2HZ LYS 942 9.356 20.012 -5.741 220 3HZ LYS 942 3HZ LYS 942 10.309 18.889 -6.447 221 H ILE 943 H ILE 943 7.703 19.406 0.601 222 HA ILE 943 HA ILE 943 6.286 20.221 -1.808 223 HB ILE 943 HB ILE 943 5.588 18.510 0.129 224 1HG1 ILE 943 1HG1 ILE 943 4.488 19.157 -2.112 225 2HG1 ILE 943 2HG1 ILE 943 3.486 18.461 -0.854 226 1HG2 ILE 943 1HG2 ILE 943 4.498 21.191 1.019 227 2HG2 ILE 943 2HG2 ILE 943 3.860 19.617 1.553 228 3HG2 ILE 943 3HG2 ILE 943 5.536 20.076 1.940 229 1HD1 ILE 943 1HD1 ILE 943 2.292 20.368 -1.738 230 2HD1 ILE 943 2HD1 ILE 943 2.889 20.835 -0.127 231 3HD1 ILE 943 3HD1 ILE 943 3.728 21.409 -1.588 232 H GLN 944 H GLN 944 6.954 21.363 1.570 233 HA GLN 944 HA GLN 944 5.684 23.703 1.537 234 1HB GLN 944 1HB GLN 944 7.773 22.515 3.042 235 2HB GLN 944 2HB GLN 944 8.368 24.107 2.615 236 1HG GLN 944 1HG GLN 944 5.530 24.111 3.479 237 2HG GLN 944 2HG GLN 944 6.629 23.542 4.719 238 1HE2 GLN 944 1HE2 GLN 944 7.142 25.086 6.056 239 2HE2 GLN 944 2HE2 GLN 944 7.516 26.733 5.673 240 HA PRO 945 HA PRO 945 9.245 25.712 -0.869 241 1HB PRO 945 1HB PRO 945 11.205 24.159 -1.969 242 2HB PRO 945 2HB PRO 945 11.371 24.955 -0.417 243 1HG PRO 945 1HG PRO 945 10.883 22.096 -0.990 244 2HG PRO 945 2HG PRO 945 11.467 22.835 0.488 245 1HD PRO 945 1HD PRO 945 8.818 21.853 -0.011 246 2HD PRO 945 2HD PRO 945 9.371 22.696 1.423 247 H ALA 946 H ALA 946 8.804 22.507 -2.289 248 HA ALA 946 HA ALA 946 8.809 23.012 -4.881 249 1HB ALA 946 1HB ALA 946 7.038 21.340 -3.130 250 2HB ALA 946 2HB ALA 946 6.622 21.475 -4.855 251 3HB ALA 946 3HB ALA 946 8.213 20.842 -4.371 252 HA PRO 947 HA PRO 947 5.959 26.259 -5.463 253 1HB PRO 947 1HB PRO 947 6.314 26.583 -8.153 254 2HB PRO 947 2HB PRO 947 7.355 27.322 -6.953 255 1HG PRO 947 1HG PRO 947 7.894 24.994 -8.693 256 2HG PRO 947 2HG PRO 947 9.033 25.996 -7.816 257 1HD PRO 947 1HD PRO 947 8.149 23.366 -7.090 258 2HD PRO 947 2HD PRO 947 9.197 24.414 -6.156 259 HA PRO 948 HA PRO 948 2.328 24.685 -7.012 260 1HB PRO 948 1HB PRO 948 1.116 26.716 -8.380 261 2HB PRO 948 2HB PRO 948 1.109 26.601 -6.632 262 1HG PRO 948 1HG PRO 948 2.689 28.402 -8.364 263 2HG PRO 948 2HG PRO 948 2.345 28.548 -6.652 264 1HD PRO 948 1HD PRO 948 4.807 27.681 -7.840 265 2HD PRO 948 2HD PRO 948 4.424 27.717 -6.130 266 H GLU 949 H GLU 949 4.626 25.748 -9.246 267 HA GLU 949 HA GLU 949 3.163 24.619 -11.447 268 1HB GLU 949 1HB GLU 949 5.831 26.045 -11.182 269 2HB GLU 949 2HB GLU 949 5.374 25.252 -12.677 270 1HG GLU 949 1HG GLU 949 3.597 26.735 -13.092 271 2HG GLU 949 2HG GLU 949 3.382 27.126 -11.398 272 H GLU 950 H GLU 950 5.396 23.622 -8.995 273 HA GLU 950 HA GLU 950 6.136 21.318 -10.621 274 1HB GLU 950 1HB GLU 950 7.719 23.048 -9.031 275 2HB GLU 950 2HB GLU 950 7.612 21.562 -8.109 276 1HG GLU 950 1HG GLU 950 9.452 21.105 -9.485 277 2HG GLU 950 2HG GLU 950 8.152 20.379 -10.410 278 H TYR 951 H TYR 951 3.956 22.359 -8.287 279 HA TYR 951 HA TYR 951 4.007 19.899 -6.736 280 1HB TYR 951 1HB TYR 951 3.656 22.225 -5.752 281 2HB TYR 951 2HB TYR 951 2.253 22.435 -6.780 282 HD1 TYR 951 HD1 TYR 951 0.609 22.770 -5.086 283 HD2 TYR 951 HD2 TYR 951 3.103 19.296 -4.979 284 HE1 TYR 951 HE1 TYR 951 -0.864 21.760 -3.276 285 HE2 TYR 951 HE2 TYR 951 1.622 18.297 -3.170 286 HH TYR 951 HH TYR 951 -1.022 18.720 -2.574 287 H VAL 952 H VAL 952 1.956 21.673 -9.114 288 HA VAL 952 HA VAL 952 -0.313 20.186 -9.020 289 HB VAL 952 HB VAL 952 1.128 21.804 -11.004 290 1HG1 VAL 952 1HG1 VAL 952 -0.261 21.157 -12.910 291 2HG1 VAL 952 2HG1 VAL 952 0.729 19.784 -12.359 292 3HG1 VAL 952 3HG1 VAL 952 -1.001 19.855 -11.948 293 1HG2 VAL 952 1HG2 VAL 952 -1.813 21.851 -10.932 294 2HG2 VAL 952 2HG2 VAL 952 -1.047 22.117 -9.348 295 3HG2 VAL 952 3HG2 VAL 952 -0.637 23.170 -10.723 296 HA PRO 953 HA PRO 953 1.813 16.941 -11.734 297 1HB PRO 953 1HB PRO 953 4.526 17.003 -12.056 298 2HB PRO 953 2HB PRO 953 3.407 17.688 -13.218 299 1HG PRO 953 1HG PRO 953 5.125 19.080 -11.256 300 2HG PRO 953 2HG PRO 953 4.341 19.728 -12.683 301 1HD PRO 953 1HD PRO 953 3.506 20.071 -9.960 302 2HD PRO 953 2HD PRO 953 2.660 20.620 -11.393 303 H MET 954 H MET 954 4.217 17.880 -9.317 304 HA MET 954 HA MET 954 5.135 15.604 -8.478 305 1HB MET 954 1HB MET 954 4.633 18.160 -7.319 306 2HB MET 954 2HB MET 954 4.025 17.017 -6.138 307 1HG MET 954 1HG MET 954 6.436 15.838 -6.847 308 2HG MET 954 2HG MET 954 6.828 17.539 -6.992 309 1HE MET 954 1HE MET 954 5.256 19.002 -5.464 310 2HE MET 954 2HE MET 954 4.533 18.404 -3.951 311 3HE MET 954 3HE MET 954 6.130 19.191 -3.925 312 H VAL 955 H VAL 955 1.860 16.802 -7.451 313 HA VAL 955 HA VAL 955 1.254 14.435 -6.028 314 HB VAL 955 HB VAL 955 -0.329 16.782 -7.054 315 1HG1 VAL 955 1HG1 VAL 955 -2.155 15.809 -5.474 316 2HG1 VAL 955 2HG1 VAL 955 -2.002 15.159 -7.124 317 3HG1 VAL 955 3HG1 VAL 955 -1.328 14.256 -5.746 318 1HG2 VAL 955 1HG2 VAL 955 -0.559 16.574 -4.283 319 2HG2 VAL 955 2HG2 VAL 955 1.128 16.115 -4.616 320 3HG2 VAL 955 3HG2 VAL 955 0.504 17.683 -5.182 321 H LYS 956 H LYS 956 0.249 15.722 -9.272 322 HA LYS 956 HA LYS 956 -1.402 13.779 -10.099 323 1HB LYS 956 1HB LYS 956 0.739 15.280 -11.617 324 2HB LYS 956 2HB LYS 956 -0.395 14.209 -12.415 325 1HG LYS 956 1HG LYS 956 -1.469 16.300 -10.511 326 2HG LYS 956 2HG LYS 956 -0.947 16.805 -12.106 327 1HD LYS 956 1HD LYS 956 -2.606 14.372 -12.218 328 2HD LYS 956 2HD LYS 956 -3.449 15.697 -11.442 329 1HE LYS 956 1HE LYS 956 -2.058 16.735 -13.763 330 2HE LYS 956 2HE LYS 956 -2.961 15.314 -14.250 331 1HZ LYS 956 1HZ LYS 956 -4.089 17.619 -14.132 332 2HZ LYS 956 2HZ LYS 956 -4.918 16.284 -13.690 333 3HZ LYS 956 3HZ LYS 956 -4.280 17.263 -12.549 334 H GLU 957 H GLU 957 2.118 13.532 -9.613 335 HA GLU 957 HA GLU 957 2.373 11.100 -10.987 336 1HB GLU 957 1HB GLU 957 4.399 12.244 -10.732 337 2HB GLU 957 2HB GLU 957 4.064 12.697 -9.072 338 1HG GLU 957 1HG GLU 957 4.641 10.555 -8.227 339 2HG GLU 957 2HG GLU 957 4.405 9.769 -9.775 340 H VAL 958 H VAL 958 2.285 11.906 -7.438 341 HA VAL 958 HA VAL 958 2.379 9.380 -6.436 342 HB VAL 958 HB VAL 958 2.104 11.851 -5.431 343 1HG1 VAL 958 1HG1 VAL 958 -0.543 10.578 -4.699 344 2HG1 VAL 958 2HG1 VAL 958 0.032 12.227 -4.351 345 3HG1 VAL 958 3HG1 VAL 958 -0.382 11.761 -6.019 346 1HG2 VAL 958 1HG2 VAL 958 2.613 10.848 -3.475 347 2HG2 VAL 958 2HG2 VAL 958 1.180 9.793 -3.525 348 3HG2 VAL 958 3HG2 VAL 958 2.639 9.357 -4.446 349 H GLY 959 H GLY 959 -0.393 11.103 -7.924 350 1HA GLY 959 1HA GLY 959 -2.407 9.288 -7.201 351 2HA GLY 959 2HA GLY 959 -2.425 10.389 -8.565 352 H LEU 960 H LEU 960 -0.077 9.385 -9.960 353 HA LEU 960 HA LEU 960 -1.297 7.285 -11.382 354 1HB LEU 960 1HB LEU 960 0.792 9.112 -11.746 355 2HB LEU 960 2HB LEU 960 1.555 7.536 -11.820 356 HG LEU 960 HG LEU 960 -0.840 8.350 -13.489 357 1HD1 LEU 960 1HD1 LEU 960 1.766 9.278 -13.759 358 2HD1 LEU 960 2HD1 LEU 960 1.652 7.947 -14.935 359 3HD1 LEU 960 3HD1 LEU 960 0.491 9.294 -15.001 360 1HD2 LEU 960 1HD2 LEU 960 0.630 5.823 -13.104 361 2HD2 LEU 960 2HD2 LEU 960 -1.024 6.122 -13.688 362 3HD2 LEU 960 3HD2 LEU 960 0.355 6.287 -14.801 363 H ALA 961 H ALA 961 1.171 7.449 -8.789 364 HA ALA 961 HA ALA 961 2.115 4.857 -8.954 365 1HB ALA 961 1HB ALA 961 1.985 5.570 -6.218 366 2HB ALA 961 2HB ALA 961 3.355 5.796 -7.332 367 3HB ALA 961 3HB ALA 961 2.162 7.098 -7.113 368 H LEU 962 H LEU 962 -0.585 6.160 -6.890 369 HA LEU 962 HA LEU 962 -1.372 3.778 -5.798 370 1HB LEU 962 1HB LEU 962 -2.790 6.329 -6.472 371 2HB LEU 962 2HB LEU 962 -3.697 4.970 -5.840 372 HG LEU 962 HG LEU 962 -3.051 6.585 -4.098 373 1HD1 LEU 962 1HD1 LEU 962 -2.136 4.968 -2.480 374 2HD1 LEU 962 2HD1 LEU 962 -3.449 4.278 -3.464 375 3HD1 LEU 962 3HD1 LEU 962 -1.756 3.859 -3.820 376 1HD2 LEU 962 1HD2 LEU 962 -1.002 7.476 -4.882 377 2HD2 LEU 962 2HD2 LEU 962 -0.629 6.613 -3.370 378 3HD2 LEU 962 3HD2 LEU 962 -0.237 5.870 -4.940 379 H ARG 963 H ARG 963 -2.387 5.265 -8.938 380 HA ARG 963 HA ARG 963 -4.277 3.520 -9.664 381 1HB ARG 963 1HB ARG 963 -3.389 5.544 -10.960 382 2HB ARG 963 2HB ARG 963 -2.087 4.528 -11.546 383 1HG ARG 963 1HG ARG 963 -3.449 3.835 -13.220 384 2HG ARG 963 2HG ARG 963 -4.438 3.020 -12.024 385 1HD ARG 963 1HD ARG 963 -6.023 4.433 -13.017 386 2HD ARG 963 2HD ARG 963 -5.515 5.418 -11.660 387 HE ARG 963 HE ARG 963 -3.793 5.955 -13.894 388 1HH1 ARG 963 2HH2 ARG 963 -7.093 6.511 -12.808 389 2HH1 ARG 963 1HH2 ARG 963 -7.288 7.964 -13.731 390 1HH2 ARG 963 2HH1 ARG 963 -4.049 7.871 -15.112 391 2HH2 ARG 963 1HH1 ARG 963 -5.544 8.743 -15.050 392 H THR 964 H THR 964 -0.697 3.169 -10.195 393 HA THR 964 HA THR 964 -0.879 0.633 -11.417 394 HB THR 964 HB THR 964 1.325 2.249 -10.055 395 HG1 THR 964 HG1 THR 964 1.639 2.771 -12.228 396 1HG2 THR 964 1HG2 THR 964 2.862 0.635 -11.336 397 2HG2 THR 964 2HG2 THR 964 2.108 -0.052 -9.878 398 3HG2 THR 964 3HG2 THR 964 1.460 -0.451 -11.487 399 H LEU 965 H LEU 965 -0.094 1.614 -8.018 400 HA LEU 965 HA LEU 965 0.426 -0.760 -6.911 401 1HB LEU 965 1HB LEU 965 0.521 0.818 -5.338 402 2HB LEU 965 2HB LEU 965 -0.799 1.746 -6.023 403 HG LEU 965 HG LEU 965 -1.561 -0.794 -4.686 404 1HD1 LEU 965 1HD1 LEU 965 -0.027 1.328 -3.311 405 2HD1 LEU 965 2HD1 LEU 965 -1.523 0.805 -2.502 406 3HD1 LEU 965 3HD1 LEU 965 -0.260 -0.386 -2.893 407 1HD2 LEU 965 1HD2 LEU 965 -2.717 1.980 -4.370 408 2HD2 LEU 965 2HD2 LEU 965 -3.133 0.901 -5.724 409 3HD2 LEU 965 3HD2 LEU 965 -3.493 0.410 -4.051 410 H LEU 966 H LEU 966 -2.790 0.417 -7.984 411 HA LEU 966 HA LEU 966 -4.257 -1.688 -6.855 412 1HB LEU 966 1HB LEU 966 -4.729 0.306 -9.045 413 2HB LEU 966 2HB LEU 966 -5.879 -0.986 -8.766 414 HG LEU 966 HG LEU 966 -5.485 0.059 -6.223 415 1HD1 LEU 966 1HD1 LEU 966 -6.171 2.579 -7.114 416 2HD1 LEU 966 2HD1 LEU 966 -4.594 2.093 -6.446 417 3HD1 LEU 966 3HD1 LEU 966 -4.848 2.111 -8.208 418 1HD2 LEU 966 1HD2 LEU 966 -7.711 1.210 -7.804 419 2HD2 LEU 966 2HD2 LEU 966 -7.579 -0.565 -7.804 420 3HD2 LEU 966 3HD2 LEU 966 -7.726 0.317 -6.265 421 H ALA 967 H ALA 967 -3.239 -1.168 -10.311 422 HA ALA 967 HA ALA 967 -3.999 -3.609 -11.267 423 1HB ALA 967 1HB ALA 967 -2.279 -1.401 -12.046 424 2HB ALA 967 2HB ALA 967 -1.576 -2.952 -12.564 425 3HB ALA 967 3HB ALA 967 -3.225 -2.509 -13.068 426 H THR 968 H THR 968 -0.692 -2.713 -10.036 427 HA THR 968 HA THR 968 0.417 -5.231 -10.193 428 HB THR 968 HB THR 968 2.056 -4.296 -8.591 429 HG1 THR 968 HG1 THR 968 0.016 -2.209 -8.312 430 1HG2 THR 968 1HG2 THR 968 1.609 -3.127 -10.976 431 2HG2 THR 968 2HG2 THR 968 1.044 -1.790 -9.946 432 3HG2 THR 968 3HG2 THR 968 2.714 -2.388 -9.792 433 H VAL 969 H VAL 969 -1.637 -3.819 -7.603 434 HA VAL 969 HA VAL 969 -1.282 -5.913 -5.791 435 HB VAL 969 HB VAL 969 -3.302 -3.756 -6.251 436 1HG1 VAL 969 1HG1 VAL 969 -3.665 -6.179 -4.510 437 2HG1 VAL 969 2HG1 VAL 969 -4.290 -4.603 -3.970 438 3HG1 VAL 969 3HG1 VAL 969 -4.853 -5.305 -5.506 439 1HG2 VAL 969 1HG2 VAL 969 -0.948 -3.669 -5.020 440 2HG2 VAL 969 2HG2 VAL 969 -2.347 -2.742 -4.427 441 3HG2 VAL 969 3HG2 VAL 969 -1.910 -4.285 -3.654 442 H ASP 970 H ASP 970 -3.606 -5.397 -8.499 443 HA ASP 970 HA ASP 970 -5.326 -7.401 -8.041 444 1HB ASP 970 1HB ASP 970 -4.915 -5.691 -10.089 445 2HB ASP 970 2HB ASP 970 -4.231 -7.120 -10.838 446 H GLU 971 H GLU 971 -1.986 -7.531 -9.377 447 HA GLU 971 HA GLU 971 -2.168 -10.270 -10.067 448 1HB GLU 971 1HB GLU 971 0.141 -8.303 -9.851 449 2HB GLU 971 2HB GLU 971 0.398 -9.984 -10.274 450 1HG GLU 971 1HG GLU 971 -1.459 -9.578 -12.096 451 2HG GLU 971 2HG GLU 971 -1.154 -7.875 -11.814 452 H SER 972 H SER 972 -1.451 -8.422 -7.166 453 HA SER 972 HA SER 972 -0.053 -10.597 -5.941 454 1HB SER 972 1HB SER 972 0.783 -8.616 -5.091 455 2HB SER 972 2HB SER 972 -0.747 -7.773 -5.240 456 HG SER 972 HG SER 972 -1.051 -8.146 -3.163 457 H LEU 973 H LEU 973 -3.335 -9.328 -6.223 458 HA LEU 973 HA LEU 973 -4.582 -10.121 -3.975 459 1HB LEU 973 1HB LEU 973 -5.301 -9.372 -6.551 460 2HB LEU 973 2HB LEU 973 -6.058 -10.939 -6.348 461 HG LEU 973 HG LEU 973 -6.687 -8.346 -5.093 462 1HD1 LEU 973 1HD1 LEU 973 -8.734 -10.386 -4.967 463 2HD1 LEU 973 2HD1 LEU 973 -8.706 -8.851 -5.867 464 3HD1 LEU 973 3HD1 LEU 973 -8.000 -10.318 -6.587 465 1HD2 LEU 973 1HD2 LEU 973 -7.749 -9.732 -3.117 466 2HD2 LEU 973 2HD2 LEU 973 -6.382 -10.824 -3.446 467 3HD2 LEU 973 3HD2 LEU 973 -6.079 -9.121 -3.026 468 HA PRO 974 HA PRO 974 -4.624 -14.596 -5.486 469 1HB PRO 974 1HB PRO 974 -3.170 -15.329 -7.681 470 2HB PRO 974 2HB PRO 974 -4.878 -14.941 -7.748 471 1HG PRO 974 1HG PRO 974 -2.572 -13.319 -8.637 472 2HG PRO 974 2HG PRO 974 -4.262 -13.153 -9.069 473 1HD PRO 974 1HD PRO 974 -2.795 -11.522 -7.222 474 2HD PRO 974 2HD PRO 974 -4.511 -11.431 -7.567 475 H VAL 975 H VAL 975 -1.583 -12.959 -5.979 476 HA VAL 975 HA VAL 975 0.157 -14.950 -5.356 477 HB VAL 975 HB VAL 975 0.139 -12.007 -4.704 478 1HG1 VAL 975 1HG1 VAL 975 2.803 -13.060 -4.700 479 2HG1 VAL 975 2HG1 VAL 975 1.936 -12.205 -3.401 480 3HG1 VAL 975 3HG1 VAL 975 1.828 -13.977 -3.527 481 1HG2 VAL 975 1HG2 VAL 975 1.914 -13.431 -6.683 482 2HG2 VAL 975 2HG2 VAL 975 0.247 -12.975 -7.110 483 3HG2 VAL 975 3HG2 VAL 975 1.419 -11.722 -6.637 484 H LEU 976 H LEU 976 -2.092 -13.198 -3.217 485 HA LEU 976 HA LEU 976 -1.005 -14.722 -0.958 486 1HB LEU 976 1HB LEU 976 -2.613 -12.170 -1.071 487 2HB LEU 976 2HB LEU 976 -2.293 -13.052 0.408 488 HG LEU 976 HG LEU 976 -0.803 -11.076 -0.034 489 1HD1 LEU 976 1HD1 LEU 976 1.250 -12.195 0.717 490 2HD1 LEU 976 2HD1 LEU 976 -0.189 -12.794 1.576 491 3HD1 LEU 976 3HD1 LEU 976 0.546 -13.771 0.283 492 1HD2 LEU 976 1HD2 LEU 976 0.878 -11.109 -1.677 493 2HD2 LEU 976 2HD2 LEU 976 0.604 -12.827 -2.050 494 3HD2 LEU 976 3HD2 LEU 976 -0.607 -11.610 -2.519 495 HA PRO 977 HA PRO 977 -4.628 -17.070 -0.938 496 1HB PRO 977 1HB PRO 977 -4.634 -17.998 1.632 497 2HB PRO 977 2HB PRO 977 -3.648 -18.697 0.364 498 1HG PRO 977 1HG PRO 977 -2.825 -16.946 2.599 499 2HG PRO 977 2HG PRO 977 -1.832 -17.983 1.593 500 1HD PRO 977 1HD PRO 977 -2.070 -15.131 1.408 501 2HD PRO 977 2HD PRO 977 -1.169 -16.179 0.331 502 H ALA 978 H ALA 978 -6.839 -17.320 -0.198 503 HA ALA 978 HA ALA 978 -8.046 -14.879 0.145 504 1HB ALA 978 1HB ALA 978 -9.783 -16.711 1.313 505 2HB ALA 978 2HB ALA 978 -9.662 -16.350 -0.426 506 3HB ALA 978 3HB ALA 978 -8.767 -17.726 0.262 507 H SER 979 H SER 979 -9.623 -14.512 2.195 508 HA SER 979 HA SER 979 -9.869 -14.306 4.388 509 1HB SER 979 1HB SER 979 -8.168 -16.389 4.499 510 2HB SER 979 2HB SER 979 -7.069 -15.160 5.093 511 HG SER 979 HG SER 979 -8.585 -14.653 6.781 512 H THR 980 H THR 980 -7.229 -13.206 2.427 513 HA THR 980 HA THR 980 -6.874 -10.875 4.197 514 HB THR 980 HB THR 980 -4.910 -12.588 3.715 515 HG1 THR 980 HG1 THR 980 -4.097 -10.707 4.558 516 1HG2 THR 980 1HG2 THR 980 -4.973 -12.702 1.282 517 2HG2 THR 980 2HG2 THR 980 -5.086 -10.930 1.149 518 3HG2 THR 980 3HG2 THR 980 -3.575 -11.686 1.710 519 H HIS 981 H HIS 981 -8.155 -12.054 1.250 520 HA HIS 981 HA HIS 981 -7.646 -9.796 -0.349 521 1HB HIS 981 1HB HIS 981 -9.928 -11.775 -0.569 522 2HB HIS 981 2HB HIS 981 -9.317 -10.729 -1.836 523 HD1 HIS 981 HD1 HIS 981 -9.233 -13.425 -2.809 524 HD2 HIS 981 HD2 HIS 981 -6.215 -12.064 -0.233 525 HE1 HIS 981 HE1 HIS 981 -7.247 -14.992 -3.145 526 H ARG 982 H ARG 982 -10.593 -10.861 1.498 527 HA ARG 982 HA ARG 982 -12.267 -8.914 1.008 528 1HB ARG 982 1HB ARG 982 -11.613 -10.490 3.451 529 2HB ARG 982 2HB ARG 982 -12.527 -9.031 3.776 530 1HG ARG 982 1HG ARG 982 -14.303 -9.705 2.246 531 2HG ARG 982 2HG ARG 982 -13.350 -11.043 1.636 532 1HD ARG 982 1HD ARG 982 -13.939 -10.922 4.602 533 2HD ARG 982 2HD ARG 982 -15.214 -11.434 3.514 534 HE ARG 982 HE ARG 982 -12.870 -12.967 4.247 535 1HH1 ARG 982 2HH2 ARG 982 -15.099 -12.381 1.588 536 2HH1 ARG 982 1HH2 ARG 982 -14.846 -13.935 0.865 537 1HH2 ARG 982 2HH1 ARG 982 -12.536 -15.017 3.294 538 2HH2 ARG 982 1HH1 ARG 982 -13.378 -15.444 1.843 539 H GLU 983 H GLU 983 -10.173 -8.619 3.974 540 HA GLU 983 HA GLU 983 -10.581 -5.968 4.355 541 1HB GLU 983 1HB GLU 983 -9.102 -7.947 5.581 542 2HB GLU 983 2HB GLU 983 -7.827 -6.905 4.983 543 1HG GLU 983 1HG GLU 983 -8.351 -5.204 6.434 544 2HG GLU 983 2HG GLU 983 -10.078 -5.423 6.231 545 H ILE 984 H ILE 984 -8.141 -7.599 2.267 546 HA ILE 984 HA ILE 984 -6.590 -5.411 1.643 547 HB ILE 984 HB ILE 984 -7.217 -8.031 0.422 548 1HG1 ILE 984 1HG1 ILE 984 -4.602 -6.600 0.974 549 2HG1 ILE 984 2HG1 ILE 984 -5.426 -7.642 2.117 550 1HG2 ILE 984 1HG2 ILE 984 -7.422 -6.612 -1.539 551 2HG2 ILE 984 2HG2 ILE 984 -5.873 -5.821 -1.158 552 3HG2 ILE 984 3HG2 ILE 984 -5.907 -7.544 -1.603 553 1HD1 ILE 984 1HD1 ILE 984 -5.400 -9.331 0.000 554 2HD1 ILE 984 2HD1 ILE 984 -3.964 -8.358 -0.401 555 3HD1 ILE 984 3HD1 ILE 984 -4.046 -9.225 1.151 556 H GLU 985 H GLU 985 -9.682 -6.555 0.166 557 HA GLU 985 HA GLU 985 -9.758 -4.762 -1.894 558 1HB GLU 985 1HB GLU 985 -11.372 -6.761 -1.053 559 2HB GLU 985 2HB GLU 985 -12.327 -5.409 -0.477 560 1HG GLU 985 1HG GLU 985 -11.401 -4.810 -3.160 561 2HG GLU 985 2HG GLU 985 -12.121 -6.408 -3.161 562 H MET 986 H MET 986 -10.969 -4.415 1.502 563 HA MET 986 HA MET 986 -11.920 -1.801 1.031 564 1HB MET 986 1HB MET 986 -11.582 -3.695 3.343 565 2HB MET 986 2HB MET 986 -11.638 -1.997 3.774 566 1HG MET 986 1HG MET 986 -13.861 -1.771 3.174 567 2HG MET 986 2HG MET 986 -13.718 -2.862 1.811 568 1HE MET 986 1HE MET 986 -13.740 -5.028 1.707 569 2HE MET 986 2HE MET 986 -13.141 -6.051 3.035 570 3HE MET 986 3HE MET 986 -14.883 -5.990 2.675 571 H ALA 987 H ALA 987 -8.831 -3.235 2.007 572 HA ALA 987 HA ALA 987 -7.734 -0.944 3.218 573 1HB ALA 987 1HB ALA 987 -7.019 -3.624 2.741 574 2HB ALA 987 2HB ALA 987 -5.792 -2.660 1.885 575 3HB ALA 987 3HB ALA 987 -6.071 -2.404 3.625 576 H GLN 988 H GLN 988 -8.363 -1.887 -0.111 577 HA GLN 988 HA GLN 988 -6.420 -0.093 -1.170 578 1HB GLN 988 1HB GLN 988 -8.645 -1.761 -2.400 579 2HB GLN 988 2HB GLN 988 -7.678 -0.662 -3.363 580 1HG GLN 988 1HG GLN 988 -5.825 -2.153 -1.779 581 2HG GLN 988 2HG GLN 988 -6.990 -3.316 -2.379 582 1HE2 GLN 988 1HE2 GLN 988 -4.542 -0.986 -3.183 583 2HE2 GLN 988 2HE2 GLN 988 -4.325 -1.405 -4.849 584 H LYS 989 H LYS 989 -10.002 -0.183 -0.721 585 HA LYS 989 HA LYS 989 -10.562 2.194 -2.054 586 1HB LYS 989 1HB LYS 989 -12.057 0.245 -1.006 587 2HB LYS 989 2HB LYS 989 -12.182 1.381 0.322 588 1HG LYS 989 1HG LYS 989 -12.705 3.149 -1.586 589 2HG LYS 989 2HG LYS 989 -13.069 1.735 -2.555 590 1HD LYS 989 1HD LYS 989 -14.333 1.391 0.020 591 2HD LYS 989 2HD LYS 989 -14.717 3.001 -0.554 592 1HE LYS 989 1HE LYS 989 -15.062 0.468 -2.228 593 2HE LYS 989 2HE LYS 989 -16.354 1.221 -1.314 594 1HZ LYS 989 1HZ LYS 989 -15.209 2.021 -3.784 595 2HZ LYS 989 2HZ LYS 989 -16.656 2.412 -3.136 596 3HZ LYS 989 3HZ LYS 989 -15.322 3.261 -2.728 597 H LEU 990 H LEU 990 -9.437 1.507 1.279 598 HA LEU 990 HA LEU 990 -9.872 4.078 2.291 599 1HB LEU 990 1HB LEU 990 -9.106 1.678 3.295 600 2HB LEU 990 2HB LEU 990 -7.574 2.528 3.311 601 HG LEU 990 HG LEU 990 -10.130 3.460 4.649 602 1HD1 LEU 990 1HD1 LEU 990 -9.298 1.600 5.863 603 2HD1 LEU 990 2HD1 LEU 990 -7.618 2.175 5.737 604 3HD1 LEU 990 3HD1 LEU 990 -8.787 3.056 6.749 605 1HD2 LEU 990 1HD2 LEU 990 -7.710 4.887 3.929 606 2HD2 LEU 990 2HD2 LEU 990 -9.238 5.494 4.609 607 3HD2 LEU 990 3HD2 LEU 990 -7.964 4.881 5.691 608 H LEU 991 H LEU 991 -6.812 2.545 1.056 609 HA LEU 991 HA LEU 991 -5.276 4.827 1.171 610 1HB LEU 991 1HB LEU 991 -4.346 2.636 0.873 611 2HB LEU 991 2HB LEU 991 -5.157 2.438 -0.667 612 HG LEU 991 HG LEU 991 -3.781 4.449 -1.477 613 1HD1 LEU 991 1HD1 LEU 991 -1.536 4.010 0.216 614 2HD1 LEU 991 2HD1 LEU 991 -2.457 5.509 -0.053 615 3HD1 LEU 991 3HD1 LEU 991 -2.937 4.392 1.247 616 1HD2 LEU 991 1HD2 LEU 991 -3.213 2.423 -2.439 617 2HD2 LEU 991 2HD2 LEU 991 -1.682 2.926 -1.681 618 3HD2 LEU 991 3HD2 LEU 991 -2.708 1.705 -0.890 619 H ASN 992 H ASN 992 -7.466 3.631 -1.433 620 HA ASN 992 HA ASN 992 -6.776 5.559 -3.281 621 1HB ASN 992 1HB ASN 992 -9.118 3.729 -2.811 622 2HB ASN 992 2HB ASN 992 -9.402 5.072 -3.900 623 1HD2 ASN 992 1HD2 ASN 992 -7.856 2.051 -3.397 624 2HD2 ASN 992 2HD2 ASN 992 -7.138 1.845 -4.960 625 H SER 993 H SER 993 -9.270 5.419 -0.662 626 HA SER 993 HA SER 993 -10.686 7.653 -1.265 627 1HB SER 993 1HB SER 993 -10.481 5.849 0.897 628 2HB SER 993 2HB SER 993 -10.215 7.422 1.622 629 HG SER 993 HG SER 993 -12.558 6.314 0.777 630 H ASP 994 H ASP 994 -8.043 7.508 1.244 631 HA ASP 994 HA ASP 994 -7.824 10.185 1.603 632 1HB ASP 994 1HB ASP 994 -5.946 7.845 1.877 633 2HB ASP 994 2HB ASP 994 -5.248 9.447 2.005 634 H LEU 995 H LEU 995 -6.562 8.063 -0.975 635 HA LEU 995 HA LEU 995 -4.581 9.728 -1.997 636 1HB LEU 995 1HB LEU 995 -4.334 7.762 -2.991 637 2HB LEU 995 2HB LEU 995 -6.015 7.321 -2.762 638 HG LEU 995 HG LEU 995 -6.609 8.687 -4.767 639 1HD1 LEU 995 1HD1 LEU 995 -3.606 8.993 -4.985 640 2HD1 LEU 995 2HD1 LEU 995 -4.740 9.292 -6.324 641 3HD1 LEU 995 3HD1 LEU 995 -4.831 10.277 -4.844 642 1HD2 LEU 995 1HD2 LEU 995 -6.561 6.483 -5.341 643 2HD2 LEU 995 2HD2 LEU 995 -5.246 7.077 -6.382 644 3HD2 LEU 995 3HD2 LEU 995 -4.866 6.268 -4.843 645 H ALA 996 H ALA 996 -8.036 9.331 -3.060 646 HA ALA 996 HA ALA 996 -8.003 11.347 -4.943 647 1HB ALA 996 1HB ALA 996 -10.144 10.100 -3.204 648 2HB ALA 996 2HB ALA 996 -10.536 11.400 -4.355 649 3HB ALA 996 3HB ALA 996 -9.840 9.871 -4.943 650 H GLU 997 H GLU 997 -8.994 11.499 -1.449 651 HA GLU 997 HA GLU 997 -9.612 14.145 -1.397 652 1HB GLU 997 1HB GLU 997 -9.930 12.413 0.439 653 2HB GLU 997 2HB GLU 997 -8.239 12.614 0.853 654 1HG GLU 997 1HG GLU 997 -9.150 14.175 2.306 655 2HG GLU 997 2HG GLU 997 -8.903 15.213 0.916 656 H LEU 998 H LEU 998 -6.431 12.562 -1.451 657 HA LEU 998 HA LEU 998 -4.977 14.850 -0.612 658 1HB LEU 998 1HB LEU 998 -4.327 12.373 -0.533 659 2HB LEU 998 2HB LEU 998 -3.920 12.542 -2.229 660 HG LEU 998 HG LEU 998 -2.731 14.395 -0.170 661 1HD1 LEU 998 1HD1 LEU 998 -2.279 11.533 -0.389 662 2HD1 LEU 998 2HD1 LEU 998 -0.792 12.465 -0.686 663 3HD1 LEU 998 3HD1 LEU 998 -1.700 12.696 0.827 664 1HD2 LEU 998 1HD2 LEU 998 -2.631 14.515 -2.853 665 2HD2 LEU 998 2HD2 LEU 998 -1.308 15.062 -1.796 666 3HD2 LEU 998 3HD2 LEU 998 -1.234 13.454 -2.554 667 H ILE 999 H ILE 999 -5.683 13.327 -3.826 668 HA ILE 999 HA ILE 999 -4.278 15.051 -5.406 669 HB ILE 999 HB ILE 999 -6.935 13.704 -5.895 670 1HG1 ILE 999 1HG1 ILE 999 -5.012 12.232 -5.292 671 2HG1 ILE 999 2HG1 ILE 999 -5.679 11.931 -6.884 672 1HG2 ILE 999 1HG2 ILE 999 -5.195 15.361 -7.671 673 2HG2 ILE 999 2HG2 ILE 999 -5.984 13.919 -8.354 674 3HG2 ILE 999 3HG2 ILE 999 -6.967 15.206 -7.616 675 1HD1 ILE 999 1HD1 ILE 999 -3.390 11.969 -7.359 676 2HD1 ILE 999 2HD1 ILE 999 -3.824 13.666 -7.676 677 3HD1 ILE 999 3HD1 ILE 999 -3.052 13.218 -6.136 678 H ASN1000 H ASN1000 -7.636 15.448 -4.110 679 HA ASN1000 HA ASN1000 -8.108 17.855 -5.370 680 1HB ASN1000 1HB ASN1000 -9.751 16.309 -4.080 681 2HB ASN1000 2HB ASN1000 -9.168 17.067 -2.611 682 1HD2 ASN1000 1HD2 ASN1000 -11.476 17.616 -2.466 683 2HD2 ASN1000 2HD2 ASN1000 -12.044 19.083 -3.192 684 H LYS1001 H LYS1001 -7.007 17.079 -1.980 685 HA LYS1001 HA LYS1001 -6.772 19.529 -0.911 686 1HB LYS1001 1HB LYS1001 -5.141 17.025 -0.643 687 2HB LYS1001 2HB LYS1001 -4.609 18.475 0.182 688 1HG LYS1001 1HG LYS1001 -7.457 17.407 0.409 689 2HG LYS1001 2HG LYS1001 -6.179 16.931 1.511 690 1HD LYS1001 1HD LYS1001 -6.663 19.879 1.037 691 2HD LYS1001 2HD LYS1001 -7.772 19.002 2.072 692 1HE LYS1001 1HE LYS1001 -6.195 18.680 3.738 693 2HE LYS1001 2HE LYS1001 -4.869 18.513 2.606 694 1HZ LYS1001 1HZ LYS1001 -4.392 20.619 2.938 695 2HZ LYS1001 2HZ LYS1001 -5.866 21.102 2.428 696 3HZ LYS1001 3HZ LYS1001 -5.616 20.770 4.008 697 H MET1002 H MET1002 -4.525 18.002 -3.277 698 HA MET1002 HA MET1002 -2.644 20.053 -3.165 699 1HB MET1002 1HB MET1002 -1.994 17.940 -4.132 700 2HB MET1002 2HB MET1002 -3.393 17.894 -5.186 701 1HG MET1002 1HG MET1002 -1.419 20.165 -5.506 702 2HG MET1002 2HG MET1002 -0.988 18.585 -6.131 703 1HE MET1002 1HE MET1002 -0.964 18.355 -8.151 704 2HE MET1002 2HE MET1002 -2.490 17.600 -8.669 705 3HE MET1002 3HE MET1002 -1.933 19.103 -9.444 706 H LYS1003 H LYS1003 -5.447 19.426 -5.373 707 HA LYS1003 HA LYS1003 -5.008 21.541 -7.102 708 1HB LYS1003 1HB LYS1003 -7.150 19.665 -6.467 709 2HB LYS1003 2HB LYS1003 -7.779 21.234 -6.928 710 1HG LYS1003 1HG LYS1003 -6.059 21.114 -8.906 711 2HG LYS1003 2HG LYS1003 -5.947 19.407 -8.524 712 1HD LYS1003 1HD LYS1003 -7.646 19.554 -10.201 713 2HD LYS1003 2HD LYS1003 -8.514 19.315 -8.697 714 1HE LYS1003 1HE LYS1003 -9.164 21.620 -8.567 715 2HE LYS1003 2HE LYS1003 -7.960 22.119 -9.737 716 1HZ LYS1003 1HZ LYS1003 -9.363 21.689 -11.364 717 2HZ LYS1003 2HZ LYS1003 -9.689 20.181 -10.829 718 3HZ LYS1003 3HZ LYS1003 -10.541 21.451 -10.258 719 H LEU1004 H LEU1004 -6.148 21.466 -3.769 720 HA LEU1004 HA LEU1004 -7.241 24.131 -3.938 721 1HB LEU1004 1HB LEU1004 -6.756 22.483 -1.463 722 2HB LEU1004 2HB LEU1004 -7.858 23.830 -1.668 723 HG LEU1004 HG LEU1004 -8.210 21.300 -3.266 724 1HD1 LEU1004 1HD1 LEU1004 -8.430 21.549 -0.394 725 2HD1 LEU1004 2HD1 LEU1004 -10.013 21.184 -1.123 726 3HD1 LEU1004 3HD1 LEU1004 -8.622 20.117 -1.434 727 1HD2 LEU1004 1HD2 LEU1004 -10.597 22.685 -2.364 728 2HD2 LEU1004 2HD2 LEU1004 -9.507 23.766 -3.265 729 3HD2 LEU1004 3HD2 LEU1004 -10.075 22.252 -4.010 730 H ALA1005 H ALA1005 -4.486 22.485 -2.233 731 HA ALA1005 HA ALA1005 -3.334 24.631 -1.063 732 1HB ALA1005 1HB ALA1005 -1.150 23.223 -1.959 733 2HB ALA1005 2HB ALA1005 -2.139 22.770 -0.550 734 3HB ALA1005 3HB ALA1005 -2.448 22.017 -2.133 735 H GLN1006 H GLN1006 -3.032 23.594 -4.513 736 HA GLN1006 HA GLN1006 -1.124 25.221 -5.389 737 1HB GLN1006 1HB GLN1006 -3.221 23.736 -6.542 738 2HB GLN1006 2HB GLN1006 -3.429 25.346 -7.202 739 1HG GLN1006 1HG GLN1006 -0.728 25.122 -7.476 740 2HG GLN1006 2HG GLN1006 -1.152 23.423 -7.559 741 1HE2 GLN1006 1HE2 GLN1006 -0.305 25.697 -9.481 742 2HE2 GLN1006 2HE2 GLN1006 -1.342 25.505 -10.855 743 H GLN1007 H GLN1007 -4.543 26.149 -4.699 744 HA GLN1007 HA GLN1007 -4.143 28.800 -5.591 745 1HB GLN1007 1HB GLN1007 -6.360 27.575 -5.538 746 2HB GLN1007 2HB GLN1007 -6.347 27.706 -3.790 747 1HG GLN1007 1HG GLN1007 -5.828 30.330 -4.581 748 2HG GLN1007 2HG GLN1007 -6.926 29.778 -5.830 749 1HE2 GLN1007 1HE2 GLN1007 -9.008 29.856 -5.450 750 2HE2 GLN1007 2HE2 GLN1007 -9.785 29.995 -3.908 751 H TYR1008 H TYR1008 -5.144 27.683 -2.280 752 HA TYR1008 HA TYR1008 -4.687 29.751 -0.767 753 1HB TYR1008 1HB TYR1008 -3.702 26.855 -0.539 754 2HB TYR1008 2HB TYR1008 -3.479 27.953 0.809 755 HD1 TYR1008 HD1 TYR1008 -5.981 26.164 -1.236 756 HD2 TYR1008 HD2 TYR1008 -5.343 28.643 2.193 757 HE1 TYR1008 HE1 TYR1008 -8.334 25.655 -0.421 758 HE2 TYR1008 HE2 TYR1008 -7.699 28.125 2.996 759 HH TYR1008 HH TYR1008 -9.431 25.633 2.010 760 H VAL1009 H VAL1009 -2.046 27.872 -2.323 761 HA VAL1009 HA VAL1009 0.160 28.680 -1.091 762 HB VAL1009 HB VAL1009 -0.430 28.578 -4.048 763 1HG1 VAL1009 1HG1 VAL1009 2.003 28.437 -4.418 764 2HG1 VAL1009 2HG1 VAL1009 1.530 30.004 -3.719 765 3HG1 VAL1009 3HG1 VAL1009 2.281 28.761 -2.690 766 1HG2 VAL1009 1HG2 VAL1009 -0.263 26.365 -3.824 767 2HG2 VAL1009 2HG2 VAL1009 1.321 26.523 -3.027 768 3HG2 VAL1009 3HG2 VAL1009 -0.171 26.587 -2.060 769 H MET1010 H MET1010 -1.646 30.701 -3.505 770 HA MET1010 HA MET1010 -0.230 32.834 -3.792 771 1HB MET1010 1HB MET1010 -2.521 34.144 -3.202 772 2HB MET1010 2HB MET1010 -2.419 33.091 -4.599 773 1HG MET1010 1HG MET1010 -3.948 31.648 -3.724 774 2HG MET1010 2HG MET1010 -3.066 31.525 -2.215 775 1HE MET1010 1HE MET1010 -5.705 31.096 -1.968 776 2HE MET1010 2HE MET1010 -5.282 31.756 -0.370 777 3HE MET1010 3HE MET1010 -6.723 32.355 -1.227 778 H THR1011 H THR1011 -2.464 32.820 -0.919 779 HA THR1011 HA THR1011 -0.944 34.862 0.363 780 HB THR1011 HB THR1011 -3.463 34.451 0.526 781 HG1 THR1011 HG1 THR1011 -2.932 35.640 2.316 782 1HG2 THR1011 1HG2 THR1011 -4.014 32.267 1.062 783 2HG2 THR1011 2HG2 THR1011 -2.418 31.947 1.784 784 3HG2 THR1011 3HG2 THR1011 -3.666 32.799 2.724 785 H SER1012 H SER1012 -1.347 33.488 3.073 786 HA SER1012 HA SER1012 1.134 31.966 2.897 787 1HB SER1012 1HB SER1012 1.667 32.714 5.133 788 2HB SER1012 2HB SER1012 1.216 34.126 4.199 789 HG SER1012 HG SER1012 -0.989 33.871 5.130 790 H LEU1013 H LEU1013 -2.254 32.012 3.826 791 HA LEU1013 HA LEU1013 -2.535 30.218 5.783 792 1HB LEU1013 1HB LEU1013 -4.188 31.397 4.035 793 2HB LEU1013 2HB LEU1013 -4.230 29.770 3.386 794 HG LEU1013 HG LEU1013 -4.938 30.580 6.220 795 1HD1 LEU1013 1HD1 LEU1013 -6.765 31.271 5.021 796 2HD1 LEU1013 2HD1 LEU1013 -6.547 30.039 3.755 797 3HD1 LEU1013 3HD1 LEU1013 -7.209 29.578 5.341 798 1HD2 LEU1013 1HD2 LEU1013 -5.706 28.230 6.468 799 2HD2 LEU1013 2HD2 LEU1013 -4.948 27.852 4.902 800 3HD2 LEU1013 3HD2 LEU1013 -3.944 28.388 6.271 801 H GLN1014 H GLN1014 -1.267 29.602 2.531 802 HA GLN1014 HA GLN1014 -1.600 27.019 2.140 803 1HB GLN1014 1HB GLN1014 -0.048 28.797 0.960 804 2HB GLN1014 2HB GLN1014 1.218 28.111 1.959 805 1HG GLN1014 1HG GLN1014 0.482 25.797 1.068 806 2HG GLN1014 2HG GLN1014 -0.499 26.660 -0.100 807 1HE2 GLN1014 1HE2 GLN1014 1.554 24.939 -0.802 808 2HE2 GLN1014 2HE2 GLN1014 2.835 25.817 -1.570 809 H GLN1015 H GLN1015 1.017 28.365 4.281 810 HA GLN1015 HA GLN1015 2.221 26.165 5.091 811 1HB GLN1015 1HB GLN1015 2.301 27.329 7.439 812 2HB GLN1015 2HB GLN1015 3.006 28.148 6.060 813 1HG GLN1015 1HG GLN1015 1.531 29.870 6.223 814 2HG GLN1015 2HG GLN1015 0.160 28.778 6.242 815 1HE2 GLN1015 1HE2 GLN1015 1.231 31.221 7.834 816 2HE2 GLN1015 2HE2 GLN1015 0.927 30.814 9.490 817 H GLU1016 H GLU1016 -1.020 27.280 6.206 818 HA GLU1016 HA GLU1016 -1.328 25.380 8.190 819 1HB GLU1016 1HB GLU1016 -2.737 27.511 7.578 820 2HB GLU1016 2HB GLU1016 -3.643 26.430 6.538 821 1HG GLU1016 1HG GLU1016 -3.757 24.889 8.702 822 2HG GLU1016 2HG GLU1016 -3.379 26.372 9.556 823 H TYR1017 H TYR1017 -2.478 25.386 4.741 824 HA TYR1017 HA TYR1017 -3.636 22.861 4.800 825 1HB TYR1017 1HB TYR1017 -2.583 24.917 2.892 826 2HB TYR1017 2HB TYR1017 -2.543 23.297 2.224 827 HD1 TYR1017 HD1 TYR1017 -4.896 25.598 4.029 828 HD2 TYR1017 HD2 TYR1017 -4.427 22.500 1.115 829 HE1 TYR1017 HE1 TYR1017 -7.361 25.776 3.432 830 HE2 TYR1017 HE2 TYR1017 -6.894 22.689 0.528 831 HH TYR1017 HH TYR1017 -9.037 23.560 2.022 832 H LYS1018 H LYS1018 -0.240 23.905 4.312 833 HA LYS1018 HA LYS1018 0.805 21.623 3.220 834 1HB LYS1018 1HB LYS1018 1.788 23.941 4.722 835 2HB LYS1018 2HB LYS1018 2.767 22.508 4.968 836 1HG LYS1018 1HG LYS1018 3.766 23.198 3.013 837 2HG LYS1018 2HG LYS1018 2.440 22.321 2.276 838 1HD LYS1018 1HD LYS1018 1.706 24.236 1.314 839 2HD LYS1018 2HD LYS1018 1.434 24.930 2.900 840 1HE LYS1018 1HE LYS1018 4.129 24.952 1.458 841 2HE LYS1018 2HE LYS1018 2.999 26.291 1.453 842 1HZ LYS1018 1HZ LYS1018 3.427 26.748 3.604 843 2HZ LYS1018 2HZ LYS1018 3.745 25.204 4.028 844 3HZ LYS1018 3HZ LYS1018 4.871 26.081 3.235 845 H LYS1019 H LYS1019 0.204 22.386 6.707 846 HA LYS1019 HA LYS1019 1.243 19.981 7.676 847 1HB LYS1019 1HB LYS1019 -0.519 22.155 8.722 848 2HB LYS1019 2HB LYS1019 -0.484 20.642 9.603 849 1HG LYS1019 1HG LYS1019 1.286 21.826 10.602 850 2HG LYS1019 2HG LYS1019 2.130 20.841 9.423 851 1HD LYS1019 1HD LYS1019 1.156 23.548 8.525 852 2HD LYS1019 2HD LYS1019 2.526 23.506 9.616 853 1HE LYS1019 1HE LYS1019 2.706 21.551 7.380 854 2HE LYS1019 2HE LYS1019 2.683 23.224 6.861 855 1HZ LYS1019 1HZ LYS1019 4.388 23.368 8.858 856 2HZ LYS1019 2HZ LYS1019 4.670 21.827 8.399 857 3HZ LYS1019 3HZ LYS1019 4.849 23.044 7.325 858 H GLN1020 H GLN1020 -2.041 20.942 6.550 859 HA GLN1020 HA GLN1020 -3.403 18.739 7.373 860 1HB GLN1020 1HB GLN1020 -3.781 20.251 4.750 861 2HB GLN1020 2HB GLN1020 -4.989 19.252 5.533 862 1HG GLN1020 1HG GLN1020 -3.768 21.831 6.615 863 2HG GLN1020 2HG GLN1020 -5.424 21.591 6.096 864 1HE2 GLN1020 1HE2 GLN1020 -4.053 22.326 8.693 865 2HE2 GLN1020 2HE2 GLN1020 -4.755 21.294 9.894 866 H MET1021 H MET1021 -1.660 19.231 4.222 867 HA MET1021 HA MET1021 -2.234 16.892 3.034 868 1HB MET1021 1HB MET1021 -0.369 19.006 2.729 869 2HB MET1021 2HB MET1021 0.640 17.576 2.808 870 1HG MET1021 1HG MET1021 -1.649 17.016 1.105 871 2HG MET1021 2HG MET1021 -0.904 18.513 0.579 872 1HE MET1021 1HE MET1021 1.281 15.662 2.428 873 2HE MET1021 2HE MET1021 -0.253 14.984 1.832 874 3HE MET1021 3HE MET1021 1.285 14.498 1.081 875 H LEU1022 H LEU1022 0.520 17.493 5.329 876 HA LEU1022 HA LEU1022 1.594 14.963 5.275 877 1HB LEU1022 1HB LEU1022 2.413 17.136 6.360 878 2HB LEU1022 2HB LEU1022 1.444 16.675 7.745 879 HG LEU1022 HG LEU1022 3.911 16.099 7.827 880 1HD1 LEU1022 1HD1 LEU1022 2.725 15.071 9.499 881 2HD1 LEU1022 2HD1 LEU1022 1.671 14.189 8.368 882 3HD1 LEU1022 3HD1 LEU1022 3.349 13.654 8.622 883 1HD2 LEU1022 1HD2 LEU1022 3.861 15.259 5.391 884 2HD2 LEU1022 2HD2 LEU1022 4.820 14.350 6.583 885 3HD2 LEU1022 3HD2 LEU1022 3.224 13.745 6.077 886 H THR1023 H THR1023 -1.058 16.279 7.360 887 HA THR1023 HA THR1023 -1.525 14.232 9.031 888 HB THR1023 HB THR1023 -3.817 15.497 7.487 889 HG1 THR1023 HG1 THR1023 -1.974 16.673 9.449 890 1HG2 THR1023 1HG2 THR1023 -4.808 15.718 9.681 891 2HG2 THR1023 2HG2 THR1023 -4.130 14.073 9.635 892 3HG2 THR1023 3HG2 THR1023 -3.260 15.371 10.488 893 H ALA1024 H ALA1024 -2.897 14.367 5.672 894 HA ALA1024 HA ALA1024 -3.979 11.795 5.802 895 1HB ALA1024 1HB ALA1024 -3.058 12.823 3.167 896 2HB ALA1024 2HB ALA1024 -4.670 12.271 3.681 897 3HB ALA1024 3HB ALA1024 -4.118 13.913 4.092 898 H ALA1025 H ALA1025 -0.809 13.043 4.578 899 HA ALA1025 HA ALA1025 0.192 10.752 3.497 900 1HB ALA1025 1HB ALA1025 2.359 11.747 3.849 901 2HB ALA1025 2HB ALA1025 1.207 13.072 3.557 902 3HB ALA1025 3HB ALA1025 1.755 12.718 5.213 903 H HIS1026 H HIS1026 -0.245 11.625 6.932 904 HA HIS1026 HA HIS1026 1.380 9.574 7.951 905 1HB HIS1026 1HB HIS1026 0.085 11.761 8.971 906 2HB HIS1026 2HB HIS1026 -0.911 10.459 9.590 907 HD1 HIS1026 HD1 HIS1026 2.815 11.373 9.466 908 HD2 HIS1026 HD2 HIS1026 0.055 9.355 11.896 909 HE1 HIS1026 HE1 HIS1026 4.082 10.692 11.574 910 H ALA1027 H ALA1027 -2.213 9.850 7.495 911 HA ALA1027 HA ALA1027 -2.721 7.214 8.332 912 1HB ALA1027 1HB ALA1027 -4.164 9.530 7.508 913 2HB ALA1027 2HB ALA1027 -4.702 8.182 6.477 914 3HB ALA1027 3HB ALA1027 -4.805 8.043 8.248 915 H LEU1028 H LEU1028 -1.900 8.729 5.192 916 HA LEU1028 HA LEU1028 -2.584 6.593 3.553 917 1HB LEU1028 1HB LEU1028 -0.717 8.918 3.375 918 2HB LEU1028 2HB LEU1028 -0.611 7.658 2.162 919 HG LEU1028 HG LEU1028 -2.908 9.517 2.748 920 1HD1 LEU1028 1HD1 LEU1028 -1.087 8.971 0.428 921 2HD1 LEU1028 2HD1 LEU1028 -2.711 9.643 0.146 922 3HD1 LEU1028 3HD1 LEU1028 -1.553 10.518 1.175 923 1HD2 LEU1028 1HD2 LEU1028 -3.012 6.833 1.389 924 2HD2 LEU1028 2HD2 LEU1028 -4.113 7.532 2.602 925 3HD2 LEU1028 3HD2 LEU1028 -4.124 8.145 0.931 926 H ALA1029 H ALA1029 0.757 7.477 4.693 927 HA ALA1029 HA ALA1029 2.115 5.325 3.896 928 1HB ALA1029 1HB ALA1029 3.304 7.007 5.030 929 2HB ALA1029 2HB ALA1029 2.228 6.946 6.447 930 3HB ALA1029 3HB ALA1029 3.387 5.628 6.153 931 H VAL1030 H VAL1030 -0.170 5.480 6.668 932 HA VAL1030 HA VAL1030 0.418 2.821 7.512 933 HB VAL1030 HB VAL1030 -1.737 4.833 8.149 934 1HG1 VAL1030 1HG1 VAL1030 -1.331 2.199 9.591 935 2HG1 VAL1030 2HG1 VAL1030 -2.632 3.391 9.820 936 3HG1 VAL1030 3HG1 VAL1030 -2.554 2.436 8.320 937 1HG2 VAL1030 1HG2 VAL1030 0.466 3.726 9.914 938 2HG2 VAL1030 2HG2 VAL1030 0.640 5.201 8.933 939 3HG2 VAL1030 3HG2 VAL1030 -0.587 5.129 10.221 940 H ASP1031 H ASP1031 -2.326 4.414 5.744 941 HA ASP1031 HA ASP1031 -3.962 2.373 5.390 942 1HB ASP1031 1HB ASP1031 -3.009 4.378 3.297 943 2HB ASP1031 2HB ASP1031 -4.387 3.328 3.037 944 H ALA1032 H ALA1032 -1.201 3.180 3.136 945 HA ALA1032 HA ALA1032 -1.410 0.914 1.555 946 1HB ALA1032 1HB ALA1032 1.308 2.014 2.048 947 2HB ALA1032 2HB ALA1032 0.420 1.796 0.521 948 3HB ALA1032 3HB ALA1032 0.075 3.201 1.558 949 H LYS1033 H LYS1033 0.101 1.461 4.741 950 HA LYS1033 HA LYS1033 1.624 -0.910 4.750 951 1HB LYS1033 1HB LYS1033 1.726 1.261 6.231 952 2HB LYS1033 2HB LYS1033 0.594 0.397 7.252 953 1HG LYS1033 1HG LYS1033 2.439 -0.569 8.183 954 2HG LYS1033 2HG LYS1033 2.470 -1.576 6.750 955 1HD LYS1033 1HD LYS1033 3.813 0.490 5.707 956 2HD LYS1033 2HD LYS1033 4.134 0.866 7.389 957 1HE LYS1033 1HE LYS1033 5.381 -1.097 7.741 958 2HE LYS1033 2HE LYS1033 4.564 -1.977 6.465 959 1HZ LYS1033 1HZ LYS1033 5.771 -0.840 4.854 960 2HZ LYS1033 2HZ LYS1033 6.283 0.321 5.883 961 3HZ LYS1033 3HZ LYS1033 6.879 -1.195 6.000 962 H ASN1034 H ASN1034 -1.643 -0.054 6.064 963 HA ASN1034 HA ASN1034 -2.165 -2.478 7.205 964 1HB ASN1034 1HB ASN1034 -3.538 -0.113 6.904 965 2HB ASN1034 2HB ASN1034 -4.442 -1.121 5.791 966 1HD2 ASN1034 1HD2 ASN1034 -5.891 -0.285 7.733 967 2HD2 ASN1034 2HD2 ASN1034 -6.177 -1.456 8.977 968 H LEU1035 H LEU1035 -1.877 -1.541 3.852 969 HA LEU1035 HA LEU1035 -3.637 -3.453 2.733 970 1HB LEU1035 1HB LEU1035 -2.462 -1.252 1.807 971 2HB LEU1035 2HB LEU1035 -1.281 -2.415 1.237 972 HG LEU1035 HG LEU1035 -4.234 -2.675 0.637 973 1HD1 LEU1035 1HD1 LEU1035 -2.195 -1.453 -1.228 974 2HD1 LEU1035 2HD1 LEU1035 -3.965 -1.525 -1.407 975 3HD1 LEU1035 3HD1 LEU1035 -3.238 -0.482 -0.161 976 1HD2 LEU1035 1HD2 LEU1035 -2.099 -3.741 -1.143 977 2HD2 LEU1035 2HD2 LEU1035 -2.368 -4.570 0.409 978 3HD2 LEU1035 3HD2 LEU1035 -3.707 -4.394 -0.750 979 H LEU1036 H LEU1036 -0.012 -3.331 3.011 980 HA LEU1036 HA LEU1036 0.219 -6.048 2.208 981 1HB LEU1036 1HB LEU1036 1.903 -3.797 2.578 982 2HB LEU1036 2HB LEU1036 2.533 -5.082 3.590 983 HG LEU1036 HG LEU1036 2.186 -6.502 1.345 984 1HD1 LEU1036 1HD1 LEU1036 1.328 -4.227 0.316 985 2HD1 LEU1036 2HD1 LEU1036 3.070 -3.933 0.098 986 3HD1 LEU1036 3HD1 LEU1036 2.311 -5.366 -0.636 987 1HD2 LEU1036 1HD2 LEU1036 4.266 -6.357 2.562 988 2HD2 LEU1036 2HD2 LEU1036 4.570 -6.075 0.832 989 3HD2 LEU1036 3HD2 LEU1036 4.544 -4.703 1.966 990 H ASP1037 H ASP1037 0.041 -4.273 5.312 991 HA ASP1037 HA ASP1037 0.957 -6.033 7.062 992 1HB ASP1037 1HB ASP1037 -0.380 -3.792 7.372 993 2HB ASP1037 2HB ASP1037 -1.799 -4.815 7.464 994 H VAL1038 H VAL1038 -2.530 -5.935 5.972 995 HA VAL1038 HA VAL1038 -3.308 -8.309 7.131 996 HB VAL1038 HB VAL1038 -4.829 -6.634 6.268 997 1HG1 VAL1038 1HG1 VAL1038 -5.254 -6.525 3.779 998 2HG1 VAL1038 2HG1 VAL1038 -3.708 -5.827 4.319 999 3HG1 VAL1038 3HG1 VAL1038 -3.741 -7.434 3.554 1000 1HG2 VAL1038 1HG2 VAL1038 -5.045 -9.463 5.793 1001 2HG2 VAL1038 2HG2 VAL1038 -6.316 -8.294 6.224 1002 3HG2 VAL1038 3HG2 VAL1038 -5.914 -8.581 4.514 1003 H ILE1039 H ILE1039 -1.805 -7.666 3.917 1004 HA ILE1039 HA ILE1039 -2.072 -10.207 2.869 1005 HB ILE1039 HB ILE1039 -0.241 -7.897 2.447 1006 1HG1 ILE1039 1HG1 ILE1039 -2.084 -9.444 0.600 1007 2HG1 ILE1039 2HG1 ILE1039 -2.519 -7.984 1.467 1008 1HG2 ILE1039 1HG2 ILE1039 0.545 -9.553 0.434 1009 2HG2 ILE1039 2HG2 ILE1039 1.468 -9.257 1.927 1010 3HG2 ILE1039 3HG2 ILE1039 0.425 -10.694 1.794 1011 1HD1 ILE1039 1HD1 ILE1039 -0.196 -7.148 0.275 1012 2HD1 ILE1039 2HD1 ILE1039 -0.780 -8.320 -0.930 1013 3HD1 ILE1039 3HD1 ILE1039 -1.808 -6.948 -0.453 1014 H ASP1040 H ASP1040 0.457 -8.821 5.039 1015 HA ASP1040 HA ASP1040 2.221 -10.856 5.003 1016 1HB ASP1040 1HB ASP1040 1.729 -8.586 6.584 1017 2HB ASP1040 2HB ASP1040 1.674 -9.897 7.745 1018 H GLN1041 H GLN1041 -0.898 -10.538 6.786 1019 HA GLN1041 HA GLN1041 -0.537 -12.847 8.335 1020 1HB GLN1041 1HB GLN1041 -2.092 -11.033 8.967 1021 2HB GLN1041 2HB GLN1041 -3.073 -11.345 7.548 1022 1HG GLN1041 1HG GLN1041 -3.937 -13.349 8.402 1023 2HG GLN1041 2HG GLN1041 -2.532 -13.660 9.401 1024 1HE2 GLN1041 1HE2 GLN1041 -4.920 -11.042 8.982 1025 2HE2 GLN1041 2HE2 GLN1041 -5.309 -10.831 10.657 1026 H ALA1042 H ALA1042 -1.418 -12.277 5.006 1027 HA ALA1042 HA ALA1042 -2.811 -14.793 4.731 1028 1HB ALA1042 1HB ALA1042 -3.568 -13.887 2.796 1029 2HB ALA1042 2HB ALA1042 -2.908 -12.361 3.431 1030 3HB ALA1042 3HB ALA1042 -1.945 -13.347 2.305 1031 H ARG1043 H ARG1043 0.228 -13.272 3.430 1032 HA ARG1043 HA ARG1043 1.246 -15.240 2.039 1033 1HB ARG1043 1HB ARG1043 2.302 -12.969 2.857 1034 2HB ARG1043 2HB ARG1043 3.004 -13.924 4.147 1035 1HG ARG1043 1HG ARG1043 4.597 -14.769 2.765 1036 2HG ARG1043 2HG ARG1043 3.399 -15.278 1.593 1037 1HD ARG1043 1HD ARG1043 3.301 -12.693 0.974 1038 2HD ARG1043 2HD ARG1043 4.860 -12.628 1.771 1039 HE ARG1043 HE ARG1043 5.019 -14.823 0.025 1040 1HH1 ARG1043 2HH2 ARG1043 4.438 -11.366 -0.274 1041 2HH1 ARG1043 1HH2 ARG1043 5.112 -11.261 -1.866 1042 1HH2 ARG1043 2HH1 ARG1043 5.907 -14.686 -2.076 1043 2HH2 ARG1043 1HH1 ARG1043 5.953 -13.162 -2.898 1044 H LEU1044 H LEU1044 1.218 -15.068 5.647 1045 HA LEU1044 HA LEU1044 2.740 -17.411 6.027 1046 1HB LEU1044 1HB LEU1044 1.903 -17.257 8.343 1047 2HB LEU1044 2HB LEU1044 2.647 -15.787 7.745 1048 HG LEU1044 HG LEU1044 0.143 -15.121 7.190 1049 1HD1 LEU1044 1HD1 LEU1044 -1.375 -16.602 7.852 1050 2HD1 LEU1044 2HD1 LEU1044 -0.159 -17.563 8.727 1051 3HD1 LEU1044 3HD1 LEU1044 -0.948 -16.183 9.528 1052 1HD2 LEU1044 1HD2 LEU1044 1.648 -14.952 9.783 1053 2HD2 LEU1044 2HD2 LEU1044 1.309 -13.688 8.577 1054 3HD2 LEU1044 3HD2 LEU1044 0.011 -14.267 9.648 1055 H LYS1045 H LYS1045 -0.818 -16.725 6.014 1056 HA LYS1045 HA LYS1045 -1.822 -19.108 6.707 1057 1HB LYS1045 1HB LYS1045 -2.671 -17.053 4.694 1058 2HB LYS1045 2HB LYS1045 -3.571 -18.552 4.802 1059 1HG LYS1045 1HG LYS1045 -3.398 -17.976 7.458 1060 2HG LYS1045 2HG LYS1045 -3.302 -16.346 6.821 1061 1HD LYS1045 1HD LYS1045 -5.390 -16.897 5.416 1062 2HD LYS1045 2HD LYS1045 -5.527 -18.377 6.345 1063 1HE LYS1045 1HE LYS1045 -5.450 -15.582 7.581 1064 2HE LYS1045 2HE LYS1045 -6.925 -16.469 7.250 1065 1HZ LYS1045 1HZ LYS1045 -4.899 -17.855 8.769 1066 2HZ LYS1045 2HZ LYS1045 -5.670 -16.633 9.529 1067 3HZ LYS1045 3HZ LYS1045 -6.524 -17.888 8.928 1068 H MET1046 H MET1046 0.042 -18.359 3.790 1069 HA MET1046 HA MET1046 -0.660 -20.878 2.606 1070 1HB MET1046 1HB MET1046 -0.343 -19.133 1.005 1071 2HB MET1046 2HB MET1046 1.033 -18.465 1.861 1072 1HG MET1046 1HG MET1046 1.474 -21.256 0.960 1073 2HG MET1046 2HG MET1046 1.169 -20.149 -0.364 1074 1HE MET1046 1HE MET1046 2.008 -17.889 -0.408 1075 2HE MET1046 2HE MET1046 2.843 -17.221 1.015 1076 3HE MET1046 3HE MET1046 3.771 -17.647 -0.443 1077 H ILE1047 H ILE1047 2.355 -19.237 3.811 1078 HA ILE1047 HA ILE1047 4.150 -21.219 3.437 1079 HB ILE1047 HB ILE1047 3.803 -19.098 5.503 1080 1HG1 ILE1047 1HG1 ILE1047 6.320 -19.307 4.019 1081 2HG1 ILE1047 2HG1 ILE1047 4.923 -19.223 2.965 1082 1HG2 ILE1047 1HG2 ILE1047 6.024 -21.159 5.579 1083 2HG2 ILE1047 2HG2 ILE1047 5.924 -19.680 6.564 1084 3HG2 ILE1047 3HG2 ILE1047 4.721 -20.975 6.778 1085 1HD1 ILE1047 1HD1 ILE1047 5.126 -17.324 5.315 1086 2HD1 ILE1047 2HD1 ILE1047 6.030 -16.991 3.818 1087 3HD1 ILE1047 3HD1 ILE1047 4.255 -17.115 3.777 1088 H SER1048 H SER1048 2.082 -20.827 6.403 1089 HA SER1048 HA SER1048 2.864 -23.420 7.274 1090 1HB SER1048 1HB SER1048 2.301 -21.386 8.753 1091 2HB SER1048 2HB SER1048 0.615 -21.696 8.387 1092 HG SER1048 HG SER1048 1.495 -22.700 10.408 1093 H GLN1049 H GLN1049 1.981 -24.134 4.929 1094 HA GLN1049 HA GLN1049 -0.461 -25.479 5.499 1095 1HB GLN1049 1HB GLN1049 -0.562 -23.021 4.017 1096 2HB GLN1049 2HB GLN1049 -0.880 -24.322 2.887 1097 1HG GLN1049 1HG GLN1049 -2.548 -25.242 4.652 1098 2HG GLN1049 2HG GLN1049 -2.375 -23.701 5.467 1099 1HE2 GLN1049 1HE2 GLN1049 -4.798 -24.120 4.818 1100 2HE2 GLN1049 2HE2 GLN1049 -5.330 -23.293 3.392 1101 H SER1050 H SER1050 1.488 -24.470 2.589 1102 HA SER1050 HA SER1050 2.561 -27.081 2.374 1103 1HB SER1050 1HB SER1050 0.064 -26.730 1.162 1104 2HB SER1050 2HB SER1050 1.181 -26.469 -0.163 1105 HG SER1050 HG SER1050 0.564 -28.824 1.219 1106 H ARG1051 H ARG1051 4.653 -26.348 2.091 1107 HA ARG1051 HA ARG1051 4.992 -24.262 0.090 1108 1HB ARG1051 1HB ARG1051 5.839 -24.225 2.708 1109 2HB ARG1051 2HB ARG1051 7.255 -24.921 1.944 1110 1HG ARG1051 1HG ARG1051 6.608 -22.836 0.205 1111 2HG ARG1051 2HG ARG1051 6.183 -22.163 1.767 1112 1HD ARG1051 1HD ARG1051 8.862 -23.539 1.289 1113 2HD ARG1051 2HD ARG1051 8.630 -21.832 0.966 1114 HE ARG1051 HE ARG1051 7.654 -22.394 3.599 1115 1HH1 ARG1051 2HH2 ARG1051 10.689 -22.213 1.826 1116 2HH1 ARG1051 1HH2 ARG1051 11.627 -21.797 3.222 1117 1HH2 ARG1051 2HH1 ARG1051 8.891 -21.846 5.440 1118 2HH2 ARG1051 1HH1 ARG1051 10.597 -21.587 5.291 1119 HA PRO1052 HA PRO1052 6.872 -27.802 -1.894 1120 1HB PRO1052 1HB PRO1052 6.426 -26.996 -4.467 1121 2HB PRO1052 2HB PRO1052 5.286 -27.966 -3.555 1122 1HG PRO1052 1HG PRO1052 5.149 -25.091 -4.230 1123 2HG PRO1052 2HG PRO1052 3.861 -26.159 -3.708 1124 1HD PRO1052 1HD PRO1052 5.214 -24.194 -2.114 1125 2HD PRO1052 2HD PRO1052 4.008 -25.341 -1.564 1126 H HIS1053 H HIS1053 8.377 -27.754 -4.130 1127 HA HIS1053 HA HIS1053 10.583 -26.193 -3.132 1128 1HB HIS1053 1HB HIS1053 11.943 -27.587 -4.338 1129 2HB HIS1053 2HB HIS1053 10.587 -28.649 -4.016 1130 HD1 HIS1053 HD1 HIS1053 9.475 -29.716 -6.011 1131 HD2 HIS1053 HD2 HIS1053 11.863 -26.434 -7.067 1132 HE1 HIS1053 HE1 HIS1053 9.534 -29.666 -8.561 Start of MODEL 7 1 H MET 915 H MET 915 14.750 -22.028 -0.418 2 HA MET 915 HA MET 915 15.131 -20.046 -2.484 3 1HB MET 915 1HB MET 915 15.791 -22.921 -2.026 4 2HB MET 915 2HB MET 915 15.284 -22.582 -3.669 5 1HG MET 915 1HG MET 915 17.018 -20.469 -3.187 6 2HG MET 915 2HG MET 915 17.761 -21.746 -2.245 7 1HE MET 915 1HE MET 915 19.883 -23.293 -4.662 8 2HE MET 915 2HE MET 915 19.985 -21.543 -4.355 9 3HE MET 915 3HE MET 915 19.516 -22.651 -3.043 10 H ALA 916 H ALA 916 12.831 -19.311 -2.377 11 HA ALA 916 HA ALA 916 10.970 -21.260 -3.526 12 1HB ALA 916 1HB ALA 916 10.001 -18.603 -2.622 13 2HB ALA 916 2HB ALA 916 9.335 -20.226 -2.325 14 3HB ALA 916 3HB ALA 916 10.698 -19.632 -1.348 15 H ASN 917 H ASN 917 9.908 -20.848 -5.491 16 HA ASN 917 HA ASN 917 11.304 -18.973 -7.141 17 1HB ASN 917 1HB ASN 917 9.524 -21.328 -7.514 18 2HB ASN 917 2HB ASN 917 9.229 -20.054 -8.681 19 1HD2 ASN 917 1HD2 ASN 917 10.124 -20.780 -10.479 20 2HD2 ASN 917 2HD2 ASN 917 11.775 -21.257 -10.688 21 H LEU 918 H LEU 918 10.548 -16.879 -6.429 22 HA LEU 918 HA LEU 918 7.693 -16.417 -6.936 23 1HB LEU 918 1HB LEU 918 9.171 -16.084 -4.498 24 2HB LEU 918 2HB LEU 918 8.640 -14.514 -5.070 25 HG LEU 918 HG LEU 918 6.420 -16.275 -5.322 26 1HD1 LEU 918 1HD1 LEU 918 6.338 -16.623 -2.664 27 2HD1 LEU 918 2HD1 LEU 918 6.951 -17.857 -3.791 28 3HD1 LEU 918 3HD1 LEU 918 8.090 -16.800 -2.922 29 1HD2 LEU 918 1HD2 LEU 918 6.851 -13.696 -4.632 30 2HD2 LEU 918 2HD2 LEU 918 5.320 -14.562 -4.358 31 3HD2 LEU 918 3HD2 LEU 918 6.500 -14.400 -3.035 32 H ASP 919 H ASP 919 7.598 -15.341 -8.838 33 HA ASP 919 HA ASP 919 9.686 -14.036 -9.990 34 1HB ASP 919 1HB ASP 919 6.807 -13.126 -10.343 35 2HB ASP 919 2HB ASP 919 8.080 -13.155 -11.548 36 H ARG 920 H ARG 920 8.921 -11.425 -10.713 37 HA ARG 920 HA ARG 920 9.371 -10.076 -8.226 38 1HB ARG 920 1HB ARG 920 9.808 -8.090 -9.667 39 2HB ARG 920 2HB ARG 920 10.734 -9.475 -10.210 40 1HG ARG 920 1HG ARG 920 8.172 -9.562 -11.535 41 2HG ARG 920 2HG ARG 920 8.793 -7.930 -11.686 42 1HD ARG 920 1HD ARG 920 10.731 -8.625 -12.855 43 2HD ARG 920 2HD ARG 920 10.657 -10.257 -12.220 44 HE ARG 920 HE ARG 920 9.268 -10.840 -14.002 45 1HH1 ARG 920 2HH2 ARG 920 9.115 -7.326 -13.576 46 2HH1 ARG 920 1HH2 ARG 920 8.130 -7.074 -14.979 47 1HH2 ARG 920 1HH1 ARG 920 7.469 -8.960 -16.302 48 H SER 921 H SER 921 6.758 -11.254 -8.466 49 HA SER 921 HA SER 921 5.002 -9.140 -9.281 50 1HB SER 921 1HB SER 921 3.214 -10.789 -8.509 51 2HB SER 921 2HB SER 921 4.243 -11.347 -9.813 52 HG SER 921 HG SER 921 4.260 -12.122 -7.045 53 H ASN 922 H ASN 922 5.963 -10.893 -6.258 54 HA ASN 922 HA ASN 922 4.272 -9.405 -4.611 55 1HB ASN 922 1HB ASN 922 5.759 -11.663 -4.271 56 2HB ASN 922 2HB ASN 922 6.858 -10.519 -3.526 57 1HD2 ASN 922 1HD2 ASN 922 6.541 -11.503 -1.525 58 2HD2 ASN 922 2HD2 ASN 922 5.124 -11.239 -0.564 59 H ASP 923 H ASP 923 7.472 -8.912 -6.040 60 HA ASP 923 HA ASP 923 8.282 -6.951 -4.160 61 1HB ASP 923 1HB ASP 923 9.918 -8.305 -5.436 62 2HB ASP 923 2HB ASP 923 9.301 -7.669 -6.948 63 H LYS 924 H LYS 924 7.105 -7.039 -7.600 64 HA LYS 924 HA LYS 924 7.246 -4.427 -8.275 65 1HB LYS 924 1HB LYS 924 6.545 -6.107 -9.839 66 2HB LYS 924 2HB LYS 924 5.110 -6.478 -8.905 67 1HG LYS 924 1HG LYS 924 4.227 -5.059 -10.548 68 2HG LYS 924 2HG LYS 924 4.519 -3.927 -9.243 69 1HD LYS 924 1HD LYS 924 6.187 -2.838 -10.382 70 2HD LYS 924 2HD LYS 924 6.880 -4.327 -10.994 71 1HE LYS 924 1HE LYS 924 4.216 -3.677 -12.149 72 2HE LYS 924 2HE LYS 924 5.457 -2.495 -12.517 73 1HZ LYS 924 1HZ LYS 924 6.346 -5.188 -12.791 74 2HZ LYS 924 2HZ LYS 924 5.116 -4.815 -13.799 75 3HZ LYS 924 3HZ LYS 924 6.490 -3.933 -13.827 76 H VAL 925 H VAL 925 4.474 -6.000 -6.529 77 HA VAL 925 HA VAL 925 3.079 -3.610 -6.140 78 HB VAL 925 HB VAL 925 3.074 -6.240 -4.651 79 1HG1 VAL 925 1HG1 VAL 925 0.769 -5.499 -3.904 80 2HG1 VAL 925 2HG1 VAL 925 2.136 -4.647 -3.145 81 3HG1 VAL 925 3HG1 VAL 925 1.208 -3.861 -4.445 82 1HG2 VAL 925 1HG2 VAL 925 1.010 -5.239 -6.617 83 2HG2 VAL 925 2HG2 VAL 925 2.459 -6.126 -7.147 84 3HG2 VAL 925 3HG2 VAL 925 1.296 -6.899 -6.043 85 H TYR 926 H TYR 926 4.788 -5.554 -3.587 86 HA TYR 926 HA TYR 926 4.828 -3.804 -1.586 87 1HB TYR 926 1HB TYR 926 6.965 -5.625 -2.818 88 2HB TYR 926 2HB TYR 926 7.306 -4.784 -1.319 89 HD1 TYR 926 HD1 TYR 926 7.643 -7.012 -0.253 90 HD2 TYR 926 HD2 TYR 926 3.864 -5.844 -1.884 91 HE1 TYR 926 HE1 TYR 926 6.498 -8.872 1.048 92 HE2 TYR 926 HE2 TYR 926 2.732 -7.708 -0.578 93 HH TYR 926 HH TYR 926 3.573 -10.023 0.348 94 H GLU 927 H GLU 927 6.843 -3.601 -4.550 95 HA GLU 927 HA GLU 927 8.516 -1.594 -3.590 96 1HB GLU 927 1HB GLU 927 7.766 -2.628 -6.328 97 2HB GLU 927 2HB GLU 927 8.727 -1.168 -6.204 98 1HG GLU 927 1HG GLU 927 9.501 -3.683 -4.678 99 2HG GLU 927 2HG GLU 927 9.973 -3.463 -6.352 100 H ASN 928 H ASN 928 5.841 -1.317 -6.050 101 HA ASN 928 HA ASN 928 5.687 1.287 -6.322 102 1HB ASN 928 1HB ASN 928 4.049 -0.720 -7.038 103 2HB ASN 928 2HB ASN 928 3.080 -0.133 -5.701 104 1HD2 ASN 928 1HD2 ASN 928 3.809 0.185 -8.938 105 2HD2 ASN 928 2HD2 ASN 928 3.073 1.714 -9.282 106 H VAL 929 H VAL 929 4.422 -0.637 -3.532 107 HA VAL 929 HA VAL 929 3.059 1.368 -2.210 108 HB VAL 929 HB VAL 929 4.580 -1.039 -1.199 109 1HG1 VAL 929 1HG1 VAL 929 4.384 0.288 0.725 110 2HG1 VAL 929 2HG1 VAL 929 2.788 0.915 0.247 111 3HG1 VAL 929 3HG1 VAL 929 2.955 -0.772 0.791 112 1HG2 VAL 929 1HG2 VAL 929 2.633 -2.259 -1.430 113 2HG2 VAL 929 2HG2 VAL 929 1.589 -0.820 -1.347 114 3HG2 VAL 929 3HG2 VAL 929 2.515 -1.164 -2.828 115 H THR 930 H THR 930 6.425 0.195 -1.472 116 HA THR 930 HA THR 930 7.054 2.298 0.231 117 HB THR 930 HB THR 930 9.376 1.479 -0.125 118 HG1 THR 930 HG1 THR 930 8.149 -0.172 -2.197 119 1HG2 THR 930 1HG2 THR 930 8.696 -0.335 1.102 120 2HG2 THR 930 2HG2 THR 930 7.098 -0.342 0.317 121 3HG2 THR 930 3HG2 THR 930 8.471 -1.174 -0.452 122 H GLY 931 H GLY 931 7.592 1.974 -3.329 123 1HA GLY 931 1HA GLY 931 9.023 4.268 -3.783 124 2HA GLY 931 2HA GLY 931 7.871 3.562 -4.898 125 H LEU 932 H LEU 932 5.426 3.878 -3.502 126 HA LEU 932 HA LEU 932 4.974 6.651 -3.982 127 1HB LEU 932 1HB LEU 932 2.882 6.006 -4.273 128 2HB LEU 932 2HB LEU 932 3.486 4.366 -4.144 129 HG LEU 932 HG LEU 932 2.981 4.416 -1.695 130 1HD1 LEU 932 1HD1 LEU 932 2.709 6.405 -0.735 131 2HD1 LEU 932 2HD1 LEU 932 2.442 7.213 -2.299 132 3HD1 LEU 932 3HD1 LEU 932 1.083 6.427 -1.459 133 1HD2 LEU 932 1HD2 LEU 932 0.312 4.913 -2.526 134 2HD2 LEU 932 2HD2 LEU 932 1.181 4.199 -3.906 135 3HD2 LEU 932 3HD2 LEU 932 1.148 3.352 -2.341 136 H VAL 933 H VAL 933 4.794 4.494 -1.066 137 HA VAL 933 HA VAL 933 4.147 6.474 0.746 138 HB VAL 933 HB VAL 933 4.798 3.742 0.736 139 1HG1 VAL 933 1HG1 VAL 933 6.240 3.491 2.711 140 2HG1 VAL 933 2HG1 VAL 933 7.096 4.312 1.383 141 3HG1 VAL 933 3HG1 VAL 933 6.482 5.253 2.764 142 1HG2 VAL 933 1HG2 VAL 933 2.885 4.328 1.887 143 2HG2 VAL 933 2HG2 VAL 933 4.014 4.046 3.235 144 3HG2 VAL 933 3HG2 VAL 933 3.662 5.708 2.701 145 H LYS 934 H LYS 934 7.233 5.644 -0.813 146 HA LYS 934 HA LYS 934 8.918 6.970 0.977 147 1HB LYS 934 1HB LYS 934 9.133 6.174 -1.925 148 2HB LYS 934 2HB LYS 934 10.411 7.080 -1.140 149 1HG LYS 934 1HG LYS 934 9.549 4.873 0.572 150 2HG LYS 934 2HG LYS 934 9.967 4.272 -1.021 151 1HD LYS 934 1HD LYS 934 11.988 4.263 0.332 152 2HD LYS 934 2HD LYS 934 12.160 5.518 -0.879 153 1HE LYS 934 1HE LYS 934 11.063 7.044 1.050 154 2HE LYS 934 2HE LYS 934 11.712 5.794 2.092 155 1HZ LYS 934 1HZ LYS 934 13.083 7.839 0.781 156 2HZ LYS 934 2HZ LYS 934 13.658 6.762 1.866 157 3HZ LYS 934 3HZ LYS 934 13.679 6.406 0.273 158 H ALA 935 H ALA 935 7.208 8.082 -2.012 159 HA ALA 935 HA ALA 935 8.240 10.717 -1.806 160 1HB ALA 935 1HB ALA 935 6.492 9.141 -3.553 161 2HB ALA 935 2HB ALA 935 5.907 10.808 -3.337 162 3HB ALA 935 3HB ALA 935 7.554 10.515 -3.945 163 H VAL 936 H VAL 936 5.247 9.024 -0.743 164 HA VAL 936 HA VAL 936 3.626 11.043 -0.062 165 HB VAL 936 HB VAL 936 4.294 8.423 1.215 166 1HG1 VAL 936 1HG1 VAL 936 3.627 9.184 3.228 167 2HG1 VAL 936 2HG1 VAL 936 2.900 10.657 2.543 168 3HG1 VAL 936 3HG1 VAL 936 1.992 9.126 2.526 169 1HG2 VAL 936 1HG2 VAL 936 2.957 8.482 -0.845 170 2HG2 VAL 936 2HG2 VAL 936 2.002 7.874 0.529 171 3HG2 VAL 936 3HG2 VAL 936 1.768 9.542 -0.049 172 H ILE 937 H ILE 937 6.532 9.942 1.781 173 HA ILE 937 HA ILE 937 6.132 12.042 3.719 174 HB ILE 937 HB ILE 937 8.169 9.856 3.357 175 1HG1 ILE 937 1HG1 ILE 937 6.630 10.088 5.856 176 2HG1 ILE 937 2HG1 ILE 937 5.636 9.818 4.438 177 1HG2 ILE 937 1HG2 ILE 937 9.648 10.994 4.554 178 2HG2 ILE 937 2HG2 ILE 937 8.516 12.355 4.743 179 3HG2 ILE 937 3HG2 ILE 937 8.492 11.009 5.907 180 1HD1 ILE 937 1HD1 ILE 937 6.180 7.622 5.064 181 2HD1 ILE 937 2HD1 ILE 937 7.433 7.966 3.847 182 3HD1 ILE 937 3HD1 ILE 937 7.824 8.071 5.580 183 H GLU 938 H GLU 938 8.878 11.106 1.522 184 HA GLU 938 HA GLU 938 10.412 13.220 1.722 185 1HB GLU 938 1HB GLU 938 9.829 11.286 -0.365 186 2HB GLU 938 2HB GLU 938 10.207 12.831 -1.099 187 1HG GLU 938 1HG GLU 938 12.377 12.116 -0.840 188 2HG GLU 938 2HG GLU 938 12.179 12.768 0.775 189 H MET 939 H MET 939 7.380 13.116 -0.250 190 HA MET 939 HA MET 939 7.506 15.482 -1.491 191 1HB MET 939 1HB MET 939 5.221 13.981 -0.143 192 2HB MET 939 2HB MET 939 4.892 15.493 -0.965 193 1HG MET 939 1HG MET 939 5.696 14.619 -3.088 194 2HG MET 939 2HG MET 939 6.372 13.195 -2.321 195 1HE MET 939 1HE MET 939 3.443 15.372 -2.308 196 2HE MET 939 2HE MET 939 2.293 14.488 -3.339 197 3HE MET 939 3HE MET 939 2.199 14.337 -1.568 198 H SER 940 H SER 940 5.896 15.043 1.750 199 HA SER 940 HA SER 940 5.345 17.583 2.305 200 1HB SER 940 1HB SER 940 6.415 15.410 4.147 201 2HB SER 940 2HB SER 940 5.833 16.944 4.762 202 HG SER 940 HG SER 940 3.899 16.182 3.143 203 H SER 941 H SER 941 8.555 15.969 2.584 204 HA SER 941 HA SER 941 9.862 17.988 3.909 205 1HB SER 941 1HB SER 941 10.644 15.590 3.301 206 2HB SER 941 2HB SER 941 11.137 16.258 1.758 207 HG SER 941 HG SER 941 12.906 16.990 2.695 208 H LYS 942 H LYS 942 10.014 17.259 0.338 209 HA LYS 942 HA LYS 942 10.889 19.981 -0.127 210 1HB LYS 942 1HB LYS 942 11.309 19.211 -2.407 211 2HB LYS 942 2HB LYS 942 12.078 18.163 -1.231 212 1HG LYS 942 1HG LYS 942 10.969 16.384 -2.086 213 2HG LYS 942 2HG LYS 942 9.441 17.120 -1.647 214 1HD LYS 942 1HD LYS 942 10.176 18.554 -3.935 215 2HD LYS 942 2HD LYS 942 10.746 16.937 -4.297 216 1HE LYS 942 1HE LYS 942 7.992 17.156 -3.112 217 2HE LYS 942 2HE LYS 942 8.186 17.735 -4.755 218 1HZ LYS 942 1HZ LYS 942 7.914 15.591 -5.229 219 2HZ LYS 942 2HZ LYS 942 9.494 15.432 -4.850 220 3HZ LYS 942 3HZ LYS 942 8.349 15.059 -3.747 221 H ILE 943 H ILE 943 8.186 19.514 0.951 222 HA ILE 943 HA ILE 943 6.511 20.109 -1.360 223 HB ILE 943 HB ILE 943 6.160 18.772 1.158 224 1HG1 ILE 943 1HG1 ILE 943 5.497 18.272 -1.367 225 2HG1 ILE 943 2HG1 ILE 943 4.624 17.578 -0.015 226 1HG2 ILE 943 1HG2 ILE 943 4.350 21.136 0.641 227 2HG2 ILE 943 2HG2 ILE 943 3.860 19.735 1.623 228 3HG2 ILE 943 3HG2 ILE 943 5.250 20.728 2.121 229 1HD1 ILE 943 1HD1 ILE 943 3.793 20.240 -1.228 230 2HD1 ILE 943 2HD1 ILE 943 3.216 18.688 -1.881 231 3HD1 ILE 943 3HD1 ILE 943 2.831 19.146 -0.205 232 H GLN 944 H GLN 944 7.133 21.418 1.977 233 HA GLN 944 HA GLN 944 5.809 23.723 1.775 234 1HB GLN 944 1HB GLN 944 7.876 22.655 3.424 235 2HB GLN 944 2HB GLN 944 8.390 24.274 2.993 236 1HG GLN 944 1HG GLN 944 5.732 24.729 3.561 237 2HG GLN 944 2HG GLN 944 6.067 23.399 4.652 238 1HE2 GLN 944 1HE2 GLN 944 5.454 26.080 5.360 239 2HE2 GLN 944 2HE2 GLN 944 6.794 26.749 6.232 240 HA PRO 945 HA PRO 945 9.473 25.662 -0.546 241 1HB PRO 945 1HB PRO 945 11.417 24.049 -1.588 242 2HB PRO 945 2HB PRO 945 11.574 24.863 -0.044 243 1HG PRO 945 1HG PRO 945 11.031 22.008 -0.587 244 2HG PRO 945 2HG PRO 945 11.605 22.755 0.891 245 1HD PRO 945 1HD PRO 945 8.944 21.826 0.359 246 2HD PRO 945 2HD PRO 945 9.490 22.676 1.790 247 H ALA 946 H ALA 946 8.812 22.459 -1.859 248 HA ALA 946 HA ALA 946 8.934 22.880 -4.481 249 1HB ALA 946 1HB ALA 946 6.569 21.526 -4.347 250 2HB ALA 946 2HB ALA 946 8.158 20.780 -4.056 251 3HB ALA 946 3HB ALA 946 7.161 21.314 -2.682 252 HA PRO 947 HA PRO 947 6.295 26.269 -5.223 253 1HB PRO 947 1HB PRO 947 6.690 26.465 -7.920 254 2HB PRO 947 2HB PRO 947 7.768 27.182 -6.739 255 1HG PRO 947 1HG PRO 947 8.169 24.758 -8.382 256 2HG PRO 947 2HG PRO 947 9.364 25.719 -7.533 257 1HD PRO 947 1HD PRO 947 8.307 23.181 -6.716 258 2HD PRO 947 2HD PRO 947 9.413 24.195 -5.812 259 HA PRO 948 HA PRO 948 2.582 24.875 -6.750 260 1HB PRO 948 1HB PRO 948 1.522 26.919 -8.223 261 2HB PRO 948 2HB PRO 948 1.490 26.883 -6.471 262 1HG PRO 948 1HG PRO 948 3.204 28.495 -8.261 263 2HG PRO 948 2HG PRO 948 2.854 28.741 -6.562 264 1HD PRO 948 1HD PRO 948 5.264 27.660 -7.679 265 2HD PRO 948 2HD PRO 948 4.867 27.799 -5.977 266 H GLU 949 H GLU 949 4.988 25.640 -8.979 267 HA GLU 949 HA GLU 949 3.465 24.503 -11.146 268 1HB GLU 949 1HB GLU 949 5.670 26.339 -10.908 269 2HB GLU 949 2HB GLU 949 6.217 24.973 -11.858 270 1HG GLU 949 1HG GLU 949 3.969 25.241 -13.176 271 2HG GLU 949 2HG GLU 949 3.863 26.815 -12.414 272 H GLU 950 H GLU 950 5.599 23.513 -8.619 273 HA GLU 950 HA GLU 950 6.233 21.095 -10.123 274 1HB GLU 950 1HB GLU 950 7.952 22.826 -8.737 275 2HB GLU 950 2HB GLU 950 7.739 21.491 -7.623 276 1HG GLU 950 1HG GLU 950 9.138 20.209 -8.859 277 2HG GLU 950 2HG GLU 950 8.073 20.354 -10.243 278 H TYR 951 H TYR 951 4.234 22.429 -7.721 279 HA TYR 951 HA TYR 951 4.136 20.011 -6.111 280 1HB TYR 951 1HB TYR 951 4.048 22.305 -5.093 281 2HB TYR 951 2HB TYR 951 2.724 22.749 -6.151 282 HD1 TYR 951 HD1 TYR 951 3.557 21.645 -2.918 283 HD2 TYR 951 HD2 TYR 951 0.565 21.189 -5.941 284 HE1 TYR 951 HE1 TYR 951 1.887 20.880 -1.160 285 HE2 TYR 951 HE2 TYR 951 -1.095 20.425 -4.173 286 HH TYR 951 HH TYR 951 -0.108 19.598 -1.013 287 H VAL 952 H VAL 952 2.160 21.896 -8.460 288 HA VAL 952 HA VAL 952 -0.234 20.612 -8.195 289 HB VAL 952 HB VAL 952 1.200 22.141 -10.236 290 1HG1 VAL 952 1HG1 VAL 952 -0.918 20.142 -11.084 291 2HG1 VAL 952 2HG1 VAL 952 -0.454 21.564 -12.048 292 3HG1 VAL 952 3HG1 VAL 952 0.746 20.297 -11.697 293 1HG2 VAL 952 1HG2 VAL 952 -0.873 23.362 -10.351 294 2HG2 VAL 952 2HG2 VAL 952 -1.747 22.056 -9.514 295 3HG2 VAL 952 3HG2 VAL 952 -0.525 23.012 -8.640 296 HA PRO 953 HA PRO 953 1.482 17.202 -10.999 297 1HB PRO 953 1HB PRO 953 4.174 17.035 -11.437 298 2HB PRO 953 2HB PRO 953 3.068 17.812 -12.552 299 1HG PRO 953 1HG PRO 953 4.980 19.054 -10.671 300 2HG PRO 953 2HG PRO 953 4.192 19.766 -12.065 301 1HD PRO 953 1HD PRO 953 3.508 20.179 -9.310 302 2HD PRO 953 2HD PRO 953 2.649 20.797 -10.707 303 H MET 954 H MET 954 3.845 18.044 -8.529 304 HA MET 954 HA MET 954 4.746 15.726 -7.737 305 1HB MET 954 1HB MET 954 4.808 18.111 -6.611 306 2HB MET 954 2HB MET 954 3.418 17.570 -5.692 307 1HG MET 954 1HG MET 954 5.068 15.422 -5.305 308 2HG MET 954 2HG MET 954 6.276 16.674 -5.520 309 1HE MET 954 1HE MET 954 5.284 19.108 -4.760 310 2HE MET 954 2HE MET 954 4.886 19.390 -3.048 311 3HE MET 954 3HE MET 954 6.520 18.850 -3.506 312 H VAL 955 H VAL 955 1.450 16.941 -6.811 313 HA VAL 955 HA VAL 955 0.789 14.546 -5.439 314 HB VAL 955 HB VAL 955 -0.689 16.988 -6.378 315 1HG1 VAL 955 1HG1 VAL 955 -2.476 15.674 -4.722 316 2HG1 VAL 955 2HG1 VAL 955 -2.589 15.800 -6.494 317 3HG1 VAL 955 3HG1 VAL 955 -1.843 14.366 -5.750 318 1HG2 VAL 955 1HG2 VAL 955 0.730 16.233 -4.022 319 2HG2 VAL 955 2HG2 VAL 955 -0.143 17.748 -4.356 320 3HG2 VAL 955 3HG2 VAL 955 -0.992 16.381 -3.597 321 H LYS 956 H LYS 956 -0.131 15.955 -8.657 322 HA LYS 956 HA LYS 956 -1.791 14.015 -9.545 323 1HB LYS 956 1HB LYS 956 -0.151 16.098 -10.699 324 2HB LYS 956 2HB LYS 956 -0.158 14.696 -11.750 325 1HG LYS 956 1HG LYS 956 -2.334 15.021 -12.339 326 2HG LYS 956 2HG LYS 956 -2.839 15.213 -10.672 327 1HD LYS 956 1HD LYS 956 -3.051 17.444 -10.997 328 2HD LYS 956 2HD LYS 956 -1.332 17.556 -11.319 329 1HE LYS 956 1HE LYS 956 -1.610 17.515 -13.636 330 2HE LYS 956 2HE LYS 956 -3.061 16.535 -13.558 331 1HZ LYS 956 1HZ LYS 956 -2.783 19.393 -13.314 332 2HZ LYS 956 2HZ LYS 956 -3.983 18.516 -13.991 333 3HZ LYS 956 3HZ LYS 956 -3.922 18.701 -12.370 334 H GLU 957 H GLU 957 1.802 13.926 -9.391 335 HA GLU 957 HA GLU 957 2.121 11.594 -10.820 336 1HB GLU 957 1HB GLU 957 3.719 13.254 -8.979 337 2HB GLU 957 2HB GLU 957 4.159 11.560 -8.905 338 1HG GLU 957 1HG GLU 957 5.450 12.032 -10.733 339 2HG GLU 957 2HG GLU 957 3.949 11.888 -11.627 340 H VAL 958 H VAL 958 1.912 12.077 -7.219 341 HA VAL 958 HA VAL 958 2.143 9.557 -6.342 342 HB VAL 958 HB VAL 958 0.160 11.673 -5.488 343 1HG1 VAL 958 1HG1 VAL 958 0.937 9.047 -4.221 344 2HG1 VAL 958 2HG1 VAL 958 0.404 10.425 -3.228 345 3HG1 VAL 958 3HG1 VAL 958 -0.682 9.746 -4.464 346 1HG2 VAL 958 1HG2 VAL 958 2.957 11.649 -5.413 347 2HG2 VAL 958 2HG2 VAL 958 1.869 12.726 -4.504 348 3HG2 VAL 958 3HG2 VAL 958 2.457 11.219 -3.760 349 H GLY 959 H GLY 959 -1.007 11.028 -7.419 350 1HA GLY 959 1HA GLY 959 -2.666 8.906 -7.195 351 2HA GLY 959 2HA GLY 959 -2.749 10.075 -8.498 352 H LEU 960 H LEU 960 -0.446 9.582 -9.995 353 HA LEU 960 HA LEU 960 -1.200 7.446 -11.557 354 1HB LEU 960 1HB LEU 960 0.758 9.462 -11.558 355 2HB LEU 960 2HB LEU 960 1.635 7.954 -11.733 356 HG LEU 960 HG LEU 960 -0.741 8.191 -13.471 357 1HD1 LEU 960 1HD1 LEU 960 1.655 9.963 -14.015 358 2HD1 LEU 960 2HD1 LEU 960 0.206 9.761 -15.029 359 3HD1 LEU 960 3HD1 LEU 960 0.074 10.538 -13.433 360 1HD2 LEU 960 1HD2 LEU 960 1.072 7.462 -15.154 361 2HD2 LEU 960 2HD2 LEU 960 2.106 7.244 -13.721 362 3HD2 LEU 960 3HD2 LEU 960 0.591 6.323 -13.873 363 H ALA 961 H ALA 961 1.488 7.607 -9.118 364 HA ALA 961 HA ALA 961 2.387 5.047 -9.337 365 1HB ALA 961 1HB ALA 961 2.661 7.244 -7.574 366 2HB ALA 961 2HB ALA 961 2.253 5.845 -6.552 367 3HB ALA 961 3HB ALA 961 3.663 5.774 -7.636 368 H LEU 962 H LEU 962 -0.179 6.208 -7.030 369 HA LEU 962 HA LEU 962 -0.861 3.727 -6.058 370 1HB LEU 962 1HB LEU 962 -2.528 6.214 -6.446 371 2HB LEU 962 2HB LEU 962 -3.055 4.815 -5.533 372 HG LEU 962 HG LEU 962 -0.494 5.562 -4.528 373 1HD1 LEU 962 1HD1 LEU 962 -1.484 7.895 -3.655 374 2HD1 LEU 962 2HD1 LEU 962 -0.451 7.754 -5.098 375 3HD1 LEU 962 3HD1 LEU 962 -2.219 7.863 -5.275 376 1HD2 LEU 962 1HD2 LEU 962 -1.584 5.610 -2.456 377 2HD2 LEU 962 2HD2 LEU 962 -3.140 6.084 -3.178 378 3HD2 LEU 962 3HD2 LEU 962 -2.511 4.436 -3.421 379 H ARG 963 H ARG 963 -2.077 5.481 -8.972 380 HA ARG 963 HA ARG 963 -4.091 3.855 -9.664 381 1HB ARG 963 1HB ARG 963 -2.928 5.962 -10.851 382 2HB ARG 963 2HB ARG 963 -2.153 4.728 -11.823 383 1HG ARG 963 1HG ARG 963 -4.036 4.868 -13.115 384 2HG ARG 963 2HG ARG 963 -4.751 3.834 -11.894 385 1HD ARG 963 1HD ARG 963 -5.066 6.335 -10.736 386 2HD ARG 963 2HD ARG 963 -5.226 6.723 -12.437 387 HE ARG 963 HE ARG 963 -6.833 4.495 -12.182 388 1HH1 ARG 963 2HH2 ARG 963 -6.647 7.539 -10.427 389 2HH1 ARG 963 1HH2 ARG 963 -8.330 7.552 -10.016 390 1HH2 ARG 963 2HH1 ARG 963 -9.052 4.511 -11.640 391 2HH2 ARG 963 1HH1 ARG 963 -9.707 5.818 -10.711 392 H THR 964 H THR 964 -0.608 3.485 -10.672 393 HA THR 964 HA THR 964 -0.956 1.065 -12.025 394 HB THR 964 HB THR 964 1.390 2.490 -10.693 395 HG1 THR 964 HG1 THR 964 0.363 1.872 -13.371 396 1HG2 THR 964 1HG2 THR 964 1.290 -0.286 -11.529 397 2HG2 THR 964 2HG2 THR 964 2.235 0.635 -12.724 398 3HG2 THR 964 3HG2 THR 964 2.709 0.653 -11.009 399 H LEU 965 H LEU 965 -0.313 1.782 -8.567 400 HA LEU 965 HA LEU 965 0.285 -0.793 -7.768 401 1HB LEU 965 1HB LEU 965 0.631 1.137 -6.375 402 2HB LEU 965 2HB LEU 965 -1.088 1.473 -6.322 403 HG LEU 965 HG LEU 965 -1.467 -0.618 -5.068 404 1HD1 LEU 965 1HD1 LEU 965 1.326 -1.100 -5.806 405 2HD1 LEU 965 2HD1 LEU 965 0.985 -1.389 -4.083 406 3HD1 LEU 965 3HD1 LEU 965 0.044 -2.241 -5.332 407 1HD2 LEU 965 1HD2 LEU 965 -0.927 0.272 -3.026 408 2HD2 LEU 965 2HD2 LEU 965 0.688 0.804 -3.554 409 3HD2 LEU 965 3HD2 LEU 965 -0.758 1.709 -4.062 410 H LEU 966 H LEU 966 -2.939 0.873 -7.891 411 HA LEU 966 HA LEU 966 -4.523 -1.084 -6.944 412 1HB LEU 966 1HB LEU 966 -4.859 0.984 -9.071 413 2HB LEU 966 2HB LEU 966 -6.126 -0.207 -8.853 414 HG LEU 966 HG LEU 966 -6.254 0.461 -6.432 415 1HD1 LEU 966 1HD1 LEU 966 -3.958 1.425 -6.313 416 2HD1 LEU 966 2HD1 LEU 966 -4.535 2.808 -7.273 417 3HD1 LEU 966 3HD1 LEU 966 -5.229 2.490 -5.665 418 1HD2 LEU 966 1HD2 LEU 966 -7.441 1.564 -8.648 419 2HD2 LEU 966 2HD2 LEU 966 -7.911 1.867 -6.958 420 3HD2 LEU 966 3HD2 LEU 966 -6.819 2.997 -7.794 421 H ALA 967 H ALA 967 -3.434 -0.785 -10.398 422 HA ALA 967 HA ALA 967 -4.616 -3.166 -11.234 423 1HB ALA 967 1HB ALA 967 -3.993 -1.738 -12.957 424 2HB ALA 967 2HB ALA 967 -2.425 -1.348 -12.211 425 3HB ALA 967 3HB ALA 967 -2.664 -2.921 -13.008 426 H THR 968 H THR 968 -1.274 -2.432 -10.039 427 HA THR 968 HA THR 968 -0.226 -4.980 -10.352 428 HB THR 968 HB THR 968 0.399 -2.987 -8.117 429 HG1 THR 968 HG1 THR 968 1.461 -1.842 -9.800 430 1HG2 THR 968 1HG2 THR 968 2.391 -4.105 -7.935 431 2HG2 THR 968 2HG2 THR 968 1.637 -5.410 -8.883 432 3HG2 THR 968 3HG2 THR 968 2.591 -4.151 -9.703 433 H VAL 969 H VAL 969 -2.166 -3.597 -7.655 434 HA VAL 969 HA VAL 969 -1.860 -5.716 -5.901 435 HB VAL 969 HB VAL 969 -4.358 -4.063 -6.267 436 1HG1 VAL 969 1HG1 VAL 969 -3.041 -5.176 -3.767 437 2HG1 VAL 969 2HG1 VAL 969 -4.589 -4.302 -3.861 438 3HG1 VAL 969 3HG1 VAL 969 -4.427 -5.910 -4.608 439 1HG2 VAL 969 1HG2 VAL 969 -2.680 -2.828 -4.358 440 2HG2 VAL 969 2HG2 VAL 969 -1.666 -3.138 -5.788 441 3HG2 VAL 969 3HG2 VAL 969 -3.171 -2.202 -5.951 442 H ASP 970 H ASP 970 -4.249 -5.184 -8.564 443 HA ASP 970 HA ASP 970 -5.877 -7.270 -8.141 444 1HB ASP 970 1HB ASP 970 -6.015 -5.569 -10.003 445 2HB ASP 970 2HB ASP 970 -4.735 -6.421 -10.844 446 H GLU 971 H GLU 971 -2.586 -7.216 -9.610 447 HA GLU 971 HA GLU 971 -2.693 -9.947 -10.363 448 1HB GLU 971 1HB GLU 971 -0.539 -7.818 -10.305 449 2HB GLU 971 2HB GLU 971 -0.111 -9.488 -10.620 450 1HG GLU 971 1HG GLU 971 -2.081 -9.384 -12.393 451 2HG GLU 971 2HG GLU 971 -1.873 -7.649 -12.263 452 H SER 972 H SER 972 -1.928 -8.136 -7.461 453 HA SER 972 HA SER 972 -0.349 -10.260 -6.368 454 1HB SER 972 1HB SER 972 -0.640 -7.487 -5.878 455 2HB SER 972 2HB SER 972 -1.270 -8.261 -4.438 456 HG SER 972 HG SER 972 1.303 -8.862 -5.628 457 H LEU 973 H LEU 973 -3.699 -9.168 -6.462 458 HA LEU 973 HA LEU 973 -4.783 -10.056 -4.162 459 1HB LEU 973 1HB LEU 973 -5.677 -9.290 -6.672 460 2HB LEU 973 2HB LEU 973 -6.330 -10.905 -6.483 461 HG LEU 973 HG LEU 973 -7.053 -8.391 -5.126 462 1HD1 LEU 973 1HD1 LEU 973 -9.088 -9.013 -5.771 463 2HD1 LEU 973 2HD1 LEU 973 -8.317 -10.375 -6.620 464 3HD1 LEU 973 3HD1 LEU 973 -8.940 -10.594 -4.967 465 1HD2 LEU 973 1HD2 LEU 973 -7.918 -9.871 -3.131 466 2HD2 LEU 973 2HD2 LEU 973 -6.520 -10.886 -3.560 467 3HD2 LEU 973 3HD2 LEU 973 -6.278 -9.179 -3.116 468 HA PRO 974 HA PRO 974 -4.647 -14.499 -5.770 469 1HB PRO 974 1HB PRO 974 -3.193 -15.106 -8.002 470 2HB PRO 974 2HB PRO 974 -4.920 -14.810 -8.035 471 1HG PRO 974 1HG PRO 974 -2.719 -13.047 -8.925 472 2HG PRO 974 2HG PRO 974 -4.423 -12.965 -9.327 473 1HD PRO 974 1HD PRO 974 -3.016 -11.294 -7.468 474 2HD PRO 974 2HD PRO 974 -4.739 -11.289 -7.784 475 H VAL 975 H VAL 975 -1.709 -12.685 -6.269 476 HA VAL 975 HA VAL 975 0.150 -14.587 -5.723 477 HB VAL 975 HB VAL 975 -0.071 -11.657 -5.139 478 1HG1 VAL 975 1HG1 VAL 975 1.436 -11.812 -3.485 479 2HG1 VAL 975 2HG1 VAL 975 1.788 -13.518 -3.850 480 3HG1 VAL 975 3HG1 VAL 975 2.614 -12.226 -4.754 481 1HG2 VAL 975 1HG2 VAL 975 0.324 -12.142 -7.422 482 2HG2 VAL 975 2HG2 VAL 975 1.905 -11.667 -6.757 483 3HG2 VAL 975 3HG2 VAL 975 1.536 -13.387 -7.033 484 H LEU 976 H LEU 976 -2.170 -13.039 -3.509 485 HA LEU 976 HA LEU 976 -0.981 -14.594 -1.321 486 1HB LEU 976 1HB LEU 976 -2.812 -12.204 -1.111 487 2HB LEU 976 2HB LEU 976 -1.976 -13.021 0.195 488 HG LEU 976 HG LEU 976 -0.783 -11.030 -0.192 489 1HD1 LEU 976 1HD1 LEU 976 0.836 -13.043 -1.757 490 2HD1 LEU 976 2HD1 LEU 976 1.407 -11.763 -0.659 491 3HD1 LEU 976 3HD1 LEU 976 0.557 -13.183 -0.004 492 1HD2 LEU 976 1HD2 LEU 976 -0.508 -11.644 -3.138 493 2HD2 LEU 976 2HD2 LEU 976 -1.829 -10.653 -2.474 494 3HD2 LEU 976 3HD2 LEU 976 -0.139 -10.130 -2.277 495 HA PRO 977 HA PRO 977 -4.560 -17.010 -1.340 496 1HB PRO 977 1HB PRO 977 -4.448 -18.102 1.163 497 2HB PRO 977 2HB PRO 977 -3.505 -18.701 -0.187 498 1HG PRO 977 1HG PRO 977 -2.615 -17.085 2.122 499 2HG PRO 977 2HG PRO 977 -1.650 -18.038 1.012 500 1HD PRO 977 1HD PRO 977 -1.935 -15.184 1.023 501 2HD PRO 977 2HD PRO 977 -1.065 -16.145 -0.155 502 H ALA 978 H ALA 978 -6.721 -17.402 -0.432 503 HA ALA 978 HA ALA 978 -7.985 -15.014 0.051 504 1HB ALA 978 1HB ALA 978 -9.565 -16.946 1.292 505 2HB ALA 978 2HB ALA 978 -9.595 -16.519 -0.436 506 3HB ALA 978 3HB ALA 978 -8.598 -17.882 0.127 507 H SER 979 H SER 979 -9.415 -14.716 2.201 508 HA SER 979 HA SER 979 -9.525 -14.563 4.409 509 1HB SER 979 1HB SER 979 -7.852 -16.632 4.407 510 2HB SER 979 2HB SER 979 -6.662 -15.424 4.851 511 HG SER 979 HG SER 979 -9.162 -15.843 6.256 512 H THR 980 H THR 980 -7.046 -13.367 2.305 513 HA THR 980 HA THR 980 -6.607 -11.074 4.107 514 HB THR 980 HB THR 980 -4.635 -12.688 3.515 515 HG1 THR 980 HG1 THR 980 -4.685 -9.843 2.786 516 1HG2 THR 980 1HG2 THR 980 -3.761 -11.295 1.227 517 2HG2 THR 980 2HG2 THR 980 -4.273 -12.998 1.271 518 3HG2 THR 980 3HG2 THR 980 -5.444 -11.728 0.844 519 H HIS 981 H HIS 981 -7.951 -12.226 1.139 520 HA HIS 981 HA HIS 981 -7.628 -9.931 -0.412 521 1HB HIS 981 1HB HIS 981 -9.919 -11.910 -0.493 522 2HB HIS 981 2HB HIS 981 -9.404 -10.844 -1.785 523 HD1 HIS 981 HD1 HIS 981 -9.506 -14.007 -2.004 524 HD2 HIS 981 HD2 HIS 981 -6.077 -11.717 -1.236 525 HE1 HIS 981 HE1 HIS 981 -7.518 -15.434 -2.725 526 H ARG 982 H ARG 982 -10.427 -11.026 1.636 527 HA ARG 982 HA ARG 982 -12.129 -9.065 1.294 528 1HB ARG 982 1HB ARG 982 -12.474 -10.883 2.927 529 2HB ARG 982 2HB ARG 982 -11.241 -10.223 3.983 530 1HG ARG 982 1HG ARG 982 -13.015 -8.064 3.548 531 2HG ARG 982 2HG ARG 982 -14.065 -9.457 3.719 532 1HD ARG 982 1HD ARG 982 -11.854 -8.699 5.692 533 2HD ARG 982 2HD ARG 982 -13.555 -8.343 5.919 534 HE ARG 982 HE ARG 982 -13.603 -11.054 5.493 535 1HH1 ARG 982 2HH2 ARG 982 -11.679 -9.030 7.634 536 2HH1 ARG 982 1HH2 ARG 982 -11.494 -10.260 8.840 537 1HH2 ARG 982 2HH1 ARG 982 -13.359 -12.677 7.083 538 2HH2 ARG 982 1HH1 ARG 982 -12.456 -12.348 8.524 539 H GLU 983 H GLU 983 -9.862 -8.840 4.134 540 HA GLU 983 HA GLU 983 -10.224 -6.195 4.586 541 1HB GLU 983 1HB GLU 983 -7.999 -8.138 5.157 542 2HB GLU 983 2HB GLU 983 -7.693 -6.440 5.465 543 1HG GLU 983 1HG GLU 983 -9.753 -6.330 6.888 544 2HG GLU 983 2HG GLU 983 -10.051 -8.030 6.585 545 H ILE 984 H ILE 984 -7.964 -7.803 2.298 546 HA ILE 984 HA ILE 984 -6.420 -5.612 1.634 547 HB ILE 984 HB ILE 984 -7.156 -8.194 0.378 548 1HG1 ILE 984 1HG1 ILE 984 -4.449 -6.898 0.761 549 2HG1 ILE 984 2HG1 ILE 984 -5.268 -7.775 2.039 550 1HG2 ILE 984 1HG2 ILE 984 -5.663 -7.507 -1.609 551 2HG2 ILE 984 2HG2 ILE 984 -7.368 -6.994 -1.607 552 3HG2 ILE 984 3HG2 ILE 984 -6.090 -5.837 -1.163 553 1HD1 ILE 984 1HD1 ILE 984 -3.793 -9.339 0.930 554 2HD1 ILE 984 2HD1 ILE 984 -5.454 -9.762 0.448 555 3HD1 ILE 984 3HD1 ILE 984 -4.403 -8.865 -0.674 556 H GLU 985 H GLU 985 -9.502 -6.791 0.123 557 HA GLU 985 HA GLU 985 -9.693 -4.889 -1.802 558 1HB GLU 985 1HB GLU 985 -11.246 -6.963 -0.989 559 2HB GLU 985 2HB GLU 985 -12.223 -5.642 -0.380 560 1HG GLU 985 1HG GLU 985 -11.306 -5.002 -3.069 561 2HG GLU 985 2HG GLU 985 -12.050 -6.589 -3.073 562 H MET 986 H MET 986 -10.650 -4.704 1.669 563 HA MET 986 HA MET 986 -11.838 -2.170 1.399 564 1HB MET 986 1HB MET 986 -10.827 -3.880 3.716 565 2HB MET 986 2HB MET 986 -11.425 -2.262 4.021 566 1HG MET 986 1HG MET 986 -13.453 -3.235 2.435 567 2HG MET 986 2HG MET 986 -12.927 -4.717 3.208 568 1HE MET 986 1HE MET 986 -15.987 -2.253 4.905 569 2HE MET 986 2HE MET 986 -15.135 -1.755 3.424 570 3HE MET 986 3HE MET 986 -15.803 -3.399 3.556 571 H ALA 987 H ALA 987 -8.533 -3.339 1.894 572 HA ALA 987 HA ALA 987 -7.495 -0.944 2.979 573 1HB ALA 987 1HB ALA 987 -5.397 -2.241 1.710 574 2HB ALA 987 2HB ALA 987 -5.953 -2.551 3.372 575 3HB ALA 987 3HB ALA 987 -6.543 -3.565 2.033 576 H GLN 988 H GLN 988 -8.279 -2.103 -0.280 577 HA GLN 988 HA GLN 988 -6.653 -0.248 -1.617 578 1HB GLN 988 1HB GLN 988 -9.111 -1.815 -2.509 579 2HB GLN 988 2HB GLN 988 -8.134 -0.849 -3.597 580 1HG GLN 988 1HG GLN 988 -6.392 -2.566 -2.022 581 2HG GLN 988 2HG GLN 988 -7.661 -3.539 -2.739 582 1HE2 GLN 988 1HE2 GLN 988 -5.035 -1.303 -3.341 583 2HE2 GLN 988 2HE2 GLN 988 -4.779 -1.669 -5.014 584 H LYS 989 H LYS 989 -10.178 -0.336 -0.768 585 HA LYS 989 HA LYS 989 -10.810 2.112 -1.947 586 1HB LYS 989 1HB LYS 989 -12.337 0.213 -1.112 587 2HB LYS 989 2HB LYS 989 -12.195 0.949 0.472 588 1HG LYS 989 1HG LYS 989 -12.742 3.145 -1.171 589 2HG LYS 989 2HG LYS 989 -13.702 1.874 -1.903 590 1HD LYS 989 1HD LYS 989 -14.470 1.348 0.563 591 2HD LYS 989 2HD LYS 989 -13.850 2.945 0.935 592 1HE LYS 989 1HE LYS 989 -15.732 2.598 -1.416 593 2HE LYS 989 2HE LYS 989 -16.388 2.636 0.209 594 1HZ LYS 989 1HZ LYS 989 -16.018 4.804 -1.124 595 2HZ LYS 989 2HZ LYS 989 -15.750 4.780 0.487 596 3HZ LYS 989 3HZ LYS 989 -14.492 4.699 -0.552 597 H LEU 990 H LEU 990 -9.349 1.237 1.185 598 HA LEU 990 HA LEU 990 -9.728 3.748 2.398 599 1HB LEU 990 1HB LEU 990 -8.637 1.222 3.048 600 2HB LEU 990 2HB LEU 990 -7.372 2.401 3.335 601 HG LEU 990 HG LEU 990 -10.161 2.459 4.521 602 1HD1 LEU 990 1HD1 LEU 990 -7.974 0.914 5.267 603 2HD1 LEU 990 2HD1 LEU 990 -7.928 2.302 6.381 604 3HD1 LEU 990 3HD1 LEU 990 -9.397 1.304 6.263 605 1HD2 LEU 990 1HD2 LEU 990 -9.485 4.374 5.796 606 2HD2 LEU 990 2HD2 LEU 990 -7.835 4.300 5.132 607 3HD2 LEU 990 3HD2 LEU 990 -9.203 4.718 4.072 608 H LEU 991 H LEU 991 -7.013 2.291 0.500 609 HA LEU 991 HA LEU 991 -5.278 4.441 0.747 610 1HB LEU 991 1HB LEU 991 -4.659 2.211 -0.029 611 2HB LEU 991 2HB LEU 991 -5.592 2.440 -1.495 612 HG LEU 991 HG LEU 991 -4.095 4.246 -2.204 613 1HD1 LEU 991 1HD1 LEU 991 -3.286 5.333 -0.345 614 2HD1 LEU 991 2HD1 LEU 991 -2.898 3.822 0.512 615 3HD1 LEU 991 3HD1 LEU 991 -1.868 4.374 -0.830 616 1HD2 LEU 991 1HD2 LEU 991 -3.076 1.505 -1.622 617 2HD2 LEU 991 2HD2 LEU 991 -3.342 2.331 -3.176 618 3HD2 LEU 991 3HD2 LEU 991 -1.911 2.724 -2.193 619 H ASN 992 H ASN 992 -7.508 3.653 -2.019 620 HA ASN 992 HA ASN 992 -7.085 5.834 -3.500 621 1HB ASN 992 1HB ASN 992 -8.750 3.831 -3.822 622 2HB ASN 992 2HB ASN 992 -9.916 4.823 -2.971 623 1HD2 ASN 992 1HD2 ASN 992 -10.569 4.102 -5.418 624 2HD2 ASN 992 2HD2 ASN 992 -10.452 5.397 -6.561 625 H SER 993 H SER 993 -9.540 5.458 -0.830 626 HA SER 993 HA SER 993 -10.760 7.801 -0.862 627 1HB SER 993 1HB SER 993 -10.382 5.747 1.017 628 2HB SER 993 2HB SER 993 -9.887 7.189 1.881 629 HG SER 993 HG SER 993 -12.438 6.403 1.011 630 H ASP 994 H ASP 994 -7.838 7.291 1.258 631 HA ASP 994 HA ASP 994 -7.422 9.862 1.908 632 1HB ASP 994 1HB ASP 994 -5.694 7.444 1.590 633 2HB ASP 994 2HB ASP 994 -4.829 8.967 1.641 634 H LEU 995 H LEU 995 -6.488 8.081 -1.079 635 HA LEU 995 HA LEU 995 -4.728 9.893 -2.177 636 1HB LEU 995 1HB LEU 995 -5.818 7.497 -2.883 637 2HB LEU 995 2HB LEU 995 -6.582 8.566 -4.043 638 HG LEU 995 HG LEU 995 -3.606 8.179 -3.626 639 1HD1 LEU 995 1HD1 LEU 995 -3.998 7.561 -6.194 640 2HD1 LEU 995 2HD1 LEU 995 -4.141 6.365 -4.883 641 3HD1 LEU 995 3HD1 LEU 995 -5.603 7.119 -5.563 642 1HD2 LEU 995 1HD2 LEU 995 -4.509 9.736 -5.959 643 2HD2 LEU 995 2HD2 LEU 995 -4.743 10.537 -4.387 644 3HD2 LEU 995 3HD2 LEU 995 -3.122 9.982 -4.871 645 H ALA 996 H ALA 996 -8.271 9.613 -2.958 646 HA ALA 996 HA ALA 996 -8.497 11.876 -4.446 647 1HB ALA 996 1HB ALA 996 -10.195 9.979 -3.215 648 2HB ALA 996 2HB ALA 996 -10.792 11.572 -2.693 649 3HB ALA 996 3HB ALA 996 -10.642 11.203 -4.428 650 H GLU 997 H GLU 997 -8.646 11.558 -0.844 651 HA GLU 997 HA GLU 997 -9.256 14.203 -0.359 652 1HB GLU 997 1HB GLU 997 -9.340 12.271 1.281 653 2HB GLU 997 2HB GLU 997 -7.594 12.354 1.406 654 1HG GLU 997 1HG GLU 997 -8.090 13.766 3.160 655 2HG GLU 997 2HG GLU 997 -8.138 14.964 1.882 656 H LEU 998 H LEU 998 -6.227 12.609 -1.250 657 HA LEU 998 HA LEU 998 -4.592 14.815 -0.411 658 1HB LEU 998 1HB LEU 998 -4.033 12.280 -0.581 659 2HB LEU 998 2HB LEU 998 -3.742 12.623 -2.274 660 HG LEU 998 HG LEU 998 -2.393 14.338 -0.222 661 1HD1 LEU 998 1HD1 LEU 998 -0.768 12.823 0.366 662 2HD1 LEU 998 2HD1 LEU 998 -2.207 11.776 0.312 663 3HD1 LEU 998 3HD1 LEU 998 -1.061 11.784 -1.050 664 1HD2 LEU 998 1HD2 LEU 998 -0.646 13.595 -2.286 665 2HD2 LEU 998 2HD2 LEU 998 -2.222 13.861 -3.068 666 3HD2 LEU 998 3HD2 LEU 998 -1.490 15.148 -2.081 667 H ILE 999 H ILE 999 -5.818 13.450 -3.534 668 HA ILE 999 HA ILE 999 -4.593 15.317 -5.179 669 HB ILE 999 HB ILE 999 -7.188 13.813 -5.536 670 1HG1 ILE 999 1HG1 ILE 999 -4.972 12.551 -5.044 671 2HG1 ILE 999 2HG1 ILE 999 -5.989 12.025 -6.370 672 1HG2 ILE 999 1HG2 ILE 999 -7.250 15.491 -7.163 673 2HG2 ILE 999 2HG2 ILE 999 -5.495 15.412 -7.450 674 3HG2 ILE 999 3HG2 ILE 999 -6.548 14.089 -8.007 675 1HD1 ILE 999 1HD1 ILE 999 -3.707 14.002 -6.773 676 2HD1 ILE 999 2HD1 ILE 999 -3.484 12.240 -6.890 677 3HD1 ILE 999 3HD1 ILE 999 -4.582 13.075 -8.015 678 H ASN1000 H ASN1000 -7.947 15.320 -3.782 679 HA ASN1000 HA ASN1000 -8.756 17.680 -4.817 680 1HB ASN1000 1HB ASN1000 -9.990 15.954 -3.266 681 2HB ASN1000 2HB ASN1000 -9.357 16.895 -1.930 682 1HD2 ASN1000 1HD2 ASN1000 -11.128 17.831 -1.156 683 2HD2 ASN1000 2HD2 ASN1000 -12.179 18.902 -2.021 684 H LYS1001 H LYS1001 -7.006 17.029 -1.694 685 HA LYS1001 HA LYS1001 -6.909 19.592 -0.719 686 1HB LYS1001 1HB LYS1001 -5.157 17.169 -0.426 687 2HB LYS1001 2HB LYS1001 -4.653 18.687 0.288 688 1HG LYS1001 1HG LYS1001 -7.508 18.006 0.782 689 2HG LYS1001 2HG LYS1001 -6.373 16.868 1.479 690 1HD LYS1001 1HD LYS1001 -6.134 18.328 3.203 691 2HD LYS1001 2HD LYS1001 -5.230 19.350 2.103 692 1HE LYS1001 1HE LYS1001 -7.405 20.432 1.387 693 2HE LYS1001 2HE LYS1001 -8.247 19.465 2.581 694 1HZ LYS1001 1HZ LYS1001 -5.973 21.099 3.393 695 2HZ LYS1001 2HZ LYS1001 -7.441 21.788 3.201 696 3HZ LYS1001 3HZ LYS1001 -7.239 20.586 4.288 697 H MET1002 H MET1002 -4.786 17.972 -3.139 698 HA MET1002 HA MET1002 -3.005 20.123 -3.308 699 1HB MET1002 1HB MET1002 -2.333 17.910 -4.077 700 2HB MET1002 2HB MET1002 -3.725 17.776 -5.132 701 1HG MET1002 1HG MET1002 -2.262 20.169 -5.860 702 2HG MET1002 2HG MET1002 -1.125 18.839 -5.759 703 1HE MET1002 1HE MET1002 -2.189 20.723 -7.886 704 2HE MET1002 2HE MET1002 -2.356 19.775 -9.383 705 3HE MET1002 3HE MET1002 -3.807 20.320 -8.508 706 H LYS1003 H LYS1003 -5.996 19.213 -5.089 707 HA LYS1003 HA LYS1003 -5.795 21.017 -7.170 708 1HB LYS1003 1HB LYS1003 -7.914 19.428 -5.873 709 2HB LYS1003 2HB LYS1003 -8.493 20.869 -6.684 710 1HG LYS1003 1HG LYS1003 -6.603 18.864 -7.998 711 2HG LYS1003 2HG LYS1003 -8.347 18.770 -8.142 712 1HD LYS1003 1HD LYS1003 -6.750 21.255 -8.909 713 2HD LYS1003 2HD LYS1003 -7.143 19.985 -10.051 714 1HE LYS1003 1HE LYS1003 -9.590 20.321 -9.549 715 2HE LYS1003 2HE LYS1003 -9.172 21.628 -8.460 716 1HZ LYS1003 1HZ LYS1003 -9.748 22.231 -10.811 717 2HZ LYS1003 2HZ LYS1003 -8.380 22.896 -10.217 718 3HZ LYS1003 3HZ LYS1003 -8.292 21.636 -11.251 719 H LEU1004 H LEU1004 -6.480 21.504 -3.742 720 HA LEU1004 HA LEU1004 -7.343 24.237 -4.281 721 1HB LEU1004 1HB LEU1004 -7.181 22.893 -1.596 722 2HB LEU1004 2HB LEU1004 -8.119 24.298 -2.061 723 HG LEU1004 HG LEU1004 -8.633 21.509 -3.124 724 1HD1 LEU1004 1HD1 LEU1004 -8.928 21.628 -0.664 725 2HD1 LEU1004 2HD1 LEU1004 -10.108 22.941 -0.898 726 3HD1 LEU1004 3HD1 LEU1004 -10.444 21.316 -1.544 727 1HD2 LEU1004 1HD2 LEU1004 -9.763 22.716 -4.648 728 2HD2 LEU1004 2HD2 LEU1004 -10.975 22.861 -3.353 729 3HD2 LEU1004 3HD2 LEU1004 -9.805 24.174 -3.627 730 H ALA1005 H ALA1005 -4.664 22.285 -2.972 731 HA ALA1005 HA ALA1005 -3.299 24.453 -1.781 732 1HB ALA1005 1HB ALA1005 -2.045 21.910 -2.853 733 2HB ALA1005 2HB ALA1005 -1.564 22.877 -1.438 734 3HB ALA1005 3HB ALA1005 -3.058 21.912 -1.389 735 H GLN1006 H GLN1006 -4.054 23.767 -5.015 736 HA GLN1006 HA GLN1006 -1.574 24.617 -6.117 737 1HB GLN1006 1HB GLN1006 -3.030 23.026 -7.318 738 2HB GLN1006 2HB GLN1006 -4.320 24.210 -7.380 739 1HG GLN1006 1HG GLN1006 -1.583 24.839 -8.544 740 2HG GLN1006 2HG GLN1006 -2.762 23.935 -9.474 741 1HE2 GLN1006 1HE2 GLN1006 -1.729 26.442 -10.180 742 2HE2 GLN1006 2HE2 GLN1006 -3.004 27.615 -10.187 743 H GLN1007 H GLN1007 -4.721 26.062 -5.245 744 HA GLN1007 HA GLN1007 -3.855 28.565 -6.421 745 1HB GLN1007 1HB GLN1007 -6.182 27.660 -6.853 746 2HB GLN1007 2HB GLN1007 -6.539 27.869 -5.150 747 1HG GLN1007 1HG GLN1007 -5.895 30.335 -5.412 748 2HG GLN1007 2HG GLN1007 -5.794 30.061 -7.140 749 1HE2 GLN1007 1HE2 GLN1007 -7.732 31.058 -4.675 750 2HE2 GLN1007 2HE2 GLN1007 -9.302 30.858 -5.379 751 H TYR1008 H TYR1008 -5.497 27.502 -3.345 752 HA TYR1008 HA TYR1008 -5.180 29.632 -1.795 753 1HB TYR1008 1HB TYR1008 -4.827 26.632 -1.458 754 2HB TYR1008 2HB TYR1008 -4.419 27.624 -0.073 755 HD1 TYR1008 HD1 TYR1008 -7.176 26.695 -2.382 756 HD2 TYR1008 HD2 TYR1008 -6.116 28.594 1.303 757 HE1 TYR1008 HE1 TYR1008 -9.627 26.784 -1.714 758 HE2 TYR1008 HE2 TYR1008 -8.571 28.676 1.958 759 HH TYR1008 HH TYR1008 -11.038 28.193 -0.235 760 H VAL1009 H VAL1009 -2.543 27.558 -2.983 761 HA VAL1009 HA VAL1009 -0.529 28.014 -1.272 762 HB VAL1009 HB VAL1009 -0.242 26.669 -3.202 763 1HG1 VAL1009 1HG1 VAL1009 -0.525 29.171 -4.901 764 2HG1 VAL1009 2HG1 VAL1009 -0.215 27.519 -5.487 765 3HG1 VAL1009 3HG1 VAL1009 -1.766 27.911 -4.706 766 1HG2 VAL1009 1HG2 VAL1009 1.687 28.307 -2.290 767 2HG2 VAL1009 2HG2 VAL1009 1.949 27.138 -3.607 768 3HG2 VAL1009 3HG2 VAL1009 1.631 28.848 -3.985 769 H MET1010 H MET1010 -1.906 30.348 -3.639 770 HA MET1010 HA MET1010 0.052 32.299 -3.093 771 1HB MET1010 1HB MET1010 -1.594 33.785 -4.357 772 2HB MET1010 2HB MET1010 -1.182 32.313 -5.215 773 1HG MET1010 1HG MET1010 -3.391 31.798 -5.318 774 2HG MET1010 2HG MET1010 -3.406 31.624 -3.575 775 1HE MET1010 1HE MET1010 -4.490 32.596 -2.202 776 2HE MET1010 2HE MET1010 -4.616 34.357 -1.977 777 3HE MET1010 3HE MET1010 -5.968 33.453 -2.699 778 H THR1011 H THR1011 -0.575 31.587 -0.581 779 HA THR1011 HA THR1011 -1.445 33.960 0.606 780 HB THR1011 HB THR1011 -3.658 32.968 -0.364 781 HG1 THR1011 HG1 THR1011 -4.618 33.818 1.559 782 1HG2 THR1011 1HG2 THR1011 -4.183 31.456 2.046 783 2HG2 THR1011 2HG2 THR1011 -4.322 30.907 0.359 784 3HG2 THR1011 3HG2 THR1011 -2.779 30.728 1.229 785 H SER1012 H SER1012 -1.897 33.533 3.083 786 HA SER1012 HA SER1012 0.395 32.222 3.973 787 1HB SER1012 1HB SER1012 -2.023 33.444 5.325 788 2HB SER1012 2HB SER1012 -0.850 32.560 6.281 789 HG SER1012 HG SER1012 0.822 34.000 5.377 790 H LEU1013 H LEU1013 -3.005 31.260 3.557 791 HA LEU1013 HA LEU1013 -3.170 29.118 5.256 792 1HB LEU1013 1HB LEU1013 -4.338 29.465 2.491 793 2HB LEU1013 2HB LEU1013 -4.834 28.237 3.640 794 HG LEU1013 HG LEU1013 -5.527 31.089 3.496 795 1HD1 LEU1013 1HD1 LEU1013 -6.913 28.916 5.060 796 2HD1 LEU1013 2HD1 LEU1013 -7.604 30.368 4.297 797 3HD1 LEU1013 3HD1 LEU1013 -7.028 29.020 3.287 798 1HD2 LEU1013 1HD2 LEU1013 -4.093 31.305 5.412 799 2HD2 LEU1013 2HD2 LEU1013 -5.787 31.344 5.958 800 3HD2 LEU1013 3HD2 LEU1013 -4.815 29.868 6.175 801 H GLN1014 H GLN1014 -1.313 29.504 2.269 802 HA GLN1014 HA GLN1014 -0.960 27.065 1.343 803 1HB GLN1014 1HB GLN1014 0.249 29.108 0.570 804 2HB GLN1014 2HB GLN1014 1.306 29.012 1.965 805 1HG GLN1014 1HG GLN1014 1.686 26.502 1.058 806 2HG GLN1014 2HG GLN1014 1.192 27.224 -0.461 807 1HE2 GLN1014 1HE2 GLN1014 3.286 27.886 2.342 808 2HE2 GLN1014 2HE2 GLN1014 4.629 28.540 1.465 809 H GLN1015 H GLN1015 1.283 28.328 3.922 810 HA GLN1015 HA GLN1015 2.463 25.986 4.518 811 1HB GLN1015 1HB GLN1015 2.634 27.040 6.924 812 2HB GLN1015 2HB GLN1015 3.400 27.849 5.571 813 1HG GLN1015 1HG GLN1015 1.711 29.513 5.434 814 2HG GLN1015 2HG GLN1015 0.535 28.533 6.288 815 1HE2 GLN1015 1HE2 GLN1015 1.489 31.258 6.773 816 2HE2 GLN1015 2HE2 GLN1015 2.081 31.313 8.400 817 H GLU1016 H GLU1016 -0.725 27.200 5.632 818 HA GLU1016 HA GLU1016 -1.122 25.287 7.595 819 1HB GLU1016 1HB GLU1016 -2.440 27.456 7.120 820 2HB GLU1016 2HB GLU1016 -3.315 26.547 5.903 821 1HG GLU1016 1HG GLU1016 -3.582 24.796 7.948 822 2HG GLU1016 2HG GLU1016 -3.364 26.251 8.899 823 H TYR1017 H TYR1017 -2.111 25.375 4.104 824 HA TYR1017 HA TYR1017 -3.441 22.935 4.083 825 1HB TYR1017 1HB TYR1017 -1.991 24.812 2.192 826 2HB TYR1017 2HB TYR1017 -2.346 23.216 1.561 827 HD1 TYR1017 HD1 TYR1017 -4.462 25.211 3.900 828 HD2 TYR1017 HD2 TYR1017 -3.979 23.703 -0.074 829 HE1 TYR1017 HE1 TYR1017 -6.822 25.960 3.321 830 HE2 TYR1017 HE2 TYR1017 -6.340 24.456 -0.640 831 HH TYR1017 HH TYR1017 -8.218 25.228 0.149 832 H LYS1018 H LYS1018 0.038 23.746 3.836 833 HA LYS1018 HA LYS1018 0.960 21.360 2.804 834 1HB LYS1018 1HB LYS1018 2.047 23.685 4.192 835 2HB LYS1018 2HB LYS1018 2.904 22.217 4.616 836 1HG LYS1018 1HG LYS1018 4.035 22.937 2.670 837 2HG LYS1018 2HG LYS1018 2.941 21.716 2.051 838 1HD LYS1018 1HD LYS1018 1.370 23.394 1.260 839 2HD LYS1018 2HD LYS1018 2.205 24.674 2.118 840 1HE LYS1018 1HE LYS1018 3.974 24.753 0.580 841 2HE LYS1018 2HE LYS1018 3.794 23.073 0.116 842 1HZ LYS1018 1HZ LYS1018 1.873 23.611 -1.117 843 2HZ LYS1018 2HZ LYS1018 1.808 25.135 -0.535 844 3HZ LYS1018 3HZ LYS1018 3.016 24.696 -1.544 845 H LYS1019 H LYS1019 0.278 22.299 6.230 846 HA LYS1019 HA LYS1019 1.169 19.943 7.386 847 1HB LYS1019 1HB LYS1019 -1.007 21.861 8.270 848 2HB LYS1019 2HB LYS1019 -0.315 20.606 9.278 849 1HG LYS1019 1HG LYS1019 1.145 22.990 8.058 850 2HG LYS1019 2HG LYS1019 0.843 22.697 9.759 851 1HD LYS1019 1HD LYS1019 2.944 21.793 9.762 852 2HD LYS1019 2HD LYS1019 2.162 20.377 9.089 853 1HE LYS1019 1HE LYS1019 3.198 20.645 7.078 854 2HE LYS1019 2HE LYS1019 2.736 22.332 6.982 855 1HZ LYS1019 1HZ LYS1019 4.869 21.536 8.800 856 2HZ LYS1019 2HZ LYS1019 5.190 21.708 7.208 857 3HZ LYS1019 3HZ LYS1019 4.625 22.976 8.068 858 H GLN1020 H GLN1020 -2.040 20.836 5.997 859 HA GLN1020 HA GLN1020 -3.432 18.644 6.782 860 1HB GLN1020 1HB GLN1020 -3.626 20.098 4.107 861 2HB GLN1020 2HB GLN1020 -4.871 19.071 4.787 862 1HG GLN1020 1HG GLN1020 -3.817 21.681 5.968 863 2HG GLN1020 2HG GLN1020 -5.407 21.411 5.282 864 1HE2 GLN1020 1HE2 GLN1020 -4.007 21.955 8.054 865 2HE2 GLN1020 2HE2 GLN1020 -4.921 20.986 9.162 866 H MET1021 H MET1021 -1.324 19.045 3.865 867 HA MET1021 HA MET1021 -1.834 16.672 2.659 868 1HB MET1021 1HB MET1021 0.022 18.789 2.435 869 2HB MET1021 2HB MET1021 1.048 17.391 2.692 870 1HG MET1021 1HG MET1021 -1.196 17.326 0.635 871 2HG MET1021 2HG MET1021 0.375 17.991 0.235 872 1HE MET1021 1HE MET1021 2.453 16.899 1.135 873 2HE MET1021 2HE MET1021 2.221 15.549 2.272 874 3HE MET1021 3HE MET1021 2.841 15.236 0.633 875 H LEU1022 H LEU1022 0.481 17.367 5.346 876 HA LEU1022 HA LEU1022 1.650 14.839 5.418 877 1HB LEU1022 1HB LEU1022 2.137 17.177 6.602 878 2HB LEU1022 2HB LEU1022 1.282 16.405 7.922 879 HG LEU1022 HG LEU1022 3.337 14.674 6.755 880 1HD1 LEU1022 1HD1 LEU1022 4.122 17.389 7.821 881 2HD1 LEU1022 2HD1 LEU1022 5.220 15.988 7.849 882 3HD1 LEU1022 3HD1 LEU1022 4.606 16.607 6.297 883 1HD2 LEU1022 1HD2 LEU1022 2.530 15.607 9.504 884 2HD2 LEU1022 2HD2 LEU1022 2.427 13.980 8.789 885 3HD2 LEU1022 3HD2 LEU1022 4.012 14.656 9.238 886 H THR1023 H THR1023 -1.366 16.152 6.848 887 HA THR1023 HA THR1023 -1.967 14.158 8.632 888 HB THR1023 HB THR1023 -4.023 15.436 6.784 889 HG1 THR1023 HG1 THR1023 -3.642 17.295 8.336 890 1HG2 THR1023 1HG2 THR1023 -3.895 15.135 9.828 891 2HG2 THR1023 2HG2 THR1023 -5.288 15.689 8.868 892 3HG2 THR1023 3HG2 THR1023 -4.752 13.995 8.764 893 H ALA1024 H ALA1024 -2.639 14.198 5.077 894 HA ALA1024 HA ALA1024 -3.785 11.594 5.166 895 1HB ALA1024 1HB ALA1024 -3.997 13.656 3.467 896 2HB ALA1024 2HB ALA1024 -2.686 12.779 2.641 897 3HB ALA1024 3HB ALA1024 -4.245 11.974 2.940 898 H ALA1025 H ALA1025 -0.634 12.966 3.987 899 HA ALA1025 HA ALA1025 0.531 10.668 3.113 900 1HB ALA1025 1HB ALA1025 2.633 11.988 4.277 901 2HB ALA1025 2HB ALA1025 1.912 12.429 2.710 902 3HB ALA1025 3HB ALA1025 1.417 13.285 4.189 903 H HIS1026 H HIS1026 -0.264 11.635 6.416 904 HA HIS1026 HA HIS1026 1.519 9.794 7.641 905 1HB HIS1026 1HB HIS1026 0.651 11.895 8.687 906 2HB HIS1026 2HB HIS1026 -0.934 11.155 8.788 907 HD1 HIS1026 HD1 HIS1026 2.604 10.059 9.838 908 HD2 HIS1026 HD2 HIS1026 -1.331 10.164 11.287 909 HE1 HIS1026 HE1 HIS1026 2.680 9.065 12.187 910 H ALA1027 H ALA1027 -2.096 9.882 7.226 911 HA ALA1027 HA ALA1027 -2.463 7.263 8.156 912 1HB ALA1027 1HB ALA1027 -4.709 7.556 6.988 913 2HB ALA1027 2HB ALA1027 -4.290 8.815 8.175 914 3HB ALA1027 3HB ALA1027 -4.119 9.141 6.433 915 H LEU1028 H LEU1028 -1.709 8.672 4.957 916 HA LEU1028 HA LEU1028 -2.359 6.591 3.316 917 1HB LEU1028 1HB LEU1028 -0.402 8.804 3.292 918 2HB LEU1028 2HB LEU1028 -0.059 7.481 2.196 919 HG LEU1028 HG LEU1028 -2.453 9.313 2.235 920 1HD1 LEU1028 1HD1 LEU1028 -0.952 10.328 0.864 921 2HD1 LEU1028 2HD1 LEU1028 -0.135 8.806 0.436 922 3HD1 LEU1028 3HD1 LEU1028 -1.692 9.223 -0.319 923 1HD2 LEU1028 1HD2 LEU1028 -3.613 7.352 1.903 924 2HD2 LEU1028 2HD2 LEU1028 -3.189 7.796 0.233 925 3HD2 LEU1028 3HD2 LEU1028 -2.249 6.550 1.089 926 H ALA1029 H ALA1029 0.922 7.116 4.801 927 HA ALA1029 HA ALA1029 2.006 4.717 4.062 928 1HB ALA1029 1HB ALA1029 2.958 5.350 6.672 929 2HB ALA1029 2HB ALA1029 3.705 5.747 5.107 930 3HB ALA1029 3HB ALA1029 2.575 6.891 5.868 931 H VAL1030 H VAL1030 -0.267 5.479 6.716 932 HA VAL1030 HA VAL1030 0.023 2.971 8.003 933 HB VAL1030 HB VAL1030 -1.888 5.277 8.117 934 1HG1 VAL1030 1HG1 VAL1030 -3.164 4.152 9.891 935 2HG1 VAL1030 2HG1 VAL1030 -3.304 3.286 8.342 936 3HG1 VAL1030 3HG1 VAL1030 -2.234 2.659 9.618 937 1HG2 VAL1030 1HG2 VAL1030 -0.136 5.832 9.464 938 2HG2 VAL1030 2HG2 VAL1030 -1.064 4.873 10.643 939 3HG2 VAL1030 3HG2 VAL1030 0.307 4.137 9.778 940 H ASP1031 H ASP1031 -2.899 4.303 6.304 941 HA ASP1031 HA ASP1031 -4.224 2.011 6.018 942 1HB ASP1031 1HB ASP1031 -5.080 3.045 3.789 943 2HB ASP1031 2HB ASP1031 -5.313 3.968 5.261 944 H ALA1032 H ALA1032 -1.531 3.297 3.988 945 HA ALA1032 HA ALA1032 -1.689 1.357 1.962 946 1HB ALA1032 1HB ALA1032 0.585 2.172 1.407 947 2HB ALA1032 2HB ALA1032 -0.537 3.518 1.719 948 3HB ALA1032 3HB ALA1032 0.646 3.040 2.960 949 H LYS1033 H LYS1033 -0.092 1.493 5.167 950 HA LYS1033 HA LYS1033 1.441 -0.859 4.729 951 1HB LYS1033 1HB LYS1033 0.775 0.848 7.122 952 2HB LYS1033 2HB LYS1033 1.609 -0.680 7.318 953 1HG LYS1033 1HG LYS1033 2.639 1.217 5.212 954 2HG LYS1033 2HG LYS1033 2.943 1.621 6.890 955 1HD LYS1033 1HD LYS1033 3.672 -0.992 6.972 956 2HD LYS1033 2HD LYS1033 3.977 -0.695 5.272 957 1HE LYS1033 1HE LYS1033 5.217 1.488 6.181 958 2HE LYS1033 2HE LYS1033 5.283 0.587 7.683 959 1HZ LYS1033 1HZ LYS1033 6.771 0.198 5.322 960 2HZ LYS1033 2HZ LYS1033 7.025 -0.417 6.813 961 3HZ LYS1033 3HZ LYS1033 6.035 -1.189 5.769 962 H ASN1034 H ASN1034 -1.619 -0.113 6.529 963 HA ASN1034 HA ASN1034 -2.114 -2.562 7.519 964 1HB ASN1034 1HB ASN1034 -3.499 -0.278 7.543 965 2HB ASN1034 2HB ASN1034 -4.369 -1.004 6.206 966 1HD2 ASN1034 1HD2 ASN1034 -5.984 -0.564 8.072 967 2HD2 ASN1034 2HD2 ASN1034 -6.359 -1.918 9.085 968 H LEU1035 H LEU1035 -2.381 -1.363 4.169 969 HA LEU1035 HA LEU1035 -4.029 -3.361 3.130 970 1HB LEU1035 1HB LEU1035 -3.521 -1.221 2.046 971 2HB LEU1035 2HB LEU1035 -1.865 -1.732 1.792 972 HG LEU1035 HG LEU1035 -3.980 -3.515 0.696 973 1HD1 LEU1035 1HD1 LEU1035 -5.052 -1.976 -0.486 974 2HD1 LEU1035 2HD1 LEU1035 -3.981 -0.694 0.129 975 3HD1 LEU1035 3HD1 LEU1035 -3.529 -1.608 -1.330 976 1HD2 LEU1035 1HD2 LEU1035 -1.719 -2.592 -0.963 977 2HD2 LEU1035 2HD2 LEU1035 -1.269 -3.457 0.526 978 3HD2 LEU1035 3HD2 LEU1035 -2.341 -4.233 -0.665 979 H LEU1036 H LEU1036 -0.423 -3.063 2.753 980 HA LEU1036 HA LEU1036 -0.139 -5.712 1.900 981 1HB LEU1036 1HB LEU1036 1.421 -3.457 2.024 982 2HB LEU1036 2HB LEU1036 2.178 -4.490 3.220 983 HG LEU1036 HG LEU1036 1.906 -6.257 1.171 984 1HD1 LEU1036 1HD1 LEU1036 1.894 -5.369 -0.894 985 2HD1 LEU1036 2HD1 LEU1036 1.133 -3.977 -0.087 986 3HD1 LEU1036 3HD1 LEU1036 2.882 -3.967 -0.418 987 1HD2 LEU1036 1HD2 LEU1036 4.073 -6.385 1.615 988 2HD2 LEU1036 2HD2 LEU1036 4.357 -4.869 0.726 989 3HD2 LEU1036 3HD2 LEU1036 3.997 -4.825 2.469 990 H ASP1037 H ASP1037 0.074 -4.142 5.134 991 HA ASP1037 HA ASP1037 1.161 -6.029 6.624 992 1HB ASP1037 1HB ASP1037 0.028 -3.839 7.346 993 2HB ASP1037 2HB ASP1037 -1.492 -4.711 7.360 994 H VAL1038 H VAL1038 -2.243 -5.958 5.379 995 HA VAL1038 HA VAL1038 -3.079 -8.304 6.682 996 HB VAL1038 HB VAL1038 -4.073 -6.913 4.187 997 1HG1 VAL1038 1HG1 VAL1038 -6.094 -8.368 5.660 998 2HG1 VAL1038 2HG1 VAL1038 -5.633 -8.490 3.945 999 3HG1 VAL1038 3HG1 VAL1038 -4.776 -9.459 5.168 1000 1HG2 VAL1038 1HG2 VAL1038 -5.317 -5.529 5.500 1001 2HG2 VAL1038 2HG2 VAL1038 -5.514 -6.741 6.789 1002 3HG2 VAL1038 3HG2 VAL1038 -3.990 -5.833 6.646 1003 H ILE1039 H ILE1039 -1.631 -7.632 3.447 1004 HA ILE1039 HA ILE1039 -1.922 -10.156 2.374 1005 HB ILE1039 HB ILE1039 -0.109 -7.839 1.954 1006 1HG1 ILE1039 1HG1 ILE1039 -1.958 -9.422 0.144 1007 2HG1 ILE1039 2HG1 ILE1039 -2.351 -7.916 0.950 1008 1HG2 ILE1039 1HG2 ILE1039 0.774 -9.405 -0.042 1009 2HG2 ILE1039 2HG2 ILE1039 1.620 -9.231 1.515 1010 3HG2 ILE1039 3HG2 ILE1039 0.567 -10.637 1.225 1011 1HD1 ILE1039 1HD1 ILE1039 -0.096 -7.089 -0.267 1012 2HD1 ILE1039 2HD1 ILE1039 -0.525 -8.404 -1.386 1013 3HD1 ILE1039 3HD1 ILE1039 -1.669 -7.072 -1.099 1014 H ASP1040 H ASP1040 0.704 -8.810 4.466 1015 HA ASP1040 HA ASP1040 2.398 -10.908 4.393 1016 1HB ASP1040 1HB ASP1040 2.457 -8.620 5.700 1017 2HB ASP1040 2HB ASP1040 1.719 -9.521 7.010 1018 H GLN1041 H GLN1041 -0.608 -10.425 6.334 1019 HA GLN1041 HA GLN1041 -0.292 -12.656 7.958 1020 1HB GLN1041 1HB GLN1041 -2.483 -10.768 7.243 1021 2HB GLN1041 2HB GLN1041 -3.020 -12.332 7.823 1022 1HG GLN1041 1HG GLN1041 -1.238 -11.959 9.741 1023 2HG GLN1041 2HG GLN1041 -1.310 -10.276 9.256 1024 1HE2 GLN1041 1HE2 GLN1041 -2.112 -9.928 11.407 1025 2HE2 GLN1041 2HE2 GLN1041 -3.793 -10.131 11.769 1026 H ALA1042 H ALA1042 -1.233 -12.280 4.600 1027 HA ALA1042 HA ALA1042 -2.668 -14.746 4.432 1028 1HB ALA1042 1HB ALA1042 -2.686 -12.521 2.954 1029 2HB ALA1042 2HB ALA1042 -1.435 -13.405 2.048 1030 3HB ALA1042 3HB ALA1042 -3.056 -14.112 2.246 1031 H ARG1043 H ARG1043 0.558 -13.592 3.201 1032 HA ARG1043 HA ARG1043 1.525 -15.739 2.096 1033 1HB ARG1043 1HB ARG1043 2.992 -14.060 4.192 1034 2HB ARG1043 2HB ARG1043 3.797 -15.117 3.050 1035 1HG ARG1043 1HG ARG1043 2.038 -13.527 1.479 1036 2HG ARG1043 2HG ARG1043 2.747 -12.419 2.637 1037 1HD ARG1043 1HD ARG1043 4.645 -12.378 1.392 1038 2HD ARG1043 2HD ARG1043 4.896 -14.074 1.755 1039 HE ARG1043 HE ARG1043 3.775 -12.958 -0.726 1040 1HH1 ARG1043 2HH2 ARG1043 4.162 -15.836 1.262 1041 2HH1 ARG1043 1HH2 ARG1043 3.897 -16.934 -0.051 1042 1HH2 ARG1043 2HH1 ARG1043 3.426 -14.406 -2.459 1043 2HH2 ARG1043 1HH1 ARG1043 3.475 -16.115 -2.182 1044 H LEU1044 H LEU1044 1.774 -15.182 5.692 1045 HA LEU1044 HA LEU1044 2.877 -17.605 6.356 1046 1HB LEU1044 1HB LEU1044 1.766 -17.196 8.587 1047 2HB LEU1044 2HB LEU1044 2.848 -15.955 7.984 1048 HG LEU1044 HG LEU1044 0.476 -15.017 7.041 1049 1HD1 LEU1044 1HD1 LEU1044 -1.048 -15.199 9.134 1050 2HD1 LEU1044 2HD1 LEU1044 -1.037 -16.521 7.943 1051 3HD1 LEU1044 3HD1 LEU1044 -0.130 -16.688 9.465 1052 1HD2 LEU1044 1HD2 LEU1044 2.150 -14.489 9.433 1053 2HD2 LEU1044 2HD2 LEU1044 1.669 -13.415 8.097 1054 3HD2 LEU1044 3HD2 LEU1044 0.526 -13.760 9.418 1055 H LYS1045 H LYS1045 -0.619 -16.712 6.039 1056 HA LYS1045 HA LYS1045 -1.746 -19.048 6.848 1057 1HB LYS1045 1HB LYS1045 -2.898 -16.922 6.171 1058 2HB LYS1045 2HB LYS1045 -2.668 -17.375 4.494 1059 1HG LYS1045 1HG LYS1045 -3.842 -19.531 6.175 1060 2HG LYS1045 2HG LYS1045 -4.846 -18.099 6.054 1061 1HD LYS1045 1HD LYS1045 -4.498 -18.210 3.504 1062 2HD LYS1045 2HD LYS1045 -3.761 -19.781 3.751 1063 1HE LYS1045 1HE LYS1045 -6.179 -19.874 5.236 1064 2HE LYS1045 2HE LYS1045 -6.600 -19.055 3.745 1065 1HZ LYS1045 1HZ LYS1045 -6.512 -21.641 3.914 1066 2HZ LYS1045 2HZ LYS1045 -6.111 -20.873 2.530 1067 3HZ LYS1045 3HZ LYS1045 -4.941 -21.415 3.532 1068 H MET1046 H MET1046 0.202 -18.425 3.975 1069 HA MET1046 HA MET1046 -0.668 -20.854 2.727 1070 1HB MET1046 1HB MET1046 0.165 -18.554 1.659 1071 2HB MET1046 2HB MET1046 1.769 -19.206 1.928 1072 1HG MET1046 1HG MET1046 1.474 -20.960 0.383 1073 2HG MET1046 2HG MET1046 -0.270 -20.967 0.556 1074 1HE MET1046 1HE MET1046 2.352 -18.260 0.130 1075 2HE MET1046 2HE MET1046 1.786 -17.292 -1.252 1076 3HE MET1046 3HE MET1046 0.900 -17.243 0.292 1077 H ILE1047 H ILE1047 2.345 -19.541 4.260 1078 HA ILE1047 HA ILE1047 3.878 -21.839 3.894 1079 HB ILE1047 HB ILE1047 3.987 -19.524 5.806 1080 1HG1 ILE1047 1HG1 ILE1047 6.278 -19.860 4.111 1081 2HG1 ILE1047 2HG1 ILE1047 4.834 -19.978 3.125 1082 1HG2 ILE1047 1HG2 ILE1047 5.449 -22.084 5.963 1083 2HG2 ILE1047 2HG2 ILE1047 6.461 -20.621 6.031 1084 3HG2 ILE1047 3HG2 ILE1047 5.144 -20.848 7.207 1085 1HD1 ILE1047 1HD1 ILE1047 5.910 -17.605 3.704 1086 2HD1 ILE1047 2HD1 ILE1047 4.144 -17.803 3.605 1087 3HD1 ILE1047 3HD1 ILE1047 4.950 -17.787 5.192 1088 H SER1048 H SER1048 2.060 -20.711 6.836 1089 HA SER1048 HA SER1048 2.447 -23.248 8.049 1090 1HB SER1048 1HB SER1048 1.140 -22.311 9.905 1091 2HB SER1048 2HB SER1048 2.340 -21.151 9.371 1092 HG SER1048 HG SER1048 -0.423 -21.139 8.500 1093 H GLN1049 H GLN1049 1.428 -24.337 6.016 1094 HA GLN1049 HA GLN1049 -1.130 -25.196 6.750 1095 1HB GLN1049 1HB GLN1049 -1.071 -22.886 5.039 1096 2HB GLN1049 2HB GLN1049 -1.624 -24.240 4.073 1097 1HG GLN1049 1HG GLN1049 -2.785 -23.805 6.840 1098 2HG GLN1049 2HG GLN1049 -3.363 -22.836 5.499 1099 1HE2 GLN1049 1HE2 GLN1049 -5.233 -24.237 6.547 1100 2HE2 GLN1049 2HE2 GLN1049 -5.653 -25.664 5.659 1101 H SER1050 H SER1050 0.576 -24.677 3.573 1102 HA SER1050 HA SER1050 1.408 -27.393 3.559 1103 1HB SER1050 1HB SER1050 -1.022 -27.491 2.803 1104 2HB SER1050 2HB SER1050 -0.576 -26.515 1.417 1105 HG SER1050 HG SER1050 1.076 -28.756 1.814 1106 H ARG1051 H ARG1051 3.525 -26.840 3.067 1107 HA ARG1051 HA ARG1051 4.137 -24.675 1.426 1108 1HB ARG1051 1HB ARG1051 5.547 -26.645 3.023 1109 2HB ARG1051 2HB ARG1051 6.332 -26.545 1.459 1110 1HG ARG1051 1HG ARG1051 6.519 -24.072 1.690 1111 2HG ARG1051 2HG ARG1051 5.685 -24.140 3.230 1112 1HD ARG1051 1HD ARG1051 7.547 -24.885 4.357 1113 2HD ARG1051 2HD ARG1051 8.020 -25.972 3.066 1114 HE ARG1051 HE ARG1051 9.348 -24.272 2.126 1115 1HH1 ARG1051 2HH2 ARG1051 7.234 -22.908 4.586 1116 2HH1 ARG1051 1HH2 ARG1051 8.021 -21.365 4.589 1117 1HH2 ARG1051 2HH1 ARG1051 10.386 -22.237 2.129 1118 2HH2 ARG1051 1HH1 ARG1051 9.826 -20.981 3.182 1119 HA PRO1052 HA PRO1052 4.904 -28.087 -1.809 1120 1HB PRO1052 1HB PRO1052 4.054 -30.637 -1.319 1121 2HB PRO1052 2HB PRO1052 5.697 -30.102 -1.027 1122 1HG PRO1052 1HG PRO1052 3.542 -30.622 0.929 1123 2HG PRO1052 2HG PRO1052 5.269 -30.506 1.203 1124 1HD PRO1052 1HD PRO1052 3.298 -28.511 1.804 1125 2HD PRO1052 2HD PRO1052 5.036 -28.351 1.970 1126 H HIS1053 H HIS1053 3.748 -28.353 -3.694 1127 HA HIS1053 HA HIS1053 0.988 -27.657 -3.338 1128 1HB HIS1053 1HB HIS1053 0.957 -27.245 -5.660 1129 2HB HIS1053 2HB HIS1053 2.506 -26.665 -5.080 1130 HD1 HIS1053 HD1 HIS1053 1.395 -28.063 -7.985 1131 HD2 HIS1053 HD2 HIS1053 4.324 -29.354 -5.274 1132 HE1 HIS1053 HE1 HIS1053 2.936 -29.626 -9.287 Start of MODEL 8 1 H MET 915 H MET 915 9.699 -23.467 -6.596 2 HA MET 915 HA MET 915 8.114 -24.416 -4.497 3 1HB MET 915 1HB MET 915 10.746 -24.589 -5.147 4 2HB MET 915 2HB MET 915 10.870 -23.246 -4.029 5 1HG MET 915 1HG MET 915 11.001 -24.863 -2.413 6 2HG MET 915 2HG MET 915 9.260 -24.961 -2.583 7 1HE MET 915 1HE MET 915 10.683 -27.216 -1.393 8 2HE MET 915 2HE MET 915 9.020 -27.580 -1.911 9 3HE MET 915 3HE MET 915 10.344 -28.697 -2.319 10 H ALA 916 H ALA 916 10.065 -21.356 -4.818 11 HA ALA 916 HA ALA 916 8.391 -20.218 -2.697 12 1HB ALA 916 1HB ALA 916 11.215 -19.841 -3.636 13 2HB ALA 916 2HB ALA 916 10.371 -18.437 -2.939 14 3HB ALA 916 3HB ALA 916 10.565 -19.925 -1.981 15 H ASN 917 H ASN 917 6.565 -19.431 -3.715 16 HA ASN 917 HA ASN 917 6.559 -18.422 -6.279 17 1HB ASN 917 1HB ASN 917 4.726 -18.346 -3.899 18 2HB ASN 917 2HB ASN 917 4.430 -17.122 -5.118 19 1HD2 ASN 917 1HD2 ASN 917 3.810 -17.691 -7.188 20 2HD2 ASN 917 2HD2 ASN 917 3.201 -19.259 -7.602 21 H LEU 918 H LEU 918 8.447 -16.929 -6.324 22 HA LEU 918 HA LEU 918 7.821 -14.353 -5.061 23 1HB LEU 918 1HB LEU 918 10.198 -16.032 -4.823 24 2HB LEU 918 2HB LEU 918 10.570 -14.405 -5.355 25 HG LEU 918 HG LEU 918 8.697 -14.404 -3.117 26 1HD1 LEU 918 1HD1 LEU 918 10.971 -16.242 -2.977 27 2HD1 LEU 918 2HD1 LEU 918 10.959 -15.028 -1.675 28 3HD1 LEU 918 3HD1 LEU 918 9.548 -16.085 -1.920 29 1HD2 LEU 918 1HD2 LEU 918 10.106 -12.699 -2.280 30 2HD2 LEU 918 2HD2 LEU 918 11.484 -13.245 -3.266 31 3HD2 LEU 918 3HD2 LEU 918 10.073 -12.492 -4.047 32 H ASP 919 H ASP 919 6.631 -14.221 -7.230 33 HA ASP 919 HA ASP 919 8.347 -13.994 -9.495 34 1HB ASP 919 1HB ASP 919 5.697 -14.604 -9.174 35 2HB ASP 919 2HB ASP 919 5.556 -12.900 -9.557 36 H ARG 920 H ARG 920 7.071 -11.742 -10.813 37 HA ARG 920 HA ARG 920 8.367 -9.641 -9.361 38 1HB ARG 920 1HB ARG 920 7.458 -10.123 -12.163 39 2HB ARG 920 2HB ARG 920 7.311 -8.458 -11.638 40 1HG ARG 920 1HG ARG 920 9.591 -8.146 -11.518 41 2HG ARG 920 2HG ARG 920 9.887 -9.755 -10.890 42 1HD ARG 920 1HD ARG 920 10.130 -10.690 -12.996 43 2HD ARG 920 2HD ARG 920 8.911 -9.657 -13.716 44 HE ARG 920 HE ARG 920 11.383 -8.267 -12.907 45 1HH1 ARG 920 2HH2 ARG 920 9.646 -9.889 -15.535 46 2HH1 ARG 920 1HH2 ARG 920 10.585 -9.142 -16.784 47 1HH2 ARG 920 1HH1 ARG 920 12.330 -7.612 -16.184 48 H SER 921 H SER 921 5.569 -10.985 -8.749 49 HA SER 921 HA SER 921 3.830 -8.730 -9.076 50 1HB SER 921 1HB SER 921 3.363 -11.385 -7.645 51 2HB SER 921 2HB SER 921 2.127 -10.206 -8.036 52 HG SER 921 HG SER 921 2.837 -12.213 -9.557 53 H ASN 922 H ASN 922 4.730 -10.826 -6.230 54 HA ASN 922 HA ASN 922 3.896 -9.044 -4.336 55 1HB ASN 922 1HB ASN 922 5.254 -10.365 -2.758 56 2HB ASN 922 2HB ASN 922 4.531 -11.451 -3.928 57 1HD2 ASN 922 1HD2 ASN 922 5.776 -12.351 -5.581 58 2HD2 ASN 922 2HD2 ASN 922 7.503 -12.452 -5.500 59 H ASP 923 H ASP 923 6.633 -8.959 -6.486 60 HA ASP 923 HA ASP 923 8.284 -7.405 -4.760 61 1HB ASP 923 1HB ASP 923 8.412 -8.485 -7.558 62 2HB ASP 923 2HB ASP 923 9.372 -7.053 -7.241 63 H LYS 924 H LYS 924 6.857 -6.855 -8.079 64 HA LYS 924 HA LYS 924 7.208 -4.173 -8.245 65 1HB LYS 924 1HB LYS 924 6.367 -5.719 -10.022 66 2HB LYS 924 2HB LYS 924 4.793 -5.701 -9.255 67 1HG LYS 924 1HG LYS 924 4.551 -3.993 -10.844 68 2HG LYS 924 2HG LYS 924 4.999 -3.076 -9.419 69 1HD LYS 924 1HD LYS 924 7.486 -3.502 -10.315 70 2HD LYS 924 2HD LYS 924 6.671 -3.748 -11.847 71 1HE LYS 924 1HE LYS 924 5.478 -1.412 -10.767 72 2HE LYS 924 2HE LYS 924 7.186 -1.246 -10.407 73 1HZ LYS 924 1HZ LYS 924 6.630 -0.392 -12.579 74 2HZ LYS 924 2HZ LYS 924 7.665 -1.647 -12.716 75 3HZ LYS 924 3HZ LYS 924 6.082 -1.852 -13.063 76 H VAL 925 H VAL 925 4.392 -5.903 -6.756 77 HA VAL 925 HA VAL 925 2.957 -3.653 -6.049 78 HB VAL 925 HB VAL 925 3.189 -6.288 -4.581 79 1HG1 VAL 925 1HG1 VAL 925 1.912 -4.110 -3.656 80 2HG1 VAL 925 2HG1 VAL 925 0.633 -4.763 -4.708 81 3HG1 VAL 925 3HG1 VAL 925 1.311 -5.766 -3.402 82 1HG2 VAL 925 1HG2 VAL 925 0.921 -5.891 -6.415 83 2HG2 VAL 925 2HG2 VAL 925 2.506 -5.957 -7.224 84 3HG2 VAL 925 3HG2 VAL 925 1.981 -7.303 -6.184 85 H TYR 926 H TYR 926 5.185 -5.590 -3.918 86 HA TYR 926 HA TYR 926 5.172 -3.854 -1.787 87 1HB TYR 926 1HB TYR 926 7.138 -5.802 -3.091 88 2HB TYR 926 2HB TYR 926 7.654 -4.919 -1.668 89 HD1 TYR 926 HD1 TYR 926 4.251 -6.292 -2.360 90 HD2 TYR 926 HD2 TYR 926 7.839 -6.628 -0.055 91 HE1 TYR 926 HE1 TYR 926 3.142 -8.032 -0.874 92 HE2 TYR 926 HE2 TYR 926 6.718 -8.367 1.423 93 HH TYR 926 HH TYR 926 4.987 -9.774 1.546 94 H GLU 927 H GLU 927 7.027 -3.711 -4.848 95 HA GLU 927 HA GLU 927 8.785 -1.722 -3.925 96 1HB GLU 927 1HB GLU 927 8.034 -2.792 -6.662 97 2HB GLU 927 2HB GLU 927 9.115 -1.421 -6.508 98 1HG GLU 927 1HG GLU 927 9.609 -3.988 -4.950 99 2HG GLU 927 2HG GLU 927 10.161 -3.816 -6.605 100 H ASN 928 H ASN 928 5.796 -1.685 -5.981 101 HA ASN 928 HA ASN 928 5.788 1.003 -6.487 102 1HB ASN 928 1HB ASN 928 4.210 -1.020 -7.266 103 2HB ASN 928 2HB ASN 928 3.192 -0.475 -5.948 104 1HD2 ASN 928 1HD2 ASN 928 4.876 0.559 -8.876 105 2HD2 ASN 928 2HD2 ASN 928 3.805 1.847 -9.318 106 H VAL 929 H VAL 929 4.233 -0.926 -3.823 107 HA VAL 929 HA VAL 929 2.911 1.105 -2.537 108 HB VAL 929 HB VAL 929 4.287 -1.360 -1.455 109 1HG1 VAL 929 1HG1 VAL 929 2.954 -1.150 0.540 110 2HG1 VAL 929 2HG1 VAL 929 3.849 0.370 0.306 111 3HG1 VAL 929 3HG1 VAL 929 2.120 0.283 -0.107 112 1HG2 VAL 929 1HG2 VAL 929 2.319 -1.370 -3.239 113 2HG2 VAL 929 2HG2 VAL 929 2.369 -2.540 -1.899 114 3HG2 VAL 929 3HG2 VAL 929 1.323 -1.104 -1.788 115 H THR 930 H THR 930 6.276 -0.111 -1.883 116 HA THR 930 HA THR 930 6.908 1.779 0.046 117 HB THR 930 HB THR 930 9.316 1.194 -0.883 118 HG1 THR 930 HG1 THR 930 9.199 -0.161 -2.654 119 1HG2 THR 930 1HG2 THR 930 9.203 -0.465 0.681 120 2HG2 THR 930 2HG2 THR 930 7.429 -0.321 0.684 121 3HG2 THR 930 3HG2 THR 930 8.229 -1.453 -0.433 122 H GLY 931 H GLY 931 7.587 1.900 -3.516 123 1HA GLY 931 1HA GLY 931 8.781 4.394 -3.566 124 2HA GLY 931 2HA GLY 931 7.886 3.659 -4.882 125 H LEU 932 H LEU 932 5.325 3.476 -3.331 126 HA LEU 932 HA LEU 932 4.336 6.036 -4.009 127 1HB LEU 932 1HB LEU 932 2.505 4.833 -4.164 128 2HB LEU 932 2HB LEU 932 3.324 3.454 -3.457 129 HG LEU 932 HG LEU 932 2.674 4.193 -1.206 130 1HD1 LEU 932 1HD1 LEU 932 0.678 6.068 -1.540 131 2HD1 LEU 932 2HD1 LEU 932 2.314 6.374 -0.909 132 3HD1 LEU 932 3HD1 LEU 932 1.960 6.644 -2.632 133 1HD2 LEU 932 1HD2 LEU 932 0.222 4.144 -2.972 134 2HD2 LEU 932 2HD2 LEU 932 1.221 2.707 -2.652 135 3HD2 LEU 932 3HD2 LEU 932 0.403 3.540 -1.308 136 H VAL 933 H VAL 933 4.602 4.306 -0.820 137 HA VAL 933 HA VAL 933 3.932 6.570 0.681 138 HB VAL 933 HB VAL 933 4.814 5.271 2.564 139 1HG1 VAL 933 1HG1 VAL 933 2.558 4.822 1.373 140 2HG1 VAL 933 2HG1 VAL 933 3.339 3.338 0.777 141 3HG1 VAL 933 3HG1 VAL 933 3.166 3.611 2.527 142 1HG2 VAL 933 1HG2 VAL 933 5.857 3.428 0.394 143 2HG2 VAL 933 2HG2 VAL 933 6.792 4.280 1.646 144 3HG2 VAL 933 3HG2 VAL 933 5.694 2.955 2.102 145 H LYS 934 H LYS 934 7.058 5.246 -0.509 146 HA LYS 934 HA LYS 934 8.800 6.760 0.940 147 1HB LYS 934 1HB LYS 934 8.905 5.781 -1.919 148 2HB LYS 934 2HB LYS 934 10.257 6.594 -1.156 149 1HG LYS 934 1HG LYS 934 9.063 4.424 0.494 150 2HG LYS 934 2HG LYS 934 9.760 3.870 -1.016 151 1HD LYS 934 1HD LYS 934 11.806 3.973 -0.046 152 2HD LYS 934 2HD LYS 934 11.650 5.718 0.001 153 1HE LYS 934 1HE LYS 934 11.722 5.550 2.268 154 2HE LYS 934 2HE LYS 934 10.097 4.900 2.185 155 1HZ LYS 934 1HZ LYS 934 12.564 3.308 2.055 156 2HZ LYS 934 2HZ LYS 934 11.573 3.426 3.348 157 3HZ LYS 934 3HZ LYS 934 11.049 2.703 1.981 158 H ALA 935 H ALA 935 6.789 7.710 -1.876 159 HA ALA 935 HA ALA 935 8.006 10.305 -2.017 160 1HB ALA 935 1HB ALA 935 6.185 10.675 -3.709 161 2HB ALA 935 2HB ALA 935 7.186 9.241 -4.039 162 3HB ALA 935 3HB ALA 935 5.564 9.050 -3.332 163 H VAL 936 H VAL 936 4.926 8.852 -0.803 164 HA VAL 936 HA VAL 936 3.455 10.974 -0.172 165 HB VAL 936 HB VAL 936 4.053 8.438 1.310 166 1HG1 VAL 936 1HG1 VAL 936 3.556 9.982 3.100 167 2HG1 VAL 936 2HG1 VAL 936 2.146 10.618 2.218 168 3HG1 VAL 936 3HG1 VAL 936 2.134 8.946 2.828 169 1HG2 VAL 936 1HG2 VAL 936 1.898 7.759 0.555 170 2HG2 VAL 936 2HG2 VAL 936 1.465 9.418 0.076 171 3HG2 VAL 936 3HG2 VAL 936 2.705 8.523 -0.836 172 H ILE 937 H ILE 937 6.407 9.886 1.589 173 HA ILE 937 HA ILE 937 6.160 12.084 3.441 174 HB ILE 937 HB ILE 937 8.161 9.861 3.076 175 1HG1 ILE 937 1HG1 ILE 937 6.398 10.341 5.468 176 2HG1 ILE 937 2HG1 ILE 937 5.761 9.535 4.048 177 1HG2 ILE 937 1HG2 ILE 937 9.668 11.036 4.201 178 2HG2 ILE 937 2HG2 ILE 937 8.537 12.397 4.386 179 3HG2 ILE 937 3HG2 ILE 937 8.549 11.081 5.584 180 1HD1 ILE 937 1HD1 ILE 937 8.122 8.665 5.765 181 2HD1 ILE 937 2HD1 ILE 937 6.588 7.802 5.501 182 3HD1 ILE 937 3HD1 ILE 937 7.769 7.943 4.177 183 H GLU 938 H GLU 938 8.802 10.977 1.198 184 HA GLU 938 HA GLU 938 10.397 13.023 1.184 185 1HB GLU 938 1HB GLU 938 9.717 10.998 -0.692 186 2HB GLU 938 2HB GLU 938 9.791 12.485 -1.617 187 1HG GLU 938 1HG GLU 938 12.045 12.127 -1.661 188 2HG GLU 938 2HG GLU 938 12.033 12.753 -0.024 189 H MET 939 H MET 939 7.208 13.021 -0.521 190 HA MET 939 HA MET 939 7.374 15.380 -1.813 191 1HB MET 939 1HB MET 939 5.273 13.620 -0.725 192 2HB MET 939 2HB MET 939 4.752 15.293 -0.691 193 1HG MET 939 1HG MET 939 5.317 15.526 -3.117 194 2HG MET 939 2HG MET 939 5.858 13.859 -3.155 195 1HE MET 939 1HE MET 939 1.578 15.121 -2.065 196 2HE MET 939 2HE MET 939 2.689 14.577 -0.785 197 3HE MET 939 3HE MET 939 3.082 16.019 -1.751 198 H SER 940 H SER 940 5.700 15.066 1.406 199 HA SER 940 HA SER 940 5.329 17.594 2.000 200 1HB SER 940 1HB SER 940 5.881 16.937 4.449 201 2HB SER 940 2HB SER 940 4.645 16.015 3.616 202 HG SER 940 HG SER 940 6.937 14.769 3.043 203 H SER 941 H SER 941 8.484 15.916 1.970 204 HA SER 941 HA SER 941 9.914 17.858 3.339 205 1HB SER 941 1HB SER 941 10.548 15.417 2.578 206 2HB SER 941 2HB SER 941 11.108 16.189 1.108 207 HG SER 941 HG SER 941 12.346 16.043 3.539 208 H LYS 942 H LYS 942 9.442 17.271 -0.219 209 HA LYS 942 HA LYS 942 10.496 19.961 -0.697 210 1HB LYS 942 1HB LYS 942 10.804 19.214 -3.014 211 2HB LYS 942 2HB LYS 942 11.665 18.195 -1.879 212 1HG LYS 942 1HG LYS 942 10.491 16.356 -2.513 213 2HG LYS 942 2HG LYS 942 8.960 17.171 -2.269 214 1HD LYS 942 1HD LYS 942 10.341 18.178 -4.663 215 2HD LYS 942 2HD LYS 942 10.102 16.444 -4.745 216 1HE LYS 942 1HE LYS 942 7.669 16.756 -4.232 217 2HE LYS 942 2HE LYS 942 7.909 18.491 -4.157 218 1HZ LYS 942 1HZ LYS 942 7.856 18.600 -6.346 219 2HZ LYS 942 2HZ LYS 942 8.954 17.407 -6.545 220 3HZ LYS 942 3HZ LYS 942 7.371 17.041 -6.382 221 H ILE 943 H ILE 943 7.792 19.287 0.441 222 HA ILE 943 HA ILE 943 6.057 19.994 -1.785 223 HB ILE 943 HB ILE 943 5.744 18.246 0.249 224 1HG1 ILE 943 1HG1 ILE 943 4.375 18.887 -1.943 225 2HG1 ILE 943 2HG1 ILE 943 3.725 17.834 -0.702 226 1HG2 ILE 943 1HG2 ILE 943 5.652 19.875 2.007 227 2HG2 ILE 943 2HG2 ILE 943 4.417 20.818 1.139 228 3HG2 ILE 943 3HG2 ILE 943 4.020 19.204 1.775 229 1HD1 ILE 943 1HD1 ILE 943 2.387 19.572 0.247 230 2HD1 ILE 943 2HD1 ILE 943 3.301 20.844 -0.598 231 3HD1 ILE 943 3HD1 ILE 943 2.213 19.772 -1.513 232 H GLN 944 H GLN 944 6.992 21.178 1.513 233 HA GLN 944 HA GLN 944 5.520 23.433 1.560 234 1HB GLN 944 1HB GLN 944 7.860 22.397 2.912 235 2HB GLN 944 2HB GLN 944 8.091 24.111 2.629 236 1HG GLN 944 1HG GLN 944 5.571 24.281 3.505 237 2HG GLN 944 2HG GLN 944 5.932 22.728 4.232 238 1HE2 GLN 944 1HE2 GLN 944 6.512 22.879 6.248 239 2HE2 GLN 944 2HE2 GLN 944 7.480 24.115 6.980 240 HA PRO 945 HA PRO 945 8.912 25.627 -0.933 241 1HB PRO 945 1HB PRO 945 10.868 24.160 -2.155 242 2HB PRO 945 2HB PRO 945 11.080 24.929 -0.594 243 1HG PRO 945 1HG PRO 945 10.655 22.069 -1.209 244 2HG PRO 945 2HG PRO 945 11.282 22.795 0.258 245 1HD PRO 945 1HD PRO 945 8.646 21.739 -0.142 246 2HD PRO 945 2HD PRO 945 9.237 22.569 1.283 247 H ALA 946 H ALA 946 8.369 22.438 -2.336 248 HA ALA 946 HA ALA 946 8.296 22.923 -4.932 249 1HB ALA 946 1HB ALA 946 7.615 20.788 -4.473 250 2HB ALA 946 2HB ALA 946 6.623 21.288 -3.082 251 3HB ALA 946 3HB ALA 946 6.001 21.491 -4.737 252 HA PRO 947 HA PRO 947 5.542 26.273 -5.413 253 1HB PRO 947 1HB PRO 947 5.861 26.618 -8.105 254 2HB PRO 947 2HB PRO 947 6.942 27.315 -6.915 255 1HG PRO 947 1HG PRO 947 7.388 24.992 -8.689 256 2HG PRO 947 2HG PRO 947 8.569 25.953 -7.821 257 1HD PRO 947 1HD PRO 947 7.624 23.339 -7.109 258 2HD PRO 947 2HD PRO 947 8.716 24.348 -6.181 259 HA PRO 948 HA PRO 948 1.844 24.822 -6.924 260 1HB PRO 948 1HB PRO 948 0.677 26.895 -8.269 261 2HB PRO 948 2HB PRO 948 0.689 26.773 -6.521 262 1HG PRO 948 1HG PRO 948 2.300 28.531 -8.268 263 2HG PRO 948 2HG PRO 948 1.984 28.682 -6.551 264 1HD PRO 948 1HD PRO 948 4.403 27.744 -7.775 265 2HD PRO 948 2HD PRO 948 4.043 27.786 -6.060 266 H GLU 949 H GLU 949 4.131 25.849 -9.196 267 HA GLU 949 HA GLU 949 2.606 24.738 -11.368 268 1HB GLU 949 1HB GLU 949 5.013 26.450 -11.065 269 2HB GLU 949 2HB GLU 949 5.118 25.305 -12.387 270 1HG GLU 949 1HG GLU 949 3.967 26.903 -13.557 271 2HG GLU 949 2HG GLU 949 2.561 26.215 -12.768 272 H GLU 950 H GLU 950 4.771 23.668 -8.928 273 HA GLU 950 HA GLU 950 5.484 21.372 -10.581 274 1HB GLU 950 1HB GLU 950 7.180 23.086 -9.165 275 2HB GLU 950 2HB GLU 950 7.027 21.711 -8.089 276 1HG GLU 950 1HG GLU 950 8.258 20.362 -9.456 277 2HG GLU 950 2HG GLU 950 7.377 20.861 -10.886 278 H TYR 951 H TYR 951 3.418 22.471 -8.162 279 HA TYR 951 HA TYR 951 3.489 20.030 -6.589 280 1HB TYR 951 1HB TYR 951 3.185 22.350 -5.608 281 2HB TYR 951 2HB TYR 951 1.778 22.595 -6.624 282 HD1 TYR 951 HD1 TYR 951 2.555 19.439 -4.821 283 HD2 TYR 951 HD2 TYR 951 0.163 22.985 -4.913 284 HE1 TYR 951 HE1 TYR 951 1.065 18.489 -2.994 285 HE2 TYR 951 HE2 TYR 951 -1.319 22.023 -3.085 286 HH TYR 951 HH TYR 951 -0.787 20.168 -1.127 287 H VAL 952 H VAL 952 1.334 21.805 -8.883 288 HA VAL 952 HA VAL 952 -0.913 20.289 -8.698 289 HB VAL 952 HB VAL 952 0.410 21.957 -10.723 290 1HG1 VAL 952 1HG1 VAL 952 -1.652 19.892 -11.562 291 2HG1 VAL 952 2HG1 VAL 952 -1.194 21.315 -12.528 292 3HG1 VAL 952 3HG1 VAL 952 0.014 20.059 -12.165 293 1HG2 VAL 952 1HG2 VAL 952 -1.372 23.290 -10.363 294 2HG2 VAL 952 2HG2 VAL 952 -2.531 21.944 -10.483 295 3HG2 VAL 952 3HG2 VAL 952 -1.665 22.240 -8.956 296 HA PRO 953 HA PRO 953 1.126 17.116 -11.560 297 1HB PRO 953 1HB PRO 953 3.823 17.212 -11.994 298 2HB PRO 953 2HB PRO 953 2.650 17.905 -13.096 299 1HG PRO 953 1HG PRO 953 4.434 19.282 -11.183 300 2HG PRO 953 2HG PRO 953 3.584 19.946 -12.564 301 1HD PRO 953 1HD PRO 953 2.860 20.233 -9.804 302 2HD PRO 953 2HD PRO 953 1.949 20.797 -11.190 303 H MET 954 H MET 954 3.337 18.141 -9.027 304 HA MET 954 HA MET 954 4.452 15.868 -8.301 305 1HB MET 954 1HB MET 954 4.741 17.987 -7.066 306 2HB MET 954 2HB MET 954 3.077 17.950 -6.519 307 1HG MET 954 1HG MET 954 3.900 15.533 -5.553 308 2HG MET 954 2HG MET 954 5.436 16.375 -5.535 309 1HE MET 954 1HE MET 954 5.788 18.756 -3.739 310 2HE MET 954 2HE MET 954 4.975 19.089 -5.287 311 3HE MET 954 3HE MET 954 4.287 19.712 -3.768 312 H VAL 955 H VAL 955 1.285 16.885 -6.812 313 HA VAL 955 HA VAL 955 0.763 14.438 -5.631 314 HB VAL 955 HB VAL 955 -0.899 16.780 -6.502 315 1HG1 VAL 955 1HG1 VAL 955 -1.886 14.126 -5.468 316 2HG1 VAL 955 2HG1 VAL 955 -2.752 15.633 -5.082 317 3HG1 VAL 955 3HG1 VAL 955 -2.535 15.141 -6.779 318 1HG2 VAL 955 1HG2 VAL 955 0.702 16.345 -4.318 319 2HG2 VAL 955 2HG2 VAL 955 -0.650 17.501 -4.383 320 3HG2 VAL 955 3HG2 VAL 955 -0.899 15.878 -3.695 321 H LYS 956 H LYS 956 -0.333 15.759 -8.829 322 HA LYS 956 HA LYS 956 -1.917 13.751 -9.669 323 1HB LYS 956 1HB LYS 956 0.066 15.475 -11.154 324 2HB LYS 956 2HB LYS 956 -0.935 14.310 -11.996 325 1HG LYS 956 1HG LYS 956 -2.167 16.309 -10.064 326 2HG LYS 956 2HG LYS 956 -1.827 16.759 -11.723 327 1HD LYS 956 1HD LYS 956 -3.290 14.168 -11.313 328 2HD LYS 956 2HD LYS 956 -4.180 15.633 -10.948 329 1HE LYS 956 1HE LYS 956 -3.421 16.507 -13.264 330 2HE LYS 956 2HE LYS 956 -2.874 14.876 -13.598 331 1HZ LYS 956 1HZ LYS 956 -5.522 15.891 -13.510 332 2HZ LYS 956 2HZ LYS 956 -4.953 14.537 -14.223 333 3HZ LYS 956 3HZ LYS 956 -5.362 14.517 -12.643 334 H GLU 957 H GLU 957 1.679 13.771 -9.550 335 HA GLU 957 HA GLU 957 2.070 11.436 -10.943 336 1HB GLU 957 1HB GLU 957 3.650 13.293 -9.559 337 2HB GLU 957 2HB GLU 957 3.938 11.796 -8.694 338 1HG GLU 957 1HG GLU 957 4.157 12.097 -11.727 339 2HG GLU 957 2HG GLU 957 5.520 12.168 -10.628 340 H VAL 958 H VAL 958 1.718 11.958 -7.364 341 HA VAL 958 HA VAL 958 2.039 9.430 -6.471 342 HB VAL 958 HB VAL 958 0.028 11.522 -5.625 343 1HG1 VAL 958 1HG1 VAL 958 1.060 9.347 -3.815 344 2HG1 VAL 958 2HG1 VAL 958 -0.387 10.368 -3.646 345 3HG1 VAL 958 3HG1 VAL 958 -0.356 9.062 -4.855 346 1HG2 VAL 958 1HG2 VAL 958 1.699 12.571 -4.554 347 2HG2 VAL 958 2HG2 VAL 958 2.381 11.047 -3.939 348 3HG2 VAL 958 3HG2 VAL 958 2.792 11.609 -5.577 349 H GLY 959 H GLY 959 -0.818 10.820 -8.148 350 1HA GLY 959 1HA GLY 959 -2.590 8.694 -7.741 351 2HA GLY 959 2HA GLY 959 -2.629 9.850 -9.058 352 H LEU 960 H LEU 960 -0.119 9.317 -10.319 353 HA LEU 960 HA LEU 960 -0.824 7.148 -11.922 354 1HB LEU 960 1HB LEU 960 1.015 9.242 -11.955 355 2HB LEU 960 2HB LEU 960 2.007 7.798 -11.964 356 HG LEU 960 HG LEU 960 -0.264 8.253 -13.912 357 1HD1 LEU 960 1HD1 LEU 960 1.844 9.898 -13.860 358 2HD1 LEU 960 2HD1 LEU 960 2.557 8.565 -14.801 359 3HD1 LEU 960 3HD1 LEU 960 1.071 9.362 -15.371 360 1HD2 LEU 960 1HD2 LEU 960 0.924 5.917 -13.307 361 2HD2 LEU 960 2HD2 LEU 960 0.319 6.322 -14.932 362 3HD2 LEU 960 3HD2 LEU 960 2.048 6.509 -14.554 363 H ALA 961 H ALA 961 1.444 7.463 -9.138 364 HA ALA 961 HA ALA 961 2.476 4.859 -9.354 365 1HB ALA 961 1HB ALA 961 2.747 7.177 -7.684 366 2HB ALA 961 2HB ALA 961 2.488 5.761 -6.637 367 3HB ALA 961 3HB ALA 961 3.827 5.767 -7.809 368 H LEU 962 H LEU 962 -0.332 6.294 -7.607 369 HA LEU 962 HA LEU 962 -0.980 3.967 -6.183 370 1HB LEU 962 1HB LEU 962 -2.136 5.584 -5.215 371 2HB LEU 962 2HB LEU 962 -2.045 6.618 -6.627 372 HG LEU 962 HG LEU 962 -3.981 4.357 -6.751 373 1HD1 LEU 962 1HD1 LEU 962 -4.992 6.776 -5.358 374 2HD1 LEU 962 2HD1 LEU 962 -5.468 5.068 -5.202 375 3HD1 LEU 962 3HD1 LEU 962 -3.991 5.657 -4.402 376 1HD2 LEU 962 1HD2 LEU 962 -4.003 7.252 -7.639 377 2HD2 LEU 962 2HD2 LEU 962 -3.808 5.803 -8.654 378 3HD2 LEU 962 3HD2 LEU 962 -5.363 6.123 -7.849 379 H ARG 963 H ARG 963 -1.847 5.191 -9.448 380 HA ARG 963 HA ARG 963 -3.867 3.484 -10.015 381 1HB ARG 963 1HB ARG 963 -2.764 5.397 -11.433 382 2HB ARG 963 2HB ARG 963 -1.699 4.150 -12.051 383 1HG ARG 963 1HG ARG 963 -3.299 3.553 -13.540 384 2HG ARG 963 2HG ARG 963 -4.327 3.056 -12.211 385 1HD ARG 963 1HD ARG 963 -5.694 4.665 -13.218 386 2HD ARG 963 2HD ARG 963 -4.875 5.655 -12.026 387 HE ARG 963 HE ARG 963 -3.230 5.710 -14.312 388 1HH1 ARG 963 2HH2 ARG 963 -6.520 6.651 -13.491 389 2HH1 ARG 963 1HH2 ARG 963 -6.582 7.928 -14.661 390 1HH2 ARG 963 2HH1 ARG 963 -3.312 7.394 -15.855 391 2HH2 ARG 963 1HH1 ARG 963 -4.745 8.353 -16.014 392 H THR 964 H THR 964 -0.311 2.994 -10.632 393 HA THR 964 HA THR 964 -0.526 0.414 -11.665 394 HB THR 964 HB THR 964 1.679 1.966 -10.225 395 HG1 THR 964 HG1 THR 964 2.342 1.930 -12.579 396 1HG2 THR 964 1HG2 THR 964 2.357 -0.363 -10.012 397 2HG2 THR 964 2HG2 THR 964 1.749 -0.745 -11.641 398 3HG2 THR 964 3HG2 THR 964 3.192 0.279 -11.447 399 H LEU 965 H LEU 965 0.026 1.518 -8.263 400 HA LEU 965 HA LEU 965 0.448 -0.806 -7.017 401 1HB LEU 965 1HB LEU 965 0.239 1.477 -6.029 402 2HB LEU 965 2HB LEU 965 -1.504 1.293 -6.066 403 HG LEU 965 HG LEU 965 -0.017 0.755 -3.909 404 1HD1 LEU 965 1HD1 LEU 965 -2.174 0.639 -3.327 405 2HD1 LEU 965 2HD1 LEU 965 -2.655 -0.096 -4.874 406 3HD1 LEU 965 3HD1 LEU 965 -1.996 -1.115 -3.572 407 1HD2 LEU 965 1HD2 LEU 965 0.272 -1.682 -3.651 408 2HD2 LEU 965 2HD2 LEU 965 -0.163 -1.900 -5.363 409 3HD2 LEU 965 3HD2 LEU 965 1.308 -0.999 -4.927 410 H LEU 966 H LEU 966 -2.779 0.409 -8.117 411 HA LEU 966 HA LEU 966 -4.276 -1.692 -7.119 412 1HB LEU 966 1HB LEU 966 -4.585 0.363 -9.239 413 2HB LEU 966 2HB LEU 966 -5.672 -1.010 -9.304 414 HG LEU 966 HG LEU 966 -5.858 -0.310 -6.660 415 1HD1 LEU 966 1HD1 LEU 966 -6.276 2.375 -7.620 416 2HD1 LEU 966 2HD1 LEU 966 -5.306 1.797 -6.243 417 3HD1 LEU 966 3HD1 LEU 966 -4.582 1.888 -7.867 418 1HD2 LEU 966 1HD2 LEU 966 -7.942 1.059 -7.641 419 2HD2 LEU 966 2HD2 LEU 966 -7.479 0.160 -9.106 420 3HD2 LEU 966 3HD2 LEU 966 -7.874 -0.720 -7.609 421 H ALA 967 H ALA 967 -3.109 -1.279 -10.542 422 HA ALA 967 HA ALA 967 -3.804 -3.750 -11.452 423 1HB ALA 967 1HB ALA 967 -1.191 -2.441 -12.229 424 2HB ALA 967 2HB ALA 967 -2.371 -3.289 -13.257 425 3HB ALA 967 3HB ALA 967 -2.747 -1.670 -12.619 426 H THR 968 H THR 968 -0.575 -2.806 -10.063 427 HA THR 968 HA THR 968 0.554 -5.319 -10.095 428 HB THR 968 HB THR 968 2.033 -4.329 -8.312 429 HG1 THR 968 HG1 THR 968 0.221 -2.059 -8.538 430 1HG2 THR 968 1HG2 THR 968 2.811 -2.400 -9.534 431 2HG2 THR 968 2HG2 THR 968 2.162 -3.500 -10.774 432 3HG2 THR 968 3HG2 THR 968 1.199 -2.105 -10.231 433 H VAL 969 H VAL 969 -1.550 -3.826 -7.572 434 HA VAL 969 HA VAL 969 -1.322 -5.853 -5.709 435 HB VAL 969 HB VAL 969 -3.479 -3.875 -6.408 436 1HG1 VAL 969 1HG1 VAL 969 -3.615 -6.168 -4.505 437 2HG1 VAL 969 2HG1 VAL 969 -4.245 -4.600 -3.944 438 3HG1 VAL 969 3HG1 VAL 969 -4.908 -5.351 -5.415 439 1HG2 VAL 969 1HG2 VAL 969 -1.059 -3.678 -5.028 440 2HG2 VAL 969 2HG2 VAL 969 -2.394 -2.501 -5.017 441 3HG2 VAL 969 3HG2 VAL 969 -2.295 -3.746 -3.749 442 H ASP 970 H ASP 970 -3.403 -5.555 -8.628 443 HA ASP 970 HA ASP 970 -5.083 -7.631 -8.157 444 1HB ASP 970 1HB ASP 970 -4.799 -5.927 -10.184 445 2HB ASP 970 2HB ASP 970 -3.875 -7.229 -10.907 446 H GLU 971 H GLU 971 -1.700 -7.571 -9.390 447 HA GLU 971 HA GLU 971 -1.666 -10.289 -10.112 448 1HB GLU 971 1HB GLU 971 0.438 -8.148 -9.719 449 2HB GLU 971 2HB GLU 971 0.928 -9.812 -9.974 450 1HG GLU 971 1HG GLU 971 -0.781 -9.700 -12.015 451 2HG GLU 971 2HG GLU 971 -0.567 -7.968 -11.854 452 H SER 972 H SER 972 -1.291 -8.509 -7.105 453 HA SER 972 HA SER 972 0.110 -10.651 -5.829 454 1HB SER 972 1HB SER 972 -1.110 -8.659 -4.046 455 2HB SER 972 2HB SER 972 0.575 -9.104 -4.229 456 HG SER 972 HG SER 972 0.159 -6.877 -4.844 457 H LEU 973 H LEU 973 -3.209 -9.469 -6.268 458 HA LEU 973 HA LEU 973 -4.607 -10.410 -4.210 459 1HB LEU 973 1HB LEU 973 -5.117 -9.703 -6.856 460 2HB LEU 973 2HB LEU 973 -5.813 -11.303 -6.697 461 HG LEU 973 HG LEU 973 -6.681 -8.731 -5.552 462 1HD1 LEU 973 1HD1 LEU 973 -8.069 -11.335 -6.239 463 2HD1 LEU 973 2HD1 LEU 973 -8.892 -9.863 -5.668 464 3HD1 LEU 973 3HD1 LEU 973 -8.013 -9.848 -7.216 465 1HD2 LEU 973 1HD2 LEU 973 -6.187 -9.445 -3.426 466 2HD2 LEU 973 2HD2 LEU 973 -7.826 -10.109 -3.631 467 3HD2 LEU 973 3HD2 LEU 973 -6.406 -11.165 -3.828 468 HA PRO 974 HA PRO 974 -4.229 -14.867 -5.727 469 1HB PRO 974 1HB PRO 974 -2.534 -15.492 -7.777 470 2HB PRO 974 2HB PRO 974 -4.249 -15.208 -8.004 471 1HG PRO 974 1HG PRO 974 -1.974 -13.441 -8.669 472 2HG PRO 974 2HG PRO 974 -3.624 -13.376 -9.258 473 1HD PRO 974 1HD PRO 974 -2.440 -11.672 -7.277 474 2HD PRO 974 2HD PRO 974 -4.118 -11.684 -7.782 475 H VAL 975 H VAL 975 -1.237 -13.075 -5.982 476 HA VAL 975 HA VAL 975 0.524 -14.978 -5.159 477 HB VAL 975 HB VAL 975 0.355 -12.027 -4.547 478 1HG1 VAL 975 1HG1 VAL 975 2.166 -12.125 -3.247 479 2HG1 VAL 975 2HG1 VAL 975 2.022 -13.900 -3.260 480 3HG1 VAL 975 3HG1 VAL 975 3.047 -13.081 -4.463 481 1HG2 VAL 975 1HG2 VAL 975 2.235 -13.385 -6.478 482 2HG2 VAL 975 2HG2 VAL 975 0.573 -12.961 -6.954 483 3HG2 VAL 975 3HG2 VAL 975 1.701 -11.687 -6.431 484 H LEU 976 H LEU 976 -1.963 -13.260 -3.274 485 HA LEU 976 HA LEU 976 -1.015 -14.678 -0.886 486 1HB LEU 976 1HB LEU 976 -2.894 -12.321 -1.007 487 2HB LEU 976 2HB LEU 976 -2.149 -13.024 0.415 488 HG LEU 976 HG LEU 976 -0.875 -11.134 0.097 489 1HD1 LEU 976 1HD1 LEU 976 0.423 -13.427 -0.077 490 2HD1 LEU 976 2HD1 LEU 976 0.828 -12.812 -1.698 491 3HD1 LEU 976 3HD1 LEU 976 1.263 -11.868 -0.253 492 1HD2 LEU 976 1HD2 LEU 976 -0.367 -11.395 -2.818 493 2HD2 LEU 976 2HD2 LEU 976 -2.010 -10.921 -2.323 494 3HD2 LEU 976 3HD2 LEU 976 -0.611 -9.947 -1.812 495 HA PRO 977 HA PRO 977 -4.599 -17.079 -0.933 496 1HB PRO 977 1HB PRO 977 -5.055 -17.551 1.719 497 2HB PRO 977 2HB PRO 977 -3.844 -18.408 0.788 498 1HG PRO 977 1HG PRO 977 -3.469 -16.262 2.786 499 2HG PRO 977 2HG PRO 977 -2.293 -17.406 2.170 500 1HD PRO 977 1HD PRO 977 -2.543 -14.642 1.444 501 2HD PRO 977 2HD PRO 977 -1.444 -15.815 0.745 502 H ALA 978 H ALA 978 -6.835 -17.110 -0.998 503 HA ALA 978 HA ALA 978 -8.103 -14.744 -1.126 504 1HB ALA 978 1HB ALA 978 -9.638 -16.247 -1.789 505 2HB ALA 978 2HB ALA 978 -8.814 -17.554 -0.905 506 3HB ALA 978 3HB ALA 978 -10.014 -16.535 -0.073 507 H SER 979 H SER 979 -7.121 -16.499 1.786 508 HA SER 979 HA SER 979 -8.731 -15.690 3.695 509 1HB SER 979 1HB SER 979 -6.739 -16.943 4.223 510 2HB SER 979 2HB SER 979 -5.690 -15.654 3.667 511 HG SER 979 HG SER 979 -6.009 -14.514 5.510 512 H THR 980 H THR 980 -6.518 -13.603 1.825 513 HA THR 980 HA THR 980 -7.575 -11.285 3.310 514 HB THR 980 HB THR 980 -5.163 -11.605 3.712 515 HG1 THR 980 HG1 THR 980 -6.262 -9.461 2.992 516 1HG2 THR 980 1HG2 THR 980 -4.914 -11.476 0.660 517 2HG2 THR 980 2HG2 THR 980 -3.559 -11.490 1.814 518 3HG2 THR 980 3HG2 THR 980 -4.599 -12.924 1.645 519 H HIS 981 H HIS 981 -9.315 -12.139 1.510 520 HA HIS 981 HA HIS 981 -8.699 -11.043 -1.069 521 1HB HIS 981 1HB HIS 981 -10.559 -12.911 0.024 522 2HB HIS 981 2HB HIS 981 -11.484 -11.635 -0.742 523 HD1 HIS 981 HD1 HIS 981 -12.224 -12.862 -2.839 524 HD2 HIS 981 HD2 HIS 981 -8.077 -13.027 -2.226 525 HE1 HIS 981 HE1 HIS 981 -11.229 -13.888 -4.953 526 H ARG 982 H ARG 982 -11.723 -10.494 0.817 527 HA ARG 982 HA ARG 982 -12.283 -8.092 -0.174 528 1HB ARG 982 1HB ARG 982 -13.697 -9.434 1.436 529 2HB ARG 982 2HB ARG 982 -12.670 -8.903 2.753 530 1HG ARG 982 1HG ARG 982 -14.616 -7.453 2.716 531 2HG ARG 982 2HG ARG 982 -13.244 -6.505 2.180 532 1HD ARG 982 1HD ARG 982 -15.135 -6.062 0.688 533 2HD ARG 982 2HD ARG 982 -13.903 -6.925 -0.211 534 HE ARG 982 HE ARG 982 -15.477 -8.976 0.742 535 1HH1 ARG 982 2HH2 ARG 982 -16.203 -6.011 -1.008 536 2HH1 ARG 982 1HH2 ARG 982 -17.595 -6.669 -1.802 537 1HH2 ARG 982 2HH1 ARG 982 -17.314 -9.845 -0.304 538 2HH2 ARG 982 1HH1 ARG 982 -18.231 -8.865 -1.399 539 H GLU 983 H GLU 983 -10.580 -8.595 3.015 540 HA GLU 983 HA GLU 983 -10.031 -6.134 3.731 541 1HB GLU 983 1HB GLU 983 -8.135 -8.516 3.727 542 2HB GLU 983 2HB GLU 983 -7.768 -7.025 4.570 543 1HG GLU 983 1HG GLU 983 -9.765 -7.244 5.972 544 2HG GLU 983 2HG GLU 983 -10.337 -8.608 5.031 545 H ILE 984 H ILE 984 -8.019 -7.973 1.325 546 HA ILE 984 HA ILE 984 -6.247 -5.906 0.786 547 HB ILE 984 HB ILE 984 -7.026 -8.477 -0.397 548 1HG1 ILE 984 1HG1 ILE 984 -4.388 -7.059 0.073 549 2HG1 ILE 984 2HG1 ILE 984 -5.133 -8.251 1.119 550 1HG2 ILE 984 1HG2 ILE 984 -5.517 -7.829 -2.450 551 2HG2 ILE 984 2HG2 ILE 984 -7.269 -7.517 -2.467 552 3HG2 ILE 984 3HG2 ILE 984 -6.134 -6.193 -2.115 553 1HD1 ILE 984 1HD1 ILE 984 -5.084 -9.484 -1.425 554 2HD1 ILE 984 2HD1 ILE 984 -3.513 -8.660 -1.276 555 3HD1 ILE 984 3HD1 ILE 984 -4.018 -9.843 -0.045 556 H GLU 985 H GLU 985 -9.369 -6.820 -0.805 557 HA GLU 985 HA GLU 985 -9.248 -4.849 -2.736 558 1HB GLU 985 1HB GLU 985 -10.947 -6.928 -2.137 559 2HB GLU 985 2HB GLU 985 -11.952 -5.559 -1.704 560 1HG GLU 985 1HG GLU 985 -10.459 -5.499 -4.336 561 2HG GLU 985 2HG GLU 985 -11.908 -6.476 -4.208 562 H MET 986 H MET 986 -10.377 -4.815 0.662 563 HA MET 986 HA MET 986 -11.554 -2.248 0.409 564 1HB MET 986 1HB MET 986 -10.965 -4.245 2.601 565 2HB MET 986 2HB MET 986 -11.241 -2.589 3.103 566 1HG MET 986 1HG MET 986 -13.364 -2.773 1.486 567 2HG MET 986 2HG MET 986 -13.148 -4.495 1.729 568 1HE MET 986 1HE MET 986 -15.357 -2.019 2.685 569 2HE MET 986 2HE MET 986 -15.250 -1.678 4.428 570 3HE MET 986 3HE MET 986 -13.997 -1.065 3.323 571 H ALA 987 H ALA 987 -8.347 -3.543 1.137 572 HA ALA 987 HA ALA 987 -7.359 -1.273 2.497 573 1HB ALA 987 1HB ALA 987 -5.887 -2.942 2.890 574 2HB ALA 987 2HB ALA 987 -6.386 -3.837 1.435 575 3HB ALA 987 3HB ALA 987 -5.187 -2.528 1.306 576 H GLN 988 H GLN 988 -7.811 -2.172 -0.915 577 HA GLN 988 HA GLN 988 -6.064 -0.204 -1.906 578 1HB GLN 988 1HB GLN 988 -8.336 -1.778 -3.184 579 2HB GLN 988 2HB GLN 988 -7.322 -0.672 -4.088 580 1HG GLN 988 1HG GLN 988 -5.294 -1.994 -3.210 581 2HG GLN 988 2HG GLN 988 -6.431 -3.179 -2.598 582 1HE2 GLN 988 1HE2 GLN 988 -8.118 -3.907 -4.217 583 2HE2 GLN 988 2HE2 GLN 988 -7.577 -4.277 -5.820 584 H LYS 989 H LYS 989 -9.673 -0.423 -1.571 585 HA LYS 989 HA LYS 989 -10.243 2.072 -2.629 586 1HB LYS 989 1HB LYS 989 -11.772 0.067 -1.983 587 2HB LYS 989 2HB LYS 989 -11.846 0.822 -0.404 588 1HG LYS 989 1HG LYS 989 -12.298 2.612 -2.777 589 2HG LYS 989 2HG LYS 989 -13.560 1.451 -2.414 590 1HD LYS 989 1HD LYS 989 -13.113 2.402 0.103 591 2HD LYS 989 2HD LYS 989 -12.633 3.815 -0.815 592 1HE LYS 989 1HE LYS 989 -14.779 4.174 -1.669 593 2HE LYS 989 2HE LYS 989 -15.206 2.475 -1.620 594 1HZ LYS 989 1HZ LYS 989 -14.743 3.264 0.978 595 2HZ LYS 989 2HZ LYS 989 -15.674 4.428 0.310 596 3HZ LYS 989 3HZ LYS 989 -16.175 2.874 0.297 597 H LEU 990 H LEU 990 -8.791 1.130 0.427 598 HA LEU 990 HA LEU 990 -9.466 3.471 1.855 599 1HB LEU 990 1HB LEU 990 -8.153 1.022 2.325 600 2HB LEU 990 2HB LEU 990 -6.987 2.276 2.702 601 HG LEU 990 HG LEU 990 -9.786 2.140 3.856 602 1HD1 LEU 990 1HD1 LEU 990 -7.694 0.430 4.438 603 2HD1 LEU 990 2HD1 LEU 990 -7.564 1.681 5.697 604 3HD1 LEU 990 3HD1 LEU 990 -9.089 0.787 5.486 605 1HD2 LEU 990 1HD2 LEU 990 -9.072 3.853 5.389 606 2HD2 LEU 990 2HD2 LEU 990 -7.425 3.833 4.714 607 3HD2 LEU 990 3HD2 LEU 990 -8.786 4.410 3.723 608 H LEU 991 H LEU 991 -6.446 2.435 0.119 609 HA LEU 991 HA LEU 991 -5.027 4.753 0.504 610 1HB LEU 991 1HB LEU 991 -3.970 2.811 -0.327 611 2HB LEU 991 2HB LEU 991 -5.038 2.718 -1.713 612 HG LEU 991 HG LEU 991 -4.021 4.924 -2.491 613 1HD1 LEU 991 1HD1 LEU 991 -1.869 4.227 -0.477 614 2HD1 LEU 991 2HD1 LEU 991 -1.883 5.592 -1.619 615 3HD1 LEU 991 3HD1 LEU 991 -3.057 5.538 -0.282 616 1HD2 LEU 991 1HD2 LEU 991 -3.461 2.478 -3.218 617 2HD2 LEU 991 2HD2 LEU 991 -2.421 3.826 -3.736 618 3HD2 LEU 991 3HD2 LEU 991 -1.920 2.785 -2.382 619 H ASN 992 H ASN 992 -7.086 3.898 -2.370 620 HA ASN 992 HA ASN 992 -6.838 6.212 -3.707 621 1HB ASN 992 1HB ASN 992 -8.356 3.972 -4.026 622 2HB ASN 992 2HB ASN 992 -9.622 5.065 -3.502 623 1HD2 ASN 992 1HD2 ASN 992 -10.135 6.891 -4.713 624 2HD2 ASN 992 2HD2 ASN 992 -9.702 7.064 -6.381 625 H SER 993 H SER 993 -9.311 5.362 -1.169 626 HA SER 993 HA SER 993 -10.800 7.567 -1.136 627 1HB SER 993 1HB SER 993 -10.114 5.468 0.738 628 2HB SER 993 2HB SER 993 -10.251 6.979 1.616 629 HG SER 993 HG SER 993 -12.237 5.431 0.433 630 H ASP 994 H ASP 994 -7.966 7.161 1.123 631 HA ASP 994 HA ASP 994 -7.868 9.699 2.008 632 1HB ASP 994 1HB ASP 994 -5.777 7.575 1.529 633 2HB ASP 994 2HB ASP 994 -5.228 9.169 2.007 634 H LEU 995 H LEU 995 -6.418 8.255 -0.974 635 HA LEU 995 HA LEU 995 -4.869 10.382 -1.789 636 1HB LEU 995 1HB LEU 995 -6.028 7.969 -2.951 637 2HB LEU 995 2HB LEU 995 -5.859 9.264 -4.120 638 HG LEU 995 HG LEU 995 -3.934 7.552 -3.800 639 1HD1 LEU 995 1HD1 LEU 995 -3.441 9.191 -5.316 640 2HD1 LEU 995 2HD1 LEU 995 -3.758 10.513 -4.167 641 3HD1 LEU 995 3HD1 LEU 995 -2.251 9.574 -4.049 642 1HD2 LEU 995 1HD2 LEU 995 -2.354 7.922 -2.099 643 2HD2 LEU 995 2HD2 LEU 995 -3.103 9.463 -1.616 644 3HD2 LEU 995 3HD2 LEU 995 -3.933 7.926 -1.277 645 H ALA 996 H ALA 996 -8.254 9.612 -2.885 646 HA ALA 996 HA ALA 996 -8.772 11.767 -4.384 647 1HB ALA 996 1HB ALA 996 -10.656 10.519 -4.319 648 2HB ALA 996 2HB ALA 996 -10.310 9.930 -2.675 649 3HB ALA 996 3HB ALA 996 -11.108 11.504 -2.907 650 H GLU 997 H GLU 997 -8.924 11.640 -0.765 651 HA GLU 997 HA GLU 997 -9.739 14.278 -0.488 652 1HB GLU 997 1HB GLU 997 -9.858 12.477 1.274 653 2HB GLU 997 2HB GLU 997 -8.122 12.594 1.475 654 1HG GLU 997 1HG GLU 997 -8.672 15.204 1.792 655 2HG GLU 997 2HG GLU 997 -10.258 14.593 2.219 656 H LEU 998 H LEU 998 -6.477 12.731 -0.548 657 HA LEU 998 HA LEU 998 -5.034 15.033 0.095 658 1HB LEU 998 1HB LEU 998 -4.402 12.492 -0.064 659 2HB LEU 998 2HB LEU 998 -3.955 12.903 -1.708 660 HG LEU 998 HG LEU 998 -2.855 14.771 0.269 661 1HD1 LEU 998 1HD1 LEU 998 -2.748 11.949 0.886 662 2HD1 LEU 998 2HD1 LEU 998 -1.117 12.590 0.573 663 3HD1 LEU 998 3HD1 LEU 998 -2.146 13.344 1.814 664 1HD2 LEU 998 1HD2 LEU 998 -0.779 13.591 -1.131 665 2HD2 LEU 998 2HD2 LEU 998 -2.145 13.516 -2.269 666 3HD2 LEU 998 3HD2 LEU 998 -1.647 15.079 -1.578 667 H ILE 999 H ILE 999 -6.322 13.749 -2.998 668 HA ILE 999 HA ILE 999 -4.950 15.544 -4.654 669 HB ILE 999 HB ILE 999 -7.604 14.171 -5.091 670 1HG1 ILE 999 1HG1 ILE 999 -5.463 12.797 -4.423 671 2HG1 ILE 999 2HG1 ILE 999 -6.526 12.248 -5.703 672 1HG2 ILE 999 1HG2 ILE 999 -5.599 15.287 -7.072 673 2HG2 ILE 999 2HG2 ILE 999 -7.077 14.380 -7.473 674 3HG2 ILE 999 3HG2 ILE 999 -7.196 15.973 -6.688 675 1HD1 ILE 999 1HD1 ILE 999 -5.050 13.008 -7.424 676 2HD1 ILE 999 2HD1 ILE 999 -4.132 14.030 -6.293 677 3HD1 ILE 999 3HD1 ILE 999 -3.989 12.258 -6.207 678 H ASN1000 H ASN1000 -8.415 15.612 -3.542 679 HA ASN1000 HA ASN1000 -9.051 18.029 -4.522 680 1HB ASN1000 1HB ASN1000 -10.376 16.242 -3.017 681 2HB ASN1000 2HB ASN1000 -9.945 17.326 -1.710 682 1HD2 ASN1000 1HD2 ASN1000 -12.556 16.718 -2.704 683 2HD2 ASN1000 2HD2 ASN1000 -13.285 18.184 -3.267 684 H LYS1001 H LYS1001 -7.141 17.179 -1.614 685 HA LYS1001 HA LYS1001 -7.185 19.707 -0.396 686 1HB LYS1001 1HB LYS1001 -6.078 17.132 0.097 687 2HB LYS1001 2HB LYS1001 -4.757 18.281 0.179 688 1HG LYS1001 1HG LYS1001 -5.538 18.484 2.352 689 2HG LYS1001 2HG LYS1001 -6.533 19.713 1.596 690 1HD LYS1001 1HD LYS1001 -7.625 16.925 1.514 691 2HD LYS1001 2HD LYS1001 -7.543 17.662 3.102 692 1HE LYS1001 1HE LYS1001 -8.573 19.613 1.209 693 2HE LYS1001 2HE LYS1001 -9.490 18.128 1.050 694 1HZ LYS1001 1HZ LYS1001 -10.284 18.321 3.126 695 2HZ LYS1001 2HZ LYS1001 -8.939 19.013 3.740 696 3HZ LYS1001 3HZ LYS1001 -10.002 19.911 2.886 697 H MET1002 H MET1002 -4.675 18.101 -2.480 698 HA MET1002 HA MET1002 -2.997 20.257 -2.598 699 1HB MET1002 1HB MET1002 -1.943 19.051 -4.389 700 2HB MET1002 2HB MET1002 -2.732 17.797 -3.453 701 1HG MET1002 1HG MET1002 -3.985 17.193 -5.247 702 2HG MET1002 2HG MET1002 -4.647 18.811 -5.369 703 1HE MET1002 1HE MET1002 -4.178 20.429 -6.620 704 2HE MET1002 2HE MET1002 -2.499 20.890 -6.987 705 3HE MET1002 3HE MET1002 -3.540 20.226 -8.269 706 H LYS1003 H LYS1003 -6.160 19.881 -3.967 707 HA LYS1003 HA LYS1003 -5.755 21.610 -6.201 708 1HB LYS1003 1HB LYS1003 -7.907 19.985 -5.063 709 2HB LYS1003 2HB LYS1003 -8.482 21.525 -5.669 710 1HG LYS1003 1HG LYS1003 -6.899 20.918 -7.752 711 2HG LYS1003 2HG LYS1003 -7.127 19.282 -7.167 712 1HD LYS1003 1HD LYS1003 -8.919 19.548 -8.685 713 2HD LYS1003 2HD LYS1003 -9.678 19.846 -7.134 714 1HE LYS1003 1HE LYS1003 -9.405 22.310 -7.466 715 2HE LYS1003 2HE LYS1003 -8.628 22.019 -9.010 716 1HZ LYS1003 1HZ LYS1003 -10.944 20.611 -9.128 717 2HZ LYS1003 2HZ LYS1003 -11.377 21.996 -8.379 718 3HZ LYS1003 3HZ LYS1003 -10.655 22.050 -9.843 719 H LEU1004 H LEU1004 -6.861 21.918 -2.803 720 HA LEU1004 HA LEU1004 -7.588 24.665 -3.162 721 1HB LEU1004 1HB LEU1004 -7.160 23.241 -0.548 722 2HB LEU1004 2HB LEU1004 -8.178 24.627 -0.883 723 HG LEU1004 HG LEU1004 -8.674 21.833 -1.948 724 1HD1 LEU1004 1HD1 LEU1004 -10.086 23.253 0.324 725 2HD1 LEU1004 2HD1 LEU1004 -10.403 21.611 -0.285 726 3HD1 LEU1004 3HD1 LEU1004 -8.860 21.978 0.522 727 1HD2 LEU1004 1HD2 LEU1004 -10.953 23.632 -1.864 728 2HD2 LEU1004 2HD2 LEU1004 -9.638 24.277 -2.875 729 3HD2 LEU1004 3HD2 LEU1004 -10.306 22.662 -3.209 730 H ALA1005 H ALA1005 -4.819 22.801 -1.798 731 HA ALA1005 HA ALA1005 -3.423 24.911 -0.707 732 1HB ALA1005 1HB ALA1005 -1.431 23.292 -1.561 733 2HB ALA1005 2HB ALA1005 -2.470 22.898 -0.171 734 3HB ALA1005 3HB ALA1005 -2.813 22.188 -1.766 735 H GLN1006 H GLN1006 -3.896 23.937 -4.095 736 HA GLN1006 HA GLN1006 -1.758 25.307 -5.177 737 1HB GLN1006 1HB GLN1006 -4.363 24.223 -6.162 738 2HB GLN1006 2HB GLN1006 -3.617 25.442 -7.176 739 1HG GLN1006 1HG GLN1006 -1.984 23.108 -6.118 740 2HG GLN1006 2HG GLN1006 -2.980 22.919 -7.547 741 1HE2 GLN1006 1HE2 GLN1006 -2.792 25.051 -8.999 742 2HE2 GLN1006 2HE2 GLN1006 -1.170 25.461 -9.448 743 H GLN1007 H GLN1007 -4.978 26.381 -4.079 744 HA GLN1007 HA GLN1007 -4.415 29.022 -5.135 745 1HB GLN1007 1HB GLN1007 -6.694 27.725 -5.371 746 2HB GLN1007 2HB GLN1007 -6.972 28.227 -3.716 747 1HG GLN1007 1HG GLN1007 -6.117 30.601 -4.854 748 2HG GLN1007 2HG GLN1007 -6.943 29.856 -6.209 749 1HE2 GLN1007 1HE2 GLN1007 -7.980 32.103 -5.309 750 2HE2 GLN1007 2HE2 GLN1007 -9.444 31.865 -4.414 751 H TYR1008 H TYR1008 -4.655 27.133 -2.146 752 HA TYR1008 HA TYR1008 -4.614 29.512 -0.492 753 1HB TYR1008 1HB TYR1008 -4.746 26.474 -0.234 754 2HB TYR1008 2HB TYR1008 -4.274 27.392 1.182 755 HD1 TYR1008 HD1 TYR1008 -5.877 29.158 2.088 756 HD2 TYR1008 HD2 TYR1008 -7.026 26.284 -0.866 757 HE1 TYR1008 HE1 TYR1008 -8.326 29.571 2.628 758 HE2 TYR1008 HE2 TYR1008 -9.472 26.707 -0.315 759 HH TYR1008 HH TYR1008 -10.525 27.969 2.352 760 H VAL1009 H VAL1009 -2.356 29.083 -2.366 761 HA VAL1009 HA VAL1009 -0.238 28.672 -0.369 762 HB VAL1009 HB VAL1009 -0.114 26.908 -1.932 763 1HG1 VAL1009 1HG1 VAL1009 -1.600 27.856 -3.654 764 2HG1 VAL1009 2HG1 VAL1009 -0.301 28.963 -4.161 765 3HG1 VAL1009 3HG1 VAL1009 -0.102 27.206 -4.361 766 1HG2 VAL1009 1HG2 VAL1009 1.932 28.838 -1.696 767 2HG2 VAL1009 2HG2 VAL1009 2.098 27.120 -2.129 768 3HG2 VAL1009 3HG2 VAL1009 1.913 28.345 -3.406 769 H MET1010 H MET1010 -1.450 30.546 -3.191 770 HA MET1010 HA MET1010 0.689 32.326 -3.247 771 1HB MET1010 1HB MET1010 -1.066 33.780 -4.492 772 2HB MET1010 2HB MET1010 -0.777 32.188 -5.165 773 1HG MET1010 1HG MET1010 -2.990 31.731 -4.947 774 2HG MET1010 2HG MET1010 -2.812 31.815 -3.206 775 1HE MET1010 1HE MET1010 -5.123 34.520 -2.365 776 2HE MET1010 2HE MET1010 -5.176 32.767 -2.666 777 3HE MET1010 3HE MET1010 -3.815 33.474 -1.763 778 H THR1011 H THR1011 0.751 32.474 -0.723 779 HA THR1011 HA THR1011 0.221 35.022 0.077 780 HB THR1011 HB THR1011 -2.148 34.797 -0.080 781 HG1 THR1011 HG1 THR1011 -1.465 33.753 2.570 782 1HG2 THR1011 1HG2 THR1011 -1.670 32.014 0.114 783 2HG2 THR1011 2HG2 THR1011 -2.543 32.421 1.611 784 3HG2 THR1011 3HG2 THR1011 -3.265 32.800 0.029 785 H SER1012 H SER1012 -0.292 31.699 1.450 786 HA SER1012 HA SER1012 2.009 31.262 2.583 787 1HB SER1012 1HB SER1012 1.545 32.211 5.041 788 2HB SER1012 2HB SER1012 2.402 33.159 3.842 789 HG SER1012 HG SER1012 0.359 34.027 5.122 790 H LEU1013 H LEU1013 -1.483 31.402 2.868 791 HA LEU1013 HA LEU1013 -2.137 29.871 4.962 792 1HB LEU1013 1HB LEU1013 -3.244 30.459 2.354 793 2HB LEU1013 2HB LEU1013 -3.668 28.834 2.858 794 HG LEU1013 HG LEU1013 -5.189 30.899 3.451 795 1HD1 LEU1013 1HD1 LEU1013 -4.571 28.679 5.420 796 2HD1 LEU1013 2HD1 LEU1013 -6.042 29.682 5.412 797 3HD1 LEU1013 3HD1 LEU1013 -5.696 28.598 4.043 798 1HD2 LEU1013 1HD2 LEU1013 -4.733 32.099 5.367 799 2HD2 LEU1013 2HD2 LEU1013 -3.586 30.888 5.988 800 3HD2 LEU1013 3HD2 LEU1013 -3.115 31.951 4.640 801 H GLN1014 H GLN1014 -0.327 28.863 2.087 802 HA GLN1014 HA GLN1014 -0.642 26.251 1.954 803 1HB GLN1014 1HB GLN1014 0.989 27.423 0.583 804 2HB GLN1014 2HB GLN1014 1.983 27.797 1.977 805 1HG GLN1014 1HG GLN1014 2.976 25.904 0.787 806 2HG GLN1014 2HG GLN1014 2.383 25.347 2.339 807 1HE2 GLN1014 1HE2 GLN1014 2.348 23.238 1.475 808 2HE2 GLN1014 2HE2 GLN1014 1.053 22.681 0.468 809 H GLN1015 H GLN1015 1.637 27.823 4.321 810 HA GLN1015 HA GLN1015 2.579 25.708 5.594 811 1HB GLN1015 1HB GLN1015 2.481 27.157 7.723 812 2HB GLN1015 2HB GLN1015 3.281 27.854 6.328 813 1HG GLN1015 1HG GLN1015 1.837 29.598 6.349 814 2HG GLN1015 2HG GLN1015 0.490 28.504 6.103 815 1HE2 GLN1015 1HE2 GLN1015 -0.812 29.811 7.399 816 2HE2 GLN1015 2HE2 GLN1015 -0.721 29.801 9.129 817 H GLU1016 H GLU1016 -0.740 27.040 5.922 818 HA GLU1016 HA GLU1016 -1.427 25.389 8.083 819 1HB GLU1016 1HB GLU1016 -2.612 27.504 7.512 820 2HB GLU1016 2HB GLU1016 -3.202 26.782 6.029 821 1HG GLU1016 1HG GLU1016 -4.614 25.246 7.184 822 2HG GLU1016 2HG GLU1016 -3.740 25.429 8.692 823 H TYR1017 H TYR1017 -2.610 25.299 4.637 824 HA TYR1017 HA TYR1017 -3.759 22.796 4.789 825 1HB TYR1017 1HB TYR1017 -2.490 24.606 2.689 826 2HB TYR1017 2HB TYR1017 -2.962 22.996 2.183 827 HD1 TYR1017 HD1 TYR1017 -4.250 26.183 3.598 828 HD2 TYR1017 HD2 TYR1017 -5.244 22.454 1.751 829 HE1 TYR1017 HE1 TYR1017 -6.637 26.984 3.248 830 HE2 TYR1017 HE2 TYR1017 -7.628 23.268 1.407 831 HH TYR1017 HH TYR1017 -8.963 25.658 3.010 832 H LYS1018 H LYS1018 -0.391 23.669 4.841 833 HA LYS1018 HA LYS1018 0.648 21.375 3.582 834 1HB LYS1018 1HB LYS1018 2.061 23.253 3.747 835 2HB LYS1018 2HB LYS1018 1.763 23.453 5.462 836 1HG LYS1018 1HG LYS1018 3.968 22.455 5.192 837 2HG LYS1018 2HG LYS1018 2.908 21.247 5.891 838 1HD LYS1018 1HD LYS1018 2.874 21.216 2.933 839 2HD LYS1018 2HD LYS1018 4.471 20.921 3.592 840 1HE LYS1018 1HE LYS1018 2.664 19.392 5.196 841 2HE LYS1018 2HE LYS1018 2.165 19.142 3.535 842 1HZ LYS1018 1HZ LYS1018 3.885 17.816 3.303 843 2HZ LYS1018 2HZ LYS1018 4.925 19.039 3.601 844 3HZ LYS1018 3HZ LYS1018 4.391 18.104 4.829 845 H LYS1019 H LYS1019 0.321 22.235 7.102 846 HA LYS1019 HA LYS1019 1.147 19.831 8.115 847 1HB LYS1019 1HB LYS1019 -0.578 22.066 9.064 848 2HB LYS1019 2HB LYS1019 -0.668 20.565 9.963 849 1HG LYS1019 1HG LYS1019 1.104 21.704 11.032 850 2HG LYS1019 2HG LYS1019 1.946 20.614 9.948 851 1HD LYS1019 1HD LYS1019 1.213 23.368 8.939 852 2HD LYS1019 2HD LYS1019 2.565 23.216 10.044 853 1HE LYS1019 1HE LYS1019 2.610 21.194 7.877 854 2HE LYS1019 2HE LYS1019 2.676 22.839 7.278 855 1HZ LYS1019 1HZ LYS1019 4.680 21.381 8.560 856 2HZ LYS1019 2HZ LYS1019 4.780 22.857 7.870 857 3HZ LYS1019 3HZ LYS1019 4.365 22.718 9.443 858 H GLN1020 H GLN1020 -2.057 20.774 6.797 859 HA GLN1020 HA GLN1020 -3.435 18.551 7.655 860 1HB GLN1020 1HB GLN1020 -3.834 20.164 5.096 861 2HB GLN1020 2HB GLN1020 -5.025 19.096 5.811 862 1HG GLN1020 1HG GLN1020 -3.866 21.625 7.069 863 2HG GLN1020 2HG GLN1020 -5.502 21.411 6.477 864 1HE2 GLN1020 1HE2 GLN1020 -4.800 22.217 9.074 865 2HE2 GLN1020 2HE2 GLN1020 -5.338 21.028 10.213 866 H MET1021 H MET1021 -1.592 19.138 4.590 867 HA MET1021 HA MET1021 -2.193 16.825 3.309 868 1HB MET1021 1HB MET1021 0.044 18.806 3.343 869 2HB MET1021 2HB MET1021 0.506 17.243 2.698 870 1HG MET1021 1HG MET1021 -1.999 18.701 1.747 871 2HG MET1021 2HG MET1021 -0.432 18.975 1.012 872 1HE MET1021 1HE MET1021 0.645 15.650 -0.374 873 2HE MET1021 2HE MET1021 1.136 17.006 0.669 874 3HE MET1021 3HE MET1021 0.591 15.475 1.396 875 H LEU1022 H LEU1022 0.256 17.399 5.886 876 HA LEU1022 HA LEU1022 1.481 14.883 5.686 877 1HB LEU1022 1HB LEU1022 2.009 17.193 6.973 878 2HB LEU1022 2HB LEU1022 1.377 16.252 8.309 879 HG LEU1022 HG LEU1022 3.319 14.733 6.751 880 1HD1 LEU1022 1HD1 LEU1022 4.005 17.306 6.618 881 2HD1 LEU1022 2HD1 LEU1022 4.652 16.943 8.236 882 3HD1 LEU1022 3HD1 LEU1022 5.201 16.004 6.827 883 1HD2 LEU1022 1HD2 LEU1022 3.300 15.581 9.660 884 2HD2 LEU1022 2HD2 LEU1022 2.482 14.143 9.002 885 3HD2 LEU1022 3HD2 LEU1022 4.256 14.269 8.930 886 H THR1023 H THR1023 -1.453 16.080 7.326 887 HA THR1023 HA THR1023 -1.867 14.008 9.107 888 HB THR1023 HB THR1023 -4.113 15.312 7.530 889 HG1 THR1023 HG1 THR1023 -2.140 16.398 9.407 890 1HG2 THR1023 1HG2 THR1023 -3.554 14.797 10.499 891 2HG2 THR1023 2HG2 THR1023 -4.971 15.679 9.881 892 3HG2 THR1023 3HG2 THR1023 -4.759 13.954 9.496 893 H ALA1024 H ALA1024 -2.924 14.230 5.649 894 HA ALA1024 HA ALA1024 -3.972 11.578 5.727 895 1HB ALA1024 1HB ALA1024 -3.900 13.873 3.933 896 2HB ALA1024 2HB ALA1024 -3.566 12.361 3.054 897 3HB ALA1024 3HB ALA1024 -5.063 12.527 4.003 898 H ALA1025 H ALA1025 -0.919 13.171 4.713 899 HA ALA1025 HA ALA1025 0.180 11.014 3.342 900 1HB ALA1025 1HB ALA1025 2.113 12.296 3.330 901 2HB ALA1025 2HB ALA1025 0.896 13.547 3.679 902 3HB ALA1025 3HB ALA1025 1.875 12.865 5.000 903 H HIS1026 H HIS1026 -0.163 11.733 6.815 904 HA HIS1026 HA HIS1026 1.719 9.800 7.651 905 1HB HIS1026 1HB HIS1026 -0.049 11.753 8.840 906 2HB HIS1026 2HB HIS1026 -0.175 10.233 9.703 907 HD1 HIS1026 HD1 HIS1026 2.940 11.869 8.166 908 HD2 HIS1026 HD2 HIS1026 1.448 10.590 11.873 909 HE1 HIS1026 HE1 HIS1026 4.831 12.194 9.848 910 H ALA1027 H ALA1027 -1.910 9.858 7.496 911 HA ALA1027 HA ALA1027 -2.188 7.184 8.320 912 1HB ALA1027 1HB ALA1027 -3.829 9.408 7.727 913 2HB ALA1027 2HB ALA1027 -4.344 8.117 6.615 914 3HB ALA1027 3HB ALA1027 -4.340 7.830 8.372 915 H LEU1028 H LEU1028 -1.663 8.784 5.167 916 HA LEU1028 HA LEU1028 -2.379 6.686 3.513 917 1HB LEU1028 1HB LEU1028 -0.602 9.065 3.321 918 2HB LEU1028 2HB LEU1028 -0.435 7.827 2.092 919 HG LEU1028 HG LEU1028 -2.847 9.526 2.724 920 1HD1 LEU1028 1HD1 LEU1028 -2.698 10.049 0.304 921 2HD1 LEU1028 2HD1 LEU1028 -1.251 10.532 1.222 922 3HD1 LEU1028 3HD1 LEU1028 -1.216 9.067 0.212 923 1HD2 LEU1028 1HD2 LEU1028 -3.919 8.128 0.813 924 2HD2 LEU1028 2HD2 LEU1028 -2.748 6.880 1.302 925 3HD2 LEU1028 3HD2 LEU1028 -3.934 7.498 2.477 926 H ALA1029 H ALA1029 1.010 7.571 4.496 927 HA ALA1029 HA ALA1029 2.335 5.446 3.573 928 1HB ALA1029 1HB ALA1029 3.999 6.298 4.842 929 2HB ALA1029 2HB ALA1029 2.807 7.506 5.378 930 3HB ALA1029 3HB ALA1029 3.090 6.043 6.351 931 H VAL1030 H VAL1030 0.283 5.537 6.537 932 HA VAL1030 HA VAL1030 0.918 2.877 7.286 933 HB VAL1030 HB VAL1030 -1.051 4.977 8.088 934 1HG1 VAL1030 1HG1 VAL1030 -2.375 2.897 8.022 935 2HG1 VAL1030 2HG1 VAL1030 -1.168 2.102 9.062 936 3HG1 VAL1030 3HG1 VAL1030 -2.120 3.469 9.688 937 1HG2 VAL1030 1HG2 VAL1030 0.843 3.326 9.781 938 2HG2 VAL1030 2HG2 VAL1030 1.333 4.822 8.950 939 3HG2 VAL1030 3HG2 VAL1030 0.057 4.869 10.191 940 H ASP1031 H ASP1031 -1.908 4.440 5.633 941 HA ASP1031 HA ASP1031 -3.530 2.365 5.346 942 1HB ASP1031 1HB ASP1031 -2.876 4.765 3.759 943 2HB ASP1031 2HB ASP1031 -3.520 3.479 2.758 944 H ALA1032 H ALA1032 -0.949 3.274 2.923 945 HA ALA1032 HA ALA1032 -1.165 1.045 1.324 946 1HB ALA1032 1HB ALA1032 0.576 2.014 0.239 947 2HB ALA1032 2HB ALA1032 0.349 3.343 1.402 948 3HB ALA1032 3HB ALA1032 1.575 2.090 1.711 949 H LYS1033 H LYS1033 0.399 1.490 4.491 950 HA LYS1033 HA LYS1033 1.936 -0.884 4.365 951 1HB LYS1033 1HB LYS1033 2.132 1.251 5.884 952 2HB LYS1033 2HB LYS1033 1.033 0.383 6.936 953 1HG LYS1033 1HG LYS1033 3.156 -0.306 7.713 954 2HG LYS1033 2HG LYS1033 2.671 -1.636 6.680 955 1HD LYS1033 1HD LYS1033 3.911 -0.069 4.820 956 2HD LYS1033 2HD LYS1033 4.800 0.431 6.245 957 1HE LYS1033 1HE LYS1033 4.779 -2.308 6.593 958 2HE LYS1033 2HE LYS1033 4.793 -2.204 4.844 959 1HZ LYS1033 1HZ LYS1033 6.824 -1.456 6.717 960 2HZ LYS1033 2HZ LYS1033 6.966 -1.952 5.168 961 3HZ LYS1033 3HZ LYS1033 6.615 -0.391 5.496 962 H ASN1034 H ASN1034 -1.201 -0.035 5.989 963 HA ASN1034 HA ASN1034 -1.717 -2.454 7.067 964 1HB ASN1034 1HB ASN1034 -3.080 -0.200 7.102 965 2HB ASN1034 2HB ASN1034 -3.895 -0.828 5.683 966 1HD2 ASN1034 1HD2 ASN1034 -5.522 -0.365 7.611 967 2HD2 ASN1034 2HD2 ASN1034 -6.026 -1.774 8.483 968 H LEU1035 H LEU1035 -1.923 -1.350 3.683 969 HA LEU1035 HA LEU1035 -3.600 -3.316 2.659 970 1HB LEU1035 1HB LEU1035 -2.904 -1.220 1.541 971 2HB LEU1035 2HB LEU1035 -1.303 -1.893 1.309 972 HG LEU1035 HG LEU1035 -3.682 -3.381 0.243 973 1HD1 LEU1035 1HD1 LEU1035 -2.344 -1.238 -1.398 974 2HD1 LEU1035 2HD1 LEU1035 -3.873 -2.100 -1.695 975 3HD1 LEU1035 3HD1 LEU1035 -3.773 -0.887 -0.396 976 1HD2 LEU1035 1HD2 LEU1035 -1.828 -4.670 -0.111 977 2HD2 LEU1035 2HD2 LEU1035 -1.825 -3.708 -1.609 978 3HD2 LEU1035 3HD2 LEU1035 -0.740 -3.270 -0.268 979 H LEU1036 H LEU1036 0.037 -3.204 2.621 980 HA LEU1036 HA LEU1036 0.221 -5.900 1.799 981 1HB LEU1036 1HB LEU1036 1.889 -3.711 1.925 982 2HB LEU1036 2HB LEU1036 2.544 -4.759 3.167 983 HG LEU1036 HG LEU1036 2.191 -6.518 1.078 984 1HD1 LEU1036 1HD1 LEU1036 3.582 -4.931 -0.673 985 2HD1 LEU1036 2HD1 LEU1036 1.852 -5.333 -0.788 986 3HD1 LEU1036 3HD1 LEU1036 2.363 -3.805 -0.030 987 1HD2 LEU1036 1HD2 LEU1036 4.183 -6.807 2.097 988 2HD2 LEU1036 2HD2 LEU1036 4.775 -5.832 0.731 989 3HD2 LEU1036 3HD2 LEU1036 4.461 -5.061 2.305 990 H ASP1037 H ASP1037 0.318 -4.202 4.967 991 HA ASP1037 HA ASP1037 1.259 -6.084 6.582 992 1HB ASP1037 1HB ASP1037 -0.080 -3.749 6.949 993 2HB ASP1037 2HB ASP1037 -1.358 -4.853 7.415 994 H VAL1038 H VAL1038 -2.264 -5.723 5.679 995 HA VAL1038 HA VAL1038 -3.163 -8.039 6.872 996 HB VAL1038 HB VAL1038 -4.313 -5.988 5.660 997 1HG1 VAL1038 1HG1 VAL1038 -3.438 -7.020 3.410 998 2HG1 VAL1038 2HG1 VAL1038 -4.861 -8.077 3.569 999 3HG1 VAL1038 3HG1 VAL1038 -5.068 -6.310 3.495 1000 1HG2 VAL1038 1HG2 VAL1038 -5.239 -8.034 7.051 1001 2HG2 VAL1038 2HG2 VAL1038 -6.337 -6.988 6.119 1002 3HG2 VAL1038 3HG2 VAL1038 -5.837 -8.564 5.460 1003 H ILE1039 H ILE1039 -1.536 -7.502 3.732 1004 HA ILE1039 HA ILE1039 -2.086 -10.070 2.705 1005 HB ILE1039 HB ILE1039 -0.367 -7.759 2.027 1006 1HG1 ILE1039 1HG1 ILE1039 -2.085 -9.549 0.290 1007 2HG1 ILE1039 2HG1 ILE1039 -2.714 -8.180 1.186 1008 1HG2 ILE1039 1HG2 ILE1039 1.408 -9.086 1.592 1009 2HG2 ILE1039 2HG2 ILE1039 0.423 -10.565 1.482 1010 3HG2 ILE1039 3HG2 ILE1039 0.494 -9.437 0.106 1011 1HD1 ILE1039 1HD1 ILE1039 -1.408 -8.164 -1.364 1012 2HD1 ILE1039 2HD1 ILE1039 -2.029 -6.772 -0.445 1013 3HD1 ILE1039 3HD1 ILE1039 -0.347 -7.309 -0.219 1014 H ASP1040 H ASP1040 0.677 -8.645 4.549 1015 HA ASP1040 HA ASP1040 2.352 -10.771 4.438 1016 1HB ASP1040 1HB ASP1040 2.071 -8.373 5.970 1017 2HB ASP1040 2HB ASP1040 2.322 -9.658 7.134 1018 H GLN1041 H GLN1041 -0.417 -10.088 6.669 1019 HA GLN1041 HA GLN1041 0.019 -12.324 8.290 1020 1HB GLN1041 1HB GLN1041 -1.718 -10.089 8.243 1021 2HB GLN1041 2HB GLN1041 -2.779 -11.482 8.184 1022 1HG GLN1041 1HG GLN1041 -1.391 -12.451 10.142 1023 2HG GLN1041 2HG GLN1041 -0.651 -10.868 10.278 1024 1HE2 GLN1041 1HE2 GLN1041 -2.733 -9.191 9.687 1025 2HE2 GLN1041 2HE2 GLN1041 -3.965 -9.285 10.901 1026 H ALA1042 H ALA1042 -1.352 -11.893 5.108 1027 HA ALA1042 HA ALA1042 -2.900 -14.337 5.251 1028 1HB ALA1042 1HB ALA1042 -3.966 -13.511 3.423 1029 2HB ALA1042 2HB ALA1042 -3.186 -11.977 3.878 1030 3HB ALA1042 3HB ALA1042 -2.446 -13.018 2.638 1031 H ARG1043 H ARG1043 -0.144 -13.027 3.267 1032 HA ARG1043 HA ARG1043 0.510 -15.139 1.857 1033 1HB ARG1043 1HB ARG1043 1.801 -13.017 1.866 1034 2HB ARG1043 2HB ARG1043 2.461 -13.395 3.445 1035 1HG ARG1043 1HG ARG1043 3.516 -15.474 2.462 1036 2HG ARG1043 2HG ARG1043 2.925 -14.995 0.883 1037 1HD ARG1043 1HD ARG1043 4.999 -13.990 0.739 1038 2HD ARG1043 2HD ARG1043 4.174 -12.680 1.559 1039 HE ARG1043 HE ARG1043 5.022 -14.232 3.666 1040 1HH1 ARG1043 2HH2 ARG1043 6.678 -12.922 0.851 1041 2HH1 ARG1043 1HH2 ARG1043 8.211 -12.803 1.650 1042 1HH2 ARG1043 2HH1 ARG1043 7.043 -14.075 4.720 1043 2HH2 ARG1043 1HH1 ARG1043 8.420 -13.463 3.865 1044 H LEU1044 H LEU1044 1.062 -14.732 5.379 1045 HA LEU1044 HA LEU1044 2.637 -17.098 5.614 1046 1HB LEU1044 1HB LEU1044 2.459 -16.690 8.004 1047 2HB LEU1044 2HB LEU1044 2.964 -15.262 7.123 1048 HG LEU1044 HG LEU1044 0.415 -14.633 7.211 1049 1HD1 LEU1044 1HD1 LEU1044 -0.960 -15.699 8.633 1050 2HD1 LEU1044 2HD1 LEU1044 0.177 -17.053 8.422 1051 3HD1 LEU1044 3HD1 LEU1044 0.323 -15.981 9.835 1052 1HD2 LEU1044 1HD2 LEU1044 0.836 -13.641 9.547 1053 2HD2 LEU1044 2HD2 LEU1044 2.442 -14.399 9.428 1054 3HD2 LEU1044 3HD2 LEU1044 1.939 -13.186 8.226 1055 H LYS1045 H LYS1045 -0.798 -16.178 6.291 1056 HA LYS1045 HA LYS1045 -1.751 -18.386 7.452 1057 1HB LYS1045 1HB LYS1045 -3.135 -16.475 6.943 1058 2HB LYS1045 2HB LYS1045 -3.002 -16.762 5.220 1059 1HG LYS1045 1HG LYS1045 -4.048 -19.007 6.942 1060 2HG LYS1045 2HG LYS1045 -5.109 -17.645 6.645 1061 1HD LYS1045 1HD LYS1045 -4.499 -17.957 4.122 1062 2HD LYS1045 2HD LYS1045 -3.856 -19.516 4.599 1063 1HE LYS1045 1HE LYS1045 -6.573 -18.948 5.675 1064 2HE LYS1045 2HE LYS1045 -6.502 -19.035 3.926 1065 1HZ LYS1045 1HZ LYS1045 -5.585 -21.091 5.810 1066 2HZ LYS1045 2HZ LYS1045 -6.855 -21.191 4.788 1067 3HZ LYS1045 3HZ LYS1045 -5.332 -21.164 4.199 1068 H MET1046 H MET1046 -0.508 -18.116 4.140 1069 HA MET1046 HA MET1046 -1.586 -20.634 3.373 1070 1HB MET1046 1HB MET1046 -1.225 -18.994 1.626 1071 2HB MET1046 2HB MET1046 0.398 -18.639 2.183 1072 1HG MET1046 1HG MET1046 0.154 -21.484 1.540 1073 2HG MET1046 2HG MET1046 -0.359 -20.511 0.176 1074 1HE MET1046 1HE MET1046 2.179 -17.762 0.850 1075 2HE MET1046 2HE MET1046 2.309 -18.348 -0.826 1076 3HE MET1046 3HE MET1046 0.714 -18.229 -0.045 1077 H ILE1047 H ILE1047 1.751 -19.350 4.046 1078 HA ILE1047 HA ILE1047 3.036 -21.806 3.777 1079 HB ILE1047 HB ILE1047 3.698 -19.236 5.187 1080 1HG1 ILE1047 1HG1 ILE1047 5.522 -20.030 3.123 1081 2HG1 ILE1047 2HG1 ILE1047 3.890 -20.186 2.506 1082 1HG2 ILE1047 1HG2 ILE1047 4.754 -21.034 6.471 1083 2HG2 ILE1047 2HG2 ILE1047 5.480 -21.679 4.979 1084 3HG2 ILE1047 3HG2 ILE1047 5.958 -20.073 5.578 1085 1HD1 ILE1047 1HD1 ILE1047 4.096 -17.941 2.098 1086 2HD1 ILE1047 2HD1 ILE1047 3.682 -17.784 3.822 1087 3HD1 ILE1047 3HD1 ILE1047 5.386 -17.741 3.309 1088 H SER1048 H SER1048 2.476 -20.058 6.912 1089 HA SER1048 HA SER1048 2.764 -22.462 8.335 1090 1HB SER1048 1HB SER1048 2.056 -19.613 8.987 1091 2HB SER1048 2HB SER1048 1.656 -20.832 10.181 1092 HG SER1048 HG SER1048 4.122 -19.770 9.518 1093 H GLN1049 H GLN1049 1.158 -23.889 7.351 1094 HA GLN1049 HA GLN1049 -1.273 -23.843 8.726 1095 1HB GLN1049 1HB GLN1049 -1.266 -22.332 6.292 1096 2HB GLN1049 2HB GLN1049 -2.176 -23.796 5.975 1097 1HG GLN1049 1HG GLN1049 -2.743 -22.411 8.579 1098 2HG GLN1049 2HG GLN1049 -3.273 -21.586 7.127 1099 1HE2 GLN1049 1HE2 GLN1049 -4.123 -23.740 9.453 1100 2HE2 GLN1049 2HE2 GLN1049 -5.397 -24.609 8.664 1101 H SER1050 H SER1050 0.024 -24.875 5.480 1102 HA SER1050 HA SER1050 -0.588 -27.601 6.321 1103 1HB SER1050 1HB SER1050 -1.764 -26.444 4.238 1104 2HB SER1050 2HB SER1050 -0.258 -26.811 3.421 1105 HG SER1050 HG SER1050 -0.874 -28.847 3.251 1106 H ARG1051 H ARG1051 1.545 -25.752 4.011 1107 HA ARG1051 HA ARG1051 3.435 -27.662 3.715 1108 1HB ARG1051 1HB ARG1051 3.306 -24.701 3.428 1109 2HB ARG1051 2HB ARG1051 4.933 -25.313 3.653 1110 1HG ARG1051 1HG ARG1051 3.861 -27.120 1.811 1111 2HG ARG1051 2HG ARG1051 3.115 -25.608 1.332 1112 1HD ARG1051 1HD ARG1051 5.976 -25.255 1.943 1113 2HD ARG1051 2HD ARG1051 5.728 -26.458 0.694 1114 HE ARG1051 HE ARG1051 4.919 -24.786 -0.753 1115 1HH1 ARG1051 2HH2 ARG1051 5.136 -23.526 2.525 1116 2HH1 ARG1051 1HH2 ARG1051 4.849 -21.886 2.050 1117 1HH2 ARG1051 2HH1 ARG1051 4.541 -22.622 -1.381 1118 2HH2 ARG1051 1HH1 ARG1051 4.508 -21.368 -0.187 1119 HA PRO1052 HA PRO1052 5.566 -27.734 7.523 1120 1HB PRO1052 1HB PRO1052 7.939 -28.862 6.773 1121 2HB PRO1052 2HB PRO1052 6.483 -29.794 7.059 1122 1HG PRO1052 1HG PRO1052 7.746 -29.074 4.486 1123 2HG PRO1052 2HG PRO1052 6.568 -30.328 4.817 1124 1HD PRO1052 1HD PRO1052 6.069 -27.789 3.579 1125 2HD PRO1052 2HD PRO1052 4.875 -28.995 4.016 1126 H HIS1053 H HIS1053 7.838 -26.769 4.986 1127 HA HIS1053 HA HIS1053 9.153 -25.038 6.831 1128 1HB HIS1053 1HB HIS1053 9.493 -25.856 3.982 1129 2HB HIS1053 2HB HIS1053 10.196 -24.325 4.465 1130 HD1 HIS1053 HD1 HIS1053 12.095 -24.402 6.327 1131 HD2 HIS1053 HD2 HIS1053 10.821 -28.137 4.906 1132 HE1 HIS1053 HE1 HIS1053 13.854 -26.091 7.078 Start of MODEL 9 1 H MET 915 H MET 915 7.715 -24.283 -2.451 2 HA MET 915 HA MET 915 8.617 -22.179 -3.714 3 1HB MET 915 1HB MET 915 8.933 -25.139 -4.123 4 2HB MET 915 2HB MET 915 9.553 -24.145 -5.427 5 1HG MET 915 1HG MET 915 11.248 -23.238 -4.126 6 2HG MET 915 2HG MET 915 10.282 -23.246 -2.663 7 1HE MET 915 1HE MET 915 13.015 -25.534 -1.354 8 2HE MET 915 2HE MET 915 12.854 -23.870 -1.964 9 3HE MET 915 3HE MET 915 11.651 -24.520 -0.824 10 H ALA 916 H ALA 916 6.795 -21.013 -4.686 11 HA ALA 916 HA ALA 916 5.885 -22.171 -7.221 12 1HB ALA 916 1HB ALA 916 4.235 -20.133 -6.940 13 2HB ALA 916 2HB ALA 916 3.986 -21.617 -5.988 14 3HB ALA 916 3HB ALA 916 4.758 -20.198 -5.240 15 H ASN 917 H ASN 917 5.223 -19.957 -8.679 16 HA ASN 917 HA ASN 917 7.575 -19.230 -9.798 17 1HB ASN 917 1HB ASN 917 4.768 -18.455 -10.001 18 2HB ASN 917 2HB ASN 917 5.768 -17.025 -10.163 19 1HD2 ASN 917 1HD2 ASN 917 4.890 -17.027 -12.336 20 2HD2 ASN 917 2HD2 ASN 917 5.660 -17.951 -13.583 21 H LEU 918 H LEU 918 9.049 -17.473 -9.493 22 HA LEU 918 HA LEU 918 8.406 -15.658 -7.276 23 1HB LEU 918 1HB LEU 918 10.624 -17.529 -7.589 24 2HB LEU 918 2HB LEU 918 11.164 -15.886 -7.304 25 HG LEU 918 HG LEU 918 9.048 -17.070 -5.530 26 1HD1 LEU 918 1HD1 LEU 918 11.692 -18.164 -5.857 27 2HD1 LEU 918 2HD1 LEU 918 11.517 -17.456 -4.233 28 3HD1 LEU 918 3HD1 LEU 918 10.367 -18.694 -4.794 29 1HD2 LEU 918 1HD2 LEU 918 10.207 -15.602 -3.853 30 2HD2 LEU 918 2HD2 LEU 918 11.204 -14.976 -5.187 31 3HD2 LEU 918 3HD2 LEU 918 9.440 -14.743 -5.210 32 H ASP 919 H ASP 919 7.538 -14.628 -9.454 33 HA ASP 919 HA ASP 919 9.588 -13.542 -11.087 34 1HB ASP 919 1HB ASP 919 6.955 -14.063 -11.490 35 2HB ASP 919 2HB ASP 919 6.814 -12.377 -11.035 36 H ARG 920 H ARG 920 9.001 -10.893 -11.517 37 HA ARG 920 HA ARG 920 9.700 -9.745 -8.986 38 1HB ARG 920 1HB ARG 920 10.092 -7.663 -10.385 39 2HB ARG 920 2HB ARG 920 11.027 -9.049 -10.910 40 1HG ARG 920 1HG ARG 920 9.545 -9.479 -12.768 41 2HG ARG 920 2HG ARG 920 8.315 -8.403 -12.136 42 1HD ARG 920 1HD ARG 920 9.475 -6.461 -12.780 43 2HD ARG 920 2HD ARG 920 11.043 -7.241 -12.711 44 HE ARG 920 HE ARG 920 9.231 -7.187 -14.994 45 1HH1 ARG 920 2HH2 ARG 920 11.826 -9.048 -13.459 46 2HH1 ARG 920 1HH2 ARG 920 12.318 -9.813 -14.933 47 1HH2 ARG 920 1HH1 ARG 920 11.160 -9.298 -16.966 48 H SER 921 H SER 921 6.979 -10.727 -9.201 49 HA SER 921 HA SER 921 5.366 -8.412 -9.717 50 1HB SER 921 1HB SER 921 3.493 -10.020 -8.980 51 2HB SER 921 2HB SER 921 4.366 -10.441 -10.441 52 HG SER 921 HG SER 921 5.356 -12.126 -9.440 53 H ASN 922 H ASN 922 6.228 -10.581 -6.938 54 HA ASN 922 HA ASN 922 4.736 -9.246 -5.051 55 1HB ASN 922 1HB ASN 922 7.294 -10.902 -4.889 56 2HB ASN 922 2HB ASN 922 6.559 -10.240 -3.442 57 1HD2 ASN 922 1HD2 ASN 922 5.702 -11.911 -2.438 58 2HD2 ASN 922 2HD2 ASN 922 4.573 -13.047 -3.097 59 H ASP 923 H ASP 923 7.817 -8.529 -6.633 60 HA ASP 923 HA ASP 923 8.721 -6.752 -4.615 61 1HB ASP 923 1HB ASP 923 9.849 -8.045 -6.825 62 2HB ASP 923 2HB ASP 923 9.788 -6.376 -7.355 63 H LYS 924 H LYS 924 7.298 -6.528 -7.954 64 HA LYS 924 HA LYS 924 7.346 -3.821 -8.299 65 1HB LYS 924 1HB LYS 924 5.959 -6.103 -9.430 66 2HB LYS 924 2HB LYS 924 4.905 -4.705 -9.387 67 1HG LYS 924 1HG LYS 924 7.730 -4.242 -10.306 68 2HG LYS 924 2HG LYS 924 6.684 -5.136 -11.391 69 1HD LYS 924 1HD LYS 924 5.980 -3.086 -12.106 70 2HD LYS 924 2HD LYS 924 5.014 -3.063 -10.645 71 1HE LYS 924 1HE LYS 924 6.237 -1.354 -9.782 72 2HE LYS 924 2HE LYS 924 7.732 -2.241 -10.005 73 1HZ LYS 924 1HZ LYS 924 7.491 -0.130 -11.282 74 2HZ LYS 924 2HZ LYS 924 7.928 -1.429 -12.170 75 3HZ LYS 924 3HZ LYS 924 6.391 -0.880 -12.228 76 H VAL 925 H VAL 925 4.564 -5.726 -6.930 77 HA VAL 925 HA VAL 925 3.028 -3.581 -6.198 78 HB VAL 925 HB VAL 925 3.360 -6.236 -4.785 79 1HG1 VAL 925 1HG1 VAL 925 0.707 -4.943 -4.856 80 2HG1 VAL 925 2HG1 VAL 925 1.545 -5.780 -3.527 81 3HG1 VAL 925 3HG1 VAL 925 1.928 -4.080 -3.890 82 1HG2 VAL 925 1HG2 VAL 925 2.282 -7.241 -6.471 83 2HG2 VAL 925 2HG2 VAL 925 1.065 -5.945 -6.570 84 3HG2 VAL 925 3HG2 VAL 925 2.617 -5.777 -7.427 85 H TYR 926 H TYR 926 5.165 -5.460 -3.927 86 HA TYR 926 HA TYR 926 5.029 -3.779 -1.802 87 1HB TYR 926 1HB TYR 926 7.195 -5.506 -3.104 88 2HB TYR 926 2HB TYR 926 7.574 -4.649 -1.623 89 HD1 TYR 926 HD1 TYR 926 4.232 -6.079 -2.336 90 HD2 TYR 926 HD2 TYR 926 7.940 -6.599 -0.266 91 HE1 TYR 926 HE1 TYR 926 3.216 -7.973 -0.976 92 HE2 TYR 926 HE2 TYR 926 6.912 -8.490 1.087 93 HH TYR 926 HH TYR 926 4.791 -9.259 1.779 94 H GLU 927 H GLU 927 6.883 -3.353 -4.825 95 HA GLU 927 HA GLU 927 8.486 -1.283 -3.789 96 1HB GLU 927 1HB GLU 927 9.069 -2.713 -5.777 97 2HB GLU 927 2HB GLU 927 7.799 -1.924 -6.692 98 1HG GLU 927 1HG GLU 927 9.661 -0.034 -5.351 99 2HG GLU 927 2HG GLU 927 10.434 -1.059 -6.544 100 H ASN 928 H ASN 928 5.823 -1.214 -6.278 101 HA ASN 928 HA ASN 928 5.543 1.429 -6.495 102 1HB ASN 928 1HB ASN 928 4.111 -0.753 -7.354 103 2HB ASN 928 2HB ASN 928 2.962 -0.087 -6.211 104 1HD2 ASN 928 1HD2 ASN 928 4.933 0.601 -9.045 105 2HD2 ASN 928 2HD2 ASN 928 3.981 1.898 -9.688 106 H VAL 929 H VAL 929 3.976 -0.757 -4.046 107 HA VAL 929 HA VAL 929 2.418 1.068 -2.737 108 HB VAL 929 HB VAL 929 3.979 -1.294 -1.679 109 1HG1 VAL 929 1HG1 VAL 929 3.269 -0.802 0.375 110 2HG1 VAL 929 2HG1 VAL 929 2.495 0.681 -0.234 111 3HG1 VAL 929 3HG1 VAL 929 1.584 -0.848 -0.196 112 1HG2 VAL 929 1HG2 VAL 929 1.992 -1.285 -3.556 113 2HG2 VAL 929 2HG2 VAL 929 2.341 -2.639 -2.455 114 3HG2 VAL 929 3HG2 VAL 929 1.055 -1.476 -2.055 115 H THR 930 H THR 930 5.852 0.159 -1.955 116 HA THR 930 HA THR 930 6.108 2.176 0.013 117 HB THR 930 HB THR 930 8.613 1.545 -0.389 118 HG1 THR 930 HG1 THR 930 8.723 -0.360 -1.821 119 1HG2 THR 930 1HG2 THR 930 6.672 -0.788 0.021 120 2HG2 THR 930 2HG2 THR 930 8.364 -0.704 0.566 121 3HG2 THR 930 3HG2 THR 930 7.136 0.348 1.310 122 H GLY 931 H GLY 931 7.667 1.964 -3.261 123 1HA GLY 931 1HA GLY 931 8.828 4.323 -3.521 124 2HA GLY 931 2HA GLY 931 7.870 3.628 -4.813 125 H LEU 932 H LEU 932 5.254 3.870 -4.053 126 HA LEU 932 HA LEU 932 4.769 6.601 -4.458 127 1HB LEU 932 1HB LEU 932 2.714 5.918 -4.928 128 2HB LEU 932 2HB LEU 932 3.388 4.304 -4.818 129 HG LEU 932 HG LEU 932 2.670 4.229 -2.413 130 1HD1 LEU 932 1HD1 LEU 932 0.613 6.150 -2.408 131 2HD1 LEU 932 2HD1 LEU 932 2.073 6.105 -1.392 132 3HD1 LEU 932 3HD1 LEU 932 2.086 7.002 -2.929 133 1HD2 LEU 932 1HD2 LEU 932 0.068 4.594 -3.532 134 2HD2 LEU 932 2HD2 LEU 932 1.136 3.922 -4.788 135 3HD2 LEU 932 3HD2 LEU 932 0.958 3.082 -3.228 136 H VAL 933 H VAL 933 4.387 4.473 -1.546 137 HA VAL 933 HA VAL 933 3.430 6.429 0.155 138 HB VAL 933 HB VAL 933 4.763 3.797 0.375 139 1HG1 VAL 933 1HG1 VAL 933 4.674 5.753 2.693 140 2HG1 VAL 933 2HG1 VAL 933 4.883 3.995 2.877 141 3HG1 VAL 933 3HG1 VAL 933 6.104 4.950 2.002 142 1HG2 VAL 933 1HG2 VAL 933 2.511 3.485 0.432 143 2HG2 VAL 933 2HG2 VAL 933 2.754 3.778 2.171 144 3HG2 VAL 933 3HG2 VAL 933 2.190 5.097 1.116 145 H LYS 934 H LYS 934 6.861 5.244 -0.128 146 HA LYS 934 HA LYS 934 8.072 6.987 1.516 147 1HB LYS 934 1HB LYS 934 9.082 6.071 -1.194 148 2HB LYS 934 2HB LYS 934 10.074 6.732 0.090 149 1HG LYS 934 1HG LYS 934 8.825 4.792 1.516 150 2HG LYS 934 2HG LYS 934 8.703 4.059 -0.072 151 1HD LYS 934 1HD LYS 934 10.790 3.246 0.495 152 2HD LYS 934 2HD LYS 934 11.305 4.772 -0.196 153 1HE LYS 934 1HE LYS 934 10.982 5.719 2.248 154 2HE LYS 934 2HE LYS 934 11.017 4.036 2.736 155 1HZ LYS 934 1HZ LYS 934 13.134 3.872 1.488 156 2HZ LYS 934 2HZ LYS 934 13.116 5.493 1.295 157 3HZ LYS 934 3HZ LYS 934 13.203 4.851 2.793 158 H ALA 935 H ALA 935 6.814 7.652 -1.777 159 HA ALA 935 HA ALA 935 7.944 10.236 -1.949 160 1HB ALA 935 1HB ALA 935 7.172 10.024 -4.049 161 2HB ALA 935 2HB ALA 935 6.506 8.439 -3.587 162 3HB ALA 935 3HB ALA 935 5.493 9.898 -3.471 163 H VAL 936 H VAL 936 4.636 9.006 -1.091 164 HA VAL 936 HA VAL 936 3.297 11.283 -0.699 165 HB VAL 936 HB VAL 936 3.377 8.841 1.082 166 1HG1 VAL 936 1HG1 VAL 936 1.744 11.305 1.203 167 2HG1 VAL 936 2HG1 VAL 936 0.825 9.782 1.274 168 3HG1 VAL 936 3HG1 VAL 936 2.110 10.103 2.464 169 1HG2 VAL 936 1HG2 VAL 936 2.699 7.954 -0.908 170 2HG2 VAL 936 2HG2 VAL 936 1.124 8.562 -0.344 171 3HG2 VAL 936 3HG2 VAL 936 2.073 9.505 -1.517 172 H ILE 937 H ILE 937 5.882 9.952 1.409 173 HA ILE 937 HA ILE 937 5.529 12.110 3.294 174 HB ILE 937 HB ILE 937 7.780 10.125 3.271 175 1HG1 ILE 937 1HG1 ILE 937 6.036 8.618 2.999 176 2HG1 ILE 937 2HG1 ILE 937 6.197 8.720 4.741 177 1HG2 ILE 937 1HG2 ILE 937 6.275 11.221 5.641 178 2HG2 ILE 937 2HG2 ILE 937 7.907 10.514 5.570 179 3HG2 ILE 937 3HG2 ILE 937 7.604 12.126 4.877 180 1HD1 ILE 937 1HD1 ILE 937 3.927 9.068 4.648 181 2HD1 ILE 937 2HD1 ILE 937 4.414 10.751 4.335 182 3HD1 ILE 937 3HD1 ILE 937 3.988 9.680 2.978 183 H GLU 938 H GLU 938 8.356 10.885 1.359 184 HA GLU 938 HA GLU 938 10.040 12.871 1.641 185 1HB GLU 938 1HB GLU 938 9.597 10.846 -0.305 186 2HB GLU 938 2HB GLU 938 9.877 12.317 -1.216 187 1HG GLU 938 1HG GLU 938 12.097 11.996 -0.860 188 2HG GLU 938 2HG GLU 938 11.816 12.445 0.810 189 H MET 939 H MET 939 7.161 12.962 -0.541 190 HA MET 939 HA MET 939 7.642 15.316 -1.793 191 1HB MET 939 1HB MET 939 5.646 13.556 -1.894 192 2HB MET 939 2HB MET 939 4.876 14.605 -0.720 193 1HG MET 939 1HG MET 939 5.525 16.527 -2.465 194 2HG MET 939 2HG MET 939 5.598 15.193 -3.600 195 1HE MET 939 1HE MET 939 3.816 16.424 -0.613 196 2HE MET 939 2HE MET 939 2.117 16.644 -1.097 197 3HE MET 939 3HE MET 939 2.687 15.050 -0.545 198 H SER 940 H SER 940 5.684 14.894 1.252 199 HA SER 940 HA SER 940 5.131 17.461 1.752 200 1HB SER 940 1HB SER 940 4.654 16.801 3.946 201 2HB SER 940 2HB SER 940 4.618 15.269 3.097 202 HG SER 940 HG SER 940 6.798 14.856 3.808 203 H SER 941 H SER 941 8.248 15.759 2.221 204 HA SER 941 HA SER 941 9.451 17.735 3.763 205 1HB SER 941 1HB SER 941 10.894 15.996 3.872 206 2HB SER 941 2HB SER 941 10.204 15.255 2.442 207 HG SER 941 HG SER 941 12.527 15.894 2.302 208 H LYS 942 H LYS 942 8.942 17.309 0.260 209 HA LYS 942 HA LYS 942 10.358 19.850 -0.161 210 1HB LYS 942 1HB LYS 942 10.734 18.994 -2.507 211 2HB LYS 942 2HB LYS 942 11.653 18.198 -1.245 212 1HG LYS 942 1HG LYS 942 10.590 16.192 -1.557 213 2HG LYS 942 2HG LYS 942 9.013 16.939 -1.722 214 1HD LYS 942 1HD LYS 942 10.657 17.651 -4.016 215 2HD LYS 942 2HD LYS 942 10.687 15.912 -3.802 216 1HE LYS 942 1HE LYS 942 7.973 16.956 -3.419 217 2HE LYS 942 2HE LYS 942 8.611 17.448 -4.975 218 1HZ LYS 942 1HZ LYS 942 7.601 15.016 -4.364 219 2HZ LYS 942 2HZ LYS 942 8.462 15.383 -5.703 220 3HZ LYS 942 3HZ LYS 942 9.211 14.744 -4.399 221 H ILE 943 H ILE 943 7.514 19.236 0.671 222 HA ILE 943 HA ILE 943 6.080 20.031 -1.738 223 HB ILE 943 HB ILE 943 5.450 18.179 0.045 224 1HG1 ILE 943 1HG1 ILE 943 4.254 18.708 -2.047 225 2HG1 ILE 943 2HG1 ILE 943 3.170 18.308 -0.730 226 1HG2 ILE 943 1HG2 ILE 943 5.414 19.676 1.968 227 2HG2 ILE 943 2HG2 ILE 943 4.168 20.678 1.185 228 3HG2 ILE 943 3HG2 ILE 943 3.796 19.003 1.657 229 1HD1 ILE 943 1HD1 ILE 943 3.205 20.694 -2.312 230 2HD1 ILE 943 2HD1 ILE 943 2.126 20.301 -0.952 231 3HD1 ILE 943 3HD1 ILE 943 3.659 21.155 -0.654 232 H GLN 944 H GLN 944 6.708 21.097 1.664 233 HA GLN 944 HA GLN 944 5.246 23.352 1.688 234 1HB GLN 944 1HB GLN 944 7.284 22.214 3.257 235 2HB GLN 944 2HB GLN 944 7.901 23.806 2.864 236 1HG GLN 944 1HG GLN 944 5.409 24.568 3.505 237 2HG GLN 944 2HG GLN 944 5.410 23.061 4.400 238 1HE2 GLN 944 1HE2 GLN 944 5.617 26.096 4.972 239 2HE2 GLN 944 2HE2 GLN 944 6.865 26.222 6.167 240 HA PRO 945 HA PRO 945 8.771 25.644 -0.512 241 1HB PRO 945 1HB PRO 945 10.843 24.240 -1.608 242 2HB PRO 945 2HB PRO 945 10.919 24.978 -0.020 243 1HG PRO 945 1HG PRO 945 10.600 22.125 -0.724 244 2HG PRO 945 2HG PRO 945 11.098 22.830 0.801 245 1HD PRO 945 1HD PRO 945 8.521 21.736 0.177 246 2HD PRO 945 2HD PRO 945 8.985 22.545 1.661 247 H ALA 946 H ALA 946 8.500 22.479 -2.056 248 HA ALA 946 HA ALA 946 8.577 23.070 -4.629 249 1HB ALA 946 1HB ALA 946 6.814 21.283 -2.990 250 2HB ALA 946 2HB ALA 946 6.430 21.469 -4.718 251 3HB ALA 946 3HB ALA 946 8.030 20.868 -4.223 252 HA PRO 947 HA PRO 947 5.642 26.220 -5.259 253 1HB PRO 947 1HB PRO 947 5.972 26.523 -7.955 254 2HB PRO 947 2HB PRO 947 7.010 27.291 -6.770 255 1HG PRO 947 1HG PRO 947 7.575 24.954 -8.490 256 2HG PRO 947 2HG PRO 947 8.703 25.984 -7.632 257 1HD PRO 947 1HD PRO 947 7.867 23.347 -6.873 258 2HD PRO 947 2HD PRO 947 8.904 24.422 -5.957 259 HA PRO 948 HA PRO 948 2.026 24.573 -6.767 260 1HB PRO 948 1HB PRO 948 0.774 26.569 -8.151 261 2HB PRO 948 2HB PRO 948 0.779 26.475 -6.402 262 1HG PRO 948 1HG PRO 948 2.320 28.279 -8.165 263 2HG PRO 948 2HG PRO 948 1.985 28.441 -6.452 264 1HD PRO 948 1HD PRO 948 4.453 27.598 -7.646 265 2HD PRO 948 2HD PRO 948 4.080 27.648 -5.935 266 H GLU 949 H GLU 949 4.274 25.678 -9.043 267 HA GLU 949 HA GLU 949 2.820 24.476 -11.210 268 1HB GLU 949 1HB GLU 949 5.125 26.304 -10.903 269 2HB GLU 949 2HB GLU 949 5.355 25.120 -12.175 270 1HG GLU 949 1HG GLU 949 2.713 26.587 -12.002 271 2HG GLU 949 2HG GLU 949 4.101 27.419 -12.673 272 H GLU 950 H GLU 950 4.997 23.514 -8.736 273 HA GLU 950 HA GLU 950 5.822 21.231 -10.355 274 1HB GLU 950 1HB GLU 950 7.415 23.012 -8.900 275 2HB GLU 950 2HB GLU 950 7.285 21.634 -7.825 276 1HG GLU 950 1HG GLU 950 9.127 21.009 -9.130 277 2HG GLU 950 2HG GLU 950 7.824 20.207 -9.984 278 H TYR 951 H TYR 951 3.743 22.305 -7.884 279 HA TYR 951 HA TYR 951 3.815 19.811 -6.396 280 1HB TYR 951 1HB TYR 951 3.556 22.106 -5.336 281 2HB TYR 951 2HB TYR 951 2.127 22.390 -6.310 282 HD1 TYR 951 HD1 TYR 951 3.014 19.235 -4.526 283 HD2 TYR 951 HD2 TYR 951 0.471 22.674 -4.649 284 HE1 TYR 951 HE1 TYR 951 1.561 18.236 -2.694 285 HE2 TYR 951 HE2 TYR 951 -0.973 21.662 -2.817 286 HH TYR 951 HH TYR 951 -0.319 18.404 -1.599 287 H VAL 952 H VAL 952 1.833 21.564 -8.805 288 HA VAL 952 HA VAL 952 -0.527 20.196 -8.591 289 HB VAL 952 HB VAL 952 0.938 21.702 -10.649 290 1HG1 VAL 952 1HG1 VAL 952 -1.253 19.757 -11.451 291 2HG1 VAL 952 2HG1 VAL 952 -0.639 21.082 -12.468 292 3HG1 VAL 952 3HG1 VAL 952 0.440 19.747 -12.000 293 1HG2 VAL 952 1HG2 VAL 952 -1.247 22.832 -10.863 294 2HG2 VAL 952 2HG2 VAL 952 -1.964 21.639 -9.754 295 3HG2 VAL 952 3HG2 VAL 952 -0.701 22.749 -9.171 296 HA PRO 953 HA PRO 953 1.426 16.811 -11.266 297 1HB PRO 953 1HB PRO 953 4.137 16.748 -11.608 298 2HB PRO 953 2HB PRO 953 3.040 17.458 -12.776 299 1HG PRO 953 1HG PRO 953 4.832 18.812 -10.854 300 2HG PRO 953 2HG PRO 953 4.065 19.466 -12.288 301 1HD PRO 953 1HD PRO 953 3.268 19.898 -9.567 302 2HD PRO 953 2HD PRO 953 2.435 20.455 -11.004 303 H MET 954 H MET 954 3.934 17.664 -8.921 304 HA MET 954 HA MET 954 4.751 15.387 -8.031 305 1HB MET 954 1HB MET 954 4.032 17.955 -6.765 306 2HB MET 954 2HB MET 954 3.928 16.641 -5.610 307 1HG MET 954 1HG MET 954 6.212 16.201 -5.683 308 2HG MET 954 2HG MET 954 6.360 16.654 -7.369 309 1HE MET 954 1HE MET 954 6.174 18.704 -3.578 310 2HE MET 954 2HE MET 954 5.067 19.784 -4.458 311 3HE MET 954 3HE MET 954 4.740 18.036 -4.393 312 H VAL 955 H VAL 955 1.622 16.738 -6.739 313 HA VAL 955 HA VAL 955 0.928 14.375 -5.404 314 HB VAL 955 HB VAL 955 -0.389 16.922 -6.198 315 1HG1 VAL 955 1HG1 VAL 955 -1.879 14.401 -5.450 316 2HG1 VAL 955 2HG1 VAL 955 -2.531 16.017 -5.093 317 3HG1 VAL 955 3HG1 VAL 955 -2.204 15.542 -6.777 318 1HG2 VAL 955 1HG2 VAL 955 0.326 17.329 -4.114 319 2HG2 VAL 955 2HG2 VAL 955 -1.016 16.296 -3.567 320 3HG2 VAL 955 3HG2 VAL 955 0.610 15.603 -3.785 321 H LYS 956 H LYS 956 -0.170 15.758 -8.579 322 HA LYS 956 HA LYS 956 -1.913 13.844 -9.337 323 1HB LYS 956 1HB LYS 956 -0.476 15.947 -10.564 324 2HB LYS 956 2HB LYS 956 -0.229 14.541 -11.580 325 1HG LYS 956 1HG LYS 956 -2.411 14.503 -12.264 326 2HG LYS 956 2HG LYS 956 -3.020 14.763 -10.642 327 1HD LYS 956 1HD LYS 956 -3.668 16.721 -11.835 328 2HD LYS 956 2HD LYS 956 -2.274 17.226 -10.900 329 1HE LYS 956 1HE LYS 956 -0.823 17.175 -12.804 330 2HE LYS 956 2HE LYS 956 -1.930 16.186 -13.736 331 1HZ LYS 956 1HZ LYS 956 -3.243 18.518 -12.980 332 2HZ LYS 956 2HZ LYS 956 -1.807 18.941 -13.633 333 3HZ LYS 956 3HZ LYS 956 -2.852 18.020 -14.486 334 H GLU 957 H GLU 957 1.674 13.657 -9.342 335 HA GLU 957 HA GLU 957 1.877 11.315 -10.774 336 1HB GLU 957 1HB GLU 957 3.585 12.940 -9.007 337 2HB GLU 957 2HB GLU 957 3.976 11.234 -8.920 338 1HG GLU 957 1HG GLU 957 5.212 11.621 -10.802 339 2HG GLU 957 2HG GLU 957 3.677 11.547 -11.644 340 H VAL 958 H VAL 958 1.569 11.872 -7.206 341 HA VAL 958 HA VAL 958 1.817 9.288 -6.347 342 HB VAL 958 HB VAL 958 0.166 11.617 -5.386 343 1HG1 VAL 958 1HG1 VAL 958 -0.980 10.298 -4.002 344 2HG1 VAL 958 2HG1 VAL 958 -0.119 8.861 -4.601 345 3HG1 VAL 958 3HG1 VAL 958 0.553 9.801 -3.247 346 1HG2 VAL 958 1HG2 VAL 958 1.904 12.007 -3.855 347 2HG2 VAL 958 2HG2 VAL 958 2.585 10.376 -4.068 348 3HG2 VAL 958 3HG2 VAL 958 2.743 11.583 -5.367 349 H GLY 959 H GLY 959 -1.113 10.982 -7.623 350 1HA GLY 959 1HA GLY 959 -2.974 8.972 -7.199 351 2HA GLY 959 2HA GLY 959 -3.031 10.176 -8.471 352 H LEU 960 H LEU 960 -0.671 9.493 -9.947 353 HA LEU 960 HA LEU 960 -1.677 7.462 -11.565 354 1HB LEU 960 1HB LEU 960 0.400 9.363 -11.610 355 2HB LEU 960 2HB LEU 960 1.169 7.808 -11.857 356 HG LEU 960 HG LEU 960 -1.270 8.309 -13.475 357 1HD1 LEU 960 1HD1 LEU 960 -0.649 10.344 -14.154 358 2HD1 LEU 960 2HD1 LEU 960 0.978 10.189 -13.449 359 3HD1 LEU 960 3HD1 LEU 960 0.636 9.506 -15.057 360 1HD2 LEU 960 1HD2 LEU 960 -0.292 6.321 -14.059 361 2HD2 LEU 960 2HD2 LEU 960 0.488 7.416 -15.226 362 3HD2 LEU 960 3HD2 LEU 960 1.360 6.911 -13.759 363 H ALA 961 H ALA 961 0.717 7.457 -8.886 364 HA ALA 961 HA ALA 961 1.736 4.926 -9.226 365 1HB ALA 961 1HB ALA 961 1.178 5.740 -6.433 366 2HB ALA 961 2HB ALA 961 2.725 5.363 -7.228 367 3HB ALA 961 3HB ALA 961 1.997 6.976 -7.418 368 H LEU 962 H LEU 962 -1.313 6.006 -7.624 369 HA LEU 962 HA LEU 962 -2.050 3.572 -6.550 370 1HB LEU 962 1HB LEU 962 -3.640 5.917 -7.571 371 2HB LEU 962 2HB LEU 962 -4.399 4.525 -6.826 372 HG LEU 962 HG LEU 962 -2.349 6.325 -5.504 373 1HD1 LEU 962 1HD1 LEU 962 -5.204 6.589 -5.849 374 2HD1 LEU 962 2HD1 LEU 962 -4.793 6.429 -4.125 375 3HD1 LEU 962 3HD1 LEU 962 -4.037 7.709 -5.105 376 1HD2 LEU 962 1HD2 LEU 962 -2.152 4.091 -4.629 377 2HD2 LEU 962 2HD2 LEU 962 -2.976 5.115 -3.429 378 3HD2 LEU 962 3HD2 LEU 962 -3.916 3.971 -4.417 379 H ARG 963 H ARG 963 -2.990 4.989 -9.764 380 HA ARG 963 HA ARG 963 -4.489 3.044 -10.721 381 1HB ARG 963 1HB ARG 963 -2.229 4.445 -12.237 382 2HB ARG 963 2HB ARG 963 -3.565 3.613 -13.006 383 1HG ARG 963 1HG ARG 963 -4.676 5.427 -11.058 384 2HG ARG 963 2HG ARG 963 -3.485 6.314 -11.989 385 1HD ARG 963 1HD ARG 963 -5.161 4.590 -13.701 386 2HD ARG 963 2HD ARG 963 -6.119 5.739 -12.788 387 HE ARG 963 HE ARG 963 -4.299 6.356 -14.967 388 1HH1 ARG 963 2HH2 ARG 963 -5.662 7.644 -11.989 389 2HH1 ARG 963 1HH2 ARG 963 -5.455 9.298 -12.459 390 1HH2 ARG 963 2HH1 ARG 963 -4.024 8.539 -15.587 391 2HH2 ARG 963 1HH1 ARG 963 -4.517 9.810 -14.519 392 H THR 964 H THR 964 -0.865 3.058 -10.672 393 HA THR 964 HA THR 964 -0.669 0.487 -11.905 394 HB THR 964 HB THR 964 1.295 2.311 -10.423 395 HG1 THR 964 HG1 THR 964 0.241 2.926 -12.535 396 1HG2 THR 964 1HG2 THR 964 2.570 0.354 -10.430 397 2HG2 THR 964 2HG2 THR 964 1.604 -0.386 -11.729 398 3HG2 THR 964 3HG2 THR 964 2.828 0.846 -12.121 399 H LEU 965 H LEU 965 -0.303 1.719 -8.521 400 HA LEU 965 HA LEU 965 0.405 -0.611 -7.313 401 1HB LEU 965 1HB LEU 965 0.443 1.198 -5.934 402 2HB LEU 965 2HB LEU 965 -1.094 1.822 -6.501 403 HG LEU 965 HG LEU 965 -1.320 -0.729 -5.048 404 1HD1 LEU 965 1HD1 LEU 965 0.613 0.467 -3.898 405 2HD1 LEU 965 2HD1 LEU 965 -0.578 1.697 -3.411 406 3HD1 LEU 965 3HD1 LEU 965 -0.774 0.009 -2.882 407 1HD2 LEU 965 1HD2 LEU 965 -2.685 1.965 -4.796 408 2HD2 LEU 965 2HD2 LEU 965 -3.271 0.551 -5.703 409 3HD2 LEU 965 3HD2 LEU 965 -3.153 0.484 -3.928 410 H LEU 966 H LEU 966 -2.844 0.427 -8.441 411 HA LEU 966 HA LEU 966 -4.278 -1.639 -7.237 412 1HB LEU 966 1HB LEU 966 -4.713 0.213 -9.544 413 2HB LEU 966 2HB LEU 966 -5.818 -1.127 -9.308 414 HG LEU 966 HG LEU 966 -5.826 -0.123 -6.803 415 1HD1 LEU 966 1HD1 LEU 966 -4.440 1.723 -6.976 416 2HD1 LEU 966 2HD1 LEU 966 -5.014 2.137 -8.610 417 3HD1 LEU 966 3HD1 LEU 966 -6.057 2.434 -7.198 418 1HD2 LEU 966 1HD2 LEU 966 -7.982 0.026 -7.298 419 2HD2 LEU 966 2HD2 LEU 966 -7.687 1.436 -8.344 420 3HD2 LEU 966 3HD2 LEU 966 -7.574 -0.209 -9.015 421 H ALA 967 H ALA 967 -3.162 -1.366 -10.691 422 HA ALA 967 HA ALA 967 -3.827 -3.904 -11.460 423 1HB ALA 967 1HB ALA 967 -1.614 -3.465 -12.944 424 2HB ALA 967 2HB ALA 967 -3.152 -2.615 -13.232 425 3HB ALA 967 3HB ALA 967 -1.857 -1.822 -12.302 426 H THR 968 H THR 968 -0.605 -2.779 -10.196 427 HA THR 968 HA THR 968 0.674 -5.194 -10.162 428 HB THR 968 HB THR 968 2.052 -4.114 -8.363 429 HG1 THR 968 HG1 THR 968 0.502 -3.077 -7.078 430 1HG2 THR 968 1HG2 THR 968 1.332 -2.838 -10.891 431 2HG2 THR 968 2HG2 THR 968 1.628 -1.599 -9.648 432 3HG2 THR 968 3HG2 THR 968 2.890 -2.795 -10.031 433 H VAL 969 H VAL 969 -1.539 -3.863 -7.635 434 HA VAL 969 HA VAL 969 -1.211 -5.940 -5.829 435 HB VAL 969 HB VAL 969 -3.479 -4.048 -6.433 436 1HG1 VAL 969 1HG1 VAL 969 -3.269 -5.959 -4.081 437 2HG1 VAL 969 2HG1 VAL 969 -4.509 -4.703 -4.311 438 3HG1 VAL 969 3HG1 VAL 969 -4.426 -6.087 -5.427 439 1HG2 VAL 969 1HG2 VAL 969 -1.013 -3.668 -5.213 440 2HG2 VAL 969 2HG2 VAL 969 -2.435 -2.609 -5.070 441 3HG2 VAL 969 3HG2 VAL 969 -2.132 -3.863 -3.843 442 H ASP 970 H ASP 970 -3.326 -5.602 -8.718 443 HA ASP 970 HA ASP 970 -4.986 -7.682 -8.343 444 1HB ASP 970 1HB ASP 970 -4.652 -6.001 -10.353 445 2HB ASP 970 2HB ASP 970 -3.630 -7.255 -11.026 446 H GLU 971 H GLU 971 -1.549 -7.657 -9.411 447 HA GLU 971 HA GLU 971 -1.535 -10.413 -10.056 448 1HB GLU 971 1HB GLU 971 0.592 -8.272 -9.768 449 2HB GLU 971 2HB GLU 971 1.051 -9.949 -9.990 450 1HG GLU 971 1HG GLU 971 -0.771 -9.788 -11.984 451 2HG GLU 971 2HG GLU 971 -0.345 -8.090 -11.903 452 H SER 972 H SER 972 -1.194 -8.497 -7.144 453 HA SER 972 HA SER 972 0.246 -10.550 -5.766 454 1HB SER 972 1HB SER 972 0.357 -7.958 -5.396 455 2HB SER 972 2HB SER 972 -1.116 -8.168 -4.471 456 HG SER 972 HG SER 972 0.718 -8.295 -3.078 457 H LEU 973 H LEU 973 -3.084 -9.501 -6.327 458 HA LEU 973 HA LEU 973 -4.452 -10.378 -4.184 459 1HB LEU 973 1HB LEU 973 -4.999 -9.709 -6.840 460 2HB LEU 973 2HB LEU 973 -5.706 -11.299 -6.631 461 HG LEU 973 HG LEU 973 -6.527 -8.694 -5.528 462 1HD1 LEU 973 1HD1 LEU 973 -8.504 -9.332 -6.329 463 2HD1 LEU 973 2HD1 LEU 973 -7.653 -10.719 -7.049 464 3HD1 LEU 973 3HD1 LEU 973 -8.446 -10.887 -5.465 465 1HD2 LEU 973 1HD2 LEU 973 -5.980 -9.379 -3.399 466 2HD2 LEU 973 2HD2 LEU 973 -7.643 -9.995 -3.550 467 3HD2 LEU 973 3HD2 LEU 973 -6.262 -11.100 -3.758 468 HA PRO 974 HA PRO 974 -4.068 -14.844 -5.677 469 1HB PRO 974 1HB PRO 974 -2.372 -15.472 -7.727 470 2HB PRO 974 2HB PRO 974 -4.088 -15.199 -7.952 471 1HG PRO 974 1HG PRO 974 -1.824 -13.424 -8.632 472 2HG PRO 974 2HG PRO 974 -3.474 -13.371 -9.218 473 1HD PRO 974 1HD PRO 974 -2.296 -11.649 -7.249 474 2HD PRO 974 2HD PRO 974 -3.975 -11.673 -7.752 475 H VAL 975 H VAL 975 -1.124 -12.988 -5.867 476 HA VAL 975 HA VAL 975 0.695 -14.854 -5.097 477 HB VAL 975 HB VAL 975 0.382 -11.928 -4.463 478 1HG1 VAL 975 1HG1 VAL 975 2.606 -11.847 -3.558 479 2HG1 VAL 975 2HG1 VAL 975 1.689 -13.070 -2.645 480 3HG1 VAL 975 3HG1 VAL 975 2.862 -13.578 -3.884 481 1HG2 VAL 975 1HG2 VAL 975 1.898 -11.558 -6.210 482 2HG2 VAL 975 2HG2 VAL 975 2.487 -13.238 -6.185 483 3HG2 VAL 975 3HG2 VAL 975 0.865 -12.873 -6.820 484 H LEU 976 H LEU 976 -1.928 -13.394 -3.207 485 HA LEU 976 HA LEU 976 -0.939 -14.857 -0.860 486 1HB LEU 976 1HB LEU 976 -2.861 -12.529 -0.936 487 2HB LEU 976 2HB LEU 976 -2.210 -13.312 0.490 488 HG LEU 976 HG LEU 976 -1.018 -11.297 0.261 489 1HD1 LEU 976 1HD1 LEU 976 0.395 -13.222 0.804 490 2HD1 LEU 976 2HD1 LEU 976 0.735 -13.466 -0.926 491 3HD1 LEU 976 3HD1 LEU 976 1.293 -11.987 -0.109 492 1HD2 LEU 976 1HD2 LEU 976 -1.722 -10.936 -2.138 493 2HD2 LEU 976 2HD2 LEU 976 -0.071 -10.414 -1.724 494 3HD2 LEU 976 3HD2 LEU 976 -0.327 -11.935 -2.613 495 HA PRO 977 HA PRO 977 -4.436 -17.374 -1.084 496 1HB PRO 977 1HB PRO 977 -4.902 -18.004 1.535 497 2HB PRO 977 2HB PRO 977 -3.652 -18.769 0.573 498 1HG PRO 977 1HG PRO 977 -3.372 -16.722 2.687 499 2HG PRO 977 2HG PRO 977 -2.151 -17.790 2.025 500 1HD PRO 977 1HD PRO 977 -2.488 -15.002 1.445 501 2HD PRO 977 2HD PRO 977 -1.343 -16.097 0.697 502 H ALA 978 H ALA 978 -6.746 -17.813 -0.378 503 HA ALA 978 HA ALA 978 -8.067 -15.300 -0.558 504 1HB ALA 978 1HB ALA 978 -10.101 -16.895 -0.224 505 2HB ALA 978 2HB ALA 978 -9.109 -17.077 -1.691 506 3HB ALA 978 3HB ALA 978 -8.894 -18.200 -0.327 507 H SER 979 H SER 979 -6.621 -14.778 1.577 508 HA SER 979 HA SER 979 -8.461 -15.246 3.792 509 1HB SER 979 1HB SER 979 -6.127 -16.388 3.891 510 2HB SER 979 2HB SER 979 -5.476 -14.777 4.127 511 HG SER 979 HG SER 979 -7.245 -14.697 5.924 512 H THR 980 H THR 980 -6.387 -13.047 1.928 513 HA THR 980 HA THR 980 -7.402 -10.808 3.556 514 HB THR 980 HB THR 980 -5.027 -10.882 3.869 515 HG1 THR 980 HG1 THR 980 -5.563 -8.779 3.165 516 1HG2 THR 980 1HG2 THR 980 -3.417 -11.180 2.043 517 2HG2 THR 980 2HG2 THR 980 -4.555 -12.548 1.991 518 3HG2 THR 980 3HG2 THR 980 -4.728 -11.202 0.838 519 H HIS 981 H HIS 981 -8.434 -12.388 1.066 520 HA HIS 981 HA HIS 981 -8.227 -10.884 -1.185 521 1HB HIS 981 1HB HIS 981 -10.251 -12.723 -0.036 522 2HB HIS 981 2HB HIS 981 -10.817 -11.682 -1.327 523 HD1 HIS 981 HD1 HIS 981 -11.023 -13.531 -3.095 524 HD2 HIS 981 HD2 HIS 981 -7.185 -13.233 -1.429 525 HE1 HIS 981 HE1 HIS 981 -9.506 -15.001 -4.526 526 H ARG 982 H ARG 982 -11.467 -10.691 0.246 527 HA ARG 982 HA ARG 982 -12.106 -8.289 -0.556 528 1HB ARG 982 1HB ARG 982 -13.287 -8.151 1.907 529 2HB ARG 982 2HB ARG 982 -13.874 -9.189 0.623 530 1HG ARG 982 1HG ARG 982 -12.930 -11.132 1.564 531 2HG ARG 982 2HG ARG 982 -11.700 -10.242 2.440 532 1HD ARG 982 1HD ARG 982 -13.222 -9.554 4.141 533 2HD ARG 982 2HD ARG 982 -14.629 -9.846 3.138 534 HE ARG 982 HE ARG 982 -13.293 -12.335 3.439 535 1HH1 ARG 982 2HH2 ARG 982 -14.992 -9.997 5.445 536 2HH1 ARG 982 1HH2 ARG 982 -15.519 -11.177 6.598 537 1HH2 ARG 982 2HH1 ARG 982 -13.988 -13.893 4.959 538 2HH2 ARG 982 1HH1 ARG 982 -14.944 -13.409 6.320 539 H GLU 983 H GLU 983 -10.203 -8.999 2.440 540 HA GLU 983 HA GLU 983 -10.091 -6.500 3.485 541 1HB GLU 983 1HB GLU 983 -8.506 -8.975 3.657 542 2HB GLU 983 2HB GLU 983 -7.530 -7.548 3.945 543 1HG GLU 983 1HG GLU 983 -8.611 -7.032 5.914 544 2HG GLU 983 2HG GLU 983 -10.181 -7.514 5.304 545 H ILE 984 H ILE 984 -7.789 -7.991 1.098 546 HA ILE 984 HA ILE 984 -6.198 -5.725 0.809 547 HB ILE 984 HB ILE 984 -6.620 -8.289 -0.571 548 1HG1 ILE 984 1HG1 ILE 984 -3.984 -6.910 -0.231 549 2HG1 ILE 984 2HG1 ILE 984 -4.831 -7.447 1.206 550 1HG2 ILE 984 1HG2 ILE 984 -5.806 -5.823 -2.055 551 2HG2 ILE 984 2HG2 ILE 984 -4.983 -7.359 -2.416 552 3HG2 ILE 984 3HG2 ILE 984 -6.749 -7.232 -2.598 553 1HD1 ILE 984 1HD1 ILE 984 -3.803 -9.447 0.782 554 2HD1 ILE 984 2HD1 ILE 984 -5.111 -9.666 -0.405 555 3HD1 ILE 984 3HD1 ILE 984 -3.526 -9.048 -0.930 556 H GLU 985 H GLU 985 -9.283 -6.719 -0.704 557 HA GLU 985 HA GLU 985 -9.218 -4.800 -2.723 558 1HB GLU 985 1HB GLU 985 -10.841 -6.926 -2.073 559 2HB GLU 985 2HB GLU 985 -11.885 -5.582 -1.654 560 1HG GLU 985 1HG GLU 985 -10.443 -5.342 -4.269 561 2HG GLU 985 2HG GLU 985 -11.666 -6.594 -4.187 562 H MET 986 H MET 986 -10.490 -4.799 0.649 563 HA MET 986 HA MET 986 -11.647 -2.234 0.364 564 1HB MET 986 1HB MET 986 -11.134 -4.236 2.570 565 2HB MET 986 2HB MET 986 -11.438 -2.584 3.067 566 1HG MET 986 1HG MET 986 -13.664 -2.885 2.748 567 2HG MET 986 2HG MET 986 -13.387 -3.218 1.050 568 1HE MET 986 1HE MET 986 -15.341 -6.067 1.049 569 2HE MET 986 2HE MET 986 -14.591 -4.645 0.286 570 3HE MET 986 3HE MET 986 -13.793 -6.233 0.186 571 H ALA 987 H ALA 987 -8.457 -3.501 1.181 572 HA ALA 987 HA ALA 987 -7.573 -1.149 2.534 573 1HB ALA 987 1HB ALA 987 -6.449 -3.119 3.142 574 2HB ALA 987 2HB ALA 987 -6.306 -3.674 1.457 575 3HB ALA 987 3HB ALA 987 -5.296 -2.329 2.040 576 H GLN 988 H GLN 988 -8.032 -2.144 -0.786 577 HA GLN 988 HA GLN 988 -6.050 -0.403 -1.829 578 1HB GLN 988 1HB GLN 988 -8.284 -2.070 -3.013 579 2HB GLN 988 2HB GLN 988 -7.435 -0.910 -4.015 580 1HG GLN 988 1HG GLN 988 -5.464 -2.392 -2.510 581 2HG GLN 988 2HG GLN 988 -6.577 -3.545 -3.218 582 1HE2 GLN 988 1HE2 GLN 988 -7.064 -3.342 -5.514 583 2HE2 GLN 988 2HE2 GLN 988 -5.835 -2.807 -6.611 584 H LYS 989 H LYS 989 -9.658 -0.366 -1.512 585 HA LYS 989 HA LYS 989 -9.966 2.143 -2.753 586 1HB LYS 989 1HB LYS 989 -11.766 0.494 -2.595 587 2HB LYS 989 2HB LYS 989 -11.771 0.623 -0.848 588 1HG LYS 989 1HG LYS 989 -11.972 3.297 -1.855 589 2HG LYS 989 2HG LYS 989 -13.084 2.329 -2.801 590 1HD LYS 989 1HD LYS 989 -13.627 1.353 -0.295 591 2HD LYS 989 2HD LYS 989 -13.148 2.988 0.117 592 1HE LYS 989 1HE LYS 989 -15.137 2.493 -2.126 593 2HE LYS 989 2HE LYS 989 -15.671 2.508 -0.458 594 1HZ LYS 989 1HZ LYS 989 -14.142 4.707 -0.628 595 2HZ LYS 989 2HZ LYS 989 -14.856 4.680 -2.097 596 3HZ LYS 989 3HZ LYS 989 -15.771 4.686 -0.745 597 H LEU 990 H LEU 990 -9.203 1.072 0.556 598 HA LEU 990 HA LEU 990 -9.824 3.411 1.904 599 1HB LEU 990 1HB LEU 990 -8.906 0.971 2.578 600 2HB LEU 990 2HB LEU 990 -7.422 1.890 2.737 601 HG LEU 990 HG LEU 990 -10.025 2.560 4.137 602 1HD1 LEU 990 1HD1 LEU 990 -9.183 0.465 4.985 603 2HD1 LEU 990 2HD1 LEU 990 -7.550 1.150 5.169 604 3HD1 LEU 990 3HD1 LEU 990 -8.885 1.748 6.183 605 1HD2 LEU 990 1HD2 LEU 990 -8.011 4.289 3.570 606 2HD2 LEU 990 2HD2 LEU 990 -9.071 4.406 4.995 607 3HD2 LEU 990 3HD2 LEU 990 -7.468 3.646 5.138 608 H LEU 991 H LEU 991 -6.525 2.369 0.775 609 HA LEU 991 HA LEU 991 -5.216 4.691 1.249 610 1HB LEU 991 1HB LEU 991 -3.793 3.085 0.588 611 2HB LEU 991 2HB LEU 991 -4.905 2.409 -0.586 612 HG LEU 991 HG LEU 991 -4.362 4.259 -2.148 613 1HD1 LEU 991 1HD1 LEU 991 -2.145 5.490 -1.534 614 2HD1 LEU 991 2HD1 LEU 991 -3.700 6.090 -0.910 615 3HD1 LEU 991 3HD1 LEU 991 -2.629 5.133 0.141 616 1HD2 LEU 991 1HD2 LEU 991 -3.142 2.454 -2.774 617 2HD2 LEU 991 2HD2 LEU 991 -1.796 3.520 -2.305 618 3HD2 LEU 991 3HD2 LEU 991 -2.376 2.270 -1.178 619 H ASN 992 H ASN 992 -7.165 3.848 -1.682 620 HA ASN 992 HA ASN 992 -6.632 6.114 -3.101 621 1HB ASN 992 1HB ASN 992 -8.395 3.901 -3.291 622 2HB ASN 992 2HB ASN 992 -9.457 5.294 -3.321 623 1HD2 ASN 992 1HD2 ASN 992 -10.001 5.653 -5.334 624 2HD2 ASN 992 2HD2 ASN 992 -8.943 5.763 -6.701 625 H SER 993 H SER 993 -9.486 5.391 -0.939 626 HA SER 993 HA SER 993 -10.833 7.657 -1.052 627 1HB SER 993 1HB SER 993 -10.838 5.489 0.622 628 2HB SER 993 2HB SER 993 -10.334 6.736 1.745 629 HG SER 993 HG SER 993 -12.829 6.251 0.718 630 H ASP 994 H ASP 994 -8.212 7.123 1.429 631 HA ASP 994 HA ASP 994 -8.132 9.637 2.399 632 1HB ASP 994 1HB ASP 994 -6.079 7.458 2.038 633 2HB ASP 994 2HB ASP 994 -5.505 9.027 2.567 634 H LEU 995 H LEU 995 -6.047 8.218 -0.242 635 HA LEU 995 HA LEU 995 -4.614 10.423 -0.918 636 1HB LEU 995 1HB LEU 995 -4.969 7.880 -1.887 637 2HB LEU 995 2HB LEU 995 -5.554 8.861 -3.216 638 HG LEU 995 HG LEU 995 -2.946 9.662 -2.025 639 1HD1 LEU 995 1HD1 LEU 995 -2.349 7.702 -3.995 640 2HD1 LEU 995 2HD1 LEU 995 -1.896 7.727 -2.274 641 3HD1 LEU 995 3HD1 LEU 995 -3.414 6.948 -2.784 642 1HD2 LEU 995 1HD2 LEU 995 -4.450 10.139 -4.414 643 2HD2 LEU 995 2HD2 LEU 995 -2.938 10.899 -3.863 644 3HD2 LEU 995 3HD2 LEU 995 -2.881 9.418 -4.849 645 H ALA 996 H ALA 996 -7.851 9.465 -2.257 646 HA ALA 996 HA ALA 996 -8.231 11.539 -3.970 647 1HB ALA 996 1HB ALA 996 -10.406 10.808 -4.020 648 2HB ALA 996 2HB ALA 996 -9.699 9.443 -3.124 649 3HB ALA 996 3HB ALA 996 -10.540 10.743 -2.247 650 H GLU 997 H GLU 997 -8.454 11.514 -0.395 651 HA GLU 997 HA GLU 997 -9.599 14.092 -0.283 652 1HB GLU 997 1HB GLU 997 -9.633 12.163 1.484 653 2HB GLU 997 2HB GLU 997 -8.064 12.769 1.975 654 1HG GLU 997 1HG GLU 997 -9.691 13.868 3.377 655 2HG GLU 997 2HG GLU 997 -9.116 15.075 2.243 656 H LEU 998 H LEU 998 -6.316 12.751 -0.425 657 HA LEU 998 HA LEU 998 -5.050 15.153 0.455 658 1HB LEU 998 1HB LEU 998 -4.250 12.677 0.522 659 2HB LEU 998 2HB LEU 998 -3.719 12.977 -1.121 660 HG LEU 998 HG LEU 998 -2.877 14.942 0.960 661 1HD1 LEU 998 1HD1 LEU 998 -1.745 13.548 2.260 662 2HD1 LEU 998 2HD1 LEU 998 -2.507 12.183 1.408 663 3HD1 LEU 998 3HD1 LEU 998 -0.940 12.817 0.851 664 1HD2 LEU 998 1HD2 LEU 998 -1.953 15.581 -1.009 665 2HD2 LEU 998 2HD2 LEU 998 -0.688 14.439 -0.495 666 3HD2 LEU 998 3HD2 LEU 998 -1.925 13.927 -1.668 667 H ILE 999 H ILE 999 -5.934 13.643 -2.683 668 HA ILE 999 HA ILE 999 -4.511 15.317 -4.349 669 HB ILE 999 HB ILE 999 -7.182 13.963 -4.721 670 1HG1 ILE 999 1HG1 ILE 999 -5.422 12.389 -4.223 671 2HG1 ILE 999 2HG1 ILE 999 -5.850 12.266 -5.918 672 1HG2 ILE 999 1HG2 ILE 999 -6.048 14.218 -7.220 673 2HG2 ILE 999 2HG2 ILE 999 -7.383 15.199 -6.568 674 3HG2 ILE 999 3HG2 ILE 999 -5.708 15.793 -6.465 675 1HD1 ILE 999 1HD1 ILE 999 -3.876 14.123 -6.124 676 2HD1 ILE 999 2HD1 ILE 999 -3.327 13.272 -4.660 677 3HD1 ILE 999 3HD1 ILE 999 -3.562 12.372 -6.178 678 H ASN1000 H ASN1000 -7.760 15.756 -2.833 679 HA ASN1000 HA ASN1000 -8.359 18.107 -4.135 680 1HB ASN1000 1HB ASN1000 -9.874 16.630 -2.642 681 2HB ASN1000 2HB ASN1000 -9.139 17.415 -1.258 682 1HD2 ASN1000 1HD2 ASN1000 -10.456 18.842 -0.440 683 2HD2 ASN1000 2HD2 ASN1000 -11.418 20.001 -1.295 684 H LYS1001 H LYS1001 -6.989 17.507 -0.805 685 HA LYS1001 HA LYS1001 -6.638 20.029 0.066 686 1HB LYS1001 1HB LYS1001 -4.811 17.633 0.384 687 2HB LYS1001 2HB LYS1001 -4.630 19.117 1.298 688 1HG LYS1001 1HG LYS1001 -7.315 17.703 1.215 689 2HG LYS1001 2HG LYS1001 -6.062 17.144 2.306 690 1HD LYS1001 1HD LYS1001 -6.501 18.829 3.759 691 2HD LYS1001 2HD LYS1001 -6.236 20.030 2.510 692 1HE LYS1001 1HE LYS1001 -8.459 20.486 2.587 693 2HE LYS1001 2HE LYS1001 -8.746 18.920 1.855 694 1HZ LYS1001 1HZ LYS1001 -8.727 19.587 4.704 695 2HZ LYS1001 2HZ LYS1001 -9.933 18.920 3.829 696 3HZ LYS1001 3HZ LYS1001 -8.607 18.040 4.192 697 H MET1002 H MET1002 -4.488 18.226 -2.212 698 HA MET1002 HA MET1002 -2.604 20.262 -2.397 699 1HB MET1002 1HB MET1002 -2.005 18.050 -3.155 700 2HB MET1002 2HB MET1002 -3.439 17.911 -4.153 701 1HG MET1002 1HG MET1002 -1.849 20.230 -4.975 702 2HG MET1002 2HG MET1002 -0.861 18.782 -4.974 703 1HE MET1002 1HE MET1002 -1.924 20.821 -7.025 704 2HE MET1002 2HE MET1002 -2.512 19.976 -8.477 705 3HE MET1002 3HE MET1002 -3.673 20.629 -7.295 706 H LYS1003 H LYS1003 -5.669 19.611 -4.131 707 HA LYS1003 HA LYS1003 -5.241 21.449 -6.213 708 1HB LYS1003 1HB LYS1003 -7.368 19.713 -5.241 709 2HB LYS1003 2HB LYS1003 -8.003 21.247 -5.800 710 1HG LYS1003 1HG LYS1003 -6.354 20.846 -7.857 711 2HG LYS1003 2HG LYS1003 -6.429 19.173 -7.343 712 1HD LYS1003 1HD LYS1003 -8.198 19.358 -8.916 713 2HD LYS1003 2HD LYS1003 -9.011 19.440 -7.366 714 1HE LYS1003 1HE LYS1003 -9.753 21.557 -7.761 715 2HE LYS1003 2HE LYS1003 -8.155 22.110 -8.222 716 1HZ LYS1003 1HZ LYS1003 -9.676 20.446 -10.067 717 2HZ LYS1003 2HZ LYS1003 -10.017 22.040 -9.954 718 3HZ LYS1003 3HZ LYS1003 -8.521 21.554 -10.394 719 H LEU1004 H LEU1004 -5.971 21.803 -2.817 720 HA LEU1004 HA LEU1004 -7.092 24.445 -3.183 721 1HB LEU1004 1HB LEU1004 -6.370 23.063 -0.604 722 2HB LEU1004 2HB LEU1004 -7.451 24.424 -0.831 723 HG LEU1004 HG LEU1004 -7.944 21.600 -1.818 724 1HD1 LEU1004 1HD1 LEU1004 -9.095 23.127 0.532 725 2HD1 LEU1004 2HD1 LEU1004 -9.739 21.588 -0.091 726 3HD1 LEU1004 3HD1 LEU1004 -8.091 21.658 0.579 727 1HD2 LEU1004 1HD2 LEU1004 -8.982 23.168 -3.319 728 2HD2 LEU1004 2HD2 LEU1004 -10.238 22.426 -2.300 729 3HD2 LEU1004 3HD2 LEU1004 -9.678 24.080 -1.958 730 H ALA1005 H ALA1005 -4.105 22.873 -1.890 731 HA ALA1005 HA ALA1005 -2.854 25.224 -1.079 732 1HB ALA1005 1HB ALA1005 -1.565 23.555 -0.289 733 2HB ALA1005 2HB ALA1005 -2.221 22.401 -1.474 734 3HB ALA1005 3HB ALA1005 -0.849 23.446 -1.915 735 H GLN1006 H GLN1006 -3.718 24.100 -4.223 736 HA GLN1006 HA GLN1006 -1.536 25.218 -5.608 737 1HB GLN1006 1HB GLN1006 -3.792 23.613 -6.222 738 2HB GLN1006 2HB GLN1006 -3.989 25.063 -7.187 739 1HG GLN1006 1HG GLN1006 -1.254 23.791 -7.099 740 2HG GLN1006 2HG GLN1006 -2.499 22.989 -8.037 741 1HE2 GLN1006 1HE2 GLN1006 -3.957 24.844 -9.175 742 2HE2 GLN1006 2HE2 GLN1006 -3.045 25.902 -10.200 743 H GLN1007 H GLN1007 -4.651 26.412 -4.379 744 HA GLN1007 HA GLN1007 -4.118 28.943 -5.717 745 1HB GLN1007 1HB GLN1007 -6.361 27.719 -6.052 746 2HB GLN1007 2HB GLN1007 -6.722 28.109 -4.382 747 1HG GLN1007 1HG GLN1007 -5.750 30.491 -5.755 748 2HG GLN1007 2HG GLN1007 -7.066 29.781 -6.668 749 1HE2 GLN1007 1HE2 GLN1007 -9.059 30.210 -6.086 750 2HE2 GLN1007 2HE2 GLN1007 -9.585 30.866 -4.572 751 H TYR1008 H TYR1008 -4.236 27.262 -2.649 752 HA TYR1008 HA TYR1008 -4.480 29.691 -1.101 753 1HB TYR1008 1HB TYR1008 -4.238 26.683 -0.756 754 2HB TYR1008 2HB TYR1008 -3.735 27.661 0.608 755 HD1 TYR1008 HD1 TYR1008 -6.501 26.133 -1.039 756 HD2 TYR1008 HD2 TYR1008 -5.450 29.419 1.490 757 HE1 TYR1008 HE1 TYR1008 -8.919 26.333 -0.283 758 HE2 TYR1008 HE2 TYR1008 -7.872 29.608 2.238 759 HH TYR1008 HH TYR1008 -10.346 27.429 0.906 760 H VAL1009 H VAL1009 -2.050 28.539 -2.993 761 HA VAL1009 HA VAL1009 0.101 28.682 -1.096 762 HB VAL1009 HB VAL1009 0.409 27.166 -2.843 763 1HG1 VAL1009 1HG1 VAL1009 -0.687 29.342 -4.609 764 2HG1 VAL1009 2HG1 VAL1009 0.340 28.064 -5.301 765 3HG1 VAL1009 3HG1 VAL1009 -1.176 27.636 -4.472 766 1HG2 VAL1009 1HG2 VAL1009 1.939 29.650 -3.688 767 2HG2 VAL1009 2HG2 VAL1009 2.400 28.559 -2.359 768 3HG2 VAL1009 3HG2 VAL1009 2.378 27.961 -4.035 769 H MET1010 H MET1010 -1.432 30.766 -3.594 770 HA MET1010 HA MET1010 0.431 32.732 -3.724 771 1HB MET1010 1HB MET1010 -1.721 34.226 -4.083 772 2HB MET1010 2HB MET1010 -1.437 32.902 -5.195 773 1HG MET1010 1HG MET1010 -3.406 31.941 -4.599 774 2HG MET1010 2HG MET1010 -2.881 31.842 -2.930 775 1HE MET1010 1HE MET1010 -6.086 33.181 -2.073 776 2HE MET1010 2HE MET1010 -4.799 31.955 -1.985 777 3HE MET1010 3HE MET1010 -4.670 33.452 -1.031 778 H THR1011 H THR1011 -1.513 31.802 -0.992 779 HA THR1011 HA THR1011 -0.806 34.325 0.359 780 HB THR1011 HB THR1011 -3.221 34.138 0.185 781 HG1 THR1011 HG1 THR1011 -3.586 34.008 2.475 782 1HG2 THR1011 1HG2 THR1011 -3.703 31.848 -0.329 783 2HG2 THR1011 2HG2 THR1011 -2.711 31.253 1.024 784 3HG2 THR1011 3HG2 THR1011 -4.277 32.036 1.345 785 H SER1012 H SER1012 -0.998 33.738 2.954 786 HA SER1012 HA SER1012 1.198 31.903 3.233 787 1HB SER1012 1HB SER1012 0.533 34.322 4.443 788 2HB SER1012 2HB SER1012 0.116 33.159 5.686 789 HG SER1012 HG SER1012 2.660 33.762 4.544 790 H LEU1013 H LEU1013 -1.782 31.159 2.703 791 HA LEU1013 HA LEU1013 -2.539 29.826 5.135 792 1HB LEU1013 1HB LEU1013 -3.818 30.748 2.801 793 2HB LEU1013 2HB LEU1013 -4.004 29.005 2.794 794 HG LEU1013 HG LEU1013 -5.828 30.431 3.906 795 1HD1 LEU1013 1HD1 LEU1013 -4.881 27.833 4.378 796 2HD1 LEU1013 2HD1 LEU1013 -5.230 28.516 5.984 797 3HD1 LEU1013 3HD1 LEU1013 -6.498 28.485 4.735 798 1HD2 LEU1013 1HD2 LEU1013 -3.814 31.580 5.282 799 2HD2 LEU1013 2HD2 LEU1013 -5.495 31.507 5.862 800 3HD2 LEU1013 3HD2 LEU1013 -4.300 30.321 6.443 801 H GLN1014 H GLN1014 -0.893 29.088 2.064 802 HA GLN1014 HA GLN1014 -1.103 26.489 1.777 803 1HB GLN1014 1HB GLN1014 1.589 26.651 1.451 804 2HB GLN1014 2HB GLN1014 0.443 27.294 0.292 805 1HG GLN1014 1HG GLN1014 0.903 29.487 0.838 806 2HG GLN1014 2HG GLN1014 1.088 29.138 2.545 807 1HE2 GLN1014 1HE2 GLN1014 2.890 30.682 2.157 808 2HE2 GLN1014 2HE2 GLN1014 4.443 30.048 1.724 809 H GLN1015 H GLN1015 1.502 27.848 3.934 810 HA GLN1015 HA GLN1015 2.466 25.689 5.034 811 1HB GLN1015 1HB GLN1015 2.559 27.024 7.256 812 2HB GLN1015 2HB GLN1015 3.293 27.749 5.840 813 1HG GLN1015 1HG GLN1015 0.997 28.915 5.452 814 2HG GLN1015 2HG GLN1015 0.594 28.414 7.083 815 1HE2 GLN1015 1HE2 GLN1015 0.770 30.044 8.408 816 2HE2 GLN1015 2HE2 GLN1015 2.051 31.208 8.482 817 H GLU1016 H GLU1016 -0.792 27.017 5.729 818 HA GLU1016 HA GLU1016 -1.306 25.300 7.876 819 1HB GLU1016 1HB GLU1016 -2.517 27.474 7.262 820 2HB GLU1016 2HB GLU1016 -3.362 26.569 6.022 821 1HG GLU1016 1HG GLU1016 -4.843 25.823 7.565 822 2HG GLU1016 2HG GLU1016 -3.547 25.024 8.432 823 H TYR1017 H TYR1017 -2.748 25.274 4.530 824 HA TYR1017 HA TYR1017 -3.865 22.760 4.711 825 1HB TYR1017 1HB TYR1017 -2.846 24.694 2.613 826 2HB TYR1017 2HB TYR1017 -3.158 23.065 2.045 827 HD1 TYR1017 HD1 TYR1017 -4.600 26.245 2.760 828 HD2 TYR1017 HD2 TYR1017 -5.515 22.071 2.553 829 HE1 TYR1017 HE1 TYR1017 -7.072 26.791 2.527 830 HE2 TYR1017 HE2 TYR1017 -7.984 22.631 2.321 831 HH TYR1017 HH TYR1017 -9.196 25.042 1.326 832 H LYS1018 H LYS1018 -0.503 23.675 4.464 833 HA LYS1018 HA LYS1018 0.425 21.375 3.125 834 1HB LYS1018 1HB LYS1018 1.501 23.783 4.228 835 2HB LYS1018 2HB LYS1018 2.417 22.440 4.879 836 1HG LYS1018 1HG LYS1018 3.546 22.841 2.859 837 2HG LYS1018 2HG LYS1018 2.450 21.554 2.398 838 1HD LYS1018 1HD LYS1018 0.986 23.025 1.247 839 2HD LYS1018 2HD LYS1018 1.557 24.436 2.116 840 1HE LYS1018 1HE LYS1018 3.465 24.668 0.786 841 2HE LYS1018 2HE LYS1018 3.576 22.953 0.447 842 1HZ LYS1018 1HZ LYS1018 2.834 23.983 -1.493 843 2HZ LYS1018 2HZ LYS1018 1.504 23.261 -0.880 844 3HZ LYS1018 3HZ LYS1018 1.701 24.875 -0.726 845 H LYS1019 H LYS1019 0.100 22.262 6.621 846 HA LYS1019 HA LYS1019 1.147 19.838 7.565 847 1HB LYS1019 1HB LYS1019 -0.707 21.852 8.870 848 2HB LYS1019 2HB LYS1019 0.086 20.536 9.711 849 1HG LYS1019 1HG LYS1019 1.474 22.811 8.218 850 2HG LYS1019 2HG LYS1019 1.392 22.618 9.957 851 1HD LYS1019 1HD LYS1019 3.333 21.448 9.829 852 2HD LYS1019 2HD LYS1019 2.422 20.154 9.076 853 1HE LYS1019 1HE LYS1019 3.337 20.555 7.023 854 2HE LYS1019 2HE LYS1019 3.068 22.283 7.146 855 1HZ LYS1019 1HZ LYS1019 5.184 21.042 8.722 856 2HZ LYS1019 2HZ LYS1019 5.442 21.380 7.145 857 3HZ LYS1019 3HZ LYS1019 5.069 22.581 8.187 858 H GLN1020 H GLN1020 -1.964 20.760 6.208 859 HA GLN1020 HA GLN1020 -3.444 18.708 7.406 860 1HB GLN1020 1HB GLN1020 -3.938 20.183 4.781 861 2HB GLN1020 2HB GLN1020 -5.128 19.231 5.647 862 1HG GLN1020 1HG GLN1020 -3.684 21.527 7.020 863 2HG GLN1020 2HG GLN1020 -5.085 21.830 6.013 864 1HE2 GLN1020 1HE2 GLN1020 -4.076 21.301 9.075 865 2HE2 GLN1020 2HE2 GLN1020 -5.517 20.687 9.815 866 H MET1021 H MET1021 -2.104 19.057 4.036 867 HA MET1021 HA MET1021 -2.786 16.581 3.151 868 1HB MET1021 1HB MET1021 -0.953 16.926 1.490 869 2HB MET1021 2HB MET1021 -1.816 18.427 1.760 870 1HG MET1021 1HG MET1021 -0.027 19.430 2.855 871 2HG MET1021 2HG MET1021 0.527 17.927 3.565 872 1HE MET1021 1HE MET1021 3.048 16.528 1.263 873 2HE MET1021 2HE MET1021 2.365 16.706 2.897 874 3HE MET1021 3HE MET1021 1.447 15.846 1.638 875 H LEU1022 H LEU1022 -0.326 17.481 5.491 876 HA LEU1022 HA LEU1022 1.293 15.174 5.158 877 1HB LEU1022 1HB LEU1022 1.726 17.530 6.261 878 2HB LEU1022 2HB LEU1022 1.153 16.724 7.708 879 HG LEU1022 HG LEU1022 3.181 15.172 6.260 880 1HD1 LEU1022 1HD1 LEU1022 5.083 16.579 6.793 881 2HD1 LEU1022 2HD1 LEU1022 3.971 17.440 5.702 882 3HD1 LEU1022 3HD1 LEU1022 4.005 17.841 7.436 883 1HD2 LEU1022 1HD2 LEU1022 2.147 15.137 8.750 884 2HD2 LEU1022 2HD2 LEU1022 3.745 14.475 8.331 885 3HD2 LEU1022 3HD2 LEU1022 3.614 16.103 9.039 886 H THR1023 H THR1023 -1.421 16.111 7.349 887 HA THR1023 HA THR1023 -1.402 13.929 9.016 888 HB THR1023 HB THR1023 -3.954 15.173 7.915 889 HG1 THR1023 HG1 THR1023 -1.866 16.231 9.690 890 1HG2 THR1023 1HG2 THR1023 -4.099 13.559 9.850 891 2HG2 THR1023 2HG2 THR1023 -2.952 14.580 10.750 892 3HG2 THR1023 3HG2 THR1023 -4.559 15.213 10.319 893 H ALA1024 H ALA1024 -2.842 14.205 5.722 894 HA ALA1024 HA ALA1024 -3.854 11.536 5.838 895 1HB ALA1024 1HB ALA1024 -4.116 13.871 4.197 896 2HB ALA1024 2HB ALA1024 -3.614 12.519 3.154 897 3HB ALA1024 3HB ALA1024 -5.079 12.375 4.154 898 H ALA1025 H ALA1025 -1.048 13.215 4.282 899 HA ALA1025 HA ALA1025 -0.040 11.038 2.916 900 1HB ALA1025 1HB ALA1025 2.104 12.303 3.016 901 2HB ALA1025 2HB ALA1025 0.722 13.341 2.592 902 3HB ALA1025 3HB ALA1025 1.389 13.378 4.241 903 H HIS1026 H HIS1026 0.005 11.855 6.369 904 HA HIS1026 HA HIS1026 2.101 10.064 7.016 905 1HB HIS1026 1HB HIS1026 1.028 12.138 8.289 906 2HB HIS1026 2HB HIS1026 0.031 10.891 9.012 907 HD1 HIS1026 HD1 HIS1026 3.025 12.663 9.675 908 HD2 HIS1026 HD2 HIS1026 1.921 8.629 9.991 909 HE1 HIS1026 HE1 HIS1026 4.677 11.595 11.300 910 H ALA1027 H ALA1027 -1.510 9.943 7.428 911 HA ALA1027 HA ALA1027 -1.525 7.287 8.329 912 1HB ALA1027 1HB ALA1027 -3.357 9.412 7.892 913 2HB ALA1027 2HB ALA1027 -3.960 8.026 6.952 914 3HB ALA1027 3HB ALA1027 -3.667 7.856 8.699 915 H LEU1028 H LEU1028 -1.567 8.805 5.090 916 HA LEU1028 HA LEU1028 -2.408 6.635 3.608 917 1HB LEU1028 1HB LEU1028 -0.735 9.050 3.101 918 2HB LEU1028 2HB LEU1028 -0.748 7.786 1.888 919 HG LEU1028 HG LEU1028 -3.059 9.462 2.867 920 1HD1 LEU1028 1HD1 LEU1028 -1.651 10.415 1.103 921 2HD1 LEU1028 2HD1 LEU1028 -1.926 8.971 0.099 922 3HD1 LEU1028 3HD1 LEU1028 -3.287 10.044 0.508 923 1HD2 LEU1028 1HD2 LEU1028 -4.134 7.414 2.813 924 2HD2 LEU1028 2HD2 LEU1028 -4.385 8.019 1.158 925 3HD2 LEU1028 3HD2 LEU1028 -3.130 6.799 1.479 926 H ALA1029 H ALA1029 1.046 7.653 4.137 927 HA ALA1029 HA ALA1029 2.325 5.566 3.072 928 1HB ALA1029 1HB ALA1029 2.801 7.398 5.363 929 2HB ALA1029 2HB ALA1029 3.804 5.928 5.339 930 3HB ALA1029 3HB ALA1029 3.823 7.041 3.950 931 H VAL1030 H VAL1030 0.737 5.626 6.320 932 HA VAL1030 HA VAL1030 1.522 2.986 6.964 933 HB VAL1030 HB VAL1030 -0.336 5.058 8.035 934 1HG1 VAL1030 1HG1 VAL1030 -1.829 3.313 8.375 935 2HG1 VAL1030 2HG1 VAL1030 -0.537 2.107 8.588 936 3HG1 VAL1030 3HG1 VAL1030 -0.876 3.284 9.879 937 1HG2 VAL1030 1HG2 VAL1030 1.548 5.402 9.202 938 2HG2 VAL1030 2HG2 VAL1030 1.123 3.926 10.103 939 3HG2 VAL1030 3HG2 VAL1030 2.236 3.833 8.717 940 H ASP1031 H ASP1031 -1.588 4.448 5.787 941 HA ASP1031 HA ASP1031 -3.164 2.339 5.716 942 1HB ASP1031 1HB ASP1031 -2.699 4.483 3.613 943 2HB ASP1031 2HB ASP1031 -3.953 3.280 3.387 944 H ALA1032 H ALA1032 -1.005 3.280 2.921 945 HA ALA1032 HA ALA1032 -1.376 1.059 1.373 946 1HB ALA1032 1HB ALA1032 1.288 1.737 0.980 947 2HB ALA1032 2HB ALA1032 -0.108 2.508 0.189 948 3HB ALA1032 3HB ALA1032 0.591 3.227 1.660 949 H LYS1033 H LYS1033 0.687 1.508 4.266 950 HA LYS1033 HA LYS1033 2.165 -0.853 3.967 951 1HB LYS1033 1HB LYS1033 2.303 1.302 5.594 952 2HB LYS1033 2HB LYS1033 1.569 0.158 6.700 953 1HG LYS1033 1HG LYS1033 3.675 -0.623 7.068 954 2HG LYS1033 2HG LYS1033 3.548 -1.391 5.498 955 1HD LYS1033 1HD LYS1033 4.720 0.371 4.396 956 2HD LYS1033 2HD LYS1033 4.442 1.503 5.705 957 1HE LYS1033 1HE LYS1033 5.878 -0.072 7.181 958 2HE LYS1033 2HE LYS1033 6.328 -0.892 5.699 959 1HZ LYS1033 1HZ LYS1033 6.912 1.849 6.498 960 2HZ LYS1033 2HZ LYS1033 7.931 0.704 5.936 961 3HZ LYS1033 3HZ LYS1033 6.903 1.455 4.913 962 H ASN1034 H ASN1034 -0.939 -0.100 5.660 963 HA ASN1034 HA ASN1034 -1.289 -2.519 6.856 964 1HB ASN1034 1HB ASN1034 -2.754 -0.226 6.692 965 2HB ASN1034 2HB ASN1034 -3.695 -1.211 5.590 966 1HD2 ASN1034 1HD2 ASN1034 -5.096 -0.510 7.588 967 2HD2 ASN1034 2HD2 ASN1034 -5.285 -1.718 8.816 968 H LEU1035 H LEU1035 -1.997 -1.402 3.499 969 HA LEU1035 HA LEU1035 -3.541 -3.456 2.581 970 1HB LEU1035 1HB LEU1035 -2.893 -1.338 1.419 971 2HB LEU1035 2HB LEU1035 -1.341 -2.063 1.052 972 HG LEU1035 HG LEU1035 -3.887 -3.431 0.210 973 1HD1 LEU1035 1HD1 LEU1035 -2.815 -0.886 -0.821 974 2HD1 LEU1035 2HD1 LEU1035 -3.143 -2.124 -2.058 975 3HD1 LEU1035 3HD1 LEU1035 -4.441 -1.597 -0.960 976 1HD2 LEU1035 1HD2 LEU1035 -0.995 -3.679 -0.351 977 2HD2 LEU1035 2HD2 LEU1035 -2.282 -4.909 -0.344 978 3HD2 LEU1035 3HD2 LEU1035 -2.073 -3.847 -1.757 979 H LEU1036 H LEU1036 0.090 -3.273 2.465 980 HA LEU1036 HA LEU1036 0.270 -5.997 1.659 981 1HB LEU1036 1HB LEU1036 1.870 -3.833 1.441 982 2HB LEU1036 2HB LEU1036 2.616 -4.615 2.821 983 HG LEU1036 HG LEU1036 2.256 -6.693 0.990 984 1HD1 LEU1036 1HD1 LEU1036 3.690 -4.699 -0.651 985 2HD1 LEU1036 2HD1 LEU1036 2.601 -6.024 -1.129 986 3HD1 LEU1036 3HD1 LEU1036 1.927 -4.482 -0.548 987 1HD2 LEU1036 1HD2 LEU1036 4.461 -5.185 2.208 988 2HD2 LEU1036 2HD2 LEU1036 4.238 -6.938 1.998 989 3HD2 LEU1036 3HD2 LEU1036 4.878 -5.956 0.658 990 H ASP1037 H ASP1037 0.502 -4.172 4.741 991 HA ASP1037 HA ASP1037 1.619 -5.966 6.359 992 1HB ASP1037 1HB ASP1037 0.603 -3.686 6.932 993 2HB ASP1037 2HB ASP1037 -0.959 -4.475 7.032 994 H VAL1038 H VAL1038 -1.895 -5.787 5.413 995 HA VAL1038 HA VAL1038 -2.681 -8.062 6.846 996 HB VAL1038 HB VAL1038 -4.183 -6.294 6.079 997 1HG1 VAL1038 1HG1 VAL1038 -4.907 -6.690 3.528 998 2HG1 VAL1038 2HG1 VAL1038 -3.634 -5.537 3.997 999 3HG1 VAL1038 3HG1 VAL1038 -3.193 -7.155 3.400 1000 1HG2 VAL1038 1HG2 VAL1038 -5.162 -8.438 6.629 1001 2HG2 VAL1038 2HG2 VAL1038 -6.012 -7.754 5.222 1002 3HG2 VAL1038 3HG2 VAL1038 -4.821 -9.057 4.996 1003 H ILE1039 H ILE1039 -1.259 -7.558 3.608 1004 HA ILE1039 HA ILE1039 -1.837 -10.108 2.601 1005 HB ILE1039 HB ILE1039 0.000 -7.869 1.936 1006 1HG1 ILE1039 1HG1 ILE1039 -1.897 -9.458 0.193 1007 2HG1 ILE1039 2HG1 ILE1039 -2.413 -8.102 1.177 1008 1HG2 ILE1039 1HG2 ILE1039 0.562 -10.704 1.311 1009 2HG2 ILE1039 2HG2 ILE1039 0.632 -9.578 -0.065 1010 3HG2 ILE1039 3HG2 ILE1039 1.648 -9.295 1.369 1011 1HD1 ILE1039 1HD1 ILE1039 -0.345 -8.055 -1.065 1012 2HD1 ILE1039 2HD1 ILE1039 -1.935 -7.255 -1.045 1013 3HD1 ILE1039 3HD1 ILE1039 -0.638 -6.682 0.031 1014 H ASP1040 H ASP1040 1.060 -8.772 4.322 1015 HA ASP1040 HA ASP1040 2.648 -10.932 4.214 1016 1HB ASP1040 1HB ASP1040 2.568 -8.536 5.648 1017 2HB ASP1040 2HB ASP1040 2.520 -9.735 6.926 1018 H GLN1041 H GLN1041 -0.035 -10.208 6.546 1019 HA GLN1041 HA GLN1041 0.355 -12.487 8.101 1020 1HB GLN1041 1HB GLN1041 -1.328 -11.604 9.353 1021 2HB GLN1041 2HB GLN1041 -1.184 -10.217 8.292 1022 1HG GLN1041 1HG GLN1041 -3.475 -10.680 8.125 1023 2HG GLN1041 2HG GLN1041 -2.853 -11.539 6.730 1024 1HE2 GLN1041 1HE2 GLN1041 -4.793 -12.791 6.894 1025 2HE2 GLN1041 2HE2 GLN1041 -4.892 -14.142 7.973 1026 H ALA1042 H ALA1042 -1.040 -11.981 4.943 1027 HA ALA1042 HA ALA1042 -2.699 -14.337 5.055 1028 1HB ALA1042 1HB ALA1042 -3.238 -13.736 2.749 1029 2HB ALA1042 2HB ALA1042 -3.319 -12.284 3.776 1030 3HB ALA1042 3HB ALA1042 -1.911 -12.550 2.718 1031 H ARG1043 H ARG1043 0.237 -13.254 3.198 1032 HA ARG1043 HA ARG1043 0.769 -15.479 1.863 1033 1HB ARG1043 1HB ARG1043 2.129 -13.324 1.911 1034 2HB ARG1043 2HB ARG1043 2.887 -13.882 3.389 1035 1HG ARG1043 1HG ARG1043 3.935 -15.746 2.279 1036 2HG ARG1043 2HG ARG1043 2.916 -15.581 0.863 1037 1HD ARG1043 1HD ARG1043 4.641 -14.386 -0.038 1038 2HD ARG1043 2HD ARG1043 4.106 -13.071 0.989 1039 HE ARG1043 HE ARG1043 5.822 -14.847 2.483 1040 1HH1 ARG1043 2HH2 ARG1043 5.918 -12.353 0.002 1041 2HH1 ARG1043 1HH2 ARG1043 7.538 -11.865 0.375 1042 1HH2 ARG1043 2HH1 ARG1043 7.959 -14.204 2.975 1043 2HH2 ARG1043 1HH1 ARG1043 8.706 -12.925 2.077 1044 H LEU1044 H LEU1044 1.486 -14.845 5.343 1045 HA LEU1044 HA LEU1044 2.855 -17.308 5.718 1046 1HB LEU1044 1HB LEU1044 2.725 -16.719 8.094 1047 2HB LEU1044 2HB LEU1044 3.389 -15.442 7.094 1048 HG LEU1044 HG LEU1044 0.911 -14.535 7.119 1049 1HD1 LEU1044 1HD1 LEU1044 -0.444 -15.110 8.909 1050 2HD1 LEU1044 2HD1 LEU1044 0.223 -16.681 8.406 1051 3HD1 LEU1044 3HD1 LEU1044 0.893 -15.843 9.826 1052 1HD2 LEU1044 1HD2 LEU1044 3.187 -14.200 8.972 1053 2HD2 LEU1044 2HD2 LEU1044 2.292 -13.000 8.010 1054 3HD2 LEU1044 3HD2 LEU1044 1.624 -13.580 9.555 1055 H LYS1045 H LYS1045 -0.518 -16.151 6.005 1056 HA LYS1045 HA LYS1045 -1.574 -18.226 7.469 1057 1HB LYS1045 1HB LYS1045 -2.760 -16.152 6.878 1058 2HB LYS1045 2HB LYS1045 -2.846 -16.660 5.204 1059 1HG LYS1045 1HG LYS1045 -3.860 -18.643 7.203 1060 2HG LYS1045 2HG LYS1045 -4.803 -17.174 7.055 1061 1HD LYS1045 1HD LYS1045 -4.654 -17.598 4.463 1062 2HD LYS1045 2HD LYS1045 -4.171 -19.224 4.903 1063 1HE LYS1045 1HE LYS1045 -6.324 -19.100 6.489 1064 2HE LYS1045 2HE LYS1045 -6.818 -17.839 5.377 1065 1HZ LYS1045 1HZ LYS1045 -7.254 -19.346 3.843 1066 2HZ LYS1045 2HZ LYS1045 -5.819 -20.105 4.013 1067 3HZ LYS1045 3HZ LYS1045 -7.072 -20.502 4.982 1068 H MET1046 H MET1046 -0.160 -18.241 4.285 1069 HA MET1046 HA MET1046 -1.549 -20.649 3.549 1070 1HB MET1046 1HB MET1046 -0.986 -19.933 1.440 1071 2HB MET1046 2HB MET1046 -0.297 -18.501 2.179 1072 1HG MET1046 1HG MET1046 1.898 -19.660 2.421 1073 2HG MET1046 2HG MET1046 1.217 -21.121 1.734 1074 1HE MET1046 1HE MET1046 1.030 -17.308 1.072 1075 2HE MET1046 2HE MET1046 2.778 -17.632 0.986 1076 3HE MET1046 3HE MET1046 1.891 -17.141 -0.477 1077 H ILE1047 H ILE1047 1.709 -19.551 4.601 1078 HA ILE1047 HA ILE1047 2.970 -22.037 4.170 1079 HB ILE1047 HB ILE1047 3.621 -19.565 5.747 1080 1HG1 ILE1047 1HG1 ILE1047 5.511 -20.453 3.724 1081 2HG1 ILE1047 2HG1 ILE1047 3.900 -20.295 3.053 1082 1HG2 ILE1047 1HG2 ILE1047 4.736 -22.233 6.122 1083 2HG2 ILE1047 2HG2 ILE1047 5.967 -21.039 5.646 1084 3HG2 ILE1047 3HG2 ILE1047 4.955 -20.749 7.081 1085 1HD1 ILE1047 1HD1 ILE1047 3.734 -17.992 4.065 1086 2HD1 ILE1047 2HD1 ILE1047 5.418 -18.159 4.618 1087 3HD1 ILE1047 3HD1 ILE1047 5.051 -18.143 2.876 1088 H SER1048 H SER1048 1.757 -20.419 7.193 1089 HA SER1048 HA SER1048 2.262 -22.578 8.821 1090 1HB SER1048 1HB SER1048 1.344 -20.025 9.183 1091 2HB SER1048 2HB SER1048 -0.140 -20.917 9.452 1092 HG SER1048 HG SER1048 1.009 -20.667 11.438 1093 H GLN1049 H GLN1049 -0.999 -21.476 7.616 1094 HA GLN1049 HA GLN1049 -2.267 -23.822 8.338 1095 1HB GLN1049 1HB GLN1049 -3.069 -21.368 7.431 1096 2HB GLN1049 2HB GLN1049 -3.352 -22.326 5.990 1097 1HG GLN1049 1HG GLN1049 -5.357 -22.810 6.991 1098 2HG GLN1049 2HG GLN1049 -4.424 -24.002 7.873 1099 1HE2 GLN1049 1HE2 GLN1049 -6.653 -21.704 8.222 1100 2HE2 GLN1049 2HE2 GLN1049 -6.363 -21.151 9.838 1101 H SER1050 H SER1050 -1.310 -25.743 7.632 1102 HA SER1050 HA SER1050 -1.028 -27.420 6.266 1103 1HB SER1050 1HB SER1050 -2.995 -26.011 4.920 1104 2HB SER1050 2HB SER1050 -1.738 -26.099 3.702 1105 HG SER1050 HG SER1050 -1.766 -28.362 3.786 1106 H ARG1051 H ARG1051 1.076 -27.968 5.839 1107 HA ARG1051 HA ARG1051 2.632 -25.987 4.383 1108 1HB ARG1051 1HB ARG1051 3.449 -26.452 6.686 1109 2HB ARG1051 2HB ARG1051 3.536 -28.167 6.333 1110 1HG ARG1051 1HG ARG1051 5.740 -27.633 5.888 1111 2HG ARG1051 2HG ARG1051 5.082 -27.300 4.299 1112 1HD ARG1051 1HD ARG1051 6.173 -25.283 4.644 1113 2HD ARG1051 2HD ARG1051 4.636 -24.870 5.378 1114 HE ARG1051 HE ARG1051 6.038 -25.996 7.480 1115 1HH1 ARG1051 2HH2 ARG1051 6.744 -23.413 5.198 1116 2HH1 ARG1051 1HH2 ARG1051 7.758 -22.543 6.300 1117 1HH2 ARG1051 2HH1 ARG1051 7.375 -24.849 8.935 1118 2HH2 ARG1051 1HH1 ARG1051 8.120 -23.366 8.440 1119 HA PRO1052 HA PRO1052 2.512 -29.324 1.430 1120 1HB PRO1052 1HB PRO1052 2.971 -27.798 -0.791 1121 2HB PRO1052 2HB PRO1052 1.367 -28.112 -0.158 1122 1HG PRO1052 1HG PRO1052 2.979 -25.640 0.020 1123 2HG PRO1052 2HG PRO1052 1.254 -25.846 0.257 1124 1HD PRO1052 1HD PRO1052 3.239 -25.513 2.300 1125 2HD PRO1052 2HD PRO1052 1.533 -25.834 2.539 1126 H HIS1053 H HIS1053 4.950 -26.826 1.636 1127 HA HIS1053 HA HIS1053 6.878 -28.254 0.198 1128 1HB HIS1053 1HB HIS1053 7.170 -25.927 0.437 1129 2HB HIS1053 2HB HIS1053 6.977 -25.983 2.178 1130 HD1 HIS1053 HD1 HIS1053 9.195 -25.199 3.053 1131 HD2 HIS1053 HD2 HIS1053 9.603 -28.083 0.035 1132 HE1 HIS1053 HE1 HIS1053 11.685 -25.736 2.910 Start of MODEL 10 1 H MET 915 H MET 915 15.062 -21.664 3.121 2 HA MET 915 HA MET 915 14.658 -19.500 1.576 3 1HB MET 915 1HB MET 915 15.196 -21.030 -0.339 4 2HB MET 915 2HB MET 915 16.207 -21.384 1.048 5 1HG MET 915 1HG MET 915 13.924 -22.993 1.454 6 2HG MET 915 2HG MET 915 14.200 -23.086 -0.274 7 1HE MET 915 1HE MET 915 14.318 -25.579 1.346 8 2HE MET 915 2HE MET 915 14.923 -25.648 -0.326 9 3HE MET 915 3HE MET 915 15.880 -26.357 0.996 10 H ALA 916 H ALA 916 12.864 -18.517 0.759 11 HA ALA 916 HA ALA 916 10.490 -20.191 0.371 12 1HB ALA 916 1HB ALA 916 9.847 -17.444 0.146 13 2HB ALA 916 2HB ALA 916 9.500 -18.529 1.514 14 3HB ALA 916 3HB ALA 916 10.997 -17.567 1.498 15 H ASN 917 H ASN 917 9.640 -20.496 -1.655 16 HA ASN 917 HA ASN 917 11.221 -19.478 -3.813 17 1HB ASN 917 1HB ASN 917 10.562 -21.790 -4.029 18 2HB ASN 917 2HB ASN 917 8.902 -21.444 -3.584 19 1HD2 ASN 917 1HD2 ASN 917 7.514 -21.451 -5.165 20 2HD2 ASN 917 2HD2 ASN 917 7.805 -21.069 -6.829 21 H LEU 918 H LEU 918 10.568 -17.162 -3.571 22 HA LEU 918 HA LEU 918 7.864 -16.699 -4.619 23 1HB LEU 918 1HB LEU 918 9.196 -15.618 -2.218 24 2HB LEU 918 2HB LEU 918 8.397 -14.428 -3.227 25 HG LEU 918 HG LEU 918 6.384 -16.154 -3.104 26 1HD1 LEU 918 1HD1 LEU 918 7.641 -17.869 -1.880 27 2HD1 LEU 918 2HD1 LEU 918 7.881 -16.731 -0.532 28 3HD1 LEU 918 3HD1 LEU 918 6.241 -17.283 -0.950 29 1HD2 LEU 918 1HD2 LEU 918 5.894 -14.034 -2.377 30 2HD2 LEU 918 2HD2 LEU 918 5.771 -14.942 -0.851 31 3HD2 LEU 918 3HD2 LEU 918 7.237 -13.999 -1.209 32 H ASP 919 H ASP 919 8.108 -16.084 -6.702 33 HA ASP 919 HA ASP 919 10.461 -15.199 -7.772 34 1HB ASP 919 1HB ASP 919 7.881 -15.780 -8.681 35 2HB ASP 919 2HB ASP 919 8.033 -14.073 -9.048 36 H ARG 920 H ARG 920 9.960 -12.824 -9.228 37 HA ARG 920 HA ARG 920 10.146 -10.914 -7.099 38 1HB ARG 920 1HB ARG 920 11.242 -11.194 -9.745 39 2HB ARG 920 2HB ARG 920 10.305 -9.713 -9.742 40 1HG ARG 920 1HG ARG 920 12.050 -8.697 -8.708 41 2HG ARG 920 2HG ARG 920 11.685 -9.647 -7.282 42 1HD ARG 920 1HD ARG 920 13.356 -11.233 -7.731 43 2HD ARG 920 2HD ARG 920 13.297 -10.970 -9.462 44 HE ARG 920 HE ARG 920 14.191 -8.538 -8.352 45 1HH1 ARG 920 2HH2 ARG 920 15.328 -11.892 -8.470 46 2HH1 ARG 920 1HH2 ARG 920 17.002 -11.458 -8.364 47 1HH2 ARG 920 1HH1 ARG 920 17.608 -9.144 -8.215 48 H SER 921 H SER 921 7.518 -12.097 -7.543 49 HA SER 921 HA SER 921 6.038 -10.170 -9.051 50 1HB SER 921 1HB SER 921 5.500 -12.781 -7.713 51 2HB SER 921 2HB SER 921 4.144 -11.672 -7.746 52 HG SER 921 HG SER 921 4.015 -12.848 -9.654 53 H ASN 922 H ASN 922 6.325 -11.253 -5.597 54 HA ASN 922 HA ASN 922 4.592 -9.208 -4.706 55 1HB ASN 922 1HB ASN 922 6.098 -11.473 -3.557 56 2HB ASN 922 2HB ASN 922 6.150 -10.074 -2.503 57 1HD2 ASN 922 1HD2 ASN 922 4.935 -11.992 -1.374 58 2HD2 ASN 922 2HD2 ASN 922 3.206 -11.895 -1.411 59 H ASP 923 H ASP 923 7.677 -9.127 -5.986 60 HA ASP 923 HA ASP 923 8.896 -7.425 -4.057 61 1HB ASP 923 1HB ASP 923 9.736 -8.989 -6.272 62 2HB ASP 923 2HB ASP 923 10.066 -7.335 -6.747 63 H LYS 924 H LYS 924 7.518 -7.186 -7.414 64 HA LYS 924 HA LYS 924 7.957 -4.417 -7.671 65 1HB LYS 924 1HB LYS 924 7.711 -5.847 -9.606 66 2HB LYS 924 2HB LYS 924 6.100 -6.329 -9.113 67 1HG LYS 924 1HG LYS 924 5.204 -4.521 -10.142 68 2HG LYS 924 2HG LYS 924 6.175 -3.444 -9.157 69 1HD LYS 924 1HD LYS 924 7.963 -3.401 -10.740 70 2HD LYS 924 2HD LYS 924 7.407 -4.853 -11.548 71 1HE LYS 924 1HE LYS 924 5.214 -3.341 -11.979 72 2HE LYS 924 2HE LYS 924 6.363 -2.033 -11.776 73 1HZ LYS 924 1HZ LYS 924 5.999 -3.596 -14.002 74 2HZ LYS 924 2HZ LYS 924 7.135 -2.444 -13.780 75 3HZ LYS 924 3HZ LYS 924 7.470 -4.001 -13.422 76 H VAL 925 H VAL 925 5.063 -6.386 -6.732 77 HA VAL 925 HA VAL 925 3.301 -4.295 -6.419 78 HB VAL 925 HB VAL 925 3.560 -6.911 -4.927 79 1HG1 VAL 925 1HG1 VAL 925 1.035 -5.264 -5.181 80 2HG1 VAL 925 2HG1 VAL 925 1.352 -6.662 -4.125 81 3HG1 VAL 925 3HG1 VAL 925 2.142 -5.101 -3.797 82 1HG2 VAL 925 1HG2 VAL 925 2.064 -6.079 -7.426 83 2HG2 VAL 925 2HG2 VAL 925 3.303 -7.344 -7.251 84 3HG2 VAL 925 3HG2 VAL 925 1.694 -7.567 -6.522 85 H TYR 926 H TYR 926 5.616 -5.730 -4.029 86 HA TYR 926 HA TYR 926 4.891 -4.022 -1.927 87 1HB TYR 926 1HB TYR 926 7.281 -5.717 -2.803 88 2HB TYR 926 2HB TYR 926 7.439 -4.732 -1.362 89 HD1 TYR 926 HD1 TYR 926 7.734 -6.593 0.148 90 HD2 TYR 926 HD2 TYR 926 4.247 -6.336 -2.318 91 HE1 TYR 926 HE1 TYR 926 6.622 -8.424 1.518 92 HE2 TYR 926 HE2 TYR 926 3.147 -8.168 -0.940 93 HH TYR 926 HH TYR 926 4.277 -9.103 2.044 94 H GLU 927 H GLU 927 7.258 -3.735 -4.613 95 HA GLU 927 HA GLU 927 8.690 -1.621 -3.612 96 1HB GLU 927 1HB GLU 927 8.076 -2.650 -6.379 97 2HB GLU 927 2HB GLU 927 8.890 -1.105 -6.231 98 1HG GLU 927 1HG GLU 927 9.961 -3.345 -4.541 99 2HG GLU 927 2HG GLU 927 10.216 -3.483 -6.269 100 H ASN 928 H ASN 928 6.071 -1.406 -6.137 101 HA ASN 928 HA ASN 928 5.782 1.202 -6.305 102 1HB ASN 928 1HB ASN 928 3.357 -0.620 -5.910 103 2HB ASN 928 2HB ASN 928 3.429 0.833 -6.887 104 1HD2 ASN 928 1HD2 ASN 928 5.121 0.841 -8.625 105 2HD2 ASN 928 2HD2 ASN 928 5.335 -0.603 -9.557 106 H VAL 929 H VAL 929 4.211 -0.913 -3.789 107 HA VAL 929 HA VAL 929 2.792 0.956 -2.415 108 HB VAL 929 HB VAL 929 4.336 -1.455 -1.454 109 1HG1 VAL 929 1HG1 VAL 929 2.094 -0.093 0.058 110 2HG1 VAL 929 2HG1 VAL 929 3.180 -1.389 0.614 111 3HG1 VAL 929 3HG1 VAL 929 3.812 0.256 0.364 112 1HG2 VAL 929 1HG2 VAL 929 1.361 -1.132 -1.948 113 2HG2 VAL 929 2HG2 VAL 929 2.502 -1.764 -3.159 114 3HG2 VAL 929 3HG2 VAL 929 2.260 -2.635 -1.625 115 H THR 930 H THR 930 6.174 -0.099 -1.577 116 HA THR 930 HA THR 930 6.571 1.978 0.267 117 HB THR 930 HB THR 930 9.064 1.257 -0.284 118 HG1 THR 930 HG1 THR 930 9.068 -0.609 -1.647 119 1HG2 THR 930 1HG2 THR 930 7.148 -0.998 0.472 120 2HG2 THR 930 2HG2 THR 930 8.836 -0.781 0.994 121 3HG2 THR 930 3HG2 THR 930 7.567 0.304 1.612 122 H GLY 931 H GLY 931 7.901 1.646 -3.097 123 1HA GLY 931 1HA GLY 931 9.174 3.971 -3.420 124 2HA GLY 931 2HA GLY 931 8.169 3.264 -4.669 125 H LEU 932 H LEU 932 5.573 3.574 -3.771 126 HA LEU 932 HA LEU 932 5.171 6.339 -4.216 127 1HB LEU 932 1HB LEU 932 3.114 5.710 -4.742 128 2HB LEU 932 2HB LEU 932 3.737 4.076 -4.630 129 HG LEU 932 HG LEU 932 2.968 4.011 -2.238 130 1HD1 LEU 932 1HD1 LEU 932 0.972 5.894 -2.103 131 2HD1 LEU 932 2HD1 LEU 932 2.553 5.992 -1.291 132 3HD1 LEU 932 3HD1 LEU 932 2.306 6.800 -2.857 133 1HD2 LEU 932 1HD2 LEU 932 1.154 2.979 -2.999 134 2HD2 LEU 932 2HD2 LEU 932 0.428 4.510 -3.544 135 3HD2 LEU 932 3HD2 LEU 932 1.545 3.624 -4.611 136 H VAL 933 H VAL 933 4.722 4.161 -1.353 137 HA VAL 933 HA VAL 933 3.742 6.042 0.390 138 HB VAL 933 HB VAL 933 5.245 3.487 0.582 139 1HG1 VAL 933 1HG1 VAL 933 5.126 3.713 3.138 140 2HG1 VAL 933 2HG1 VAL 933 6.442 4.570 2.299 141 3HG1 VAL 933 3HG1 VAL 933 5.008 5.466 2.856 142 1HG2 VAL 933 1HG2 VAL 933 3.277 2.658 1.441 143 2HG2 VAL 933 2HG2 VAL 933 2.819 4.206 2.190 144 3HG2 VAL 933 3HG2 VAL 933 2.649 3.983 0.432 145 H LYS 934 H LYS 934 7.051 5.529 -0.823 146 HA LYS 934 HA LYS 934 8.362 7.052 1.132 147 1HB LYS 934 1HB LYS 934 9.167 6.535 -1.746 148 2HB LYS 934 2HB LYS 934 10.222 7.069 -0.454 149 1HG LYS 934 1HG LYS 934 8.820 4.729 0.482 150 2HG LYS 934 2HG LYS 934 9.430 4.373 -1.121 151 1HD LYS 934 1HD LYS 934 11.337 3.840 0.068 152 2HD LYS 934 2HD LYS 934 11.652 5.552 -0.137 153 1HE LYS 934 1HE LYS 934 11.817 5.631 2.137 154 2HE LYS 934 2HE LYS 934 10.066 5.549 2.145 155 1HZ LYS 934 1HZ LYS 934 10.145 3.247 2.443 156 2HZ LYS 934 2HZ LYS 934 11.734 3.139 2.085 157 3HZ LYS 934 3HZ LYS 934 11.258 3.839 3.481 158 H ALA 935 H ALA 935 7.056 7.895 -2.144 159 HA ALA 935 HA ALA 935 7.797 10.597 -1.988 160 1HB ALA 935 1HB ALA 935 5.630 10.516 -3.687 161 2HB ALA 935 2HB ALA 935 7.304 10.126 -4.151 162 3HB ALA 935 3HB ALA 935 6.176 8.822 -3.709 163 H VAL 936 H VAL 936 4.818 8.781 -1.071 164 HA VAL 936 HA VAL 936 3.049 10.722 -0.596 165 HB VAL 936 HB VAL 936 3.772 8.209 0.850 166 1HG1 VAL 936 1HG1 VAL 936 1.385 8.795 2.015 167 2HG1 VAL 936 2HG1 VAL 936 2.968 9.071 2.782 168 3HG1 VAL 936 3HG1 VAL 936 2.130 10.410 1.962 169 1HG2 VAL 936 1HG2 VAL 936 2.488 8.366 -1.365 170 2HG2 VAL 936 2HG2 VAL 936 1.771 7.371 -0.076 171 3HG2 VAL 936 3HG2 VAL 936 1.134 9.002 -0.400 172 H ILE 937 H ILE 937 5.790 9.830 1.601 173 HA ILE 937 HA ILE 937 5.163 12.082 3.296 174 HB ILE 937 HB ILE 937 7.215 9.881 3.379 175 1HG1 ILE 937 1HG1 ILE 937 5.393 10.300 5.645 176 2HG1 ILE 937 2HG1 ILE 937 4.561 9.941 4.145 177 1HG2 ILE 937 1HG2 ILE 937 7.294 12.493 4.681 178 2HG2 ILE 937 2HG2 ILE 937 7.317 11.142 5.840 179 3HG2 ILE 937 3HG2 ILE 937 8.544 11.232 4.553 180 1HD1 ILE 937 1HD1 ILE 937 6.957 8.253 4.590 181 2HD1 ILE 937 2HD1 ILE 937 5.686 8.049 5.819 182 3HD1 ILE 937 3HD1 ILE 937 5.311 7.785 4.100 183 H GLU 938 H GLU 938 8.062 10.962 1.404 184 HA GLU 938 HA GLU 938 9.691 12.976 1.618 185 1HB GLU 938 1HB GLU 938 9.036 11.103 -0.519 186 2HB GLU 938 2HB GLU 938 9.599 12.616 -1.199 187 1HG GLU 938 1HG GLU 938 11.670 11.675 -0.840 188 2HG GLU 938 2HG GLU 938 11.454 12.346 0.765 189 H MET 939 H MET 939 6.664 13.080 -0.339 190 HA MET 939 HA MET 939 6.976 15.404 -1.641 191 1HB MET 939 1HB MET 939 4.959 14.127 -1.965 192 2HB MET 939 2HB MET 939 4.586 14.115 -0.253 193 1HG MET 939 1HG MET 939 4.162 16.592 -0.340 194 2HG MET 939 2HG MET 939 4.506 16.583 -2.058 195 1HE MET 939 1HE MET 939 3.557 14.490 -3.414 196 2HE MET 939 2HE MET 939 2.915 13.278 -2.279 197 3HE MET 939 3HE MET 939 1.818 14.111 -3.407 198 H SER 940 H SER 940 5.066 15.299 1.451 199 HA SER 940 HA SER 940 4.887 17.871 1.959 200 1HB SER 940 1HB SER 940 5.329 15.503 3.767 201 2HB SER 940 2HB SER 940 5.338 17.098 4.494 202 HG SER 940 HG SER 940 3.213 17.390 4.031 203 H SER 941 H SER 941 7.843 15.883 2.290 204 HA SER 941 HA SER 941 9.324 17.717 3.747 205 1HB SER 941 1HB SER 941 9.725 15.166 2.893 206 2HB SER 941 2HB SER 941 10.725 16.005 1.724 207 HG SER 941 HG SER 941 11.500 15.318 4.106 208 H LYS 942 H LYS 942 9.093 17.091 0.175 209 HA LYS 942 HA LYS 942 10.482 19.634 -0.255 210 1HB LYS 942 1HB LYS 942 10.849 18.772 -2.555 211 2HB LYS 942 2HB LYS 942 11.595 17.791 -1.310 212 1HG LYS 942 1HG LYS 942 10.404 15.972 -1.953 213 2HG LYS 942 2HG LYS 942 8.893 16.833 -1.739 214 1HD LYS 942 1HD LYS 942 9.954 17.926 -4.110 215 2HD LYS 942 2HD LYS 942 10.356 16.224 -4.221 216 1HE LYS 942 1HE LYS 942 7.625 16.530 -3.236 217 2HE LYS 942 2HE LYS 942 7.825 17.439 -4.720 218 1HZ LYS 942 1HZ LYS 942 7.444 14.782 -4.549 219 2HZ LYS 942 2HZ LYS 942 7.988 15.573 -5.870 220 3HZ LYS 942 3HZ LYS 942 9.048 14.880 -4.838 221 H ILE 943 H ILE 943 7.642 19.311 0.648 222 HA ILE 943 HA ILE 943 6.196 20.119 -1.747 223 HB ILE 943 HB ILE 943 5.502 18.459 0.245 224 1HG1 ILE 943 1HG1 ILE 943 4.389 18.997 -1.990 225 2HG1 ILE 943 2HG1 ILE 943 3.356 18.450 -0.684 226 1HG2 ILE 943 1HG2 ILE 943 4.447 21.177 1.064 227 2HG2 ILE 943 2HG2 ILE 943 3.810 19.624 1.657 228 3HG2 ILE 943 3HG2 ILE 943 5.493 20.087 2.006 229 1HD1 ILE 943 1HD1 ILE 943 3.805 21.416 -0.954 230 2HD1 ILE 943 2HD1 ILE 943 2.738 20.616 -2.132 231 3HD1 ILE 943 3HD1 ILE 943 2.363 20.535 -0.393 232 H GLN 944 H GLN 944 6.959 21.293 1.598 233 HA GLN 944 HA GLN 944 5.738 23.677 1.509 234 1HB GLN 944 1HB GLN 944 7.659 22.432 3.129 235 2HB GLN 944 2HB GLN 944 8.449 23.915 2.634 236 1HG GLN 944 1HG GLN 944 6.601 25.273 3.471 237 2HG GLN 944 2HG GLN 944 5.608 23.856 3.745 238 1HE2 GLN 944 1HE2 GLN 944 6.037 25.643 5.739 239 2HE2 GLN 944 2HE2 GLN 944 7.032 24.971 6.987 240 HA PRO 945 HA PRO 945 9.437 25.494 -0.844 241 1HB PRO 945 1HB PRO 945 11.331 23.833 -1.903 242 2HB PRO 945 2HB PRO 945 11.515 24.632 -0.355 243 1HG PRO 945 1HG PRO 945 10.889 21.798 -0.915 244 2HG PRO 945 2HG PRO 945 11.488 22.518 0.566 245 1HD PRO 945 1HD PRO 945 8.800 21.669 0.036 246 2HD PRO 945 2HD PRO 945 9.375 22.494 1.471 247 H ALA 946 H ALA 946 8.813 22.306 -2.231 248 HA ALA 946 HA ALA 946 8.897 22.757 -4.828 249 1HB ALA 946 1HB ALA 946 7.022 21.240 -3.064 250 2HB ALA 946 2HB ALA 946 6.554 21.421 -4.772 251 3HB ALA 946 3HB ALA 946 8.106 20.658 -4.350 252 HA PRO 947 HA PRO 947 6.311 26.164 -5.610 253 1HB PRO 947 1HB PRO 947 6.552 26.230 -8.331 254 2HB PRO 947 2HB PRO 947 7.726 26.950 -7.248 255 1HG PRO 947 1HG PRO 947 7.931 24.444 -8.803 256 2HG PRO 947 2HG PRO 947 9.212 25.387 -8.068 257 1HD PRO 947 1HD PRO 947 8.104 22.933 -7.079 258 2HD PRO 947 2HD PRO 947 9.302 23.937 -6.287 259 HA PRO 948 HA PRO 948 2.461 24.869 -6.858 260 1HB PRO 948 1HB PRO 948 1.399 26.891 -8.359 261 2HB PRO 948 2HB PRO 948 1.469 26.932 -6.609 262 1HG PRO 948 1HG PRO 948 3.138 28.391 -8.565 263 2HG PRO 948 2HG PRO 948 2.899 28.724 -6.861 264 1HD PRO 948 1HD PRO 948 5.194 27.493 -8.065 265 2HD PRO 948 2HD PRO 948 4.904 27.722 -6.351 266 H GLU 949 H GLU 949 4.729 25.499 -9.288 267 HA GLU 949 HA GLU 949 3.048 24.339 -11.307 268 1HB GLU 949 1HB GLU 949 5.793 25.598 -11.245 269 2HB GLU 949 2HB GLU 949 5.363 24.579 -12.605 270 1HG GLU 949 1HG GLU 949 3.124 26.062 -12.578 271 2HG GLU 949 2HG GLU 949 4.155 27.209 -11.746 272 H GLU 950 H GLU 950 5.311 23.327 -8.880 273 HA GLU 950 HA GLU 950 5.765 20.842 -10.326 274 1HB GLU 950 1HB GLU 950 7.561 22.483 -8.981 275 2HB GLU 950 2HB GLU 950 7.232 21.245 -7.785 276 1HG GLU 950 1HG GLU 950 9.015 20.302 -9.003 277 2HG GLU 950 2HG GLU 950 7.619 19.539 -9.737 278 H TYR 951 H TYR 951 3.672 22.228 -8.111 279 HA TYR 951 HA TYR 951 3.495 19.902 -6.375 280 1HB TYR 951 1HB TYR 951 3.319 22.431 -5.731 281 2HB TYR 951 2HB TYR 951 1.804 22.465 -6.612 282 HD1 TYR 951 HD1 TYR 951 1.280 23.356 -4.124 283 HD2 TYR 951 HD2 TYR 951 2.026 19.279 -5.182 284 HE1 TYR 951 HE1 TYR 951 0.050 22.582 -2.038 285 HE2 TYR 951 HE2 TYR 951 0.794 18.518 -3.092 286 HH TYR 951 HH TYR 951 -0.338 20.862 -0.714 287 H VAL 952 H VAL 952 1.578 21.684 -8.868 288 HA VAL 952 HA VAL 952 -0.748 20.215 -8.672 289 HB VAL 952 HB VAL 952 0.548 22.029 -10.545 290 1HG1 VAL 952 1HG1 VAL 952 -0.939 21.404 -12.480 291 2HG1 VAL 952 2HG1 VAL 952 0.392 20.266 -12.162 292 3HG1 VAL 952 3HG1 VAL 952 -1.265 19.863 -11.651 293 1HG2 VAL 952 1HG2 VAL 952 -1.550 22.192 -8.897 294 2HG2 VAL 952 2HG2 VAL 952 -1.420 23.178 -10.373 295 3HG2 VAL 952 3HG2 VAL 952 -2.415 21.702 -10.373 296 HA PRO 953 HA PRO 953 1.297 17.162 -11.661 297 1HB PRO 953 1HB PRO 953 4.002 17.247 -12.039 298 2HB PRO 953 2HB PRO 953 2.859 18.006 -13.128 299 1HG PRO 953 1HG PRO 953 4.621 19.268 -11.117 300 2HG PRO 953 2HG PRO 953 3.805 20.007 -12.480 301 1HD PRO 953 1HD PRO 953 3.032 20.170 -9.723 302 2HD PRO 953 2HD PRO 953 2.154 20.811 -11.097 303 H MET 954 H MET 954 3.931 17.849 -9.397 304 HA MET 954 HA MET 954 4.712 15.466 -8.723 305 1HB MET 954 1HB MET 954 5.541 17.377 -7.497 306 2HB MET 954 2HB MET 954 3.940 17.815 -6.934 307 1HG MET 954 1HG MET 954 4.560 15.106 -6.057 308 2HG MET 954 2HG MET 954 5.868 16.178 -5.598 309 1HE MET 954 1HE MET 954 5.005 18.742 -5.248 310 2HE MET 954 2HE MET 954 3.905 19.088 -3.891 311 3HE MET 954 3HE MET 954 5.447 18.249 -3.596 312 H VAL 955 H VAL 955 1.589 16.886 -7.579 313 HA VAL 955 HA VAL 955 0.911 14.667 -5.973 314 HB VAL 955 HB VAL 955 -0.703 16.900 -7.214 315 1HG1 VAL 955 1HG1 VAL 955 -2.612 16.044 -6.416 316 2HG1 VAL 955 2HG1 VAL 955 -1.730 14.509 -6.232 317 3HG1 VAL 955 3HG1 VAL 955 -1.865 15.628 -4.854 318 1HG2 VAL 955 1HG2 VAL 955 1.081 16.755 -4.963 319 2HG2 VAL 955 2HG2 VAL 955 0.172 18.151 -5.589 320 3HG2 VAL 955 3HG2 VAL 955 -0.572 17.072 -4.384 321 H LYS 956 H LYS 956 -0.164 15.737 -9.276 322 HA LYS 956 HA LYS 956 -1.843 13.682 -9.849 323 1HB LYS 956 1HB LYS 956 -0.340 15.685 -11.317 324 2HB LYS 956 2HB LYS 956 -0.444 14.196 -12.234 325 1HG LYS 956 1HG LYS 956 -2.600 14.654 -12.753 326 2HG LYS 956 2HG LYS 956 -3.025 14.614 -11.054 327 1HD LYS 956 1HD LYS 956 -3.508 16.827 -11.254 328 2HD LYS 956 2HD LYS 956 -1.777 17.099 -11.294 329 1HE LYS 956 1HE LYS 956 -1.724 17.372 -13.616 330 2HE LYS 956 2HE LYS 956 -3.097 16.316 -13.884 331 1HZ LYS 956 1HZ LYS 956 -3.620 18.644 -14.230 332 2HZ LYS 956 2HZ LYS 956 -4.531 18.013 -13.030 333 3HZ LYS 956 3HZ LYS 956 -3.271 18.988 -12.672 334 H GLU 957 H GLU 957 1.735 13.692 -9.806 335 HA GLU 957 HA GLU 957 2.115 11.316 -11.136 336 1HB GLU 957 1HB GLU 957 3.666 13.043 -9.285 337 2HB GLU 957 2HB GLU 957 4.173 11.365 -9.285 338 1HG GLU 957 1HG GLU 957 5.293 11.735 -11.218 339 2HG GLU 957 2HG GLU 957 3.763 12.022 -12.023 340 H VAL 958 H VAL 958 1.785 11.948 -7.572 341 HA VAL 958 HA VAL 958 2.109 9.456 -6.596 342 HB VAL 958 HB VAL 958 0.441 11.807 -5.868 343 1HG1 VAL 958 1HG1 VAL 958 -0.365 10.606 -3.811 344 2HG1 VAL 958 2HG1 VAL 958 -1.132 10.076 -5.327 345 3HG1 VAL 958 3HG1 VAL 958 0.137 9.079 -4.576 346 1HG2 VAL 958 1HG2 VAL 958 2.396 10.225 -4.182 347 2HG2 VAL 958 2HG2 VAL 958 2.915 11.473 -5.340 348 3HG2 VAL 958 3HG2 VAL 958 1.862 11.910 -3.973 349 H GLY 959 H GLY 959 -1.059 10.824 -7.750 350 1HA GLY 959 1HA GLY 959 -2.676 8.673 -7.451 351 2HA GLY 959 2HA GLY 959 -2.781 9.799 -8.790 352 H LEU 960 H LEU 960 -0.356 9.273 -10.176 353 HA LEU 960 HA LEU 960 -1.097 7.060 -11.688 354 1HB LEU 960 1HB LEU 960 0.799 9.148 -11.779 355 2HB LEU 960 2HB LEU 960 1.704 7.657 -11.941 356 HG LEU 960 HG LEU 960 -0.708 7.755 -13.624 357 1HD1 LEU 960 1HD1 LEU 960 1.054 10.069 -13.554 358 2HD1 LEU 960 2HD1 LEU 960 1.027 9.295 -15.157 359 3HD1 LEU 960 3HD1 LEU 960 -0.493 9.829 -14.400 360 1HD2 LEU 960 1HD2 LEU 960 2.192 7.006 -13.950 361 2HD2 LEU 960 2HD2 LEU 960 0.744 5.974 -14.031 362 3HD2 LEU 960 3HD2 LEU 960 1.096 7.120 -15.348 363 H ALA 961 H ALA 961 1.439 7.455 -9.134 364 HA ALA 961 HA ALA 961 2.481 4.898 -9.299 365 1HB ALA 961 1HB ALA 961 3.753 6.293 -7.983 366 2HB ALA 961 2HB ALA 961 2.333 7.080 -7.254 367 3HB ALA 961 3HB ALA 961 2.839 5.467 -6.699 368 H LEU 962 H LEU 962 -0.229 6.186 -7.257 369 HA LEU 962 HA LEU 962 -0.792 3.799 -5.965 370 1HB LEU 962 1HB LEU 962 -2.501 6.180 -6.672 371 2HB LEU 962 2HB LEU 962 -3.085 4.845 -5.699 372 HG LEU 962 HG LEU 962 -0.562 5.835 -4.660 373 1HD1 LEU 962 1HD1 LEU 962 -1.405 8.037 -3.876 374 2HD1 LEU 962 2HD1 LEU 962 -1.138 7.958 -5.634 375 3HD1 LEU 962 3HD1 LEU 962 -2.791 7.861 -4.980 376 1HD2 LEU 962 1HD2 LEU 962 -3.190 6.078 -3.243 377 2HD2 LEU 962 2HD2 LEU 962 -2.543 4.463 -3.618 378 3HD2 LEU 962 3HD2 LEU 962 -1.594 5.592 -2.622 379 H ARG 963 H ARG 963 -2.053 5.153 -9.073 380 HA ARG 963 HA ARG 963 -3.937 3.335 -9.619 381 1HB ARG 963 1HB ARG 963 -3.421 5.258 -11.085 382 2HB ARG 963 2HB ARG 963 -1.884 4.547 -11.537 383 1HG ARG 963 1HG ARG 963 -4.344 2.875 -11.991 384 2HG ARG 963 2HG ARG 963 -4.120 4.260 -13.042 385 1HD ARG 963 1HD ARG 963 -1.571 2.939 -12.836 386 2HD ARG 963 2HD ARG 963 -2.771 1.697 -13.130 387 HE ARG 963 HE ARG 963 -3.456 3.681 -14.943 388 1HH1 ARG 963 2HH2 ARG 963 -0.490 1.919 -14.247 389 2HH1 ARG 963 1HH2 ARG 963 0.104 2.022 -15.870 390 1HH2 ARG 963 2HH1 ARG 963 -2.673 3.817 -17.086 391 2HH2 ARG 963 1HH1 ARG 963 -1.146 3.109 -17.496 392 H THR 964 H THR 964 -0.402 3.074 -10.453 393 HA THR 964 HA THR 964 -0.546 0.529 -11.594 394 HB THR 964 HB THR 964 1.590 2.297 -10.363 395 HG1 THR 964 HG1 THR 964 2.155 2.230 -12.637 396 1HG2 THR 964 1HG2 THR 964 2.630 0.230 -9.824 397 2HG2 THR 964 2HG2 THR 964 1.822 -0.627 -11.159 398 3HG2 THR 964 3HG2 THR 964 3.163 0.492 -11.502 399 H LEU 965 H LEU 965 -0.615 1.578 -8.228 400 HA LEU 965 HA LEU 965 0.278 -0.786 -7.057 401 1HB LEU 965 1HB LEU 965 -0.295 1.617 -6.134 402 2HB LEU 965 2HB LEU 965 -1.853 0.888 -5.799 403 HG LEU 965 HG LEU 965 -0.761 -0.845 -4.427 404 1HD1 LEU 965 1HD1 LEU 965 1.683 0.384 -5.545 405 2HD1 LEU 965 2HD1 LEU 965 1.744 -0.015 -3.811 406 3HD1 LEU 965 3HD1 LEU 965 1.369 -1.283 -5.004 407 1HD2 LEU 965 1HD2 LEU 965 -1.531 0.832 -3.068 408 2HD2 LEU 965 2HD2 LEU 965 0.203 0.864 -2.670 409 3HD2 LEU 965 3HD2 LEU 965 -0.474 2.066 -3.795 410 H LEU 966 H LEU 966 -2.986 0.268 -8.177 411 HA LEU 966 HA LEU 966 -4.377 -1.928 -7.188 412 1HB LEU 966 1HB LEU 966 -4.893 -0.129 -9.557 413 2HB LEU 966 2HB LEU 966 -6.037 -1.316 -8.963 414 HG LEU 966 HG LEU 966 -5.853 -0.090 -6.696 415 1HD1 LEU 966 1HD1 LEU 966 -4.324 1.735 -8.490 416 2HD1 LEU 966 2HD1 LEU 966 -5.422 2.465 -7.294 417 3HD1 LEU 966 3HD1 LEU 966 -4.117 1.381 -6.758 418 1HD2 LEU 966 1HD2 LEU 966 -7.263 1.888 -8.093 419 2HD2 LEU 966 2HD2 LEU 966 -7.434 0.407 -9.065 420 3HD2 LEU 966 3HD2 LEU 966 -7.915 0.407 -7.351 421 H ALA 967 H ALA 967 -2.794 -1.368 -10.399 422 HA ALA 967 HA ALA 967 -3.515 -3.829 -11.492 423 1HB ALA 967 1HB ALA 967 -1.696 -3.343 -13.096 424 2HB ALA 967 2HB ALA 967 -2.688 -1.898 -12.783 425 3HB ALA 967 3HB ALA 967 -1.089 -2.063 -12.018 426 H THR 968 H THR 968 -0.282 -2.829 -10.146 427 HA THR 968 HA THR 968 0.909 -5.279 -10.149 428 HB THR 968 HB THR 968 2.270 -4.284 -8.249 429 HG1 THR 968 HG1 THR 968 0.485 -2.019 -8.593 430 1HG2 THR 968 1HG2 THR 968 1.556 -2.751 -10.740 431 2HG2 THR 968 2HG2 THR 968 2.416 -1.856 -9.464 432 3HG2 THR 968 3HG2 THR 968 3.149 -3.311 -10.180 433 H VAL 969 H VAL 969 -1.259 -3.941 -7.586 434 HA VAL 969 HA VAL 969 -1.006 -6.077 -5.839 435 HB VAL 969 HB VAL 969 -3.198 -4.084 -6.391 436 1HG1 VAL 969 1HG1 VAL 969 -3.387 -6.533 -4.858 437 2HG1 VAL 969 2HG1 VAL 969 -3.567 -5.115 -3.798 438 3HG1 VAL 969 3HG1 VAL 969 -4.636 -5.314 -5.208 439 1HG2 VAL 969 1HG2 VAL 969 -0.742 -3.785 -5.196 440 2HG2 VAL 969 2HG2 VAL 969 -2.159 -2.746 -4.909 441 3HG2 VAL 969 3HG2 VAL 969 -1.802 -4.090 -3.798 442 H ASP 970 H ASP 970 -3.137 -5.576 -8.698 443 HA ASP 970 HA ASP 970 -4.855 -7.612 -8.382 444 1HB ASP 970 1HB ASP 970 -4.378 -5.876 -10.365 445 2HB ASP 970 2HB ASP 970 -3.537 -7.238 -11.078 446 H GLU 971 H GLU 971 -1.407 -7.673 -9.369 447 HA GLU 971 HA GLU 971 -1.501 -10.421 -10.107 448 1HB GLU 971 1HB GLU 971 0.709 -8.361 -9.824 449 2HB GLU 971 2HB GLU 971 1.090 -10.047 -10.110 450 1HG GLU 971 1HG GLU 971 -0.778 -9.745 -12.045 451 2HG GLU 971 2HG GLU 971 -0.272 -8.071 -11.926 452 H SER 972 H SER 972 -1.028 -8.542 -7.185 453 HA SER 972 HA SER 972 0.354 -10.674 -5.860 454 1HB SER 972 1HB SER 972 -0.145 -7.843 -5.403 455 2HB SER 972 2HB SER 972 -0.570 -8.754 -3.967 456 HG SER 972 HG SER 972 1.882 -9.438 -5.238 457 H LEU 973 H LEU 973 -2.930 -9.432 -6.309 458 HA LEU 973 HA LEU 973 -4.269 -10.268 -4.125 459 1HB LEU 973 1HB LEU 973 -4.877 -9.475 -6.721 460 2HB LEU 973 2HB LEU 973 -5.648 -11.041 -6.566 461 HG LEU 973 HG LEU 973 -6.326 -8.459 -5.324 462 1HD1 LEU 973 1HD1 LEU 973 -8.482 -9.084 -5.771 463 2HD1 LEU 973 2HD1 LEU 973 -7.615 -10.040 -6.996 464 3HD1 LEU 973 3HD1 LEU 973 -8.165 -10.812 -5.489 465 1HD2 LEU 973 1HD2 LEU 973 -7.433 -9.816 -3.369 466 2HD2 LEU 973 2HD2 LEU 973 -6.083 -10.939 -3.661 467 3HD2 LEU 973 3HD2 LEU 973 -5.753 -9.241 -3.241 468 HA PRO 974 HA PRO 974 -4.198 -14.708 -5.744 469 1HB PRO 974 1HB PRO 974 -2.569 -15.381 -7.832 470 2HB PRO 974 2HB PRO 974 -4.268 -15.000 -8.027 471 1HG PRO 974 1HG PRO 974 -1.909 -13.346 -8.690 472 2HG PRO 974 2HG PRO 974 -3.560 -13.178 -9.252 473 1HD PRO 974 1HD PRO 974 -2.257 -11.584 -7.256 474 2HD PRO 974 2HD PRO 974 -3.940 -11.493 -7.735 475 H VAL 975 H VAL 975 -1.136 -13.049 -5.960 476 HA VAL 975 HA VAL 975 0.557 -15.049 -5.240 477 HB VAL 975 HB VAL 975 0.463 -12.110 -4.617 478 1HG1 VAL 975 1HG1 VAL 975 3.104 -12.943 -4.196 479 2HG1 VAL 975 2HG1 VAL 975 1.952 -12.363 -2.969 480 3HG1 VAL 975 3HG1 VAL 975 2.108 -14.107 -3.291 481 1HG2 VAL 975 1HG2 VAL 975 1.898 -11.847 -6.405 482 2HG2 VAL 975 2HG2 VAL 975 2.561 -13.492 -6.259 483 3HG2 VAL 975 3HG2 VAL 975 0.940 -13.245 -6.949 484 H LEU 976 H LEU 976 -1.853 -13.334 -3.252 485 HA LEU 976 HA LEU 976 -0.965 -14.937 -0.957 486 1HB LEU 976 1HB LEU 976 -2.656 -12.436 -0.931 487 2HB LEU 976 2HB LEU 976 -1.998 -13.289 0.452 488 HG LEU 976 HG LEU 976 -0.647 -11.387 0.174 489 1HD1 LEU 976 1HD1 LEU 976 0.455 -13.827 0.220 490 2HD1 LEU 976 2HD1 LEU 976 1.160 -13.229 -1.302 491 3HD1 LEU 976 3HD1 LEU 976 1.415 -12.328 0.211 492 1HD2 LEU 976 1HD2 LEU 976 -0.160 -12.029 -2.738 493 2HD2 LEU 976 2HD2 LEU 976 -1.461 -10.946 -2.186 494 3HD2 LEU 976 3HD2 LEU 976 0.239 -10.541 -1.846 495 HA PRO 977 HA PRO 977 -4.715 -17.067 -1.081 496 1HB PRO 977 1HB PRO 977 -5.203 -17.622 1.550 497 2HB PRO 977 2HB PRO 977 -4.056 -18.521 0.578 498 1HG PRO 977 1HG PRO 977 -3.530 -16.497 2.667 499 2HG PRO 977 2HG PRO 977 -2.438 -17.693 1.998 500 1HD PRO 977 1HD PRO 977 -2.492 -14.889 1.395 501 2HD PRO 977 2HD PRO 977 -1.478 -16.104 0.641 502 H ALA 978 H ALA 978 -7.039 -17.289 -0.143 503 HA ALA 978 HA ALA 978 -8.083 -14.617 -0.350 504 1HB ALA 978 1HB ALA 978 -9.166 -17.426 -0.315 505 2HB ALA 978 2HB ALA 978 -10.269 -16.067 0.007 506 3HB ALA 978 3HB ALA 978 -9.377 -16.144 -1.532 507 H SER 979 H SER 979 -6.482 -14.581 1.855 508 HA SER 979 HA SER 979 -8.417 -14.801 4.028 509 1HB SER 979 1HB SER 979 -5.711 -15.809 3.792 510 2HB SER 979 2HB SER 979 -5.759 -14.624 5.082 511 HG SER 979 HG SER 979 -6.682 -17.186 5.098 512 H THR 980 H THR 980 -6.305 -12.796 2.108 513 HA THR 980 HA THR 980 -6.723 -10.568 3.993 514 HB THR 980 HB THR 980 -4.348 -11.111 3.856 515 HG1 THR 980 HG1 THR 980 -3.743 -9.046 2.971 516 1HG2 THR 980 1HG2 THR 980 -4.752 -10.947 0.823 517 2HG2 THR 980 2HG2 THR 980 -3.171 -11.041 1.635 518 3HG2 THR 980 3HG2 THR 980 -4.306 -12.409 1.734 519 H HIS 981 H HIS 981 -7.645 -11.959 1.039 520 HA HIS 981 HA HIS 981 -7.741 -9.891 -0.716 521 1HB HIS 981 1HB HIS 981 -9.741 -12.104 -0.200 522 2HB HIS 981 2HB HIS 981 -9.841 -11.022 -1.576 523 HD1 HIS 981 HD1 HIS 981 -9.409 -12.882 -3.315 524 HD2 HIS 981 HD2 HIS 981 -6.339 -12.463 -0.488 525 HE1 HIS 981 HE1 HIS 981 -7.448 -14.267 -4.179 526 H ARG 982 H ARG 982 -10.350 -10.764 1.668 527 HA ARG 982 HA ARG 982 -12.048 -8.779 1.185 528 1HB ARG 982 1HB ARG 982 -11.384 -10.481 3.470 529 2HB ARG 982 2HB ARG 982 -11.913 -8.909 4.036 530 1HG ARG 982 1HG ARG 982 -13.960 -9.099 2.580 531 2HG ARG 982 2HG ARG 982 -13.436 -10.694 2.077 532 1HD ARG 982 1HD ARG 982 -13.564 -10.232 5.039 533 2HD ARG 982 2HD ARG 982 -15.103 -10.262 4.202 534 HE ARG 982 HE ARG 982 -13.263 -12.523 4.569 535 1HH1 ARG 982 2HH2 ARG 982 -15.972 -11.257 2.714 536 2HH1 ARG 982 1HH2 ARG 982 -16.518 -12.820 2.204 537 1HH2 ARG 982 2HH1 ARG 982 -13.983 -14.585 3.895 538 2HH2 ARG 982 1HH1 ARG 982 -15.379 -14.725 2.880 539 H GLU 983 H GLU 983 -9.649 -8.544 3.921 540 HA GLU 983 HA GLU 983 -9.945 -5.900 4.383 541 1HB GLU 983 1HB GLU 983 -7.758 -7.895 4.824 542 2HB GLU 983 2HB GLU 983 -7.305 -6.210 4.990 543 1HG GLU 983 1HG GLU 983 -8.894 -5.828 6.741 544 2HG GLU 983 2HG GLU 983 -9.796 -7.282 6.362 545 H ILE 984 H ILE 984 -7.668 -7.501 2.065 546 HA ILE 984 HA ILE 984 -6.288 -5.284 1.238 547 HB ILE 984 HB ILE 984 -7.016 -7.907 0.041 548 1HG1 ILE 984 1HG1 ILE 984 -4.317 -6.587 0.402 549 2HG1 ILE 984 2HG1 ILE 984 -5.117 -7.479 1.681 550 1HG2 ILE 984 1HG2 ILE 984 -5.659 -7.305 -1.996 551 2HG2 ILE 984 2HG2 ILE 984 -7.280 -6.576 -1.908 552 3HG2 ILE 984 3HG2 ILE 984 -5.843 -5.600 -1.522 553 1HD1 ILE 984 1HD1 ILE 984 -5.360 -9.362 -0.193 554 2HD1 ILE 984 2HD1 ILE 984 -3.990 -8.493 -0.925 555 3HD1 ILE 984 3HD1 ILE 984 -3.839 -9.174 0.712 556 H GLU 985 H GLU 985 -9.436 -6.577 -0.008 557 HA GLU 985 HA GLU 985 -9.798 -4.803 -2.022 558 1HB GLU 985 1HB GLU 985 -11.275 -6.812 -0.915 559 2HB GLU 985 2HB GLU 985 -12.212 -5.434 -0.373 560 1HG GLU 985 1HG GLU 985 -11.371 -5.299 -3.228 561 2HG GLU 985 2HG GLU 985 -12.456 -6.624 -2.858 562 H MET 986 H MET 986 -10.727 -4.426 1.464 563 HA MET 986 HA MET 986 -11.748 -1.834 1.044 564 1HB MET 986 1HB MET 986 -11.190 -3.694 3.335 565 2HB MET 986 2HB MET 986 -11.206 -1.993 3.757 566 1HG MET 986 1HG MET 986 -13.475 -1.795 3.427 567 2HG MET 986 2HG MET 986 -13.459 -2.804 1.993 568 1HE MET 986 1HE MET 986 -12.866 -5.572 2.296 569 2HE MET 986 2HE MET 986 -14.299 -6.242 3.111 570 3HE MET 986 3HE MET 986 -14.487 -4.953 1.898 571 H ALA 987 H ALA 987 -8.557 -3.197 1.725 572 HA ALA 987 HA ALA 987 -7.390 -0.888 2.830 573 1HB ALA 987 1HB ALA 987 -6.622 -3.405 2.723 574 2HB ALA 987 2HB ALA 987 -5.869 -2.909 1.188 575 3HB ALA 987 3HB ALA 987 -5.404 -2.107 2.707 576 H GLN 988 H GLN 988 -7.933 -2.067 -0.515 577 HA GLN 988 HA GLN 988 -6.274 -0.171 -1.715 578 1HB GLN 988 1HB GLN 988 -8.559 -1.910 -2.686 579 2HB GLN 988 2HB GLN 988 -7.826 -0.736 -3.761 580 1HG GLN 988 1HG GLN 988 -5.704 -2.174 -2.419 581 2HG GLN 988 2HG GLN 988 -6.845 -3.346 -3.048 582 1HE2 GLN 988 1HE2 GLN 988 -7.213 -3.528 -5.235 583 2HE2 GLN 988 2HE2 GLN 988 -6.188 -2.825 -6.441 584 H LYS 989 H LYS 989 -9.801 -0.246 -0.941 585 HA LYS 989 HA LYS 989 -10.361 2.221 -2.190 586 1HB LYS 989 1HB LYS 989 -11.774 0.165 -0.725 587 2HB LYS 989 2HB LYS 989 -12.258 1.749 -0.153 588 1HG LYS 989 1HG LYS 989 -13.433 2.155 -2.052 589 2HG LYS 989 2HG LYS 989 -12.040 1.802 -3.055 590 1HD LYS 989 1HD LYS 989 -12.824 -0.267 -3.588 591 2HD LYS 989 2HD LYS 989 -13.139 -0.662 -1.910 592 1HE LYS 989 1HE LYS 989 -15.359 -0.056 -2.039 593 2HE LYS 989 2HE LYS 989 -15.032 1.326 -3.067 594 1HZ LYS 989 1HZ LYS 989 -16.231 -0.549 -4.128 595 2HZ LYS 989 2HZ LYS 989 -14.895 -0.065 -4.932 596 3HZ LYS 989 3HZ LYS 989 -14.862 -1.435 -4.043 597 H LEU 990 H LEU 990 -9.023 1.261 0.942 598 HA LEU 990 HA LEU 990 -9.571 3.685 2.274 599 1HB LEU 990 1HB LEU 990 -8.675 1.217 2.980 600 2HB LEU 990 2HB LEU 990 -7.186 2.138 3.059 601 HG LEU 990 HG LEU 990 -9.747 2.810 4.537 602 1HD1 LEU 990 1HD1 LEU 990 -9.061 1.056 5.788 603 2HD1 LEU 990 2HD1 LEU 990 -7.373 1.168 5.232 604 3HD1 LEU 990 3HD1 LEU 990 -7.974 2.281 6.485 605 1HD2 LEU 990 1HD2 LEU 990 -7.327 4.349 4.001 606 2HD2 LEU 990 2HD2 LEU 990 -8.895 4.864 4.668 607 3HD2 LEU 990 3HD2 LEU 990 -7.656 4.170 5.741 608 H LEU 991 H LEU 991 -6.556 2.404 0.697 609 HA LEU 991 HA LEU 991 -5.069 4.713 1.030 610 1HB LEU 991 1HB LEU 991 -4.000 2.688 0.476 611 2HB LEU 991 2HB LEU 991 -4.973 2.462 -0.963 612 HG LEU 991 HG LEU 991 -3.822 4.201 -2.135 613 1HD1 LEU 991 1HD1 LEU 991 -3.241 6.007 -0.955 614 2HD1 LEU 991 2HD1 LEU 991 -3.083 5.084 0.559 615 3HD1 LEU 991 3HD1 LEU 991 -1.734 5.128 -0.601 616 1HD2 LEU 991 1HD2 LEU 991 -1.606 3.304 -2.282 617 2HD2 LEU 991 2HD2 LEU 991 -1.718 2.613 -0.646 618 3HD2 LEU 991 3HD2 LEU 991 -2.730 1.962 -1.958 619 H ASN 992 H ASN 992 -6.900 3.632 -1.923 620 HA ASN 992 HA ASN 992 -6.486 5.748 -3.479 621 1HB ASN 992 1HB ASN 992 -7.975 3.657 -3.877 622 2HB ASN 992 2HB ASN 992 -9.273 4.546 -3.107 623 1HD2 ASN 992 1HD2 ASN 992 -8.505 3.580 -5.939 624 2HD2 ASN 992 2HD2 ASN 992 -8.863 4.927 -6.967 625 H SER 993 H SER 993 -8.946 5.408 -0.833 626 HA SER 993 HA SER 993 -10.358 7.667 -1.167 627 1HB SER 993 1HB SER 993 -9.912 5.769 0.917 628 2HB SER 993 2HB SER 993 -9.761 7.349 1.660 629 HG SER 993 HG SER 993 -11.853 7.912 0.918 630 H ASP 994 H ASP 994 -7.734 7.503 1.346 631 HA ASP 994 HA ASP 994 -7.474 10.149 1.718 632 1HB ASP 994 1HB ASP 994 -5.531 7.837 1.866 633 2HB ASP 994 2HB ASP 994 -4.913 9.457 2.116 634 H LEU 995 H LEU 995 -6.217 8.087 -0.916 635 HA LEU 995 HA LEU 995 -4.268 9.791 -1.929 636 1HB LEU 995 1HB LEU 995 -4.006 7.876 -3.002 637 2HB LEU 995 2HB LEU 995 -5.659 7.376 -2.701 638 HG LEU 995 HG LEU 995 -6.447 8.527 -4.670 639 1HD1 LEU 995 1HD1 LEU 995 -5.441 10.325 -5.482 640 2HD1 LEU 995 2HD1 LEU 995 -4.086 10.088 -4.354 641 3HD1 LEU 995 3HD1 LEU 995 -4.042 9.337 -5.967 642 1HD2 LEU 995 1HD2 LEU 995 -4.445 7.397 -6.254 643 2HD2 LEU 995 2HD2 LEU 995 -4.428 6.446 -4.749 644 3HD2 LEU 995 3HD2 LEU 995 -5.937 6.614 -5.679 645 H ALA 996 H ALA 996 -7.701 9.352 -3.056 646 HA ALA 996 HA ALA 996 -7.697 11.438 -4.851 647 1HB ALA 996 1HB ALA 996 -10.131 11.306 -4.672 648 2HB ALA 996 2HB ALA 996 -9.438 9.668 -4.604 649 3HB ALA 996 3HB ALA 996 -9.998 10.460 -3.112 650 H GLU 997 H GLU 997 -8.752 11.455 -1.371 651 HA GLU 997 HA GLU 997 -9.403 14.094 -1.250 652 1HB GLU 997 1HB GLU 997 -9.775 12.319 0.519 653 2HB GLU 997 2HB GLU 997 -8.091 12.475 0.976 654 1HG GLU 997 1HG GLU 997 -9.126 13.947 2.485 655 2HG GLU 997 2HG GLU 997 -8.627 15.043 1.213 656 H LEU 998 H LEU 998 -6.248 12.598 -1.543 657 HA LEU 998 HA LEU 998 -4.723 14.666 -0.389 658 1HB LEU 998 1HB LEU 998 -4.163 12.194 -1.051 659 2HB LEU 998 2HB LEU 998 -3.720 12.904 -2.591 660 HG LEU 998 HG LEU 998 -2.533 14.367 -0.368 661 1HD1 LEU 998 1HD1 LEU 998 -1.338 11.644 -0.621 662 2HD1 LEU 998 2HD1 LEU 998 -1.308 12.794 0.738 663 3HD1 LEU 998 3HD1 LEU 998 -2.775 11.841 0.411 664 1HD2 LEU 998 1HD2 LEU 998 -1.231 12.850 -2.643 665 2HD2 LEU 998 2HD2 LEU 998 -1.895 14.496 -2.778 666 3HD2 LEU 998 3HD2 LEU 998 -0.535 14.173 -1.677 667 H ILE 999 H ILE 999 -5.778 13.946 -3.776 668 HA ILE 999 HA ILE 999 -4.470 16.149 -4.906 669 HB ILE 999 HB ILE 999 -6.800 14.447 -5.768 670 1HG1 ILE 999 1HG1 ILE 999 -4.818 13.965 -7.529 671 2HG1 ILE 999 2HG1 ILE 999 -3.846 14.400 -6.138 672 1HG2 ILE 999 1HG2 ILE 999 -7.341 15.922 -7.331 673 2HG2 ILE 999 2HG2 ILE 999 -6.051 17.023 -6.793 674 3HG2 ILE 999 3HG2 ILE 999 -5.702 15.771 -8.009 675 1HD1 ILE 999 1HD1 ILE 999 -4.444 12.522 -4.956 676 2HD1 ILE 999 2HD1 ILE 999 -6.121 12.560 -5.552 677 3HD1 ILE 999 3HD1 ILE 999 -4.829 11.885 -6.573 678 H ASN1000 H ASN1000 -7.978 15.693 -4.056 679 HA ASN1000 HA ASN1000 -8.867 18.134 -4.651 680 1HB ASN1000 1HB ASN1000 -10.170 16.172 -3.636 681 2HB ASN1000 2HB ASN1000 -9.576 16.660 -2.061 682 1HD2 ASN1000 1HD2 ASN1000 -11.908 17.105 -4.465 683 2HD2 ASN1000 2HD2 ASN1000 -12.742 18.480 -3.821 684 H LYS1001 H LYS1001 -7.137 17.063 -1.655 685 HA LYS1001 HA LYS1001 -7.367 19.489 -0.273 686 1HB LYS1001 1HB LYS1001 -5.679 17.025 -0.049 687 2HB LYS1001 2HB LYS1001 -5.204 18.445 0.861 688 1HG LYS1001 1HG LYS1001 -8.074 17.442 0.931 689 2HG LYS1001 2HG LYS1001 -6.854 16.741 1.975 690 1HD LYS1001 1HD LYS1001 -6.368 18.953 2.965 691 2HD LYS1001 2HD LYS1001 -7.476 19.729 1.851 692 1HE LYS1001 1HE LYS1001 -9.120 17.801 2.956 693 2HE LYS1001 2HE LYS1001 -8.061 18.145 4.310 694 1HZ LYS1001 1HZ LYS1001 -8.547 20.530 3.870 695 2HZ LYS1001 2HZ LYS1001 -9.709 20.060 2.823 696 3HZ LYS1001 3HZ LYS1001 -9.822 19.659 4.403 697 H MET1002 H MET1002 -4.419 18.102 -1.894 698 HA MET1002 HA MET1002 -2.944 20.376 -1.779 699 1HB MET1002 1HB MET1002 -1.470 19.178 -3.154 700 2HB MET1002 2HB MET1002 -2.539 17.864 -2.706 701 1HG MET1002 1HG MET1002 -2.556 17.615 -5.026 702 2HG MET1002 2HG MET1002 -3.940 18.674 -4.833 703 1HE MET1002 1HE MET1002 -3.386 18.646 -7.277 704 2HE MET1002 2HE MET1002 -2.647 20.094 -8.003 705 3HE MET1002 3HE MET1002 -1.663 18.637 -7.723 706 H LYS1003 H LYS1003 -5.672 19.617 -3.878 707 HA LYS1003 HA LYS1003 -5.113 21.342 -5.991 708 1HB LYS1003 1HB LYS1003 -7.373 19.790 -4.986 709 2HB LYS1003 2HB LYS1003 -7.887 21.301 -5.710 710 1HG LYS1003 1HG LYS1003 -6.127 20.604 -7.614 711 2HG LYS1003 2HG LYS1003 -6.404 18.995 -6.977 712 1HD LYS1003 1HD LYS1003 -8.017 19.279 -8.731 713 2HD LYS1003 2HD LYS1003 -8.918 19.427 -7.235 714 1HE LYS1003 1HE LYS1003 -9.448 21.619 -7.628 715 2HE LYS1003 2HE LYS1003 -7.822 22.017 -8.148 716 1HZ LYS1003 1HZ LYS1003 -9.090 20.342 -10.020 717 2HZ LYS1003 2HZ LYS1003 -9.997 21.671 -9.745 718 3HZ LYS1003 3HZ LYS1003 -8.448 21.828 -10.238 719 H LEU1004 H LEU1004 -6.727 21.875 -2.810 720 HA LEU1004 HA LEU1004 -7.231 24.627 -3.433 721 1HB LEU1004 1HB LEU1004 -7.372 23.366 -0.709 722 2HB LEU1004 2HB LEU1004 -8.263 24.741 -1.332 723 HG LEU1004 HG LEU1004 -8.629 21.883 -2.273 724 1HD1 LEU1004 1HD1 LEU1004 -10.960 22.649 -1.007 725 2HD1 LEU1004 2HD1 LEU1004 -9.705 21.574 -0.344 726 3HD1 LEU1004 3HD1 LEU1004 -9.688 23.311 0.047 727 1HD2 LEU1004 1HD2 LEU1004 -9.870 22.678 -3.930 728 2HD2 LEU1004 2HD2 LEU1004 -10.858 23.622 -2.790 729 3HD2 LEU1004 3HD2 LEU1004 -9.374 24.326 -3.476 730 H ALA1005 H ALA1005 -4.676 22.684 -1.939 731 HA ALA1005 HA ALA1005 -3.430 24.621 -0.415 732 1HB ALA1005 1HB ALA1005 -2.844 22.253 -0.344 733 2HB ALA1005 2HB ALA1005 -2.279 22.311 -2.031 734 3HB ALA1005 3HB ALA1005 -1.401 23.205 -0.767 735 H GLN1006 H GLN1006 -3.679 24.225 -3.917 736 HA GLN1006 HA GLN1006 -1.544 26.129 -4.313 737 1HB GLN1006 1HB GLN1006 -2.224 23.924 -5.740 738 2HB GLN1006 2HB GLN1006 -3.179 25.108 -6.611 739 1HG GLN1006 1HG GLN1006 -0.949 26.538 -6.602 740 2HG GLN1006 2HG GLN1006 -0.169 25.008 -6.249 741 1HE2 GLN1006 1HE2 GLN1006 -2.402 26.619 -8.471 742 2HE2 GLN1006 2HE2 GLN1006 -2.018 25.702 -9.889 743 H GLN1007 H GLN1007 -4.990 25.987 -3.947 744 HA GLN1007 HA GLN1007 -5.297 28.507 -5.353 745 1HB GLN1007 1HB GLN1007 -6.865 26.373 -5.571 746 2HB GLN1007 2HB GLN1007 -7.589 26.989 -4.099 747 1HG GLN1007 1HG GLN1007 -7.151 29.048 -6.208 748 2HG GLN1007 2HG GLN1007 -8.290 27.792 -6.650 749 1HE2 GLN1007 1HE2 GLN1007 -8.510 30.703 -5.905 750 2HE2 GLN1007 2HE2 GLN1007 -9.744 30.785 -4.692 751 H TYR1008 H TYR1008 -4.389 27.456 -2.345 752 HA TYR1008 HA TYR1008 -5.859 29.599 -0.968 753 1HB TYR1008 1HB TYR1008 -4.689 26.871 -0.317 754 2HB TYR1008 2HB TYR1008 -4.643 28.061 0.969 755 HD1 TYR1008 HD1 TYR1008 -7.170 26.958 -1.594 756 HD2 TYR1008 HD2 TYR1008 -6.352 27.850 2.510 757 HE1 TYR1008 HE1 TYR1008 -9.575 26.404 -0.987 758 HE2 TYR1008 HE2 TYR1008 -8.761 27.292 3.103 759 HH TYR1008 HH TYR1008 -10.591 25.620 1.812 760 H VAL1009 H VAL1009 -2.793 28.607 -2.245 761 HA VAL1009 HA VAL1009 -1.128 29.875 -0.353 762 HB VAL1009 HB VAL1009 -0.199 28.206 -1.717 763 1HG1 VAL1009 1HG1 VAL1009 -0.080 28.648 -4.293 764 2HG1 VAL1009 2HG1 VAL1009 -1.563 27.968 -3.581 765 3HG1 VAL1009 3HG1 VAL1009 -1.485 29.699 -3.993 766 1HG2 VAL1009 1HG2 VAL1009 1.652 29.351 -2.892 767 2HG2 VAL1009 2HG2 VAL1009 0.772 30.892 -2.751 768 3HG2 VAL1009 3HG2 VAL1009 1.335 30.052 -1.286 769 H MET1010 H MET1010 -3.127 30.984 -3.040 770 HA MET1010 HA MET1010 -2.045 33.151 -3.993 771 1HB MET1010 1HB MET1010 -4.505 34.211 -3.392 772 2HB MET1010 2HB MET1010 -4.276 33.003 -4.641 773 1HG MET1010 1HG MET1010 -5.222 31.302 -3.375 774 2HG MET1010 2HG MET1010 -4.614 31.939 -1.859 775 1HE MET1010 1HE MET1010 -6.756 34.131 -0.404 776 2HE MET1010 2HE MET1010 -7.398 32.476 -0.278 777 3HE MET1010 3HE MET1010 -5.641 32.745 -0.352 778 H THR1011 H THR1011 -3.396 32.941 -0.646 779 HA THR1011 HA THR1011 -2.349 35.625 -0.110 780 HB THR1011 HB THR1011 -4.740 35.096 0.441 781 HG1 THR1011 HG1 THR1011 -2.885 35.237 2.714 782 1HG2 THR1011 1HG2 THR1011 -3.589 33.254 2.587 783 2HG2 THR1011 2HG2 THR1011 -5.301 33.513 2.174 784 3HG2 THR1011 3HG2 THR1011 -4.241 32.619 1.058 785 H SER1012 H SER1012 -2.354 32.317 1.388 786 HA SER1012 HA SER1012 0.166 31.829 1.647 787 1HB SER1012 1HB SER1012 0.973 33.842 2.531 788 2HB SER1012 2HB SER1012 -0.455 34.114 3.510 789 HG SER1012 HG SER1012 0.284 32.739 5.078 790 H LEU1013 H LEU1013 -2.450 30.651 1.842 791 HA LEU1013 HA LEU1013 -2.785 29.817 4.582 792 1HB LEU1013 1HB LEU1013 -4.339 29.842 2.133 793 2HB LEU1013 2HB LEU1013 -4.418 28.278 2.920 794 HG LEU1013 HG LEU1013 -6.242 29.881 3.536 795 1HD1 LEU1013 1HD1 LEU1013 -6.153 28.172 5.047 796 2HD1 LEU1013 2HD1 LEU1013 -4.468 28.511 5.510 797 3HD1 LEU1013 3HD1 LEU1013 -5.783 29.542 6.123 798 1HD2 LEU1013 1HD2 LEU1013 -4.179 31.327 5.200 799 2HD2 LEU1013 2HD2 LEU1013 -4.661 31.881 3.579 800 3HD2 LEU1013 3HD2 LEU1013 -5.872 31.775 4.879 801 H GLN1014 H GLN1014 -0.994 28.862 1.760 802 HA GLN1014 HA GLN1014 -0.914 26.238 1.720 803 1HB GLN1014 1HB GLN1014 0.681 28.157 0.707 804 2HB GLN1014 2HB GLN1014 1.774 27.570 1.944 805 1HG GLN1014 1HG GLN1014 1.068 25.173 0.967 806 2HG GLN1014 2HG GLN1014 0.665 26.112 -0.457 807 1HE2 GLN1014 1HE2 GLN1014 2.255 25.387 -1.759 808 2HE2 GLN1014 2HE2 GLN1014 3.944 25.693 -1.531 809 H GLN1015 H GLN1015 1.358 28.055 3.916 810 HA GLN1015 HA GLN1015 2.415 26.122 5.307 811 1HB GLN1015 1HB GLN1015 2.415 27.632 7.306 812 2HB GLN1015 2HB GLN1015 2.843 28.462 5.823 813 1HG GLN1015 1HG GLN1015 1.243 29.973 6.440 814 2HG GLN1015 2HG GLN1015 0.107 28.796 5.812 815 1HE2 GLN1015 1HE2 GLN1015 -1.152 30.131 7.452 816 2HE2 GLN1015 2HE2 GLN1015 -1.271 29.497 9.059 817 H GLU1016 H GLU1016 -1.004 27.151 5.576 818 HA GLU1016 HA GLU1016 -1.509 25.550 7.842 819 1HB GLU1016 1HB GLU1016 -2.806 27.633 6.892 820 2HB GLU1016 2HB GLU1016 -3.636 26.463 5.886 821 1HG GLU1016 1HG GLU1016 -4.403 25.217 7.861 822 2HG GLU1016 2HG GLU1016 -3.437 26.223 8.923 823 H TYR1017 H TYR1017 -2.808 25.282 4.448 824 HA TYR1017 HA TYR1017 -3.688 22.661 4.743 825 1HB TYR1017 1HB TYR1017 -2.895 24.602 2.537 826 2HB TYR1017 2HB TYR1017 -3.179 22.939 2.064 827 HD1 TYR1017 HD1 TYR1017 -4.853 25.554 4.187 828 HD2 TYR1017 HD2 TYR1017 -5.302 22.435 1.293 829 HE1 TYR1017 HE1 TYR1017 -7.353 26.005 4.078 830 HE2 TYR1017 HE2 TYR1017 -7.800 22.897 1.193 831 HH TYR1017 HH TYR1017 -9.356 24.895 3.493 832 H LYS1018 H LYS1018 -0.471 23.894 4.574 833 HA LYS1018 HA LYS1018 0.704 21.736 3.163 834 1HB LYS1018 1HB LYS1018 2.011 23.629 3.113 835 2HB LYS1018 2HB LYS1018 1.660 24.066 4.773 836 1HG LYS1018 1HG LYS1018 3.959 23.294 4.694 837 2HG LYS1018 2HG LYS1018 3.026 22.079 5.543 838 1HD LYS1018 1HD LYS1018 2.875 21.391 2.773 839 2HD LYS1018 2HD LYS1018 4.548 21.817 3.073 840 1HE LYS1018 1HE LYS1018 3.283 20.093 5.164 841 2HE LYS1018 2HE LYS1018 3.479 19.339 3.595 842 1HZ LYS1018 1HZ LYS1018 5.549 19.002 4.250 843 2HZ LYS1018 2HZ LYS1018 5.829 20.590 3.991 844 3HZ LYS1018 3HZ LYS1018 5.460 20.059 5.491 845 H LYS1019 H LYS1019 0.564 22.599 6.692 846 HA LYS1019 HA LYS1019 1.765 20.265 7.581 847 1HB LYS1019 1HB LYS1019 -0.236 22.092 8.942 848 2HB LYS1019 2HB LYS1019 0.679 20.841 9.758 849 1HG LYS1019 1HG LYS1019 1.869 23.211 8.239 850 2HG LYS1019 2HG LYS1019 1.788 23.052 9.983 851 1HD LYS1019 1HD LYS1019 3.801 22.010 9.916 852 2HD LYS1019 2HD LYS1019 3.017 20.655 9.128 853 1HE LYS1019 1HE LYS1019 3.908 21.171 7.081 854 2HE LYS1019 2HE LYS1019 3.579 22.883 7.263 855 1HZ LYS1019 1HZ LYS1019 5.493 22.809 8.911 856 2HZ LYS1019 2HZ LYS1019 5.885 21.378 8.229 857 3HZ LYS1019 3HZ LYS1019 5.857 22.734 7.321 858 H GLN1020 H GLN1020 -1.574 20.973 6.556 859 HA GLN1020 HA GLN1020 -2.726 18.711 7.684 860 1HB GLN1020 1HB GLN1020 -3.563 20.221 5.168 861 2HB GLN1020 2HB GLN1020 -4.585 19.144 6.099 862 1HG GLN1020 1HG GLN1020 -3.275 21.653 7.247 863 2HG GLN1020 2HG GLN1020 -4.910 21.609 6.620 864 1HE2 GLN1020 1HE2 GLN1020 -3.806 22.112 9.321 865 2HE2 GLN1020 2HE2 GLN1020 -4.613 21.020 10.397 866 H MET1021 H MET1021 -1.556 19.348 4.298 867 HA MET1021 HA MET1021 -2.122 17.006 3.157 868 1HB MET1021 1HB MET1021 -0.184 19.166 2.808 869 2HB MET1021 2HB MET1021 0.582 17.648 2.385 870 1HG MET1021 1HG MET1021 -2.082 18.645 1.260 871 2HG MET1021 2HG MET1021 -0.546 18.706 0.418 872 1HE MET1021 1HE MET1021 0.375 15.395 1.812 873 2HE MET1021 2HE MET1021 0.476 15.049 0.069 874 3HE MET1021 3HE MET1021 1.010 16.627 0.696 875 H LEU1022 H LEU1022 0.555 17.668 5.457 876 HA LEU1022 HA LEU1022 1.884 15.224 5.087 877 1HB LEU1022 1HB LEU1022 2.884 17.221 6.083 878 2HB LEU1022 2HB LEU1022 1.808 17.091 7.461 879 HG LEU1022 HG LEU1022 4.096 16.287 7.925 880 1HD1 LEU1022 1HD1 LEU1022 1.781 15.268 8.834 881 2HD1 LEU1022 2HD1 LEU1022 2.495 13.797 8.132 882 3HD1 LEU1022 3HD1 LEU1022 3.381 14.709 9.378 883 1HD2 LEU1022 1HD2 LEU1022 4.091 15.218 5.443 884 2HD2 LEU1022 2HD2 LEU1022 5.199 14.717 6.743 885 3HD2 LEU1022 3HD2 LEU1022 3.728 13.770 6.413 886 H THR1023 H THR1023 -0.663 16.308 7.419 887 HA THR1023 HA THR1023 -0.851 14.153 9.034 888 HB THR1023 HB THR1023 -3.334 15.408 7.810 889 HG1 THR1023 HG1 THR1023 -1.289 16.527 9.597 890 1HG2 THR1023 1HG2 THR1023 -3.031 13.842 10.036 891 2HG2 THR1023 2HG2 THR1023 -2.680 15.439 10.738 892 3HG2 THR1023 3HG2 THR1023 -4.240 15.145 9.934 893 H ALA1024 H ALA1024 -2.272 14.401 5.718 894 HA ALA1024 HA ALA1024 -3.452 11.867 5.778 895 1HB ALA1024 1HB ALA1024 -2.478 12.830 3.161 896 2HB ALA1024 2HB ALA1024 -4.134 12.467 3.702 897 3HB ALA1024 3HB ALA1024 -3.399 14.043 4.083 898 H ALA1025 H ALA1025 -0.279 13.004 4.420 899 HA ALA1025 HA ALA1025 0.655 10.676 3.413 900 1HB ALA1025 1HB ALA1025 1.906 13.052 4.761 901 2HB ALA1025 2HB ALA1025 2.938 11.655 4.373 902 3HB ALA1025 3HB ALA1025 2.049 12.492 3.078 903 H HIS1026 H HIS1026 0.333 11.626 6.846 904 HA HIS1026 HA HIS1026 1.910 9.564 7.883 905 1HB HIS1026 1HB HIS1026 0.881 11.753 8.939 906 2HB HIS1026 2HB HIS1026 -0.442 10.688 9.368 907 HD1 HIS1026 HD1 HIS1026 1.607 12.060 11.413 908 HD2 HIS1026 HD2 HIS1026 1.712 8.084 10.081 909 HE1 HIS1026 HE1 HIS1026 2.883 10.744 13.189 910 H ALA1027 H ALA1027 -1.696 9.858 7.511 911 HA ALA1027 HA ALA1027 -2.190 7.220 8.342 912 1HB ALA1027 1HB ALA1027 -3.981 8.746 8.490 913 2HB ALA1027 2HB ALA1027 -3.734 9.340 6.831 914 3HB ALA1027 3HB ALA1027 -4.419 7.720 7.103 915 H LEU1028 H LEU1028 -1.448 8.744 5.187 916 HA LEU1028 HA LEU1028 -2.183 6.618 3.558 917 1HB LEU1028 1HB LEU1028 -0.303 8.931 3.337 918 2HB LEU1028 2HB LEU1028 -0.254 7.678 2.112 919 HG LEU1028 HG LEU1028 -2.533 9.529 2.805 920 1HD1 LEU1028 1HD1 LEU1028 -1.085 10.540 1.261 921 2HD1 LEU1028 2HD1 LEU1028 -0.846 9.028 0.354 922 3HD1 LEU1028 3HD1 LEU1028 -2.409 9.876 0.274 923 1HD2 LEU1028 1HD2 LEU1028 -2.639 6.906 1.327 924 2HD2 LEU1028 2HD2 LEU1028 -3.710 7.525 2.607 925 3HD2 LEU1028 3HD2 LEU1028 -3.781 8.224 0.971 926 H ALA1029 H ALA1029 1.182 7.483 4.640 927 HA ALA1029 HA ALA1029 2.525 5.342 3.791 928 1HB ALA1029 1HB ALA1029 2.796 6.487 6.596 929 2HB ALA1029 2HB ALA1029 4.072 5.740 5.605 930 3HB ALA1029 3HB ALA1029 3.376 7.307 5.127 931 H VAL1030 H VAL1030 0.311 5.459 6.627 932 HA VAL1030 HA VAL1030 0.897 2.779 7.396 933 HB VAL1030 HB VAL1030 -1.065 4.904 8.171 934 1HG1 VAL1030 1HG1 VAL1030 -1.559 2.880 9.982 935 2HG1 VAL1030 2HG1 VAL1030 -2.627 3.359 8.642 936 3HG1 VAL1030 3HG1 VAL1030 -1.487 2.009 8.432 937 1HG2 VAL1030 1HG2 VAL1030 0.078 3.936 10.454 938 2HG2 VAL1030 2HG2 VAL1030 1.374 3.647 9.269 939 3HG2 VAL1030 3HG2 VAL1030 0.724 5.288 9.494 940 H ASP1031 H ASP1031 -1.930 4.416 5.802 941 HA ASP1031 HA ASP1031 -3.554 2.369 5.434 942 1HB ASP1031 1HB ASP1031 -2.731 4.423 3.328 943 2HB ASP1031 2HB ASP1031 -4.162 3.420 3.199 944 H ALA1032 H ALA1032 -0.847 3.290 3.163 945 HA ALA1032 HA ALA1032 -1.111 1.138 1.440 946 1HB ALA1032 1HB ALA1032 0.203 2.970 0.739 947 2HB ALA1032 2HB ALA1032 1.173 2.962 2.231 948 3HB ALA1032 3HB ALA1032 1.391 1.676 1.020 949 H LYS1033 H LYS1033 0.556 1.474 4.595 950 HA LYS1033 HA LYS1033 1.953 -0.970 4.410 951 1HB LYS1033 1HB LYS1033 2.393 1.059 5.927 952 2HB LYS1033 2HB LYS1033 1.135 0.420 6.965 953 1HG LYS1033 1HG LYS1033 3.364 -1.412 6.038 954 2HG LYS1033 2HG LYS1033 3.668 -0.286 7.346 955 1HD LYS1033 1HD LYS1033 1.345 -1.286 8.274 956 2HD LYS1033 2HD LYS1033 1.794 -2.648 7.267 957 1HE LYS1033 1HE LYS1033 2.997 -3.323 9.097 958 2HE LYS1033 2HE LYS1033 4.190 -2.172 8.530 959 1HZ LYS1033 1HZ LYS1033 2.138 -1.742 10.576 960 2HZ LYS1033 2HZ LYS1033 3.760 -1.651 10.744 961 3HZ LYS1033 3HZ LYS1033 2.961 -0.503 9.901 962 H ASN1034 H ASN1034 -1.026 -0.044 6.283 963 HA ASN1034 HA ASN1034 -1.668 -2.400 7.305 964 1HB ASN1034 1HB ASN1034 -2.972 -0.060 7.150 965 2HB ASN1034 2HB ASN1034 -3.863 -0.866 5.875 966 1HD2 ASN1034 1HD2 ASN1034 -5.487 -0.258 7.662 967 2HD2 ASN1034 2HD2 ASN1034 -5.891 -1.507 8.793 968 H LEU1035 H LEU1035 -1.889 -1.364 3.890 969 HA LEU1035 HA LEU1035 -3.578 -3.361 2.936 970 1HB LEU1035 1HB LEU1035 -2.813 -1.229 1.815 971 2HB LEU1035 2HB LEU1035 -1.310 -2.049 1.441 972 HG LEU1035 HG LEU1035 -3.898 -3.321 0.613 973 1HD1 LEU1035 1HD1 LEU1035 -2.966 -1.790 -1.578 974 2HD1 LEU1035 2HD1 LEU1035 -4.512 -1.650 -0.707 975 3HD1 LEU1035 3HD1 LEU1035 -3.109 -0.684 -0.190 976 1HD2 LEU1035 1HD2 LEU1035 -1.026 -3.402 -0.253 977 2HD2 LEU1035 2HD2 LEU1035 -2.141 -4.735 0.133 978 3HD2 LEU1035 3HD2 LEU1035 -2.315 -3.843 -1.398 979 H LEU1036 H LEU1036 0.034 -3.227 2.535 980 HA LEU1036 HA LEU1036 0.214 -5.935 1.870 981 1HB LEU1036 1HB LEU1036 1.851 -3.764 1.778 982 2HB LEU1036 2HB LEU1036 2.562 -4.653 3.110 983 HG LEU1036 HG LEU1036 2.183 -6.610 1.171 984 1HD1 LEU1036 1HD1 LEU1036 2.700 -5.848 -0.924 985 2HD1 LEU1036 2HD1 LEU1036 1.752 -4.470 -0.315 986 3HD1 LEU1036 3HD1 LEU1036 3.530 -4.395 -0.319 987 1HD2 LEU1036 1HD2 LEU1036 4.438 -5.136 2.381 988 2HD2 LEU1036 2HD2 LEU1036 4.157 -6.886 2.211 989 3HD2 LEU1036 3HD2 LEU1036 4.795 -5.949 0.839 990 H ASP1037 H ASP1037 0.424 -4.164 4.989 991 HA ASP1037 HA ASP1037 1.471 -5.986 6.606 992 1HB ASP1037 1HB ASP1037 0.114 -3.672 6.983 993 2HB ASP1037 2HB ASP1037 -1.140 -4.780 7.505 994 H VAL1038 H VAL1038 -1.950 -5.853 5.398 995 HA VAL1038 HA VAL1038 -2.823 -8.118 6.829 996 HB VAL1038 HB VAL1038 -3.876 -6.799 4.318 997 1HG1 VAL1038 1HG1 VAL1038 -5.711 -8.128 4.371 998 2HG1 VAL1038 2HG1 VAL1038 -4.609 -9.258 5.195 999 3HG1 VAL1038 3HG1 VAL1038 -5.715 -8.239 6.148 1000 1HG2 VAL1038 1HG2 VAL1038 -3.708 -5.813 6.952 1001 2HG2 VAL1038 2HG2 VAL1038 -4.658 -5.149 5.602 1002 3HG2 VAL1038 3HG2 VAL1038 -5.402 -6.310 6.728 1003 H ILE1039 H ILE1039 -1.219 -7.602 3.679 1004 HA ILE1039 HA ILE1039 -1.717 -10.182 2.673 1005 HB ILE1039 HB ILE1039 0.068 -7.894 2.028 1006 1HG1 ILE1039 1HG1 ILE1039 -1.850 -9.569 0.380 1007 2HG1 ILE1039 2HG1 ILE1039 -2.247 -8.056 1.171 1008 1HG2 ILE1039 1HG2 ILE1039 0.727 -10.721 1.451 1009 2HG2 ILE1039 2HG2 ILE1039 0.811 -9.602 0.069 1010 3HG2 ILE1039 3HG2 ILE1039 1.772 -9.283 1.533 1011 1HD1 ILE1039 1HD1 ILE1039 -0.376 -8.534 -1.165 1012 2HD1 ILE1039 2HD1 ILE1039 -1.720 -7.375 -1.026 1013 3HD1 ILE1039 3HD1 ILE1039 -0.196 -7.080 -0.154 1014 H ASP1040 H ASP1040 1.104 -8.728 4.428 1015 HA ASP1040 HA ASP1040 2.774 -10.808 4.407 1016 1HB ASP1040 1HB ASP1040 2.810 -8.459 5.654 1017 2HB ASP1040 2HB ASP1040 2.245 -9.385 7.030 1018 H GLN1041 H GLN1041 -0.022 -10.229 6.650 1019 HA GLN1041 HA GLN1041 0.420 -12.554 8.147 1020 1HB GLN1041 1HB GLN1041 -0.847 -10.634 9.026 1021 2HB GLN1041 2HB GLN1041 -2.075 -10.836 7.793 1022 1HG GLN1041 1HG GLN1041 -2.836 -12.915 8.726 1023 2HG GLN1041 2HG GLN1041 -1.394 -13.102 9.705 1024 1HE2 GLN1041 1HE2 GLN1041 -4.483 -11.591 9.361 1025 2HE2 GLN1041 2HE2 GLN1041 -4.603 -10.873 10.933 1026 H ALA1042 H ALA1042 -1.127 -11.878 5.059 1027 HA ALA1042 HA ALA1042 -2.683 -14.299 5.075 1028 1HB ALA1042 1HB ALA1042 -2.527 -11.835 3.575 1029 2HB ALA1042 2HB ALA1042 -2.437 -13.217 2.457 1030 3HB ALA1042 3HB ALA1042 -3.813 -13.066 3.577 1031 H ARG1043 H ARG1043 0.528 -13.176 4.078 1032 HA ARG1043 HA ARG1043 1.081 -15.060 2.179 1033 1HB ARG1043 1HB ARG1043 2.562 -13.142 2.655 1034 2HB ARG1043 2HB ARG1043 2.918 -13.765 4.254 1035 1HG ARG1043 1HG ARG1043 3.685 -15.935 2.856 1036 2HG ARG1043 2HG ARG1043 3.874 -14.759 1.571 1037 1HD ARG1043 1HD ARG1043 5.849 -14.089 2.467 1038 2HD ARG1043 2HD ARG1043 5.024 -13.591 3.930 1039 HE ARG1043 HE ARG1043 5.337 -16.443 3.974 1040 1HH1 ARG1043 2HH2 ARG1043 7.245 -13.498 4.247 1041 2HH1 ARG1043 1HH2 ARG1043 8.468 -14.230 5.231 1042 1HH2 ARG1043 2HH1 ARG1043 6.950 -17.408 5.273 1043 2HH2 ARG1043 1HH1 ARG1043 8.299 -16.469 5.819 1044 H LEU1044 H LEU1044 2.128 -15.131 5.675 1045 HA LEU1044 HA LEU1044 2.949 -17.794 5.609 1046 1HB LEU1044 1HB LEU1044 3.240 -17.599 7.916 1047 2HB LEU1044 2HB LEU1044 3.577 -16.012 7.254 1048 HG LEU1044 HG LEU1044 2.338 -15.821 9.325 1049 1HD1 LEU1044 1HD1 LEU1044 1.938 -14.082 7.718 1050 2HD1 LEU1044 2HD1 LEU1044 0.709 -15.065 6.886 1051 3HD1 LEU1044 3HD1 LEU1044 0.403 -14.466 8.534 1052 1HD2 LEU1044 1HD2 LEU1044 0.552 -17.038 9.927 1053 2HD2 LEU1044 2HD2 LEU1044 -0.196 -16.935 8.315 1054 3HD2 LEU1044 3HD2 LEU1044 1.081 -18.134 8.629 1055 H LYS1045 H LYS1045 -0.226 -16.295 5.841 1056 HA LYS1045 HA LYS1045 -1.642 -18.250 7.154 1057 1HB LYS1045 1HB LYS1045 -2.325 -15.912 6.215 1058 2HB LYS1045 2HB LYS1045 -2.764 -16.796 4.768 1059 1HG LYS1045 1HG LYS1045 -4.658 -17.596 5.735 1060 2HG LYS1045 2HG LYS1045 -3.768 -18.203 7.117 1061 1HD LYS1045 1HD LYS1045 -3.825 -15.979 8.189 1062 2HD LYS1045 2HD LYS1045 -4.584 -15.279 6.773 1063 1HE LYS1045 1HE LYS1045 -6.527 -15.688 7.933 1064 2HE LYS1045 2HE LYS1045 -6.357 -17.297 7.261 1065 1HZ LYS1045 1HZ LYS1045 -4.906 -16.806 9.696 1066 2HZ LYS1045 2HZ LYS1045 -6.533 -16.819 9.838 1067 3HZ LYS1045 3HZ LYS1045 -5.756 -18.123 9.236 1068 H MET1046 H MET1046 -0.120 -18.292 3.975 1069 HA MET1046 HA MET1046 -1.661 -20.554 3.137 1070 1HB MET1046 1HB MET1046 -0.854 -18.827 1.514 1071 2HB MET1046 2HB MET1046 0.807 -19.153 1.967 1072 1HG MET1046 1HG MET1046 -0.385 -21.677 1.260 1073 2HG MET1046 2HG MET1046 -0.827 -20.530 0.011 1074 1HE MET1046 1HE MET1046 2.627 -19.085 -1.075 1075 2HE MET1046 2HE MET1046 0.866 -18.840 -0.998 1076 3HE MET1046 3HE MET1046 1.876 -18.488 0.424 1077 H ILE1047 H ILE1047 1.277 -19.911 4.919 1078 HA ILE1047 HA ILE1047 2.756 -22.176 4.274 1079 HB ILE1047 HB ILE1047 2.613 -20.543 6.809 1080 1HG1 ILE1047 1HG1 ILE1047 3.246 -19.453 4.561 1081 2HG1 ILE1047 2HG1 ILE1047 4.297 -19.198 5.941 1082 1HG2 ILE1047 1HG2 ILE1047 4.600 -22.657 5.945 1083 2HG2 ILE1047 2HG2 ILE1047 4.901 -21.472 7.239 1084 3HG2 ILE1047 3HG2 ILE1047 3.573 -22.647 7.399 1085 1HD1 ILE1047 1HD1 ILE1047 4.722 -21.245 3.716 1086 2HD1 ILE1047 2HD1 ILE1047 5.653 -19.750 3.972 1087 3HD1 ILE1047 3HD1 ILE1047 5.763 -21.080 5.150 1088 H SER1048 H SER1048 0.538 -21.628 7.106 1089 HA SER1048 HA SER1048 0.388 -24.519 7.324 1090 1HB SER1048 1HB SER1048 0.552 -22.380 9.233 1091 2HB SER1048 2HB SER1048 -1.007 -23.150 9.454 1092 HG SER1048 HG SER1048 1.438 -24.043 10.230 1093 H GLN1049 H GLN1049 -1.053 -24.594 5.379 1094 HA GLN1049 HA GLN1049 -3.672 -24.873 6.063 1095 1HB GLN1049 1HB GLN1049 -3.129 -22.137 5.832 1096 2HB GLN1049 2HB GLN1049 -3.823 -22.534 4.273 1097 1HG GLN1049 1HG GLN1049 -5.272 -23.782 6.537 1098 2HG GLN1049 2HG GLN1049 -5.263 -22.031 6.611 1099 1HE2 GLN1049 1HE2 GLN1049 -7.304 -24.170 5.937 1100 2HE2 GLN1049 2HE2 GLN1049 -8.043 -23.651 4.459 1101 H SER1050 H SER1050 -1.633 -26.236 4.611 1102 HA SER1050 HA SER1050 -3.092 -26.805 2.269 1103 1HB SER1050 1HB SER1050 -1.482 -24.709 1.808 1104 2HB SER1050 2HB SER1050 -0.268 -25.961 1.639 1105 HG SER1050 HG SER1050 -2.491 -25.359 -0.009 1106 H ARG1051 H ARG1051 0.082 -26.992 3.999 1107 HA ARG1051 HA ARG1051 0.804 -29.441 2.920 1108 1HB ARG1051 1HB ARG1051 1.807 -27.572 4.893 1109 2HB ARG1051 2HB ARG1051 1.882 -29.180 5.587 1110 1HG ARG1051 1HG ARG1051 3.937 -29.068 4.462 1111 2HG ARG1051 2HG ARG1051 2.937 -29.877 3.271 1112 1HD ARG1051 1HD ARG1051 3.951 -28.188 1.979 1113 2HD ARG1051 2HD ARG1051 2.415 -27.449 2.387 1114 HE ARG1051 HE ARG1051 4.313 -26.820 4.444 1115 1HH1 ARG1051 2HH2 ARG1051 3.609 -26.061 1.081 1116 2HH1 ARG1051 1HH2 ARG1051 4.341 -24.493 1.148 1117 1HH2 ARG1051 2HH1 ARG1051 5.279 -24.751 4.534 1118 2HH2 ARG1051 1HH1 ARG1051 5.298 -23.743 3.125 1119 HA PRO1052 HA PRO1052 -2.066 -31.804 5.318 1120 1HB PRO1052 1HB PRO1052 -1.767 -34.162 3.969 1121 2HB PRO1052 2HB PRO1052 -2.886 -32.908 3.471 1122 1HG PRO1052 1HG PRO1052 -0.281 -33.645 2.285 1123 2HG PRO1052 2HG PRO1052 -1.586 -32.714 1.576 1124 1HD PRO1052 1HD PRO1052 0.873 -31.689 2.641 1125 2HD PRO1052 2HD PRO1052 -0.480 -30.752 2.039 1126 H HIS1053 H HIS1053 1.059 -33.171 4.422 1127 HA HIS1053 HA HIS1053 1.159 -34.957 6.539 1128 1HB HIS1053 1HB HIS1053 2.600 -34.846 4.444 1129 2HB HIS1053 2HB HIS1053 3.536 -33.601 5.248 1130 HD1 HIS1053 HD1 HIS1053 2.885 -37.296 5.254 1131 HD2 HIS1053 HD2 HIS1053 5.149 -34.505 7.417 1132 HE1 HIS1053 HE1 HIS1053 4.533 -38.647 6.657 Start of MODEL 11 1 H MET 915 H MET 915 8.673 -20.387 -1.046 2 HA MET 915 HA MET 915 8.543 -19.863 1.154 3 1HB MET 915 1HB MET 915 10.337 -21.540 2.262 4 2HB MET 915 2HB MET 915 9.002 -22.165 1.314 5 1HG MET 915 1HG MET 915 10.374 -22.528 -0.612 6 2HG MET 915 2HG MET 915 11.633 -21.455 -0.033 7 1HE MET 915 1HE MET 915 12.648 -22.026 2.610 8 2HE MET 915 2HE MET 915 13.694 -23.448 2.382 9 3HE MET 915 3HE MET 915 13.641 -22.175 1.140 10 H ALA 916 H ALA 916 11.827 -19.448 -0.192 11 HA ALA 916 HA ALA 916 12.578 -17.894 2.170 12 1HB ALA 916 1HB ALA 916 14.773 -18.008 0.482 13 2HB ALA 916 2HB ALA 916 14.450 -19.120 1.834 14 3HB ALA 916 3HB ALA 916 13.966 -19.566 0.180 15 H ASN 917 H ASN 917 13.613 -17.515 -1.260 16 HA ASN 917 HA ASN 917 13.199 -14.709 -0.991 17 1HB ASN 917 1HB ASN 917 14.625 -16.552 -2.811 18 2HB ASN 917 2HB ASN 917 13.819 -15.270 -3.693 19 1HD2 ASN 917 1HD2 ASN 917 14.147 -13.048 -2.932 20 2HD2 ASN 917 2HD2 ASN 917 15.695 -12.583 -2.309 21 H LEU 918 H LEU 918 10.985 -14.147 -1.098 22 HA LEU 918 HA LEU 918 9.541 -15.139 -3.456 23 1HB LEU 918 1HB LEU 918 8.583 -14.780 -0.623 24 2HB LEU 918 2HB LEU 918 7.480 -14.839 -1.984 25 HG LEU 918 HG LEU 918 9.136 -17.094 -2.290 26 1HD1 LEU 918 1HD1 LEU 918 8.400 -18.112 0.080 27 2HD1 LEU 918 2HD1 LEU 918 9.989 -17.364 -0.210 28 3HD1 LEU 918 3HD1 LEU 918 8.694 -16.426 0.571 29 1HD2 LEU 918 1HD2 LEU 918 6.802 -16.980 -2.926 30 2HD2 LEU 918 2HD2 LEU 918 7.061 -18.341 -1.809 31 3HD2 LEU 918 3HD2 LEU 918 6.312 -16.838 -1.220 32 H ASP 919 H ASP 919 11.221 -12.875 -3.532 33 HA ASP 919 HA ASP 919 9.343 -10.680 -3.248 34 1HB ASP 919 1HB ASP 919 11.512 -9.331 -3.830 35 2HB ASP 919 2HB ASP 919 11.368 -10.042 -2.235 36 H ARG 920 H ARG 920 8.793 -12.491 -5.351 37 HA ARG 920 HA ARG 920 10.085 -11.468 -7.697 38 1HB ARG 920 1HB ARG 920 8.651 -13.887 -6.951 39 2HB ARG 920 2HB ARG 920 7.898 -13.205 -8.379 40 1HG ARG 920 1HG ARG 920 9.570 -14.112 -9.613 41 2HG ARG 920 2HG ARG 920 10.668 -12.960 -8.879 42 1HD ARG 920 1HD ARG 920 11.599 -14.534 -7.477 43 2HD ARG 920 2HD ARG 920 10.062 -15.311 -7.155 44 HE ARG 920 HE ARG 920 10.732 -15.851 -9.868 45 1HH1 ARG 920 2HH2 ARG 920 11.931 -16.638 -6.628 46 2HH1 ARG 920 1HH2 ARG 920 12.620 -18.150 -7.115 47 1HH2 ARG 920 1HH1 ARG 920 12.439 -18.840 -9.403 48 H SER 921 H SER 921 6.591 -12.299 -7.205 49 HA SER 921 HA SER 921 5.878 -10.012 -8.753 50 1HB SER 921 1HB SER 921 4.331 -12.286 -7.468 51 2HB SER 921 2HB SER 921 3.493 -10.921 -8.179 52 HG SER 921 HG SER 921 5.487 -12.417 -9.637 53 H ASN 922 H ASN 922 5.229 -11.251 -5.395 54 HA ASN 922 HA ASN 922 3.756 -9.143 -4.517 55 1HB ASN 922 1HB ASN 922 4.350 -9.881 -2.259 56 2HB ASN 922 2HB ASN 922 4.226 -11.306 -3.271 57 1HD2 ASN 922 1HD2 ASN 922 5.592 -11.402 -0.934 58 2HD2 ASN 922 2HD2 ASN 922 7.295 -11.571 -1.201 59 H ASP 923 H ASP 923 7.122 -9.315 -5.406 60 HA ASP 923 HA ASP 923 8.067 -7.313 -3.669 61 1HB ASP 923 1HB ASP 923 9.771 -8.681 -4.526 62 2HB ASP 923 2HB ASP 923 9.063 -8.742 -6.127 63 H LYS 924 H LYS 924 6.397 -7.460 -6.789 64 HA LYS 924 HA LYS 924 7.142 -4.830 -7.625 65 1HB LYS 924 1HB LYS 924 6.645 -6.589 -9.245 66 2HB LYS 924 2HB LYS 924 5.017 -6.751 -8.619 67 1HG LYS 924 1HG LYS 924 4.771 -5.339 -10.520 68 2HG LYS 924 2HG LYS 924 4.705 -4.239 -9.158 69 1HD LYS 924 1HD LYS 924 7.309 -4.019 -9.501 70 2HD LYS 924 2HD LYS 924 7.007 -4.715 -11.080 71 1HE LYS 924 1HE LYS 924 5.131 -2.851 -11.260 72 2HE LYS 924 2HE LYS 924 6.017 -2.075 -9.963 73 1HZ LYS 924 1HZ LYS 924 7.472 -3.016 -12.302 74 2HZ LYS 924 2HZ LYS 924 6.641 -1.613 -12.392 75 3HZ LYS 924 3HZ LYS 924 7.833 -1.786 -11.289 76 H VAL 925 H VAL 925 4.359 -6.383 -5.953 77 HA VAL 925 HA VAL 925 2.852 -3.962 -5.904 78 HB VAL 925 HB VAL 925 2.628 -6.720 -4.775 79 1HG1 VAL 925 1HG1 VAL 925 2.035 -5.251 -2.888 80 2HG1 VAL 925 2HG1 VAL 925 0.860 -4.402 -3.921 81 3HG1 VAL 925 3HG1 VAL 925 0.615 -6.119 -3.519 82 1HG2 VAL 925 1HG2 VAL 925 0.292 -6.361 -5.869 83 2HG2 VAL 925 2HG2 VAL 925 1.059 -4.957 -6.649 84 3HG2 VAL 925 3HG2 VAL 925 1.715 -6.590 -6.915 85 H TYR 926 H TYR 926 5.171 -5.654 -3.764 86 HA TYR 926 HA TYR 926 4.667 -4.013 -1.509 87 1HB TYR 926 1HB TYR 926 6.838 -5.893 -2.572 88 2HB TYR 926 2HB TYR 926 7.132 -5.013 -1.085 89 HD1 TYR 926 HD1 TYR 926 7.253 -6.900 0.383 90 HD2 TYR 926 HD2 TYR 926 3.810 -6.326 -2.091 91 HE1 TYR 926 HE1 TYR 926 6.009 -8.694 1.686 92 HE2 TYR 926 HE2 TYR 926 2.577 -8.122 -0.780 93 HH TYR 926 HH TYR 926 4.216 -9.900 1.820 94 H GLU 927 H GLU 927 6.507 -3.620 -4.481 95 HA GLU 927 HA GLU 927 8.250 -1.669 -3.358 96 1HB GLU 927 1HB GLU 927 7.793 -2.893 -6.060 97 2HB GLU 927 2HB GLU 927 8.555 -1.315 -6.025 98 1HG GLU 927 1HG GLU 927 9.602 -3.377 -4.101 99 2HG GLU 927 2HG GLU 927 9.964 -3.619 -5.798 100 H ASN 928 H ASN 928 5.738 -1.528 -5.996 101 HA ASN 928 HA ASN 928 5.594 1.116 -6.283 102 1HB ASN 928 1HB ASN 928 4.127 -0.983 -7.212 103 2HB ASN 928 2HB ASN 928 2.951 -0.327 -6.091 104 1HD2 ASN 928 1HD2 ASN 928 3.998 -0.265 -9.185 105 2HD2 ASN 928 2HD2 ASN 928 3.439 1.288 -9.711 106 H VAL 929 H VAL 929 4.154 -0.931 -3.695 107 HA VAL 929 HA VAL 929 2.476 0.966 -2.550 108 HB VAL 929 HB VAL 929 3.773 -1.581 -1.762 109 1HG1 VAL 929 1HG1 VAL 929 4.268 -0.572 0.278 110 2HG1 VAL 929 2HG1 VAL 929 2.832 0.480 0.225 111 3HG1 VAL 929 3HG1 VAL 929 2.651 -1.258 0.568 112 1HG2 VAL 929 1HG2 VAL 929 1.026 -0.459 -2.101 113 2HG2 VAL 929 2HG2 VAL 929 1.710 -2.009 -2.649 114 3HG2 VAL 929 3HG2 VAL 929 1.239 -1.797 -0.946 115 H THR 930 H THR 930 5.784 -0.050 -1.416 116 HA THR 930 HA THR 930 6.052 2.065 0.389 117 HB THR 930 HB THR 930 8.482 1.359 0.289 118 HG1 THR 930 HG1 THR 930 8.787 0.788 -1.874 119 1HG2 THR 930 1HG2 THR 930 6.204 -0.424 0.776 120 2HG2 THR 930 2HG2 THR 930 7.591 -1.333 0.130 121 3HG2 THR 930 3HG2 THR 930 7.774 -0.367 1.613 122 H GLY 931 H GLY 931 6.525 1.896 -3.118 123 1HA GLY 931 1HA GLY 931 8.205 4.053 -3.525 124 2HA GLY 931 2HA GLY 931 6.949 3.512 -4.620 125 H LEU 932 H LEU 932 4.702 4.343 -4.305 126 HA LEU 932 HA LEU 932 4.620 7.070 -4.093 127 1HB LEU 932 1HB LEU 932 2.392 6.880 -4.471 128 2HB LEU 932 2HB LEU 932 2.947 5.311 -5.020 129 HG LEU 932 HG LEU 932 0.897 5.094 -3.747 130 1HD1 LEU 932 1HD1 LEU 932 2.287 3.808 -1.671 131 2HD1 LEU 932 2HD1 LEU 932 1.714 3.104 -3.202 132 3HD1 LEU 932 3HD1 LEU 932 3.366 3.755 -3.085 133 1HD2 LEU 932 1HD2 LEU 932 1.940 5.738 -1.102 134 2HD2 LEU 932 2HD2 LEU 932 1.891 7.153 -2.180 135 3HD2 LEU 932 3HD2 LEU 932 0.411 6.210 -1.882 136 H VAL 933 H VAL 933 4.186 4.567 -1.553 137 HA VAL 933 HA VAL 933 3.235 6.217 0.453 138 HB VAL 933 HB VAL 933 4.733 3.641 0.296 139 1HG1 VAL 933 1HG1 VAL 933 5.847 4.401 2.196 140 2HG1 VAL 933 2HG1 VAL 933 4.445 5.336 2.771 141 3HG1 VAL 933 3HG1 VAL 933 4.436 3.559 2.881 142 1HG2 VAL 933 1HG2 VAL 933 2.600 2.964 0.242 143 2HG2 VAL 933 2HG2 VAL 933 2.517 3.396 1.966 144 3HG2 VAL 933 3HG2 VAL 933 1.999 4.567 0.730 145 H LYS 934 H LYS 934 6.663 5.288 -0.324 146 HA LYS 934 HA LYS 934 7.844 6.842 1.629 147 1HB LYS 934 1HB LYS 934 8.693 5.576 -0.926 148 2HB LYS 934 2HB LYS 934 9.735 6.835 -0.295 149 1HG LYS 934 1HG LYS 934 9.846 5.666 1.903 150 2HG LYS 934 2HG LYS 934 8.764 4.422 1.309 151 1HD LYS 934 1HD LYS 934 11.120 4.892 -0.442 152 2HD LYS 934 2HD LYS 934 11.537 4.330 1.164 153 1HE LYS 934 1HE LYS 934 10.176 2.339 0.930 154 2HE LYS 934 2HE LYS 934 9.391 2.958 -0.509 155 1HZ LYS 934 1HZ LYS 934 11.032 1.483 -1.217 156 2HZ LYS 934 2HZ LYS 934 11.655 2.960 -1.525 157 3HZ LYS 934 3HZ LYS 934 12.180 2.105 -0.237 158 H ALA 935 H ALA 935 6.682 7.682 -1.663 159 HA ALA 935 HA ALA 935 7.803 10.274 -1.660 160 1HB ALA 935 1HB ALA 935 7.129 10.113 -3.795 161 2HB ALA 935 2HB ALA 935 6.343 8.563 -3.410 162 3HB ALA 935 3HB ALA 935 5.425 10.082 -3.279 163 H VAL 936 H VAL 936 4.493 8.979 -0.923 164 HA VAL 936 HA VAL 936 3.066 11.159 -0.481 165 HB VAL 936 HB VAL 936 3.323 8.715 1.274 166 1HG1 VAL 936 1HG1 VAL 936 2.252 10.798 2.371 167 2HG1 VAL 936 2HG1 VAL 936 0.909 10.527 1.235 168 3HG1 VAL 936 3HG1 VAL 936 1.348 9.265 2.410 169 1HG2 VAL 936 1HG2 VAL 936 2.405 8.996 -1.331 170 2HG2 VAL 936 2HG2 VAL 936 2.034 7.654 -0.222 171 3HG2 VAL 936 3HG2 VAL 936 0.915 9.031 -0.359 172 H ILE 937 H ILE 937 5.646 9.930 1.725 173 HA ILE 937 HA ILE 937 5.256 12.182 3.486 174 HB ILE 937 HB ILE 937 7.145 9.833 3.473 175 1HG1 ILE 937 1HG1 ILE 937 5.550 9.958 5.805 176 2HG1 ILE 937 2HG1 ILE 937 4.470 10.283 4.464 177 1HG2 ILE 937 1HG2 ILE 937 8.463 10.788 4.982 178 2HG2 ILE 937 2HG2 ILE 937 7.630 12.328 4.663 179 3HG2 ILE 937 3HG2 ILE 937 7.069 11.268 5.978 180 1HD1 ILE 937 1HD1 ILE 937 6.446 8.042 4.119 181 2HD1 ILE 937 2HD1 ILE 937 5.072 7.775 5.218 182 3HD1 ILE 937 3HD1 ILE 937 4.779 8.188 3.511 183 H GLU 938 H GLU 938 8.137 10.858 1.701 184 HA GLU 938 HA GLU 938 9.832 12.824 1.923 185 1HB GLU 938 1HB GLU 938 9.285 10.815 -0.084 186 2HB GLU 938 2HB GLU 938 9.823 12.273 -0.893 187 1HG GLU 938 1HG GLU 938 11.934 11.579 -0.386 188 2HG GLU 938 2HG GLU 938 11.594 12.149 1.237 189 H MET 939 H MET 939 6.898 12.937 -0.153 190 HA MET 939 HA MET 939 7.420 15.204 -1.549 191 1HB MET 939 1HB MET 939 5.429 13.928 -2.039 192 2HB MET 939 2HB MET 939 4.874 13.996 -0.378 193 1HG MET 939 1HG MET 939 3.781 15.965 -0.729 194 2HG MET 939 2HG MET 939 5.194 16.701 -1.460 195 1HE MET 939 1HE MET 939 3.789 13.278 -2.982 196 2HE MET 939 2HE MET 939 2.531 14.001 -1.951 197 3HE MET 939 3HE MET 939 2.299 13.918 -3.714 198 H SER 940 H SER 940 5.307 15.138 1.417 199 HA SER 940 HA SER 940 5.054 17.741 1.822 200 1HB SER 940 1HB SER 940 4.811 17.250 4.235 201 2HB SER 940 2HB SER 940 4.034 16.019 3.259 202 HG SER 940 HG SER 940 6.675 15.808 4.438 203 H SER 941 H SER 941 7.986 15.785 2.360 204 HA SER 941 HA SER 941 9.340 17.653 3.918 205 1HB SER 941 1HB SER 941 10.859 15.855 2.046 206 2HB SER 941 2HB SER 941 11.165 16.213 3.734 207 HG SER 941 HG SER 941 10.335 14.198 3.892 208 H LYS 942 H LYS 942 9.245 16.998 0.358 209 HA LYS 942 HA LYS 942 10.748 19.484 -0.040 210 1HB LYS 942 1HB LYS 942 11.149 18.558 -2.339 211 2HB LYS 942 2HB LYS 942 11.894 17.658 -1.033 212 1HG LYS 942 1HG LYS 942 10.677 15.787 -1.489 213 2HG LYS 942 2HG LYS 942 9.174 16.686 -1.562 214 1HD LYS 942 1HD LYS 942 11.150 16.914 -3.848 215 2HD LYS 942 2HD LYS 942 10.126 15.496 -3.739 216 1HE LYS 942 1HE LYS 942 8.381 16.658 -4.603 217 2HE LYS 942 2HE LYS 942 8.456 17.800 -3.277 218 1HZ LYS 942 1HZ LYS 942 9.840 17.945 -5.848 219 2HZ LYS 942 2HZ LYS 942 8.836 19.041 -5.171 220 3HZ LYS 942 3HZ LYS 942 10.341 18.832 -4.572 221 H ILE 943 H ILE 943 7.817 19.133 0.689 222 HA ILE 943 HA ILE 943 6.549 20.012 -1.778 223 HB ILE 943 HB ILE 943 5.709 18.318 0.125 224 1HG1 ILE 943 1HG1 ILE 943 4.756 18.999 -2.182 225 2HG1 ILE 943 2HG1 ILE 943 3.681 18.299 -0.989 226 1HG2 ILE 943 1HG2 ILE 943 3.935 19.470 1.447 227 2HG2 ILE 943 2HG2 ILE 943 5.595 19.905 1.920 228 3HG2 ILE 943 3HG2 ILE 943 4.627 21.028 0.935 229 1HD1 ILE 943 1HD1 ILE 943 3.107 20.597 -2.304 230 2HD1 ILE 943 2HD1 ILE 943 2.527 20.271 -0.654 231 3HD1 ILE 943 3HD1 ILE 943 3.971 21.280 -0.906 232 H GLN 944 H GLN 944 7.108 21.118 1.629 233 HA GLN 944 HA GLN 944 5.906 23.466 1.634 234 1HB GLN 944 1HB GLN 944 8.103 22.273 3.028 235 2HB GLN 944 2HB GLN 944 8.578 23.919 2.659 236 1HG GLN 944 1HG GLN 944 5.918 24.212 3.487 237 2HG GLN 944 2HG GLN 944 6.512 22.937 4.533 238 1HE2 GLN 944 1HE2 GLN 944 8.677 23.315 5.534 239 2HE2 GLN 944 2HE2 GLN 944 9.037 24.899 6.133 240 HA PRO 945 HA PRO 945 9.402 25.486 -0.857 241 1HB PRO 945 1HB PRO 945 11.331 23.938 -2.019 242 2HB PRO 945 2HB PRO 945 11.539 24.724 -0.467 243 1HG PRO 945 1HG PRO 945 11.033 21.869 -1.045 244 2HG PRO 945 2HG PRO 945 11.657 22.598 0.421 245 1HD PRO 945 1HD PRO 945 8.995 21.622 -0.012 246 2HD PRO 945 2HD PRO 945 9.587 22.455 1.411 247 H ALA 946 H ALA 946 8.832 22.291 -2.244 248 HA ALA 946 HA ALA 946 8.797 22.795 -4.847 249 1HB ALA 946 1HB ALA 946 8.218 20.628 -4.042 250 2HB ALA 946 2HB ALA 946 6.809 21.251 -3.152 251 3HB ALA 946 3HB ALA 946 6.788 21.204 -4.931 252 HA PRO 947 HA PRO 947 5.986 26.090 -5.348 253 1HB PRO 947 1HB PRO 947 6.278 26.416 -8.045 254 2HB PRO 947 2HB PRO 947 7.361 27.136 -6.870 255 1HG PRO 947 1HG PRO 947 7.820 24.804 -8.628 256 2HG PRO 947 2HG PRO 947 8.996 25.787 -7.778 257 1HD PRO 947 1HD PRO 947 8.089 23.168 -7.036 258 2HD PRO 947 2HD PRO 947 9.177 24.198 -6.126 259 HA PRO 948 HA PRO 948 2.293 24.588 -6.825 260 1HB PRO 948 1HB PRO 948 1.104 26.624 -8.206 261 2HB PRO 948 2HB PRO 948 1.124 26.537 -6.456 262 1HG PRO 948 1HG PRO 948 2.714 28.275 -8.243 263 2HG PRO 948 2HG PRO 948 2.402 28.456 -6.528 264 1HD PRO 948 1HD PRO 948 4.824 27.515 -7.741 265 2HD PRO 948 2HD PRO 948 4.470 27.587 -6.027 266 H GLU 949 H GLU 949 4.529 25.651 -9.152 267 HA GLU 949 HA GLU 949 3.019 24.477 -11.289 268 1HB GLU 949 1HB GLU 949 5.489 26.133 -11.022 269 2HB GLU 949 2HB GLU 949 5.472 25.024 -12.379 270 1HG GLU 949 1HG GLU 949 3.029 26.732 -11.858 271 2HG GLU 949 2HG GLU 949 4.431 27.468 -12.609 272 H GLU 950 H GLU 950 5.179 23.435 -8.836 273 HA GLU 950 HA GLU 950 5.916 21.129 -10.463 274 1HB GLU 950 1HB GLU 950 7.547 22.851 -8.932 275 2HB GLU 950 2HB GLU 950 7.412 21.400 -7.958 276 1HG GLU 950 1HG GLU 950 9.015 20.489 -9.284 277 2HG GLU 950 2HG GLU 950 7.799 20.385 -10.542 278 H TYR 951 H TYR 951 3.756 22.210 -8.139 279 HA TYR 951 HA TYR 951 3.798 19.769 -6.555 280 1HB TYR 951 1HB TYR 951 3.471 22.150 -5.642 281 2HB TYR 951 2HB TYR 951 2.016 22.286 -6.610 282 HD1 TYR 951 HD1 TYR 951 3.122 19.305 -4.657 283 HD2 TYR 951 HD2 TYR 951 0.363 22.562 -4.945 284 HE1 TYR 951 HE1 TYR 951 1.756 18.326 -2.749 285 HE2 TYR 951 HE2 TYR 951 -0.994 21.572 -3.036 286 HH TYR 951 HH TYR 951 0.214 19.006 -1.108 287 H VAL 952 H VAL 952 1.854 21.470 -9.048 288 HA VAL 952 HA VAL 952 -0.466 20.013 -8.891 289 HB VAL 952 HB VAL 952 0.987 21.584 -10.924 290 1HG1 VAL 952 1HG1 VAL 952 -0.909 19.379 -11.666 291 2HG1 VAL 952 2HG1 VAL 952 -0.956 20.908 -12.576 292 3HG1 VAL 952 3HG1 VAL 952 0.549 19.961 -12.504 293 1HG2 VAL 952 1HG2 VAL 952 -1.859 21.494 -9.878 294 2HG2 VAL 952 2HG2 VAL 952 -0.597 22.692 -9.506 295 3HG2 VAL 952 3HG2 VAL 952 -1.300 22.618 -11.139 296 HA PRO 953 HA PRO 953 1.694 16.763 -11.579 297 1HB PRO 953 1HB PRO 953 4.419 16.790 -11.793 298 2HB PRO 953 2HB PRO 953 3.357 17.498 -12.993 299 1HG PRO 953 1HG PRO 953 5.014 18.853 -10.955 300 2HG PRO 953 2HG PRO 953 4.296 19.521 -12.407 301 1HD PRO 953 1HD PRO 953 3.358 19.858 -9.718 302 2HD PRO 953 2HD PRO 953 2.577 20.428 -11.179 303 H MET 954 H MET 954 3.969 17.673 -9.032 304 HA MET 954 HA MET 954 4.847 15.382 -8.177 305 1HB MET 954 1HB MET 954 4.113 17.922 -6.956 306 2HB MET 954 2HB MET 954 3.755 16.643 -5.812 307 1HG MET 954 1HG MET 954 5.980 16.098 -5.511 308 2HG MET 954 2HG MET 954 6.386 16.367 -7.194 309 1HE MET 954 1HE MET 954 4.736 18.007 -4.369 310 2HE MET 954 2HE MET 954 6.170 18.723 -3.595 311 3HE MET 954 3HE MET 954 5.082 19.741 -4.568 312 H VAL 955 H VAL 955 1.550 16.595 -7.226 313 HA VAL 955 HA VAL 955 0.846 14.262 -5.845 314 HB VAL 955 HB VAL 955 -0.494 16.692 -6.897 315 1HG1 VAL 955 1HG1 VAL 955 -1.873 14.072 -6.552 316 2HG1 VAL 955 2HG1 VAL 955 -2.676 15.508 -5.873 317 3HG1 VAL 955 3HG1 VAL 955 -2.271 15.451 -7.605 318 1HG2 VAL 955 1HG2 VAL 955 0.166 17.046 -4.733 319 2HG2 VAL 955 2HG2 VAL 955 -1.458 16.381 -4.432 320 3HG2 VAL 955 3HG2 VAL 955 -0.025 15.337 -4.274 321 H LYS 956 H LYS 956 0.186 15.389 -9.227 322 HA LYS 956 HA LYS 956 -1.380 13.302 -10.043 323 1HB LYS 956 1HB LYS 956 0.234 15.391 -11.275 324 2HB LYS 956 2HB LYS 956 0.229 13.932 -12.244 325 1HG LYS 956 1HG LYS 956 -1.696 15.098 -12.991 326 2HG LYS 956 2HG LYS 956 -2.347 13.897 -11.893 327 1HD LYS 956 1HD LYS 956 -3.305 15.565 -10.696 328 2HD LYS 956 2HD LYS 956 -1.706 16.126 -10.251 329 1HE LYS 956 1HE LYS 956 -1.602 17.568 -12.253 330 2HE LYS 956 2HE LYS 956 -3.126 16.930 -12.835 331 1HZ LYS 956 1HZ LYS 956 -4.137 17.793 -10.785 332 2HZ LYS 956 2HZ LYS 956 -2.719 18.499 -10.387 333 3HZ LYS 956 3HZ LYS 956 -3.515 18.969 -11.733 334 H GLU 957 H GLU 957 2.179 13.456 -9.636 335 HA GLU 957 HA GLU 957 2.760 11.104 -10.953 336 1HB GLU 957 1HB GLU 957 4.098 12.904 -9.016 337 2HB GLU 957 2HB GLU 957 4.664 11.247 -8.938 338 1HG GLU 957 1HG GLU 957 5.805 11.466 -10.888 339 2HG GLU 957 2HG GLU 957 4.377 12.041 -11.726 340 H VAL 958 H VAL 958 1.716 11.759 -7.575 341 HA VAL 958 HA VAL 958 2.165 9.161 -6.614 342 HB VAL 958 HB VAL 958 0.348 11.416 -5.761 343 1HG1 VAL 958 1HG1 VAL 958 0.936 9.526 -3.650 344 2HG1 VAL 958 2HG1 VAL 958 -0.636 10.131 -4.224 345 3HG1 VAL 958 3HG1 VAL 958 0.110 8.713 -5.001 346 1HG2 VAL 958 1HG2 VAL 958 3.065 10.432 -4.852 347 2HG2 VAL 958 2HG2 VAL 958 2.629 12.030 -5.506 348 3HG2 VAL 958 3HG2 VAL 958 2.064 11.545 -3.889 349 H GLY 959 H GLY 959 -0.764 10.802 -7.980 350 1HA GLY 959 1HA GLY 959 -2.532 8.663 -7.705 351 2HA GLY 959 2HA GLY 959 -2.646 9.964 -8.875 352 H LEU 960 H LEU 960 0.197 9.149 -9.885 353 HA LEU 960 HA LEU 960 -0.817 7.263 -11.821 354 1HB LEU 960 1HB LEU 960 1.230 9.299 -11.685 355 2HB LEU 960 2HB LEU 960 1.897 7.797 -12.295 356 HG LEU 960 HG LEU 960 -0.680 8.640 -13.501 357 1HD1 LEU 960 1HD1 LEU 960 1.763 10.055 -14.503 358 2HD1 LEU 960 2HD1 LEU 960 0.042 10.469 -14.689 359 3HD1 LEU 960 3HD1 LEU 960 0.857 10.734 -13.129 360 1HD2 LEU 960 1HD2 LEU 960 0.086 6.825 -14.621 361 2HD2 LEU 960 2HD2 LEU 960 0.939 8.075 -15.559 362 3HD2 LEU 960 3HD2 LEU 960 1.794 7.187 -14.275 363 H ALA 961 H ALA 961 1.683 7.450 -9.227 364 HA ALA 961 HA ALA 961 2.688 4.856 -9.710 365 1HB ALA 961 1HB ALA 961 4.238 5.826 -8.398 366 2HB ALA 961 2HB ALA 961 3.095 7.087 -7.876 367 3HB ALA 961 3HB ALA 961 3.153 5.528 -7.019 368 H LEU 962 H LEU 962 0.183 6.231 -7.501 369 HA LEU 962 HA LEU 962 -0.313 3.821 -6.153 370 1HB LEU 962 1HB LEU 962 -1.381 5.274 -4.896 371 2HB LEU 962 2HB LEU 962 -1.228 6.511 -6.129 372 HG LEU 962 HG LEU 962 -3.556 6.139 -5.371 373 1HD1 LEU 962 1HD1 LEU 962 -2.650 6.635 -7.902 374 2HD1 LEU 962 2HD1 LEU 962 -3.764 5.273 -8.174 375 3HD1 LEU 962 3HD1 LEU 962 -4.346 6.754 -7.375 376 1HD2 LEU 962 1HD2 LEU 962 -4.024 3.697 -6.887 377 2HD2 LEU 962 2HD2 LEU 962 -2.918 3.442 -5.516 378 3HD2 LEU 962 3HD2 LEU 962 -4.531 4.142 -5.240 379 H ARG 963 H ARG 963 -1.440 5.202 -9.240 380 HA ARG 963 HA ARG 963 -3.648 3.637 -9.600 381 1HB ARG 963 1HB ARG 963 -2.972 5.543 -11.075 382 2HB ARG 963 2HB ARG 963 -1.635 4.596 -11.698 383 1HG ARG 963 1HG ARG 963 -3.009 3.702 -13.261 384 2HG ARG 963 2HG ARG 963 -3.962 2.962 -11.990 385 1HD ARG 963 1HD ARG 963 -5.685 4.342 -12.520 386 2HD ARG 963 2HD ARG 963 -4.721 5.710 -12.001 387 HE ARG 963 HE ARG 963 -3.812 5.083 -14.593 388 1HH1 ARG 963 2HH2 ARG 963 -6.838 6.086 -13.103 389 2HH1 ARG 963 1HH2 ARG 963 -7.414 6.899 -14.520 390 1HH2 ARG 963 2HH1 ARG 963 -4.571 6.156 -16.463 391 2HH2 ARG 963 1HH1 ARG 963 -6.116 6.939 -16.444 392 H THR 964 H THR 964 -0.254 3.068 -10.807 393 HA THR 964 HA THR 964 -0.679 0.582 -11.928 394 HB THR 964 HB THR 964 1.747 1.865 -10.573 395 HG1 THR 964 HG1 THR 964 0.881 1.365 -13.334 396 1HG2 THR 964 1HG2 THR 964 2.226 -0.065 -12.752 397 2HG2 THR 964 2HG2 THR 964 3.043 0.072 -11.177 398 3HG2 THR 964 3HG2 THR 964 1.525 -0.847 -11.315 399 H LEU 965 H LEU 965 0.154 1.409 -8.513 400 HA LEU 965 HA LEU 965 0.563 -1.092 -7.541 401 1HB LEU 965 1HB LEU 965 0.852 0.959 -6.277 402 2HB LEU 965 2HB LEU 965 -0.880 1.228 -6.252 403 HG LEU 965 HG LEU 965 0.370 0.212 -4.178 404 1HD1 LEU 965 1HD1 LEU 965 -2.339 -0.289 -5.279 405 2HD1 LEU 965 2HD1 LEU 965 -1.833 -1.303 -3.906 406 3HD1 LEU 965 3HD1 LEU 965 -1.835 0.470 -3.751 407 1HD2 LEU 965 1HD2 LEU 965 0.320 -2.238 -4.112 408 2HD2 LEU 965 2HD2 LEU 965 -0.157 -2.276 -5.826 409 3HD2 LEU 965 3HD2 LEU 965 1.436 -1.635 -5.360 410 H LEU 966 H LEU 966 -2.643 0.593 -7.837 411 HA LEU 966 HA LEU 966 -4.267 -1.316 -6.858 412 1HB LEU 966 1HB LEU 966 -4.481 0.807 -8.882 413 2HB LEU 966 2HB LEU 966 -5.684 -0.459 -9.032 414 HG LEU 966 HG LEU 966 -6.475 -0.073 -6.780 415 1HD1 LEU 966 1HD1 LEU 966 -3.975 1.516 -6.543 416 2HD1 LEU 966 2HD1 LEU 966 -5.412 2.131 -5.692 417 3HD1 LEU 966 3HD1 LEU 966 -4.809 0.491 -5.351 418 1HD2 LEU 966 1HD2 LEU 966 -6.177 2.633 -8.095 419 2HD2 LEU 966 2HD2 LEU 966 -7.267 1.362 -8.700 420 3HD2 LEU 966 3HD2 LEU 966 -7.508 2.041 -7.072 421 H ALA 967 H ALA 967 -3.259 -1.124 -10.349 422 HA ALA 967 HA ALA 967 -4.377 -3.554 -11.074 423 1HB ALA 967 1HB ALA 967 -2.649 -1.513 -12.186 424 2HB ALA 967 2HB ALA 967 -2.051 -3.127 -12.639 425 3HB ALA 967 3HB ALA 967 -3.723 -2.656 -13.027 426 H THR 968 H THR 968 -1.089 -2.733 -9.813 427 HA THR 968 HA THR 968 0.038 -5.257 -10.084 428 HB THR 968 HB THR 968 0.597 -3.336 -7.785 429 HG1 THR 968 HG1 THR 968 1.377 -1.919 -9.370 430 1HG2 THR 968 1HG2 THR 968 2.687 -4.361 -9.675 431 2HG2 THR 968 2HG2 THR 968 2.767 -4.149 -7.909 432 3HG2 THR 968 3HG2 THR 968 1.958 -5.577 -8.598 433 H VAL 969 H VAL 969 -1.935 -3.881 -7.395 434 HA VAL 969 HA VAL 969 -1.648 -5.974 -5.631 435 HB VAL 969 HB VAL 969 -4.023 -4.183 -6.180 436 1HG1 VAL 969 1HG1 VAL 969 -3.481 -6.210 -4.042 437 2HG1 VAL 969 2HG1 VAL 969 -4.316 -4.703 -3.595 438 3HG1 VAL 969 3HG1 VAL 969 -5.010 -5.769 -4.841 439 1HG2 VAL 969 1HG2 VAL 969 -1.429 -3.805 -4.824 440 2HG2 VAL 969 2HG2 VAL 969 -2.555 -2.609 -5.508 441 3HG2 VAL 969 3HG2 VAL 969 -2.844 -3.276 -3.883 442 H ASP 970 H ASP 970 -3.944 -5.569 -8.392 443 HA ASP 970 HA ASP 970 -5.532 -7.693 -7.979 444 1HB ASP 970 1HB ASP 970 -5.671 -6.042 -9.876 445 2HB ASP 970 2HB ASP 970 -4.317 -6.841 -10.651 446 H GLU 971 H GLU 971 -2.221 -7.569 -9.425 447 HA GLU 971 HA GLU 971 -2.215 -10.316 -10.088 448 1HB GLU 971 1HB GLU 971 -0.850 -8.574 -11.267 449 2HB GLU 971 2HB GLU 971 0.116 -8.366 -9.820 450 1HG GLU 971 1HG GLU 971 0.819 -10.752 -9.922 451 2HG GLU 971 2HG GLU 971 -0.188 -11.003 -11.335 452 H SER 972 H SER 972 -1.607 -8.433 -7.201 453 HA SER 972 HA SER 972 0.011 -10.484 -6.022 454 1HB SER 972 1HB SER 972 0.626 -8.280 -5.373 455 2HB SER 972 2HB SER 972 -1.035 -7.789 -5.111 456 HG SER 972 HG SER 972 -0.881 -8.437 -3.083 457 H LEU 973 H LEU 973 -3.345 -9.707 -6.424 458 HA LEU 973 HA LEU 973 -4.480 -10.522 -4.063 459 1HB LEU 973 1HB LEU 973 -5.310 -9.830 -6.635 460 2HB LEU 973 2HB LEU 973 -5.957 -11.439 -6.386 461 HG LEU 973 HG LEU 973 -6.668 -8.872 -5.082 462 1HD1 LEU 973 1HD1 LEU 973 -7.933 -10.877 -6.621 463 2HD1 LEU 973 2HD1 LEU 973 -8.693 -10.907 -5.012 464 3HD1 LEU 973 3HD1 LEU 973 -8.643 -9.391 -5.944 465 1HD2 LEU 973 1HD2 LEU 973 -6.238 -11.385 -3.538 466 2HD2 LEU 973 2HD2 LEU 973 -6.089 -9.684 -3.037 467 3HD2 LEU 973 3HD2 LEU 973 -7.698 -10.429 -3.185 468 HA PRO 974 HA PRO 974 -4.186 -14.966 -5.635 469 1HB PRO 974 1HB PRO 974 -2.736 -15.548 -7.877 470 2HB PRO 974 2HB PRO 974 -4.471 -15.303 -7.895 471 1HG PRO 974 1HG PRO 974 -2.333 -13.484 -8.820 472 2HG PRO 974 2HG PRO 974 -4.042 -13.455 -9.206 473 1HD PRO 974 1HD PRO 974 -2.666 -11.729 -7.374 474 2HD PRO 974 2HD PRO 974 -4.392 -11.777 -7.674 475 H VAL 975 H VAL 975 -1.306 -13.075 -6.184 476 HA VAL 975 HA VAL 975 0.605 -14.929 -5.627 477 HB VAL 975 HB VAL 975 0.388 -12.001 -4.932 478 1HG1 VAL 975 1HG1 VAL 975 3.054 -12.398 -4.962 479 2HG1 VAL 975 2HG1 VAL 975 2.077 -12.443 -3.475 480 3HG1 VAL 975 3HG1 VAL 975 2.533 -13.960 -4.287 481 1HG2 VAL 975 1HG2 VAL 975 0.501 -13.056 -7.370 482 2HG2 VAL 975 2HG2 VAL 975 1.378 -11.563 -6.955 483 3HG2 VAL 975 3HG2 VAL 975 2.240 -13.120 -6.999 484 H LEU 976 H LEU 976 -1.835 -13.557 -3.484 485 HA LEU 976 HA LEU 976 -0.478 -14.798 -1.200 486 1HB LEU 976 1HB LEU 976 -2.531 -12.604 -1.416 487 2HB LEU 976 2HB LEU 976 -2.193 -13.425 0.095 488 HG LEU 976 HG LEU 976 -1.020 -11.167 -0.466 489 1HD1 LEU 976 1HD1 LEU 976 -0.506 -12.254 1.557 490 2HD1 LEU 976 2HD1 LEU 976 0.322 -13.594 0.728 491 3HD1 LEU 976 3HD1 LEU 976 1.061 -11.975 0.760 492 1HD2 LEU 976 1HD2 LEU 976 -0.221 -12.003 -2.707 493 2HD2 LEU 976 2HD2 LEU 976 1.022 -11.256 -1.674 494 3HD2 LEU 976 3HD2 LEU 976 0.938 -13.028 -1.826 495 HA PRO 977 HA PRO 977 -3.565 -17.803 -0.964 496 1HB PRO 977 1HB PRO 977 -3.804 -18.260 1.720 497 2HB PRO 977 2HB PRO 977 -2.498 -18.910 0.750 498 1HG PRO 977 1HG PRO 977 -2.439 -16.665 2.671 499 2HG PRO 977 2HG PRO 977 -1.100 -17.592 2.026 500 1HD PRO 977 1HD PRO 977 -1.891 -14.949 1.243 501 2HD PRO 977 2HD PRO 977 -0.627 -15.922 0.519 502 H ALA 978 H ALA 978 -5.659 -17.808 -1.465 503 HA ALA 978 HA ALA 978 -7.260 -15.674 -1.118 504 1HB ALA 978 1HB ALA 978 -9.084 -17.685 -0.981 505 2HB ALA 978 2HB ALA 978 -8.241 -17.224 -2.480 506 3HB ALA 978 3HB ALA 978 -7.653 -18.599 -1.515 507 H SER 979 H SER 979 -7.896 -14.539 0.639 508 HA SER 979 HA SER 979 -9.394 -15.355 2.625 509 1HB SER 979 1HB SER 979 -7.505 -15.547 4.535 510 2HB SER 979 2HB SER 979 -8.134 -16.953 3.698 511 HG SER 979 HG SER 979 -6.252 -17.243 2.675 512 H THR 980 H THR 980 -6.621 -13.477 1.540 513 HA THR 980 HA THR 980 -7.260 -11.348 3.458 514 HB THR 980 HB THR 980 -4.910 -12.027 3.436 515 HG1 THR 980 HG1 THR 980 -4.624 -9.834 3.405 516 1HG2 THR 980 1HG2 THR 980 -4.701 -13.095 1.228 517 2HG2 THR 980 2HG2 THR 980 -5.122 -11.569 0.415 518 3HG2 THR 980 3HG2 THR 980 -3.579 -11.714 1.291 519 H HIS 981 H HIS 981 -8.293 -12.391 0.495 520 HA HIS 981 HA HIS 981 -8.073 -10.094 -1.067 521 1HB HIS 981 1HB HIS 981 -10.198 -11.144 -2.160 522 2HB HIS 981 2HB HIS 981 -8.646 -11.949 -2.284 523 HD1 HIS 981 HD1 HIS 981 -11.637 -12.053 0.132 524 HD2 HIS 981 HD2 HIS 981 -8.819 -14.593 -1.659 525 HE1 HIS 981 HE1 HIS 981 -12.225 -14.419 0.886 526 H ARG 982 H ARG 982 -10.501 -11.169 1.366 527 HA ARG 982 HA ARG 982 -12.424 -9.338 0.910 528 1HB ARG 982 1HB ARG 982 -11.679 -11.129 3.021 529 2HB ARG 982 2HB ARG 982 -12.004 -9.587 3.786 530 1HG ARG 982 1HG ARG 982 -14.008 -10.249 1.721 531 2HG ARG 982 2HG ARG 982 -13.923 -11.470 2.975 532 1HD ARG 982 1HD ARG 982 -14.463 -9.912 4.706 533 2HD ARG 982 2HD ARG 982 -14.043 -8.526 3.720 534 HE ARG 982 HE ARG 982 -16.102 -9.675 2.287 535 1HH1 ARG 982 2HH2 ARG 982 -15.762 -8.696 5.650 536 2HH1 ARG 982 1HH2 ARG 982 -17.447 -8.345 5.851 537 1HH2 ARG 982 2HH1 ARG 982 -18.324 -9.212 2.552 538 2HH2 ARG 982 1HH1 ARG 982 -18.914 -8.640 4.077 539 H GLU 983 H GLU 983 -10.073 -8.955 3.663 540 HA GLU 983 HA GLU 983 -10.530 -6.313 4.059 541 1HB GLU 983 1HB GLU 983 -8.132 -8.088 4.568 542 2HB GLU 983 2HB GLU 983 -8.046 -6.382 4.958 543 1HG GLU 983 1HG GLU 983 -9.676 -6.530 6.637 544 2HG GLU 983 2HG GLU 983 -10.469 -7.909 5.900 545 H ILE 984 H ILE 984 -8.296 -7.900 1.737 546 HA ILE 984 HA ILE 984 -6.839 -5.676 0.982 547 HB ILE 984 HB ILE 984 -7.583 -8.271 -0.292 548 1HG1 ILE 984 1HG1 ILE 984 -4.871 -7.064 0.299 549 2HG1 ILE 984 2HG1 ILE 984 -5.785 -7.986 1.477 550 1HG2 ILE 984 1HG2 ILE 984 -6.482 -5.874 -1.708 551 2HG2 ILE 984 2HG2 ILE 984 -5.876 -7.493 -2.134 552 3HG2 ILE 984 3HG2 ILE 984 -7.612 -7.124 -2.280 553 1HD1 ILE 984 1HD1 ILE 984 -4.470 -9.662 0.507 554 2HD1 ILE 984 2HD1 ILE 984 -5.953 -9.785 -0.469 555 3HD1 ILE 984 3HD1 ILE 984 -4.535 -8.920 -1.109 556 H GLU 985 H GLU 985 -9.936 -6.983 -0.383 557 HA GLU 985 HA GLU 985 -10.250 -5.156 -2.361 558 1HB GLU 985 1HB GLU 985 -11.715 -7.235 -1.442 559 2HB GLU 985 2HB GLU 985 -12.692 -5.932 -0.794 560 1HG GLU 985 1HG GLU 985 -11.820 -5.612 -3.643 561 2HG GLU 985 2HG GLU 985 -12.963 -6.904 -3.337 562 H MET 986 H MET 986 -11.368 -4.914 1.084 563 HA MET 986 HA MET 986 -12.445 -2.352 0.724 564 1HB MET 986 1HB MET 986 -11.803 -4.224 2.991 565 2HB MET 986 2HB MET 986 -11.941 -2.534 3.433 566 1HG MET 986 1HG MET 986 -14.209 -2.589 3.248 567 2HG MET 986 2HG MET 986 -14.124 -3.267 1.635 568 1HE MET 986 1HE MET 986 -15.354 -5.165 1.186 569 2HE MET 986 2HE MET 986 -13.787 -6.009 1.206 570 3HE MET 986 3HE MET 986 -15.203 -6.741 2.000 571 H ALA 987 H ALA 987 -9.203 -3.591 1.415 572 HA ALA 987 HA ALA 987 -8.183 -1.187 2.519 573 1HB ALA 987 1HB ALA 987 -6.729 -3.482 1.143 574 2HB ALA 987 2HB ALA 987 -6.031 -2.300 2.276 575 3HB ALA 987 3HB ALA 987 -7.231 -3.482 2.851 576 H GLN 988 H GLN 988 -8.716 -2.471 -0.753 577 HA GLN 988 HA GLN 988 -6.950 -0.770 -2.061 578 1HB GLN 988 1HB GLN 988 -9.458 -2.244 -2.939 579 2HB GLN 988 2HB GLN 988 -8.540 -1.258 -4.059 580 1HG GLN 988 1HG GLN 988 -6.494 -2.706 -2.981 581 2HG GLN 988 2HG GLN 988 -7.796 -3.859 -2.763 582 1HE2 GLN 988 1HE2 GLN 988 -7.121 -5.307 -4.259 583 2HE2 GLN 988 2HE2 GLN 988 -7.117 -5.030 -5.969 584 H LYS 989 H LYS 989 -10.545 -0.536 -1.551 585 HA LYS 989 HA LYS 989 -10.889 1.917 -2.761 586 1HB LYS 989 1HB LYS 989 -12.504 0.077 -1.576 587 2HB LYS 989 2HB LYS 989 -12.550 1.350 -0.373 588 1HG LYS 989 1HG LYS 989 -13.050 2.992 -2.289 589 2HG LYS 989 2HG LYS 989 -13.246 1.598 -3.333 590 1HD LYS 989 1HD LYS 989 -14.793 1.026 -1.011 591 2HD LYS 989 2HD LYS 989 -15.115 2.708 -1.381 592 1HE LYS 989 1HE LYS 989 -15.134 0.725 -3.659 593 2HE LYS 989 2HE LYS 989 -16.498 0.731 -2.559 594 1HZ LYS 989 1HZ LYS 989 -16.849 2.233 -4.375 595 2HZ LYS 989 2HZ LYS 989 -16.748 3.088 -2.987 596 3HZ LYS 989 3HZ LYS 989 -15.489 3.068 -4.028 597 H LEU 990 H LEU 990 -9.572 1.060 0.429 598 HA LEU 990 HA LEU 990 -9.818 3.548 1.644 599 1HB LEU 990 1HB LEU 990 -8.561 1.025 2.137 600 2HB LEU 990 2HB LEU 990 -7.413 2.302 2.488 601 HG LEU 990 HG LEU 990 -10.108 2.770 3.593 602 1HD1 LEU 990 1HD1 LEU 990 -9.595 1.150 5.518 603 2HD1 LEU 990 2HD1 LEU 990 -10.253 0.475 4.008 604 3HD1 LEU 990 3HD1 LEU 990 -8.515 0.331 4.364 605 1HD2 LEU 990 1HD2 LEU 990 -7.713 3.902 3.974 606 2HD2 LEU 990 2HD2 LEU 990 -8.980 3.870 5.223 607 3HD2 LEU 990 3HD2 LEU 990 -7.655 2.683 5.271 608 H LEU 991 H LEU 991 -7.084 2.140 -0.286 609 HA LEU 991 HA LEU 991 -5.343 4.212 -0.147 610 1HB LEU 991 1HB LEU 991 -5.111 1.960 -1.271 611 2HB LEU 991 2HB LEU 991 -5.923 2.651 -2.662 612 HG LEU 991 HG LEU 991 -4.138 4.237 -3.012 613 1HD1 LEU 991 1HD1 LEU 991 -2.035 3.630 -1.369 614 2HD1 LEU 991 2HD1 LEU 991 -3.134 5.016 -1.169 615 3HD1 LEU 991 3HD1 LEU 991 -3.419 3.516 -0.255 616 1HD2 LEU 991 1HD2 LEU 991 -3.217 1.388 -2.593 617 2HD2 LEU 991 2HD2 LEU 991 -3.760 2.168 -4.098 618 3HD2 LEU 991 3HD2 LEU 991 -2.208 2.637 -3.362 619 H ASN 992 H ASN 992 -7.886 3.818 -2.720 620 HA ASN 992 HA ASN 992 -7.470 6.215 -3.918 621 1HB ASN 992 1HB ASN 992 -8.974 4.584 -4.915 622 2HB ASN 992 2HB ASN 992 -10.017 4.579 -3.506 623 1HD2 ASN 992 1HD2 ASN 992 -11.403 6.294 -3.098 624 2HD2 ASN 992 2HD2 ASN 992 -11.856 7.451 -4.306 625 H SER 993 H SER 993 -10.023 5.384 -1.439 626 HA SER 993 HA SER 993 -11.136 7.767 -1.070 627 1HB SER 993 1HB SER 993 -10.946 5.328 0.388 628 2HB SER 993 2HB SER 993 -10.625 6.600 1.549 629 HG SER 993 HG SER 993 -12.998 5.997 0.134 630 H ASP 994 H ASP 994 -8.260 6.573 0.827 631 HA ASP 994 HA ASP 994 -7.818 8.901 2.181 632 1HB ASP 994 1HB ASP 994 -5.832 6.814 1.170 633 2HB ASP 994 2HB ASP 994 -5.413 8.057 2.333 634 H LEU 995 H LEU 995 -6.444 7.689 -0.960 635 HA LEU 995 HA LEU 995 -4.697 9.734 -1.488 636 1HB LEU 995 1HB LEU 995 -6.089 7.640 -2.980 637 2HB LEU 995 2HB LEU 995 -5.721 9.047 -3.957 638 HG LEU 995 HG LEU 995 -4.038 6.989 -3.646 639 1HD1 LEU 995 1HD1 LEU 995 -2.171 8.818 -4.043 640 2HD1 LEU 995 2HD1 LEU 995 -3.424 8.485 -5.262 641 3HD1 LEU 995 3HD1 LEU 995 -3.582 9.893 -4.185 642 1HD2 LEU 995 1HD2 LEU 995 -2.704 8.841 -1.737 643 2HD2 LEU 995 2HD2 LEU 995 -3.993 7.793 -1.098 644 3HD2 LEU 995 3HD2 LEU 995 -2.581 7.073 -1.908 645 H ALA 996 H ALA 996 -8.167 9.486 -2.546 646 HA ALA 996 HA ALA 996 -8.419 11.852 -3.818 647 1HB ALA 996 1HB ALA 996 -10.666 11.440 -3.666 648 2HB ALA 996 2HB ALA 996 -10.099 9.875 -3.036 649 3HB ALA 996 3HB ALA 996 -10.604 11.157 -1.909 650 H GLU 997 H GLU 997 -8.471 11.276 -0.251 651 HA GLU 997 HA GLU 997 -9.111 13.871 0.440 652 1HB GLU 997 1HB GLU 997 -8.820 11.565 1.815 653 2HB GLU 997 2HB GLU 997 -7.272 12.286 2.210 654 1HG GLU 997 1HG GLU 997 -8.221 13.809 3.614 655 2HG GLU 997 2HG GLU 997 -9.443 14.252 2.439 656 H LEU 998 H LEU 998 -5.991 12.298 -0.354 657 HA LEU 998 HA LEU 998 -4.463 14.586 0.449 658 1HB LEU 998 1HB LEU 998 -3.452 12.473 0.710 659 2HB LEU 998 2HB LEU 998 -3.838 11.985 -0.929 660 HG LEU 998 HG LEU 998 -2.145 14.384 -0.808 661 1HD1 LEU 998 1HD1 LEU 998 -0.224 12.444 -0.330 662 2HD1 LEU 998 2HD1 LEU 998 -0.739 13.727 0.790 663 3HD1 LEU 998 3HD1 LEU 998 -1.476 12.110 0.890 664 1HD2 LEU 998 1HD2 LEU 998 -2.761 12.871 -2.801 665 2HD2 LEU 998 2HD2 LEU 998 -1.076 13.420 -2.641 666 3HD2 LEU 998 3HD2 LEU 998 -1.522 11.766 -2.160 667 H ILE 999 H ILE 999 -5.624 13.113 -2.638 668 HA ILE 999 HA ILE 999 -4.341 14.848 -4.362 669 HB ILE 999 HB ILE 999 -6.969 13.383 -4.576 670 1HG1 ILE 999 1HG1 ILE 999 -4.993 11.963 -4.267 671 2HG1 ILE 999 2HG1 ILE 999 -5.702 11.759 -5.857 672 1HG2 ILE 999 1HG2 ILE 999 -5.925 13.859 -7.147 673 2HG2 ILE 999 2HG2 ILE 999 -7.417 14.514 -6.431 674 3HG2 ILE 999 3HG2 ILE 999 -5.894 15.425 -6.301 675 1HD1 ILE 999 1HD1 ILE 999 -3.344 11.915 -6.233 676 2HD1 ILE 999 2HD1 ILE 999 -3.992 13.507 -6.694 677 3HD1 ILE 999 3HD1 ILE 999 -3.182 13.298 -5.123 678 H ASN1000 H ASN1000 -7.465 15.183 -2.593 679 HA ASN1000 HA ASN1000 -8.184 17.558 -3.841 680 1HB ASN1000 1HB ASN1000 -9.496 15.883 -2.210 681 2HB ASN1000 2HB ASN1000 -8.924 16.966 -0.957 682 1HD2 ASN1000 1HD2 ASN1000 -11.141 17.438 -0.570 683 2HD2 ASN1000 2HD2 ASN1000 -11.997 18.597 -1.532 684 H LYS1001 H LYS1001 -6.731 16.851 -0.567 685 HA LYS1001 HA LYS1001 -6.416 19.311 0.436 686 1HB LYS1001 1HB LYS1001 -4.590 16.910 0.520 687 2HB LYS1001 2HB LYS1001 -4.211 18.374 1.404 688 1HG LYS1001 1HG LYS1001 -7.003 17.282 1.686 689 2HG LYS1001 2HG LYS1001 -5.713 16.391 2.467 690 1HD LYS1001 1HD LYS1001 -5.002 18.410 3.700 691 2HD LYS1001 2HD LYS1001 -6.179 19.386 2.843 692 1HE LYS1001 1HE LYS1001 -7.405 17.020 4.121 693 2HE LYS1001 2HE LYS1001 -6.599 18.059 5.280 694 1HZ LYS1001 1HZ LYS1001 -7.837 19.892 3.967 695 2HZ LYS1001 2HZ LYS1001 -8.835 18.674 3.534 696 3HZ LYS1001 3HZ LYS1001 -8.623 19.035 5.113 697 H MET1002 H MET1002 -4.538 17.847 -2.241 698 HA MET1002 HA MET1002 -2.707 20.004 -2.323 699 1HB MET1002 1HB MET1002 -2.036 17.803 -3.156 700 2HB MET1002 2HB MET1002 -3.428 17.708 -4.216 701 1HG MET1002 1HG MET1002 -2.021 20.127 -4.889 702 2HG MET1002 2HG MET1002 -0.824 18.854 -4.764 703 1HE MET1002 1HE MET1002 -3.430 19.920 -8.017 704 2HE MET1002 2HE MET1002 -4.594 19.281 -6.832 705 3HE MET1002 3HE MET1002 -3.436 20.545 -6.350 706 H LYS1003 H LYS1003 -5.603 18.996 -4.250 707 HA LYS1003 HA LYS1003 -5.479 20.951 -6.184 708 1HB LYS1003 1HB LYS1003 -7.446 19.067 -5.135 709 2HB LYS1003 2HB LYS1003 -8.196 20.550 -5.690 710 1HG LYS1003 1HG LYS1003 -6.537 20.213 -7.776 711 2HG LYS1003 2HG LYS1003 -6.572 18.541 -7.254 712 1HD LYS1003 1HD LYS1003 -8.411 18.513 -8.667 713 2HD LYS1003 2HD LYS1003 -9.220 18.962 -7.179 714 1HE LYS1003 1HE LYS1003 -9.803 20.999 -8.008 715 2HE LYS1003 2HE LYS1003 -8.159 21.343 -8.507 716 1HZ LYS1003 1HZ LYS1003 -9.082 19.436 -10.235 717 2HZ LYS1003 2HZ LYS1003 -10.320 20.488 -10.074 718 3HZ LYS1003 3HZ LYS1003 -8.853 21.021 -10.556 719 H LEU1004 H LEU1004 -6.140 21.209 -2.757 720 HA LEU1004 HA LEU1004 -7.383 23.813 -3.092 721 1HB LEU1004 1HB LEU1004 -6.717 22.377 -0.527 722 2HB LEU1004 2HB LEU1004 -7.824 23.716 -0.756 723 HG LEU1004 HG LEU1004 -8.236 20.963 -1.953 724 1HD1 LEU1004 1HD1 LEU1004 -10.160 21.217 -0.033 725 2HD1 LEU1004 2HD1 LEU1004 -8.633 20.322 0.159 726 3HD1 LEU1004 3HD1 LEU1004 -8.766 21.995 0.754 727 1HD2 LEU1004 1HD2 LEU1004 -9.385 22.686 -3.196 728 2HD2 LEU1004 2HD2 LEU1004 -10.566 21.742 -2.257 729 3HD2 LEU1004 3HD2 LEU1004 -10.074 23.359 -1.700 730 H ALA1005 H ALA1005 -4.419 22.296 -1.674 731 HA ALA1005 HA ALA1005 -3.227 24.536 -0.671 732 1HB ALA1005 1HB ALA1005 -2.398 21.878 -1.670 733 2HB ALA1005 2HB ALA1005 -1.112 23.109 -1.708 734 3HB ALA1005 3HB ALA1005 -1.940 22.733 -0.177 735 H GLN1006 H GLN1006 -3.848 23.654 -4.025 736 HA GLN1006 HA GLN1006 -1.858 25.258 -5.156 737 1HB GLN1006 1HB GLN1006 -3.581 23.377 -6.113 738 2HB GLN1006 2HB GLN1006 -4.411 24.822 -6.657 739 1HG GLN1006 1HG GLN1006 -2.967 24.433 -8.459 740 2HG GLN1006 2HG GLN1006 -2.025 25.571 -7.517 741 1HE2 GLN1006 1HE2 GLN1006 0.014 25.033 -7.659 742 2HE2 GLN1006 2HE2 GLN1006 0.701 23.458 -7.443 743 H GLN1007 H GLN1007 -5.200 25.850 -4.028 744 HA GLN1007 HA GLN1007 -5.058 28.541 -5.076 745 1HB GLN1007 1HB GLN1007 -7.134 26.839 -5.070 746 2HB GLN1007 2HB GLN1007 -7.408 27.533 -3.485 747 1HG GLN1007 1HG GLN1007 -6.794 29.621 -5.456 748 2HG GLN1007 2HG GLN1007 -8.156 28.649 -5.975 749 1HE2 GLN1007 1HE2 GLN1007 -6.822 30.290 -3.120 750 2HE2 GLN1007 2HE2 GLN1007 -8.324 30.836 -2.452 751 H TYR1008 H TYR1008 -4.813 26.679 -2.079 752 HA TYR1008 HA TYR1008 -4.996 29.088 -0.458 753 1HB TYR1008 1HB TYR1008 -4.787 26.056 -0.117 754 2HB TYR1008 2HB TYR1008 -4.418 27.078 1.259 755 HD1 TYR1008 HD1 TYR1008 -7.095 26.118 -1.127 756 HD2 TYR1008 HD2 TYR1008 -6.153 28.119 2.535 757 HE1 TYR1008 HE1 TYR1008 -9.569 26.260 -0.560 758 HE2 TYR1008 HE2 TYR1008 -8.630 28.254 3.090 759 HH TYR1008 HH TYR1008 -10.973 26.489 1.316 760 H VAL1009 H VAL1009 -2.808 28.968 -2.378 761 HA VAL1009 HA VAL1009 -0.582 28.819 -0.467 762 HB VAL1009 HB VAL1009 -0.306 26.958 -1.878 763 1HG1 VAL1009 1HG1 VAL1009 -0.719 28.713 -4.318 764 2HG1 VAL1009 2HG1 VAL1009 -0.530 26.943 -4.267 765 3HG1 VAL1009 3HG1 VAL1009 -1.991 27.703 -3.591 766 1HG2 VAL1009 1HG2 VAL1009 1.454 29.255 -2.159 767 2HG2 VAL1009 2HG2 VAL1009 1.852 27.529 -1.976 768 3HG2 VAL1009 3HG2 VAL1009 1.528 28.201 -3.592 769 H MET1010 H MET1010 -2.012 30.304 -3.425 770 HA MET1010 HA MET1010 -0.069 32.314 -3.588 771 1HB MET1010 1HB MET1010 -1.829 33.384 -5.114 772 2HB MET1010 2HB MET1010 -1.428 31.731 -5.535 773 1HG MET1010 1HG MET1010 -3.640 31.231 -5.382 774 2HG MET1010 2HG MET1010 -3.520 31.472 -3.651 775 1HE MET1010 1HE MET1010 -4.586 32.723 -2.469 776 2HE MET1010 2HE MET1010 -5.101 34.411 -2.703 777 3HE MET1010 3HE MET1010 -6.176 33.076 -3.186 778 H THR1011 H THR1011 -0.383 32.520 -0.993 779 HA THR1011 HA THR1011 -1.272 35.118 -0.537 780 HB THR1011 HB THR1011 -3.554 34.569 -0.635 781 HG1 THR1011 HG1 THR1011 -3.308 35.257 1.518 782 1HG2 THR1011 1HG2 THR1011 -3.122 32.062 -0.998 783 2HG2 THR1011 2HG2 THR1011 -2.981 31.912 0.770 784 3HG2 THR1011 3HG2 THR1011 -4.519 32.434 0.041 785 H SER1012 H SER1012 -1.086 31.863 1.045 786 HA SER1012 HA SER1012 1.185 32.108 2.316 787 1HB SER1012 1HB SER1012 0.983 34.030 3.559 788 2HB SER1012 2HB SER1012 -0.768 33.965 3.578 789 HG SER1012 HG SER1012 1.023 32.363 5.198 790 H LEU1013 H LEU1013 -2.247 31.318 2.462 791 HA LEU1013 HA LEU1013 -2.468 29.649 4.574 792 1HB LEU1013 1HB LEU1013 -3.603 29.500 1.792 793 2HB LEU1013 2HB LEU1013 -4.030 28.326 3.021 794 HG LEU1013 HG LEU1013 -5.511 30.455 2.586 795 1HD1 LEU1013 1HD1 LEU1013 -5.778 30.430 5.296 796 2HD1 LEU1013 2HD1 LEU1013 -6.473 29.218 4.193 797 3HD1 LEU1013 3HD1 LEU1013 -4.929 28.891 5.016 798 1HD2 LEU1013 1HD2 LEU1013 -3.952 32.202 2.840 799 2HD2 LEU1013 2HD2 LEU1013 -4.944 32.230 4.318 800 3HD2 LEU1013 3HD2 LEU1013 -3.310 31.524 4.356 801 H GLN1014 H GLN1014 -0.512 29.215 1.668 802 HA GLN1014 HA GLN1014 -0.199 26.639 1.350 803 1HB GLN1014 1HB GLN1014 1.190 28.195 0.143 804 2HB GLN1014 2HB GLN1014 1.973 28.752 1.608 805 1HG GLN1014 1HG GLN1014 2.227 25.834 1.263 806 2HG GLN1014 2HG GLN1014 2.895 26.715 -0.096 807 1HE2 GLN1014 1HE2 GLN1014 4.373 28.505 0.380 808 2HE2 GLN1014 2HE2 GLN1014 5.467 28.373 1.717 809 H GLN1015 H GLN1015 2.232 28.173 3.553 810 HA GLN1015 HA GLN1015 3.121 26.032 4.784 811 1HB GLN1015 1HB GLN1015 3.382 27.508 6.873 812 2HB GLN1015 2HB GLN1015 4.052 28.137 5.381 813 1HG GLN1015 1HG GLN1015 2.686 29.948 5.450 814 2HG GLN1015 2HG GLN1015 1.262 28.935 5.582 815 1HE2 GLN1015 1HE2 GLN1015 0.709 30.901 6.907 816 2HE2 GLN1015 2HE2 GLN1015 1.032 30.844 8.608 817 H GLU1016 H GLU1016 -0.073 27.534 5.331 818 HA GLU1016 HA GLU1016 -0.650 26.086 7.656 819 1HB GLU1016 1HB GLU1016 -1.835 28.160 6.215 820 2HB GLU1016 2HB GLU1016 -2.972 26.846 5.994 821 1HG GLU1016 1HG GLU1016 -3.316 26.585 8.352 822 2HG GLU1016 2HG GLU1016 -1.871 27.491 8.753 823 H TYR1017 H TYR1017 -1.856 25.702 4.239 824 HA TYR1017 HA TYR1017 -3.059 23.205 4.765 825 1HB TYR1017 1HB TYR1017 -2.255 24.996 2.457 826 2HB TYR1017 2HB TYR1017 -2.568 23.323 2.041 827 HD1 TYR1017 HD1 TYR1017 -4.201 25.908 4.235 828 HD2 TYR1017 HD2 TYR1017 -4.683 22.940 1.191 829 HE1 TYR1017 HE1 TYR1017 -6.696 26.390 4.150 830 HE2 TYR1017 HE2 TYR1017 -7.176 23.432 1.116 831 HH TYR1017 HH TYR1017 -8.792 24.644 1.868 832 H LYS1018 H LYS1018 0.239 24.142 4.421 833 HA LYS1018 HA LYS1018 1.186 21.844 3.075 834 1HB LYS1018 1HB LYS1018 2.224 24.300 3.987 835 2HB LYS1018 2HB LYS1018 3.134 23.067 4.836 836 1HG LYS1018 1HG LYS1018 4.202 23.597 2.667 837 2HG LYS1018 2HG LYS1018 3.657 21.932 2.694 838 1HD LYS1018 1HD LYS1018 1.975 22.299 1.134 839 2HD LYS1018 2HD LYS1018 1.683 23.942 1.668 840 1HE LYS1018 1HE LYS1018 3.738 24.726 0.553 841 2HE LYS1018 2HE LYS1018 4.181 23.083 0.132 842 1HZ LYS1018 1HZ LYS1018 1.840 24.562 -0.844 843 2HZ LYS1018 2HZ LYS1018 3.138 24.088 -1.715 844 3HZ LYS1018 3HZ LYS1018 2.092 22.975 -1.137 845 H LYS1019 H LYS1019 0.973 22.795 6.567 846 HA LYS1019 HA LYS1019 2.064 20.400 7.520 847 1HB LYS1019 1HB LYS1019 0.620 22.741 8.640 848 2HB LYS1019 2HB LYS1019 0.538 21.269 9.587 849 1HG LYS1019 1HG LYS1019 2.508 22.351 10.370 850 2HG LYS1019 2HG LYS1019 3.107 21.104 9.294 851 1HD LYS1019 1HD LYS1019 2.506 23.661 7.911 852 2HD LYS1019 2HD LYS1019 3.748 23.810 9.139 853 1HE LYS1019 1HE LYS1019 3.800 21.625 7.009 854 2HE LYS1019 2HE LYS1019 4.562 23.187 6.778 855 1HZ LYS1019 1HZ LYS1019 5.984 21.379 7.707 856 2HZ LYS1019 2HZ LYS1019 6.008 22.781 8.544 857 3HZ LYS1019 3HZ LYS1019 5.152 21.508 9.106 858 H GLN1020 H GLN1020 -1.281 21.426 6.701 859 HA GLN1020 HA GLN1020 -2.595 19.304 7.829 860 1HB GLN1020 1HB GLN1020 -3.283 20.792 5.255 861 2HB GLN1020 2HB GLN1020 -4.402 19.819 6.188 862 1HG GLN1020 1HG GLN1020 -2.959 22.322 7.184 863 2HG GLN1020 2HG GLN1020 -4.649 22.230 6.729 864 1HE2 GLN1020 1HE2 GLN1020 -2.492 22.117 9.231 865 2HE2 GLN1020 2HE2 GLN1020 -3.446 21.349 10.456 866 H MET1021 H MET1021 -1.306 19.659 4.449 867 HA MET1021 HA MET1021 -2.116 17.305 3.432 868 1HB MET1021 1HB MET1021 -0.424 19.359 2.669 869 2HB MET1021 2HB MET1021 0.737 18.059 2.860 870 1HG MET1021 1HG MET1021 -1.607 17.062 1.441 871 2HG MET1021 2HG MET1021 -1.021 18.511 0.650 872 1HE MET1021 1HE MET1021 1.143 14.549 1.288 873 2HE MET1021 2HE MET1021 1.313 15.709 2.627 874 3HE MET1021 3HE MET1021 -0.304 15.169 2.117 875 H LEU1022 H LEU1022 0.829 17.910 5.448 876 HA LEU1022 HA LEU1022 1.955 15.406 5.258 877 1HB LEU1022 1HB LEU1022 3.075 17.318 6.213 878 2HB LEU1022 2HB LEU1022 1.930 17.386 7.538 879 HG LEU1022 HG LEU1022 4.074 16.440 8.233 880 1HD1 LEU1022 1HD1 LEU1022 3.143 14.978 9.675 881 2HD1 LEU1022 2HD1 LEU1022 1.626 15.557 8.945 882 3HD1 LEU1022 3HD1 LEU1022 2.357 14.032 8.388 883 1HD2 LEU1022 1HD2 LEU1022 3.607 13.967 6.604 884 2HD2 LEU1022 2HD2 LEU1022 4.407 15.374 5.864 885 3HD2 LEU1022 3HD2 LEU1022 5.112 14.607 7.307 886 H THR1023 H THR1023 -0.426 16.628 7.714 887 HA THR1023 HA THR1023 -0.732 14.473 9.279 888 HB THR1023 HB THR1023 -3.145 15.926 8.121 889 HG1 THR1023 HG1 THR1023 -2.296 17.787 9.078 890 1HG2 THR1023 1HG2 THR1023 -2.343 15.544 11.033 891 2HG2 THR1023 2HG2 THR1023 -3.961 15.862 10.365 892 3HG2 THR1023 3HG2 THR1023 -3.213 14.260 10.159 893 H ALA1024 H ALA1024 -2.308 14.852 6.041 894 HA ALA1024 HA ALA1024 -3.613 12.394 6.107 895 1HB ALA1024 1HB ALA1024 -2.863 13.047 3.426 896 2HB ALA1024 2HB ALA1024 -4.425 13.324 4.233 897 3HB ALA1024 3HB ALA1024 -3.160 14.575 4.290 898 H ALA1025 H ALA1025 -0.417 13.335 4.655 899 HA ALA1025 HA ALA1025 0.312 10.923 3.633 900 1HB ALA1025 1HB ALA1025 2.677 11.732 4.153 901 2HB ALA1025 2HB ALA1025 1.646 12.874 3.257 902 3HB ALA1025 3HB ALA1025 1.924 13.105 5.000 903 H HIS1026 H HIS1026 -0.040 11.878 7.012 904 HA HIS1026 HA HIS1026 1.600 9.856 8.084 905 1HB HIS1026 1HB HIS1026 0.704 12.035 9.152 906 2HB HIS1026 2HB HIS1026 -0.753 11.120 9.487 907 HD1 HIS1026 HD1 HIS1026 2.777 11.578 10.605 908 HD2 HIS1026 HD2 HIS1026 -0.424 8.980 11.383 909 HE1 HIS1026 HE1 HIS1026 3.383 10.315 12.738 910 H ALA1027 H ALA1027 -2.014 10.153 7.780 911 HA ALA1027 HA ALA1027 -2.414 7.454 8.562 912 1HB ALA1027 1HB ALA1027 -4.273 8.727 9.019 913 2HB ALA1027 2HB ALA1027 -4.049 9.764 7.589 914 3HB ALA1027 3HB ALA1027 -4.746 8.137 7.407 915 H LEU1028 H LEU1028 -1.965 9.206 5.479 916 HA LEU1028 HA LEU1028 -2.874 7.175 3.791 917 1HB LEU1028 1HB LEU1028 -1.153 9.593 3.536 918 2HB LEU1028 2HB LEU1028 -1.108 8.415 2.239 919 HG LEU1028 HG LEU1028 -2.746 10.427 2.109 920 1HD1 LEU1028 1HD1 LEU1028 -3.653 7.598 1.509 921 2HD1 LEU1028 2HD1 LEU1028 -4.360 9.080 0.823 922 3HD1 LEU1028 3HD1 LEU1028 -2.672 8.649 0.460 923 1HD2 LEU1028 1HD2 LEU1028 -3.771 10.236 4.280 924 2HD2 LEU1028 2HD2 LEU1028 -4.998 9.928 3.028 925 3HD2 LEU1028 3HD2 LEU1028 -4.292 8.569 3.936 926 H ALA1029 H ALA1029 0.552 8.074 4.625 927 HA ALA1029 HA ALA1029 1.842 6.028 3.447 928 1HB ALA1029 1HB ALA1029 3.422 6.234 5.505 929 2HB ALA1029 2HB ALA1029 3.133 7.684 4.513 930 3HB ALA1029 3HB ALA1029 2.283 7.483 6.064 931 H VAL1030 H VAL1030 0.016 5.944 6.551 932 HA VAL1030 HA VAL1030 0.766 3.257 7.113 933 HB VAL1030 HB VAL1030 -1.134 5.288 8.215 934 1HG1 VAL1030 1HG1 VAL1030 -1.104 2.368 9.054 935 2HG1 VAL1030 2HG1 VAL1030 -2.006 3.684 9.843 936 3HG1 VAL1030 3HG1 VAL1030 -2.425 3.186 8.186 937 1HG2 VAL1030 1HG2 VAL1030 0.255 4.231 10.306 938 2HG2 VAL1030 2HG2 VAL1030 1.415 3.990 8.979 939 3HG2 VAL1030 3HG2 VAL1030 0.800 5.622 9.338 940 H ASP1031 H ASP1031 -2.233 4.871 5.856 941 HA ASP1031 HA ASP1031 -3.883 2.837 5.621 942 1HB ASP1031 1HB ASP1031 -4.746 4.786 4.703 943 2HB ASP1031 2HB ASP1031 -3.255 5.184 3.873 944 H ALA1032 H ALA1032 -1.345 3.717 3.150 945 HA ALA1032 HA ALA1032 -1.768 1.592 1.435 946 1HB ALA1032 1HB ALA1032 0.479 3.476 2.068 947 2HB ALA1032 2HB ALA1032 0.832 2.066 1.041 948 3HB ALA1032 3HB ALA1032 -0.414 3.237 0.547 949 H LYS1033 H LYS1033 0.240 1.862 4.414 950 HA LYS1033 HA LYS1033 1.484 -0.634 4.135 951 1HB LYS1033 1HB LYS1033 0.961 1.160 6.515 952 2HB LYS1033 2HB LYS1033 1.861 -0.338 6.638 953 1HG LYS1033 1HG LYS1033 2.607 1.738 4.549 954 2HG LYS1033 2HG LYS1033 3.172 1.898 6.200 955 1HD LYS1033 1HD LYS1033 3.974 -0.592 5.940 956 2HD LYS1033 2HD LYS1033 3.769 -0.328 4.220 957 1HE LYS1033 1HE LYS1033 5.620 1.020 4.075 958 2HE LYS1033 2HE LYS1033 5.243 1.867 5.562 959 1HZ LYS1033 1HZ LYS1033 6.592 0.542 6.676 960 2HZ LYS1033 2HZ LYS1033 5.973 -0.826 6.034 961 3HZ LYS1033 3HZ LYS1033 7.153 -0.016 5.248 962 H ASN1034 H ASN1034 -1.553 0.430 5.776 963 HA ASN1034 HA ASN1034 -2.144 -1.932 6.997 964 1HB ASN1034 1HB ASN1034 -3.372 0.462 6.880 965 2HB ASN1034 2HB ASN1034 -4.353 -0.337 5.667 966 1HD2 ASN1034 1HD2 ASN1034 -6.054 0.094 7.233 967 2HD2 ASN1034 2HD2 ASN1034 -6.363 -1.039 8.506 968 H LEU1035 H LEU1035 -2.299 -0.944 3.593 969 HA LEU1035 HA LEU1035 -4.153 -2.840 2.686 970 1HB LEU1035 1HB LEU1035 -3.242 -0.725 1.565 971 2HB LEU1035 2HB LEU1035 -1.870 -1.705 1.086 972 HG LEU1035 HG LEU1035 -4.441 -2.952 0.425 973 1HD1 LEU1035 1HD1 LEU1035 -3.849 -0.620 -1.330 974 2HD1 LEU1035 2HD1 LEU1035 -5.391 -1.436 -0.978 975 3HD1 LEU1035 3HD1 LEU1035 -4.690 -0.309 0.207 976 1HD2 LEU1035 1HD2 LEU1035 -3.035 -2.630 -1.903 977 2HD2 LEU1035 2HD2 LEU1035 -1.739 -2.635 -0.683 978 3HD2 LEU1035 3HD2 LEU1035 -2.875 -4.002 -0.780 979 H LEU1036 H LEU1036 -0.521 -2.856 2.452 980 HA LEU1036 HA LEU1036 -0.459 -5.567 1.684 981 1HB LEU1036 1HB LEU1036 1.261 -3.507 1.554 982 2HB LEU1036 2HB LEU1036 1.903 -4.316 2.970 983 HG LEU1036 HG LEU1036 1.553 -6.395 1.157 984 1HD1 LEU1036 1HD1 LEU1036 2.128 -5.791 -0.966 985 2HD1 LEU1036 2HD1 LEU1036 1.233 -4.332 -0.479 986 3HD1 LEU1036 3HD1 LEU1036 3.013 -4.339 -0.441 987 1HD2 LEU1036 1HD2 LEU1036 3.784 -4.893 2.362 988 2HD2 LEU1036 2HD2 LEU1036 3.487 -6.645 2.266 989 3HD2 LEU1036 3HD2 LEU1036 4.192 -5.785 0.876 990 H ASP1037 H ASP1037 -0.291 -3.837 4.818 991 HA ASP1037 HA ASP1037 0.699 -5.612 6.480 992 1HB ASP1037 1HB ASP1037 -0.538 -3.401 6.977 993 2HB ASP1037 2HB ASP1037 -2.022 -4.332 6.993 994 H VAL1038 H VAL1038 -2.855 -5.529 5.627 995 HA VAL1038 HA VAL1038 -3.546 -7.914 6.808 996 HB VAL1038 HB VAL1038 -5.192 -6.358 6.113 997 1HG1 VAL1038 1HG1 VAL1038 -4.224 -5.209 4.294 998 2HG1 VAL1038 2HG1 VAL1038 -4.018 -6.702 3.347 999 3HG1 VAL1038 3HG1 VAL1038 -5.646 -6.032 3.610 1000 1HG2 VAL1038 1HG2 VAL1038 -6.597 -8.068 5.852 1001 2HG2 VAL1038 2HG2 VAL1038 -6.181 -8.129 4.123 1002 3HG2 VAL1038 3HG2 VAL1038 -5.266 -9.110 5.293 1003 H ILE1039 H ILE1039 -2.186 -7.248 3.542 1004 HA ILE1039 HA ILE1039 -2.500 -9.825 2.533 1005 HB ILE1039 HB ILE1039 -0.927 -7.407 1.889 1006 1HG1 ILE1039 1HG1 ILE1039 -2.542 -9.297 0.155 1007 2HG1 ILE1039 2HG1 ILE1039 -3.222 -7.933 1.019 1008 1HG2 ILE1039 1HG2 ILE1039 0.208 -8.767 0.012 1009 2HG2 ILE1039 2HG2 ILE1039 0.915 -8.810 1.645 1010 3HG2 ILE1039 3HG2 ILE1039 -0.071 -10.174 1.066 1011 1HD1 ILE1039 1HD1 ILE1039 -0.848 -7.097 -0.462 1012 2HD1 ILE1039 2HD1 ILE1039 -2.020 -7.892 -1.540 1013 3HD1 ILE1039 3HD1 ILE1039 -2.516 -6.483 -0.572 1014 H ASP1040 H ASP1040 0.236 -8.275 4.330 1015 HA ASP1040 HA ASP1040 2.017 -10.283 4.201 1016 1HB ASP1040 1HB ASP1040 1.683 -7.937 5.695 1017 2HB ASP1040 2HB ASP1040 1.760 -9.174 6.934 1018 H GLN1041 H GLN1041 -0.823 -9.885 6.406 1019 HA GLN1041 HA GLN1041 -0.260 -12.071 8.022 1020 1HB GLN1041 1HB GLN1041 -2.616 -10.316 7.472 1021 2HB GLN1041 2HB GLN1041 -2.982 -11.874 8.185 1022 1HG GLN1041 1HG GLN1041 -2.614 -10.550 10.092 1023 2HG GLN1041 2HG GLN1041 -1.049 -11.309 9.878 1024 1HE2 GLN1041 1HE2 GLN1041 -2.886 -8.397 9.771 1025 2HE2 GLN1041 2HE2 GLN1041 -1.598 -7.276 9.482 1026 H ALA1042 H ALA1042 -1.571 -11.789 4.773 1027 HA ALA1042 HA ALA1042 -2.869 -14.340 4.794 1028 1HB ALA1042 1HB ALA1042 -3.746 -13.571 2.863 1029 2HB ALA1042 2HB ALA1042 -2.929 -12.032 3.226 1030 3HB ALA1042 3HB ALA1042 -2.138 -13.234 2.179 1031 H ARG1043 H ARG1043 0.126 -12.982 3.238 1032 HA ARG1043 HA ARG1043 1.086 -15.066 1.994 1033 1HB ARG1043 1HB ARG1043 2.172 -12.718 2.767 1034 2HB ARG1043 2HB ARG1043 3.021 -13.745 3.904 1035 1HG ARG1043 1HG ARG1043 4.186 -14.894 2.226 1036 2HG ARG1043 2HG ARG1043 2.939 -14.629 1.023 1037 1HD ARG1043 1HD ARG1043 4.139 -12.876 0.223 1038 2HD ARG1043 2HD ARG1043 3.849 -12.027 1.728 1039 HE ARG1043 HE ARG1043 6.308 -13.448 0.962 1040 1HH1 ARG1043 2HH2 ARG1043 4.445 -12.070 3.610 1041 2HH1 ARG1043 1HH2 ARG1043 5.815 -11.904 4.656 1042 1HH2 ARG1043 2HH1 ARG1043 8.116 -13.229 2.342 1043 2HH2 ARG1043 1HH1 ARG1043 7.917 -12.567 3.930 1044 H LEU1044 H LEU1044 1.666 -14.504 5.550 1045 HA LEU1044 HA LEU1044 2.999 -16.852 6.064 1046 1HB LEU1044 1HB LEU1044 2.120 -16.516 8.408 1047 2HB LEU1044 2HB LEU1044 3.051 -15.211 7.700 1048 HG LEU1044 HG LEU1044 0.526 -14.431 7.033 1049 1HD1 LEU1044 1HD1 LEU1044 0.288 -15.788 9.733 1050 2HD1 LEU1044 2HD1 LEU1044 -0.928 -14.731 8.976 1051 3HD1 LEU1044 3HD1 LEU1044 -0.516 -16.293 8.228 1052 1HD2 LEU1044 1HD2 LEU1044 1.776 -12.761 7.927 1053 2HD2 LEU1044 2HD2 LEU1044 0.767 -13.120 9.349 1054 3HD2 LEU1044 3HD2 LEU1044 2.416 -13.781 9.238 1055 H LYS1045 H LYS1045 -0.557 -16.177 6.131 1056 HA LYS1045 HA LYS1045 -1.530 -18.483 7.078 1057 1HB LYS1045 1HB LYS1045 -2.760 -16.442 6.175 1058 2HB LYS1045 2HB LYS1045 -2.637 -17.171 4.586 1059 1HG LYS1045 1HG LYS1045 -3.604 -19.064 6.648 1060 2HG LYS1045 2HG LYS1045 -4.652 -17.672 6.457 1061 1HD LYS1045 1HD LYS1045 -4.581 -18.100 3.923 1062 2HD LYS1045 2HD LYS1045 -3.762 -19.609 4.273 1063 1HE LYS1045 1HE LYS1045 -6.439 -18.887 5.544 1064 2HE LYS1045 2HE LYS1045 -6.333 -19.716 4.004 1065 1HZ LYS1045 1HZ LYS1045 -6.444 -21.392 5.556 1066 2HZ LYS1045 2HZ LYS1045 -4.841 -21.319 5.255 1067 3HZ LYS1045 3HZ LYS1045 -5.446 -20.659 6.621 1068 H MET1046 H MET1046 0.216 -18.013 4.028 1069 HA MET1046 HA MET1046 -0.472 -20.683 3.188 1070 1HB MET1046 1HB MET1046 -0.376 -19.289 1.299 1071 2HB MET1046 2HB MET1046 0.838 -18.240 2.006 1072 1HG MET1046 1HG MET1046 2.598 -19.925 1.606 1073 2HG MET1046 2HG MET1046 1.412 -21.083 1.038 1074 1HE MET1046 1HE MET1046 2.307 -17.516 0.871 1075 2HE MET1046 2HE MET1046 3.535 -17.749 -0.396 1076 3HE MET1046 3HE MET1046 1.979 -16.983 -0.795 1077 H ILE1047 H ILE1047 2.495 -18.744 3.987 1078 HA ILE1047 HA ILE1047 4.340 -20.759 3.697 1079 HB ILE1047 HB ILE1047 4.187 -18.272 5.353 1080 1HG1 ILE1047 1HG1 ILE1047 6.437 -18.600 3.542 1081 2HG1 ILE1047 2HG1 ILE1047 4.917 -18.871 2.712 1082 1HG2 ILE1047 1HG2 ILE1047 6.781 -18.875 5.654 1083 2HG2 ILE1047 2HG2 ILE1047 5.539 -19.284 6.862 1084 3HG2 ILE1047 3HG2 ILE1047 6.099 -20.518 5.708 1085 1HD1 ILE1047 1HD1 ILE1047 5.540 -16.441 4.455 1086 2HD1 ILE1047 2HD1 ILE1047 5.578 -16.468 2.676 1087 3HD1 ILE1047 3HD1 ILE1047 4.039 -16.710 3.537 1088 H SER1048 H SER1048 2.422 -19.835 6.632 1089 HA SER1048 HA SER1048 3.534 -21.883 8.180 1090 1HB SER1048 1HB SER1048 1.639 -19.731 8.502 1091 2HB SER1048 2HB SER1048 0.911 -21.191 9.142 1092 HG SER1048 HG SER1048 2.165 -20.074 10.760 1093 H GLN1049 H GLN1049 0.420 -21.524 6.356 1094 HA GLN1049 HA GLN1049 -0.051 -24.351 6.830 1095 1HB GLN1049 1HB GLN1049 -1.753 -22.041 6.774 1096 2HB GLN1049 2HB GLN1049 -2.230 -23.064 5.433 1097 1HG GLN1049 1HG GLN1049 -3.408 -24.276 6.958 1098 2HG GLN1049 2HG GLN1049 -1.864 -24.922 7.477 1099 1HE2 GLN1049 1HE2 GLN1049 -0.625 -23.525 9.037 1100 2HE2 GLN1049 2HE2 GLN1049 -1.506 -22.783 10.330 1101 H SER1050 H SER1050 1.120 -25.483 5.289 1102 HA SER1050 HA SER1050 0.157 -25.436 2.676 1103 1HB SER1050 1HB SER1050 1.415 -23.499 2.179 1104 2HB SER1050 2HB SER1050 2.748 -23.973 3.212 1105 HG SER1050 HG SER1050 2.465 -24.399 0.557 1106 H ARG1051 H ARG1051 3.059 -26.076 4.756 1107 HA ARG1051 HA ARG1051 3.906 -28.291 3.344 1108 1HB ARG1051 1HB ARG1051 4.291 -27.333 6.203 1109 2HB ARG1051 2HB ARG1051 4.965 -28.871 5.703 1110 1HG ARG1051 1HG ARG1051 5.482 -26.280 4.177 1111 2HG ARG1051 2HG ARG1051 6.515 -26.826 5.484 1112 1HD ARG1051 1HD ARG1051 7.495 -28.451 4.195 1113 2HD ARG1051 2HD ARG1051 5.968 -28.954 3.497 1114 HE ARG1051 HE ARG1051 6.288 -27.446 1.710 1115 1HH1 ARG1051 2HH2 ARG1051 8.667 -26.856 4.234 1116 2HH1 ARG1051 1HH2 ARG1051 9.626 -25.793 3.259 1117 1HH2 ARG1051 2HH1 ARG1051 7.552 -26.043 0.423 1118 2HH2 ARG1051 1HH1 ARG1051 8.987 -25.327 1.077 1119 HA PRO1052 HA PRO1052 0.669 -30.976 4.718 1120 1HB PRO1052 1HB PRO1052 1.161 -33.016 2.967 1121 2HB PRO1052 2HB PRO1052 0.146 -31.642 2.577 1122 1HG PRO1052 1HG PRO1052 2.901 -32.224 1.679 1123 2HG PRO1052 2HG PRO1052 1.733 -31.115 0.989 1124 1HD PRO1052 1HD PRO1052 3.998 -30.433 2.612 1125 2HD PRO1052 2HD PRO1052 2.766 -29.337 2.019 1126 H HIS1053 H HIS1053 0.662 -33.638 4.981 1127 HA HIS1053 HA HIS1053 2.629 -33.892 7.072 1128 1HB HIS1053 1HB HIS1053 0.118 -34.530 7.167 1129 2HB HIS1053 2HB HIS1053 0.590 -35.968 6.283 1130 HD1 HIS1053 HD1 HIS1053 3.110 -36.900 7.637 1131 HD2 HIS1053 HD2 HIS1053 -0.117 -35.281 9.773 1132 HE1 HIS1053 HE1 HIS1053 3.334 -37.758 10.030 Start of MODEL 12 1 H MET 915 H MET 915 2.373 -22.749 -9.501 2 HA MET 915 HA MET 915 0.380 -23.245 -7.756 3 1HB MET 915 1HB MET 915 0.567 -21.354 -6.104 4 2HB MET 915 2HB MET 915 1.884 -22.496 -5.923 5 1HG MET 915 1HG MET 915 2.213 -20.077 -7.731 6 2HG MET 915 2HG MET 915 2.418 -19.910 -5.999 7 1HE MET 915 1HE MET 915 5.169 -21.615 -9.063 8 2HE MET 915 2HE MET 915 3.565 -20.863 -9.230 9 3HE MET 915 3HE MET 915 4.951 -19.890 -8.682 10 H ALA 916 H ALA 916 -1.069 -21.016 -7.448 11 HA ALA 916 HA ALA 916 -1.937 -20.310 -9.906 12 1HB ALA 916 1HB ALA 916 -2.821 -19.827 -7.484 13 2HB ALA 916 2HB ALA 916 -1.936 -18.293 -7.660 14 3HB ALA 916 3HB ALA 916 -3.236 -18.707 -8.804 15 H ASN 917 H ASN 917 -1.784 -18.230 -11.132 16 HA ASN 917 HA ASN 917 0.611 -17.745 -12.105 17 1HB ASN 917 1HB ASN 917 -1.745 -15.875 -11.656 18 2HB ASN 917 2HB ASN 917 -0.296 -15.258 -12.425 19 1HD2 ASN 917 1HD2 ASN 917 -2.714 -15.313 -13.713 20 2HD2 ASN 917 2HD2 ASN 917 -2.687 -16.442 -15.026 21 H LEU 918 H LEU 918 2.510 -17.352 -10.937 22 HA LEU 918 HA LEU 918 2.341 -15.356 -8.789 23 1HB LEU 918 1HB LEU 918 3.122 -17.967 -8.604 24 2HB LEU 918 2HB LEU 918 4.659 -17.165 -8.858 25 HG LEU 918 HG LEU 918 2.695 -16.346 -6.704 26 1HD1 LEU 918 1HD1 LEU 918 4.950 -17.605 -5.554 27 2HD1 LEU 918 2HD1 LEU 918 3.253 -18.141 -5.530 28 3HD1 LEU 918 3HD1 LEU 918 4.342 -18.693 -6.824 29 1HD2 LEU 918 1HD2 LEU 918 4.860 -15.386 -5.720 30 2HD2 LEU 918 2HD2 LEU 918 5.541 -15.591 -7.352 31 3HD2 LEU 918 3HD2 LEU 918 4.127 -14.540 -7.104 32 H ASP 919 H ASP 919 2.387 -14.030 -11.010 33 HA ASP 919 HA ASP 919 4.683 -13.890 -12.471 34 1HB ASP 919 1HB ASP 919 2.434 -12.025 -11.802 35 2HB ASP 919 2HB ASP 919 3.870 -11.273 -12.468 36 H ARG 920 H ARG 920 5.835 -11.373 -12.380 37 HA ARG 920 HA ARG 920 7.233 -11.511 -9.883 38 1HB ARG 920 1HB ARG 920 7.689 -10.263 -12.577 39 2HB ARG 920 2HB ARG 920 8.432 -9.442 -11.219 40 1HG ARG 920 1HG ARG 920 8.928 -12.226 -10.815 41 2HG ARG 920 2HG ARG 920 9.235 -11.926 -12.514 42 1HD ARG 920 1HD ARG 920 10.439 -9.719 -11.289 43 2HD ARG 920 2HD ARG 920 10.752 -11.005 -10.140 44 HE ARG 920 HE ARG 920 11.307 -11.974 -12.784 45 1HH1 ARG 920 2HH2 ARG 920 12.625 -9.736 -10.373 46 2HH1 ARG 920 1HH2 ARG 920 14.256 -9.895 -10.936 47 1HH2 ARG 920 1HH1 ARG 920 14.722 -11.340 -12.791 48 H SER 921 H SER 921 4.520 -10.651 -9.608 49 HA SER 921 HA SER 921 4.575 -7.788 -9.514 50 1HB SER 921 1HB SER 921 2.560 -9.380 -10.100 51 2HB SER 921 2HB SER 921 2.378 -9.530 -8.364 52 HG SER 921 HG SER 921 2.512 -6.966 -9.693 53 H ASN 922 H ASN 922 5.429 -10.459 -7.496 54 HA ASN 922 HA ASN 922 4.670 -9.606 -5.018 55 1HB ASN 922 1HB ASN 922 6.126 -11.716 -5.995 56 2HB ASN 922 2HB ASN 922 7.426 -10.781 -5.286 57 1HD2 ASN 922 1HD2 ASN 922 7.494 -12.797 -3.977 58 2HD2 ASN 922 2HD2 ASN 922 6.567 -12.865 -2.515 59 H ASP 923 H ASP 923 7.676 -8.925 -6.946 60 HA ASP 923 HA ASP 923 8.742 -7.244 -4.940 61 1HB ASP 923 1HB ASP 923 9.460 -8.122 -7.707 62 2HB ASP 923 2HB ASP 923 10.099 -6.560 -7.236 63 H LYS 924 H LYS 924 6.947 -6.896 -8.050 64 HA LYS 924 HA LYS 924 7.227 -4.173 -8.418 65 1HB LYS 924 1HB LYS 924 6.077 -6.168 -9.801 66 2HB LYS 924 2HB LYS 924 4.629 -5.461 -9.113 67 1HG LYS 924 1HG LYS 924 4.978 -3.371 -10.172 68 2HG LYS 924 2HG LYS 924 6.697 -3.644 -10.376 69 1HD LYS 924 1HD LYS 924 6.180 -5.469 -12.041 70 2HD LYS 924 2HD LYS 924 4.473 -5.113 -11.871 71 1HE LYS 924 1HE LYS 924 4.612 -3.154 -13.092 72 2HE LYS 924 2HE LYS 924 6.198 -2.748 -12.468 73 1HZ LYS 924 1HZ LYS 924 5.841 -4.992 -14.308 74 2HZ LYS 924 2HZ LYS 924 6.021 -3.467 -14.863 75 3HZ LYS 924 3HZ LYS 924 7.206 -4.159 -13.977 76 H VAL 925 H VAL 925 4.233 -5.756 -7.101 77 HA VAL 925 HA VAL 925 3.045 -3.538 -6.122 78 HB VAL 925 HB VAL 925 3.136 -6.325 -4.956 79 1HG1 VAL 925 1HG1 VAL 925 0.941 -5.743 -3.929 80 2HG1 VAL 925 2HG1 VAL 925 2.303 -4.816 -3.257 81 3HG1 VAL 925 3HG1 VAL 925 1.196 -4.051 -4.422 82 1HG2 VAL 925 1HG2 VAL 925 0.939 -6.537 -6.174 83 2HG2 VAL 925 2HG2 VAL 925 1.304 -4.986 -6.968 84 3HG2 VAL 925 3HG2 VAL 925 2.369 -6.389 -7.224 85 H TYR 926 H TYR 926 5.401 -5.651 -4.338 86 HA TYR 926 HA TYR 926 5.457 -4.233 -1.986 87 1HB TYR 926 1HB TYR 926 7.354 -5.906 -3.683 88 2HB TYR 926 2HB TYR 926 8.030 -5.122 -2.269 89 HD1 TYR 926 HD1 TYR 926 4.701 -6.774 -2.795 90 HD2 TYR 926 HD2 TYR 926 8.419 -6.776 -0.677 91 HE1 TYR 926 HE1 TYR 926 3.877 -8.685 -1.335 92 HE2 TYR 926 HE2 TYR 926 7.582 -8.687 0.776 93 HH TYR 926 HH TYR 926 4.710 -9.418 1.309 94 H GLU 927 H GLU 927 7.516 -3.773 -4.941 95 HA GLU 927 HA GLU 927 8.955 -1.664 -3.824 96 1HB GLU 927 1HB GLU 927 8.571 -2.826 -6.563 97 2HB GLU 927 2HB GLU 927 9.233 -1.206 -6.481 98 1HG GLU 927 1HG GLU 927 11.259 -2.123 -6.043 99 2HG GLU 927 2HG GLU 927 10.639 -2.629 -4.484 100 H ASN 928 H ASN 928 6.395 -1.604 -6.418 101 HA ASN 928 HA ASN 928 6.075 0.971 -6.773 102 1HB ASN 928 1HB ASN 928 3.779 -0.994 -6.259 103 2HB ASN 928 2HB ASN 928 3.608 0.533 -7.102 104 1HD2 ASN 928 1HD2 ASN 928 5.134 0.875 -8.959 105 2HD2 ASN 928 2HD2 ASN 928 5.414 -0.454 -10.034 106 H VAL 929 H VAL 929 4.917 -0.941 -3.937 107 HA VAL 929 HA VAL 929 3.385 1.035 -2.723 108 HB VAL 929 HB VAL 929 4.762 -1.474 -1.911 109 1HG1 VAL 929 1HG1 VAL 929 5.361 -0.252 0.011 110 2HG1 VAL 929 2HG1 VAL 929 3.826 0.648 0.028 111 3HG1 VAL 929 3HG1 VAL 929 3.850 -1.079 0.459 112 1HG2 VAL 929 1HG2 VAL 929 1.980 -0.412 -2.148 113 2HG2 VAL 929 2HG2 VAL 929 2.657 -1.981 -2.647 114 3HG2 VAL 929 3HG2 VAL 929 2.285 -1.677 -0.934 115 H THR 930 H THR 930 6.750 0.001 -1.795 116 HA THR 930 HA THR 930 7.311 2.035 -0.079 117 HB THR 930 HB THR 930 9.679 1.492 -0.619 118 HG1 THR 930 HG1 THR 930 8.376 0.073 -2.834 119 1HG2 THR 930 1HG2 THR 930 9.484 -0.622 0.231 120 2HG2 THR 930 2HG2 THR 930 7.721 -0.452 0.063 121 3HG2 THR 930 3HG2 THR 930 8.673 -1.190 -1.248 122 H GLY 931 H GLY 931 7.932 2.088 -3.653 123 1HA GLY 931 1HA GLY 931 8.956 4.645 -3.814 124 2HA GLY 931 2HA GLY 931 8.069 3.819 -5.080 125 H LEU 932 H LEU 932 5.566 3.531 -3.463 126 HA LEU 932 HA LEU 932 4.469 6.082 -4.113 127 1HB LEU 932 1HB LEU 932 2.732 4.775 -4.437 128 2HB LEU 932 2HB LEU 932 3.554 3.419 -3.692 129 HG LEU 932 HG LEU 932 2.709 4.040 -1.499 130 1HD1 LEU 932 1HD1 LEU 932 0.757 6.014 -2.086 131 2HD1 LEU 932 2HD1 LEU 932 2.167 6.130 -1.005 132 3HD1 LEU 932 3HD1 LEU 932 2.316 6.598 -2.716 133 1HD2 LEU 932 1HD2 LEU 932 0.108 4.115 -2.365 134 2HD2 LEU 932 2HD2 LEU 932 0.958 3.443 -3.778 135 3HD2 LEU 932 3HD2 LEU 932 1.101 2.648 -2.191 136 H VAL 933 H VAL 933 4.567 4.172 -1.016 137 HA VAL 933 HA VAL 933 3.782 6.288 0.591 138 HB VAL 933 HB VAL 933 4.756 4.930 2.417 139 1HG1 VAL 933 1HG1 VAL 933 2.571 4.391 0.837 140 2HG1 VAL 933 2HG1 VAL 933 3.431 2.832 0.832 141 3HG1 VAL 933 3HG1 VAL 933 2.955 3.581 2.375 142 1HG2 VAL 933 1HG2 VAL 933 6.008 3.494 0.100 143 2HG2 VAL 933 2HG2 VAL 933 6.697 3.924 1.684 144 3HG2 VAL 933 3HG2 VAL 933 5.552 2.567 1.550 145 H LYS 934 H LYS 934 7.108 5.078 -0.216 146 HA LYS 934 HA LYS 934 8.604 6.742 1.283 147 1HB LYS 934 1HB LYS 934 9.058 5.796 -1.558 148 2HB LYS 934 2HB LYS 934 10.284 6.607 -0.605 149 1HG LYS 934 1HG LYS 934 8.980 4.412 0.881 150 2HG LYS 934 2HG LYS 934 9.740 3.855 -0.597 151 1HD LYS 934 1HD LYS 934 11.688 3.837 0.581 152 2HD LYS 934 2HD LYS 934 11.670 5.582 0.425 153 1HE LYS 934 1HE LYS 934 10.368 5.744 2.573 154 2HE LYS 934 2HE LYS 934 10.439 4.001 2.733 155 1HZ LYS 934 1HZ LYS 934 12.737 5.829 2.682 156 2HZ LYS 934 2HZ LYS 934 12.191 4.983 3.968 157 3HZ LYS 934 3HZ LYS 934 12.866 4.201 2.702 158 H ALA 935 H ALA 935 6.965 7.527 -1.834 159 HA ALA 935 HA ALA 935 8.002 10.177 -1.886 160 1HB ALA 935 1HB ALA 935 7.157 8.659 -3.821 161 2HB ALA 935 2HB ALA 935 5.531 9.201 -3.337 162 3HB ALA 935 3HB ALA 935 6.744 10.390 -3.867 163 H VAL 936 H VAL 936 4.806 8.680 -1.041 164 HA VAL 936 HA VAL 936 3.275 10.780 -0.528 165 HB VAL 936 HB VAL 936 3.715 8.233 0.999 166 1HG1 VAL 936 1HG1 VAL 936 1.257 9.103 1.878 167 2HG1 VAL 936 2HG1 VAL 936 2.769 9.163 2.816 168 3HG1 VAL 936 3HG1 VAL 936 2.222 10.598 1.916 169 1HG2 VAL 936 1HG2 VAL 936 1.492 7.684 0.057 170 2HG2 VAL 936 2HG2 VAL 936 1.462 9.267 -0.756 171 3HG2 VAL 936 3HG2 VAL 936 2.691 8.060 -1.203 172 H ILE 937 H ILE 937 6.037 9.692 1.512 173 HA ILE 937 HA ILE 937 5.564 11.850 3.370 174 HB ILE 937 HB ILE 937 7.634 9.666 3.187 175 1HG1 ILE 937 1HG1 ILE 937 5.627 10.010 5.393 176 2HG1 ILE 937 2HG1 ILE 937 5.113 9.311 3.870 177 1HG2 ILE 937 1HG2 ILE 937 7.322 11.712 5.399 178 2HG2 ILE 937 2HG2 ILE 937 8.501 10.381 5.319 179 3HG2 ILE 937 3HG2 ILE 937 8.603 11.732 4.164 180 1HD1 ILE 937 1HD1 ILE 937 6.658 8.089 6.007 181 2HD1 ILE 937 2HD1 ILE 937 5.953 7.327 4.561 182 3HD1 ILE 937 3HD1 ILE 937 7.582 8.040 4.487 183 H GLU 938 H GLU 938 8.462 10.805 1.436 184 HA GLU 938 HA GLU 938 10.025 12.854 1.617 185 1HB GLU 938 1HB GLU 938 9.687 10.830 -0.262 186 2HB GLU 938 2HB GLU 938 9.583 12.273 -1.251 187 1HG GLU 938 1HG GLU 938 11.848 12.383 -1.204 188 2HG GLU 938 2HG GLU 938 11.737 12.800 0.495 189 H MET 939 H MET 939 7.071 12.879 -0.479 190 HA MET 939 HA MET 939 7.353 15.275 -1.659 191 1HB MET 939 1HB MET 939 5.442 13.913 -2.200 192 2HB MET 939 2HB MET 939 4.944 13.790 -0.524 193 1HG MET 939 1HG MET 939 3.769 15.757 -0.600 194 2HG MET 939 2HG MET 939 5.032 16.590 -1.484 195 1HE MET 939 1HE MET 939 2.151 13.592 -3.429 196 2HE MET 939 2HE MET 939 3.863 13.153 -3.215 197 3HE MET 939 3HE MET 939 2.854 13.521 -1.795 198 H SER 940 H SER 940 5.304 14.872 1.324 199 HA SER 940 HA SER 940 4.888 17.406 1.923 200 1HB SER 940 1HB SER 940 5.705 15.279 3.953 201 2HB SER 940 2HB SER 940 4.801 16.734 4.320 202 HG SER 940 HG SER 940 3.408 15.655 2.364 203 H SER 941 H SER 941 7.968 15.635 2.301 204 HA SER 941 HA SER 941 9.237 17.463 3.943 205 1HB SER 941 1HB SER 941 9.887 15.032 2.960 206 2HB SER 941 2HB SER 941 10.819 16.008 1.842 207 HG SER 941 HG SER 941 11.911 15.318 3.905 208 H LYS 942 H LYS 942 9.190 17.112 0.327 209 HA LYS 942 HA LYS 942 10.350 19.800 0.164 210 1HB LYS 942 1HB LYS 942 11.162 19.215 -2.000 211 2HB LYS 942 2HB LYS 942 11.597 17.917 -0.907 212 1HG LYS 942 1HG LYS 942 10.350 16.397 -2.055 213 2HG LYS 942 2HG LYS 942 8.948 17.448 -2.077 214 1HD LYS 942 1HD LYS 942 10.891 18.598 -3.858 215 2HD LYS 942 2HD LYS 942 10.815 16.885 -4.219 216 1HE LYS 942 1HE LYS 942 8.573 16.972 -4.881 217 2HE LYS 942 2HE LYS 942 8.197 18.320 -3.825 218 1HZ LYS 942 1HZ LYS 942 9.926 19.452 -5.454 219 2HZ LYS 942 2HZ LYS 942 9.301 18.345 -6.479 220 3HZ LYS 942 3HZ LYS 942 8.319 19.426 -5.747 221 H ILE 943 H ILE 943 7.523 19.159 0.867 222 HA ILE 943 HA ILE 943 6.131 19.958 -1.562 223 HB ILE 943 HB ILE 943 5.499 18.120 0.277 224 1HG1 ILE 943 1HG1 ILE 943 4.427 18.795 -1.976 225 2HG1 ILE 943 2HG1 ILE 943 3.451 17.949 -0.792 226 1HG2 ILE 943 1HG2 ILE 943 4.172 20.669 1.232 227 2HG2 ILE 943 2HG2 ILE 943 3.650 19.029 1.685 228 3HG2 ILE 943 3HG2 ILE 943 5.270 19.606 2.145 229 1HD1 ILE 943 1HD1 ILE 943 2.468 20.091 -1.948 230 2HD1 ILE 943 2HD1 ILE 943 2.240 19.886 -0.194 231 3HD1 ILE 943 3HD1 ILE 943 3.505 20.979 -0.806 232 H GLN 944 H GLN 944 6.597 21.007 1.878 233 HA GLN 944 HA GLN 944 5.151 23.266 1.836 234 1HB GLN 944 1HB GLN 944 7.134 22.122 3.487 235 2HB GLN 944 2HB GLN 944 7.727 23.736 3.152 236 1HG GLN 944 1HG GLN 944 5.041 24.228 3.649 237 2HG GLN 944 2HG GLN 944 5.354 22.884 4.728 238 1HE2 GLN 944 1HE2 GLN 944 8.048 23.316 5.291 239 2HE2 GLN 944 2HE2 GLN 944 8.228 24.749 6.247 240 HA PRO 945 HA PRO 945 8.790 25.549 -0.185 241 1HB PRO 945 1HB PRO 945 10.882 24.130 -1.222 242 2HB PRO 945 2HB PRO 945 10.909 24.847 0.377 243 1HG PRO 945 1HG PRO 945 10.577 22.007 -0.376 244 2HG PRO 945 2HG PRO 945 11.028 22.686 1.176 245 1HD PRO 945 1HD PRO 945 8.461 21.636 0.442 246 2HD PRO 945 2HD PRO 945 8.880 22.420 1.952 247 H ALA 946 H ALA 946 8.477 22.407 -1.761 248 HA ALA 946 HA ALA 946 8.674 23.033 -4.330 249 1HB ALA 946 1HB ALA 946 8.082 20.837 -4.008 250 2HB ALA 946 2HB ALA 946 6.868 21.232 -2.767 251 3HB ALA 946 3HB ALA 946 6.489 21.468 -4.490 252 HA PRO 947 HA PRO 947 5.799 26.236 -4.995 253 1HB PRO 947 1HB PRO 947 6.263 26.615 -7.661 254 2HB PRO 947 2HB PRO 947 7.245 27.341 -6.405 255 1HG PRO 947 1HG PRO 947 7.881 25.052 -8.163 256 2HG PRO 947 2HG PRO 947 8.972 26.048 -7.221 257 1HD PRO 947 1HD PRO 947 8.086 23.396 -6.582 258 2HD PRO 947 2HD PRO 947 9.083 24.436 -5.585 259 HA PRO 948 HA PRO 948 2.253 24.655 -6.721 260 1HB PRO 948 1HB PRO 948 1.075 26.703 -8.095 261 2HB PRO 948 2HB PRO 948 0.998 26.550 -6.351 262 1HG PRO 948 1HG PRO 948 2.626 28.404 -7.979 263 2HG PRO 948 2HG PRO 948 2.211 28.510 -6.280 264 1HD PRO 948 1HD PRO 948 4.730 27.694 -7.384 265 2HD PRO 948 2HD PRO 948 4.277 27.690 -5.691 266 H GLU 949 H GLU 949 4.657 25.733 -8.811 267 HA GLU 949 HA GLU 949 3.288 24.651 -11.103 268 1HB GLU 949 1HB GLU 949 5.153 26.701 -10.750 269 2HB GLU 949 2HB GLU 949 6.118 25.416 -11.449 270 1HG GLU 949 1HG GLU 949 3.965 25.226 -13.086 271 2HG GLU 949 2HG GLU 949 3.794 26.911 -12.637 272 H GLU 950 H GLU 950 5.495 23.672 -8.598 273 HA GLU 950 HA GLU 950 6.317 21.400 -10.225 274 1HB GLU 950 1HB GLU 950 7.804 23.122 -8.553 275 2HB GLU 950 2HB GLU 950 7.663 21.638 -7.633 276 1HG GLU 950 1HG GLU 950 9.572 21.189 -8.914 277 2HG GLU 950 2HG GLU 950 8.326 20.457 -9.905 278 H TYR 951 H TYR 951 4.085 22.389 -7.869 279 HA TYR 951 HA TYR 951 4.081 19.863 -6.434 280 1HB TYR 951 1HB TYR 951 3.717 22.119 -5.337 281 2HB TYR 951 2HB TYR 951 2.374 22.431 -6.418 282 HD1 TYR 951 HD1 TYR 951 2.831 19.066 -5.021 283 HD2 TYR 951 HD2 TYR 951 0.866 22.834 -4.525 284 HE1 TYR 951 HE1 TYR 951 1.234 18.020 -3.342 285 HE2 TYR 951 HE2 TYR 951 -0.725 21.775 -2.847 286 HH TYR 951 HH TYR 951 -0.609 18.300 -2.200 287 H VAL 952 H VAL 952 2.083 21.741 -8.779 288 HA VAL 952 HA VAL 952 -0.199 20.293 -8.801 289 HB VAL 952 HB VAL 952 1.324 21.937 -10.683 290 1HG1 VAL 952 1HG1 VAL 952 -0.074 21.317 -12.656 291 2HG1 VAL 952 2HG1 VAL 952 1.079 20.050 -12.174 292 3HG1 VAL 952 3HG1 VAL 952 -0.644 19.890 -11.757 293 1HG2 VAL 952 1HG2 VAL 952 -1.259 22.530 -11.134 294 2HG2 VAL 952 2HG2 VAL 952 -1.422 21.742 -9.546 295 3HG2 VAL 952 3HG2 VAL 952 -0.352 23.152 -9.734 296 HA PRO 953 HA PRO 953 1.927 17.041 -11.504 297 1HB PRO 953 1HB PRO 953 4.645 17.062 -11.783 298 2HB PRO 953 2HB PRO 953 3.556 17.778 -12.954 299 1HG PRO 953 1HG PRO 953 5.266 19.119 -10.950 300 2HG PRO 953 2HG PRO 953 4.515 19.796 -12.381 301 1HD PRO 953 1HD PRO 953 3.643 20.123 -9.668 302 2HD PRO 953 2HD PRO 953 2.828 20.702 -11.107 303 H MET 954 H MET 954 4.327 17.902 -9.054 304 HA MET 954 HA MET 954 5.203 15.624 -8.217 305 1HB MET 954 1HB MET 954 4.774 18.149 -7.053 306 2HB MET 954 2HB MET 954 3.968 17.074 -5.927 307 1HG MET 954 1HG MET 954 6.333 15.697 -6.404 308 2HG MET 954 2HG MET 954 6.871 17.361 -6.516 309 1HE MET 954 1HE MET 954 4.316 18.434 -3.900 310 2HE MET 954 2HE MET 954 5.911 19.031 -3.381 311 3HE MET 954 3HE MET 954 5.478 19.033 -5.108 312 H VAL 955 H VAL 955 1.876 16.784 -7.341 313 HA VAL 955 HA VAL 955 1.230 14.423 -5.925 314 HB VAL 955 HB VAL 955 -0.289 16.770 -7.026 315 1HG1 VAL 955 1HG1 VAL 955 -1.897 15.056 -7.306 316 2HG1 VAL 955 2HG1 VAL 955 -1.432 14.257 -5.785 317 3HG1 VAL 955 3HG1 VAL 955 -2.285 15.819 -5.745 318 1HG2 VAL 955 1HG2 VAL 955 -0.061 17.632 -4.969 319 2HG2 VAL 955 2HG2 VAL 955 -0.534 16.105 -4.185 320 3HG2 VAL 955 3HG2 VAL 955 1.153 16.359 -4.692 321 H LYS 956 H LYS 956 0.310 15.672 -9.213 322 HA LYS 956 HA LYS 956 -1.239 13.679 -10.097 323 1HB LYS 956 1HB LYS 956 0.876 15.315 -11.487 324 2HB LYS 956 2HB LYS 956 -0.050 14.118 -12.371 325 1HG LYS 956 1HG LYS 956 -1.395 16.240 -10.646 326 2HG LYS 956 2HG LYS 956 -0.984 16.536 -12.323 327 1HD LYS 956 1HD LYS 956 -2.780 15.354 -13.056 328 2HD LYS 956 2HD LYS 956 -2.341 13.964 -12.082 329 1HE LYS 956 1HE LYS 956 -4.407 14.547 -11.136 330 2HE LYS 956 2HE LYS 956 -3.298 15.378 -10.064 331 1HZ LYS 956 1HZ LYS 956 -3.590 17.313 -11.635 332 2HZ LYS 956 2HZ LYS 956 -4.882 16.518 -12.239 333 3HZ LYS 956 3HZ LYS 956 -4.854 16.954 -10.666 334 H GLU 957 H GLU 957 2.243 13.517 -9.415 335 HA GLU 957 HA GLU 957 2.643 11.102 -10.791 336 1HB GLU 957 1HB GLU 957 4.180 12.864 -8.959 337 2HB GLU 957 2HB GLU 957 4.628 11.173 -8.865 338 1HG GLU 957 1HG GLU 957 5.941 11.617 -10.681 339 2HG GLU 957 2HG GLU 957 4.453 11.507 -11.601 340 H VAL 958 H VAL 958 2.353 11.881 -7.245 341 HA VAL 958 HA VAL 958 2.427 9.323 -6.287 342 HB VAL 958 HB VAL 958 2.174 11.766 -5.231 343 1HG1 VAL 958 1HG1 VAL 958 -0.584 10.528 -4.937 344 2HG1 VAL 958 2HG1 VAL 958 0.017 11.929 -4.019 345 3HG1 VAL 958 3HG1 VAL 958 -0.180 12.040 -5.784 346 1HG2 VAL 958 1HG2 VAL 958 1.574 10.500 -3.032 347 2HG2 VAL 958 2HG2 VAL 958 1.656 9.043 -4.051 348 3HG2 VAL 958 3HG2 VAL 958 3.082 10.096 -3.887 349 H GLY 959 H GLY 959 -0.381 11.171 -7.605 350 1HA GLY 959 1HA GLY 959 -2.398 9.362 -7.031 351 2HA GLY 959 2HA GLY 959 -2.370 10.475 -8.384 352 H LEU 960 H LEU 960 0.027 9.404 -9.698 353 HA LEU 960 HA LEU 960 -1.220 7.360 -11.188 354 1HB LEU 960 1HB LEU 960 0.928 9.131 -11.473 355 2HB LEU 960 2HB LEU 960 1.648 7.535 -11.543 356 HG LEU 960 HG LEU 960 -0.672 8.441 -13.271 357 1HD1 LEU 960 1HD1 LEU 960 1.393 8.135 -14.996 358 2HD1 LEU 960 2HD1 LEU 960 0.908 9.690 -14.277 359 3HD1 LEU 960 3HD1 LEU 960 2.252 8.762 -13.569 360 1HD2 LEU 960 1HD2 LEU 960 -0.860 6.144 -13.238 361 2HD2 LEU 960 2HD2 LEU 960 0.222 6.395 -14.630 362 3HD2 LEU 960 3HD2 LEU 960 0.893 5.890 -13.061 363 H ALA 961 H ALA 961 1.535 7.383 -8.831 364 HA ALA 961 HA ALA 961 2.211 4.751 -8.928 365 1HB ALA 961 1HB ALA 961 3.394 6.462 -7.623 366 2HB ALA 961 2HB ALA 961 2.017 6.581 -6.501 367 3HB ALA 961 3HB ALA 961 2.969 5.079 -6.586 368 H LEU 962 H LEU 962 -0.282 6.243 -6.738 369 HA LEU 962 HA LEU 962 -1.155 3.905 -5.593 370 1HB LEU 962 1HB LEU 962 -2.662 6.440 -6.242 371 2HB LEU 962 2HB LEU 962 -3.278 5.164 -5.212 372 HG LEU 962 HG LEU 962 -0.617 6.094 -4.399 373 1HD1 LEU 962 1HD1 LEU 962 -1.981 8.154 -5.400 374 2HD1 LEU 962 2HD1 LEU 962 -2.734 8.099 -3.788 375 3HD1 LEU 962 3HD1 LEU 962 -0.971 8.292 -3.941 376 1HD2 LEU 962 1HD2 LEU 962 -1.577 6.037 -2.207 377 2HD2 LEU 962 2HD2 LEU 962 -3.228 5.995 -2.870 378 3HD2 LEU 962 3HD2 LEU 962 -2.143 4.603 -3.097 379 H ARG 963 H ARG 963 -2.302 5.521 -8.625 380 HA ARG 963 HA ARG 963 -4.311 3.773 -9.181 381 1HB ARG 963 1HB ARG 963 -3.238 5.970 -10.419 382 2HB ARG 963 2HB ARG 963 -2.659 4.722 -11.504 383 1HG ARG 963 1HG ARG 963 -4.701 4.781 -12.497 384 2HG ARG 963 2HG ARG 963 -5.333 3.991 -11.065 385 1HD ARG 963 1HD ARG 963 -6.694 5.921 -11.246 386 2HD ARG 963 2HD ARG 963 -5.509 6.394 -10.044 387 HE ARG 963 HE ARG 963 -4.400 7.125 -12.527 388 1HH1 ARG 963 2HH2 ARG 963 -7.274 7.928 -10.663 389 2HH1 ARG 963 1HH2 ARG 963 -7.406 9.527 -11.314 390 1HH2 ARG 963 2HH1 ARG 963 -4.573 9.235 -13.387 391 2HH2 ARG 963 1HH1 ARG 963 -5.859 10.276 -12.874 392 H THR 964 H THR 964 -0.883 3.707 -10.423 393 HA THR 964 HA THR 964 -1.092 1.294 -11.790 394 HB THR 964 HB THR 964 1.169 2.902 -10.534 395 HG1 THR 964 HG1 THR 964 0.335 2.064 -13.223 396 1HG2 THR 964 1HG2 THR 964 1.348 0.323 -12.178 397 2HG2 THR 964 2HG2 THR 964 2.704 1.451 -11.938 398 3HG2 THR 964 3HG2 THR 964 2.013 0.582 -10.547 399 H LEU 965 H LEU 965 -0.148 1.948 -8.367 400 HA LEU 965 HA LEU 965 0.588 -0.587 -7.667 401 1HB LEU 965 1HB LEU 965 0.957 1.138 -6.147 402 2HB LEU 965 2HB LEU 965 -0.711 1.671 -6.182 403 HG LEU 965 HG LEU 965 -0.955 -0.891 -5.198 404 1HD1 LEU 965 1HD1 LEU 965 0.702 -1.198 -3.461 405 2HD1 LEU 965 2HD1 LEU 965 1.503 -1.098 -5.048 406 3HD1 LEU 965 3HD1 LEU 965 1.535 0.299 -3.945 407 1HD2 LEU 965 1HD2 LEU 965 -1.840 0.126 -3.364 408 2HD2 LEU 965 2HD2 LEU 965 -0.517 1.310 -3.235 409 3HD2 LEU 965 3HD2 LEU 965 -1.787 1.525 -4.463 410 H LEU 966 H LEU 966 -2.742 0.840 -7.710 411 HA LEU 966 HA LEU 966 -4.156 -1.220 -6.684 412 1HB LEU 966 1HB LEU 966 -4.663 1.109 -8.150 413 2HB LEU 966 2HB LEU 966 -5.457 -0.169 -9.047 414 HG LEU 966 HG LEU 966 -5.896 -0.079 -6.093 415 1HD1 LEU 966 1HD1 LEU 966 -6.318 2.159 -6.292 416 2HD1 LEU 966 2HD1 LEU 966 -6.773 2.041 -8.009 417 3HD1 LEU 966 3HD1 LEU 966 -7.910 1.505 -6.748 418 1HD2 LEU 966 1HD2 LEU 966 -8.134 -0.846 -6.734 419 2HD2 LEU 966 2HD2 LEU 966 -7.696 -0.699 -8.453 420 3HD2 LEU 966 3HD2 LEU 966 -6.861 -1.884 -7.420 421 H ALA 967 H ALA 967 -3.293 -0.845 -10.197 422 HA ALA 967 HA ALA 967 -4.305 -3.289 -11.002 423 1HB ALA 967 1HB ALA 967 -1.927 -2.593 -12.487 424 2HB ALA 967 2HB ALA 967 -3.633 -2.436 -12.968 425 3HB ALA 967 3HB ALA 967 -2.831 -1.113 -12.088 426 H THR 968 H THR 968 -0.928 -2.406 -9.992 427 HA THR 968 HA THR 968 0.255 -4.851 -10.296 428 HB THR 968 HB THR 968 0.759 -3.023 -7.909 429 HG1 THR 968 HG1 THR 968 1.094 -1.450 -9.430 430 1HG2 THR 968 1HG2 THR 968 2.205 -5.163 -8.788 431 2HG2 THR 968 2HG2 THR 968 2.853 -3.912 -9.876 432 3HG2 THR 968 3HG2 THR 968 2.976 -3.708 -8.111 433 H VAL 969 H VAL 969 -1.678 -3.702 -7.467 434 HA VAL 969 HA VAL 969 -1.283 -5.937 -5.889 435 HB VAL 969 HB VAL 969 -3.581 -3.998 -6.153 436 1HG1 VAL 969 1HG1 VAL 969 -4.231 -6.254 -5.151 437 2HG1 VAL 969 2HG1 VAL 969 -3.136 -5.856 -3.805 438 3HG1 VAL 969 3HG1 VAL 969 -4.540 -4.817 -4.148 439 1HG2 VAL 969 1HG2 VAL 969 -2.583 -3.171 -3.959 440 2HG2 VAL 969 2HG2 VAL 969 -1.176 -4.197 -4.325 441 3HG2 VAL 969 3HG2 VAL 969 -1.623 -2.874 -5.428 442 H ASP 970 H ASP 970 -3.532 -5.335 -8.618 443 HA ASP 970 HA ASP 970 -5.266 -7.354 -8.314 444 1HB ASP 970 1HB ASP 970 -4.988 -5.604 -10.226 445 2HB ASP 970 2HB ASP 970 -3.926 -6.772 -10.986 446 H GLU 971 H GLU 971 -1.932 -7.443 -9.742 447 HA GLU 971 HA GLU 971 -2.061 -10.157 -10.425 448 1HB GLU 971 1HB GLU 971 0.165 -8.122 -10.152 449 2HB GLU 971 2HB GLU 971 0.558 -9.807 -10.430 450 1HG GLU 971 1HG GLU 971 -1.216 -9.643 -12.385 451 2HG GLU 971 2HG GLU 971 -0.991 -7.912 -12.223 452 H SER 972 H SER 972 -1.516 -8.428 -7.434 453 HA SER 972 HA SER 972 -0.112 -10.617 -6.235 454 1HB SER 972 1HB SER 972 -0.668 -7.813 -5.606 455 2HB SER 972 2HB SER 972 -0.977 -8.832 -4.215 456 HG SER 972 HG SER 972 1.280 -9.802 -5.025 457 H LEU 973 H LEU 973 -3.406 -9.418 -6.626 458 HA LEU 973 HA LEU 973 -4.748 -10.297 -4.476 459 1HB LEU 973 1HB LEU 973 -5.345 -9.543 -7.085 460 2HB LEU 973 2HB LEU 973 -6.067 -11.132 -6.931 461 HG LEU 973 HG LEU 973 -6.823 -8.566 -5.677 462 1HD1 LEU 973 1HD1 LEU 973 -8.166 -11.013 -6.765 463 2HD1 LEU 973 2HD1 LEU 973 -9.061 -9.940 -5.662 464 3HD1 LEU 973 3HD1 LEU 973 -8.395 -9.298 -7.183 465 1HD2 LEU 973 1HD2 LEU 973 -7.980 -10.008 -3.802 466 2HD2 LEU 973 2HD2 LEU 973 -6.585 -11.081 -4.073 467 3HD2 LEU 973 3HD2 LEU 973 -6.325 -9.386 -3.596 468 HA PRO 974 HA PRO 974 -4.528 -14.748 -6.052 469 1HB PRO 974 1HB PRO 974 -2.865 -15.392 -8.123 470 2HB PRO 974 2HB PRO 974 -4.573 -15.062 -8.332 471 1HG PRO 974 1HG PRO 974 -2.260 -13.346 -8.996 472 2HG PRO 974 2HG PRO 974 -3.912 -13.232 -9.570 473 1HD PRO 974 1HD PRO 974 -2.670 -11.582 -7.580 474 2HD PRO 974 2HD PRO 974 -4.351 -11.545 -8.071 475 H VAL 975 H VAL 975 -1.505 -13.014 -6.285 476 HA VAL 975 HA VAL 975 0.225 -14.968 -5.513 477 HB VAL 975 HB VAL 975 0.080 -12.013 -4.980 478 1HG1 VAL 975 1HG1 VAL 975 1.751 -13.938 -3.585 479 2HG1 VAL 975 2HG1 VAL 975 2.735 -12.794 -4.529 480 3HG1 VAL 975 3HG1 VAL 975 1.572 -12.186 -3.326 481 1HG2 VAL 975 1HG2 VAL 975 1.942 -13.679 -6.707 482 2HG2 VAL 975 2HG2 VAL 975 0.494 -12.823 -7.289 483 3HG2 VAL 975 3HG2 VAL 975 1.866 -11.902 -6.626 484 H LEU 976 H LEU 976 -2.206 -13.223 -3.573 485 HA LEU 976 HA LEU 976 -1.307 -14.764 -1.240 486 1HB LEU 976 1HB LEU 976 -3.016 -12.280 -1.235 487 2HB LEU 976 2HB LEU 976 -2.284 -13.082 0.140 488 HG LEU 976 HG LEU 976 -0.934 -11.222 -0.186 489 1HD1 LEU 976 1HD1 LEU 976 0.282 -13.479 -0.150 490 2HD1 LEU 976 2HD1 LEU 976 0.591 -13.197 -1.880 491 3HD1 LEU 976 3HD1 LEU 976 1.203 -12.047 -0.667 492 1HD2 LEU 976 1HD2 LEU 976 -0.459 -10.136 -2.147 493 2HD2 LEU 976 2HD2 LEU 976 -0.497 -11.628 -3.118 494 3HD2 LEU 976 3HD2 LEU 976 -2.018 -10.887 -2.563 495 HA PRO 977 HA PRO 977 -5.067 -16.879 -1.287 496 1HB PRO 977 1HB PRO 977 -5.564 -17.340 1.361 497 2HB PRO 977 2HB PRO 977 -4.417 -18.277 0.424 498 1HG PRO 977 1HG PRO 977 -3.890 -16.182 2.442 499 2HG PRO 977 2HG PRO 977 -2.800 -17.404 1.818 500 1HD PRO 977 1HD PRO 977 -2.843 -14.624 1.116 501 2HD PRO 977 2HD PRO 977 -1.832 -15.868 0.409 502 H ALA 978 H ALA 978 -7.394 -16.974 -0.803 503 HA ALA 978 HA ALA 978 -8.639 -14.664 -1.299 504 1HB ALA 978 1HB ALA 978 -9.436 -17.091 0.316 505 2HB ALA 978 2HB ALA 978 -10.572 -15.739 0.098 506 3HB ALA 978 3HB ALA 978 -9.945 -16.612 -1.321 507 H SER 979 H SER 979 -7.169 -15.658 1.770 508 HA SER 979 HA SER 979 -8.456 -14.103 3.546 509 1HB SER 979 1HB SER 979 -5.940 -15.463 3.379 510 2HB SER 979 2HB SER 979 -5.608 -13.871 4.032 511 HG SER 979 HG SER 979 -7.422 -14.307 5.581 512 H THR 980 H THR 980 -6.499 -13.100 0.818 513 HA THR 980 HA THR 980 -6.266 -10.380 1.888 514 HB THR 980 HB THR 980 -4.749 -10.170 -0.187 515 HG1 THR 980 HG1 THR 980 -5.058 -11.921 -1.505 516 1HG2 THR 980 1HG2 THR 980 -3.892 -12.572 1.468 517 2HG2 THR 980 2HG2 THR 980 -2.889 -11.248 0.829 518 3HG2 THR 980 3HG2 THR 980 -3.965 -10.959 2.216 519 H HIS 981 H HIS 981 -8.875 -11.536 1.161 520 HA HIS 981 HA HIS 981 -9.469 -10.264 -1.360 521 1HB HIS 981 1HB HIS 981 -10.885 -12.096 0.527 522 2HB HIS 981 2HB HIS 981 -11.867 -11.075 -0.504 523 HD1 HIS 981 HD1 HIS 981 -12.605 -13.465 -1.565 524 HD2 HIS 981 HD2 HIS 981 -8.670 -12.221 -2.313 525 HE1 HIS 981 HE1 HIS 981 -11.768 -14.877 -3.520 526 H ARG 982 H ARG 982 -11.831 -10.145 1.261 527 HA ARG 982 HA ARG 982 -12.412 -7.526 0.851 528 1HB ARG 982 1HB ARG 982 -12.810 -9.400 3.206 529 2HB ARG 982 2HB ARG 982 -13.314 -7.728 3.347 530 1HG ARG 982 1HG ARG 982 -15.253 -8.344 2.336 531 2HG ARG 982 2HG ARG 982 -14.335 -8.469 0.848 532 1HD ARG 982 1HD ARG 982 -13.735 -10.897 2.014 533 2HD ARG 982 2HD ARG 982 -15.353 -10.636 2.633 534 HE ARG 982 HE ARG 982 -14.674 -11.327 -0.073 535 1HH1 ARG 982 2HH2 ARG 982 -16.898 -9.299 1.750 536 2HH1 ARG 982 1HH2 ARG 982 -18.122 -9.320 0.524 537 1HH2 ARG 982 2HH1 ARG 982 -16.288 -11.354 -1.690 538 2HH2 ARG 982 1HH1 ARG 982 -17.773 -10.497 -1.445 539 H GLU 983 H GLU 983 -10.054 -9.049 3.099 540 HA GLU 983 HA GLU 983 -9.509 -6.884 4.673 541 1HB GLU 983 1HB GLU 983 -8.141 -9.404 3.914 542 2HB GLU 983 2HB GLU 983 -7.049 -8.141 4.445 543 1HG GLU 983 1HG GLU 983 -8.222 -7.897 6.564 544 2HG GLU 983 2HG GLU 983 -9.545 -8.909 6.020 545 H ILE 984 H ILE 984 -8.198 -7.785 1.438 546 HA ILE 984 HA ILE 984 -6.354 -5.612 1.401 547 HB ILE 984 HB ILE 984 -7.328 -7.620 -0.610 548 1HG1 ILE 984 1HG1 ILE 984 -4.988 -7.299 1.177 549 2HG1 ILE 984 2HG1 ILE 984 -5.793 -8.751 0.616 550 1HG2 ILE 984 1HG2 ILE 984 -5.281 -5.455 -1.153 551 2HG2 ILE 984 2HG2 ILE 984 -5.838 -6.726 -2.268 552 3HG2 ILE 984 3HG2 ILE 984 -6.956 -5.440 -1.754 553 1HD1 ILE 984 1HD1 ILE 984 -3.536 -8.610 -0.357 554 2HD1 ILE 984 2HD1 ILE 984 -4.756 -8.450 -1.643 555 3HD1 ILE 984 3HD1 ILE 984 -3.908 -7.007 -1.037 556 H GLU 985 H GLU 985 -9.713 -6.205 0.333 557 HA GLU 985 HA GLU 985 -9.892 -3.937 -1.271 558 1HB GLU 985 1HB GLU 985 -11.939 -5.666 0.155 559 2HB GLU 985 2HB GLU 985 -12.435 -4.266 -0.775 560 1HG GLU 985 1HG GLU 985 -10.592 -6.357 -1.990 561 2HG GLU 985 2HG GLU 985 -12.327 -6.601 -1.971 562 H MET 986 H MET 986 -10.238 -4.502 2.234 563 HA MET 986 HA MET 986 -11.515 -2.073 2.783 564 1HB MET 986 1HB MET 986 -10.159 -4.292 4.266 565 2HB MET 986 2HB MET 986 -10.125 -2.753 5.103 566 1HG MET 986 1HG MET 986 -12.294 -3.012 5.721 567 2HG MET 986 2HG MET 986 -12.784 -3.095 4.040 568 1HE MET 986 1HE MET 986 -14.383 -4.505 3.796 569 2HE MET 986 2HE MET 986 -13.445 -5.676 2.837 570 3HE MET 986 3HE MET 986 -14.479 -6.243 4.170 571 H ALA 987 H ALA 987 -8.065 -3.115 2.689 572 HA ALA 987 HA ALA 987 -7.104 -0.614 3.663 573 1HB ALA 987 1HB ALA 987 -5.825 -2.626 4.046 574 2HB ALA 987 2HB ALA 987 -5.795 -3.002 2.307 575 3HB ALA 987 3HB ALA 987 -4.894 -1.598 2.930 576 H GLN 988 H GLN 988 -7.930 -2.037 0.512 577 HA GLN 988 HA GLN 988 -6.477 -0.219 -1.025 578 1HB GLN 988 1HB GLN 988 -8.723 -2.158 -1.503 579 2HB GLN 988 2HB GLN 988 -8.436 -0.943 -2.733 580 1HG GLN 988 1HG GLN 988 -5.860 -1.755 -2.287 581 2HG GLN 988 2HG GLN 988 -6.705 -3.236 -1.885 582 1HE2 GLN 988 1HE2 GLN 988 -8.440 -3.905 -3.448 583 2HE2 GLN 988 2HE2 GLN 988 -8.101 -3.769 -5.141 584 H LYS 989 H LYS 989 -9.996 -0.350 -0.114 585 HA LYS 989 HA LYS 989 -10.751 1.994 -1.351 586 1HB LYS 989 1HB LYS 989 -11.817 0.177 0.686 587 2HB LYS 989 2HB LYS 989 -12.338 1.833 0.920 588 1HG LYS 989 1HG LYS 989 -12.879 1.842 -1.630 589 2HG LYS 989 2HG LYS 989 -12.696 0.101 -1.557 590 1HD LYS 989 1HD LYS 989 -14.383 0.212 0.449 591 2HD LYS 989 2HD LYS 989 -14.740 1.832 -0.118 592 1HE LYS 989 1HE LYS 989 -15.009 0.630 -2.484 593 2HE LYS 989 2HE LYS 989 -15.227 -0.811 -1.511 594 1HZ LYS 989 1HZ LYS 989 -17.044 1.246 -1.974 595 2HZ LYS 989 2HZ LYS 989 -17.280 -0.151 -1.162 596 3HZ LYS 989 3HZ LYS 989 -16.755 1.176 -0.368 597 H LEU 990 H LEU 990 -9.071 1.430 1.752 598 HA LEU 990 HA LEU 990 -9.402 4.044 2.736 599 1HB LEU 990 1HB LEU 990 -8.335 1.620 3.609 600 2HB LEU 990 2HB LEU 990 -6.965 2.714 3.585 601 HG LEU 990 HG LEU 990 -9.580 3.296 5.001 602 1HD1 LEU 990 1HD1 LEU 990 -7.607 1.436 5.738 603 2HD1 LEU 990 2HD1 LEU 990 -7.338 2.865 6.765 604 3HD1 LEU 990 3HD1 LEU 990 -8.934 2.076 6.737 605 1HD2 LEU 990 1HD2 LEU 990 -8.574 5.359 4.551 606 2HD2 LEU 990 2HD2 LEU 990 -8.059 4.970 6.210 607 3HD2 LEU 990 3HD2 LEU 990 -6.934 4.734 4.851 608 H LEU 991 H LEU 991 -6.467 2.463 1.273 609 HA LEU 991 HA LEU 991 -4.935 4.698 1.049 610 1HB LEU 991 1HB LEU 991 -3.885 2.706 0.599 611 2HB LEU 991 2HB LEU 991 -5.146 2.144 -0.480 612 HG LEU 991 HG LEU 991 -3.713 4.535 -1.446 613 1HD1 LEU 991 1HD1 LEU 991 -2.200 2.258 -0.443 614 2HD1 LEU 991 2HD1 LEU 991 -1.923 2.543 -2.178 615 3HD1 LEU 991 3HD1 LEU 991 -1.641 3.852 -1.004 616 1HD2 LEU 991 1HD2 LEU 991 -5.420 3.070 -2.669 617 2HD2 LEU 991 2HD2 LEU 991 -3.937 3.518 -3.544 618 3HD2 LEU 991 3HD2 LEU 991 -4.099 1.890 -2.843 619 H ASN 992 H ASN 992 -7.387 3.466 -1.316 620 HA ASN 992 HA ASN 992 -6.971 5.425 -3.193 621 1HB ASN 992 1HB ASN 992 -8.508 3.240 -3.155 622 2HB ASN 992 2HB ASN 992 -9.754 4.349 -2.619 623 1HD2 ASN 992 1HD2 ASN 992 -11.034 4.712 -4.267 624 2HD2 ASN 992 2HD2 ASN 992 -10.569 5.177 -5.869 625 H SER 993 H SER 993 -9.333 5.200 -0.433 626 HA SER 993 HA SER 993 -10.716 7.479 -0.845 627 1HB SER 993 1HB SER 993 -10.082 5.745 1.456 628 2HB SER 993 2HB SER 993 -10.417 7.396 1.938 629 HG SER 993 HG SER 993 -12.494 7.147 1.449 630 H ASP 994 H ASP 994 -7.866 7.172 1.412 631 HA ASP 994 HA ASP 994 -7.605 9.837 1.904 632 1HB ASP 994 1HB ASP 994 -5.734 7.473 1.921 633 2HB ASP 994 2HB ASP 994 -5.022 9.064 2.095 634 H LEU 995 H LEU 995 -6.481 7.801 -0.821 635 HA LEU 995 HA LEU 995 -4.571 9.459 -1.920 636 1HB LEU 995 1HB LEU 995 -4.497 7.565 -3.065 637 2HB LEU 995 2HB LEU 995 -6.166 7.169 -2.705 638 HG LEU 995 HG LEU 995 -6.960 8.454 -4.583 639 1HD1 LEU 995 1HD1 LEU 995 -4.295 9.670 -4.445 640 2HD1 LEU 995 2HD1 LEU 995 -4.813 9.259 -6.097 641 3HD1 LEU 995 3HD1 LEU 995 -5.827 10.314 -5.084 642 1HD2 LEU 995 1HD2 LEU 995 -6.415 6.953 -6.199 643 2HD2 LEU 995 2HD2 LEU 995 -4.669 7.048 -5.865 644 3HD2 LEU 995 3HD2 LEU 995 -5.729 6.097 -4.797 645 H ALA 996 H ALA 996 -8.109 9.283 -2.747 646 HA ALA 996 HA ALA 996 -8.146 11.389 -4.506 647 1HB ALA 996 1HB ALA 996 -10.444 11.034 -2.617 648 2HB ALA 996 2HB ALA 996 -10.433 11.149 -4.393 649 3HB ALA 996 3HB ALA 996 -9.956 9.630 -3.597 650 H GLU 997 H GLU 997 -8.815 11.465 -0.931 651 HA GLU 997 HA GLU 997 -9.214 14.142 -0.729 652 1HB GLU 997 1HB GLU 997 -9.447 12.296 1.053 653 2HB GLU 997 2HB GLU 997 -7.733 12.496 1.360 654 1HG GLU 997 1HG GLU 997 -8.263 14.194 2.767 655 2HG GLU 997 2HG GLU 997 -8.725 15.134 1.362 656 H LEU 998 H LEU 998 -6.153 12.318 -0.994 657 HA LEU 998 HA LEU 998 -4.478 14.468 -0.256 658 1HB LEU 998 1HB LEU 998 -4.027 11.936 -0.325 659 2HB LEU 998 2HB LEU 998 -3.710 12.167 -2.033 660 HG LEU 998 HG LEU 998 -1.630 12.161 -0.825 661 1HD1 LEU 998 1HD1 LEU 998 -1.955 13.731 -2.767 662 2HD1 LEU 998 2HD1 LEU 998 -2.179 15.038 -1.579 663 3HD1 LEU 998 3HD1 LEU 998 -0.636 14.155 -1.650 664 1HD2 LEU 998 1HD2 LEU 998 -3.074 13.422 1.213 665 2HD2 LEU 998 2HD2 LEU 998 -1.343 13.004 1.210 666 3HD2 LEU 998 3HD2 LEU 998 -1.869 14.621 0.684 667 H ILE 999 H ILE 999 -5.572 13.131 -3.443 668 HA ILE 999 HA ILE 999 -4.159 14.891 -5.034 669 HB ILE 999 HB ILE 999 -6.813 13.521 -5.463 670 1HG1 ILE 999 1HG1 ILE 999 -4.722 12.138 -4.994 671 2HG1 ILE 999 2HG1 ILE 999 -5.624 11.761 -6.448 672 1HG2 ILE 999 1HG2 ILE 999 -6.948 15.082 -7.125 673 2HG2 ILE 999 2HG2 ILE 999 -5.182 15.275 -7.248 674 3HG2 ILE 999 3HG2 ILE 999 -5.972 13.844 -7.952 675 1HD1 ILE 999 1HD1 ILE 999 -2.893 12.318 -6.326 676 2HD1 ILE 999 2HD1 ILE 999 -3.887 12.330 -7.802 677 3HD1 ILE 999 3HD1 ILE 999 -3.592 13.845 -6.916 678 H ASN1000 H ASN1000 -7.390 15.228 -3.465 679 HA ASN1000 HA ASN1000 -8.007 17.642 -4.667 680 1HB ASN1000 1HB ASN1000 -9.303 15.908 -2.968 681 2HB ASN1000 2HB ASN1000 -8.919 17.192 -1.840 682 1HD2 ASN1000 1HD2 ASN1000 -11.150 16.069 -3.966 683 2HD2 ASN1000 2HD2 ASN1000 -12.026 17.516 -4.338 684 H LYS1001 H LYS1001 -6.598 16.819 -1.407 685 HA LYS1001 HA LYS1001 -6.322 19.222 -0.273 686 1HB LYS1001 1HB LYS1001 -5.227 16.673 0.080 687 2HB LYS1001 2HB LYS1001 -3.832 17.727 -0.035 688 1HG LYS1001 1HG LYS1001 -4.313 17.909 2.243 689 2HG LYS1001 2HG LYS1001 -5.203 19.283 1.620 690 1HD LYS1001 1HD LYS1001 -7.119 17.352 1.348 691 2HD LYS1001 2HD LYS1001 -6.231 16.684 2.703 692 1HE LYS1001 1HE LYS1001 -7.393 18.105 4.043 693 2HE LYS1001 2HE LYS1001 -6.452 19.412 3.353 694 1HZ LYS1001 1HZ LYS1001 -9.159 18.656 2.819 695 2HZ LYS1001 2HZ LYS1001 -8.443 20.119 2.701 696 3HZ LYS1001 3HZ LYS1001 -8.299 19.039 1.484 697 H MET1002 H MET1002 -4.463 17.967 -3.060 698 HA MET1002 HA MET1002 -2.643 20.130 -3.022 699 1HB MET1002 1HB MET1002 -1.909 18.084 -4.067 700 2HB MET1002 2HB MET1002 -3.395 17.915 -4.981 701 1HG MET1002 1HG MET1002 -1.694 20.362 -5.481 702 2HG MET1002 2HG MET1002 -1.145 18.830 -6.130 703 1HE MET1002 1HE MET1002 -3.409 17.999 -8.953 704 2HE MET1002 2HE MET1002 -1.782 17.953 -8.232 705 3HE MET1002 3HE MET1002 -3.143 17.155 -7.408 706 H LYS1003 H LYS1003 -5.534 19.253 -5.033 707 HA LYS1003 HA LYS1003 -5.453 21.399 -6.753 708 1HB LYS1003 1HB LYS1003 -7.353 19.350 -5.942 709 2HB LYS1003 2HB LYS1003 -8.165 20.862 -6.292 710 1HG LYS1003 1HG LYS1003 -6.664 20.930 -8.446 711 2HG LYS1003 2HG LYS1003 -6.366 19.234 -8.122 712 1HD LYS1003 1HD LYS1003 -8.245 19.034 -9.474 713 2HD LYS1003 2HD LYS1003 -9.029 19.124 -7.909 714 1HE LYS1003 1HE LYS1003 -9.897 21.224 -8.306 715 2HE LYS1003 2HE LYS1003 -8.466 21.773 -9.157 716 1HZ LYS1003 1HZ LYS1003 -9.312 20.059 -10.900 717 2HZ LYS1003 2HZ LYS1003 -10.757 20.334 -10.191 718 3HZ LYS1003 3HZ LYS1003 -9.924 21.573 -10.852 719 H LEU1004 H LEU1004 -6.150 21.282 -3.324 720 HA LEU1004 HA LEU1004 -7.449 23.879 -3.402 721 1HB LEU1004 1HB LEU1004 -6.780 22.200 -0.990 722 2HB LEU1004 2HB LEU1004 -7.919 23.527 -1.097 723 HG LEU1004 HG LEU1004 -8.231 20.881 -2.542 724 1HD1 LEU1004 1HD1 LEU1004 -9.575 20.082 -0.850 725 2HD1 LEU1004 2HD1 LEU1004 -8.327 20.955 0.071 726 3HD1 LEU1004 3HD1 LEU1004 -9.919 21.704 -0.203 727 1HD2 LEU1004 1HD2 LEU1004 -10.409 21.581 -3.145 728 2HD2 LEU1004 2HD2 LEU1004 -10.329 23.009 -2.085 729 3HD2 LEU1004 3HD2 LEU1004 -9.322 22.931 -3.551 730 H ALA1005 H ALA1005 -4.468 22.285 -2.108 731 HA ALA1005 HA ALA1005 -3.387 24.605 -0.990 732 1HB ALA1005 1HB ALA1005 -1.197 23.151 -1.514 733 2HB ALA1005 2HB ALA1005 -2.348 22.690 -0.237 734 3HB ALA1005 3HB ALA1005 -2.418 21.895 -1.828 735 H GLN1006 H GLN1006 -3.986 23.741 -4.265 736 HA GLN1006 HA GLN1006 -1.758 25.231 -5.280 737 1HB GLN1006 1HB GLN1006 -3.140 23.120 -6.281 738 2HB GLN1006 2HB GLN1006 -4.026 24.413 -7.063 739 1HG GLN1006 1HG GLN1006 -2.339 24.132 -8.631 740 2HG GLN1006 2HG GLN1006 -1.566 25.329 -7.611 741 1HE2 GLN1006 1HE2 GLN1006 -2.158 21.819 -7.391 742 2HE2 GLN1006 2HE2 GLN1006 -0.523 21.340 -7.079 743 H GLN1007 H GLN1007 -5.194 25.675 -4.528 744 HA GLN1007 HA GLN1007 -5.110 28.259 -5.853 745 1HB GLN1007 1HB GLN1007 -7.047 26.339 -5.949 746 2HB GLN1007 2HB GLN1007 -7.641 27.279 -4.596 747 1HG GLN1007 1HG GLN1007 -7.717 29.314 -5.923 748 2HG GLN1007 2HG GLN1007 -6.823 28.569 -7.234 749 1HE2 GLN1007 1HE2 GLN1007 -9.863 28.795 -5.558 750 2HE2 GLN1007 2HE2 GLN1007 -10.862 28.009 -6.735 751 H TYR1008 H TYR1008 -4.424 26.885 -2.882 752 HA TYR1008 HA TYR1008 -5.483 29.170 -1.376 753 1HB TYR1008 1HB TYR1008 -4.610 26.295 -0.882 754 2HB TYR1008 2HB TYR1008 -4.429 27.418 0.451 755 HD1 TYR1008 HD1 TYR1008 -6.368 24.884 -0.257 756 HD2 TYR1008 HD2 TYR1008 -6.848 29.116 0.149 757 HE1 TYR1008 HE1 TYR1008 -8.813 24.555 0.357 758 HE2 TYR1008 HE2 TYR1008 -9.291 28.773 0.762 759 HH TYR1008 HH TYR1008 -11.019 27.123 0.409 760 H VAL1009 H VAL1009 -2.582 27.735 -2.715 761 HA VAL1009 HA VAL1009 -0.696 28.667 -0.899 762 HB VAL1009 HB VAL1009 -0.023 27.081 -2.469 763 1HG1 VAL1009 1HG1 VAL1009 -1.738 28.543 -4.266 764 2HG1 VAL1009 2HG1 VAL1009 -0.148 28.289 -5.025 765 3HG1 VAL1009 3HG1 VAL1009 -1.080 26.897 -4.424 766 1HG2 VAL1009 1HG2 VAL1009 1.123 29.747 -3.367 767 2HG2 VAL1009 2HG2 VAL1009 1.725 28.720 -2.043 768 3HG2 VAL1009 3HG2 VAL1009 1.825 28.151 -3.727 769 H MET1010 H MET1010 -2.385 30.254 -3.643 770 HA MET1010 HA MET1010 -0.939 32.434 -4.053 771 1HB MET1010 1HB MET1010 -3.362 33.605 -4.106 772 2HB MET1010 2HB MET1010 -2.952 32.364 -5.273 773 1HG MET1010 1HG MET1010 -4.502 30.914 -4.432 774 2HG MET1010 2HG MET1010 -3.976 31.181 -2.782 775 1HE MET1010 1HE MET1010 -5.589 32.309 -1.065 776 2HE MET1010 2HE MET1010 -7.270 32.378 -1.647 777 3HE MET1010 3HE MET1010 -6.284 30.925 -1.941 778 H THR1011 H THR1011 -2.684 31.637 -1.074 779 HA THR1011 HA THR1011 -2.034 34.299 -0.005 780 HB THR1011 HB THR1011 -4.447 33.553 0.010 781 HG1 THR1011 HG1 THR1011 -3.531 34.924 1.712 782 1HG2 THR1011 1HG2 THR1011 -4.683 31.854 2.132 783 2HG2 THR1011 2HG2 THR1011 -4.676 31.276 0.448 784 3HG2 THR1011 3HG2 THR1011 -3.184 31.215 1.417 785 H SER1012 H SER1012 -2.496 32.924 2.739 786 HA SER1012 HA SER1012 0.238 31.920 2.886 787 1HB SER1012 1HB SER1012 -1.449 33.482 4.875 788 2HB SER1012 2HB SER1012 -0.012 32.614 5.377 789 HG SER1012 HG SER1012 0.705 34.673 4.906 790 H LEU1013 H LEU1013 -3.164 31.282 3.373 791 HA LEU1013 HA LEU1013 -3.273 29.495 5.396 792 1HB LEU1013 1HB LEU1013 -4.920 30.328 3.365 793 2HB LEU1013 2HB LEU1013 -4.713 28.628 2.991 794 HG LEU1013 HG LEU1013 -6.711 29.225 4.411 795 1HD1 LEU1013 1HD1 LEU1013 -4.917 27.024 4.576 796 2HD1 LEU1013 2HD1 LEU1013 -5.520 27.362 6.217 797 3HD1 LEU1013 3HD1 LEU1013 -6.669 27.062 4.890 798 1HD2 LEU1013 1HD2 LEU1013 -5.157 30.825 5.828 799 2HD2 LEU1013 2HD2 LEU1013 -6.557 30.001 6.556 800 3HD2 LEU1013 3HD2 LEU1013 -4.917 29.352 6.799 801 H GLN1014 H GLN1014 -1.571 29.179 2.330 802 HA GLN1014 HA GLN1014 -1.426 26.602 1.835 803 1HB GLN1014 1HB GLN1014 -0.012 28.673 0.968 804 2HB GLN1014 2HB GLN1014 1.197 28.082 2.091 805 1HG GLN1014 1HG GLN1014 0.338 25.754 0.760 806 2HG GLN1014 2HG GLN1014 0.357 26.968 -0.504 807 1HE2 GLN1014 1HE2 GLN1014 2.117 26.406 -1.609 808 2HE2 GLN1014 2HE2 GLN1014 3.735 26.369 -0.992 809 H GLN1015 H GLN1015 1.054 28.075 4.056 810 HA GLN1015 HA GLN1015 2.161 25.897 5.028 811 1HB GLN1015 1HB GLN1015 2.240 27.205 7.305 812 2HB GLN1015 2HB GLN1015 3.007 27.900 5.891 813 1HG GLN1015 1HG GLN1015 1.344 29.529 5.605 814 2HG GLN1015 2HG GLN1015 0.103 28.555 6.368 815 1HE2 GLN1015 1HE2 GLN1015 2.328 31.047 6.729 816 2HE2 GLN1015 2HE2 GLN1015 2.254 31.278 8.444 817 H GLU1016 H GLU1016 -1.102 27.107 5.884 818 HA GLU1016 HA GLU1016 -1.465 25.309 8.006 819 1HB GLU1016 1HB GLU1016 -2.764 27.531 7.223 820 2HB GLU1016 2HB GLU1016 -3.809 26.363 6.438 821 1HG GLU1016 1HG GLU1016 -3.527 25.198 8.922 822 2HG GLU1016 2HG GLU1016 -3.405 26.894 9.348 823 H TYR1017 H TYR1017 -2.912 25.379 4.661 824 HA TYR1017 HA TYR1017 -4.028 22.831 4.821 825 1HB TYR1017 1HB TYR1017 -3.057 24.781 2.676 826 2HB TYR1017 2HB TYR1017 -3.632 23.205 2.168 827 HD1 TYR1017 HD1 TYR1017 -4.622 26.447 2.329 828 HD2 TYR1017 HD2 TYR1017 -5.972 22.602 3.634 829 HE1 TYR1017 HE1 TYR1017 -7.018 27.297 2.381 830 HE2 TYR1017 HE2 TYR1017 -8.363 23.466 3.681 831 HH TYR1017 HH TYR1017 -9.647 25.211 3.524 832 H LYS1018 H LYS1018 -0.709 23.857 4.439 833 HA LYS1018 HA LYS1018 0.197 21.623 2.967 834 1HB LYS1018 1HB LYS1018 1.242 24.049 3.742 835 2HB LYS1018 2HB LYS1018 2.121 22.935 4.769 836 1HG LYS1018 1HG LYS1018 3.461 22.495 2.991 837 2HG LYS1018 2HG LYS1018 2.109 21.642 2.273 838 1HD LYS1018 1HD LYS1018 1.444 24.243 1.652 839 2HD LYS1018 2HD LYS1018 3.193 24.352 1.643 840 1HE LYS1018 1HE LYS1018 3.406 23.028 -0.232 841 2HE LYS1018 2HE LYS1018 2.115 21.947 0.254 842 1HZ LYS1018 1HZ LYS1018 1.349 24.636 -0.470 843 2HZ LYS1018 2HZ LYS1018 1.844 23.664 -1.685 844 3HZ LYS1018 3HZ LYS1018 0.580 23.223 -0.751 845 H LYS1019 H LYS1019 -0.109 22.388 6.477 846 HA LYS1019 HA LYS1019 1.175 20.056 7.359 847 1HB LYS1019 1HB LYS1019 -0.142 22.345 8.490 848 2HB LYS1019 2HB LYS1019 -0.753 20.902 9.273 849 1HG LYS1019 1HG LYS1019 1.142 21.224 10.567 850 2HG LYS1019 2HG LYS1019 1.847 20.227 9.310 851 1HD LYS1019 1HD LYS1019 1.794 23.264 9.090 852 2HD LYS1019 2HD LYS1019 3.083 22.430 9.935 853 1HE LYS1019 1HE LYS1019 3.068 20.975 7.625 854 2HE LYS1019 2HE LYS1019 2.466 22.497 6.999 855 1HZ LYS1019 1HZ LYS1019 4.460 23.385 7.211 856 2HZ LYS1019 2HZ LYS1019 4.647 22.883 8.753 857 3HZ LYS1019 3HZ LYS1019 5.053 21.894 7.518 858 H GLN1020 H GLN1020 -2.196 20.817 6.413 859 HA GLN1020 HA GLN1020 -3.394 18.580 7.439 860 1HB GLN1020 1HB GLN1020 -4.060 20.028 4.837 861 2HB GLN1020 2HB GLN1020 -5.148 18.975 5.719 862 1HG GLN1020 1HG GLN1020 -3.971 21.610 6.715 863 2HG GLN1020 2HG GLN1020 -5.642 21.317 6.276 864 1HE2 GLN1020 1HE2 GLN1020 -3.331 21.289 8.725 865 2HE2 GLN1020 2HE2 GLN1020 -4.233 20.514 9.984 866 H MET1021 H MET1021 -1.773 19.080 4.240 867 HA MET1021 HA MET1021 -2.385 16.663 3.132 868 1HB MET1021 1HB MET1021 -0.635 18.888 2.642 869 2HB MET1021 2HB MET1021 0.373 17.458 2.527 870 1HG MET1021 1HG MET1021 -2.041 16.807 1.150 871 2HG MET1021 2HG MET1021 -1.637 18.437 0.649 872 1HE MET1021 1HE MET1021 -0.046 15.370 1.855 873 2HE MET1021 2HE MET1021 0.682 14.616 0.416 874 3HE MET1021 3HE MET1021 1.633 15.752 1.404 875 H LEU1022 H LEU1022 0.419 17.552 5.249 876 HA LEU1022 HA LEU1022 1.795 15.187 5.130 877 1HB LEU1022 1HB LEU1022 2.601 17.235 6.171 878 2HB LEU1022 2HB LEU1022 1.428 17.072 7.462 879 HG LEU1022 HG LEU1022 3.685 16.407 8.157 880 1HD1 LEU1022 1HD1 LEU1022 2.960 14.748 9.519 881 2HD1 LEU1022 2HD1 LEU1022 1.383 15.222 8.843 882 3HD1 LEU1022 3HD1 LEU1022 2.244 13.808 8.188 883 1HD2 LEU1022 1HD2 LEU1022 3.823 15.187 5.643 884 2HD2 LEU1022 2HD2 LEU1022 5.043 15.144 6.938 885 3HD2 LEU1022 3HD2 LEU1022 3.830 13.847 6.814 886 H THR1023 H THR1023 -0.990 16.087 7.255 887 HA THR1023 HA THR1023 -1.092 13.859 8.834 888 HB THR1023 HB THR1023 -3.561 15.162 7.611 889 HG1 THR1023 HG1 THR1023 -1.695 16.125 9.664 890 1HG2 THR1023 1HG2 THR1023 -2.938 13.598 10.006 891 2HG2 THR1023 2HG2 THR1023 -3.511 15.221 10.459 892 3HG2 THR1023 3HG2 THR1023 -4.523 14.173 9.435 893 H ALA1024 H ALA1024 -2.585 14.239 5.554 894 HA ALA1024 HA ALA1024 -3.610 11.637 5.487 895 1HB ALA1024 1HB ALA1024 -3.070 13.860 3.560 896 2HB ALA1024 2HB ALA1024 -3.323 12.235 2.878 897 3HB ALA1024 3HB ALA1024 -4.580 12.979 3.895 898 H ALA1025 H ALA1025 -0.460 13.069 4.475 899 HA ALA1025 HA ALA1025 0.553 10.860 3.154 900 1HB ALA1025 1HB ALA1025 1.434 13.413 4.081 901 2HB ALA1025 2HB ALA1025 2.627 12.209 4.624 902 3HB ALA1025 3HB ALA1025 2.220 12.342 2.897 903 H HIS1026 H HIS1026 0.099 11.527 6.611 904 HA HIS1026 HA HIS1026 1.872 9.497 7.481 905 1HB HIS1026 1HB HIS1026 1.155 11.521 8.790 906 2HB HIS1026 2HB HIS1026 -0.422 10.782 8.983 907 HD1 HIS1026 HD1 HIS1026 3.240 9.966 9.773 908 HD2 HIS1026 HD2 HIS1026 -0.629 9.162 11.183 909 HE1 HIS1026 HE1 HIS1026 3.527 8.642 11.936 910 H ALA1027 H ALA1027 -1.747 9.754 7.270 911 HA ALA1027 HA ALA1027 -2.191 7.090 8.028 912 1HB ALA1027 1HB ALA1027 -4.465 7.524 7.337 913 2HB ALA1027 2HB ALA1027 -3.829 9.011 8.080 914 3HB ALA1027 3HB ALA1027 -3.948 8.883 6.309 915 H LEU1028 H LEU1028 -1.482 8.696 4.915 916 HA LEU1028 HA LEU1028 -2.265 6.651 3.216 917 1HB LEU1028 1HB LEU1028 -0.347 8.930 3.087 918 2HB LEU1028 2HB LEU1028 -0.266 7.709 1.834 919 HG LEU1028 HG LEU1028 -2.571 9.537 2.511 920 1HD1 LEU1028 1HD1 LEU1028 -1.391 10.738 1.007 921 2HD1 LEU1028 2HD1 LEU1028 -0.578 9.307 0.329 922 3HD1 LEU1028 3HD1 LEU1028 -2.245 9.699 -0.158 923 1HD2 LEU1028 1HD2 LEU1028 -2.604 6.972 0.933 924 2HD2 LEU1028 2HD2 LEU1028 -3.732 7.542 2.186 925 3HD2 LEU1028 3HD2 LEU1028 -3.735 8.298 0.575 926 H ALA1029 H ALA1029 1.129 7.368 4.316 927 HA ALA1029 HA ALA1029 2.396 5.212 3.394 928 1HB ALA1029 1HB ALA1029 3.831 5.392 5.468 929 2HB ALA1029 2HB ALA1029 3.529 6.940 4.642 930 3HB ALA1029 3HB ALA1029 2.632 6.532 6.124 931 H VAL1030 H VAL1030 0.296 5.316 6.332 932 HA VAL1030 HA VAL1030 0.767 2.602 6.991 933 HB VAL1030 HB VAL1030 -1.205 4.719 7.802 934 1HG1 VAL1030 1HG1 VAL1030 -1.517 2.617 9.620 935 2HG1 VAL1030 2HG1 VAL1030 -2.698 3.168 8.408 936 3HG1 VAL1030 3HG1 VAL1030 -1.579 1.840 8.020 937 1HG2 VAL1030 1HG2 VAL1030 -0.010 3.905 10.072 938 2HG2 VAL1030 2HG2 VAL1030 1.268 3.481 8.907 939 3HG2 VAL1030 3HG2 VAL1030 0.675 5.157 9.008 940 H ASP1031 H ASP1031 -2.051 4.336 5.481 941 HA ASP1031 HA ASP1031 -3.708 2.335 5.053 942 1HB ASP1031 1HB ASP1031 -2.852 4.474 3.051 943 2HB ASP1031 2HB ASP1031 -4.261 3.460 2.811 944 H ALA1032 H ALA1032 -0.995 3.267 2.794 945 HA ALA1032 HA ALA1032 -1.322 1.131 1.039 946 1HB ALA1032 1HB ALA1032 1.251 2.602 1.725 947 2HB ALA1032 2HB ALA1032 0.842 1.793 0.193 948 3HB ALA1032 3HB ALA1032 -0.026 3.269 0.679 949 H LYS1033 H LYS1033 0.443 1.474 4.139 950 HA LYS1033 HA LYS1033 1.930 -0.884 3.931 951 1HB LYS1033 1HB LYS1033 2.059 1.153 5.581 952 2HB LYS1033 2HB LYS1033 0.957 0.205 6.559 953 1HG LYS1033 1HG LYS1033 2.617 -1.200 7.216 954 2HG LYS1033 2HG LYS1033 3.110 -1.496 5.561 955 1HD LYS1033 1HD LYS1033 5.009 -0.353 6.086 956 2HD LYS1033 2HD LYS1033 4.030 1.094 5.961 957 1HE LYS1033 1HE LYS1033 3.522 0.039 8.565 958 2HE LYS1033 2HE LYS1033 5.254 -0.087 8.330 959 1HZ LYS1033 1HZ LYS1033 4.560 2.056 9.210 960 2HZ LYS1033 2HZ LYS1033 5.327 2.219 7.777 961 3HZ LYS1033 3HZ LYS1033 3.702 2.362 7.855 962 H ASN1034 H ASN1034 -1.048 -0.303 5.938 963 HA ASN1034 HA ASN1034 -1.578 -2.739 6.736 964 1HB ASN1034 1HB ASN1034 -3.251 -0.430 5.903 965 2HB ASN1034 2HB ASN1034 -4.119 -1.951 5.831 966 1HD2 ASN1034 1HD2 ASN1034 -5.008 -0.169 7.561 967 2HD2 ASN1034 2HD2 ASN1034 -4.638 -0.579 9.203 968 H LEU1035 H LEU1035 -1.794 -1.515 3.394 969 HA LEU1035 HA LEU1035 -3.383 -3.510 2.282 970 1HB LEU1035 1HB LEU1035 -2.422 -1.228 1.388 971 2HB LEU1035 2HB LEU1035 -1.140 -2.246 0.762 972 HG LEU1035 HG LEU1035 -2.976 -1.737 -0.857 973 1HD1 LEU1035 1HD1 LEU1035 -2.966 -3.872 -1.872 974 2HD1 LEU1035 2HD1 LEU1035 -1.435 -3.746 -0.973 975 3HD1 LEU1035 3HD1 LEU1035 -2.781 -4.703 -0.309 976 1HD2 LEU1035 1HD2 LEU1035 -4.668 -3.662 0.746 977 2HD2 LEU1035 2HD2 LEU1035 -4.803 -1.892 0.887 978 3HD2 LEU1035 3HD2 LEU1035 -5.134 -2.689 -0.670 979 H LEU1036 H LEU1036 0.228 -3.233 1.963 980 HA LEU1036 HA LEU1036 0.424 -5.985 1.293 981 1HB LEU1036 1HB LEU1036 1.936 -3.778 0.861 982 2HB LEU1036 2HB LEU1036 2.829 -4.516 2.176 983 HG LEU1036 HG LEU1036 2.160 -6.517 0.196 984 1HD1 LEU1036 1HD1 LEU1036 2.105 -4.499 -1.295 985 2HD1 LEU1036 2HD1 LEU1036 3.814 -4.222 -0.881 986 3HD1 LEU1036 3HD1 LEU1036 3.333 -5.716 -1.721 987 1HD2 LEU1036 1HD2 LEU1036 4.969 -5.786 0.408 988 2HD2 LEU1036 2HD2 LEU1036 4.195 -5.950 2.002 989 3HD2 LEU1036 3HD2 LEU1036 4.140 -7.300 0.843 990 H ASP1037 H ASP1037 1.050 -4.001 4.240 991 HA ASP1037 HA ASP1037 2.297 -5.706 5.820 992 1HB ASP1037 1HB ASP1037 1.168 -3.389 6.310 993 2HB ASP1037 2HB ASP1037 -0.226 -4.326 6.810 994 H VAL1038 H VAL1038 -1.203 -5.753 4.920 995 HA VAL1038 HA VAL1038 -1.854 -7.916 6.642 996 HB VAL1038 HB VAL1038 -3.216 -6.576 4.308 997 1HG1 VAL1038 1HG1 VAL1038 -4.034 -9.000 5.885 998 2HG1 VAL1038 2HG1 VAL1038 -5.274 -7.858 5.313 999 3HG1 VAL1038 3HG1 VAL1038 -4.200 -8.665 4.145 1000 1HG2 VAL1038 1HG2 VAL1038 -2.857 -5.573 6.750 1001 2HG2 VAL1038 2HG2 VAL1038 -4.368 -5.325 5.842 1002 3HG2 VAL1038 3HG2 VAL1038 -4.282 -6.580 7.101 1003 H ILE1039 H ILE1039 -0.895 -7.548 3.194 1004 HA ILE1039 HA ILE1039 -1.429 -10.132 2.372 1005 HB ILE1039 HB ILE1039 0.452 -7.974 1.515 1006 1HG1 ILE1039 1HG1 ILE1039 -1.673 -9.376 -0.102 1007 2HG1 ILE1039 2HG1 ILE1039 -2.091 -8.113 1.039 1008 1HG2 ILE1039 1HG2 ILE1039 0.681 -9.768 -0.525 1009 2HG2 ILE1039 2HG2 ILE1039 1.900 -9.504 0.744 1010 3HG2 ILE1039 3HG2 ILE1039 0.733 -10.840 0.894 1011 1HD1 ILE1039 1HD1 ILE1039 -0.919 -6.449 -0.154 1012 2HD1 ILE1039 2HD1 ILE1039 0.122 -7.636 -0.975 1013 3HD1 ILE1039 3HD1 ILE1039 -1.582 -7.464 -1.458 1014 H ASP1040 H ASP1040 1.690 -8.760 3.642 1015 HA ASP1040 HA ASP1040 3.183 -10.967 3.579 1016 1HB ASP1040 1HB ASP1040 3.641 -8.567 4.542 1017 2HB ASP1040 2HB ASP1040 3.109 -9.230 6.074 1018 H GLN1041 H GLN1041 0.753 -9.998 6.089 1019 HA GLN1041 HA GLN1041 1.256 -12.288 7.673 1020 1HB GLN1041 1HB GLN1041 -0.700 -10.001 7.710 1021 2HB GLN1041 2HB GLN1041 -1.096 -11.426 8.650 1022 1HG GLN1041 1HG GLN1041 1.588 -11.034 9.291 1023 2HG GLN1041 2HG GLN1041 1.013 -9.389 9.109 1024 1HE2 GLN1041 1HE2 GLN1041 -1.092 -8.882 10.182 1025 2HE2 GLN1041 2HE2 GLN1041 -1.379 -9.523 11.765 1026 H ALA1042 H ALA1042 -0.737 -11.519 4.886 1027 HA ALA1042 HA ALA1042 -2.651 -13.591 5.322 1028 1HB ALA1042 1HB ALA1042 -3.658 -12.735 3.444 1029 2HB ALA1042 2HB ALA1042 -2.638 -11.335 3.852 1030 3HB ALA1042 3HB ALA1042 -2.114 -12.483 2.597 1031 H ARG1043 H ARG1043 0.236 -13.137 3.168 1032 HA ARG1043 HA ARG1043 0.138 -15.461 1.844 1033 1HB ARG1043 1HB ARG1043 1.854 -13.643 1.541 1034 2HB ARG1043 2HB ARG1043 2.656 -14.165 3.009 1035 1HG ARG1043 1HG ARG1043 3.596 -16.014 2.006 1036 2HG ARG1043 2HG ARG1043 2.176 -16.344 1.034 1037 1HD ARG1043 1HD ARG1043 2.800 -14.767 -0.646 1038 2HD ARG1043 2HD ARG1043 3.903 -13.922 0.421 1039 HE ARG1043 HE ARG1043 4.459 -16.388 -1.077 1040 1HH1 ARG1043 2HH2 ARG1043 5.443 -14.337 1.608 1041 2HH1 ARG1043 1HH2 ARG1043 7.067 -14.939 1.639 1042 1HH2 ARG1043 2HH1 ARG1043 6.601 -17.182 -1.036 1043 2HH2 ARG1043 1HH1 ARG1043 7.730 -16.568 0.125 1044 H LEU1044 H LEU1044 1.976 -14.908 4.947 1045 HA LEU1044 HA LEU1044 2.735 -17.528 5.345 1046 1HB LEU1044 1HB LEU1044 2.966 -16.858 7.721 1047 2HB LEU1044 2HB LEU1044 3.761 -15.801 6.572 1048 HG LEU1044 HG LEU1044 1.516 -14.408 6.780 1049 1HD1 LEU1044 1HD1 LEU1044 0.520 -16.218 8.270 1050 2HD1 LEU1044 2HD1 LEU1044 1.617 -15.628 9.541 1051 3HD1 LEU1044 3HD1 LEU1044 0.394 -14.538 8.845 1052 1HD2 LEU1044 1HD2 LEU1044 3.894 -14.444 8.628 1053 2HD2 LEU1044 2HD2 LEU1044 3.524 -13.339 7.282 1054 3HD2 LEU1044 3HD2 LEU1044 2.602 -13.232 8.801 1055 H LYS1045 H LYS1045 -0.367 -15.878 5.965 1056 HA LYS1045 HA LYS1045 -1.520 -17.682 7.686 1057 1HB LYS1045 1HB LYS1045 -2.299 -15.395 6.418 1058 2HB LYS1045 2HB LYS1045 -3.276 -16.579 5.574 1059 1HG LYS1045 1HG LYS1045 -4.588 -16.981 7.404 1060 2HG LYS1045 2HG LYS1045 -3.215 -17.047 8.491 1061 1HD LYS1045 1HD LYS1045 -3.223 -14.716 8.872 1062 2HD LYS1045 2HD LYS1045 -4.047 -14.365 7.366 1063 1HE LYS1045 1HE LYS1045 -6.065 -14.431 8.402 1064 2HE LYS1045 2HE LYS1045 -5.766 -16.065 8.961 1065 1HZ LYS1045 1HZ LYS1045 -5.114 -13.555 10.305 1066 2HZ LYS1045 2HZ LYS1045 -5.971 -14.824 10.873 1067 3HZ LYS1045 3HZ LYS1045 -4.350 -14.938 10.716 1068 H MET1046 H MET1046 -0.552 -18.079 4.350 1069 HA MET1046 HA MET1046 -2.288 -20.363 4.040 1070 1HB MET1046 1HB MET1046 -2.058 -19.846 1.812 1071 2HB MET1046 2HB MET1046 -1.145 -18.434 2.304 1072 1HG MET1046 1HG MET1046 0.966 -19.769 2.259 1073 2HG MET1046 2HG MET1046 0.063 -21.199 1.803 1074 1HE MET1046 1HE MET1046 -0.489 -17.353 -0.242 1075 2HE MET1046 2HE MET1046 0.433 -17.613 1.258 1076 3HE MET1046 3HE MET1046 1.280 -17.539 -0.305 1077 H ILE1047 H ILE1047 1.181 -19.519 4.434 1078 HA ILE1047 HA ILE1047 2.175 -22.097 3.941 1079 HB ILE1047 HB ILE1047 3.198 -19.616 5.266 1080 1HG1 ILE1047 1HG1 ILE1047 4.653 -21.005 3.087 1081 2HG1 ILE1047 2HG1 ILE1047 3.073 -20.378 2.660 1082 1HG2 ILE1047 1HG2 ILE1047 5.419 -21.221 5.133 1083 2HG2 ILE1047 2HG2 ILE1047 4.507 -20.832 6.611 1084 3HG2 ILE1047 3HG2 ILE1047 4.175 -22.344 5.732 1085 1HD1 ILE1047 1HD1 ILE1047 5.566 -18.919 3.300 1086 2HD1 ILE1047 2HD1 ILE1047 4.154 -18.394 2.353 1087 3HD1 ILE1047 3HD1 ILE1047 4.129 -18.273 4.128 1088 H SER1048 H SER1048 1.224 -20.370 6.977 1089 HA SER1048 HA SER1048 1.958 -22.370 8.701 1090 1HB SER1048 1HB SER1048 -0.207 -20.242 8.830 1091 2HB SER1048 2HB SER1048 0.069 -21.338 10.169 1092 HG SER1048 HG SER1048 1.430 -19.714 10.696 1093 H GLN1049 H GLN1049 -1.461 -21.610 7.691 1094 HA GLN1049 HA GLN1049 -2.660 -23.787 8.647 1095 1HB GLN1049 1HB GLN1049 -3.228 -21.792 6.645 1096 2HB GLN1049 2HB GLN1049 -3.786 -23.338 6.038 1097 1HG GLN1049 1HG GLN1049 -4.444 -22.326 8.841 1098 2HG GLN1049 2HG GLN1049 -5.472 -22.021 7.456 1099 1HE2 GLN1049 1HE2 GLN1049 -4.668 -24.138 9.936 1100 2HE2 GLN1049 2HE2 GLN1049 -5.578 -25.532 9.457 1101 H SER1050 H SER1050 -1.435 -23.558 5.222 1102 HA SER1050 HA SER1050 -1.909 -26.049 4.421 1103 1HB SER1050 1HB SER1050 -0.942 -24.501 2.881 1104 2HB SER1050 2HB SER1050 0.462 -24.231 3.894 1105 HG SER1050 HG SER1050 0.675 -25.706 1.930 1106 H ARG1051 H ARG1051 1.253 -25.019 5.920 1107 HA ARG1051 HA ARG1051 2.224 -27.580 6.149 1108 1HB ARG1051 1HB ARG1051 2.821 -24.992 7.643 1109 2HB ARG1051 2HB ARG1051 3.693 -26.466 8.017 1110 1HG ARG1051 1HG ARG1051 3.627 -26.128 5.134 1111 2HG ARG1051 2HG ARG1051 4.175 -24.632 5.863 1112 1HD ARG1051 1HD ARG1051 5.885 -25.920 7.186 1113 2HD ARG1051 2HD ARG1051 5.353 -27.400 6.413 1114 HE ARG1051 HE ARG1051 5.956 -25.529 4.351 1115 1HH1 ARG1051 2HH2 ARG1051 7.624 -27.340 6.867 1116 2HH1 ARG1051 1HH2 ARG1051 9.124 -27.404 6.004 1117 1HH2 ARG1051 2HH1 ARG1051 7.936 -25.614 3.212 1118 2HH2 ARG1051 1HH1 ARG1051 9.303 -26.416 3.911 1119 HA PRO1052 HA PRO1052 -0.256 -28.887 9.546 1120 1HB PRO1052 1HB PRO1052 0.610 -31.477 9.649 1121 2HB PRO1052 2HB PRO1052 -0.669 -30.936 8.580 1122 1HG PRO1052 1HG PRO1052 2.132 -31.615 7.923 1123 2HG PRO1052 2HG PRO1052 0.752 -31.490 6.850 1124 1HD PRO1052 1HD PRO1052 2.858 -29.569 7.169 1125 2HD PRO1052 2HD PRO1052 1.419 -29.393 6.184 1126 H HIS1053 H HIS1053 0.216 -30.447 11.615 1127 HA HIS1053 HA HIS1053 1.974 -28.858 13.106 1128 1HB HIS1053 1HB HIS1053 0.036 -30.887 13.566 1129 2HB HIS1053 2HB HIS1053 1.513 -31.409 14.351 1130 HD1 HIS1053 HD1 HIS1053 -1.132 -30.413 15.843 1131 HD2 HIS1053 HD2 HIS1053 2.343 -28.155 15.193 1132 HE1 HIS1053 HE1 HIS1053 -1.121 -28.589 17.627 Start of MODEL 13 1 H MET 915 H MET 915 10.991 -12.083 4.999 2 HA MET 915 HA MET 915 12.030 -10.973 2.505 3 1HB MET 915 1HB MET 915 13.389 -11.508 5.201 4 2HB MET 915 2HB MET 915 14.302 -11.159 3.746 5 1HG MET 915 1HG MET 915 14.077 -8.962 4.330 6 2HG MET 915 2HG MET 915 12.435 -9.100 3.735 7 1HE MET 915 1HE MET 915 12.345 -7.077 7.164 8 2HE MET 915 2HE MET 915 13.475 -7.055 5.790 9 3HE MET 915 3HE MET 915 11.719 -7.052 5.498 10 H ALA 916 H ALA 916 10.660 -13.352 2.318 11 HA ALA 916 HA ALA 916 12.721 -15.432 2.443 12 1HB ALA 916 1HB ALA 916 10.103 -15.419 3.309 13 2HB ALA 916 2HB ALA 916 9.959 -16.177 1.705 14 3HB ALA 916 3HB ALA 916 11.045 -16.880 2.927 15 H ASN 917 H ASN 917 11.863 -17.166 0.477 16 HA ASN 917 HA ASN 917 12.951 -16.000 -1.775 17 1HB ASN 917 1HB ASN 917 13.012 -18.418 -1.502 18 2HB ASN 917 2HB ASN 917 11.268 -18.515 -1.353 19 1HD2 ASN 917 1HD2 ASN 917 11.950 -20.182 -3.062 20 2HD2 ASN 917 2HD2 ASN 917 11.831 -19.686 -4.717 21 H LEU 918 H LEU 918 11.746 -14.070 -2.345 22 HA LEU 918 HA LEU 918 9.065 -14.634 -3.400 23 1HB LEU 918 1HB LEU 918 10.015 -12.373 -1.674 24 2HB LEU 918 2HB LEU 918 8.690 -12.132 -2.796 25 HG LEU 918 HG LEU 918 8.353 -14.530 -1.141 26 1HD1 LEU 918 1HD1 LEU 918 8.423 -13.721 0.958 27 2HD1 LEU 918 2HD1 LEU 918 9.584 -12.567 0.259 28 3HD1 LEU 918 3HD1 LEU 918 7.881 -12.097 0.471 29 1HD2 LEU 918 1HD2 LEU 918 6.605 -13.550 -2.576 30 2HD2 LEU 918 2HD2 LEU 918 6.111 -13.649 -0.869 31 3HD2 LEU 918 3HD2 LEU 918 6.610 -12.087 -1.561 32 H ASP 919 H ASP 919 9.114 -14.510 -5.574 33 HA ASP 919 HA ASP 919 11.248 -13.551 -6.978 34 1HB ASP 919 1HB ASP 919 8.409 -13.458 -8.058 35 2HB ASP 919 2HB ASP 919 9.882 -13.824 -8.934 36 H ARG 920 H ARG 920 10.032 -11.829 -9.008 37 HA ARG 920 HA ARG 920 10.130 -9.377 -7.535 38 1HB ARG 920 1HB ARG 920 10.708 -10.258 -10.252 39 2HB ARG 920 2HB ARG 920 9.620 -8.886 -10.316 40 1HG ARG 920 1HG ARG 920 11.379 -7.515 -9.919 41 2HG ARG 920 2HG ARG 920 11.536 -8.220 -8.323 42 1HD ARG 920 1HD ARG 920 12.804 -10.169 -9.669 43 2HD ARG 920 2HD ARG 920 13.041 -8.899 -10.854 44 HE ARG 920 HE ARG 920 14.362 -9.116 -8.284 45 1HH1 ARG 920 2HH2 ARG 920 13.162 -6.742 -10.623 46 2HH1 ARG 920 1HH2 ARG 920 14.269 -5.506 -10.124 47 1HH2 ARG 920 1HH1 ARG 920 15.823 -5.966 -8.359 48 H SER 921 H SER 921 7.736 -11.415 -7.654 49 HA SER 921 HA SER 921 5.721 -9.858 -8.945 50 1HB SER 921 1HB SER 921 5.835 -12.489 -7.481 51 2HB SER 921 2HB SER 921 4.276 -11.705 -7.636 52 HG SER 921 HG SER 921 5.516 -11.600 -10.060 53 H ASN 922 H ASN 922 5.851 -11.250 -5.585 54 HA ASN 922 HA ASN 922 4.072 -9.461 -4.535 55 1HB ASN 922 1HB ASN 922 4.782 -11.557 -3.393 56 2HB ASN 922 2HB ASN 922 6.399 -10.918 -3.173 57 1HD2 ASN 922 1HD2 ASN 922 3.302 -11.218 -1.898 58 2HD2 ASN 922 2HD2 ASN 922 3.417 -10.126 -0.558 59 H ASP 923 H ASP 923 7.374 -9.050 -5.542 60 HA ASP 923 HA ASP 923 8.083 -7.056 -3.682 61 1HB ASP 923 1HB ASP 923 9.292 -8.490 -5.878 62 2HB ASP 923 2HB ASP 923 9.531 -6.778 -6.169 63 H LYS 924 H LYS 924 7.470 -6.992 -7.286 64 HA LYS 924 HA LYS 924 7.432 -4.345 -7.730 65 1HB LYS 924 1HB LYS 924 6.851 -6.537 -9.195 66 2HB LYS 924 2HB LYS 924 5.235 -5.883 -9.018 67 1HG LYS 924 1HG LYS 924 7.348 -3.880 -9.695 68 2HG LYS 924 2HG LYS 924 7.022 -5.068 -10.941 69 1HD LYS 924 1HD LYS 924 4.487 -4.502 -10.502 70 2HD LYS 924 2HD LYS 924 5.101 -3.069 -9.702 71 1HE LYS 924 1HE LYS 924 5.723 -3.880 -12.583 72 2HE LYS 924 2HE LYS 924 4.579 -2.641 -12.108 73 1HZ LYS 924 1HZ LYS 924 7.127 -2.270 -10.921 74 2HZ LYS 924 2HZ LYS 924 7.206 -2.265 -12.552 75 3HZ LYS 924 3HZ LYS 924 6.220 -1.218 -11.779 76 H VAL 925 H VAL 925 5.023 -6.255 -5.950 77 HA VAL 925 HA VAL 925 3.099 -4.132 -5.932 78 HB VAL 925 HB VAL 925 3.264 -6.608 -4.208 79 1HG1 VAL 925 1HG1 VAL 925 0.598 -5.905 -4.893 80 2HG1 VAL 925 2HG1 VAL 925 1.377 -5.850 -3.294 81 3HG1 VAL 925 3HG1 VAL 925 1.411 -4.417 -4.349 82 1HG2 VAL 925 1HG2 VAL 925 2.101 -7.837 -5.858 83 2HG2 VAL 925 2HG2 VAL 925 1.745 -6.379 -6.815 84 3HG2 VAL 925 3HG2 VAL 925 3.409 -7.006 -6.733 85 H TYR 926 H TYR 926 5.116 -5.737 -3.361 86 HA TYR 926 HA TYR 926 4.591 -3.912 -1.370 87 1HB TYR 926 1HB TYR 926 6.939 -5.693 -2.208 88 2HB TYR 926 2HB TYR 926 7.070 -4.735 -0.747 89 HD1 TYR 926 HD1 TYR 926 7.345 -6.796 0.583 90 HD2 TYR 926 HD2 TYR 926 3.790 -6.067 -1.683 91 HE1 TYR 926 HE1 TYR 926 6.135 -8.617 1.881 92 HE2 TYR 926 HE2 TYR 926 2.592 -7.890 -0.377 93 HH TYR 926 HH TYR 926 4.332 -9.807 2.050 94 H GLU 927 H GLU 927 6.721 -3.647 -4.195 95 HA GLU 927 HA GLU 927 8.282 -1.563 -3.142 96 1HB GLU 927 1HB GLU 927 7.748 -2.492 -5.994 97 2HB GLU 927 2HB GLU 927 8.894 -1.225 -5.603 98 1HG GLU 927 1HG GLU 927 9.080 -3.889 -4.170 99 2HG GLU 927 2HG GLU 927 9.710 -3.744 -5.799 100 H ASN 928 H ASN 928 5.758 -1.523 -5.772 101 HA ASN 928 HA ASN 928 5.516 1.069 -6.166 102 1HB ASN 928 1HB ASN 928 3.991 -1.119 -6.810 103 2HB ASN 928 2HB ASN 928 2.890 -0.325 -5.702 104 1HD2 ASN 928 1HD2 ASN 928 4.810 0.058 -8.626 105 2HD2 ASN 928 2HD2 ASN 928 3.886 1.330 -9.353 106 H VAL 929 H VAL 929 4.333 -0.804 -3.337 107 HA VAL 929 HA VAL 929 2.702 1.151 -2.206 108 HB VAL 929 HB VAL 929 4.333 -1.049 -0.921 109 1HG1 VAL 929 1HG1 VAL 929 1.780 -0.054 0.270 110 2HG1 VAL 929 2HG1 VAL 929 3.226 -0.732 1.055 111 3HG1 VAL 929 3HG1 VAL 929 3.236 0.950 0.472 112 1HG2 VAL 929 1HG2 VAL 929 2.768 -2.541 -1.556 113 2HG2 VAL 929 2HG2 VAL 929 1.427 -1.405 -1.277 114 3HG2 VAL 929 3HG2 VAL 929 2.353 -1.333 -2.796 115 H THR 930 H THR 930 6.075 0.222 -1.201 116 HA THR 930 HA THR 930 6.459 2.451 0.421 117 HB THR 930 HB THR 930 8.816 1.725 0.340 118 HG1 THR 930 HG1 THR 930 7.848 0.069 -1.877 119 1HG2 THR 930 1HG2 THR 930 6.695 -0.048 0.923 120 2HG2 THR 930 2HG2 THR 930 7.741 -0.966 -0.187 121 3HG2 THR 930 3HG2 THR 930 8.410 -0.304 1.324 122 H GLY 931 H GLY 931 7.818 1.933 -2.909 123 1HA GLY 931 1HA GLY 931 8.997 4.228 -3.455 124 2HA GLY 931 2HA GLY 931 7.927 3.458 -4.608 125 H LEU 932 H LEU 932 5.384 3.840 -3.710 126 HA LEU 932 HA LEU 932 4.950 6.556 -4.270 127 1HB LEU 932 1HB LEU 932 2.842 5.923 -4.562 128 2HB LEU 932 2HB LEU 932 3.493 4.300 -4.444 129 HG LEU 932 HG LEU 932 2.974 4.443 -1.931 130 1HD1 LEU 932 1HD1 LEU 932 1.757 6.979 -2.913 131 2HD1 LEU 932 2HD1 LEU 932 0.853 6.038 -1.702 132 3HD1 LEU 932 3HD1 LEU 932 2.507 6.591 -1.346 133 1HD2 LEU 932 1HD2 LEU 932 1.697 2.957 -3.213 134 2HD2 LEU 932 2HD2 LEU 932 0.496 3.978 -2.385 135 3HD2 LEU 932 3HD2 LEU 932 0.883 4.271 -4.098 136 H VAL 933 H VAL 933 4.755 4.617 -1.218 137 HA VAL 933 HA VAL 933 3.936 6.732 0.400 138 HB VAL 933 HB VAL 933 5.079 4.028 0.715 139 1HG1 VAL 933 1HG1 VAL 933 6.619 5.044 2.197 140 2HG1 VAL 933 2HG1 VAL 933 5.389 6.156 2.845 141 3HG1 VAL 933 3HG1 VAL 933 5.309 4.420 3.229 142 1HG2 VAL 933 1HG2 VAL 933 3.210 3.893 2.392 143 2HG2 VAL 933 2HG2 VAL 933 2.796 5.575 1.980 144 3HG2 VAL 933 3HG2 VAL 933 2.695 4.303 0.738 145 H LYS 934 H LYS 934 7.124 5.741 -0.854 146 HA LYS 934 HA LYS 934 8.711 7.189 0.904 147 1HB LYS 934 1HB LYS 934 9.169 6.474 -2.007 148 2HB LYS 934 2HB LYS 934 10.403 7.068 -0.915 149 1HG LYS 934 1HG LYS 934 8.913 4.827 0.271 150 2HG LYS 934 2HG LYS 934 9.620 4.378 -1.268 151 1HD LYS 934 1HD LYS 934 11.437 5.945 0.495 152 2HD LYS 934 2HD LYS 934 10.971 4.388 1.150 153 1HE LYS 934 1HE LYS 934 12.819 3.745 -0.116 154 2HE LYS 934 2HE LYS 934 11.553 3.513 -1.305 155 1HZ LYS 934 1HZ LYS 934 12.131 6.062 -1.678 156 2HZ LYS 934 2HZ LYS 934 13.598 5.523 -1.204 157 3HZ LYS 934 3HZ LYS 934 12.859 4.850 -2.496 158 H ALA 935 H ALA 935 6.907 8.157 -2.044 159 HA ALA 935 HA ALA 935 8.025 10.797 -2.008 160 1HB ALA 935 1HB ALA 935 6.312 9.136 -3.719 161 2HB ALA 935 2HB ALA 935 5.747 10.821 -3.611 162 3HB ALA 935 3HB ALA 935 7.405 10.471 -4.154 163 H VAL 936 H VAL 936 4.998 9.153 -0.959 164 HA VAL 936 HA VAL 936 3.351 11.184 -0.421 165 HB VAL 936 HB VAL 936 4.011 8.644 1.004 166 1HG1 VAL 936 1HG1 VAL 936 1.953 10.643 2.003 167 2HG1 VAL 936 2HG1 VAL 936 2.193 8.988 2.611 168 3HG1 VAL 936 3HG1 VAL 936 3.471 10.208 2.825 169 1HG2 VAL 936 1HG2 VAL 936 1.455 9.667 -0.278 170 2HG2 VAL 936 2HG2 VAL 936 2.680 8.665 -1.093 171 3HG2 VAL 936 3HG2 VAL 936 1.776 8.012 0.294 172 H ILE 937 H ILE 937 6.220 10.225 1.555 173 HA ILE 937 HA ILE 937 5.753 12.445 3.342 174 HB ILE 937 HB ILE 937 7.749 10.203 3.201 175 1HG1 ILE 937 1HG1 ILE 937 6.423 10.515 5.719 176 2HG1 ILE 937 2HG1 ILE 937 5.213 10.592 4.454 177 1HG2 ILE 937 1HG2 ILE 937 8.399 11.282 5.545 178 2HG2 ILE 937 2HG2 ILE 937 9.224 11.724 4.030 179 3HG2 ILE 937 3HG2 ILE 937 7.949 12.777 4.690 180 1HD1 ILE 937 1HD1 ILE 937 5.876 8.244 5.373 181 2HD1 ILE 937 2HD1 ILE 937 5.765 8.443 3.607 182 3HD1 ILE 937 3HD1 ILE 937 7.357 8.442 4.404 183 H GLU 938 H GLU 938 8.572 11.359 1.313 184 HA GLU 938 HA GLU 938 10.115 13.464 1.416 185 1HB GLU 938 1HB GLU 938 10.056 11.318 -0.191 186 2HB GLU 938 2HB GLU 938 9.503 12.492 -1.369 187 1HG GLU 938 1HG GLU 938 11.642 13.166 -1.677 188 2HG GLU 938 2HG GLU 938 11.690 13.728 -0.018 189 H MET 939 H MET 939 7.044 13.307 -0.456 190 HA MET 939 HA MET 939 7.214 15.552 -1.917 191 1HB MET 939 1HB MET 939 5.263 14.103 -2.048 192 2HB MET 939 2HB MET 939 4.896 14.320 -0.348 193 1HG MET 939 1HG MET 939 4.534 16.824 -0.876 194 2HG MET 939 2HG MET 939 4.616 16.390 -2.572 195 1HE MET 939 1HE MET 939 3.198 14.549 -3.649 196 2HE MET 939 2HE MET 939 3.223 13.334 -2.348 197 3HE MET 939 3HE MET 939 1.669 13.907 -3.002 198 H SER 940 H SER 940 5.532 15.497 1.314 199 HA SER 940 HA SER 940 5.216 18.124 1.632 200 1HB SER 940 1HB SER 940 4.318 16.618 3.264 201 2HB SER 940 2HB SER 940 5.896 15.968 3.659 202 HG SER 940 HG SER 940 5.036 18.688 4.178 203 H SER 941 H SER 941 8.238 16.267 1.873 204 HA SER 941 HA SER 941 9.708 18.170 3.266 205 1HB SER 941 1HB SER 941 10.190 15.637 2.551 206 2HB SER 941 2HB SER 941 11.003 16.397 1.197 207 HG SER 941 HG SER 941 12.485 16.056 2.939 208 H LYS 942 H LYS 942 9.113 17.589 -0.247 209 HA LYS 942 HA LYS 942 10.469 20.139 -0.784 210 1HB LYS 942 1HB LYS 942 11.124 19.328 -2.884 211 2HB LYS 942 2HB LYS 942 11.430 18.000 -1.783 212 1HG LYS 942 1HG LYS 942 9.968 16.650 -2.877 213 2HG LYS 942 2HG LYS 942 8.690 17.844 -2.770 214 1HD LYS 942 1HD LYS 942 10.307 18.986 -4.699 215 2HD LYS 942 2HD LYS 942 10.575 17.282 -5.010 216 1HE LYS 942 1HE LYS 942 8.173 16.881 -5.281 217 2HE LYS 942 2HE LYS 942 7.789 18.503 -4.740 218 1HZ LYS 942 1HZ LYS 942 8.173 19.278 -6.756 219 2HZ LYS 942 2HZ LYS 942 9.615 18.524 -6.898 220 3HZ LYS 942 3HZ LYS 942 8.240 17.738 -7.295 221 H ILE 943 H ILE 943 7.696 19.708 0.247 222 HA ILE 943 HA ILE 943 6.110 20.397 -2.097 223 HB ILE 943 HB ILE 943 5.549 18.704 -0.146 224 1HG1 ILE 943 1HG1 ILE 943 4.166 19.886 -2.221 225 2HG1 ILE 943 2HG1 ILE 943 3.618 18.535 -1.249 226 1HG2 ILE 943 1HG2 ILE 943 4.524 21.347 0.925 227 2HG2 ILE 943 2HG2 ILE 943 4.034 19.739 1.511 228 3HG2 ILE 943 3HG2 ILE 943 5.723 20.273 1.685 229 1HD1 ILE 943 1HD1 ILE 943 2.471 20.055 0.312 230 2HD1 ILE 943 2HD1 ILE 943 3.108 21.467 -0.564 231 3HD1 ILE 943 3HD1 ILE 943 1.935 20.386 -1.352 232 H GLN 944 H GLN 944 6.980 21.666 1.185 233 HA GLN 944 HA GLN 944 5.632 23.987 1.116 234 1HB GLN 944 1HB GLN 944 7.968 22.926 2.499 235 2HB GLN 944 2HB GLN 944 8.178 24.641 2.203 236 1HG GLN 944 1HG GLN 944 5.524 24.526 3.033 237 2HG GLN 944 2HG GLN 944 6.255 23.255 3.993 238 1HE2 GLN 944 1HE2 GLN 944 5.890 26.607 3.486 239 2HE2 GLN 944 2HE2 GLN 944 6.909 27.199 4.755 240 HA PRO 945 HA PRO 945 9.137 25.935 -1.423 241 1HB PRO 945 1HB PRO 945 11.062 24.346 -2.537 242 2HB PRO 945 2HB PRO 945 11.273 25.180 -1.010 243 1HG PRO 945 1HG PRO 945 10.761 22.310 -1.498 244 2HG PRO 945 2HG PRO 945 11.387 23.084 -0.056 245 1HD PRO 945 1HD PRO 945 8.722 22.100 -0.457 246 2HD PRO 945 2HD PRO 945 9.317 22.976 0.940 247 H ALA 946 H ALA 946 8.564 22.699 -2.711 248 HA ALA 946 HA ALA 946 8.528 23.116 -5.326 249 1HB ALA 946 1HB ALA 946 6.801 21.533 -3.464 250 2HB ALA 946 2HB ALA 946 6.284 21.646 -5.163 251 3HB ALA 946 3HB ALA 946 7.886 20.982 -4.763 252 HA PRO 947 HA PRO 947 5.737 26.401 -5.959 253 1HB PRO 947 1HB PRO 947 5.992 26.591 -8.674 254 2HB PRO 947 2HB PRO 947 7.100 27.354 -7.552 255 1HG PRO 947 1HG PRO 947 7.505 24.933 -9.199 256 2HG PRO 947 2HG PRO 947 8.705 25.941 -8.416 257 1HD PRO 947 1HD PRO 947 7.779 23.374 -7.532 258 2HD PRO 947 2HD PRO 947 8.893 24.433 -6.690 259 HA PRO 948 HA PRO 948 2.005 24.873 -7.302 260 1HB PRO 948 1HB PRO 948 0.814 26.858 -8.754 261 2HB PRO 948 2HB PRO 948 0.862 26.850 -7.003 262 1HG PRO 948 1HG PRO 948 2.440 28.487 -8.892 263 2HG PRO 948 2HG PRO 948 2.159 28.749 -7.183 264 1HD PRO 948 1HD PRO 948 4.550 27.727 -8.393 265 2HD PRO 948 2HD PRO 948 4.227 27.880 -6.677 266 H GLU 949 H GLU 949 4.250 25.738 -9.679 267 HA GLU 949 HA GLU 949 2.678 24.511 -11.750 268 1HB GLU 949 1HB GLU 949 4.822 26.413 -11.633 269 2HB GLU 949 2HB GLU 949 5.405 25.042 -12.556 270 1HG GLU 949 1HG GLU 949 2.846 25.342 -13.583 271 2HG GLU 949 2HG GLU 949 3.272 27.005 -13.228 272 H GLU 950 H GLU 950 4.959 23.603 -9.315 273 HA GLU 950 HA GLU 950 5.605 21.195 -10.825 274 1HB GLU 950 1HB GLU 950 7.286 22.969 -9.435 275 2HB GLU 950 2HB GLU 950 7.138 21.601 -8.351 276 1HG GLU 950 1HG GLU 950 8.821 20.719 -9.638 277 2HG GLU 950 2HG GLU 950 7.507 20.262 -10.703 278 H TYR 951 H TYR 951 3.461 22.386 -8.563 279 HA TYR 951 HA TYR 951 3.520 20.035 -6.844 280 1HB TYR 951 1HB TYR 951 3.211 22.456 -6.044 281 2HB TYR 951 2HB TYR 951 1.754 22.558 -7.011 282 HD1 TYR 951 HD1 TYR 951 0.072 22.889 -5.400 283 HD2 TYR 951 HD2 TYR 951 2.879 19.704 -4.877 284 HE1 TYR 951 HE1 TYR 951 -1.286 22.005 -3.440 285 HE2 TYR 951 HE2 TYR 951 1.513 18.830 -2.919 286 HH TYR 951 HH TYR 951 -0.813 20.645 -1.394 287 H VAL 952 H VAL 952 1.415 21.711 -9.255 288 HA VAL 952 HA VAL 952 -0.823 20.143 -9.014 289 HB VAL 952 HB VAL 952 0.331 22.011 -10.879 290 1HG1 VAL 952 1HG1 VAL 952 -0.788 21.270 -12.932 291 2HG1 VAL 952 2HG1 VAL 952 0.442 20.092 -12.413 292 3HG1 VAL 952 3HG1 VAL 952 -1.284 19.761 -12.128 293 1HG2 VAL 952 1HG2 VAL 952 -2.132 22.457 -11.307 294 2HG2 VAL 952 2HG2 VAL 952 -2.481 21.146 -10.156 295 3HG2 VAL 952 3HG2 VAL 952 -1.599 22.594 -9.614 296 HA PRO 953 HA PRO 953 1.313 17.081 -11.931 297 1HB PRO 953 1HB PRO 953 4.014 17.247 -12.317 298 2HB PRO 953 2HB PRO 953 2.843 17.936 -13.425 299 1HG PRO 953 1HG PRO 953 4.564 19.312 -11.455 300 2HG PRO 953 2HG PRO 953 3.722 19.985 -12.836 301 1HD PRO 953 1HD PRO 953 2.947 20.199 -10.082 302 2HD PRO 953 2HD PRO 953 2.046 20.771 -11.472 303 H MET 954 H MET 954 3.611 18.061 -9.440 304 HA MET 954 HA MET 954 4.673 15.766 -8.737 305 1HB MET 954 1HB MET 954 5.204 17.667 -7.397 306 2HB MET 954 2HB MET 954 3.520 18.049 -7.097 307 1HG MET 954 1HG MET 954 3.347 16.561 -5.328 308 2HG MET 954 2HG MET 954 4.432 15.394 -6.057 309 1HE MET 954 1HE MET 954 5.896 19.354 -4.219 310 2HE MET 954 2HE MET 954 4.696 19.163 -5.520 311 3HE MET 954 3HE MET 954 4.267 18.744 -3.844 312 H VAL 955 H VAL 955 1.297 16.762 -7.937 313 HA VAL 955 HA VAL 955 0.775 14.438 -6.393 314 HB VAL 955 HB VAL 955 -0.849 16.665 -7.587 315 1HG1 VAL 955 1HG1 VAL 955 -2.650 15.335 -7.690 316 2HG1 VAL 955 2HG1 VAL 955 -1.821 14.007 -6.842 317 3HG1 VAL 955 3HG1 VAL 955 -2.599 15.310 -5.911 318 1HG2 VAL 955 1HG2 VAL 955 -1.056 16.023 -4.721 319 2HG2 VAL 955 2HG2 VAL 955 0.588 16.450 -5.253 320 3HG2 VAL 955 3HG2 VAL 955 -0.760 17.579 -5.533 321 H LYS 956 H LYS 956 -0.245 15.512 -9.716 322 HA LYS 956 HA LYS 956 -1.649 13.381 -10.519 323 1HB LYS 956 1HB LYS 956 -0.017 15.431 -11.804 324 2HB LYS 956 2HB LYS 956 -0.048 13.948 -12.735 325 1HG LYS 956 1HG LYS 956 -2.033 14.769 -13.535 326 2HG LYS 956 2HG LYS 956 -2.695 14.112 -12.051 327 1HD LYS 956 1HD LYS 956 -3.437 16.237 -11.665 328 2HD LYS 956 2HD LYS 956 -1.789 16.565 -11.166 329 1HE LYS 956 1HE LYS 956 -1.257 17.690 -13.136 330 2HE LYS 956 2HE LYS 956 -2.350 16.729 -14.113 331 1HZ LYS 956 1HZ LYS 956 -3.406 18.561 -12.099 332 2HZ LYS 956 2HZ LYS 956 -2.978 19.112 -13.576 333 3HZ LYS 956 3HZ LYS 956 -4.143 17.976 -13.434 334 H GLU 957 H GLU 957 1.942 13.580 -10.273 335 HA GLU 957 HA GLU 957 2.452 11.137 -11.444 336 1HB GLU 957 1HB GLU 957 3.899 13.117 -9.819 337 2HB GLU 957 2HB GLU 957 4.450 11.484 -9.499 338 1HG GLU 957 1HG GLU 957 5.737 11.743 -11.365 339 2HG GLU 957 2HG GLU 957 4.259 11.447 -12.260 340 H VAL 958 H VAL 958 2.235 11.978 -7.907 341 HA VAL 958 HA VAL 958 2.557 9.479 -6.878 342 HB VAL 958 HB VAL 958 0.838 11.800 -6.004 343 1HG1 VAL 958 1HG1 VAL 958 1.548 9.309 -4.417 344 2HG1 VAL 958 2HG1 VAL 958 0.748 10.762 -3.773 345 3HG1 VAL 958 3HG1 VAL 958 -0.073 9.762 -4.996 346 1HG2 VAL 958 1HG2 VAL 958 2.710 12.667 -5.136 347 2HG2 VAL 958 2HG2 VAL 958 3.165 11.119 -4.384 348 3HG2 VAL 958 3HG2 VAL 958 3.604 11.448 -6.077 349 H GLY 959 H GLY 959 -0.604 11.037 -7.782 350 1HA GLY 959 1HA GLY 959 -2.340 9.034 -7.239 351 2HA GLY 959 2HA GLY 959 -2.483 10.103 -8.620 352 H LEU 960 H LEU 960 -0.077 9.251 -10.042 353 HA LEU 960 HA LEU 960 -1.164 7.062 -11.426 354 1HB LEU 960 1HB LEU 960 0.839 8.994 -11.798 355 2HB LEU 960 2HB LEU 960 1.662 7.450 -11.885 356 HG LEU 960 HG LEU 960 -0.858 7.848 -13.466 357 1HD1 LEU 960 1HD1 LEU 960 -0.001 9.247 -14.992 358 2HD1 LEU 960 2HD1 LEU 960 1.128 9.709 -13.695 359 3HD1 LEU 960 3HD1 LEU 960 1.616 8.508 -14.915 360 1HD2 LEU 960 1HD2 LEU 960 0.221 6.280 -15.000 361 2HD2 LEU 960 2HD2 LEU 960 1.674 6.262 -13.973 362 3HD2 LEU 960 3HD2 LEU 960 0.136 5.618 -13.350 363 H ALA 961 H ALA 961 1.303 7.396 -8.846 364 HA ALA 961 HA ALA 961 2.252 4.757 -9.010 365 1HB ALA 961 1HB ALA 961 2.196 6.830 -6.785 366 2HB ALA 961 2HB ALA 961 3.057 5.277 -6.664 367 3HB ALA 961 3HB ALA 961 3.536 6.465 -7.899 368 H LEU 962 H LEU 962 -0.408 6.338 -7.152 369 HA LEU 962 HA LEU 962 -1.053 4.119 -5.594 370 1HB LEU 962 1HB LEU 962 -2.623 6.511 -6.536 371 2HB LEU 962 2HB LEU 962 -3.315 5.292 -5.485 372 HG LEU 962 HG LEU 962 -2.570 7.186 -4.184 373 1HD1 LEU 962 1HD1 LEU 962 -0.447 5.596 -3.153 374 2HD1 LEU 962 2HD1 LEU 962 -2.119 5.748 -2.560 375 3HD1 LEU 962 3HD1 LEU 962 -1.711 4.499 -3.760 376 1HD2 LEU 962 1HD2 LEU 962 -0.215 7.857 -4.057 377 2HD2 LEU 962 2HD2 LEU 962 0.190 6.684 -5.334 378 3HD2 LEU 962 3HD2 LEU 962 -0.873 8.065 -5.698 379 H ARG 963 H ARG 963 -2.214 5.201 -8.842 380 HA ARG 963 HA ARG 963 -4.118 3.245 -9.124 381 1HB ARG 963 1HB ARG 963 -3.524 5.351 -10.601 382 2HB ARG 963 2HB ARG 963 -2.457 4.260 -11.462 383 1HG ARG 963 1HG ARG 963 -4.256 3.625 -12.694 384 2HG ARG 963 2HG ARG 963 -4.849 2.799 -11.266 385 1HD ARG 963 1HD ARG 963 -6.631 4.257 -11.969 386 2HD ARG 963 2HD ARG 963 -5.933 5.009 -10.548 387 HE ARG 963 HE ARG 963 -5.565 5.917 -13.364 388 1HH1 ARG 963 2HH2 ARG 963 -5.006 6.426 -9.928 389 2HH1 ARG 963 1HH2 ARG 963 -4.505 8.073 -10.123 390 1HH2 ARG 963 2HH1 ARG 963 -4.905 8.089 -13.622 391 2HH2 ARG 963 1HH1 ARG 963 -4.448 9.025 -12.239 392 H THR 964 H THR 964 -0.668 3.336 -10.280 393 HA THR 964 HA THR 964 -0.628 0.815 -11.445 394 HB THR 964 HB THR 964 1.487 2.599 -10.147 395 HG1 THR 964 HG1 THR 964 1.785 3.029 -12.435 396 1HG2 THR 964 1HG2 THR 964 3.196 1.255 -11.202 397 2HG2 THR 964 2HG2 THR 964 2.187 0.104 -10.293 398 3HG2 THR 964 3HG2 THR 964 1.986 0.266 -12.054 399 H LEU 965 H LEU 965 -0.355 1.798 -8.028 400 HA LEU 965 HA LEU 965 0.658 -0.616 -7.068 401 1HB LEU 965 1HB LEU 965 0.785 1.226 -5.659 402 2HB LEU 965 2HB LEU 965 -0.897 1.659 -5.890 403 HG LEU 965 HG LEU 965 -0.262 -0.945 -4.550 404 1HD1 LEU 965 1HD1 LEU 965 1.228 0.705 -3.474 405 2HD1 LEU 965 2HD1 LEU 965 -0.187 1.724 -3.116 406 3HD1 LEU 965 3HD1 LEU 965 -0.044 0.109 -2.380 407 1HD2 LEU 965 1HD2 LEU 965 -2.601 0.299 -5.196 408 2HD2 LEU 965 2HD2 LEU 965 -2.408 -0.904 -3.898 409 3HD2 LEU 965 3HD2 LEU 965 -2.369 0.833 -3.514 410 H LEU 966 H LEU 966 -2.689 0.501 -7.775 411 HA LEU 966 HA LEU 966 -4.034 -1.622 -6.618 412 1HB LEU 966 1HB LEU 966 -4.768 0.643 -7.789 413 2HB LEU 966 2HB LEU 966 -5.018 -0.418 -9.162 414 HG LEU 966 HG LEU 966 -6.307 -0.719 -6.435 415 1HD1 LEU 966 1HD1 LEU 966 -8.042 0.493 -7.143 416 2HD1 LEU 966 2HD1 LEU 966 -6.947 1.088 -8.414 417 3HD1 LEU 966 3HD1 LEU 966 -8.043 -0.274 -8.749 418 1HD2 LEU 966 1HD2 LEU 966 -6.788 -2.315 -8.965 419 2HD2 LEU 966 2HD2 LEU 966 -5.900 -2.886 -7.532 420 3HD2 LEU 966 3HD2 LEU 966 -7.633 -2.501 -7.410 421 H ALA 967 H ALA 967 -2.533 -1.276 -9.879 422 HA ALA 967 HA ALA 967 -3.471 -3.675 -10.927 423 1HB ALA 967 1HB ALA 967 -2.272 -2.979 -12.709 424 2HB ALA 967 2HB ALA 967 -1.879 -1.539 -11.740 425 3HB ALA 967 3HB ALA 967 -0.761 -2.924 -11.770 426 H THR 968 H THR 968 -0.139 -3.002 -9.623 427 HA THR 968 HA THR 968 0.829 -5.515 -9.562 428 HB THR 968 HB THR 968 2.263 -4.676 -7.713 429 HG1 THR 968 HG1 THR 968 0.131 -2.655 -7.699 430 1HG2 THR 968 1HG2 THR 968 1.760 -2.040 -8.964 431 2HG2 THR 968 2HG2 THR 968 3.240 -3.029 -8.982 432 3HG2 THR 968 3HG2 THR 968 1.945 -3.343 -10.162 433 H VAL 969 H VAL 969 -1.435 -4.086 -7.152 434 HA VAL 969 HA VAL 969 -1.396 -6.156 -5.339 435 HB VAL 969 HB VAL 969 -3.709 -4.404 -6.193 436 1HG1 VAL 969 1HG1 VAL 969 -4.667 -4.828 -4.019 437 2HG1 VAL 969 2HG1 VAL 969 -4.345 -6.389 -4.811 438 3HG1 VAL 969 3HG1 VAL 969 -3.255 -5.797 -3.535 439 1HG2 VAL 969 1HG2 VAL 969 -1.239 -3.644 -5.128 440 2HG2 VAL 969 2HG2 VAL 969 -2.733 -2.676 -5.164 441 3HG2 VAL 969 3HG2 VAL 969 -2.343 -3.659 -3.732 442 H ASP 970 H ASP 970 -3.417 -5.737 -8.316 443 HA ASP 970 HA ASP 970 -5.016 -7.872 -8.074 444 1HB ASP 970 1HB ASP 970 -4.949 -6.192 -9.968 445 2HB ASP 970 2HB ASP 970 -3.560 -7.034 -10.626 446 H GLU 971 H GLU 971 -1.554 -7.727 -9.037 447 HA GLU 971 HA GLU 971 -1.481 -10.474 -9.768 448 1HB GLU 971 1HB GLU 971 0.526 -8.231 -9.552 449 2HB GLU 971 2HB GLU 971 1.119 -9.878 -9.637 450 1HG GLU 971 1HG GLU 971 -0.760 -9.911 -11.657 451 2HG GLU 971 2HG GLU 971 -0.236 -8.240 -11.731 452 H SER 972 H SER 972 -1.130 -8.573 -6.839 453 HA SER 972 HA SER 972 0.347 -10.634 -5.506 454 1HB SER 972 1HB SER 972 0.995 -8.801 -4.350 455 2HB SER 972 2HB SER 972 -0.282 -7.831 -5.056 456 HG SER 972 HG SER 972 -1.101 -7.840 -3.076 457 H LEU 973 H LEU 973 -2.945 -9.852 -6.237 458 HA LEU 973 HA LEU 973 -4.292 -10.657 -3.974 459 1HB LEU 973 1HB LEU 973 -4.889 -9.927 -6.606 460 2HB LEU 973 2HB LEU 973 -5.591 -11.521 -6.415 461 HG LEU 973 HG LEU 973 -6.333 -8.942 -5.143 462 1HD1 LEU 973 1HD1 LEU 973 -8.456 -9.492 -5.778 463 2HD1 LEU 973 2HD1 LEU 973 -7.533 -10.418 -6.986 464 3HD1 LEU 973 3HD1 LEU 973 -8.197 -11.239 -5.553 465 1HD2 LEU 973 1HD2 LEU 973 -7.584 -10.530 -3.390 466 2HD2 LEU 973 2HD2 LEU 973 -6.098 -11.483 -3.616 467 3HD2 LEU 973 3HD2 LEU 973 -5.996 -9.792 -3.068 468 HA PRO 974 HA PRO 974 -3.940 -15.083 -5.580 469 1HB PRO 974 1HB PRO 974 -2.332 -15.661 -7.713 470 2HB PRO 974 2HB PRO 974 -4.056 -15.386 -7.859 471 1HG PRO 974 1HG PRO 974 -1.826 -13.591 -8.593 472 2HG PRO 974 2HG PRO 974 -3.500 -13.529 -9.108 473 1HD PRO 974 1HD PRO 974 -2.242 -11.849 -7.152 474 2HD PRO 974 2HD PRO 974 -3.940 -11.865 -7.583 475 H VAL 975 H VAL 975 -1.021 -13.203 -5.827 476 HA VAL 975 HA VAL 975 0.829 -15.097 -5.174 477 HB VAL 975 HB VAL 975 0.576 -12.181 -4.453 478 1HG1 VAL 975 1HG1 VAL 975 2.917 -12.173 -3.802 479 2HG1 VAL 975 2HG1 VAL 975 2.017 -13.322 -2.784 480 3HG1 VAL 975 3HG1 VAL 975 3.041 -13.922 -4.111 481 1HG2 VAL 975 1HG2 VAL 975 2.593 -13.327 -6.355 482 2HG2 VAL 975 2HG2 VAL 975 0.899 -13.174 -6.881 483 3HG2 VAL 975 3HG2 VAL 975 1.800 -11.733 -6.353 484 H LEU 976 H LEU 976 -1.755 -13.730 -3.199 485 HA LEU 976 HA LEU 976 -0.616 -15.087 -0.860 486 1HB LEU 976 1HB LEU 976 -2.405 -12.706 -1.195 487 2HB LEU 976 2HB LEU 976 -2.462 -13.642 0.285 488 HG LEU 976 HG LEU 976 -0.901 -11.518 0.014 489 1HD1 LEU 976 1HD1 LEU 976 -0.591 -14.029 1.582 490 2HD1 LEU 976 2HD1 LEU 976 0.757 -12.866 1.616 491 3HD1 LEU 976 3HD1 LEU 976 -0.872 -12.357 2.123 492 1HD2 LEU 976 1HD2 LEU 976 0.312 -12.411 -1.937 493 2HD2 LEU 976 2HD2 LEU 976 1.390 -12.071 -0.561 494 3HD2 LEU 976 3HD2 LEU 976 0.921 -13.748 -0.932 495 HA PRO 977 HA PRO 977 -3.845 -17.944 -1.020 496 1HB PRO 977 1HB PRO 977 -4.125 -18.658 1.603 497 2HB PRO 977 2HB PRO 977 -2.854 -19.282 0.570 498 1HG PRO 977 1HG PRO 977 -2.674 -17.251 2.711 499 2HG PRO 977 2HG PRO 977 -1.388 -18.185 1.973 500 1HD PRO 977 1HD PRO 977 -2.020 -15.434 1.465 501 2HD PRO 977 2HD PRO 977 -0.810 -16.400 0.644 502 H ALA 978 H ALA 978 -6.021 -18.670 0.135 503 HA ALA 978 HA ALA 978 -7.643 -16.325 -0.124 504 1HB ALA 978 1HB ALA 978 -8.433 -18.409 -1.047 505 2HB ALA 978 2HB ALA 978 -8.213 -19.245 0.509 506 3HB ALA 978 3HB ALA 978 -9.479 -18.005 0.336 507 H SER 979 H SER 979 -7.703 -14.855 1.510 508 HA SER 979 HA SER 979 -8.830 -15.444 3.911 509 1HB SER 979 1HB SER 979 -6.201 -16.410 3.932 510 2HB SER 979 2HB SER 979 -6.058 -14.859 4.736 511 HG SER 979 HG SER 979 -7.300 -15.538 6.402 512 H THR 980 H THR 980 -6.472 -13.523 2.037 513 HA THR 980 HA THR 980 -7.444 -11.104 3.411 514 HB THR 980 HB THR 980 -5.017 -11.533 3.702 515 HG1 THR 980 HG1 THR 980 -5.671 -9.580 1.608 516 1HG2 THR 980 1HG2 THR 980 -4.622 -12.871 1.602 517 2HG2 THR 980 2HG2 THR 980 -4.926 -11.404 0.642 518 3HG2 THR 980 3HG2 THR 980 -3.516 -11.482 1.726 519 H HIS 981 H HIS 981 -9.280 -12.008 1.711 520 HA HIS 981 HA HIS 981 -8.742 -10.994 -0.923 521 1HB HIS 981 1HB HIS 981 -11.059 -12.374 0.412 522 2HB HIS 981 2HB HIS 981 -11.275 -11.589 -1.140 523 HD1 HIS 981 HD1 HIS 981 -11.787 -14.165 -1.902 524 HD2 HIS 981 HD2 HIS 981 -7.811 -13.229 -0.944 525 HE1 HIS 981 HE1 HIS 981 -10.353 -16.024 -2.901 526 H ARG 982 H ARG 982 -11.838 -10.412 0.749 527 HA ARG 982 HA ARG 982 -12.249 -7.971 -0.211 528 1HB ARG 982 1HB ARG 982 -13.810 -9.374 1.243 529 2HB ARG 982 2HB ARG 982 -12.947 -8.793 2.652 530 1HG ARG 982 1HG ARG 982 -13.468 -6.398 1.793 531 2HG ARG 982 2HG ARG 982 -14.584 -7.155 0.674 532 1HD ARG 982 1HD ARG 982 -14.689 -7.612 3.693 533 2HD ARG 982 2HD ARG 982 -15.616 -6.365 2.882 534 HE ARG 982 HE ARG 982 -16.069 -8.865 1.548 535 1HH1 ARG 982 2HH2 ARG 982 -16.823 -7.224 4.568 536 2HH1 ARG 982 1HH2 ARG 982 -18.297 -8.098 4.824 537 1HH2 ARG 982 2HH1 ARG 982 -18.013 -10.018 1.884 538 2HH2 ARG 982 1HH1 ARG 982 -18.978 -9.698 3.287 539 H GLU 983 H GLU 983 -10.683 -8.710 2.994 540 HA GLU 983 HA GLU 983 -10.234 -6.279 3.937 541 1HB GLU 983 1HB GLU 983 -8.286 -8.622 3.870 542 2HB GLU 983 2HB GLU 983 -8.054 -7.209 4.881 543 1HG GLU 983 1HG GLU 983 -10.001 -7.668 6.187 544 2HG GLU 983 2HG GLU 983 -10.669 -8.750 4.982 545 H ILE 984 H ILE 984 -8.225 -7.918 1.406 546 HA ILE 984 HA ILE 984 -6.388 -5.815 1.146 547 HB ILE 984 HB ILE 984 -6.974 -8.362 -0.089 548 1HG1 ILE 984 1HG1 ILE 984 -4.422 -6.729 0.013 549 2HG1 ILE 984 2HG1 ILE 984 -4.998 -7.748 1.317 550 1HG2 ILE 984 1HG2 ILE 984 -7.550 -6.911 -2.025 551 2HG2 ILE 984 2HG2 ILE 984 -5.907 -6.230 -1.956 552 3HG2 ILE 984 3HG2 ILE 984 -6.139 -7.959 -2.307 553 1HD1 ILE 984 1HD1 ILE 984 -4.090 -9.566 0.326 554 2HD1 ILE 984 2HD1 ILE 984 -5.088 -9.291 -1.122 555 3HD1 ILE 984 3HD1 ILE 984 -3.485 -8.528 -0.987 556 H GLU 985 H GLU 985 -9.481 -6.611 -0.533 557 HA GLU 985 HA GLU 985 -9.284 -4.570 -2.396 558 1HB GLU 985 1HB GLU 985 -11.120 -6.620 -1.724 559 2HB GLU 985 2HB GLU 985 -12.046 -5.135 -1.625 560 1HG GLU 985 1HG GLU 985 -10.280 -5.188 -3.989 561 2HG GLU 985 2HG GLU 985 -11.404 -6.532 -3.975 562 H MET 986 H MET 986 -10.547 -4.684 0.960 563 HA MET 986 HA MET 986 -11.730 -2.136 0.826 564 1HB MET 986 1HB MET 986 -11.053 -4.196 2.918 565 2HB MET 986 2HB MET 986 -11.280 -2.562 3.509 566 1HG MET 986 1HG MET 986 -13.485 -2.606 2.040 567 2HG MET 986 2HG MET 986 -13.280 -4.346 2.084 568 1HE MET 986 1HE MET 986 -13.934 -1.163 3.663 569 2HE MET 986 2HE MET 986 -15.521 -1.903 3.980 570 3HE MET 986 3HE MET 986 -14.455 -1.465 5.337 571 H ALA 987 H ALA 987 -8.454 -3.305 1.283 572 HA ALA 987 HA ALA 987 -7.546 -0.949 2.649 573 1HB ALA 987 1HB ALA 987 -6.048 -2.536 3.222 574 2HB ALA 987 2HB ALA 987 -6.529 -3.587 1.868 575 3HB ALA 987 3HB ALA 987 -5.335 -2.293 1.609 576 H GLN 988 H GLN 988 -8.207 -1.944 -0.632 577 HA GLN 988 HA GLN 988 -6.317 -0.200 -1.816 578 1HB GLN 988 1HB GLN 988 -8.713 -1.740 -2.881 579 2HB GLN 988 2HB GLN 988 -7.755 -0.695 -3.910 580 1HG GLN 988 1HG GLN 988 -6.136 -2.560 -2.254 581 2HG GLN 988 2HG GLN 988 -7.199 -3.365 -3.392 582 1HE2 GLN 988 1HE2 GLN 988 -5.010 -0.560 -3.213 583 2HE2 GLN 988 2HE2 GLN 988 -4.262 -0.764 -4.761 584 H LYS 989 H LYS 989 -9.877 -0.126 -1.171 585 HA LYS 989 HA LYS 989 -10.322 2.348 -2.405 586 1HB LYS 989 1HB LYS 989 -11.914 0.403 -1.471 587 2HB LYS 989 2HB LYS 989 -12.009 1.487 -0.098 588 1HG LYS 989 1HG LYS 989 -12.248 2.898 -2.690 589 2HG LYS 989 2HG LYS 989 -13.503 1.698 -2.453 590 1HD LYS 989 1HD LYS 989 -13.278 3.019 0.050 591 2HD LYS 989 2HD LYS 989 -13.161 4.296 -1.145 592 1HE LYS 989 1HE LYS 989 -15.241 2.694 -2.136 593 2HE LYS 989 2HE LYS 989 -15.488 2.632 -0.402 594 1HZ LYS 989 1HZ LYS 989 -15.909 4.783 -2.163 595 2HZ LYS 989 2HZ LYS 989 -16.381 4.620 -0.608 596 3HZ LYS 989 3HZ LYS 989 -14.909 5.237 -0.954 597 H LEU 990 H LEU 990 -9.274 1.390 0.888 598 HA LEU 990 HA LEU 990 -9.607 3.862 2.108 599 1HB LEU 990 1HB LEU 990 -8.534 1.318 2.722 600 2HB LEU 990 2HB LEU 990 -7.291 2.492 3.105 601 HG LEU 990 HG LEU 990 -10.126 2.466 4.174 602 1HD1 LEU 990 1HD1 LEU 990 -8.276 0.791 4.987 603 2HD1 LEU 990 2HD1 LEU 990 -7.668 2.213 5.869 604 3HD1 LEU 990 3HD1 LEU 990 -9.324 1.628 6.158 605 1HD2 LEU 990 1HD2 LEU 990 -9.039 4.275 5.732 606 2HD2 LEU 990 2HD2 LEU 990 -7.946 4.514 4.348 607 3HD2 LEU 990 3HD2 LEU 990 -9.701 4.725 4.142 608 H LEU 991 H LEU 991 -6.929 2.521 0.114 609 HA LEU 991 HA LEU 991 -5.157 4.642 0.561 610 1HB LEU 991 1HB LEU 991 -4.259 2.656 -0.251 611 2HB LEU 991 2HB LEU 991 -5.450 2.511 -1.528 612 HG LEU 991 HG LEU 991 -3.681 4.890 -1.683 613 1HD1 LEU 991 1HD1 LEU 991 -2.234 2.771 -2.913 614 2HD1 LEU 991 2HD1 LEU 991 -1.723 3.857 -1.598 615 3HD1 LEU 991 3HD1 LEU 991 -2.536 2.319 -1.218 616 1HD2 LEU 991 1HD2 LEU 991 -5.341 3.280 -3.415 617 2HD2 LEU 991 2HD2 LEU 991 -4.647 4.897 -3.681 618 3HD2 LEU 991 3HD2 LEU 991 -3.701 3.444 -4.087 619 H ASN 992 H ASN 992 -7.486 3.997 -2.151 620 HA ASN 992 HA ASN 992 -6.951 6.344 -3.483 621 1HB ASN 992 1HB ASN 992 -8.365 4.246 -4.189 622 2HB ASN 992 2HB ASN 992 -9.708 5.038 -3.388 623 1HD2 ASN 992 1HD2 ASN 992 -8.139 4.619 -6.251 624 2HD2 ASN 992 2HD2 ASN 992 -8.681 6.004 -7.138 625 H SER 993 H SER 993 -9.131 5.508 -0.757 626 HA SER 993 HA SER 993 -10.800 7.650 -0.780 627 1HB SER 993 1HB SER 993 -10.085 5.554 1.022 628 2HB SER 993 2HB SER 993 -10.017 7.038 1.952 629 HG SER 993 HG SER 993 -12.149 7.067 1.983 630 H ASP 994 H ASP 994 -7.841 7.349 1.332 631 HA ASP 994 HA ASP 994 -7.794 9.913 2.183 632 1HB ASP 994 1HB ASP 994 -5.927 7.667 2.000 633 2HB ASP 994 2HB ASP 994 -5.072 9.181 1.777 634 H LEU 995 H LEU 995 -6.653 8.461 -0.891 635 HA LEU 995 HA LEU 995 -5.039 10.501 -1.815 636 1HB LEU 995 1HB LEU 995 -6.469 8.194 -2.909 637 2HB LEU 995 2HB LEU 995 -6.270 9.496 -4.066 638 HG LEU 995 HG LEU 995 -4.480 7.625 -3.909 639 1HD1 LEU 995 1HD1 LEU 995 -2.883 9.035 -4.860 640 2HD1 LEU 995 2HD1 LEU 995 -4.426 9.866 -5.172 641 3HD1 LEU 995 3HD1 LEU 995 -3.365 10.423 -3.856 642 1HD2 LEU 995 1HD2 LEU 995 -3.358 9.404 -1.742 643 2HD2 LEU 995 2HD2 LEU 995 -4.275 7.919 -1.391 644 3HD2 LEU 995 3HD2 LEU 995 -2.757 7.830 -2.316 645 H ALA 996 H ALA 996 -8.547 9.952 -2.613 646 HA ALA 996 HA ALA 996 -9.051 12.174 -4.028 647 1HB ALA 996 1HB ALA 996 -11.269 11.707 -3.616 648 2HB ALA 996 2HB ALA 996 -10.549 10.197 -3.007 649 3HB ALA 996 3HB ALA 996 -11.011 11.485 -1.869 650 H GLU 997 H GLU 997 -9.112 11.963 -0.400 651 HA GLU 997 HA GLU 997 -9.690 14.630 -0.015 652 1HB GLU 997 1HB GLU 997 -9.578 12.538 1.626 653 2HB GLU 997 2HB GLU 997 -7.951 13.111 1.934 654 1HG GLU 997 1HG GLU 997 -8.982 14.430 3.504 655 2HG GLU 997 2HG GLU 997 -9.296 15.480 2.137 656 H LEU 998 H LEU 998 -6.611 12.924 -0.625 657 HA LEU 998 HA LEU 998 -4.957 15.105 0.102 658 1HB LEU 998 1HB LEU 998 -4.332 12.677 0.023 659 2HB LEU 998 2HB LEU 998 -4.334 12.785 -1.726 660 HG LEU 998 HG LEU 998 -2.609 14.603 -0.045 661 1HD1 LEU 998 1HD1 LEU 998 -1.130 12.398 -1.182 662 2HD1 LEU 998 2HD1 LEU 998 -1.185 12.990 0.496 663 3HD1 LEU 998 3HD1 LEU 998 -2.387 11.805 -0.070 664 1HD2 LEU 998 1HD2 LEU 998 -2.148 15.477 -2.033 665 2HD2 LEU 998 2HD2 LEU 998 -1.363 13.940 -2.465 666 3HD2 LEU 998 3HD2 LEU 998 -3.074 14.210 -2.872 667 H ILE 999 H ILE 999 -6.306 13.866 -3.017 668 HA ILE 999 HA ILE 999 -5.032 15.753 -4.630 669 HB ILE 999 HB ILE 999 -7.674 14.364 -5.084 670 1HG1 ILE 999 1HG1 ILE 999 -6.156 12.642 -4.535 671 2HG1 ILE 999 2HG1 ILE 999 -6.239 12.667 -6.285 672 1HG2 ILE 999 1HG2 ILE 999 -7.075 14.582 -7.471 673 2HG2 ILE 999 2HG2 ILE 999 -7.301 16.154 -6.668 674 3HG2 ILE 999 3HG2 ILE 999 -5.659 15.556 -7.008 675 1HD1 ILE 999 1HD1 ILE 999 -4.059 13.986 -4.601 676 2HD1 ILE 999 2HD1 ILE 999 -3.894 12.471 -5.522 677 3HD1 ILE 999 3HD1 ILE 999 -4.143 14.011 -6.379 678 H ASN1000 H ASN1000 -8.378 15.729 -3.216 679 HA ASN1000 HA ASN1000 -9.188 18.115 -4.194 680 1HB ASN1000 1HB ASN1000 -10.326 16.298 -2.574 681 2HB ASN1000 2HB ASN1000 -9.823 17.406 -1.313 682 1HD2 ASN1000 1HD2 ASN1000 -11.591 18.400 -0.675 683 2HD2 ASN1000 2HD2 ASN1000 -12.722 19.250 -1.674 684 H LYS1001 H LYS1001 -6.837 17.360 -1.657 685 HA LYS1001 HA LYS1001 -6.901 19.952 -0.449 686 1HB LYS1001 1HB LYS1001 -5.838 17.382 0.156 687 2HB LYS1001 2HB LYS1001 -4.489 18.499 0.116 688 1HG LYS1001 1HG LYS1001 -5.119 19.035 2.245 689 2HG LYS1001 2HG LYS1001 -6.359 20.006 1.476 690 1HD LYS1001 1HD LYS1001 -7.931 18.051 1.562 691 2HD LYS1001 2HD LYS1001 -6.692 17.098 2.354 692 1HE LYS1001 1HE LYS1001 -6.821 19.472 3.885 693 2HE LYS1001 2HE LYS1001 -8.493 19.120 3.497 694 1HZ LYS1001 1HZ LYS1001 -8.183 16.910 4.351 695 2HZ LYS1001 2HZ LYS1001 -6.606 17.194 4.668 696 3HZ LYS1001 3HZ LYS1001 -7.762 18.000 5.492 697 H MET1002 H MET1002 -4.338 18.170 -2.319 698 HA MET1002 HA MET1002 -2.705 20.290 -2.703 699 1HB MET1002 1HB MET1002 -1.632 18.887 -4.279 700 2HB MET1002 2HB MET1002 -2.589 17.714 -3.396 701 1HG MET1002 1HG MET1002 -3.291 17.122 -5.513 702 2HG MET1002 2HG MET1002 -4.438 18.423 -5.260 703 1HE MET1002 1HE MET1002 -3.917 18.785 -8.733 704 2HE MET1002 2HE MET1002 -2.522 17.682 -8.645 705 3HE MET1002 3HE MET1002 -3.985 17.346 -7.688 706 H LYS1003 H LYS1003 -5.851 19.702 -4.130 707 HA LYS1003 HA LYS1003 -5.468 21.283 -6.453 708 1HB LYS1003 1HB LYS1003 -7.625 19.771 -5.166 709 2HB LYS1003 2HB LYS1003 -8.190 21.244 -5.927 710 1HG LYS1003 1HG LYS1003 -6.606 20.431 -7.932 711 2HG LYS1003 2HG LYS1003 -6.826 18.861 -7.185 712 1HD LYS1003 1HD LYS1003 -8.588 19.044 -8.798 713 2HD LYS1003 2HD LYS1003 -9.356 19.303 -7.244 714 1HE LYS1003 1HE LYS1003 -9.828 21.516 -7.688 715 2HE LYS1003 2HE LYS1003 -8.309 21.785 -8.520 716 1HZ LYS1003 1HZ LYS1003 -10.822 20.868 -9.577 717 2HZ LYS1003 2HZ LYS1003 -9.667 21.785 -10.279 718 3HZ LYS1003 3HZ LYS1003 -9.494 20.163 -10.213 719 H LEU1004 H LEU1004 -7.032 21.871 -3.232 720 HA LEU1004 HA LEU1004 -7.523 24.598 -3.823 721 1HB LEU1004 1HB LEU1004 -7.389 23.331 -1.093 722 2HB LEU1004 2HB LEU1004 -8.286 24.754 -1.584 723 HG LEU1004 HG LEU1004 -8.912 22.085 -2.824 724 1HD1 LEU1004 1HD1 LEU1004 -9.833 21.206 -1.000 725 2HD1 LEU1004 2HD1 LEU1004 -8.963 22.450 -0.069 726 3HD1 LEU1004 3HD1 LEU1004 -10.645 22.733 -0.579 727 1HD2 LEU1004 1HD2 LEU1004 -10.704 24.440 -2.184 728 2HD2 LEU1004 2HD2 LEU1004 -9.863 24.212 -3.737 729 3HD2 LEU1004 3HD2 LEU1004 -11.077 23.026 -3.200 730 H ALA1005 H ALA1005 -4.924 22.771 -2.133 731 HA ALA1005 HA ALA1005 -3.554 24.763 -0.930 732 1HB ALA1005 1HB ALA1005 -1.509 23.283 -1.924 733 2HB ALA1005 2HB ALA1005 -2.552 22.736 -0.589 734 3HB ALA1005 3HB ALA1005 -2.867 22.180 -2.251 735 H GLN1006 H GLN1006 -3.535 23.905 -4.440 736 HA GLN1006 HA GLN1006 -1.542 25.496 -5.290 737 1HB GLN1006 1HB GLN1006 -4.186 24.697 -6.522 738 2HB GLN1006 2HB GLN1006 -3.128 25.787 -7.396 739 1HG GLN1006 1HG GLN1006 -2.100 23.161 -6.247 740 2HG GLN1006 2HG GLN1006 -2.858 23.231 -7.825 741 1HE2 GLN1006 1HE2 GLN1006 -0.412 22.350 -7.851 742 2HE2 GLN1006 2HE2 GLN1006 0.741 23.506 -8.430 743 H GLN1007 H GLN1007 -4.792 26.447 -4.184 744 HA GLN1007 HA GLN1007 -4.302 29.161 -5.038 745 1HB GLN1007 1HB GLN1007 -6.574 27.801 -5.162 746 2HB GLN1007 2HB GLN1007 -6.741 28.276 -3.483 747 1HG GLN1007 1HG GLN1007 -5.935 30.482 -5.323 748 2HG GLN1007 2HG GLN1007 -7.530 29.822 -5.630 749 1HE2 GLN1007 1HE2 GLN1007 -9.104 29.824 -3.983 750 2HE2 GLN1007 2HE2 GLN1007 -9.048 30.943 -2.662 751 H TYR1008 H TYR1008 -4.557 27.132 -2.096 752 HA TYR1008 HA TYR1008 -4.263 29.438 -0.373 753 1HB TYR1008 1HB TYR1008 -4.476 26.384 -0.126 754 2HB TYR1008 2HB TYR1008 -4.146 27.366 1.288 755 HD1 TYR1008 HD1 TYR1008 -5.854 29.146 1.963 756 HD2 TYR1008 HD2 TYR1008 -6.689 26.103 -0.927 757 HE1 TYR1008 HE1 TYR1008 -8.349 29.525 2.273 758 HE2 TYR1008 HE2 TYR1008 -9.181 26.493 -0.607 759 HH TYR1008 HH TYR1008 -10.479 27.876 1.903 760 H VAL1009 H VAL1009 -2.096 29.178 -2.221 761 HA VAL1009 HA VAL1009 0.037 28.496 -0.326 762 HB VAL1009 HB VAL1009 0.001 26.699 -1.858 763 1HG1 VAL1009 1HG1 VAL1009 -1.432 27.974 -3.557 764 2HG1 VAL1009 2HG1 VAL1009 0.102 28.588 -4.219 765 3HG1 VAL1009 3HG1 VAL1009 -0.224 26.838 -4.205 766 1HG2 VAL1009 1HG2 VAL1009 2.094 28.525 -3.052 767 2HG2 VAL1009 2HG2 VAL1009 2.221 27.908 -1.387 768 3HG2 VAL1009 3HG2 VAL1009 2.176 26.771 -2.756 769 H MET1010 H MET1010 -1.020 30.333 -3.251 770 HA MET1010 HA MET1010 1.204 31.988 -3.326 771 1HB MET1010 1HB MET1010 -0.425 33.496 -4.652 772 2HB MET1010 2HB MET1010 -0.275 31.854 -5.246 773 1HG MET1010 1HG MET1010 -2.526 31.634 -5.035 774 2HG MET1010 2HG MET1010 -2.329 31.720 -3.296 775 1HE MET1010 1HE MET1010 -4.942 33.700 -2.891 776 2HE MET1010 2HE MET1010 -3.608 32.755 -2.187 777 3HE MET1010 3HE MET1010 -3.622 34.528 -2.031 778 H THR1011 H THR1011 1.398 32.344 -0.894 779 HA THR1011 HA THR1011 0.992 34.892 -0.158 780 HB THR1011 HB THR1011 -1.360 34.935 -0.268 781 HG1 THR1011 HG1 THR1011 -0.805 35.430 1.917 782 1HG2 THR1011 1HG2 THR1011 -2.245 32.634 1.199 783 2HG2 THR1011 2HG2 THR1011 -2.529 32.989 -0.521 784 3HG2 THR1011 3HG2 THR1011 -1.101 32.047 -0.031 785 H SER1012 H SER1012 0.223 31.663 1.312 786 HA SER1012 HA SER1012 2.468 31.110 2.505 787 1HB SER1012 1HB SER1012 1.315 33.503 3.854 788 2HB SER1012 2HB SER1012 1.824 32.225 4.941 789 HG SER1012 HG SER1012 3.674 32.765 2.900 790 H LEU1013 H LEU1013 -1.010 31.485 2.705 791 HA LEU1013 HA LEU1013 -1.808 30.075 4.834 792 1HB LEU1013 1HB LEU1013 -2.988 31.026 2.615 793 2HB LEU1013 2HB LEU1013 -3.070 29.312 2.261 794 HG LEU1013 HG LEU1013 -5.064 30.429 3.441 795 1HD1 LEU1013 1HD1 LEU1013 -4.008 27.968 4.832 796 2HD1 LEU1013 2HD1 LEU1013 -5.692 28.405 4.459 797 3HD1 LEU1013 3HD1 LEU1013 -4.581 27.943 3.147 798 1HD2 LEU1013 1HD2 LEU1013 -3.553 29.919 5.985 799 2HD2 LEU1013 2HD2 LEU1013 -3.417 31.491 5.159 800 3HD2 LEU1013 3HD2 LEU1013 -5.008 30.904 5.700 801 H GLN1014 H GLN1014 0.015 28.859 2.056 802 HA GLN1014 HA GLN1014 -0.463 26.276 1.970 803 1HB GLN1014 1HB GLN1014 1.341 27.449 0.719 804 2HB GLN1014 2HB GLN1014 2.321 27.510 2.171 805 1HG GLN1014 1HG GLN1014 1.954 24.879 2.202 806 2HG GLN1014 2HG GLN1014 1.550 25.095 0.511 807 1HE2 GLN1014 1HE2 GLN1014 3.182 24.595 -0.723 808 2HE2 GLN1014 2HE2 GLN1014 4.849 24.998 -0.482 809 H GLN1015 H GLN1015 1.825 27.732 4.402 810 HA GLN1015 HA GLN1015 2.574 25.621 5.770 811 1HB GLN1015 1HB GLN1015 2.339 27.122 7.885 812 2HB GLN1015 2HB GLN1015 3.338 27.701 6.566 813 1HG GLN1015 1HG GLN1015 2.031 29.538 6.334 814 2HG GLN1015 2HG GLN1015 0.624 28.534 6.042 815 1HE2 GLN1015 1HE2 GLN1015 -0.901 28.317 7.547 816 2HE2 GLN1015 2HE2 GLN1015 -0.861 28.998 9.139 817 H GLU1016 H GLU1016 -0.699 27.103 5.922 818 HA GLU1016 HA GLU1016 -1.584 25.525 8.048 819 1HB GLU1016 1HB GLU1016 -2.564 27.694 6.682 820 2HB GLU1016 2HB GLU1016 -3.595 26.431 6.041 821 1HG GLU1016 1HG GLU1016 -4.695 26.136 8.032 822 2HG GLU1016 2HG GLU1016 -3.225 26.257 8.978 823 H TYR1017 H TYR1017 -2.567 25.351 4.544 824 HA TYR1017 HA TYR1017 -3.778 22.880 4.704 825 1HB TYR1017 1HB TYR1017 -2.484 24.707 2.682 826 2HB TYR1017 2HB TYR1017 -2.662 23.049 2.144 827 HD1 TYR1017 HD1 TYR1017 -4.561 25.986 3.423 828 HD2 TYR1017 HD2 TYR1017 -4.760 22.219 1.404 829 HE1 TYR1017 HE1 TYR1017 -6.981 26.443 2.793 830 HE2 TYR1017 HE2 TYR1017 -7.180 22.689 0.781 831 HH TYR1017 HH TYR1017 -9.059 24.136 1.830 832 H LYS1018 H LYS1018 -0.355 23.720 4.689 833 HA LYS1018 HA LYS1018 0.670 21.352 3.640 834 1HB LYS1018 1HB LYS1018 2.111 23.211 3.808 835 2HB LYS1018 2HB LYS1018 1.752 23.463 5.504 836 1HG LYS1018 1HG LYS1018 3.901 22.415 5.478 837 2HG LYS1018 2HG LYS1018 2.787 21.148 5.950 838 1HD LYS1018 1HD LYS1018 3.305 21.480 3.005 839 2HD LYS1018 2HD LYS1018 4.610 20.822 3.971 840 1HE LYS1018 1HE LYS1018 1.790 19.705 3.665 841 2HE LYS1018 2HE LYS1018 3.293 18.947 3.179 842 1HZ LYS1018 1HZ LYS1018 3.771 19.289 5.728 843 2HZ LYS1018 2HZ LYS1018 2.144 19.182 5.812 844 3HZ LYS1018 3HZ LYS1018 3.010 17.962 5.158 845 H LYS1019 H LYS1019 -0.066 22.321 7.056 846 HA LYS1019 HA LYS1019 0.758 19.928 8.205 847 1HB LYS1019 1HB LYS1019 -0.886 22.267 8.994 848 2HB LYS1019 2HB LYS1019 -1.175 20.798 9.904 849 1HG LYS1019 1HG LYS1019 0.591 21.754 11.117 850 2HG LYS1019 2HG LYS1019 1.454 20.654 10.061 851 1HD LYS1019 1HD LYS1019 0.941 23.477 9.105 852 2HD LYS1019 2HD LYS1019 2.206 23.208 10.288 853 1HE LYS1019 1HE LYS1019 2.131 21.412 7.861 854 2HE LYS1019 2HE LYS1019 2.698 23.057 7.650 855 1HZ LYS1019 1HZ LYS1019 3.789 21.687 9.921 856 2HZ LYS1019 2HZ LYS1019 4.223 21.063 8.475 857 3HZ LYS1019 3HZ LYS1019 4.534 22.630 8.814 858 H GLN1020 H GLN1020 -2.290 20.896 6.602 859 HA GLN1020 HA GLN1020 -3.795 18.743 7.478 860 1HB GLN1020 1HB GLN1020 -4.046 20.235 4.830 861 2HB GLN1020 2HB GLN1020 -5.308 19.309 5.616 862 1HG GLN1020 1HG GLN1020 -4.006 21.869 6.646 863 2HG GLN1020 2HG GLN1020 -5.662 21.675 6.107 864 1HE2 GLN1020 1HE2 GLN1020 -7.188 20.855 7.429 865 2HE2 GLN1020 2HE2 GLN1020 -6.943 20.437 9.092 866 H MET1021 H MET1021 -1.973 19.232 4.367 867 HA MET1021 HA MET1021 -2.520 16.830 3.240 868 1HB MET1021 1HB MET1021 -0.643 19.008 2.914 869 2HB MET1021 2HB MET1021 0.271 17.519 2.768 870 1HG MET1021 1HG MET1021 -2.211 17.213 1.300 871 2HG MET1021 2HG MET1021 -1.466 18.724 0.818 872 1HE MET1021 1HE MET1021 -0.882 15.075 1.652 873 2HE MET1021 2HE MET1021 0.522 14.583 0.675 874 3HE MET1021 3HE MET1021 0.756 15.589 2.125 875 H LEU1022 H LEU1022 -0.015 17.640 5.697 876 HA LEU1022 HA LEU1022 1.370 15.233 5.605 877 1HB LEU1022 1HB LEU1022 1.959 17.438 6.734 878 2HB LEU1022 2HB LEU1022 0.938 16.924 8.062 879 HG LEU1022 HG LEU1022 3.340 16.504 8.453 880 1HD1 LEU1022 1HD1 LEU1022 3.100 14.352 9.418 881 2HD1 LEU1022 2HD1 LEU1022 1.493 15.116 9.473 882 3HD1 LEU1022 3HD1 LEU1022 1.850 13.882 8.241 883 1HD2 LEU1022 1HD2 LEU1022 3.170 14.416 6.269 884 2HD2 LEU1022 2HD2 LEU1022 3.892 16.029 6.051 885 3HD2 LEU1022 3HD2 LEU1022 4.594 14.890 7.226 886 H THR1023 H THR1023 -1.564 16.236 7.451 887 HA THR1023 HA THR1023 -1.845 14.062 9.089 888 HB THR1023 HB THR1023 -4.085 15.495 7.573 889 HG1 THR1023 HG1 THR1023 -3.069 17.215 8.541 890 1HG2 THR1023 1HG2 THR1023 -3.836 14.374 10.415 891 2HG2 THR1023 2HG2 THR1023 -5.220 15.313 9.807 892 3HG2 THR1023 3HG2 THR1023 -4.864 13.708 9.124 893 H ALA1024 H ALA1024 -2.949 14.356 5.654 894 HA ALA1024 HA ALA1024 -4.005 11.743 5.595 895 1HB ALA1024 1HB ALA1024 -4.878 12.773 3.791 896 2HB ALA1024 2HB ALA1024 -3.611 14.023 3.807 897 3HB ALA1024 3HB ALA1024 -3.324 12.474 2.978 898 H ALA1025 H ALA1025 -0.820 13.197 4.720 899 HA ALA1025 HA ALA1025 0.310 10.994 3.514 900 1HB ALA1025 1HB ALA1025 1.952 12.516 3.361 901 2HB ALA1025 2HB ALA1025 1.107 13.553 4.535 902 3HB ALA1025 3HB ALA1025 2.280 12.340 5.101 903 H HIS1026 H HIS1026 -0.271 11.729 6.961 904 HA HIS1026 HA HIS1026 1.406 9.680 7.932 905 1HB HIS1026 1HB HIS1026 0.258 11.826 9.047 906 2HB HIS1026 2HB HIS1026 -0.944 10.636 9.506 907 HD1 HIS1026 HD1 HIS1026 2.903 10.535 9.507 908 HD2 HIS1026 HD2 HIS1026 -0.367 9.828 12.038 909 HE1 HIS1026 HE1 HIS1026 3.876 9.733 11.725 910 H ALA1027 H ALA1027 -2.201 9.946 7.557 911 HA ALA1027 HA ALA1027 -2.701 7.298 8.307 912 1HB ALA1027 1HB ALA1027 -4.828 7.904 6.764 913 2HB ALA1027 2HB ALA1027 -4.605 8.576 8.397 914 3HB ALA1027 3HB ALA1027 -4.157 9.540 6.970 915 H LEU1028 H LEU1028 -1.789 8.843 5.216 916 HA LEU1028 HA LEU1028 -2.476 6.783 3.502 917 1HB LEU1028 1HB LEU1028 -0.560 9.056 3.480 918 2HB LEU1028 2HB LEU1028 -0.326 7.798 2.282 919 HG LEU1028 HG LEU1028 -2.721 9.600 2.650 920 1HD1 LEU1028 1HD1 LEU1028 -1.258 10.738 1.300 921 2HD1 LEU1028 2HD1 LEU1028 -0.575 9.255 0.591 922 3HD1 LEU1028 3HD1 LEU1028 -2.184 9.824 0.085 923 1HD2 LEU1028 1HD2 LEU1028 -3.847 7.623 2.243 924 2HD2 LEU1028 2HD2 LEU1028 -3.598 8.257 0.599 925 3HD2 LEU1028 3HD2 LEU1028 -2.546 6.963 1.223 926 H ALA1029 H ALA1029 0.846 7.460 4.824 927 HA ALA1029 HA ALA1029 2.128 5.260 4.024 928 1HB ALA1029 1HB ALA1029 2.794 7.264 5.598 929 2HB ALA1029 2HB ALA1029 2.406 6.117 6.902 930 3HB ALA1029 3HB ALA1029 3.669 5.719 5.714 931 H VAL1030 H VAL1030 -0.244 5.470 6.723 932 HA VAL1030 HA VAL1030 0.160 2.769 7.520 933 HB VAL1030 HB VAL1030 -1.754 4.982 8.147 934 1HG1 VAL1030 1HG1 VAL1030 -2.329 2.099 8.384 935 2HG1 VAL1030 2HG1 VAL1030 -2.542 3.020 9.892 936 3HG1 VAL1030 3HG1 VAL1030 -3.428 3.498 8.424 937 1HG2 VAL1030 1HG2 VAL1030 -0.550 5.186 10.033 938 2HG2 VAL1030 2HG2 VAL1030 -0.526 3.429 10.317 939 3HG2 VAL1030 3HG2 VAL1030 0.657 4.167 9.211 940 H ASP1031 H ASP1031 -2.408 4.524 5.647 941 HA ASP1031 HA ASP1031 -4.121 2.573 5.170 942 1HB ASP1031 1HB ASP1031 -2.990 4.723 3.364 943 2HB ASP1031 2HB ASP1031 -4.151 3.591 2.700 944 H ALA1032 H ALA1032 -1.206 3.279 3.083 945 HA ALA1032 HA ALA1032 -1.436 1.072 1.433 946 1HB ALA1032 1HB ALA1032 1.215 1.501 1.400 947 2HB ALA1032 2HB ALA1032 0.064 2.626 0.638 948 3HB ALA1032 3HB ALA1032 0.719 2.982 2.255 949 H LYS1033 H LYS1033 -0.047 1.446 4.709 950 HA LYS1033 HA LYS1033 1.273 -1.046 4.727 951 1HB LYS1033 1HB LYS1033 1.565 1.056 6.237 952 2HB LYS1033 2HB LYS1033 0.264 0.370 7.188 953 1HG LYS1033 1HG LYS1033 2.867 -1.061 6.470 954 2HG LYS1033 2HG LYS1033 2.503 -0.345 8.028 955 1HD LYS1033 1HD LYS1033 0.330 -1.917 7.865 956 2HD LYS1033 2HD LYS1033 1.341 -2.826 6.759 957 1HE LYS1033 1HE LYS1033 1.676 -3.751 8.979 958 2HE LYS1033 2HE LYS1033 3.144 -2.902 8.539 959 1HZ LYS1033 1HZ LYS1033 2.265 -2.424 10.789 960 2HZ LYS1033 2HZ LYS1033 2.523 -1.093 9.877 961 3HZ LYS1033 3HZ LYS1033 1.003 -1.646 10.103 962 H ASN1034 H ASN1034 -1.828 0.025 6.301 963 HA ASN1034 HA ASN1034 -2.657 -2.263 7.316 964 1HB ASN1034 1HB ASN1034 -3.860 0.116 6.895 965 2HB ASN1034 2HB ASN1034 -4.664 -0.765 5.612 966 1HD2 ASN1034 1HD2 ASN1034 -6.475 -0.087 7.095 967 2HD2 ASN1034 2HD2 ASN1034 -6.980 -1.209 8.315 968 H LEU1035 H LEU1035 -2.445 -1.383 3.864 969 HA LEU1035 HA LEU1035 -4.097 -3.384 2.824 970 1HB LEU1035 1HB LEU1035 -3.192 -1.302 1.706 971 2HB LEU1035 2HB LEU1035 -1.679 -2.161 1.501 972 HG LEU1035 HG LEU1035 -4.157 -3.492 0.500 973 1HD1 LEU1035 1HD1 LEU1035 -2.959 -1.002 -0.706 974 2HD1 LEU1035 2HD1 LEU1035 -3.810 -2.212 -1.696 975 3HD1 LEU1035 3HD1 LEU1035 -4.666 -1.383 -0.374 976 1HD2 LEU1035 1HD2 LEU1035 -1.870 -4.521 0.414 977 2HD2 LEU1035 2HD2 LEU1035 -2.698 -4.394 -1.156 978 3HD2 LEU1035 3HD2 LEU1035 -1.406 -3.244 -0.736 979 H LEU1036 H LEU1036 -0.465 -3.310 2.702 980 HA LEU1036 HA LEU1036 -0.247 -6.029 2.166 981 1HB LEU1036 1HB LEU1036 1.421 -3.852 2.265 982 2HB LEU1036 2HB LEU1036 1.988 -4.805 3.621 983 HG LEU1036 HG LEU1036 1.744 -6.688 1.597 984 1HD1 LEU1036 1HD1 LEU1036 2.090 -5.832 -0.429 985 2HD1 LEU1036 2HD1 LEU1036 1.680 -4.249 0.275 986 3HD1 LEU1036 3HD1 LEU1036 3.382 -4.757 0.157 987 1HD2 LEU1036 1HD2 LEU1036 3.637 -7.051 2.738 988 2HD2 LEU1036 2HD2 LEU1036 4.393 -6.014 1.504 989 3HD2 LEU1036 3HD2 LEU1036 3.893 -5.320 3.065 990 H ASP1037 H ASP1037 -0.363 -4.189 5.249 991 HA ASP1037 HA ASP1037 0.487 -5.929 7.031 992 1HB ASP1037 1HB ASP1037 -0.430 -3.931 7.888 993 2HB ASP1037 2HB ASP1037 -1.925 -4.113 6.992 994 H VAL1038 H VAL1038 -2.906 -5.864 5.685 995 HA VAL1038 HA VAL1038 -3.803 -8.156 6.962 996 HB VAL1038 HB VAL1038 -4.594 -6.876 4.340 997 1HG1 VAL1038 1HG1 VAL1038 -5.316 -9.414 5.186 998 2HG1 VAL1038 2HG1 VAL1038 -6.660 -8.396 5.755 999 3HG1 VAL1038 3HG1 VAL1038 -6.213 -8.397 4.032 1000 1HG2 VAL1038 1HG2 VAL1038 -5.889 -5.435 5.507 1001 2HG2 VAL1038 2HG2 VAL1038 -6.318 -6.648 6.737 1002 3HG2 VAL1038 3HG2 VAL1038 -4.757 -5.798 6.832 1003 H ILE1039 H ILE1039 -1.959 -7.682 3.922 1004 HA ILE1039 HA ILE1039 -2.233 -10.319 3.004 1005 HB ILE1039 HB ILE1039 -0.584 -7.946 2.391 1006 1HG1 ILE1039 1HG1 ILE1039 -2.044 -9.953 0.648 1007 2HG1 ILE1039 2HG1 ILE1039 -2.745 -8.478 1.283 1008 1HG2 ILE1039 1HG2 ILE1039 1.269 -9.353 2.450 1009 2HG2 ILE1039 2HG2 ILE1039 0.352 -10.756 1.851 1010 3HG2 ILE1039 3HG2 ILE1039 0.754 -9.419 0.748 1011 1HD1 ILE1039 1HD1 ILE1039 -0.253 -7.743 0.074 1012 2HD1 ILE1039 2HD1 ILE1039 -1.100 -8.817 -1.065 1013 3HD1 ILE1039 3HD1 ILE1039 -1.897 -7.338 -0.476 1014 H ASP1040 H ASP1040 0.147 -8.680 5.154 1015 HA ASP1040 HA ASP1040 2.035 -10.574 5.317 1016 1HB ASP1040 1HB ASP1040 1.422 -8.282 6.702 1017 2HB ASP1040 2HB ASP1040 1.115 -9.478 7.946 1018 H GLN1041 H GLN1041 -1.211 -10.462 6.880 1019 HA GLN1041 HA GLN1041 -0.736 -12.745 8.476 1020 1HB GLN1041 1HB GLN1041 -3.240 -11.189 7.729 1021 2HB GLN1041 2HB GLN1041 -3.305 -12.610 8.752 1022 1HG GLN1041 1HG GLN1041 -1.301 -11.269 10.019 1023 2HG GLN1041 2HG GLN1041 -2.151 -9.900 9.332 1024 1HE2 GLN1041 1HE2 GLN1041 -4.417 -9.651 9.757 1025 2HE2 GLN1041 2HE2 GLN1041 -5.112 -10.233 11.233 1026 H ALA1042 H ALA1042 -1.774 -12.136 5.168 1027 HA ALA1042 HA ALA1042 -3.008 -14.716 4.857 1028 1HB ALA1042 1HB ALA1042 -2.710 -13.794 2.340 1029 2HB ALA1042 2HB ALA1042 -4.008 -13.232 3.421 1030 3HB ALA1042 3HB ALA1042 -2.530 -12.260 3.223 1031 H ARG1043 H ARG1043 0.094 -13.079 4.007 1032 HA ARG1043 HA ARG1043 1.154 -14.993 2.428 1033 1HB ARG1043 1HB ARG1043 2.235 -12.807 2.891 1034 2HB ARG1043 2HB ARG1043 2.560 -13.287 4.544 1035 1HG ARG1043 1HG ARG1043 3.678 -15.384 3.065 1036 2HG ARG1043 2HG ARG1043 4.017 -13.985 2.065 1037 1HD ARG1043 1HD ARG1043 4.672 -14.174 5.046 1038 2HD ARG1043 2HD ARG1043 5.827 -14.455 3.759 1039 HE ARG1043 HE ARG1043 4.433 -11.865 3.596 1040 1HH1 ARG1043 2HH2 ARG1043 7.251 -13.596 4.798 1041 2HH1 ARG1043 1HH2 ARG1043 8.218 -12.168 4.960 1042 1HH2 ARG1043 2HH1 ARG1043 5.708 -9.981 3.810 1043 2HH2 ARG1043 1HH1 ARG1043 7.334 -10.098 4.394 1044 H LEU1044 H LEU1044 1.234 -14.760 6.047 1045 HA LEU1044 HA LEU1044 2.804 -17.044 6.442 1046 1HB LEU1044 1HB LEU1044 1.925 -16.924 8.754 1047 2HB LEU1044 2HB LEU1044 2.637 -15.438 8.159 1048 HG LEU1044 HG LEU1044 0.116 -14.854 7.562 1049 1HD1 LEU1044 1HD1 LEU1044 -0.347 -16.539 10.016 1050 2HD1 LEU1044 2HD1 LEU1044 -1.533 -15.811 8.905 1051 3HD1 LEU1044 3HD1 LEU1044 -0.557 -17.203 8.378 1052 1HD2 LEU1044 1HD2 LEU1044 1.216 -13.356 8.928 1053 2HD2 LEU1044 2HD2 LEU1044 -0.055 -13.970 10.013 1054 3HD2 LEU1044 3HD2 LEU1044 1.609 -14.587 10.152 1055 H LYS1045 H LYS1045 -0.717 -16.524 6.013 1056 HA LYS1045 HA LYS1045 -1.683 -18.926 6.855 1057 1HB LYS1045 1HB LYS1045 -2.571 -16.732 5.257 1058 2HB LYS1045 2HB LYS1045 -3.019 -18.208 4.427 1059 1HG LYS1045 1HG LYS1045 -4.808 -18.224 5.850 1060 2HG LYS1045 2HG LYS1045 -3.675 -18.877 7.017 1061 1HD LYS1045 1HD LYS1045 -3.196 -16.616 7.886 1062 2HD LYS1045 2HD LYS1045 -4.198 -15.890 6.645 1063 1HE LYS1045 1HE LYS1045 -5.557 -15.974 8.632 1064 2HE LYS1045 2HE LYS1045 -6.171 -17.229 7.574 1065 1HZ LYS1045 1HZ LYS1045 -4.291 -18.524 8.948 1066 2HZ LYS1045 2HZ LYS1045 -4.831 -17.481 10.082 1067 3HZ LYS1045 3HZ LYS1045 -5.874 -18.503 9.351 1068 H MET1046 H MET1046 0.457 -18.248 4.160 1069 HA MET1046 HA MET1046 -0.139 -20.751 2.896 1070 1HB MET1046 1HB MET1046 0.456 -18.761 1.533 1071 2HB MET1046 2HB MET1046 1.966 -18.573 2.403 1072 1HG MET1046 1HG MET1046 2.011 -21.251 1.467 1073 2HG MET1046 2HG MET1046 1.346 -20.328 0.134 1074 1HE MET1046 1HE MET1046 3.443 -17.398 1.465 1075 2HE MET1046 2HE MET1046 3.836 -17.456 -0.270 1076 3HE MET1046 3HE MET1046 2.167 -17.748 0.275 1077 H ILE1047 H ILE1047 2.197 -19.374 5.182 1078 HA ILE1047 HA ILE1047 4.357 -20.966 4.946 1079 HB ILE1047 HB ILE1047 2.944 -19.998 7.427 1080 1HG1 ILE1047 1HG1 ILE1047 3.917 -18.421 5.580 1081 2HG1 ILE1047 2HG1 ILE1047 4.196 -18.079 7.276 1082 1HG2 ILE1047 1HG2 ILE1047 5.440 -21.596 7.114 1083 2HG2 ILE1047 2HG2 ILE1047 5.445 -20.265 8.295 1084 3HG2 ILE1047 3HG2 ILE1047 4.244 -21.572 8.432 1085 1HD1 ILE1047 1HD1 ILE1047 6.162 -19.757 5.676 1086 2HD1 ILE1047 2HD1 ILE1047 6.244 -17.979 5.686 1087 3HD1 ILE1047 3HD1 ILE1047 6.438 -18.887 7.204 1088 H SER1048 H SER1048 1.326 -21.799 6.765 1089 HA SER1048 HA SER1048 2.203 -24.572 6.545 1090 1HB SER1048 1HB SER1048 0.838 -23.035 8.730 1091 2HB SER1048 2HB SER1048 0.326 -24.696 8.504 1092 HG SER1048 HG SER1048 2.024 -24.992 9.839 1093 H GLN1049 H GLN1049 1.220 -24.620 4.358 1094 HA GLN1049 HA GLN1049 -1.401 -25.566 4.463 1095 1HB GLN1049 1HB GLN1049 -1.209 -22.731 4.174 1096 2HB GLN1049 2HB GLN1049 -1.655 -23.355 2.598 1097 1HG GLN1049 1HG GLN1049 -3.079 -24.266 5.131 1098 2HG GLN1049 2HG GLN1049 -3.576 -22.823 4.270 1099 1HE2 GLN1049 1HE2 GLN1049 -4.426 -22.958 2.198 1100 2HE2 GLN1049 2HE2 GLN1049 -5.052 -24.427 1.528 1101 H SER1050 H SER1050 0.442 -27.082 3.590 1102 HA SER1050 HA SER1050 1.261 -28.223 1.937 1103 1HB SER1050 1HB SER1050 -1.251 -27.705 1.111 1104 2HB SER1050 2HB SER1050 -0.403 -26.851 -0.162 1105 HG SER1050 HG SER1050 0.897 -28.954 -0.354 1106 H ARG1051 H ARG1051 3.320 -27.875 1.195 1107 HA ARG1051 HA ARG1051 4.223 -25.303 0.684 1108 1HB ARG1051 1HB ARG1051 5.360 -27.850 1.094 1109 2HB ARG1051 2HB ARG1051 5.858 -27.442 -0.536 1110 1HG ARG1051 1HG ARG1051 6.117 -25.177 1.357 1111 2HG ARG1051 2HG ARG1051 7.094 -26.561 1.805 1112 1HD ARG1051 1HD ARG1051 7.219 -25.960 -1.094 1113 2HD ARG1051 2HD ARG1051 7.782 -24.631 -0.099 1114 HE ARG1051 HE ARG1051 9.050 -27.264 -0.387 1115 1HH1 ARG1051 2HH2 ARG1051 8.796 -24.372 1.602 1116 2HH1 ARG1051 1HH2 ARG1051 10.334 -24.605 2.362 1117 1HH2 ARG1051 2HH1 ARG1051 11.080 -27.572 0.617 1118 2HH2 ARG1051 1HH1 ARG1051 11.642 -26.437 1.798 1119 HA PRO1052 HA PRO1052 3.158 -25.013 -3.551 1120 1HB PRO1052 1HB PRO1052 4.495 -22.714 -4.181 1121 2HB PRO1052 2HB PRO1052 2.922 -22.727 -3.409 1122 1HG PRO1052 1HG PRO1052 5.565 -22.148 -2.219 1123 2HG PRO1052 2HG PRO1052 3.973 -21.761 -1.598 1124 1HD PRO1052 1HD PRO1052 5.694 -23.876 -0.708 1125 2HD PRO1052 2HD PRO1052 4.057 -23.559 -0.168 1126 H HIS1053 H HIS1053 4.396 -24.299 -5.768 1127 HA HIS1053 HA HIS1053 6.684 -26.125 -5.724 1128 1HB HIS1053 1HB HIS1053 6.205 -26.653 -8.008 1129 2HB HIS1053 2HB HIS1053 4.737 -26.849 -7.071 1130 HD1 HIS1053 HD1 HIS1053 5.863 -25.468 -10.172 1131 HD2 HIS1053 HD2 HIS1053 3.062 -24.289 -7.281 1132 HE1 HIS1053 HE1 HIS1053 4.299 -23.814 -11.325 Start of MODEL 14 1 H MET 915 H MET 915 -0.721 -23.244 -5.487 2 HA MET 915 HA MET 915 1.241 -22.484 -6.392 3 1HB MET 915 1HB MET 915 -1.116 -22.629 -8.266 4 2HB MET 915 2HB MET 915 0.366 -21.995 -8.953 5 1HG MET 915 1HG MET 915 0.802 -24.428 -7.316 6 2HG MET 915 2HG MET 915 -0.265 -24.703 -8.678 7 1HE MET 915 1HE MET 915 0.039 -24.236 -10.842 8 2HE MET 915 2HE MET 915 1.526 -23.826 -11.730 9 3HE MET 915 3HE MET 915 1.256 -25.493 -11.169 10 H ALA 916 H ALA 916 1.535 -20.428 -5.137 11 HA ALA 916 HA ALA 916 0.831 -18.053 -6.700 12 1HB ALA 916 1HB ALA 916 1.182 -16.831 -4.631 13 2HB ALA 916 2HB ALA 916 0.121 -18.221 -4.296 14 3HB ALA 916 3HB ALA 916 1.840 -18.282 -3.838 15 H ASN 917 H ASN 917 2.651 -19.199 -8.152 16 HA ASN 917 HA ASN 917 5.277 -18.701 -7.152 17 1HB ASN 917 1HB ASN 917 4.188 -19.633 -9.855 18 2HB ASN 917 2HB ASN 917 5.902 -19.397 -9.571 19 1HD2 ASN 917 1HD2 ASN 917 6.905 -20.569 -7.803 20 2HD2 ASN 917 2HD2 ASN 917 6.348 -22.156 -7.387 21 H LEU 918 H LEU 918 4.149 -16.273 -6.954 22 HA LEU 918 HA LEU 918 5.038 -14.847 -9.362 23 1HB LEU 918 1HB LEU 918 2.467 -14.756 -7.939 24 2HB LEU 918 2HB LEU 918 3.180 -13.184 -8.241 25 HG LEU 918 HG LEU 918 3.395 -13.871 -10.680 26 1HD1 LEU 918 1HD1 LEU 918 1.825 -16.213 -9.630 27 2HD1 LEU 918 2HD1 LEU 918 1.634 -15.657 -11.310 28 3HD1 LEU 918 3HD1 LEU 918 3.229 -16.188 -10.724 29 1HD2 LEU 918 1HD2 LEU 918 0.502 -13.872 -9.906 30 2HD2 LEU 918 2HD2 LEU 918 1.518 -12.474 -9.483 31 3HD2 LEU 918 3HD2 LEU 918 1.346 -12.967 -11.185 32 H ASP 919 H ASP 919 6.911 -13.842 -8.874 33 HA ASP 919 HA ASP 919 7.179 -12.892 -6.137 34 1HB ASP 919 1HB ASP 919 8.974 -14.193 -8.033 35 2HB ASP 919 2HB ASP 919 9.650 -12.648 -7.556 36 H ARG 920 H ARG 920 8.057 -12.100 -9.590 37 HA ARG 920 HA ARG 920 8.911 -9.596 -9.302 38 1HB ARG 920 1HB ARG 920 7.648 -11.171 -11.438 39 2HB ARG 920 2HB ARG 920 7.250 -9.472 -11.602 40 1HG ARG 920 1HG ARG 920 9.970 -9.378 -10.999 41 2HG ARG 920 2HG ARG 920 9.858 -10.840 -11.958 42 1HD ARG 920 1HD ARG 920 9.852 -9.521 -13.810 43 2HD ARG 920 2HD ARG 920 8.240 -9.003 -13.357 44 HE ARG 920 HE ARG 920 10.194 -7.503 -11.861 45 1HH1 ARG 920 2HH2 ARG 920 8.825 -7.767 -15.118 46 2HH1 ARG 920 1HH2 ARG 920 9.157 -6.117 -15.526 47 1HH2 ARG 920 1HH1 ARG 920 10.221 -4.700 -13.913 48 H SER 921 H SER 921 5.446 -10.478 -10.030 49 HA SER 921 HA SER 921 4.444 -7.950 -9.768 50 1HB SER 921 1HB SER 921 3.051 -10.573 -9.068 51 2HB SER 921 2HB SER 921 2.247 -9.061 -9.438 52 HG SER 921 HG SER 921 2.856 -10.918 -11.179 53 H ASN 922 H ASN 922 4.882 -10.554 -7.293 54 HA ASN 922 HA ASN 922 3.599 -9.326 -5.224 55 1HB ASN 922 1HB ASN 922 4.504 -11.671 -5.197 56 2HB ASN 922 2HB ASN 922 6.138 -11.041 -5.127 57 1HD2 ASN 922 1HD2 ASN 922 4.958 -12.774 -3.248 58 2HD2 ASN 922 2HD2 ASN 922 4.874 -11.981 -1.710 59 H ASP 923 H ASP 923 6.902 -8.911 -6.576 60 HA ASP 923 HA ASP 923 7.824 -7.331 -4.434 61 1HB ASP 923 1HB ASP 923 8.916 -8.567 -6.728 62 2HB ASP 923 2HB ASP 923 9.142 -6.855 -7.023 63 H LYS 924 H LYS 924 6.303 -6.807 -7.650 64 HA LYS 924 HA LYS 924 6.786 -4.113 -7.971 65 1HB LYS 924 1HB LYS 924 5.610 -5.968 -9.464 66 2HB LYS 924 2HB LYS 924 4.149 -5.278 -8.787 67 1HG LYS 924 1HG LYS 924 4.507 -3.988 -10.743 68 2HG LYS 924 2HG LYS 924 5.125 -2.962 -9.464 69 1HD LYS 924 1HD LYS 924 7.441 -3.722 -9.930 70 2HD LYS 924 2HD LYS 924 6.854 -4.833 -11.152 71 1HE LYS 924 1HE LYS 924 6.022 -2.963 -12.527 72 2HE LYS 924 2HE LYS 924 6.427 -1.809 -11.272 73 1HZ LYS 924 1HZ LYS 924 8.070 -2.125 -13.127 74 2HZ LYS 924 2HZ LYS 924 8.679 -2.164 -11.612 75 3HZ LYS 924 3HZ LYS 924 8.465 -3.554 -12.442 76 H VAL 925 H VAL 925 3.820 -5.651 -6.528 77 HA VAL 925 HA VAL 925 2.602 -3.356 -5.698 78 HB VAL 925 HB VAL 925 2.697 -6.083 -4.397 79 1HG1 VAL 925 1HG1 VAL 925 1.809 -3.967 -3.066 80 2HG1 VAL 925 2HG1 VAL 925 0.367 -4.228 -4.077 81 3HG1 VAL 925 3HG1 VAL 925 0.952 -5.526 -3.009 82 1HG2 VAL 925 1HG2 VAL 925 1.272 -4.937 -6.731 83 2HG2 VAL 925 2HG2 VAL 925 1.733 -6.619 -6.375 84 3HG2 VAL 925 3HG2 VAL 925 0.281 -5.917 -5.623 85 H TYR 926 H TYR 926 4.747 -5.461 -3.644 86 HA TYR 926 HA TYR 926 4.881 -3.783 -1.478 87 1HB TYR 926 1HB TYR 926 6.665 -5.820 -2.881 88 2HB TYR 926 2HB TYR 926 7.342 -4.960 -1.512 89 HD1 TYR 926 HD1 TYR 926 3.965 -6.471 -2.186 90 HD2 TYR 926 HD2 TYR 926 7.397 -6.317 0.363 91 HE1 TYR 926 HE1 TYR 926 2.868 -8.125 -0.596 92 HE2 TYR 926 HE2 TYR 926 6.289 -7.971 1.944 93 HH TYR 926 HH TYR 926 4.417 -9.874 1.534 94 H GLU 927 H GLU 927 6.546 -3.562 -4.619 95 HA GLU 927 HA GLU 927 8.444 -1.686 -3.667 96 1HB GLU 927 1HB GLU 927 7.636 -2.712 -6.404 97 2HB GLU 927 2HB GLU 927 8.746 -1.364 -6.257 98 1HG GLU 927 1HG GLU 927 9.302 -3.800 -4.574 99 2HG GLU 927 2HG GLU 927 9.596 -3.928 -6.297 100 H ASN 928 H ASN 928 5.393 -1.548 -5.614 101 HA ASN 928 HA ASN 928 5.462 1.136 -6.146 102 1HB ASN 928 1HB ASN 928 3.733 -0.935 -6.693 103 2HB ASN 928 2HB ASN 928 2.784 -0.063 -5.506 104 1HD2 ASN 928 1HD2 ASN 928 4.853 0.552 -8.339 105 2HD2 ASN 928 2HD2 ASN 928 3.869 1.776 -9.070 106 H VAL 929 H VAL 929 3.647 -0.656 -3.531 107 HA VAL 929 HA VAL 929 2.544 1.391 -2.182 108 HB VAL 929 HB VAL 929 3.734 -1.226 -1.356 109 1HG1 VAL 929 1HG1 VAL 929 4.221 0.041 0.597 110 2HG1 VAL 929 2HG1 VAL 929 2.660 0.892 0.525 111 3HG1 VAL 929 3HG1 VAL 929 2.712 -0.839 0.938 112 1HG2 VAL 929 1HG2 VAL 929 0.949 -0.047 -1.510 113 2HG2 VAL 929 2HG2 VAL 929 1.633 -1.399 -2.444 114 3HG2 VAL 929 3HG2 VAL 929 1.298 -1.597 -0.707 115 H THR 930 H THR 930 5.919 0.141 -1.683 116 HA THR 930 HA THR 930 6.615 2.093 0.208 117 HB THR 930 HB THR 930 8.993 1.333 -0.685 118 HG1 THR 930 HG1 THR 930 8.555 -0.743 -1.921 119 1HG2 THR 930 1HG2 THR 930 8.907 -0.504 0.736 120 2HG2 THR 930 2HG2 THR 930 7.357 0.229 1.211 121 3HG2 THR 930 3HG2 THR 930 7.387 -1.101 0.028 122 H GLY 931 H GLY 931 7.326 1.940 -3.348 123 1HA GLY 931 1HA GLY 931 8.619 4.378 -3.549 124 2HA GLY 931 2HA GLY 931 7.718 3.586 -4.826 125 H LEU 932 H LEU 932 5.179 3.637 -3.084 126 HA LEU 932 HA LEU 932 4.340 6.245 -3.967 127 1HB LEU 932 1HB LEU 932 2.500 5.095 -4.325 128 2HB LEU 932 2HB LEU 932 3.151 3.699 -3.488 129 HG LEU 932 HG LEU 932 2.288 4.512 -1.359 130 1HD1 LEU 932 1HD1 LEU 932 2.091 6.715 -1.086 131 2HD1 LEU 932 2HD1 LEU 932 2.001 7.011 -2.839 132 3HD1 LEU 932 3HD1 LEU 932 0.532 6.572 -1.934 133 1HD2 LEU 932 1HD2 LEU 932 0.333 4.345 -3.651 134 2HD2 LEU 932 2HD2 LEU 932 0.783 3.093 -2.468 135 3HD2 LEU 932 3HD2 LEU 932 -0.196 4.489 -1.957 136 H VAL 933 H VAL 933 4.146 4.445 -0.809 137 HA VAL 933 HA VAL 933 3.514 6.688 0.695 138 HB VAL 933 HB VAL 933 4.429 5.264 2.588 139 1HG1 VAL 933 1HG1 VAL 933 2.044 5.251 1.392 140 2HG1 VAL 933 2HG1 VAL 933 2.533 3.585 1.001 141 3HG1 VAL 933 3HG1 VAL 933 2.453 4.114 2.699 142 1HG2 VAL 933 1HG2 VAL 933 4.479 2.773 1.230 143 2HG2 VAL 933 2HG2 VAL 933 5.593 3.860 0.367 144 3HG2 VAL 933 3HG2 VAL 933 5.802 3.574 2.111 145 H LYS 934 H LYS 934 6.601 5.472 -0.572 146 HA LYS 934 HA LYS 934 8.279 6.917 1.144 147 1HB LYS 934 1HB LYS 934 8.617 5.715 -1.604 148 2HB LYS 934 2HB LYS 934 9.911 6.608 -0.832 149 1HG LYS 934 1HG LYS 934 8.668 4.664 1.005 150 2HG LYS 934 2HG LYS 934 9.296 3.891 -0.437 151 1HD LYS 934 1HD LYS 934 11.154 5.918 0.641 152 2HD LYS 934 2HD LYS 934 10.792 4.663 1.810 153 1HE LYS 934 1HE LYS 934 11.923 3.054 0.627 154 2HE LYS 934 2HE LYS 934 11.293 3.602 -0.913 155 1HZ LYS 934 1HZ LYS 934 13.604 4.610 0.552 156 2HZ LYS 934 2HZ LYS 934 13.509 4.125 -1.004 157 3HZ LYS 934 3HZ LYS 934 12.863 5.556 -0.554 158 H ALA 935 H ALA 935 6.794 7.694 -2.059 159 HA ALA 935 HA ALA 935 8.022 10.255 -2.172 160 1HB ALA 935 1HB ALA 935 5.781 10.262 -3.846 161 2HB ALA 935 2HB ALA 935 7.439 9.803 -4.301 162 3HB ALA 935 3HB ALA 935 6.278 8.554 -3.793 163 H VAL 936 H VAL 936 4.777 8.978 -1.220 164 HA VAL 936 HA VAL 936 3.361 11.227 -0.886 165 HB VAL 936 HB VAL 936 3.574 8.689 0.686 166 1HG1 VAL 936 1HG1 VAL 936 1.673 9.310 2.077 167 2HG1 VAL 936 2HG1 VAL 936 3.021 10.441 2.344 168 3HG1 VAL 936 3HG1 VAL 936 1.633 10.931 1.343 169 1HG2 VAL 936 1HG2 VAL 936 2.492 8.629 -1.501 170 2HG2 VAL 936 2HG2 VAL 936 1.299 8.344 -0.212 171 3HG2 VAL 936 3HG2 VAL 936 1.383 9.933 -1.011 172 H ILE 937 H ILE 937 5.801 9.921 1.457 173 HA ILE 937 HA ILE 937 5.500 12.169 3.181 174 HB ILE 937 HB ILE 937 7.494 9.911 3.036 175 1HG1 ILE 937 1HG1 ILE 937 5.352 10.384 5.112 176 2HG1 ILE 937 2HG1 ILE 937 5.022 9.509 3.630 177 1HG2 ILE 937 1HG2 ILE 937 7.211 11.766 5.390 178 2HG2 ILE 937 2HG2 ILE 937 8.522 10.627 4.997 179 3HG2 ILE 937 3HG2 ILE 937 8.335 12.128 4.058 180 1HD1 ILE 937 1HD1 ILE 937 6.781 7.867 4.144 181 2HD1 ILE 937 2HD1 ILE 937 7.251 8.792 5.591 182 3HD1 ILE 937 3HD1 ILE 937 5.661 7.995 5.522 183 H GLU 938 H GLU 938 8.272 11.004 1.131 184 HA GLU 938 HA GLU 938 9.968 12.972 1.355 185 1HB GLU 938 1HB GLU 938 9.507 10.983 -0.537 186 2HB GLU 938 2HB GLU 938 9.462 12.439 -1.512 187 1HG GLU 938 1HG GLU 938 11.737 12.311 -1.524 188 2HG GLU 938 2HG GLU 938 11.659 12.929 0.114 189 H MET 939 H MET 939 6.959 13.164 -0.641 190 HA MET 939 HA MET 939 7.306 15.509 -1.873 191 1HB MET 939 1HB MET 939 5.262 14.309 -2.245 192 2HB MET 939 2HB MET 939 4.899 14.211 -0.533 193 1HG MET 939 1HG MET 939 3.860 16.256 -0.509 194 2HG MET 939 2HG MET 939 5.092 17.003 -1.506 195 1HE MET 939 1HE MET 939 1.980 14.156 -3.369 196 2HE MET 939 2HE MET 939 3.431 13.662 -2.465 197 3HE MET 939 3HE MET 939 2.072 14.433 -1.613 198 H SER 940 H SER 940 5.518 15.302 1.295 199 HA SER 940 HA SER 940 5.325 17.888 1.841 200 1HB SER 940 1HB SER 940 4.962 17.286 4.083 201 2HB SER 940 2HB SER 940 4.653 15.785 3.233 202 HG SER 940 HG SER 940 6.287 14.869 4.263 203 H SER 941 H SER 941 8.265 15.856 2.132 204 HA SER 941 HA SER 941 9.788 17.635 3.591 205 1HB SER 941 1HB SER 941 10.204 15.138 2.825 206 2HB SER 941 2HB SER 941 10.989 15.874 1.442 207 HG SER 941 HG SER 941 12.242 17.162 3.127 208 H LYS 942 H LYS 942 9.254 17.262 0.039 209 HA LYS 942 HA LYS 942 10.701 19.792 -0.328 210 1HB LYS 942 1HB LYS 942 11.332 19.070 -2.500 211 2HB LYS 942 2HB LYS 942 11.706 17.758 -1.401 212 1HG LYS 942 1HG LYS 942 10.189 16.346 -2.372 213 2HG LYS 942 2HG LYS 942 8.955 17.586 -2.471 214 1HD LYS 942 1HD LYS 942 11.088 18.258 -4.318 215 2HD LYS 942 2HD LYS 942 10.629 16.587 -4.581 216 1HE LYS 942 1HE LYS 942 8.594 17.159 -5.456 217 2HE LYS 942 2HE LYS 942 8.282 18.342 -4.201 218 1HZ LYS 942 1HZ LYS 942 9.723 18.697 -6.706 219 2HZ LYS 942 2HZ LYS 942 8.537 19.616 -6.061 220 3HZ LYS 942 3HZ LYS 942 10.050 19.687 -5.449 221 H ILE 943 H ILE 943 7.915 19.463 0.611 222 HA ILE 943 HA ILE 943 6.401 20.248 -1.753 223 HB ILE 943 HB ILE 943 5.735 18.537 0.144 224 1HG1 ILE 943 1HG1 ILE 943 4.477 19.543 -1.958 225 2HG1 ILE 943 2HG1 ILE 943 3.649 18.558 -0.769 226 1HG2 ILE 943 1HG2 ILE 943 5.952 20.078 2.009 227 2HG2 ILE 943 2HG2 ILE 943 4.772 21.183 1.265 228 3HG2 ILE 943 3HG2 ILE 943 4.256 19.572 1.817 229 1HD1 ILE 943 1HD1 ILE 943 2.552 20.818 -1.469 230 2HD1 ILE 943 2HD1 ILE 943 2.621 20.431 0.267 231 3HD1 ILE 943 3HD1 ILE 943 3.791 21.573 -0.438 232 H GLN 944 H GLN 944 7.254 21.421 1.569 233 HA GLN 944 HA GLN 944 5.995 23.772 1.574 234 1HB GLN 944 1HB GLN 944 8.206 22.591 2.952 235 2HB GLN 944 2HB GLN 944 8.691 24.223 2.539 236 1HG GLN 944 1HG GLN 944 6.248 24.847 3.424 237 2HG GLN 944 2HG GLN 944 6.377 23.311 4.259 238 1HE2 GLN 944 1HE2 GLN 944 8.138 22.948 5.699 239 2HE2 GLN 944 2HE2 GLN 944 8.909 24.260 6.525 240 HA PRO 945 HA PRO 945 9.454 25.730 -1.014 241 1HB PRO 945 1HB PRO 945 11.368 24.156 -2.166 242 2HB PRO 945 2HB PRO 945 11.597 24.977 -0.635 243 1HG PRO 945 1HG PRO 945 11.084 22.110 -1.142 244 2HG PRO 945 2HG PRO 945 11.727 22.872 0.299 245 1HD PRO 945 1HD PRO 945 9.060 21.886 -0.076 246 2HD PRO 945 2HD PRO 945 9.670 22.751 1.320 247 H ALA 946 H ALA 946 8.946 22.502 -2.358 248 HA ALA 946 HA ALA 946 8.854 22.942 -4.954 249 1HB ALA 946 1HB ALA 946 7.125 21.349 -3.096 250 2HB ALA 946 2HB ALA 946 6.627 21.460 -4.801 251 3HB ALA 946 3HB ALA 946 8.226 20.801 -4.382 252 HA PRO 947 HA PRO 947 6.050 26.220 -5.552 253 1HB PRO 947 1HB PRO 947 6.248 26.398 -8.272 254 2HB PRO 947 2HB PRO 947 7.382 27.162 -7.176 255 1HG PRO 947 1HG PRO 947 7.746 24.734 -8.822 256 2HG PRO 947 2HG PRO 947 8.965 25.741 -8.067 257 1HD PRO 947 1HD PRO 947 8.051 23.180 -7.155 258 2HD PRO 947 2HD PRO 947 9.184 24.240 -6.340 259 HA PRO 948 HA PRO 948 2.286 24.692 -6.802 260 1HB PRO 948 1HB PRO 948 1.060 26.684 -8.214 261 2HB PRO 948 2HB PRO 948 1.152 26.667 -6.465 262 1HG PRO 948 1HG PRO 948 2.682 28.313 -8.385 263 2HG PRO 948 2HG PRO 948 2.444 28.567 -6.667 264 1HD PRO 948 1HD PRO 948 4.804 27.550 -7.942 265 2HD PRO 948 2HD PRO 948 4.524 27.695 -6.218 266 H GLU 949 H GLU 949 4.476 25.559 -9.226 267 HA GLU 949 HA GLU 949 2.854 24.370 -11.274 268 1HB GLU 949 1HB GLU 949 5.004 26.244 -11.189 269 2HB GLU 949 2HB GLU 949 5.603 24.859 -12.079 270 1HG GLU 949 1HG GLU 949 3.332 24.968 -13.384 271 2HG GLU 949 2HG GLU 949 3.169 26.572 -12.699 272 H GLU 950 H GLU 950 5.291 23.451 -8.948 273 HA GLU 950 HA GLU 950 5.833 21.032 -10.469 274 1HB GLU 950 1HB GLU 950 7.528 22.758 -9.030 275 2HB GLU 950 2HB GLU 950 7.362 21.362 -7.983 276 1HG GLU 950 1HG GLU 950 9.072 20.548 -9.298 277 2HG GLU 950 2HG GLU 950 7.741 20.048 -10.322 278 H TYR 951 H TYR 951 3.704 22.208 -8.178 279 HA TYR 951 HA TYR 951 3.726 19.824 -6.508 280 1HB TYR 951 1HB TYR 951 3.430 22.265 -5.708 281 2HB TYR 951 2HB TYR 951 1.942 22.335 -6.630 282 HD1 TYR 951 HD1 TYR 951 3.186 19.499 -4.540 283 HD2 TYR 951 HD2 TYR 951 0.311 22.639 -4.959 284 HE1 TYR 951 HE1 TYR 951 1.900 18.597 -2.542 285 HE2 TYR 951 HE2 TYR 951 -0.966 21.726 -2.958 286 HH TYR 951 HH TYR 951 -0.734 18.797 -1.859 287 H VAL 952 H VAL 952 1.663 21.550 -8.916 288 HA VAL 952 HA VAL 952 -0.609 20.048 -8.721 289 HB VAL 952 HB VAL 952 0.756 21.655 -10.789 290 1HG1 VAL 952 1HG1 VAL 952 0.227 19.731 -12.162 291 2HG1 VAL 952 2HG1 VAL 952 -1.433 19.682 -11.521 292 3HG1 VAL 952 3HG1 VAL 952 -0.911 21.047 -12.537 293 1HG2 VAL 952 1HG2 VAL 952 -0.926 22.480 -9.087 294 2HG2 VAL 952 2HG2 VAL 952 -1.285 22.891 -10.781 295 3HG2 VAL 952 3HG2 VAL 952 -2.165 21.566 -9.981 296 HA PRO 953 HA PRO 953 1.484 16.853 -11.523 297 1HB PRO 953 1HB PRO 953 4.194 16.929 -11.870 298 2HB PRO 953 2HB PRO 953 3.061 17.626 -13.012 299 1HG PRO 953 1HG PRO 953 4.793 18.998 -11.047 300 2HG PRO 953 2HG PRO 953 3.993 19.662 -12.457 301 1HD PRO 953 1HD PRO 953 3.183 19.965 -9.722 302 2HD PRO 953 2HD PRO 953 2.321 20.530 -11.139 303 H MET 954 H MET 954 3.873 17.783 -9.090 304 HA MET 954 HA MET 954 4.813 15.485 -8.301 305 1HB MET 954 1HB MET 954 4.244 18.033 -7.075 306 2HB MET 954 2HB MET 954 3.809 16.809 -5.899 307 1HG MET 954 1HG MET 954 6.230 15.825 -6.825 308 2HG MET 954 2HG MET 954 6.496 17.552 -6.947 309 1HE MET 954 1HE MET 954 6.026 19.114 -3.870 310 2HE MET 954 2HE MET 954 4.948 18.859 -5.263 311 3HE MET 954 3HE MET 954 4.485 18.250 -3.656 312 H VAL 955 H VAL 955 1.882 16.692 -6.523 313 HA VAL 955 HA VAL 955 1.219 14.276 -5.407 314 HB VAL 955 HB VAL 955 -0.183 16.823 -6.030 315 1HG1 VAL 955 1HG1 VAL 955 -1.910 15.224 -6.627 316 2HG1 VAL 955 2HG1 VAL 955 -1.637 14.318 -5.119 317 3HG1 VAL 955 3HG1 VAL 955 -2.303 15.968 -5.058 318 1HG2 VAL 955 1HG2 VAL 955 1.162 16.656 -4.017 319 2HG2 VAL 955 2HG2 VAL 955 -0.557 16.779 -3.574 320 3HG2 VAL 955 3HG2 VAL 955 0.270 15.205 -3.501 321 H LYS 956 H LYS 956 -0.009 15.745 -8.491 322 HA LYS 956 HA LYS 956 -1.784 13.881 -9.258 323 1HB LYS 956 1HB LYS 956 0.094 15.688 -10.686 324 2HB LYS 956 2HB LYS 956 -0.614 14.401 -11.641 325 1HG LYS 956 1HG LYS 956 -2.427 16.000 -9.829 326 2HG LYS 956 2HG LYS 956 -1.873 16.746 -11.315 327 1HD LYS 956 1HD LYS 956 -3.729 15.699 -12.189 328 2HD LYS 956 2HD LYS 956 -2.623 14.347 -12.335 329 1HE LYS 956 1HE LYS 956 -3.862 13.120 -10.884 330 2HE LYS 956 2HE LYS 956 -3.692 14.348 -9.645 331 1HZ LYS 956 1HZ LYS 956 -5.810 14.026 -11.606 332 2HZ LYS 956 2HZ LYS 956 -5.919 14.348 -10.008 333 3HZ LYS 956 3HZ LYS 956 -5.487 15.528 -11.052 334 H GLU 957 H GLU 957 1.792 13.596 -9.294 335 HA GLU 957 HA GLU 957 1.905 11.265 -10.769 336 1HB GLU 957 1HB GLU 957 3.730 12.975 -9.590 337 2HB GLU 957 2HB GLU 957 3.917 11.541 -8.600 338 1HG GLU 957 1HG GLU 957 3.864 11.296 -11.624 339 2HG GLU 957 2HG GLU 957 5.338 11.785 -10.812 340 H VAL 958 H VAL 958 1.889 11.752 -7.164 341 HA VAL 958 HA VAL 958 2.068 9.231 -6.285 342 HB VAL 958 HB VAL 958 0.369 11.547 -5.403 343 1HG1 VAL 958 1HG1 VAL 958 -0.950 10.078 -4.305 344 2HG1 VAL 958 2HG1 VAL 958 0.222 8.747 -4.462 345 3HG1 VAL 958 3HG1 VAL 958 0.427 9.966 -3.182 346 1HG2 VAL 958 1HG2 VAL 958 2.009 11.637 -3.564 347 2HG2 VAL 958 2HG2 VAL 958 2.851 10.227 -4.252 348 3HG2 VAL 958 3HG2 VAL 958 2.793 11.758 -5.157 349 H GLY 959 H GLY 959 -0.827 10.764 -7.781 350 1HA GLY 959 1HA GLY 959 -2.643 8.689 -7.321 351 2HA GLY 959 2HA GLY 959 -2.718 9.877 -8.607 352 H LEU 960 H LEU 960 -0.397 9.330 -10.103 353 HA LEU 960 HA LEU 960 -1.237 7.241 -11.699 354 1HB LEU 960 1HB LEU 960 0.692 9.233 -11.762 355 2HB LEU 960 2HB LEU 960 1.629 7.753 -11.820 356 HG LEU 960 HG LEU 960 -0.673 8.341 -13.698 357 1HD1 LEU 960 1HD1 LEU 960 2.152 8.513 -14.631 358 2HD1 LEU 960 2HD1 LEU 960 0.696 9.365 -15.198 359 3HD1 LEU 960 3HD1 LEU 960 1.499 9.879 -13.696 360 1HD2 LEU 960 1HD2 LEU 960 0.409 5.935 -13.147 361 2HD2 LEU 960 2HD2 LEU 960 -0.236 6.388 -14.743 362 3HD2 LEU 960 3HD2 LEU 960 1.514 6.480 -14.432 363 H ALA 961 H ALA 961 1.234 7.319 -9.065 364 HA ALA 961 HA ALA 961 2.210 4.766 -9.367 365 1HB ALA 961 1HB ALA 961 1.861 6.671 -7.056 366 2HB ALA 961 2HB ALA 961 2.476 5.027 -6.759 367 3HB ALA 961 3HB ALA 961 3.355 6.122 -7.853 368 H LEU 962 H LEU 962 -0.679 5.925 -7.514 369 HA LEU 962 HA LEU 962 -1.379 3.480 -6.428 370 1HB LEU 962 1HB LEU 962 -2.571 6.103 -6.829 371 2HB LEU 962 2HB LEU 962 -3.762 4.822 -6.924 372 HG LEU 962 HG LEU 962 -2.346 4.105 -4.675 373 1HD1 LEU 962 1HD1 LEU 962 -2.646 6.585 -3.536 374 2HD1 LEU 962 2HD1 LEU 962 -1.103 5.851 -4.037 375 3HD1 LEU 962 3HD1 LEU 962 -1.949 6.977 -5.126 376 1HD2 LEU 962 1HD2 LEU 962 -4.465 3.989 -4.036 377 2HD2 LEU 962 2HD2 LEU 962 -4.468 5.753 -3.799 378 3HD2 LEU 962 3HD2 LEU 962 -4.963 5.064 -5.364 379 H ARG 963 H ARG 963 -2.505 5.023 -9.518 380 HA ARG 963 HA ARG 963 -4.213 3.212 -10.380 381 1HB ARG 963 1HB ARG 963 -2.998 5.318 -11.547 382 2HB ARG 963 2HB ARG 963 -2.088 4.059 -12.358 383 1HG ARG 963 1HG ARG 963 -3.814 3.897 -13.825 384 2HG ARG 963 2HG ARG 963 -4.734 3.143 -12.538 385 1HD ARG 963 1HD ARG 963 -6.127 4.933 -12.420 386 2HD ARG 963 2HD ARG 963 -4.778 6.013 -12.128 387 HE ARG 963 HE ARG 963 -4.824 6.645 -14.382 388 1HH1 ARG 963 2HH2 ARG 963 -6.624 3.647 -13.989 389 2HH1 ARG 963 1HH2 ARG 963 -7.222 3.644 -15.615 390 1HH2 ARG 963 2HH1 ARG 963 -5.612 6.642 -16.527 391 2HH2 ARG 963 1HH1 ARG 963 -6.642 5.359 -17.068 392 H THR 964 H THR 964 -0.608 2.996 -10.823 393 HA THR 964 HA THR 964 -0.676 0.458 -12.056 394 HB THR 964 HB THR 964 1.420 2.210 -10.709 395 HG1 THR 964 HG1 THR 964 0.849 2.805 -12.839 396 1HG2 THR 964 1HG2 THR 964 2.803 0.343 -12.243 397 2HG2 THR 964 2HG2 THR 964 2.727 0.328 -10.464 398 3HG2 THR 964 3HG2 THR 964 1.602 -0.675 -11.412 399 H LEU 965 H LEU 965 -0.633 1.531 -8.661 400 HA LEU 965 HA LEU 965 0.178 -0.861 -7.516 401 1HB LEU 965 1HB LEU 965 -0.339 1.570 -6.591 402 2HB LEU 965 2HB LEU 965 -1.882 0.841 -6.192 403 HG LEU 965 HG LEU 965 0.490 -0.725 -5.364 404 1HD1 LEU 965 1HD1 LEU 965 0.994 1.822 -5.022 405 2HD1 LEU 965 2HD1 LEU 965 -0.145 1.662 -3.664 406 3HD1 LEU 965 3HD1 LEU 965 1.321 0.654 -3.719 407 1HD2 LEU 965 1HD2 LEU 965 -1.005 -1.641 -4.004 408 2HD2 LEU 965 2HD2 LEU 965 -1.419 -0.060 -3.299 409 3HD2 LEU 965 3HD2 LEU 965 -2.248 -0.624 -4.770 410 H LEU 966 H LEU 966 -3.104 0.306 -8.486 411 HA LEU 966 HA LEU 966 -4.545 -1.825 -7.491 412 1HB LEU 966 1HB LEU 966 -4.971 0.008 -9.842 413 2HB LEU 966 2HB LEU 966 -6.143 -1.213 -9.386 414 HG LEU 966 HG LEU 966 -6.073 -0.103 -7.038 415 1HD1 LEU 966 1HD1 LEU 966 -4.216 1.330 -7.173 416 2HD1 LEU 966 2HD1 LEU 966 -4.732 1.999 -8.739 417 3HD1 LEU 966 3HD1 LEU 966 -5.635 2.401 -7.259 418 1HD2 LEU 966 1HD2 LEU 966 -8.123 0.287 -7.822 419 2HD2 LEU 966 2HD2 LEU 966 -7.513 1.888 -8.304 420 3HD2 LEU 966 3HD2 LEU 966 -7.535 0.552 -9.481 421 H ALA 967 H ALA 967 -3.050 -1.407 -10.772 422 HA ALA 967 HA ALA 967 -3.833 -3.878 -11.762 423 1HB ALA 967 1HB ALA 967 -1.204 -2.586 -12.487 424 2HB ALA 967 2HB ALA 967 -2.399 -3.380 -13.539 425 3HB ALA 967 3HB ALA 967 -2.736 -1.765 -12.871 426 H THR 968 H THR 968 -0.690 -2.893 -10.218 427 HA THR 968 HA THR 968 0.471 -5.409 -10.242 428 HB THR 968 HB THR 968 1.955 -4.405 -8.524 429 HG1 THR 968 HG1 THR 968 0.028 -3.504 -7.346 430 1HG2 THR 968 1HG2 THR 968 1.115 -2.929 -10.934 431 2HG2 THR 968 2HG2 THR 968 1.673 -1.833 -9.648 432 3HG2 THR 968 3HG2 THR 968 2.746 -3.120 -10.249 433 H VAL 969 H VAL 969 -1.931 -3.997 -8.006 434 HA VAL 969 HA VAL 969 -1.673 -5.955 -6.020 435 HB VAL 969 HB VAL 969 -3.897 -4.100 -6.862 436 1HG1 VAL 969 1HG1 VAL 969 -3.808 -6.024 -4.520 437 2HG1 VAL 969 2HG1 VAL 969 -4.903 -4.622 -4.603 438 3HG1 VAL 969 3HG1 VAL 969 -5.029 -5.923 -5.811 439 1HG2 VAL 969 1HG2 VAL 969 -1.493 -3.675 -5.493 440 2HG2 VAL 969 2HG2 VAL 969 -2.887 -2.572 -5.580 441 3HG2 VAL 969 3HG2 VAL 969 -2.739 -3.713 -4.222 442 H ASP 970 H ASP 970 -3.705 -5.718 -8.993 443 HA ASP 970 HA ASP 970 -5.335 -7.815 -8.605 444 1HB ASP 970 1HB ASP 970 -5.302 -6.287 -10.600 445 2HB ASP 970 2HB ASP 970 -3.871 -7.106 -11.192 446 H GLU 971 H GLU 971 -1.892 -7.768 -9.684 447 HA GLU 971 HA GLU 971 -1.850 -10.566 -10.166 448 1HB GLU 971 1HB GLU 971 0.383 -8.497 -9.968 449 2HB GLU 971 2HB GLU 971 0.636 -10.166 -10.441 450 1HG GLU 971 1HG GLU 971 -1.218 -9.713 -12.247 451 2HG GLU 971 2HG GLU 971 -0.934 -8.017 -11.909 452 H SER 972 H SER 972 -1.472 -8.452 -7.409 453 HA SER 972 HA SER 972 0.091 -10.358 -5.951 454 1HB SER 972 1HB SER 972 0.403 -7.910 -5.627 455 2HB SER 972 2HB SER 972 -1.251 -7.764 -5.068 456 HG SER 972 HG SER 972 0.889 -8.279 -3.579 457 H LEU 973 H LEU 973 -3.278 -9.551 -6.539 458 HA LEU 973 HA LEU 973 -4.532 -10.311 -4.248 459 1HB LEU 973 1HB LEU 973 -5.213 -9.773 -6.907 460 2HB LEU 973 2HB LEU 973 -5.874 -11.365 -6.589 461 HG LEU 973 HG LEU 973 -6.686 -8.724 -5.550 462 1HD1 LEU 973 1HD1 LEU 973 -8.800 -10.433 -5.264 463 2HD1 LEU 973 2HD1 LEU 973 -8.420 -9.505 -6.734 464 3HD1 LEU 973 3HD1 LEU 973 -7.891 -11.198 -6.589 465 1HD2 LEU 973 1HD2 LEU 973 -7.722 -10.037 -3.507 466 2HD2 LEU 973 2HD2 LEU 973 -6.277 -11.054 -3.722 467 3HD2 LEU 973 3HD2 LEU 973 -6.100 -9.309 -3.417 468 HA PRO 974 HA PRO 974 -4.099 -14.823 -5.574 469 1HB PRO 974 1HB PRO 974 -2.495 -15.496 -7.682 470 2HB PRO 974 2HB PRO 974 -4.227 -15.275 -7.829 471 1HG PRO 974 1HG PRO 974 -2.048 -13.476 -8.697 472 2HG PRO 974 2HG PRO 974 -3.727 -13.488 -9.198 473 1HD PRO 974 1HD PRO 974 -2.496 -11.656 -7.366 474 2HD PRO 974 2HD PRO 974 -4.197 -11.742 -7.779 475 H VAL 975 H VAL 975 -1.261 -12.853 -5.904 476 HA VAL 975 HA VAL 975 0.686 -14.618 -5.217 477 HB VAL 975 HB VAL 975 0.220 -11.712 -4.637 478 1HG1 VAL 975 1HG1 VAL 975 1.581 -11.948 -2.832 479 2HG1 VAL 975 2HG1 VAL 975 2.281 -13.476 -3.418 480 3HG1 VAL 975 3HG1 VAL 975 2.852 -11.925 -4.078 481 1HG2 VAL 975 1HG2 VAL 975 1.783 -11.323 -6.347 482 2HG2 VAL 975 2HG2 VAL 975 2.442 -12.973 -6.249 483 3HG2 VAL 975 3HG2 VAL 975 0.825 -12.701 -6.940 484 H LEU 976 H LEU 976 -1.966 -13.372 -3.238 485 HA LEU 976 HA LEU 976 -0.767 -14.685 -0.905 486 1HB LEU 976 1HB LEU 976 -2.946 -12.596 -1.039 487 2HB LEU 976 2HB LEU 976 -2.306 -13.321 0.422 488 HG LEU 976 HG LEU 976 -1.295 -11.204 0.259 489 1HD1 LEU 976 1HD1 LEU 976 1.113 -11.692 -0.086 490 2HD1 LEU 976 2HD1 LEU 976 0.284 -12.899 0.926 491 3HD1 LEU 976 3HD1 LEU 976 0.664 -13.272 -0.772 492 1HD2 LEU 976 1HD2 LEU 976 -0.241 -10.281 -1.696 493 2HD2 LEU 976 2HD2 LEU 976 -0.485 -11.795 -2.599 494 3HD2 LEU 976 3HD2 LEU 976 -1.887 -10.807 -2.122 495 HA PRO 977 HA PRO 977 -3.840 -17.705 -1.159 496 1HB PRO 977 1HB PRO 977 -3.893 -18.628 1.412 497 2HB PRO 977 2HB PRO 977 -2.676 -19.109 0.246 498 1HG PRO 977 1HG PRO 977 -2.424 -17.241 2.523 499 2HG PRO 977 2HG PRO 977 -1.158 -18.052 1.623 500 1HD PRO 977 1HD PRO 977 -1.944 -15.304 1.381 501 2HD PRO 977 2HD PRO 977 -0.759 -16.146 0.403 502 H ALA 978 H ALA 978 -5.281 -15.753 -1.650 503 HA ALA 978 HA ALA 978 -7.068 -14.492 -1.110 504 1HB ALA 978 1HB ALA 978 -8.864 -15.845 -1.435 505 2HB ALA 978 2HB ALA 978 -7.644 -17.135 -1.569 506 3HB ALA 978 3HB ALA 978 -8.481 -16.858 -0.023 507 H SER 979 H SER 979 -9.114 -15.276 0.966 508 HA SER 979 HA SER 979 -9.568 -14.974 3.074 509 1HB SER 979 1HB SER 979 -6.855 -15.975 3.213 510 2HB SER 979 2HB SER 979 -7.055 -14.735 4.435 511 HG SER 979 HG SER 979 -8.967 -16.874 4.085 512 H THR 980 H THR 980 -6.444 -13.242 2.351 513 HA THR 980 HA THR 980 -7.302 -10.918 3.799 514 HB THR 980 HB THR 980 -4.945 -11.501 3.802 515 HG1 THR 980 HG1 THR 980 -4.316 -9.427 3.146 516 1HG2 THR 980 1HG2 THR 980 -3.686 -11.346 1.546 517 2HG2 THR 980 2HG2 THR 980 -4.638 -12.828 1.798 518 3HG2 THR 980 3HG2 THR 980 -5.274 -11.526 0.764 519 H HIS 981 H HIS 981 -8.205 -12.204 0.829 520 HA HIS 981 HA HIS 981 -8.096 -10.119 -0.919 521 1HB HIS 981 1HB HIS 981 -10.067 -12.348 -0.487 522 2HB HIS 981 2HB HIS 981 -10.369 -11.142 -1.722 523 HD1 HIS 981 HD1 HIS 981 -10.120 -13.342 -3.330 524 HD2 HIS 981 HD2 HIS 981 -6.618 -11.917 -1.512 525 HE1 HIS 981 HE1 HIS 981 -8.174 -14.361 -4.628 526 H ARG 982 H ARG 982 -10.972 -10.895 1.174 527 HA ARG 982 HA ARG 982 -12.503 -8.837 0.713 528 1HB ARG 982 1HB ARG 982 -12.236 -10.678 2.810 529 2HB ARG 982 2HB ARG 982 -12.141 -9.139 3.642 530 1HG ARG 982 1HG ARG 982 -14.370 -8.793 3.395 531 2HG ARG 982 2HG ARG 982 -14.264 -9.015 1.660 532 1HD ARG 982 1HD ARG 982 -15.701 -10.775 2.296 533 2HD ARG 982 2HD ARG 982 -14.149 -11.584 2.208 534 HE ARG 982 HE ARG 982 -14.243 -11.937 4.514 535 1HH1 ARG 982 2HH2 ARG 982 -16.431 -9.310 3.680 536 2HH1 ARG 982 1HH2 ARG 982 -17.082 -9.174 5.280 537 1HH2 ARG 982 2HH1 ARG 982 -15.101 -11.757 6.625 538 2HH2 ARG 982 1HH1 ARG 982 -16.320 -10.575 6.966 539 H GLU 983 H GLU 983 -10.101 -8.669 3.455 540 HA GLU 983 HA GLU 983 -10.334 -5.970 3.830 541 1HB GLU 983 1HB GLU 983 -8.164 -7.989 4.434 542 2HB GLU 983 2HB GLU 983 -7.877 -6.293 4.771 543 1HG GLU 983 1HG GLU 983 -10.208 -6.367 5.991 544 2HG GLU 983 2HG GLU 983 -10.008 -8.108 5.952 545 H ILE 984 H ILE 984 -8.223 -7.837 1.599 546 HA ILE 984 HA ILE 984 -6.560 -5.751 0.826 547 HB ILE 984 HB ILE 984 -7.380 -8.387 -0.266 548 1HG1 ILE 984 1HG1 ILE 984 -4.642 -7.162 0.156 549 2HG1 ILE 984 2HG1 ILE 984 -5.531 -7.996 1.415 550 1HG2 ILE 984 1HG2 ILE 984 -6.412 -6.129 -1.939 551 2HG2 ILE 984 2HG2 ILE 984 -5.643 -7.715 -2.190 552 3HG2 ILE 984 3HG2 ILE 984 -7.406 -7.543 -2.368 553 1HD1 ILE 984 1HD1 ILE 984 -4.389 -9.118 -1.155 554 2HD1 ILE 984 2HD1 ILE 984 -4.200 -9.715 0.511 555 3HD1 ILE 984 3HD1 ILE 984 -5.743 -9.944 -0.347 556 H GLU 985 H GLU 985 -9.764 -6.840 -0.439 557 HA GLU 985 HA GLU 985 -9.826 -5.056 -2.550 558 1HB GLU 985 1HB GLU 985 -11.431 -7.092 -1.647 559 2HB GLU 985 2HB GLU 985 -12.423 -5.706 -1.237 560 1HG GLU 985 1HG GLU 985 -11.310 -5.327 -3.898 561 2HG GLU 985 2HG GLU 985 -12.068 -6.906 -3.812 562 H MET 986 H MET 986 -10.895 -4.766 0.881 563 HA MET 986 HA MET 986 -12.003 -2.197 0.460 564 1HB MET 986 1HB MET 986 -11.423 -4.039 2.788 565 2HB MET 986 2HB MET 986 -11.676 -2.346 3.166 566 1HG MET 986 1HG MET 986 -13.924 -2.493 2.791 567 2HG MET 986 2HG MET 986 -13.696 -3.321 1.263 568 1HE MET 986 1HE MET 986 -13.616 -6.767 1.671 569 2HE MET 986 2HE MET 986 -15.258 -6.087 1.577 570 3HE MET 986 3HE MET 986 -13.913 -5.282 0.734 571 H ALA 987 H ALA 987 -8.803 -3.483 1.128 572 HA ALA 987 HA ALA 987 -7.766 -1.125 2.337 573 1HB ALA 987 1HB ALA 987 -5.626 -2.539 1.273 574 2HB ALA 987 2HB ALA 987 -6.332 -2.783 2.888 575 3HB ALA 987 3HB ALA 987 -6.854 -3.802 1.525 576 H GLN 988 H GLN 988 -8.313 -2.303 -0.962 577 HA GLN 988 HA GLN 988 -6.504 -0.488 -2.145 578 1HB GLN 988 1HB GLN 988 -8.609 -2.406 -3.093 579 2HB GLN 988 2HB GLN 988 -8.146 -1.130 -4.200 580 1HG GLN 988 1HG GLN 988 -5.795 -2.358 -2.923 581 2HG GLN 988 2HG GLN 988 -6.768 -3.550 -3.762 582 1HE2 GLN 988 1HE2 GLN 988 -4.468 -1.112 -4.031 583 2HE2 GLN 988 2HE2 GLN 988 -4.410 -0.936 -5.753 584 H LYS 989 H LYS 989 -10.064 -0.557 -1.540 585 HA LYS 989 HA LYS 989 -10.584 1.856 -2.898 586 1HB LYS 989 1HB LYS 989 -12.323 0.219 -2.518 587 2HB LYS 989 2HB LYS 989 -12.126 0.332 -0.781 588 1HG LYS 989 1HG LYS 989 -12.536 3.002 -1.829 589 2HG LYS 989 2HG LYS 989 -13.778 1.954 -2.486 590 1HD LYS 989 1HD LYS 989 -13.406 1.335 0.331 591 2HD LYS 989 2HD LYS 989 -13.636 3.063 0.150 592 1HE LYS 989 1HE LYS 989 -15.645 2.424 -1.415 593 2HE LYS 989 2HE LYS 989 -15.502 0.824 -0.716 594 1HZ LYS 989 1HZ LYS 989 -17.040 2.256 0.480 595 2HZ LYS 989 2HZ LYS 989 -15.815 1.764 1.442 596 3HZ LYS 989 3HZ LYS 989 -15.830 3.287 0.853 597 H LEU 990 H LEU 990 -9.423 1.028 0.355 598 HA LEU 990 HA LEU 990 -9.994 3.529 1.523 599 1HB LEU 990 1HB LEU 990 -9.048 1.047 2.339 600 2HB LEU 990 2HB LEU 990 -7.691 2.121 2.613 601 HG LEU 990 HG LEU 990 -10.461 2.770 3.628 602 1HD1 LEU 990 1HD1 LEU 990 -9.367 1.900 5.865 603 2HD1 LEU 990 2HD1 LEU 990 -10.214 0.794 4.756 604 3HD1 LEU 990 3HD1 LEU 990 -8.436 0.875 4.747 605 1HD2 LEU 990 1HD2 LEU 990 -8.065 3.629 5.112 606 2HD2 LEU 990 2HD2 LEU 990 -8.226 4.325 3.481 607 3HD2 LEU 990 3HD2 LEU 990 -9.536 4.529 4.669 608 H LEU 991 H LEU 991 -6.838 2.123 0.380 609 HA LEU 991 HA LEU 991 -5.278 4.299 0.650 610 1HB LEU 991 1HB LEU 991 -4.531 2.095 -0.077 611 2HB LEU 991 2HB LEU 991 -5.298 2.324 -1.636 612 HG LEU 991 HG LEU 991 -3.766 4.207 -2.114 613 1HD1 LEU 991 1HD1 LEU 991 -1.757 4.496 -0.652 614 2HD1 LEU 991 2HD1 LEU 991 -3.288 5.039 0.076 615 3HD1 LEU 991 3HD1 LEU 991 -2.568 3.488 0.571 616 1HD2 LEU 991 1HD2 LEU 991 -2.265 2.807 -3.010 617 2HD2 LEU 991 2HD2 LEU 991 -1.821 2.110 -1.434 618 3HD2 LEU 991 3HD2 LEU 991 -3.266 1.523 -2.291 619 H ASN 992 H ASN 992 -7.492 3.595 -2.128 620 HA ASN 992 HA ASN 992 -6.817 5.834 -3.579 621 1HB ASN 992 1HB ASN 992 -8.638 3.693 -3.805 622 2HB ASN 992 2HB ASN 992 -9.683 5.099 -3.747 623 1HD2 ASN 992 1HD2 ASN 992 -6.903 3.649 -5.358 624 2HD2 ASN 992 2HD2 ASN 992 -7.063 4.460 -6.881 625 H SER 993 H SER 993 -9.781 5.230 -1.527 626 HA SER 993 HA SER 993 -10.887 7.652 -1.596 627 1HB SER 993 1HB SER 993 -10.880 5.388 0.265 628 2HB SER 993 2HB SER 993 -11.139 6.898 1.116 629 HG SER 993 HG SER 993 -12.616 6.224 -1.273 630 H ASP 994 H ASP 994 -8.364 6.577 0.797 631 HA ASP 994 HA ASP 994 -8.169 9.023 2.061 632 1HB ASP 994 1HB ASP 994 -6.740 6.472 1.999 633 2HB ASP 994 2HB ASP 994 -5.597 7.794 2.125 634 H LEU 995 H LEU 995 -6.800 7.695 -0.944 635 HA LEU 995 HA LEU 995 -4.692 9.560 -1.212 636 1HB LEU 995 1HB LEU 995 -4.247 7.792 -2.510 637 2HB LEU 995 2HB LEU 995 -5.936 7.410 -2.777 638 HG LEU 995 HG LEU 995 -6.012 9.352 -4.411 639 1HD1 LEU 995 1HD1 LEU 995 -3.069 9.186 -4.753 640 2HD1 LEU 995 2HD1 LEU 995 -4.189 10.547 -5.008 641 3HD1 LEU 995 3HD1 LEU 995 -3.661 10.126 -3.361 642 1HD2 LEU 995 1HD2 LEU 995 -4.046 7.236 -5.271 643 2HD2 LEU 995 2HD2 LEU 995 -5.751 6.851 -4.934 644 3HD2 LEU 995 3HD2 LEU 995 -5.338 8.021 -6.210 645 H ALA 996 H ALA 996 -7.946 9.306 -2.817 646 HA ALA 996 HA ALA 996 -7.891 11.586 -4.269 647 1HB ALA 996 1HB ALA 996 -10.223 11.383 -4.363 648 2HB ALA 996 2HB ALA 996 -9.713 9.738 -3.913 649 3HB ALA 996 3HB ALA 996 -10.345 10.845 -2.671 650 H GLU 997 H GLU 997 -8.679 11.253 -0.752 651 HA GLU 997 HA GLU 997 -9.366 13.867 -0.323 652 1HB GLU 997 1HB GLU 997 -9.465 11.780 1.243 653 2HB GLU 997 2HB GLU 997 -7.833 12.213 1.710 654 1HG GLU 997 1HG GLU 997 -8.656 13.765 3.139 655 2HG GLU 997 2HG GLU 997 -9.357 14.635 1.789 656 H LEU 998 H LEU 998 -6.156 12.312 -0.580 657 HA LEU 998 HA LEU 998 -4.734 14.571 0.400 658 1HB LEU 998 1HB LEU 998 -3.985 12.179 0.451 659 2HB LEU 998 2HB LEU 998 -3.730 12.274 -1.280 660 HG LEU 998 HG LEU 998 -2.380 14.254 0.534 661 1HD1 LEU 998 1HD1 LEU 998 -0.492 12.258 0.082 662 2HD1 LEU 998 2HD1 LEU 998 -1.293 12.649 1.623 663 3HD1 LEU 998 3HD1 LEU 998 -1.961 11.379 0.570 664 1HD2 LEU 998 1HD2 LEU 998 -0.867 13.185 -1.705 665 2HD2 LEU 998 2HD2 LEU 998 -2.430 13.862 -2.221 666 3HD2 LEU 998 3HD2 LEU 998 -1.285 14.868 -1.302 667 H ILE 999 H ILE 999 -5.690 13.314 -2.836 668 HA ILE 999 HA ILE 999 -4.212 15.076 -4.368 669 HB ILE 999 HB ILE 999 -6.905 13.813 -4.884 670 1HG1 ILE 999 1HG1 ILE 999 -4.794 12.385 -4.354 671 2HG1 ILE 999 2HG1 ILE 999 -5.813 11.962 -5.715 672 1HG2 ILE 999 1HG2 ILE 999 -6.355 14.151 -7.283 673 2HG2 ILE 999 2HG2 ILE 999 -6.636 15.667 -6.394 674 3HG2 ILE 999 3HG2 ILE 999 -4.976 15.163 -6.790 675 1HD1 ILE 999 1HD1 ILE 999 -3.490 13.856 -6.138 676 2HD1 ILE 999 2HD1 ILE 999 -3.203 12.102 -6.049 677 3HD1 ILE 999 3HD1 ILE 999 -4.274 12.766 -7.306 678 H ASN1000 H ASN1000 -7.500 15.437 -2.908 679 HA ASN1000 HA ASN1000 -8.065 17.870 -4.037 680 1HB ASN1000 1HB ASN1000 -9.601 16.331 -2.647 681 2HB ASN1000 2HB ASN1000 -8.848 16.994 -1.210 682 1HD2 ASN1000 1HD2 ASN1000 -10.649 17.964 -0.420 683 2HD2 ASN1000 2HD2 ASN1000 -11.414 19.346 -1.130 684 H LYS1001 H LYS1001 -6.664 17.051 -0.769 685 HA LYS1001 HA LYS1001 -6.315 19.473 0.311 686 1HB LYS1001 1HB LYS1001 -4.654 16.975 0.360 687 2HB LYS1001 2HB LYS1001 -4.050 18.412 1.159 688 1HG LYS1001 1HG LYS1001 -6.846 17.289 1.647 689 2HG LYS1001 2HG LYS1001 -5.457 16.848 2.620 690 1HD LYS1001 1HD LYS1001 -5.394 18.879 3.705 691 2HD LYS1001 2HD LYS1001 -5.814 19.783 2.264 692 1HE LYS1001 1HE LYS1001 -8.176 19.235 2.506 693 2HE LYS1001 2HE LYS1001 -7.839 18.063 3.764 694 1HZ LYS1001 1HZ LYS1001 -8.193 19.750 5.128 695 2HZ LYS1001 2HZ LYS1001 -6.722 20.320 4.703 696 3HZ LYS1001 3HZ LYS1001 -8.063 20.886 3.961 697 H MET1002 H MET1002 -4.551 18.109 -2.471 698 HA MET1002 HA MET1002 -2.650 20.228 -2.456 699 1HB MET1002 1HB MET1002 -2.135 17.936 -3.331 700 2HB MET1002 2HB MET1002 -3.385 18.104 -4.547 701 1HG MET1002 1HG MET1002 -1.779 20.405 -4.891 702 2HG MET1002 2HG MET1002 -0.627 19.126 -4.566 703 1HE MET1002 1HE MET1002 -4.150 19.016 -7.142 704 2HE MET1002 2HE MET1002 -3.467 20.449 -6.338 705 3HE MET1002 3HE MET1002 -3.083 20.118 -8.045 706 H LYS1003 H LYS1003 -5.396 19.227 -4.623 707 HA LYS1003 HA LYS1003 -5.288 21.255 -6.424 708 1HB LYS1003 1HB LYS1003 -7.230 19.311 -5.515 709 2HB LYS1003 2HB LYS1003 -8.028 20.821 -5.909 710 1HG LYS1003 1HG LYS1003 -6.346 20.677 -8.042 711 2HG LYS1003 2HG LYS1003 -6.481 18.964 -7.695 712 1HD LYS1003 1HD LYS1003 -8.268 19.355 -9.199 713 2HD LYS1003 2HD LYS1003 -9.056 19.350 -7.634 714 1HE LYS1003 1HE LYS1003 -9.704 21.522 -7.852 715 2HE LYS1003 2HE LYS1003 -8.084 22.037 -8.277 716 1HZ LYS1003 1HZ LYS1003 -10.273 21.572 -9.967 717 2HZ LYS1003 2HZ LYS1003 -8.838 22.269 -10.317 718 3HZ LYS1003 3HZ LYS1003 -9.011 20.649 -10.440 719 H LEU1004 H LEU1004 -6.082 21.416 -3.006 720 HA LEU1004 HA LEU1004 -7.314 24.018 -3.287 721 1HB LEU1004 1HB LEU1004 -6.598 22.527 -0.765 722 2HB LEU1004 2HB LEU1004 -7.701 23.879 -0.932 723 HG LEU1004 HG LEU1004 -8.181 21.215 -2.280 724 1HD1 LEU1004 1HD1 LEU1004 -8.207 20.503 -0.093 725 2HD1 LEU1004 2HD1 LEU1004 -8.752 22.077 0.533 726 3HD1 LEU1004 3HD1 LEU1004 -9.900 21.010 -0.311 727 1HD2 LEU1004 1HD2 LEU1004 -10.609 22.160 -2.003 728 2HD2 LEU1004 2HD2 LEU1004 -9.770 23.726 -1.884 729 3HD2 LEU1004 3HD2 LEU1004 -9.568 22.716 -3.336 730 H ALA1005 H ALA1005 -4.375 22.580 -1.709 731 HA ALA1005 HA ALA1005 -3.214 24.840 -0.780 732 1HB ALA1005 1HB ALA1005 -1.826 23.144 -0.248 733 2HB ALA1005 2HB ALA1005 -2.378 22.163 -1.626 734 3HB ALA1005 3HB ALA1005 -1.092 23.372 -1.853 735 H GLN1006 H GLN1006 -3.303 23.633 -4.170 736 HA GLN1006 HA GLN1006 -1.476 25.238 -5.310 737 1HB GLN1006 1HB GLN1006 -2.662 23.565 -6.595 738 2HB GLN1006 2HB GLN1006 -4.203 24.358 -6.335 739 1HG GLN1006 1HG GLN1006 -3.275 24.812 -8.616 740 2HG GLN1006 2HG GLN1006 -3.519 26.282 -7.693 741 1HE2 GLN1006 1HE2 GLN1006 -1.343 24.353 -9.409 742 2HE2 GLN1006 2HE2 GLN1006 0.132 25.197 -9.076 743 H GLN1007 H GLN1007 -4.840 26.085 -4.337 744 HA GLN1007 HA GLN1007 -4.326 28.801 -5.215 745 1HB GLN1007 1HB GLN1007 -6.497 27.412 -5.732 746 2HB GLN1007 2HB GLN1007 -6.955 27.799 -4.086 747 1HG GLN1007 1HG GLN1007 -6.427 30.278 -4.709 748 2HG GLN1007 2HG GLN1007 -6.418 29.732 -6.374 749 1HE2 GLN1007 1HE2 GLN1007 -8.230 31.374 -4.460 750 2HE2 GLN1007 2HE2 GLN1007 -9.834 30.834 -4.828 751 H TYR1008 H TYR1008 -4.549 26.754 -2.372 752 HA TYR1008 HA TYR1008 -4.885 29.032 -0.597 753 1HB TYR1008 1HB TYR1008 -4.848 25.994 -0.544 754 2HB TYR1008 2HB TYR1008 -4.425 26.801 0.953 755 HD1 TYR1008 HD1 TYR1008 -7.111 25.758 -1.206 756 HD2 TYR1008 HD2 TYR1008 -6.105 28.439 1.972 757 HE1 TYR1008 HE1 TYR1008 -9.577 26.041 -0.654 758 HE2 TYR1008 HE2 TYR1008 -8.574 28.712 2.514 759 HH TYR1008 HH TYR1008 -11.015 27.613 0.398 760 H VAL1009 H VAL1009 -2.458 28.838 -2.328 761 HA VAL1009 HA VAL1009 -0.474 28.561 -0.176 762 HB VAL1009 HB VAL1009 -0.264 26.821 -1.872 763 1HG1 VAL1009 1HG1 VAL1009 -1.292 28.158 -3.738 764 2HG1 VAL1009 2HG1 VAL1009 0.252 29.031 -3.886 765 3HG1 VAL1009 3HG1 VAL1009 0.189 27.278 -4.185 766 1HG2 VAL1009 1HG2 VAL1009 2.093 27.140 -2.408 767 2HG2 VAL1009 2HG2 VAL1009 1.953 28.886 -2.092 768 3HG2 VAL1009 3HG2 VAL1009 1.754 27.722 -0.760 769 H MET1010 H MET1010 -1.267 30.233 -3.300 770 HA MET1010 HA MET1010 0.612 32.197 -3.102 771 1HB MET1010 1HB MET1010 -1.203 33.536 -4.466 772 2HB MET1010 2HB MET1010 -0.608 32.036 -5.150 773 1HG MET1010 1HG MET1010 -2.707 31.173 -5.139 774 2HG MET1010 2HG MET1010 -2.800 31.369 -3.400 775 1HE MET1010 1HE MET1010 -4.208 33.904 -2.303 776 2HE MET1010 2HE MET1010 -5.681 33.330 -3.121 777 3HE MET1010 3HE MET1010 -4.476 32.160 -2.533 778 H THR1011 H THR1011 -2.671 32.012 -1.635 779 HA THR1011 HA THR1011 -2.937 34.610 -0.764 780 HB THR1011 HB THR1011 -4.799 33.133 -0.543 781 HG1 THR1011 HG1 THR1011 -4.653 34.408 1.365 782 1HG2 THR1011 1HG2 THR1011 -3.791 31.290 1.500 783 2HG2 THR1011 2HG2 THR1011 -4.604 30.911 -0.038 784 3HG2 THR1011 3HG2 THR1011 -2.839 31.142 0.003 785 H SER1012 H SER1012 -1.664 31.883 1.270 786 HA SER1012 HA SER1012 0.628 32.851 2.062 787 1HB SER1012 1HB SER1012 -0.131 34.065 4.327 788 2HB SER1012 2HB SER1012 0.120 34.962 2.843 789 HG SER1012 HG SER1012 -1.886 35.640 3.304 790 H LEU1013 H LEU1013 -2.495 31.479 2.927 791 HA LEU1013 HA LEU1013 -1.587 30.199 5.311 792 1HB LEU1013 1HB LEU1013 -3.975 29.290 3.767 793 2HB LEU1013 2HB LEU1013 -3.726 29.380 5.500 794 HG LEU1013 HG LEU1013 -4.290 31.675 3.608 795 1HD1 LEU1013 1HD1 LEU1013 -6.369 30.882 4.028 796 2HD1 LEU1013 2HD1 LEU1013 -5.889 30.096 5.551 797 3HD1 LEU1013 3HD1 LEU1013 -6.175 31.852 5.508 798 1HD2 LEU1013 1HD2 LEU1013 -4.412 32.893 5.969 799 2HD2 LEU1013 2HD2 LEU1013 -3.182 31.673 6.376 800 3HD2 LEU1013 3HD2 LEU1013 -2.906 32.797 5.024 801 H GLN1014 H GLN1014 0.451 29.611 3.767 802 HA GLN1014 HA GLN1014 -0.082 27.203 2.303 803 1HB GLN1014 1HB GLN1014 1.517 28.631 1.268 804 2HB GLN1014 2HB GLN1014 2.373 28.921 2.769 805 1HG GLN1014 1HG GLN1014 3.594 27.339 1.250 806 2HG GLN1014 2HG GLN1014 3.229 26.630 2.811 807 1HE2 GLN1014 1HE2 GLN1014 3.137 26.197 -0.464 808 2HE2 GLN1014 2HE2 GLN1014 1.983 24.912 -0.596 809 H GLN1015 H GLN1015 2.537 27.966 4.703 810 HA GLN1015 HA GLN1015 3.146 25.504 5.448 811 1HB GLN1015 1HB GLN1015 3.461 26.605 7.847 812 2HB GLN1015 2HB GLN1015 4.447 27.116 6.492 813 1HG GLN1015 1HG GLN1015 3.340 29.158 6.262 814 2HG GLN1015 2HG GLN1015 1.818 28.529 6.863 815 1HE2 GLN1015 1HE2 GLN1015 4.124 30.649 7.523 816 2HE2 GLN1015 2HE2 GLN1015 4.133 30.671 9.255 817 H GLU1016 H GLU1016 0.147 27.222 6.213 818 HA GLU1016 HA GLU1016 -0.601 25.513 8.322 819 1HB GLU1016 1HB GLU1016 -1.545 27.752 8.162 820 2HB GLU1016 2HB GLU1016 -2.183 27.431 6.562 821 1HG GLU1016 1HG GLU1016 -4.071 26.521 7.429 822 2HG GLU1016 2HG GLU1016 -3.142 25.381 8.382 823 H TYR1017 H TYR1017 -1.913 25.880 4.941 824 HA TYR1017 HA TYR1017 -3.370 23.473 5.065 825 1HB TYR1017 1HB TYR1017 -2.435 25.569 3.096 826 2HB TYR1017 2HB TYR1017 -2.887 24.034 2.381 827 HD1 TYR1017 HD1 TYR1017 -5.114 23.672 1.797 828 HD2 TYR1017 HD2 TYR1017 -4.204 26.595 4.786 829 HE1 TYR1017 HE1 TYR1017 -7.559 24.365 1.874 830 HE2 TYR1017 HE2 TYR1017 -6.652 27.278 4.853 831 HH TYR1017 HH TYR1017 -9.056 25.562 2.887 832 H LYS1018 H LYS1018 0.010 24.111 4.710 833 HA LYS1018 HA LYS1018 0.610 21.925 2.996 834 1HB LYS1018 1HB LYS1018 1.974 24.065 3.444 835 2HB LYS1018 2HB LYS1018 2.520 23.273 4.909 836 1HG LYS1018 1HG LYS1018 2.679 21.486 2.568 837 2HG LYS1018 2HG LYS1018 3.612 22.952 2.336 838 1HD LYS1018 1HD LYS1018 5.225 21.768 3.474 839 2HD LYS1018 2HD LYS1018 4.377 22.382 4.880 840 1HE LYS1018 1HE LYS1018 3.370 20.329 5.355 841 2HE LYS1018 2HE LYS1018 3.336 19.829 3.676 842 1HZ LYS1018 1HZ LYS1018 5.482 19.135 3.770 843 2HZ LYS1018 2HZ LYS1018 5.917 20.157 4.967 844 3HZ LYS1018 3HZ LYS1018 5.038 18.824 5.311 845 H LYS1019 H LYS1019 0.557 22.473 6.563 846 HA LYS1019 HA LYS1019 1.567 19.925 7.197 847 1HB LYS1019 1HB LYS1019 -0.093 21.868 8.830 848 2HB LYS1019 2HB LYS1019 0.723 20.456 9.472 849 1HG LYS1019 1HG LYS1019 2.223 22.593 7.902 850 2HG LYS1019 2HG LYS1019 1.968 22.731 9.631 851 1HD LYS1019 1HD LYS1019 3.463 21.045 10.131 852 2HD LYS1019 2HD LYS1019 3.015 20.085 8.736 853 1HE LYS1019 1HE LYS1019 4.739 20.915 7.505 854 2HE LYS1019 2HE LYS1019 4.292 22.569 7.872 855 1HZ LYS1019 1HZ LYS1019 5.322 21.641 10.189 856 2HZ LYS1019 2HZ LYS1019 6.289 20.958 9.065 857 3HZ LYS1019 3HZ LYS1019 6.106 22.580 9.107 858 H GLN1020 H GLN1020 -1.670 21.199 6.428 859 HA GLN1020 HA GLN1020 -3.189 19.187 7.469 860 1HB GLN1020 1HB GLN1020 -3.600 20.775 4.898 861 2HB GLN1020 2HB GLN1020 -4.844 19.809 5.664 862 1HG GLN1020 1HG GLN1020 -3.365 22.076 7.078 863 2HG GLN1020 2HG GLN1020 -4.898 22.288 6.255 864 1HE2 GLN1020 1HE2 GLN1020 -4.188 22.608 9.066 865 2HE2 GLN1020 2HE2 GLN1020 -5.232 21.577 9.986 866 H MET1021 H MET1021 -2.013 19.445 4.029 867 HA MET1021 HA MET1021 -2.848 16.944 3.283 868 1HB MET1021 1HB MET1021 -1.248 17.250 1.396 869 2HB MET1021 2HB MET1021 -2.063 18.762 1.739 870 1HG MET1021 1HG MET1021 -0.141 19.786 2.521 871 2HG MET1021 2HG MET1021 0.467 18.323 3.269 872 1HE MET1021 1HE MET1021 0.439 16.144 1.031 873 2HE MET1021 2HE MET1021 2.081 16.366 0.381 874 3HE MET1021 3HE MET1021 1.791 16.499 2.132 875 H LEU1022 H LEU1022 -0.119 17.922 5.269 876 HA LEU1022 HA LEU1022 1.458 15.608 4.807 877 1HB LEU1022 1HB LEU1022 2.342 17.772 5.570 878 2HB LEU1022 2HB LEU1022 1.476 17.595 7.083 879 HG LEU1022 HG LEU1022 3.891 17.060 7.241 880 1HD1 LEU1022 1HD1 LEU1022 3.560 15.507 8.854 881 2HD1 LEU1022 2HD1 LEU1022 1.853 15.899 8.540 882 3HD1 LEU1022 3HD1 LEU1022 2.584 14.453 7.804 883 1HD2 LEU1022 1HD2 LEU1022 4.962 15.675 5.866 884 2HD2 LEU1022 2HD2 LEU1022 3.725 14.408 6.047 885 3HD2 LEU1022 3HD2 LEU1022 3.500 15.707 4.851 886 H THR1023 H THR1023 -0.776 16.650 7.472 887 HA THR1023 HA THR1023 -0.587 14.506 9.116 888 HB THR1023 HB THR1023 -3.286 15.689 8.372 889 HG1 THR1023 HG1 THR1023 -2.483 17.624 9.442 890 1HG2 THR1023 1HG2 THR1023 -1.826 15.276 11.034 891 2HG2 THR1023 2HG2 THR1023 -3.494 15.865 10.836 892 3HG2 THR1023 3HG2 THR1023 -3.084 14.191 10.394 893 H ALA1024 H ALA1024 -2.490 14.680 6.058 894 HA ALA1024 HA ALA1024 -3.687 12.179 6.327 895 1HB ALA1024 1HB ALA1024 -4.674 13.380 4.650 896 2HB ALA1024 2HB ALA1024 -3.150 14.161 4.166 897 3HB ALA1024 3HB ALA1024 -3.504 12.497 3.641 898 H ALA1025 H ALA1025 -0.658 13.181 4.587 899 HA ALA1025 HA ALA1025 0.106 10.790 3.579 900 1HB ALA1025 1HB ALA1025 2.463 11.952 4.595 901 2HB ALA1025 2HB ALA1025 1.739 12.222 2.991 902 3HB ALA1025 3HB ALA1025 1.345 13.313 4.341 903 H HIS1026 H HIS1026 0.019 11.814 6.976 904 HA HIS1026 HA HIS1026 1.738 9.836 7.962 905 1HB HIS1026 1HB HIS1026 0.618 12.031 9.005 906 2HB HIS1026 2HB HIS1026 -0.525 10.855 9.622 907 HD1 HIS1026 HD1 HIS1026 3.300 11.230 9.511 908 HD2 HIS1026 HD2 HIS1026 0.248 9.823 12.021 909 HE1 HIS1026 HE1 HIS1026 4.437 10.488 11.671 910 H ALA1027 H ALA1027 -1.898 10.014 7.961 911 HA ALA1027 HA ALA1027 -2.146 7.303 8.746 912 1HB ALA1027 1HB ALA1027 -3.763 9.546 8.670 913 2HB ALA1027 2HB ALA1027 -4.434 8.545 7.360 914 3HB ALA1027 3HB ALA1027 -4.316 7.889 9.010 915 H LEU1028 H LEU1028 -2.000 9.068 5.641 916 HA LEU1028 HA LEU1028 -2.986 7.040 4.011 917 1HB LEU1028 1HB LEU1028 -1.414 9.517 3.704 918 2HB LEU1028 2HB LEU1028 -1.193 8.334 2.430 919 HG LEU1028 HG LEU1028 -3.014 10.176 2.197 920 1HD1 LEU1028 1HD1 LEU1028 -2.620 8.290 0.637 921 2HD1 LEU1028 2HD1 LEU1028 -3.738 7.295 1.600 922 3HD1 LEU1028 3HD1 LEU1028 -4.334 8.751 0.767 923 1HD2 LEU1028 1HD2 LEU1028 -4.038 9.728 4.418 924 2HD2 LEU1028 2HD2 LEU1028 -5.194 9.654 3.067 925 3HD2 LEU1028 3HD2 LEU1028 -4.591 8.151 3.805 926 H ALA1029 H ALA1029 0.493 7.933 4.598 927 HA ALA1029 HA ALA1029 1.699 5.893 3.341 928 1HB ALA1029 1HB ALA1029 3.409 6.078 5.291 929 2HB ALA1029 2HB ALA1029 3.054 7.541 4.341 930 3HB ALA1029 3HB ALA1029 2.308 7.316 5.942 931 H VAL1030 H VAL1030 0.116 5.787 6.580 932 HA VAL1030 HA VAL1030 0.887 3.110 7.088 933 HB VAL1030 HB VAL1030 -1.093 5.051 8.248 934 1HG1 VAL1030 1HG1 VAL1030 -0.662 2.213 9.237 935 2HG1 VAL1030 2HG1 VAL1030 -1.725 3.450 9.950 936 3HG1 VAL1030 3HG1 VAL1030 -2.098 2.772 8.347 937 1HG2 VAL1030 1HG2 VAL1030 1.641 4.553 8.648 938 2HG2 VAL1030 2HG2 VAL1030 0.568 5.557 9.653 939 3HG2 VAL1030 3HG2 VAL1030 0.824 3.843 10.062 940 H ASP1031 H ASP1031 -2.045 4.710 5.718 941 HA ASP1031 HA ASP1031 -3.748 2.667 5.620 942 1HB ASP1031 1HB ASP1031 -4.074 5.001 4.692 943 2HB ASP1031 2HB ASP1031 -3.144 4.538 3.281 944 H ALA1032 H ALA1032 -1.245 3.475 3.088 945 HA ALA1032 HA ALA1032 -1.691 1.297 1.446 946 1HB ALA1032 1HB ALA1032 -0.317 3.380 0.999 947 2HB ALA1032 2HB ALA1032 0.978 2.655 1.981 948 3HB ALA1032 3HB ALA1032 0.445 1.857 0.482 949 H LYS1033 H LYS1033 0.235 1.642 4.452 950 HA LYS1033 HA LYS1033 1.536 -0.848 4.213 951 1HB LYS1033 1HB LYS1033 1.917 1.322 5.745 952 2HB LYS1033 2HB LYS1033 1.017 0.351 6.894 953 1HG LYS1033 1HG LYS1033 2.775 -1.054 7.233 954 2HG LYS1033 2HG LYS1033 3.024 -1.279 5.512 955 1HD LYS1033 1HD LYS1033 4.507 0.551 5.342 956 2HD LYS1033 2HD LYS1033 3.864 1.342 6.768 957 1HE LYS1033 1HE LYS1033 4.895 -0.353 8.235 958 2HE LYS1033 2HE LYS1033 5.428 -1.282 6.847 959 1HZ LYS1033 1HZ LYS1033 6.314 1.422 7.572 960 2HZ LYS1033 2HZ LYS1033 7.204 0.054 7.619 961 3HZ LYS1033 3HZ LYS1033 6.732 0.671 6.183 962 H ASN1034 H ASN1034 -1.519 0.250 5.785 963 HA ASN1034 HA ASN1034 -2.114 -2.029 7.128 964 1HB ASN1034 1HB ASN1034 -3.387 0.315 6.805 965 2HB ASN1034 2HB ASN1034 -4.302 -0.579 5.607 966 1HD2 ASN1034 1HD2 ASN1034 -5.954 0.118 7.277 967 2HD2 ASN1034 2HD2 ASN1034 -6.338 -1.009 8.535 968 H LEU1035 H LEU1035 -2.586 -1.149 3.660 969 HA LEU1035 HA LEU1035 -4.212 -3.236 2.883 970 1HB LEU1035 1HB LEU1035 -3.929 -1.488 1.387 971 2HB LEU1035 2HB LEU1035 -2.180 -1.522 1.504 972 HG LEU1035 HG LEU1035 -2.012 -3.452 0.125 973 1HD1 LEU1035 1HD1 LEU1035 -4.972 -3.764 -0.203 974 2HD1 LEU1035 2HD1 LEU1035 -3.665 -4.957 -0.393 975 3HD1 LEU1035 3HD1 LEU1035 -4.177 -4.451 1.234 976 1HD2 LEU1035 1HD2 LEU1035 -4.159 -2.214 -1.463 977 2HD2 LEU1035 2HD2 LEU1035 -2.976 -1.066 -0.792 978 3HD2 LEU1035 3HD2 LEU1035 -2.426 -2.413 -1.817 979 H LEU1036 H LEU1036 -0.594 -3.077 2.525 980 HA LEU1036 HA LEU1036 -0.365 -5.789 1.890 981 1HB LEU1036 1HB LEU1036 1.260 -3.579 1.895 982 2HB LEU1036 2HB LEU1036 1.942 -4.533 3.198 983 HG LEU1036 HG LEU1036 1.647 -6.432 1.239 984 1HD1 LEU1036 1HD1 LEU1036 1.964 -3.762 -0.071 985 2HD1 LEU1036 2HD1 LEU1036 2.843 -5.160 -0.736 986 3HD1 LEU1036 3HD1 LEU1036 1.068 -5.204 -0.605 987 1HD2 LEU1036 1HD2 LEU1036 4.188 -5.735 0.802 988 2HD2 LEU1036 2HD2 LEU1036 3.890 -4.767 2.265 989 3HD2 LEU1036 3HD2 LEU1036 3.651 -6.530 2.301 990 H ASP1037 H ASP1037 -0.309 -3.991 4.997 991 HA ASP1037 HA ASP1037 0.709 -5.730 6.693 992 1HB ASP1037 1HB ASP1037 -0.536 -3.521 7.157 993 2HB ASP1037 2HB ASP1037 -2.020 -4.452 7.170 994 H VAL1038 H VAL1038 -2.670 -5.806 5.351 995 HA VAL1038 HA VAL1038 -3.456 -8.124 6.731 996 HB VAL1038 HB VAL1038 -4.485 -6.973 4.130 997 1HG1 VAL1038 1HG1 VAL1038 -5.172 -9.353 5.387 998 2HG1 VAL1038 2HG1 VAL1038 -6.417 -8.210 5.945 999 3HG1 VAL1038 3HG1 VAL1038 -6.158 -8.463 4.202 1000 1HG2 VAL1038 1HG2 VAL1038 -4.314 -5.595 6.470 1001 2HG2 VAL1038 2HG2 VAL1038 -5.587 -5.346 5.251 1002 3HG2 VAL1038 3HG2 VAL1038 -5.899 -6.382 6.664 1003 H ILE1039 H ILE1039 -1.873 -7.522 3.563 1004 HA ILE1039 HA ILE1039 -2.120 -10.112 2.568 1005 HB ILE1039 HB ILE1039 -0.377 -7.755 2.048 1006 1HG1 ILE1039 1HG1 ILE1039 -2.249 -9.427 0.348 1007 2HG1 ILE1039 2HG1 ILE1039 -2.610 -7.871 1.067 1008 1HG2 ILE1039 1HG2 ILE1039 0.311 -10.570 1.355 1009 2HG2 ILE1039 2HG2 ILE1039 0.544 -9.324 0.105 1010 3HG2 ILE1039 3HG2 ILE1039 1.364 -9.171 1.677 1011 1HD1 ILE1039 1HD1 ILE1039 -1.865 -6.976 -0.888 1012 2HD1 ILE1039 2HD1 ILE1039 -0.231 -7.359 -0.297 1013 3HD1 ILE1039 3HD1 ILE1039 -1.077 -8.496 -1.374 1014 H ASP1040 H ASP1040 0.519 -8.549 4.502 1015 HA ASP1040 HA ASP1040 2.292 -10.536 4.563 1016 1HB ASP1040 1HB ASP1040 2.157 -8.223 5.836 1017 2HB ASP1040 2HB ASP1040 1.491 -9.168 7.152 1018 H GLN1041 H GLN1041 -0.725 -10.189 6.536 1019 HA GLN1041 HA GLN1041 -0.291 -12.387 8.162 1020 1HB GLN1041 1HB GLN1041 -1.948 -10.725 8.755 1021 2HB GLN1041 2HB GLN1041 -2.834 -10.976 7.264 1022 1HG GLN1041 1HG GLN1041 -3.701 -13.061 7.964 1023 2HG GLN1041 2HG GLN1041 -2.414 -13.326 9.123 1024 1HE2 GLN1041 1HE2 GLN1041 -5.391 -11.649 8.429 1025 2HE2 GLN1041 2HE2 GLN1041 -5.783 -11.153 10.042 1026 H ALA1042 H ALA1042 -1.580 -12.050 4.857 1027 HA ALA1042 HA ALA1042 -2.596 -14.733 4.789 1028 1HB ALA1042 1HB ALA1042 -2.041 -13.085 2.336 1029 2HB ALA1042 2HB ALA1042 -3.428 -14.135 2.710 1030 3HB ALA1042 3HB ALA1042 -3.294 -12.533 3.472 1031 H ARG1043 H ARG1043 0.432 -13.021 4.100 1032 HA ARG1043 HA ARG1043 1.577 -14.723 2.335 1033 1HB ARG1043 1HB ARG1043 2.492 -12.523 3.341 1034 2HB ARG1043 2HB ARG1043 3.059 -13.476 4.698 1035 1HG ARG1043 1HG ARG1043 4.386 -14.912 3.119 1036 2HG ARG1043 2HG ARG1043 3.840 -13.925 1.777 1037 1HD ARG1043 1HD ARG1043 5.052 -12.006 2.530 1038 2HD ARG1043 2HD ARG1043 5.225 -12.636 4.156 1039 HE ARG1043 HE ARG1043 6.564 -14.529 2.707 1040 1HH1 ARG1043 2HH2 ARG1043 6.730 -11.014 2.678 1041 2HH1 ARG1043 1HH2 ARG1043 8.395 -10.970 2.201 1042 1HH2 ARG1043 2HH1 ARG1043 8.760 -14.471 2.077 1043 2HH2 ARG1043 1HH1 ARG1043 9.557 -12.949 1.857 1044 H LEU1044 H LEU1044 2.291 -14.756 5.911 1045 HA LEU1044 HA LEU1044 3.468 -17.267 5.895 1046 1HB LEU1044 1HB LEU1044 3.416 -17.136 8.246 1047 2HB LEU1044 2HB LEU1044 3.685 -15.516 7.636 1048 HG LEU1044 HG LEU1044 2.177 -15.472 9.530 1049 1HD1 LEU1044 1HD1 LEU1044 0.728 -14.854 6.941 1050 2HD1 LEU1044 2HD1 LEU1044 0.307 -14.222 8.551 1051 3HD1 LEU1044 3HD1 LEU1044 1.861 -13.784 7.801 1052 1HD2 LEU1044 1HD2 LEU1044 -0.106 -16.776 8.213 1053 2HD2 LEU1044 2HD2 LEU1044 1.228 -17.876 8.636 1054 3HD2 LEU1044 3HD2 LEU1044 0.468 -16.873 9.895 1055 H LYS1045 H LYS1045 0.084 -16.263 5.856 1056 HA LYS1045 HA LYS1045 -1.133 -18.469 6.943 1057 1HB LYS1045 1HB LYS1045 -2.066 -16.212 6.005 1058 2HB LYS1045 2HB LYS1045 -2.239 -17.098 4.503 1059 1HG LYS1045 1HG LYS1045 -3.929 -18.445 5.323 1060 2HG LYS1045 2HG LYS1045 -3.233 -18.529 6.930 1061 1HD LYS1045 1HD LYS1045 -4.234 -16.523 7.629 1062 2HD LYS1045 2HD LYS1045 -4.320 -15.870 6.005 1063 1HE LYS1045 1HE LYS1045 -6.444 -16.631 5.780 1064 2HE LYS1045 2HE LYS1045 -5.910 -18.277 6.057 1065 1HZ LYS1045 1HZ LYS1045 -7.443 -17.718 7.728 1066 2HZ LYS1045 2HZ LYS1045 -5.983 -17.745 8.458 1067 3HZ LYS1045 3HZ LYS1045 -6.689 -16.318 8.097 1068 H MET1046 H MET1046 0.797 -18.196 4.046 1069 HA MET1046 HA MET1046 -0.358 -20.472 2.796 1070 1HB MET1046 1HB MET1046 0.743 -18.636 1.507 1071 2HB MET1046 2HB MET1046 2.258 -18.934 2.336 1072 1HG MET1046 1HG MET1046 2.725 -20.848 1.105 1073 2HG MET1046 2HG MET1046 1.039 -21.307 0.969 1074 1HE MET1046 1HE MET1046 2.569 -17.557 -1.022 1075 2HE MET1046 2HE MET1046 3.102 -18.295 0.507 1076 3HE MET1046 3HE MET1046 3.831 -18.812 -1.032 1077 H ILE1047 H ILE1047 2.653 -19.749 4.668 1078 HA ILE1047 HA ILE1047 3.599 -22.427 4.455 1079 HB ILE1047 HB ILE1047 4.415 -20.062 6.138 1080 1HG1 ILE1047 1HG1 ILE1047 6.440 -20.831 4.343 1081 2HG1 ILE1047 2HG1 ILE1047 4.954 -20.908 3.417 1082 1HG2 ILE1047 1HG2 ILE1047 5.213 -22.888 6.310 1083 2HG2 ILE1047 2HG2 ILE1047 6.569 -21.746 6.148 1084 3HG2 ILE1047 3HG2 ILE1047 5.403 -21.559 7.480 1085 1HD1 ILE1047 1HD1 ILE1047 5.273 -18.656 3.162 1086 2HD1 ILE1047 2HD1 ILE1047 4.566 -18.553 4.792 1087 3HD1 ILE1047 3HD1 ILE1047 6.334 -18.549 4.587 1088 H SER1048 H SER1048 2.075 -20.441 7.080 1089 HA SER1048 HA SER1048 1.982 -22.646 8.825 1090 1HB SER1048 1HB SER1048 0.923 -21.172 10.348 1091 2HB SER1048 2HB SER1048 1.969 -20.129 9.406 1092 HG SER1048 HG SER1048 -0.078 -19.872 7.984 1093 H GLN1049 H GLN1049 0.987 -23.920 6.774 1094 HA GLN1049 HA GLN1049 -1.666 -24.464 7.515 1095 1HB GLN1049 1HB GLN1049 -1.347 -22.441 5.515 1096 2HB GLN1049 2HB GLN1049 -1.918 -23.877 4.688 1097 1HG GLN1049 1HG GLN1049 -3.940 -23.933 5.862 1098 2HG GLN1049 2HG GLN1049 -3.266 -23.160 7.283 1099 1HE2 GLN1049 1HE2 GLN1049 -4.262 -21.332 7.630 1100 2HE2 GLN1049 2HE2 GLN1049 -4.647 -20.107 6.468 1101 H SER1050 H SER1050 0.454 -24.592 4.552 1102 HA SER1050 HA SER1050 0.918 -27.342 4.950 1103 1HB SER1050 1HB SER1050 -1.324 -27.613 4.046 1104 2HB SER1050 2HB SER1050 -0.992 -26.502 2.732 1105 HG SER1050 HG SER1050 0.697 -28.063 2.020 1106 H ARG1051 H ARG1051 3.123 -26.778 4.719 1107 HA ARG1051 HA ARG1051 4.020 -25.081 2.716 1108 1HB ARG1051 1HB ARG1051 5.121 -26.475 4.935 1109 2HB ARG1051 2HB ARG1051 6.033 -27.049 3.553 1110 1HG ARG1051 1HG ARG1051 5.584 -24.113 3.540 1111 2HG ARG1051 2HG ARG1051 6.512 -24.672 4.917 1112 1HD ARG1051 1HD ARG1051 8.276 -25.482 3.585 1113 2HD ARG1051 2HD ARG1051 7.249 -25.737 2.188 1114 HE ARG1051 HE ARG1051 7.393 -22.920 2.881 1115 1HH1 ARG1051 2HH2 ARG1051 9.150 -25.512 1.275 1116 2HH1 ARG1051 1HH2 ARG1051 10.041 -24.443 0.244 1117 1HH2 ARG1051 2HH1 ARG1051 8.567 -21.509 1.520 1118 2HH2 ARG1051 1HH1 ARG1051 9.707 -22.150 0.385 1119 HA PRO1052 HA PRO1052 5.019 -29.161 0.462 1120 1HB PRO1052 1HB PRO1052 3.937 -31.501 1.369 1121 2HB PRO1052 2HB PRO1052 5.557 -30.973 1.777 1122 1HG PRO1052 1HG PRO1052 3.125 -30.956 3.457 1123 2HG PRO1052 2HG PRO1052 4.801 -30.842 3.952 1124 1HD PRO1052 1HD PRO1052 2.908 -28.693 3.800 1125 2HD PRO1052 2HD PRO1052 4.613 -28.563 4.183 1126 H HIS1053 H HIS1053 4.106 -29.014 -1.478 1127 HA HIS1053 HA HIS1053 1.279 -28.654 -1.530 1128 1HB HIS1053 1HB HIS1053 2.188 -27.361 -3.151 1129 2HB HIS1053 2HB HIS1053 3.550 -28.433 -3.411 1130 HD1 HIS1053 HD1 HIS1053 2.911 -30.736 -4.816 1131 HD2 HIS1053 HD2 HIS1053 0.271 -27.489 -5.106 1132 HE1 HIS1053 HE1 HIS1053 1.489 -31.154 -6.893 Start of MODEL 15 1 H MET 915 H MET 915 4.632 -22.532 -7.875 2 HA MET 915 HA MET 915 1.832 -22.003 -7.528 3 1HB MET 915 1HB MET 915 4.369 -20.313 -7.748 4 2HB MET 915 2HB MET 915 2.790 -19.553 -7.754 5 1HG MET 915 1HG MET 915 2.660 -19.720 -5.493 6 2HG MET 915 2HG MET 915 2.847 -21.460 -5.580 7 1HE MET 915 1HE MET 915 4.141 -18.137 -5.435 8 2HE MET 915 2HE MET 915 5.239 -18.320 -4.046 9 3HE MET 915 3HE MET 915 5.898 -18.242 -5.697 10 H ALA 916 H ALA 916 0.969 -20.048 -9.001 11 HA ALA 916 HA ALA 916 0.746 -21.079 -11.587 12 1HB ALA 916 1HB ALA 916 -0.438 -19.070 -9.976 13 2HB ALA 916 2HB ALA 916 0.137 -18.250 -11.448 14 3HB ALA 916 3HB ALA 916 -0.974 -19.634 -11.577 15 H ASN 917 H ASN 917 1.035 -18.985 -13.386 16 HA ASN 917 HA ASN 917 3.878 -19.005 -13.651 17 1HB ASN 917 1HB ASN 917 1.926 -19.232 -15.493 18 2HB ASN 917 2HB ASN 917 2.040 -17.483 -15.519 19 1HD2 ASN 917 1HD2 ASN 917 4.044 -16.482 -16.020 20 2HD2 ASN 917 2HD2 ASN 917 5.233 -17.276 -16.997 21 H LEU 918 H LEU 918 3.470 -17.529 -11.417 22 HA LEU 918 HA LEU 918 3.477 -14.733 -12.323 23 1HB LEU 918 1HB LEU 918 1.950 -16.041 -10.321 24 2HB LEU 918 2HB LEU 918 3.086 -14.990 -9.499 25 HG LEU 918 HG LEU 918 1.349 -13.993 -11.760 26 1HD1 LEU 918 1HD1 LEU 918 -0.015 -15.040 -9.904 27 2HD1 LEU 918 2HD1 LEU 918 0.635 -13.778 -8.830 28 3HD1 LEU 918 3HD1 LEU 918 -0.344 -13.324 -10.246 29 1HD2 LEU 918 1HD2 LEU 918 3.156 -12.762 -9.726 30 2HD2 LEU 918 2HD2 LEU 918 2.911 -12.360 -11.443 31 3HD2 LEU 918 3HD2 LEU 918 1.707 -11.859 -10.231 32 H ASP 919 H ASP 919 5.571 -14.147 -12.621 33 HA ASP 919 HA ASP 919 7.727 -15.374 -11.548 34 1HB ASP 919 1HB ASP 919 7.197 -12.564 -12.532 35 2HB ASP 919 2HB ASP 919 8.755 -12.914 -11.810 36 H ARG 920 H ARG 920 9.401 -13.989 -10.028 37 HA ARG 920 HA ARG 920 8.096 -13.834 -7.541 38 1HB ARG 920 1HB ARG 920 10.365 -13.306 -6.662 39 2HB ARG 920 2HB ARG 920 10.424 -14.666 -7.765 40 1HG ARG 920 1HG ARG 920 10.848 -12.688 -9.567 41 2HG ARG 920 2HG ARG 920 11.452 -11.863 -8.144 42 1HD ARG 920 1HD ARG 920 12.364 -14.702 -8.670 43 2HD ARG 920 2HD ARG 920 13.065 -13.405 -9.617 44 HE ARG 920 HE ARG 920 14.076 -12.507 -7.652 45 1HH1 ARG 920 2HH2 ARG 920 12.039 -15.303 -6.882 46 2HH1 ARG 920 1HH2 ARG 920 12.693 -15.497 -5.290 47 1HH2 ARG 920 1HH1 ARG 920 14.396 -13.993 -4.528 48 H SER 921 H SER 921 6.626 -12.012 -8.718 49 HA SER 921 HA SER 921 7.896 -9.439 -8.620 50 1HB SER 921 1HB SER 921 5.315 -10.557 -9.636 51 2HB SER 921 2HB SER 921 5.259 -8.893 -9.092 52 HG SER 921 HG SER 921 7.140 -8.488 -10.522 53 H ASN 922 H ASN 922 7.832 -10.850 -6.106 54 HA ASN 922 HA ASN 922 5.599 -9.979 -4.620 55 1HB ASN 922 1HB ASN 922 7.845 -11.721 -4.244 56 2HB ASN 922 2HB ASN 922 7.962 -10.514 -2.978 57 1HD2 ASN 922 1HD2 ASN 922 7.159 -11.278 -1.184 58 2HD2 ASN 922 2HD2 ASN 922 5.676 -12.151 -0.981 59 H ASP 923 H ASP 923 9.001 -8.911 -5.178 60 HA ASP 923 HA ASP 923 8.901 -6.882 -3.229 61 1HB ASP 923 1HB ASP 923 10.841 -8.074 -4.938 62 2HB ASP 923 2HB ASP 923 10.808 -6.382 -5.393 63 H LYS 924 H LYS 924 7.865 -7.282 -6.566 64 HA LYS 924 HA LYS 924 8.028 -4.619 -7.424 65 1HB LYS 924 1HB LYS 924 7.809 -6.434 -8.994 66 2HB LYS 924 2HB LYS 924 6.285 -6.939 -8.292 67 1HG LYS 924 1HG LYS 924 5.426 -5.662 -10.013 68 2HG LYS 924 2HG LYS 924 5.615 -4.376 -8.836 69 1HD LYS 924 1HD LYS 924 7.220 -3.345 -10.077 70 2HD LYS 924 2HD LYS 924 8.126 -4.831 -10.278 71 1HE LYS 924 1HE LYS 924 6.240 -5.472 -12.010 72 2HE LYS 924 2HE LYS 924 5.862 -3.761 -11.996 73 1HZ LYS 924 1HZ LYS 924 7.622 -4.713 -13.609 74 2HZ LYS 924 2HZ LYS 924 7.850 -3.246 -12.928 75 3HZ LYS 924 3HZ LYS 924 8.635 -4.551 -12.339 76 H VAL 925 H VAL 925 5.165 -6.515 -6.221 77 HA VAL 925 HA VAL 925 3.480 -4.306 -6.076 78 HB VAL 925 HB VAL 925 3.495 -6.917 -4.551 79 1HG1 VAL 925 1HG1 VAL 925 0.895 -5.646 -5.001 80 2HG1 VAL 925 2HG1 VAL 925 1.582 -6.359 -3.522 81 3HG1 VAL 925 3HG1 VAL 925 1.969 -4.678 -3.963 82 1HG2 VAL 925 1HG2 VAL 925 3.330 -6.698 -7.207 83 2HG2 VAL 925 2HG2 VAL 925 2.369 -7.885 -6.292 84 3HG2 VAL 925 3HG2 VAL 925 1.628 -6.354 -6.814 85 H TYR 926 H TYR 926 5.837 -5.703 -3.754 86 HA TYR 926 HA TYR 926 5.032 -4.057 -1.592 87 1HB TYR 926 1HB TYR 926 7.417 -5.768 -2.454 88 2HB TYR 926 2HB TYR 926 7.562 -4.802 -0.999 89 HD1 TYR 926 HD1 TYR 926 7.594 -6.357 0.751 90 HD2 TYR 926 HD2 TYR 926 4.593 -6.689 -2.281 91 HE1 TYR 926 HE1 TYR 926 6.444 -8.194 2.080 92 HE2 TYR 926 HE2 TYR 926 3.454 -8.525 -0.942 93 HH TYR 926 HH TYR 926 4.349 -9.206 2.309 94 H GLU 927 H GLU 927 6.885 -3.498 -4.493 95 HA GLU 927 HA GLU 927 8.527 -1.480 -3.384 96 1HB GLU 927 1HB GLU 927 8.255 -2.871 -5.894 97 2HB GLU 927 2HB GLU 927 8.227 -1.151 -6.228 98 1HG GLU 927 1HG GLU 927 10.538 -1.669 -6.255 99 2HG GLU 927 2HG GLU 927 10.300 -0.983 -4.660 100 H ASN 928 H ASN 928 5.930 -1.266 -5.930 101 HA ASN 928 HA ASN 928 5.598 1.347 -6.021 102 1HB ASN 928 1HB ASN 928 3.238 -0.592 -5.792 103 2HB ASN 928 2HB ASN 928 3.238 0.941 -6.641 104 1HD2 ASN 928 1HD2 ASN 928 2.634 -1.666 -7.672 105 2HD2 ASN 928 2HD2 ASN 928 3.744 -2.016 -8.954 106 H VAL 929 H VAL 929 4.190 -0.908 -3.553 107 HA VAL 929 HA VAL 929 2.609 0.866 -2.177 108 HB VAL 929 HB VAL 929 4.220 -1.524 -1.280 109 1HG1 VAL 929 1HG1 VAL 929 1.948 -0.252 0.268 110 2HG1 VAL 929 2HG1 VAL 929 3.030 -1.569 0.780 111 3HG1 VAL 929 3HG1 VAL 929 3.663 0.085 0.604 112 1HG2 VAL 929 1HG2 VAL 929 1.288 -1.687 -1.339 113 2HG2 VAL 929 2HG2 VAL 929 2.015 -1.363 -2.932 114 3HG2 VAL 929 3HG2 VAL 929 2.514 -2.796 -2.001 115 H THR 930 H THR 930 6.070 -0.014 -1.480 116 HA THR 930 HA THR 930 6.337 2.012 0.486 117 HB THR 930 HB THR 930 8.863 1.370 -0.031 118 HG1 THR 930 HG1 THR 930 8.825 -0.680 -1.264 119 1HG2 THR 930 1HG2 THR 930 8.301 -1.104 0.811 120 2HG2 THR 930 2HG2 THR 930 8.062 0.280 1.904 121 3HG2 THR 930 3HG2 THR 930 6.672 -0.426 1.046 122 H GLY 931 H GLY 931 7.739 1.760 -2.856 123 1HA GLY 931 1HA GLY 931 8.964 4.103 -3.145 124 2HA GLY 931 2HA GLY 931 7.962 3.412 -4.406 125 H LEU 932 H LEU 932 5.364 3.667 -3.417 126 HA LEU 932 HA LEU 932 4.935 6.445 -3.826 127 1HB LEU 932 1HB LEU 932 2.865 5.827 -4.335 128 2HB LEU 932 2HB LEU 932 3.526 4.204 -4.333 129 HG LEU 932 HG LEU 932 2.796 3.974 -1.939 130 1HD1 LEU 932 1HD1 LEU 932 0.749 5.880 -1.785 131 2HD1 LEU 932 2HD1 LEU 932 2.237 5.802 -0.811 132 3HD1 LEU 932 3HD1 LEU 932 2.196 6.781 -2.298 133 1HD2 LEU 932 1HD2 LEU 932 1.472 2.919 -3.598 134 2HD2 LEU 932 2HD2 LEU 932 0.345 3.770 -2.515 135 3HD2 LEU 932 3HD2 LEU 932 0.745 4.462 -4.106 136 H VAL 933 H VAL 933 4.520 4.186 -1.022 137 HA VAL 933 HA VAL 933 3.510 5.984 0.778 138 HB VAL 933 HB VAL 933 5.040 3.457 0.860 139 1HG1 VAL 933 1HG1 VAL 933 5.141 5.469 3.074 140 2HG1 VAL 933 2HG1 VAL 933 4.926 3.754 3.499 141 3HG1 VAL 933 3HG1 VAL 933 6.350 4.267 2.562 142 1HG2 VAL 933 1HG2 VAL 933 2.937 3.671 2.799 143 2HG2 VAL 933 2HG2 VAL 933 2.371 4.359 1.258 144 3HG2 VAL 933 3HG2 VAL 933 2.996 2.693 1.313 145 H LYS 934 H LYS 934 6.918 5.434 -0.244 146 HA LYS 934 HA LYS 934 8.077 7.098 1.677 147 1HB LYS 934 1HB LYS 934 9.048 6.367 -1.103 148 2HB LYS 934 2HB LYS 934 10.028 7.076 0.165 149 1HG LYS 934 1HG LYS 934 8.862 4.910 1.475 150 2HG LYS 934 2HG LYS 934 9.082 4.282 -0.146 151 1HD LYS 934 1HD LYS 934 11.468 4.778 -0.105 152 2HD LYS 934 2HD LYS 934 11.313 5.695 1.380 153 1HE LYS 934 1HE LYS 934 10.830 3.713 2.677 154 2HE LYS 934 2HE LYS 934 10.555 2.747 1.241 155 1HZ LYS 934 1HZ LYS 934 13.067 3.659 2.364 156 2HZ LYS 934 2HZ LYS 934 12.676 2.199 1.746 157 3HZ LYS 934 3HZ LYS 934 12.987 3.452 0.746 158 H ALA 935 H ALA 935 6.914 7.735 -1.692 159 HA ALA 935 HA ALA 935 7.682 10.409 -1.763 160 1HB ALA 935 1HB ALA 935 5.998 8.539 -3.284 161 2HB ALA 935 2HB ALA 935 5.401 10.215 -3.340 162 3HB ALA 935 3HB ALA 935 7.062 9.844 -3.861 163 H VAL 936 H VAL 936 4.582 8.831 -0.744 164 HA VAL 936 HA VAL 936 2.990 10.923 -0.306 165 HB VAL 936 HB VAL 936 3.492 8.375 1.156 166 1HG1 VAL 936 1HG1 VAL 936 1.307 9.060 2.485 167 2HG1 VAL 936 2HG1 VAL 936 2.926 9.478 3.095 168 3HG1 VAL 936 3HG1 VAL 936 1.951 10.702 2.247 169 1HG2 VAL 936 1HG2 VAL 936 2.138 7.916 -0.621 170 2HG2 VAL 936 2HG2 VAL 936 0.880 8.369 0.554 171 3HG2 VAL 936 3HG2 VAL 936 1.435 9.552 -0.655 172 H ILE 937 H ILE 937 5.684 9.871 1.872 173 HA ILE 937 HA ILE 937 5.235 12.169 3.559 174 HB ILE 937 HB ILE 937 7.074 9.799 3.602 175 1HG1 ILE 937 1HG1 ILE 937 5.863 10.034 6.052 176 2HG1 ILE 937 2HG1 ILE 937 4.626 10.682 4.993 177 1HG2 ILE 937 1HG2 ILE 937 8.660 10.970 4.629 178 2HG2 ILE 937 2HG2 ILE 937 7.637 12.425 4.702 179 3HG2 ILE 937 3HG2 ILE 937 7.520 11.190 5.978 180 1HD1 ILE 937 1HD1 ILE 937 5.631 8.399 3.637 181 2HD1 ILE 937 2HD1 ILE 937 5.469 7.917 5.343 182 3HD1 ILE 937 3HD1 ILE 937 4.061 8.555 4.460 183 H GLU 938 H GLU 938 8.052 10.879 1.648 184 HA GLU 938 HA GLU 938 9.762 12.833 1.802 185 1HB GLU 938 1HB GLU 938 9.348 10.761 0.023 186 2HB GLU 938 2HB GLU 938 9.246 12.147 -1.045 187 1HG GLU 938 1HG GLU 938 11.517 12.168 -1.071 188 2HG GLU 938 2HG GLU 938 11.453 12.757 0.579 189 H MET 939 H MET 939 6.858 12.962 -0.368 190 HA MET 939 HA MET 939 7.276 15.290 -1.609 191 1HB MET 939 1HB MET 939 5.278 14.026 -2.088 192 2HB MET 939 2HB MET 939 4.771 14.026 -0.411 193 1HG MET 939 1HG MET 939 3.874 16.170 -0.528 194 2HG MET 939 2HG MET 939 5.056 16.723 -1.697 195 1HE MET 939 1HE MET 939 3.561 13.231 -2.842 196 2HE MET 939 2HE MET 939 2.770 13.740 -1.331 197 3HE MET 939 3HE MET 939 1.836 13.668 -2.845 198 H SER 940 H SER 940 5.243 15.124 1.409 199 HA SER 940 HA SER 940 4.956 17.691 1.915 200 1HB SER 940 1HB SER 940 4.778 15.304 3.406 201 2HB SER 940 2HB SER 940 5.796 16.342 4.384 202 HG SER 940 HG SER 940 3.095 16.456 4.025 203 H SER 941 H SER 941 7.965 15.797 2.351 204 HA SER 941 HA SER 941 9.349 17.652 3.853 205 1HB SER 941 1HB SER 941 10.723 15.940 1.771 206 2HB SER 941 2HB SER 941 11.270 16.354 3.383 207 HG SER 941 HG SER 941 9.646 14.963 4.275 208 H LYS 942 H LYS 942 9.193 17.129 0.262 209 HA LYS 942 HA LYS 942 10.456 19.757 -0.059 210 1HB LYS 942 1HB LYS 942 11.276 19.035 -2.152 211 2HB LYS 942 2HB LYS 942 11.587 17.719 -1.038 212 1HG LYS 942 1HG LYS 942 10.347 16.302 -2.299 213 2HG LYS 942 2HG LYS 942 8.944 17.340 -2.143 214 1HD LYS 942 1HD LYS 942 10.493 18.743 -3.982 215 2HD LYS 942 2HD LYS 942 10.857 17.080 -4.398 216 1HE LYS 942 1HE LYS 942 8.526 16.556 -4.777 217 2HE LYS 942 2HE LYS 942 7.990 18.037 -4.010 218 1HZ LYS 942 1HZ LYS 942 7.897 18.496 -6.243 219 2HZ LYS 942 2HZ LYS 942 9.333 19.158 -5.836 220 3HZ LYS 942 3HZ LYS 942 9.286 17.717 -6.604 221 H ILE 943 H ILE 943 7.626 19.269 0.716 222 HA ILE 943 HA ILE 943 6.219 19.959 -1.737 223 HB ILE 943 HB ILE 943 5.550 18.276 0.226 224 1HG1 ILE 943 1HG1 ILE 943 4.438 18.650 -1.980 225 2HG1 ILE 943 2HG1 ILE 943 3.340 18.272 -0.668 226 1HG2 ILE 943 1HG2 ILE 943 3.781 19.350 1.620 227 2HG2 ILE 943 2HG2 ILE 943 5.437 19.878 2.005 228 3HG2 ILE 943 3HG2 ILE 943 4.364 20.935 1.057 229 1HD1 ILE 943 1HD1 ILE 943 3.239 20.525 -2.385 230 2HD1 ILE 943 2HD1 ILE 943 2.241 20.233 -0.940 231 3HD1 ILE 943 3HD1 ILE 943 3.758 21.155 -0.803 232 H GLN 944 H GLN 944 6.767 21.222 1.620 233 HA GLN 944 HA GLN 944 5.419 23.531 1.431 234 1HB GLN 944 1HB GLN 944 7.562 22.462 3.052 235 2HB GLN 944 2HB GLN 944 7.897 24.153 2.734 236 1HG GLN 944 1HG GLN 944 5.410 24.588 3.388 237 2HG GLN 944 2HG GLN 944 5.417 22.957 4.030 238 1HE2 GLN 944 1HE2 GLN 944 5.862 26.124 4.756 239 2HE2 GLN 944 2HE2 GLN 944 6.840 26.014 6.181 240 HA PRO 945 HA PRO 945 9.126 25.517 -0.769 241 1HB PRO 945 1HB PRO 945 11.150 23.945 -1.718 242 2HB PRO 945 2HB PRO 945 11.221 24.770 -0.173 243 1HG PRO 945 1HG PRO 945 10.768 21.901 -0.724 244 2HG PRO 945 2HG PRO 945 11.260 22.667 0.774 245 1HD PRO 945 1HD PRO 945 8.647 21.674 0.132 246 2HD PRO 945 2HD PRO 945 9.111 22.543 1.581 247 H ALA 946 H ALA 946 8.668 22.289 -2.117 248 HA ALA 946 HA ALA 946 8.873 22.691 -4.719 249 1HB ALA 946 1HB ALA 946 6.973 21.146 -3.011 250 2HB ALA 946 2HB ALA 946 6.561 21.289 -4.737 251 3HB ALA 946 3HB ALA 946 8.119 20.579 -4.249 252 HA PRO 947 HA PRO 947 6.229 26.008 -5.683 253 1HB PRO 947 1HB PRO 947 6.627 26.056 -8.386 254 2HB PRO 947 2HB PRO 947 7.710 26.827 -7.244 255 1HG PRO 947 1HG PRO 947 8.091 24.315 -8.755 256 2HG PRO 947 2HG PRO 947 9.293 25.309 -7.958 257 1HD PRO 947 1HD PRO 947 8.215 22.828 -7.006 258 2HD PRO 947 2HD PRO 947 9.329 23.880 -6.157 259 HA PRO 948 HA PRO 948 2.504 24.559 -7.125 260 1HB PRO 948 1HB PRO 948 1.445 26.545 -8.675 261 2HB PRO 948 2HB PRO 948 1.421 26.582 -6.923 262 1HG PRO 948 1HG PRO 948 3.132 28.112 -8.786 263 2HG PRO 948 2HG PRO 948 2.791 28.429 -7.096 264 1HD PRO 948 1HD PRO 948 5.192 27.293 -8.179 265 2HD PRO 948 2HD PRO 948 4.804 27.503 -6.483 266 H GLU 949 H GLU 949 4.911 25.200 -9.382 267 HA GLU 949 HA GLU 949 3.376 24.032 -11.517 268 1HB GLU 949 1HB GLU 949 5.746 25.709 -11.283 269 2HB GLU 949 2HB GLU 949 6.097 24.324 -12.298 270 1HG GLU 949 1HG GLU 949 3.907 24.842 -13.556 271 2HG GLU 949 2HG GLU 949 3.846 26.349 -12.664 272 H GLU 950 H GLU 950 5.633 23.109 -9.006 273 HA GLU 950 HA GLU 950 6.153 20.609 -10.398 274 1HB GLU 950 1HB GLU 950 7.823 22.323 -8.898 275 2HB GLU 950 2HB GLU 950 7.553 20.948 -7.847 276 1HG GLU 950 1HG GLU 950 9.439 20.301 -9.132 277 2HG GLU 950 2HG GLU 950 8.109 19.464 -9.907 278 H TYR 951 H TYR 951 3.964 21.973 -8.260 279 HA TYR 951 HA TYR 951 3.770 19.631 -6.538 280 1HB TYR 951 1HB TYR 951 3.602 22.088 -5.774 281 2HB TYR 951 2HB TYR 951 2.180 22.262 -6.783 282 HD1 TYR 951 HD1 TYR 951 0.524 22.752 -5.167 283 HD2 TYR 951 HD2 TYR 951 3.034 19.326 -4.646 284 HE1 TYR 951 HE1 TYR 951 -0.934 21.968 -3.238 285 HE2 TYR 951 HE2 TYR 951 1.567 18.553 -2.719 286 HH TYR 951 HH TYR 951 -0.563 18.817 -1.863 287 H VAL 952 H VAL 952 1.953 21.423 -9.087 288 HA VAL 952 HA VAL 952 -0.429 20.080 -8.958 289 HB VAL 952 HB VAL 952 1.124 21.561 -10.986 290 1HG1 VAL 952 1HG1 VAL 952 -0.839 20.978 -12.650 291 2HG1 VAL 952 2HG1 VAL 952 0.613 19.954 -12.560 292 3HG1 VAL 952 3HG1 VAL 952 -0.880 19.454 -11.731 293 1HG2 VAL 952 1HG2 VAL 952 -0.401 23.106 -10.478 294 2HG2 VAL 952 2HG2 VAL 952 -1.721 22.027 -10.989 295 3HG2 VAL 952 3HG2 VAL 952 -1.123 21.970 -9.313 296 HA PRO 953 HA PRO 953 1.575 16.708 -11.612 297 1HB PRO 953 1HB PRO 953 4.297 16.604 -11.836 298 2HB PRO 953 2HB PRO 953 3.264 17.351 -13.039 299 1HG PRO 953 1HG PRO 953 4.992 18.645 -11.019 300 2HG PRO 953 2HG PRO 953 4.299 19.333 -12.474 301 1HD PRO 953 1HD PRO 953 3.390 19.737 -9.784 302 2HD PRO 953 2HD PRO 953 2.630 20.330 -11.247 303 H MET 954 H MET 954 3.903 17.530 -9.084 304 HA MET 954 HA MET 954 4.648 15.179 -8.222 305 1HB MET 954 1HB MET 954 4.222 17.791 -7.067 306 2HB MET 954 2HB MET 954 3.663 16.624 -5.884 307 1HG MET 954 1HG MET 954 6.042 15.460 -6.721 308 2HG MET 954 2HG MET 954 6.428 17.165 -6.843 309 1HE MET 954 1HE MET 954 5.107 18.676 -5.212 310 2HE MET 954 2HE MET 954 4.208 17.981 -3.842 311 3HE MET 954 3HE MET 954 5.820 18.688 -3.581 312 H VAL 955 H VAL 955 1.619 16.675 -6.855 313 HA VAL 955 HA VAL 955 0.750 14.398 -5.561 314 HB VAL 955 HB VAL 955 -0.341 16.987 -6.417 315 1HG1 VAL 955 1HG1 VAL 955 -2.113 14.560 -6.180 316 2HG1 VAL 955 2HG1 VAL 955 -2.705 16.169 -5.698 317 3HG1 VAL 955 3HG1 VAL 955 -2.161 15.884 -7.369 318 1HG2 VAL 955 1HG2 VAL 955 -1.425 16.074 -3.954 319 2HG2 VAL 955 2HG2 VAL 955 0.276 15.554 -4.007 320 3HG2 VAL 955 3HG2 VAL 955 -0.137 17.273 -4.216 321 H LYS 956 H LYS 956 -0.099 15.628 -8.870 322 HA LYS 956 HA LYS 956 -1.863 13.694 -9.599 323 1HB LYS 956 1HB LYS 956 -0.440 15.768 -10.844 324 2HB LYS 956 2HB LYS 956 -0.052 14.339 -11.781 325 1HG LYS 956 1HG LYS 956 -2.100 14.396 -12.747 326 2HG LYS 956 2HG LYS 956 -2.860 14.208 -11.180 327 1HD LYS 956 1HD LYS 956 -3.720 16.290 -11.543 328 2HD LYS 956 2HD LYS 956 -2.129 16.877 -11.099 329 1HE LYS 956 1HE LYS 956 -1.720 17.608 -13.214 330 2HE LYS 956 2HE LYS 956 -2.135 16.051 -13.901 331 1HZ LYS 956 1HZ LYS 956 -3.823 17.250 -14.714 332 2HZ LYS 956 2HZ LYS 956 -4.525 16.934 -13.274 333 3HZ LYS 956 3HZ LYS 956 -3.794 18.372 -13.527 334 H GLU 957 H GLU 957 1.648 13.443 -9.157 335 HA GLU 957 HA GLU 957 1.977 11.088 -10.603 336 1HB GLU 957 1HB GLU 957 3.677 12.841 -9.451 337 2HB GLU 957 2HB GLU 957 3.686 11.624 -8.191 338 1HG GLU 957 1HG GLU 957 3.992 10.671 -11.031 339 2HG GLU 957 2HG GLU 957 5.353 11.509 -10.315 340 H VAL 958 H VAL 958 1.391 11.728 -7.082 341 HA VAL 958 HA VAL 958 1.551 9.195 -6.114 342 HB VAL 958 HB VAL 958 -0.070 11.613 -5.444 343 1HG1 VAL 958 1HG1 VAL 958 -0.672 10.191 -3.285 344 2HG1 VAL 958 2HG1 VAL 958 -1.717 10.181 -4.726 345 3HG1 VAL 958 3HG1 VAL 958 -0.583 8.839 -4.439 346 1HG2 VAL 958 1HG2 VAL 958 1.739 10.099 -3.581 347 2HG2 VAL 958 2HG2 VAL 958 2.442 11.091 -4.882 348 3HG2 VAL 958 3HG2 VAL 958 1.388 11.842 -3.660 349 H GLY 959 H GLY 959 -1.255 10.761 -7.774 350 1HA GLY 959 1HA GLY 959 -3.087 8.688 -7.488 351 2HA GLY 959 2HA GLY 959 -3.061 9.876 -8.776 352 H LEU 960 H LEU 960 -0.542 9.270 -10.000 353 HA LEU 960 HA LEU 960 -1.308 7.172 -11.672 354 1HB LEU 960 1HB LEU 960 0.699 9.162 -11.542 355 2HB LEU 960 2HB LEU 960 1.524 7.629 -11.746 356 HG LEU 960 HG LEU 960 -0.805 8.102 -13.531 357 1HD1 LEU 960 1HD1 LEU 960 0.943 9.366 -15.062 358 2HD1 LEU 960 2HD1 LEU 960 -0.087 10.239 -13.903 359 3HD1 LEU 960 3HD1 LEU 960 1.604 9.870 -13.488 360 1HD2 LEU 960 1HD2 LEU 960 1.895 7.255 -14.472 361 2HD2 LEU 960 2HD2 LEU 960 0.989 6.146 -13.416 362 3HD2 LEU 960 3HD2 LEU 960 0.278 6.691 -14.954 363 H ALA 961 H ALA 961 1.321 7.315 -9.163 364 HA ALA 961 HA ALA 961 2.149 4.724 -9.328 365 1HB ALA 961 1HB ALA 961 2.390 5.200 -6.668 366 2HB ALA 961 2HB ALA 961 3.460 5.925 -7.892 367 3HB ALA 961 3HB ALA 961 2.086 6.855 -7.247 368 H LEU 962 H LEU 962 -0.609 6.074 -7.406 369 HA LEU 962 HA LEU 962 -1.326 3.694 -6.175 370 1HB LEU 962 1HB LEU 962 -2.297 6.357 -6.411 371 2HB LEU 962 2HB LEU 962 -3.637 5.276 -6.734 372 HG LEU 962 HG LEU 962 -3.688 5.766 -4.419 373 1HD1 LEU 962 1HD1 LEU 962 -3.959 3.336 -5.178 374 2HD1 LEU 962 2HD1 LEU 962 -2.350 3.063 -4.466 375 3HD1 LEU 962 3HD1 LEU 962 -3.690 3.635 -3.444 376 1HD2 LEU 962 1HD2 LEU 962 -1.318 4.789 -3.282 377 2HD2 LEU 962 2HD2 LEU 962 -0.809 5.792 -4.661 378 3HD2 LEU 962 3HD2 LEU 962 -1.854 6.482 -3.396 379 H ARG 963 H ARG 963 -2.519 5.171 -9.269 380 HA ARG 963 HA ARG 963 -4.346 3.326 -9.921 381 1HB ARG 963 1HB ARG 963 -3.429 5.467 -11.193 382 2HB ARG 963 2HB ARG 963 -2.404 4.322 -12.036 383 1HG ARG 963 1HG ARG 963 -4.125 3.727 -13.384 384 2HG ARG 963 2HG ARG 963 -5.070 3.227 -11.995 385 1HD ARG 963 1HD ARG 963 -6.458 4.909 -12.812 386 2HD ARG 963 2HD ARG 963 -5.476 5.860 -11.716 387 HE ARG 963 HE ARG 963 -4.147 5.782 -14.243 388 1HH1 ARG 963 2HH2 ARG 963 -7.057 7.123 -12.787 389 2HH1 ARG 963 1HH2 ARG 963 -7.137 8.466 -13.878 390 1HH2 ARG 963 2HH1 ARG 963 -4.253 7.553 -15.682 391 2HH2 ARG 963 1HH1 ARG 963 -5.531 8.712 -15.536 392 H THR 964 H THR 964 -0.810 3.233 -10.790 393 HA THR 964 HA THR 964 -0.912 0.702 -12.005 394 HB THR 964 HB THR 964 1.313 2.381 -10.744 395 HG1 THR 964 HG1 THR 964 0.313 3.239 -12.661 396 1HG2 THR 964 1HG2 THR 964 1.414 -0.181 -12.411 397 2HG2 THR 964 2HG2 THR 964 2.771 0.969 -12.336 398 3HG2 THR 964 3HG2 THR 964 2.230 0.133 -10.861 399 H LEU 965 H LEU 965 -0.276 1.732 -8.616 400 HA LEU 965 HA LEU 965 0.591 -0.650 -7.603 401 1HB LEU 965 1HB LEU 965 0.703 1.139 -6.172 402 2HB LEU 965 2HB LEU 965 -0.929 1.674 -6.517 403 HG LEU 965 HG LEU 965 -0.627 -0.948 -5.128 404 1HD1 LEU 965 1HD1 LEU 965 1.020 0.788 -4.119 405 2HD1 LEU 965 2HD1 LEU 965 -0.452 1.560 -3.481 406 3HD1 LEU 965 3HD1 LEU 965 -0.065 -0.120 -3.039 407 1HD2 LEU 965 1HD2 LEU 965 -2.832 -0.605 -5.139 408 2HD2 LEU 965 2HD2 LEU 965 -2.530 0.562 -3.830 409 3HD2 LEU 965 3HD2 LEU 965 -2.656 1.126 -5.513 410 H LEU 966 H LEU 966 -2.815 0.453 -8.131 411 HA LEU 966 HA LEU 966 -4.089 -1.713 -7.026 412 1HB LEU 966 1HB LEU 966 -4.749 0.230 -9.203 413 2HB LEU 966 2HB LEU 966 -5.819 -1.128 -8.912 414 HG LEU 966 HG LEU 966 -5.540 -0.185 -6.375 415 1HD1 LEU 966 1HD1 LEU 966 -4.980 2.087 -8.237 416 2HD1 LEU 966 2HD1 LEU 966 -5.981 2.381 -6.795 417 3HD1 LEU 966 3HD1 LEU 966 -4.329 1.743 -6.616 418 1HD2 LEU 966 1HD2 LEU 966 -7.572 -0.573 -8.110 419 2HD2 LEU 966 2HD2 LEU 966 -7.761 0.186 -6.511 420 3HD2 LEU 966 3HD2 LEU 966 -7.618 1.201 -7.966 421 H ALA 967 H ALA 967 -3.231 -1.266 -10.534 422 HA ALA 967 HA ALA 967 -3.966 -3.761 -11.384 423 1HB ALA 967 1HB ALA 967 -3.404 -2.426 -13.150 424 2HB ALA 967 2HB ALA 967 -2.092 -1.619 -12.259 425 3HB ALA 967 3HB ALA 967 -1.825 -3.228 -12.972 426 H THR 968 H THR 968 -0.655 -2.707 -10.302 427 HA THR 968 HA THR 968 0.545 -5.189 -10.454 428 HB THR 968 HB THR 968 1.073 -2.983 -8.398 429 HG1 THR 968 HG1 THR 968 2.255 -2.075 -10.231 430 1HG2 THR 968 1HG2 THR 968 3.431 -3.930 -9.678 431 2HG2 THR 968 2HG2 THR 968 2.953 -4.220 -7.988 432 3HG2 THR 968 3HG2 THR 968 2.507 -5.391 -9.253 433 H VAL 969 H VAL 969 -1.482 -3.793 -7.841 434 HA VAL 969 HA VAL 969 -0.961 -5.833 -5.990 435 HB VAL 969 HB VAL 969 -3.140 -3.801 -6.387 436 1HG1 VAL 969 1HG1 VAL 969 -3.324 -6.240 -4.820 437 2HG1 VAL 969 2HG1 VAL 969 -3.418 -4.798 -3.781 438 3HG1 VAL 969 3HG1 VAL 969 -4.555 -4.995 -5.136 439 1HG2 VAL 969 1HG2 VAL 969 -2.102 -2.600 -4.701 440 2HG2 VAL 969 2HG2 VAL 969 -1.342 -4.043 -3.989 441 3HG2 VAL 969 3HG2 VAL 969 -0.707 -3.360 -5.505 442 H ASP 970 H ASP 970 -3.230 -5.503 -8.735 443 HA ASP 970 HA ASP 970 -4.987 -7.467 -8.144 444 1HB ASP 970 1HB ASP 970 -4.844 -5.895 -10.199 445 2HB ASP 970 2HB ASP 970 -3.767 -7.080 -10.911 446 H GLU 971 H GLU 971 -1.664 -7.662 -9.540 447 HA GLU 971 HA GLU 971 -1.819 -10.420 -10.079 448 1HB GLU 971 1HB GLU 971 0.425 -8.388 -9.950 449 2HB GLU 971 2HB GLU 971 0.793 -10.090 -10.148 450 1HG GLU 971 1HG GLU 971 -1.138 -9.870 -12.047 451 2HG GLU 971 2HG GLU 971 -0.582 -8.208 -12.046 452 H SER 972 H SER 972 -1.312 -8.515 -7.207 453 HA SER 972 HA SER 972 0.154 -10.579 -5.873 454 1HB SER 972 1HB SER 972 -0.035 -7.842 -5.547 455 2HB SER 972 2HB SER 972 -1.074 -8.408 -4.254 456 HG SER 972 HG SER 972 1.043 -9.988 -4.090 457 H LEU 973 H LEU 973 -3.185 -9.431 -6.253 458 HA LEU 973 HA LEU 973 -4.480 -10.305 -4.082 459 1HB LEU 973 1HB LEU 973 -5.100 -9.750 -6.795 460 2HB LEU 973 2HB LEU 973 -5.924 -11.237 -6.370 461 HG LEU 973 HG LEU 973 -6.470 -8.476 -5.555 462 1HD1 LEU 973 1HD1 LEU 973 -8.739 -9.421 -5.215 463 2HD1 LEU 973 2HD1 LEU 973 -8.064 -9.760 -6.826 464 3HD1 LEU 973 3HD1 LEU 973 -8.090 -11.036 -5.585 465 1HD2 LEU 973 1HD2 LEU 973 -7.394 -9.260 -3.294 466 2HD2 LEU 973 2HD2 LEU 973 -6.268 -10.629 -3.454 467 3HD2 LEU 973 3HD2 LEU 973 -5.643 -8.962 -3.422 468 HA PRO 974 HA PRO 974 -4.208 -14.782 -5.569 469 1HB PRO 974 1HB PRO 974 -2.579 -15.441 -7.662 470 2HB PRO 974 2HB PRO 974 -4.297 -15.146 -7.841 471 1HG PRO 974 1HG PRO 974 -2.030 -13.404 -8.591 472 2HG PRO 974 2HG PRO 974 -3.695 -13.331 -9.131 473 1HD PRO 974 1HD PRO 974 -2.440 -11.618 -7.203 474 2HD PRO 974 2HD PRO 974 -4.132 -11.621 -7.658 475 H VAL 975 H VAL 975 -1.238 -12.979 -5.868 476 HA VAL 975 HA VAL 975 0.567 -14.870 -5.129 477 HB VAL 975 HB VAL 975 0.338 -11.932 -4.508 478 1HG1 VAL 975 1HG1 VAL 975 1.734 -12.576 -2.754 479 2HG1 VAL 975 2HG1 VAL 975 2.497 -13.875 -3.703 480 3HG1 VAL 975 3HG1 VAL 975 2.886 -12.173 -4.050 481 1HG2 VAL 975 1HG2 VAL 975 1.783 -11.600 -6.325 482 2HG2 VAL 975 2HG2 VAL 975 2.324 -13.296 -6.328 483 3HG2 VAL 975 3HG2 VAL 975 0.684 -12.884 -6.883 484 H LEU 976 H LEU 976 -2.013 -13.409 -3.211 485 HA LEU 976 HA LEU 976 -0.941 -14.778 -0.844 486 1HB LEU 976 1HB LEU 976 -2.935 -12.512 -0.969 487 2HB LEU 976 2HB LEU 976 -2.269 -13.243 0.478 488 HG LEU 976 HG LEU 976 -1.115 -11.219 0.218 489 1HD1 LEU 976 1HD1 LEU 976 0.597 -13.460 -0.880 490 2HD1 LEU 976 2HD1 LEU 976 1.232 -11.887 -0.340 491 3HD1 LEU 976 3HD1 LEU 976 0.408 -12.960 0.817 492 1HD2 LEU 976 1HD2 LEU 976 -0.281 -10.285 -1.766 493 2HD2 LEU 976 2HD2 LEU 976 -0.377 -11.832 -2.642 494 3HD2 LEU 976 3HD2 LEU 976 -1.867 -10.959 -2.212 495 HA PRO 977 HA PRO 977 -4.349 -17.421 -0.933 496 1HB PRO 977 1HB PRO 977 -4.768 -17.973 1.711 497 2HB PRO 977 2HB PRO 977 -3.500 -18.726 0.764 498 1HG PRO 977 1HG PRO 977 -3.275 -16.596 2.801 499 2HG PRO 977 2HG PRO 977 -2.022 -17.643 2.165 500 1HD PRO 977 1HD PRO 977 -2.466 -14.891 1.489 501 2HD PRO 977 2HD PRO 977 -1.289 -15.970 0.769 502 H ALA 978 H ALA 978 -6.502 -17.898 0.724 503 HA ALA 978 HA ALA 978 -8.157 -15.742 -0.119 504 1HB ALA 978 1HB ALA 978 -9.657 -17.285 1.615 505 2HB ALA 978 2HB ALA 978 -9.457 -17.598 -0.126 506 3HB ALA 978 3HB ALA 978 -8.422 -18.438 1.054 507 H SER 979 H SER 979 -9.843 -14.909 1.672 508 HA SER 979 HA SER 979 -10.193 -13.654 3.407 509 1HB SER 979 1HB SER 979 -8.806 -15.828 4.479 510 2HB SER 979 2HB SER 979 -7.913 -14.457 5.107 511 HG SER 979 HG SER 979 -10.134 -13.582 5.718 512 H THR 980 H THR 980 -8.112 -13.026 1.245 513 HA THR 980 HA THR 980 -6.635 -10.958 2.738 514 HB THR 980 HB THR 980 -5.738 -11.882 0.022 515 HG1 THR 980 HG1 THR 980 -5.855 -13.949 0.834 516 1HG2 THR 980 1HG2 THR 980 -4.294 -10.320 1.239 517 2HG2 THR 980 2HG2 THR 980 -4.394 -11.312 2.713 518 3HG2 THR 980 3HG2 THR 980 -3.519 -11.922 1.288 519 H HIS 981 H HIS 981 -8.066 -11.688 -0.518 520 HA HIS 981 HA HIS 981 -8.072 -9.146 -1.470 521 1HB HIS 981 1HB HIS 981 -10.237 -9.964 -2.681 522 2HB HIS 981 2HB HIS 981 -8.690 -10.711 -3.024 523 HD1 HIS 981 HD1 HIS 981 -10.593 -12.632 -3.813 524 HD2 HIS 981 HD2 HIS 981 -9.828 -12.138 0.282 525 HE1 HIS 981 HE1 HIS 981 -11.418 -14.759 -2.670 526 H ARG 982 H ARG 982 -9.930 -10.485 1.178 527 HA ARG 982 HA ARG 982 -12.055 -8.686 1.055 528 1HB ARG 982 1HB ARG 982 -11.028 -10.744 2.893 529 2HB ARG 982 2HB ARG 982 -11.690 -9.383 3.777 530 1HG ARG 982 1HG ARG 982 -13.339 -10.302 1.462 531 2HG ARG 982 2HG ARG 982 -13.197 -11.457 2.773 532 1HD ARG 982 1HD ARG 982 -14.136 -9.922 4.376 533 2HD ARG 982 2HD ARG 982 -13.919 -8.548 3.311 534 HE ARG 982 HE ARG 982 -15.873 -9.149 2.135 535 1HH1 ARG 982 2HH2 ARG 982 -14.936 -11.738 4.327 536 2HH1 ARG 982 1HH2 ARG 982 -16.417 -12.614 4.130 537 1HH2 ARG 982 2HH1 ARG 982 -17.828 -10.305 1.875 538 2HH2 ARG 982 1HH1 ARG 982 -18.073 -11.794 2.726 539 H GLU 983 H GLU 983 -9.645 -8.844 3.764 540 HA GLU 983 HA GLU 983 -10.006 -6.244 4.528 541 1HB GLU 983 1HB GLU 983 -7.727 -8.210 4.902 542 2HB GLU 983 2HB GLU 983 -7.622 -6.593 5.569 543 1HG GLU 983 1HG GLU 983 -9.887 -7.011 6.694 544 2HG GLU 983 2HG GLU 983 -9.768 -8.679 6.170 545 H ILE 984 H ILE 984 -8.281 -7.539 1.789 546 HA ILE 984 HA ILE 984 -6.444 -5.382 1.510 547 HB ILE 984 HB ILE 984 -7.309 -7.725 -0.130 548 1HG1 ILE 984 1HG1 ILE 984 -4.820 -6.793 1.265 549 2HG1 ILE 984 2HG1 ILE 984 -5.654 -8.330 1.381 550 1HG2 ILE 984 1HG2 ILE 984 -7.201 -5.852 -1.721 551 2HG2 ILE 984 2HG2 ILE 984 -5.548 -5.488 -1.170 552 3HG2 ILE 984 3HG2 ILE 984 -5.896 -7.033 -1.982 553 1HD1 ILE 984 1HD1 ILE 984 -3.883 -7.321 -0.871 554 2HD1 ILE 984 2HD1 ILE 984 -3.721 -8.814 0.084 555 3HD1 ILE 984 3HD1 ILE 984 -5.021 -8.666 -1.123 556 H GLU 985 H GLU 985 -9.743 -6.161 0.342 557 HA GLU 985 HA GLU 985 -9.867 -4.129 -1.540 558 1HB GLU 985 1HB GLU 985 -11.470 -6.195 -0.924 559 2HB GLU 985 2HB GLU 985 -12.336 -4.960 -0.030 560 1HG GLU 985 1HG GLU 985 -11.529 -4.175 -2.796 561 2HG GLU 985 2HG GLU 985 -12.701 -5.476 -2.711 562 H MET 986 H MET 986 -10.595 -4.233 1.983 563 HA MET 986 HA MET 986 -11.671 -1.625 2.010 564 1HB MET 986 1HB MET 986 -10.924 -3.778 3.962 565 2HB MET 986 2HB MET 986 -10.884 -2.155 4.620 566 1HG MET 986 1HG MET 986 -13.174 -1.898 4.497 567 2HG MET 986 2HG MET 986 -13.295 -2.747 2.969 568 1HE MET 986 1HE MET 986 -13.050 -6.408 3.847 569 2HE MET 986 2HE MET 986 -14.334 -5.489 3.027 570 3HE MET 986 3HE MET 986 -12.625 -5.100 2.717 571 H ALA 987 H ALA 987 -8.430 -3.007 2.165 572 HA ALA 987 HA ALA 987 -7.268 -0.661 3.357 573 1HB ALA 987 1HB ALA 987 -6.122 -3.183 2.098 574 2HB ALA 987 2HB ALA 987 -5.137 -1.906 2.851 575 3HB ALA 987 3HB ALA 987 -6.299 -2.828 3.834 576 H GLN 988 H GLN 988 -8.133 -1.857 0.163 577 HA GLN 988 HA GLN 988 -6.285 -0.168 -1.183 578 1HB GLN 988 1HB GLN 988 -8.507 -2.037 -1.983 579 2HB GLN 988 2HB GLN 988 -7.974 -0.848 -3.155 580 1HG GLN 988 1HG GLN 988 -5.622 -2.018 -1.955 581 2HG GLN 988 2HG GLN 988 -6.695 -3.326 -2.413 582 1HE2 GLN 988 1HE2 GLN 988 -7.532 -3.376 -4.590 583 2HE2 GLN 988 2HE2 GLN 988 -6.591 -2.756 -5.906 584 H LYS 989 H LYS 989 -9.809 -0.141 -0.397 585 HA LYS 989 HA LYS 989 -10.398 2.190 -1.837 586 1HB LYS 989 1HB LYS 989 -11.816 0.271 -0.447 587 2HB LYS 989 2HB LYS 989 -12.022 1.689 0.561 588 1HG LYS 989 1HG LYS 989 -12.643 2.981 -1.576 589 2HG LYS 989 2HG LYS 989 -12.670 1.440 -2.410 590 1HD LYS 989 1HD LYS 989 -14.214 0.954 -0.115 591 2HD LYS 989 2HD LYS 989 -14.648 2.595 -0.548 592 1HE LYS 989 1HE LYS 989 -14.589 0.366 -2.623 593 2HE LYS 989 2HE LYS 989 -16.009 0.665 -1.641 594 1HZ LYS 989 1HZ LYS 989 -16.054 1.861 -3.731 595 2HZ LYS 989 2HZ LYS 989 -16.070 2.899 -2.470 596 3HZ LYS 989 3HZ LYS 989 -14.700 2.682 -3.332 597 H LEU 990 H LEU 990 -9.143 1.576 1.461 598 HA LEU 990 HA LEU 990 -9.509 4.147 2.461 599 1HB LEU 990 1HB LEU 990 -8.526 1.736 3.362 600 2HB LEU 990 2HB LEU 990 -7.100 2.755 3.370 601 HG LEU 990 HG LEU 990 -9.703 3.526 4.711 602 1HD1 LEU 990 1HD1 LEU 990 -9.280 2.018 6.284 603 2HD1 LEU 990 2HD1 LEU 990 -7.731 1.575 5.528 604 3HD1 LEU 990 3HD1 LEU 990 -7.803 2.928 6.682 605 1HD2 LEU 990 1HD2 LEU 990 -7.449 5.044 4.064 606 2HD2 LEU 990 2HD2 LEU 990 -8.749 5.471 5.202 607 3HD2 LEU 990 3HD2 LEU 990 -7.272 4.673 5.796 608 H LEU 991 H LEU 991 -6.724 2.654 0.691 609 HA LEU 991 HA LEU 991 -5.050 4.845 0.793 610 1HB LEU 991 1HB LEU 991 -4.681 2.422 -0.007 611 2HB LEU 991 2HB LEU 991 -5.231 2.995 -1.569 612 HG LEU 991 HG LEU 991 -3.402 4.574 -1.710 613 1HD1 LEU 991 1HD1 LEU 991 -2.833 5.452 0.297 614 2HD1 LEU 991 2HD1 LEU 991 -3.073 3.918 1.167 615 3HD1 LEU 991 3HD1 LEU 991 -1.586 4.184 0.226 616 1HD2 LEU 991 1HD2 LEU 991 -3.156 2.005 -2.174 617 2HD2 LEU 991 2HD2 LEU 991 -1.736 3.077 -2.229 618 3HD2 LEU 991 3HD2 LEU 991 -2.036 2.070 -0.792 619 H ASN 992 H ASN 992 -7.134 3.883 -2.031 620 HA ASN 992 HA ASN 992 -6.789 6.122 -3.474 621 1HB ASN 992 1HB ASN 992 -8.079 4.133 -4.244 622 2HB ASN 992 2HB ASN 992 -9.366 4.504 -3.113 623 1HD2 ASN 992 1HD2 ASN 992 -7.844 5.268 -6.115 624 2HD2 ASN 992 2HD2 ASN 992 -8.999 6.411 -6.717 625 H SER 993 H SER 993 -9.104 5.483 -0.770 626 HA SER 993 HA SER 993 -10.682 7.667 -0.952 627 1HB SER 993 1HB SER 993 -9.831 5.809 1.178 628 2HB SER 993 2HB SER 993 -10.290 7.381 1.803 629 HG SER 993 HG SER 993 -12.005 5.586 1.412 630 H ASP 994 H ASP 994 -7.863 7.444 1.348 631 HA ASP 994 HA ASP 994 -7.773 10.072 1.975 632 1HB ASP 994 1HB ASP 994 -5.717 7.869 1.834 633 2HB ASP 994 2HB ASP 994 -5.141 9.497 2.134 634 H LEU 995 H LEU 995 -6.439 8.304 -0.852 635 HA LEU 995 HA LEU 995 -4.699 10.209 -1.828 636 1HB LEU 995 1HB LEU 995 -4.410 8.403 -3.074 637 2HB LEU 995 2HB LEU 995 -6.026 7.807 -2.755 638 HG LEU 995 HG LEU 995 -6.900 9.319 -4.538 639 1HD1 LEU 995 1HD1 LEU 995 -4.758 10.821 -4.306 640 2HD1 LEU 995 2HD1 LEU 995 -4.108 9.720 -5.544 641 3HD1 LEU 995 3HD1 LEU 995 -5.589 10.651 -5.871 642 1HD2 LEU 995 1HD2 LEU 995 -6.797 7.362 -5.598 643 2HD2 LEU 995 2HD2 LEU 995 -5.298 7.966 -6.345 644 3HD2 LEU 995 3HD2 LEU 995 -5.219 6.959 -4.879 645 H ALA 996 H ALA 996 -8.181 9.702 -2.753 646 HA ALA 996 HA ALA 996 -8.453 11.840 -4.414 647 1HB ALA 996 1HB ALA 996 -10.826 11.650 -2.839 648 2HB ALA 996 2HB ALA 996 -10.503 10.926 -4.433 649 3HB ALA 996 3HB ALA 996 -10.131 10.015 -2.950 650 H GLU 997 H GLU 997 -8.860 11.783 -0.807 651 HA GLU 997 HA GLU 997 -9.502 14.454 -0.585 652 1HB GLU 997 1HB GLU 997 -9.756 12.674 1.189 653 2HB GLU 997 2HB GLU 997 -8.024 12.732 1.453 654 1HG GLU 997 1HG GLU 997 -8.913 14.190 3.111 655 2HG GLU 997 2HG GLU 997 -8.312 15.271 1.869 656 H LEU 998 H LEU 998 -6.397 12.798 -1.022 657 HA LEU 998 HA LEU 998 -4.813 15.010 -0.182 658 1HB LEU 998 1HB LEU 998 -3.741 12.999 0.055 659 2HB LEU 998 2HB LEU 998 -4.353 12.354 -1.456 660 HG LEU 998 HG LEU 998 -1.839 12.938 -1.240 661 1HD1 LEU 998 1HD1 LEU 998 -1.658 13.219 -3.567 662 2HD1 LEU 998 2HD1 LEU 998 -3.176 12.322 -3.324 663 3HD1 LEU 998 3HD1 LEU 998 -3.220 14.066 -3.676 664 1HD2 LEU 998 1HD2 LEU 998 -2.420 15.639 -2.267 665 2HD2 LEU 998 2HD2 LEU 998 -2.753 15.405 -0.534 666 3HD2 LEU 998 3HD2 LEU 998 -1.130 15.067 -1.182 667 H ILE 999 H ILE 999 -5.906 13.663 -3.357 668 HA ILE 999 HA ILE 999 -4.541 15.349 -5.016 669 HB ILE 999 HB ILE 999 -7.329 14.222 -5.288 670 1HG1 ILE 999 1HG1 ILE 999 -5.707 12.479 -4.923 671 2HG1 ILE 999 2HG1 ILE 999 -6.201 12.460 -6.604 672 1HG2 ILE 999 1HG2 ILE 999 -7.277 15.887 -6.914 673 2HG2 ILE 999 2HG2 ILE 999 -5.546 15.646 -7.252 674 3HG2 ILE 999 3HG2 ILE 999 -6.735 14.435 -7.790 675 1HD1 ILE 999 1HD1 ILE 999 -4.037 14.207 -6.662 676 2HD1 ILE 999 2HD1 ILE 999 -3.546 13.016 -5.433 677 3HD1 ILE 999 3HD1 ILE 999 -3.972 12.476 -7.075 678 H ASN1000 H ASN1000 -7.725 15.912 -3.384 679 HA ASN1000 HA ASN1000 -8.087 18.424 -4.504 680 1HB ASN1000 1HB ASN1000 -9.717 16.829 -3.133 681 2HB ASN1000 2HB ASN1000 -9.105 17.688 -1.733 682 1HD2 ASN1000 1HD2 ASN1000 -11.478 18.173 -1.685 683 2HD2 ASN1000 2HD2 ASN1000 -12.030 19.615 -2.469 684 H LYS1001 H LYS1001 -6.431 17.188 -1.564 685 HA LYS1001 HA LYS1001 -6.111 19.563 -0.186 686 1HB LYS1001 1HB LYS1001 -5.473 16.967 0.253 687 2HB LYS1001 2HB LYS1001 -3.881 17.603 -0.108 688 1HG LYS1001 1HG LYS1001 -3.796 18.362 2.029 689 2HG LYS1001 2HG LYS1001 -4.997 19.557 1.580 690 1HD LYS1001 1HD LYS1001 -6.315 18.585 3.166 691 2HD LYS1001 2HD LYS1001 -6.583 17.319 1.984 692 1HE LYS1001 1HE LYS1001 -4.408 16.224 2.925 693 2HE LYS1001 2HE LYS1001 -4.564 17.344 4.263 694 1HZ LYS1001 1HZ LYS1001 -5.851 15.730 5.064 695 2HZ LYS1001 2HZ LYS1001 -7.019 16.371 4.120 696 3HZ LYS1001 3HZ LYS1001 -6.178 15.068 3.608 697 H MET1002 H MET1002 -4.475 18.288 -3.071 698 HA MET1002 HA MET1002 -2.393 20.226 -2.896 699 1HB MET1002 1HB MET1002 -1.968 18.034 -3.946 700 2HB MET1002 2HB MET1002 -3.306 18.252 -5.057 701 1HG MET1002 1HG MET1002 -1.695 20.539 -5.466 702 2HG MET1002 2HG MET1002 -0.542 19.236 -5.265 703 1HE MET1002 1HE MET1002 -3.191 20.210 -8.703 704 2HE MET1002 2HE MET1002 -4.192 19.620 -7.354 705 3HE MET1002 3HE MET1002 -3.070 20.978 -7.102 706 H LYS1003 H LYS1003 -5.486 19.789 -4.669 707 HA LYS1003 HA LYS1003 -5.164 21.834 -6.516 708 1HB LYS1003 1HB LYS1003 -7.388 20.233 -5.406 709 2HB LYS1003 2HB LYS1003 -7.859 21.795 -6.046 710 1HG LYS1003 1HG LYS1003 -6.541 21.236 -8.162 711 2HG LYS1003 2HG LYS1003 -6.299 19.624 -7.520 712 1HD LYS1003 1HD LYS1003 -8.221 19.457 -8.941 713 2HD LYS1003 2HD LYS1003 -8.851 19.436 -7.306 714 1HE LYS1003 1HE LYS1003 -9.730 21.611 -7.460 715 2HE LYS1003 2HE LYS1003 -8.572 22.112 -8.676 716 1HZ LYS1003 1HZ LYS1003 -9.916 21.423 -10.270 717 2HZ LYS1003 2HZ LYS1003 -10.212 19.979 -9.567 718 3HZ LYS1003 3HZ LYS1003 -11.093 21.288 -9.146 719 H LEU1004 H LEU1004 -6.709 21.893 -3.229 720 HA LEU1004 HA LEU1004 -7.192 24.658 -3.300 721 1HB LEU1004 1HB LEU1004 -7.587 24.402 -0.892 722 2HB LEU1004 2HB LEU1004 -8.457 23.238 -1.871 723 HG LEU1004 HG LEU1004 -6.428 21.662 -1.323 724 1HD1 LEU1004 1HD1 LEU1004 -5.096 22.119 0.470 725 2HD1 LEU1004 2HD1 LEU1004 -5.352 23.776 -0.129 726 3HD1 LEU1004 3HD1 LEU1004 -6.303 23.170 1.249 727 1HD2 LEU1004 1HD2 LEU1004 -8.299 22.201 0.971 728 2HD2 LEU1004 2HD2 LEU1004 -8.906 21.582 -0.584 729 3HD2 LEU1004 3HD2 LEU1004 -7.700 20.649 0.336 730 H ALA1005 H ALA1005 -4.398 22.652 -2.327 731 HA ALA1005 HA ALA1005 -3.021 24.790 -1.064 732 1HB ALA1005 1HB ALA1005 -2.432 21.978 -1.946 733 2HB ALA1005 2HB ALA1005 -1.067 23.055 -1.565 734 3HB ALA1005 3HB ALA1005 -2.303 22.715 -0.331 735 H GLN1006 H GLN1006 -3.905 24.247 -4.277 736 HA GLN1006 HA GLN1006 -1.462 25.439 -5.289 737 1HB GLN1006 1HB GLN1006 -3.178 23.434 -6.288 738 2HB GLN1006 2HB GLN1006 -3.512 24.829 -7.295 739 1HG GLN1006 1HG GLN1006 -0.620 24.445 -6.789 740 2HG GLN1006 2HG GLN1006 -1.356 23.077 -7.600 741 1HE2 GLN1006 1HE2 GLN1006 -3.302 24.177 -9.115 742 2HE2 GLN1006 2HE2 GLN1006 -2.650 25.229 -10.327 743 H GLN1007 H GLN1007 -4.684 26.205 -4.298 744 HA GLN1007 HA GLN1007 -4.646 28.614 -5.928 745 1HB GLN1007 1HB GLN1007 -6.679 26.887 -5.697 746 2HB GLN1007 2HB GLN1007 -7.022 27.818 -4.252 747 1HG GLN1007 1HG GLN1007 -6.499 29.234 -6.886 748 2HG GLN1007 2HG GLN1007 -8.083 28.565 -6.547 749 1HE2 GLN1007 1HE2 GLN1007 -9.359 29.403 -4.928 750 2HE2 GLN1007 2HE2 GLN1007 -9.064 30.933 -4.171 751 H TYR1008 H TYR1008 -4.800 27.338 -2.579 752 HA TYR1008 HA TYR1008 -5.140 29.882 -1.365 753 1HB TYR1008 1HB TYR1008 -4.277 27.043 -0.612 754 2HB TYR1008 2HB TYR1008 -4.154 28.311 0.591 755 HD1 TYR1008 HD1 TYR1008 -6.041 25.659 0.015 756 HD2 TYR1008 HD2 TYR1008 -6.579 29.900 0.178 757 HE1 TYR1008 HE1 TYR1008 -8.489 25.332 0.618 758 HE2 TYR1008 HE2 TYR1008 -9.025 29.559 0.780 759 HH TYR1008 HH TYR1008 -10.572 28.134 1.275 760 H VAL1009 H VAL1009 -2.441 28.238 -2.822 761 HA VAL1009 HA VAL1009 -0.286 28.847 -1.358 762 HB VAL1009 HB VAL1009 -0.036 27.723 -3.401 763 1HG1 VAL1009 1HG1 VAL1009 -0.957 28.272 -5.401 764 2HG1 VAL1009 2HG1 VAL1009 -2.025 29.272 -4.388 765 3HG1 VAL1009 3HG1 VAL1009 -0.624 30.009 -5.203 766 1HG2 VAL1009 1HG2 VAL1009 1.749 28.941 -4.542 767 2HG2 VAL1009 2HG2 VAL1009 1.221 30.462 -3.782 768 3HG2 VAL1009 3HG2 VAL1009 1.881 29.148 -2.779 769 H MET1010 H MET1010 -1.550 31.150 -3.876 770 HA MET1010 HA MET1010 -0.051 33.266 -3.255 771 1HB MET1010 1HB MET1010 -1.902 32.991 -5.044 772 2HB MET1010 2HB MET1010 -3.064 33.423 -3.805 773 1HG MET1010 1HG MET1010 -0.996 35.403 -3.688 774 2HG MET1010 2HG MET1010 -1.359 35.173 -5.387 775 1HE MET1010 1HE MET1010 -4.150 34.496 -2.550 776 2HE MET1010 2HE MET1010 -2.831 35.495 -1.894 777 3HE MET1010 3HE MET1010 -4.447 36.201 -2.134 778 H THR1011 H THR1011 -3.344 32.656 -1.820 779 HA THR1011 HA THR1011 -3.587 34.700 -0.119 780 HB THR1011 HB THR1011 -4.089 31.749 0.542 781 HG1 THR1011 HG1 THR1011 -5.656 33.854 -0.775 782 1HG2 THR1011 1HG2 THR1011 -5.675 34.252 1.307 783 2HG2 THR1011 2HG2 THR1011 -5.971 32.583 1.851 784 3HG2 THR1011 3HG2 THR1011 -4.525 33.457 2.409 785 H SER1012 H SER1012 -2.290 31.653 1.312 786 HA SER1012 HA SER1012 0.125 32.224 2.029 787 1HB SER1012 1HB SER1012 -1.666 34.130 3.475 788 2HB SER1012 2HB SER1012 -0.427 33.368 4.453 789 HG SER1012 HG SER1012 0.312 34.474 1.917 790 H LEU1013 H LEU1013 -3.065 31.140 2.871 791 HA LEU1013 HA LEU1013 -2.523 29.800 5.263 792 1HB LEU1013 1HB LEU1013 -4.509 28.729 3.319 793 2HB LEU1013 2HB LEU1013 -4.623 28.918 5.057 794 HG LEU1013 HG LEU1013 -4.929 31.053 2.939 795 1HD1 LEU1013 1HD1 LEU1013 -6.958 29.921 3.173 796 2HD1 LEU1013 2HD1 LEU1013 -6.775 29.753 4.936 797 3HD1 LEU1013 3HD1 LEU1013 -7.134 31.346 4.226 798 1HD2 LEU1013 1HD2 LEU1013 -4.462 31.349 5.899 799 2HD2 LEU1013 2HD2 LEU1013 -3.714 32.225 4.542 800 3HD2 LEU1013 3HD2 LEU1013 -5.406 32.551 4.987 801 H GLN1014 H GLN1014 -1.284 29.325 2.115 802 HA GLN1014 HA GLN1014 -1.206 26.774 1.562 803 1HB GLN1014 1HB GLN1014 0.168 28.715 0.558 804 2HB GLN1014 2HB GLN1014 1.396 28.341 1.751 805 1HG GLN1014 1HG GLN1014 1.098 25.850 0.826 806 2HG GLN1014 2HG GLN1014 0.445 26.666 -0.580 807 1HE2 GLN1014 1HE2 GLN1014 2.023 26.343 -2.013 808 2HE2 GLN1014 2HE2 GLN1014 3.651 26.920 -1.876 809 H GLN1015 H GLN1015 1.444 28.088 3.683 810 HA GLN1015 HA GLN1015 2.463 25.803 4.546 811 1HB GLN1015 1HB GLN1015 2.673 27.174 6.860 812 2HB GLN1015 2HB GLN1015 3.606 27.586 5.435 813 1HG GLN1015 1HG GLN1015 2.424 29.525 5.049 814 2HG GLN1015 2HG GLN1015 0.892 28.811 5.514 815 1HE2 GLN1015 1HE2 GLN1015 0.566 30.851 6.594 816 2HE2 GLN1015 2HE2 GLN1015 1.178 31.105 8.195 817 H GLU1016 H GLU1016 -0.556 27.345 5.760 818 HA GLU1016 HA GLU1016 -0.922 25.580 7.878 819 1HB GLU1016 1HB GLU1016 -2.065 27.841 7.450 820 2HB GLU1016 2HB GLU1016 -3.122 27.006 6.329 821 1HG GLU1016 1HG GLU1016 -3.466 25.333 8.390 822 2HG GLU1016 2HG GLU1016 -2.926 26.709 9.331 823 H TYR1017 H TYR1017 -2.268 25.628 4.506 824 HA TYR1017 HA TYR1017 -3.700 23.213 4.828 825 1HB TYR1017 1HB TYR1017 -2.635 24.991 2.574 826 2HB TYR1017 2HB TYR1017 -3.409 23.474 2.162 827 HD1 TYR1017 HD1 TYR1017 -5.763 23.140 3.546 828 HD2 TYR1017 HD2 TYR1017 -3.977 26.870 2.450 829 HE1 TYR1017 HE1 TYR1017 -8.035 24.274 3.672 830 HE2 TYR1017 HE2 TYR1017 -6.255 27.991 2.579 831 HH TYR1017 HH TYR1017 -8.333 27.746 3.414 832 H LYS1018 H LYS1018 -0.338 24.010 4.049 833 HA LYS1018 HA LYS1018 0.289 21.601 2.739 834 1HB LYS1018 1HB LYS1018 1.984 23.645 4.197 835 2HB LYS1018 2HB LYS1018 2.653 22.276 3.332 836 1HG LYS1018 1HG LYS1018 0.691 24.153 1.967 837 2HG LYS1018 2HG LYS1018 2.391 24.566 2.071 838 1HD LYS1018 1HD LYS1018 2.789 22.133 1.114 839 2HD LYS1018 2HD LYS1018 1.106 22.223 0.634 840 1HE LYS1018 1HE LYS1018 2.799 24.605 -0.047 841 2HE LYS1018 2HE LYS1018 3.154 23.131 -0.925 842 1HZ LYS1018 1HZ LYS1018 0.442 24.224 -0.677 843 2HZ LYS1018 2HZ LYS1018 1.432 24.559 -1.931 844 3HZ LYS1018 3HZ LYS1018 0.936 23.025 -1.670 845 H LYS1019 H LYS1019 0.367 22.659 6.185 846 HA LYS1019 HA LYS1019 1.610 20.376 7.181 847 1HB LYS1019 1HB LYS1019 0.284 22.741 8.201 848 2HB LYS1019 2HB LYS1019 -0.161 21.338 9.150 849 1HG LYS1019 1HG LYS1019 1.835 22.102 10.183 850 2HG LYS1019 2HG LYS1019 2.369 20.755 9.197 851 1HD LYS1019 1HD LYS1019 2.359 23.458 7.884 852 2HD LYS1019 2HD LYS1019 3.562 23.199 9.131 853 1HE LYS1019 1HE LYS1019 3.532 20.842 7.475 854 2HE LYS1019 2HE LYS1019 3.561 22.229 6.404 855 1HZ LYS1019 1HZ LYS1019 5.510 22.989 7.366 856 2HZ LYS1019 2HZ LYS1019 5.365 22.059 8.701 857 3HZ LYS1019 3HZ LYS1019 5.748 21.376 7.268 858 H GLN1020 H GLN1020 -1.844 21.137 6.497 859 HA GLN1020 HA GLN1020 -2.988 18.995 7.700 860 1HB GLN1020 1HB GLN1020 -3.755 20.274 5.038 861 2HB GLN1020 2HB GLN1020 -4.809 19.250 5.994 862 1HG GLN1020 1HG GLN1020 -3.629 21.933 6.852 863 2HG GLN1020 2HG GLN1020 -5.306 21.615 6.457 864 1HE2 GLN1020 1HE2 GLN1020 -6.647 20.653 7.896 865 2HE2 GLN1020 2HE2 GLN1020 -6.234 20.288 9.538 866 H MET1021 H MET1021 -1.678 19.196 4.318 867 HA MET1021 HA MET1021 -2.326 16.731 3.457 868 1HB MET1021 1HB MET1021 -0.732 18.835 2.589 869 2HB MET1021 2HB MET1021 0.482 17.599 2.853 870 1HG MET1021 1HG MET1021 -2.037 16.905 1.312 871 2HG MET1021 2HG MET1021 -0.743 17.767 0.504 872 1HE MET1021 1HE MET1021 1.632 17.217 0.925 873 2HE MET1021 2HE MET1021 1.969 16.080 2.252 874 3HE MET1021 3HE MET1021 2.243 15.584 0.564 875 H LEU1022 H LEU1022 0.777 17.614 5.147 876 HA LEU1022 HA LEU1022 1.979 15.213 5.236 877 1HB LEU1022 1HB LEU1022 2.913 17.287 6.097 878 2HB LEU1022 2HB LEU1022 1.794 17.266 7.445 879 HG LEU1022 HG LEU1022 4.077 16.554 8.058 880 1HD1 LEU1022 1HD1 LEU1022 2.421 14.094 8.411 881 2HD1 LEU1022 2HD1 LEU1022 3.378 15.016 9.595 882 3HD1 LEU1022 3HD1 LEU1022 1.800 15.635 9.050 883 1HD2 LEU1022 1HD2 LEU1022 5.240 14.881 7.083 884 2HD2 LEU1022 2HD2 LEU1022 3.787 13.905 6.757 885 3HD2 LEU1022 3HD2 LEU1022 4.198 15.272 5.694 886 H THR1023 H THR1023 -0.611 16.367 7.492 887 HA THR1023 HA THR1023 -0.719 14.231 9.184 888 HB THR1023 HB THR1023 -3.220 15.556 8.066 889 HG1 THR1023 HG1 THR1023 -1.999 17.391 8.389 890 1HG2 THR1023 1HG2 THR1023 -3.800 15.709 10.466 891 2HG2 THR1023 2HG2 THR1023 -3.396 14.021 10.070 892 3HG2 THR1023 3HG2 THR1023 -2.210 15.046 10.913 893 H ALA1024 H ALA1024 -2.395 14.508 5.984 894 HA ALA1024 HA ALA1024 -3.550 11.964 6.127 895 1HB ALA1024 1HB ALA1024 -2.784 13.733 3.771 896 2HB ALA1024 2HB ALA1024 -3.817 12.288 3.656 897 3HB ALA1024 3HB ALA1024 -4.352 13.692 4.612 898 H ALA1025 H ALA1025 -0.422 13.168 4.778 899 HA ALA1025 HA ALA1025 0.424 10.890 3.524 900 1HB ALA1025 1HB ALA1025 2.678 11.787 3.866 901 2HB ALA1025 2HB ALA1025 1.545 13.112 3.503 902 3HB ALA1025 3HB ALA1025 2.085 12.836 5.176 903 H HIS1026 H HIS1026 0.282 11.660 7.013 904 HA HIS1026 HA HIS1026 1.905 9.540 7.851 905 1HB HIS1026 1HB HIS1026 1.364 11.502 9.227 906 2HB HIS1026 2HB HIS1026 -0.316 11.009 9.299 907 HD1 HIS1026 HD1 HIS1026 -0.928 8.991 10.850 908 HD2 HIS1026 HD2 HIS1026 3.131 10.051 10.897 909 HE1 HIS1026 HE1 HIS1026 0.103 7.785 12.848 910 H ALA1027 H ALA1027 -1.713 9.881 7.702 911 HA ALA1027 HA ALA1027 -2.188 7.210 8.431 912 1HB ALA1027 1HB ALA1027 -4.170 8.616 6.717 913 2HB ALA1027 2HB ALA1027 -4.374 7.848 8.310 914 3HB ALA1027 3HB ALA1027 -3.676 9.481 8.192 915 H LEU1028 H LEU1028 -1.576 8.876 5.325 916 HA LEU1028 HA LEU1028 -2.450 6.886 3.613 917 1HB LEU1028 1HB LEU1028 -0.541 9.159 3.482 918 2HB LEU1028 2HB LEU1028 -0.423 7.946 2.223 919 HG LEU1028 HG LEU1028 -2.761 9.737 2.882 920 1HD1 LEU1028 1HD1 LEU1028 -1.023 9.323 0.443 921 2HD1 LEU1028 2HD1 LEU1028 -2.550 10.237 0.414 922 3HD1 LEU1028 3HD1 LEU1028 -1.203 10.788 1.438 923 1HD2 LEU1028 1HD2 LEU1028 -2.757 7.160 1.323 924 2HD2 LEU1028 2HD2 LEU1028 -3.899 7.729 2.564 925 3HD2 LEU1028 3HD2 LEU1028 -3.901 8.471 0.946 926 H ALA1029 H ALA1029 1.005 7.509 4.568 927 HA ALA1029 HA ALA1029 2.168 5.326 3.567 928 1HB ALA1029 1HB ALA1029 3.782 6.452 4.667 929 2HB ALA1029 2HB ALA1029 2.617 7.137 5.825 930 3HB ALA1029 3HB ALA1029 3.311 5.522 6.109 931 H VAL1030 H VAL1030 0.205 5.471 6.593 932 HA VAL1030 HA VAL1030 0.657 2.756 7.252 933 HB VAL1030 HB VAL1030 -1.335 4.855 8.095 934 1HG1 VAL1030 1HG1 VAL1030 -1.064 2.073 9.282 935 2HG1 VAL1030 2HG1 VAL1030 -2.169 3.365 9.810 936 3HG1 VAL1030 3HG1 VAL1030 -2.390 2.599 8.219 937 1HG2 VAL1030 1HG2 VAL1030 0.212 3.900 10.255 938 2HG2 VAL1030 2HG2 VAL1030 1.338 4.105 8.892 939 3HG2 VAL1030 3HG2 VAL1030 0.338 5.474 9.434 940 H ASP1031 H ASP1031 -2.048 4.545 5.632 941 HA ASP1031 HA ASP1031 -3.829 2.606 5.329 942 1HB ASP1031 1HB ASP1031 -2.865 4.596 3.225 943 2HB ASP1031 2HB ASP1031 -4.327 3.648 3.038 944 H ALA1032 H ALA1032 -1.263 3.358 2.836 945 HA ALA1032 HA ALA1032 -1.645 1.105 1.291 946 1HB ALA1032 1HB ALA1032 0.029 3.351 1.343 947 2HB ALA1032 2HB ALA1032 1.146 1.967 1.423 948 3HB ALA1032 3HB ALA1032 -0.020 2.094 0.084 949 H LYS1033 H LYS1033 -0.115 1.506 4.439 950 HA LYS1033 HA LYS1033 1.451 -0.862 4.293 951 1HB LYS1033 1HB LYS1033 1.314 1.357 5.952 952 2HB LYS1033 2HB LYS1033 0.704 0.068 6.971 953 1HG LYS1033 1HG LYS1033 2.845 -0.594 7.312 954 2HG LYS1033 2HG LYS1033 2.912 -1.087 5.631 955 1HD LYS1033 1HD LYS1033 4.689 0.418 5.675 956 2HD LYS1033 2HD LYS1033 3.396 1.497 5.194 957 1HE LYS1033 1HE LYS1033 3.052 1.922 7.753 958 2HE LYS1033 2HE LYS1033 4.619 1.166 7.960 959 1HZ LYS1033 1HZ LYS1033 5.009 2.927 5.953 960 2HZ LYS1033 2HZ LYS1033 4.002 3.737 6.951 961 3HZ LYS1033 3HZ LYS1033 5.421 3.160 7.516 962 H ASN1034 H ASN1034 -1.523 -0.053 6.229 963 HA ASN1034 HA ASN1034 -2.102 -2.416 7.220 964 1HB ASN1034 1HB ASN1034 -3.636 -0.075 6.393 965 2HB ASN1034 2HB ASN1034 -4.594 -1.514 6.108 966 1HD2 ASN1034 1HD2 ASN1034 -5.620 0.059 7.879 967 2HD2 ASN1034 2HD2 ASN1034 -5.401 -0.471 9.513 968 H LEU1035 H LEU1035 -2.317 -1.422 3.799 969 HA LEU1035 HA LEU1035 -3.934 -3.504 2.866 970 1HB LEU1035 1HB LEU1035 -3.723 -1.688 1.460 971 2HB LEU1035 2HB LEU1035 -1.984 -1.587 1.657 972 HG LEU1035 HG LEU1035 -1.610 -3.444 0.201 973 1HD1 LEU1035 1HD1 LEU1035 -3.897 -4.522 1.115 974 2HD1 LEU1035 2HD1 LEU1035 -4.461 -3.925 -0.465 975 3HD1 LEU1035 3HD1 LEU1035 -3.087 -5.054 -0.379 976 1HD2 LEU1035 1HD2 LEU1035 -2.749 -1.059 -0.626 977 2HD2 LEU1035 2HD2 LEU1035 -1.902 -2.241 -1.652 978 3HD2 LEU1035 3HD2 LEU1035 -3.676 -2.296 -1.509 979 H LEU1036 H LEU1036 -0.351 -3.166 2.361 980 HA LEU1036 HA LEU1036 -0.036 -5.873 1.743 981 1HB LEU1036 1HB LEU1036 1.459 -3.632 1.507 982 2HB LEU1036 2HB LEU1036 2.262 -4.390 2.867 983 HG LEU1036 HG LEU1036 1.868 -6.410 0.897 984 1HD1 LEU1036 1HD1 LEU1036 3.426 -5.230 -0.856 985 2HD1 LEU1036 2HD1 LEU1036 1.658 -5.032 -0.928 986 3HD1 LEU1036 3HD1 LEU1036 2.669 -3.749 -0.221 987 1HD2 LEU1036 1HD2 LEU1036 4.069 -5.122 2.377 988 2HD2 LEU1036 2HD2 LEU1036 3.727 -6.843 2.079 989 3HD2 LEU1036 3HD2 LEU1036 4.534 -5.867 0.828 990 H ASP1037 H ASP1037 0.139 -4.028 4.815 991 HA ASP1037 HA ASP1037 1.370 -5.733 6.434 992 1HB ASP1037 1HB ASP1037 -0.022 -3.507 6.864 993 2HB ASP1037 2HB ASP1037 -1.312 -4.612 7.295 994 H VAL1038 H VAL1038 -2.040 -5.910 5.233 995 HA VAL1038 HA VAL1038 -2.706 -8.203 6.765 996 HB VAL1038 HB VAL1038 -3.927 -6.740 4.436 997 1HG1 VAL1038 1HG1 VAL1038 -4.397 -9.490 5.160 998 2HG1 VAL1038 2HG1 VAL1038 -5.850 -8.521 5.503 999 3HG1 VAL1038 3HG1 VAL1038 -5.145 -8.520 3.869 1000 1HG2 VAL1038 1HG2 VAL1038 -4.784 -7.131 7.323 1001 2HG2 VAL1038 2HG2 VAL1038 -4.077 -5.657 6.620 1002 3HG2 VAL1038 3HG2 VAL1038 -5.682 -6.215 6.090 1003 H ILE1039 H ILE1039 -1.252 -7.582 3.569 1004 HA ILE1039 HA ILE1039 -1.627 -10.159 2.530 1005 HB ILE1039 HB ILE1039 0.140 -7.827 1.939 1006 1HG1 ILE1039 1HG1 ILE1039 -1.827 -9.370 0.225 1007 2HG1 ILE1039 2HG1 ILE1039 -2.246 -7.965 1.185 1008 1HG2 ILE1039 1HG2 ILE1039 0.827 -9.374 -0.116 1009 2HG2 ILE1039 2HG2 ILE1039 1.780 -9.303 1.385 1010 3HG2 ILE1039 3HG2 ILE1039 0.643 -10.646 1.115 1011 1HD1 ILE1039 1HD1 ILE1039 -1.637 -6.704 -0.600 1012 2HD1 ILE1039 2HD1 ILE1039 0.046 -7.143 -0.225 1013 3HD1 ILE1039 3HD1 ILE1039 -0.881 -8.099 -1.406 1014 H ASP1040 H ASP1040 1.099 -8.639 4.369 1015 HA ASP1040 HA ASP1040 2.849 -10.679 4.280 1016 1HB ASP1040 1HB ASP1040 2.551 -8.310 5.734 1017 2HB ASP1040 2HB ASP1040 2.560 -9.525 6.996 1018 H GLN1041 H GLN1041 0.038 -10.178 6.515 1019 HA GLN1041 HA GLN1041 0.568 -12.534 7.977 1020 1HB GLN1041 1HB GLN1041 -1.509 -10.398 7.935 1021 2HB GLN1041 2HB GLN1041 -2.066 -11.954 8.517 1022 1HG GLN1041 1HG GLN1041 0.245 -11.849 9.910 1023 2HG GLN1041 2HG GLN1041 0.024 -10.125 9.684 1024 1HE2 GLN1041 1HE2 GLN1041 -0.860 -9.222 11.367 1025 2HE2 GLN1041 2HE2 GLN1041 -2.145 -9.845 12.347 1026 H ALA1042 H ALA1042 -0.960 -11.806 4.932 1027 HA ALA1042 HA ALA1042 -2.674 -14.116 4.954 1028 1HB ALA1042 1HB ALA1042 -2.664 -11.698 3.637 1029 2HB ALA1042 2HB ALA1042 -2.048 -12.799 2.381 1030 3HB ALA1042 3HB ALA1042 -3.621 -13.118 3.150 1031 H ARG1043 H ARG1043 0.295 -13.052 3.142 1032 HA ARG1043 HA ARG1043 0.710 -15.234 1.676 1033 1HB ARG1043 1HB ARG1043 2.146 -13.142 1.767 1034 2HB ARG1043 2HB ARG1043 2.896 -13.756 3.228 1035 1HG ARG1043 1HG ARG1043 3.864 -15.640 2.064 1036 2HG ARG1043 2HG ARG1043 2.866 -15.376 0.649 1037 1HD ARG1043 1HD ARG1043 4.651 -14.226 -0.192 1038 2HD ARG1043 2HD ARG1043 4.158 -12.927 0.876 1039 HE ARG1043 HE ARG1043 6.107 -13.310 2.086 1040 1HH1 ARG1043 2HH2 ARG1043 5.134 -16.336 0.577 1041 2HH1 ARG1043 1HH2 ARG1043 6.491 -17.224 1.187 1042 1HH2 ARG1043 2HH1 ARG1043 7.897 -14.480 2.891 1043 2HH2 ARG1043 1HH1 ARG1043 8.073 -16.161 2.512 1044 H LEU1044 H LEU1044 1.514 -14.777 5.166 1045 HA LEU1044 HA LEU1044 2.805 -17.297 5.407 1046 1HB LEU1044 1HB LEU1044 2.766 -16.812 7.797 1047 2HB LEU1044 2HB LEU1044 3.403 -15.484 6.847 1048 HG LEU1044 HG LEU1044 0.996 -14.506 7.003 1049 1HD1 LEU1044 1HD1 LEU1044 0.849 -16.823 8.836 1050 2HD1 LEU1044 2HD1 LEU1044 0.208 -15.288 9.470 1051 3HD1 LEU1044 3HD1 LEU1044 -0.436 -15.963 7.954 1052 1HD2 LEU1044 1HD2 LEU1044 3.060 -14.575 9.193 1053 2HD2 LEU1044 2HD2 LEU1044 2.702 -13.290 8.015 1054 3HD2 LEU1044 3HD2 LEU1044 1.572 -13.610 9.354 1055 H LYS1045 H LYS1045 -0.527 -16.073 5.684 1056 HA LYS1045 HA LYS1045 -1.679 -18.084 7.142 1057 1HB LYS1045 1HB LYS1045 -2.725 -15.946 6.302 1058 2HB LYS1045 2HB LYS1045 -2.918 -16.714 4.740 1059 1HG LYS1045 1HG LYS1045 -3.888 -18.438 6.921 1060 2HG LYS1045 2HG LYS1045 -4.696 -16.883 6.920 1061 1HD LYS1045 1HD LYS1045 -5.036 -17.239 4.367 1062 2HD LYS1045 2HD LYS1045 -4.548 -18.899 4.642 1063 1HE LYS1045 1HE LYS1045 -6.763 -17.624 6.294 1064 2HE LYS1045 2HE LYS1045 -7.100 -18.334 4.728 1065 1HZ LYS1045 1HZ LYS1045 -5.811 -20.315 5.720 1066 2HZ LYS1045 2HZ LYS1045 -6.198 -19.645 7.158 1067 3HZ LYS1045 3HZ LYS1045 -7.378 -20.089 6.120 1068 H MET1046 H MET1046 -0.148 -18.234 4.013 1069 HA MET1046 HA MET1046 -1.530 -20.678 3.353 1070 1HB MET1046 1HB MET1046 -1.141 -19.263 1.453 1071 2HB MET1046 2HB MET1046 0.473 -18.835 1.986 1072 1HG MET1046 1HG MET1046 1.284 -21.124 1.490 1073 2HG MET1046 2HG MET1046 -0.337 -21.636 1.064 1074 1HE MET1046 1HE MET1046 0.857 -17.886 -0.130 1075 2HE MET1046 2HE MET1046 2.141 -18.866 0.619 1076 3HE MET1046 3HE MET1046 2.192 -18.515 -1.126 1077 H ILE1047 H ILE1047 1.482 -19.539 4.787 1078 HA ILE1047 HA ILE1047 3.263 -21.492 4.249 1079 HB ILE1047 HB ILE1047 2.673 -20.000 6.795 1080 1HG1 ILE1047 1HG1 ILE1047 3.523 -18.926 4.569 1081 2HG1 ILE1047 2HG1 ILE1047 4.235 -18.464 6.102 1082 1HG2 ILE1047 1HG2 ILE1047 4.930 -20.701 7.569 1083 2HG2 ILE1047 2HG2 ILE1047 3.748 -22.031 7.505 1084 3HG2 ILE1047 3HG2 ILE1047 4.984 -21.876 6.233 1085 1HD1 ILE1047 1HD1 ILE1047 5.936 -18.952 4.304 1086 2HD1 ILE1047 2HD1 ILE1047 6.134 -19.963 5.755 1087 3HD1 ILE1047 3HD1 ILE1047 5.377 -20.641 4.293 1088 H SER1048 H SER1048 0.763 -21.616 6.885 1089 HA SER1048 HA SER1048 1.365 -24.376 7.285 1090 1HB SER1048 1HB SER1048 0.548 -22.509 9.001 1091 2HB SER1048 2HB SER1048 -1.049 -23.002 8.473 1092 HG SER1048 HG SER1048 0.951 -24.529 9.854 1093 H GLN1049 H GLN1049 0.821 -25.336 5.223 1094 HA GLN1049 HA GLN1049 -1.801 -26.210 5.060 1095 1HB GLN1049 1HB GLN1049 -1.443 -23.651 3.868 1096 2HB GLN1049 2HB GLN1049 -1.535 -24.784 2.534 1097 1HG GLN1049 1HG GLN1049 -3.729 -25.377 2.995 1098 2HG GLN1049 2HG GLN1049 -3.533 -25.198 4.727 1099 1HE2 GLN1049 1HE2 GLN1049 -5.647 -24.151 4.451 1100 2HE2 GLN1049 2HE2 GLN1049 -5.714 -22.453 4.117 1101 H SER1050 H SER1050 1.008 -25.289 2.941 1102 HA SER1050 HA SER1050 1.223 -28.110 2.289 1103 1HB SER1050 1HB SER1050 0.350 -26.074 0.475 1104 2HB SER1050 2HB SER1050 1.975 -26.511 -0.011 1105 HG SER1050 HG SER1050 0.879 -28.079 -1.034 1106 H ARG1051 H ARG1051 2.743 -24.846 1.709 1107 HA ARG1051 HA ARG1051 5.294 -25.793 1.429 1108 1HB ARG1051 1HB ARG1051 4.455 -23.450 0.914 1109 2HB ARG1051 2HB ARG1051 4.456 -23.107 2.632 1110 1HG ARG1051 1HG ARG1051 6.740 -22.889 2.725 1111 2HG ARG1051 2HG ARG1051 7.016 -24.250 1.655 1112 1HD ARG1051 1HD ARG1051 5.869 -22.394 -0.075 1113 2HD ARG1051 2HD ARG1051 6.780 -21.359 1.007 1114 HE ARG1051 HE ARG1051 8.499 -23.500 0.334 1115 1HH1 ARG1051 2HH2 ARG1051 6.848 -20.873 -1.327 1116 2HH1 ARG1051 1HH2 ARG1051 8.040 -20.745 -2.578 1117 1HH2 ARG1051 2HH1 ARG1051 10.072 -23.330 -1.316 1118 2HH2 ARG1051 1HH1 ARG1051 9.886 -22.152 -2.571 1119 HA PRO1052 HA PRO1052 5.983 -26.891 5.654 1120 1HB PRO1052 1HB PRO1052 8.329 -28.240 5.275 1121 2HB PRO1052 2HB PRO1052 6.754 -28.990 5.105 1122 1HG PRO1052 1HG PRO1052 8.648 -28.155 2.994 1123 2HG PRO1052 2HG PRO1052 7.297 -29.264 2.880 1124 1HD PRO1052 1HD PRO1052 7.376 -26.554 1.945 1125 2HD PRO1052 2HD PRO1052 5.989 -27.626 1.936 1126 H HIS1053 H HIS1053 9.269 -26.683 4.561 1127 HA HIS1053 HA HIS1053 9.949 -24.976 6.650 1128 1HB HIS1053 1HB HIS1053 11.281 -25.983 4.170 1129 2HB HIS1053 2HB HIS1053 12.015 -24.625 5.000 1130 HD1 HIS1053 HD1 HIS1053 14.062 -26.123 5.670 1131 HD2 HIS1053 HD2 HIS1053 10.384 -27.389 7.240 1132 HE1 HIS1053 HE1 HIS1053 14.609 -27.835 7.481 Start of MODEL 16 1 H MET 915 H MET 915 12.510 -20.828 -16.479 2 HA MET 915 HA MET 915 13.292 -20.755 -14.209 3 1HB MET 915 1HB MET 915 14.989 -19.504 -16.419 4 2HB MET 915 2HB MET 915 15.678 -19.784 -14.832 5 1HG MET 915 1HG MET 915 15.322 -22.174 -14.987 6 2HG MET 915 2HG MET 915 14.271 -22.003 -16.379 7 1HE MET 915 1HE MET 915 17.637 -23.818 -16.620 8 2HE MET 915 2HE MET 915 15.864 -23.960 -16.574 9 3HE MET 915 3HE MET 915 16.704 -23.795 -18.135 10 H ALA 916 H ALA 916 13.781 -17.564 -15.898 11 HA ALA 916 HA ALA 916 13.746 -16.297 -13.257 12 1HB ALA 916 1HB ALA 916 15.539 -16.056 -15.301 13 2HB ALA 916 2HB ALA 916 14.421 -14.725 -15.688 14 3HB ALA 916 3HB ALA 916 15.223 -14.780 -14.100 15 H ASN 917 H ASN 917 11.279 -17.060 -13.627 16 HA ASN 917 HA ASN 917 9.858 -15.281 -15.337 17 1HB ASN 917 1HB ASN 917 8.789 -17.170 -13.175 18 2HB ASN 917 2HB ASN 917 7.847 -16.452 -14.467 19 1HD2 ASN 917 1HD2 ASN 917 8.978 -19.242 -13.539 20 2HD2 ASN 917 2HD2 ASN 917 9.422 -20.011 -15.026 21 H LEU 918 H LEU 918 7.940 -13.967 -14.332 22 HA LEU 918 HA LEU 918 8.710 -12.956 -11.684 23 1HB LEU 918 1HB LEU 918 8.114 -11.488 -14.222 24 2HB LEU 918 2HB LEU 918 7.684 -10.758 -12.688 25 HG LEU 918 HG LEU 918 10.235 -11.408 -12.129 26 1HD1 LEU 918 1HD1 LEU 918 11.583 -10.777 -14.196 27 2HD1 LEU 918 2HD1 LEU 918 10.875 -12.410 -14.160 28 3HD1 LEU 918 3HD1 LEU 918 10.111 -11.131 -15.133 29 1HD2 LEU 918 1HD2 LEU 918 9.383 -8.929 -13.650 30 2HD2 LEU 918 2HD2 LEU 918 9.199 -9.197 -11.900 31 3HD2 LEU 918 3HD2 LEU 918 10.824 -9.095 -12.619 32 H ASP 919 H ASP 919 7.035 -15.025 -11.630 33 HA ASP 919 HA ASP 919 4.350 -14.098 -11.977 34 1HB ASP 919 1HB ASP 919 5.685 -16.621 -11.824 35 2HB ASP 919 2HB ASP 919 4.594 -16.573 -10.454 36 H ARG 920 H ARG 920 6.723 -14.886 -9.380 37 HA ARG 920 HA ARG 920 4.778 -14.358 -7.351 38 1HB ARG 920 1HB ARG 920 7.545 -15.464 -7.494 39 2HB ARG 920 2HB ARG 920 7.221 -14.534 -6.045 40 1HG ARG 920 1HG ARG 920 5.531 -15.997 -5.307 41 2HG ARG 920 2HG ARG 920 5.166 -16.565 -6.924 42 1HD ARG 920 1HD ARG 920 7.947 -17.160 -6.060 43 2HD ARG 920 2HD ARG 920 6.726 -17.926 -5.064 44 HE ARG 920 HE ARG 920 7.455 -18.764 -7.670 45 1HH1 ARG 920 2HH2 ARG 920 4.478 -18.078 -5.876 46 2HH1 ARG 920 1HH2 ARG 920 3.520 -19.189 -6.797 47 1HH2 ARG 920 1HH1 ARG 920 4.548 -20.444 -8.561 48 H SER 921 H SER 921 4.553 -12.058 -8.417 49 HA SER 921 HA SER 921 6.701 -10.279 -7.999 50 1HB SER 921 1HB SER 921 3.806 -10.023 -8.823 51 2HB SER 921 2HB SER 921 4.685 -8.575 -8.373 52 HG SER 921 HG SER 921 6.026 -10.313 -10.162 53 H ASN 922 H ASN 922 6.810 -11.225 -5.602 54 HA ASN 922 HA ASN 922 4.861 -10.081 -3.863 55 1HB ASN 922 1HB ASN 922 6.116 -11.201 -2.081 56 2HB ASN 922 2HB ASN 922 5.999 -12.309 -3.434 57 1HD2 ASN 922 1HD2 ASN 922 8.036 -10.588 -1.337 58 2HD2 ASN 922 2HD2 ASN 922 9.574 -10.994 -2.025 59 H ASP 923 H ASP 923 8.187 -9.486 -5.039 60 HA ASP 923 HA ASP 923 8.710 -7.505 -3.064 61 1HB ASP 923 1HB ASP 923 10.232 -9.045 -4.860 62 2HB ASP 923 2HB ASP 923 10.361 -7.424 -5.512 63 H LYS 924 H LYS 924 7.697 -7.739 -6.511 64 HA LYS 924 HA LYS 924 7.996 -5.053 -7.190 65 1HB LYS 924 1HB LYS 924 7.743 -6.755 -8.872 66 2HB LYS 924 2HB LYS 924 6.173 -7.225 -8.253 67 1HG LYS 924 1HG LYS 924 5.344 -5.784 -9.821 68 2HG LYS 924 2HG LYS 924 5.762 -4.531 -8.670 69 1HD LYS 924 1HD LYS 924 8.105 -4.493 -9.769 70 2HD LYS 924 2HD LYS 924 7.425 -5.496 -11.035 71 1HE LYS 924 1HE LYS 924 6.620 -3.633 -12.046 72 2HE LYS 924 2HE LYS 924 5.568 -3.362 -10.672 73 1HZ LYS 924 1HZ LYS 924 7.245 -1.583 -11.274 74 2HZ LYS 924 2HZ LYS 924 7.109 -1.979 -9.695 75 3HZ LYS 924 3HZ LYS 924 8.368 -2.538 -10.571 76 H VAL 925 H VAL 925 5.212 -6.882 -5.783 77 HA VAL 925 HA VAL 925 3.466 -4.687 -5.770 78 HB VAL 925 HB VAL 925 3.628 -7.342 -4.391 79 1HG1 VAL 925 1HG1 VAL 925 2.591 -6.361 -2.608 80 2HG1 VAL 925 2HG1 VAL 925 1.949 -5.013 -3.577 81 3HG1 VAL 925 3HG1 VAL 925 1.163 -6.609 -3.641 82 1HG2 VAL 925 1HG2 VAL 925 2.643 -6.508 -6.833 83 2HG2 VAL 925 2HG2 VAL 925 2.210 -8.017 -5.996 84 3HG2 VAL 925 3HG2 VAL 925 1.181 -6.576 -5.820 85 H TYR 926 H TYR 926 5.880 -5.949 -3.418 86 HA TYR 926 HA TYR 926 5.146 -4.150 -1.358 87 1HB TYR 926 1HB TYR 926 7.532 -5.901 -2.156 88 2HB TYR 926 2HB TYR 926 7.654 -4.880 -0.736 89 HD1 TYR 926 HD1 TYR 926 4.411 -6.361 -1.594 90 HD2 TYR 926 HD2 TYR 926 7.993 -6.855 0.693 91 HE1 TYR 926 HE1 TYR 926 3.281 -8.162 -0.199 92 HE2 TYR 926 HE2 TYR 926 6.851 -8.653 2.080 93 HH TYR 926 HH TYR 926 3.456 -9.516 1.470 94 H GLU 927 H GLU 927 6.830 -3.749 -4.357 95 HA GLU 927 HA GLU 927 8.500 -1.646 -3.388 96 1HB GLU 927 1HB GLU 927 7.943 -2.849 -6.115 97 2HB GLU 927 2HB GLU 927 8.865 -1.366 -5.970 98 1HG GLU 927 1HG GLU 927 9.666 -3.644 -4.177 99 2HG GLU 927 2HG GLU 927 10.020 -3.819 -5.884 100 H ASN 928 H ASN 928 5.923 -1.785 -5.962 101 HA ASN 928 HA ASN 928 5.550 0.781 -6.402 102 1HB ASN 928 1HB ASN 928 3.297 -1.239 -5.911 103 2HB ASN 928 2HB ASN 928 3.116 0.257 -6.806 104 1HD2 ASN 928 1HD2 ASN 928 3.554 0.308 -8.897 105 2HD2 ASN 928 2HD2 ASN 928 4.305 -0.948 -9.823 106 H VAL 929 H VAL 929 4.332 -1.110 -3.573 107 HA VAL 929 HA VAL 929 2.740 0.890 -2.456 108 HB VAL 929 HB VAL 929 4.107 -1.587 -1.476 109 1HG1 VAL 929 1HG1 VAL 929 2.886 -1.217 0.729 110 2HG1 VAL 929 2HG1 VAL 929 4.344 -0.234 0.458 111 3HG1 VAL 929 3HG1 VAL 929 2.731 0.489 0.246 112 1HG2 VAL 929 1HG2 VAL 929 1.741 -2.258 -1.036 113 2HG2 VAL 929 2HG2 VAL 929 1.214 -0.705 -1.729 114 3HG2 VAL 929 3HG2 VAL 929 2.074 -1.887 -2.745 115 H THR 930 H THR 930 6.046 -0.189 -1.381 116 HA THR 930 HA THR 930 6.537 1.869 0.353 117 HB THR 930 HB THR 930 9.013 1.329 -0.415 118 HG1 THR 930 HG1 THR 930 9.014 -0.041 -2.160 119 1HG2 THR 930 1HG2 THR 930 9.018 -0.695 0.831 120 2HG2 THR 930 2HG2 THR 930 7.581 0.138 1.471 121 3HG2 THR 930 3HG2 THR 930 7.396 -1.154 0.262 122 H GLY 931 H GLY 931 7.188 1.815 -3.205 123 1HA GLY 931 1HA GLY 931 8.370 4.337 -3.361 124 2HA GLY 931 2HA GLY 931 7.539 3.495 -4.654 125 H LEU 932 H LEU 932 5.003 3.354 -2.877 126 HA LEU 932 HA LEU 932 3.946 5.860 -3.798 127 1HB LEU 932 1HB LEU 932 2.120 4.653 -3.981 128 2HB LEU 932 2HB LEU 932 2.976 3.270 -3.328 129 HG LEU 932 HG LEU 932 2.296 3.916 -1.045 130 1HD1 LEU 932 1HD1 LEU 932 1.724 6.020 -0.627 131 2HD1 LEU 932 2HD1 LEU 932 1.568 6.386 -2.362 132 3HD1 LEU 932 3HD1 LEU 932 0.185 5.711 -1.467 133 1HD2 LEU 932 1HD2 LEU 932 -0.265 3.620 -1.488 134 2HD2 LEU 932 2HD2 LEU 932 0.252 3.382 -3.175 135 3HD2 LEU 932 3HD2 LEU 932 0.875 2.314 -1.894 136 H VAL 933 H VAL 933 4.168 4.172 -0.583 137 HA VAL 933 HA VAL 933 3.374 6.457 0.851 138 HB VAL 933 HB VAL 933 4.298 5.157 2.789 139 1HG1 VAL 933 1HG1 VAL 933 2.544 3.383 1.092 140 2HG1 VAL 933 2HG1 VAL 933 2.485 3.680 2.846 141 3HG1 VAL 933 3HG1 VAL 933 1.951 4.943 1.710 142 1HG2 VAL 933 1HG2 VAL 933 5.861 3.613 2.396 143 2HG2 VAL 933 2HG2 VAL 933 4.603 2.612 1.630 144 3HG2 VAL 933 3HG2 VAL 933 5.593 3.711 0.639 145 H LYS 934 H LYS 934 6.437 5.354 -0.521 146 HA LYS 934 HA LYS 934 8.112 6.911 1.131 147 1HB LYS 934 1HB LYS 934 8.435 5.548 -1.541 148 2HB LYS 934 2HB LYS 934 9.708 6.553 -0.879 149 1HG LYS 934 1HG LYS 934 8.589 4.664 1.107 150 2HG LYS 934 2HG LYS 934 9.283 3.855 -0.283 151 1HD LYS 934 1HD LYS 934 11.242 4.091 0.897 152 2HD LYS 934 2HD LYS 934 11.252 5.681 0.162 153 1HE LYS 934 1HE LYS 934 11.511 6.301 2.387 154 2HE LYS 934 2HE LYS 934 9.761 6.327 2.293 155 1HZ LYS 934 1HZ LYS 934 11.022 3.807 2.959 156 2HZ LYS 934 2HZ LYS 934 11.007 4.967 4.108 157 3HZ LYS 934 3HZ LYS 934 9.602 4.426 3.476 158 H ALA 935 H ALA 935 6.320 7.503 -1.919 159 HA ALA 935 HA ALA 935 7.545 10.043 -2.346 160 1HB ALA 935 1HB ALA 935 6.231 10.105 -4.268 161 2HB ALA 935 2HB ALA 935 6.369 8.352 -3.996 162 3HB ALA 935 3HB ALA 935 4.891 9.214 -3.508 163 H VAL 936 H VAL 936 4.256 8.946 -1.247 164 HA VAL 936 HA VAL 936 3.052 11.286 -0.790 165 HB VAL 936 HB VAL 936 2.623 8.681 -0.130 166 1HG1 VAL 936 1HG1 VAL 936 3.878 8.821 1.956 167 2HG1 VAL 936 2HG1 VAL 936 2.892 10.206 2.483 168 3HG1 VAL 936 3HG1 VAL 936 2.145 8.601 2.297 169 1HG2 VAL 936 1HG2 VAL 936 1.168 11.244 0.343 170 2HG2 VAL 936 2HG2 VAL 936 0.719 9.835 -0.647 171 3HG2 VAL 936 3HG2 VAL 936 0.530 9.777 1.122 172 H ILE 937 H ILE 937 5.757 9.886 1.082 173 HA ILE 937 HA ILE 937 5.586 11.998 3.045 174 HB ILE 937 HB ILE 937 7.336 9.587 2.649 175 1HG1 ILE 937 1HG1 ILE 937 5.779 10.252 5.124 176 2HG1 ILE 937 2HG1 ILE 937 4.915 9.673 3.713 177 1HG2 ILE 937 1HG2 ILE 937 7.758 11.906 4.535 178 2HG2 ILE 937 2HG2 ILE 937 8.373 10.271 4.878 179 3HG2 ILE 937 3HG2 ILE 937 8.919 11.141 3.424 180 1HD1 ILE 937 1HD1 ILE 937 7.089 8.264 5.295 181 2HD1 ILE 937 2HD1 ILE 937 5.450 7.691 4.903 182 3HD1 ILE 937 3HD1 ILE 937 6.695 7.765 3.633 183 H GLU 938 H GLU 938 8.227 10.796 0.849 184 HA GLU 938 HA GLU 938 9.974 12.712 1.012 185 1HB GLU 938 1HB GLU 938 9.522 10.743 -0.803 186 2HB GLU 938 2HB GLU 938 9.189 12.129 -1.821 187 1HG GLU 938 1HG GLU 938 11.429 12.339 -2.117 188 2HG GLU 938 2HG GLU 938 11.529 12.875 -0.451 189 H MET 939 H MET 939 7.030 13.011 -1.103 190 HA MET 939 HA MET 939 7.404 15.413 -2.161 191 1HB MET 939 1HB MET 939 5.377 14.032 -2.518 192 2HB MET 939 2HB MET 939 4.866 14.283 -0.860 193 1HG MET 939 1HG MET 939 4.925 16.853 -1.485 194 2HG MET 939 2HG MET 939 4.903 16.286 -3.143 195 1HE MET 939 1HE MET 939 2.938 13.388 -1.729 196 2HE MET 939 2HE MET 939 1.790 13.877 -2.998 197 3HE MET 939 3HE MET 939 3.539 13.887 -3.328 198 H SER 940 H SER 940 5.608 15.004 0.985 199 HA SER 940 HA SER 940 5.295 17.533 1.674 200 1HB SER 940 1HB SER 940 5.113 16.817 3.927 201 2HB SER 940 2HB SER 940 4.747 15.382 2.990 202 HG SER 940 HG SER 940 6.984 14.694 3.294 203 H SER 941 H SER 941 8.363 15.673 1.805 204 HA SER 941 HA SER 941 9.816 17.485 3.291 205 1HB SER 941 1HB SER 941 10.406 15.075 2.523 206 2HB SER 941 2HB SER 941 10.969 15.807 1.034 207 HG SER 941 HG SER 941 12.449 15.474 3.116 208 H LYS 942 H LYS 942 9.297 17.177 -0.280 209 HA LYS 942 HA LYS 942 10.554 19.814 -0.575 210 1HB LYS 942 1HB LYS 942 10.825 19.127 -2.980 211 2HB LYS 942 2HB LYS 942 11.785 18.223 -1.827 212 1HG LYS 942 1HG LYS 942 10.698 16.260 -2.274 213 2HG LYS 942 2HG LYS 942 9.119 17.022 -2.259 214 1HD LYS 942 1HD LYS 942 10.979 17.560 -4.585 215 2HD LYS 942 2HD LYS 942 10.128 16.029 -4.519 216 1HE LYS 942 1HE LYS 942 8.194 17.004 -5.203 217 2HE LYS 942 2HE LYS 942 8.262 18.170 -3.897 218 1HZ LYS 942 1HZ LYS 942 10.034 19.254 -5.395 219 2HZ LYS 942 2HZ LYS 942 9.322 18.402 -6.593 220 3HZ LYS 942 3HZ LYS 942 8.451 19.480 -5.729 221 H ILE 943 H ILE 943 7.805 19.264 0.418 222 HA ILE 943 HA ILE 943 6.194 20.095 -1.863 223 HB ILE 943 HB ILE 943 5.696 18.259 0.007 224 1HG1 ILE 943 1HG1 ILE 943 4.404 18.829 -2.071 225 2HG1 ILE 943 2HG1 ILE 943 3.437 18.277 -0.717 226 1HG2 ILE 943 1HG2 ILE 943 5.723 19.709 1.913 227 2HG2 ILE 943 2HG2 ILE 943 4.574 20.830 1.145 228 3HG2 ILE 943 3HG2 ILE 943 4.043 19.200 1.624 229 1HD1 ILE 943 1HD1 ILE 943 2.313 20.201 -1.656 230 2HD1 ILE 943 2HD1 ILE 943 3.032 20.725 -0.114 231 3HD1 ILE 943 3HD1 ILE 943 3.817 21.153 -1.653 232 H GLN 944 H GLN 944 6.995 21.111 1.527 233 HA GLN 944 HA GLN 944 5.625 23.377 1.698 234 1HB GLN 944 1HB GLN 944 7.879 22.243 2.986 235 2HB GLN 944 2HB GLN 944 8.366 23.877 2.584 236 1HG GLN 944 1HG GLN 944 5.951 24.507 3.541 237 2HG GLN 944 2HG GLN 944 6.089 22.958 4.349 238 1HE2 GLN 944 1HE2 GLN 944 6.430 23.505 6.391 239 2HE2 GLN 944 2HE2 GLN 944 7.738 24.470 6.990 240 HA PRO 945 HA PRO 945 8.867 25.714 -0.854 241 1HB PRO 945 1HB PRO 945 10.862 24.351 -2.131 242 2HB PRO 945 2HB PRO 945 11.067 25.101 -0.561 243 1HG PRO 945 1HG PRO 945 10.751 22.236 -1.218 244 2HG PRO 945 2HG PRO 945 11.371 22.964 0.251 245 1HD PRO 945 1HD PRO 945 8.774 21.806 -0.127 246 2HD PRO 945 2HD PRO 945 9.354 22.636 1.303 247 H ALA 946 H ALA 946 8.593 22.539 -2.384 248 HA ALA 946 HA ALA 946 8.405 23.083 -4.938 249 1HB ALA 946 1HB ALA 946 7.877 20.894 -4.487 250 2HB ALA 946 2HB ALA 946 6.816 21.316 -3.122 251 3HB ALA 946 3HB ALA 946 6.231 21.498 -4.793 252 HA PRO 947 HA PRO 947 5.434 26.230 -5.382 253 1HB PRO 947 1HB PRO 947 5.529 26.474 -8.102 254 2HB PRO 947 2HB PRO 947 6.668 27.262 -7.029 255 1HG PRO 947 1HG PRO 947 7.073 24.886 -8.740 256 2HG PRO 947 2HG PRO 947 8.276 25.928 -8.006 257 1HD PRO 947 1HD PRO 947 7.500 23.312 -7.121 258 2HD PRO 947 2HD PRO 947 8.617 24.400 -6.322 259 HA PRO 948 HA PRO 948 1.693 24.582 -6.551 260 1HB PRO 948 1HB PRO 948 0.355 26.536 -7.914 261 2HB PRO 948 2HB PRO 948 0.496 26.511 -6.167 262 1HG PRO 948 1HG PRO 948 1.910 28.226 -8.116 263 2HG PRO 948 2HG PRO 948 1.710 28.459 -6.391 264 1HD PRO 948 1HD PRO 948 4.071 27.540 -7.737 265 2HD PRO 948 2HD PRO 948 3.832 27.663 -6.005 266 H GLU 949 H GLU 949 3.820 25.481 -8.997 267 HA GLU 949 HA GLU 949 2.178 24.313 -11.040 268 1HB GLU 949 1HB GLU 949 4.831 25.743 -10.947 269 2HB GLU 949 2HB GLU 949 4.484 24.731 -12.335 270 1HG GLU 949 1HG GLU 949 2.101 26.138 -12.048 271 2HG GLU 949 2HG GLU 949 3.283 27.330 -11.548 272 H GLU 950 H GLU 950 4.865 23.458 -8.889 273 HA GLU 950 HA GLU 950 5.336 21.038 -10.393 274 1HB GLU 950 1HB GLU 950 7.082 22.674 -9.131 275 2HB GLU 950 2HB GLU 950 6.742 21.589 -7.797 276 1HG GLU 950 1HG GLU 950 7.877 19.850 -8.758 277 2HG GLU 950 2HG GLU 950 7.189 20.150 -10.342 278 H TYR 951 H TYR 951 3.175 22.133 -8.068 279 HA TYR 951 HA TYR 951 3.181 19.705 -6.477 280 1HB TYR 951 1HB TYR 951 2.773 22.202 -5.745 281 2HB TYR 951 2HB TYR 951 1.239 22.090 -6.584 282 HD1 TYR 951 HD1 TYR 951 1.641 18.893 -5.397 283 HD2 TYR 951 HD2 TYR 951 0.917 22.846 -3.931 284 HE1 TYR 951 HE1 TYR 951 0.567 17.928 -3.304 285 HE2 TYR 951 HE2 TYR 951 -0.154 21.868 -1.843 286 HH TYR 951 HH TYR 951 -1.315 18.987 -1.596 287 H VAL 952 H VAL 952 1.114 21.441 -8.884 288 HA VAL 952 HA VAL 952 -1.113 19.887 -8.803 289 HB VAL 952 HB VAL 952 0.274 21.578 -10.762 290 1HG1 VAL 952 1HG1 VAL 952 -1.693 19.466 -11.703 291 2HG1 VAL 952 2HG1 VAL 952 -1.225 20.902 -12.645 292 3HG1 VAL 952 3HG1 VAL 952 -0.004 19.676 -12.224 293 1HG2 VAL 952 1HG2 VAL 952 -2.278 21.419 -9.327 294 2HG2 VAL 952 2HG2 VAL 952 -1.385 22.837 -9.927 295 3HG2 VAL 952 3HG2 VAL 952 -2.458 21.933 -11.021 296 HA PRO 953 HA PRO 953 1.117 16.744 -11.556 297 1HB PRO 953 1HB PRO 953 3.831 16.881 -11.847 298 2HB PRO 953 2HB PRO 953 2.707 17.556 -13.010 299 1HG PRO 953 1HG PRO 953 4.368 18.960 -11.008 300 2HG PRO 953 2HG PRO 953 3.581 19.611 -12.432 301 1HD PRO 953 1HD PRO 953 2.710 19.888 -9.714 302 2HD PRO 953 2HD PRO 953 1.864 20.438 -11.147 303 H MET 954 H MET 954 3.475 17.703 -9.101 304 HA MET 954 HA MET 954 4.417 15.409 -8.298 305 1HB MET 954 1HB MET 954 3.750 17.955 -7.046 306 2HB MET 954 2HB MET 954 3.472 16.679 -5.878 307 1HG MET 954 1HG MET 954 5.721 16.062 -5.793 308 2HG MET 954 2HG MET 954 6.025 16.517 -7.457 309 1HE MET 954 1HE MET 954 5.620 18.375 -3.675 310 2HE MET 954 2HE MET 954 4.862 19.748 -4.518 311 3HE MET 954 3HE MET 954 4.183 18.111 -4.692 312 H VAL 955 H VAL 955 1.145 16.610 -7.273 313 HA VAL 955 HA VAL 955 0.533 14.286 -5.802 314 HB VAL 955 HB VAL 955 -1.031 16.591 -6.933 315 1HG1 VAL 955 1HG1 VAL 955 -3.051 15.784 -5.878 316 2HG1 VAL 955 2HG1 VAL 955 -2.461 14.547 -7.014 317 3HG1 VAL 955 3HG1 VAL 955 -2.204 14.343 -5.265 318 1HG2 VAL 955 1HG2 VAL 955 -0.379 17.530 -5.017 319 2HG2 VAL 955 2HG2 VAL 955 -1.359 16.327 -4.145 320 3HG2 VAL 955 3HG2 VAL 955 0.362 16.008 -4.467 321 H LYS 956 H LYS 956 -0.234 15.392 -9.162 322 HA LYS 956 HA LYS 956 -1.902 13.405 -9.942 323 1HB LYS 956 1HB LYS 956 0.247 14.919 -11.426 324 2HB LYS 956 2HB LYS 956 -0.772 13.748 -12.239 325 1HG LYS 956 1HG LYS 956 -2.058 15.875 -10.507 326 2HG LYS 956 2HG LYS 956 -1.501 16.302 -12.113 327 1HD LYS 956 1HD LYS 956 -3.310 13.899 -11.623 328 2HD LYS 956 2HD LYS 956 -3.958 15.506 -11.888 329 1HE LYS 956 1HE LYS 956 -3.779 15.168 -14.123 330 2HE LYS 956 2HE LYS 956 -2.035 15.136 -13.950 331 1HZ LYS 956 1HZ LYS 956 -2.885 13.124 -14.942 332 2HZ LYS 956 2HZ LYS 956 -2.166 12.788 -13.514 333 3HZ LYS 956 3HZ LYS 956 -3.795 12.805 -13.624 334 H GLU 957 H GLU 957 1.665 13.275 -9.549 335 HA GLU 957 HA GLU 957 2.028 10.824 -10.760 336 1HB GLU 957 1HB GLU 957 4.013 11.979 -10.347 337 2HB GLU 957 2HB GLU 957 3.532 12.462 -8.733 338 1HG GLU 957 1HG GLU 957 4.046 10.334 -7.799 339 2HG GLU 957 2HG GLU 957 3.987 9.527 -9.354 340 H VAL 958 H VAL 958 1.794 11.560 -7.197 341 HA VAL 958 HA VAL 958 1.823 9.070 -6.196 342 HB VAL 958 HB VAL 958 0.054 11.394 -5.416 343 1HG1 VAL 958 1HG1 VAL 958 -0.323 8.868 -4.510 344 2HG1 VAL 958 2HG1 VAL 958 0.915 9.432 -3.361 345 3HG1 VAL 958 3HG1 VAL 958 -0.615 10.326 -3.531 346 1HG2 VAL 958 1HG2 VAL 958 1.887 12.357 -4.584 347 2HG2 VAL 958 2HG2 VAL 958 2.316 10.880 -3.688 348 3HG2 VAL 958 3HG2 VAL 958 2.856 11.089 -5.372 349 H GLY 959 H GLY 959 -0.814 10.624 -8.035 350 1HA GLY 959 1HA GLY 959 -2.827 8.734 -7.453 351 2HA GLY 959 2HA GLY 959 -2.769 9.833 -8.817 352 H LEU 960 H LEU 960 -0.402 9.024 -10.140 353 HA LEU 960 HA LEU 960 -1.319 6.898 -11.648 354 1HB LEU 960 1HB LEU 960 0.746 8.744 -11.739 355 2HB LEU 960 2HB LEU 960 1.581 7.207 -11.639 356 HG LEU 960 HG LEU 960 -0.557 7.841 -13.691 357 1HD1 LEU 960 1HD1 LEU 960 2.176 8.723 -13.563 358 2HD1 LEU 960 2HD1 LEU 960 1.968 7.603 -14.931 359 3HD1 LEU 960 3HD1 LEU 960 0.937 9.048 -14.798 360 1HD2 LEU 960 1HD2 LEU 960 0.104 5.395 -12.932 361 2HD2 LEU 960 2HD2 LEU 960 -0.184 5.797 -14.642 362 3HD2 LEU 960 3HD2 LEU 960 1.481 5.681 -14.023 363 H ALA 961 H ALA 961 0.872 6.994 -8.798 364 HA ALA 961 HA ALA 961 1.733 4.361 -8.907 365 1HB ALA 961 1HB ALA 961 2.494 4.739 -6.710 366 2HB ALA 961 2HB ALA 961 2.452 6.371 -7.420 367 3HB ALA 961 3HB ALA 961 1.147 5.839 -6.332 368 H LEU 962 H LEU 962 -1.255 5.842 -7.543 369 HA LEU 962 HA LEU 962 -2.194 3.566 -6.251 370 1HB LEU 962 1HB LEU 962 -3.207 6.178 -7.088 371 2HB LEU 962 2HB LEU 962 -4.441 4.934 -7.087 372 HG LEU 962 HG LEU 962 -4.509 6.007 -4.970 373 1HD1 LEU 962 1HD1 LEU 962 -4.386 3.354 -5.195 374 2HD1 LEU 962 2HD1 LEU 962 -2.973 3.595 -4.139 375 3HD1 LEU 962 3HD1 LEU 962 -4.575 4.175 -3.627 376 1HD2 LEU 962 1HD2 LEU 962 -1.735 5.344 -4.146 377 2HD2 LEU 962 2HD2 LEU 962 -1.931 6.676 -5.310 378 3HD2 LEU 962 3HD2 LEU 962 -2.760 6.740 -3.736 379 H ARG 963 H ARG 963 -2.818 4.802 -9.604 380 HA ARG 963 HA ARG 963 -4.542 2.881 -10.386 381 1HB ARG 963 1HB ARG 963 -3.224 4.971 -11.612 382 2HB ARG 963 2HB ARG 963 -2.456 3.611 -12.406 383 1HG ARG 963 1HG ARG 963 -4.320 4.010 -13.791 384 2HG ARG 963 2HG ARG 963 -4.889 2.705 -12.769 385 1HD ARG 963 1HD ARG 963 -5.425 5.208 -11.414 386 2HD ARG 963 2HD ARG 963 -6.006 5.344 -13.061 387 HE ARG 963 HE ARG 963 -7.122 3.661 -10.975 388 1HH1 ARG 963 2HH2 ARG 963 -6.654 3.884 -14.455 389 2HH1 ARG 963 1HH2 ARG 963 -8.013 2.878 -14.831 390 1HH2 ARG 963 2HH1 ARG 963 -8.915 2.333 -11.470 391 2HH2 ARG 963 1HH1 ARG 963 -9.308 1.990 -13.122 392 H THR 964 H THR 964 -0.925 2.857 -10.862 393 HA THR 964 HA THR 964 -0.813 0.246 -11.870 394 HB THR 964 HB THR 964 1.240 2.005 -10.426 395 HG1 THR 964 HG1 THR 964 1.665 2.556 -12.662 396 1HG2 THR 964 1HG2 THR 964 2.289 0.263 -12.503 397 2HG2 THR 964 2HG2 THR 964 2.786 0.365 -10.796 398 3HG2 THR 964 3HG2 THR 964 1.467 -0.730 -11.275 399 H LEU 965 H LEU 965 -0.487 1.514 -8.506 400 HA LEU 965 HA LEU 965 0.267 -0.780 -7.254 401 1HB LEU 965 1HB LEU 965 0.175 1.256 -6.072 402 2HB LEU 965 2HB LEU 965 -1.530 1.480 -6.409 403 HG LEU 965 HG LEU 965 -0.826 0.771 -4.042 404 1HD1 LEU 965 1HD1 LEU 965 -2.871 -0.434 -3.689 405 2HD1 LEU 965 2HD1 LEU 965 -3.152 0.805 -4.936 406 3HD1 LEU 965 3HD1 LEU 965 -2.952 -0.900 -5.405 407 1HD2 LEU 965 1HD2 LEU 965 -0.250 -1.736 -5.582 408 2HD2 LEU 965 2HD2 LEU 965 0.650 -0.982 -4.245 409 3HD2 LEU 965 3HD2 LEU 965 -0.871 -1.845 -3.917 410 H LEU 966 H LEU 966 -3.067 0.223 -8.230 411 HA LEU 966 HA LEU 966 -4.449 -1.856 -7.093 412 1HB LEU 966 1HB LEU 966 -4.846 0.024 -9.336 413 2HB LEU 966 2HB LEU 966 -5.826 -1.428 -9.389 414 HG LEU 966 HG LEU 966 -6.088 -0.557 -6.753 415 1HD1 LEU 966 1HD1 LEU 966 -5.399 1.587 -6.778 416 2HD1 LEU 966 2HD1 LEU 966 -5.564 1.738 -8.544 417 3HD1 LEU 966 3HD1 LEU 966 -6.999 1.877 -7.501 418 1HD2 LEU 966 1HD2 LEU 966 -7.766 -1.517 -8.433 419 2HD2 LEU 966 2HD2 LEU 966 -8.360 -0.310 -7.267 420 3HD2 LEU 966 3HD2 LEU 966 -8.024 0.167 -8.949 421 H ALA 967 H ALA 967 -3.311 -1.718 -10.547 422 HA ALA 967 HA ALA 967 -3.863 -4.367 -11.107 423 1HB ALA 967 1HB ALA 967 -3.032 -2.225 -12.520 424 2HB ALA 967 2HB ALA 967 -1.481 -3.085 -12.377 425 3HB ALA 967 3HB ALA 967 -2.880 -3.892 -13.125 426 H THR 968 H THR 968 -0.843 -2.817 -9.848 427 HA THR 968 HA THR 968 0.785 -5.038 -9.858 428 HB THR 968 HB THR 968 0.549 -2.537 -8.141 429 HG1 THR 968 HG1 THR 968 2.514 -2.180 -9.446 430 1HG2 THR 968 1HG2 THR 968 1.678 -4.575 -6.892 431 2HG2 THR 968 2HG2 THR 968 2.967 -4.382 -8.105 432 3HG2 THR 968 3HG2 THR 968 2.576 -3.042 -7.000 433 H VAL 969 H VAL 969 -1.817 -4.150 -7.570 434 HA VAL 969 HA VAL 969 -1.138 -6.082 -5.643 435 HB VAL 969 HB VAL 969 -3.786 -4.779 -6.310 436 1HG1 VAL 969 1HG1 VAL 969 -3.753 -6.906 -4.833 437 2HG1 VAL 969 2HG1 VAL 969 -2.986 -5.865 -3.610 438 3HG1 VAL 969 3HG1 VAL 969 -4.607 -5.467 -4.228 439 1HG2 VAL 969 1HG2 VAL 969 -2.981 -2.890 -5.443 440 2HG2 VAL 969 2HG2 VAL 969 -2.506 -3.739 -3.953 441 3HG2 VAL 969 3HG2 VAL 969 -1.376 -3.651 -5.326 442 H ASP 970 H ASP 970 -3.199 -6.109 -8.592 443 HA ASP 970 HA ASP 970 -4.495 -8.444 -8.219 444 1HB ASP 970 1HB ASP 970 -4.458 -6.725 -10.220 445 2HB ASP 970 2HB ASP 970 -3.221 -7.768 -10.893 446 H GLU 971 H GLU 971 -1.084 -7.811 -9.076 447 HA GLU 971 HA GLU 971 -0.541 -10.452 -9.908 448 1HB GLU 971 1HB GLU 971 1.152 -8.039 -9.206 449 2HB GLU 971 2HB GLU 971 1.911 -9.590 -9.501 450 1HG GLU 971 1HG GLU 971 0.368 -9.578 -11.687 451 2HG GLU 971 2HG GLU 971 0.352 -7.847 -11.417 452 H SER 972 H SER 972 -0.832 -8.820 -6.826 453 HA SER 972 HA SER 972 0.796 -10.745 -5.469 454 1HB SER 972 1HB SER 972 0.924 -9.072 -3.963 455 2HB SER 972 2HB SER 972 -0.190 -8.122 -4.926 456 HG SER 972 HG SER 972 -1.907 -8.771 -3.690 457 H LEU 973 H LEU 973 -2.599 -10.169 -6.297 458 HA LEU 973 HA LEU 973 -4.014 -11.459 -4.424 459 1HB LEU 973 1HB LEU 973 -4.245 -11.015 -7.307 460 2HB LEU 973 2HB LEU 973 -5.123 -12.428 -6.756 461 HG LEU 973 HG LEU 973 -5.519 -9.999 -5.113 462 1HD1 LEU 973 1HD1 LEU 973 -7.334 -9.543 -7.152 463 2HD1 LEU 973 2HD1 LEU 973 -5.872 -8.590 -6.803 464 3HD1 LEU 973 3HD1 LEU 973 -5.816 -9.893 -8.014 465 1HD2 LEU 973 1HD2 LEU 973 -7.979 -10.938 -5.832 466 2HD2 LEU 973 2HD2 LEU 973 -6.987 -12.413 -5.940 467 3HD2 LEU 973 3HD2 LEU 973 -7.045 -11.488 -4.420 468 HA PRO 974 HA PRO 974 -2.693 -15.652 -6.158 469 1HB PRO 974 1HB PRO 974 -0.679 -15.808 -7.999 470 2HB PRO 974 2HB PRO 974 -2.377 -15.799 -8.434 471 1HG PRO 974 1HG PRO 974 -0.390 -13.625 -8.680 472 2HG PRO 974 2HG PRO 974 -1.941 -13.789 -9.478 473 1HD PRO 974 1HD PRO 974 -1.327 -12.083 -7.255 474 2HD PRO 974 2HD PRO 974 -2.903 -12.335 -7.979 475 H VAL 975 H VAL 975 -0.058 -13.368 -5.902 476 HA VAL 975 HA VAL 975 1.854 -15.083 -4.914 477 HB VAL 975 HB VAL 975 1.262 -12.169 -4.398 478 1HG1 VAL 975 1HG1 VAL 975 2.540 -12.817 -2.502 479 2HG1 VAL 975 2HG1 VAL 975 3.617 -13.840 -3.483 480 3HG1 VAL 975 3HG1 VAL 975 3.686 -12.068 -3.639 481 1HG2 VAL 975 1HG2 VAL 975 1.907 -13.080 -6.725 482 2HG2 VAL 975 2HG2 VAL 975 2.828 -11.699 -6.082 483 3HG2 VAL 975 3HG2 VAL 975 3.524 -13.336 -6.025 484 H LEU 976 H LEU 976 -0.999 -13.622 -3.340 485 HA LEU 976 HA LEU 976 -0.203 -14.974 -0.859 486 1HB LEU 976 1HB LEU 976 -2.185 -12.724 -1.212 487 2HB LEU 976 2HB LEU 976 -1.639 -13.421 0.300 488 HG LEU 976 HG LEU 976 -0.490 -11.387 0.106 489 1HD1 LEU 976 1HD1 LEU 976 1.423 -13.516 -0.893 490 2HD1 LEU 976 2HD1 LEU 976 1.866 -11.997 -0.078 491 3HD1 LEU 976 3HD1 LEU 976 0.948 -13.244 0.801 492 1HD2 LEU 976 1HD2 LEU 976 -1.026 -11.100 -2.342 493 2HD2 LEU 976 2HD2 LEU 976 0.577 -10.521 -1.830 494 3HD2 LEU 976 3HD2 LEU 976 0.424 -12.069 -2.695 495 HA PRO 977 HA PRO 977 -3.577 -17.625 -1.309 496 1HB PRO 977 1HB PRO 977 -4.247 -18.192 1.279 497 2HB PRO 977 2HB PRO 977 -2.894 -18.940 0.453 498 1HG PRO 977 1HG PRO 977 -2.866 -16.822 2.515 499 2HG PRO 977 2HG PRO 977 -1.558 -17.865 1.996 500 1HD PRO 977 1HD PRO 977 -1.936 -15.109 1.296 501 2HD PRO 977 2HD PRO 977 -0.694 -16.185 0.686 502 H ALA 978 H ALA 978 -5.888 -18.126 0.059 503 HA ALA 978 HA ALA 978 -7.461 -15.983 -0.917 504 1HB ALA 978 1HB ALA 978 -8.240 -18.268 0.937 505 2HB ALA 978 2HB ALA 978 -9.319 -17.318 -0.113 506 3HB ALA 978 3HB ALA 978 -8.114 -18.412 -0.833 507 H SER 979 H SER 979 -9.158 -14.882 0.537 508 HA SER 979 HA SER 979 -9.728 -13.715 2.296 509 1HB SER 979 1HB SER 979 -8.585 -15.787 3.576 510 2HB SER 979 2HB SER 979 -7.404 -14.567 4.008 511 HG SER 979 HG SER 979 -10.247 -14.528 4.541 512 H THR 980 H THR 980 -7.824 -12.899 0.187 513 HA THR 980 HA THR 980 -6.324 -10.848 1.682 514 HB THR 980 HB THR 980 -5.023 -11.009 -0.705 515 HG1 THR 980 HG1 THR 980 -6.052 -13.668 -0.011 516 1HG2 THR 980 1HG2 THR 980 -3.371 -12.399 0.345 517 2HG2 THR 980 2HG2 THR 980 -4.136 -11.536 1.700 518 3HG2 THR 980 3HG2 THR 980 -4.589 -13.221 1.349 519 H HIS 981 H HIS 981 -7.777 -11.484 -1.586 520 HA HIS 981 HA HIS 981 -7.945 -8.931 -2.427 521 1HB HIS 981 1HB HIS 981 -10.214 -9.842 -3.485 522 2HB HIS 981 2HB HIS 981 -8.633 -10.347 -4.048 523 HD1 HIS 981 HD1 HIS 981 -11.709 -11.601 -2.343 524 HD2 HIS 981 HD2 HIS 981 -7.866 -13.005 -3.268 525 HE1 HIS 981 HE1 HIS 981 -11.768 -14.128 -1.994 526 H ARG 982 H ARG 982 -10.321 -10.666 -0.312 527 HA ARG 982 HA ARG 982 -12.205 -8.766 -0.140 528 1HB ARG 982 1HB ARG 982 -12.406 -10.959 0.961 529 2HB ARG 982 2HB ARG 982 -11.106 -10.572 2.070 530 1HG ARG 982 1HG ARG 982 -12.741 -8.458 2.590 531 2HG ARG 982 2HG ARG 982 -13.952 -9.611 2.064 532 1HD ARG 982 1HD ARG 982 -11.857 -10.453 4.093 533 2HD ARG 982 2HD ARG 982 -13.250 -9.528 4.615 534 HE ARG 982 HE ARG 982 -13.240 -12.318 3.888 535 1HH1 ARG 982 2HH2 ARG 982 -15.227 -9.423 3.662 536 2HH1 ARG 982 1HH2 ARG 982 -16.720 -10.298 3.590 537 1HH2 ARG 982 2HH1 ARG 982 -15.209 -13.473 3.794 538 2HH2 ARG 982 1HH1 ARG 982 -16.709 -12.618 3.666 539 H GLU 983 H GLU 983 -9.897 -9.205 2.628 540 HA GLU 983 HA GLU 983 -10.275 -6.732 3.678 541 1HB GLU 983 1HB GLU 983 -7.988 -8.707 3.802 542 2HB GLU 983 2HB GLU 983 -7.828 -7.156 4.602 543 1HG GLU 983 1HG GLU 983 -10.316 -7.855 5.487 544 2HG GLU 983 2HG GLU 983 -9.641 -9.455 5.252 545 H ILE 984 H ILE 984 -7.875 -7.799 1.203 546 HA ILE 984 HA ILE 984 -6.416 -5.443 1.084 547 HB ILE 984 HB ILE 984 -6.989 -7.613 -0.922 548 1HG1 ILE 984 1HG1 ILE 984 -4.519 -6.965 0.713 549 2HG1 ILE 984 2HG1 ILE 984 -5.697 -8.200 1.114 550 1HG2 ILE 984 1HG2 ILE 984 -4.931 -6.626 -2.108 551 2HG2 ILE 984 2HG2 ILE 984 -6.505 -5.830 -2.348 552 3HG2 ILE 984 3HG2 ILE 984 -5.314 -5.128 -1.227 553 1HD1 ILE 984 1HD1 ILE 984 -3.774 -8.113 -1.227 554 2HD1 ILE 984 2HD1 ILE 984 -4.032 -9.414 -0.040 555 3HD1 ILE 984 3HD1 ILE 984 -5.245 -9.112 -1.308 556 H GLU 985 H GLU 985 -9.595 -6.337 -0.244 557 HA GLU 985 HA GLU 985 -9.743 -4.262 -2.091 558 1HB GLU 985 1HB GLU 985 -11.407 -6.391 -1.147 559 2HB GLU 985 2HB GLU 985 -12.356 -4.922 -1.029 560 1HG GLU 985 1HG GLU 985 -10.781 -5.200 -3.551 561 2HG GLU 985 2HG GLU 985 -12.051 -6.390 -3.340 562 H MET 986 H MET 986 -10.628 -4.529 1.389 563 HA MET 986 HA MET 986 -11.852 -1.996 1.461 564 1HB MET 986 1HB MET 986 -11.075 -4.180 3.343 565 2HB MET 986 2HB MET 986 -11.052 -2.590 4.079 566 1HG MET 986 1HG MET 986 -13.341 -2.359 3.975 567 2HG MET 986 2HG MET 986 -13.450 -3.099 2.390 568 1HE MET 986 1HE MET 986 -12.396 -6.438 2.898 569 2HE MET 986 2HE MET 986 -14.161 -6.510 2.677 570 3HE MET 986 3HE MET 986 -13.207 -5.270 1.828 571 H ALA 987 H ALA 987 -8.553 -3.072 1.406 572 HA ALA 987 HA ALA 987 -7.556 -0.749 2.816 573 1HB ALA 987 1HB ALA 987 -6.441 -2.885 3.149 574 2HB ALA 987 2HB ALA 987 -6.212 -3.082 1.395 575 3HB ALA 987 3HB ALA 987 -5.344 -1.796 2.267 576 H GLN 988 H GLN 988 -8.364 -1.803 -0.437 577 HA GLN 988 HA GLN 988 -6.628 0.021 -1.723 578 1HB GLN 988 1HB GLN 988 -9.037 -1.579 -2.679 579 2HB GLN 988 2HB GLN 988 -8.099 -0.553 -3.746 580 1HG GLN 988 1HG GLN 988 -6.279 -2.219 -2.216 581 2HG GLN 988 2HG GLN 988 -7.517 -3.239 -2.923 582 1HE2 GLN 988 1HE2 GLN 988 -7.986 -2.962 -5.224 583 2HE2 GLN 988 2HE2 GLN 988 -6.699 -2.584 -6.320 584 H LYS 989 H LYS 989 -10.067 0.001 -0.673 585 HA LYS 989 HA LYS 989 -10.667 2.477 -1.939 586 1HB LYS 989 1HB LYS 989 -12.049 0.465 -0.298 587 2HB LYS 989 2HB LYS 989 -12.578 2.106 0.014 588 1HG LYS 989 1HG LYS 989 -13.672 2.219 -1.975 589 2HG LYS 989 2HG LYS 989 -12.252 1.698 -2.859 590 1HD LYS 989 1HD LYS 989 -13.450 -0.198 -3.292 591 2HD LYS 989 2HD LYS 989 -13.012 -0.673 -1.663 592 1HE LYS 989 1HE LYS 989 -15.332 1.119 -1.623 593 2HE LYS 989 2HE LYS 989 -15.631 -0.252 -2.673 594 1HZ LYS 989 1HZ LYS 989 -15.643 -0.214 0.079 595 2HZ LYS 989 2HZ LYS 989 -15.866 -1.504 -0.897 596 3HZ LYS 989 3HZ LYS 989 -14.370 -1.142 -0.352 597 H LEU 990 H LEU 990 -9.501 1.420 1.277 598 HA LEU 990 HA LEU 990 -9.922 3.792 2.642 599 1HB LEU 990 1HB LEU 990 -8.878 1.314 3.181 600 2HB LEU 990 2HB LEU 990 -7.461 2.338 3.310 601 HG LEU 990 HG LEU 990 -10.054 2.751 4.825 602 1HD1 LEU 990 1HD1 LEU 990 -9.112 0.806 5.731 603 2HD1 LEU 990 2HD1 LEU 990 -7.452 1.432 5.591 604 3HD1 LEU 990 3HD1 LEU 990 -8.561 2.115 6.804 605 1HD2 LEU 990 1HD2 LEU 990 -8.762 4.829 4.327 606 2HD2 LEU 990 2HD2 LEU 990 -8.925 4.464 6.061 607 3HD2 LEU 990 3HD2 LEU 990 -7.390 4.134 5.223 608 H LEU 991 H LEU 991 -7.252 2.748 0.467 609 HA LEU 991 HA LEU 991 -5.648 5.010 0.970 610 1HB LEU 991 1HB LEU 991 -4.939 2.787 0.041 611 2HB LEU 991 2HB LEU 991 -5.683 3.245 -1.478 612 HG LEU 991 HG LEU 991 -4.113 4.977 -1.863 613 1HD1 LEU 991 1HD1 LEU 991 -3.434 4.684 1.055 614 2HD1 LEU 991 2HD1 LEU 991 -2.291 5.426 -0.090 615 3HD1 LEU 991 3HD1 LEU 991 -3.905 6.139 0.143 616 1HD2 LEU 991 1HD2 LEU 991 -3.372 2.508 -2.054 617 2HD2 LEU 991 2HD2 LEU 991 -2.137 3.787 -2.144 618 3HD2 LEU 991 3HD2 LEU 991 -2.355 2.865 -0.637 619 H ASN 992 H ASN 992 -7.748 4.155 -1.876 620 HA ASN 992 HA ASN 992 -7.516 6.393 -3.279 621 1HB ASN 992 1HB ASN 992 -9.433 4.264 -3.060 622 2HB ASN 992 2HB ASN 992 -10.360 5.750 -3.125 623 1HD2 ASN 992 1HD2 ASN 992 -9.936 7.258 -4.852 624 2HD2 ASN 992 2HD2 ASN 992 -9.420 6.692 -6.406 625 H SER 993 H SER 993 -9.760 5.812 -0.478 626 HA SER 993 HA SER 993 -11.149 8.107 -0.477 627 1HB SER 993 1HB SER 993 -11.181 6.060 1.150 628 2HB SER 993 2HB SER 993 -10.025 6.969 2.104 629 HG SER 993 HG SER 993 -11.754 7.902 2.955 630 H ASP 994 H ASP 994 -8.257 7.632 1.687 631 HA ASP 994 HA ASP 994 -7.938 10.216 2.373 632 1HB ASP 994 1HB ASP 994 -6.147 7.835 2.136 633 2HB ASP 994 2HB ASP 994 -5.317 9.375 2.228 634 H LEU 995 H LEU 995 -6.875 8.468 -0.582 635 HA LEU 995 HA LEU 995 -5.087 10.312 -1.595 636 1HB LEU 995 1HB LEU 995 -6.644 8.037 -2.556 637 2HB LEU 995 2HB LEU 995 -6.368 9.241 -3.800 638 HG LEU 995 HG LEU 995 -4.685 7.260 -3.423 639 1HD1 LEU 995 1HD1 LEU 995 -3.888 10.127 -3.974 640 2HD1 LEU 995 2HD1 LEU 995 -2.830 8.724 -4.258 641 3HD1 LEU 995 3HD1 LEU 995 -4.364 8.877 -5.149 642 1HD2 LEU 995 1HD2 LEU 995 -3.372 9.262 -1.597 643 2HD2 LEU 995 2HD2 LEU 995 -4.429 7.978 -0.962 644 3HD2 LEU 995 3HD2 LEU 995 -2.964 7.553 -1.879 645 H ALA 996 H ALA 996 -8.608 9.975 -2.453 646 HA ALA 996 HA ALA 996 -8.909 12.124 -4.026 647 1HB ALA 996 1HB ALA 996 -11.177 12.220 -2.416 648 2HB ALA 996 2HB ALA 996 -10.942 11.160 -3.827 649 3HB ALA 996 3HB ALA 996 -10.584 10.557 -2.191 650 H GLU 997 H GLU 997 -9.006 12.161 -0.396 651 HA GLU 997 HA GLU 997 -9.440 14.862 -0.162 652 1HB GLU 997 1HB GLU 997 -9.352 12.858 1.597 653 2HB GLU 997 2HB GLU 997 -7.708 13.414 1.840 654 1HG GLU 997 1HG GLU 997 -8.859 14.714 3.413 655 2HG GLU 997 2HG GLU 997 -8.807 15.809 2.046 656 H LEU 998 H LEU 998 -6.375 12.986 -0.462 657 HA LEU 998 HA LEU 998 -4.690 15.207 -0.044 658 1HB LEU 998 1HB LEU 998 -4.285 12.618 0.046 659 2HB LEU 998 2HB LEU 998 -3.897 12.811 -1.652 660 HG LEU 998 HG LEU 998 -2.520 14.794 -0.022 661 1HD1 LEU 998 1HD1 LEU 998 -0.991 12.570 0.661 662 2HD1 LEU 998 2HD1 LEU 998 -1.968 13.578 1.757 663 3HD1 LEU 998 3HD1 LEU 998 -2.662 12.097 1.054 664 1HD2 LEU 998 1HD2 LEU 998 -0.957 14.536 -1.597 665 2HD2 LEU 998 2HD2 LEU 998 -0.923 12.766 -1.410 666 3HD2 LEU 998 3HD2 LEU 998 -2.159 13.530 -2.438 667 H ILE 999 H ILE 999 -6.079 13.625 -2.976 668 HA ILE 999 HA ILE 999 -4.713 15.052 -4.882 669 HB ILE 999 HB ILE 999 -7.536 13.986 -4.866 670 1HG1 ILE 999 1HG1 ILE 999 -5.978 12.222 -4.507 671 2HG1 ILE 999 2HG1 ILE 999 -6.490 12.133 -6.180 672 1HG2 ILE 999 1HG2 ILE 999 -7.324 15.714 -6.579 673 2HG2 ILE 999 2HG2 ILE 999 -5.872 14.912 -7.224 674 3HG2 ILE 999 3HG2 ILE 999 -7.452 14.096 -7.309 675 1HD1 ILE 999 1HD1 ILE 999 -3.815 12.793 -5.048 676 2HD1 ILE 999 2HD1 ILE 999 -4.237 12.019 -6.594 677 3HD1 ILE 999 3HD1 ILE 999 -4.318 13.790 -6.435 678 H ASN1000 H ASN1000 -7.700 15.939 -3.055 679 HA ASN1000 HA ASN1000 -8.032 18.345 -4.446 680 1HB ASN1000 1HB ASN1000 -9.661 16.937 -2.850 681 2HB ASN1000 2HB ASN1000 -8.990 17.955 -1.592 682 1HD2 ASN1000 1HD2 ASN1000 -11.688 17.879 -2.483 683 2HD2 ASN1000 2HD2 ASN1000 -12.114 19.437 -3.109 684 H LYS1001 H LYS1001 -6.598 17.387 -1.252 685 HA LYS1001 HA LYS1001 -6.063 19.729 -0.087 686 1HB LYS1001 1HB LYS1001 -4.491 17.177 -0.282 687 2HB LYS1001 2HB LYS1001 -3.804 18.546 0.568 688 1HG LYS1001 1HG LYS1001 -6.631 17.575 1.149 689 2HG LYS1001 2HG LYS1001 -5.241 16.863 1.943 690 1HD LYS1001 1HD LYS1001 -4.745 18.807 3.151 691 2HD LYS1001 2HD LYS1001 -5.448 19.869 1.946 692 1HE LYS1001 1HE LYS1001 -6.899 19.851 3.917 693 2HE LYS1001 2HE LYS1001 -7.740 19.067 2.595 694 1HZ LYS1001 1HZ LYS1001 -6.918 17.977 5.059 695 2HZ LYS1001 2HZ LYS1001 -7.954 17.364 3.956 696 3HZ LYS1001 3HZ LYS1001 -6.352 17.077 3.819 697 H MET1002 H MET1002 -4.482 18.409 -3.010 698 HA MET1002 HA MET1002 -2.501 20.431 -3.033 699 1HB MET1002 1HB MET1002 -2.082 18.264 -4.112 700 2HB MET1002 2HB MET1002 -3.529 18.406 -5.090 701 1HG MET1002 1HG MET1002 -1.388 20.538 -5.320 702 2HG MET1002 2HG MET1002 -1.146 18.999 -6.123 703 1HE MET1002 1HE MET1002 -4.029 18.142 -7.679 704 2HE MET1002 2HE MET1002 -3.150 18.884 -9.038 705 3HE MET1002 3HE MET1002 -2.253 18.039 -7.754 706 H LYS1003 H LYS1003 -5.442 19.748 -5.066 707 HA LYS1003 HA LYS1003 -5.315 21.946 -6.682 708 1HB LYS1003 1HB LYS1003 -7.350 20.020 -5.824 709 2HB LYS1003 2HB LYS1003 -8.030 21.582 -6.236 710 1HG LYS1003 1HG LYS1003 -6.655 21.505 -8.399 711 2HG LYS1003 2HG LYS1003 -6.232 19.852 -7.995 712 1HD LYS1003 1HD LYS1003 -8.120 19.581 -9.390 713 2HD LYS1003 2HD LYS1003 -8.805 19.442 -7.783 714 1HE LYS1003 1HE LYS1003 -9.510 21.817 -7.838 715 2HE LYS1003 2HE LYS1003 -8.738 22.037 -9.396 716 1HZ LYS1003 1HZ LYS1003 -10.441 19.845 -9.551 717 2HZ LYS1003 2HZ LYS1003 -11.277 21.084 -8.893 718 3HZ LYS1003 3HZ LYS1003 -10.550 21.269 -10.343 719 H LEU1004 H LEU1004 -6.184 21.718 -3.252 720 HA LEU1004 HA LEU1004 -7.272 24.386 -3.222 721 1HB LEU1004 1HB LEU1004 -6.594 22.590 -0.895 722 2HB LEU1004 2HB LEU1004 -7.644 23.993 -0.891 723 HG LEU1004 HG LEU1004 -8.212 21.470 -2.468 724 1HD1 LEU1004 1HD1 LEU1004 -8.448 20.599 -0.381 725 2HD1 LEU1004 2HD1 LEU1004 -8.764 22.181 0.372 726 3HD1 LEU1004 3HD1 LEU1004 -10.051 21.357 -0.542 727 1HD2 LEU1004 1HD2 LEU1004 -9.992 23.818 -1.756 728 2HD2 LEU1004 2HD2 LEU1004 -9.291 23.479 -3.356 729 3HD2 LEU1004 3HD2 LEU1004 -10.480 22.359 -2.650 730 H ALA1005 H ALA1005 -4.463 22.735 -1.599 731 HA ALA1005 HA ALA1005 -3.232 24.915 -0.582 732 1HB ALA1005 1HB ALA1005 -2.457 22.653 -0.186 733 2HB ALA1005 2HB ALA1005 -2.033 22.450 -1.903 734 3HB ALA1005 3HB ALA1005 -1.115 23.588 -0.888 735 H GLN1006 H GLN1006 -3.317 23.820 -3.993 736 HA GLN1006 HA GLN1006 -1.303 25.341 -4.996 737 1HB GLN1006 1HB GLN1006 -3.377 23.751 -6.015 738 2HB GLN1006 2HB GLN1006 -3.671 25.317 -6.745 739 1HG GLN1006 1HG GLN1006 -0.920 25.092 -7.021 740 2HG GLN1006 2HG GLN1006 -1.420 23.420 -7.178 741 1HE2 GLN1006 1HE2 GLN1006 -0.307 25.203 -9.164 742 2HE2 GLN1006 2HE2 GLN1006 -1.436 25.311 -10.474 743 H GLN1007 H GLN1007 -4.614 26.294 -4.036 744 HA GLN1007 HA GLN1007 -4.083 28.970 -5.010 745 1HB GLN1007 1HB GLN1007 -6.317 27.567 -5.319 746 2HB GLN1007 2HB GLN1007 -6.674 28.134 -3.700 747 1HG GLN1007 1HG GLN1007 -6.659 30.428 -4.360 748 2HG GLN1007 2HG GLN1007 -5.773 30.095 -5.835 749 1HE2 GLN1007 1HE2 GLN1007 -8.834 30.192 -4.267 750 2HE2 GLN1007 2HE2 GLN1007 -9.847 29.841 -5.628 751 H TYR1008 H TYR1008 -4.446 27.030 -2.056 752 HA TYR1008 HA TYR1008 -4.506 29.392 -0.377 753 1HB TYR1008 1HB TYR1008 -4.489 26.336 -0.062 754 2HB TYR1008 2HB TYR1008 -4.363 27.373 1.345 755 HD1 TYR1008 HD1 TYR1008 -6.259 29.180 1.617 756 HD2 TYR1008 HD2 TYR1008 -6.598 25.687 -0.830 757 HE1 TYR1008 HE1 TYR1008 -8.794 29.354 1.708 758 HE2 TYR1008 HE2 TYR1008 -9.131 25.872 -0.731 759 HH TYR1008 HH TYR1008 -10.820 26.805 0.475 760 H VAL1009 H VAL1009 -2.146 28.933 -2.149 761 HA VAL1009 HA VAL1009 -0.142 28.617 -0.021 762 HB VAL1009 HB VAL1009 -0.046 26.738 -1.518 763 1HG1 VAL1009 1HG1 VAL1009 0.389 28.654 -3.827 764 2HG1 VAL1009 2HG1 VAL1009 0.193 26.885 -3.890 765 3HG1 VAL1009 3HG1 VAL1009 -1.186 27.918 -3.442 766 1HG2 VAL1009 1HG2 VAL1009 2.101 28.613 -1.149 767 2HG2 VAL1009 2HG2 VAL1009 2.163 26.837 -1.246 768 3HG2 VAL1009 3HG2 VAL1009 2.285 27.814 -2.729 769 H MET1010 H MET1010 -0.952 30.155 -3.202 770 HA MET1010 HA MET1010 1.115 32.056 -2.919 771 1HB MET1010 1HB MET1010 -0.093 33.117 -4.909 772 2HB MET1010 2HB MET1010 0.309 31.428 -5.145 773 1HG MET1010 1HG MET1010 -1.888 31.069 -5.615 774 2HG MET1010 2HG MET1010 -2.221 31.328 -3.915 775 1HE MET1010 1HE MET1010 -4.125 34.073 -3.485 776 2HE MET1010 2HE MET1010 -4.967 32.985 -4.615 777 3HE MET1010 3HE MET1010 -3.869 32.314 -3.384 778 H THR1011 H THR1011 -0.064 32.260 -0.504 779 HA THR1011 HA THR1011 -1.259 34.909 -0.626 780 HB THR1011 HB THR1011 -2.986 33.908 1.142 781 HG1 THR1011 HG1 THR1011 -2.038 31.711 -0.559 782 1HG2 THR1011 1HG2 THR1011 -3.821 34.765 -1.001 783 2HG2 THR1011 2HG2 THR1011 -3.138 33.370 -1.869 784 3HG2 THR1011 3HG2 THR1011 -4.509 33.142 -0.756 785 H SER1012 H SER1012 -0.690 32.264 1.797 786 HA SER1012 HA SER1012 1.575 33.214 2.863 787 1HB SER1012 1HB SER1012 0.615 34.429 4.966 788 2HB SER1012 2HB SER1012 0.787 35.339 3.478 789 HG SER1012 HG SER1012 -1.424 35.230 3.100 790 H LEU1013 H LEU1013 -1.729 31.987 3.460 791 HA LEU1013 HA LEU1013 -0.901 30.470 5.761 792 1HB LEU1013 1HB LEU1013 -3.229 29.613 5.652 793 2HB LEU1013 2HB LEU1013 -3.080 31.350 5.831 794 HG LEU1013 HG LEU1013 -3.252 30.793 3.037 795 1HD1 LEU1013 1HD1 LEU1013 -5.781 29.883 3.444 796 2HD1 LEU1013 2HD1 LEU1013 -4.392 28.857 3.012 797 3HD1 LEU1013 3HD1 LEU1013 -4.895 29.004 4.713 798 1HD2 LEU1013 1HD2 LEU1013 -5.354 32.120 3.247 799 2HD2 LEU1013 2HD2 LEU1013 -5.152 32.076 5.015 800 3HD2 LEU1013 3HD2 LEU1013 -3.931 32.880 4.000 801 H GLN1014 H GLN1014 0.893 29.800 3.869 802 HA GLN1014 HA GLN1014 -0.040 27.639 2.291 803 1HB GLN1014 1HB GLN1014 1.808 28.972 1.467 804 2HB GLN1014 2HB GLN1014 2.736 28.712 2.931 805 1HG GLN1014 1HG GLN1014 2.588 26.167 2.351 806 2HG GLN1014 2HG GLN1014 2.066 26.688 0.762 807 1HE2 GLN1014 1HE2 GLN1014 3.490 28.857 0.193 808 2HE2 GLN1014 2HE2 GLN1014 5.192 28.542 0.149 809 H GLN1015 H GLN1015 2.444 27.810 4.953 810 HA GLN1015 HA GLN1015 2.724 25.162 5.343 811 1HB GLN1015 1HB GLN1015 3.107 25.933 7.859 812 2HB GLN1015 2HB GLN1015 4.213 26.427 6.592 813 1HG GLN1015 1HG GLN1015 3.389 28.627 6.528 814 2HG GLN1015 2HG GLN1015 1.807 28.169 7.127 815 1HE2 GLN1015 1HE2 GLN1015 3.407 30.294 8.081 816 2HE2 GLN1015 2HE2 GLN1015 3.812 29.999 9.740 817 H GLU1016 H GLU1016 -0.057 27.171 6.092 818 HA GLU1016 HA GLU1016 -1.136 25.534 8.089 819 1HB GLU1016 1HB GLU1016 -1.834 27.871 7.792 820 2HB GLU1016 2HB GLU1016 -2.447 27.524 6.187 821 1HG GLU1016 1HG GLU1016 -3.924 25.705 7.439 822 2HG GLU1016 2HG GLU1016 -3.567 26.658 8.866 823 H TYR1017 H TYR1017 -2.027 25.935 4.579 824 HA TYR1017 HA TYR1017 -3.692 23.625 4.631 825 1HB TYR1017 1HB TYR1017 -2.598 25.719 2.745 826 2HB TYR1017 2HB TYR1017 -3.084 24.220 1.979 827 HD1 TYR1017 HD1 TYR1017 -4.297 27.061 4.037 828 HD2 TYR1017 HD2 TYR1017 -5.391 23.679 1.656 829 HE1 TYR1017 HE1 TYR1017 -6.717 27.841 4.028 830 HE2 TYR1017 HE2 TYR1017 -7.807 24.470 1.655 831 HH TYR1017 HH TYR1017 -9.255 25.826 2.695 832 H LYS1018 H LYS1018 -0.280 24.311 3.880 833 HA LYS1018 HA LYS1018 0.201 21.982 2.386 834 1HB LYS1018 1HB LYS1018 1.625 24.032 2.425 835 2HB LYS1018 2HB LYS1018 2.144 23.615 4.045 836 1HG LYS1018 1HG LYS1018 2.382 21.364 2.129 837 2HG LYS1018 2HG LYS1018 3.355 22.753 1.686 838 1HD LYS1018 1HD LYS1018 4.863 21.742 3.117 839 2HD LYS1018 2HD LYS1018 3.992 22.691 4.306 840 1HE LYS1018 1HE LYS1018 2.847 20.840 5.165 841 2HE LYS1018 2HE LYS1018 2.884 19.970 3.644 842 1HZ LYS1018 1HZ LYS1018 4.389 19.068 5.314 843 2HZ LYS1018 2HZ LYS1018 5.189 19.532 3.968 844 3HZ LYS1018 3HZ LYS1018 5.252 20.455 5.314 845 H LYS1019 H LYS1019 0.422 22.760 5.904 846 HA LYS1019 HA LYS1019 1.538 20.347 6.699 847 1HB LYS1019 1HB LYS1019 -0.097 22.480 8.040 848 2HB LYS1019 2HB LYS1019 0.237 20.989 8.898 849 1HG LYS1019 1HG LYS1019 2.369 22.761 7.612 850 2HG LYS1019 2HG LYS1019 1.958 22.781 9.315 851 1HD LYS1019 1HD LYS1019 3.226 20.941 9.732 852 2HD LYS1019 2HD LYS1019 2.461 20.039 8.440 853 1HE LYS1019 1HE LYS1019 4.472 20.165 7.372 854 2HE LYS1019 2HE LYS1019 4.044 21.826 7.014 855 1HZ LYS1019 1HZ LYS1019 5.619 20.873 9.299 856 2HZ LYS1019 2HZ LYS1019 6.129 21.817 8.069 857 3HZ LYS1019 3HZ LYS1019 5.076 22.408 9.168 858 H GLN1020 H GLN1020 -1.925 21.342 6.337 859 HA GLN1020 HA GLN1020 -3.156 19.194 7.315 860 1HB GLN1020 1HB GLN1020 -3.800 20.759 4.784 861 2HB GLN1020 2HB GLN1020 -4.906 19.593 5.481 862 1HG GLN1020 1HG GLN1020 -3.780 22.024 6.953 863 2HG GLN1020 2HG GLN1020 -5.376 21.942 6.232 864 1HE2 GLN1020 1HE2 GLN1020 -3.446 21.269 8.931 865 2HE2 GLN1020 2HE2 GLN1020 -4.590 20.408 9.905 866 H MET1021 H MET1021 -1.887 19.485 3.921 867 HA MET1021 HA MET1021 -2.640 17.040 3.028 868 1HB MET1021 1HB MET1021 -1.118 19.165 2.097 869 2HB MET1021 2HB MET1021 0.121 17.937 2.263 870 1HG MET1021 1HG MET1021 -2.198 16.716 1.030 871 2HG MET1021 2HG MET1021 -1.844 18.203 0.174 872 1HE MET1021 1HE MET1021 0.870 14.574 0.751 873 2HE MET1021 2HE MET1021 1.027 15.842 1.991 874 3HE MET1021 3HE MET1021 -0.547 15.059 1.713 875 H LEU1022 H LEU1022 0.324 17.927 4.896 876 HA LEU1022 HA LEU1022 1.600 15.477 4.741 877 1HB LEU1022 1HB LEU1022 2.438 17.720 5.591 878 2HB LEU1022 2HB LEU1022 1.656 17.338 7.111 879 HG LEU1022 HG LEU1022 4.152 16.863 6.917 880 1HD1 LEU1022 1HD1 LEU1022 2.129 14.852 7.884 881 2HD1 LEU1022 2HD1 LEU1022 3.877 14.588 8.095 882 3HD1 LEU1022 3HD1 LEU1022 3.100 16.017 8.817 883 1HD2 LEU1022 1HD2 LEU1022 4.999 15.215 5.610 884 2HD2 LEU1022 2HD2 LEU1022 3.512 14.239 5.672 885 3HD2 LEU1022 3HD2 LEU1022 3.603 15.654 4.597 886 H THR1023 H THR1023 -0.841 16.701 7.115 887 HA THR1023 HA THR1023 -0.891 14.664 8.896 888 HB THR1023 HB THR1023 -3.457 15.825 7.747 889 HG1 THR1023 HG1 THR1023 -1.306 17.055 9.325 890 1HG2 THR1023 1HG2 THR1023 -2.873 16.231 10.586 891 2HG2 THR1023 2HG2 THR1023 -4.257 15.393 9.844 892 3HG2 THR1023 3HG2 THR1023 -2.749 14.505 10.170 893 H ALA1024 H ALA1024 -2.725 14.695 5.766 894 HA ALA1024 HA ALA1024 -3.755 12.128 6.076 895 1HB ALA1024 1HB ALA1024 -4.819 13.341 4.425 896 2HB ALA1024 2HB ALA1024 -3.305 14.063 3.828 897 3HB ALA1024 3HB ALA1024 -3.712 12.381 3.414 898 H ALA1025 H ALA1025 -0.694 13.340 4.592 899 HA ALA1025 HA ALA1025 0.208 11.047 3.432 900 1HB ALA1025 1HB ALA1025 2.352 12.053 3.523 901 2HB ALA1025 2HB ALA1025 1.215 13.422 3.536 902 3HB ALA1025 3HB ALA1025 1.988 12.892 5.049 903 H HIS1026 H HIS1026 0.146 11.951 6.903 904 HA HIS1026 HA HIS1026 1.780 9.870 7.787 905 1HB HIS1026 1HB HIS1026 0.575 12.057 8.909 906 2HB HIS1026 2HB HIS1026 -0.382 10.759 9.593 907 HD1 HIS1026 HD1 HIS1026 0.857 11.735 11.860 908 HD2 HIS1026 HD2 HIS1026 3.213 9.550 9.164 909 HE1 HIS1026 HE1 HIS1026 2.936 11.014 13.151 910 H ALA1027 H ALA1027 -1.846 10.160 7.720 911 HA ALA1027 HA ALA1027 -2.283 7.518 8.538 912 1HB ALA1027 1HB ALA1027 -3.796 9.847 7.700 913 2HB ALA1027 2HB ALA1027 -4.468 8.374 6.958 914 3HB ALA1027 3HB ALA1027 -4.303 8.484 8.727 915 H LEU1028 H LEU1028 -1.700 9.051 5.360 916 HA LEU1028 HA LEU1028 -2.561 6.979 3.740 917 1HB LEU1028 1HB LEU1028 -0.696 9.275 3.505 918 2HB LEU1028 2HB LEU1028 -0.534 8.005 2.309 919 HG LEU1028 HG LEU1028 -2.901 9.793 2.843 920 1HD1 LEU1028 1HD1 LEU1028 -1.256 10.677 1.319 921 2HD1 LEU1028 2HD1 LEU1028 -1.263 9.171 0.372 922 3HD1 LEU1028 3HD1 LEU1028 -2.709 10.208 0.405 923 1HD2 LEU1028 1HD2 LEU1028 -3.989 8.347 0.965 924 2HD2 LEU1028 2HD2 LEU1028 -2.886 7.081 1.557 925 3HD2 LEU1028 3HD2 LEU1028 -4.074 7.814 2.662 926 H ALA1029 H ALA1029 0.880 7.676 4.697 927 HA ALA1029 HA ALA1029 2.076 5.474 3.773 928 1HB ALA1029 1HB ALA1029 3.657 5.723 5.680 929 2HB ALA1029 2HB ALA1029 3.224 7.289 4.952 930 3HB ALA1029 3HB ALA1029 2.482 6.787 6.490 931 H VAL1030 H VAL1030 0.019 5.699 6.718 932 HA VAL1030 HA VAL1030 0.520 3.015 7.499 933 HB VAL1030 HB VAL1030 -1.434 5.166 8.262 934 1HG1 VAL1030 1HG1 VAL1030 -2.416 3.733 9.946 935 2HG1 VAL1030 2HG1 VAL1030 -2.620 2.975 8.349 936 3HG1 VAL1030 3HG1 VAL1030 -1.367 2.379 9.464 937 1HG2 VAL1030 1HG2 VAL1030 -0.035 4.146 10.485 938 2HG2 VAL1030 2HG2 VAL1030 1.158 4.254 9.168 939 3HG2 VAL1030 3HG2 VAL1030 0.231 5.696 9.650 940 H ASP1031 H ASP1031 -2.241 4.714 5.865 941 HA ASP1031 HA ASP1031 -3.958 2.717 5.588 942 1HB ASP1031 1HB ASP1031 -3.086 4.659 3.396 943 2HB ASP1031 2HB ASP1031 -4.573 3.732 3.350 944 H ALA1032 H ALA1032 -1.290 3.488 3.215 945 HA ALA1032 HA ALA1032 -1.640 1.294 1.576 946 1HB ALA1032 1HB ALA1032 1.069 1.805 1.479 947 2HB ALA1032 2HB ALA1032 -0.174 2.707 0.580 948 3HB ALA1032 3HB ALA1032 0.427 3.329 2.136 949 H LYS1033 H LYS1033 -0.042 1.628 4.747 950 HA LYS1033 HA LYS1033 1.365 -0.810 4.626 951 1HB LYS1033 1HB LYS1033 1.609 1.278 6.194 952 2HB LYS1033 2HB LYS1033 0.433 0.449 7.193 953 1HG LYS1033 1HG LYS1033 2.230 -0.651 8.072 954 2HG LYS1033 2HG LYS1033 2.172 -1.620 6.613 955 1HD LYS1033 1HD LYS1033 4.007 -0.567 5.662 956 2HD LYS1033 2HD LYS1033 3.632 0.985 6.384 957 1HE LYS1033 1HE LYS1033 4.395 -1.200 8.292 958 2HE LYS1033 2HE LYS1033 5.672 -0.614 7.246 959 1HZ LYS1033 1HZ LYS1033 5.666 0.726 9.142 960 2HZ LYS1033 2HZ LYS1033 4.998 1.654 7.975 961 3HZ LYS1033 3HZ LYS1033 4.050 0.961 9.110 962 H ASN1034 H ASN1034 -1.833 0.137 6.049 963 HA ASN1034 HA ASN1034 -2.481 -2.250 7.136 964 1HB ASN1034 1HB ASN1034 -3.779 0.157 6.715 965 2HB ASN1034 2HB ASN1034 -4.695 -0.886 5.647 966 1HD2 ASN1034 1HD2 ASN1034 -6.258 -0.062 7.394 967 2HD2 ASN1034 2HD2 ASN1034 -6.537 -1.115 8.740 968 H LEU1035 H LEU1035 -2.181 -1.311 3.758 969 HA LEU1035 HA LEU1035 -3.910 -3.263 2.660 970 1HB LEU1035 1HB LEU1035 -2.854 -1.048 1.700 971 2HB LEU1035 2HB LEU1035 -1.575 -2.128 1.180 972 HG LEU1035 HG LEU1035 -4.472 -2.657 0.509 973 1HD1 LEU1035 1HD1 LEU1035 -4.541 -0.982 -0.938 974 2HD1 LEU1035 2HD1 LEU1035 -2.936 -0.442 -0.389 975 3HD1 LEU1035 3HD1 LEU1035 -3.074 -1.590 -1.742 976 1HD2 LEU1035 1HD2 LEU1035 -3.368 -4.596 0.014 977 2HD2 LEU1035 2HD2 LEU1035 -3.148 -3.719 -1.519 978 3HD2 LEU1035 3HD2 LEU1035 -1.828 -3.771 -0.326 979 H LEU1036 H LEU1036 -0.281 -3.074 2.527 980 HA LEU1036 HA LEU1036 -0.019 -5.779 1.862 981 1HB LEU1036 1HB LEU1036 1.589 -3.578 1.891 982 2HB LEU1036 2HB LEU1036 2.230 -4.478 3.251 983 HG LEU1036 HG LEU1036 2.006 -6.420 1.287 984 1HD1 LEU1036 1HD1 LEU1036 1.520 -4.435 -0.278 985 2HD1 LEU1036 2HD1 LEU1036 3.248 -4.048 -0.094 986 3HD1 LEU1036 3HD1 LEU1036 2.754 -5.619 -0.772 987 1HD2 LEU1036 1HD2 LEU1036 3.993 -6.711 2.241 988 2HD2 LEU1036 2HD2 LEU1036 4.627 -5.495 1.106 989 3HD2 LEU1036 3HD2 LEU1036 4.090 -5.002 2.730 990 H ASP1037 H ASP1037 -0.023 -4.009 4.990 991 HA ASP1037 HA ASP1037 0.943 -5.784 6.683 992 1HB ASP1037 1HB ASP1037 -0.100 -3.632 7.339 993 2HB ASP1037 2HB ASP1037 -1.692 -4.267 6.974 994 H VAL1038 H VAL1038 -2.455 -5.758 5.370 995 HA VAL1038 HA VAL1038 -3.287 -8.083 6.683 996 HB VAL1038 HB VAL1038 -4.206 -6.520 4.290 997 1HG1 VAL1038 1HG1 VAL1038 -5.641 -8.964 5.373 998 2HG1 VAL1038 2HG1 VAL1038 -6.115 -7.946 3.992 999 3HG1 VAL1038 3HG1 VAL1038 -4.656 -8.961 3.890 1000 1HG2 VAL1038 1HG2 VAL1038 -5.962 -7.065 6.621 1001 2HG2 VAL1038 2HG2 VAL1038 -4.524 -6.065 6.940 1002 3HG2 VAL1038 3HG2 VAL1038 -5.701 -5.563 5.702 1003 H ILE1039 H ILE1039 -1.625 -7.485 3.559 1004 HA ILE1039 HA ILE1039 -1.908 -10.103 2.585 1005 HB ILE1039 HB ILE1039 -0.245 -7.716 1.962 1006 1HG1 ILE1039 1HG1 ILE1039 -1.998 -9.497 0.245 1007 2HG1 ILE1039 2HG1 ILE1039 -2.554 -8.057 1.075 1008 1HG2 ILE1039 1HG2 ILE1039 0.611 -10.489 1.477 1009 2HG2 ILE1039 2HG2 ILE1039 0.586 -9.456 0.028 1010 3HG2 ILE1039 3HG2 ILE1039 1.540 -8.971 1.450 1011 1HD1 ILE1039 1HD1 ILE1039 -1.445 -8.137 -1.486 1012 2HD1 ILE1039 2HD1 ILE1039 -1.645 -6.677 -0.488 1013 3HD1 ILE1039 3HD1 ILE1039 -0.098 -7.558 -0.477 1014 H ASP1040 H ASP1040 0.548 -8.477 4.653 1015 HA ASP1040 HA ASP1040 2.459 -10.390 4.632 1016 1HB ASP1040 1HB ASP1040 1.892 -8.082 6.104 1017 2HB ASP1040 2HB ASP1040 1.883 -9.325 7.339 1018 H GLN1041 H GLN1041 -0.637 -10.202 6.468 1019 HA GLN1041 HA GLN1041 -0.046 -12.513 8.007 1020 1HB GLN1041 1HB GLN1041 -2.327 -10.594 7.727 1021 2HB GLN1041 2HB GLN1041 -2.730 -12.190 8.326 1022 1HG GLN1041 1HG GLN1041 -0.412 -11.549 9.765 1023 2HG GLN1041 2HG GLN1041 -1.241 -10.009 9.654 1024 1HE2 GLN1041 1HE2 GLN1041 -3.614 -10.055 10.121 1025 2HE2 GLN1041 2HE2 GLN1041 -4.166 -11.020 11.450 1026 H ALA1042 H ALA1042 -1.221 -11.877 4.808 1027 HA ALA1042 HA ALA1042 -2.745 -14.322 4.626 1028 1HB ALA1042 1HB ALA1042 -3.615 -12.523 3.360 1029 2HB ALA1042 2HB ALA1042 -2.009 -12.065 2.743 1030 3HB ALA1042 3HB ALA1042 -2.797 -13.549 2.157 1031 H ARG1043 H ARG1043 0.410 -12.967 3.496 1032 HA ARG1043 HA ARG1043 1.139 -15.085 1.937 1033 1HB ARG1043 1HB ARG1043 2.308 -12.813 2.219 1034 2HB ARG1043 2HB ARG1043 3.035 -13.442 3.684 1035 1HG ARG1043 1HG ARG1043 4.466 -14.860 2.542 1036 2HG ARG1043 2HG ARG1043 3.308 -15.185 1.267 1037 1HD ARG1043 1HD ARG1043 5.041 -13.884 0.234 1038 2HD ARG1043 2HD ARG1043 3.698 -12.779 0.443 1039 HE ARG1043 HE ARG1043 5.015 -11.530 1.908 1040 1HH1 ARG1043 2HH2 ARG1043 6.308 -14.798 1.744 1041 2HH1 ARG1043 1HH2 ARG1043 7.685 -14.440 2.732 1042 1HH2 ARG1043 2HH1 ARG1043 6.831 -11.057 3.212 1043 2HH2 ARG1043 1HH1 ARG1043 7.984 -12.297 3.573 1044 H LEU1044 H LEU1044 1.423 -14.564 5.486 1045 HA LEU1044 HA LEU1044 2.984 -16.913 5.903 1046 1HB LEU1044 1HB LEU1044 2.623 -16.437 8.265 1047 2HB LEU1044 2HB LEU1044 3.202 -15.040 7.378 1048 HG LEU1044 HG LEU1044 0.679 -14.374 7.251 1049 1HD1 LEU1044 1HD1 LEU1044 -0.842 -15.424 8.519 1050 2HD1 LEU1044 2HD1 LEU1044 0.309 -16.781 8.488 1051 3HD1 LEU1044 3HD1 LEU1044 0.292 -15.659 9.870 1052 1HD2 LEU1044 1HD2 LEU1044 1.989 -12.881 8.396 1053 2HD2 LEU1044 2HD2 LEU1044 0.939 -13.465 9.709 1054 3HD2 LEU1044 3HD2 LEU1044 2.591 -14.106 9.538 1055 H LYS1045 H LYS1045 -0.468 -16.080 5.746 1056 HA LYS1045 HA LYS1045 -1.569 -18.184 7.102 1057 1HB LYS1045 1HB LYS1045 -2.765 -16.229 6.114 1058 2HB LYS1045 2HB LYS1045 -2.591 -16.951 4.527 1059 1HG LYS1045 1HG LYS1045 -3.716 -18.768 6.611 1060 2HG LYS1045 2HG LYS1045 -4.728 -17.395 6.209 1061 1HD LYS1045 1HD LYS1045 -3.858 -18.298 3.699 1062 2HD LYS1045 2HD LYS1045 -4.085 -19.786 4.597 1063 1HE LYS1045 1HE LYS1045 -6.204 -19.265 3.549 1064 2HE LYS1045 2HE LYS1045 -6.396 -18.962 5.265 1065 1HZ LYS1045 1HZ LYS1045 -6.035 -16.641 4.861 1066 2HZ LYS1045 2HZ LYS1045 -5.766 -16.897 3.271 1067 3HZ LYS1045 3HZ LYS1045 -7.247 -17.169 3.902 1068 H MET1046 H MET1046 0.357 -18.210 4.190 1069 HA MET1046 HA MET1046 -0.634 -20.813 3.449 1070 1HB MET1046 1HB MET1046 -0.163 -19.362 1.581 1071 2HB MET1046 2HB MET1046 1.338 -18.797 2.287 1072 1HG MET1046 1HG MET1046 2.373 -21.031 1.948 1073 2HG MET1046 2HG MET1046 0.862 -21.660 1.323 1074 1HE MET1046 1HE MET1046 3.330 -18.294 -0.544 1075 2HE MET1046 2HE MET1046 1.767 -17.829 0.170 1076 3HE MET1046 3HE MET1046 3.011 -18.606 1.179 1077 H ILE1047 H ILE1047 2.005 -19.305 5.226 1078 HA ILE1047 HA ILE1047 4.050 -21.060 4.980 1079 HB ILE1047 HB ILE1047 2.995 -19.558 7.364 1080 1HG1 ILE1047 1HG1 ILE1047 3.996 -18.474 5.205 1081 2HG1 ILE1047 2HG1 ILE1047 4.456 -17.882 6.789 1082 1HG2 ILE1047 1HG2 ILE1047 5.338 -19.967 8.309 1083 2HG2 ILE1047 2HG2 ILE1047 4.161 -21.298 8.417 1084 3HG2 ILE1047 3HG2 ILE1047 5.429 -21.330 7.167 1085 1HD1 ILE1047 1HD1 ILE1047 6.553 -19.077 6.743 1086 2HD1 ILE1047 2HD1 ILE1047 6.051 -20.024 5.322 1087 3HD1 ILE1047 3HD1 ILE1047 6.386 -18.284 5.159 1088 H SER1048 H SER1048 1.918 -21.342 7.884 1089 HA SER1048 HA SER1048 2.320 -24.196 7.702 1090 1HB SER1048 1HB SER1048 1.819 -22.241 9.859 1091 2HB SER1048 2HB SER1048 0.853 -23.693 10.027 1092 HG SER1048 HG SER1048 2.632 -24.523 10.888 1093 H GLN1049 H GLN1049 0.808 -24.103 5.707 1094 HA GLN1049 HA GLN1049 -1.651 -25.127 6.441 1095 1HB GLN1049 1HB GLN1049 -1.650 -22.281 6.425 1096 2HB GLN1049 2HB GLN1049 -2.477 -22.761 4.957 1097 1HG GLN1049 1HG GLN1049 -4.271 -23.634 6.092 1098 2HG GLN1049 2HG GLN1049 -3.265 -24.365 7.326 1099 1HE2 GLN1049 1HE2 GLN1049 -5.082 -21.603 6.339 1100 2HE2 GLN1049 2HE2 GLN1049 -4.996 -20.688 7.808 1101 H SER1050 H SER1050 -0.462 -26.624 4.959 1102 HA SER1050 HA SER1050 -1.425 -26.244 2.316 1103 1HB SER1050 1HB SER1050 1.485 -25.901 2.962 1104 2HB SER1050 2HB SER1050 1.104 -26.838 1.531 1105 HG SER1050 HG SER1050 0.948 -24.104 1.932 1106 H ARG1051 H ARG1051 1.518 -28.122 3.102 1107 HA ARG1051 HA ARG1051 0.361 -30.485 2.267 1108 1HB ARG1051 1HB ARG1051 2.819 -29.964 4.012 1109 2HB ARG1051 2HB ARG1051 2.425 -31.541 3.358 1110 1HG ARG1051 1HG ARG1051 2.366 -29.408 1.308 1111 2HG ARG1051 2HG ARG1051 3.935 -29.568 2.072 1112 1HD ARG1051 1HD ARG1051 3.274 -32.226 1.653 1113 2HD ARG1051 2HD ARG1051 2.506 -31.466 0.274 1114 HE ARG1051 HE ARG1051 5.358 -31.770 0.702 1115 1HH1 ARG1051 2HH2 ARG1051 2.956 -29.654 -0.758 1116 2HH1 ARG1051 1HH2 ARG1051 4.054 -29.002 -1.928 1117 1HH2 ARG1051 2HH1 ARG1051 6.808 -30.910 -0.841 1118 2HH2 ARG1051 1HH1 ARG1051 6.260 -29.721 -1.975 1119 HA PRO1052 HA PRO1052 -1.768 -31.399 6.021 1120 1HB PRO1052 1HB PRO1052 -3.133 -33.590 5.125 1121 2HB PRO1052 2HB PRO1052 -3.707 -31.949 4.908 1122 1HG PRO1052 1HG PRO1052 -2.496 -33.767 2.916 1123 2HG PRO1052 2HG PRO1052 -3.448 -32.320 2.647 1124 1HD PRO1052 1HD PRO1052 -0.601 -32.572 2.405 1125 2HD PRO1052 2HD PRO1052 -1.540 -31.100 2.249 1126 H HIS1053 H HIS1053 -0.426 -34.121 4.208 1127 HA HIS1053 HA HIS1053 -0.018 -35.624 6.553 1128 1HB HIS1053 1HB HIS1053 1.312 -35.927 3.847 1129 2HB HIS1053 2HB HIS1053 1.215 -37.144 5.105 1130 HD1 HIS1053 HD1 HIS1053 -0.898 -35.387 2.507 1131 HD2 HIS1053 HD2 HIS1053 -1.225 -38.530 5.266 1132 HE1 HIS1053 HE1 HIS1053 -3.066 -36.610 1.945 Start of MODEL 17 1 H MET 915 H MET 915 13.900 -21.680 -2.510 2 HA MET 915 HA MET 915 11.108 -21.685 -1.859 3 1HB MET 915 1HB MET 915 13.151 -19.762 -1.956 4 2HB MET 915 2HB MET 915 12.233 -19.396 -3.404 5 1HG MET 915 1HG MET 915 10.288 -18.837 -2.207 6 2HG MET 915 2HG MET 915 10.697 -19.864 -0.847 7 1HE MET 915 1HE MET 915 11.453 -17.171 1.539 8 2HE MET 915 2HE MET 915 10.008 -17.890 0.789 9 3HE MET 915 3HE MET 915 11.363 -18.931 1.290 10 H ALA 916 H ALA 916 9.372 -21.385 -3.369 11 HA ALA 916 HA ALA 916 9.762 -22.704 -5.833 12 1HB ALA 916 1HB ALA 916 7.314 -21.386 -5.970 13 2HB ALA 916 2HB ALA 916 7.590 -23.010 -5.295 14 3HB ALA 916 3HB ALA 916 7.573 -21.590 -4.221 15 H ASN 917 H ASN 917 8.892 -21.626 -7.958 16 HA ASN 917 HA ASN 917 10.581 -19.379 -8.372 17 1HB ASN 917 1HB ASN 917 9.102 -21.350 -10.009 18 2HB ASN 917 2HB ASN 917 9.003 -19.738 -10.689 19 1HD2 ASN 917 1HD2 ASN 917 10.231 -21.248 -12.288 20 2HD2 ASN 917 2HD2 ASN 917 11.959 -21.139 -12.246 21 H LEU 918 H LEU 918 9.812 -17.347 -7.747 22 HA LEU 918 HA LEU 918 7.018 -16.746 -8.418 23 1HB LEU 918 1HB LEU 918 8.375 -16.670 -5.844 24 2HB LEU 918 2HB LEU 918 7.690 -15.115 -6.271 25 HG LEU 918 HG LEU 918 5.500 -16.363 -6.726 26 1HD1 LEU 918 1HD1 LEU 918 5.997 -18.609 -6.874 27 2HD1 LEU 918 2HD1 LEU 918 7.147 -18.560 -5.516 28 3HD1 LEU 918 3HD1 LEU 918 5.397 -18.485 -5.203 29 1HD2 LEU 918 1HD2 LEU 918 4.768 -15.890 -4.614 30 2HD2 LEU 918 2HD2 LEU 918 6.198 -16.604 -3.830 31 3HD2 LEU 918 3HD2 LEU 918 6.313 -15.006 -4.608 32 H ASP 919 H ASP 919 7.013 -15.330 -10.075 33 HA ASP 919 HA ASP 919 9.206 -13.994 -10.959 34 1HB ASP 919 1HB ASP 919 6.598 -14.285 -11.780 35 2HB ASP 919 2HB ASP 919 6.578 -12.601 -11.297 36 H ARG 920 H ARG 920 8.572 -11.247 -11.258 37 HA ARG 920 HA ARG 920 9.093 -10.351 -8.587 38 1HB ARG 920 1HB ARG 920 9.337 -9.193 -11.363 39 2HB ARG 920 2HB ARG 920 9.182 -8.060 -10.035 40 1HG ARG 920 1HG ARG 920 11.174 -10.322 -9.784 41 2HG ARG 920 2HG ARG 920 11.581 -8.954 -10.801 42 1HD ARG 920 1HD ARG 920 11.426 -7.400 -8.964 43 2HD ARG 920 2HD ARG 920 10.587 -8.556 -7.950 44 HE ARG 920 HE ARG 920 12.650 -9.454 -7.330 45 1HH1 ARG 920 2HH2 ARG 920 13.074 -7.670 -10.361 46 2HH1 ARG 920 1HH2 ARG 920 14.795 -7.867 -10.381 47 1HH2 ARG 920 1HH1 ARG 920 15.859 -9.074 -8.604 48 H SER 921 H SER 921 6.449 -11.330 -8.871 49 HA SER 921 HA SER 921 4.765 -9.071 -9.392 50 1HB SER 921 1HB SER 921 4.328 -11.984 -8.714 51 2HB SER 921 2HB SER 921 3.003 -10.857 -8.501 52 HG SER 921 HG SER 921 4.430 -10.761 -10.970 53 H ASN 922 H ASN 922 5.871 -11.096 -6.617 54 HA ASN 922 HA ASN 922 4.234 -9.933 -4.719 55 1HB ASN 922 1HB ASN 922 7.004 -11.218 -4.502 56 2HB ASN 922 2HB ASN 922 6.065 -10.759 -3.096 57 1HD2 ASN 922 1HD2 ASN 922 5.749 -12.772 -2.307 58 2HD2 ASN 922 2HD2 ASN 922 4.773 -13.988 -3.061 59 H ASP 923 H ASP 923 7.463 -9.098 -6.074 60 HA ASP 923 HA ASP 923 8.003 -7.107 -4.161 61 1HB ASP 923 1HB ASP 923 9.467 -8.435 -6.069 62 2HB ASP 923 2HB ASP 923 9.219 -6.906 -6.889 63 H LYS 924 H LYS 924 6.675 -7.240 -7.524 64 HA LYS 924 HA LYS 924 6.627 -4.665 -8.269 65 1HB LYS 924 1HB LYS 924 5.009 -7.044 -8.796 66 2HB LYS 924 2HB LYS 924 4.095 -5.563 -8.993 67 1HG LYS 924 1HG LYS 924 6.864 -5.912 -10.215 68 2HG LYS 924 2HG LYS 924 5.414 -6.426 -11.054 69 1HD LYS 924 1HD LYS 924 4.495 -4.117 -10.927 70 2HD LYS 924 2HD LYS 924 5.904 -3.589 -10.030 71 1HE LYS 924 1HE LYS 924 6.887 -3.111 -12.021 72 2HE LYS 924 2HE LYS 924 7.001 -4.837 -12.305 73 1HZ LYS 924 1HZ LYS 924 4.918 -2.997 -13.205 74 2HZ LYS 924 2HZ LYS 924 5.820 -4.031 -14.091 75 3HZ LYS 924 3HZ LYS 924 4.630 -4.603 -13.131 76 H VAL 925 H VAL 925 3.751 -6.119 -6.590 77 HA VAL 925 HA VAL 925 2.519 -3.764 -5.988 78 HB VAL 925 HB VAL 925 2.607 -6.316 -4.367 79 1HG1 VAL 925 1HG1 VAL 925 0.330 -5.613 -3.615 80 2HG1 VAL 925 2HG1 VAL 925 1.636 -4.551 -3.037 81 3HG1 VAL 925 3HG1 VAL 925 0.604 -4.036 -4.393 82 1HG2 VAL 925 1HG2 VAL 925 1.782 -5.973 -6.996 83 2HG2 VAL 925 2HG2 VAL 925 1.306 -7.297 -5.905 84 3HG2 VAL 925 3HG2 VAL 925 0.269 -5.859 -6.065 85 H TYR 926 H TYR 926 4.616 -5.661 -3.694 86 HA TYR 926 HA TYR 926 4.748 -3.992 -1.622 87 1HB TYR 926 1HB TYR 926 6.405 -5.988 -3.000 88 2HB TYR 926 2HB TYR 926 7.459 -4.758 -2.332 89 HD1 TYR 926 HD1 TYR 926 6.848 -4.090 0.213 90 HD2 TYR 926 HD2 TYR 926 5.910 -7.818 -1.665 91 HE1 TYR 926 HE1 TYR 926 6.696 -5.208 2.492 92 HE2 TYR 926 HE2 TYR 926 5.761 -8.923 0.620 93 HH TYR 926 HH TYR 926 5.517 -7.188 3.448 94 H GLU 927 H GLU 927 7.129 -3.773 -4.369 95 HA GLU 927 HA GLU 927 8.427 -1.577 -3.615 96 1HB GLU 927 1HB GLU 927 7.866 -2.927 -6.146 97 2HB GLU 927 2HB GLU 927 8.041 -1.201 -6.396 98 1HG GLU 927 1HG GLU 927 10.042 -2.878 -4.813 99 2HG GLU 927 2HG GLU 927 10.213 -2.536 -6.523 100 H ASN 928 H ASN 928 5.726 -1.329 -6.042 101 HA ASN 928 HA ASN 928 5.388 1.272 -6.100 102 1HB ASN 928 1HB ASN 928 2.992 -0.590 -5.717 103 2HB ASN 928 2HB ASN 928 3.035 0.889 -6.656 104 1HD2 ASN 928 1HD2 ASN 928 4.959 0.896 -8.293 105 2HD2 ASN 928 2HD2 ASN 928 5.077 -0.500 -9.312 106 H VAL 929 H VAL 929 3.469 -0.847 -3.821 107 HA VAL 929 HA VAL 929 2.257 0.997 -2.311 108 HB VAL 929 HB VAL 929 3.617 -1.550 -1.415 109 1HG1 VAL 929 1HG1 VAL 929 2.969 0.146 0.417 110 2HG1 VAL 929 2HG1 VAL 929 1.285 -0.237 -0.014 111 3HG1 VAL 929 3HG1 VAL 929 2.367 -1.522 0.573 112 1HG2 VAL 929 1HG2 VAL 929 1.544 -1.198 -3.217 113 2HG2 VAL 929 2HG2 VAL 929 1.903 -2.687 -2.310 114 3HG2 VAL 929 3HG2 VAL 929 0.700 -1.533 -1.686 115 H THR 930 H THR 930 5.572 -0.311 -1.569 116 HA THR 930 HA THR 930 6.108 1.452 0.509 117 HB THR 930 HB THR 930 8.237 0.425 -1.397 118 HG1 THR 930 HG1 THR 930 7.723 -1.684 -0.583 119 1HG2 THR 930 1HG2 THR 930 8.109 1.307 1.360 120 2HG2 THR 930 2HG2 THR 930 8.483 -0.433 1.342 121 3HG2 THR 930 3HG2 THR 930 9.527 0.711 0.464 122 H GLY 931 H GLY 931 7.267 1.727 -2.924 123 1HA GLY 931 1HA GLY 931 8.471 4.145 -2.820 124 2HA GLY 931 2HA GLY 931 7.548 3.574 -4.196 125 H LEU 932 H LEU 932 5.083 3.911 -4.084 126 HA LEU 932 HA LEU 932 4.410 6.486 -4.013 127 1HB LEU 932 1HB LEU 932 2.372 5.742 -4.458 128 2HB LEU 932 2HB LEU 932 3.099 4.148 -4.406 129 HG LEU 932 HG LEU 932 2.443 3.991 -1.987 130 1HD1 LEU 932 1HD1 LEU 932 1.761 6.755 -2.418 131 2HD1 LEU 932 2HD1 LEU 932 0.325 5.845 -1.889 132 3HD1 LEU 932 3HD1 LEU 932 1.808 5.819 -0.904 133 1HD2 LEU 932 1HD2 LEU 932 1.135 3.054 -3.952 134 2HD2 LEU 932 2HD2 LEU 932 0.235 3.290 -2.434 135 3HD2 LEU 932 3HD2 LEU 932 0.048 4.452 -3.770 136 H VAL 933 H VAL 933 4.622 4.294 -1.180 137 HA VAL 933 HA VAL 933 3.528 6.178 0.630 138 HB VAL 933 HB VAL 933 4.775 3.512 0.682 139 1HG1 VAL 933 1HG1 VAL 933 4.997 5.376 3.067 140 2HG1 VAL 933 2HG1 VAL 933 5.142 3.604 3.163 141 3HG1 VAL 933 3HG1 VAL 933 6.318 4.543 2.213 142 1HG2 VAL 933 1HG2 VAL 933 2.279 4.780 1.336 143 2HG2 VAL 933 2HG2 VAL 933 2.661 3.046 1.213 144 3HG2 VAL 933 3HG2 VAL 933 2.880 3.898 2.760 145 H LYS 934 H LYS 934 6.922 5.045 -0.019 146 HA LYS 934 HA LYS 934 8.182 6.779 1.698 147 1HB LYS 934 1HB LYS 934 10.101 5.993 0.776 148 2HB LYS 934 2HB LYS 934 9.003 4.796 0.120 149 1HG LYS 934 1HG LYS 934 8.823 6.043 -1.997 150 2HG LYS 934 2HG LYS 934 9.773 7.363 -1.344 151 1HD LYS 934 1HD LYS 934 11.373 5.068 -0.917 152 2HD LYS 934 2HD LYS 934 10.679 4.825 -2.508 153 1HE LYS 934 1HE LYS 934 11.372 7.405 -2.829 154 2HE LYS 934 2HE LYS 934 12.509 7.027 -1.550 155 1HZ LYS 934 1HZ LYS 934 13.747 6.179 -3.149 156 2HZ LYS 934 2HZ LYS 934 12.697 4.934 -3.258 157 3HZ LYS 934 3HZ LYS 934 12.547 6.217 -4.256 158 H ALA 935 H ALA 935 6.445 7.442 -1.255 159 HA ALA 935 HA ALA 935 7.789 9.962 -1.690 160 1HB ALA 935 1HB ALA 935 6.224 8.125 -3.209 161 2HB ALA 935 2HB ALA 935 5.329 9.663 -3.160 162 3HB ALA 935 3HB ALA 935 7.002 9.626 -3.765 163 H VAL 936 H VAL 936 4.533 8.756 -0.641 164 HA VAL 936 HA VAL 936 3.185 11.040 -0.309 165 HB VAL 936 HB VAL 936 2.838 8.472 0.409 166 1HG1 VAL 936 1HG1 VAL 936 2.931 9.907 3.076 167 2HG1 VAL 936 2HG1 VAL 936 2.640 8.179 2.764 168 3HG1 VAL 936 3HG1 VAL 936 4.252 8.877 2.477 169 1HG2 VAL 936 1HG2 VAL 936 0.951 9.758 -0.086 170 2HG2 VAL 936 2HG2 VAL 936 0.726 9.352 1.632 171 3HG2 VAL 936 3HG2 VAL 936 1.319 10.965 1.170 172 H ILE 937 H ILE 937 5.892 9.848 1.720 173 HA ILE 937 HA ILE 937 5.589 12.063 3.542 174 HB ILE 937 HB ILE 937 7.415 9.691 3.332 175 1HG1 ILE 937 1HG1 ILE 937 6.084 10.276 5.870 176 2HG1 ILE 937 2HG1 ILE 937 4.948 10.117 4.546 177 1HG2 ILE 937 1HG2 ILE 937 7.987 12.262 4.633 178 2HG2 ILE 937 2HG2 ILE 937 8.111 10.854 5.715 179 3HG2 ILE 937 3HG2 ILE 937 9.069 10.911 4.216 180 1HD1 ILE 937 1HD1 ILE 937 6.131 8.009 5.949 181 2HD1 ILE 937 2HD1 ILE 937 5.289 7.874 4.387 182 3HD1 ILE 937 3HD1 ILE 937 7.058 8.065 4.431 183 H GLU 938 H GLU 938 8.355 10.854 1.513 184 HA GLU 938 HA GLU 938 10.002 12.863 1.612 185 1HB GLU 938 1HB GLU 938 9.318 10.887 -0.395 186 2HB GLU 938 2HB GLU 938 9.780 12.374 -1.198 187 1HG GLU 938 1HG GLU 938 11.934 11.718 -0.862 188 2HG GLU 938 2HG GLU 938 11.699 12.185 0.811 189 H MET 939 H MET 939 6.998 12.893 -0.407 190 HA MET 939 HA MET 939 7.344 15.245 -1.683 191 1HB MET 939 1HB MET 939 5.415 13.759 -2.070 192 2HB MET 939 2HB MET 939 4.836 14.000 -0.434 193 1HG MET 939 1HG MET 939 4.692 16.539 -1.066 194 2HG MET 939 2HG MET 939 4.849 16.002 -2.726 195 1HE MET 939 1HE MET 939 3.434 13.042 -2.271 196 2HE MET 939 2HE MET 939 1.827 13.436 -2.927 197 3HE MET 939 3HE MET 939 3.291 14.043 -3.736 198 H SER 940 H SER 940 5.411 14.908 1.389 199 HA SER 940 HA SER 940 4.974 17.469 1.912 200 1HB SER 940 1HB SER 940 5.930 15.562 4.083 201 2HB SER 940 2HB SER 940 4.784 16.877 4.252 202 HG SER 940 HG SER 940 3.315 15.703 2.840 203 H SER 941 H SER 941 8.068 15.708 2.307 204 HA SER 941 HA SER 941 9.364 17.637 3.813 205 1HB SER 941 1HB SER 941 10.007 15.153 3.081 206 2HB SER 941 2HB SER 941 10.851 15.970 1.781 207 HG SER 941 HG SER 941 11.485 15.812 4.498 208 H LYS 942 H LYS 942 9.025 17.134 0.253 209 HA LYS 942 HA LYS 942 10.304 19.750 -0.128 210 1HB LYS 942 1HB LYS 942 10.678 18.906 -2.489 211 2HB LYS 942 2HB LYS 942 11.629 18.144 -1.230 212 1HG LYS 942 1HG LYS 942 10.658 16.105 -1.569 213 2HG LYS 942 2HG LYS 942 9.043 16.784 -1.628 214 1HD LYS 942 1HD LYS 942 10.566 17.575 -3.999 215 2HD LYS 942 2HD LYS 942 10.586 15.832 -3.817 216 1HE LYS 942 1HE LYS 942 7.909 16.910 -3.276 217 2HE LYS 942 2HE LYS 942 8.473 17.404 -4.859 218 1HZ LYS 942 1HZ LYS 942 7.397 15.040 -4.329 219 2HZ LYS 942 2HZ LYS 942 8.391 15.320 -5.595 220 3HZ LYS 942 3HZ LYS 942 8.982 14.660 -4.223 221 H ILE 943 H ILE 943 7.500 19.207 0.731 222 HA ILE 943 HA ILE 943 6.025 19.909 -1.683 223 HB ILE 943 HB ILE 943 5.421 18.141 0.201 224 1HG1 ILE 943 1HG1 ILE 943 4.209 18.978 -1.984 225 2HG1 ILE 943 2HG1 ILE 943 3.377 17.984 -0.805 226 1HG2 ILE 943 1HG2 ILE 943 5.400 19.722 2.048 227 2HG2 ILE 943 2HG2 ILE 943 4.167 20.705 1.222 228 3HG2 ILE 943 3HG2 ILE 943 3.771 19.060 1.775 229 1HD1 ILE 943 1HD1 ILE 943 2.174 20.133 -1.657 230 2HD1 ILE 943 2HD1 ILE 943 2.173 19.824 0.096 231 3HD1 ILE 943 3HD1 ILE 943 3.302 21.013 -0.597 232 H GLN 944 H GLN 944 6.693 21.105 1.670 233 HA GLN 944 HA GLN 944 5.257 23.369 1.623 234 1HB GLN 944 1HB GLN 944 7.367 22.290 3.175 235 2HB GLN 944 2HB GLN 944 7.904 23.902 2.745 236 1HG GLN 944 1HG GLN 944 5.263 24.387 3.411 237 2HG GLN 944 2HG GLN 944 5.643 23.063 4.494 238 1HE2 GLN 944 1HE2 GLN 944 7.609 23.234 5.792 239 2HE2 GLN 944 2HE2 GLN 944 8.107 24.780 6.394 240 HA PRO 945 HA PRO 945 8.752 25.556 -0.723 241 1HB PRO 945 1HB PRO 945 10.813 24.105 -1.779 242 2HB PRO 945 2HB PRO 945 10.907 24.913 -0.227 243 1HG PRO 945 1HG PRO 945 10.582 22.031 -0.800 244 2HG PRO 945 2HG PRO 945 11.097 22.804 0.687 245 1HD PRO 945 1HD PRO 945 8.514 21.682 0.141 246 2HD PRO 945 2HD PRO 945 8.993 22.557 1.582 247 H ALA 946 H ALA 946 8.400 22.325 -2.096 248 HA ALA 946 HA ALA 946 8.471 22.782 -4.701 249 1HB ALA 946 1HB ALA 946 6.750 21.092 -2.940 250 2HB ALA 946 2HB ALA 946 6.259 21.232 -4.646 251 3HB ALA 946 3HB ALA 946 7.878 20.617 -4.233 252 HA PRO 947 HA PRO 947 5.589 25.979 -5.399 253 1HB PRO 947 1HB PRO 947 6.025 26.286 -8.079 254 2HB PRO 947 2HB PRO 947 7.013 27.055 -6.853 255 1HG PRO 947 1HG PRO 947 7.651 24.721 -8.551 256 2HG PRO 947 2HG PRO 947 8.743 25.753 -7.648 257 1HD PRO 947 1HD PRO 947 7.883 23.113 -6.926 258 2HD PRO 947 2HD PRO 947 8.881 24.189 -5.968 259 HA PRO 948 HA PRO 948 2.040 24.327 -7.052 260 1HB PRO 948 1HB PRO 948 0.842 26.319 -8.489 261 2HB PRO 948 2HB PRO 948 0.777 26.227 -6.740 262 1HG PRO 948 1HG PRO 948 2.385 28.031 -8.442 263 2HG PRO 948 2HG PRO 948 1.980 28.194 -6.744 264 1HD PRO 948 1HD PRO 948 4.496 27.354 -7.835 265 2HD PRO 948 2HD PRO 948 4.054 27.406 -6.141 266 H GLU 949 H GLU 949 4.421 25.353 -9.198 267 HA GLU 949 HA GLU 949 3.047 24.207 -11.448 268 1HB GLU 949 1HB GLU 949 5.038 26.191 -11.104 269 2HB GLU 949 2HB GLU 949 5.858 24.867 -11.908 270 1HG GLU 949 1HG GLU 949 3.446 24.973 -13.294 271 2HG GLU 949 2HG GLU 949 3.724 26.664 -12.927 272 H GLU 950 H GLU 950 5.067 23.182 -8.863 273 HA GLU 950 HA GLU 950 5.882 20.863 -10.434 274 1HB GLU 950 1HB GLU 950 7.582 22.540 -9.171 275 2HB GLU 950 2HB GLU 950 7.213 21.493 -7.815 276 1HG GLU 950 1HG GLU 950 7.697 19.523 -9.499 277 2HG GLU 950 2HG GLU 950 8.480 20.752 -10.473 278 H TYR 951 H TYR 951 3.727 22.019 -8.084 279 HA TYR 951 HA TYR 951 3.682 19.573 -6.523 280 1HB TYR 951 1HB TYR 951 3.369 21.934 -5.596 281 2HB TYR 951 2HB TYR 951 1.969 22.135 -6.630 282 HD1 TYR 951 HD1 TYR 951 0.340 22.537 -4.931 283 HD2 TYR 951 HD2 TYR 951 2.770 19.019 -4.773 284 HE1 TYR 951 HE1 TYR 951 -1.145 21.584 -3.100 285 HE2 TYR 951 HE2 TYR 951 1.277 18.078 -2.944 286 HH TYR 951 HH TYR 951 -0.932 19.978 -1.267 287 H VAL 952 H VAL 952 1.779 21.300 -9.036 288 HA VAL 952 HA VAL 952 -0.558 19.900 -8.931 289 HB VAL 952 HB VAL 952 0.986 21.396 -10.936 290 1HG1 VAL 952 1HG1 VAL 952 -0.660 20.722 -12.768 291 2HG1 VAL 952 2HG1 VAL 952 0.631 19.558 -12.385 292 3HG1 VAL 952 3HG1 VAL 952 -1.019 19.289 -11.774 293 1HG2 VAL 952 1HG2 VAL 952 -1.798 21.812 -11.192 294 2HG2 VAL 952 2HG2 VAL 952 -1.483 21.587 -9.455 295 3HG2 VAL 952 3HG2 VAL 952 -0.610 22.845 -10.362 296 HA PRO 953 HA PRO 953 1.543 16.499 -11.469 297 1HB PRO 953 1HB PRO 953 4.266 16.459 -11.692 298 2HB PRO 953 2HB PRO 953 3.214 17.142 -12.916 299 1HG PRO 953 1HG PRO 953 4.909 18.540 -10.938 300 2HG PRO 953 2HG PRO 953 4.198 19.166 -12.412 301 1HD PRO 953 1HD PRO 953 3.280 19.628 -9.734 302 2HD PRO 953 2HD PRO 953 2.504 20.157 -11.214 303 H MET 954 H MET 954 3.938 17.409 -9.030 304 HA MET 954 HA MET 954 4.744 15.160 -8.071 305 1HB MET 954 1HB MET 954 3.964 17.737 -6.893 306 2HB MET 954 2HB MET 954 3.745 16.455 -5.719 307 1HG MET 954 1HG MET 954 6.013 16.009 -5.567 308 2HG MET 954 2HG MET 954 6.304 16.334 -7.264 309 1HE MET 954 1HE MET 954 6.040 18.531 -3.615 310 2HE MET 954 2HE MET 954 5.003 19.657 -4.524 311 3HE MET 954 3HE MET 954 4.581 17.929 -4.440 312 H VAL 955 H VAL 955 1.595 16.475 -6.789 313 HA VAL 955 HA VAL 955 0.866 14.111 -5.520 314 HB VAL 955 HB VAL 955 -0.492 16.612 -6.415 315 1HG1 VAL 955 1HG1 VAL 955 -2.125 14.847 -6.959 316 2HG1 VAL 955 2HG1 VAL 955 -1.994 14.218 -5.298 317 3HG1 VAL 955 3HG1 VAL 955 -2.662 15.843 -5.585 318 1HG2 VAL 955 1HG2 VAL 955 0.528 15.423 -3.947 319 2HG2 VAL 955 2HG2 VAL 955 0.180 17.124 -4.341 320 3HG2 VAL 955 3HG2 VAL 955 -1.125 16.058 -3.766 321 H LYS 956 H LYS 956 0.057 15.404 -8.805 322 HA LYS 956 HA LYS 956 -1.691 13.459 -9.596 323 1HB LYS 956 1HB LYS 956 -0.214 15.575 -10.785 324 2HB LYS 956 2HB LYS 956 0.040 14.159 -11.786 325 1HG LYS 956 1HG LYS 956 -2.112 14.173 -12.539 326 2HG LYS 956 2HG LYS 956 -2.764 14.368 -10.924 327 1HD LYS 956 1HD LYS 956 -3.402 16.402 -11.869 328 2HD LYS 956 2HD LYS 956 -1.864 16.861 -11.166 329 1HE LYS 956 1HE LYS 956 -0.757 16.888 -13.250 330 2HE LYS 956 2HE LYS 956 -1.890 15.774 -13.988 331 1HZ LYS 956 1HZ LYS 956 -2.259 18.614 -13.429 332 2HZ LYS 956 2HZ LYS 956 -2.468 17.813 -14.837 333 3HZ LYS 956 3HZ LYS 956 -3.555 17.641 -13.631 334 H GLU 957 H GLU 957 1.895 13.362 -9.435 335 HA GLU 957 HA GLU 957 2.218 11.013 -10.838 336 1HB GLU 957 1HB GLU 957 3.812 12.733 -9.087 337 2HB GLU 957 2HB GLU 957 4.216 11.047 -8.835 338 1HG GLU 957 1HG GLU 957 5.625 11.516 -10.625 339 2HG GLU 957 2HG GLU 957 4.215 10.961 -11.505 340 H VAL 958 H VAL 958 1.474 11.638 -7.373 341 HA VAL 958 HA VAL 958 1.836 9.051 -6.437 342 HB VAL 958 HB VAL 958 -0.062 11.239 -5.568 343 1HG1 VAL 958 1HG1 VAL 958 0.485 9.833 -3.303 344 2HG1 VAL 958 2HG1 VAL 958 -0.963 9.589 -4.309 345 3HG1 VAL 958 3HG1 VAL 958 0.448 8.521 -4.506 346 1HG2 VAL 958 1HG2 VAL 958 2.327 10.684 -3.947 347 2HG2 VAL 958 2HG2 VAL 958 2.695 11.260 -5.591 348 3HG2 VAL 958 3HG2 VAL 958 1.659 12.233 -4.518 349 H GLY 959 H GLY 959 -0.873 10.607 -8.186 350 1HA GLY 959 1HA GLY 959 -2.784 8.577 -7.758 351 2HA GLY 959 2HA GLY 959 -2.780 9.774 -9.038 352 H LEU 960 H LEU 960 -0.352 9.173 -10.383 353 HA LEU 960 HA LEU 960 -1.177 7.077 -12.019 354 1HB LEU 960 1HB LEU 960 0.820 9.069 -11.977 355 2HB LEU 960 2HB LEU 960 1.657 7.544 -12.186 356 HG LEU 960 HG LEU 960 -0.730 8.001 -13.908 357 1HD1 LEU 960 1HD1 LEU 960 1.440 9.148 -15.310 358 2HD1 LEU 960 2HD1 LEU 960 -0.073 9.926 -14.787 359 3HD1 LEU 960 3HD1 LEU 960 1.358 9.961 -13.729 360 1HD2 LEU 960 1HD2 LEU 960 1.422 7.149 -15.440 361 2HD2 LEU 960 2HD2 LEU 960 1.672 6.355 -13.867 362 3HD2 LEU 960 3HD2 LEU 960 0.139 6.130 -14.744 363 H ALA 961 H ALA 961 1.137 7.220 -9.264 364 HA ALA 961 HA ALA 961 2.088 4.598 -9.576 365 1HB ALA 961 1HB ALA 961 3.233 6.349 -8.275 366 2HB ALA 961 2HB ALA 961 1.886 6.377 -7.111 367 3HB ALA 961 3HB ALA 961 2.903 4.924 -7.262 368 H LEU 962 H LEU 962 -0.702 6.042 -7.820 369 HA LEU 962 HA LEU 962 -1.411 3.723 -6.427 370 1HB LEU 962 1HB LEU 962 -2.578 5.354 -5.496 371 2HB LEU 962 2HB LEU 962 -2.454 6.377 -6.913 372 HG LEU 962 HG LEU 962 -4.382 4.134 -7.127 373 1HD1 LEU 962 1HD1 LEU 962 -4.505 6.104 -4.928 374 2HD1 LEU 962 2HD1 LEU 962 -5.998 5.917 -5.879 375 3HD1 LEU 962 3HD1 LEU 962 -5.262 4.502 -5.089 376 1HD2 LEU 962 1HD2 LEU 962 -5.751 5.883 -8.199 377 2HD2 LEU 962 2HD2 LEU 962 -4.489 7.081 -7.824 378 3HD2 LEU 962 3HD2 LEU 962 -4.135 5.733 -8.931 379 H ARG 963 H ARG 963 -2.404 5.025 -9.651 380 HA ARG 963 HA ARG 963 -4.320 3.221 -10.235 381 1HB ARG 963 1HB ARG 963 -2.204 4.473 -12.051 382 2HB ARG 963 2HB ARG 963 -3.572 3.575 -12.677 383 1HG ARG 963 1HG ARG 963 -4.691 5.398 -10.811 384 2HG ARG 963 2HG ARG 963 -3.473 6.322 -11.667 385 1HD ARG 963 1HD ARG 963 -4.654 4.980 -13.769 386 2HD ARG 963 2HD ARG 963 -6.022 5.145 -12.686 387 HE ARG 963 HE ARG 963 -4.573 7.647 -12.894 388 1HH1 ARG 963 2HH2 ARG 963 -6.871 5.598 -14.599 389 2HH1 ARG 963 1HH2 ARG 963 -7.577 6.909 -15.485 390 1HH2 ARG 963 2HH1 ARG 963 -5.504 9.376 -14.062 391 2HH2 ARG 963 1HH1 ARG 963 -6.794 9.072 -15.177 392 H THR 964 H THR 964 -0.748 2.942 -10.854 393 HA THR 964 HA THR 964 -0.900 0.353 -11.969 394 HB THR 964 HB THR 964 1.289 2.109 -10.775 395 HG1 THR 964 HG1 THR 964 0.339 2.576 -12.895 396 1HG2 THR 964 1HG2 THR 964 1.594 -0.592 -12.191 397 2HG2 THR 964 2HG2 THR 964 2.922 0.511 -11.755 398 3HG2 THR 964 3HG2 THR 964 1.978 -0.294 -10.479 399 H LEU 965 H LEU 965 -0.641 1.575 -8.628 400 HA LEU 965 HA LEU 965 0.178 -0.779 -7.423 401 1HB LEU 965 1HB LEU 965 0.273 1.136 -6.133 402 2HB LEU 965 2HB LEU 965 -1.356 1.635 -6.546 403 HG LEU 965 HG LEU 965 -1.107 -0.904 -5.017 404 1HD1 LEU 965 1HD1 LEU 965 0.524 1.039 -4.130 405 2HD1 LEU 965 2HD1 LEU 965 -0.990 1.542 -3.340 406 3HD1 LEU 965 3HD1 LEU 965 -0.336 -0.089 -3.054 407 1HD2 LEU 965 1HD2 LEU 965 -3.138 -0.186 -4.001 408 2HD2 LEU 965 2HD2 LEU 965 -2.932 1.474 -4.608 409 3HD2 LEU 965 3HD2 LEU 965 -3.271 0.146 -5.744 410 H LEU 966 H LEU 966 -3.049 0.320 -8.534 411 HA LEU 966 HA LEU 966 -4.510 -1.713 -7.283 412 1HB LEU 966 1HB LEU 966 -4.970 0.135 -9.597 413 2HB LEU 966 2HB LEU 966 -6.112 -1.153 -9.268 414 HG LEU 966 HG LEU 966 -6.136 -0.178 -6.841 415 1HD1 LEU 966 1HD1 LEU 966 -4.377 1.378 -6.883 416 2HD1 LEU 966 2HD1 LEU 966 -4.915 2.080 -8.428 417 3HD1 LEU 966 3HD1 LEU 966 -5.861 2.358 -6.946 418 1HD2 LEU 966 1HD2 LEU 966 -7.473 1.554 -8.904 419 2HD2 LEU 966 2HD2 LEU 966 -7.931 -0.155 -8.708 420 3HD2 LEU 966 3HD2 LEU 966 -8.089 0.972 -7.339 421 H ALA 967 H ALA 967 -3.078 -1.456 -10.604 422 HA ALA 967 HA ALA 967 -3.953 -3.932 -11.500 423 1HB ALA 967 1HB ALA 967 -3.113 -2.749 -13.252 424 2HB ALA 967 2HB ALA 967 -1.927 -1.895 -12.236 425 3HB ALA 967 3HB ALA 967 -1.581 -3.542 -12.815 426 H THR 968 H THR 968 -0.726 -3.012 -10.090 427 HA THR 968 HA THR 968 0.351 -5.547 -10.027 428 HB THR 968 HB THR 968 1.894 -4.547 -8.387 429 HG1 THR 968 HG1 THR 968 -0.421 -2.769 -8.188 430 1HG2 THR 968 1HG2 THR 968 2.671 -3.143 -10.012 431 2HG2 THR 968 2HG2 THR 968 1.069 -3.127 -10.788 432 3HG2 THR 968 3HG2 THR 968 1.453 -1.944 -9.514 433 H VAL 969 H VAL 969 -1.905 -3.985 -7.714 434 HA VAL 969 HA VAL 969 -1.715 -5.874 -5.700 435 HB VAL 969 HB VAL 969 -3.872 -4.012 -6.656 436 1HG1 VAL 969 1HG1 VAL 969 -4.033 -5.955 -4.332 437 2HG1 VAL 969 2HG1 VAL 969 -5.088 -4.533 -4.515 438 3HG1 VAL 969 3HG1 VAL 969 -5.129 -5.833 -5.730 439 1HG2 VAL 969 1HG2 VAL 969 -2.993 -2.546 -5.200 440 2HG2 VAL 969 2HG2 VAL 969 -2.835 -3.772 -3.920 441 3HG2 VAL 969 3HG2 VAL 969 -1.576 -3.623 -5.169 442 H ASP 970 H ASP 970 -3.796 -5.785 -8.657 443 HA ASP 970 HA ASP 970 -5.353 -7.918 -8.162 444 1HB ASP 970 1HB ASP 970 -5.409 -6.435 -10.199 445 2HB ASP 970 2HB ASP 970 -3.988 -7.255 -10.815 446 H GLU 971 H GLU 971 -1.953 -7.801 -9.381 447 HA GLU 971 HA GLU 971 -1.819 -10.584 -9.831 448 1HB GLU 971 1HB GLU 971 -0.352 -8.470 -10.692 449 2HB GLU 971 2HB GLU 971 0.683 -8.994 -9.379 450 1HG GLU 971 1HG GLU 971 1.208 -11.015 -10.401 451 2HG GLU 971 2HG GLU 971 -0.354 -11.155 -11.183 452 H SER 972 H SER 972 -1.539 -8.502 -7.041 453 HA SER 972 HA SER 972 0.067 -10.373 -5.588 454 1HB SER 972 1HB SER 972 -0.577 -7.611 -5.367 455 2HB SER 972 2HB SER 972 -1.250 -8.364 -3.935 456 HG SER 972 HG SER 972 1.115 -7.615 -3.931 457 H LEU 973 H LEU 973 -3.319 -9.695 -6.224 458 HA LEU 973 HA LEU 973 -4.595 -10.515 -3.975 459 1HB LEU 973 1HB LEU 973 -5.225 -10.032 -6.658 460 2HB LEU 973 2HB LEU 973 -5.821 -11.649 -6.341 461 HG LEU 973 HG LEU 973 -6.797 -9.042 -5.380 462 1HD1 LEU 973 1HD1 LEU 973 -7.805 -11.274 -6.716 463 2HD1 LEU 973 2HD1 LEU 973 -8.587 -11.310 -5.117 464 3HD1 LEU 973 3HD1 LEU 973 -8.719 -9.859 -6.140 465 1HD2 LEU 973 1HD2 LEU 973 -6.158 -9.555 -3.226 466 2HD2 LEU 973 2HD2 LEU 973 -7.782 -10.280 -3.298 467 3HD2 LEU 973 3HD2 LEU 973 -6.339 -11.309 -3.469 468 HA PRO 974 HA PRO 974 -3.913 -15.010 -5.253 469 1HB PRO 974 1HB PRO 974 -2.232 -15.622 -7.319 470 2HB PRO 974 2HB PRO 974 -3.969 -15.484 -7.506 471 1HG PRO 974 1HG PRO 974 -1.859 -13.590 -8.342 472 2HG PRO 974 2HG PRO 974 -3.524 -13.685 -8.879 473 1HD PRO 974 1HD PRO 974 -2.423 -11.784 -7.036 474 2HD PRO 974 2HD PRO 974 -4.108 -11.953 -7.485 475 H VAL 975 H VAL 975 -1.160 -12.915 -5.547 476 HA VAL 975 HA VAL 975 0.848 -14.583 -4.796 477 HB VAL 975 HB VAL 975 0.246 -11.693 -4.247 478 1HG1 VAL 975 1HG1 VAL 975 2.555 -13.320 -3.190 479 2HG1 VAL 975 2HG1 VAL 975 2.754 -11.593 -3.575 480 3HG1 VAL 975 3HG1 VAL 975 1.557 -12.102 -2.359 481 1HG2 VAL 975 1HG2 VAL 975 1.821 -11.247 -5.942 482 2HG2 VAL 975 2HG2 VAL 975 2.514 -12.885 -5.852 483 3HG2 VAL 975 3HG2 VAL 975 0.892 -12.641 -6.544 484 H LEU 976 H LEU 976 -1.839 -13.308 -2.843 485 HA LEU 976 HA LEU 976 -0.685 -14.683 -0.519 486 1HB LEU 976 1HB LEU 976 -2.787 -12.517 -0.542 487 2HB LEU 976 2HB LEU 976 -2.012 -13.226 0.861 488 HG LEU 976 HG LEU 976 -0.997 -11.129 0.577 489 1HD1 LEU 976 1HD1 LEU 976 1.340 -11.618 0.082 490 2HD1 LEU 976 2HD1 LEU 976 0.600 -12.933 1.027 491 3HD1 LEU 976 3HD1 LEU 976 0.868 -13.135 -0.721 492 1HD2 LEU 976 1HD2 LEU 976 -0.271 -10.148 -1.441 493 2HD2 LEU 976 2HD2 LEU 976 -0.380 -11.688 -2.327 494 3HD2 LEU 976 3HD2 LEU 976 -1.863 -10.859 -1.797 495 HA PRO 977 HA PRO 977 -3.968 -17.477 -0.692 496 1HB PRO 977 1HB PRO 977 -4.199 -18.253 1.918 497 2HB PRO 977 2HB PRO 977 -2.966 -18.875 0.839 498 1HG PRO 977 1HG PRO 977 -2.694 -16.904 3.026 499 2HG PRO 977 2HG PRO 977 -1.445 -17.844 2.233 500 1HD PRO 977 1HD PRO 977 -2.033 -15.068 1.812 501 2HD PRO 977 2HD PRO 977 -0.863 -16.037 0.937 502 H ALA 978 H ALA 978 -6.206 -17.941 -0.336 503 HA ALA 978 HA ALA 978 -7.704 -15.615 -0.175 504 1HB ALA 978 1HB ALA 978 -8.314 -17.869 -1.189 505 2HB ALA 978 2HB ALA 978 -8.664 -18.427 0.465 506 3HB ALA 978 3HB ALA 978 -9.599 -17.085 -0.239 507 H SER 979 H SER 979 -7.728 -14.265 1.564 508 HA SER 979 HA SER 979 -8.959 -15.031 3.892 509 1HB SER 979 1HB SER 979 -6.242 -15.864 3.870 510 2HB SER 979 2HB SER 979 -6.284 -14.447 4.901 511 HG SER 979 HG SER 979 -8.157 -15.512 6.014 512 H THR 980 H THR 980 -6.554 -12.959 2.236 513 HA THR 980 HA THR 980 -7.623 -10.649 3.721 514 HB THR 980 HB THR 980 -5.217 -11.022 4.103 515 HG1 THR 980 HG1 THR 980 -4.730 -8.891 3.451 516 1HG2 THR 980 1HG2 THR 980 -4.697 -12.315 2.004 517 2HG2 THR 980 2HG2 THR 980 -4.972 -10.836 1.054 518 3HG2 THR 980 3HG2 THR 980 -3.617 -10.915 2.206 519 H HIS 981 H HIS 981 -8.403 -12.279 1.087 520 HA HIS 981 HA HIS 981 -8.051 -10.623 -1.066 521 1HB HIS 981 1HB HIS 981 -10.027 -12.704 -0.271 522 2HB HIS 981 2HB HIS 981 -10.479 -11.661 -1.605 523 HD1 HIS 981 HD1 HIS 981 -10.215 -13.332 -3.506 524 HD2 HIS 981 HD2 HIS 981 -6.785 -13.016 -1.112 525 HE1 HIS 981 HE1 HIS 981 -8.383 -14.643 -4.704 526 H ARG 982 H ARG 982 -11.193 -10.831 0.745 527 HA ARG 982 HA ARG 982 -12.307 -8.621 -0.221 528 1HB ARG 982 1HB ARG 982 -12.824 -10.384 1.897 529 2HB ARG 982 2HB ARG 982 -12.719 -8.834 2.708 530 1HG ARG 982 1HG ARG 982 -14.382 -7.881 1.090 531 2HG ARG 982 2HG ARG 982 -14.496 -9.439 0.297 532 1HD ARG 982 1HD ARG 982 -16.364 -9.188 1.881 533 2HD ARG 982 2HD ARG 982 -15.304 -10.471 2.431 534 HE ARG 982 HE ARG 982 -14.286 -8.234 3.706 535 1HH1 ARG 982 2HH2 ARG 982 -17.489 -9.677 3.508 536 2HH1 ARG 982 1HH2 ARG 982 -17.979 -9.115 5.071 537 1HH2 ARG 982 2HH1 ARG 982 -14.932 -7.491 5.768 538 2HH2 ARG 982 1HH1 ARG 982 -16.515 -7.863 6.365 539 H GLU 983 H GLU 983 -10.364 -8.750 2.863 540 HA GLU 983 HA GLU 983 -10.416 -6.111 3.446 541 1HB GLU 983 1HB GLU 983 -8.689 -8.415 4.091 542 2HB GLU 983 2HB GLU 983 -7.836 -6.887 4.191 543 1HG GLU 983 1HG GLU 983 -9.179 -6.078 5.924 544 2HG GLU 983 2HG GLU 983 -10.579 -7.006 5.424 545 H ILE 984 H ILE 984 -8.106 -7.865 1.280 546 HA ILE 984 HA ILE 984 -6.400 -5.786 0.731 547 HB ILE 984 HB ILE 984 -7.233 -8.295 -0.595 548 1HG1 ILE 984 1HG1 ILE 984 -4.525 -7.085 0.042 549 2HG1 ILE 984 2HG1 ILE 984 -5.425 -8.156 1.098 550 1HG2 ILE 984 1HG2 ILE 984 -5.586 -7.640 -2.507 551 2HG2 ILE 984 2HG2 ILE 984 -7.293 -7.144 -2.596 552 3HG2 ILE 984 3HG2 ILE 984 -6.051 -5.974 -2.089 553 1HD1 ILE 984 1HD1 ILE 984 -5.467 -9.823 -0.894 554 2HD1 ILE 984 2HD1 ILE 984 -4.215 -8.786 -1.617 555 3HD1 ILE 984 3HD1 ILE 984 -3.914 -9.589 -0.057 556 H GLU 985 H GLU 985 -9.495 -6.673 -0.936 557 HA GLU 985 HA GLU 985 -9.379 -4.663 -2.806 558 1HB GLU 985 1HB GLU 985 -11.089 -6.733 -2.250 559 2HB GLU 985 2HB GLU 985 -12.081 -5.374 -1.759 560 1HG GLU 985 1HG GLU 985 -10.780 -4.722 -4.272 561 2HG GLU 985 2HG GLU 985 -11.547 -6.291 -4.423 562 H MET 986 H MET 986 -10.738 -4.701 0.538 563 HA MET 986 HA MET 986 -11.792 -2.105 0.335 564 1HB MET 986 1HB MET 986 -11.346 -4.199 2.436 565 2HB MET 986 2HB MET 986 -11.429 -2.559 3.050 566 1HG MET 986 1HG MET 986 -13.682 -2.442 2.709 567 2HG MET 986 2HG MET 986 -13.543 -3.042 1.069 568 1HE MET 986 1HE MET 986 -13.820 -5.823 0.469 569 2HE MET 986 2HE MET 986 -15.347 -6.150 1.324 570 3HE MET 986 3HE MET 986 -15.062 -4.554 0.589 571 H ALA 987 H ALA 987 -8.605 -3.436 1.047 572 HA ALA 987 HA ALA 987 -7.625 -1.184 2.465 573 1HB ALA 987 1HB ALA 987 -5.897 -3.084 0.883 574 2HB ALA 987 2HB ALA 987 -5.606 -2.354 2.480 575 3HB ALA 987 3HB ALA 987 -6.787 -3.674 2.307 576 H GLN 988 H GLN 988 -8.145 -2.004 -0.929 577 HA GLN 988 HA GLN 988 -6.290 -0.111 -1.907 578 1HB GLN 988 1HB GLN 988 -8.562 -1.689 -3.165 579 2HB GLN 988 2HB GLN 988 -7.645 -0.516 -4.089 580 1HG GLN 988 1HG GLN 988 -5.687 -2.059 -2.735 581 2HG GLN 988 2HG GLN 988 -6.884 -3.223 -3.267 582 1HE2 GLN 988 1HE2 GLN 988 -7.308 -3.523 -5.436 583 2HE2 GLN 988 2HE2 GLN 988 -6.265 -2.959 -6.699 584 H LYS 989 H LYS 989 -9.890 -0.214 -1.498 585 HA LYS 989 HA LYS 989 -10.406 2.288 -2.587 586 1HB LYS 989 1HB LYS 989 -12.130 0.616 -2.200 587 2HB LYS 989 2HB LYS 989 -11.890 0.708 -0.467 588 1HG LYS 989 1HG LYS 989 -12.307 3.395 -1.420 589 2HG LYS 989 2HG LYS 989 -13.544 2.386 -2.145 590 1HD LYS 989 1HD LYS 989 -13.586 1.428 0.433 591 2HD LYS 989 2HD LYS 989 -13.111 3.089 0.728 592 1HE LYS 989 1HE LYS 989 -15.505 2.327 -1.008 593 2HE LYS 989 2HE LYS 989 -15.635 2.658 0.708 594 1HZ LYS 989 1HZ LYS 989 -14.350 4.794 -0.014 595 2HZ LYS 989 2HZ LYS 989 -15.049 4.484 -1.457 596 3HZ LYS 989 3HZ LYS 989 -15.976 4.706 -0.132 597 H LEU 990 H LEU 990 -9.230 1.279 0.628 598 HA LEU 990 HA LEU 990 -9.723 3.645 1.989 599 1HB LEU 990 1HB LEU 990 -8.497 1.180 2.468 600 2HB LEU 990 2HB LEU 990 -7.240 2.365 2.762 601 HG LEU 990 HG LEU 990 -9.983 2.431 4.048 602 1HD1 LEU 990 1HD1 LEU 990 -8.051 1.906 6.003 603 2HD1 LEU 990 2HD1 LEU 990 -9.287 0.791 5.373 604 3HD1 LEU 990 3HD1 LEU 990 -7.659 0.814 4.653 605 1HD2 LEU 990 1HD2 LEU 990 -8.997 4.078 5.566 606 2HD2 LEU 990 2HD2 LEU 990 -7.468 4.009 4.657 607 3HD2 LEU 990 3HD2 LEU 990 -8.941 4.633 3.876 608 H LEU 991 H LEU 991 -6.712 2.579 0.253 609 HA LEU 991 HA LEU 991 -5.271 4.880 0.624 610 1HB LEU 991 1HB LEU 991 -4.335 2.838 -0.244 611 2HB LEU 991 2HB LEU 991 -5.314 2.946 -1.694 612 HG LEU 991 HG LEU 991 -4.101 4.969 -2.387 613 1HD1 LEU 991 1HD1 LEU 991 -3.536 5.928 -0.251 614 2HD1 LEU 991 2HD1 LEU 991 -2.493 4.541 0.145 615 3HD1 LEU 991 3HD1 LEU 991 -2.042 5.645 -1.177 616 1HD2 LEU 991 1HD2 LEU 991 -3.158 3.147 -3.406 617 2HD2 LEU 991 2HD2 LEU 991 -1.751 3.783 -2.521 618 3HD2 LEU 991 3HD2 LEU 991 -2.660 2.399 -1.869 619 H ASN 992 H ASN 992 -7.213 4.066 -2.345 620 HA ASN 992 HA ASN 992 -6.993 6.363 -3.644 621 1HB ASN 992 1HB ASN 992 -8.479 4.211 -4.089 622 2HB ASN 992 2HB ASN 992 -9.758 5.130 -3.321 623 1HD2 ASN 992 1HD2 ASN 992 -11.037 6.074 -4.698 624 2HD2 ASN 992 2HD2 ASN 992 -10.611 6.801 -6.211 625 H SER 993 H SER 993 -9.487 5.595 -1.098 626 HA SER 993 HA SER 993 -10.907 7.837 -1.057 627 1HB SER 993 1HB SER 993 -10.530 5.670 0.659 628 2HB SER 993 2HB SER 993 -10.110 7.034 1.675 629 HG SER 993 HG SER 993 -12.330 6.760 1.893 630 H ASP 994 H ASP 994 -8.130 7.393 1.260 631 HA ASP 994 HA ASP 994 -7.952 9.953 2.060 632 1HB ASP 994 1HB ASP 994 -5.856 7.797 1.651 633 2HB ASP 994 2HB ASP 994 -5.378 9.370 2.255 634 H LEU 995 H LEU 995 -6.528 8.356 -0.849 635 HA LEU 995 HA LEU 995 -4.847 10.373 -1.688 636 1HB LEU 995 1HB LEU 995 -6.062 7.971 -2.771 637 2HB LEU 995 2HB LEU 995 -5.910 9.217 -3.995 638 HG LEU 995 HG LEU 995 -3.991 7.477 -3.590 639 1HD1 LEU 995 1HD1 LEU 995 -2.812 10.176 -3.816 640 2HD1 LEU 995 2HD1 LEU 995 -2.731 8.781 -4.920 641 3HD1 LEU 995 3HD1 LEU 995 -4.165 9.836 -4.922 642 1HD2 LEU 995 1HD2 LEU 995 -2.704 7.645 -1.779 643 2HD2 LEU 995 2HD2 LEU 995 -2.612 9.418 -1.903 644 3HD2 LEU 995 3HD2 LEU 995 -3.995 8.654 -1.084 645 H ALA 996 H ALA 996 -8.260 9.759 -2.790 646 HA ALA 996 HA ALA 996 -8.658 11.862 -4.383 647 1HB ALA 996 1HB ALA 996 -10.335 10.137 -3.797 648 2HB ALA 996 2HB ALA 996 -10.552 10.895 -2.202 649 3HB ALA 996 3HB ALA 996 -11.016 11.777 -3.677 650 H GLU 997 H GLU 997 -8.958 11.962 -0.762 651 HA GLU 997 HA GLU 997 -9.542 14.642 -0.622 652 1HB GLU 997 1HB GLU 997 -9.630 12.819 1.210 653 2HB GLU 997 2HB GLU 997 -7.924 13.129 1.462 654 1HG GLU 997 1HG GLU 997 -8.387 14.977 2.689 655 2HG GLU 997 2HG GLU 997 -9.305 15.673 1.368 656 H LEU 998 H LEU 998 -6.368 12.920 -0.638 657 HA LEU 998 HA LEU 998 -4.815 15.206 -0.158 658 1HB LEU 998 1HB LEU 998 -4.259 12.688 -0.001 659 2HB LEU 998 2HB LEU 998 -3.899 12.804 -1.712 660 HG LEU 998 HG LEU 998 -2.601 14.830 0.033 661 1HD1 LEU 998 1HD1 LEU 998 -1.340 13.494 1.309 662 2HD1 LEU 998 2HD1 LEU 998 -2.586 12.262 0.993 663 3HD1 LEU 998 3HD1 LEU 998 -1.105 12.304 0.006 664 1HD2 LEU 998 1HD2 LEU 998 -2.243 13.641 -2.578 665 2HD2 LEU 998 2HD2 LEU 998 -1.524 15.116 -1.887 666 3HD2 LEU 998 3HD2 LEU 998 -0.745 13.538 -1.623 667 H ILE 999 H ILE 999 -5.999 13.612 -3.169 668 HA ILE 999 HA ILE 999 -4.584 15.190 -4.958 669 HB ILE 999 HB ILE 999 -7.283 13.861 -5.225 670 1HG1 ILE 999 1HG1 ILE 999 -5.304 12.422 -4.566 671 2HG1 ILE 999 2HG1 ILE 999 -6.160 11.951 -6.021 672 1HG2 ILE 999 1HG2 ILE 999 -6.897 15.622 -6.927 673 2HG2 ILE 999 2HG2 ILE 999 -5.405 14.784 -7.416 674 3HG2 ILE 999 3HG2 ILE 999 -6.982 13.982 -7.614 675 1HD1 ILE 999 1HD1 ILE 999 -3.447 12.245 -5.896 676 2HD1 ILE 999 2HD1 ILE 999 -4.384 12.446 -7.396 677 3HD1 ILE 999 3HD1 ILE 999 -3.914 13.874 -6.442 678 H ASN1000 H ASN1000 -7.840 15.669 -3.452 679 HA ASN1000 HA ASN1000 -8.369 18.021 -4.819 680 1HB ASN1000 1HB ASN1000 -9.814 16.413 -3.170 681 2HB ASN1000 2HB ASN1000 -9.394 17.651 -2.003 682 1HD2 ASN1000 1HD2 ASN1000 -11.492 16.718 -4.432 683 2HD2 ASN1000 2HD2 ASN1000 -12.315 18.213 -4.727 684 H LYS1001 H LYS1001 -6.945 17.290 -1.560 685 HA LYS1001 HA LYS1001 -6.735 19.779 -0.509 686 1HB LYS1001 1HB LYS1001 -4.965 17.346 -0.340 687 2HB LYS1001 2HB LYS1001 -4.543 18.817 0.514 688 1HG LYS1001 1HG LYS1001 -7.388 17.937 0.806 689 2HG LYS1001 2HG LYS1001 -6.196 16.878 1.534 690 1HD LYS1001 1HD LYS1001 -5.493 18.485 3.080 691 2HD LYS1001 2HD LYS1001 -5.893 19.831 2.032 692 1HE LYS1001 1HE LYS1001 -8.196 18.138 2.948 693 2HE LYS1001 2HE LYS1001 -7.414 19.111 4.178 694 1HZ LYS1001 1HZ LYS1001 -8.992 20.493 3.273 695 2HZ LYS1001 2HZ LYS1001 -7.642 20.971 2.487 696 3HZ LYS1001 3HZ LYS1001 -8.730 20.014 1.734 697 H MET1002 H MET1002 -4.567 18.230 -2.946 698 HA MET1002 HA MET1002 -2.751 20.333 -3.008 699 1HB MET1002 1HB MET1002 -2.259 18.085 -3.923 700 2HB MET1002 2HB MET1002 -3.564 18.226 -5.084 701 1HG MET1002 1HG MET1002 -2.083 20.500 -5.660 702 2HG MET1002 2HG MET1002 -0.822 19.384 -5.174 703 1HE MET1002 1HE MET1002 -3.888 18.753 -8.523 704 2HE MET1002 2HE MET1002 -4.139 19.571 -6.962 705 3HE MET1002 3HE MET1002 -3.167 20.353 -8.231 706 H LYS1003 H LYS1003 -5.728 19.626 -4.923 707 HA LYS1003 HA LYS1003 -5.446 21.631 -6.808 708 1HB LYS1003 1HB LYS1003 -7.549 19.851 -5.827 709 2HB LYS1003 2HB LYS1003 -8.182 21.397 -6.354 710 1HG LYS1003 1HG LYS1003 -6.724 21.099 -8.481 711 2HG LYS1003 2HG LYS1003 -6.492 19.441 -7.965 712 1HD LYS1003 1HD LYS1003 -8.366 19.356 -9.441 713 2HD LYS1003 2HD LYS1003 -9.062 19.251 -7.835 714 1HE LYS1003 1HE LYS1003 -10.030 21.353 -7.957 715 2HE LYS1003 2HE LYS1003 -8.717 22.026 -8.902 716 1HZ LYS1003 1HZ LYS1003 -9.585 21.156 -10.831 717 2HZ LYS1003 2HZ LYS1003 -10.503 20.035 -10.075 718 3HZ LYS1003 3HZ LYS1003 -10.934 21.610 -10.029 719 H LEU1004 H LEU1004 -6.267 21.759 -3.377 720 HA LEU1004 HA LEU1004 -7.346 24.419 -3.574 721 1HB LEU1004 1HB LEU1004 -6.571 22.846 -1.117 722 2HB LEU1004 2HB LEU1004 -7.594 24.268 -1.188 723 HG LEU1004 HG LEU1004 -8.233 21.523 -2.299 724 1HD1 LEU1004 1HD1 LEU1004 -8.520 22.606 0.291 725 2HD1 LEU1004 2HD1 LEU1004 -10.148 22.565 -0.425 726 3HD1 LEU1004 3HD1 LEU1004 -9.176 21.077 -0.342 727 1HD2 LEU1004 1HD2 LEU1004 -10.434 22.428 -2.889 728 2HD2 LEU1004 2HD2 LEU1004 -9.896 24.055 -2.406 729 3HD2 LEU1004 3HD2 LEU1004 -9.126 23.236 -3.786 730 H ALA1005 H ALA1005 -4.430 22.908 -2.009 731 HA ALA1005 HA ALA1005 -3.143 25.101 -1.162 732 1HB ALA1005 1HB ALA1005 -1.192 23.476 -2.475 733 2HB ALA1005 2HB ALA1005 -1.647 23.478 -0.754 734 3HB ALA1005 3HB ALA1005 -2.486 22.400 -1.895 735 H GLN1006 H GLN1006 -3.310 23.900 -4.563 736 HA GLN1006 HA GLN1006 -1.519 25.445 -5.770 737 1HB GLN1006 1HB GLN1006 -3.829 23.989 -6.539 738 2HB GLN1006 2HB GLN1006 -4.012 25.564 -7.286 739 1HG GLN1006 1HG GLN1006 -2.767 24.254 -8.862 740 2HG GLN1006 2HG GLN1006 -1.598 25.334 -8.128 741 1HE2 GLN1006 1HE2 GLN1006 0.117 23.997 -8.580 742 2HE2 GLN1006 2HE2 GLN1006 0.430 22.516 -7.738 743 H GLN1007 H GLN1007 -4.786 26.477 -4.641 744 HA GLN1007 HA GLN1007 -4.123 29.178 -5.466 745 1HB GLN1007 1HB GLN1007 -6.428 27.835 -5.837 746 2HB GLN1007 2HB GLN1007 -6.782 28.477 -4.245 747 1HG GLN1007 1HG GLN1007 -5.669 30.664 -5.658 748 2HG GLN1007 2HG GLN1007 -6.701 29.868 -6.828 749 1HE2 GLN1007 1HE2 GLN1007 -8.910 29.597 -6.411 750 2HE2 GLN1007 2HE2 GLN1007 -9.766 30.577 -5.269 751 H TYR1008 H TYR1008 -4.735 27.105 -2.629 752 HA TYR1008 HA TYR1008 -4.678 29.374 -0.830 753 1HB TYR1008 1HB TYR1008 -4.957 26.325 -0.728 754 2HB TYR1008 2HB TYR1008 -4.689 27.208 0.762 755 HD1 TYR1008 HD1 TYR1008 -6.374 29.040 1.403 756 HD2 TYR1008 HD2 TYR1008 -7.123 26.143 -1.655 757 HE1 TYR1008 HE1 TYR1008 -8.870 29.494 1.574 758 HE2 TYR1008 HE2 TYR1008 -9.616 26.606 -1.474 759 HH TYR1008 HH TYR1008 -10.875 29.218 -0.218 760 H VAL1009 H VAL1009 -2.301 29.159 -2.415 761 HA VAL1009 HA VAL1009 -0.392 28.178 -0.408 762 HB VAL1009 HB VAL1009 -0.161 26.932 -2.404 763 1HG1 VAL1009 1HG1 VAL1009 -1.431 28.337 -3.932 764 2HG1 VAL1009 2HG1 VAL1009 -0.148 29.571 -3.907 765 3HG1 VAL1009 3HG1 VAL1009 0.167 27.974 -4.628 766 1HG2 VAL1009 1HG2 VAL1009 2.100 27.283 -2.934 767 2HG2 VAL1009 2HG2 VAL1009 1.972 29.046 -2.726 768 3HG2 VAL1009 3HG2 VAL1009 1.924 27.976 -1.304 769 H MET1010 H MET1010 -1.162 30.795 -2.781 770 HA MET1010 HA MET1010 0.890 32.429 -1.615 771 1HB MET1010 1HB MET1010 -0.046 32.232 -4.148 772 2HB MET1010 2HB MET1010 -1.183 33.441 -3.587 773 1HG MET1010 1HG MET1010 1.797 33.805 -3.111 774 2HG MET1010 2HG MET1010 1.090 34.232 -4.656 775 1HE MET1010 1HE MET1010 -0.191 35.558 -0.577 776 2HE MET1010 2HE MET1010 1.046 34.366 -1.047 777 3HE MET1010 3HE MET1010 1.480 36.085 -0.890 778 H THR1011 H THR1011 -0.570 32.003 0.517 779 HA THR1011 HA THR1011 -1.857 34.532 1.004 780 HB THR1011 HB THR1011 -3.922 33.115 1.914 781 HG1 THR1011 HG1 THR1011 -2.539 31.155 1.178 782 1HG2 THR1011 1HG2 THR1011 -3.682 33.203 -1.119 783 2HG2 THR1011 2HG2 THR1011 -5.121 33.496 -0.111 784 3HG2 THR1011 3HG2 THR1011 -3.824 34.713 -0.186 785 H SER1012 H SER1012 0.498 32.732 1.816 786 HA SER1012 HA SER1012 1.642 32.518 3.658 787 1HB SER1012 1HB SER1012 -0.480 33.407 5.569 788 2HB SER1012 2HB SER1012 1.218 33.837 5.509 789 HG SER1012 HG SER1012 0.407 35.688 4.742 790 H LEU1013 H LEU1013 -1.871 31.849 4.339 791 HA LEU1013 HA LEU1013 -1.721 29.939 6.196 792 1HB LEU1013 1HB LEU1013 -3.589 28.893 4.445 793 2HB LEU1013 2HB LEU1013 -3.871 30.041 5.739 794 HG LEU1013 HG LEU1013 -2.990 31.182 3.137 795 1HD1 LEU1013 1HD1 LEU1013 -4.548 29.410 2.426 796 2HD1 LEU1013 2HD1 LEU1013 -5.793 30.089 3.503 797 3HD1 LEU1013 3HD1 LEU1013 -5.190 31.043 2.126 798 1HD2 LEU1013 1HD2 LEU1013 -4.588 32.929 3.730 799 2HD2 LEU1013 2HD2 LEU1013 -5.128 31.977 5.134 800 3HD2 LEU1013 3HD2 LEU1013 -3.464 32.607 5.072 801 H GLN1014 H GLN1014 -0.486 29.744 2.902 802 HA GLN1014 HA GLN1014 -0.432 27.258 2.189 803 1HB GLN1014 1HB GLN1014 0.923 28.690 0.916 804 2HB GLN1014 2HB GLN1014 1.815 29.267 2.310 805 1HG GLN1014 1HG GLN1014 2.089 26.344 1.835 806 2HG GLN1014 2HG GLN1014 2.713 27.334 0.531 807 1HE2 GLN1014 1HE2 GLN1014 3.845 29.431 1.490 808 2HE2 GLN1014 2HE2 GLN1014 5.084 29.109 2.657 809 H GLN1015 H GLN1015 2.204 28.383 4.438 810 HA GLN1015 HA GLN1015 3.295 26.090 5.097 811 1HB GLN1015 1HB GLN1015 3.285 27.170 7.580 812 2HB GLN1015 2HB GLN1015 4.282 27.789 6.278 813 1HG GLN1015 1HG GLN1015 2.953 29.671 5.954 814 2HG GLN1015 2HG GLN1015 1.477 28.848 6.419 815 1HE2 GLN1015 1HE2 GLN1015 3.659 31.131 7.296 816 2HE2 GLN1015 2HE2 GLN1015 3.419 31.195 9.010 817 H GLU1016 H GLU1016 0.230 27.348 6.569 818 HA GLU1016 HA GLU1016 -0.099 25.161 8.263 819 1HB GLU1016 1HB GLU1016 -1.299 27.133 8.816 820 2HB GLU1016 2HB GLU1016 -1.940 27.317 7.196 821 1HG GLU1016 1HG GLU1016 -3.557 26.419 9.015 822 2HG GLU1016 2HG GLU1016 -3.530 25.574 7.480 823 H TYR1017 H TYR1017 -1.787 26.012 5.149 824 HA TYR1017 HA TYR1017 -3.318 23.805 4.840 825 1HB TYR1017 1HB TYR1017 -1.957 25.886 3.237 826 2HB TYR1017 2HB TYR1017 -2.054 24.397 2.318 827 HD1 TYR1017 HD1 TYR1017 -4.118 23.655 1.370 828 HD2 TYR1017 HD2 TYR1017 -4.077 26.963 4.083 829 HE1 TYR1017 HE1 TYR1017 -6.524 24.200 0.754 830 HE2 TYR1017 HE2 TYR1017 -6.483 27.496 3.458 831 HH TYR1017 HH TYR1017 -8.387 25.310 1.592 832 H LYS1018 H LYS1018 0.218 24.099 4.282 833 HA LYS1018 HA LYS1018 0.553 21.687 2.932 834 1HB LYS1018 1HB LYS1018 2.204 23.749 4.132 835 2HB LYS1018 2HB LYS1018 2.880 22.163 4.440 836 1HG LYS1018 1HG LYS1018 3.743 22.297 2.336 837 2HG LYS1018 2HG LYS1018 2.122 21.932 1.779 838 1HD LYS1018 1HD LYS1018 1.602 24.374 1.673 839 2HD LYS1018 2HD LYS1018 3.213 24.748 2.250 840 1HE LYS1018 1HE LYS1018 4.131 24.460 0.183 841 2HE LYS1018 2HE LYS1018 3.315 22.927 -0.054 842 1HZ LYS1018 1HZ LYS1018 1.557 23.938 -1.025 843 2HZ LYS1018 2HZ LYS1018 1.719 25.343 -0.208 844 3HZ LYS1018 3HZ LYS1018 2.713 25.007 -1.460 845 H LYS1019 H LYS1019 0.563 22.495 6.452 846 HA LYS1019 HA LYS1019 1.332 20.040 7.415 847 1HB LYS1019 1HB LYS1019 -0.607 22.054 8.591 848 2HB LYS1019 2HB LYS1019 0.099 20.716 9.475 849 1HG LYS1019 1HG LYS1019 1.700 22.913 8.080 850 2HG LYS1019 2HG LYS1019 1.352 22.872 9.797 851 1HD LYS1019 1HD LYS1019 3.096 21.473 10.171 852 2HD LYS1019 2HD LYS1019 2.456 20.306 9.031 853 1HE LYS1019 1HE LYS1019 4.082 20.832 7.542 854 2HE LYS1019 2HE LYS1019 3.533 22.496 7.499 855 1HZ LYS1019 1HZ LYS1019 4.828 22.781 9.602 856 2HZ LYS1019 2HZ LYS1019 5.502 21.321 9.320 857 3HZ LYS1019 3HZ LYS1019 5.719 22.539 8.255 858 H GLN1020 H GLN1020 -1.886 21.170 6.277 859 HA GLN1020 HA GLN1020 -3.375 19.069 7.170 860 1HB GLN1020 1HB GLN1020 -3.672 20.606 4.550 861 2HB GLN1020 2HB GLN1020 -4.929 19.632 5.288 862 1HG GLN1020 1HG GLN1020 -3.584 21.904 6.805 863 2HG GLN1020 2HG GLN1020 -4.955 22.193 5.754 864 1HE2 GLN1020 1HE2 GLN1020 -5.078 22.771 8.410 865 2HE2 GLN1020 2HE2 GLN1020 -6.168 21.706 9.233 866 H MET1021 H MET1021 -1.810 19.418 3.899 867 HA MET1021 HA MET1021 -2.496 16.982 2.925 868 1HB MET1021 1HB MET1021 -0.898 19.131 2.147 869 2HB MET1021 2HB MET1021 0.301 17.866 2.328 870 1HG MET1021 1HG MET1021 -1.875 16.641 0.958 871 2HG MET1021 2HG MET1021 -1.695 18.220 0.218 872 1HE MET1021 1HE MET1021 0.895 14.647 0.436 873 2HE MET1021 2HE MET1021 1.740 15.828 1.465 874 3HE MET1021 3HE MET1021 0.037 15.422 1.789 875 H LEU1022 H LEU1022 0.405 17.855 4.912 876 HA LEU1022 HA LEU1022 1.684 15.423 4.826 877 1HB LEU1022 1HB LEU1022 2.700 17.415 5.700 878 2HB LEU1022 2HB LEU1022 1.531 17.506 7.003 879 HG LEU1022 HG LEU1022 3.700 16.707 7.789 880 1HD1 LEU1022 1HD1 LEU1022 1.365 15.832 8.628 881 2HD1 LEU1022 2HD1 LEU1022 1.954 14.283 7.979 882 3HD1 LEU1022 3HD1 LEU1022 2.882 15.130 9.240 883 1HD2 LEU1022 1HD2 LEU1022 3.876 14.067 6.878 884 2HD2 LEU1022 2HD2 LEU1022 3.553 15.043 5.425 885 3HD2 LEU1022 3HD2 LEU1022 4.944 15.429 6.466 886 H THR1023 H THR1023 -0.787 16.585 7.219 887 HA THR1023 HA THR1023 -0.951 14.470 8.869 888 HB THR1023 HB THR1023 -3.439 15.758 7.668 889 HG1 THR1023 HG1 THR1023 -2.535 17.673 8.315 890 1HG2 THR1023 1HG2 THR1023 -3.685 16.068 10.317 891 2HG2 THR1023 2HG2 THR1023 -4.119 14.518 9.556 892 3HG2 THR1023 3HG2 THR1023 -2.543 14.703 10.363 893 H ALA1024 H ALA1024 -2.592 14.653 5.644 894 HA ALA1024 HA ALA1024 -3.723 12.112 5.804 895 1HB ALA1024 1HB ALA1024 -2.792 13.510 3.274 896 2HB ALA1024 2HB ALA1024 -4.173 12.405 3.476 897 3HB ALA1024 3HB ALA1024 -4.224 14.034 4.192 898 H ALA1025 H ALA1025 -0.593 13.253 4.367 899 HA ALA1025 HA ALA1025 0.312 10.946 3.286 900 1HB ALA1025 1HB ALA1025 2.426 11.940 3.363 901 2HB ALA1025 2HB ALA1025 1.350 13.347 3.540 902 3HB ALA1025 3HB ALA1025 2.146 12.650 4.971 903 H HIS1026 H HIS1026 0.130 11.839 6.755 904 HA HIS1026 HA HIS1026 1.685 9.725 7.698 905 1HB HIS1026 1HB HIS1026 0.495 11.928 8.782 906 2HB HIS1026 2HB HIS1026 -0.548 10.663 9.400 907 HD1 HIS1026 HD1 HIS1026 3.128 11.682 9.386 908 HD2 HIS1026 HD2 HIS1026 0.488 9.216 11.518 909 HE1 HIS1026 HE1 HIS1026 4.419 10.844 11.421 910 H ALA1027 H ALA1027 -1.928 10.078 7.464 911 HA ALA1027 HA ALA1027 -2.447 7.440 8.253 912 1HB ALA1027 1HB ALA1027 -4.214 8.985 8.448 913 2HB ALA1027 2HB ALA1027 -3.981 9.604 6.796 914 3HB ALA1027 3HB ALA1027 -4.687 7.990 7.051 915 H LEU1028 H LEU1028 -1.727 8.981 5.102 916 HA LEU1028 HA LEU1028 -2.526 6.880 3.468 917 1HB LEU1028 1HB LEU1028 -0.625 9.173 3.231 918 2HB LEU1028 2HB LEU1028 -0.607 7.929 1.997 919 HG LEU1028 HG LEU1028 -2.872 9.780 2.746 920 1HD1 LEU1028 1HD1 LEU1028 -1.241 10.702 1.209 921 2HD1 LEU1028 2HD1 LEU1028 -1.386 9.276 0.153 922 3HD1 LEU1028 3HD1 LEU1028 -2.769 10.378 0.355 923 1HD2 LEU1028 1HD2 LEU1028 -4.153 8.530 0.918 924 2HD2 LEU1028 2HD2 LEU1028 -2.986 7.210 1.171 925 3HD2 LEU1028 3HD2 LEU1028 -4.023 7.751 2.513 926 H ALA1029 H ALA1029 0.875 7.694 4.473 927 HA ALA1029 HA ALA1029 2.168 5.540 3.587 928 1HB ALA1029 1HB ALA1029 3.486 5.776 5.858 929 2HB ALA1029 2HB ALA1029 3.469 7.125 4.697 930 3HB ALA1029 3HB ALA1029 2.399 7.161 6.119 931 H VAL1030 H VAL1030 -0.046 5.663 6.409 932 HA VAL1030 HA VAL1030 0.543 2.970 7.173 933 HB VAL1030 HB VAL1030 -1.368 5.121 8.006 934 1HG1 VAL1030 1HG1 VAL1030 -2.360 3.571 9.672 935 2HG1 VAL1030 2HG1 VAL1030 -2.765 3.133 7.995 936 3HG1 VAL1030 3HG1 VAL1030 -1.522 2.216 8.879 937 1HG2 VAL1030 1HG2 VAL1030 0.922 3.600 9.240 938 2HG2 VAL1030 2HG2 VAL1030 0.680 5.357 9.091 939 3HG2 VAL1030 3HG2 VAL1030 -0.277 4.424 10.266 940 H ASP1031 H ASP1031 -2.186 4.689 5.516 941 HA ASP1031 HA ASP1031 -3.910 2.693 5.203 942 1HB ASP1031 1HB ASP1031 -4.055 5.065 4.287 943 2HB ASP1031 2HB ASP1031 -3.048 4.560 2.945 944 H ALA1032 H ALA1032 -1.225 3.505 2.861 945 HA ALA1032 HA ALA1032 -1.562 1.280 1.233 946 1HB ALA1032 1HB ALA1032 -0.284 3.030 0.348 947 2HB ALA1032 2HB ALA1032 0.690 3.202 1.828 948 3HB ALA1032 3HB ALA1032 0.957 1.817 0.743 949 H LYS1033 H LYS1033 0.119 1.740 4.346 950 HA LYS1033 HA LYS1033 1.620 -0.641 4.225 951 1HB LYS1033 1HB LYS1033 1.955 1.416 5.716 952 2HB LYS1033 2HB LYS1033 0.690 0.762 6.736 953 1HG LYS1033 1HG LYS1033 3.232 -0.739 5.947 954 2HG LYS1033 2HG LYS1033 2.996 0.083 7.476 955 1HD LYS1033 1HD LYS1033 0.723 -1.499 7.356 956 2HD LYS1033 2HD LYS1033 1.891 -2.515 6.536 957 1HE LYS1033 1HE LYS1033 2.453 -3.170 8.663 958 2HE LYS1033 2HE LYS1033 3.411 -1.703 8.665 959 1HZ LYS1033 1HZ LYS1033 0.792 -1.049 9.326 960 2HZ LYS1033 2HZ LYS1033 1.243 -2.308 10.264 961 3HZ LYS1033 3HZ LYS1033 2.128 -0.935 10.258 962 H ASN1034 H ASN1034 -1.470 0.179 5.959 963 HA ASN1034 HA ASN1034 -2.001 -2.212 7.016 964 1HB ASN1034 1HB ASN1034 -3.398 0.091 6.812 965 2HB ASN1034 2HB ASN1034 -4.267 -0.806 5.582 966 1HD2 ASN1034 1HD2 ASN1034 -6.008 -0.391 7.173 967 2HD2 ASN1034 2HD2 ASN1034 -6.288 -1.556 8.425 968 H LEU1035 H LEU1035 -2.167 -1.197 3.603 969 HA LEU1035 HA LEU1035 -3.799 -3.219 2.607 970 1HB LEU1035 1HB LEU1035 -3.010 -1.077 1.506 971 2HB LEU1035 2HB LEU1035 -1.502 -1.901 1.166 972 HG LEU1035 HG LEU1035 -3.998 -3.275 0.299 973 1HD1 LEU1035 1HD1 LEU1035 -4.784 -1.337 -0.585 974 2HD1 LEU1035 2HD1 LEU1035 -3.173 -0.585 -0.674 975 3HD1 LEU1035 3HD1 LEU1035 -3.663 -1.787 -1.892 976 1HD2 LEU1035 1HD2 LEU1035 -2.057 -4.446 -0.239 977 2HD2 LEU1035 2HD2 LEU1035 -2.472 -3.606 -1.753 978 3HD2 LEU1035 3HD2 LEU1035 -1.176 -2.972 -0.708 979 H LEU1036 H LEU1036 -0.172 -3.036 2.387 980 HA LEU1036 HA LEU1036 0.029 -5.777 1.759 981 1HB LEU1036 1HB LEU1036 1.681 -3.503 1.784 982 2HB LEU1036 2HB LEU1036 2.441 -4.648 2.872 983 HG LEU1036 HG LEU1036 1.926 -6.299 0.796 984 1HD1 LEU1036 1HD1 LEU1036 1.048 -4.989 -0.848 985 2HD1 LEU1036 2HD1 LEU1036 1.908 -3.528 -0.306 986 3HD1 LEU1036 3HD1 LEU1036 2.779 -4.787 -1.214 987 1HD2 LEU1036 1HD2 LEU1036 4.362 -4.512 0.808 988 2HD2 LEU1036 2HD2 LEU1036 4.089 -5.789 2.018 989 3HD2 LEU1036 3HD2 LEU1036 4.232 -6.211 0.294 990 H ASP1037 H ASP1037 0.079 -3.883 4.787 991 HA ASP1037 HA ASP1037 1.225 -5.599 6.487 992 1HB ASP1037 1HB ASP1037 0.062 -3.318 6.913 993 2HB ASP1037 2HB ASP1037 -1.425 -4.226 7.104 994 H VAL1038 H VAL1038 -2.314 -5.489 5.593 995 HA VAL1038 HA VAL1038 -3.057 -7.762 7.008 996 HB VAL1038 HB VAL1038 -4.542 -6.001 6.100 997 1HG1 VAL1038 1HG1 VAL1038 -3.460 -7.004 3.552 998 2HG1 VAL1038 2HG1 VAL1038 -5.231 -6.823 3.569 999 3HG1 VAL1038 3HG1 VAL1038 -4.191 -5.431 3.952 1000 1HG2 VAL1038 1HG2 VAL1038 -6.360 -7.583 5.338 1001 2HG2 VAL1038 2HG2 VAL1038 -5.148 -8.886 5.393 1002 3HG2 VAL1038 3HG2 VAL1038 -5.579 -8.007 6.880 1003 H ILE1039 H ILE1039 -1.495 -7.321 3.841 1004 HA ILE1039 HA ILE1039 -2.013 -9.927 2.895 1005 HB ILE1039 HB ILE1039 -0.303 -7.625 2.150 1006 1HG1 ILE1039 1HG1 ILE1039 -2.032 -9.447 0.459 1007 2HG1 ILE1039 2HG1 ILE1039 -2.664 -8.071 1.341 1008 1HG2 ILE1039 1HG2 ILE1039 0.523 -9.371 0.263 1009 2HG2 ILE1039 2HG2 ILE1039 1.464 -8.958 1.717 1010 3HG2 ILE1039 3HG2 ILE1039 0.481 -10.442 1.684 1011 1HD1 ILE1039 1HD1 ILE1039 -0.515 -6.907 0.074 1012 2HD1 ILE1039 2HD1 ILE1039 -0.995 -8.138 -1.119 1013 3HD1 ILE1039 3HD1 ILE1039 -2.173 -6.919 -0.575 1014 H ASP1040 H ASP1040 0.716 -8.411 4.714 1015 HA ASP1040 HA ASP1040 2.479 -10.427 4.668 1016 1HB ASP1040 1HB ASP1040 2.453 -8.107 5.928 1017 2HB ASP1040 2HB ASP1040 1.826 -9.027 7.282 1018 H GLN1041 H GLN1041 -0.506 -10.068 6.657 1019 HA GLN1041 HA GLN1041 0.023 -12.337 8.243 1020 1HB GLN1041 1HB GLN1041 -2.170 -10.360 7.902 1021 2HB GLN1041 2HB GLN1041 -2.705 -11.943 8.430 1022 1HG GLN1041 1HG GLN1041 -1.425 -11.865 10.423 1023 2HG GLN1041 2HG GLN1041 -0.317 -10.665 9.786 1024 1HE2 GLN1041 1HE2 GLN1041 -3.865 -10.940 10.024 1025 2HE2 GLN1041 2HE2 GLN1041 -4.149 -9.424 10.813 1026 H ALA1042 H ALA1042 -1.397 -11.757 5.069 1027 HA ALA1042 HA ALA1042 -2.769 -14.285 4.997 1028 1HB ALA1042 1HB ALA1042 -3.126 -13.581 2.587 1029 2HB ALA1042 2HB ALA1042 -3.736 -12.432 3.802 1030 3HB ALA1042 3HB ALA1042 -2.206 -12.103 2.955 1031 H ARG1043 H ARG1043 0.232 -12.797 3.634 1032 HA ARG1043 HA ARG1043 0.992 -14.818 2.020 1033 1HB ARG1043 1HB ARG1043 2.208 -12.676 2.180 1034 2HB ARG1043 2HB ARG1043 2.720 -13.043 3.815 1035 1HG ARG1043 1HG ARG1043 4.262 -14.686 3.118 1036 2HG ARG1043 2HG ARG1043 3.417 -14.994 1.614 1037 1HD ARG1043 1HD ARG1043 5.002 -13.664 0.646 1038 2HD ARG1043 2HD ARG1043 4.104 -12.319 1.321 1039 HE ARG1043 HE ARG1043 6.641 -13.424 2.338 1040 1HH1 ARG1043 2HH2 ARG1043 3.879 -11.343 2.987 1041 2HH1 ARG1043 1HH2 ARG1043 4.688 -10.439 4.223 1042 1HH2 ARG1043 2HH1 ARG1043 7.709 -12.232 3.970 1043 2HH2 ARG1043 1HH1 ARG1043 6.881 -10.949 4.786 1044 H LEU1044 H LEU1044 1.605 -14.430 5.573 1045 HA LEU1044 HA LEU1044 3.155 -16.742 5.853 1046 1HB LEU1044 1HB LEU1044 2.628 -16.495 8.254 1047 2HB LEU1044 2HB LEU1044 3.257 -15.046 7.495 1048 HG LEU1044 HG LEU1044 0.720 -14.399 7.255 1049 1HD1 LEU1044 1HD1 LEU1044 0.626 -16.791 8.953 1050 2HD1 LEU1044 2HD1 LEU1044 -0.209 -15.378 9.643 1051 3HD1 LEU1044 3HD1 LEU1044 -0.661 -15.978 8.030 1052 1HD2 LEU1044 1HD2 LEU1044 0.882 -13.596 9.770 1053 2HD2 LEU1044 2HD2 LEU1044 2.557 -14.174 9.600 1054 3HD2 LEU1044 3HD2 LEU1044 1.933 -12.919 8.503 1055 H LYS1045 H LYS1045 -0.391 -16.127 6.104 1056 HA LYS1045 HA LYS1045 -1.316 -18.410 7.126 1057 1HB LYS1045 1HB LYS1045 -2.316 -16.336 5.456 1058 2HB LYS1045 2HB LYS1045 -2.866 -17.851 4.771 1059 1HG LYS1045 1HG LYS1045 -4.523 -17.705 6.344 1060 2HG LYS1045 2HG LYS1045 -3.310 -18.348 7.434 1061 1HD LYS1045 1HD LYS1045 -2.690 -16.099 8.182 1062 2HD LYS1045 2HD LYS1045 -3.701 -15.358 6.957 1063 1HE LYS1045 1HE LYS1045 -5.440 -15.383 8.412 1064 2HE LYS1045 2HE LYS1045 -5.414 -17.135 8.386 1065 1HZ LYS1045 1HZ LYS1045 -3.488 -15.741 10.058 1066 2HZ LYS1045 2HZ LYS1045 -5.033 -15.857 10.573 1067 3HZ LYS1045 3HZ LYS1045 -4.169 -17.210 10.271 1068 H MET1046 H MET1046 0.319 -18.015 3.994 1069 HA MET1046 HA MET1046 -0.394 -20.641 3.150 1070 1HB MET1046 1HB MET1046 -0.032 -18.986 1.421 1071 2HB MET1046 2HB MET1046 1.467 -18.439 2.145 1072 1HG MET1046 1HG MET1046 1.625 -21.298 1.534 1073 2HG MET1046 2HG MET1046 1.164 -20.396 0.103 1074 1HE MET1046 1HE MET1046 3.592 -17.867 -0.546 1075 2HE MET1046 2HE MET1046 1.972 -17.918 0.190 1076 3HE MET1046 3HE MET1046 3.370 -17.383 1.153 1077 H ILE1047 H ILE1047 2.698 -18.986 4.124 1078 HA ILE1047 HA ILE1047 4.403 -21.077 3.972 1079 HB ILE1047 HB ILE1047 4.195 -18.744 5.839 1080 1HG1 ILE1047 1HG1 ILE1047 6.607 -18.906 4.296 1081 2HG1 ILE1047 2HG1 ILE1047 5.249 -19.215 3.232 1082 1HG2 ILE1047 1HG2 ILE1047 6.380 -20.845 5.888 1083 2HG2 ILE1047 2HG2 ILE1047 6.430 -19.272 6.721 1084 3HG2 ILE1047 3HG2 ILE1047 5.217 -20.488 7.188 1085 1HD1 ILE1047 1HD1 ILE1047 5.419 -16.850 5.157 1086 2HD1 ILE1047 2HD1 ILE1047 5.797 -16.775 3.419 1087 3HD1 ILE1047 3HD1 ILE1047 4.139 -17.142 3.954 1088 H SER1048 H SER1048 2.279 -20.261 6.801 1089 HA SER1048 HA SER1048 3.032 -22.710 8.055 1090 1HB SER1048 1HB SER1048 1.306 -20.345 8.747 1091 2HB SER1048 2HB SER1048 0.998 -21.845 9.600 1092 HG SER1048 HG SER1048 2.744 -21.507 10.782 1093 H GLN1049 H GLN1049 2.241 -23.922 5.992 1094 HA GLN1049 HA GLN1049 -0.241 -25.080 6.640 1095 1HB GLN1049 1HB GLN1049 -0.309 -22.861 4.808 1096 2HB GLN1049 2HB GLN1049 -0.642 -24.316 3.890 1097 1HG GLN1049 1HG GLN1049 -2.467 -24.937 5.401 1098 2HG GLN1049 2HG GLN1049 -2.056 -23.644 6.510 1099 1HE2 GLN1049 1HE2 GLN1049 -3.121 -21.826 6.349 1100 2HE2 GLN1049 2HE2 GLN1049 -4.010 -21.248 4.979 1101 H SER1050 H SER1050 -0.849 -26.717 4.689 1102 HA SER1050 HA SER1050 1.548 -28.190 4.306 1103 1HB SER1050 1HB SER1050 -1.382 -28.633 3.938 1104 2HB SER1050 2HB SER1050 -0.344 -29.566 2.878 1105 HG SER1050 HG SER1050 0.077 -29.447 5.735 1106 H ARG1051 H ARG1051 2.735 -26.657 2.912 1107 HA ARG1051 HA ARG1051 1.689 -25.750 0.522 1108 1HB ARG1051 1HB ARG1051 4.002 -25.314 1.953 1109 2HB ARG1051 2HB ARG1051 4.637 -26.277 0.633 1110 1HG ARG1051 1HG ARG1051 3.776 -24.718 -1.030 1111 2HG ARG1051 2HG ARG1051 2.847 -23.850 0.175 1112 1HD ARG1051 1HD ARG1051 4.707 -22.452 0.038 1113 2HD ARG1051 2HD ARG1051 5.236 -23.511 1.330 1114 HE ARG1051 HE ARG1051 6.272 -23.451 -1.424 1115 1HH1 ARG1051 2HH2 ARG1051 6.066 -25.278 1.576 1116 2HH1 ARG1051 1HH2 ARG1051 7.467 -26.237 1.238 1117 1HH2 ARG1051 2HH1 ARG1051 8.121 -24.717 -1.872 1118 2HH2 ARG1051 1HH1 ARG1051 8.644 -25.916 -0.737 1119 HA PRO1052 HA PRO1052 1.978 -29.627 -1.592 1120 1HB PRO1052 1HB PRO1052 0.482 -28.931 -3.771 1121 2HB PRO1052 2HB PRO1052 -0.215 -29.552 -2.288 1122 1HG PRO1052 1HG PRO1052 -0.194 -26.776 -3.305 1123 2HG PRO1052 2HG PRO1052 -1.223 -27.488 -2.078 1124 1HD PRO1052 1HD PRO1052 1.029 -25.765 -1.642 1125 2HD PRO1052 2HD PRO1052 0.072 -26.570 -0.414 1126 H HIS1053 H HIS1053 2.333 -30.218 -4.121 1127 HA HIS1053 HA HIS1053 4.958 -29.463 -4.545 1128 1HB HIS1053 1HB HIS1053 3.183 -31.295 -5.603 1129 2HB HIS1053 2HB HIS1053 3.464 -30.222 -6.960 1130 HD1 HIS1053 HD1 HIS1053 6.020 -31.330 -4.330 1131 HD2 HIS1053 HD2 HIS1053 5.263 -31.671 -8.442 1132 HE1 HIS1053 HE1 HIS1053 8.050 -32.503 -5.336 Start of MODEL 18 1 H MET 915 H MET 915 17.067 -12.361 -8.868 2 HA MET 915 HA MET 915 16.833 -15.155 -8.876 3 1HB MET 915 1HB MET 915 14.560 -14.666 -7.955 4 2HB MET 915 2HB MET 915 15.762 -13.649 -7.186 5 1HG MET 915 1HG MET 915 14.589 -12.470 -9.655 6 2HG MET 915 2HG MET 915 13.426 -12.726 -8.370 7 1HE MET 915 1HE MET 915 16.425 -9.662 -9.030 8 2HE MET 915 2HE MET 915 15.361 -10.666 -10.043 9 3HE MET 915 3HE MET 915 14.688 -9.290 -9.136 10 H ALA 916 H ALA 916 14.140 -15.666 -9.574 11 HA ALA 916 HA ALA 916 14.412 -15.925 -12.391 12 1HB ALA 916 1HB ALA 916 11.747 -16.438 -11.303 13 2HB ALA 916 2HB ALA 916 12.903 -17.564 -12.053 14 3HB ALA 916 3HB ALA 916 13.022 -17.192 -10.316 15 H ASN 917 H ASN 917 13.109 -14.975 -14.049 16 HA ASN 917 HA ASN 917 12.780 -12.334 -13.941 17 1HB ASN 917 1HB ASN 917 11.035 -12.669 -15.810 18 2HB ASN 917 2HB ASN 917 12.574 -13.468 -16.065 19 1HD2 ASN 917 1HD2 ASN 917 9.510 -13.893 -16.613 20 2HD2 ASN 917 2HD2 ASN 917 9.282 -15.590 -16.353 21 H LEU 918 H LEU 918 10.369 -14.909 -13.117 22 HA LEU 918 HA LEU 918 8.696 -12.815 -11.911 23 1HB LEU 918 1HB LEU 918 8.067 -14.987 -13.764 24 2HB LEU 918 2HB LEU 918 7.052 -14.992 -12.335 25 HG LEU 918 HG LEU 918 6.553 -12.549 -12.801 26 1HD1 LEU 918 1HD1 LEU 918 8.623 -12.752 -14.612 27 2HD1 LEU 918 2HD1 LEU 918 7.177 -12.797 -15.649 28 3HD1 LEU 918 3HD1 LEU 918 7.426 -11.437 -14.528 29 1HD2 LEU 918 1HD2 LEU 918 5.616 -14.916 -14.298 30 2HD2 LEU 918 2HD2 LEU 918 4.710 -13.716 -13.346 31 3HD2 LEU 918 3HD2 LEU 918 5.199 -13.340 -15.015 32 H ASP 919 H ASP 919 10.679 -13.496 -10.310 33 HA ASP 919 HA ASP 919 9.663 -15.711 -8.718 34 1HB ASP 919 1HB ASP 919 12.244 -15.160 -9.613 35 2HB ASP 919 2HB ASP 919 12.282 -14.514 -7.985 36 H ARG 920 H ARG 920 11.308 -12.463 -8.444 37 HA ARG 920 HA ARG 920 10.231 -12.166 -5.808 38 1HB ARG 920 1HB ARG 920 12.581 -11.340 -6.938 39 2HB ARG 920 2HB ARG 920 11.634 -9.885 -7.173 40 1HG ARG 920 1HG ARG 920 12.109 -9.337 -5.022 41 2HG ARG 920 2HG ARG 920 11.036 -10.631 -4.528 42 1HD ARG 920 1HD ARG 920 14.045 -10.869 -5.011 43 2HD ARG 920 2HD ARG 920 13.238 -10.920 -3.456 44 HE ARG 920 HE ARG 920 12.070 -12.940 -5.090 45 1HH1 ARG 920 2HH2 ARG 920 15.182 -12.232 -3.551 46 2HH1 ARG 920 1HH2 ARG 920 15.626 -13.899 -3.398 47 1HH2 ARG 920 1HH1 ARG 920 14.125 -15.591 -4.191 48 H SER 921 H SER 921 7.942 -12.260 -6.859 49 HA SER 921 HA SER 921 7.226 -9.846 -8.235 50 1HB SER 921 1HB SER 921 6.177 -12.528 -8.005 51 2HB SER 921 2HB SER 921 4.918 -11.406 -7.529 52 HG SER 921 HG SER 921 4.717 -11.574 -9.745 53 H ASN 922 H ASN 922 6.890 -11.410 -5.035 54 HA ASN 922 HA ASN 922 4.899 -9.806 -4.024 55 1HB ASN 922 1HB ASN 922 6.902 -11.694 -3.011 56 2HB ASN 922 2HB ASN 922 6.714 -10.362 -1.888 57 1HD2 ASN 922 1HD2 ASN 922 4.315 -9.657 -1.646 58 2HD2 ASN 922 2HD2 ASN 922 3.185 -10.927 -1.319 59 H ASP 923 H ASP 923 8.301 -9.225 -4.733 60 HA ASP 923 HA ASP 923 8.651 -7.116 -2.898 61 1HB ASP 923 1HB ASP 923 10.811 -7.159 -3.650 62 2HB ASP 923 2HB ASP 923 10.323 -8.642 -4.445 63 H LYS 924 H LYS 924 7.492 -7.524 -6.251 64 HA LYS 924 HA LYS 924 7.748 -4.882 -7.112 65 1HB LYS 924 1HB LYS 924 7.404 -6.654 -8.687 66 2HB LYS 924 2HB LYS 924 5.899 -7.135 -7.929 67 1HG LYS 924 1HG LYS 924 4.726 -5.244 -8.733 68 2HG LYS 924 2HG LYS 924 6.185 -4.297 -8.943 69 1HD LYS 924 1HD LYS 924 5.640 -6.799 -10.595 70 2HD LYS 924 2HD LYS 924 5.057 -5.221 -11.087 71 1HE LYS 924 1HE LYS 924 7.153 -4.479 -11.684 72 2HE LYS 924 2HE LYS 924 7.933 -5.260 -10.323 73 1HZ LYS 924 1HZ LYS 924 8.486 -6.917 -11.636 74 2HZ LYS 924 2HZ LYS 924 6.935 -7.205 -12.059 75 3HZ LYS 924 3HZ LYS 924 7.833 -6.147 -12.920 76 H VAL 925 H VAL 925 4.850 -6.623 -5.770 77 HA VAL 925 HA VAL 925 3.244 -4.358 -5.647 78 HB VAL 925 HB VAL 925 3.239 -6.888 -3.991 79 1HG1 VAL 925 1HG1 VAL 925 1.820 -5.548 -2.762 80 2HG1 VAL 925 2HG1 VAL 925 1.320 -4.588 -4.175 81 3HG1 VAL 925 3HG1 VAL 925 0.683 -6.235 -3.947 82 1HG2 VAL 925 1HG2 VAL 925 1.425 -6.308 -6.326 83 2HG2 VAL 925 2HG2 VAL 925 3.061 -6.959 -6.589 84 3HG2 VAL 925 3HG2 VAL 925 1.887 -7.872 -5.612 85 H TYR 926 H TYR 926 5.605 -5.761 -3.322 86 HA TYR 926 HA TYR 926 4.958 -3.997 -1.217 87 1HB TYR 926 1HB TYR 926 7.281 -5.780 -2.110 88 2HB TYR 926 2HB TYR 926 7.482 -4.780 -0.685 89 HD1 TYR 926 HD1 TYR 926 7.630 -6.417 1.014 90 HD2 TYR 926 HD2 TYR 926 4.362 -6.528 -1.745 91 HE1 TYR 926 HE1 TYR 926 6.493 -8.202 2.422 92 HE2 TYR 926 HE2 TYR 926 3.236 -8.313 -0.328 93 HH TYR 926 HH TYR 926 4.092 -8.945 2.788 94 H GLU 927 H GLU 927 6.727 -3.609 -4.205 95 HA GLU 927 HA GLU 927 8.425 -1.562 -3.230 96 1HB GLU 927 1HB GLU 927 8.234 -3.143 -5.566 97 2HB GLU 927 2HB GLU 927 7.966 -1.503 -6.121 98 1HG GLU 927 1HG GLU 927 10.368 -1.974 -6.175 99 2HG GLU 927 2HG GLU 927 10.055 -0.769 -4.941 100 H ASN 928 H ASN 928 5.774 -1.469 -5.728 101 HA ASN 928 HA ASN 928 5.490 1.160 -5.940 102 1HB ASN 928 1HB ASN 928 3.117 -0.757 -5.667 103 2HB ASN 928 2HB ASN 928 3.130 0.749 -6.562 104 1HD2 ASN 928 1HD2 ASN 928 3.533 0.676 -8.637 105 2HD2 ASN 928 2HD2 ASN 928 4.299 -0.609 -9.510 106 H VAL 929 H VAL 929 4.282 -0.985 -3.310 107 HA VAL 929 HA VAL 929 2.607 0.821 -2.030 108 HB VAL 929 HB VAL 929 4.280 -1.468 -0.981 109 1HG1 VAL 929 1HG1 VAL 929 1.988 -1.129 0.626 110 2HG1 VAL 929 2HG1 VAL 929 3.687 -0.855 1.081 111 3HG1 VAL 929 3HG1 VAL 929 2.706 0.490 0.452 112 1HG2 VAL 929 1HG2 VAL 929 2.572 -2.883 -1.526 113 2HG2 VAL 929 2HG2 VAL 929 1.320 -1.633 -1.329 114 3HG2 VAL 929 3HG2 VAL 929 2.325 -1.662 -2.798 115 H THR 930 H THR 930 6.109 0.061 -1.422 116 HA THR 930 HA THR 930 6.342 2.207 0.454 117 HB THR 930 HB THR 930 8.846 1.509 0.135 118 HG1 THR 930 HG1 THR 930 8.784 -0.680 -1.004 119 1HG2 THR 930 1HG2 THR 930 8.594 -0.408 1.506 120 2HG2 THR 930 2HG2 THR 930 7.077 0.467 1.826 121 3HG2 THR 930 3HG2 THR 930 7.091 -0.906 0.692 122 H GLY 931 H GLY 931 7.760 1.659 -2.846 123 1HA GLY 931 1HA GLY 931 9.040 3.933 -3.330 124 2HA GLY 931 2HA GLY 931 8.001 3.182 -4.524 125 H LEU 932 H LEU 932 5.425 3.597 -3.536 126 HA LEU 932 HA LEU 932 5.081 6.349 -4.147 127 1HB LEU 932 1HB LEU 932 2.960 5.789 -4.542 128 2HB LEU 932 2HB LEU 932 3.598 4.157 -4.517 129 HG LEU 932 HG LEU 932 2.944 4.009 -2.091 130 1HD1 LEU 932 1HD1 LEU 932 2.405 5.864 -1.001 131 2HD1 LEU 932 2HD1 LEU 932 2.376 6.805 -2.511 132 3HD1 LEU 932 3HD1 LEU 932 0.913 5.949 -1.968 133 1HD2 LEU 932 1HD2 LEU 932 0.806 4.462 -4.184 134 2HD2 LEU 932 2HD2 LEU 932 1.575 2.926 -3.718 135 3HD2 LEU 932 3HD2 LEU 932 0.496 3.763 -2.577 136 H VAL 933 H VAL 933 4.623 4.322 -1.177 137 HA VAL 933 HA VAL 933 3.708 6.306 0.485 138 HB VAL 933 HB VAL 933 5.039 3.693 0.731 139 1HG1 VAL 933 1HG1 VAL 933 5.325 3.975 3.225 140 2HG1 VAL 933 2HG1 VAL 933 6.525 4.826 2.223 141 3HG1 VAL 933 3HG1 VAL 933 5.187 5.731 2.971 142 1HG2 VAL 933 1HG2 VAL 933 2.540 5.049 1.557 143 2HG2 VAL 933 2HG2 VAL 933 2.818 3.377 1.012 144 3HG2 VAL 933 3HG2 VAL 933 3.162 3.833 2.698 145 H LYS 934 H LYS 934 7.023 5.592 -0.655 146 HA LYS 934 HA LYS 934 8.364 7.217 1.181 147 1HB LYS 934 1HB LYS 934 9.127 6.431 -1.648 148 2HB LYS 934 2HB LYS 934 10.213 7.117 -0.457 149 1HG LYS 934 1HG LYS 934 8.930 4.946 0.862 150 2HG LYS 934 2HG LYS 934 9.305 4.353 -0.743 151 1HD LYS 934 1HD LYS 934 11.494 4.148 -0.194 152 2HD LYS 934 2HD LYS 934 11.586 5.855 0.189 153 1HE LYS 934 1HE LYS 934 10.739 5.405 2.488 154 2HE LYS 934 2HE LYS 934 10.580 3.701 2.111 155 1HZ LYS 934 1HZ LYS 934 12.776 4.870 3.108 156 2HZ LYS 934 2HZ LYS 934 12.744 3.406 2.384 157 3HZ LYS 934 3HZ LYS 934 13.166 4.732 1.528 158 H ALA 935 H ALA 935 6.997 7.885 -2.102 159 HA ALA 935 HA ALA 935 7.853 10.561 -2.163 160 1HB ALA 935 1HB ALA 935 7.105 10.310 -4.265 161 2HB ALA 935 2HB ALA 935 6.481 8.702 -3.826 162 3HB ALA 935 3HB ALA 935 5.434 10.134 -3.676 163 H VAL 936 H VAL 936 4.802 8.946 -1.093 164 HA VAL 936 HA VAL 936 3.166 11.019 -0.678 165 HB VAL 936 HB VAL 936 3.747 8.567 0.959 166 1HG1 VAL 936 1HG1 VAL 936 1.660 10.692 1.525 167 2HG1 VAL 936 2HG1 VAL 936 1.564 9.028 2.148 168 3HG1 VAL 936 3HG1 VAL 936 2.923 10.077 2.617 169 1HG2 VAL 936 1HG2 VAL 936 1.855 7.651 -0.077 170 2HG2 VAL 936 2HG2 VAL 936 1.219 9.246 -0.546 171 3HG2 VAL 936 3HG2 VAL 936 2.642 8.575 -1.379 172 H ILE 937 H ILE 937 5.940 10.065 1.432 173 HA ILE 937 HA ILE 937 5.451 12.341 3.138 174 HB ILE 937 HB ILE 937 7.366 10.034 3.130 175 1HG1 ILE 937 1HG1 ILE 937 6.122 10.442 5.632 176 2HG1 ILE 937 2HG1 ILE 937 4.873 10.708 4.432 177 1HG2 ILE 937 1HG2 ILE 937 7.654 12.645 4.571 178 2HG2 ILE 937 2HG2 ILE 937 8.136 11.136 5.382 179 3HG2 ILE 937 3HG2 ILE 937 8.894 11.598 3.839 180 1HD1 ILE 937 1HD1 ILE 937 5.534 8.239 5.332 181 2HD1 ILE 937 2HD1 ILE 937 4.917 8.522 3.686 182 3HD1 ILE 937 3HD1 ILE 937 6.667 8.353 3.964 183 H GLU 938 H GLU 938 8.276 11.154 1.174 184 HA GLU 938 HA GLU 938 9.912 13.168 1.277 185 1HB GLU 938 1HB GLU 938 9.376 11.124 -0.605 186 2HB GLU 938 2HB GLU 938 9.497 12.588 -1.560 187 1HG GLU 938 1HG GLU 938 11.753 12.344 -1.433 188 2HG GLU 938 2HG GLU 938 11.623 12.857 0.238 189 H MET 939 H MET 939 6.849 13.218 -0.632 190 HA MET 939 HA MET 939 7.165 15.545 -1.961 191 1HB MET 939 1HB MET 939 5.192 14.138 -2.271 192 2HB MET 939 2HB MET 939 4.730 14.299 -0.589 193 1HG MET 939 1HG MET 939 3.499 16.143 -1.077 194 2HG MET 939 2HG MET 939 4.925 16.959 -1.687 195 1HE MET 939 1HE MET 939 3.472 13.559 -3.089 196 2HE MET 939 2HE MET 939 2.068 14.465 -2.477 197 3HE MET 939 3HE MET 939 2.252 14.182 -4.225 198 H SER 940 H SER 940 5.252 15.355 1.131 199 HA SER 940 HA SER 940 4.972 17.932 1.630 200 1HB SER 940 1HB SER 940 4.029 16.331 3.141 201 2HB SER 940 2HB SER 940 5.596 15.654 3.540 202 HG SER 940 HG SER 940 4.329 17.990 4.520 203 H SER 941 H SER 941 7.989 16.059 1.869 204 HA SER 941 HA SER 941 9.406 17.898 3.402 205 1HB SER 941 1HB SER 941 9.876 15.381 2.243 206 2HB SER 941 2HB SER 941 11.038 16.424 1.447 207 HG SER 941 HG SER 941 12.125 15.848 3.268 208 H LYS 942 H LYS 942 9.113 17.378 -0.176 209 HA LYS 942 HA LYS 942 10.470 19.947 -0.560 210 1HB LYS 942 1HB LYS 942 10.847 19.174 -2.867 211 2HB LYS 942 2HB LYS 942 11.560 18.102 -1.678 212 1HG LYS 942 1HG LYS 942 10.162 16.358 -2.211 213 2HG LYS 942 2HG LYS 942 8.762 17.398 -2.387 214 1HD LYS 942 1HD LYS 942 10.888 17.712 -4.476 215 2HD LYS 942 2HD LYS 942 10.022 16.188 -4.494 216 1HE LYS 942 1HE LYS 942 8.050 17.159 -5.182 217 2HE LYS 942 2HE LYS 942 8.266 18.569 -4.164 218 1HZ LYS 942 1HZ LYS 942 10.236 18.728 -6.038 219 2HZ LYS 942 2HZ LYS 942 8.923 18.240 -6.877 220 3HZ LYS 942 3HZ LYS 942 8.864 19.612 -5.993 221 H ILE 943 H ILE 943 7.614 19.447 0.354 222 HA ILE 943 HA ILE 943 6.145 20.391 -1.975 223 HB ILE 943 HB ILE 943 5.507 18.569 -0.104 224 1HG1 ILE 943 1HG1 ILE 943 4.383 19.159 -2.294 225 2HG1 ILE 943 2HG1 ILE 943 3.333 18.583 -1.015 226 1HG2 ILE 943 1HG2 ILE 943 4.361 21.190 0.889 227 2HG2 ILE 943 2HG2 ILE 943 3.763 19.583 1.366 228 3HG2 ILE 943 3HG2 ILE 943 5.429 20.066 1.765 229 1HD1 ILE 943 1HD1 ILE 943 2.238 20.586 -0.829 230 2HD1 ILE 943 2HD1 ILE 943 3.734 21.531 -1.024 231 3HD1 ILE 943 3HD1 ILE 943 2.897 20.885 -2.456 232 H GLN 944 H GLN 944 6.863 21.337 1.452 233 HA GLN 944 HA GLN 944 5.574 23.650 1.607 234 1HB GLN 944 1HB GLN 944 7.713 22.413 2.969 235 2HB GLN 944 2HB GLN 944 8.317 24.011 2.578 236 1HG GLN 944 1HG GLN 944 5.610 24.356 3.456 237 2HG GLN 944 2HG GLN 944 6.362 23.249 4.588 238 1HE2 GLN 944 1HE2 GLN 944 5.807 26.409 3.883 239 2HE2 GLN 944 2HE2 GLN 944 7.071 27.184 4.778 240 HA PRO 945 HA PRO 945 8.982 25.894 -0.808 241 1HB PRO 945 1HB PRO 945 10.969 24.472 -2.032 242 2HB PRO 945 2HB PRO 945 11.147 25.198 -0.448 243 1HG PRO 945 1HG PRO 945 10.751 22.354 -1.149 244 2HG PRO 945 2HG PRO 945 11.347 23.043 0.348 245 1HD PRO 945 1HD PRO 945 8.724 21.984 -0.130 246 2HD PRO 945 2HD PRO 945 9.284 22.777 1.329 247 H ALA 946 H ALA 946 8.622 22.745 -2.372 248 HA ALA 946 HA ALA 946 8.543 23.350 -4.932 249 1HB ALA 946 1HB ALA 946 6.849 21.578 -3.207 250 2HB ALA 946 2HB ALA 946 6.369 21.783 -4.909 251 3HB ALA 946 3HB ALA 946 7.986 21.154 -4.510 252 HA PRO 947 HA PRO 947 5.629 26.557 -5.362 253 1HB PRO 947 1HB PRO 947 5.854 26.915 -8.062 254 2HB PRO 947 2HB PRO 947 6.946 27.647 -6.904 255 1HG PRO 947 1HG PRO 947 7.417 25.343 -8.695 256 2HG PRO 947 2HG PRO 947 8.590 26.343 -7.861 257 1HD PRO 947 1HD PRO 947 7.757 23.698 -7.126 258 2HD PRO 947 2HD PRO 947 8.842 24.742 -6.229 259 HA PRO 948 HA PRO 948 1.938 24.982 -6.762 260 1HB PRO 948 1HB PRO 948 0.661 27.014 -8.070 261 2HB PRO 948 2HB PRO 948 0.730 26.892 -6.323 262 1HG PRO 948 1HG PRO 948 2.227 28.705 -8.116 263 2HG PRO 948 2HG PRO 948 1.957 28.844 -6.390 264 1HD PRO 948 1HD PRO 948 4.369 27.990 -7.687 265 2HD PRO 948 2HD PRO 948 4.060 28.019 -5.962 266 H GLU 949 H GLU 949 4.059 26.182 -9.142 267 HA GLU 949 HA GLU 949 2.529 25.024 -11.262 268 1HB GLU 949 1HB GLU 949 4.466 27.038 -11.081 269 2HB GLU 949 2HB GLU 949 5.324 25.733 -11.875 270 1HG GLU 949 1HG GLU 949 3.218 25.542 -13.417 271 2HG GLU 949 2HG GLU 949 2.768 27.111 -12.779 272 H GLU 950 H GLU 950 4.858 23.988 -8.922 273 HA GLU 950 HA GLU 950 5.529 21.706 -10.608 274 1HB GLU 950 1HB GLU 950 7.185 23.407 -9.087 275 2HB GLU 950 2HB GLU 950 7.084 21.942 -8.131 276 1HG GLU 950 1HG GLU 950 8.576 20.960 -9.524 277 2HG GLU 950 2HG GLU 950 7.404 21.068 -10.823 278 H TYR 951 H TYR 951 3.373 22.681 -8.263 279 HA TYR 951 HA TYR 951 3.505 20.240 -6.688 280 1HB TYR 951 1HB TYR 951 3.084 22.626 -5.794 281 2HB TYR 951 2HB TYR 951 1.604 22.667 -6.732 282 HD1 TYR 951 HD1 TYR 951 2.791 19.655 -4.925 283 HD2 TYR 951 HD2 TYR 951 0.103 22.984 -4.886 284 HE1 TYR 951 HE1 TYR 951 1.524 18.619 -2.979 285 HE2 TYR 951 HE2 TYR 951 -1.154 21.936 -2.940 286 HH TYR 951 HH TYR 951 -0.775 18.736 -2.064 287 H VAL 952 H VAL 952 1.510 21.862 -9.189 288 HA VAL 952 HA VAL 952 -0.756 20.318 -9.032 289 HB VAL 952 HB VAL 952 0.624 21.972 -11.040 290 1HG1 VAL 952 1HG1 VAL 952 0.309 20.209 -12.561 291 2HG1 VAL 952 2HG1 VAL 952 -1.255 19.748 -11.848 292 3HG1 VAL 952 3HG1 VAL 952 -1.116 21.248 -12.797 293 1HG2 VAL 952 1HG2 VAL 952 -2.342 21.874 -10.754 294 2HG2 VAL 952 2HG2 VAL 952 -1.405 22.398 -9.334 295 3HG2 VAL 952 3HG2 VAL 952 -1.244 23.269 -10.878 296 HA PRO 953 HA PRO 953 1.512 17.165 -11.742 297 1HB PRO 953 1HB PRO 953 4.227 17.319 -12.013 298 2HB PRO 953 2HB PRO 953 3.108 17.974 -13.191 299 1HG PRO 953 1HG PRO 953 4.742 19.410 -11.190 300 2HG PRO 953 2HG PRO 953 3.963 20.040 -12.628 301 1HD PRO 953 1HD PRO 953 3.067 20.339 -9.919 302 2HD PRO 953 2HD PRO 953 2.229 20.868 -11.364 303 H MET 954 H MET 954 3.852 18.162 -9.284 304 HA MET 954 HA MET 954 4.835 15.927 -8.434 305 1HB MET 954 1HB MET 954 3.952 18.417 -7.168 306 2HB MET 954 2HB MET 954 3.782 17.098 -6.028 307 1HG MET 954 1HG MET 954 6.075 16.681 -5.940 308 2HG MET 954 2HG MET 954 6.345 17.187 -7.596 309 1HE MET 954 1HE MET 954 4.755 20.216 -4.722 310 2HE MET 954 2HE MET 954 4.444 18.464 -4.742 311 3HE MET 954 3HE MET 954 5.791 19.117 -3.781 312 H VAL 955 H VAL 955 1.487 16.967 -7.467 313 HA VAL 955 HA VAL 955 0.939 14.592 -6.061 314 HB VAL 955 HB VAL 955 -0.771 16.774 -7.252 315 1HG1 VAL 955 1HG1 VAL 955 -1.636 14.179 -6.500 316 2HG1 VAL 955 2HG1 VAL 955 -2.146 15.290 -5.206 317 3HG1 VAL 955 3HG1 VAL 955 -2.633 15.602 -6.890 318 1HG2 VAL 955 1HG2 VAL 955 0.728 16.433 -4.785 319 2HG2 VAL 955 2HG2 VAL 955 -0.074 17.881 -5.440 320 3HG2 VAL 955 3HG2 VAL 955 -0.999 16.718 -4.460 321 H LYS 956 H LYS 956 0.030 15.745 -9.383 322 HA LYS 956 HA LYS 956 -1.467 13.701 -10.247 323 1HB LYS 956 1HB LYS 956 0.614 15.387 -11.613 324 2HB LYS 956 2HB LYS 956 -0.191 14.111 -12.504 325 1HG LYS 956 1HG LYS 956 -1.712 16.232 -10.922 326 2HG LYS 956 2HG LYS 956 -1.298 16.427 -12.614 327 1HD LYS 956 1HD LYS 956 -2.468 13.818 -12.342 328 2HD LYS 956 2HD LYS 956 -3.490 14.926 -11.448 329 1HE LYS 956 1HE LYS 956 -4.314 15.825 -13.365 330 2HE LYS 956 2HE LYS 956 -2.703 16.158 -13.969 331 1HZ LYS 956 1HZ LYS 956 -4.434 13.999 -14.590 332 2HZ LYS 956 2HZ LYS 956 -3.149 14.570 -15.420 333 3HZ LYS 956 3HZ LYS 956 -2.929 13.488 -14.217 334 H GLU 957 H GLU 957 2.069 13.667 -9.685 335 HA GLU 957 HA GLU 957 2.522 11.227 -10.938 336 1HB GLU 957 1HB GLU 957 3.983 13.072 -9.145 337 2HB GLU 957 2HB GLU 957 4.448 11.396 -8.931 338 1HG GLU 957 1HG GLU 957 5.814 11.733 -10.727 339 2HG GLU 957 2HG GLU 957 4.358 11.566 -11.689 340 H VAL 958 H VAL 958 2.223 12.013 -7.392 341 HA VAL 958 HA VAL 958 2.332 9.503 -6.385 342 HB VAL 958 HB VAL 958 1.858 11.974 -5.421 343 1HG1 VAL 958 1HG1 VAL 958 -0.300 12.095 -4.338 344 2HG1 VAL 958 2HG1 VAL 958 -0.546 11.850 -6.083 345 3HG1 VAL 958 3HG1 VAL 958 -0.749 10.488 -4.956 346 1HG2 VAL 958 1HG2 VAL 958 2.345 11.014 -3.438 347 2HG2 VAL 958 2HG2 VAL 958 0.990 9.865 -3.545 348 3HG2 VAL 958 3HG2 VAL 958 2.515 9.523 -4.396 349 H GLY 959 H GLY 959 -0.479 11.140 -7.935 350 1HA GLY 959 1HA GLY 959 -2.442 9.260 -7.374 351 2HA GLY 959 2HA GLY 959 -2.392 10.314 -8.774 352 H LEU 960 H LEU 960 -0.124 9.442 -10.168 353 HA LEU 960 HA LEU 960 -1.104 7.258 -11.546 354 1HB LEU 960 1HB LEU 960 0.930 9.103 -11.825 355 2HB LEU 960 2HB LEU 960 1.799 7.589 -11.667 356 HG LEU 960 HG LEU 960 -0.382 8.151 -13.696 357 1HD1 LEU 960 1HD1 LEU 960 1.149 8.971 -15.081 358 2HD1 LEU 960 2HD1 LEU 960 2.271 9.027 -13.700 359 3HD1 LEU 960 3HD1 LEU 960 2.253 7.609 -14.776 360 1HD2 LEU 960 1HD2 LEU 960 1.203 5.924 -14.434 361 2HD2 LEU 960 2HD2 LEU 960 0.713 5.681 -12.740 362 3HD2 LEU 960 3HD2 LEU 960 -0.521 5.960 -13.992 363 H ALA 961 H ALA 961 1.307 7.453 -8.870 364 HA ALA 961 HA ALA 961 2.096 4.799 -8.911 365 1HB ALA 961 1HB ALA 961 1.869 6.871 -6.702 366 2HB ALA 961 2HB ALA 961 2.605 5.270 -6.451 367 3HB ALA 961 3HB ALA 961 3.317 6.404 -7.625 368 H LEU 962 H LEU 962 -0.697 6.423 -7.295 369 HA LEU 962 HA LEU 962 -1.568 4.175 -5.890 370 1HB LEU 962 1HB LEU 962 -2.971 6.649 -6.890 371 2HB LEU 962 2HB LEU 962 -3.778 5.426 -5.927 372 HG LEU 962 HG LEU 962 -1.257 6.355 -4.738 373 1HD1 LEU 962 1HD1 LEU 962 -2.843 8.478 -4.006 374 2HD1 LEU 962 2HD1 LEU 962 -1.500 8.534 -5.174 375 3HD1 LEU 962 3HD1 LEU 962 -3.172 8.331 -5.749 376 1HD2 LEU 962 1HD2 LEU 962 -2.929 6.700 -2.791 377 2HD2 LEU 962 2HD2 LEU 962 -4.085 5.853 -3.847 378 3HD2 LEU 962 3HD2 LEU 962 -2.579 5.046 -3.350 379 H ARG 963 H ARG 963 -2.435 5.450 -9.166 380 HA ARG 963 HA ARG 963 -4.367 3.636 -9.742 381 1HB ARG 963 1HB ARG 963 -2.274 4.887 -11.589 382 2HB ARG 963 2HB ARG 963 -3.693 4.041 -12.174 383 1HG ARG 963 1HG ARG 963 -4.556 5.954 -10.187 384 2HG ARG 963 2HG ARG 963 -3.485 6.780 -11.300 385 1HD ARG 963 1HD ARG 963 -5.027 5.295 -13.056 386 2HD ARG 963 2HD ARG 963 -6.188 5.622 -11.785 387 HE ARG 963 HE ARG 963 -4.641 7.979 -12.619 388 1HH1 ARG 963 2HH2 ARG 963 -7.538 6.059 -13.170 389 2HH1 ARG 963 1HH2 ARG 963 -8.406 7.353 -13.926 390 1HH2 ARG 963 2HH1 ARG 963 -5.786 9.687 -13.615 391 2HH2 ARG 963 1HH1 ARG 963 -7.403 9.430 -14.181 392 H THR 964 H THR 964 -0.816 3.436 -10.533 393 HA THR 964 HA THR 964 -0.907 0.873 -11.640 394 HB THR 964 HB THR 964 1.267 2.557 -10.306 395 HG1 THR 964 HG1 THR 964 0.571 1.690 -13.024 396 1HG2 THR 964 1HG2 THR 964 2.692 0.779 -10.456 397 2HG2 THR 964 2HG2 THR 964 1.367 -0.258 -11.038 398 3HG2 THR 964 3HG2 THR 964 2.335 0.685 -12.197 399 H LEU 965 H LEU 965 -0.696 1.986 -8.253 400 HA LEU 965 HA LEU 965 0.137 -0.370 -7.094 401 1HB LEU 965 1HB LEU 965 -0.111 1.862 -6.023 402 2HB LEU 965 2HB LEU 965 -1.847 1.624 -5.991 403 HG LEU 965 HG LEU 965 -0.472 1.148 -3.860 404 1HD1 LEU 965 1HD1 LEU 965 -1.953 -0.989 -3.461 405 2HD1 LEU 965 2HD1 LEU 965 -2.695 0.617 -3.658 406 3HD1 LEU 965 3HD1 LEU 965 -2.666 -0.524 -5.024 407 1HD2 LEU 965 1HD2 LEU 965 0.738 -0.790 -3.629 408 2HD2 LEU 965 2HD2 LEU 965 -0.104 -1.611 -4.965 409 3HD2 LEU 965 3HD2 LEU 965 1.113 -0.360 -5.316 410 H LEU 966 H LEU 966 -3.253 0.742 -7.777 411 HA LEU 966 HA LEU 966 -4.599 -1.408 -6.808 412 1HB LEU 966 1HB LEU 966 -5.078 0.452 -9.108 413 2HB LEU 966 2HB LEU 966 -6.182 -0.877 -8.816 414 HG LEU 966 HG LEU 966 -6.361 0.034 -6.408 415 1HD1 LEU 966 1HD1 LEU 966 -4.445 1.528 -6.456 416 2HD1 LEU 966 2HD1 LEU 966 -5.184 2.470 -7.773 417 3HD1 LEU 966 3HD1 LEU 966 -5.942 2.444 -6.163 418 1HD2 LEU 966 1HD2 LEU 966 -7.621 2.100 -8.022 419 2HD2 LEU 966 2HD2 LEU 966 -7.817 0.480 -8.734 420 3HD2 LEU 966 3HD2 LEU 966 -8.349 0.789 -7.063 421 H ALA 967 H ALA 967 -3.284 -1.052 -10.178 422 HA ALA 967 HA ALA 967 -3.988 -3.619 -10.993 423 1HB ALA 967 1HB ALA 967 -1.932 -1.576 -11.865 424 2HB ALA 967 2HB ALA 967 -2.049 -3.162 -12.665 425 3HB ALA 967 3HB ALA 967 -3.445 -2.057 -12.671 426 H THR 968 H THR 968 -0.958 -2.316 -9.502 427 HA THR 968 HA THR 968 0.563 -4.615 -9.638 428 HB THR 968 HB THR 968 0.459 -2.494 -7.428 429 HG1 THR 968 HG1 THR 968 2.005 -1.498 -8.977 430 1HG2 THR 968 1HG2 THR 968 2.756 -2.997 -7.036 431 2HG2 THR 968 2HG2 THR 968 2.023 -4.610 -7.214 432 3HG2 THR 968 3HG2 THR 968 2.913 -3.882 -8.573 433 H VAL 969 H VAL 969 -1.828 -3.636 -7.112 434 HA VAL 969 HA VAL 969 -1.366 -5.826 -5.453 435 HB VAL 969 HB VAL 969 -3.850 -4.160 -5.905 436 1HG1 VAL 969 1HG1 VAL 969 -3.507 -6.516 -4.345 437 2HG1 VAL 969 2HG1 VAL 969 -3.610 -5.139 -3.221 438 3HG1 VAL 969 3HG1 VAL 969 -4.909 -5.422 -4.405 439 1HG2 VAL 969 1HG2 VAL 969 -1.855 -3.844 -3.660 440 2HG2 VAL 969 2HG2 VAL 969 -1.629 -3.030 -5.227 441 3HG2 VAL 969 3HG2 VAL 969 -3.076 -2.691 -4.249 442 H ASP 970 H ASP 970 -3.437 -5.370 -8.350 443 HA ASP 970 HA ASP 970 -5.022 -7.533 -8.164 444 1HB ASP 970 1HB ASP 970 -4.744 -5.713 -10.037 445 2HB ASP 970 2HB ASP 970 -3.605 -6.830 -10.761 446 H GLU 971 H GLU 971 -1.559 -7.302 -9.111 447 HA GLU 971 HA GLU 971 -1.424 -10.012 -9.938 448 1HB GLU 971 1HB GLU 971 0.671 -7.869 -9.417 449 2HB GLU 971 2HB GLU 971 1.107 -9.496 -9.900 450 1HG GLU 971 1HG GLU 971 -0.674 -9.089 -11.840 451 2HG GLU 971 2HG GLU 971 -0.405 -7.396 -11.471 452 H SER 972 H SER 972 -1.217 -8.262 -6.913 453 HA SER 972 HA SER 972 0.287 -10.336 -5.634 454 1HB SER 972 1HB SER 972 -0.047 -7.637 -5.151 455 2HB SER 972 2HB SER 972 -1.120 -8.328 -3.951 456 HG SER 972 HG SER 972 1.115 -8.037 -3.205 457 H LEU 973 H LEU 973 -3.073 -9.362 -6.171 458 HA LEU 973 HA LEU 973 -4.433 -10.418 -4.107 459 1HB LEU 973 1HB LEU 973 -4.976 -9.600 -6.720 460 2HB LEU 973 2HB LEU 973 -5.623 -11.225 -6.627 461 HG LEU 973 HG LEU 973 -6.567 -8.732 -5.382 462 1HD1 LEU 973 1HD1 LEU 973 -8.694 -9.641 -5.765 463 2HD1 LEU 973 2HD1 LEU 973 -7.708 -10.204 -7.136 464 3HD1 LEU 973 3HD1 LEU 973 -8.079 -11.311 -5.792 465 1HD2 LEU 973 1HD2 LEU 973 -5.981 -9.516 -3.291 466 2HD2 LEU 973 2HD2 LEU 973 -7.629 -10.161 -3.477 467 3HD2 LEU 973 3HD2 LEU 973 -6.223 -11.222 -3.739 468 HA PRO 974 HA PRO 974 -3.859 -14.764 -5.874 469 1HB PRO 974 1HB PRO 974 -2.073 -15.199 -7.896 470 2HB PRO 974 2HB PRO 974 -3.789 -14.970 -8.167 471 1HG PRO 974 1HG PRO 974 -1.569 -13.078 -8.647 472 2HG PRO 974 2HG PRO 974 -3.199 -13.043 -9.289 473 1HD PRO 974 1HD PRO 974 -2.153 -11.415 -7.172 474 2HD PRO 974 2HD PRO 974 -3.811 -11.463 -7.735 475 H VAL 975 H VAL 975 -0.956 -12.825 -5.883 476 HA VAL 975 HA VAL 975 0.877 -14.688 -5.138 477 HB VAL 975 HB VAL 975 0.483 -11.791 -4.440 478 1HG1 VAL 975 1HG1 VAL 975 1.672 -12.757 -2.536 479 2HG1 VAL 975 2HG1 VAL 975 2.847 -13.520 -3.634 480 3HG1 VAL 975 3HG1 VAL 975 2.767 -11.746 -3.509 481 1HG2 VAL 975 1HG2 VAL 975 1.082 -12.490 -6.771 482 2HG2 VAL 975 2HG2 VAL 975 2.280 -11.422 -6.001 483 3HG2 VAL 975 3HG2 VAL 975 2.596 -13.169 -6.127 484 H LEU 976 H LEU 976 -1.814 -13.336 -3.258 485 HA LEU 976 HA LEU 976 -0.862 -14.867 -0.941 486 1HB LEU 976 1HB LEU 976 -2.850 -12.595 -1.007 487 2HB LEU 976 2HB LEU 976 -2.236 -13.413 0.416 488 HG LEU 976 HG LEU 976 -1.090 -11.363 0.312 489 1HD1 LEU 976 1HD1 LEU 976 0.712 -13.511 -0.837 490 2HD1 LEU 976 2HD1 LEU 976 1.274 -11.991 -0.099 491 3HD1 LEU 976 3HD1 LEU 976 0.386 -13.182 0.882 492 1HD2 LEU 976 1HD2 LEU 976 -0.083 -10.384 -1.603 493 2HD2 LEU 976 2HD2 LEU 976 -0.288 -11.870 -2.560 494 3HD2 LEU 976 3HD2 LEU 976 -1.712 -10.912 -2.088 495 HA PRO 977 HA PRO 977 -4.273 -17.478 -1.338 496 1HB PRO 977 1HB PRO 977 -4.849 -18.153 1.247 497 2HB PRO 977 2HB PRO 977 -3.530 -18.867 0.342 498 1HG PRO 977 1HG PRO 977 -3.419 -16.838 2.488 499 2HG PRO 977 2HG PRO 977 -2.134 -17.860 1.877 500 1HD PRO 977 1HD PRO 977 -2.529 -15.077 1.309 501 2HD PRO 977 2HD PRO 977 -1.314 -16.127 0.608 502 H ALA 978 H ALA 978 -6.568 -17.855 -1.174 503 HA ALA 978 HA ALA 978 -7.926 -15.388 -1.168 504 1HB ALA 978 1HB ALA 978 -8.943 -16.929 -2.544 505 2HB ALA 978 2HB ALA 978 -8.594 -18.294 -1.456 506 3HB ALA 978 3HB ALA 978 -9.925 -17.174 -1.080 507 H SER 979 H SER 979 -7.099 -14.635 1.007 508 HA SER 979 HA SER 979 -9.098 -15.333 2.956 509 1HB SER 979 1HB SER 979 -7.377 -16.856 3.648 510 2HB SER 979 2HB SER 979 -6.111 -15.671 3.394 511 HG SER 979 HG SER 979 -6.709 -15.991 5.672 512 H THR 980 H THR 980 -6.216 -13.374 2.013 513 HA THR 980 HA THR 980 -7.134 -11.183 3.704 514 HB THR 980 HB THR 980 -4.760 -11.687 3.812 515 HG1 THR 980 HG1 THR 980 -5.662 -9.392 3.326 516 1HG2 THR 980 1HG2 THR 980 -4.863 -11.499 0.757 517 2HG2 THR 980 2HG2 THR 980 -3.355 -11.488 1.702 518 3HG2 THR 980 3HG2 THR 980 -4.403 -12.926 1.716 519 H HIS 981 H HIS 981 -7.788 -12.389 0.623 520 HA HIS 981 HA HIS 981 -7.696 -10.161 -0.978 521 1HB HIS 981 1HB HIS 981 -9.732 -12.407 -0.971 522 2HB HIS 981 2HB HIS 981 -9.472 -11.283 -2.290 523 HD1 HIS 981 HD1 HIS 981 -8.817 -13.304 -3.846 524 HD2 HIS 981 HD2 HIS 981 -6.259 -12.700 -0.577 525 HE1 HIS 981 HE1 HIS 981 -6.725 -14.689 -4.309 526 H ARG 982 H ARG 982 -10.504 -11.364 0.998 527 HA ARG 982 HA ARG 982 -12.274 -9.466 0.468 528 1HB ARG 982 1HB ARG 982 -12.105 -11.458 2.325 529 2HB ARG 982 2HB ARG 982 -11.930 -10.080 3.394 530 1HG ARG 982 1HG ARG 982 -14.069 -9.512 1.527 531 2HG ARG 982 2HG ARG 982 -14.339 -11.107 2.201 532 1HD ARG 982 1HD ARG 982 -14.209 -10.226 4.495 533 2HD ARG 982 2HD ARG 982 -13.736 -8.644 3.906 534 HE ARG 982 HE ARG 982 -16.293 -9.609 2.820 535 1HH1 ARG 982 2HH2 ARG 982 -14.723 -7.810 5.405 536 2HH1 ARG 982 1HH2 ARG 982 -16.150 -6.924 5.828 537 1HH2 ARG 982 2HH1 ARG 982 -18.176 -8.440 3.378 538 2HH2 ARG 982 1HH1 ARG 982 -18.127 -7.285 4.668 539 H GLU 983 H GLU 983 -10.045 -9.252 3.350 540 HA GLU 983 HA GLU 983 -10.618 -6.625 3.900 541 1HB GLU 983 1HB GLU 983 -8.168 -8.333 4.479 542 2HB GLU 983 2HB GLU 983 -8.331 -6.703 5.100 543 1HG GLU 983 1HG GLU 983 -9.796 -7.357 6.715 544 2HG GLU 983 2HG GLU 983 -10.782 -8.243 5.570 545 H ILE 984 H ILE 984 -8.164 -8.093 1.721 546 HA ILE 984 HA ILE 984 -6.663 -5.832 1.211 547 HB ILE 984 HB ILE 984 -7.248 -8.383 -0.206 548 1HG1 ILE 984 1HG1 ILE 984 -4.600 -7.120 0.527 549 2HG1 ILE 984 2HG1 ILE 984 -5.551 -8.042 1.675 550 1HG2 ILE 984 1HG2 ILE 984 -7.173 -7.259 -2.183 551 2HG2 ILE 984 2HG2 ILE 984 -6.230 -5.905 -1.514 552 3HG2 ILE 984 3HG2 ILE 984 -5.425 -7.445 -1.901 553 1HD1 ILE 984 1HD1 ILE 984 -5.605 -9.898 -0.178 554 2HD1 ILE 984 2HD1 ILE 984 -4.247 -8.995 -0.891 555 3HD1 ILE 984 3HD1 ILE 984 -4.104 -9.667 0.751 556 H GLU 985 H GLU 985 -9.659 -7.049 -0.421 557 HA GLU 985 HA GLU 985 -9.793 -5.143 -2.360 558 1HB GLU 985 1HB GLU 985 -11.335 -7.256 -1.636 559 2HB GLU 985 2HB GLU 985 -12.364 -5.964 -1.052 560 1HG GLU 985 1HG GLU 985 -11.218 -5.589 -3.797 561 2HG GLU 985 2HG GLU 985 -12.405 -6.867 -3.629 562 H MET 986 H MET 986 -11.040 -5.031 1.035 563 HA MET 986 HA MET 986 -12.156 -2.467 0.701 564 1HB MET 986 1HB MET 986 -11.576 -4.381 2.970 565 2HB MET 986 2HB MET 986 -11.886 -2.712 3.405 566 1HG MET 986 1HG MET 986 -14.116 -3.048 3.149 567 2HG MET 986 2HG MET 986 -13.873 -3.451 1.461 568 1HE MET 986 1HE MET 986 -15.364 -6.163 1.064 569 2HE MET 986 2HE MET 986 -13.966 -5.249 0.450 570 3HE MET 986 3HE MET 986 -13.758 -6.928 1.003 571 H ALA 987 H ALA 987 -8.934 -3.685 1.339 572 HA ALA 987 HA ALA 987 -7.970 -1.388 2.705 573 1HB ALA 987 1HB ALA 987 -6.160 -3.174 1.122 574 2HB ALA 987 2HB ALA 987 -5.988 -2.558 2.783 575 3HB ALA 987 3HB ALA 987 -7.094 -3.911 2.446 576 H GLN 988 H GLN 988 -8.189 -2.472 -0.713 577 HA GLN 988 HA GLN 988 -6.537 -0.506 -1.750 578 1HB GLN 988 1HB GLN 988 -8.842 -2.095 -2.943 579 2HB GLN 988 2HB GLN 988 -7.887 -0.981 -3.902 580 1HG GLN 988 1HG GLN 988 -6.172 -2.757 -2.303 581 2HG GLN 988 2HG GLN 988 -7.260 -3.674 -3.326 582 1HE2 GLN 988 1HE2 GLN 988 -6.818 -3.910 -5.399 583 2HE2 GLN 988 2HE2 GLN 988 -5.596 -3.072 -6.296 584 H LYS 989 H LYS 989 -10.161 -0.640 -1.467 585 HA LYS 989 HA LYS 989 -10.628 1.886 -2.516 586 1HB LYS 989 1HB LYS 989 -12.267 -0.015 -2.078 587 2HB LYS 989 2HB LYS 989 -12.306 0.510 -0.407 588 1HG LYS 989 1HG LYS 989 -12.661 2.912 -1.765 589 2HG LYS 989 2HG LYS 989 -13.495 1.782 -2.812 590 1HD LYS 989 1HD LYS 989 -14.095 1.306 0.038 591 2HD LYS 989 2HD LYS 989 -14.520 2.930 -0.462 592 1HE LYS 989 1HE LYS 989 -15.897 2.061 -2.310 593 2HE LYS 989 2HE LYS 989 -15.369 0.422 -1.986 594 1HZ LYS 989 1HZ LYS 989 -16.526 0.403 0.013 595 2HZ LYS 989 2HZ LYS 989 -16.721 2.023 0.059 596 3HZ LYS 989 3HZ LYS 989 -17.556 1.131 -1.024 597 H LEU 990 H LEU 990 -9.374 0.841 0.607 598 HA LEU 990 HA LEU 990 -10.035 3.174 2.040 599 1HB LEU 990 1HB LEU 990 -9.039 0.713 2.637 600 2HB LEU 990 2HB LEU 990 -7.596 1.695 2.789 601 HG LEU 990 HG LEU 990 -10.206 2.213 4.241 602 1HD1 LEU 990 1HD1 LEU 990 -9.375 0.234 5.179 603 2HD1 LEU 990 2HD1 LEU 990 -7.685 0.782 5.075 604 3HD1 LEU 990 3HD1 LEU 990 -8.789 1.522 6.259 605 1HD2 LEU 990 1HD2 LEU 990 -7.683 3.735 3.982 606 2HD2 LEU 990 2HD2 LEU 990 -9.334 4.287 4.355 607 3HD2 LEU 990 3HD2 LEU 990 -8.325 3.569 5.634 608 H LEU 991 H LEU 991 -6.998 2.111 0.355 609 HA LEU 991 HA LEU 991 -5.577 4.439 0.859 610 1HB LEU 991 1HB LEU 991 -4.532 2.400 0.138 611 2HB LEU 991 2HB LEU 991 -5.405 2.424 -1.381 612 HG LEU 991 HG LEU 991 -4.146 4.264 -2.206 613 1HD1 LEU 991 1HD1 LEU 991 -2.945 4.550 0.563 614 2HD1 LEU 991 2HD1 LEU 991 -2.483 5.486 -0.879 615 3HD1 LEU 991 3HD1 LEU 991 -4.120 5.648 -0.200 616 1HD2 LEU 991 1HD2 LEU 991 -2.759 2.557 -2.698 617 2HD2 LEU 991 2HD2 LEU 991 -1.690 3.366 -1.527 618 3HD2 LEU 991 3HD2 LEU 991 -2.685 1.981 -1.015 619 H ASN 992 H ASN 992 -7.646 3.521 -1.974 620 HA ASN 992 HA ASN 992 -7.250 5.690 -3.503 621 1HB ASN 992 1HB ASN 992 -9.125 3.577 -3.373 622 2HB ASN 992 2HB ASN 992 -10.123 5.017 -3.335 623 1HD2 ASN 992 1HD2 ASN 992 -10.354 6.268 -5.098 624 2HD2 ASN 992 2HD2 ASN 992 -9.663 5.941 -6.652 625 H SER 993 H SER 993 -9.910 5.262 -1.035 626 HA SER 993 HA SER 993 -11.114 7.600 -1.122 627 1HB SER 993 1HB SER 993 -11.710 5.839 0.478 628 2HB SER 993 2HB SER 993 -10.239 6.111 1.390 629 HG SER 993 HG SER 993 -12.202 8.192 0.983 630 H ASP 994 H ASP 994 -8.379 7.067 1.229 631 HA ASP 994 HA ASP 994 -8.044 9.672 1.891 632 1HB ASP 994 1HB ASP 994 -6.921 7.564 2.858 633 2HB ASP 994 2HB ASP 994 -5.764 7.674 1.546 634 H LEU 995 H LEU 995 -6.682 7.757 -0.849 635 HA LEU 995 HA LEU 995 -4.779 9.487 -1.778 636 1HB LEU 995 1HB LEU 995 -4.622 7.712 -3.078 637 2HB LEU 995 2HB LEU 995 -6.267 7.217 -2.734 638 HG LEU 995 HG LEU 995 -7.126 8.600 -4.532 639 1HD1 LEU 995 1HD1 LEU 995 -4.842 9.419 -5.961 640 2HD1 LEU 995 2HD1 LEU 995 -6.057 10.440 -5.154 641 3HD1 LEU 995 3HD1 LEU 995 -4.590 9.941 -4.278 642 1HD2 LEU 995 1HD2 LEU 995 -5.844 6.265 -4.852 643 2HD2 LEU 995 2HD2 LEU 995 -6.615 7.148 -6.192 644 3HD2 LEU 995 3HD2 LEU 995 -4.859 7.284 -5.929 645 H ALA 996 H ALA 996 -8.287 9.383 -2.727 646 HA ALA 996 HA ALA 996 -8.222 11.590 -4.382 647 1HB ALA 996 1HB ALA 996 -10.344 10.892 -4.610 648 2HB ALA 996 2HB ALA 996 -10.144 9.823 -3.202 649 3HB ALA 996 3HB ALA 996 -10.721 11.492 -2.977 650 H GLU 997 H GLU 997 -8.590 11.339 -0.809 651 HA GLU 997 HA GLU 997 -9.230 14.005 -0.410 652 1HB GLU 997 1HB GLU 997 -9.049 11.772 1.174 653 2HB GLU 997 2HB GLU 997 -7.622 12.641 1.701 654 1HG GLU 997 1HG GLU 997 -9.321 13.470 3.129 655 2HG GLU 997 2HG GLU 997 -9.170 14.724 1.913 656 H LEU 998 H LEU 998 -6.090 12.272 -0.663 657 HA LEU 998 HA LEU 998 -4.528 14.494 0.121 658 1HB LEU 998 1HB LEU 998 -3.659 12.304 0.378 659 2HB LEU 998 2HB LEU 998 -3.936 11.910 -1.307 660 HG LEU 998 HG LEU 998 -2.136 14.211 -0.872 661 1HD1 LEU 998 1HD1 LEU 998 -1.751 12.223 0.936 662 2HD1 LEU 998 2HD1 LEU 998 -0.743 11.649 -0.414 663 3HD1 LEU 998 3HD1 LEU 998 -0.460 13.261 0.286 664 1HD2 LEU 998 1HD2 LEU 998 -1.649 11.705 -2.481 665 2HD2 LEU 998 2HD2 LEU 998 -2.695 13.023 -3.060 666 3HD2 LEU 998 3HD2 LEU 998 -0.976 13.335 -2.718 667 H ILE 999 H ILE 999 -5.881 13.302 -2.965 668 HA ILE 999 HA ILE 999 -4.335 14.976 -4.615 669 HB ILE 999 HB ILE 999 -6.958 13.540 -4.974 670 1HG1 ILE 999 1HG1 ILE 999 -4.970 12.129 -4.717 671 2HG1 ILE 999 2HG1 ILE 999 -5.651 12.006 -6.327 672 1HG2 ILE 999 1HG2 ILE 999 -5.727 15.603 -6.661 673 2HG2 ILE 999 2HG2 ILE 999 -6.071 14.078 -7.513 674 3HG2 ILE 999 3HG2 ILE 999 -7.379 14.940 -6.667 675 1HD1 ILE 999 1HD1 ILE 999 -3.918 13.993 -6.841 676 2HD1 ILE 999 2HD1 ILE 999 -3.077 13.284 -5.442 677 3HD1 ILE 999 3HD1 ILE 999 -3.413 12.287 -6.877 678 H ASN1000 H ASN1000 -7.523 15.340 -2.973 679 HA ASN1000 HA ASN1000 -8.112 17.778 -4.182 680 1HB ASN1000 1HB ASN1000 -9.590 16.096 -2.740 681 2HB ASN1000 2HB ASN1000 -9.037 17.049 -1.377 682 1HD2 ASN1000 1HD2 ASN1000 -11.232 17.625 -1.054 683 2HD2 ASN1000 2HD2 ASN1000 -11.982 18.891 -1.969 684 H LYS1001 H LYS1001 -6.605 16.810 -1.024 685 HA LYS1001 HA LYS1001 -6.375 19.234 0.186 686 1HB LYS1001 1HB LYS1001 -5.216 16.617 0.434 687 2HB LYS1001 2HB LYS1001 -3.956 17.812 0.659 688 1HG LYS1001 1HG LYS1001 -4.795 17.725 2.827 689 2HG LYS1001 2HG LYS1001 -5.787 19.018 2.184 690 1HD LYS1001 1HD LYS1001 -7.186 16.679 1.464 691 2HD LYS1001 2HD LYS1001 -6.580 16.324 3.069 692 1HE LYS1001 1HE LYS1001 -7.704 19.064 2.791 693 2HE LYS1001 2HE LYS1001 -8.875 17.788 2.521 694 1HZ LYS1001 1HZ LYS1001 -8.154 16.817 4.631 695 2HZ LYS1001 2HZ LYS1001 -7.164 18.089 4.889 696 3HZ LYS1001 3HZ LYS1001 -8.780 18.313 4.820 697 H MET1002 H MET1002 -4.508 17.916 -2.559 698 HA MET1002 HA MET1002 -2.647 20.074 -2.452 699 1HB MET1002 1HB MET1002 -1.469 18.743 -3.938 700 2HB MET1002 2HB MET1002 -2.632 17.509 -3.498 701 1HG MET1002 1HG MET1002 -2.820 17.488 -5.837 702 2HG MET1002 2HG MET1002 -4.120 18.583 -5.409 703 1HE MET1002 1HE MET1002 -4.068 18.979 -7.689 704 2HE MET1002 2HE MET1002 -3.906 20.751 -7.747 705 3HE MET1002 3HE MET1002 -2.781 19.724 -8.668 706 H LYS1003 H LYS1003 -5.756 19.380 -3.958 707 HA LYS1003 HA LYS1003 -5.542 21.140 -6.134 708 1HB LYS1003 1HB LYS1003 -7.849 19.894 -4.642 709 2HB LYS1003 2HB LYS1003 -8.121 21.041 -5.938 710 1HG LYS1003 1HG LYS1003 -6.321 19.445 -7.193 711 2HG LYS1003 2HG LYS1003 -6.964 18.269 -6.064 712 1HD LYS1003 1HD LYS1003 -9.059 19.905 -7.386 713 2HD LYS1003 2HD LYS1003 -8.112 18.948 -8.508 714 1HE LYS1003 1HE LYS1003 -8.568 17.105 -6.492 715 2HE LYS1003 2HE LYS1003 -10.038 18.056 -6.418 716 1HZ LYS1003 1HZ LYS1003 -9.718 17.710 -9.043 717 2HZ LYS1003 2HZ LYS1003 -9.131 16.297 -8.473 718 3HZ LYS1003 3HZ LYS1003 -10.651 16.762 -8.095 719 H LEU1004 H LEU1004 -6.875 21.534 -2.786 720 HA LEU1004 HA LEU1004 -7.558 24.238 -3.174 721 1HB LEU1004 1HB LEU1004 -7.424 24.124 -0.554 722 2HB LEU1004 2HB LEU1004 -8.725 23.372 -1.454 723 HG LEU1004 HG LEU1004 -6.378 21.637 -0.947 724 1HD1 LEU1004 1HD1 LEU1004 -8.158 22.561 1.325 725 2HD1 LEU1004 2HD1 LEU1004 -7.043 21.175 1.387 726 3HD1 LEU1004 3HD1 LEU1004 -6.404 22.822 1.163 727 1HD2 LEU1004 1HD2 LEU1004 -8.576 20.983 -2.042 728 2HD2 LEU1004 2HD2 LEU1004 -7.997 19.937 -0.724 729 3HD2 LEU1004 3HD2 LEU1004 -9.305 21.106 -0.423 730 H ALA1005 H ALA1005 -4.765 22.664 -1.459 731 HA ALA1005 HA ALA1005 -3.397 24.840 -0.674 732 1HB ALA1005 1HB ALA1005 -2.665 22.110 -1.647 733 2HB ALA1005 2HB ALA1005 -1.344 23.292 -1.487 734 3HB ALA1005 3HB ALA1005 -2.350 22.886 -0.076 735 H GLN1006 H GLN1006 -3.448 23.423 -4.003 736 HA GLN1006 HA GLN1006 -1.570 24.841 -5.221 737 1HB GLN1006 1HB GLN1006 -4.011 23.510 -5.998 738 2HB GLN1006 2HB GLN1006 -3.868 24.980 -6.942 739 1HG GLN1006 1HG GLN1006 -1.628 22.926 -6.631 740 2HG GLN1006 2HG GLN1006 -2.736 22.968 -7.988 741 1HE2 GLN1006 1HE2 GLN1006 -2.822 24.884 -9.307 742 2HE2 GLN1006 2HE2 GLN1006 -1.411 25.865 -9.529 743 H GLN1007 H GLN1007 -4.852 26.041 -4.319 744 HA GLN1007 HA GLN1007 -4.080 28.657 -5.295 745 1HB GLN1007 1HB GLN1007 -6.412 27.373 -5.635 746 2HB GLN1007 2HB GLN1007 -6.781 28.099 -4.083 747 1HG GLN1007 1HG GLN1007 -6.033 30.349 -5.079 748 2HG GLN1007 2HG GLN1007 -5.964 29.552 -6.638 749 1HE2 GLN1007 1HE2 GLN1007 -8.058 30.276 -3.888 750 2HE2 GLN1007 2HE2 GLN1007 -9.565 30.299 -4.742 751 H TYR1008 H TYR1008 -4.636 26.783 -2.343 752 HA TYR1008 HA TYR1008 -4.645 29.168 -0.690 753 1HB TYR1008 1HB TYR1008 -4.891 26.130 -0.408 754 2HB TYR1008 2HB TYR1008 -4.603 27.091 1.030 755 HD1 TYR1008 HD1 TYR1008 -6.290 28.914 1.638 756 HD2 TYR1008 HD2 TYR1008 -7.068 25.923 -1.321 757 HE1 TYR1008 HE1 TYR1008 -8.785 29.364 1.828 758 HE2 TYR1008 HE2 TYR1008 -9.560 26.383 -1.121 759 HH TYR1008 HH TYR1008 -10.985 27.594 1.211 760 H VAL1009 H VAL1009 -2.248 28.417 -2.397 761 HA VAL1009 HA VAL1009 -0.343 28.092 -0.181 762 HB VAL1009 HB VAL1009 -0.400 26.165 -1.685 763 1HG1 VAL1009 1HG1 VAL1009 0.002 26.257 -3.996 764 2HG1 VAL1009 2HG1 VAL1009 -1.121 27.606 -3.701 765 3HG1 VAL1009 3HG1 VAL1009 0.616 27.926 -3.919 766 1HG2 VAL1009 1HG2 VAL1009 1.765 25.979 -1.190 767 2HG2 VAL1009 2HG2 VAL1009 2.171 26.988 -2.600 768 3HG2 VAL1009 3HG2 VAL1009 1.892 27.746 -1.013 769 H MET1010 H MET1010 -0.888 29.528 -3.469 770 HA MET1010 HA MET1010 1.263 31.326 -3.132 771 1HB MET1010 1HB MET1010 0.252 32.348 -5.249 772 2HB MET1010 2HB MET1010 0.575 30.631 -5.378 773 1HG MET1010 1HG MET1010 -1.602 30.357 -5.978 774 2HG MET1010 2HG MET1010 -2.036 30.733 -4.322 775 1HE MET1010 1HE MET1010 -3.538 33.908 -4.170 776 2HE MET1010 2HE MET1010 -4.471 32.528 -4.796 777 3HE MET1010 3HE MET1010 -3.201 32.263 -3.578 778 H THR1011 H THR1011 -0.036 31.732 -0.819 779 HA THR1011 HA THR1011 -1.106 34.417 -1.162 780 HB THR1011 HB THR1011 -2.918 33.530 0.630 781 HG1 THR1011 HG1 THR1011 -2.244 31.300 -1.156 782 1HG2 THR1011 1HG2 THR1011 -4.242 34.110 -1.144 783 2HG2 THR1011 2HG2 THR1011 -2.915 33.799 -2.289 784 3HG2 THR1011 3HG2 THR1011 -3.984 32.469 -1.783 785 H SER1012 H SER1012 -0.869 31.976 1.509 786 HA SER1012 HA SER1012 1.426 32.937 2.598 787 1HB SER1012 1HB SER1012 -0.639 34.856 2.929 788 2HB SER1012 2HB SER1012 -0.478 34.083 4.494 789 HG SER1012 HG SER1012 1.939 34.796 3.179 790 H LEU1013 H LEU1013 -1.884 31.688 3.044 791 HA LEU1013 HA LEU1013 -1.203 30.306 5.472 792 1HB LEU1013 1HB LEU1013 -3.519 29.315 5.076 793 2HB LEU1013 2HB LEU1013 -3.390 31.022 5.452 794 HG LEU1013 HG LEU1013 -3.848 31.663 3.205 795 1HD1 LEU1013 1HD1 LEU1013 -2.470 29.996 2.059 796 2HD1 LEU1013 2HD1 LEU1013 -3.672 28.737 2.431 797 3HD1 LEU1013 3HD1 LEU1013 -4.102 30.088 1.355 798 1HD2 LEU1013 1HD2 LEU1013 -6.060 30.660 2.805 799 2HD2 LEU1013 2HD2 LEU1013 -5.688 29.386 3.991 800 3HD2 LEU1013 3HD2 LEU1013 -5.809 31.082 4.517 801 H GLN1014 H GLN1014 0.747 29.593 3.756 802 HA GLN1014 HA GLN1014 -0.072 27.239 2.343 803 1HB GLN1014 1HB GLN1014 1.605 28.628 1.286 804 2HB GLN1014 2HB GLN1014 2.609 28.630 2.723 805 1HG GLN1014 1HG GLN1014 2.237 25.889 2.147 806 2HG GLN1014 2HG GLN1014 2.444 26.632 0.573 807 1HE2 GLN1014 1HE2 GLN1014 4.255 28.199 0.364 808 2HE2 GLN1014 2HE2 GLN1014 5.760 27.832 1.140 809 H GLN1015 H GLN1015 2.607 27.854 4.733 810 HA GLN1015 HA GLN1015 3.198 25.390 5.428 811 1HB GLN1015 1HB GLN1015 3.329 26.446 7.903 812 2HB GLN1015 2HB GLN1015 4.448 26.900 6.632 813 1HG GLN1015 1HG GLN1015 3.335 28.951 6.196 814 2HG GLN1015 2HG GLN1015 1.835 28.408 6.920 815 1HE2 GLN1015 1HE2 GLN1015 1.900 30.401 8.087 816 2HE2 GLN1015 2HE2 GLN1015 2.825 30.555 9.543 817 H GLU1016 H GLU1016 0.172 27.077 6.234 818 HA GLU1016 HA GLU1016 -0.626 25.214 8.189 819 1HB GLU1016 1HB GLU1016 -1.483 27.567 8.020 820 2HB GLU1016 2HB GLU1016 -2.317 27.144 6.538 821 1HG GLU1016 1HG GLU1016 -4.049 26.782 8.037 822 2HG GLU1016 2HG GLU1016 -3.335 25.181 8.060 823 H TYR1017 H TYR1017 -1.979 25.881 4.871 824 HA TYR1017 HA TYR1017 -3.474 23.543 4.739 825 1HB TYR1017 1HB TYR1017 -2.269 25.648 2.928 826 2HB TYR1017 2HB TYR1017 -2.792 24.182 2.123 827 HD1 TYR1017 HD1 TYR1017 -4.109 26.598 4.685 828 HD2 TYR1017 HD2 TYR1017 -4.946 24.160 1.270 829 HE1 TYR1017 HE1 TYR1017 -6.498 27.467 4.641 830 HE2 TYR1017 HE2 TYR1017 -7.332 25.037 1.238 831 HH TYR1017 HH TYR1017 -8.773 26.427 3.724 832 H LYS1018 H LYS1018 -0.023 24.074 4.417 833 HA LYS1018 HA LYS1018 0.483 21.823 2.762 834 1HB LYS1018 1HB LYS1018 1.900 24.019 3.443 835 2HB LYS1018 2HB LYS1018 2.600 22.873 4.569 836 1HG LYS1018 1HG LYS1018 3.958 22.489 2.716 837 2HG LYS1018 2HG LYS1018 2.717 21.285 2.431 838 1HD LYS1018 1HD LYS1018 2.446 24.093 1.297 839 2HD LYS1018 2HD LYS1018 3.394 22.879 0.462 840 1HE LYS1018 1HE LYS1018 1.365 22.403 -0.529 841 2HE LYS1018 2HE LYS1018 1.159 21.403 0.895 842 1HZ LYS1018 1HZ LYS1018 -0.019 23.983 0.299 843 2HZ LYS1018 2HZ LYS1018 -0.704 22.659 0.967 844 3HZ LYS1018 3HZ LYS1018 0.261 23.621 1.867 845 H LYS1019 H LYS1019 0.358 22.451 6.301 846 HA LYS1019 HA LYS1019 1.376 19.949 7.056 847 1HB LYS1019 1HB LYS1019 0.247 22.307 8.316 848 2HB LYS1019 2HB LYS1019 -0.358 20.851 9.079 849 1HG LYS1019 1HG LYS1019 1.621 21.036 10.259 850 2HG LYS1019 2HG LYS1019 2.232 20.115 8.900 851 1HD LYS1019 1HD LYS1019 2.197 23.147 8.778 852 2HD LYS1019 2HD LYS1019 3.479 22.323 9.643 853 1HE LYS1019 1HE LYS1019 2.945 21.164 6.964 854 2HE LYS1019 2HE LYS1019 3.454 22.840 6.903 855 1HZ LYS1019 1HZ LYS1019 5.491 22.189 7.350 856 2HZ LYS1019 2HZ LYS1019 5.035 21.487 8.752 857 3HZ LYS1019 3HZ LYS1019 5.024 20.624 7.366 858 H GLN1020 H GLN1020 -1.815 21.079 5.986 859 HA GLN1020 HA GLN1020 -3.312 19.001 7.011 860 1HB GLN1020 1HB GLN1020 -3.624 20.894 4.676 861 2HB GLN1020 2HB GLN1020 -4.774 19.585 4.869 862 1HG GLN1020 1HG GLN1020 -4.143 21.217 7.317 863 2HG GLN1020 2HG GLN1020 -5.096 21.994 6.068 864 1HE2 GLN1020 1HE2 GLN1020 -6.788 22.041 7.634 865 2HE2 GLN1020 2HE2 GLN1020 -7.806 20.665 7.897 866 H MET1021 H MET1021 -1.987 19.396 3.640 867 HA MET1021 HA MET1021 -2.722 16.932 2.736 868 1HB MET1021 1HB MET1021 -0.959 17.302 1.013 869 2HB MET1021 2HB MET1021 -1.791 18.807 1.347 870 1HG MET1021 1HG MET1021 0.052 19.767 2.386 871 2HG MET1021 2HG MET1021 0.612 18.245 3.051 872 1HE MET1021 1HE MET1021 0.829 16.300 1.363 873 2HE MET1021 2HE MET1021 1.747 16.408 -0.158 874 3HE MET1021 3HE MET1021 2.584 16.594 1.402 875 H LEU1022 H LEU1022 -0.192 17.799 5.010 876 HA LEU1022 HA LEU1022 1.388 15.465 4.592 877 1HB LEU1022 1HB LEU1022 2.394 17.470 5.425 878 2HB LEU1022 2HB LEU1022 1.279 17.544 6.776 879 HG LEU1022 HG LEU1022 3.492 16.804 7.482 880 1HD1 LEU1022 1HD1 LEU1022 2.029 14.265 7.824 881 2HD1 LEU1022 2HD1 LEU1022 2.678 15.398 9.033 882 3HD1 LEU1022 3HD1 LEU1022 1.115 15.731 8.252 883 1HD2 LEU1022 1HD2 LEU1022 4.463 14.699 6.766 884 2HD2 LEU1022 2HD2 LEU1022 3.087 14.403 5.677 885 3HD2 LEU1022 3HD2 LEU1022 4.195 15.760 5.363 886 H THR1023 H THR1023 -1.085 16.507 7.027 887 HA THR1023 HA THR1023 -1.056 14.384 8.707 888 HB THR1023 HB THR1023 -3.601 15.660 7.591 889 HG1 THR1023 HG1 THR1023 -1.541 16.553 9.486 890 1HG2 THR1023 1HG2 THR1023 -2.922 15.296 10.512 891 2HG2 THR1023 2HG2 THR1023 -4.515 15.276 9.716 892 3HG2 THR1023 3HG2 THR1023 -3.443 13.860 9.598 893 H ALA1024 H ALA1024 -2.837 14.518 5.554 894 HA ALA1024 HA ALA1024 -3.852 11.927 5.751 895 1HB ALA1024 1HB ALA1024 -3.384 12.616 3.015 896 2HB ALA1024 2HB ALA1024 -4.905 12.719 3.934 897 3HB ALA1024 3HB ALA1024 -3.798 14.112 3.886 898 H ALA1025 H ALA1025 -0.772 13.243 4.417 899 HA ALA1025 HA ALA1025 0.161 10.976 3.180 900 1HB ALA1025 1HB ALA1025 1.115 13.536 3.945 901 2HB ALA1025 2HB ALA1025 2.292 12.356 4.571 902 3HB ALA1025 3HB ALA1025 1.885 12.374 2.838 903 H HIS1026 H HIS1026 0.048 11.842 6.654 904 HA HIS1026 HA HIS1026 1.750 9.794 7.515 905 1HB HIS1026 1HB HIS1026 0.274 11.920 8.650 906 2HB HIS1026 2HB HIS1026 -0.272 10.469 9.467 907 HD1 HIS1026 HD1 HIS1026 3.059 12.154 8.575 908 HD2 HIS1026 HD2 HIS1026 1.364 9.687 11.515 909 HE1 HIS1026 HE1 HIS1026 4.846 11.851 10.372 910 H ALA1027 H ALA1027 -1.877 10.029 7.429 911 HA ALA1027 HA ALA1027 -2.270 7.376 8.258 912 1HB ALA1027 1HB ALA1027 -4.162 8.643 8.556 913 2HB ALA1027 2HB ALA1027 -3.885 9.602 7.083 914 3HB ALA1027 3HB ALA1027 -4.558 7.959 6.961 915 H LEU1028 H LEU1028 -1.658 8.923 5.103 916 HA LEU1028 HA LEU1028 -2.519 6.844 3.472 917 1HB LEU1028 1HB LEU1028 -0.688 9.171 3.231 918 2HB LEU1028 2HB LEU1028 -0.539 7.912 2.021 919 HG LEU1028 HG LEU1028 -2.946 9.629 2.636 920 1HD1 LEU1028 1HD1 LEU1028 -1.662 9.169 -0.049 921 2HD1 LEU1028 2HD1 LEU1028 -2.688 10.518 0.497 922 3HD1 LEU1028 3HD1 LEU1028 -1.017 10.370 1.095 923 1HD2 LEU1028 1HD2 LEU1028 -2.818 7.033 1.111 924 2HD2 LEU1028 2HD2 LEU1028 -3.975 7.550 2.362 925 3HD2 LEU1028 3HD2 LEU1028 -4.034 8.279 0.739 926 H ALA1029 H ALA1029 0.911 7.613 4.413 927 HA ALA1029 HA ALA1029 2.148 5.437 3.476 928 1HB ALA1029 1HB ALA1029 3.863 6.219 4.727 929 2HB ALA1029 2HB ALA1029 2.731 7.493 5.242 930 3HB ALA1029 3HB ALA1029 2.951 6.039 6.245 931 H VAL1030 H VAL1030 0.090 5.614 6.422 932 HA VAL1030 HA VAL1030 0.655 2.927 7.179 933 HB VAL1030 HB VAL1030 -1.259 5.077 8.021 934 1HG1 VAL1030 1HG1 VAL1030 -2.722 3.291 8.304 935 2HG1 VAL1030 2HG1 VAL1030 -1.415 2.144 8.684 936 3HG1 VAL1030 3HG1 VAL1030 -1.903 3.366 9.883 937 1HG2 VAL1030 1HG2 VAL1030 1.015 3.574 9.347 938 2HG2 VAL1030 2HG2 VAL1030 0.943 5.299 8.917 939 3HG2 VAL1030 3HG2 VAL1030 -0.085 4.664 10.224 940 H ASP1031 H ASP1031 -2.114 4.629 5.572 941 HA ASP1031 HA ASP1031 -3.853 2.643 5.332 942 1HB ASP1031 1HB ASP1031 -2.997 4.856 3.475 943 2HB ASP1031 2HB ASP1031 -4.102 3.658 2.832 944 H ALA1032 H ALA1032 -1.217 3.383 2.912 945 HA ALA1032 HA ALA1032 -1.601 1.156 1.317 946 1HB ALA1032 1HB ALA1032 0.759 1.623 0.597 947 2HB ALA1032 2HB ALA1032 -0.278 3.070 0.620 948 3HB ALA1032 3HB ALA1032 0.891 2.791 1.934 949 H LYS1033 H LYS1033 0.102 1.577 4.424 950 HA LYS1033 HA LYS1033 1.533 -0.842 4.316 951 1HB LYS1033 1HB LYS1033 1.369 1.378 6.006 952 2HB LYS1033 2HB LYS1033 0.819 0.044 7.000 953 1HG LYS1033 1HG LYS1033 3.147 -0.057 7.310 954 2HG LYS1033 2HG LYS1033 2.904 -1.243 6.043 955 1HD LYS1033 1HD LYS1033 3.203 1.303 4.749 956 2HD LYS1033 2HD LYS1033 4.465 1.200 5.960 957 1HE LYS1033 1HE LYS1033 3.962 -1.201 4.189 958 2HE LYS1033 2HE LYS1033 4.821 0.171 3.517 959 1HZ LYS1033 1HZ LYS1033 6.463 -0.025 5.161 960 2HZ LYS1033 2HZ LYS1033 5.597 -1.084 6.053 961 3HZ LYS1033 3HZ LYS1033 6.215 -1.543 4.612 962 H ASN1034 H ASN1034 -1.465 0.022 6.190 963 HA ASN1034 HA ASN1034 -2.089 -2.324 7.201 964 1HB ASN1034 1HB ASN1034 -3.448 -0.015 6.961 965 2HB ASN1034 2HB ASN1034 -4.301 -0.888 5.703 966 1HD2 ASN1034 1HD2 ASN1034 -5.886 -0.188 7.569 967 2HD2 ASN1034 2HD2 ASN1034 -6.292 -1.440 8.694 968 H LEU1035 H LEU1035 -2.508 -1.283 3.772 969 HA LEU1035 HA LEU1035 -4.045 -3.349 2.823 970 1HB LEU1035 1HB LEU1035 -3.345 -1.250 1.656 971 2HB LEU1035 2HB LEU1035 -1.777 -1.980 1.374 972 HG LEU1035 HG LEU1035 -4.276 -3.373 0.442 973 1HD1 LEU1035 1HD1 LEU1035 -4.377 -2.177 -1.572 974 2HD1 LEU1035 2HD1 LEU1035 -4.227 -0.928 -0.313 975 3HD1 LEU1035 3HD1 LEU1035 -2.809 -1.384 -1.288 976 1HD2 LEU1035 1HD2 LEU1035 -1.362 -3.609 0.014 977 2HD2 LEU1035 2HD2 LEU1035 -2.641 -4.846 -0.023 978 3HD2 LEU1035 3HD2 LEU1035 -2.372 -3.801 -1.438 979 H LEU1036 H LEU1036 -0.422 -3.169 2.541 980 HA LEU1036 HA LEU1036 -0.207 -5.897 1.911 981 1HB LEU1036 1HB LEU1036 1.388 -3.773 1.649 982 2HB LEU1036 2HB LEU1036 2.073 -4.423 3.126 983 HG LEU1036 HG LEU1036 1.822 -6.628 1.388 984 1HD1 LEU1036 1HD1 LEU1036 3.529 -4.984 -0.253 985 2HD1 LEU1036 2HD1 LEU1036 2.129 -5.982 -0.712 986 3HD1 LEU1036 3HD1 LEU1036 1.888 -4.298 -0.186 987 1HD2 LEU1036 1HD2 LEU1036 4.477 -5.961 1.295 988 2HD2 LEU1036 2HD2 LEU1036 3.928 -5.103 2.755 989 3HD2 LEU1036 3HD2 LEU1036 3.682 -6.860 2.610 990 H ASP1037 H ASP1037 0.035 -4.032 4.981 991 HA ASP1037 HA ASP1037 1.078 -5.757 6.664 992 1HB ASP1037 1HB ASP1037 -0.274 -3.498 7.019 993 2HB ASP1037 2HB ASP1037 -1.614 -4.565 7.386 994 H VAL1038 H VAL1038 -2.408 -5.755 5.601 995 HA VAL1038 HA VAL1038 -3.151 -8.040 7.021 996 HB VAL1038 HB VAL1038 -4.264 -6.854 4.470 997 1HG1 VAL1038 1HG1 VAL1038 -5.865 -8.443 6.463 998 2HG1 VAL1038 2HG1 VAL1038 -6.193 -8.119 4.744 999 3HG1 VAL1038 3HG1 VAL1038 -4.921 -9.275 5.204 1000 1HG2 VAL1038 1HG2 VAL1038 -4.234 -5.903 7.201 1001 2HG2 VAL1038 2HG2 VAL1038 -4.880 -5.124 5.737 1002 3HG2 VAL1038 3HG2 VAL1038 -5.903 -6.234 6.679 1003 H ILE1039 H ILE1039 -1.786 -7.555 3.723 1004 HA ILE1039 HA ILE1039 -2.107 -10.172 2.843 1005 HB ILE1039 HB ILE1039 -0.423 -7.835 2.120 1006 1HG1 ILE1039 1HG1 ILE1039 -2.151 -9.627 0.400 1007 2HG1 ILE1039 2HG1 ILE1039 -2.799 -8.289 1.328 1008 1HG2 ILE1039 1HG2 ILE1039 0.402 -9.532 0.204 1009 2HG2 ILE1039 2HG2 ILE1039 1.337 -9.183 1.678 1010 3HG2 ILE1039 3HG2 ILE1039 0.336 -10.653 1.586 1011 1HD1 ILE1039 1HD1 ILE1039 -0.779 -8.184 -0.942 1012 2HD1 ILE1039 2HD1 ILE1039 -2.363 -7.381 -0.836 1013 3HD1 ILE1039 3HD1 ILE1039 -1.009 -6.814 0.171 1014 H ASP1040 H ASP1040 0.502 -8.588 4.760 1015 HA ASP1040 HA ASP1040 2.325 -10.590 4.702 1016 1HB ASP1040 1HB ASP1040 1.883 -8.217 6.170 1017 2HB ASP1040 2HB ASP1040 2.017 -9.456 7.402 1018 H GLN1041 H GLN1041 -0.667 -10.199 6.668 1019 HA GLN1041 HA GLN1041 -0.113 -12.408 8.333 1020 1HB GLN1041 1HB GLN1041 -2.407 -10.533 7.876 1021 2HB GLN1041 2HB GLN1041 -2.794 -12.073 8.617 1022 1HG GLN1041 1HG GLN1041 -2.127 -11.173 10.593 1023 2HG GLN1041 2HG GLN1041 -0.483 -11.274 9.993 1024 1HE2 GLN1041 1HE2 GLN1041 -3.356 -9.242 10.180 1025 2HE2 GLN1041 2HE2 GLN1041 -2.569 -7.706 10.048 1026 H ALA1042 H ALA1042 -1.312 -12.011 5.092 1027 HA ALA1042 HA ALA1042 -2.711 -14.556 5.122 1028 1HB ALA1042 1HB ALA1042 -2.799 -12.109 3.603 1029 2HB ALA1042 2HB ALA1042 -2.476 -13.467 2.497 1030 3HB ALA1042 3HB ALA1042 -3.912 -13.498 3.549 1031 H ARG1043 H ARG1043 0.285 -13.000 3.889 1032 HA ARG1043 HA ARG1043 1.113 -14.920 2.183 1033 1HB ARG1043 1HB ARG1043 2.222 -12.666 2.804 1034 2HB ARG1043 2HB ARG1043 2.971 -13.501 4.151 1035 1HG ARG1043 1HG ARG1043 4.123 -15.049 2.640 1036 2HG ARG1043 2HG ARG1043 3.242 -14.432 1.256 1037 1HD ARG1043 1HD ARG1043 4.604 -12.594 1.045 1038 2HD ARG1043 2HD ARG1043 4.664 -12.314 2.773 1039 HE ARG1043 HE ARG1043 6.148 -14.702 2.086 1040 1HH1 ARG1043 2HH2 ARG1043 6.338 -11.189 2.008 1041 2HH1 ARG1043 1HH2 ARG1043 8.069 -11.154 2.057 1042 1HH2 ARG1043 2HH1 ARG1043 8.431 -14.656 2.151 1043 2HH2 ARG1043 1HH1 ARG1043 9.268 -13.139 2.139 1044 H LEU1044 H LEU1044 1.854 -14.679 5.742 1045 HA LEU1044 HA LEU1044 3.194 -17.156 5.829 1046 1HB LEU1044 1HB LEU1044 3.581 -16.665 7.990 1047 2HB LEU1044 2HB LEU1044 3.185 -15.058 7.413 1048 HG LEU1044 HG LEU1044 2.097 -15.384 9.510 1049 1HD1 LEU1044 1HD1 LEU1044 -0.387 -15.786 8.096 1050 2HD1 LEU1044 2HD1 LEU1044 0.286 -14.305 8.819 1051 3HD1 LEU1044 3HD1 LEU1044 0.711 -14.753 7.149 1052 1HD2 LEU1044 1HD2 LEU1044 0.245 -17.521 8.889 1053 2HD2 LEU1044 2HD2 LEU1044 1.932 -18.073 8.754 1054 3HD2 LEU1044 3HD2 LEU1044 1.355 -17.335 10.268 1055 H LYS1045 H LYS1045 -0.207 -16.133 6.149 1056 HA LYS1045 HA LYS1045 -1.285 -18.303 7.399 1057 1HB LYS1045 1HB LYS1045 -2.434 -16.182 6.689 1058 2HB LYS1045 2HB LYS1045 -2.516 -16.821 5.059 1059 1HG LYS1045 1HG LYS1045 -3.492 -18.668 7.198 1060 2HG LYS1045 2HG LYS1045 -4.453 -17.221 6.969 1061 1HD LYS1045 1HD LYS1045 -4.435 -17.769 4.442 1062 2HD LYS1045 2HD LYS1045 -3.760 -19.327 4.876 1063 1HE LYS1045 1HE LYS1045 -6.306 -18.326 6.203 1064 2HE LYS1045 2HE LYS1045 -6.368 -19.101 4.633 1065 1HZ LYS1045 1HZ LYS1045 -5.416 -20.247 7.152 1066 2HZ LYS1045 2HZ LYS1045 -6.617 -20.787 6.186 1067 3HZ LYS1045 3HZ LYS1045 -5.061 -20.934 5.714 1068 H MET1046 H MET1046 0.187 -18.082 4.204 1069 HA MET1046 HA MET1046 -1.005 -20.521 3.325 1070 1HB MET1046 1HB MET1046 -0.252 -18.520 1.862 1071 2HB MET1046 2HB MET1046 1.401 -19.012 2.171 1072 1HG MET1046 1HG MET1046 0.048 -21.385 1.359 1073 2HG MET1046 2HG MET1046 -0.524 -20.132 0.276 1074 1HE MET1046 1HE MET1046 1.417 -18.132 0.294 1075 2HE MET1046 2HE MET1046 3.048 -18.459 -0.340 1076 3HE MET1046 3HE MET1046 1.632 -18.605 -1.408 1077 H ILE1047 H ILE1047 1.913 -19.481 5.026 1078 HA ILE1047 HA ILE1047 3.566 -21.640 4.432 1079 HB ILE1047 HB ILE1047 3.409 -19.938 6.922 1080 1HG1 ILE1047 1HG1 ILE1047 3.675 -18.786 4.645 1081 2HG1 ILE1047 2HG1 ILE1047 4.836 -18.403 5.901 1082 1HG2 ILE1047 1HG2 ILE1047 6.044 -20.676 6.545 1083 2HG2 ILE1047 2HG2 ILE1047 4.917 -21.363 7.740 1084 3HG2 ILE1047 3HG2 ILE1047 5.144 -22.165 6.167 1085 1HD1 ILE1047 1HD1 ILE1047 6.561 -19.206 4.667 1086 2HD1 ILE1047 2HD1 ILE1047 5.709 -20.738 4.363 1087 3HD1 ILE1047 3HD1 ILE1047 5.419 -19.334 3.308 1088 H SER1048 H SER1048 1.511 -21.119 7.390 1089 HA SER1048 HA SER1048 1.800 -23.873 8.040 1090 1HB SER1048 1HB SER1048 0.955 -21.441 9.363 1091 2HB SER1048 2HB SER1048 -0.291 -22.654 9.580 1092 HG SER1048 HG SER1048 1.857 -24.043 10.045 1093 H GLN1049 H GLN1049 0.859 -24.730 5.979 1094 HA GLN1049 HA GLN1049 -1.751 -25.531 6.344 1095 1HB GLN1049 1HB GLN1049 -2.462 -23.282 5.760 1096 2HB GLN1049 2HB GLN1049 -1.416 -23.249 4.355 1097 1HG GLN1049 1HG GLN1049 -3.546 -23.744 3.440 1098 2HG GLN1049 2HG GLN1049 -2.763 -25.311 3.509 1099 1HE2 GLN1049 1HE2 GLN1049 -5.138 -25.837 3.353 1100 2HE2 GLN1049 2HE2 GLN1049 -6.003 -26.095 4.831 1101 H SER1050 H SER1050 0.094 -24.444 3.397 1102 HA SER1050 HA SER1050 1.034 -27.029 2.881 1103 1HB SER1050 1HB SER1050 -1.386 -27.352 2.273 1104 2HB SER1050 2HB SER1050 -1.237 -26.077 1.080 1105 HG SER1050 HG SER1050 -0.127 -27.378 -0.256 1106 H ARG1051 H ARG1051 3.039 -26.302 2.233 1107 HA ARG1051 HA ARG1051 3.562 -23.871 1.177 1108 1HB ARG1051 1HB ARG1051 5.723 -24.909 0.367 1109 2HB ARG1051 2HB ARG1051 5.340 -25.317 2.027 1110 1HG ARG1051 1HG ARG1051 5.621 -27.489 1.408 1111 2HG ARG1051 2HG ARG1051 4.058 -27.353 0.626 1112 1HD ARG1051 1HD ARG1051 4.981 -27.447 -1.459 1113 2HD ARG1051 2HD ARG1051 6.185 -26.236 -1.068 1114 HE ARG1051 HE ARG1051 7.091 -28.470 0.292 1115 1HH1 ARG1051 2HH2 ARG1051 6.176 -27.864 -3.052 1116 2HH1 ARG1051 1HH2 ARG1051 7.259 -29.052 -3.697 1117 1HH2 ARG1051 2HH1 ARG1051 8.519 -30.038 -0.559 1118 2HH2 ARG1051 1HH1 ARG1051 8.600 -30.297 -2.270 1119 HA PRO1052 HA PRO1052 2.365 -24.153 -3.009 1120 1HB PRO1052 1HB PRO1052 3.897 -22.194 -4.141 1121 2HB PRO1052 2HB PRO1052 2.417 -21.865 -3.262 1122 1HG PRO1052 1HG PRO1052 5.215 -21.454 -2.400 1123 2HG PRO1052 2HG PRO1052 3.749 -20.758 -1.739 1124 1HD PRO1052 1HD PRO1052 5.287 -22.904 -0.618 1125 2HD PRO1052 2HD PRO1052 3.761 -22.285 -0.020 1126 H HIS1053 H HIS1053 5.839 -23.495 -3.128 1127 HA HIS1053 HA HIS1053 6.000 -25.807 -4.919 1128 1HB HIS1053 1HB HIS1053 6.757 -23.177 -5.371 1129 2HB HIS1053 2HB HIS1053 8.269 -23.951 -4.940 1130 HD1 HIS1053 HD1 HIS1053 5.517 -25.739 -6.860 1131 HD2 HIS1053 HD2 HIS1053 9.302 -24.055 -7.523 1132 HE1 HIS1053 HE1 HIS1053 6.204 -26.431 -9.217 Start of MODEL 19 1 H MET 915 H MET 915 9.757 -20.810 5.578 2 HA MET 915 HA MET 915 11.698 -18.973 4.414 3 1HB MET 915 1HB MET 915 11.624 -21.908 5.010 4 2HB MET 915 2HB MET 915 12.320 -21.511 3.451 5 1HG MET 915 1HG MET 915 13.830 -19.826 4.646 6 2HG MET 915 2HG MET 915 13.221 -20.445 6.169 7 1HE MET 915 1HE MET 915 15.839 -20.129 4.429 8 2HE MET 915 2HE MET 915 16.892 -21.492 4.878 9 3HE MET 915 3HE MET 915 16.083 -21.477 3.292 10 H ALA 916 H ALA 916 9.557 -18.142 3.324 11 HA ALA 916 HA ALA 916 8.910 -19.836 1.020 12 1HB ALA 916 1HB ALA 916 7.246 -18.641 2.814 13 2HB ALA 916 2HB ALA 916 7.359 -17.360 1.584 14 3HB ALA 916 3HB ALA 916 6.795 -18.985 1.127 15 H ASN 917 H ASN 917 10.451 -19.430 -0.535 16 HA ASN 917 HA ASN 917 11.367 -16.738 -0.867 17 1HB ASN 917 1HB ASN 917 12.031 -19.420 -2.151 18 2HB ASN 917 2HB ASN 917 12.630 -17.935 -2.863 19 1HD2 ASN 917 1HD2 ASN 917 14.621 -17.527 -2.324 20 2HD2 ASN 917 2HD2 ASN 917 15.375 -17.785 -0.786 21 H LEU 918 H LEU 918 8.909 -16.210 -1.403 22 HA LEU 918 HA LEU 918 8.549 -16.562 -4.296 23 1HB LEU 918 1HB LEU 918 6.718 -17.140 -2.053 24 2HB LEU 918 2HB LEU 918 6.012 -16.249 -3.386 25 HG LEU 918 HG LEU 918 7.231 -18.196 -4.793 26 1HD1 LEU 918 1HD1 LEU 918 6.422 -19.617 -2.246 27 2HD1 LEU 918 2HD1 LEU 918 7.156 -20.317 -3.709 28 3HD1 LEU 918 3HD1 LEU 918 8.105 -19.223 -2.674 29 1HD2 LEU 918 1HD2 LEU 918 4.842 -19.423 -4.139 30 2HD2 LEU 918 2HD2 LEU 918 4.538 -17.709 -3.770 31 3HD2 LEU 918 3HD2 LEU 918 5.084 -18.186 -5.395 32 H ASP 919 H ASP 919 10.069 -14.481 -3.549 33 HA ASP 919 HA ASP 919 8.227 -12.260 -3.227 34 1HB ASP 919 1HB ASP 919 10.468 -10.971 -2.936 35 2HB ASP 919 2HB ASP 919 9.967 -12.042 -1.642 36 H ARG 920 H ARG 920 8.226 -13.591 -5.750 37 HA ARG 920 HA ARG 920 10.079 -12.235 -7.444 38 1HB ARG 920 1HB ARG 920 8.881 -14.669 -7.625 39 2HB ARG 920 2HB ARG 920 7.723 -13.746 -8.563 40 1HG ARG 920 1HG ARG 920 10.693 -13.474 -9.127 41 2HG ARG 920 2HG ARG 920 9.801 -14.835 -9.776 42 1HD ARG 920 1HD ARG 920 8.393 -13.448 -11.108 43 2HD ARG 920 2HD ARG 920 8.732 -12.018 -10.153 44 HE ARG 920 HE ARG 920 10.722 -11.682 -11.367 45 1HH1 ARG 920 2HH2 ARG 920 9.437 -14.907 -12.073 46 2HH1 ARG 920 1HH2 ARG 920 10.535 -15.194 -13.382 47 1HH2 ARG 920 1HH1 ARG 920 12.133 -13.506 -13.964 48 H SER 921 H SER 921 6.445 -12.582 -7.444 49 HA SER 921 HA SER 921 6.266 -10.106 -8.878 50 1HB SER 921 1HB SER 921 4.192 -12.135 -7.952 51 2HB SER 921 2HB SER 921 3.759 -10.652 -8.778 52 HG SER 921 HG SER 921 4.989 -11.324 -10.615 53 H ASN 922 H ASN 922 6.028 -11.339 -5.596 54 HA ASN 922 HA ASN 922 4.328 -9.373 -4.583 55 1HB ASN 922 1HB ASN 922 5.621 -11.670 -3.606 56 2HB ASN 922 2HB ASN 922 6.400 -10.382 -2.710 57 1HD2 ASN 922 1HD2 ASN 922 5.050 -12.040 -1.234 58 2HD2 ASN 922 2HD2 ASN 922 3.532 -11.413 -0.686 59 H ASP 923 H ASP 923 7.547 -9.297 -5.800 60 HA ASP 923 HA ASP 923 8.623 -7.413 -4.004 61 1HB ASP 923 1HB ASP 923 9.844 -9.031 -5.637 62 2HB ASP 923 2HB ASP 923 9.479 -7.864 -6.892 63 H LYS 924 H LYS 924 7.122 -7.353 -7.306 64 HA LYS 924 HA LYS 924 7.486 -4.632 -7.793 65 1HB LYS 924 1HB LYS 924 6.593 -6.765 -9.223 66 2HB LYS 924 2HB LYS 924 5.076 -5.944 -8.917 67 1HG LYS 924 1HG LYS 924 7.253 -4.092 -9.694 68 2HG LYS 924 2HG LYS 924 6.906 -5.290 -10.925 69 1HD LYS 924 1HD LYS 924 4.350 -4.498 -10.104 70 2HD LYS 924 2HD LYS 924 5.262 -3.005 -10.010 71 1HE LYS 924 1HE LYS 924 6.107 -4.167 -12.442 72 2HE LYS 924 2HE LYS 924 4.388 -4.505 -12.386 73 1HZ LYS 924 1HZ LYS 924 4.643 -2.404 -13.339 74 2HZ LYS 924 2HZ LYS 924 4.111 -2.107 -11.823 75 3HZ LYS 924 3HZ LYS 924 5.686 -1.884 -12.195 76 H VAL 925 H VAL 925 4.640 -6.436 -6.440 77 HA VAL 925 HA VAL 925 3.056 -4.204 -6.016 78 HB VAL 925 HB VAL 925 3.147 -6.690 -4.304 79 1HG1 VAL 925 1HG1 VAL 925 0.694 -5.176 -5.199 80 2HG1 VAL 925 2HG1 VAL 925 0.892 -6.287 -3.822 81 3HG1 VAL 925 3HG1 VAL 925 1.624 -4.665 -3.770 82 1HG2 VAL 925 1HG2 VAL 925 2.498 -6.372 -7.173 83 2HG2 VAL 925 2HG2 VAL 925 2.968 -7.820 -6.252 84 3HG2 VAL 925 3HG2 VAL 925 1.282 -7.250 -6.214 85 H TYR 926 H TYR 926 5.490 -5.810 -3.873 86 HA TYR 926 HA TYR 926 5.069 -4.102 -1.687 87 1HB TYR 926 1HB TYR 926 7.273 -5.903 -2.813 88 2HB TYR 926 2HB TYR 926 7.606 -4.966 -1.369 89 HD1 TYR 926 HD1 TYR 926 4.324 -6.509 -2.195 90 HD2 TYR 926 HD2 TYR 926 7.871 -6.751 0.185 91 HE1 TYR 926 HE1 TYR 926 3.251 -8.319 -0.768 92 HE2 TYR 926 HE2 TYR 926 6.786 -8.560 1.604 93 HH TYR 926 HH TYR 926 3.689 -9.075 1.806 94 H GLU 927 H GLU 927 6.921 -3.774 -4.699 95 HA GLU 927 HA GLU 927 8.623 -1.761 -3.760 96 1HB GLU 927 1HB GLU 927 7.870 -2.934 -6.403 97 2HB GLU 927 2HB GLU 927 8.526 -1.310 -6.455 98 1HG GLU 927 1HG GLU 927 10.001 -3.196 -4.674 99 2HG GLU 927 2HG GLU 927 10.054 -3.604 -6.377 100 H ASN 928 H ASN 928 5.874 -1.491 -6.137 101 HA ASN 928 HA ASN 928 5.667 1.147 -6.252 102 1HB ASN 928 1HB ASN 928 3.252 -0.708 -5.921 103 2HB ASN 928 2HB ASN 928 3.259 0.833 -6.754 104 1HD2 ASN 928 1HD2 ASN 928 4.510 1.079 -8.673 105 2HD2 ASN 928 2HD2 ASN 928 4.858 -0.273 -9.699 106 H VAL 929 H VAL 929 3.987 -1.000 -3.828 107 HA VAL 929 HA VAL 929 2.619 0.799 -2.375 108 HB VAL 929 HB VAL 929 4.262 -1.554 -1.424 109 1HG1 VAL 929 1HG1 VAL 929 3.543 -1.268 0.680 110 2HG1 VAL 929 2HG1 VAL 929 3.121 0.392 0.195 111 3HG1 VAL 929 3HG1 VAL 929 1.886 -0.890 0.150 112 1HG2 VAL 929 1HG2 VAL 929 2.185 -1.586 -3.169 113 2HG2 VAL 929 2HG2 VAL 929 2.552 -2.909 -2.036 114 3HG2 VAL 929 3HG2 VAL 929 1.306 -1.705 -1.626 115 H THR 930 H THR 930 6.076 -0.127 -1.709 116 HA THR 930 HA THR 930 6.422 1.959 0.173 117 HB THR 930 HB THR 930 8.921 1.259 -0.348 118 HG1 THR 930 HG1 THR 930 8.674 -0.961 -1.447 119 1HG2 THR 930 1HG2 THR 930 7.071 0.183 1.378 120 2HG2 THR 930 2HG2 THR 930 7.369 -1.216 0.317 121 3HG2 THR 930 3HG2 THR 930 8.721 -0.461 1.195 122 H GLY 931 H GLY 931 7.865 1.581 -3.139 123 1HA GLY 931 1HA GLY 931 9.071 3.914 -3.512 124 2HA GLY 931 2HA GLY 931 8.085 3.172 -4.756 125 H LEU 932 H LEU 932 5.475 3.458 -3.764 126 HA LEU 932 HA LEU 932 5.013 6.188 -4.347 127 1HB LEU 932 1HB LEU 932 2.956 5.496 -4.774 128 2HB LEU 932 2HB LEU 932 3.601 3.879 -4.573 129 HG LEU 932 HG LEU 932 2.905 3.965 -2.160 130 1HD1 LEU 932 1HD1 LEU 932 2.189 5.835 -1.208 131 2HD1 LEU 932 2HD1 LEU 932 2.502 6.702 -2.731 132 3HD1 LEU 932 3HD1 LEU 932 0.895 6.003 -2.419 133 1HD2 LEU 932 1HD2 LEU 932 0.860 4.165 -4.373 134 2HD2 LEU 932 2HD2 LEU 932 1.533 2.709 -3.601 135 3HD2 LEU 932 3HD2 LEU 932 0.422 3.764 -2.695 136 H VAL 933 H VAL 933 4.654 4.166 -1.356 137 HA VAL 933 HA VAL 933 3.754 6.185 0.296 138 HB VAL 933 HB VAL 933 5.001 3.534 0.550 139 1HG1 VAL 933 1HG1 VAL 933 5.434 5.664 2.625 140 2HG1 VAL 933 2HG1 VAL 933 5.142 3.984 3.136 141 3HG1 VAL 933 3HG1 VAL 933 6.523 4.367 2.080 142 1HG2 VAL 933 1HG2 VAL 933 2.591 5.007 1.527 143 2HG2 VAL 933 2HG2 VAL 933 2.726 3.402 0.769 144 3HG2 VAL 933 3HG2 VAL 933 3.162 3.617 2.482 145 H LYS 934 H LYS 934 6.981 5.509 -1.007 146 HA LYS 934 HA LYS 934 8.444 6.993 0.865 147 1HB LYS 934 1HB LYS 934 9.003 6.261 -2.023 148 2HB LYS 934 2HB LYS 934 10.171 7.028 -0.966 149 1HG LYS 934 1HG LYS 934 8.961 4.740 0.386 150 2HG LYS 934 2HG LYS 934 9.592 4.246 -1.173 151 1HD LYS 934 1HD LYS 934 11.259 5.955 0.710 152 2HD LYS 934 2HD LYS 934 11.202 4.213 0.894 153 1HE LYS 934 1HE LYS 934 12.706 3.960 -0.785 154 2HE LYS 934 2HE LYS 934 11.626 4.770 -1.903 155 1HZ LYS 934 1HZ LYS 934 12.666 6.761 -0.376 156 2HZ LYS 934 2HZ LYS 934 13.938 5.771 -0.639 157 3HZ LYS 934 3HZ LYS 934 13.107 6.385 -1.903 158 H ALA 935 H ALA 935 6.964 7.870 -2.323 159 HA ALA 935 HA ALA 935 7.837 10.535 -2.257 160 1HB ALA 935 1HB ALA 935 6.494 10.790 -4.171 161 2HB ALA 935 2HB ALA 935 6.909 9.059 -4.194 162 3HB ALA 935 3HB ALA 935 5.309 9.583 -3.617 163 H VAL 936 H VAL 936 4.840 8.879 -1.116 164 HA VAL 936 HA VAL 936 3.232 10.933 -0.519 165 HB VAL 936 HB VAL 936 3.892 8.445 1.049 166 1HG1 VAL 936 1HG1 VAL 936 1.879 10.604 1.648 167 2HG1 VAL 936 2HG1 VAL 936 1.538 8.909 2.071 168 3HG1 VAL 936 3HG1 VAL 936 2.963 9.728 2.754 169 1HG2 VAL 936 1HG2 VAL 936 1.970 9.198 -1.109 170 2HG2 VAL 936 2HG2 VAL 936 2.866 7.682 -0.847 171 3HG2 VAL 936 3HG2 VAL 936 1.418 8.039 0.125 172 H ILE 937 H ILE 937 6.049 9.826 1.472 173 HA ILE 937 HA ILE 937 5.680 12.070 3.251 174 HB ILE 937 HB ILE 937 7.466 9.671 3.140 175 1HG1 ILE 937 1HG1 ILE 937 6.379 10.136 5.704 176 2HG1 ILE 937 2HG1 ILE 937 5.093 10.501 4.571 177 1HG2 ILE 937 1HG2 ILE 937 9.110 11.187 3.752 178 2HG2 ILE 937 2HG2 ILE 937 7.974 12.222 4.648 179 3HG2 ILE 937 3HG2 ILE 937 8.467 10.650 5.322 180 1HD1 ILE 937 1HD1 ILE 937 6.730 8.012 4.100 181 2HD1 ILE 937 2HD1 ILE 937 5.513 8.002 5.399 182 3HD1 ILE 937 3HD1 ILE 937 5.020 8.328 3.720 183 H GLU 938 H GLU 938 8.388 10.840 1.153 184 HA GLU 938 HA GLU 938 10.091 12.826 1.301 185 1HB GLU 938 1HB GLU 938 9.845 10.733 -0.365 186 2HB GLU 938 2HB GLU 938 9.380 11.984 -1.501 187 1HG GLU 938 1HG GLU 938 11.545 12.597 -1.771 188 2HG GLU 938 2HG GLU 938 11.698 12.922 -0.056 189 H MET 939 H MET 939 7.126 12.896 -0.788 190 HA MET 939 HA MET 939 7.494 15.263 -2.010 191 1HB MET 939 1HB MET 939 5.562 13.806 -2.452 192 2HB MET 939 2HB MET 939 4.966 14.007 -0.817 193 1HG MET 939 1HG MET 939 4.829 16.560 -1.382 194 2HG MET 939 2HG MET 939 5.013 16.070 -3.055 195 1HE MET 939 1HE MET 939 1.997 13.684 -3.598 196 2HE MET 939 2HE MET 939 3.655 14.123 -4.074 197 3HE MET 939 3HE MET 939 3.384 13.043 -2.685 198 H SER 940 H SER 940 5.588 14.869 1.073 199 HA SER 940 HA SER 940 5.130 17.437 1.612 200 1HB SER 940 1HB SER 940 5.077 16.805 4.011 201 2HB SER 940 2HB SER 940 4.316 15.586 3.008 202 HG SER 940 HG SER 940 5.626 14.304 4.169 203 H SER 941 H SER 941 8.224 15.684 1.906 204 HA SER 941 HA SER 941 9.521 17.570 3.486 205 1HB SER 941 1HB SER 941 10.126 15.080 2.398 206 2HB SER 941 2HB SER 941 11.216 16.138 1.524 207 HG SER 941 HG SER 941 11.001 16.444 4.362 208 H LYS 942 H LYS 942 9.072 17.192 -0.065 209 HA LYS 942 HA LYS 942 10.415 19.783 -0.405 210 1HB LYS 942 1HB LYS 942 10.811 19.040 -2.752 211 2HB LYS 942 2HB LYS 942 11.655 18.089 -1.547 212 1HG LYS 942 1HG LYS 942 10.438 16.187 -1.993 213 2HG LYS 942 2HG LYS 942 8.939 17.068 -2.209 214 1HD LYS 942 1HD LYS 942 10.973 17.595 -4.318 215 2HD LYS 942 2HD LYS 942 10.418 15.934 -4.259 216 1HE LYS 942 1HE LYS 942 8.106 16.591 -4.564 217 2HE LYS 942 2HE LYS 942 8.469 18.278 -4.260 218 1HZ LYS 942 1HZ LYS 942 8.848 18.500 -6.400 219 2HZ LYS 942 2HZ LYS 942 10.085 17.434 -6.339 220 3HZ LYS 942 3HZ LYS 942 8.574 16.913 -6.674 221 H ILE 943 H ILE 943 7.592 19.177 0.470 222 HA ILE 943 HA ILE 943 6.106 20.037 -1.883 223 HB ILE 943 HB ILE 943 5.514 18.163 -0.090 224 1HG1 ILE 943 1HG1 ILE 943 4.301 19.149 -2.236 225 2HG1 ILE 943 2HG1 ILE 943 3.507 18.028 -1.148 226 1HG2 ILE 943 1HG2 ILE 943 5.458 19.581 1.851 227 2HG2 ILE 943 2HG2 ILE 943 4.314 20.694 1.062 228 3HG2 ILE 943 3HG2 ILE 943 3.801 19.043 1.485 229 1HD1 ILE 943 1HD1 ILE 943 2.114 20.058 -1.732 230 2HD1 ILE 943 2HD1 ILE 943 2.367 19.842 0.017 231 3HD1 ILE 943 3HD1 ILE 943 3.309 21.061 -0.874 232 H GLN 944 H GLN 944 6.825 21.024 1.525 233 HA GLN 944 HA GLN 944 5.390 23.278 1.662 234 1HB GLN 944 1HB GLN 944 7.545 22.121 3.078 235 2HB GLN 944 2HB GLN 944 8.083 23.749 2.714 236 1HG GLN 944 1HG GLN 944 5.470 24.218 3.497 237 2HG GLN 944 2HG GLN 944 5.877 22.837 4.497 238 1HE2 GLN 944 1HE2 GLN 944 8.613 23.242 4.816 239 2HE2 GLN 944 2HE2 GLN 944 8.893 24.642 5.796 240 HA PRO 945 HA PRO 945 8.780 25.649 -0.656 241 1HB PRO 945 1HB PRO 945 10.849 24.302 -1.828 242 2HB PRO 945 2HB PRO 945 10.958 25.031 -0.238 243 1HG PRO 945 1HG PRO 945 10.683 22.176 -0.953 244 2HG PRO 945 2HG PRO 945 11.213 22.882 0.561 245 1HD PRO 945 1HD PRO 945 8.644 21.731 0.010 246 2HD PRO 945 2HD PRO 945 9.136 22.541 1.485 247 H ALA 946 H ALA 946 8.512 22.488 -2.205 248 HA ALA 946 HA ALA 946 8.513 23.038 -4.771 249 1HB ALA 946 1HB ALA 946 6.268 21.524 -4.738 250 2HB ALA 946 2HB ALA 946 7.886 20.869 -4.393 251 3HB ALA 946 3HB ALA 946 6.797 21.303 -3.053 252 HA PRO 947 HA PRO 947 5.665 26.275 -5.377 253 1HB PRO 947 1HB PRO 947 5.970 26.552 -8.079 254 2HB PRO 947 2HB PRO 947 7.044 27.298 -6.912 255 1HG PRO 947 1HG PRO 947 7.520 24.935 -8.624 256 2HG PRO 947 2HG PRO 947 8.688 25.937 -7.786 257 1HD PRO 947 1HD PRO 947 7.788 23.330 -7.000 258 2HD PRO 947 2HD PRO 947 8.867 24.380 -6.104 259 HA PRO 948 HA PRO 948 1.986 24.732 -6.844 260 1HB PRO 948 1HB PRO 948 0.796 26.738 -8.269 261 2HB PRO 948 2HB PRO 948 0.807 26.683 -6.517 262 1HG PRO 948 1HG PRO 948 2.399 28.393 -8.328 263 2HG PRO 948 2HG PRO 948 2.078 28.604 -6.618 264 1HD PRO 948 1HD PRO 948 4.510 27.651 -7.802 265 2HD PRO 948 2HD PRO 948 4.148 27.753 -6.091 266 H GLU 949 H GLU 949 4.280 25.670 -9.137 267 HA GLU 949 HA GLU 949 2.771 24.510 -11.287 268 1HB GLU 949 1HB GLU 949 5.228 26.157 -11.001 269 2HB GLU 949 2HB GLU 949 5.302 24.976 -12.294 270 1HG GLU 949 1HG GLU 949 2.958 25.852 -13.009 271 2HG GLU 949 2HG GLU 949 3.247 27.191 -11.916 272 H GLU 950 H GLU 950 5.185 23.607 -8.905 273 HA GLU 950 HA GLU 950 5.836 21.234 -10.442 274 1HB GLU 950 1HB GLU 950 7.428 22.927 -8.929 275 2HB GLU 950 2HB GLU 950 7.145 21.611 -7.807 276 1HG GLU 950 1HG GLU 950 8.719 20.398 -8.895 277 2HG GLU 950 2HG GLU 950 7.670 20.350 -10.297 278 H TYR 951 H TYR 951 3.543 22.291 -8.235 279 HA TYR 951 HA TYR 951 3.492 19.831 -6.682 280 1HB TYR 951 1HB TYR 951 3.112 22.262 -5.827 281 2HB TYR 951 2HB TYR 951 1.648 22.297 -6.789 282 HD1 TYR 951 HD1 TYR 951 1.974 19.010 -5.634 283 HD2 TYR 951 HD2 TYR 951 0.939 22.930 -4.269 284 HE1 TYR 951 HE1 TYR 951 0.675 18.000 -3.695 285 HE2 TYR 951 HE2 TYR 951 -0.356 21.907 -2.335 286 HH TYR 951 HH TYR 951 -0.647 18.382 -2.025 287 H VAL 952 H VAL 952 1.604 21.624 -9.174 288 HA VAL 952 HA VAL 952 -0.682 20.127 -9.183 289 HB VAL 952 HB VAL 952 0.822 21.808 -11.075 290 1HG1 VAL 952 1HG1 VAL 952 -1.215 19.792 -12.077 291 2HG1 VAL 952 2HG1 VAL 952 -0.675 21.222 -12.991 292 3HG1 VAL 952 3HG1 VAL 952 0.489 19.943 -12.570 293 1HG2 VAL 952 1HG2 VAL 952 -1.064 23.122 -11.018 294 2HG2 VAL 952 2HG2 VAL 952 -2.164 21.733 -10.844 295 3HG2 VAL 952 3HG2 VAL 952 -1.213 22.295 -9.448 296 HA PRO 953 HA PRO 953 1.611 16.999 -11.904 297 1HB PRO 953 1HB PRO 953 4.339 17.074 -12.041 298 2HB PRO 953 2HB PRO 953 3.299 17.805 -13.247 299 1HG PRO 953 1HG PRO 953 4.879 19.117 -11.120 300 2HG PRO 953 2HG PRO 953 4.189 19.822 -12.569 301 1HD PRO 953 1HD PRO 953 3.174 20.055 -9.896 302 2HD PRO 953 2HD PRO 953 2.423 20.661 -11.359 303 H MET 954 H MET 954 3.808 17.855 -9.272 304 HA MET 954 HA MET 954 4.688 15.540 -8.472 305 1HB MET 954 1HB MET 954 4.027 18.049 -7.229 306 2HB MET 954 2HB MET 954 3.466 16.805 -6.130 307 1HG MET 954 1HG MET 954 5.605 16.055 -5.657 308 2HG MET 954 2HG MET 954 6.184 16.337 -7.287 309 1HE MET 954 1HE MET 954 5.768 19.336 -3.876 310 2HE MET 954 2HE MET 954 4.377 19.287 -4.986 311 3HE MET 954 3HE MET 954 4.881 17.813 -4.126 312 H VAL 955 H VAL 955 1.334 16.693 -7.686 313 HA VAL 955 HA VAL 955 0.618 14.326 -6.336 314 HB VAL 955 HB VAL 955 -0.950 16.573 -7.603 315 1HG1 VAL 955 1HG1 VAL 955 -1.924 14.004 -6.850 316 2HG1 VAL 955 2HG1 VAL 955 -2.484 15.173 -5.629 317 3HG1 VAL 955 3HG1 VAL 955 -2.852 15.438 -7.351 318 1HG2 VAL 955 1HG2 VAL 955 -1.398 16.938 -5.043 319 2HG2 VAL 955 2HG2 VAL 955 0.080 15.966 -4.844 320 3HG2 VAL 955 3HG2 VAL 955 0.132 17.486 -5.770 321 H LYS 956 H LYS 956 0.037 15.538 -9.705 322 HA LYS 956 HA LYS 956 -1.503 13.527 -10.659 323 1HB LYS 956 1HB LYS 956 0.693 15.141 -11.967 324 2HB LYS 956 2HB LYS 956 -0.281 13.998 -12.870 325 1HG LYS 956 1HG LYS 956 -1.579 16.128 -11.128 326 2HG LYS 956 2HG LYS 956 -1.075 16.487 -12.767 327 1HD LYS 956 1HD LYS 956 -2.909 14.149 -12.069 328 2HD LYS 956 2HD LYS 956 -3.511 15.738 -12.498 329 1HE LYS 956 1HE LYS 956 -3.490 14.881 -14.632 330 2HE LYS 956 2HE LYS 956 -1.802 15.350 -14.588 331 1HZ LYS 956 1HZ LYS 956 -1.283 13.238 -14.794 332 2HZ LYS 956 2HZ LYS 956 -2.026 12.865 -13.388 333 3HZ LYS 956 3HZ LYS 956 -2.855 12.796 -14.794 334 H GLU 957 H GLU 957 1.950 13.440 -9.808 335 HA GLU 957 HA GLU 957 2.457 11.024 -11.146 336 1HB GLU 957 1HB GLU 957 3.874 12.793 -9.203 337 2HB GLU 957 2HB GLU 957 4.378 11.115 -9.195 338 1HG GLU 957 1HG GLU 957 5.577 11.452 -11.087 339 2HG GLU 957 2HG GLU 957 4.114 11.886 -11.948 340 H VAL 958 H VAL 958 1.494 11.915 -7.788 341 HA VAL 958 HA VAL 958 1.793 9.437 -6.611 342 HB VAL 958 HB VAL 958 0.979 11.915 -5.856 343 1HG1 VAL 958 1HG1 VAL 958 -1.474 10.129 -5.772 344 2HG1 VAL 958 2HG1 VAL 958 -1.297 11.649 -4.863 345 3HG1 VAL 958 3HG1 VAL 958 -1.292 11.670 -6.643 346 1HG2 VAL 958 1HG2 VAL 958 1.443 9.342 -4.624 347 2HG2 VAL 958 2HG2 VAL 958 1.756 10.975 -3.988 348 3HG2 VAL 958 3HG2 VAL 958 0.161 10.220 -3.755 349 H GLY 959 H GLY 959 -1.000 10.830 -8.440 350 1HA GLY 959 1HA GLY 959 -2.816 8.776 -8.082 351 2HA GLY 959 2HA GLY 959 -2.724 9.831 -9.478 352 H LEU 960 H LEU 960 -0.207 9.148 -10.578 353 HA LEU 960 HA LEU 960 -0.875 6.859 -12.020 354 1HB LEU 960 1HB LEU 960 1.042 8.912 -12.101 355 2HB LEU 960 2HB LEU 960 1.956 7.418 -12.040 356 HG LEU 960 HG LEU 960 -0.240 7.985 -14.049 357 1HD1 LEU 960 1HD1 LEU 960 1.447 9.548 -14.554 358 2HD1 LEU 960 2HD1 LEU 960 2.749 8.380 -14.220 359 3HD1 LEU 960 3HD1 LEU 960 1.721 8.180 -15.660 360 1HD2 LEU 960 1HD2 LEU 960 1.019 5.571 -13.284 361 2HD2 LEU 960 2HD2 LEU 960 -0.085 5.857 -14.650 362 3HD2 LEU 960 3HD2 LEU 960 1.673 6.014 -14.879 363 H ALA 961 H ALA 961 1.434 7.376 -9.280 364 HA ALA 961 HA ALA 961 2.285 4.693 -9.217 365 1HB ALA 961 1HB ALA 961 3.560 6.579 -8.268 366 2HB ALA 961 2HB ALA 961 2.276 6.848 -7.065 367 3HB ALA 961 3HB ALA 961 3.229 5.345 -7.028 368 H LEU 962 H LEU 962 -0.348 6.535 -7.594 369 HA LEU 962 HA LEU 962 -1.082 4.448 -5.857 370 1HB LEU 962 1HB LEU 962 -1.997 6.306 -5.053 371 2HB LEU 962 2HB LEU 962 -2.020 7.099 -6.615 372 HG LEU 962 HG LEU 962 -4.256 6.747 -5.475 373 1HD1 LEU 962 1HD1 LEU 962 -3.667 7.025 -8.054 374 2HD1 LEU 962 2HD1 LEU 962 -4.400 5.405 -8.132 375 3HD1 LEU 962 3HD1 LEU 962 -5.332 6.773 -7.479 376 1HD2 LEU 962 1HD2 LEU 962 -4.994 4.733 -4.896 377 2HD2 LEU 962 2HD2 LEU 962 -4.644 4.066 -6.509 378 3HD2 LEU 962 3HD2 LEU 962 -3.369 4.107 -5.267 379 H ARG 963 H ARG 963 -1.976 5.338 -9.214 380 HA ARG 963 HA ARG 963 -4.137 3.647 -9.420 381 1HB ARG 963 1HB ARG 963 -2.143 4.690 -11.482 382 2HB ARG 963 2HB ARG 963 -3.526 3.721 -11.949 383 1HG ARG 963 1HG ARG 963 -4.436 5.799 -10.147 384 2HG ARG 963 2HG ARG 963 -3.447 6.540 -11.390 385 1HD ARG 963 1HD ARG 963 -5.206 4.543 -12.592 386 2HD ARG 963 2HD ARG 963 -6.151 5.659 -11.626 387 HE ARG 963 HE ARG 963 -4.795 6.264 -14.118 388 1HH1 ARG 963 2HH2 ARG 963 -5.773 7.677 -11.047 389 2HH1 ARG 963 1HH2 ARG 963 -5.835 9.294 -11.665 390 1HH2 ARG 963 2HH1 ARG 963 -4.876 8.397 -14.933 391 2HH2 ARG 963 1HH1 ARG 963 -5.321 9.706 -13.891 392 H THR 964 H THR 964 -0.680 3.159 -10.465 393 HA THR 964 HA THR 964 -0.970 0.522 -11.303 394 HB THR 964 HB THR 964 1.351 2.209 -10.259 395 HG1 THR 964 HG1 THR 964 0.936 2.795 -12.365 396 1HG2 THR 964 1HG2 THR 964 2.302 0.095 -11.908 397 2HG2 THR 964 2HG2 THR 964 2.644 0.325 -10.177 398 3HG2 THR 964 3HG2 THR 964 1.273 -0.689 -10.686 399 H LEU 965 H LEU 965 -0.550 1.903 -8.042 400 HA LEU 965 HA LEU 965 0.248 -0.346 -6.694 401 1HB LEU 965 1HB LEU 965 0.077 1.940 -5.790 402 2HB LEU 965 2HB LEU 965 -1.670 1.800 -5.773 403 HG LEU 965 HG LEU 965 -0.269 1.408 -3.596 404 1HD1 LEU 965 1HD1 LEU 965 -2.379 1.048 -2.992 405 2HD1 LEU 965 2HD1 LEU 965 -2.794 0.344 -4.573 406 3HD1 LEU 965 3HD1 LEU 965 -2.082 -0.679 -3.302 407 1HD2 LEU 965 1HD2 LEU 965 0.264 -0.963 -3.193 408 2HD2 LEU 965 2HD2 LEU 965 -0.106 -1.325 -4.896 409 3HD2 LEU 965 3HD2 LEU 965 1.257 -0.255 -4.489 410 H LEU 966 H LEU 966 -3.097 0.681 -7.617 411 HA LEU 966 HA LEU 966 -4.414 -1.424 -6.377 412 1HB LEU 966 1HB LEU 966 -5.361 -0.224 -8.953 413 2HB LEU 966 2HB LEU 966 -6.290 -0.753 -7.564 414 HG LEU 966 HG LEU 966 -4.663 1.771 -7.872 415 1HD1 LEU 966 1HD1 LEU 966 -7.266 2.144 -6.750 416 2HD1 LEU 966 2HD1 LEU 966 -6.621 2.712 -8.309 417 3HD1 LEU 966 3HD1 LEU 966 -7.408 1.119 -8.199 418 1HD2 LEU 966 1HD2 LEU 966 -5.874 1.839 -5.345 419 2HD2 LEU 966 2HD2 LEU 966 -5.080 0.250 -5.448 420 3HD2 LEU 966 3HD2 LEU 966 -4.136 1.735 -5.716 421 H ALA 967 H ALA 967 -3.140 -1.116 -9.757 422 HA ALA 967 HA ALA 967 -3.962 -3.624 -10.616 423 1HB ALA 967 1HB ALA 967 -3.271 -2.229 -12.327 424 2HB ALA 967 2HB ALA 967 -1.877 -1.612 -11.409 425 3HB ALA 967 3HB ALA 967 -1.813 -3.233 -12.142 426 H THR 968 H THR 968 -0.620 -2.636 -9.560 427 HA THR 968 HA THR 968 0.569 -5.053 -9.503 428 HB THR 968 HB THR 968 1.987 -4.040 -7.687 429 HG1 THR 968 HG1 THR 968 -0.056 -1.948 -7.849 430 1HG2 THR 968 1HG2 THR 968 1.688 -1.504 -8.912 431 2HG2 THR 968 2HG2 THR 968 2.837 -2.775 -9.396 432 3HG2 THR 968 3HG2 THR 968 1.243 -2.671 -10.181 433 H VAL 969 H VAL 969 -1.609 -3.742 -6.941 434 HA VAL 969 HA VAL 969 -1.295 -5.783 -5.124 435 HB VAL 969 HB VAL 969 -3.701 -4.096 -5.831 436 1HG1 VAL 969 1HG1 VAL 969 -4.700 -5.799 -4.613 437 2HG1 VAL 969 2HG1 VAL 969 -3.252 -6.084 -3.617 438 3HG1 VAL 969 3HG1 VAL 969 -4.260 -4.644 -3.332 439 1HG2 VAL 969 1HG2 VAL 969 -1.265 -3.328 -4.792 440 2HG2 VAL 969 2HG2 VAL 969 -2.800 -2.448 -4.596 441 3HG2 VAL 969 3HG2 VAL 969 -2.250 -3.571 -3.329 442 H ASP 970 H ASP 970 -3.521 -5.546 -7.967 443 HA ASP 970 HA ASP 970 -4.949 -7.798 -7.562 444 1HB ASP 970 1HB ASP 970 -5.206 -6.120 -9.440 445 2HB ASP 970 2HB ASP 970 -3.820 -6.839 -10.235 446 H GLU 971 H GLU 971 -1.564 -7.384 -8.560 447 HA GLU 971 HA GLU 971 -1.280 -10.001 -9.592 448 1HB GLU 971 1HB GLU 971 0.143 -7.755 -9.940 449 2HB GLU 971 2HB GLU 971 1.075 -8.403 -8.605 450 1HG GLU 971 1HG GLU 971 1.819 -10.253 -9.826 451 2HG GLU 971 2HG GLU 971 0.395 -10.294 -10.846 452 H SER 972 H SER 972 -1.242 -8.525 -6.414 453 HA SER 972 HA SER 972 0.283 -10.663 -5.272 454 1HB SER 972 1HB SER 972 0.701 -9.032 -3.770 455 2HB SER 972 2HB SER 972 -0.503 -7.994 -4.508 456 HG SER 972 HG SER 972 -1.035 -10.047 -2.531 457 H LEU 973 H LEU 973 -3.036 -9.895 -6.038 458 HA LEU 973 HA LEU 973 -4.470 -11.102 -4.064 459 1HB LEU 973 1HB LEU 973 -4.832 -10.427 -6.878 460 2HB LEU 973 2HB LEU 973 -5.775 -11.824 -6.399 461 HG LEU 973 HG LEU 973 -5.917 -9.518 -4.546 462 1HD1 LEU 973 1HD1 LEU 973 -6.275 -7.964 -6.103 463 2HD1 LEU 973 2HD1 LEU 973 -6.380 -9.170 -7.407 464 3HD1 LEU 973 3HD1 LEU 973 -7.816 -8.795 -6.424 465 1HD2 LEU 973 1HD2 LEU 973 -7.553 -11.789 -5.418 466 2HD2 LEU 973 2HD2 LEU 973 -7.518 -10.920 -3.865 467 3HD2 LEU 973 3HD2 LEU 973 -8.471 -10.276 -5.223 468 HA PRO 974 HA PRO 974 -3.658 -15.279 -6.113 469 1HB PRO 974 1HB PRO 974 -1.835 -15.497 -8.137 470 2HB PRO 974 2HB PRO 974 -3.556 -15.320 -8.413 471 1HG PRO 974 1HG PRO 974 -1.411 -13.311 -8.731 472 2HG PRO 974 2HG PRO 974 -3.035 -13.297 -9.390 473 1HD PRO 974 1HD PRO 974 -2.079 -11.780 -7.151 474 2HD PRO 974 2HD PRO 974 -3.728 -11.855 -7.739 475 H VAL 975 H VAL 975 -0.857 -13.212 -5.912 476 HA VAL 975 HA VAL 975 0.958 -15.190 -5.175 477 HB VAL 975 HB VAL 975 0.858 -12.272 -4.383 478 1HG1 VAL 975 1HG1 VAL 975 2.507 -13.329 -3.044 479 2HG1 VAL 975 2HG1 VAL 975 3.089 -14.320 -4.403 480 3HG1 VAL 975 3HG1 VAL 975 3.390 -12.566 -4.388 481 1HG2 VAL 975 1HG2 VAL 975 1.683 -11.674 -6.422 482 2HG2 VAL 975 2HG2 VAL 975 2.532 -13.221 -6.660 483 3HG2 VAL 975 3HG2 VAL 975 0.775 -13.119 -6.928 484 H LEU 976 H LEU 976 -1.637 -13.545 -3.408 485 HA LEU 976 HA LEU 976 -0.699 -14.831 -0.945 486 1HB LEU 976 1HB LEU 976 -2.410 -12.421 -1.489 487 2HB LEU 976 2HB LEU 976 -2.468 -13.243 0.057 488 HG LEU 976 HG LEU 976 -0.932 -11.187 -0.220 489 1HD1 LEU 976 1HD1 LEU 976 -0.954 -12.561 1.776 490 2HD1 LEU 976 2HD1 LEU 976 0.109 -13.759 1.000 491 3HD1 LEU 976 3HD1 LEU 976 0.720 -12.125 1.355 492 1HD2 LEU 976 1HD2 LEU 976 1.318 -11.617 -1.031 493 2HD2 LEU 976 2HD2 LEU 976 0.868 -13.283 -1.466 494 3HD2 LEU 976 3HD2 LEU 976 0.126 -11.909 -2.320 495 HA PRO 977 HA PRO 977 -4.070 -17.520 -1.065 496 1HB PRO 977 1HB PRO 977 -4.602 -17.953 1.580 497 2HB PRO 977 2HB PRO 977 -3.286 -18.734 0.727 498 1HG PRO 977 1HG PRO 977 -3.174 -16.509 2.670 499 2HG PRO 977 2HG PRO 977 -1.883 -17.569 2.139 500 1HD PRO 977 1HD PRO 977 -2.324 -14.857 1.316 501 2HD PRO 977 2HD PRO 977 -1.104 -15.954 0.700 502 H ALA 978 H ALA 978 -6.278 -17.929 0.571 503 HA ALA 978 HA ALA 978 -7.930 -15.856 -0.471 504 1HB ALA 978 1HB ALA 978 -9.615 -17.203 1.066 505 2HB ALA 978 2HB ALA 978 -8.985 -17.925 -0.434 506 3HB ALA 978 3HB ALA 978 -8.279 -18.377 1.136 507 H SER 979 H SER 979 -9.591 -14.757 1.068 508 HA SER 979 HA SER 979 -10.033 -13.419 2.723 509 1HB SER 979 1HB SER 979 -8.829 -15.546 4.033 510 2HB SER 979 2HB SER 979 -7.853 -14.198 4.582 511 HG SER 979 HG SER 979 -10.434 -13.394 4.694 512 H THR 980 H THR 980 -8.145 -12.719 0.612 513 HA THR 980 HA THR 980 -6.413 -10.828 2.065 514 HB THR 980 HB THR 980 -5.249 -10.979 -0.361 515 HG1 THR 980 HG1 THR 980 -6.485 -13.590 0.123 516 1HG2 THR 980 1HG2 THR 980 -4.377 -13.425 0.635 517 2HG2 THR 980 2HG2 THR 980 -3.721 -11.847 1.132 518 3HG2 THR 980 3HG2 THR 980 -4.990 -12.629 2.104 519 H HIS 981 H HIS 981 -8.269 -11.250 -1.025 520 HA HIS 981 HA HIS 981 -8.243 -8.656 -1.814 521 1HB HIS 981 1HB HIS 981 -10.658 -9.322 -2.695 522 2HB HIS 981 2HB HIS 981 -9.190 -9.976 -3.392 523 HD1 HIS 981 HD1 HIS 981 -12.197 -10.934 -1.370 524 HD2 HIS 981 HD2 HIS 981 -8.680 -12.721 -2.795 525 HE1 HIS 981 HE1 HIS 981 -12.502 -13.450 -1.071 526 H ARG 982 H ARG 982 -10.897 -10.202 0.142 527 HA ARG 982 HA ARG 982 -12.478 -8.214 0.628 528 1HB ARG 982 1HB ARG 982 -12.196 -10.586 1.814 529 2HB ARG 982 2HB ARG 982 -11.432 -9.654 3.086 530 1HG ARG 982 1HG ARG 982 -13.415 -8.754 3.788 531 2HG ARG 982 2HG ARG 982 -13.957 -8.432 2.153 532 1HD ARG 982 1HD ARG 982 -14.133 -11.164 2.152 533 2HD ARG 982 2HD ARG 982 -14.398 -10.860 3.857 534 HE ARG 982 HE ARG 982 -16.242 -10.271 1.703 535 1HH1 ARG 982 2HH2 ARG 982 -15.173 -9.118 4.851 536 2HH1 ARG 982 1HH2 ARG 982 -16.672 -8.330 5.214 537 1HH2 ARG 982 2HH1 ARG 982 -18.221 -9.232 2.182 538 2HH2 ARG 982 1HH1 ARG 982 -18.418 -8.396 3.686 539 H GLU 983 H GLU 983 -9.753 -8.771 2.985 540 HA GLU 983 HA GLU 983 -9.964 -6.247 4.092 541 1HB GLU 983 1HB GLU 983 -7.974 -8.484 4.160 542 2HB GLU 983 2HB GLU 983 -7.396 -6.916 4.691 543 1HG GLU 983 1HG GLU 983 -9.394 -6.767 6.250 544 2HG GLU 983 2HG GLU 983 -9.836 -8.397 5.781 545 H ILE 984 H ILE 984 -7.804 -7.562 1.508 546 HA ILE 984 HA ILE 984 -6.190 -5.352 1.187 547 HB ILE 984 HB ILE 984 -7.121 -7.545 -0.634 548 1HG1 ILE 984 1HG1 ILE 984 -4.422 -6.855 0.567 549 2HG1 ILE 984 2HG1 ILE 984 -5.532 -8.063 1.183 550 1HG2 ILE 984 1HG2 ILE 984 -6.816 -6.009 -2.306 551 2HG2 ILE 984 2HG2 ILE 984 -5.622 -5.066 -1.382 552 3HG2 ILE 984 3HG2 ILE 984 -5.153 -6.616 -2.120 553 1HD1 ILE 984 1HD1 ILE 984 -4.088 -9.357 -0.145 554 2HD1 ILE 984 2HD1 ILE 984 -5.435 -9.047 -1.267 555 3HD1 ILE 984 3HD1 ILE 984 -3.938 -8.092 -1.388 556 H GLU 985 H GLU 985 -9.493 -6.031 -0.048 557 HA GLU 985 HA GLU 985 -9.623 -3.940 -1.828 558 1HB GLU 985 1HB GLU 985 -11.334 -5.942 -0.911 559 2HB GLU 985 2HB GLU 985 -12.146 -4.480 -0.386 560 1HG GLU 985 1HG GLU 985 -11.057 -4.536 -3.196 561 2HG GLU 985 2HG GLU 985 -12.487 -5.493 -2.863 562 H MET 986 H MET 986 -10.490 -4.084 1.688 563 HA MET 986 HA MET 986 -11.380 -1.450 1.807 564 1HB MET 986 1HB MET 986 -10.675 -3.672 3.665 565 2HB MET 986 2HB MET 986 -10.421 -2.088 4.371 566 1HG MET 986 1HG MET 986 -12.677 -1.596 4.425 567 2HG MET 986 2HG MET 986 -12.996 -2.379 2.891 568 1HE MET 986 1HE MET 986 -14.315 -5.089 3.026 569 2HE MET 986 2HE MET 986 -12.657 -4.718 2.494 570 3HE MET 986 3HE MET 986 -12.948 -6.056 3.631 571 H ALA 987 H ALA 987 -8.199 -2.795 1.517 572 HA ALA 987 HA ALA 987 -6.890 -0.585 2.836 573 1HB ALA 987 1HB ALA 987 -4.835 -1.785 2.082 574 2HB ALA 987 2HB ALA 987 -5.944 -2.831 3.001 575 3HB ALA 987 3HB ALA 987 -5.865 -2.959 1.228 576 H GLN 988 H GLN 988 -7.952 -1.585 -0.395 577 HA GLN 988 HA GLN 988 -6.265 0.253 -1.732 578 1HB GLN 988 1HB GLN 988 -8.782 -1.159 -2.722 579 2HB GLN 988 2HB GLN 988 -7.593 -0.363 -3.733 580 1HG GLN 988 1HG GLN 988 -6.306 -2.280 -1.923 581 2HG GLN 988 2HG GLN 988 -7.558 -3.061 -2.869 582 1HE2 GLN 988 1HE2 GLN 988 -7.378 -3.257 -5.059 583 2HE2 GLN 988 2HE2 GLN 988 -5.935 -2.913 -5.952 584 H LYS 989 H LYS 989 -9.727 0.170 -0.699 585 HA LYS 989 HA LYS 989 -10.428 2.609 -1.884 586 1HB LYS 989 1HB LYS 989 -11.595 0.711 0.069 587 2HB LYS 989 2HB LYS 989 -12.164 2.363 0.199 588 1HG LYS 989 1HG LYS 989 -13.258 2.293 -1.823 589 2HG LYS 989 2HG LYS 989 -11.988 1.368 -2.598 590 1HD LYS 989 1HD LYS 989 -12.806 -0.713 -1.718 591 2HD LYS 989 2HD LYS 989 -13.811 0.088 -0.527 592 1HE LYS 989 1HE LYS 989 -14.276 0.526 -3.501 593 2HE LYS 989 2HE LYS 989 -14.955 -0.867 -2.683 594 1HZ LYS 989 1HZ LYS 989 -16.061 1.571 -2.763 595 2HZ LYS 989 2HZ LYS 989 -16.450 0.406 -1.686 596 3HZ LYS 989 3HZ LYS 989 -15.380 1.571 -1.278 597 H LEU 990 H LEU 990 -9.003 1.731 1.292 598 HA LEU 990 HA LEU 990 -9.294 4.194 2.525 599 1HB LEU 990 1HB LEU 990 -8.146 1.719 3.083 600 2HB LEU 990 2HB LEU 990 -6.804 2.842 3.174 601 HG LEU 990 HG LEU 990 -9.407 3.139 4.698 602 1HD1 LEU 990 1HD1 LEU 990 -6.826 2.497 6.052 603 2HD1 LEU 990 2HD1 LEU 990 -8.499 2.104 6.516 604 3HD1 LEU 990 3HD1 LEU 990 -7.695 1.184 5.221 605 1HD2 LEU 990 1HD2 LEU 990 -6.818 4.705 4.790 606 2HD2 LEU 990 2HD2 LEU 990 -8.436 5.293 4.335 607 3HD2 LEU 990 3HD2 LEU 990 -8.103 4.817 6.017 608 H LEU 991 H LEU 991 -6.731 2.946 0.312 609 HA LEU 991 HA LEU 991 -5.101 5.221 0.523 610 1HB LEU 991 1HB LEU 991 -4.188 3.168 -0.228 611 2HB LEU 991 2HB LEU 991 -5.363 3.025 -1.520 612 HG LEU 991 HG LEU 991 -4.344 4.805 -2.767 613 1HD1 LEU 991 1HD1 LEU 991 -2.531 5.230 -0.376 614 2HD1 LEU 991 2HD1 LEU 991 -2.355 6.022 -1.961 615 3HD1 LEU 991 3HD1 LEU 991 -3.798 6.332 -0.966 616 1HD2 LEU 991 1HD2 LEU 991 -3.273 2.812 -3.288 617 2HD2 LEU 991 2HD2 LEU 991 -1.921 3.902 -2.898 618 3HD2 LEU 991 3HD2 LEU 991 -2.472 2.705 -1.701 619 H ASN 992 H ASN 992 -7.299 4.195 -2.190 620 HA ASN 992 HA ASN 992 -7.142 6.400 -3.678 621 1HB ASN 992 1HB ASN 992 -8.783 4.166 -3.619 622 2HB ASN 992 2HB ASN 992 -9.947 5.433 -3.283 623 1HD2 ASN 992 1HD2 ASN 992 -10.995 5.896 -5.057 624 2HD2 ASN 992 2HD2 ASN 992 -10.325 6.173 -6.631 625 H SER 993 H SER 993 -9.106 5.850 -0.700 626 HA SER 993 HA SER 993 -10.682 8.072 -0.796 627 1HB SER 993 1HB SER 993 -10.946 6.256 0.855 628 2HB SER 993 2HB SER 993 -9.437 6.700 1.627 629 HG SER 993 HG SER 993 -11.536 7.528 2.596 630 H ASP 994 H ASP 994 -7.816 7.805 1.428 631 HA ASP 994 HA ASP 994 -7.553 10.386 2.019 632 1HB ASP 994 1HB ASP 994 -5.774 8.045 1.897 633 2HB ASP 994 2HB ASP 994 -4.882 9.533 1.646 634 H LEU 995 H LEU 995 -6.542 8.675 -0.969 635 HA LEU 995 HA LEU 995 -4.912 10.683 -2.030 636 1HB LEU 995 1HB LEU 995 -6.099 8.166 -2.862 637 2HB LEU 995 2HB LEU 995 -6.081 9.332 -4.170 638 HG LEU 995 HG LEU 995 -4.063 7.680 -3.737 639 1HD1 LEU 995 1HD1 LEU 995 -4.453 10.003 -5.213 640 2HD1 LEU 995 2HD1 LEU 995 -2.903 10.269 -4.379 641 3HD1 LEU 995 3HD1 LEU 995 -3.129 8.827 -5.398 642 1HD2 LEU 995 1HD2 LEU 995 -3.907 8.911 -1.362 643 2HD2 LEU 995 2HD2 LEU 995 -2.492 8.233 -2.202 644 3HD2 LEU 995 3HD2 LEU 995 -2.837 9.976 -2.305 645 H ALA 996 H ALA 996 -8.300 9.813 -3.031 646 HA ALA 996 HA ALA 996 -8.865 11.877 -4.623 647 1HB ALA 996 1HB ALA 996 -10.304 9.890 -3.634 648 2HB ALA 996 2HB ALA 996 -10.878 11.142 -2.506 649 3HB ALA 996 3HB ALA 996 -11.102 11.353 -4.259 650 H GLU 997 H GLU 997 -9.182 11.952 -1.003 651 HA GLU 997 HA GLU 997 -9.990 14.563 -0.845 652 1HB GLU 997 1HB GLU 997 -9.893 12.761 0.990 653 2HB GLU 997 2HB GLU 997 -8.204 13.181 1.196 654 1HG GLU 997 1HG GLU 997 -9.485 14.462 2.815 655 2HG GLU 997 2HG GLU 997 -8.887 15.580 1.605 656 H LEU 998 H LEU 998 -6.647 13.168 -0.779 657 HA LEU 998 HA LEU 998 -5.342 15.610 -0.393 658 1HB LEU 998 1HB LEU 998 -4.269 13.530 0.075 659 2HB LEU 998 2HB LEU 998 -4.466 12.979 -1.576 660 HG LEU 998 HG LEU 998 -2.147 13.700 -0.944 661 1HD1 LEU 998 1HD1 LEU 998 -3.583 14.096 -3.327 662 2HD1 LEU 998 2HD1 LEU 998 -2.593 15.559 -3.105 663 3HD1 LEU 998 3HD1 LEU 998 -1.820 13.955 -3.124 664 1HD2 LEU 998 1HD2 LEU 998 -3.023 16.554 -1.221 665 2HD2 LEU 998 2HD2 LEU 998 -3.140 15.744 0.360 666 3HD2 LEU 998 3HD2 LEU 998 -1.565 15.873 -0.460 667 H ILE 999 H ILE 999 -6.321 13.809 -3.363 668 HA ILE 999 HA ILE 999 -5.075 15.497 -5.183 669 HB ILE 999 HB ILE 999 -7.572 13.818 -5.431 670 1HG1 ILE 999 1HG1 ILE 999 -5.456 12.648 -4.744 671 2HG1 ILE 999 2HG1 ILE 999 -6.176 12.078 -6.237 672 1HG2 ILE 999 1HG2 ILE 999 -6.083 14.225 -7.884 673 2HG2 ILE 999 2HG2 ILE 999 -7.814 14.459 -7.544 674 3HG2 ILE 999 3HG2 ILE 999 -6.657 15.769 -7.210 675 1HD1 ILE 999 1HD1 ILE 999 -4.288 12.566 -7.384 676 2HD1 ILE 999 2HD1 ILE 999 -4.358 14.260 -6.841 677 3HD1 ILE 999 3HD1 ILE 999 -3.523 13.041 -5.849 678 H ASN1000 H ASN1000 -8.266 15.688 -3.534 679 HA ASN1000 HA ASN1000 -9.109 17.897 -5.041 680 1HB ASN1000 1HB ASN1000 -10.606 16.314 -3.712 681 2HB ASN1000 2HB ASN1000 -9.997 17.038 -2.237 682 1HD2 ASN1000 1HD2 ASN1000 -11.456 18.304 -1.395 683 2HD2 ASN1000 2HD2 ASN1000 -12.445 19.465 -2.217 684 H LYS1001 H LYS1001 -7.688 17.410 -1.731 685 HA LYS1001 HA LYS1001 -7.721 20.093 -0.969 686 1HB LYS1001 1HB LYS1001 -7.065 17.669 0.191 687 2HB LYS1001 2HB LYS1001 -5.516 18.484 0.114 688 1HG LYS1001 1HG LYS1001 -6.365 19.269 2.160 689 2HG LYS1001 2HG LYS1001 -6.812 20.566 1.070 690 1HD LYS1001 1HD LYS1001 -9.067 19.315 0.754 691 2HD LYS1001 2HD LYS1001 -8.596 18.336 2.129 692 1HE LYS1001 1HE LYS1001 -8.901 20.056 3.641 693 2HE LYS1001 2HE LYS1001 -8.301 21.279 2.537 694 1HZ LYS1001 1HZ LYS1001 -10.350 21.336 1.442 695 2HZ LYS1001 2HZ LYS1001 -10.897 19.971 2.153 696 3HZ LYS1001 3HZ LYS1001 -10.725 21.337 3.032 697 H MET1002 H MET1002 -4.922 18.105 -2.175 698 HA MET1002 HA MET1002 -3.114 20.075 -2.364 699 1HB MET1002 1HB MET1002 -1.928 18.576 -3.778 700 2HB MET1002 2HB MET1002 -3.059 17.497 -2.987 701 1HG MET1002 1HG MET1002 -3.415 16.881 -5.208 702 2HG MET1002 2HG MET1002 -4.639 18.125 -5.049 703 1HE MET1002 1HE MET1002 -3.215 17.301 -8.047 704 2HE MET1002 2HE MET1002 -4.698 18.119 -7.500 705 3HE MET1002 3HE MET1002 -3.560 18.965 -8.575 706 H LYS1003 H LYS1003 -5.915 19.502 -4.482 707 HA LYS1003 HA LYS1003 -5.054 21.096 -6.629 708 1HB LYS1003 1HB LYS1003 -7.349 19.545 -5.896 709 2HB LYS1003 2HB LYS1003 -7.901 21.123 -6.422 710 1HG LYS1003 1HG LYS1003 -5.985 20.616 -8.330 711 2HG LYS1003 2HG LYS1003 -6.511 18.982 -7.977 712 1HD LYS1003 1HD LYS1003 -7.948 19.734 -9.737 713 2HD LYS1003 2HD LYS1003 -8.926 19.807 -8.285 714 1HE LYS1003 1HE LYS1003 -9.271 22.026 -8.600 715 2HE LYS1003 2HE LYS1003 -7.546 22.325 -8.511 716 1HZ LYS1003 1HZ LYS1003 -8.876 21.392 -10.956 717 2HZ LYS1003 2HZ LYS1003 -8.618 22.970 -10.624 718 3HZ LYS1003 3HZ LYS1003 -7.350 21.958 -10.815 719 H LEU1004 H LEU1004 -6.718 21.784 -3.532 720 HA LEU1004 HA LEU1004 -7.187 24.519 -4.272 721 1HB LEU1004 1HB LEU1004 -7.402 23.326 -1.519 722 2HB LEU1004 2HB LEU1004 -8.223 24.732 -2.167 723 HG LEU1004 HG LEU1004 -8.713 21.996 -3.332 724 1HD1 LEU1004 1HD1 LEU1004 -9.051 21.766 -0.923 725 2HD1 LEU1004 2HD1 LEU1004 -10.132 23.179 -0.929 726 3HD1 LEU1004 3HD1 LEU1004 -10.598 21.699 -1.801 727 1HD2 LEU1004 1HD2 LEU1004 -9.509 24.429 -4.191 728 2HD2 LEU1004 2HD2 LEU1004 -10.443 22.933 -4.436 729 3HD2 LEU1004 3HD2 LEU1004 -10.854 24.030 -3.095 730 H ALA1005 H ALA1005 -4.801 22.607 -2.409 731 HA ALA1005 HA ALA1005 -3.519 24.541 -1.010 732 1HB ALA1005 1HB ALA1005 -2.971 22.146 -0.942 733 2HB ALA1005 2HB ALA1005 -2.308 22.236 -2.591 734 3HB ALA1005 3HB ALA1005 -1.509 23.109 -1.261 735 H GLN1006 H GLN1006 -3.345 23.858 -4.534 736 HA GLN1006 HA GLN1006 -1.191 25.380 -5.167 737 1HB GLN1006 1HB GLN1006 -3.620 24.411 -6.565 738 2HB GLN1006 2HB GLN1006 -2.901 25.828 -7.303 739 1HG GLN1006 1HG GLN1006 -1.473 24.371 -8.320 740 2HG GLN1006 2HG GLN1006 -0.655 24.290 -6.772 741 1HE2 GLN1006 1HE2 GLN1006 -0.280 22.342 -6.072 742 2HE2 GLN1006 2HE2 GLN1006 -1.234 20.921 -6.336 743 H GLN1007 H GLN1007 -4.601 26.403 -4.605 744 HA GLN1007 HA GLN1007 -3.839 29.135 -5.123 745 1HB GLN1007 1HB GLN1007 -6.081 27.905 -5.813 746 2HB GLN1007 2HB GLN1007 -6.579 28.274 -4.173 747 1HG GLN1007 1HG GLN1007 -5.500 30.702 -5.007 748 2HG GLN1007 2HG GLN1007 -6.213 30.095 -6.488 749 1HE2 GLN1007 1HE2 GLN1007 -6.873 30.541 -3.028 750 2HE2 GLN1007 2HE2 GLN1007 -8.558 30.918 -3.167 751 H TYR1008 H TYR1008 -4.525 26.900 -2.458 752 HA TYR1008 HA TYR1008 -4.707 29.052 -0.529 753 1HB TYR1008 1HB TYR1008 -4.868 26.007 -0.675 754 2HB TYR1008 2HB TYR1008 -4.603 26.735 0.897 755 HD1 TYR1008 HD1 TYR1008 -6.360 28.011 2.010 756 HD2 TYR1008 HD2 TYR1008 -6.997 26.320 -1.868 757 HE1 TYR1008 HE1 TYR1008 -8.862 28.392 2.247 758 HE2 TYR1008 HE2 TYR1008 -9.498 26.707 -1.618 759 HH TYR1008 HH TYR1008 -11.054 26.931 0.769 760 H VAL1009 H VAL1009 -2.238 29.062 -1.997 761 HA VAL1009 HA VAL1009 -0.415 28.330 0.185 762 HB VAL1009 HB VAL1009 -0.175 26.719 -1.602 763 1HG1 VAL1009 1HG1 VAL1009 0.011 27.182 -3.840 764 2HG1 VAL1009 2HG1 VAL1009 -0.996 28.562 -3.341 765 3HG1 VAL1009 3HG1 VAL1009 0.757 28.774 -3.566 766 1HG2 VAL1009 1HG2 VAL1009 1.884 28.324 -0.547 767 2HG2 VAL1009 2HG2 VAL1009 2.026 26.691 -1.240 768 3HG2 VAL1009 3HG2 VAL1009 2.267 28.120 -2.273 769 H MET1010 H MET1010 -1.101 30.403 -2.692 770 HA MET1010 HA MET1010 0.912 32.140 -2.583 771 1HB MET1010 1HB MET1010 -1.076 33.886 -3.112 772 2HB MET1010 2HB MET1010 -0.670 32.620 -4.254 773 1HG MET1010 1HG MET1010 -2.680 31.579 -3.966 774 2HG MET1010 2HG MET1010 -2.547 31.634 -2.220 775 1HE MET1010 1HE MET1010 -5.455 32.573 -1.872 776 2HE MET1010 2HE MET1010 -3.926 32.503 -0.962 777 3HE MET1010 3HE MET1010 -4.835 34.031 -1.059 778 H THR1011 H THR1011 -1.599 31.703 -0.146 779 HA THR1011 HA THR1011 -0.701 34.147 1.221 780 HB THR1011 HB THR1011 -3.153 33.902 0.687 781 HG1 THR1011 HG1 THR1011 -2.525 35.027 2.624 782 1HG2 THR1011 1HG2 THR1011 -3.899 31.705 0.878 783 2HG2 THR1011 2HG2 THR1011 -2.691 31.301 2.121 784 3HG2 THR1011 3HG2 THR1011 -4.162 32.200 2.567 785 H SER1012 H SER1012 -1.536 33.391 3.830 786 HA SER1012 HA SER1012 0.780 31.897 4.516 787 1HB SER1012 1HB SER1012 0.381 32.607 6.719 788 2HB SER1012 2HB SER1012 -0.307 33.912 5.773 789 HG SER1012 HG SER1012 -2.409 32.636 5.976 790 H LEU1013 H LEU1013 -2.671 31.312 4.057 791 HA LEU1013 HA LEU1013 -3.248 29.226 5.650 792 1HB LEU1013 1HB LEU1013 -4.339 30.410 3.422 793 2HB LEU1013 2HB LEU1013 -4.043 28.775 2.865 794 HG LEU1013 HG LEU1013 -6.317 29.077 3.745 795 1HD1 LEU1013 1HD1 LEU1013 -6.211 26.905 4.169 796 2HD1 LEU1013 2HD1 LEU1013 -4.461 27.025 4.468 797 3HD1 LEU1013 3HD1 LEU1013 -5.610 27.259 5.806 798 1HD2 LEU1013 1HD2 LEU1013 -5.054 29.503 6.463 799 2HD2 LEU1013 2HD2 LEU1013 -5.708 30.808 5.445 800 3HD2 LEU1013 3HD2 LEU1013 -6.784 29.524 6.048 801 H GLN1014 H GLN1014 -0.880 29.322 3.029 802 HA GLN1014 HA GLN1014 -0.593 26.837 2.227 803 1HB GLN1014 1HB GLN1014 0.939 28.666 1.613 804 2HB GLN1014 2HB GLN1014 1.652 28.649 3.214 805 1HG GLN1014 1HG GLN1014 1.749 25.955 2.190 806 2HG GLN1014 2HG GLN1014 2.338 27.020 0.930 807 1HE2 GLN1014 1HE2 GLN1014 4.261 28.010 1.111 808 2HE2 GLN1014 2HE2 GLN1014 5.364 27.823 2.433 809 H GLN1015 H GLN1015 1.456 27.875 5.040 810 HA GLN1015 HA GLN1015 2.239 25.528 5.919 811 1HB GLN1015 1HB GLN1015 2.087 26.529 8.291 812 2HB GLN1015 2HB GLN1015 2.977 27.452 7.097 813 1HG GLN1015 1HG GLN1015 1.458 29.172 7.099 814 2HG GLN1015 2HG GLN1015 0.080 28.091 7.152 815 1HE2 GLN1015 1HE2 GLN1015 -0.572 29.900 8.630 816 2HE2 GLN1015 2HE2 GLN1015 -0.234 29.729 10.320 817 H GLU1016 H GLU1016 -1.072 26.814 6.180 818 HA GLU1016 HA GLU1016 -1.970 24.977 8.073 819 1HB GLU1016 1HB GLU1016 -3.013 27.203 6.822 820 2HB GLU1016 2HB GLU1016 -3.939 25.928 6.056 821 1HG GLU1016 1HG GLU1016 -5.173 25.585 7.932 822 2HG GLU1016 2HG GLU1016 -3.737 25.417 8.922 823 H TYR1017 H TYR1017 -2.533 25.076 4.473 824 HA TYR1017 HA TYR1017 -3.673 22.548 4.313 825 1HB TYR1017 1HB TYR1017 -2.406 24.664 2.616 826 2HB TYR1017 2HB TYR1017 -2.251 23.066 1.914 827 HD1 TYR1017 HD1 TYR1017 -4.059 22.068 0.765 828 HD2 TYR1017 HD2 TYR1017 -4.760 25.493 3.231 829 HE1 TYR1017 HE1 TYR1017 -6.428 22.245 -0.140 830 HE2 TYR1017 HE2 TYR1017 -7.126 25.658 2.317 831 HH TYR1017 HH TYR1017 -8.684 23.292 0.914 832 H LYS1018 H LYS1018 -0.234 23.620 4.079 833 HA LYS1018 HA LYS1018 0.866 21.267 3.186 834 1HB LYS1018 1HB LYS1018 1.767 23.751 4.112 835 2HB LYS1018 2HB LYS1018 2.525 22.588 5.181 836 1HG LYS1018 1HG LYS1018 3.913 23.014 3.156 837 2HG LYS1018 2HG LYS1018 3.429 21.333 3.264 838 1HD LYS1018 1HD LYS1018 2.506 21.489 1.202 839 2HD LYS1018 2HD LYS1018 1.340 22.637 1.829 840 1HE LYS1018 1HE LYS1018 3.448 24.325 1.550 841 2HE LYS1018 2HE LYS1018 3.898 23.150 0.330 842 1HZ LYS1018 1HZ LYS1018 1.867 23.489 -0.773 843 2HZ LYS1018 2HZ LYS1018 1.226 24.357 0.453 844 3HZ LYS1018 3HZ LYS1018 2.444 24.980 -0.439 845 H LYS1019 H LYS1019 -0.331 22.173 6.425 846 HA LYS1019 HA LYS1019 0.792 19.835 7.645 847 1HB LYS1019 1HB LYS1019 -0.542 22.287 8.484 848 2HB LYS1019 2HB LYS1019 -1.171 20.890 9.335 849 1HG LYS1019 1HG LYS1019 0.658 21.385 10.687 850 2HG LYS1019 2HG LYS1019 1.405 20.246 9.584 851 1HD LYS1019 1HD LYS1019 1.401 23.215 8.943 852 2HD LYS1019 2HD LYS1019 2.592 22.553 10.046 853 1HE LYS1019 1HE LYS1019 2.144 21.269 7.328 854 2HE LYS1019 2HE LYS1019 3.165 22.686 7.479 855 1HZ LYS1019 1HZ LYS1019 3.553 20.323 9.167 856 2HZ LYS1019 2HZ LYS1019 4.270 20.471 7.707 857 3HZ LYS1019 3HZ LYS1019 4.601 21.545 8.892 858 H GLN1020 H GLN1020 -2.098 20.699 5.856 859 HA GLN1020 HA GLN1020 -3.721 18.678 6.948 860 1HB GLN1020 1HB GLN1020 -3.903 20.216 4.321 861 2HB GLN1020 2HB GLN1020 -5.161 19.154 4.923 862 1HG GLN1020 1HG GLN1020 -4.088 21.399 6.666 863 2HG GLN1020 2HG GLN1020 -5.303 21.730 5.447 864 1HE2 GLN1020 1HE2 GLN1020 -6.672 22.343 7.187 865 2HE2 GLN1020 2HE2 GLN1020 -7.547 21.164 8.106 866 H MET1021 H MET1021 -2.057 18.995 3.722 867 HA MET1021 HA MET1021 -2.629 16.463 2.859 868 1HB MET1021 1HB MET1021 -0.790 16.852 1.252 869 2HB MET1021 2HB MET1021 -1.641 18.362 1.505 870 1HG MET1021 1HG MET1021 0.561 19.096 1.756 871 2HG MET1021 2HG MET1021 0.176 18.727 3.426 872 1HE MET1021 1HE MET1021 1.046 15.519 0.766 873 2HE MET1021 2HE MET1021 0.984 17.199 0.181 874 3HE MET1021 3HE MET1021 2.554 16.389 0.396 875 H LEU1022 H LEU1022 -0.042 17.634 5.035 876 HA LEU1022 HA LEU1022 1.598 15.390 4.938 877 1HB LEU1022 1HB LEU1022 2.254 17.534 5.873 878 2HB LEU1022 2HB LEU1022 1.083 17.366 7.165 879 HG LEU1022 HG LEU1022 3.372 16.899 7.912 880 1HD1 LEU1022 1HD1 LEU1022 2.705 15.331 9.383 881 2HD1 LEU1022 2HD1 LEU1022 1.126 15.543 8.590 882 3HD1 LEU1022 3HD1 LEU1022 2.188 14.197 8.112 883 1HD2 LEU1022 1HD2 LEU1022 3.340 14.454 6.131 884 2HD2 LEU1022 2HD2 LEU1022 4.144 15.981 5.696 885 3HD2 LEU1022 3HD2 LEU1022 4.676 15.073 7.131 886 H THR1023 H THR1023 -1.218 16.188 7.071 887 HA THR1023 HA THR1023 -1.126 13.968 8.694 888 HB THR1023 HB THR1023 -3.634 15.319 7.578 889 HG1 THR1023 HG1 THR1023 -1.891 16.017 9.827 890 1HG2 THR1023 1HG2 THR1023 -2.959 13.634 9.957 891 2HG2 THR1023 2HG2 THR1023 -3.881 15.114 10.314 892 3HG2 THR1023 3HG2 THR1023 -4.536 13.910 9.179 893 H ALA1024 H ALA1024 -2.568 14.287 5.406 894 HA ALA1024 HA ALA1024 -3.643 11.684 5.399 895 1HB ALA1024 1HB ALA1024 -4.628 12.791 3.693 896 2HB ALA1024 2HB ALA1024 -3.289 13.957 3.566 897 3HB ALA1024 3HB ALA1024 -3.176 12.380 2.750 898 H ALA1025 H ALA1025 -0.500 13.109 4.353 899 HA ALA1025 HA ALA1025 0.508 10.863 3.078 900 1HB ALA1025 1HB ALA1025 1.381 13.289 3.190 901 2HB ALA1025 2HB ALA1025 2.156 12.808 4.719 902 3HB ALA1025 3HB ALA1025 2.593 11.984 3.203 903 H HIS1026 H HIS1026 0.228 11.719 6.535 904 HA HIS1026 HA HIS1026 1.981 9.697 7.428 905 1HB HIS1026 1HB HIS1026 0.987 11.881 8.571 906 2HB HIS1026 2HB HIS1026 -0.233 10.759 9.141 907 HD1 HIS1026 HD1 HIS1026 0.481 10.745 11.598 908 HD2 HIS1026 HD2 HIS1026 3.583 9.734 8.961 909 HE1 HIS1026 HE1 HIS1026 2.401 9.892 13.046 910 H ALA1027 H ALA1027 -1.633 9.963 7.218 911 HA ALA1027 HA ALA1027 -2.083 7.347 8.151 912 1HB ALA1027 1HB ALA1027 -3.926 8.893 6.313 913 2HB ALA1027 2HB ALA1027 -4.344 7.798 7.652 914 3HB ALA1027 3HB ALA1027 -3.661 9.405 7.997 915 H LEU1028 H LEU1028 -1.426 8.784 4.943 916 HA LEU1028 HA LEU1028 -2.229 6.618 3.393 917 1HB LEU1028 1HB LEU1028 -0.349 8.917 3.044 918 2HB LEU1028 2HB LEU1028 -0.363 7.636 1.848 919 HG LEU1028 HG LEU1028 -2.594 9.525 2.594 920 1HD1 LEU1028 1HD1 LEU1028 -1.954 8.990 -0.228 921 2HD1 LEU1028 2HD1 LEU1028 -2.218 10.529 0.626 922 3HD1 LEU1028 3HD1 LEU1028 -0.631 9.727 0.706 923 1HD2 LEU1028 1HD2 LEU1028 -2.784 6.813 1.355 924 2HD2 LEU1028 2HD2 LEU1028 -3.907 7.660 2.446 925 3HD2 LEU1028 3HD2 LEU1028 -3.824 8.113 0.726 926 H ALA1029 H ALA1029 1.173 7.511 4.324 927 HA ALA1029 HA ALA1029 2.478 5.338 3.489 928 1HB ALA1029 1HB ALA1029 4.112 5.816 5.186 929 2HB ALA1029 2HB ALA1029 3.357 7.365 4.743 930 3HB ALA1029 3HB ALA1029 2.885 6.544 6.250 931 H VAL1030 H VAL1030 0.372 5.558 6.398 932 HA VAL1030 HA VAL1030 0.993 2.908 7.245 933 HB VAL1030 HB VAL1030 -0.969 5.043 8.010 934 1HG1 VAL1030 1HG1 VAL1030 -1.939 3.608 9.717 935 2HG1 VAL1030 2HG1 VAL1030 -2.196 2.889 8.109 936 3HG1 VAL1030 3HG1 VAL1030 -0.932 2.242 9.183 937 1HG2 VAL1030 1HG2 VAL1030 0.869 3.603 9.891 938 2HG2 VAL1030 2HG2 VAL1030 1.557 4.777 8.744 939 3HG2 VAL1030 3HG2 VAL1030 0.313 5.294 9.907 940 H ASP1031 H ASP1031 -1.865 4.494 5.659 941 HA ASP1031 HA ASP1031 -3.499 2.413 5.439 942 1HB ASP1031 1HB ASP1031 -2.796 4.450 3.275 943 2HB ASP1031 2HB ASP1031 -4.203 3.408 3.196 944 H ALA1032 H ALA1032 -0.879 3.311 3.063 945 HA ALA1032 HA ALA1032 -1.195 1.139 1.373 946 1HB ALA1032 1HB ALA1032 1.455 1.721 1.154 947 2HB ALA1032 2HB ALA1032 0.165 2.703 0.418 948 3HB ALA1032 3HB ALA1032 0.875 3.189 1.976 949 H LYS1033 H LYS1033 0.492 1.495 4.502 950 HA LYS1033 HA LYS1033 1.905 -0.952 4.291 951 1HB LYS1033 1HB LYS1033 2.218 1.201 5.826 952 2HB LYS1033 2HB LYS1033 1.230 0.274 6.936 953 1HG LYS1033 1HG LYS1033 3.369 -0.474 7.519 954 2HG LYS1033 2HG LYS1033 2.891 -1.706 6.368 955 1HD LYS1033 1HD LYS1033 3.992 0.206 4.690 956 2HD LYS1033 2HD LYS1033 4.977 0.403 6.126 957 1HE LYS1033 1HE LYS1033 5.409 -2.088 6.130 958 2HE LYS1033 2HE LYS1033 4.493 -2.226 4.642 959 1HZ LYS1033 1HZ LYS1033 6.944 -1.980 4.406 960 2HZ LYS1033 2HZ LYS1033 6.062 -0.927 3.522 961 3HZ LYS1033 3HZ LYS1033 6.796 -0.429 4.894 962 H ASN1034 H ASN1034 -1.132 0.063 5.995 963 HA ASN1034 HA ASN1034 -1.737 -2.260 7.190 964 1HB ASN1034 1HB ASN1034 -3.056 0.126 6.732 965 2HB ASN1034 2HB ASN1034 -4.034 -0.962 5.767 966 1HD2 ASN1034 1HD2 ASN1034 -5.681 -0.375 7.330 967 2HD2 ASN1034 2HD2 ASN1034 -5.818 -1.251 8.818 968 H LEU1035 H LEU1035 -2.019 -1.337 3.738 969 HA LEU1035 HA LEU1035 -3.678 -3.402 2.883 970 1HB LEU1035 1HB LEU1035 -2.922 -1.267 1.700 971 2HB LEU1035 2HB LEU1035 -1.472 -2.148 1.261 972 HG LEU1035 HG LEU1035 -4.043 -3.493 0.627 973 1HD1 LEU1035 1HD1 LEU1035 -3.588 -0.753 -0.153 974 2HD1 LEU1035 2HD1 LEU1035 -3.605 -1.813 -1.582 975 3HD1 LEU1035 3HD1 LEU1035 -4.988 -1.807 -0.461 976 1HD2 LEU1035 1HD2 LEU1035 -1.774 -3.043 -1.279 977 2HD2 LEU1035 2HD2 LEU1035 -1.569 -4.172 0.082 978 3HD2 LEU1035 3HD2 LEU1035 -2.866 -4.438 -1.107 979 H LEU1036 H LEU1036 -0.078 -3.197 2.411 980 HA LEU1036 HA LEU1036 0.180 -5.896 1.790 981 1HB LEU1036 1HB LEU1036 1.774 -3.667 1.773 982 2HB LEU1036 2HB LEU1036 2.495 -4.611 3.062 983 HG LEU1036 HG LEU1036 2.122 -6.472 1.021 984 1HD1 LEU1036 1HD1 LEU1036 2.475 -3.766 -0.117 985 2HD1 LEU1036 2HD1 LEU1036 3.569 -5.020 -0.749 986 3HD1 LEU1036 3HD1 LEU1036 1.806 -5.248 -0.841 987 1HD2 LEU1036 1HD2 LEU1036 4.068 -6.767 2.141 988 2HD2 LEU1036 2HD2 LEU1036 4.722 -5.889 0.738 989 3HD2 LEU1036 3HD2 LEU1036 4.402 -5.023 2.259 990 H ASP1037 H ASP1037 0.128 -4.138 4.899 991 HA ASP1037 HA ASP1037 1.246 -5.923 6.550 992 1HB ASP1037 1HB ASP1037 0.149 -3.691 7.120 993 2HB ASP1037 2HB ASP1037 -1.404 -4.503 7.086 994 H VAL1038 H VAL1038 -1.996 -5.999 4.991 995 HA VAL1038 HA VAL1038 -2.858 -8.297 6.471 996 HB VAL1038 HB VAL1038 -3.922 -6.550 4.295 997 1HG1 VAL1038 1HG1 VAL1038 -5.978 -8.261 4.489 998 2HG1 VAL1038 2HG1 VAL1038 -4.711 -8.417 3.249 999 3HG1 VAL1038 3HG1 VAL1038 -4.641 -9.412 4.723 1000 1HG2 VAL1038 1HG2 VAL1038 -4.679 -5.681 6.253 1001 2HG2 VAL1038 2HG2 VAL1038 -5.941 -6.920 6.050 1002 3HG2 VAL1038 3HG2 VAL1038 -4.553 -7.230 7.119 1003 H ILE1039 H ILE1039 -1.032 -7.608 3.541 1004 HA ILE1039 HA ILE1039 -1.525 -10.095 2.280 1005 HB ILE1039 HB ILE1039 0.326 -7.792 1.920 1006 1HG1 ILE1039 1HG1 ILE1039 -1.465 -9.272 -0.026 1007 2HG1 ILE1039 2HG1 ILE1039 -1.989 -7.914 0.949 1008 1HG2 ILE1039 1HG2 ILE1039 1.771 -9.812 1.745 1009 2HG2 ILE1039 2HG2 ILE1039 0.712 -10.409 0.444 1010 3HG2 ILE1039 3HG2 ILE1039 1.624 -8.896 0.226 1011 1HD1 ILE1039 1HD1 ILE1039 -0.143 -7.965 -1.405 1012 2HD1 ILE1039 2HD1 ILE1039 -1.318 -6.724 -0.907 1013 3HD1 ILE1039 3HD1 ILE1039 0.268 -6.822 -0.104 1014 H ASP1040 H ASP1040 1.342 -8.794 4.102 1015 HA ASP1040 HA ASP1040 2.866 -10.985 4.086 1016 1HB ASP1040 1HB ASP1040 2.967 -8.598 5.370 1017 2HB ASP1040 2HB ASP1040 2.540 -9.602 6.741 1018 H GLN1041 H GLN1041 0.306 -10.138 6.543 1019 HA GLN1041 HA GLN1041 0.561 -12.509 7.969 1020 1HB GLN1041 1HB GLN1041 -1.498 -11.833 9.084 1021 2HB GLN1041 2HB GLN1041 -0.507 -10.411 8.820 1022 1HG GLN1041 1HG GLN1041 -1.836 -9.953 6.700 1023 2HG GLN1041 2HG GLN1041 -2.885 -11.293 7.119 1024 1HE2 GLN1041 1HE2 GLN1041 -4.668 -10.777 8.110 1025 2HE2 GLN1041 2HE2 GLN1041 -4.943 -9.423 9.154 1026 H ALA1042 H ALA1042 -1.158 -11.651 4.997 1027 HA ALA1042 HA ALA1042 -2.976 -13.826 5.051 1028 1HB ALA1042 1HB ALA1042 -3.745 -12.244 3.599 1029 2HB ALA1042 2HB ALA1042 -2.109 -11.678 3.184 1030 3HB ALA1042 3HB ALA1042 -2.763 -13.148 2.422 1031 H ARG1043 H ARG1043 0.196 -13.212 3.397 1032 HA ARG1043 HA ARG1043 0.411 -15.443 1.967 1033 1HB ARG1043 1HB ARG1043 2.108 -13.474 2.415 1034 2HB ARG1043 2HB ARG1043 2.762 -14.516 3.663 1035 1HG ARG1043 1HG ARG1043 3.440 -16.180 2.105 1036 2HG ARG1043 2HG ARG1043 2.344 -15.606 0.864 1037 1HD ARG1043 1HD ARG1043 4.257 -14.635 0.019 1038 2HD ARG1043 2HD ARG1043 3.855 -13.359 1.151 1039 HE ARG1043 HE ARG1043 6.045 -15.304 1.406 1040 1HH1 ARG1043 2HH2 ARG1043 4.006 -12.986 3.095 1041 2HH1 ARG1043 1HH2 ARG1043 5.124 -12.759 4.398 1042 1HH2 ARG1043 2HH1 ARG1043 7.520 -15.004 3.125 1043 2HH2 ARG1043 1HH1 ARG1043 7.136 -13.915 4.415 1044 H LEU1044 H LEU1044 1.862 -15.152 5.303 1045 HA LEU1044 HA LEU1044 2.539 -17.717 5.724 1046 1HB LEU1044 1HB LEU1044 1.997 -17.234 8.162 1047 2HB LEU1044 2HB LEU1044 3.155 -16.202 7.347 1048 HG LEU1044 HG LEU1044 0.850 -14.798 6.929 1049 1HD1 LEU1044 1HD1 LEU1044 -0.452 -16.393 8.294 1050 2HD1 LEU1044 2HD1 LEU1044 0.576 -16.008 9.695 1051 3HD1 LEU1044 3HD1 LEU1044 -0.450 -14.747 8.970 1052 1HD2 LEU1044 1HD2 LEU1044 2.346 -13.356 7.726 1053 2HD2 LEU1044 2HD2 LEU1044 1.777 -13.803 9.352 1054 3HD2 LEU1044 3HD2 LEU1044 3.192 -14.621 8.649 1055 H LYS1045 H LYS1045 -0.757 -16.288 6.055 1056 HA LYS1045 HA LYS1045 -2.136 -18.270 7.198 1057 1HB LYS1045 1HB LYS1045 -2.835 -16.006 6.008 1058 2HB LYS1045 2HB LYS1045 -3.274 -17.079 4.695 1059 1HG LYS1045 1HG LYS1045 -5.210 -17.531 5.784 1060 2HG LYS1045 2HG LYS1045 -4.275 -18.356 7.016 1061 1HD LYS1045 1HD LYS1045 -3.966 -16.173 8.223 1062 2HD LYS1045 2HD LYS1045 -4.938 -15.373 7.004 1063 1HE LYS1045 1HE LYS1045 -6.697 -15.833 8.394 1064 2HE LYS1045 2HE LYS1045 -6.620 -17.443 7.705 1065 1HZ LYS1045 1HZ LYS1045 -4.973 -16.727 10.012 1066 2HZ LYS1045 2HZ LYS1045 -6.519 -17.215 10.203 1067 3HZ LYS1045 3HZ LYS1045 -5.428 -18.213 9.510 1068 H MET1046 H MET1046 -0.550 -18.356 4.028 1069 HA MET1046 HA MET1046 -1.861 -20.845 3.402 1070 1HB MET1046 1HB MET1046 -1.569 -19.424 1.494 1071 2HB MET1046 2HB MET1046 0.037 -18.929 1.991 1072 1HG MET1046 1HG MET1046 0.939 -21.173 1.468 1073 2HG MET1046 2HG MET1046 -0.668 -21.765 1.094 1074 1HE MET1046 1HE MET1046 1.300 -18.295 -1.175 1075 2HE MET1046 2HE MET1046 -0.087 -17.981 -0.104 1076 3HE MET1046 3HE MET1046 1.417 -18.661 0.563 1077 H ILE1047 H ILE1047 1.540 -19.605 3.785 1078 HA ILE1047 HA ILE1047 2.890 -21.941 3.547 1079 HB ILE1047 HB ILE1047 3.328 -19.489 5.213 1080 1HG1 ILE1047 1HG1 ILE1047 5.392 -20.089 3.320 1081 2HG1 ILE1047 2HG1 ILE1047 3.845 -20.274 2.518 1082 1HG2 ILE1047 1HG2 ILE1047 4.375 -21.114 6.576 1083 2HG2 ILE1047 2HG2 ILE1047 5.042 -21.978 5.171 1084 3HG2 ILE1047 3HG2 ILE1047 5.669 -20.370 5.607 1085 1HD1 ILE1047 1HD1 ILE1047 4.699 -17.832 4.142 1086 2HD1 ILE1047 2HD1 ILE1047 4.664 -17.935 2.365 1087 3HD1 ILE1047 3HD1 ILE1047 3.146 -18.020 3.292 1088 H SER1048 H SER1048 2.213 -20.602 6.845 1089 HA SER1048 HA SER1048 2.473 -23.130 7.992 1090 1HB SER1048 1HB SER1048 2.463 -20.539 8.918 1091 2HB SER1048 2HB SER1048 0.893 -21.083 9.476 1092 HG SER1048 HG SER1048 3.489 -22.170 10.100 1093 H GLN1049 H GLN1049 0.930 -24.280 6.452 1094 HA GLN1049 HA GLN1049 -1.443 -24.820 7.779 1095 1HB GLN1049 1HB GLN1049 -1.651 -22.537 6.108 1096 2HB GLN1049 2HB GLN1049 -2.416 -23.832 5.208 1097 1HG GLN1049 1HG GLN1049 -3.291 -24.134 7.911 1098 2HG GLN1049 2HG GLN1049 -3.390 -22.419 7.563 1099 1HE2 GLN1049 1HE2 GLN1049 -4.282 -25.633 6.409 1100 2HE2 GLN1049 2HE2 GLN1049 -5.716 -25.182 5.547 1101 H SER1050 H SER1050 0.737 -26.326 6.864 1102 HA SER1050 HA SER1050 -0.611 -28.262 5.365 1103 1HB SER1050 1HB SER1050 0.577 -26.289 3.761 1104 2HB SER1050 2HB SER1050 1.764 -27.579 3.760 1105 HG SER1050 HG SER1050 0.470 -28.812 2.565 1106 H ARG1051 H ARG1051 2.653 -26.875 6.147 1107 HA ARG1051 HA ARG1051 3.523 -29.568 6.756 1108 1HB ARG1051 1HB ARG1051 5.058 -26.947 6.406 1109 2HB ARG1051 2HB ARG1051 5.826 -28.443 6.897 1110 1HG ARG1051 1HG ARG1051 5.461 -29.484 4.810 1111 2HG ARG1051 2HG ARG1051 4.104 -28.450 4.411 1112 1HD ARG1051 1HD ARG1051 6.290 -26.669 4.705 1113 2HD ARG1051 2HD ARG1051 6.959 -28.050 3.860 1114 HE ARG1051 HE ARG1051 4.993 -26.159 2.819 1115 1HH1 ARG1051 2HH2 ARG1051 6.215 -29.447 2.540 1116 2HH1 ARG1051 1HH2 ARG1051 5.677 -29.645 0.905 1117 1HH2 ARG1051 2HH1 ARG1051 4.282 -26.419 0.663 1118 2HH2 ARG1051 1HH1 ARG1051 4.570 -27.911 -0.169 1119 HA PRO1052 HA PRO1052 2.910 -28.281 10.955 1120 1HB PRO1052 1HB PRO1052 2.983 -30.773 12.074 1121 2HB PRO1052 2HB PRO1052 1.518 -30.050 11.439 1122 1HG PRO1052 1HG PRO1052 3.195 -32.182 10.262 1123 2HG PRO1052 2HG PRO1052 1.541 -31.748 9.878 1124 1HD PRO1052 1HD PRO1052 3.880 -31.118 8.343 1125 2HD PRO1052 2HD PRO1052 2.241 -30.587 8.022 1126 H HIS1053 H HIS1053 4.987 -27.147 10.666 1127 HA HIS1053 HA HIS1053 7.072 -28.732 11.978 1128 1HB HIS1053 1HB HIS1053 7.149 -26.662 9.813 1129 2HB HIS1053 2HB HIS1053 8.516 -26.789 10.902 1130 HD1 HIS1053 HD1 HIS1053 6.523 -29.789 9.666 1131 HD2 HIS1053 HD2 HIS1053 10.273 -27.991 9.121 1132 HE1 HIS1053 HE1 HIS1053 7.905 -31.424 8.276 Start of MODEL 20 1 H MET 915 H MET 915 0.585 -21.647 -9.378 2 HA MET 915 HA MET 915 0.661 -19.818 -7.692 3 1HB MET 915 1HB MET 915 1.800 -22.224 -6.211 4 2HB MET 915 2HB MET 915 2.366 -20.619 -5.790 5 1HG MET 915 1HG MET 915 0.565 -20.762 -4.328 6 2HG MET 915 2HG MET 915 -0.264 -20.073 -5.710 7 1HE MET 915 1HE MET 915 -2.669 -21.100 -6.097 8 2HE MET 915 2HE MET 915 -1.514 -21.308 -7.436 9 3HE MET 915 3HE MET 915 -2.589 -22.649 -6.970 10 H ALA 916 H ALA 916 1.718 -20.138 -10.150 11 HA ALA 916 HA ALA 916 4.605 -20.356 -9.902 12 1HB ALA 916 1HB ALA 916 4.546 -20.263 -12.360 13 2HB ALA 916 2HB ALA 916 3.409 -21.490 -11.753 14 3HB ALA 916 3HB ALA 916 2.801 -19.915 -12.316 15 H ASN 917 H ASN 917 5.226 -18.505 -8.732 16 HA ASN 917 HA ASN 917 4.223 -15.974 -9.600 17 1HB ASN 917 1HB ASN 917 5.766 -15.092 -7.792 18 2HB ASN 917 2HB ASN 917 4.637 -16.297 -7.204 19 1HD2 ASN 917 1HD2 ASN 917 5.392 -17.935 -6.096 20 2HD2 ASN 917 2HD2 ASN 917 7.033 -18.488 -6.035 21 H LEU 918 H LEU 918 6.292 -14.205 -9.586 22 HA LEU 918 HA LEU 918 8.302 -15.336 -11.404 23 1HB LEU 918 1HB LEU 918 6.889 -12.676 -11.639 24 2HB LEU 918 2HB LEU 918 8.249 -13.186 -12.620 25 HG LEU 918 HG LEU 918 6.515 -15.263 -13.023 26 1HD1 LEU 918 1HD1 LEU 918 4.547 -14.628 -12.101 27 2HD1 LEU 918 2HD1 LEU 918 4.921 -12.891 -12.211 28 3HD1 LEU 918 3HD1 LEU 918 4.373 -13.777 -13.655 29 1HD2 LEU 918 1HD2 LEU 918 6.850 -12.687 -14.574 30 2HD2 LEU 918 2HD2 LEU 918 7.718 -14.225 -14.796 31 3HD2 LEU 918 3HD2 LEU 918 5.987 -14.114 -15.195 32 H ASP 919 H ASP 919 9.861 -12.976 -11.641 33 HA ASP 919 HA ASP 919 11.100 -13.080 -9.072 34 1HB ASP 919 1HB ASP 919 12.017 -12.808 -11.670 35 2HB ASP 919 2HB ASP 919 12.104 -11.149 -11.111 36 H ARG 920 H ARG 920 10.145 -10.416 -11.385 37 HA ARG 920 HA ARG 920 10.026 -8.603 -9.170 38 1HB ARG 920 1HB ARG 920 10.627 -8.367 -11.922 39 2HB ARG 920 2HB ARG 920 9.079 -7.561 -11.763 40 1HG ARG 920 1HG ARG 920 10.115 -5.752 -10.878 41 2HG ARG 920 2HG ARG 920 10.647 -6.724 -9.520 42 1HD ARG 920 1HD ARG 920 12.573 -7.538 -11.089 43 2HD ARG 920 2HD ARG 920 12.123 -6.204 -12.132 44 HE ARG 920 HE ARG 920 12.396 -5.211 -9.460 45 1HH1 ARG 920 2HH2 ARG 920 14.401 -6.457 -12.102 46 2HH1 ARG 920 1HH2 ARG 920 15.808 -5.570 -11.617 47 1HH2 ARG 920 1HH1 ARG 920 15.697 -4.157 -9.685 48 H SER 921 H SER 921 8.090 -10.685 -8.991 49 HA SER 921 HA SER 921 5.644 -9.621 -10.043 50 1HB SER 921 1HB SER 921 4.758 -11.670 -8.590 51 2HB SER 921 2HB SER 921 5.538 -11.933 -10.137 52 HG SER 921 HG SER 921 6.264 -13.001 -7.845 53 H ASN 922 H ASN 922 6.052 -11.069 -6.774 54 HA ASN 922 HA ASN 922 4.336 -9.228 -5.622 55 1HB ASN 922 1HB ASN 922 5.229 -10.192 -3.435 56 2HB ASN 922 2HB ASN 922 4.685 -11.404 -4.578 57 1HD2 ASN 922 1HD2 ASN 922 7.353 -9.998 -2.908 58 2HD2 ASN 922 2HD2 ASN 922 8.588 -11.113 -3.389 59 H ASP 923 H ASP 923 7.637 -9.009 -6.601 60 HA ASP 923 HA ASP 923 8.543 -7.318 -4.531 61 1HB ASP 923 1HB ASP 923 9.710 -8.744 -6.614 62 2HB ASP 923 2HB ASP 923 9.849 -7.096 -7.194 63 H LYS 924 H LYS 924 6.958 -6.992 -7.721 64 HA LYS 924 HA LYS 924 7.474 -4.222 -8.028 65 1HB LYS 924 1HB LYS 924 6.095 -6.359 -9.466 66 2HB LYS 924 2HB LYS 924 5.214 -4.847 -9.538 67 1HG LYS 924 1HG LYS 924 8.168 -4.618 -9.937 68 2HG LYS 924 2HG LYS 924 7.310 -5.484 -11.196 69 1HD LYS 924 1HD LYS 924 6.725 -3.477 -12.075 70 2HD LYS 924 2HD LYS 924 5.678 -3.240 -10.690 71 1HE LYS 924 1HE LYS 924 7.065 -1.676 -9.769 72 2HE LYS 924 2HE LYS 924 8.492 -2.656 -10.038 73 1HZ LYS 924 1HZ LYS 924 7.146 -1.017 -12.072 74 2HZ LYS 924 2HZ LYS 924 8.562 -0.664 -11.340 75 3HZ LYS 924 3HZ LYS 924 8.460 -1.949 -12.342 76 H VAL 925 H VAL 925 4.672 -6.169 -6.817 77 HA VAL 925 HA VAL 925 2.993 -4.008 -6.337 78 HB VAL 925 HB VAL 925 3.151 -6.586 -4.770 79 1HG1 VAL 925 1HG1 VAL 925 1.475 -5.466 -3.709 80 2HG1 VAL 925 2HG1 VAL 925 1.126 -4.428 -5.112 81 3HG1 VAL 925 3HG1 VAL 925 0.524 -6.103 -5.072 82 1HG2 VAL 925 1HG2 VAL 925 1.323 -7.149 -6.659 83 2HG2 VAL 925 2HG2 VAL 925 2.379 -6.068 -7.600 84 3HG2 VAL 925 3HG2 VAL 925 3.052 -7.530 -6.840 85 H TYR 926 H TYR 926 5.202 -5.776 -4.050 86 HA TYR 926 HA TYR 926 4.759 -4.084 -1.889 87 1HB TYR 926 1HB TYR 926 6.979 -5.911 -2.939 88 2HB TYR 926 2HB TYR 926 7.256 -5.018 -1.457 89 HD1 TYR 926 HD1 TYR 926 7.413 -6.883 0.030 90 HD2 TYR 926 HD2 TYR 926 3.967 -6.419 -2.463 91 HE1 TYR 926 HE1 TYR 926 6.210 -8.697 1.343 92 HE2 TYR 926 HE2 TYR 926 2.775 -8.234 -1.141 93 HH TYR 926 HH TYR 926 3.159 -9.981 0.263 94 H GLU 927 H GLU 927 6.854 -3.762 -4.754 95 HA GLU 927 HA GLU 927 8.434 -1.721 -3.616 96 1HB GLU 927 1HB GLU 927 8.057 -2.893 -6.369 97 2HB GLU 927 2HB GLU 927 8.893 -1.360 -6.225 98 1HG GLU 927 1HG GLU 927 9.673 -3.739 -4.498 99 2HG GLU 927 2HG GLU 927 10.310 -3.554 -6.120 100 H ASN 928 H ASN 928 5.710 -1.781 -6.019 101 HA ASN 928 HA ASN 928 5.574 0.851 -6.560 102 1HB ASN 928 1HB ASN 928 4.088 -1.212 -7.327 103 2HB ASN 928 2HB ASN 928 3.032 -0.732 -6.013 104 1HD2 ASN 928 1HD2 ASN 928 4.956 0.885 -8.546 105 2HD2 ASN 928 2HD2 ASN 928 3.711 1.941 -9.125 106 H VAL 929 H VAL 929 4.008 -0.988 -3.840 107 HA VAL 929 HA VAL 929 2.639 1.131 -2.698 108 HB VAL 929 HB VAL 929 3.826 -1.405 -1.574 109 1HG1 VAL 929 1HG1 VAL 929 3.578 0.383 0.187 110 2HG1 VAL 929 2HG1 VAL 929 1.833 0.396 -0.164 111 3HG1 VAL 929 3HG1 VAL 929 2.604 -1.082 0.461 112 1HG2 VAL 929 1HG2 VAL 929 1.821 -2.407 -2.014 113 2HG2 VAL 929 2HG2 VAL 929 0.892 -0.904 -1.800 114 3HG2 VAL 929 3HG2 VAL 929 1.799 -1.183 -3.306 115 H THR 930 H THR 930 5.869 -0.239 -1.724 116 HA THR 930 HA THR 930 6.496 1.664 0.155 117 HB THR 930 HB THR 930 8.928 1.000 -0.686 118 HG1 THR 930 HG1 THR 930 8.582 0.069 -2.684 119 1HG2 THR 930 1HG2 THR 930 7.062 -0.316 0.973 120 2HG2 THR 930 2HG2 THR 930 7.564 -1.565 -0.192 121 3HG2 THR 930 3HG2 THR 930 8.783 -0.735 0.804 122 H GLY 931 H GLY 931 7.258 1.757 -3.387 123 1HA GLY 931 1HA GLY 931 8.555 4.217 -3.381 124 2HA GLY 931 2HA GLY 931 7.715 3.492 -4.737 125 H LEU 932 H LEU 932 5.082 3.379 -3.258 126 HA LEU 932 HA LEU 932 4.189 5.964 -4.017 127 1HB LEU 932 1HB LEU 932 2.322 4.836 -4.261 128 2HB LEU 932 2HB LEU 932 3.087 3.412 -3.584 129 HG LEU 932 HG LEU 932 2.381 4.099 -1.321 130 1HD1 LEU 932 1HD1 LEU 932 1.762 6.174 -0.851 131 2HD1 LEU 932 2HD1 LEU 932 1.956 6.617 -2.564 132 3HD1 LEU 932 3HD1 LEU 932 0.382 6.038 -1.967 133 1HD2 LEU 932 1HD2 LEU 932 0.802 2.638 -1.966 134 2HD2 LEU 932 2HD2 LEU 932 -0.240 4.079 -2.048 135 3HD2 LEU 932 3HD2 LEU 932 0.531 3.452 -3.525 136 H VAL 933 H VAL 933 4.293 4.212 -0.832 137 HA VAL 933 HA VAL 933 3.578 6.495 0.640 138 HB VAL 933 HB VAL 933 4.333 5.152 2.566 139 1HG1 VAL 933 1HG1 VAL 933 2.803 3.328 0.710 140 2HG1 VAL 933 2HG1 VAL 933 2.589 3.594 2.457 141 3HG1 VAL 933 3HG1 VAL 933 2.095 4.852 1.299 142 1HG2 VAL 933 1HG2 VAL 933 5.221 3.138 0.472 143 2HG2 VAL 933 2HG2 VAL 933 6.290 4.083 1.536 144 3HG2 VAL 933 3HG2 VAL 933 5.184 2.874 2.232 145 H LYS 934 H LYS 934 6.687 5.141 -0.502 146 HA LYS 934 HA LYS 934 8.374 6.639 1.113 147 1HB LYS 934 1HB LYS 934 8.688 5.430 -1.639 148 2HB LYS 934 2HB LYS 934 9.997 6.281 -0.843 149 1HG LYS 934 1HG LYS 934 8.692 4.355 0.964 150 2HG LYS 934 2HG LYS 934 9.298 3.576 -0.484 151 1HD LYS 934 1HD LYS 934 11.535 4.168 -0.043 152 2HD LYS 934 2HD LYS 934 11.089 5.552 0.936 153 1HE LYS 934 1HE LYS 934 10.554 4.210 2.828 154 2HE LYS 934 2HE LYS 934 10.361 2.757 1.867 155 1HZ LYS 934 1HZ LYS 934 12.522 2.354 1.981 156 2HZ LYS 934 2HZ LYS 934 12.961 3.894 1.661 157 3HZ LYS 934 3HZ LYS 934 12.584 3.453 3.188 158 H ALA 935 H ALA 935 6.516 7.473 -1.812 159 HA ALA 935 HA ALA 935 7.879 10.004 -2.074 160 1HB ALA 935 1HB ALA 935 7.162 8.763 -4.065 161 2HB ALA 935 2HB ALA 935 5.475 8.787 -3.496 162 3HB ALA 935 3HB ALA 935 6.281 10.306 -3.955 163 H VAL 936 H VAL 936 4.639 8.735 -1.076 164 HA VAL 936 HA VAL 936 3.227 10.960 -0.690 165 HB VAL 936 HB VAL 936 3.528 8.460 0.936 166 1HG1 VAL 936 1HG1 VAL 936 1.415 9.186 2.159 167 2HG1 VAL 936 2HG1 VAL 936 2.928 9.981 2.655 168 3HG1 VAL 936 3HG1 VAL 936 1.776 10.838 1.603 169 1HG2 VAL 936 1HG2 VAL 936 1.487 9.600 -0.976 170 2HG2 VAL 936 2HG2 VAL 936 2.387 8.068 -1.078 171 3HG2 VAL 936 3HG2 VAL 936 1.087 8.259 0.123 172 H ILE 937 H ILE 937 5.947 9.814 1.372 173 HA ILE 937 HA ILE 937 5.625 12.074 3.135 174 HB ILE 937 HB ILE 937 7.589 9.789 3.005 175 1HG1 ILE 937 1HG1 ILE 937 5.648 10.312 5.234 176 2HG1 ILE 937 2HG1 ILE 937 5.066 9.584 3.750 177 1HG2 ILE 937 1HG2 ILE 937 8.998 11.047 4.183 178 2HG2 ILE 937 2HG2 ILE 937 7.793 12.338 4.404 179 3HG2 ILE 937 3HG2 ILE 937 7.821 10.947 5.514 180 1HD1 ILE 937 1HD1 ILE 937 7.319 8.534 5.520 181 2HD1 ILE 937 2HD1 ILE 937 5.712 7.803 5.289 182 3HD1 ILE 937 3HD1 ILE 937 6.879 7.833 3.944 183 H GLU 938 H GLU 938 8.387 10.809 1.132 184 HA GLU 938 HA GLU 938 10.077 12.768 1.204 185 1HB GLU 938 1HB GLU 938 9.310 10.833 -0.805 186 2HB GLU 938 2HB GLU 938 9.774 12.318 -1.611 187 1HG GLU 938 1HG GLU 938 11.919 11.593 -1.349 188 2HG GLU 938 2HG GLU 938 11.754 12.108 0.318 189 H MET 939 H MET 939 7.017 12.921 -0.714 190 HA MET 939 HA MET 939 7.405 15.270 -1.989 191 1HB MET 939 1HB MET 939 5.406 14.010 -2.442 192 2HB MET 939 2HB MET 939 4.963 13.934 -0.748 193 1HG MET 939 1HG MET 939 3.954 16.009 -0.774 194 2HG MET 939 2HG MET 939 5.160 16.702 -1.839 195 1HE MET 939 1HE MET 939 1.881 13.807 -3.006 196 2HE MET 939 2HE MET 939 3.497 13.287 -3.544 197 3HE MET 939 3HE MET 939 3.192 13.606 -1.820 198 H SER 940 H SER 940 5.449 15.031 1.073 199 HA SER 940 HA SER 940 5.169 17.586 1.639 200 1HB SER 940 1HB SER 940 5.017 16.988 3.992 201 2HB SER 940 2HB SER 940 4.382 15.661 3.039 202 HG SER 940 HG SER 940 6.953 15.837 4.344 203 H SER 941 H SER 941 8.195 15.708 1.898 204 HA SER 941 HA SER 941 9.600 17.559 3.424 205 1HB SER 941 1HB SER 941 10.911 15.796 1.336 206 2HB SER 941 2HB SER 941 11.525 16.263 2.910 207 HG SER 941 HG SER 941 9.483 14.338 2.273 208 H LYS 942 H LYS 942 9.355 17.015 -0.156 209 HA LYS 942 HA LYS 942 10.709 19.584 -0.541 210 1HB LYS 942 1HB LYS 942 10.949 18.758 -2.914 211 2HB LYS 942 2HB LYS 942 11.851 17.870 -1.702 212 1HG LYS 942 1HG LYS 942 10.677 15.946 -2.069 213 2HG LYS 942 2HG LYS 942 9.135 16.780 -2.063 214 1HD LYS 942 1HD LYS 942 10.387 17.635 -4.454 215 2HD LYS 942 2HD LYS 942 10.775 15.929 -4.345 216 1HE LYS 942 1HE LYS 942 7.943 16.594 -3.684 217 2HE LYS 942 2HE LYS 942 8.400 16.934 -5.341 218 1HZ LYS 942 1HZ LYS 942 7.603 14.650 -4.911 219 2HZ LYS 942 2HZ LYS 942 9.069 14.712 -5.629 220 3HZ LYS 942 3HZ LYS 942 8.953 14.364 -4.038 221 H ILE 943 H ILE 943 7.856 19.122 0.377 222 HA ILE 943 HA ILE 943 6.391 20.058 -1.959 223 HB ILE 943 HB ILE 943 5.742 18.255 -0.069 224 1HG1 ILE 943 1HG1 ILE 943 4.627 19.044 -2.304 225 2HG1 ILE 943 2HG1 ILE 943 3.702 18.149 -1.115 226 1HG2 ILE 943 1HG2 ILE 943 5.667 19.775 1.782 227 2HG2 ILE 943 2HG2 ILE 943 4.607 20.893 0.891 228 3HG2 ILE 943 3HG2 ILE 943 4.000 19.294 1.385 229 1HD1 ILE 943 1HD1 ILE 943 2.733 20.392 -2.152 230 2HD1 ILE 943 2HD1 ILE 943 2.484 20.029 -0.428 231 3HD1 ILE 943 3HD1 ILE 943 3.763 21.164 -0.923 232 H GLN 944 H GLN 944 7.128 21.020 1.459 233 HA GLN 944 HA GLN 944 5.853 23.356 1.577 234 1HB GLN 944 1HB GLN 944 8.167 22.153 2.864 235 2HB GLN 944 2HB GLN 944 8.422 23.879 2.698 236 1HG GLN 944 1HG GLN 944 5.773 23.786 3.528 237 2HG GLN 944 2HG GLN 944 6.454 22.412 4.375 238 1HE2 GLN 944 1HE2 GLN 944 7.315 25.762 3.517 239 2HE2 GLN 944 2HE2 GLN 944 7.971 26.221 5.054 240 HA PRO 945 HA PRO 945 9.362 25.503 -0.784 241 1HB PRO 945 1HB PRO 945 11.315 24.020 -1.989 242 2HB PRO 945 2HB PRO 945 11.500 24.739 -0.402 243 1HG PRO 945 1HG PRO 945 11.021 21.909 -1.111 244 2HG PRO 945 2HG PRO 945 11.622 22.577 0.393 245 1HD PRO 945 1HD PRO 945 8.973 21.603 -0.114 246 2HD PRO 945 2HD PRO 945 9.542 22.377 1.352 247 H ALA 946 H ALA 946 8.929 22.370 -2.360 248 HA ALA 946 HA ALA 946 8.894 22.979 -4.919 249 1HB ALA 946 1HB ALA 946 8.266 20.800 -4.488 250 2HB ALA 946 2HB ALA 946 7.109 21.268 -3.219 251 3HB ALA 946 3HB ALA 946 6.682 21.478 -4.934 252 HA PRO 947 HA PRO 947 6.087 26.275 -5.383 253 1HB PRO 947 1HB PRO 947 6.337 26.613 -8.083 254 2HB PRO 947 2HB PRO 947 7.447 27.313 -6.923 255 1HG PRO 947 1HG PRO 947 7.849 24.986 -8.701 256 2HG PRO 947 2HG PRO 947 9.051 25.950 -7.866 257 1HD PRO 947 1HD PRO 947 8.126 23.338 -7.123 258 2HD PRO 947 2HD PRO 947 9.241 24.350 -6.226 259 HA PRO 948 HA PRO 948 2.352 24.819 -6.797 260 1HB PRO 948 1HB PRO 948 1.153 26.885 -8.125 261 2HB PRO 948 2HB PRO 948 1.208 26.773 -6.377 262 1HG PRO 948 1HG PRO 948 2.776 28.522 -8.172 263 2HG PRO 948 2HG PRO 948 2.501 28.681 -6.448 264 1HD PRO 948 1HD PRO 948 4.890 27.737 -7.726 265 2HD PRO 948 2HD PRO 948 4.572 27.787 -6.003 266 H GLU 949 H GLU 949 4.522 25.939 -9.174 267 HA GLU 949 HA GLU 949 2.965 24.792 -11.287 268 1HB GLU 949 1HB GLU 949 5.432 26.447 -11.047 269 2HB GLU 949 2HB GLU 949 5.415 25.341 -12.406 270 1HG GLU 949 1HG GLU 949 2.814 26.512 -12.329 271 2HG GLU 949 2HG GLU 949 3.937 27.829 -12.053 272 H GLU 950 H GLU 950 5.074 23.648 -8.872 273 HA GLU 950 HA GLU 950 5.781 21.375 -10.561 274 1HB GLU 950 1HB GLU 950 7.480 23.061 -9.055 275 2HB GLU 950 2HB GLU 950 7.364 21.592 -8.107 276 1HG GLU 950 1HG GLU 950 8.776 20.544 -9.535 277 2HG GLU 950 2HG GLU 950 7.644 20.788 -10.850 278 H TYR 951 H TYR 951 3.666 22.436 -8.216 279 HA TYR 951 HA TYR 951 3.751 20.012 -6.608 280 1HB TYR 951 1HB TYR 951 3.402 22.425 -5.747 281 2HB TYR 951 2HB TYR 951 1.908 22.483 -6.662 282 HD1 TYR 951 HD1 TYR 951 1.196 23.136 -4.186 283 HD2 TYR 951 HD2 TYR 951 2.309 19.199 -5.438 284 HE1 TYR 951 HE1 TYR 951 -0.055 22.145 -2.207 285 HE2 TYR 951 HE2 TYR 951 1.055 18.222 -3.455 286 HH TYR 951 HH TYR 951 0.400 19.531 -0.917 287 H VAL 952 H VAL 952 1.654 21.735 -8.985 288 HA VAL 952 HA VAL 952 -0.592 20.188 -8.811 289 HB VAL 952 HB VAL 952 0.733 21.872 -10.834 290 1HG1 VAL 952 1HG1 VAL 952 0.286 19.924 -12.232 291 2HG1 VAL 952 2HG1 VAL 952 -1.398 19.869 -11.657 292 3HG1 VAL 952 3HG1 VAL 952 -0.837 21.244 -12.639 293 1HG2 VAL 952 1HG2 VAL 952 -1.939 22.396 -10.954 294 2HG2 VAL 952 2HG2 VAL 952 -1.797 21.738 -9.306 295 3HG2 VAL 952 3HG2 VAL 952 -0.817 23.142 -9.791 296 HA PRO 953 HA PRO 953 1.554 17.079 -11.669 297 1HB PRO 953 1HB PRO 953 4.258 17.221 -12.037 298 2HB PRO 953 2HB PRO 953 3.101 17.908 -13.159 299 1HG PRO 953 1HG PRO 953 4.818 19.290 -11.189 300 2HG PRO 953 2HG PRO 953 3.991 19.957 -12.583 301 1HD PRO 953 1HD PRO 953 3.198 20.202 -9.837 302 2HD PRO 953 2HD PRO 953 2.312 20.768 -11.239 303 H MET 954 H MET 954 3.952 18.024 -9.250 304 HA MET 954 HA MET 954 4.964 15.760 -8.492 305 1HB MET 954 1HB MET 954 4.240 18.246 -7.194 306 2HB MET 954 2HB MET 954 3.913 16.955 -6.055 307 1HG MET 954 1HG MET 954 6.159 16.315 -5.908 308 2HG MET 954 2HG MET 954 6.531 16.835 -7.540 309 1HE MET 954 1HE MET 954 6.004 19.149 -3.747 310 2HE MET 954 2HE MET 954 4.780 19.740 -4.896 311 3HE MET 954 3HE MET 954 4.865 18.007 -4.499 312 H VAL 955 H VAL 955 1.664 16.799 -7.371 313 HA VAL 955 HA VAL 955 1.156 14.374 -6.026 314 HB VAL 955 HB VAL 955 -0.561 16.645 -7.019 315 1HG1 VAL 955 1HG1 VAL 955 -1.945 15.143 -5.035 316 2HG1 VAL 955 2HG1 VAL 955 -2.410 15.436 -6.728 317 3HG1 VAL 955 3HG1 VAL 955 -1.434 14.009 -6.308 318 1HG2 VAL 955 1HG2 VAL 955 -0.151 17.619 -5.043 319 2HG2 VAL 955 2HG2 VAL 955 -0.445 16.110 -4.145 320 3HG2 VAL 955 3HG2 VAL 955 1.159 16.428 -4.849 321 H LYS 956 H LYS 956 0.180 15.674 -9.268 322 HA LYS 956 HA LYS 956 -1.434 13.738 -10.160 323 1HB LYS 956 1HB LYS 956 0.763 15.240 -11.592 324 2HB LYS 956 2HB LYS 956 -0.329 14.163 -12.438 325 1HG LYS 956 1HG LYS 956 -1.443 16.298 -10.592 326 2HG LYS 956 2HG LYS 956 -0.939 16.725 -12.215 327 1HD LYS 956 1HD LYS 956 -2.747 14.329 -11.848 328 2HD LYS 956 2HD LYS 956 -3.444 15.932 -11.714 329 1HE LYS 956 1HE LYS 956 -1.651 15.632 -14.059 330 2HE LYS 956 2HE LYS 956 -3.025 14.545 -14.098 331 1HZ LYS 956 1HZ LYS 956 -2.983 17.428 -14.192 332 2HZ LYS 956 2HZ LYS 956 -3.968 16.375 -14.958 333 3HZ LYS 956 3HZ LYS 956 -4.234 16.749 -13.391 334 H GLU 957 H GLU 957 2.113 13.507 -9.702 335 HA GLU 957 HA GLU 957 2.379 11.065 -11.017 336 1HB GLU 957 1HB GLU 957 4.093 12.916 -9.883 337 2HB GLU 957 2HB GLU 957 4.235 11.582 -8.755 338 1HG GLU 957 1HG GLU 957 4.496 11.242 -11.778 339 2HG GLU 957 2HG GLU 957 5.868 11.533 -10.726 340 H VAL 958 H VAL 958 2.341 11.807 -7.449 341 HA VAL 958 HA VAL 958 2.343 9.277 -6.489 342 HB VAL 958 HB VAL 958 2.086 11.761 -5.463 343 1HG1 VAL 958 1HG1 VAL 958 -0.595 10.409 -5.004 344 2HG1 VAL 958 2HG1 VAL 958 -0.005 11.847 -4.136 345 3HG1 VAL 958 3HG1 VAL 958 -0.305 11.926 -5.889 346 1HG2 VAL 958 1HG2 VAL 958 3.001 9.625 -4.437 347 2HG2 VAL 958 2HG2 VAL 958 2.206 10.753 -3.312 348 3HG2 VAL 958 3HG2 VAL 958 1.348 9.295 -3.866 349 H GLY 959 H GLY 959 -0.474 11.142 -7.764 350 1HA GLY 959 1HA GLY 959 -2.498 9.363 -7.129 351 2HA GLY 959 2HA GLY 959 -2.484 10.458 -8.497 352 H LEU 960 H LEU 960 -0.208 9.400 -9.929 353 HA LEU 960 HA LEU 960 -1.476 7.351 -11.350 354 1HB LEU 960 1HB LEU 960 0.676 9.077 -11.694 355 2HB LEU 960 2HB LEU 960 1.409 7.485 -11.698 356 HG LEU 960 HG LEU 960 -0.880 8.350 -13.487 357 1HD1 LEU 960 1HD1 LEU 960 1.327 9.483 -13.914 358 2HD1 LEU 960 2HD1 LEU 960 2.000 7.877 -14.280 359 3HD1 LEU 960 3HD1 LEU 960 0.678 8.535 -15.273 360 1HD2 LEU 960 1HD2 LEU 960 -1.100 6.030 -13.212 361 2HD2 LEU 960 2HD2 LEU 960 -0.201 6.227 -14.735 362 3HD2 LEU 960 3HD2 LEU 960 0.660 5.767 -13.247 363 H ALA 961 H ALA 961 1.323 7.304 -9.040 364 HA ALA 961 HA ALA 961 2.015 4.720 -9.098 365 1HB ALA 961 1HB ALA 961 1.715 6.706 -6.844 366 2HB ALA 961 2HB ALA 961 2.275 5.050 -6.509 367 3HB ALA 961 3HB ALA 961 3.196 6.094 -7.618 368 H LEU 962 H LEU 962 -0.639 6.021 -6.973 369 HA LEU 962 HA LEU 962 -1.536 3.694 -5.941 370 1HB LEU 962 1HB LEU 962 -2.917 6.226 -6.756 371 2HB LEU 962 2HB LEU 962 -3.851 4.886 -6.121 372 HG LEU 962 HG LEU 962 -3.224 6.620 -4.438 373 1HD1 LEU 962 1HD1 LEU 962 -2.414 3.741 -4.082 374 2HD1 LEU 962 2HD1 LEU 962 -2.303 4.911 -2.745 375 3HD1 LEU 962 3HD1 LEU 962 -3.876 4.582 -3.512 376 1HD2 LEU 962 1HD2 LEU 962 -1.057 7.295 -5.127 377 2HD2 LEU 962 2HD2 LEU 962 -0.866 6.505 -3.544 378 3HD2 LEU 962 3HD2 LEU 962 -0.428 5.632 -5.032 379 H ARG 963 H ARG 963 -2.643 5.157 -9.079 380 HA ARG 963 HA ARG 963 -4.389 3.286 -9.820 381 1HB ARG 963 1HB ARG 963 -3.542 5.416 -11.070 382 2HB ARG 963 2HB ARG 963 -2.326 4.376 -11.785 383 1HG ARG 963 1HG ARG 963 -3.839 3.732 -13.343 384 2HG ARG 963 2HG ARG 963 -4.777 2.963 -12.078 385 1HD ARG 963 1HD ARG 963 -6.371 4.454 -12.901 386 2HD ARG 963 2HD ARG 963 -5.665 5.445 -11.640 387 HE ARG 963 HE ARG 963 -4.136 5.850 -14.012 388 1HH1 ARG 963 2HH2 ARG 963 -7.371 6.495 -12.787 389 2HH1 ARG 963 1HH2 ARG 963 -7.605 7.896 -13.777 390 1HH2 ARG 963 2HH1 ARG 963 -4.444 7.699 -15.318 391 2HH2 ARG 963 1HH1 ARG 963 -5.929 8.586 -15.226 392 H THR 964 H THR 964 -0.816 3.225 -10.533 393 HA THR 964 HA THR 964 -0.838 0.688 -11.736 394 HB THR 964 HB THR 964 1.298 2.418 -10.398 395 HG1 THR 964 HG1 THR 964 0.707 1.588 -13.147 396 1HG2 THR 964 1HG2 THR 964 2.228 0.502 -12.415 397 2HG2 THR 964 2HG2 THR 964 2.881 0.813 -10.788 398 3HG2 THR 964 3HG2 THR 964 1.548 -0.346 -11.006 399 H LEU 965 H LEU 965 -0.478 1.741 -8.326 400 HA LEU 965 HA LEU 965 0.391 -0.649 -7.270 401 1HB LEU 965 1HB LEU 965 0.477 1.072 -5.793 402 2HB LEU 965 2HB LEU 965 -1.070 1.736 -6.280 403 HG LEU 965 HG LEU 965 -1.128 -0.893 -4.880 404 1HD1 LEU 965 1HD1 LEU 965 0.608 0.524 -3.689 405 2HD1 LEU 965 2HD1 LEU 965 -0.718 1.641 -3.286 406 3HD1 LEU 965 3HD1 LEU 965 -0.766 -0.042 -2.708 407 1HD2 LEU 965 1HD2 LEU 965 -3.072 0.338 -3.739 408 2HD2 LEU 965 2HD2 LEU 965 -2.834 1.590 -4.982 409 3HD2 LEU 965 3HD2 LEU 965 -3.238 -0.075 -5.463 410 H LEU 966 H LEU 966 -2.916 0.432 -8.180 411 HA LEU 966 HA LEU 966 -4.297 -1.689 -7.035 412 1HB LEU 966 1HB LEU 966 -4.817 0.209 -9.294 413 2HB LEU 966 2HB LEU 966 -5.922 -1.118 -8.999 414 HG LEU 966 HG LEU 966 -5.905 -0.189 -6.526 415 1HD1 LEU 966 1HD1 LEU 966 -4.803 2.084 -8.150 416 2HD1 LEU 966 2HD1 LEU 966 -5.857 2.403 -6.752 417 3HD1 LEU 966 3HD1 LEU 966 -4.335 1.508 -6.533 418 1HD2 LEU 966 1HD2 LEU 966 -8.021 0.116 -7.108 419 2HD2 LEU 966 2HD2 LEU 966 -7.583 1.668 -7.863 420 3HD2 LEU 966 3HD2 LEU 966 -7.564 0.173 -8.828 421 H ALA 967 H ALA 967 -3.172 -1.292 -10.472 422 HA ALA 967 HA ALA 967 -3.898 -3.782 -11.356 423 1HB ALA 967 1HB ALA 967 -3.048 -2.830 -13.203 424 2HB ALA 967 2HB ALA 967 -2.284 -1.562 -12.215 425 3HB ALA 967 3HB ALA 967 -1.405 -3.070 -12.561 426 H THR 968 H THR 968 -0.646 -2.782 -10.060 427 HA THR 968 HA THR 968 0.536 -5.260 -10.103 428 HB THR 968 HB THR 968 2.021 -4.252 -8.356 429 HG1 THR 968 HG1 THR 968 1.017 -2.777 -7.045 430 1HG2 THR 968 1HG2 THR 968 2.809 -3.044 -10.143 431 2HG2 THR 968 2HG2 THR 968 1.170 -2.810 -10.797 432 3HG2 THR 968 3HG2 THR 968 1.790 -1.718 -9.536 433 H VAL 969 H VAL 969 -1.655 -3.872 -7.608 434 HA VAL 969 HA VAL 969 -1.336 -5.936 -5.764 435 HB VAL 969 HB VAL 969 -3.543 -3.973 -6.360 436 1HG1 VAL 969 1HG1 VAL 969 -3.422 -6.070 -4.177 437 2HG1 VAL 969 2HG1 VAL 969 -4.433 -4.609 -4.069 438 3HG1 VAL 969 3HG1 VAL 969 -4.714 -5.792 -5.369 439 1HG2 VAL 969 1HG2 VAL 969 -1.987 -3.989 -3.816 440 2HG2 VAL 969 2HG2 VAL 969 -1.128 -3.497 -5.296 441 3HG2 VAL 969 3HG2 VAL 969 -2.593 -2.624 -4.785 442 H ASP 970 H ASP 970 -3.492 -5.547 -8.621 443 HA ASP 970 HA ASP 970 -5.199 -7.577 -8.222 444 1HB ASP 970 1HB ASP 970 -4.725 -5.913 -10.274 445 2HB ASP 970 2HB ASP 970 -3.903 -7.311 -10.939 446 H GLU 971 H GLU 971 -1.810 -7.673 -9.484 447 HA GLU 971 HA GLU 971 -1.876 -10.424 -10.057 448 1HB GLU 971 1HB GLU 971 0.373 -8.403 -9.734 449 2HB GLU 971 2HB GLU 971 0.693 -10.087 -10.100 450 1HG GLU 971 1HG GLU 971 -1.146 -9.673 -12.013 451 2HG GLU 971 2HG GLU 971 -0.670 -8.000 -11.803 452 H SER 972 H SER 972 -1.442 -8.524 -7.148 453 HA SER 972 HA SER 972 -0.036 -10.607 -5.786 454 1HB SER 972 1HB SER 972 -0.421 -7.824 -5.419 455 2HB SER 972 2HB SER 972 -1.226 -8.572 -4.054 456 HG SER 972 HG SER 972 1.144 -8.085 -3.817 457 H LEU 973 H LEU 973 -3.354 -9.524 -6.336 458 HA LEU 973 HA LEU 973 -4.736 -10.367 -4.195 459 1HB LEU 973 1HB LEU 973 -5.262 -9.758 -6.876 460 2HB LEU 973 2HB LEU 973 -5.990 -11.331 -6.620 461 HG LEU 973 HG LEU 973 -6.765 -8.682 -5.572 462 1HD1 LEU 973 1HD1 LEU 973 -8.213 -11.254 -6.237 463 2HD1 LEU 973 2HD1 LEU 973 -9.017 -9.799 -5.602 464 3HD1 LEU 973 3HD1 LEU 973 -8.177 -9.739 -7.171 465 1HD2 LEU 973 1HD2 LEU 973 -7.946 -9.971 -3.607 466 2HD2 LEU 973 2HD2 LEU 973 -6.555 -11.069 -3.777 467 3HD2 LEU 973 3HD2 LEU 973 -6.289 -9.344 -3.428 468 HA PRO 974 HA PRO 974 -4.388 -14.863 -5.592 469 1HB PRO 974 1HB PRO 974 -2.743 -15.550 -7.664 470 2HB PRO 974 2HB PRO 974 -4.461 -15.269 -7.858 471 1HG PRO 974 1HG PRO 974 -2.200 -13.526 -8.626 472 2HG PRO 974 2HG PRO 974 -3.863 -13.474 -9.177 473 1HD PRO 974 1HD PRO 974 -2.630 -11.718 -7.274 474 2HD PRO 974 2HD PRO 974 -4.319 -11.740 -7.738 475 H VAL 975 H VAL 975 -1.439 -13.031 -5.883 476 HA VAL 975 HA VAL 975 0.392 -14.883 -5.123 477 HB VAL 975 HB VAL 975 0.089 -11.952 -4.510 478 1HG1 VAL 975 1HG1 VAL 975 2.791 -12.575 -4.165 479 2HG1 VAL 975 2HG1 VAL 975 1.629 -12.119 -2.896 480 3HG1 VAL 975 3HG1 VAL 975 1.923 -13.836 -3.258 481 1HG2 VAL 975 1HG2 VAL 975 1.581 -11.599 -6.286 482 2HG2 VAL 975 2HG2 VAL 975 2.156 -13.284 -6.263 483 3HG2 VAL 975 3HG2 VAL 975 0.524 -12.908 -6.867 484 H LEU 976 H LEU 976 -2.154 -13.345 -3.169 485 HA LEU 976 HA LEU 976 -1.143 -14.830 -0.846 486 1HB LEU 976 1HB LEU 976 -3.034 -12.479 -0.848 487 2HB LEU 976 2HB LEU 976 -2.289 -13.247 0.540 488 HG LEU 976 HG LEU 976 -1.044 -11.312 0.285 489 1HD1 LEU 976 1HD1 LEU 976 0.642 -13.110 -1.447 490 2HD1 LEU 976 2HD1 LEU 976 1.144 -11.987 -0.161 491 3HD1 LEU 976 3HD1 LEU 976 0.308 -13.502 0.257 492 1HD2 LEU 976 1HD2 LEU 976 -0.664 -10.123 -1.621 493 2HD2 LEU 976 2HD2 LEU 976 -0.497 -11.576 -2.636 494 3HD2 LEU 976 3HD2 LEU 976 -2.112 -11.024 -2.130 495 HA PRO 977 HA PRO 977 -4.690 -17.281 -1.021 496 1HB PRO 977 1HB PRO 977 -4.994 -18.035 1.588 497 2HB PRO 977 2HB PRO 977 -3.831 -18.775 0.507 498 1HG PRO 977 1HG PRO 977 -3.359 -16.847 2.697 499 2HG PRO 977 2HG PRO 977 -2.212 -17.905 1.900 500 1HD PRO 977 1HD PRO 977 -2.519 -15.084 1.484 501 2HD PRO 977 2HD PRO 977 -1.454 -16.163 0.606 502 H ALA 978 H ALA 978 -6.780 -17.778 0.694 503 HA ALA 978 HA ALA 978 -8.399 -15.559 0.087 504 1HB ALA 978 1HB ALA 978 -9.308 -17.802 0.221 505 2HB ALA 978 2HB ALA 978 -8.773 -17.967 1.911 506 3HB ALA 978 3HB ALA 978 -10.066 -16.816 1.495 507 H SER 979 H SER 979 -9.655 -14.275 1.741 508 HA SER 979 HA SER 979 -9.863 -13.210 3.673 509 1HB SER 979 1HB SER 979 -7.127 -14.043 4.666 510 2HB SER 979 2HB SER 979 -8.545 -13.612 5.601 511 HG SER 979 HG SER 979 -9.098 -15.672 5.630 512 H THR 980 H THR 980 -8.186 -12.653 1.093 513 HA THR 980 HA THR 980 -6.775 -10.291 2.151 514 HB THR 980 HB THR 980 -5.483 -10.639 -0.128 515 HG1 THR 980 HG1 THR 980 -6.468 -13.318 0.509 516 1HG2 THR 980 1HG2 THR 980 -5.145 -12.852 1.952 517 2HG2 THR 980 2HG2 THR 980 -3.895 -12.158 0.892 518 3HG2 THR 980 3HG2 THR 980 -4.566 -11.192 2.229 519 H HIS 981 H HIS 981 -8.491 -11.571 -0.780 520 HA HIS 981 HA HIS 981 -8.877 -9.212 -2.047 521 1HB HIS 981 1HB HIS 981 -11.023 -10.304 -2.905 522 2HB HIS 981 2HB HIS 981 -9.509 -11.142 -3.185 523 HD1 HIS 981 HD1 HIS 981 -12.549 -11.272 -0.886 524 HD2 HIS 981 HD2 HIS 981 -9.373 -13.704 -2.147 525 HE1 HIS 981 HE1 HIS 981 -13.029 -13.605 0.028 526 H ARG 982 H ARG 982 -10.171 -10.225 1.029 527 HA ARG 982 HA ARG 982 -12.372 -8.423 0.904 528 1HB ARG 982 1HB ARG 982 -12.349 -10.603 2.230 529 2HB ARG 982 2HB ARG 982 -11.201 -9.869 3.332 530 1HG ARG 982 1HG ARG 982 -13.108 -9.279 4.478 531 2HG ARG 982 2HG ARG 982 -13.096 -7.923 3.368 532 1HD ARG 982 1HD ARG 982 -15.325 -8.835 3.277 533 2HD ARG 982 2HD ARG 982 -14.547 -9.320 1.783 534 HE ARG 982 HE ARG 982 -14.038 -11.382 3.656 535 1HH1 ARG 982 2HH2 ARG 982 -16.821 -9.928 2.067 536 2HH1 ARG 982 1HH2 ARG 982 -17.769 -11.377 2.121 537 1HH2 ARG 982 2HH1 ARG 982 -15.289 -13.293 3.727 538 2HH2 ARG 982 1HH1 ARG 982 -16.892 -13.304 3.071 539 H GLU 983 H GLU 983 -9.592 -8.746 3.243 540 HA GLU 983 HA GLU 983 -9.844 -6.151 4.172 541 1HB GLU 983 1HB GLU 983 -8.323 -8.417 4.803 542 2HB GLU 983 2HB GLU 983 -7.110 -7.244 4.330 543 1HG GLU 983 1HG GLU 983 -7.464 -5.945 6.181 544 2HG GLU 983 2HG GLU 983 -9.208 -6.073 6.055 545 H ILE 984 H ILE 984 -7.847 -7.598 1.550 546 HA ILE 984 HA ILE 984 -6.221 -5.414 1.050 547 HB ILE 984 HB ILE 984 -7.286 -7.579 -0.760 548 1HG1 ILE 984 1HG1 ILE 984 -4.888 -7.294 1.024 549 2HG1 ILE 984 2HG1 ILE 984 -6.003 -8.636 0.864 550 1HG2 ILE 984 1HG2 ILE 984 -4.850 -5.927 -1.374 551 2HG2 ILE 984 2HG2 ILE 984 -5.832 -6.948 -2.453 552 3HG2 ILE 984 3HG2 ILE 984 -6.470 -5.388 -1.880 553 1HD1 ILE 984 1HD1 ILE 984 -5.116 -8.939 -1.532 554 2HD1 ILE 984 2HD1 ILE 984 -3.835 -7.784 -1.096 555 3HD1 ILE 984 3HD1 ILE 984 -3.976 -9.328 -0.222 556 H GLU 985 H GLU 985 -9.380 -6.317 -0.505 557 HA GLU 985 HA GLU 985 -9.560 -4.141 -2.126 558 1HB GLU 985 1HB GLU 985 -11.071 -6.242 -1.941 559 2HB GLU 985 2HB GLU 985 -11.962 -5.360 -0.717 560 1HG GLU 985 1HG GLU 985 -11.403 -4.023 -3.375 561 2HG GLU 985 2HG GLU 985 -12.682 -5.218 -3.277 562 H MET 986 H MET 986 -10.524 -4.499 1.331 563 HA MET 986 HA MET 986 -11.702 -1.958 1.474 564 1HB MET 986 1HB MET 986 -10.670 -4.017 3.471 565 2HB MET 986 2HB MET 986 -11.220 -2.457 4.050 566 1HG MET 986 1HG MET 986 -13.310 -3.113 2.387 567 2HG MET 986 2HG MET 986 -12.802 -4.715 2.885 568 1HE MET 986 1HE MET 986 -14.783 -1.619 3.760 569 2HE MET 986 2HE MET 986 -15.584 -3.183 3.475 570 3HE MET 986 3HE MET 986 -15.703 -2.399 5.069 571 H ALA 987 H ALA 987 -8.387 -3.155 1.681 572 HA ALA 987 HA ALA 987 -7.402 -0.823 3.036 573 1HB ALA 987 1HB ALA 987 -5.911 -2.457 3.508 574 2HB ALA 987 2HB ALA 987 -6.416 -3.441 2.114 575 3HB ALA 987 3HB ALA 987 -5.238 -2.126 1.894 576 H GLN 988 H GLN 988 -8.376 -1.650 -0.172 577 HA GLN 988 HA GLN 988 -6.516 0.138 -1.413 578 1HB GLN 988 1HB GLN 988 -8.864 -1.491 -2.462 579 2HB GLN 988 2HB GLN 988 -7.930 -0.419 -3.485 580 1HG GLN 988 1HG GLN 988 -5.888 -1.808 -2.308 581 2HG GLN 988 2HG GLN 988 -7.142 -3.032 -2.248 582 1HE2 GLN 988 1HE2 GLN 988 -8.569 -2.859 -4.414 583 2HE2 GLN 988 2HE2 GLN 988 -7.649 -3.023 -5.873 584 H LYS 989 H LYS 989 -10.065 -0.016 -0.709 585 HA LYS 989 HA LYS 989 -10.753 2.387 -1.905 586 1HB LYS 989 1HB LYS 989 -12.308 0.598 -1.120 587 2HB LYS 989 2HB LYS 989 -12.010 1.097 0.534 588 1HG LYS 989 1HG LYS 989 -12.819 3.230 -1.436 589 2HG LYS 989 2HG LYS 989 -14.053 2.099 -0.918 590 1HD LYS 989 1HD LYS 989 -12.911 2.713 1.507 591 2HD LYS 989 2HD LYS 989 -12.642 4.217 0.649 592 1HE LYS 989 1HE LYS 989 -15.032 4.441 0.152 593 2HE LYS 989 2HE LYS 989 -15.364 2.839 0.779 594 1HZ LYS 989 1HZ LYS 989 -14.467 5.179 2.302 595 2HZ LYS 989 2HZ LYS 989 -15.879 4.373 2.452 596 3HZ LYS 989 3HZ LYS 989 -14.484 3.672 2.931 597 H LEU 990 H LEU 990 -9.518 1.654 1.404 598 HA LEU 990 HA LEU 990 -9.809 4.250 2.394 599 1HB LEU 990 1HB LEU 990 -9.139 1.835 3.413 600 2HB LEU 990 2HB LEU 990 -7.560 2.596 3.371 601 HG LEU 990 HG LEU 990 -10.010 3.732 4.749 602 1HD1 LEU 990 1HD1 LEU 990 -8.309 1.641 5.570 603 2HD1 LEU 990 2HD1 LEU 990 -7.836 3.073 6.516 604 3HD1 LEU 990 3HD1 LEU 990 -9.525 2.511 6.535 605 1HD2 LEU 990 1HD2 LEU 990 -8.911 5.639 5.095 606 2HD2 LEU 990 2HD2 LEU 990 -7.410 4.791 5.540 607 3HD2 LEU 990 3HD2 LEU 990 -7.784 5.098 3.827 608 H LEU 991 H LEU 991 -6.777 2.590 1.253 609 HA LEU 991 HA LEU 991 -5.198 4.835 1.252 610 1HB LEU 991 1HB LEU 991 -4.274 2.653 1.065 611 2HB LEU 991 2HB LEU 991 -5.140 2.332 -0.424 612 HG LEU 991 HG LEU 991 -3.781 3.975 -1.617 613 1HD1 LEU 991 1HD1 LEU 991 -1.651 4.727 -0.214 614 2HD1 LEU 991 2HD1 LEU 991 -3.150 5.687 -0.255 615 3HD1 LEU 991 3HD1 LEU 991 -2.814 4.619 1.129 616 1HD2 LEU 991 1HD2 LEU 991 -3.053 1.578 -1.339 617 2HD2 LEU 991 2HD2 LEU 991 -1.758 2.736 -1.728 618 3HD2 LEU 991 3HD2 LEU 991 -1.948 2.140 -0.062 619 H ASN 992 H ASN 992 -7.346 3.546 -1.352 620 HA ASN 992 HA ASN 992 -6.614 5.396 -3.256 621 1HB ASN 992 1HB ASN 992 -8.010 3.322 -3.647 622 2HB ASN 992 2HB ASN 992 -9.356 4.093 -2.831 623 1HD2 ASN 992 1HD2 ASN 992 -8.084 3.390 -5.747 624 2HD2 ASN 992 2HD2 ASN 992 -8.782 4.624 -6.742 625 H SER 993 H SER 993 -9.029 5.431 -0.583 626 HA SER 993 HA SER 993 -10.431 7.669 -1.345 627 1HB SER 993 1HB SER 993 -11.094 6.093 0.472 628 2HB SER 993 2HB SER 993 -9.787 6.693 1.474 629 HG SER 993 HG SER 993 -11.292 8.063 2.171 630 H ASP 994 H ASP 994 -7.949 7.530 1.322 631 HA ASP 994 HA ASP 994 -7.647 10.206 1.586 632 1HB ASP 994 1HB ASP 994 -6.056 7.780 2.207 633 2HB ASP 994 2HB ASP 994 -5.072 9.220 2.040 634 H LEU 995 H LEU 995 -6.591 8.057 -0.982 635 HA LEU 995 HA LEU 995 -4.370 9.515 -1.900 636 1HB LEU 995 1HB LEU 995 -4.258 7.523 -2.871 637 2HB LEU 995 2HB LEU 995 -5.980 7.235 -2.715 638 HG LEU 995 HG LEU 995 -6.358 8.647 -4.745 639 1HD1 LEU 995 1HD1 LEU 995 -3.431 8.441 -5.370 640 2HD1 LEU 995 2HD1 LEU 995 -4.668 9.533 -6.038 641 3HD1 LEU 995 3HD1 LEU 995 -4.039 9.800 -4.394 642 1HD2 LEU 995 1HD2 LEU 995 -6.496 6.587 -5.579 643 2HD2 LEU 995 2HD2 LEU 995 -4.832 6.822 -6.166 644 3HD2 LEU 995 3HD2 LEU 995 -5.120 6.010 -4.608 645 H ALA 996 H ALA 996 -7.785 9.365 -3.147 646 HA ALA 996 HA ALA 996 -7.503 11.403 -4.989 647 1HB ALA 996 1HB ALA 996 -10.023 11.571 -4.716 648 2HB ALA 996 2HB ALA 996 -9.404 9.932 -5.030 649 3HB ALA 996 3HB ALA 996 -9.882 10.403 -3.381 650 H GLU 997 H GLU 997 -8.712 11.561 -1.565 651 HA GLU 997 HA GLU 997 -9.203 14.219 -1.478 652 1HB GLU 997 1HB GLU 997 -9.512 12.332 0.310 653 2HB GLU 997 2HB GLU 997 -7.906 12.776 0.855 654 1HG GLU 997 1HG GLU 997 -8.885 14.412 2.088 655 2HG GLU 997 2HG GLU 997 -9.194 15.256 0.583 656 H LEU 998 H LEU 998 -6.113 12.572 -1.705 657 HA LEU 998 HA LEU 998 -4.547 14.689 -0.637 658 1HB LEU 998 1HB LEU 998 -4.088 12.111 -1.036 659 2HB LEU 998 2HB LEU 998 -3.462 12.690 -2.567 660 HG LEU 998 HG LEU 998 -2.401 14.307 -0.425 661 1HD1 LEU 998 1HD1 LEU 998 -1.430 12.839 1.037 662 2HD1 LEU 998 2HD1 LEU 998 -2.962 11.993 0.714 663 3HD1 LEU 998 3HD1 LEU 998 -1.472 11.482 -0.114 664 1HD2 LEU 998 1HD2 LEU 998 -1.601 13.594 -2.874 665 2HD2 LEU 998 2HD2 LEU 998 -0.472 14.125 -1.605 666 3HD2 LEU 998 3HD2 LEU 998 -0.695 12.389 -1.928 667 H ILE 999 H ILE 999 -5.298 13.546 -4.000 668 HA ILE 999 HA ILE 999 -3.885 15.433 -5.374 669 HB ILE 999 HB ILE 999 -6.398 13.905 -5.917 670 1HG1 ILE 999 1HG1 ILE 999 -4.507 13.410 -7.885 671 2HG1 ILE 999 2HG1 ILE 999 -3.528 13.650 -6.451 672 1HG2 ILE 999 1HG2 ILE 999 -5.857 14.874 -8.375 673 2HG2 ILE 999 2HG2 ILE 999 -7.072 15.573 -7.279 674 3HG2 ILE 999 3HG2 ILE 999 -5.449 16.297 -7.386 675 1HD1 ILE 999 1HD1 ILE 999 -4.402 11.796 -5.360 676 2HD1 ILE 999 2HD1 ILE 999 -5.987 11.944 -6.156 677 3HD1 ILE 999 3HD1 ILE 999 -4.605 11.259 -7.044 678 H ASN1000 H ASN1000 -7.243 15.688 -4.042 679 HA ASN1000 HA ASN1000 -7.716 18.218 -5.029 680 1HB ASN1000 1HB ASN1000 -9.239 16.416 -3.731 681 2HB ASN1000 2HB ASN1000 -8.809 17.376 -2.330 682 1HD2 ASN1000 1HD2 ASN1000 -10.906 17.013 -4.893 683 2HD2 ASN1000 2HD2 ASN1000 -11.672 18.566 -4.900 684 H LYS1001 H LYS1001 -6.535 17.057 -1.784 685 HA LYS1001 HA LYS1001 -6.325 19.335 -0.399 686 1HB LYS1001 1HB LYS1001 -4.684 16.847 -0.531 687 2HB LYS1001 2HB LYS1001 -4.027 18.193 0.378 688 1HG LYS1001 1HG LYS1001 -6.901 17.291 0.792 689 2HG LYS1001 2HG LYS1001 -5.580 16.489 1.620 690 1HD LYS1001 1HD LYS1001 -5.084 18.346 2.944 691 2HD LYS1001 2HD LYS1001 -5.628 19.494 1.736 692 1HE LYS1001 1HE LYS1001 -8.022 18.408 2.226 693 2HE LYS1001 2HE LYS1001 -7.270 17.920 3.731 694 1HZ LYS1001 1HZ LYS1001 -8.110 19.989 4.182 695 2HZ LYS1001 2HZ LYS1001 -6.554 20.348 3.842 696 3HZ LYS1001 3HZ LYS1001 -7.717 20.621 2.729 697 H MET1002 H MET1002 -4.283 18.326 -3.158 698 HA MET1002 HA MET1002 -2.475 20.476 -2.783 699 1HB MET1002 1HB MET1002 -1.667 18.481 -3.904 700 2HB MET1002 2HB MET1002 -3.035 18.448 -4.999 701 1HG MET1002 1HG MET1002 -1.279 20.898 -5.059 702 2HG MET1002 2HG MET1002 -0.626 19.423 -5.744 703 1HE MET1002 1HE MET1002 -1.111 18.492 -7.850 704 2HE MET1002 2HE MET1002 -2.678 17.839 -7.317 705 3HE MET1002 3HE MET1002 -2.562 18.733 -8.851 706 H LYS1003 H LYS1003 -4.984 19.707 -5.309 707 HA LYS1003 HA LYS1003 -4.844 21.939 -6.806 708 1HB LYS1003 1HB LYS1003 -6.939 19.984 -6.117 709 2HB LYS1003 2HB LYS1003 -7.561 21.524 -6.674 710 1HG LYS1003 1HG LYS1003 -6.105 21.393 -8.698 711 2HG LYS1003 2HG LYS1003 -5.447 19.869 -8.136 712 1HD LYS1003 1HD LYS1003 -7.141 19.214 -9.663 713 2HD LYS1003 2HD LYS1003 -7.898 19.005 -8.096 714 1HE LYS1003 1HE LYS1003 -8.199 21.718 -9.335 715 2HE LYS1003 2HE LYS1003 -9.038 20.412 -10.148 716 1HZ LYS1003 1HZ LYS1003 -10.480 20.272 -8.494 717 2HZ LYS1003 2HZ LYS1003 -9.340 20.317 -7.326 718 3HZ LYS1003 3HZ LYS1003 -9.911 21.708 -7.963 719 H LEU1004 H LEU1004 -5.942 21.668 -3.459 720 HA LEU1004 HA LEU1004 -7.143 24.289 -3.504 721 1HB LEU1004 1HB LEU1004 -6.571 22.527 -1.125 722 2HB LEU1004 2HB LEU1004 -7.696 23.868 -1.223 723 HG LEU1004 HG LEU1004 -8.037 21.418 -2.950 724 1HD1 LEU1004 1HD1 LEU1004 -9.511 20.456 -1.267 725 2HD1 LEU1004 2HD1 LEU1004 -7.861 20.647 -0.625 726 3HD1 LEU1004 3HD1 LEU1004 -9.139 21.792 -0.151 727 1HD2 LEU1004 1HD2 LEU1004 -9.379 23.884 -2.768 728 2HD2 LEU1004 2HD2 LEU1004 -9.867 22.436 -3.681 729 3HD2 LEU1004 3HD2 LEU1004 -10.454 22.681 -2.018 730 H ALA1005 H ALA1005 -4.332 22.700 -1.832 731 HA ALA1005 HA ALA1005 -3.247 24.804 -0.579 732 1HB ALA1005 1HB ALA1005 -0.990 23.671 -1.354 733 2HB ALA1005 2HB ALA1005 -2.126 22.781 -0.311 734 3HB ALA1005 3HB ALA1005 -2.079 22.454 -2.060 735 H GLN1006 H GLN1006 -3.412 24.256 -4.091 736 HA GLN1006 HA GLN1006 -1.465 26.015 -4.883 737 1HB GLN1006 1HB GLN1006 -4.043 25.040 -6.133 738 2HB GLN1006 2HB GLN1006 -3.090 26.257 -6.957 739 1HG GLN1006 1HG GLN1006 -1.270 24.215 -6.060 740 2HG GLN1006 2HG GLN1006 -2.628 23.405 -6.813 741 1HE2 GLN1006 1HE2 GLN1006 0.253 25.068 -7.280 742 2HE2 GLN1006 2HE2 GLN1006 0.187 25.320 -8.993 743 H GLN1007 H GLN1007 -5.018 26.615 -4.392 744 HA GLN1007 HA GLN1007 -4.535 29.431 -4.682 745 1HB GLN1007 1HB GLN1007 -6.654 27.848 -5.366 746 2HB GLN1007 2HB GLN1007 -7.217 28.434 -3.813 747 1HG GLN1007 1HG GLN1007 -7.154 30.714 -4.503 748 2HG GLN1007 2HG GLN1007 -6.070 30.381 -5.839 749 1HE2 GLN1007 1HE2 GLN1007 -9.320 29.767 -4.585 750 2HE2 GLN1007 2HE2 GLN1007 -10.131 29.620 -6.108 751 H TYR1008 H TYR1008 -4.248 27.149 -2.215 752 HA TYR1008 HA TYR1008 -5.023 29.089 -0.149 753 1HB TYR1008 1HB TYR1008 -4.749 26.065 -0.451 754 2HB TYR1008 2HB TYR1008 -4.554 26.742 1.154 755 HD1 TYR1008 HD1 TYR1008 -6.472 28.113 2.142 756 HD2 TYR1008 HD2 TYR1008 -6.904 25.714 -1.374 757 HE1 TYR1008 HE1 TYR1008 -8.997 28.120 2.439 758 HE2 TYR1008 HE2 TYR1008 -9.428 25.729 -1.065 759 HH TYR1008 HH TYR1008 -10.965 27.848 1.108 760 H VAL1009 H VAL1009 -2.507 29.151 -1.826 761 HA VAL1009 HA VAL1009 -0.607 28.774 0.385 762 HB VAL1009 HB VAL1009 -0.159 27.177 -1.337 763 1HG1 VAL1009 1HG1 VAL1009 0.564 28.805 -3.579 764 2HG1 VAL1009 2HG1 VAL1009 -0.674 27.530 -3.476 765 3HG1 VAL1009 3HG1 VAL1009 -1.099 29.216 -3.093 766 1HG2 VAL1009 1HG2 VAL1009 2.063 28.502 -2.291 767 2HG2 VAL1009 2HG2 VAL1009 1.683 29.403 -0.804 768 3HG2 VAL1009 3HG2 VAL1009 1.955 27.645 -0.735 769 H MET1010 H MET1010 -1.828 30.792 -2.301 770 HA MET1010 HA MET1010 0.114 32.817 -1.789 771 1HB MET1010 1HB MET1010 -1.335 34.080 -3.496 772 2HB MET1010 2HB MET1010 -0.704 32.550 -4.072 773 1HG MET1010 1HG MET1010 -2.837 31.927 -4.544 774 2HG MET1010 2HG MET1010 -3.146 31.862 -2.820 775 1HE MET1010 1HE MET1010 -4.639 32.727 -1.836 776 2HE MET1010 2HE MET1010 -4.974 34.471 -1.713 777 3HE MET1010 3HE MET1010 -6.005 33.436 -2.730 778 H THR1011 H THR1011 -2.016 31.844 0.292 779 HA THR1011 HA THR1011 -2.821 34.558 1.060 780 HB THR1011 HB THR1011 -4.783 33.488 -0.007 781 HG1 THR1011 HG1 THR1011 -4.813 33.269 2.919 782 1HG2 THR1011 1HG2 THR1011 -5.425 31.312 0.369 783 2HG2 THR1011 2HG2 THR1011 -3.774 31.078 0.991 784 3HG2 THR1011 3HG2 THR1011 -5.105 31.441 2.115 785 H SER1012 H SER1012 -0.797 32.163 1.726 786 HA SER1012 HA SER1012 0.375 31.843 3.563 787 1HB SER1012 1HB SER1012 -0.840 34.052 4.408 788 2HB SER1012 2HB SER1012 -1.756 32.940 5.405 789 HG SER1012 HG SER1012 0.016 32.444 6.590 790 H LEU1013 H LEU1013 -2.766 30.809 2.820 791 HA LEU1013 HA LEU1013 -3.361 29.139 4.986 792 1HB LEU1013 1HB LEU1013 -4.224 29.396 2.146 793 2HB LEU1013 2HB LEU1013 -4.621 27.914 2.993 794 HG LEU1013 HG LEU1013 -6.223 30.057 2.946 795 1HD1 LEU1013 1HD1 LEU1013 -6.225 27.632 4.187 796 2HD1 LEU1013 2HD1 LEU1013 -6.299 28.738 5.580 797 3HD1 LEU1013 3HD1 LEU1013 -7.531 28.836 4.299 798 1HD2 LEU1013 1HD2 LEU1013 -4.416 31.399 4.140 799 2HD2 LEU1013 2HD2 LEU1013 -6.059 31.468 4.821 800 3HD2 LEU1013 3HD2 LEU1013 -4.819 30.449 5.590 801 H GLN1014 H GLN1014 -0.821 29.039 2.680 802 HA GLN1014 HA GLN1014 -0.508 26.470 2.027 803 1HB GLN1014 1HB GLN1014 1.054 28.209 1.326 804 2HB GLN1014 2HB GLN1014 1.610 28.447 2.970 805 1HG GLN1014 1HG GLN1014 1.947 25.674 2.502 806 2HG GLN1014 2HG GLN1014 2.447 26.436 1.005 807 1HE2 GLN1014 1HE2 GLN1014 3.296 25.617 4.147 808 2HE2 GLN1014 2HE2 GLN1014 4.769 26.514 4.311 809 H GLN1015 H GLN1015 1.449 27.717 4.808 810 HA GLN1015 HA GLN1015 2.111 25.443 5.936 811 1HB GLN1015 1HB GLN1015 2.118 26.628 8.141 812 2HB GLN1015 2HB GLN1015 2.802 27.594 6.848 813 1HG GLN1015 1HG GLN1015 1.371 29.216 7.595 814 2HG GLN1015 2HG GLN1015 0.165 28.347 6.667 815 1HE2 GLN1015 1HE2 GLN1015 -1.599 28.620 7.865 816 2HE2 GLN1015 2HE2 GLN1015 -1.811 28.095 9.502 817 H GLU1016 H GLU1016 -1.154 26.862 5.961 818 HA GLU1016 HA GLU1016 -2.153 25.193 7.981 819 1HB GLU1016 1HB GLU1016 -3.065 27.422 6.660 820 2HB GLU1016 2HB GLU1016 -4.043 26.184 5.899 821 1HG GLU1016 1HG GLU1016 -4.911 25.429 8.048 822 2HG GLU1016 2HG GLU1016 -3.761 26.417 8.927 823 H TYR1017 H TYR1017 -2.698 25.165 4.377 824 HA TYR1017 HA TYR1017 -3.867 22.589 4.434 825 1HB TYR1017 1HB TYR1017 -2.840 24.678 2.499 826 2HB TYR1017 2HB TYR1017 -2.973 23.057 1.847 827 HD1 TYR1017 HD1 TYR1017 -5.032 22.277 1.035 828 HD2 TYR1017 HD2 TYR1017 -4.961 25.669 3.641 829 HE1 TYR1017 HE1 TYR1017 -7.513 22.654 0.623 830 HE2 TYR1017 HE2 TYR1017 -7.442 26.035 3.220 831 HH TYR1017 HH TYR1017 -9.417 23.773 2.018 832 H LYS1018 H LYS1018 -0.627 23.631 4.795 833 HA LYS1018 HA LYS1018 0.643 21.570 3.320 834 1HB LYS1018 1HB LYS1018 1.403 23.918 4.647 835 2HB LYS1018 2HB LYS1018 2.190 22.635 5.544 836 1HG LYS1018 1HG LYS1018 2.346 22.201 2.630 837 2HG LYS1018 2HG LYS1018 3.058 23.731 3.105 838 1HD LYS1018 1HD LYS1018 4.748 21.919 3.165 839 2HD LYS1018 2HD LYS1018 4.498 22.590 4.765 840 1HE LYS1018 1HE LYS1018 2.899 20.702 5.274 841 2HE LYS1018 2HE LYS1018 3.238 20.017 3.697 842 1HZ LYS1018 1HZ LYS1018 4.853 18.981 4.788 843 2HZ LYS1018 2HZ LYS1018 5.685 20.383 4.687 844 3HZ LYS1018 3HZ LYS1018 4.858 20.021 6.048 845 H LYS1019 H LYS1019 -0.120 22.050 6.835 846 HA LYS1019 HA LYS1019 0.875 19.528 7.583 847 1HB LYS1019 1HB LYS1019 -0.753 21.687 8.855 848 2HB LYS1019 2HB LYS1019 -0.774 20.103 9.603 849 1HG LYS1019 1HG LYS1019 1.044 21.419 10.582 850 2HG LYS1019 2HG LYS1019 1.733 20.100 9.655 851 1HD LYS1019 1HD LYS1019 1.285 22.594 8.088 852 2HD LYS1019 2HD LYS1019 2.450 22.760 9.386 853 1HE LYS1019 1HE LYS1019 2.538 20.585 7.239 854 2HE LYS1019 2HE LYS1019 3.506 22.046 7.219 855 1HZ LYS1019 1HZ LYS1019 4.328 21.309 9.446 856 2HZ LYS1019 2HZ LYS1019 3.623 19.863 9.168 857 3HZ LYS1019 3HZ LYS1019 4.811 20.394 8.182 858 H GLN1020 H GLN1020 -2.206 20.682 6.254 859 HA GLN1020 HA GLN1020 -3.781 18.561 7.041 860 1HB GLN1020 1HB GLN1020 -3.909 20.333 4.565 861 2HB GLN1020 2HB GLN1020 -5.179 19.210 5.008 862 1HG GLN1020 1HG GLN1020 -4.152 21.436 6.831 863 2HG GLN1020 2HG GLN1020 -5.574 21.577 5.817 864 1HE2 GLN1020 1HE2 GLN1020 -4.271 20.481 8.753 865 2HE2 GLN1020 2HE2 GLN1020 -5.665 19.695 9.416 866 H MET1021 H MET1021 -2.165 19.081 3.816 867 HA MET1021 HA MET1021 -2.769 16.630 2.787 868 1HB MET1021 1HB MET1021 -0.895 17.089 1.218 869 2HB MET1021 2HB MET1021 -1.764 18.576 1.543 870 1HG MET1021 1HG MET1021 0.024 19.538 2.621 871 2HG MET1021 2HG MET1021 0.438 18.061 3.468 872 1HE MET1021 1HE MET1021 2.165 16.196 2.476 873 2HE MET1021 2HE MET1021 0.703 15.926 1.497 874 3HE MET1021 3HE MET1021 2.298 16.015 0.711 875 H LEU1022 H LEU1022 -0.445 17.486 5.278 876 HA LEU1022 HA LEU1022 1.211 15.194 4.931 877 1HB LEU1022 1HB LEU1022 1.604 17.543 6.082 878 2HB LEU1022 2HB LEU1022 1.023 16.698 7.502 879 HG LEU1022 HG LEU1022 3.083 15.198 6.045 880 1HD1 LEU1022 1HD1 LEU1022 4.964 16.614 6.644 881 2HD1 LEU1022 2HD1 LEU1022 3.865 17.475 5.540 882 3HD1 LEU1022 3HD1 LEU1022 3.858 17.856 7.279 883 1HD2 LEU1022 1HD2 LEU1022 3.142 16.147 8.908 884 2HD2 LEU1022 2HD2 LEU1022 2.107 14.799 8.378 885 3HD2 LEU1022 3HD2 LEU1022 3.874 14.691 8.191 886 H THR1023 H THR1023 -1.553 16.107 7.071 887 HA THR1023 HA THR1023 -1.589 13.948 8.739 888 HB THR1023 HB THR1023 -4.014 15.277 7.425 889 HG1 THR1023 HG1 THR1023 -3.150 17.052 8.419 890 1HG2 THR1023 1HG2 THR1023 -5.181 14.207 9.070 891 2HG2 THR1023 2HG2 THR1023 -3.686 13.431 9.643 892 3HG2 THR1023 3HG2 THR1023 -4.164 15.022 10.282 893 H ALA1024 H ALA1024 -2.927 14.129 5.390 894 HA ALA1024 HA ALA1024 -3.829 11.425 5.503 895 1HB ALA1024 1HB ALA1024 -5.090 12.580 3.983 896 2HB ALA1024 2HB ALA1024 -3.759 13.681 3.554 897 3HB ALA1024 3HB ALA1024 -3.816 12.041 2.864 898 H ALA1025 H ALA1025 -0.967 13.191 4.208 899 HA ALA1025 HA ALA1025 0.162 11.057 2.830 900 1HB ALA1025 1HB ALA1025 2.209 12.384 2.938 901 2HB ALA1025 2HB ALA1025 0.818 13.461 2.667 902 3HB ALA1025 3HB ALA1025 1.551 13.343 4.285 903 H HIS1026 H HIS1026 0.036 11.875 6.291 904 HA HIS1026 HA HIS1026 2.102 10.051 6.995 905 1HB HIS1026 1HB HIS1026 0.818 12.175 8.216 906 2HB HIS1026 2HB HIS1026 0.183 10.795 9.091 907 HD1 HIS1026 HD1 HIS1026 3.643 12.047 7.976 908 HD2 HIS1026 HD2 HIS1026 1.787 10.051 11.165 909 HE1 HIS1026 HE1 HIS1026 5.453 11.671 9.735 910 H ALA1027 H ALA1027 -1.519 10.067 7.280 911 HA ALA1027 HA ALA1027 -1.686 7.471 8.311 912 1HB ALA1027 1HB ALA1027 -3.992 7.774 8.099 913 2HB ALA1027 2HB ALA1027 -3.407 9.455 8.160 914 3HB ALA1027 3HB ALA1027 -3.834 8.717 6.597 915 H LEU1028 H LEU1028 -1.460 8.791 4.993 916 HA LEU1028 HA LEU1028 -2.266 6.539 3.601 917 1HB LEU1028 1HB LEU1028 -0.542 8.905 3.037 918 2HB LEU1028 2HB LEU1028 -0.505 7.568 1.905 919 HG LEU1028 HG LEU1028 -2.811 9.366 2.625 920 1HD1 LEU1028 1HD1 LEU1028 -1.053 9.722 0.709 921 2HD1 LEU1028 2HD1 LEU1028 -2.047 8.517 -0.144 922 3HD1 LEU1028 3HD1 LEU1028 -2.783 10.033 0.427 923 1HD2 LEU1028 1HD2 LEU1028 -3.993 7.397 2.751 924 2HD2 LEU1028 2HD2 LEU1028 -4.108 7.758 1.012 925 3HD2 LEU1028 3HD2 LEU1028 -2.934 6.554 1.595 926 H ALA1029 H ALA1029 1.153 7.562 4.317 927 HA ALA1029 HA ALA1029 2.501 5.442 3.434 928 1HB ALA1029 1HB ALA1029 4.046 5.845 5.423 929 2HB ALA1029 2HB ALA1029 3.635 7.285 4.461 930 3HB ALA1029 3HB ALA1029 2.830 6.999 6.022 931 H VAL1030 H VAL1030 0.682 5.600 6.559 932 HA VAL1030 HA VAL1030 1.373 2.948 7.284 933 HB VAL1030 HB VAL1030 -0.474 5.086 8.245 934 1HG1 VAL1030 1HG1 VAL1030 -2.041 3.543 8.775 935 2HG1 VAL1030 2HG1 VAL1030 -0.906 2.181 8.619 936 3HG1 VAL1030 3HG1 VAL1030 -0.929 3.154 10.109 937 1HG2 VAL1030 1HG2 VAL1030 1.500 3.392 9.794 938 2HG2 VAL1030 2HG2 VAL1030 1.982 4.845 8.886 939 3HG2 VAL1030 3HG2 VAL1030 0.821 4.979 10.228 940 H ASP1031 H ASP1031 -1.641 4.491 5.968 941 HA ASP1031 HA ASP1031 -3.257 2.402 5.849 942 1HB ASP1031 1HB ASP1031 -2.707 4.554 3.772 943 2HB ASP1031 2HB ASP1031 -3.990 3.385 3.529 944 H ALA1032 H ALA1032 -0.774 3.291 3.331 945 HA ALA1032 HA ALA1032 -1.198 1.154 1.631 946 1HB ALA1032 1HB ALA1032 1.599 1.893 1.751 947 2HB ALA1032 2HB ALA1032 0.389 2.272 0.501 948 3HB ALA1032 3HB ALA1032 0.582 3.345 1.909 949 H LYS1033 H LYS1033 0.768 1.443 4.626 950 HA LYS1033 HA LYS1033 2.049 -1.045 4.338 951 1HB LYS1033 1HB LYS1033 2.504 1.065 5.881 952 2HB LYS1033 2HB LYS1033 1.524 0.170 7.025 953 1HG LYS1033 1HG LYS1033 3.677 -0.638 7.508 954 2HG LYS1033 2HG LYS1033 3.071 -1.871 6.420 955 1HD LYS1033 1HD LYS1033 5.044 -1.485 5.308 956 2HD LYS1033 2HD LYS1033 4.142 -0.171 4.579 957 1HE LYS1033 1HE LYS1033 4.975 1.365 6.410 958 2HE LYS1033 2HE LYS1033 5.944 0.047 7.039 959 1HZ LYS1033 1HZ LYS1033 6.166 1.066 4.292 960 2HZ LYS1033 2HZ LYS1033 7.141 1.522 5.521 961 3HZ LYS1033 3HZ LYS1033 7.145 -0.028 5.007 962 H ASN1034 H ASN1034 -0.994 0.022 5.955 963 HA ASN1034 HA ASN1034 -1.569 -2.317 7.226 964 1HB ASN1034 1HB ASN1034 -2.815 0.051 7.083 965 2HB ASN1034 2HB ASN1034 -3.769 -0.745 5.847 966 1HD2 ASN1034 1HD2 ASN1034 -5.316 -0.069 7.678 967 2HD2 ASN1034 2HD2 ASN1034 -5.718 -1.293 8.836 968 H LEU1035 H LEU1035 -1.913 -1.322 3.805 969 HA LEU1035 HA LEU1035 -3.677 -3.290 2.946 970 1HB LEU1035 1HB LEU1035 -2.996 -1.244 1.722 971 2HB LEU1035 2HB LEU1035 -1.432 -1.971 1.414 972 HG LEU1035 HG LEU1035 -3.908 -3.430 0.552 973 1HD1 LEU1035 1HD1 LEU1035 -4.585 -1.810 -0.803 974 2HD1 LEU1035 2HD1 LEU1035 -3.212 -0.779 -0.335 975 3HD1 LEU1035 3HD1 LEU1035 -3.037 -1.940 -1.672 976 1HD2 LEU1035 1HD2 LEU1035 -2.077 -3.729 -1.420 977 2HD2 LEU1035 2HD2 LEU1035 -1.007 -3.492 -0.018 978 3HD2 LEU1035 3HD2 LEU1035 -2.212 -4.802 -0.007 979 H LEU1036 H LEU1036 -0.050 -3.254 2.647 980 HA LEU1036 HA LEU1036 0.052 -5.967 1.914 981 1HB LEU1036 1HB LEU1036 1.762 -3.817 1.915 982 2HB LEU1036 2HB LEU1036 2.443 -4.829 3.173 983 HG LEU1036 HG LEU1036 1.991 -6.654 1.158 984 1HD1 LEU1036 1HD1 LEU1036 3.392 -4.661 -0.451 985 2HD1 LEU1036 2HD1 LEU1036 2.080 -5.781 -0.891 986 3HD1 LEU1036 3HD1 LEU1036 1.698 -4.221 -0.124 987 1HD2 LEU1036 1HD2 LEU1036 4.607 -5.846 0.748 988 2HD2 LEU1036 2HD2 LEU1036 4.263 -5.320 2.413 989 3HD2 LEU1036 3HD2 LEU1036 4.039 -7.025 1.955 990 H ASP1037 H ASP1037 0.316 -4.216 5.045 991 HA ASP1037 HA ASP1037 1.291 -6.024 6.682 992 1HB ASP1037 1HB ASP1037 0.248 -3.797 7.291 993 2HB ASP1037 2HB ASP1037 -1.333 -4.547 7.193 994 H VAL1038 H VAL1038 -2.160 -5.903 5.525 995 HA VAL1038 HA VAL1038 -2.992 -8.210 6.876 996 HB VAL1038 HB VAL1038 -4.002 -6.729 4.449 997 1HG1 VAL1038 1HG1 VAL1038 -6.056 -8.324 5.648 998 2HG1 VAL1038 2HG1 VAL1038 -5.434 -8.372 3.982 999 3HG1 VAL1038 3HG1 VAL1038 -4.683 -9.381 5.241 1000 1HG2 VAL1038 1HG2 VAL1038 -4.035 -6.037 7.113 1001 2HG2 VAL1038 2HG2 VAL1038 -5.166 -5.438 5.876 1002 3HG2 VAL1038 3HG2 VAL1038 -5.621 -6.817 6.904 1003 H ILE1039 H ILE1039 -1.571 -7.642 3.616 1004 HA ILE1039 HA ILE1039 -1.951 -10.217 2.637 1005 HB ILE1039 HB ILE1039 -0.145 -7.926 2.027 1006 1HG1 ILE1039 1HG1 ILE1039 -2.018 -9.487 0.236 1007 2HG1 ILE1039 2HG1 ILE1039 -2.557 -8.163 1.249 1008 1HG2 ILE1039 1HG2 ILE1039 1.509 -9.290 1.385 1009 2HG2 ILE1039 2HG2 ILE1039 0.472 -10.736 1.429 1010 3HG2 ILE1039 3HG2 ILE1039 0.453 -9.670 0.004 1011 1HD1 ILE1039 1HD1 ILE1039 -2.048 -6.918 -0.618 1012 2HD1 ILE1039 2HD1 ILE1039 -0.410 -6.962 0.075 1013 3HD1 ILE1039 3HD1 ILE1039 -0.863 -8.106 -1.212 1014 H ASP1040 H ASP1040 0.737 -8.763 4.564 1015 HA ASP1040 HA ASP1040 2.488 -10.803 4.477 1016 1HB ASP1040 1HB ASP1040 1.808 -8.635 6.370 1017 2HB ASP1040 2HB ASP1040 2.557 -10.003 7.168 1018 H GLN1041 H GLN1041 -0.478 -10.408 6.498 1019 HA GLN1041 HA GLN1041 0.015 -12.762 7.989 1020 1HB GLN1041 1HB GLN1041 -2.200 -10.743 7.765 1021 2HB GLN1041 2HB GLN1041 -2.604 -12.302 8.455 1022 1HG GLN1041 1HG GLN1041 -0.903 -12.068 10.187 1023 2HG GLN1041 2HG GLN1041 -0.227 -10.648 9.414 1024 1HE2 GLN1041 1HE2 GLN1041 -3.090 -11.966 10.997 1025 2HE2 GLN1041 2HE2 GLN1041 -3.732 -10.475 11.600 1026 H ALA1042 H ALA1042 -1.237 -12.058 4.834 1027 HA ALA1042 HA ALA1042 -2.962 -14.350 4.694 1028 1HB ALA1042 1HB ALA1042 -3.407 -13.600 2.483 1029 2HB ALA1042 2HB ALA1042 -3.193 -12.115 3.441 1030 3HB ALA1042 3HB ALA1042 -1.876 -12.697 2.394 1031 H ARG1043 H ARG1043 0.062 -13.378 2.914 1032 HA ARG1043 HA ARG1043 0.620 -15.609 1.662 1033 1HB ARG1043 1HB ARG1043 3.143 -14.994 2.710 1034 2HB ARG1043 2HB ARG1043 2.422 -14.253 1.295 1035 1HG ARG1043 1HG ARG1043 1.671 -12.354 2.502 1036 2HG ARG1043 2HG ARG1043 1.724 -13.185 4.043 1037 1HD ARG1043 1HD ARG1043 4.376 -13.116 2.763 1038 2HD ARG1043 2HD ARG1043 3.724 -11.504 2.981 1039 HE ARG1043 HE ARG1043 3.454 -13.228 5.347 1040 1HH1 ARG1043 2HH2 ARG1043 5.490 -10.910 3.656 1041 2HH1 ARG1043 1HH2 ARG1043 6.370 -10.453 5.077 1042 1HH2 ARG1043 2HH1 ARG1043 4.614 -12.626 7.222 1043 2HH2 ARG1043 1HH1 ARG1043 5.868 -11.436 7.118 1044 H LEU1044 H LEU1044 1.910 -14.982 5.019 1045 HA LEU1044 HA LEU1044 2.892 -17.507 5.468 1046 1HB LEU1044 1HB LEU1044 2.698 -16.925 7.865 1047 2HB LEU1044 2HB LEU1044 3.493 -15.713 6.880 1048 HG LEU1044 HG LEU1044 1.093 -14.621 6.800 1049 1HD1 LEU1044 1HD1 LEU1044 0.840 -15.816 9.534 1050 2HD1 LEU1044 2HD1 LEU1044 -0.402 -15.115 8.469 1051 3HD1 LEU1044 3HD1 LEU1044 0.255 -16.733 8.125 1052 1HD2 LEU1044 1HD2 LEU1044 2.379 -14.271 9.460 1053 2HD2 LEU1044 2HD2 LEU1044 3.385 -13.987 8.020 1054 3HD2 LEU1044 3HD2 LEU1044 1.881 -13.064 8.250 1055 H LYS1045 H LYS1045 -0.445 -16.234 5.802 1056 HA LYS1045 HA LYS1045 -1.647 -18.168 7.241 1057 1HB LYS1045 1HB LYS1045 -2.491 -16.047 5.794 1058 2HB LYS1045 2HB LYS1045 -3.068 -17.341 4.763 1059 1HG LYS1045 1HG LYS1045 -4.685 -17.968 6.251 1060 2HG LYS1045 2HG LYS1045 -3.591 -17.879 7.618 1061 1HD LYS1045 1HD LYS1045 -3.990 -15.564 7.960 1062 2HD LYS1045 2HD LYS1045 -4.565 -15.317 6.324 1063 1HE LYS1045 1HE LYS1045 -6.712 -15.862 6.879 1064 2HE LYS1045 2HE LYS1045 -6.211 -17.293 7.758 1065 1HZ LYS1045 1HZ LYS1045 -7.207 -15.241 8.970 1066 2HZ LYS1045 2HZ LYS1045 -6.038 -16.136 9.676 1067 3HZ LYS1045 3HZ LYS1045 -5.661 -14.716 8.963 1068 H MET1046 H MET1046 -0.159 -18.473 4.056 1069 HA MET1046 HA MET1046 -1.420 -21.032 3.655 1070 1HB MET1046 1HB MET1046 -0.168 -18.975 2.025 1071 2HB MET1046 2HB MET1046 0.694 -20.476 1.751 1072 1HG MET1046 1HG MET1046 -1.539 -21.618 1.331 1073 2HG MET1046 2HG MET1046 -2.321 -20.055 1.470 1074 1HE MET1046 1HE MET1046 0.832 -18.871 0.217 1075 2HE MET1046 2HE MET1046 0.140 -18.269 -1.309 1076 3HE MET1046 3HE MET1046 -0.698 -17.961 0.231 1077 H ILE1047 H ILE1047 1.959 -19.693 3.856 1078 HA ILE1047 HA ILE1047 3.267 -22.120 3.866 1079 HB ILE1047 HB ILE1047 3.908 -19.399 4.955 1080 1HG1 ILE1047 1HG1 ILE1047 5.768 -20.297 3.030 1081 2HG1 ILE1047 2HG1 ILE1047 4.194 -20.782 2.432 1082 1HG2 ILE1047 1HG2 ILE1047 5.560 -21.914 5.220 1083 2HG2 ILE1047 2HG2 ILE1047 6.275 -20.284 5.235 1084 3HG2 ILE1047 3HG2 ILE1047 5.093 -20.748 6.482 1085 1HD1 ILE1047 1HD1 ILE1047 4.464 -18.571 1.608 1086 2HD1 ILE1047 2HD1 ILE1047 3.419 -18.366 3.034 1087 3HD1 ILE1047 3HD1 ILE1047 5.155 -17.991 3.142 1088 H SER1048 H SER1048 1.917 -20.202 6.619 1089 HA SER1048 HA SER1048 2.850 -21.799 8.627 1090 1HB SER1048 1HB SER1048 1.548 -19.541 8.695 1091 2HB SER1048 2HB SER1048 0.095 -20.520 8.680 1092 HG SER1048 HG SER1048 1.987 -20.131 10.733 1093 H GLN1049 H GLN1049 -0.477 -21.887 7.135 1094 HA GLN1049 HA GLN1049 -1.472 -24.017 8.378 1095 1HB GLN1049 1HB GLN1049 -1.978 -22.608 5.918 1096 2HB GLN1049 2HB GLN1049 -2.154 -24.322 5.595 1097 1HG GLN1049 1HG GLN1049 -3.467 -22.970 7.993 1098 2HG GLN1049 2HG GLN1049 -4.259 -23.090 6.434 1099 1HE2 GLN1049 1HE2 GLN1049 -5.119 -24.971 5.751 1100 2HE2 GLN1049 2HE2 GLN1049 -5.184 -26.431 6.680 1101 H SER1050 H SER1050 0.413 -24.210 5.267 1102 HA SER1050 HA SER1050 1.854 -26.424 6.137 1103 1HB SER1050 1HB SER1050 -0.290 -27.624 5.856 1104 2HB SER1050 2HB SER1050 -0.434 -27.032 4.213 1105 HG SER1050 HG SER1050 0.989 -28.498 3.510 1106 H ARG1051 H ARG1051 3.738 -26.351 4.950 1107 HA ARG1051 HA ARG1051 3.656 -24.739 2.566 1108 1HB ARG1051 1HB ARG1051 5.391 -24.471 4.474 1109 2HB ARG1051 2HB ARG1051 6.115 -25.962 3.904 1110 1HG ARG1051 1HG ARG1051 6.850 -25.010 1.890 1111 2HG ARG1051 2HG ARG1051 5.584 -23.798 1.872 1112 1HD ARG1051 1HD ARG1051 7.109 -22.326 2.696 1113 2HD ARG1051 2HD ARG1051 7.027 -23.199 4.214 1114 HE ARG1051 HE ARG1051 8.805 -24.620 2.497 1115 1HH1 ARG1051 2HH2 ARG1051 8.632 -21.545 4.200 1116 2HH1 ARG1051 1HH2 ARG1051 10.350 -21.395 4.367 1117 1HH2 ARG1051 2HH1 ARG1051 11.071 -24.422 2.717 1118 2HH2 ARG1051 1HH1 ARG1051 11.747 -23.043 3.518 1119 HA PRO1052 HA PRO1052 3.807 -28.493 0.255 1120 1HB PRO1052 1HB PRO1052 3.475 -27.391 -2.224 1121 2HB PRO1052 2HB PRO1052 2.136 -27.805 -1.172 1122 1HG PRO1052 1HG PRO1052 3.247 -25.138 -1.795 1123 2HG PRO1052 2HG PRO1052 1.686 -25.544 -1.109 1124 1HD PRO1052 1HD PRO1052 3.966 -24.520 0.299 1125 2HD PRO1052 2HD PRO1052 2.446 -25.036 1.001 1126 H HIS1053 H HIS1053 4.925 -29.136 -2.030 1127 HA HIS1053 HA HIS1053 7.638 -29.044 -1.375 1128 1HB HIS1053 1HB HIS1053 6.014 -30.511 -3.063 1129 2HB HIS1053 2HB HIS1053 7.009 -29.608 -4.188 1130 HD1 HIS1053 HD1 HIS1053 8.058 -31.125 -0.827 1131 HD2 HIS1053 HD2 HIS1053 8.890 -31.458 -4.925 1132 HE1 HIS1053 HE1 HIS1053 10.009 -32.757 -1.030 Start of MODEL 21 1 H MET 915 H MET 915 11.557 -22.375 -0.489 2 HA MET 915 HA MET 915 11.464 -21.780 1.608 3 1HB MET 915 1HB MET 915 14.140 -20.608 0.717 4 2HB MET 915 2HB MET 915 13.645 -20.502 2.395 5 1HG MET 915 1HG MET 915 13.384 -22.997 2.470 6 2HG MET 915 2HG MET 915 13.895 -23.098 0.797 7 1HE MET 915 1HE MET 915 15.191 -24.816 1.925 8 2HE MET 915 2HE MET 915 16.685 -24.353 1.077 9 3HE MET 915 3HE MET 915 16.700 -24.592 2.841 10 H ALA 916 H ALA 916 12.823 -18.872 -0.116 11 HA ALA 916 HA ALA 916 11.003 -17.228 1.491 12 1HB ALA 916 1HB ALA 916 12.681 -15.721 1.592 13 2HB ALA 916 2HB ALA 916 13.732 -17.017 0.974 14 3HB ALA 916 3HB ALA 916 13.006 -15.847 -0.153 15 H ASN 917 H ASN 917 9.053 -17.403 0.362 16 HA ASN 917 HA ASN 917 8.947 -17.399 -2.420 17 1HB ASN 917 1HB ASN 917 6.739 -16.485 -0.510 18 2HB ASN 917 2HB ASN 917 6.523 -17.155 -2.115 19 1HD2 ASN 917 1HD2 ASN 917 6.480 -19.296 -2.429 20 2HD2 ASN 917 2HD2 ASN 917 6.641 -20.499 -1.193 21 H LEU 918 H LEU 918 10.517 -15.434 -2.623 22 HA LEU 918 HA LEU 918 8.929 -12.964 -2.574 23 1HB LEU 918 1HB LEU 918 11.742 -13.461 -1.654 24 2HB LEU 918 2HB LEU 918 11.267 -11.882 -2.246 25 HG LEU 918 HG LEU 918 9.274 -12.321 -0.458 26 1HD1 LEU 918 1HD1 LEU 918 11.317 -13.197 1.380 27 2HD1 LEU 918 2HD1 LEU 918 9.696 -13.866 1.077 28 3HD1 LEU 918 3HD1 LEU 918 11.079 -14.403 0.093 29 1HD2 LEU 918 1HD2 LEU 918 11.632 -10.716 -0.649 30 2HD2 LEU 918 2HD2 LEU 918 10.105 -10.374 0.198 31 3HD2 LEU 918 3HD2 LEU 918 11.420 -11.225 1.043 32 H ASP 919 H ASP 919 8.596 -14.364 -4.780 33 HA ASP 919 HA ASP 919 10.630 -14.292 -6.640 34 1HB ASP 919 1HB ASP 919 7.747 -14.795 -6.568 35 2HB ASP 919 2HB ASP 919 8.175 -13.936 -8.035 36 H ARG 920 H ARG 920 9.650 -12.948 -8.929 37 HA ARG 920 HA ARG 920 10.217 -10.259 -8.183 38 1HB ARG 920 1HB ARG 920 9.676 -11.595 -10.880 39 2HB ARG 920 2HB ARG 920 10.066 -9.894 -10.720 40 1HG ARG 920 1HG ARG 920 12.285 -10.312 -10.368 41 2HG ARG 920 2HG ARG 920 11.955 -11.611 -9.239 42 1HD ARG 920 1HD ARG 920 11.774 -13.244 -10.963 43 2HD ARG 920 2HD ARG 920 11.475 -12.044 -12.205 44 HE ARG 920 HE ARG 920 14.107 -11.834 -10.887 45 1HH1 ARG 920 2HH2 ARG 920 12.281 -13.147 -13.625 46 2HH1 ARG 920 1HH2 ARG 920 13.686 -13.374 -14.612 47 1HH2 ARG 920 1HH1 ARG 920 15.838 -12.772 -13.748 48 H SER 921 H SER 921 7.492 -11.932 -7.797 49 HA SER 921 HA SER 921 5.694 -10.201 -9.212 50 1HB SER 921 1HB SER 921 5.164 -12.464 -7.235 51 2HB SER 921 2HB SER 921 3.926 -11.630 -8.153 52 HG SER 921 HG SER 921 4.682 -13.692 -9.103 53 H ASN 922 H ASN 922 6.092 -11.238 -5.737 54 HA ASN 922 HA ASN 922 4.590 -9.064 -4.810 55 1HB ASN 922 1HB ASN 922 5.226 -9.850 -2.582 56 2HB ASN 922 2HB ASN 922 4.948 -11.262 -3.583 57 1HD2 ASN 922 1HD2 ASN 922 6.881 -10.075 -1.304 58 2HD2 ASN 922 2HD2 ASN 922 8.387 -10.857 -1.650 59 H ASP 923 H ASP 923 7.708 -9.289 -6.138 60 HA ASP 923 HA ASP 923 9.073 -7.565 -4.370 61 1HB ASP 923 1HB ASP 923 10.049 -9.274 -6.059 62 2HB ASP 923 2HB ASP 923 9.722 -8.084 -7.303 63 H LYS 924 H LYS 924 6.952 -7.276 -7.204 64 HA LYS 924 HA LYS 924 7.701 -4.535 -7.709 65 1HB LYS 924 1HB LYS 924 7.102 -6.218 -9.500 66 2HB LYS 924 2HB LYS 924 5.446 -6.146 -8.933 67 1HG LYS 924 1HG LYS 924 5.739 -3.527 -9.194 68 2HG LYS 924 2HG LYS 924 7.099 -3.949 -10.214 69 1HD LYS 924 1HD LYS 924 5.333 -5.601 -11.356 70 2HD LYS 924 2HD LYS 924 4.160 -4.512 -10.645 71 1HE LYS 924 1HE LYS 924 4.939 -2.642 -11.900 72 2HE LYS 924 2HE LYS 924 6.486 -3.391 -12.240 73 1HZ LYS 924 1HZ LYS 924 4.729 -5.112 -13.312 74 2HZ LYS 924 2HZ LYS 924 4.015 -3.675 -13.616 75 3HZ LYS 924 3HZ LYS 924 5.535 -3.959 -14.141 76 H VAL 925 H VAL 925 4.862 -6.385 -6.433 77 HA VAL 925 HA VAL 925 3.235 -4.197 -5.963 78 HB VAL 925 HB VAL 925 3.467 -6.811 -4.458 79 1HG1 VAL 925 1HG1 VAL 925 2.031 -5.747 -3.060 80 2HG1 VAL 925 2HG1 VAL 925 1.569 -4.534 -4.277 81 3HG1 VAL 925 3HG1 VAL 925 0.843 -6.159 -4.320 82 1HG2 VAL 925 1HG2 VAL 925 2.424 -6.093 -7.116 83 2HG2 VAL 925 2HG2 VAL 925 2.886 -7.678 -6.451 84 3HG2 VAL 925 3HG2 VAL 925 1.275 -7.004 -6.106 85 H TYR 926 H TYR 926 5.762 -5.747 -3.894 86 HA TYR 926 HA TYR 926 5.312 -4.070 -1.677 87 1HB TYR 926 1HB TYR 926 7.554 -5.815 -2.825 88 2HB TYR 926 2HB TYR 926 7.844 -4.908 -1.354 89 HD1 TYR 926 HD1 TYR 926 7.926 -6.435 0.401 90 HD2 TYR 926 HD2 TYR 926 4.811 -6.792 -2.510 91 HE1 TYR 926 HE1 TYR 926 6.862 -8.303 1.758 92 HE2 TYR 926 HE2 TYR 926 3.758 -8.659 -1.143 93 HH TYR 926 HH TYR 926 5.386 -9.955 1.694 94 H GLU 927 H GLU 927 7.314 -3.793 -4.632 95 HA GLU 927 HA GLU 927 8.881 -1.688 -3.675 96 1HB GLU 927 1HB GLU 927 8.303 -2.940 -6.337 97 2HB GLU 927 2HB GLU 927 8.987 -1.327 -6.363 98 1HG GLU 927 1HG GLU 927 10.281 -3.262 -4.476 99 2HG GLU 927 2HG GLU 927 10.494 -3.602 -6.182 100 H ASN 928 H ASN 928 6.243 -1.614 -6.188 101 HA ASN 928 HA ASN 928 5.977 1.020 -6.431 102 1HB ASN 928 1HB ASN 928 3.722 -1.047 -6.247 103 2HB ASN 928 2HB ASN 928 3.509 0.566 -6.897 104 1HD2 ASN 928 1HD2 ASN 928 3.414 0.541 -9.000 105 2HD2 ASN 928 2HD2 ASN 928 4.385 -0.391 -10.090 106 H VAL 929 H VAL 929 4.651 -1.112 -3.834 107 HA VAL 929 HA VAL 929 2.998 0.711 -2.577 108 HB VAL 929 HB VAL 929 4.445 -1.779 -1.855 109 1HG1 VAL 929 1HG1 VAL 929 3.575 -1.631 0.497 110 2HG1 VAL 929 2HG1 VAL 929 4.917 -0.520 0.135 111 3HG1 VAL 929 3HG1 VAL 929 3.248 0.095 0.209 112 1HG2 VAL 929 1HG2 VAL 929 2.101 -2.414 -1.156 113 2HG2 VAL 929 2HG2 VAL 929 1.568 -0.829 -1.765 114 3HG2 VAL 929 3HG2 VAL 929 2.298 -2.010 -2.878 115 H THR 930 H THR 930 6.397 -0.177 -1.622 116 HA THR 930 HA THR 930 6.693 1.871 0.227 117 HB THR 930 HB THR 930 9.211 1.399 -0.355 118 HG1 THR 930 HG1 THR 930 9.374 0.184 -2.197 119 1HG2 THR 930 1HG2 THR 930 7.177 -0.334 0.864 120 2HG2 THR 930 2HG2 THR 930 8.438 -1.300 0.061 121 3HG2 THR 930 3HG2 THR 930 8.885 -0.125 1.321 122 H GLY 931 H GLY 931 8.090 1.828 -3.126 123 1HA GLY 931 1HA GLY 931 9.081 4.281 -3.357 124 2HA GLY 931 2HA GLY 931 8.153 3.529 -4.640 125 H LEU 932 H LEU 932 5.568 3.487 -3.235 126 HA LEU 932 HA LEU 932 4.727 6.104 -3.902 127 1HB LEU 932 1HB LEU 932 3.093 4.610 -4.341 128 2HB LEU 932 2HB LEU 932 3.507 3.569 -2.994 129 HG LEU 932 HG LEU 932 2.437 6.116 -2.070 130 1HD1 LEU 932 1HD1 LEU 932 1.304 5.494 -4.442 131 2HD1 LEU 932 2HD1 LEU 932 0.269 4.553 -3.342 132 3HD1 LEU 932 3HD1 LEU 932 0.447 6.309 -3.111 133 1HD2 LEU 932 1HD2 LEU 932 2.612 3.513 -1.173 134 2HD2 LEU 932 2HD2 LEU 932 1.671 4.824 -0.421 135 3HD2 LEU 932 3HD2 LEU 932 0.882 3.695 -1.549 136 H VAL 933 H VAL 933 4.311 4.362 -0.741 137 HA VAL 933 HA VAL 933 3.791 6.569 0.767 138 HB VAL 933 HB VAL 933 4.749 5.179 2.655 139 1HG1 VAL 933 1HG1 VAL 933 2.366 5.072 1.456 140 2HG1 VAL 933 2HG1 VAL 933 2.915 3.422 1.080 141 3HG1 VAL 933 3HG1 VAL 933 2.814 3.962 2.773 142 1HG2 VAL 933 1HG2 VAL 933 6.416 4.019 1.083 143 2HG2 VAL 933 2HG2 VAL 933 5.571 3.004 2.276 144 3HG2 VAL 933 3HG2 VAL 933 5.045 3.004 0.575 145 H LYS 934 H LYS 934 6.887 5.433 -0.549 146 HA LYS 934 HA LYS 934 8.571 6.886 1.140 147 1HB LYS 934 1HB LYS 934 8.854 5.780 -1.655 148 2HB LYS 934 2HB LYS 934 10.148 6.682 -0.893 149 1HG LYS 934 1HG LYS 934 9.213 4.803 1.058 150 2HG LYS 934 2HG LYS 934 9.350 3.923 -0.451 151 1HD LYS 934 1HD LYS 934 11.638 4.059 -0.471 152 2HD LYS 934 2HD LYS 934 11.641 5.736 0.038 153 1HE LYS 934 1HE LYS 934 11.024 4.908 2.395 154 2HE LYS 934 2HE LYS 934 11.321 3.279 1.820 155 1HZ LYS 934 1HZ LYS 934 13.221 5.461 2.144 156 2HZ LYS 934 2HZ LYS 934 13.339 3.910 2.641 157 3HZ LYS 934 3HZ LYS 934 13.541 4.279 1.063 158 H ALA 935 H ALA 935 6.742 7.756 -1.820 159 HA ALA 935 HA ALA 935 7.974 10.346 -1.956 160 1HB ALA 935 1HB ALA 935 6.192 8.655 -3.557 161 2HB ALA 935 2HB ALA 935 5.672 10.357 -3.533 162 3HB ALA 935 3HB ALA 935 7.314 9.936 -4.074 163 H VAL 936 H VAL 936 4.746 8.976 -1.032 164 HA VAL 936 HA VAL 936 3.311 11.149 -0.510 165 HB VAL 936 HB VAL 936 3.649 8.560 0.954 166 1HG1 VAL 936 1HG1 VAL 936 2.177 10.970 1.930 167 2HG1 VAL 936 2HG1 VAL 936 1.383 9.386 2.100 168 3HG1 VAL 936 3HG1 VAL 936 2.977 9.666 2.841 169 1HG2 VAL 936 1HG2 VAL 936 2.464 8.280 -1.043 170 2HG2 VAL 936 2HG2 VAL 936 1.180 8.425 0.182 171 3HG2 VAL 936 3HG2 VAL 936 1.585 9.816 -0.852 172 H ILE 937 H ILE 937 6.089 9.964 1.438 173 HA ILE 937 HA ILE 937 5.725 12.102 3.345 174 HB ILE 937 HB ILE 937 7.676 9.827 3.058 175 1HG1 ILE 937 1HG1 ILE 937 5.981 10.276 5.468 176 2HG1 ILE 937 2HG1 ILE 937 5.159 9.775 4.004 177 1HG2 ILE 937 1HG2 ILE 937 8.715 10.518 5.146 178 2HG2 ILE 937 2HG2 ILE 937 8.896 11.784 3.908 179 3HG2 ILE 937 3HG2 ILE 937 7.687 11.970 5.202 180 1HD1 ILE 937 1HD1 ILE 937 6.698 7.832 3.783 181 2HD1 ILE 937 2HD1 ILE 937 7.547 8.345 5.261 182 3HD1 ILE 937 3HD1 ILE 937 5.851 7.812 5.348 183 H GLU 938 H GLU 938 8.548 11.020 1.323 184 HA GLU 938 HA GLU 938 10.134 13.070 1.491 185 1HB GLU 938 1HB GLU 938 9.585 11.093 -0.521 186 2HB GLU 938 2HB GLU 938 9.895 12.606 -1.348 187 1HG GLU 938 1HG GLU 938 12.105 12.140 -1.067 188 2HG GLU 938 2HG GLU 938 11.876 12.608 0.606 189 H MET 939 H MET 939 7.184 13.064 -0.614 190 HA MET 939 HA MET 939 7.471 15.451 -1.816 191 1HB MET 939 1HB MET 939 5.570 14.076 -2.362 192 2HB MET 939 2HB MET 939 5.056 13.968 -0.690 193 1HG MET 939 1HG MET 939 3.922 15.973 -0.766 194 2HG MET 939 2HG MET 939 5.148 16.751 -1.746 195 1HE MET 939 1HE MET 939 3.192 13.552 -1.920 196 2HE MET 939 2HE MET 939 2.323 13.588 -3.473 197 3HE MET 939 3HE MET 939 4.078 13.294 -3.442 198 H SER 940 H SER 940 5.518 15.008 1.229 199 HA SER 940 HA SER 940 4.968 17.509 1.821 200 1HB SER 940 1HB SER 940 6.136 15.751 3.999 201 2HB SER 940 2HB SER 940 4.789 16.866 4.111 202 HG SER 940 HG SER 940 3.886 15.261 2.318 203 H SER 941 H SER 941 8.186 15.956 2.127 204 HA SER 941 HA SER 941 9.382 17.984 3.593 205 1HB SER 941 1HB SER 941 10.217 15.584 3.050 206 2HB SER 941 2HB SER 941 10.813 16.254 1.544 207 HG SER 941 HG SER 941 12.235 17.605 2.663 208 H LYS 942 H LYS 942 9.290 17.312 0.022 209 HA LYS 942 HA LYS 942 10.368 19.991 -0.427 210 1HB LYS 942 1HB LYS 942 10.632 19.142 -2.789 211 2HB LYS 942 2HB LYS 942 11.618 18.347 -1.579 212 1HG LYS 942 1HG LYS 942 10.580 16.334 -1.883 213 2HG LYS 942 2HG LYS 942 8.983 17.054 -1.886 214 1HD LYS 942 1HD LYS 942 10.882 17.258 -4.265 215 2HD LYS 942 2HD LYS 942 9.731 15.948 -4.086 216 1HE LYS 942 1HE LYS 942 8.180 17.281 -5.074 217 2HE LYS 942 2HE LYS 942 8.188 18.263 -3.623 218 1HZ LYS 942 1HZ LYS 942 9.941 19.578 -4.565 219 2HZ LYS 942 2HZ LYS 942 10.014 18.634 -5.896 220 3HZ LYS 942 3HZ LYS 942 8.683 19.534 -5.605 221 H ILE 943 H ILE 943 7.584 19.359 0.562 222 HA ILE 943 HA ILE 943 6.003 20.114 -1.765 223 HB ILE 943 HB ILE 943 5.534 18.333 0.208 224 1HG1 ILE 943 1HG1 ILE 943 4.311 19.064 -2.052 225 2HG1 ILE 943 2HG1 ILE 943 3.589 17.965 -0.893 226 1HG2 ILE 943 1HG2 ILE 943 3.786 19.245 1.684 227 2HG2 ILE 943 2HG2 ILE 943 5.374 20.000 1.964 228 3HG2 ILE 943 3HG2 ILE 943 4.119 20.876 1.054 229 1HD1 ILE 943 1HD1 ILE 943 2.427 19.912 0.197 230 2HD1 ILE 943 2HD1 ILE 943 3.102 20.974 -1.061 231 3HD1 ILE 943 3HD1 ILE 943 1.955 19.687 -1.504 232 H GLN 944 H GLN 944 6.793 21.237 1.588 233 HA GLN 944 HA GLN 944 5.335 23.479 1.669 234 1HB GLN 944 1HB GLN 944 7.465 22.389 3.124 235 2HB GLN 944 2HB GLN 944 8.081 23.955 2.633 236 1HG GLN 944 1HG GLN 944 5.371 24.381 3.452 237 2HG GLN 944 2HG GLN 944 6.090 23.336 4.661 238 1HE2 GLN 944 1HE2 GLN 944 5.290 26.249 4.527 239 2HE2 GLN 944 2HE2 GLN 944 6.655 27.132 5.125 240 HA PRO 945 HA PRO 945 8.658 25.782 -0.812 241 1HB PRO 945 1HB PRO 945 10.684 24.394 -2.011 242 2HB PRO 945 2HB PRO 945 10.848 25.169 -0.448 243 1HG PRO 945 1HG PRO 945 10.543 22.295 -1.069 244 2HG PRO 945 2HG PRO 945 11.124 23.044 0.405 245 1HD PRO 945 1HD PRO 945 8.535 21.886 -0.026 246 2HD PRO 945 2HD PRO 945 9.077 22.737 1.406 247 H ALA 946 H ALA 946 8.373 22.580 -2.277 248 HA ALA 946 HA ALA 946 8.265 23.112 -4.857 249 1HB ALA 946 1HB ALA 946 6.649 21.330 -3.070 250 2HB ALA 946 2HB ALA 946 6.145 21.473 -4.772 251 3HB ALA 946 3HB ALA 946 7.787 20.911 -4.374 252 HA PRO 947 HA PRO 947 5.247 26.237 -5.276 253 1HB PRO 947 1HB PRO 947 5.577 26.696 -7.950 254 2HB PRO 947 2HB PRO 947 6.575 27.444 -6.719 255 1HG PRO 947 1HG PRO 947 7.248 25.228 -8.556 256 2HG PRO 947 2HG PRO 947 8.327 26.257 -7.636 257 1HD PRO 947 1HD PRO 947 7.601 23.551 -7.024 258 2HD PRO 947 2HD PRO 947 8.587 24.619 -6.045 259 HA PRO 948 HA PRO 948 1.712 24.531 -6.910 260 1HB PRO 948 1HB PRO 948 0.408 26.529 -8.243 261 2HB PRO 948 2HB PRO 948 0.392 26.372 -6.498 262 1HG PRO 948 1HG PRO 948 1.891 28.293 -8.172 263 2HG PRO 948 2HG PRO 948 1.526 28.381 -6.460 264 1HD PRO 948 1HD PRO 948 4.040 27.670 -7.644 265 2HD PRO 948 2HD PRO 948 3.641 27.646 -5.938 266 H GLU 949 H GLU 949 3.984 25.743 -9.087 267 HA GLU 949 HA GLU 949 2.596 24.603 -11.333 268 1HB GLU 949 1HB GLU 949 4.658 26.593 -10.931 269 2HB GLU 949 2HB GLU 949 5.271 25.368 -12.024 270 1HG GLU 949 1HG GLU 949 2.461 26.263 -12.538 271 2HG GLU 949 2HG GLU 949 3.701 27.470 -12.818 272 H GLU 950 H GLU 950 5.090 23.794 -8.983 273 HA GLU 950 HA GLU 950 5.878 21.525 -10.618 274 1HB GLU 950 1HB GLU 950 7.350 23.308 -8.999 275 2HB GLU 950 2HB GLU 950 7.311 21.818 -8.078 276 1HG GLU 950 1HG GLU 950 9.129 21.313 -9.406 277 2HG GLU 950 2HG GLU 950 7.878 20.749 -10.497 278 H TYR 951 H TYR 951 3.764 22.431 -8.088 279 HA TYR 951 HA TYR 951 3.899 19.872 -6.727 280 1HB TYR 951 1HB TYR 951 3.557 22.015 -5.487 281 2HB TYR 951 2HB TYR 951 2.229 22.452 -6.543 282 HD1 TYR 951 HD1 TYR 951 0.306 22.557 -5.235 283 HD2 TYR 951 HD2 TYR 951 2.968 19.244 -4.741 284 HE1 TYR 951 HE1 TYR 951 -1.330 21.473 -3.618 285 HE2 TYR 951 HE2 TYR 951 1.324 18.172 -3.126 286 HH TYR 951 HH TYR 951 -0.763 18.225 -2.387 287 H VAL 952 H VAL 952 1.943 21.617 -9.140 288 HA VAL 952 HA VAL 952 -0.411 20.229 -8.997 289 HB VAL 952 HB VAL 952 1.116 21.705 -11.053 290 1HG1 VAL 952 1HG1 VAL 952 0.590 19.998 -12.551 291 2HG1 VAL 952 2HG1 VAL 952 -0.958 19.633 -11.752 292 3HG1 VAL 952 3HG1 VAL 952 -0.787 21.112 -12.727 293 1HG2 VAL 952 1HG2 VAL 952 -1.837 21.816 -10.394 294 2HG2 VAL 952 2HG2 VAL 952 -0.600 22.638 -9.413 295 3HG2 VAL 952 3HG2 VAL 952 -0.815 23.077 -11.125 296 HA PRO 953 HA PRO 953 1.663 16.870 -11.616 297 1HB PRO 953 1HB PRO 953 4.387 16.812 -11.824 298 2HB PRO 953 2HB PRO 953 3.349 17.530 -13.039 299 1HG PRO 953 1HG PRO 953 5.041 18.872 -11.021 300 2HG PRO 953 2HG PRO 953 4.346 19.535 -12.486 301 1HD PRO 953 1HD PRO 953 3.414 19.947 -9.804 302 2HD PRO 953 2HD PRO 953 2.652 20.513 -11.277 303 H MET 954 H MET 954 3.988 17.742 -9.099 304 HA MET 954 HA MET 954 4.791 15.452 -8.195 305 1HB MET 954 1HB MET 954 3.907 17.986 -6.913 306 2HB MET 954 2HB MET 954 3.892 16.634 -5.799 307 1HG MET 954 1HG MET 954 6.190 16.424 -5.803 308 2HG MET 954 2HG MET 954 6.327 16.778 -7.514 309 1HE MET 954 1HE MET 954 4.866 18.103 -4.437 310 2HE MET 954 2HE MET 954 6.239 19.067 -3.843 311 3HE MET 954 3HE MET 954 4.874 19.869 -4.656 312 H VAL 955 H VAL 955 1.623 16.775 -6.970 313 HA VAL 955 HA VAL 955 0.847 14.449 -5.687 314 HB VAL 955 HB VAL 955 -0.634 16.797 -6.852 315 1HG1 VAL 955 1HG1 VAL 955 -2.665 16.039 -5.715 316 2HG1 VAL 955 2HG1 VAL 955 -2.151 14.858 -6.943 317 3HG1 VAL 955 3HG1 VAL 955 -1.844 14.539 -5.219 318 1HG2 VAL 955 1HG2 VAL 955 -0.297 17.765 -4.861 319 2HG2 VAL 955 2HG2 VAL 955 -0.805 16.306 -3.977 320 3HG2 VAL 955 3HG2 VAL 955 0.876 16.465 -4.540 321 H LYS 956 H LYS 956 0.063 15.639 -9.025 322 HA LYS 956 HA LYS 956 -1.575 13.615 -9.817 323 1HB LYS 956 1HB LYS 956 0.484 15.204 -11.367 324 2HB LYS 956 2HB LYS 956 -0.650 14.110 -12.133 325 1HG LYS 956 1HG LYS 956 -1.816 16.073 -10.185 326 2HG LYS 956 2HG LYS 956 -1.192 16.744 -11.678 327 1HD LYS 956 1HD LYS 956 -3.078 14.354 -11.673 328 2HD LYS 956 2HD LYS 956 -3.683 15.998 -11.646 329 1HE LYS 956 1HE LYS 956 -1.624 15.243 -13.732 330 2HE LYS 956 2HE LYS 956 -3.283 14.727 -13.962 331 1HZ LYS 956 1HZ LYS 956 -2.183 17.381 -14.019 332 2HZ LYS 956 2HZ LYS 956 -3.439 16.754 -14.854 333 3HZ LYS 956 3HZ LYS 956 -3.650 17.251 -13.313 334 H GLU 957 H GLU 957 1.971 13.597 -9.400 335 HA GLU 957 HA GLU 957 2.450 11.252 -10.788 336 1HB GLU 957 1HB GLU 957 3.998 13.115 -9.523 337 2HB GLU 957 2HB GLU 957 4.106 11.808 -8.361 338 1HG GLU 957 1HG GLU 957 4.440 11.007 -11.225 339 2HG GLU 957 2HG GLU 957 5.713 12.021 -10.575 340 H VAL 958 H VAL 958 1.421 11.892 -7.406 341 HA VAL 958 HA VAL 958 1.816 9.352 -6.378 342 HB VAL 958 HB VAL 958 0.988 11.724 -5.428 343 1HG1 VAL 958 1HG1 VAL 958 -1.294 11.696 -4.720 344 2HG1 VAL 958 2HG1 VAL 958 -1.286 11.360 -6.468 345 3HG1 VAL 958 3HG1 VAL 958 -1.525 10.032 -5.307 346 1HG2 VAL 958 1HG2 VAL 958 0.515 8.996 -4.182 347 2HG2 VAL 958 2HG2 VAL 958 1.991 9.985 -4.078 348 3HG2 VAL 958 3HG2 VAL 958 0.493 10.538 -3.292 349 H GLY 959 H GLY 959 -0.911 10.754 -8.267 350 1HA GLY 959 1HA GLY 959 -2.721 8.658 -8.010 351 2HA GLY 959 2HA GLY 959 -2.616 9.777 -9.355 352 H LEU 960 H LEU 960 0.076 9.122 -10.248 353 HA LEU 960 HA LEU 960 -0.550 6.896 -11.861 354 1HB LEU 960 1HB LEU 960 1.255 9.018 -11.880 355 2HB LEU 960 2HB LEU 960 2.268 7.595 -11.744 356 HG LEU 960 HG LEU 960 0.221 8.148 -13.909 357 1HD1 LEU 960 1HD1 LEU 960 2.684 9.229 -13.718 358 2HD1 LEU 960 2HD1 LEU 960 3.078 7.709 -14.557 359 3HD1 LEU 960 3HD1 LEU 960 1.891 8.833 -15.262 360 1HD2 LEU 960 1HD2 LEU 960 2.078 5.767 -13.690 361 2HD2 LEU 960 2HD2 LEU 960 0.347 5.740 -13.276 362 3HD2 LEU 960 3HD2 LEU 960 0.858 6.081 -14.947 363 H ALA 961 H ALA 961 1.455 7.389 -8.915 364 HA ALA 961 HA ALA 961 2.469 4.730 -8.952 365 1HB ALA 961 1HB ALA 961 3.857 6.184 -7.804 366 2HB ALA 961 2HB ALA 961 2.501 7.099 -7.103 367 3HB ALA 961 3HB ALA 961 2.930 5.501 -6.446 368 H LEU 962 H LEU 962 -0.254 6.460 -7.344 369 HA LEU 962 HA LEU 962 -0.998 4.250 -5.749 370 1HB LEU 962 1HB LEU 962 -1.926 6.034 -4.809 371 2HB LEU 962 2HB LEU 962 -1.906 6.959 -6.297 372 HG LEU 962 HG LEU 962 -4.170 6.524 -5.230 373 1HD1 LEU 962 1HD1 LEU 962 -3.364 6.436 -8.018 374 2HD1 LEU 962 2HD1 LEU 962 -4.899 5.575 -7.747 375 3HD1 LEU 962 3HD1 LEU 962 -4.732 7.274 -7.245 376 1HD2 LEU 962 1HD2 LEU 962 -4.545 3.962 -6.544 377 2HD2 LEU 962 2HD2 LEU 962 -3.315 3.872 -5.261 378 3HD2 LEU 962 3HD2 LEU 962 -4.948 4.470 -4.886 379 H ARG 963 H ARG 963 -1.879 5.424 -9.027 380 HA ARG 963 HA ARG 963 -4.022 3.721 -9.374 381 1HB ARG 963 1HB ARG 963 -3.492 5.668 -10.854 382 2HB ARG 963 2HB ARG 963 -2.071 4.835 -11.454 383 1HG ARG 963 1HG ARG 963 -3.409 3.987 -13.085 384 2HG ARG 963 2HG ARG 963 -4.089 2.944 -11.852 385 1HD ARG 963 1HD ARG 963 -6.080 3.941 -12.382 386 2HD ARG 963 2HD ARG 963 -5.509 5.272 -11.396 387 HE ARG 963 HE ARG 963 -4.562 5.402 -14.166 388 1HH1 ARG 963 2HH2 ARG 963 -7.184 6.241 -11.974 389 2HH1 ARG 963 1HH2 ARG 963 -7.769 7.535 -12.964 390 1HH2 ARG 963 2HH1 ARG 963 -5.334 7.110 -15.474 391 2HH2 ARG 963 1HH1 ARG 963 -6.710 8.033 -14.969 392 H THR 964 H THR 964 -0.526 3.402 -10.318 393 HA THR 964 HA THR 964 -0.751 0.878 -11.498 394 HB THR 964 HB THR 964 1.547 2.377 -10.140 395 HG1 THR 964 HG1 THR 964 0.592 3.324 -12.071 396 1HG2 THR 964 1HG2 THR 964 3.077 0.872 -11.191 397 2HG2 THR 964 2HG2 THR 964 1.855 -0.214 -10.487 398 3HG2 THR 964 3HG2 THR 964 1.808 0.171 -12.224 399 H LEU 965 H LEU 965 -0.692 1.884 -8.116 400 HA LEU 965 HA LEU 965 0.199 -0.475 -6.974 401 1HB LEU 965 1HB LEU 965 -0.631 1.970 -6.101 402 2HB LEU 965 2HB LEU 965 -1.956 0.956 -5.567 403 HG LEU 965 HG LEU 965 0.877 0.153 -4.958 404 1HD1 LEU 965 1HD1 LEU 965 1.268 1.865 -3.607 405 2HD1 LEU 965 2HD1 LEU 965 -0.250 2.624 -4.143 406 3HD1 LEU 965 3HD1 LEU 965 -0.245 1.548 -2.725 407 1HD2 LEU 965 1HD2 LEU 965 -0.786 -0.390 -2.797 408 2HD2 LEU 965 2HD2 LEU 965 -1.798 -0.720 -4.224 409 3HD2 LEU 965 3HD2 LEU 965 -0.230 -1.541 -4.036 410 H LEU 966 H LEU 966 -3.216 0.580 -7.641 411 HA LEU 966 HA LEU 966 -4.496 -1.666 -6.812 412 1HB LEU 966 1HB LEU 966 -5.052 0.256 -9.057 413 2HB LEU 966 2HB LEU 966 -6.141 -1.069 -8.699 414 HG LEU 966 HG LEU 966 -5.997 -0.048 -6.237 415 1HD1 LEU 966 1HD1 LEU 966 -6.150 2.569 -6.781 416 2HD1 LEU 966 2HD1 LEU 966 -4.638 1.764 -6.296 417 3HD1 LEU 966 3HD1 LEU 966 -4.958 2.095 -8.015 418 1HD2 LEU 966 1HD2 LEU 966 -8.160 0.169 -6.664 419 2HD2 LEU 966 2HD2 LEU 966 -7.842 1.643 -7.610 420 3HD2 LEU 966 3HD2 LEU 966 -7.828 0.053 -8.409 421 H ALA 967 H ALA 967 -3.093 -1.064 -10.105 422 HA ALA 967 HA ALA 967 -3.770 -3.547 -11.153 423 1HB ALA 967 1HB ALA 967 -1.981 -3.018 -12.809 424 2HB ALA 967 2HB ALA 967 -3.068 -1.641 -12.514 425 3HB ALA 967 3HB ALA 967 -1.451 -1.672 -11.772 426 H THR 968 H THR 968 -0.650 -2.420 -9.660 427 HA THR 968 HA THR 968 0.683 -4.834 -9.805 428 HB THR 968 HB THR 968 1.135 -2.251 -8.844 429 HG1 THR 968 HG1 THR 968 3.237 -3.179 -8.753 430 1HG2 THR 968 1HG2 THR 968 0.319 -2.813 -6.566 431 2HG2 THR 968 2HG2 THR 968 1.327 -4.280 -6.555 432 3HG2 THR 968 3HG2 THR 968 2.093 -2.674 -6.553 433 H VAL 969 H VAL 969 -1.789 -3.729 -7.474 434 HA VAL 969 HA VAL 969 -1.360 -5.793 -5.619 435 HB VAL 969 HB VAL 969 -3.858 -4.209 -6.254 436 1HG1 VAL 969 1HG1 VAL 969 -4.680 -5.831 -4.854 437 2HG1 VAL 969 2HG1 VAL 969 -3.113 -6.095 -4.052 438 3HG1 VAL 969 3HG1 VAL 969 -4.090 -4.664 -3.646 439 1HG2 VAL 969 1HG2 VAL 969 -1.347 -3.321 -5.288 440 2HG2 VAL 969 2HG2 VAL 969 -2.877 -2.415 -5.365 441 3HG2 VAL 969 3HG2 VAL 969 -2.458 -3.330 -3.897 442 H ASP 970 H ASP 970 -3.365 -5.494 -8.590 443 HA ASP 970 HA ASP 970 -4.933 -7.664 -8.320 444 1HB ASP 970 1HB ASP 970 -4.786 -5.969 -10.251 445 2HB ASP 970 2HB ASP 970 -3.470 -6.930 -10.896 446 H GLU 971 H GLU 971 -1.476 -7.435 -9.323 447 HA GLU 971 HA GLU 971 -1.259 -10.127 -10.078 448 1HB GLU 971 1HB GLU 971 0.702 -7.907 -9.461 449 2HB GLU 971 2HB GLU 971 1.294 -9.540 -9.690 450 1HG GLU 971 1HG GLU 971 -0.341 -9.384 -11.860 451 2HG GLU 971 2HG GLU 971 0.025 -7.680 -11.678 452 H SER 972 H SER 972 -1.290 -8.448 -7.007 453 HA SER 972 HA SER 972 0.140 -10.520 -5.655 454 1HB SER 972 1HB SER 972 -0.582 -7.815 -5.120 455 2HB SER 972 2HB SER 972 -1.379 -8.775 -3.889 456 HG SER 972 HG SER 972 1.087 -9.795 -4.085 457 H LEU 973 H LEU 973 -3.216 -9.561 -6.361 458 HA LEU 973 HA LEU 973 -4.718 -10.722 -4.504 459 1HB LEU 973 1HB LEU 973 -4.991 -10.010 -7.229 460 2HB LEU 973 2HB LEU 973 -5.705 -11.601 -7.049 461 HG LEU 973 HG LEU 973 -6.600 -8.978 -6.004 462 1HD1 LEU 973 1HD1 LEU 973 -8.792 -9.882 -6.456 463 2HD1 LEU 973 2HD1 LEU 973 -7.724 -10.198 -7.844 464 3HD1 LEU 973 3HD1 LEU 973 -8.113 -11.508 -6.704 465 1HD2 LEU 973 1HD2 LEU 973 -6.553 -11.442 -4.303 466 2HD2 LEU 973 2HD2 LEU 973 -6.334 -9.734 -3.854 467 3HD2 LEU 973 3HD2 LEU 973 -7.960 -10.355 -4.223 468 HA PRO 974 HA PRO 974 -3.844 -15.049 -6.183 469 1HB PRO 974 1HB PRO 974 -1.923 -15.433 -8.088 470 2HB PRO 974 2HB PRO 974 -3.626 -15.268 -8.464 471 1HG PRO 974 1HG PRO 974 -1.450 -13.300 -8.826 472 2HG PRO 974 2HG PRO 974 -3.038 -13.329 -9.566 473 1HD PRO 974 1HD PRO 974 -2.182 -11.649 -7.404 474 2HD PRO 974 2HD PRO 974 -3.800 -11.761 -8.068 475 H VAL 975 H VAL 975 -0.949 -13.071 -6.142 476 HA VAL 975 HA VAL 975 0.796 -14.942 -5.149 477 HB VAL 975 HB VAL 975 0.601 -11.987 -4.530 478 1HG1 VAL 975 1HG1 VAL 975 2.582 -12.081 -3.473 479 2HG1 VAL 975 2HG1 VAL 975 2.264 -13.826 -3.321 480 3HG1 VAL 975 3HG1 VAL 975 3.267 -13.217 -4.660 481 1HG2 VAL 975 1HG2 VAL 975 2.497 -13.050 -6.567 482 2HG2 VAL 975 2HG2 VAL 975 0.772 -13.025 -7.005 483 3HG2 VAL 975 3HG2 VAL 975 1.591 -11.518 -6.527 484 H LEU 976 H LEU 976 -1.808 -13.122 -3.517 485 HA LEU 976 HA LEU 976 -1.055 -14.470 -1.021 486 1HB LEU 976 1HB LEU 976 -2.891 -12.099 -1.281 487 2HB LEU 976 2HB LEU 976 -2.127 -12.732 0.163 488 HG LEU 976 HG LEU 976 -0.779 -10.943 -0.180 489 1HD1 LEU 976 1HD1 LEU 976 0.447 -13.259 -0.699 490 2HD1 LEU 976 2HD1 LEU 976 0.752 -12.438 -2.249 491 3HD1 LEU 976 3HD1 LEU 976 1.293 -11.693 -0.725 492 1HD2 LEU 976 1HD2 LEU 976 -0.431 -10.907 -3.087 493 2HD2 LEU 976 2HD2 LEU 976 -2.125 -10.718 -2.573 494 3HD2 LEU 976 3HD2 LEU 976 -0.880 -9.602 -1.962 495 HA PRO 977 HA PRO 977 -4.712 -16.751 -1.209 496 1HB PRO 977 1HB PRO 977 -5.374 -17.081 1.422 497 2HB PRO 977 2HB PRO 977 -4.129 -18.019 0.621 498 1HG PRO 977 1HG PRO 977 -3.825 -15.793 2.542 499 2HG PRO 977 2HG PRO 977 -2.648 -17.001 2.067 500 1HD PRO 977 1HD PRO 977 -2.748 -14.269 1.199 501 2HD PRO 977 2HD PRO 977 -1.644 -15.508 0.636 502 H ALA 978 H ALA 978 -7.090 -16.978 -0.388 503 HA ALA 978 HA ALA 978 -8.322 -14.587 -1.170 504 1HB ALA 978 1HB ALA 978 -10.289 -16.003 0.102 505 2HB ALA 978 2HB ALA 978 -9.741 -16.322 -1.562 506 3HB ALA 978 3HB ALA 978 -9.096 -17.286 -0.212 507 H SER 979 H SER 979 -6.815 -15.508 1.774 508 HA SER 979 HA SER 979 -8.498 -14.355 3.624 509 1HB SER 979 1HB SER 979 -6.614 -14.413 5.126 510 2HB SER 979 2HB SER 979 -6.482 -15.815 4.083 511 HG SER 979 HG SER 979 -4.533 -14.233 4.502 512 H THR 980 H THR 980 -6.564 -12.937 1.110 513 HA THR 980 HA THR 980 -6.673 -10.311 2.432 514 HB THR 980 HB THR 980 -4.664 -9.844 1.357 515 HG1 THR 980 HG1 THR 980 -4.343 -10.801 -0.833 516 1HG2 THR 980 1HG2 THR 980 -4.582 -12.365 2.355 517 2HG2 THR 980 2HG2 THR 980 -4.375 -12.756 0.631 518 3HG2 THR 980 3HG2 THR 980 -3.216 -11.677 1.445 519 H HIS 981 H HIS 981 -9.100 -11.405 1.494 520 HA HIS 981 HA HIS 981 -9.515 -10.283 -1.124 521 1HB HIS 981 1HB HIS 981 -11.040 -11.994 0.776 522 2HB HIS 981 2HB HIS 981 -11.985 -10.991 -0.307 523 HD1 HIS 981 HD1 HIS 981 -12.058 -14.062 -0.589 524 HD2 HIS 981 HD2 HIS 981 -9.445 -11.578 -2.733 525 HE1 HIS 981 HE1 HIS 981 -11.384 -15.365 -2.676 526 H ARG 982 H ARG 982 -11.957 -9.947 1.433 527 HA ARG 982 HA ARG 982 -12.551 -7.382 0.774 528 1HB ARG 982 1HB ARG 982 -12.957 -9.036 3.286 529 2HB ARG 982 2HB ARG 982 -13.456 -7.356 3.283 530 1HG ARG 982 1HG ARG 982 -14.839 -7.794 1.224 531 2HG ARG 982 2HG ARG 982 -14.373 -9.482 1.288 532 1HD ARG 982 1HD ARG 982 -15.350 -9.562 3.661 533 2HD ARG 982 2HD ARG 982 -15.981 -7.951 3.385 534 HE ARG 982 HE ARG 982 -16.710 -9.772 1.234 535 1HH1 ARG 982 2HH2 ARG 982 -17.565 -8.756 4.492 536 2HH1 ARG 982 1HH2 ARG 982 -19.220 -9.245 4.348 537 1HH2 ARG 982 2HH1 ARG 982 -18.893 -10.418 1.043 538 2HH2 ARG 982 1HH1 ARG 982 -19.981 -10.197 2.373 539 H GLU 983 H GLU 983 -10.309 -8.650 3.313 540 HA GLU 983 HA GLU 983 -9.756 -6.347 4.620 541 1HB GLU 983 1HB GLU 983 -7.950 -8.695 3.919 542 2HB GLU 983 2HB GLU 983 -7.448 -7.418 5.010 543 1HG GLU 983 1HG GLU 983 -8.858 -8.111 6.702 544 2HG GLU 983 2HG GLU 983 -10.136 -8.575 5.597 545 H ILE 984 H ILE 984 -8.275 -7.591 1.564 546 HA ILE 984 HA ILE 984 -6.454 -5.444 1.326 547 HB ILE 984 HB ILE 984 -7.492 -7.552 -0.551 548 1HG1 ILE 984 1HG1 ILE 984 -5.012 -7.143 1.093 549 2HG1 ILE 984 2HG1 ILE 984 -6.050 -8.550 0.976 550 1HG2 ILE 984 1HG2 ILE 984 -5.349 -5.508 -1.188 551 2HG2 ILE 984 2HG2 ILE 984 -5.918 -6.836 -2.228 552 3HG2 ILE 984 3HG2 ILE 984 -7.007 -5.484 -1.835 553 1HD1 ILE 984 1HD1 ILE 984 -5.281 -8.924 -1.374 554 2HD1 ILE 984 2HD1 ILE 984 -4.203 -7.515 -1.225 555 3HD1 ILE 984 3HD1 ILE 984 -3.930 -8.955 -0.215 556 H GLU 985 H GLU 985 -9.835 -6.016 0.331 557 HA GLU 985 HA GLU 985 -9.977 -3.906 -1.469 558 1HB GLU 985 1HB GLU 985 -11.912 -5.625 0.030 559 2HB GLU 985 2HB GLU 985 -12.547 -4.105 -0.568 560 1HG GLU 985 1HG GLU 985 -11.012 -5.129 -2.718 561 2HG GLU 985 2HG GLU 985 -11.835 -6.529 -2.058 562 H MET 986 H MET 986 -10.488 -4.126 2.088 563 HA MET 986 HA MET 986 -11.475 -1.510 2.321 564 1HB MET 986 1HB MET 986 -10.675 -3.777 4.057 565 2HB MET 986 2HB MET 986 -10.288 -2.232 4.789 566 1HG MET 986 1HG MET 986 -12.531 -1.572 4.934 567 2HG MET 986 2HG MET 986 -13.017 -2.519 3.541 568 1HE MET 986 1HE MET 986 -14.300 -5.559 4.599 569 2HE MET 986 2HE MET 986 -13.483 -4.612 3.333 570 3HE MET 986 3HE MET 986 -12.578 -5.842 4.247 571 H ALA 987 H ALA 987 -8.214 -2.982 2.395 572 HA ALA 987 HA ALA 987 -6.936 -0.651 3.409 573 1HB ALA 987 1HB ALA 987 -6.211 -3.358 2.437 574 2HB ALA 987 2HB ALA 987 -4.973 -2.107 2.172 575 3HB ALA 987 3HB ALA 987 -5.576 -2.429 3.815 576 H GLN 988 H GLN 988 -7.970 -1.848 0.237 577 HA GLN 988 HA GLN 988 -6.308 0.027 -1.138 578 1HB GLN 988 1HB GLN 988 -8.556 -1.760 -2.168 579 2HB GLN 988 2HB GLN 988 -7.438 -0.861 -3.174 580 1HG GLN 988 1HG GLN 988 -6.070 -2.529 -1.146 581 2HG GLN 988 2HG GLN 988 -7.060 -3.470 -2.244 582 1HE2 GLN 988 1HE2 GLN 988 -4.440 -1.152 -1.980 583 2HE2 GLN 988 2HE2 GLN 988 -3.695 -1.451 -3.515 584 H LYS 989 H LYS 989 -9.784 -0.376 -0.269 585 HA LYS 989 HA LYS 989 -10.723 1.827 -1.706 586 1HB LYS 989 1HB LYS 989 -12.744 1.413 -0.680 587 2HB LYS 989 2HB LYS 989 -11.967 -0.153 -0.554 588 1HG LYS 989 1HG LYS 989 -12.526 0.029 1.665 589 2HG LYS 989 2HG LYS 989 -11.057 0.979 1.761 590 1HD LYS 989 1HD LYS 989 -12.320 3.070 1.494 591 2HD LYS 989 2HD LYS 989 -13.802 2.187 1.184 592 1HE LYS 989 1HE LYS 989 -13.815 1.282 3.467 593 2HE LYS 989 2HE LYS 989 -12.227 1.949 3.791 594 1HZ LYS 989 1HZ LYS 989 -13.899 3.989 2.894 595 2HZ LYS 989 2HZ LYS 989 -14.664 3.194 4.098 596 3HZ LYS 989 3HZ LYS 989 -13.183 3.832 4.353 597 H LEU 990 H LEU 990 -8.884 1.534 1.278 598 HA LEU 990 HA LEU 990 -9.611 4.096 2.286 599 1HB LEU 990 1HB LEU 990 -8.146 1.807 3.140 600 2HB LEU 990 2HB LEU 990 -7.097 3.203 3.292 601 HG LEU 990 HG LEU 990 -9.892 3.075 4.452 602 1HD1 LEU 990 1HD1 LEU 990 -8.518 2.867 6.653 603 2HD1 LEU 990 2HD1 LEU 990 -8.836 1.417 5.670 604 3HD1 LEU 990 3HD1 LEU 990 -7.247 2.216 5.590 605 1HD2 LEU 990 1HD2 LEU 990 -8.106 5.229 4.053 606 2HD2 LEU 990 2HD2 LEU 990 -9.631 5.215 4.970 607 3HD2 LEU 990 3HD2 LEU 990 -8.093 4.866 5.795 608 H LEU 991 H LEU 991 -6.607 2.771 0.720 609 HA LEU 991 HA LEU 991 -5.217 5.110 0.550 610 1HB LEU 991 1HB LEU 991 -4.379 2.862 0.019 611 2HB LEU 991 2HB LEU 991 -5.315 2.859 -1.463 612 HG LEU 991 HG LEU 991 -3.997 4.835 -2.250 613 1HD1 LEU 991 1HD1 LEU 991 -2.731 5.994 -0.849 614 2HD1 LEU 991 2HD1 LEU 991 -3.096 4.844 0.459 615 3HD1 LEU 991 3HD1 LEU 991 -1.695 4.568 -0.603 616 1HD2 LEU 991 1HD2 LEU 991 -2.218 3.562 -3.063 617 2HD2 LEU 991 2HD2 LEU 991 -2.126 2.567 -1.590 618 3HD2 LEU 991 3HD2 LEU 991 -3.484 2.358 -2.721 619 H ASN 992 H ASN 992 -7.680 3.814 -1.767 620 HA ASN 992 HA ASN 992 -7.452 5.801 -3.623 621 1HB ASN 992 1HB ASN 992 -8.913 3.601 -3.568 622 2HB ASN 992 2HB ASN 992 -10.145 4.611 -2.838 623 1HD2 ASN 992 1HD2 ASN 992 -11.365 5.889 -4.057 624 2HD2 ASN 992 2HD2 ASN 992 -11.184 6.154 -5.759 625 H SER 993 H SER 993 -10.071 5.473 -1.095 626 HA SER 993 HA SER 993 -11.303 7.785 -1.331 627 1HB SER 993 1HB SER 993 -11.270 5.814 0.563 628 2HB SER 993 2HB SER 993 -10.585 7.130 1.497 629 HG SER 993 HG SER 993 -12.544 8.381 0.480 630 H ASP 994 H ASP 994 -8.337 7.319 0.731 631 HA ASP 994 HA ASP 994 -8.107 9.969 1.442 632 1HB ASP 994 1HB ASP 994 -5.947 7.840 1.069 633 2HB ASP 994 2HB ASP 994 -5.684 9.364 1.894 634 H LEU 995 H LEU 995 -6.796 8.037 -1.319 635 HA LEU 995 HA LEU 995 -4.999 9.787 -2.377 636 1HB LEU 995 1HB LEU 995 -4.886 8.011 -3.678 637 2HB LEU 995 2HB LEU 995 -6.495 7.485 -3.224 638 HG LEU 995 HG LEU 995 -7.334 9.233 -4.947 639 1HD1 LEU 995 1HD1 LEU 995 -4.521 8.862 -6.006 640 2HD1 LEU 995 2HD1 LEU 995 -5.842 9.800 -6.742 641 3HD1 LEU 995 3HD1 LEU 995 -5.117 10.337 -5.208 642 1HD2 LEU 995 1HD2 LEU 995 -7.831 7.088 -5.549 643 2HD2 LEU 995 2HD2 LEU 995 -6.679 7.501 -6.841 644 3HD2 LEU 995 3HD2 LEU 995 -6.141 6.540 -5.442 645 H ALA 996 H ALA 996 -8.579 9.695 -2.942 646 HA ALA 996 HA ALA 996 -8.686 11.813 -4.715 647 1HB ALA 996 1HB ALA 996 -10.769 10.955 -4.650 648 2HB ALA 996 2HB ALA 996 -10.497 10.238 -3.044 649 3HB ALA 996 3HB ALA 996 -11.030 11.931 -3.185 650 H GLU 997 H GLU 997 -9.016 11.809 -1.097 651 HA GLU 997 HA GLU 997 -9.381 14.513 -0.844 652 1HB GLU 997 1HB GLU 997 -9.670 12.744 0.943 653 2HB GLU 997 2HB GLU 997 -7.927 12.684 1.115 654 1HG GLU 997 1HG GLU 997 -8.606 14.202 2.810 655 2HG GLU 997 2HG GLU 997 -8.033 15.246 1.524 656 H LEU 998 H LEU 998 -6.466 12.630 -1.514 657 HA LEU 998 HA LEU 998 -4.670 14.731 -0.768 658 1HB LEU 998 1HB LEU 998 -4.489 12.009 -1.160 659 2HB LEU 998 2HB LEU 998 -3.680 12.653 -2.575 660 HG LEU 998 HG LEU 998 -2.462 14.158 -0.723 661 1HD1 LEU 998 1HD1 LEU 998 -3.912 12.265 0.846 662 2HD1 LEU 998 2HD1 LEU 998 -2.174 11.913 0.998 663 3HD1 LEU 998 3HD1 LEU 998 -2.789 13.539 1.379 664 1HD2 LEU 998 1HD2 LEU 998 -0.859 11.977 -0.581 665 2HD2 LEU 998 2HD2 LEU 998 -1.867 11.554 -1.986 666 3HD2 LEU 998 3HD2 LEU 998 -0.942 13.075 -1.979 667 H ILE 999 H ILE 999 -5.969 13.348 -3.852 668 HA ILE 999 HA ILE 999 -4.566 15.061 -5.537 669 HB ILE 999 HB ILE 999 -7.242 13.718 -5.930 670 1HG1 ILE 999 1HG1 ILE 999 -5.111 12.345 -5.278 671 2HG1 ILE 999 2HG1 ILE 999 -6.164 11.795 -6.566 672 1HG2 ILE 999 1HG2 ILE 999 -5.279 14.774 -7.984 673 2HG2 ILE 999 2HG2 ILE 999 -6.799 13.910 -8.315 674 3HG2 ILE 999 3HG2 ILE 999 -6.837 15.519 -7.553 675 1HD1 ILE 999 1HD1 ILE 999 -4.681 12.792 -8.267 676 2HD1 ILE 999 2HD1 ILE 999 -3.639 13.459 -6.988 677 3HD1 ILE 999 3HD1 ILE 999 -3.754 11.698 -7.214 678 H ASN1000 H ASN1000 -7.933 15.318 -4.201 679 HA ASN1000 HA ASN1000 -8.516 17.721 -5.364 680 1HB ASN1000 1HB ASN1000 -9.857 15.991 -3.732 681 2HB ASN1000 2HB ASN1000 -9.488 17.233 -2.552 682 1HD2 ASN1000 1HD2 ASN1000 -12.063 16.542 -3.397 683 2HD2 ASN1000 2HD2 ASN1000 -12.791 17.886 -4.211 684 H LYS1001 H LYS1001 -7.176 16.964 -2.061 685 HA LYS1001 HA LYS1001 -6.987 19.422 -0.984 686 1HB LYS1001 1HB LYS1001 -6.364 17.518 0.286 687 2HB LYS1001 2HB LYS1001 -5.105 17.063 -0.845 688 1HG LYS1001 1HG LYS1001 -3.619 18.275 0.359 689 2HG LYS1001 2HG LYS1001 -4.492 19.733 -0.068 690 1HD LYS1001 1HD LYS1001 -4.257 19.423 2.417 691 2HD LYS1001 2HD LYS1001 -5.926 19.546 1.899 692 1HE LYS1001 1HE LYS1001 -5.159 16.762 1.766 693 2HE LYS1001 2HE LYS1001 -4.657 17.384 3.325 694 1HZ LYS1001 1HZ LYS1001 -6.838 18.079 3.774 695 2HZ LYS1001 2HZ LYS1001 -7.346 17.833 2.241 696 3HZ LYS1001 3HZ LYS1001 -6.975 16.559 3.193 697 H MET1002 H MET1002 -4.689 17.947 -3.357 698 HA MET1002 HA MET1002 -2.922 20.067 -3.370 699 1HB MET1002 1HB MET1002 -2.321 17.931 -4.376 700 2HB MET1002 2HB MET1002 -3.717 17.955 -5.435 701 1HG MET1002 1HG MET1002 -1.696 20.199 -5.647 702 2HG MET1002 2HG MET1002 -1.302 18.643 -6.349 703 1HE MET1002 1HE MET1002 -3.447 17.791 -8.904 704 2HE MET1002 2HE MET1002 -2.148 18.871 -9.465 705 3HE MET1002 3HE MET1002 -1.860 17.768 -8.098 706 H LYS1003 H LYS1003 -5.752 19.353 -5.529 707 HA LYS1003 HA LYS1003 -5.487 21.470 -7.246 708 1HB LYS1003 1HB LYS1003 -7.544 19.571 -6.472 709 2HB LYS1003 2HB LYS1003 -8.246 21.135 -6.833 710 1HG LYS1003 1HG LYS1003 -6.745 21.119 -8.968 711 2HG LYS1003 2HG LYS1003 -6.498 19.416 -8.636 712 1HD LYS1003 1HD LYS1003 -8.359 19.410 -10.099 713 2HD LYS1003 2HD LYS1003 -9.098 19.240 -8.519 714 1HE LYS1003 1HE LYS1003 -9.685 21.603 -8.444 715 2HE LYS1003 2HE LYS1003 -8.712 21.954 -9.859 716 1HZ LYS1003 1HZ LYS1003 -10.187 20.716 -11.194 717 2HZ LYS1003 2HZ LYS1003 -11.001 20.117 -9.911 718 3HZ LYS1003 3HZ LYS1003 -11.114 21.704 -10.281 719 H LEU1004 H LEU1004 -6.469 21.420 -3.850 720 HA LEU1004 HA LEU1004 -7.485 24.125 -4.005 721 1HB LEU1004 1HB LEU1004 -7.076 22.421 -1.553 722 2HB LEU1004 2HB LEU1004 -8.094 23.837 -1.723 723 HG LEU1004 HG LEU1004 -8.561 21.229 -3.192 724 1HD1 LEU1004 1HD1 LEU1004 -10.592 21.678 -1.281 725 2HD1 LEU1004 2HD1 LEU1004 -9.377 20.377 -1.316 726 3HD1 LEU1004 3HD1 LEU1004 -9.038 21.888 -0.438 727 1HD2 LEU1004 1HD2 LEU1004 -9.522 23.095 -4.371 728 2HD2 LEU1004 2HD2 LEU1004 -10.824 22.176 -3.579 729 3HD2 LEU1004 3HD2 LEU1004 -10.265 23.713 -2.876 730 H ALA1005 H ALA1005 -4.751 22.321 -2.445 731 HA ALA1005 HA ALA1005 -3.511 24.398 -1.205 732 1HB ALA1005 1HB ALA1005 -2.340 22.516 -0.750 733 2HB ALA1005 2HB ALA1005 -2.781 21.763 -2.302 734 3HB ALA1005 3HB ALA1005 -1.414 22.900 -2.221 735 H GLN1006 H GLN1006 -3.533 23.552 -4.693 736 HA GLN1006 HA GLN1006 -1.492 25.118 -5.548 737 1HB GLN1006 1HB GLN1006 -3.735 23.751 -6.700 738 2HB GLN1006 2HB GLN1006 -3.688 25.350 -7.416 739 1HG GLN1006 1HG GLN1006 -1.019 24.713 -7.501 740 2HG GLN1006 2HG GLN1006 -1.716 23.111 -7.635 741 1HE2 GLN1006 1HE2 GLN1006 -0.373 25.204 -9.470 742 2HE2 GLN1006 2HE2 GLN1006 -1.338 25.199 -10.908 743 H GLN1007 H GLN1007 -4.816 26.055 -4.595 744 HA GLN1007 HA GLN1007 -4.188 28.794 -5.310 745 1HB GLN1007 1HB GLN1007 -6.448 27.424 -5.808 746 2HB GLN1007 2HB GLN1007 -6.867 27.988 -4.202 747 1HG GLN1007 1HG GLN1007 -5.925 30.325 -5.227 748 2HG GLN1007 2HG GLN1007 -6.438 29.567 -6.721 749 1HE2 GLN1007 1HE2 GLN1007 -7.386 30.993 -3.734 750 2HE2 GLN1007 2HE2 GLN1007 -9.102 31.001 -3.971 751 H TYR1008 H TYR1008 -4.647 26.593 -2.583 752 HA TYR1008 HA TYR1008 -4.808 28.787 -0.688 753 1HB TYR1008 1HB TYR1008 -4.939 25.737 -0.758 754 2HB TYR1008 2HB TYR1008 -4.634 26.510 0.784 755 HD1 TYR1008 HD1 TYR1008 -7.135 25.590 -1.636 756 HD2 TYR1008 HD2 TYR1008 -6.346 28.192 1.667 757 HE1 TYR1008 HE1 TYR1008 -9.631 25.952 -1.316 758 HE2 TYR1008 HE2 TYR1008 -8.845 28.545 1.976 759 HH TYR1008 HH TYR1008 -10.917 28.375 0.218 760 H VAL1009 H VAL1009 -2.373 28.511 -2.379 761 HA VAL1009 HA VAL1009 -0.461 27.907 -0.228 762 HB VAL1009 HB VAL1009 -0.273 26.294 -1.995 763 1HG1 VAL1009 1HG1 VAL1009 -1.375 27.625 -3.775 764 2HG1 VAL1009 2HG1 VAL1009 0.100 28.612 -3.922 765 3HG1 VAL1009 3HG1 VAL1009 0.147 26.877 -4.317 766 1HG2 VAL1009 1HG2 VAL1009 1.920 26.388 -1.601 767 2HG2 VAL1009 2HG2 VAL1009 2.078 27.541 -2.948 768 3HG2 VAL1009 3HG2 VAL1009 1.831 28.138 -1.289 769 H MET1010 H MET1010 -1.131 29.930 -3.162 770 HA MET1010 HA MET1010 0.864 31.679 -3.034 771 1HB MET1010 1HB MET1010 -1.088 33.410 -3.675 772 2HB MET1010 2HB MET1010 -0.693 32.089 -4.757 773 1HG MET1010 1HG MET1010 -2.727 31.101 -4.454 774 2HG MET1010 2HG MET1010 -2.613 31.224 -2.709 775 1HE MET1010 1HE MET1010 -4.474 33.417 -1.429 776 2HE MET1010 2HE MET1010 -5.727 32.760 -2.509 777 3HE MET1010 3HE MET1010 -4.424 31.704 -1.911 778 H THR1011 H THR1011 -1.717 31.299 -0.660 779 HA THR1011 HA THR1011 -0.830 33.759 0.688 780 HB THR1011 HB THR1011 -3.237 33.680 0.125 781 HG1 THR1011 HG1 THR1011 -2.890 34.590 2.176 782 1HG2 THR1011 1HG2 THR1011 -3.899 31.400 -0.008 783 2HG2 THR1011 2HG2 THR1011 -3.034 30.969 1.487 784 3HG2 THR1011 3HG2 THR1011 -4.552 31.896 1.572 785 H SER1012 H SER1012 -1.000 33.576 3.184 786 HA SER1012 HA SER1012 0.959 31.840 3.970 787 1HB SER1012 1HB SER1012 -1.170 33.380 5.484 788 2HB SER1012 2HB SER1012 -0.044 32.350 6.344 789 HG SER1012 HG SER1012 0.503 34.701 4.779 790 H LEU1013 H LEU1013 -2.440 31.288 3.408 791 HA LEU1013 HA LEU1013 -3.060 29.316 5.205 792 1HB LEU1013 1HB LEU1013 -4.226 30.495 3.014 793 2HB LEU1013 2HB LEU1013 -4.025 28.838 2.479 794 HG LEU1013 HG LEU1013 -6.235 29.268 3.482 795 1HD1 LEU1013 1HD1 LEU1013 -6.211 27.096 3.916 796 2HD1 LEU1013 2HD1 LEU1013 -4.441 27.130 4.102 797 3HD1 LEU1013 3HD1 LEU1013 -5.490 27.426 5.509 798 1HD2 LEU1013 1HD2 LEU1013 -6.533 30.388 5.374 799 2HD2 LEU1013 2HD2 LEU1013 -5.459 29.283 6.265 800 3HD2 LEU1013 3HD2 LEU1013 -4.779 30.690 5.412 801 H GLN1014 H GLN1014 -0.706 29.300 2.623 802 HA GLN1014 HA GLN1014 -0.591 26.780 1.793 803 1HB GLN1014 1HB GLN1014 1.010 28.405 1.016 804 2HB GLN1014 2HB GLN1014 1.674 28.632 2.621 805 1HG GLN1014 1HG GLN1014 1.792 25.808 1.848 806 2HG GLN1014 2HG GLN1014 2.577 26.811 0.643 807 1HE2 GLN1014 1HE2 GLN1014 4.334 28.104 1.194 808 2HE2 GLN1014 2HE2 GLN1014 5.283 27.841 2.618 809 H GLN1015 H GLN1015 1.608 27.759 4.510 810 HA GLN1015 HA GLN1015 2.266 25.355 5.392 811 1HB GLN1015 1HB GLN1015 2.578 26.370 7.641 812 2HB GLN1015 2HB GLN1015 3.140 27.428 6.363 813 1HG GLN1015 1HG GLN1015 1.180 28.832 6.519 814 2HG GLN1015 2HG GLN1015 0.324 27.658 7.499 815 1HE2 GLN1015 1HE2 GLN1015 0.019 28.559 9.396 816 2HE2 GLN1015 2HE2 GLN1015 1.220 29.295 10.404 817 H GLU1016 H GLU1016 -0.914 26.879 5.699 818 HA GLU1016 HA GLU1016 -1.853 25.235 7.757 819 1HB GLU1016 1HB GLU1016 -2.783 27.465 6.407 820 2HB GLU1016 2HB GLU1016 -3.853 26.219 5.795 821 1HG GLU1016 1HG GLU1016 -4.677 25.678 7.965 822 2HG GLU1016 2HG GLU1016 -3.311 26.420 8.775 823 H TYR1017 H TYR1017 -2.543 25.186 4.178 824 HA TYR1017 HA TYR1017 -3.835 22.692 4.267 825 1HB TYR1017 1HB TYR1017 -2.820 24.757 2.383 826 2HB TYR1017 2HB TYR1017 -2.640 23.150 1.706 827 HD1 TYR1017 HD1 TYR1017 -4.583 21.818 1.086 828 HD2 TYR1017 HD2 TYR1017 -5.054 25.685 2.854 829 HE1 TYR1017 HE1 TYR1017 -7.029 21.843 0.396 830 HE2 TYR1017 HE2 TYR1017 -7.499 25.697 2.158 831 HH TYR1017 HH TYR1017 -9.244 23.641 1.680 832 H LYS1018 H LYS1018 -0.489 23.568 4.495 833 HA LYS1018 HA LYS1018 0.568 21.266 3.210 834 1HB LYS1018 1HB LYS1018 1.551 23.696 4.181 835 2HB LYS1018 2HB LYS1018 2.290 22.492 5.217 836 1HG LYS1018 1HG LYS1018 3.801 22.212 3.533 837 2HG LYS1018 2HG LYS1018 2.542 21.294 2.730 838 1HD LYS1018 1HD LYS1018 3.072 24.283 2.390 839 2HD LYS1018 2HD LYS1018 3.447 23.033 1.220 840 1HE LYS1018 1HE LYS1018 0.919 22.445 1.262 841 2HE LYS1018 2HE LYS1018 0.687 23.945 2.137 842 1HZ LYS1018 1HZ LYS1018 1.371 23.542 -0.616 843 2HZ LYS1018 2HZ LYS1018 0.559 24.772 0.088 844 3HZ LYS1018 3HZ LYS1018 2.192 24.751 0.113 845 H LYS1019 H LYS1019 -0.362 22.152 6.567 846 HA LYS1019 HA LYS1019 0.683 19.769 7.691 847 1HB LYS1019 1HB LYS1019 -1.317 21.797 8.730 848 2HB LYS1019 2HB LYS1019 -0.654 20.484 9.681 849 1HG LYS1019 1HG LYS1019 0.975 22.689 8.330 850 2HG LYS1019 2HG LYS1019 0.605 22.604 10.041 851 1HD LYS1019 1HD LYS1019 2.548 21.444 10.270 852 2HD LYS1019 2HD LYS1019 1.704 20.087 9.551 853 1HE LYS1019 1HE LYS1019 2.893 20.238 7.608 854 2HE LYS1019 2HE LYS1019 2.648 21.970 7.496 855 1HZ LYS1019 1HZ LYS1019 4.847 20.527 8.609 856 2HZ LYS1019 2HZ LYS1019 4.800 22.035 7.983 857 3HZ LYS1019 3HZ LYS1019 4.353 21.780 9.533 858 H GLN1020 H GLN1020 -2.347 20.718 6.106 859 HA GLN1020 HA GLN1020 -3.891 18.627 7.096 860 1HB GLN1020 1HB GLN1020 -4.142 20.092 4.431 861 2HB GLN1020 2HB GLN1020 -5.405 19.152 5.200 862 1HG GLN1020 1HG GLN1020 -4.078 21.587 6.480 863 2HG GLN1020 2HG GLN1020 -5.587 21.651 5.592 864 1HE2 GLN1020 1HE2 GLN1020 -4.677 21.998 8.494 865 2HE2 GLN1020 2HE2 GLN1020 -5.818 21.091 9.430 866 H MET1021 H MET1021 -2.425 18.994 3.778 867 HA MET1021 HA MET1021 -2.929 16.474 2.926 868 1HB MET1021 1HB MET1021 -1.103 16.891 1.299 869 2HB MET1021 2HB MET1021 -1.990 18.379 1.564 870 1HG MET1021 1HG MET1021 -0.108 19.421 2.291 871 2HG MET1021 2HG MET1021 0.111 18.222 3.549 872 1HE MET1021 1HE MET1021 1.389 15.908 3.188 873 2HE MET1021 2HE MET1021 0.273 15.562 1.846 874 3HE MET1021 3HE MET1021 2.028 15.385 1.611 875 H LEU1022 H LEU1022 -0.564 17.549 5.302 876 HA LEU1022 HA LEU1022 1.113 15.254 5.073 877 1HB LEU1022 1HB LEU1022 1.419 17.732 6.092 878 2HB LEU1022 2HB LEU1022 1.063 16.852 7.565 879 HG LEU1022 HG LEU1022 3.058 15.491 5.910 880 1HD1 LEU1022 1HD1 LEU1022 3.875 18.170 7.054 881 2HD1 LEU1022 2HD1 LEU1022 4.859 17.032 6.102 882 3HD1 LEU1022 3HD1 LEU1022 3.508 17.900 5.333 883 1HD2 LEU1022 1HD2 LEU1022 3.607 16.510 8.659 884 2HD2 LEU1022 2HD2 LEU1022 2.319 15.299 8.453 885 3HD2 LEU1022 3HD2 LEU1022 3.977 14.935 7.919 886 H THR1023 H THR1023 -1.394 16.366 7.454 887 HA THR1023 HA THR1023 -1.402 14.340 9.209 888 HB THR1023 HB THR1023 -3.975 15.385 7.948 889 HG1 THR1023 HG1 THR1023 -3.348 17.388 8.746 890 1HG2 THR1023 1HG2 THR1023 -3.036 14.895 10.824 891 2HG2 THR1023 2HG2 THR1023 -4.598 15.622 10.377 892 3HG2 THR1023 3HG2 THR1023 -4.246 13.931 9.944 893 H ALA1024 H ALA1024 -2.837 14.197 5.903 894 HA ALA1024 HA ALA1024 -3.697 11.498 6.307 895 1HB ALA1024 1HB ALA1024 -5.050 12.294 4.686 896 2HB ALA1024 2HB ALA1024 -3.936 13.629 4.305 897 3HB ALA1024 3HB ALA1024 -3.689 12.027 3.570 898 H ALA1025 H ALA1025 -1.214 13.081 4.165 899 HA ALA1025 HA ALA1025 -0.048 10.866 3.147 900 1HB ALA1025 1HB ALA1025 0.915 13.603 3.919 901 2HB ALA1025 2HB ALA1025 2.120 12.396 3.410 902 3HB ALA1025 3HB ALA1025 0.795 12.849 2.311 903 H HIS1026 H HIS1026 -0.031 11.982 6.488 904 HA HIS1026 HA HIS1026 2.250 10.445 7.230 905 1HB HIS1026 1HB HIS1026 1.453 12.543 8.365 906 2HB HIS1026 2HB HIS1026 0.093 11.635 8.993 907 HD1 HIS1026 HD1 HIS1026 3.778 10.581 8.845 908 HD2 HIS1026 HD2 HIS1026 0.734 11.321 11.635 909 HE1 HIS1026 HE1 HIS1026 4.732 9.954 11.127 910 H ALA1027 H ALA1027 -1.294 10.173 8.021 911 HA ALA1027 HA ALA1027 -1.038 7.577 9.057 912 1HB ALA1027 1HB ALA1027 -2.990 9.574 8.891 913 2HB ALA1027 2HB ALA1027 -3.666 8.227 7.944 914 3HB ALA1027 3HB ALA1027 -3.181 7.969 9.637 915 H LEU1028 H LEU1028 -1.785 8.892 5.792 916 HA LEU1028 HA LEU1028 -2.654 6.625 4.552 917 1HB LEU1028 1HB LEU1028 -1.209 9.081 3.718 918 2HB LEU1028 2HB LEU1028 -1.232 7.749 2.579 919 HG LEU1028 HG LEU1028 -3.049 9.534 2.371 920 1HD1 LEU1028 1HD1 LEU1028 -3.980 8.014 1.056 921 2HD1 LEU1028 2HD1 LEU1028 -3.063 6.741 1.897 922 3HD1 LEU1028 3HD1 LEU1028 -4.690 7.189 2.464 923 1HD2 LEU1028 1HD2 LEU1028 -4.171 8.047 4.762 924 2HD2 LEU1028 2HD2 LEU1028 -3.623 9.740 4.728 925 3HD2 LEU1028 3HD2 LEU1028 -5.042 9.244 3.774 926 H ALA1029 H ALA1029 0.801 7.765 4.530 927 HA ALA1029 HA ALA1029 1.985 5.649 3.410 928 1HB ALA1029 1HB ALA1029 2.791 7.873 4.811 929 2HB ALA1029 2HB ALA1029 3.351 6.559 5.873 930 3HB ALA1029 3HB ALA1029 3.888 6.622 4.177 931 H VAL1030 H VAL1030 1.123 5.904 6.929 932 HA VAL1030 HA VAL1030 2.013 3.335 7.578 933 HB VAL1030 HB VAL1030 0.181 5.369 8.789 934 1HG1 VAL1030 1HG1 VAL1030 -1.030 3.688 9.709 935 2HG1 VAL1030 2HG1 VAL1030 0.237 2.471 9.424 936 3HG1 VAL1030 3HG1 VAL1030 0.360 3.575 10.815 937 1HG2 VAL1030 1HG2 VAL1030 1.882 5.263 10.610 938 2HG2 VAL1030 2HG2 VAL1030 2.790 4.074 9.646 939 3HG2 VAL1030 3HG2 VAL1030 2.561 5.729 9.032 940 H ASP1031 H ASP1031 -1.183 4.615 6.496 941 HA ASP1031 HA ASP1031 -2.654 2.367 6.888 942 1HB ASP1031 1HB ASP1031 -2.798 4.321 4.544 943 2HB ASP1031 2HB ASP1031 -4.081 3.217 4.996 944 H ALA1032 H ALA1032 -0.662 3.388 4.025 945 HA ALA1032 HA ALA1032 -1.264 1.229 2.382 946 1HB ALA1032 1HB ALA1032 1.144 1.880 1.487 947 2HB ALA1032 2HB ALA1032 -0.225 3.003 1.304 948 3HB ALA1032 3HB ALA1032 0.958 3.245 2.613 949 H LYS1033 H LYS1033 0.663 1.471 5.296 950 HA LYS1033 HA LYS1033 2.326 -0.770 4.731 951 1HB LYS1033 1HB LYS1033 2.598 1.265 6.404 952 2HB LYS1033 2HB LYS1033 1.766 0.194 7.514 953 1HG LYS1033 1HG LYS1033 3.864 -0.634 7.922 954 2HG LYS1033 2HG LYS1033 3.592 -1.558 6.459 955 1HD LYS1033 1HD LYS1033 4.493 0.903 5.474 956 2HD LYS1033 2HD LYS1033 5.439 0.703 6.936 957 1HE LYS1033 1HE LYS1033 6.724 -0.910 5.977 958 2HE LYS1033 2HE LYS1033 5.314 -1.830 5.490 959 1HZ LYS1033 1HZ LYS1033 5.298 -0.864 3.472 960 2HZ LYS1033 2HZ LYS1033 5.890 0.570 3.985 961 3HZ LYS1033 3HZ LYS1033 6.896 -0.697 3.765 962 H ASN1034 H ASN1034 -0.707 -0.204 6.619 963 HA ASN1034 HA ASN1034 -0.908 -2.762 7.605 964 1HB ASN1034 1HB ASN1034 -3.226 -2.197 8.084 965 2HB ASN1034 2HB ASN1034 -2.302 -0.718 8.256 966 1HD2 ASN1034 1HD2 ASN1034 -3.591 0.860 7.658 967 2HD2 ASN1034 2HD2 ASN1034 -4.472 0.977 6.171 968 H LEU1035 H LEU1035 -1.384 -1.419 4.393 969 HA LEU1035 HA LEU1035 -3.249 -3.283 3.412 970 1HB LEU1035 1HB LEU1035 -3.123 -1.382 2.156 971 2HB LEU1035 2HB LEU1035 -1.378 -1.268 2.277 972 HG LEU1035 HG LEU1035 -2.366 -3.606 0.757 973 1HD1 LEU1035 1HD1 LEU1035 -2.837 -2.253 -1.273 974 2HD1 LEU1035 2HD1 LEU1035 -4.039 -2.040 0.022 975 3HD1 LEU1035 3HD1 LEU1035 -2.807 -0.788 -0.263 976 1HD2 LEU1035 1HD2 LEU1035 -0.336 -3.500 -0.158 977 2HD2 LEU1035 2HD2 LEU1035 -0.499 -1.768 -0.533 978 3HD2 LEU1035 3HD2 LEU1035 0.038 -2.281 1.084 979 H LEU1036 H LEU1036 0.343 -3.056 2.871 980 HA LEU1036 HA LEU1036 0.444 -5.676 1.809 981 1HB LEU1036 1HB LEU1036 2.021 -3.512 1.660 982 2HB LEU1036 2HB LEU1036 2.876 -4.384 2.917 983 HG LEU1036 HG LEU1036 2.374 -6.304 0.928 984 1HD1 LEU1036 1HD1 LEU1036 3.259 -5.340 -1.115 985 2HD1 LEU1036 2HD1 LEU1036 1.788 -4.473 -0.613 986 3HD1 LEU1036 3HD1 LEU1036 3.388 -3.744 -0.338 987 1HD2 LEU1036 1HD2 LEU1036 4.388 -6.672 1.836 988 2HD2 LEU1036 2HD2 LEU1036 4.989 -5.602 0.547 989 3HD2 LEU1036 3HD2 LEU1036 4.668 -4.946 2.170 990 H ASP1037 H ASP1037 0.975 -4.217 5.047 991 HA ASP1037 HA ASP1037 2.197 -6.243 6.310 992 1HB ASP1037 1HB ASP1037 1.524 -4.050 7.321 993 2HB ASP1037 2HB ASP1037 -0.144 -4.585 7.362 994 H VAL1038 H VAL1038 -1.292 -5.864 5.459 995 HA VAL1038 HA VAL1038 -2.126 -8.196 6.851 996 HB VAL1038 HB VAL1038 -3.411 -6.060 6.077 997 1HG1 VAL1038 1HG1 VAL1038 -4.013 -5.855 3.933 998 2HG1 VAL1038 2HG1 VAL1038 -2.855 -7.156 3.569 999 3HG1 VAL1038 3HG1 VAL1038 -4.569 -7.544 3.853 1000 1HG2 VAL1038 1HG2 VAL1038 -4.727 -7.432 7.334 1001 2HG2 VAL1038 2HG2 VAL1038 -5.509 -7.705 5.758 1002 3HG2 VAL1038 3HG2 VAL1038 -4.326 -8.880 6.380 1003 H ILE1039 H ILE1039 -0.695 -7.488 3.705 1004 HA ILE1039 HA ILE1039 -1.568 -9.904 2.478 1005 HB ILE1039 HB ILE1039 0.252 -7.648 1.822 1006 1HG1 ILE1039 1HG1 ILE1039 -1.901 -9.053 0.216 1007 2HG1 ILE1039 2HG1 ILE1039 -2.198 -7.695 1.284 1008 1HG2 ILE1039 1HG2 ILE1039 0.735 -10.417 0.978 1009 2HG2 ILE1039 2HG2 ILE1039 0.573 -9.266 -0.370 1010 3HG2 ILE1039 3HG2 ILE1039 1.789 -8.985 0.900 1011 1HD1 ILE1039 1HD1 ILE1039 -1.925 -6.750 -0.901 1012 2HD1 ILE1039 2HD1 ILE1039 -0.399 -6.414 -0.048 1013 3HD1 ILE1039 3HD1 ILE1039 -0.484 -7.742 -1.231 1014 H ASP1040 H ASP1040 1.553 -8.759 3.936 1015 HA ASP1040 HA ASP1040 2.987 -11.016 3.517 1016 1HB ASP1040 1HB ASP1040 3.251 -8.638 5.004 1017 2HB ASP1040 2HB ASP1040 3.413 -9.896 6.214 1018 H GLN1041 H GLN1041 0.939 -10.112 6.394 1019 HA GLN1041 HA GLN1041 1.361 -12.498 7.750 1020 1HB GLN1041 1HB GLN1041 -0.682 -10.278 7.911 1021 2HB GLN1041 2HB GLN1041 -0.933 -11.731 8.858 1022 1HG GLN1041 1HG GLN1041 1.590 -11.371 9.594 1023 2HG GLN1041 2HG GLN1041 1.335 -9.729 9.037 1024 1HE2 GLN1041 1HE2 GLN1041 -0.705 -8.667 9.821 1025 2HE2 GLN1041 2HE2 GLN1041 -1.143 -8.883 11.483 1026 H ALA1042 H ALA1042 -0.723 -11.621 5.055 1027 HA ALA1042 HA ALA1042 -2.616 -13.709 5.428 1028 1HB ALA1042 1HB ALA1042 -3.576 -12.189 4.049 1029 2HB ALA1042 2HB ALA1042 -2.005 -11.564 3.492 1030 3HB ALA1042 3HB ALA1042 -2.692 -13.031 2.754 1031 H ARG1043 H ARG1043 0.146 -13.223 3.108 1032 HA ARG1043 HA ARG1043 0.090 -15.478 1.772 1033 1HB ARG1043 1HB ARG1043 1.906 -13.578 1.879 1034 2HB ARG1043 2HB ARG1043 2.721 -14.610 3.038 1035 1HG ARG1043 1HG ARG1043 2.416 -16.495 1.213 1036 2HG ARG1043 2HG ARG1043 2.133 -15.161 0.111 1037 1HD ARG1043 1HD ARG1043 4.551 -15.011 1.915 1038 2HD ARG1043 2HD ARG1043 4.610 -16.114 0.554 1039 HE ARG1043 HE ARG1043 3.670 -13.781 -0.593 1040 1HH1 ARG1043 2HH2 ARG1043 6.457 -14.540 1.416 1041 2HH1 ARG1043 1HH2 ARG1043 7.446 -13.289 0.739 1042 1HH2 ARG1043 2HH1 ARG1043 4.974 -12.130 -1.486 1043 2HH2 ARG1043 1HH1 ARG1043 6.596 -11.909 -0.923 1044 H LEU1044 H LEU1044 1.969 -15.179 4.888 1045 HA LEU1044 HA LEU1044 2.634 -17.798 5.196 1046 1HB LEU1044 1HB LEU1044 2.641 -17.271 7.655 1047 2HB LEU1044 2HB LEU1044 3.602 -16.234 6.621 1048 HG LEU1044 HG LEU1044 1.350 -14.767 6.677 1049 1HD1 LEU1044 1HD1 LEU1044 1.216 -16.559 9.068 1050 2HD1 LEU1044 2HD1 LEU1044 0.719 -14.858 9.235 1051 3HD1 LEU1044 3HD1 LEU1044 -0.087 -15.909 8.046 1052 1HD2 LEU1044 1HD2 LEU1044 3.843 -14.812 8.259 1053 2HD2 LEU1044 2HD2 LEU1044 3.116 -13.514 7.281 1054 3HD2 LEU1044 3HD2 LEU1044 2.527 -13.821 8.932 1055 H LYS1045 H LYS1045 -0.465 -16.166 6.044 1056 HA LYS1045 HA LYS1045 -1.703 -18.097 7.465 1057 1HB LYS1045 1HB LYS1045 -2.472 -15.750 6.513 1058 2HB LYS1045 2HB LYS1045 -3.233 -16.732 5.278 1059 1HG LYS1045 1HG LYS1045 -4.777 -17.630 6.740 1060 2HG LYS1045 2HG LYS1045 -3.638 -17.707 8.070 1061 1HD LYS1045 1HD LYS1045 -3.894 -15.336 8.545 1062 2HD LYS1045 2HD LYS1045 -4.778 -15.067 7.055 1063 1HE LYS1045 1HE LYS1045 -6.562 -15.206 8.545 1064 2HE LYS1045 2HE LYS1045 -6.449 -16.889 8.070 1065 1HZ LYS1045 1HZ LYS1045 -6.503 -16.380 10.514 1066 2HZ LYS1045 2HZ LYS1045 -5.335 -17.409 10.021 1067 3HZ LYS1045 3HZ LYS1045 -4.962 -15.858 10.371 1068 H MET1046 H MET1046 -0.934 -18.102 3.981 1069 HA MET1046 HA MET1046 -2.497 -20.460 3.563 1070 1HB MET1046 1HB MET1046 -2.362 -18.938 1.695 1071 2HB MET1046 2HB MET1046 -0.633 -18.722 1.886 1072 1HG MET1046 1HG MET1046 -0.227 -21.060 1.152 1073 2HG MET1046 2HG MET1046 -1.952 -21.348 1.041 1074 1HE MET1046 1HE MET1046 0.610 -18.713 0.264 1075 2HE MET1046 2HE MET1046 0.341 -18.247 -1.433 1076 3HE MET1046 3HE MET1046 -0.755 -17.653 -0.164 1077 H ILE1047 H ILE1047 1.015 -19.556 3.614 1078 HA ILE1047 HA ILE1047 2.125 -21.944 2.968 1079 HB ILE1047 HB ILE1047 2.951 -19.762 4.855 1080 1HG1 ILE1047 1HG1 ILE1047 4.718 -20.216 2.652 1081 2HG1 ILE1047 2HG1 ILE1047 3.079 -20.197 2.034 1082 1HG2 ILE1047 1HG2 ILE1047 5.279 -20.967 4.599 1083 2HG2 ILE1047 2HG2 ILE1047 4.146 -21.418 5.896 1084 3HG2 ILE1047 3HG2 ILE1047 4.263 -22.418 4.427 1085 1HD1 ILE1047 1HD1 ILE1047 4.178 -18.066 3.921 1086 2HD1 ILE1047 2HD1 ILE1047 4.177 -17.914 2.147 1087 3HD1 ILE1047 3HD1 ILE1047 2.636 -18.022 3.032 1088 H SER1048 H SER1048 1.248 -20.871 6.330 1089 HA SER1048 HA SER1048 1.652 -23.541 7.250 1090 1HB SER1048 1HB SER1048 1.852 -21.073 8.435 1091 2HB SER1048 2HB SER1048 0.269 -21.563 9.006 1092 HG SER1048 HG SER1048 2.734 -22.413 9.840 1093 H GLN1049 H GLN1049 -0.140 -24.029 5.394 1094 HA GLN1049 HA GLN1049 -2.401 -24.850 6.827 1095 1HB GLN1049 1HB GLN1049 -2.581 -22.226 5.681 1096 2HB GLN1049 2HB GLN1049 -3.594 -23.278 4.713 1097 1HG GLN1049 1HG GLN1049 -4.458 -24.169 7.057 1098 2HG GLN1049 2HG GLN1049 -3.789 -22.673 7.677 1099 1HE2 GLN1049 1HE2 GLN1049 -6.538 -24.032 6.773 1100 2HE2 GLN1049 2HE2 GLN1049 -7.431 -22.693 6.131 1101 H SER1050 H SER1050 -0.258 -25.952 5.177 1102 HA SER1050 HA SER1050 -1.876 -27.536 3.500 1103 1HB SER1050 1HB SER1050 -1.434 -25.435 2.091 1104 2HB SER1050 2HB SER1050 0.258 -25.890 2.082 1105 HG SER1050 HG SER1050 -0.151 -27.321 0.550 1106 H ARG1051 H ARG1051 -0.910 -29.067 5.044 1107 HA ARG1051 HA ARG1051 1.742 -29.328 5.520 1108 1HB ARG1051 1HB ARG1051 -0.030 -30.595 6.717 1109 2HB ARG1051 2HB ARG1051 -0.373 -31.526 5.272 1110 1HG ARG1051 1HG ARG1051 2.448 -31.750 5.735 1111 2HG ARG1051 2HG ARG1051 1.669 -31.987 7.286 1112 1HD ARG1051 1HD ARG1051 0.069 -33.461 5.477 1113 2HD ARG1051 2HD ARG1051 1.711 -33.760 4.942 1114 HE ARG1051 HE ARG1051 1.622 -33.993 7.798 1115 1HH1 ARG1051 2HH2 ARG1051 0.528 -35.676 4.907 1116 2HH1 ARG1051 1HH2 ARG1051 0.526 -37.235 5.661 1117 1HH2 ARG1051 2HH1 ARG1051 1.619 -36.051 8.793 1118 2HH2 ARG1051 1HH1 ARG1051 1.150 -37.450 7.886 1119 HA PRO1052 HA PRO1052 3.160 -30.687 1.583 1120 1HB PRO1052 1HB PRO1052 5.825 -30.812 2.173 1121 2HB PRO1052 2HB PRO1052 5.020 -29.334 1.685 1122 1HG PRO1052 1HG PRO1052 5.930 -30.147 4.378 1123 2HG PRO1052 2HG PRO1052 5.523 -28.546 3.794 1124 1HD PRO1052 1HD PRO1052 3.905 -30.227 5.462 1125 2HD PRO1052 2HD PRO1052 3.452 -28.677 4.783 1126 H HIS1053 H HIS1053 4.419 -32.486 0.544 1127 HA HIS1053 HA HIS1053 3.790 -34.841 2.124 1128 1HB HIS1053 1HB HIS1053 2.826 -35.101 0.053 1129 2HB HIS1053 2HB HIS1053 4.100 -34.235 -0.784 1130 HD1 HIS1053 HD1 HIS1053 3.383 -37.634 0.774 1131 HD2 HIS1053 HD2 HIS1053 6.123 -35.820 -1.833 1132 HE1 HIS1053 HE1 HIS1053 4.783 -39.522 -0.219 Start of MODEL 22 1 H MET 915 H MET 915 13.749 -18.654 -4.751 2 HA MET 915 HA MET 915 16.181 -18.641 -3.803 3 1HB MET 915 1HB MET 915 15.775 -16.184 -5.453 4 2HB MET 915 2HB MET 915 16.401 -15.851 -3.851 5 1HG MET 915 1HG MET 915 18.311 -17.339 -4.205 6 2HG MET 915 2HG MET 915 17.634 -17.941 -5.705 7 1HE MET 915 1HE MET 915 20.672 -16.017 -6.899 8 2HE MET 915 2HE MET 915 20.723 -15.923 -5.122 9 3HE MET 915 3HE MET 915 20.181 -17.420 -5.919 10 H ALA 916 H ALA 916 16.354 -17.756 -1.605 11 HA ALA 916 HA ALA 916 13.997 -17.769 -0.208 12 1HB ALA 916 1HB ALA 916 16.755 -16.648 0.360 13 2HB ALA 916 2HB ALA 916 15.451 -16.580 1.571 14 3HB ALA 916 3HB ALA 916 16.018 -18.153 0.961 15 H ASN 917 H ASN 917 15.913 -14.928 -1.397 16 HA ASN 917 HA ASN 917 13.897 -13.155 -0.443 17 1HB ASN 917 1HB ASN 917 16.639 -12.977 -1.381 18 2HB ASN 917 2HB ASN 917 15.670 -11.868 -2.330 19 1HD2 ASN 917 1HD2 ASN 917 17.192 -10.412 -1.115 20 2HD2 ASN 917 2HD2 ASN 917 16.651 -9.756 0.394 21 H LEU 918 H LEU 918 11.971 -13.677 -1.662 22 HA LEU 918 HA LEU 918 12.165 -13.794 -4.542 23 1HB LEU 918 1HB LEU 918 9.860 -14.099 -2.616 24 2HB LEU 918 2HB LEU 918 9.704 -14.210 -4.358 25 HG LEU 918 HG LEU 918 11.730 -16.012 -3.843 26 1HD1 LEU 918 1HD1 LEU 918 11.122 -15.603 -1.362 27 2HD1 LEU 918 2HD1 LEU 918 9.680 -16.585 -1.716 28 3HD1 LEU 918 3HD1 LEU 918 11.305 -17.276 -1.941 29 1HD2 LEU 918 1HD2 LEU 918 8.925 -17.018 -3.772 30 2HD2 LEU 918 2HD2 LEU 918 9.428 -16.048 -5.177 31 3HD2 LEU 918 3HD2 LEU 918 10.311 -17.536 -4.761 32 H ASP 919 H ASP 919 13.094 -11.527 -4.590 33 HA ASP 919 HA ASP 919 11.008 -9.550 -4.197 34 1HB ASP 919 1HB ASP 919 12.854 -7.893 -4.438 35 2HB ASP 919 2HB ASP 919 13.169 -9.039 -3.151 36 H ARG 920 H ARG 920 10.939 -11.481 -6.434 37 HA ARG 920 HA ARG 920 11.934 -10.044 -8.695 38 1HB ARG 920 1HB ARG 920 12.061 -12.486 -8.747 39 2HB ARG 920 2HB ARG 920 10.352 -12.641 -8.393 40 1HG ARG 920 1HG ARG 920 9.746 -11.670 -10.561 41 2HG ARG 920 2HG ARG 920 11.417 -11.269 -10.903 42 1HD ARG 920 1HD ARG 920 11.955 -13.427 -11.514 43 2HD ARG 920 2HD ARG 920 10.960 -14.143 -10.262 44 HE ARG 920 HE ARG 920 9.181 -14.271 -11.779 45 1HH1 ARG 920 2HH2 ARG 920 11.587 -11.995 -13.036 46 2HH1 ARG 920 1HH2 ARG 920 10.797 -11.812 -14.567 47 1HH2 ARG 920 1HH1 ARG 920 8.771 -13.019 -14.993 48 H SER 921 H SER 921 8.699 -11.627 -8.225 49 HA SER 921 HA SER 921 7.511 -9.439 -9.650 50 1HB SER 921 1HB SER 921 7.009 -12.145 -9.583 51 2HB SER 921 2HB SER 921 5.767 -11.561 -8.494 52 HG SER 921 HG SER 921 6.095 -10.128 -10.926 53 H ASN 922 H ASN 922 7.277 -11.056 -6.413 54 HA ASN 922 HA ASN 922 5.278 -9.524 -5.377 55 1HB ASN 922 1HB ASN 922 7.753 -10.567 -3.899 56 2HB ASN 922 2HB ASN 922 6.226 -10.144 -3.148 57 1HD2 ASN 922 1HD2 ASN 922 8.008 -12.658 -3.924 58 2HD2 ASN 922 2HD2 ASN 922 6.829 -13.860 -4.332 59 H ASP 923 H ASP 923 8.562 -8.698 -6.244 60 HA ASP 923 HA ASP 923 8.913 -6.624 -4.373 61 1HB ASP 923 1HB ASP 923 10.925 -7.436 -5.285 62 2HB ASP 923 2HB ASP 923 10.267 -7.547 -6.906 63 H LYS 924 H LYS 924 7.933 -6.888 -7.857 64 HA LYS 924 HA LYS 924 7.786 -4.227 -8.492 65 1HB LYS 924 1HB LYS 924 7.510 -6.271 -9.983 66 2HB LYS 924 2HB LYS 924 5.841 -6.339 -9.452 67 1HG LYS 924 1HG LYS 924 5.951 -3.705 -10.119 68 2HG LYS 924 2HG LYS 924 7.204 -4.301 -11.190 69 1HD LYS 924 1HD LYS 924 4.959 -4.314 -12.285 70 2HD LYS 924 2HD LYS 924 5.654 -5.921 -12.200 71 1HE LYS 924 1HE LYS 924 4.106 -5.353 -9.780 72 2HE LYS 924 2HE LYS 924 3.123 -5.094 -11.207 73 1HZ LYS 924 1HZ LYS 924 4.594 -7.534 -10.506 74 2HZ LYS 924 2HZ LYS 924 2.975 -7.350 -10.620 75 3HZ LYS 924 3HZ LYS 924 3.899 -7.303 -11.966 76 H VAL 925 H VAL 925 5.396 -6.305 -6.771 77 HA VAL 925 HA VAL 925 3.471 -4.210 -6.618 78 HB VAL 925 HB VAL 925 3.696 -6.762 -5.013 79 1HG1 VAL 925 1HG1 VAL 925 1.618 -6.372 -4.224 80 2HG1 VAL 925 2HG1 VAL 925 1.974 -4.676 -4.630 81 3HG1 VAL 925 3HG1 VAL 925 1.048 -5.688 -5.765 82 1HG2 VAL 925 1HG2 VAL 925 2.764 -7.978 -6.719 83 2HG2 VAL 925 2HG2 VAL 925 1.957 -6.564 -7.440 84 3HG2 VAL 925 3HG2 VAL 925 3.705 -6.807 -7.674 85 H TYR 926 H TYR 926 5.473 -5.894 -4.086 86 HA TYR 926 HA TYR 926 4.935 -4.195 -2.018 87 1HB TYR 926 1HB TYR 926 7.350 -5.808 -2.989 88 2HB TYR 926 2HB TYR 926 7.475 -4.911 -1.489 89 HD1 TYR 926 HD1 TYR 926 4.336 -6.534 -2.590 90 HD2 TYR 926 HD2 TYR 926 7.784 -6.837 -0.075 91 HE1 TYR 926 HE1 TYR 926 3.262 -8.469 -1.338 92 HE2 TYR 926 HE2 TYR 926 6.698 -8.771 1.168 93 HH TYR 926 HH TYR 926 3.736 -9.374 1.323 94 H GLU 927 H GLU 927 6.799 -3.558 -4.921 95 HA GLU 927 HA GLU 927 8.402 -1.536 -3.802 96 1HB GLU 927 1HB GLU 927 7.775 -2.570 -6.539 97 2HB GLU 927 2HB GLU 927 8.370 -0.924 -6.459 98 1HG GLU 927 1HG GLU 927 9.848 -2.921 -4.785 99 2HG GLU 927 2HG GLU 927 10.001 -3.121 -6.520 100 H ASN 928 H ASN 928 5.688 -1.287 -6.222 101 HA ASN 928 HA ASN 928 5.311 1.302 -6.287 102 1HB ASN 928 1HB ASN 928 3.747 -0.952 -6.881 103 2HB ASN 928 2HB ASN 928 2.727 -0.068 -5.762 104 1HD2 ASN 928 1HD2 ASN 928 4.679 0.247 -8.696 105 2HD2 ASN 928 2HD2 ASN 928 3.757 1.503 -9.452 106 H VAL 929 H VAL 929 4.011 -0.919 -3.716 107 HA VAL 929 HA VAL 929 2.612 0.894 -2.220 108 HB VAL 929 HB VAL 929 4.299 -1.395 -1.193 109 1HG1 VAL 929 1HG1 VAL 929 3.419 -0.022 0.603 110 2HG1 VAL 929 2HG1 VAL 929 1.789 -0.072 -0.110 111 3HG1 VAL 929 3HG1 VAL 929 2.523 -1.558 0.540 112 1HG2 VAL 929 1HG2 VAL 929 1.993 -1.372 -2.980 113 2HG2 VAL 929 2HG2 VAL 929 3.068 -2.713 -2.518 114 3HG2 VAL 929 3HG2 VAL 929 1.676 -2.293 -1.490 115 H THR 930 H THR 930 6.096 -0.062 -1.801 116 HA THR 930 HA THR 930 6.559 1.964 0.133 117 HB THR 930 HB THR 930 8.997 1.248 -0.413 118 HG1 THR 930 HG1 THR 930 9.131 -0.269 -2.080 119 1HG2 THR 930 1HG2 THR 930 7.705 0.064 1.378 120 2HG2 THR 930 2HG2 THR 930 6.952 -0.968 0.138 121 3HG2 THR 930 3HG2 THR 930 8.702 -1.078 0.445 122 H GLY 931 H GLY 931 7.808 1.649 -3.264 123 1HA GLY 931 1HA GLY 931 9.032 3.961 -3.663 124 2HA GLY 931 2HA GLY 931 7.938 3.282 -4.853 125 H LEU 932 H LEU 932 5.423 3.675 -4.087 126 HA LEU 932 HA LEU 932 4.992 6.385 -4.440 127 1HB LEU 932 1HB LEU 932 2.859 5.788 -4.644 128 2HB LEU 932 2HB LEU 932 3.502 4.158 -4.617 129 HG LEU 932 HG LEU 932 3.070 4.109 -2.132 130 1HD1 LEU 932 1HD1 LEU 932 2.564 5.986 -1.066 131 2HD1 LEU 932 2HD1 LEU 932 2.465 6.876 -2.604 132 3HD1 LEU 932 3HD1 LEU 932 1.026 6.052 -1.959 133 1HD2 LEU 932 1HD2 LEU 932 0.374 4.366 -2.808 134 2HD2 LEU 932 2HD2 LEU 932 1.188 3.936 -4.331 135 3HD2 LEU 932 3HD2 LEU 932 1.373 2.896 -2.898 136 H VAL 933 H VAL 933 4.849 4.380 -1.423 137 HA VAL 933 HA VAL 933 4.114 6.424 0.286 138 HB VAL 933 HB VAL 933 5.305 3.743 0.450 139 1HG1 VAL 933 1HG1 VAL 933 5.867 5.821 2.575 140 2HG1 VAL 933 2HG1 VAL 933 5.783 4.082 2.948 141 3HG1 VAL 933 3HG1 VAL 933 6.997 4.687 1.795 142 1HG2 VAL 933 1HG2 VAL 933 2.931 5.189 1.302 143 2HG2 VAL 933 2HG2 VAL 933 3.187 3.439 1.096 144 3HG2 VAL 933 3HG2 VAL 933 3.617 4.227 2.633 145 H LYS 934 H LYS 934 7.446 5.197 -0.501 146 HA LYS 934 HA LYS 934 8.946 6.826 1.001 147 1HB LYS 934 1HB LYS 934 9.449 6.095 -1.900 148 2HB LYS 934 2HB LYS 934 10.662 6.676 -0.777 149 1HG LYS 934 1HG LYS 934 9.141 4.443 0.375 150 2HG LYS 934 2HG LYS 934 9.855 3.992 -1.160 151 1HD LYS 934 1HD LYS 934 11.855 3.742 -0.128 152 2HD LYS 934 2HD LYS 934 11.874 5.462 0.209 153 1HE LYS 934 1HE LYS 934 11.689 4.996 2.420 154 2HE LYS 934 2HE LYS 934 10.088 4.347 2.124 155 1HZ LYS 934 1HZ LYS 934 12.170 2.552 1.392 156 2HZ LYS 934 2HZ LYS 934 12.198 2.934 2.979 157 3HZ LYS 934 3HZ LYS 934 10.850 2.291 2.318 158 H ALA 935 H ALA 935 7.137 7.726 -1.963 159 HA ALA 935 HA ALA 935 8.239 10.368 -2.001 160 1HB ALA 935 1HB ALA 935 7.035 10.606 -3.973 161 2HB ALA 935 2HB ALA 935 7.241 8.839 -3.919 162 3HB ALA 935 3HB ALA 935 5.701 9.572 -3.410 163 H VAL 936 H VAL 936 5.039 8.877 -1.148 164 HA VAL 936 HA VAL 936 3.551 10.967 -0.510 165 HB VAL 936 HB VAL 936 3.534 8.291 0.041 166 1HG1 VAL 936 1HG1 VAL 936 4.770 8.667 2.158 167 2HG1 VAL 936 2HG1 VAL 936 3.446 9.714 2.723 168 3HG1 VAL 936 3HG1 VAL 936 3.147 7.985 2.422 169 1HG2 VAL 936 1HG2 VAL 936 1.721 10.550 0.227 170 2HG2 VAL 936 2HG2 VAL 936 1.397 8.867 -0.255 171 3HG2 VAL 936 3HG2 VAL 936 1.347 9.326 1.464 172 H ILE 937 H ILE 937 6.379 9.801 1.378 173 HA ILE 937 HA ILE 937 5.962 11.854 3.364 174 HB ILE 937 HB ILE 937 7.958 9.640 2.976 175 1HG1 ILE 937 1HG1 ILE 937 6.578 9.802 5.524 176 2HG1 ILE 937 2HG1 ILE 937 5.432 9.795 4.198 177 1HG2 ILE 937 1HG2 ILE 937 8.007 11.629 5.255 178 2HG2 ILE 937 2HG2 ILE 937 9.145 10.299 4.933 179 3HG2 ILE 937 3HG2 ILE 937 9.091 11.707 3.845 180 1HD1 ILE 937 1HD1 ILE 937 7.395 7.682 5.031 181 2HD1 ILE 937 2HD1 ILE 937 5.732 7.510 4.422 182 3HD1 ILE 937 3HD1 ILE 937 7.064 7.845 3.290 183 H GLU 938 H GLU 938 8.807 10.949 1.286 184 HA GLU 938 HA GLU 938 10.319 13.047 1.518 185 1HB GLU 938 1HB GLU 938 10.066 11.045 -0.373 186 2HB GLU 938 2HB GLU 938 9.829 12.476 -1.356 187 1HG GLU 938 1HG GLU 938 12.081 12.738 -1.387 188 2HG GLU 938 2HG GLU 938 11.998 13.158 0.312 189 H MET 939 H MET 939 7.333 13.016 -0.528 190 HA MET 939 HA MET 939 7.499 15.416 -1.694 191 1HB MET 939 1HB MET 939 5.579 14.074 -2.173 192 2HB MET 939 2HB MET 939 5.199 13.842 -0.478 193 1HG MET 939 1HG MET 939 4.516 16.232 -0.285 194 2HG MET 939 2HG MET 939 4.940 16.503 -1.964 195 1HE MET 939 1HE MET 939 4.174 14.726 -3.759 196 2HE MET 939 2HE MET 939 3.780 13.239 -2.864 197 3HE MET 939 3HE MET 939 2.523 14.063 -3.817 198 H SER 940 H SER 940 5.674 14.948 1.425 199 HA SER 940 HA SER 940 5.175 17.457 2.052 200 1HB SER 940 1HB SER 940 6.292 15.414 4.025 201 2HB SER 940 2HB SER 940 5.309 16.804 4.443 202 HG SER 940 HG SER 940 3.540 15.719 3.919 203 H SER 941 H SER 941 8.366 15.825 2.321 204 HA SER 941 HA SER 941 9.652 17.767 3.783 205 1HB SER 941 1HB SER 941 10.418 15.385 3.025 206 2HB SER 941 2HB SER 941 11.002 16.179 1.575 207 HG SER 941 HG SER 941 12.650 15.998 3.241 208 H LYS 942 H LYS 942 9.752 17.233 0.176 209 HA LYS 942 HA LYS 942 10.692 19.964 -0.138 210 1HB LYS 942 1HB LYS 942 11.369 19.340 -2.298 211 2HB LYS 942 2HB LYS 942 11.746 17.957 -1.291 212 1HG LYS 942 1HG LYS 942 10.410 16.628 -2.550 213 2HG LYS 942 2HG LYS 942 9.028 17.654 -2.219 214 1HD LYS 942 1HD LYS 942 10.370 19.196 -4.069 215 2HD LYS 942 2HD LYS 942 10.813 17.589 -4.610 216 1HE LYS 942 1HE LYS 942 8.452 16.930 -4.786 217 2HE LYS 942 2HE LYS 942 7.931 18.436 -4.057 218 1HZ LYS 942 1HZ LYS 942 9.538 19.113 -6.177 219 2HZ LYS 942 2HZ LYS 942 8.560 17.928 -6.731 220 3HZ LYS 942 3HZ LYS 942 7.916 19.277 -6.074 221 H ILE 943 H ILE 943 7.951 19.382 0.863 222 HA ILE 943 HA ILE 943 6.316 20.129 -1.426 223 HB ILE 943 HB ILE 943 5.902 18.428 0.671 224 1HG1 ILE 943 1HG1 ILE 943 4.756 18.507 -1.535 225 2HG1 ILE 943 2HG1 ILE 943 3.679 18.193 -0.189 226 1HG2 ILE 943 1HG2 ILE 943 4.526 21.046 1.314 227 2HG2 ILE 943 2HG2 ILE 943 4.028 19.470 1.974 228 3HG2 ILE 943 3HG2 ILE 943 5.647 20.116 2.337 229 1HD1 ILE 943 1HD1 ILE 943 4.025 21.079 -0.820 230 2HD1 ILE 943 2HD1 ILE 943 3.243 20.121 -2.100 231 3HD1 ILE 943 3HD1 ILE 943 2.542 20.161 -0.465 232 H GLN 944 H GLN 944 7.112 21.287 1.921 233 HA GLN 944 HA GLN 944 5.725 23.561 1.963 234 1HB GLN 944 1HB GLN 944 8.115 22.530 3.252 235 2HB GLN 944 2HB GLN 944 8.294 24.254 2.994 236 1HG GLN 944 1HG GLN 944 5.728 24.230 3.904 237 2HG GLN 944 2HG GLN 944 6.309 22.781 4.700 238 1HE2 GLN 944 1HE2 GLN 944 6.061 23.811 6.700 239 2HE2 GLN 944 2HE2 GLN 944 7.208 24.961 7.302 240 HA PRO 945 HA PRO 945 9.073 25.757 -0.581 241 1HB PRO 945 1HB PRO 945 11.055 24.308 -1.781 242 2HB PRO 945 2HB PRO 945 11.252 25.101 -0.231 243 1HG PRO 945 1HG PRO 945 10.877 22.226 -0.806 244 2HG PRO 945 2HG PRO 945 11.490 22.983 0.651 245 1HD PRO 945 1HD PRO 945 8.872 21.877 0.263 246 2HD PRO 945 2HD PRO 945 9.448 22.736 1.677 247 H ALA 946 H ALA 946 8.696 22.541 -1.993 248 HA ALA 946 HA ALA 946 8.584 22.988 -4.572 249 1HB ALA 946 1HB ALA 946 6.909 21.359 -2.715 250 2HB ALA 946 2HB ALA 946 6.323 21.515 -4.389 251 3HB ALA 946 3HB ALA 946 7.942 20.847 -4.071 252 HA PRO 947 HA PRO 947 5.779 26.283 -5.124 253 1HB PRO 947 1HB PRO 947 6.105 26.588 -7.820 254 2HB PRO 947 2HB PRO 947 7.169 27.322 -6.637 255 1HG PRO 947 1HG PRO 947 7.660 24.977 -8.370 256 2HG PRO 947 2HG PRO 947 8.821 25.971 -7.512 257 1HD PRO 947 1HD PRO 947 7.915 23.355 -6.761 258 2HD PRO 947 2HD PRO 947 8.986 24.396 -5.845 259 HA PRO 948 HA PRO 948 2.111 24.752 -6.632 260 1HB PRO 948 1HB PRO 948 0.925 26.778 -8.031 261 2HB PRO 948 2HB PRO 948 0.927 26.695 -6.281 262 1HG PRO 948 1HG PRO 948 2.526 28.437 -8.055 263 2HG PRO 948 2HG PRO 948 2.195 28.621 -6.344 264 1HD PRO 948 1HD PRO 948 4.635 27.690 -7.530 265 2HD PRO 948 2HD PRO 948 4.263 27.765 -5.819 266 H GLU 949 H GLU 949 4.436 25.692 -8.879 267 HA GLU 949 HA GLU 949 2.933 24.554 -11.055 268 1HB GLU 949 1HB GLU 949 4.878 26.561 -10.866 269 2HB GLU 949 2HB GLU 949 5.753 25.224 -11.586 270 1HG GLU 949 1HG GLU 949 3.574 25.034 -13.126 271 2HG GLU 949 2HG GLU 949 3.341 26.704 -12.650 272 H GLU 950 H GLU 950 5.271 23.634 -8.637 273 HA GLU 950 HA GLU 950 5.958 21.280 -10.206 274 1HB GLU 950 1HB GLU 950 7.564 23.023 -8.703 275 2HB GLU 950 2HB GLU 950 7.398 21.623 -7.662 276 1HG GLU 950 1HG GLU 950 8.604 20.257 -9.069 277 2HG GLU 950 2HG GLU 950 7.913 20.960 -10.518 278 H TYR 951 H TYR 951 3.775 22.362 -7.888 279 HA TYR 951 HA TYR 951 3.803 19.909 -6.324 280 1HB TYR 951 1HB TYR 951 3.490 22.234 -5.336 281 2HB TYR 951 2HB TYR 951 2.094 22.475 -6.367 282 HD1 TYR 951 HD1 TYR 951 2.990 19.412 -4.422 283 HD2 TYR 951 HD2 TYR 951 0.339 22.747 -4.822 284 HE1 TYR 951 HE1 TYR 951 1.485 18.442 -2.617 285 HE2 TYR 951 HE2 TYR 951 -1.157 21.765 -3.016 286 HH TYR 951 HH TYR 951 -1.129 20.282 -1.269 287 H VAL 952 H VAL 952 1.777 21.703 -8.706 288 HA VAL 952 HA VAL 952 -0.504 20.201 -8.584 289 HB VAL 952 HB VAL 952 0.825 21.994 -10.444 290 1HG1 VAL 952 1HG1 VAL 952 0.797 20.342 -12.111 291 2HG1 VAL 952 2HG1 VAL 952 -0.762 19.680 -11.563 292 3HG1 VAL 952 3HG1 VAL 952 -0.705 21.256 -12.388 293 1HG2 VAL 952 1HG2 VAL 952 -1.378 22.089 -8.896 294 2HG2 VAL 952 2HG2 VAL 952 -1.151 23.115 -10.332 295 3HG2 VAL 952 3HG2 VAL 952 -2.130 21.632 -10.443 296 HA PRO 953 HA PRO 953 1.624 17.089 -11.452 297 1HB PRO 953 1HB PRO 953 4.336 17.179 -11.773 298 2HB PRO 953 2HB PRO 953 3.213 17.906 -12.904 299 1HG PRO 953 1HG PRO 953 4.925 19.224 -10.886 300 2HG PRO 953 2HG PRO 953 4.135 19.927 -12.284 301 1HD PRO 953 1HD PRO 953 3.301 20.151 -9.549 302 2HD PRO 953 2HD PRO 953 2.450 20.755 -10.956 303 H MET 954 H MET 954 3.955 17.967 -8.948 304 HA MET 954 HA MET 954 4.928 15.671 -8.211 305 1HB MET 954 1HB MET 954 4.377 18.156 -6.951 306 2HB MET 954 2HB MET 954 3.727 16.968 -5.839 307 1HG MET 954 1HG MET 954 6.163 15.816 -6.510 308 2HG MET 954 2HG MET 954 6.558 17.522 -6.568 309 1HE MET 954 1HE MET 954 6.094 19.089 -3.588 310 2HE MET 954 2HE MET 954 5.083 18.981 -5.049 311 3HE MET 954 3HE MET 954 4.424 18.485 -3.472 312 H VAL 955 H VAL 955 1.621 16.746 -7.143 313 HA VAL 955 HA VAL 955 1.041 14.316 -5.845 314 HB VAL 955 HB VAL 955 -0.447 16.749 -6.723 315 1HG1 VAL 955 1HG1 VAL 955 -1.655 14.071 -6.353 316 2HG1 VAL 955 2HG1 VAL 955 -2.426 15.389 -5.438 317 3HG1 VAL 955 3HG1 VAL 955 -2.272 15.506 -7.208 318 1HG2 VAL 955 1HG2 VAL 955 0.194 17.239 -4.626 319 2HG2 VAL 955 2HG2 VAL 955 -1.121 16.155 -4.115 320 3HG2 VAL 955 3HG2 VAL 955 0.544 15.538 -4.236 321 H LYS 956 H LYS 956 0.032 15.674 -9.062 322 HA LYS 956 HA LYS 956 -1.514 13.696 -9.987 323 1HB LYS 956 1HB LYS 956 0.071 15.804 -11.103 324 2HB LYS 956 2HB LYS 956 0.261 14.386 -12.114 325 1HG LYS 956 1HG LYS 956 -1.816 14.674 -12.971 326 2HG LYS 956 2HG LYS 956 -2.522 14.563 -11.371 327 1HD LYS 956 1HD LYS 956 -3.100 16.749 -11.596 328 2HD LYS 956 2HD LYS 956 -1.404 17.130 -11.374 329 1HE LYS 956 1HE LYS 956 -1.389 17.995 -13.472 330 2HE LYS 956 2HE LYS 956 -1.593 16.368 -14.092 331 1HZ LYS 956 1HZ LYS 956 -3.968 17.717 -13.143 332 2HZ LYS 956 2HZ LYS 956 -3.326 18.250 -14.546 333 3HZ LYS 956 3HZ LYS 956 -3.787 16.690 -14.400 334 H GLU 957 H GLU 957 1.969 13.538 -9.344 335 HA GLU 957 HA GLU 957 2.360 11.172 -10.824 336 1HB GLU 957 1HB GLU 957 4.018 13.048 -9.718 337 2HB GLU 957 2HB GLU 957 4.175 11.771 -8.529 338 1HG GLU 957 1HG GLU 957 4.337 10.974 -11.427 339 2HG GLU 957 2HG GLU 957 5.695 11.862 -10.766 340 H VAL 958 H VAL 958 1.999 11.903 -7.283 341 HA VAL 958 HA VAL 958 2.202 9.323 -6.353 342 HB VAL 958 HB VAL 958 1.863 11.751 -5.268 343 1HG1 VAL 958 1HG1 VAL 958 -0.289 11.776 -4.016 344 2HG1 VAL 958 2HG1 VAL 958 -0.499 11.946 -5.775 345 3HG1 VAL 958 3HG1 VAL 958 -0.835 10.387 -4.985 346 1HG2 VAL 958 1HG2 VAL 958 2.464 9.268 -4.355 347 2HG2 VAL 958 2HG2 VAL 958 2.296 10.699 -3.309 348 3HG2 VAL 958 3HG2 VAL 958 0.936 9.565 -3.490 349 H GLY 959 H GLY 959 -0.581 11.056 -7.817 350 1HA GLY 959 1HA GLY 959 -2.567 9.173 -7.209 351 2HA GLY 959 2HA GLY 959 -2.585 10.329 -8.526 352 H LEU 960 H LEU 960 -0.243 9.461 -9.967 353 HA LEU 960 HA LEU 960 -1.382 7.389 -11.476 354 1HB LEU 960 1HB LEU 960 0.700 9.260 -11.712 355 2HB LEU 960 2HB LEU 960 1.459 7.690 -11.887 356 HG LEU 960 HG LEU 960 -1.027 8.280 -13.459 357 1HD1 LEU 960 1HD1 LEU 960 0.009 9.544 -15.085 358 2HD1 LEU 960 2HD1 LEU 960 0.739 10.199 -13.601 359 3HD1 LEU 960 3HD1 LEU 960 1.644 9.036 -14.599 360 1HD2 LEU 960 1HD2 LEU 960 -0.547 6.284 -14.296 361 2HD2 LEU 960 2HD2 LEU 960 0.961 6.950 -14.966 362 3HD2 LEU 960 3HD2 LEU 960 0.958 6.208 -13.348 363 H ALA 961 H ALA 961 1.035 7.487 -8.836 364 HA ALA 961 HA ALA 961 1.980 4.881 -9.122 365 1HB ALA 961 1HB ALA 961 2.292 5.289 -6.500 366 2HB ALA 961 2HB ALA 961 3.267 6.169 -7.701 367 3HB ALA 961 3HB ALA 961 1.855 6.954 -6.955 368 H LEU 962 H LEU 962 -0.731 6.237 -7.127 369 HA LEU 962 HA LEU 962 -1.494 3.871 -5.936 370 1HB LEU 962 1HB LEU 962 -3.160 6.248 -6.773 371 2HB LEU 962 2HB LEU 962 -3.706 4.975 -5.699 372 HG LEU 962 HG LEU 962 -1.173 6.203 -4.852 373 1HD1 LEU 962 1HD1 LEU 962 -3.275 7.948 -5.762 374 2HD1 LEU 962 2HD1 LEU 962 -3.064 8.109 -4.002 375 3HD1 LEU 962 3HD1 LEU 962 -1.676 8.350 -5.090 376 1HD2 LEU 962 1HD2 LEU 962 -2.811 4.599 -3.620 377 2HD2 LEU 962 2HD2 LEU 962 -2.027 5.921 -2.723 378 3HD2 LEU 962 3HD2 LEU 962 -3.717 6.088 -3.259 379 H ARG 963 H ARG 963 -2.512 5.297 -9.103 380 HA ARG 963 HA ARG 963 -4.398 3.487 -9.759 381 1HB ARG 963 1HB ARG 963 -3.422 5.591 -11.039 382 2HB ARG 963 2HB ARG 963 -2.380 4.425 -11.831 383 1HG ARG 963 1HG ARG 963 -4.210 4.468 -13.295 384 2HG ARG 963 2HG ARG 963 -4.614 3.093 -12.286 385 1HD ARG 963 1HD ARG 963 -6.189 4.377 -10.980 386 2HD ARG 963 2HD ARG 963 -5.587 5.900 -11.606 387 HE ARG 963 HE ARG 963 -6.496 4.294 -13.803 388 1HH1 ARG 963 2HH2 ARG 963 -7.756 6.112 -11.067 389 2HH1 ARG 963 1HH2 ARG 963 -9.277 6.446 -11.825 390 1HH2 ARG 963 2HH1 ARG 963 -8.502 4.734 -14.805 391 2HH2 ARG 963 1HH1 ARG 963 -9.704 5.657 -13.966 392 H THR 964 H THR 964 -0.837 3.315 -10.501 393 HA THR 964 HA THR 964 -0.940 0.781 -11.705 394 HB THR 964 HB THR 964 1.166 2.605 -10.509 395 HG1 THR 964 HG1 THR 964 1.765 2.381 -12.828 396 1HG2 THR 964 1HG2 THR 964 2.885 0.977 -11.406 397 2HG2 THR 964 2HG2 THR 964 2.041 0.358 -9.966 398 3HG2 THR 964 3HG2 THR 964 1.591 -0.232 -11.584 399 H LEU 965 H LEU 965 -0.357 1.804 -8.298 400 HA LEU 965 HA LEU 965 0.417 -0.533 -7.201 401 1HB LEU 965 1HB LEU 965 0.330 1.312 -5.812 402 2HB LEU 965 2HB LEU 965 -1.325 1.700 -6.239 403 HG LEU 965 HG LEU 965 -1.802 -0.641 -5.048 404 1HD1 LEU 965 1HD1 LEU 965 0.960 0.012 -4.300 405 2HD1 LEU 965 2HD1 LEU 965 -0.115 -0.289 -2.914 406 3HD1 LEU 965 3HD1 LEU 965 0.064 -1.522 -4.185 407 1HD2 LEU 965 1HD2 LEU 965 -2.205 2.020 -4.450 408 2HD2 LEU 965 2HD2 LEU 965 -2.877 0.631 -3.563 409 3HD2 LEU 965 3HD2 LEU 965 -1.376 1.404 -3.000 410 H LEU 966 H LEU 966 -2.970 0.432 -8.028 411 HA LEU 966 HA LEU 966 -4.205 -1.834 -7.026 412 1HB LEU 966 1HB LEU 966 -4.879 0.131 -9.194 413 2HB LEU 966 2HB LEU 966 -5.918 -1.244 -8.877 414 HG LEU 966 HG LEU 966 -5.810 -0.356 -6.385 415 1HD1 LEU 966 1HD1 LEU 966 -5.900 2.241 -6.582 416 2HD1 LEU 966 2HD1 LEU 966 -4.329 1.415 -6.442 417 3HD1 LEU 966 3HD1 LEU 966 -4.896 1.984 -8.030 418 1HD2 LEU 966 1HD2 LEU 966 -7.910 -0.538 -7.340 419 2HD2 LEU 966 2HD2 LEU 966 -7.782 1.210 -7.032 420 3HD2 LEU 966 3HD2 LEU 966 -7.521 0.574 -8.674 421 H ALA 967 H ALA 967 -3.135 -1.162 -10.437 422 HA ALA 967 HA ALA 967 -3.754 -3.609 -11.492 423 1HB ALA 967 1HB ALA 967 -2.553 -1.289 -12.348 424 2HB ALA 967 2HB ALA 967 -1.196 -2.438 -12.414 425 3HB ALA 967 3HB ALA 967 -2.691 -2.776 -13.317 426 H THR 968 H THR 968 -0.484 -2.600 -10.246 427 HA THR 968 HA THR 968 0.713 -5.066 -10.397 428 HB THR 968 HB THR 968 2.301 -4.087 -8.770 429 HG1 THR 968 HG1 THR 968 0.161 -2.100 -8.487 430 1HG2 THR 968 1HG2 THR 968 1.620 -2.827 -11.150 431 2HG2 THR 968 2HG2 THR 968 1.359 -1.525 -9.964 432 3HG2 THR 968 3HG2 THR 968 2.952 -2.309 -10.089 433 H VAL 969 H VAL 969 -1.331 -3.739 -7.740 434 HA VAL 969 HA VAL 969 -0.932 -5.860 -5.984 435 HB VAL 969 HB VAL 969 -3.154 -3.869 -6.404 436 1HG1 VAL 969 1HG1 VAL 969 -3.930 -4.576 -4.089 437 2HG1 VAL 969 2HG1 VAL 969 -4.292 -5.708 -5.415 438 3HG1 VAL 969 3HG1 VAL 969 -2.942 -6.041 -4.302 439 1HG2 VAL 969 1HG2 VAL 969 -1.436 -4.000 -3.959 440 2HG2 VAL 969 2HG2 VAL 969 -0.702 -3.408 -5.469 441 3HG2 VAL 969 3HG2 VAL 969 -2.135 -2.593 -4.797 442 H ASP 970 H ASP 970 -3.141 -5.417 -8.774 443 HA ASP 970 HA ASP 970 -4.894 -7.404 -8.352 444 1HB ASP 970 1HB ASP 970 -4.443 -5.750 -10.399 445 2HB ASP 970 2HB ASP 970 -3.611 -7.134 -11.080 446 H GLU 971 H GLU 971 -1.503 -7.574 -9.574 447 HA GLU 971 HA GLU 971 -1.641 -10.320 -10.190 448 1HB GLU 971 1HB GLU 971 0.053 -8.319 -10.886 449 2HB GLU 971 2HB GLU 971 1.000 -9.030 -9.593 450 1HG GLU 971 1HG GLU 971 1.204 -11.112 -10.695 451 2HG GLU 971 2HG GLU 971 -0.222 -10.849 -11.680 452 H SER 972 H SER 972 -1.196 -8.460 -7.264 453 HA SER 972 HA SER 972 0.146 -10.607 -5.919 454 1HB SER 972 1HB SER 972 0.085 -7.860 -5.570 455 2HB SER 972 2HB SER 972 -0.992 -8.395 -4.295 456 HG SER 972 HG SER 972 0.704 -9.833 -3.538 457 H LEU 973 H LEU 973 -3.079 -9.660 -6.709 458 HA LEU 973 HA LEU 973 -4.509 -10.354 -4.459 459 1HB LEU 973 1HB LEU 973 -5.013 -9.652 -7.126 460 2HB LEU 973 2HB LEU 973 -5.821 -11.190 -6.897 461 HG LEU 973 HG LEU 973 -6.445 -8.525 -5.784 462 1HD1 LEU 973 1HD1 LEU 973 -7.928 -10.961 -6.720 463 2HD1 LEU 973 2HD1 LEU 973 -8.757 -9.736 -5.730 464 3HD1 LEU 973 3HD1 LEU 973 -8.026 -9.277 -7.287 465 1HD2 LEU 973 1HD2 LEU 973 -7.688 -9.800 -3.847 466 2HD2 LEU 973 2HD2 LEU 973 -6.357 -10.963 -4.050 467 3HD2 LEU 973 3HD2 LEU 973 -6.001 -9.264 -3.659 468 HA PRO 974 HA PRO 974 -4.355 -14.817 -5.997 469 1HB PRO 974 1HB PRO 974 -2.717 -15.510 -8.071 470 2HB PRO 974 2HB PRO 974 -4.419 -15.148 -8.274 471 1HG PRO 974 1HG PRO 974 -2.076 -13.483 -8.964 472 2HG PRO 974 2HG PRO 974 -3.728 -13.341 -9.530 473 1HD PRO 974 1HD PRO 974 -2.442 -11.701 -7.560 474 2HD PRO 974 2HD PRO 974 -4.126 -11.634 -8.042 475 H VAL 975 H VAL 975 -1.314 -13.124 -6.225 476 HA VAL 975 HA VAL 975 0.393 -15.107 -5.464 477 HB VAL 975 HB VAL 975 0.329 -12.167 -4.780 478 1HG1 VAL 975 1HG1 VAL 975 2.056 -14.224 -3.725 479 2HG1 VAL 975 2HG1 VAL 975 2.995 -13.105 -4.741 480 3HG1 VAL 975 3HG1 VAL 975 2.036 -12.479 -3.378 481 1HG2 VAL 975 1HG2 VAL 975 1.537 -11.794 -6.707 482 2HG2 VAL 975 2HG2 VAL 975 2.214 -13.440 -6.736 483 3HG2 VAL 975 3HG2 VAL 975 0.523 -13.164 -7.219 484 H LEU 976 H LEU 976 -2.092 -13.438 -3.566 485 HA LEU 976 HA LEU 976 -1.145 -14.885 -1.193 486 1HB LEU 976 1HB LEU 976 -2.577 -12.280 -1.573 487 2HB LEU 976 2HB LEU 976 -2.784 -13.180 -0.083 488 HG LEU 976 HG LEU 976 -0.947 -11.307 -0.323 489 1HD1 LEU 976 1HD1 LEU 976 -1.401 -12.611 1.699 490 2HD1 LEU 976 2HD1 LEU 976 -0.402 -13.944 1.070 491 3HD1 LEU 976 3HD1 LEU 976 0.346 -12.374 1.452 492 1HD2 LEU 976 1HD2 LEU 976 0.071 -12.492 -2.323 493 2HD2 LEU 976 2HD2 LEU 976 1.195 -12.002 -1.033 494 3HD2 LEU 976 3HD2 LEU 976 0.687 -13.703 -1.172 495 HA PRO 977 HA PRO 977 -4.782 -17.207 -1.204 496 1HB PRO 977 1HB PRO 977 -5.405 -17.493 1.441 497 2HB PRO 977 2HB PRO 977 -4.150 -18.422 0.646 498 1HG PRO 977 1HG PRO 977 -3.870 -16.147 2.513 499 2HG PRO 977 2HG PRO 977 -2.673 -17.341 2.050 500 1HD PRO 977 1HD PRO 977 -2.843 -14.632 1.123 501 2HD PRO 977 2HD PRO 977 -1.719 -15.858 0.575 502 H ALA 978 H ALA 978 -7.128 -17.452 -0.080 503 HA ALA 978 HA ALA 978 -8.347 -14.946 -0.828 504 1HB ALA 978 1HB ALA 978 -9.160 -17.782 -0.416 505 2HB ALA 978 2HB ALA 978 -10.397 -16.554 -0.054 506 3HB ALA 978 3HB ALA 978 -9.654 -16.619 -1.671 507 H SER 979 H SER 979 -6.714 -14.518 1.378 508 HA SER 979 HA SER 979 -8.736 -14.188 3.451 509 1HB SER 979 1HB SER 979 -6.493 -15.827 3.670 510 2HB SER 979 2HB SER 979 -5.943 -14.340 4.418 511 HG SER 979 HG SER 979 -8.212 -15.967 5.149 512 H THR 980 H THR 980 -6.961 -12.678 1.135 513 HA THR 980 HA THR 980 -6.480 -10.305 2.817 514 HB THR 980 HB THR 980 -4.471 -9.987 1.690 515 HG1 THR 980 HG1 THR 980 -5.872 -11.387 -0.480 516 1HG2 THR 980 1HG2 THR 980 -4.663 -12.787 0.580 517 2HG2 THR 980 2HG2 THR 980 -3.308 -12.002 1.426 518 3HG2 THR 980 3HG2 THR 980 -4.707 -12.601 2.349 519 H HIS 981 H HIS 981 -8.006 -11.690 -0.060 520 HA HIS 981 HA HIS 981 -8.560 -9.498 -1.529 521 1HB HIS 981 1HB HIS 981 -10.526 -11.715 -0.894 522 2HB HIS 981 2HB HIS 981 -10.551 -10.670 -2.301 523 HD1 HIS 981 HD1 HIS 981 -10.471 -13.528 -3.017 524 HD2 HIS 981 HD2 HIS 981 -6.955 -11.415 -2.142 525 HE1 HIS 981 HE1 HIS 981 -8.565 -14.831 -4.102 526 H ARG 982 H ARG 982 -9.842 -10.371 1.665 527 HA ARG 982 HA ARG 982 -11.925 -8.453 1.516 528 1HB ARG 982 1HB ARG 982 -11.241 -10.646 3.196 529 2HB ARG 982 2HB ARG 982 -11.175 -9.242 4.243 530 1HG ARG 982 1HG ARG 982 -13.517 -8.956 2.599 531 2HG ARG 982 2HG ARG 982 -13.508 -10.603 3.197 532 1HD ARG 982 1HD ARG 982 -13.053 -9.622 5.541 533 2HD ARG 982 2HD ARG 982 -13.386 -8.044 4.856 534 HE ARG 982 HE ARG 982 -15.666 -8.567 4.824 535 1HH1 ARG 982 2HH2 ARG 982 -13.812 -11.542 5.133 536 2HH1 ARG 982 1HH2 ARG 982 -15.207 -12.536 5.389 537 1HH2 ARG 982 2HH1 ARG 982 -17.508 -9.878 5.162 538 2HH2 ARG 982 1HH1 ARG 982 -17.323 -11.583 5.405 539 H GLU 983 H GLU 983 -9.163 -8.787 3.874 540 HA GLU 983 HA GLU 983 -9.250 -6.243 4.801 541 1HB GLU 983 1HB GLU 983 -7.495 -8.499 4.987 542 2HB GLU 983 2HB GLU 983 -6.487 -7.101 4.670 543 1HG GLU 983 1HG GLU 983 -6.767 -6.351 6.791 544 2HG GLU 983 2HG GLU 983 -8.509 -6.353 6.607 545 H ILE 984 H ILE 984 -7.477 -7.536 1.935 546 HA ILE 984 HA ILE 984 -6.099 -5.179 1.342 547 HB ILE 984 HB ILE 984 -6.983 -7.489 -0.386 548 1HG1 ILE 984 1HG1 ILE 984 -4.473 -6.888 1.182 549 2HG1 ILE 984 2HG1 ILE 984 -5.531 -8.278 1.314 550 1HG2 ILE 984 1HG2 ILE 984 -4.657 -6.020 -1.324 551 2HG2 ILE 984 2HG2 ILE 984 -6.122 -6.530 -2.198 552 3HG2 ILE 984 3HG2 ILE 984 -6.117 -5.002 -1.285 553 1HD1 ILE 984 1HD1 ILE 984 -3.707 -9.104 0.055 554 2HD1 ILE 984 2HD1 ILE 984 -4.919 -8.728 -1.194 555 3HD1 ILE 984 3HD1 ILE 984 -3.569 -7.606 -0.898 556 H GLU 985 H GLU 985 -9.411 -6.315 0.624 557 HA GLU 985 HA GLU 985 -9.963 -4.405 -1.313 558 1HB GLU 985 1HB GLU 985 -11.445 -6.377 0.295 559 2HB GLU 985 2HB GLU 985 -12.401 -4.946 -0.035 560 1HG GLU 985 1HG GLU 985 -10.913 -5.806 -2.420 561 2HG GLU 985 2HG GLU 985 -11.921 -7.099 -1.801 562 H MET 986 H MET 986 -10.436 -4.437 2.275 563 HA MET 986 HA MET 986 -11.610 -1.865 2.263 564 1HB MET 986 1HB MET 986 -10.777 -3.956 4.237 565 2HB MET 986 2HB MET 986 -10.719 -2.321 4.864 566 1HG MET 986 1HG MET 986 -13.016 -2.061 4.794 567 2HG MET 986 2HG MET 986 -13.184 -2.975 3.309 568 1HE MET 986 1HE MET 986 -12.478 -6.348 4.037 569 2HE MET 986 2HE MET 986 -14.240 -6.116 3.949 570 3HE MET 986 3HE MET 986 -13.159 -5.116 2.949 571 H ALA 987 H ALA 987 -8.342 -3.110 2.219 572 HA ALA 987 HA ALA 987 -7.187 -0.757 3.410 573 1HB ALA 987 1HB ALA 987 -5.146 -2.151 2.183 574 2HB ALA 987 2HB ALA 987 -5.724 -2.432 3.843 575 3HB ALA 987 3HB ALA 987 -6.335 -3.436 2.506 576 H GLN 988 H GLN 988 -8.206 -1.906 0.245 577 HA GLN 988 HA GLN 988 -6.517 -0.070 -1.141 578 1HB GLN 988 1HB GLN 988 -8.610 -2.100 -1.903 579 2HB GLN 988 2HB GLN 988 -8.212 -0.852 -3.067 580 1HG GLN 988 1HG GLN 988 -5.724 -1.814 -2.006 581 2HG GLN 988 2HG GLN 988 -6.697 -3.226 -2.370 582 1HE2 GLN 988 1HE2 GLN 988 -8.061 -2.826 -4.505 583 2HE2 GLN 988 2HE2 GLN 988 -7.122 -2.359 -5.884 584 H LYS 989 H LYS 989 -10.029 -0.380 -0.322 585 HA LYS 989 HA LYS 989 -10.865 1.912 -1.662 586 1HB LYS 989 1HB LYS 989 -12.409 0.199 -0.922 587 2HB LYS 989 2HB LYS 989 -11.996 0.480 0.757 588 1HG LYS 989 1HG LYS 989 -12.715 3.029 -0.341 589 2HG LYS 989 2HG LYS 989 -13.923 1.888 -0.898 590 1HD LYS 989 1HD LYS 989 -13.185 1.570 1.968 591 2HD LYS 989 2HD LYS 989 -13.927 3.112 1.589 592 1HE LYS 989 1HE LYS 989 -15.979 2.171 1.165 593 2HE LYS 989 2HE LYS 989 -15.291 0.806 0.310 594 1HZ LYS 989 1HZ LYS 989 -14.558 0.562 2.956 595 2HZ LYS 989 2HZ LYS 989 -16.150 0.926 2.954 596 3HZ LYS 989 3HZ LYS 989 -15.608 -0.371 2.123 597 H LEU 990 H LEU 990 -9.403 1.403 1.569 598 HA LEU 990 HA LEU 990 -9.926 3.976 2.546 599 1HB LEU 990 1HB LEU 990 -8.938 1.662 3.554 600 2HB LEU 990 2HB LEU 990 -7.463 2.598 3.418 601 HG LEU 990 HG LEU 990 -9.953 3.452 4.922 602 1HD1 LEU 990 1HD1 LEU 990 -8.941 1.633 6.090 603 2HD1 LEU 990 2HD1 LEU 990 -7.314 2.325 5.885 604 3HD1 LEU 990 3HD1 LEU 990 -8.499 3.135 6.938 605 1HD2 LEU 990 1HD2 LEU 990 -7.405 4.847 4.248 606 2HD2 LEU 990 2HD2 LEU 990 -9.057 5.486 4.423 607 3HD2 LEU 990 3HD2 LEU 990 -8.094 5.099 5.870 608 H LEU 991 H LEU 991 -7.076 2.564 0.812 609 HA LEU 991 HA LEU 991 -5.521 4.853 0.850 610 1HB LEU 991 1HB LEU 991 -4.799 2.560 0.256 611 2HB LEU 991 2HB LEU 991 -5.650 2.704 -1.270 612 HG LEU 991 HG LEU 991 -4.172 4.689 -1.803 613 1HD1 LEU 991 1HD1 LEU 991 -2.227 3.715 0.244 614 2HD1 LEU 991 2HD1 LEU 991 -2.394 5.318 -0.513 615 3HD1 LEU 991 3HD1 LEU 991 -3.530 4.812 0.761 616 1HD2 LEU 991 1HD2 LEU 991 -3.133 1.880 -1.514 617 2HD2 LEU 991 2HD2 LEU 991 -3.662 2.749 -2.975 618 3HD2 LEU 991 3HD2 LEU 991 -2.117 3.171 -2.199 619 H ASN 992 H ASN 992 -7.416 3.645 -2.009 620 HA ASN 992 HA ASN 992 -7.218 5.740 -3.588 621 1HB ASN 992 1HB ASN 992 -8.576 3.695 -4.084 622 2HB ASN 992 2HB ASN 992 -9.820 4.240 -2.976 623 1HD2 ASN 992 1HD2 ASN 992 -11.506 5.023 -3.958 624 2HD2 ASN 992 2HD2 ASN 992 -11.540 5.982 -5.400 625 H SER 993 H SER 993 -9.609 5.357 -0.874 626 HA SER 993 HA SER 993 -11.001 7.660 -1.216 627 1HB SER 993 1HB SER 993 -10.451 5.786 1.001 628 2HB SER 993 2HB SER 993 -10.827 7.404 1.560 629 HG SER 993 HG SER 993 -12.777 6.232 1.347 630 H ASP 994 H ASP 994 -8.427 7.270 1.331 631 HA ASP 994 HA ASP 994 -8.137 9.901 1.869 632 1HB ASP 994 1HB ASP 994 -6.303 7.510 2.006 633 2HB ASP 994 2HB ASP 994 -5.599 9.087 2.300 634 H LEU 995 H LEU 995 -7.161 8.069 -0.960 635 HA LEU 995 HA LEU 995 -5.006 9.704 -1.779 636 1HB LEU 995 1HB LEU 995 -4.780 7.861 -2.974 637 2HB LEU 995 2HB LEU 995 -6.442 7.377 -2.700 638 HG LEU 995 HG LEU 995 -7.199 8.690 -4.597 639 1HD1 LEU 995 1HD1 LEU 995 -4.651 9.395 -5.773 640 2HD1 LEU 995 2HD1 LEU 995 -6.085 10.403 -5.466 641 3HD1 LEU 995 3HD1 LEU 995 -4.864 10.180 -4.190 642 1HD2 LEU 995 1HD2 LEU 995 -5.410 6.456 -4.755 643 2HD2 LEU 995 2HD2 LEU 995 -6.796 6.868 -5.793 644 3HD2 LEU 995 3HD2 LEU 995 -5.176 7.497 -6.180 645 H ALA 996 H ALA 996 -8.387 9.416 -3.096 646 HA ALA 996 HA ALA 996 -8.305 11.589 -4.740 647 1HB ALA 996 1HB ALA 996 -10.897 11.567 -3.684 648 2HB ALA 996 2HB ALA 996 -10.313 10.621 -5.074 649 3HB ALA 996 3HB ALA 996 -10.316 9.902 -3.446 650 H GLU 997 H GLU 997 -9.387 11.515 -1.269 651 HA GLU 997 HA GLU 997 -9.945 14.155 -1.025 652 1HB GLU 997 1HB GLU 997 -10.229 12.219 0.667 653 2HB GLU 997 2HB GLU 997 -8.580 12.542 1.163 654 1HG GLU 997 1HG GLU 997 -9.806 13.878 2.661 655 2HG GLU 997 2HG GLU 997 -9.370 15.035 1.419 656 H LEU 998 H LEU 998 -6.766 12.503 -0.966 657 HA LEU 998 HA LEU 998 -5.319 14.745 -0.040 658 1HB LEU 998 1HB LEU 998 -4.576 12.408 0.144 659 2HB LEU 998 2HB LEU 998 -4.411 12.321 -1.599 660 HG LEU 998 HG LEU 998 -2.896 14.424 -0.079 661 1HD1 LEU 998 1HD1 LEU 998 -1.344 13.040 0.793 662 2HD1 LEU 998 2HD1 LEU 998 -2.687 11.872 0.780 663 3HD1 LEU 998 3HD1 LEU 998 -1.485 11.861 -0.533 664 1HD2 LEU 998 1HD2 LEU 998 -1.554 13.024 -2.253 665 2HD2 LEU 998 2HD2 LEU 998 -3.100 13.744 -2.761 666 3HD2 LEU 998 3HD2 LEU 998 -1.847 14.763 -2.013 667 H ILE 999 H ILE 999 -6.105 13.420 -3.306 668 HA ILE 999 HA ILE 999 -4.562 15.174 -4.780 669 HB ILE 999 HB ILE 999 -7.189 13.827 -5.406 670 1HG1 ILE 999 1HG1 ILE 999 -5.370 12.289 -4.850 671 2HG1 ILE 999 2HG1 ILE 999 -5.816 12.171 -6.540 672 1HG2 ILE 999 1HG2 ILE 999 -7.288 15.143 -7.203 673 2HG2 ILE 999 2HG2 ILE 999 -5.646 15.776 -6.939 674 3HG2 ILE 999 3HG2 ILE 999 -5.878 14.239 -7.805 675 1HD1 ILE 999 1HD1 ILE 999 -3.465 12.237 -6.644 676 2HD1 ILE 999 2HD1 ILE 999 -3.900 13.939 -6.928 677 3HD1 ILE 999 3HD1 ILE 999 -3.343 13.420 -5.319 678 H ASN1000 H ASN1000 -8.016 15.493 -3.710 679 HA ASN1000 HA ASN1000 -8.415 17.958 -4.847 680 1HB ASN1000 1HB ASN1000 -10.084 16.309 -3.662 681 2HB ASN1000 2HB ASN1000 -9.633 17.123 -2.177 682 1HD2 ASN1000 1HD2 ASN1000 -12.212 17.118 -3.105 683 2HD2 ASN1000 2HD2 ASN1000 -12.693 18.709 -3.594 684 H LYS1001 H LYS1001 -7.008 16.923 -1.700 685 HA LYS1001 HA LYS1001 -6.990 19.381 -0.414 686 1HB LYS1001 1HB LYS1001 -6.128 16.768 0.102 687 2HB LYS1001 2HB LYS1001 -4.668 17.732 0.198 688 1HG LYS1001 1HG LYS1001 -5.351 18.234 2.317 689 2HG LYS1001 2HG LYS1001 -6.462 19.350 1.549 690 1HD LYS1001 1HD LYS1001 -7.585 16.659 1.492 691 2HD LYS1001 2HD LYS1001 -7.112 17.064 3.130 692 1HE LYS1001 1HE LYS1001 -8.761 18.954 1.393 693 2HE LYS1001 2HE LYS1001 -9.498 17.747 2.428 694 1HZ LYS1001 1HZ LYS1001 -9.052 18.955 4.213 695 2HZ LYS1001 2HZ LYS1001 -7.521 19.302 3.760 696 3HZ LYS1001 3HZ LYS1001 -8.763 20.203 3.200 697 H MET1002 H MET1002 -4.599 17.859 -2.657 698 HA MET1002 HA MET1002 -2.801 20.004 -2.436 699 1HB MET1002 1HB MET1002 -1.493 18.645 -3.794 700 2HB MET1002 2HB MET1002 -2.712 17.439 -3.430 701 1HG MET1002 1HG MET1002 -2.702 17.336 -5.767 702 2HG MET1002 2HG MET1002 -3.988 18.498 -5.511 703 1HE MET1002 1HE MET1002 -2.500 20.291 -8.511 704 2HE MET1002 2HE MET1002 -3.025 18.612 -8.234 705 3HE MET1002 3HE MET1002 -3.973 19.963 -7.568 706 H LYS1003 H LYS1003 -5.751 19.471 -4.250 707 HA LYS1003 HA LYS1003 -5.172 21.209 -6.404 708 1HB LYS1003 1HB LYS1003 -7.719 20.049 -5.263 709 2HB LYS1003 2HB LYS1003 -7.728 21.154 -6.623 710 1HG LYS1003 1HG LYS1003 -5.696 19.113 -7.054 711 2HG LYS1003 2HG LYS1003 -7.220 18.340 -6.663 712 1HD LYS1003 1HD LYS1003 -7.070 20.577 -8.721 713 2HD LYS1003 2HD LYS1003 -6.742 18.914 -9.165 714 1HE LYS1003 1HE LYS1003 -9.247 19.369 -7.583 715 2HE LYS1003 2HE LYS1003 -9.244 20.021 -9.209 716 1HZ LYS1003 1HZ LYS1003 -8.155 17.472 -9.297 717 2HZ LYS1003 2HZ LYS1003 -9.542 17.381 -8.439 718 3HZ LYS1003 3HZ LYS1003 -9.558 17.992 -9.953 719 H LEU1004 H LEU1004 -6.638 21.599 -3.145 720 HA LEU1004 HA LEU1004 -7.361 24.308 -3.605 721 1HB LEU1004 1HB LEU1004 -6.987 22.911 -0.959 722 2HB LEU1004 2HB LEU1004 -7.949 24.338 -1.293 723 HG LEU1004 HG LEU1004 -8.514 21.509 -2.215 724 1HD1 LEU1004 1HD1 LEU1004 -10.685 22.096 -0.871 725 2HD1 LEU1004 2HD1 LEU1004 -9.214 21.560 -0.024 726 3HD1 LEU1004 3HD1 LEU1004 -9.630 23.290 -0.078 727 1HD2 LEU1004 1HD2 LEU1004 -10.755 22.768 -2.902 728 2HD2 LEU1004 2HD2 LEU1004 -9.622 24.123 -3.121 729 3HD2 LEU1004 3HD2 LEU1004 -9.375 22.603 -4.014 730 H ALA1005 H ALA1005 -4.707 22.689 -1.725 731 HA ALA1005 HA ALA1005 -3.384 24.782 -0.741 732 1HB ALA1005 1HB ALA1005 -1.306 23.272 -1.738 733 2HB ALA1005 2HB ALA1005 -2.219 22.897 -0.257 734 3HB ALA1005 3HB ALA1005 -2.659 22.117 -1.795 735 H GLN1006 H GLN1006 -3.179 23.631 -4.173 736 HA GLN1006 HA GLN1006 -1.298 25.208 -5.154 737 1HB GLN1006 1HB GLN1006 -2.385 23.748 -6.665 738 2HB GLN1006 2HB GLN1006 -3.977 24.380 -6.293 739 1HG GLN1006 1HG GLN1006 -3.792 26.095 -7.804 740 2HG GLN1006 2HG GLN1006 -2.132 26.440 -7.360 741 1HE2 GLN1006 1HE2 GLN1006 -0.774 26.205 -8.947 742 2HE2 GLN1006 2HE2 GLN1006 -0.819 25.023 -10.212 743 H GLN1007 H GLN1007 -4.707 26.224 -4.485 744 HA GLN1007 HA GLN1007 -3.952 28.935 -5.150 745 1HB GLN1007 1HB GLN1007 -6.196 27.611 -5.787 746 2HB GLN1007 2HB GLN1007 -6.718 28.188 -4.217 747 1HG GLN1007 1HG GLN1007 -5.748 30.521 -5.110 748 2HG GLN1007 2HG GLN1007 -5.994 29.782 -6.679 749 1HE2 GLN1007 1HE2 GLN1007 -7.633 30.196 -3.547 750 2HE2 GLN1007 2HE2 GLN1007 -9.223 30.492 -4.166 751 H TYR1008 H TYR1008 -4.671 26.809 -2.413 752 HA TYR1008 HA TYR1008 -4.894 29.053 -0.585 753 1HB TYR1008 1HB TYR1008 -5.161 26.018 -0.624 754 2HB TYR1008 2HB TYR1008 -4.873 26.776 0.930 755 HD1 TYR1008 HD1 TYR1008 -7.302 26.181 -1.721 756 HD2 TYR1008 HD2 TYR1008 -6.549 28.360 1.883 757 HE1 TYR1008 HE1 TYR1008 -9.785 26.679 -1.495 758 HE2 TYR1008 HE2 TYR1008 -9.034 28.851 2.097 759 HH TYR1008 HH TYR1008 -11.080 28.804 -0.176 760 H VAL1009 H VAL1009 -2.363 28.767 -2.047 761 HA VAL1009 HA VAL1009 -0.636 28.185 0.257 762 HB VAL1009 HB VAL1009 -0.462 26.426 -1.426 763 1HG1 VAL1009 1HG1 VAL1009 0.122 26.771 -3.677 764 2HG1 VAL1009 2HG1 VAL1009 -1.108 28.015 -3.346 765 3HG1 VAL1009 3HG1 VAL1009 0.616 28.457 -3.387 766 1HG2 VAL1009 1HG2 VAL1009 2.082 27.963 -1.784 767 2HG2 VAL1009 2HG2 VAL1009 1.564 27.555 -0.131 768 3HG2 VAL1009 3HG2 VAL1009 1.826 26.263 -1.326 769 H MET1010 H MET1010 -0.852 29.892 -2.945 770 HA MET1010 HA MET1010 1.183 31.657 -2.459 771 1HB MET1010 1HB MET1010 -0.172 33.114 -4.153 772 2HB MET1010 2HB MET1010 0.283 31.508 -4.685 773 1HG MET1010 1HG MET1010 -1.908 31.044 -5.055 774 2HG MET1010 2HG MET1010 -2.203 31.174 -3.332 775 1HE MET1010 1HE MET1010 -4.180 33.823 -2.671 776 2HE MET1010 2HE MET1010 -5.011 32.786 -3.856 777 3HE MET1010 3HE MET1010 -3.865 32.071 -2.696 778 H THR1011 H THR1011 -2.296 31.815 -1.558 779 HA THR1011 HA THR1011 -2.485 34.447 -0.799 780 HB THR1011 HB THR1011 -4.495 33.224 -0.754 781 HG1 THR1011 HG1 THR1011 -3.514 32.910 1.987 782 1HG2 THR1011 1HG2 THR1011 -4.197 31.131 1.130 783 2HG2 THR1011 2HG2 THR1011 -4.355 30.942 -0.633 784 3HG2 THR1011 3HG2 THR1011 -2.741 31.029 0.112 785 H SER1012 H SER1012 -1.966 31.807 1.628 786 HA SER1012 HA SER1012 0.333 32.827 2.680 787 1HB SER1012 1HB SER1012 -0.810 34.866 3.297 788 2HB SER1012 2HB SER1012 -2.172 33.985 3.961 789 HG SER1012 HG SER1012 -0.562 33.055 5.539 790 H LEU1013 H LEU1013 -2.856 31.302 3.183 791 HA LEU1013 HA LEU1013 -2.085 29.820 5.475 792 1HB LEU1013 1HB LEU1013 -4.260 28.825 3.737 793 2HB LEU1013 2HB LEU1013 -4.205 29.046 5.474 794 HG LEU1013 HG LEU1013 -4.776 31.105 3.344 795 1HD1 LEU1013 1HD1 LEU1013 -6.890 30.716 3.878 796 2HD1 LEU1013 2HD1 LEU1013 -6.376 29.488 5.060 797 3HD1 LEU1013 3HD1 LEU1013 -6.560 31.186 5.563 798 1HD2 LEU1013 1HD2 LEU1013 -3.516 31.521 5.957 799 2HD2 LEU1013 2HD2 LEU1013 -3.660 32.612 4.558 800 3HD2 LEU1013 3HD2 LEU1013 -5.002 32.472 5.719 801 H GLN1014 H GLN1014 0.111 29.438 4.102 802 HA GLN1014 HA GLN1014 -0.166 27.165 2.380 803 1HB GLN1014 1HB GLN1014 1.477 28.780 1.708 804 2HB GLN1014 2HB GLN1014 2.188 28.848 3.308 805 1HG GLN1014 1HG GLN1014 2.854 26.406 3.049 806 2HG GLN1014 2HG GLN1014 2.267 26.465 1.399 807 1HE2 GLN1014 1HE2 GLN1014 3.863 26.584 0.030 808 2HE2 GLN1014 2HE2 GLN1014 5.294 27.552 0.159 809 H GLN1015 H GLN1015 2.081 27.785 5.172 810 HA GLN1015 HA GLN1015 2.699 25.254 5.727 811 1HB GLN1015 1HB GLN1015 2.740 26.141 8.233 812 2HB GLN1015 2HB GLN1015 3.851 26.781 7.038 813 1HG GLN1015 1HG GLN1015 2.642 28.798 6.788 814 2HG GLN1015 2HG GLN1015 1.147 28.098 7.375 815 1HE2 GLN1015 1HE2 GLN1015 0.693 29.439 9.004 816 2HE2 GLN1015 2HE2 GLN1015 1.660 29.671 10.422 817 H GLU1016 H GLU1016 -0.371 26.910 6.440 818 HA GLU1016 HA GLU1016 -1.310 25.031 8.276 819 1HB GLU1016 1HB GLU1016 -2.282 27.275 8.093 820 2HB GLU1016 2HB GLU1016 -2.784 26.970 6.442 821 1HG GLU1016 1HG GLU1016 -4.121 24.945 7.439 822 2HG GLU1016 2HG GLU1016 -3.868 25.718 8.991 823 H TYR1017 H TYR1017 -2.081 25.516 4.750 824 HA TYR1017 HA TYR1017 -3.562 23.122 4.562 825 1HB TYR1017 1HB TYR1017 -2.323 25.278 2.846 826 2HB TYR1017 2HB TYR1017 -2.633 23.768 2.012 827 HD1 TYR1017 HD1 TYR1017 -4.593 23.768 0.788 828 HD2 TYR1017 HD2 TYR1017 -4.495 25.886 4.504 829 HE1 TYR1017 HE1 TYR1017 -7.023 24.449 0.472 830 HE2 TYR1017 HE2 TYR1017 -6.925 26.560 4.176 831 HH TYR1017 HH TYR1017 -8.930 25.077 2.025 832 H LYS1018 H LYS1018 -0.180 23.720 4.833 833 HA LYS1018 HA LYS1018 0.715 21.621 3.144 834 1HB LYS1018 1HB LYS1018 1.855 23.754 4.604 835 2HB LYS1018 2HB LYS1018 2.565 22.294 5.262 836 1HG LYS1018 1HG LYS1018 3.997 22.633 3.463 837 2HG LYS1018 2HG LYS1018 2.801 21.614 2.688 838 1HD LYS1018 1HD LYS1018 1.748 24.229 2.451 839 2HD LYS1018 2HD LYS1018 3.465 24.425 2.160 840 1HE LYS1018 1HE LYS1018 3.407 22.663 0.417 841 2HE LYS1018 2HE LYS1018 1.714 22.354 0.750 842 1HZ LYS1018 1HZ LYS1018 2.763 24.947 -0.151 843 2HZ LYS1018 2HZ LYS1018 2.077 23.836 -1.132 844 3HZ LYS1018 3HZ LYS1018 1.190 24.552 0.038 845 H LYS1019 H LYS1019 0.074 21.968 6.686 846 HA LYS1019 HA LYS1019 0.898 19.367 7.330 847 1HB LYS1019 1HB LYS1019 -0.528 21.601 8.652 848 2HB LYS1019 2HB LYS1019 -0.885 20.008 9.289 849 1HG LYS1019 1HG LYS1019 1.020 20.784 10.525 850 2HG LYS1019 2HG LYS1019 1.643 19.591 9.402 851 1HD LYS1019 1HD LYS1019 1.570 22.378 8.340 852 2HD LYS1019 2HD LYS1019 2.658 22.141 9.693 853 1HE LYS1019 1HE LYS1019 2.662 20.263 7.293 854 2HE LYS1019 2HE LYS1019 3.612 21.735 7.310 855 1HZ LYS1019 1HZ LYS1019 4.704 19.648 8.136 856 2HZ LYS1019 2HZ LYS1019 4.856 20.963 9.092 857 3HZ LYS1019 3HZ LYS1019 3.795 19.786 9.486 858 H GLN1020 H GLN1020 -2.201 20.771 6.204 859 HA GLN1020 HA GLN1020 -3.867 18.717 6.788 860 1HB GLN1020 1HB GLN1020 -3.813 20.511 4.323 861 2HB GLN1020 2HB GLN1020 -5.169 19.483 4.743 862 1HG GLN1020 1HG GLN1020 -4.020 21.575 6.645 863 2HG GLN1020 2HG GLN1020 -5.337 21.912 5.539 864 1HE2 GLN1020 1HE2 GLN1020 -7.339 20.944 5.809 865 2HE2 GLN1020 2HE2 GLN1020 -7.837 20.196 7.290 866 H MET1021 H MET1021 -2.131 19.180 3.616 867 HA MET1021 HA MET1021 -2.850 16.767 2.554 868 1HB MET1021 1HB MET1021 -0.919 17.145 1.021 869 2HB MET1021 2HB MET1021 -1.752 18.657 1.320 870 1HG MET1021 1HG MET1021 -0.007 19.541 2.584 871 2HG MET1021 2HG MET1021 0.477 17.979 3.215 872 1HE MET1021 1HE MET1021 2.742 16.406 1.179 873 2HE MET1021 2HE MET1021 1.106 16.159 1.836 874 3HE MET1021 3HE MET1021 1.358 16.223 0.075 875 H LEU1022 H LEU1022 -0.490 17.511 5.057 876 HA LEU1022 HA LEU1022 1.084 15.178 4.722 877 1HB LEU1022 1HB LEU1022 1.475 17.483 5.970 878 2HB LEU1022 2HB LEU1022 0.841 16.589 7.338 879 HG LEU1022 HG LEU1022 2.918 15.114 5.885 880 1HD1 LEU1022 1HD1 LEU1022 4.806 16.474 6.550 881 2HD1 LEU1022 2HD1 LEU1022 3.731 17.412 5.485 882 3HD1 LEU1022 3HD1 LEU1022 3.719 17.702 7.241 883 1HD2 LEU1022 1HD2 LEU1022 1.788 15.019 8.363 884 2HD2 LEU1022 2HD2 LEU1022 3.338 14.265 7.919 885 3HD2 LEU1022 3HD2 LEU1022 3.317 15.861 8.707 886 H THR1023 H THR1023 -1.731 16.084 6.797 887 HA THR1023 HA THR1023 -1.870 13.861 8.380 888 HB THR1023 HB THR1023 -4.054 15.560 7.069 889 HG1 THR1023 HG1 THR1023 -3.301 16.886 8.671 890 1HG2 THR1023 1HG2 THR1023 -4.173 13.306 9.047 891 2HG2 THR1023 2HG2 THR1023 -5.047 14.788 9.502 892 3HG2 THR1023 3HG2 THR1023 -5.452 13.946 7.987 893 H ALA1024 H ALA1024 -3.106 14.223 5.006 894 HA ALA1024 HA ALA1024 -4.129 11.570 4.968 895 1HB ALA1024 1HB ALA1024 -5.095 13.298 3.566 896 2HB ALA1024 2HB ALA1024 -3.521 13.615 2.797 897 3HB ALA1024 3HB ALA1024 -4.355 12.068 2.513 898 H ALA1025 H ALA1025 -1.144 13.211 3.748 899 HA ALA1025 HA ALA1025 -0.063 11.009 2.453 900 1HB ALA1025 1HB ALA1025 1.249 12.766 1.924 901 2HB ALA1025 2HB ALA1025 0.771 13.659 3.387 902 3HB ALA1025 3HB ALA1025 2.091 12.468 3.464 903 H HIS1026 H HIS1026 -0.313 11.851 5.889 904 HA HIS1026 HA HIS1026 1.688 9.999 6.703 905 1HB HIS1026 1HB HIS1026 0.562 12.161 7.854 906 2HB HIS1026 2HB HIS1026 -0.413 10.913 8.603 907 HD1 HIS1026 HD1 HIS1026 2.225 12.832 9.600 908 HD2 HIS1026 HD2 HIS1026 1.826 8.666 9.310 909 HE1 HIS1026 HE1 HIS1026 3.967 11.835 11.176 910 H ALA1027 H ALA1027 -1.943 10.072 6.846 911 HA ALA1027 HA ALA1027 -2.172 7.462 7.843 912 1HB ALA1027 1HB ALA1027 -4.455 7.832 7.643 913 2HB ALA1027 2HB ALA1027 -3.851 9.506 7.648 914 3HB ALA1027 3HB ALA1027 -4.285 8.722 6.111 915 H LEU1028 H LEU1028 -1.876 8.838 4.552 916 HA LEU1028 HA LEU1028 -2.699 6.656 3.087 917 1HB LEU1028 1HB LEU1028 -0.846 8.948 2.640 918 2HB LEU1028 2HB LEU1028 -0.831 7.636 1.479 919 HG LEU1028 HG LEU1028 -3.116 9.476 2.189 920 1HD1 LEU1028 1HD1 LEU1028 -1.935 8.808 -0.514 921 2HD1 LEU1028 2HD1 LEU1028 -3.058 10.125 -0.098 922 3HD1 LEU1028 3HD1 LEU1028 -1.381 10.163 0.499 923 1HD2 LEU1028 1HD2 LEU1028 -3.215 6.768 0.895 924 2HD2 LEU1028 2HD2 LEU1028 -4.305 7.497 2.098 925 3HD2 LEU1028 3HD2 LEU1028 -4.358 8.042 0.404 926 H ALA1029 H ALA1029 0.738 7.498 3.941 927 HA ALA1029 HA ALA1029 1.981 5.294 3.057 928 1HB ALA1029 1HB ALA1029 2.362 7.169 5.345 929 2HB ALA1029 2HB ALA1029 3.316 5.667 5.383 930 3HB ALA1029 3HB ALA1029 3.453 6.774 3.996 931 H VAL1030 H VAL1030 0.072 5.597 6.105 932 HA VAL1030 HA VAL1030 0.653 2.951 6.945 933 HB VAL1030 HB VAL1030 -1.164 5.174 7.754 934 1HG1 VAL1030 1HG1 VAL1030 -1.705 2.292 8.210 935 2HG1 VAL1030 2HG1 VAL1030 -1.803 3.341 9.645 936 3HG1 VAL1030 3HG1 VAL1030 -2.811 3.687 8.219 937 1HG2 VAL1030 1HG2 VAL1030 0.677 3.452 9.434 938 2HG2 VAL1030 2HG2 VAL1030 1.241 4.877 8.527 939 3HG2 VAL1030 3HG2 VAL1030 0.021 5.064 9.810 940 H ASP1031 H ASP1031 -2.049 4.548 5.162 941 HA ASP1031 HA ASP1031 -3.777 2.456 5.114 942 1HB ASP1031 1HB ASP1031 -3.123 4.635 3.102 943 2HB ASP1031 2HB ASP1031 -4.363 3.452 2.740 944 H ALA1032 H ALA1032 -1.153 3.329 2.740 945 HA ALA1032 HA ALA1032 -1.531 1.128 1.060 946 1HB ALA1032 1HB ALA1032 0.588 1.789 0.106 947 2HB ALA1032 2HB ALA1032 -0.283 3.270 0.571 948 3HB ALA1032 3HB ALA1032 1.043 2.661 1.590 949 H LYS1033 H LYS1033 0.021 1.514 4.207 950 HA LYS1033 HA LYS1033 1.629 -0.825 3.988 951 1HB LYS1033 1HB LYS1033 0.908 1.123 6.148 952 2HB LYS1033 2HB LYS1033 1.590 -0.423 6.608 953 1HG LYS1033 1HG LYS1033 2.894 1.261 4.438 954 2HG LYS1033 2HG LYS1033 3.218 1.578 6.131 955 1HD LYS1033 1HD LYS1033 3.835 -0.905 6.370 956 2HD LYS1033 2HD LYS1033 3.732 -1.025 4.624 957 1HE LYS1033 1HE LYS1033 5.606 0.372 4.275 958 2HE LYS1033 2HE LYS1033 5.437 1.166 5.828 959 1HZ LYS1033 1HZ LYS1033 6.440 -1.534 5.305 960 2HZ LYS1033 2HZ LYS1033 7.211 -0.296 6.039 961 3HZ LYS1033 3HZ LYS1033 5.988 -1.063 6.802 962 H ASN1034 H ASN1034 -1.300 -0.068 6.012 963 HA ASN1034 HA ASN1034 -1.815 -2.454 6.996 964 1HB ASN1034 1HB ASN1034 -4.039 -0.856 5.642 965 2HB ASN1034 2HB ASN1034 -4.162 -1.824 7.098 966 1HD2 ASN1034 1HD2 ASN1034 -4.788 0.986 6.616 967 2HD2 ASN1034 2HD2 ASN1034 -3.871 1.923 7.748 968 H LEU1035 H LEU1035 -2.084 -1.437 3.599 969 HA LEU1035 HA LEU1035 -3.747 -3.494 2.679 970 1HB LEU1035 1HB LEU1035 -3.414 -1.498 1.412 971 2HB LEU1035 2HB LEU1035 -1.683 -1.758 1.330 972 HG LEU1035 HG LEU1035 -1.961 -3.648 -0.146 973 1HD1 LEU1035 1HD1 LEU1035 -3.837 -4.823 0.503 974 2HD1 LEU1035 2HD1 LEU1035 -4.866 -3.371 0.556 975 3HD1 LEU1035 3HD1 LEU1035 -4.388 -4.067 -1.011 976 1HD2 LEU1035 1HD2 LEU1035 -3.764 -2.102 -1.719 977 2HD2 LEU1035 2HD2 LEU1035 -2.751 -0.984 -0.776 978 3HD2 LEU1035 3HD2 LEU1035 -1.990 -2.204 -1.825 979 H LEU1036 H LEU1036 -0.167 -3.169 2.135 980 HA LEU1036 HA LEU1036 0.090 -5.904 1.519 981 1HB LEU1036 1HB LEU1036 1.600 -3.617 1.237 982 2HB LEU1036 2HB LEU1036 2.501 -4.521 2.438 983 HG LEU1036 HG LEU1036 1.953 -6.451 0.538 984 1HD1 LEU1036 1HD1 LEU1036 2.792 -4.014 -1.030 985 2HD1 LEU1036 2HD1 LEU1036 2.293 -5.614 -1.627 986 3HD1 LEU1036 3HD1 LEU1036 1.091 -4.522 -0.900 987 1HD2 LEU1036 1HD2 LEU1036 4.461 -5.384 -0.139 988 2HD2 LEU1036 2HD2 LEU1036 4.228 -5.018 1.587 989 3HD2 LEU1036 3HD2 LEU1036 4.107 -6.697 1.009 990 H ASP1037 H ASP1037 0.549 -3.956 4.509 991 HA ASP1037 HA ASP1037 1.841 -5.628 6.095 992 1HB ASP1037 1HB ASP1037 0.635 -3.377 6.612 993 2HB ASP1037 2HB ASP1037 -0.770 -4.350 7.000 994 H VAL1038 H VAL1038 -1.631 -5.812 5.105 995 HA VAL1038 HA VAL1038 -2.228 -8.035 6.768 996 HB VAL1038 HB VAL1038 -3.602 -6.785 4.385 997 1HG1 VAL1038 1HG1 VAL1038 -5.428 -8.257 6.010 998 2HG1 VAL1038 2HG1 VAL1038 -5.003 -8.516 4.301 999 3HG1 VAL1038 3HG1 VAL1038 -4.081 -9.339 5.583 1000 1HG2 VAL1038 1HG2 VAL1038 -4.685 -6.663 7.167 1001 2HG2 VAL1038 2HG2 VAL1038 -3.272 -5.651 6.781 1002 3HG2 VAL1038 3HG2 VAL1038 -4.776 -5.474 5.846 1003 H ILE1039 H ILE1039 -1.149 -7.556 3.376 1004 HA ILE1039 HA ILE1039 -1.572 -10.113 2.442 1005 HB ILE1039 HB ILE1039 0.220 -7.846 1.772 1006 1HG1 ILE1039 1HG1 ILE1039 -1.677 -9.526 0.106 1007 2HG1 ILE1039 2HG1 ILE1039 -2.128 -8.061 0.957 1008 1HG2 ILE1039 1HG2 ILE1039 1.352 -9.115 0.005 1009 2HG2 ILE1039 2HG2 ILE1039 1.773 -9.719 1.625 1010 3HG2 ILE1039 3HG2 ILE1039 0.618 -10.618 0.612 1011 1HD1 ILE1039 1HD1 ILE1039 0.006 -8.272 -1.217 1012 2HD1 ILE1039 2HD1 ILE1039 -1.610 -7.550 -1.397 1013 3HD1 ILE1039 3HD1 ILE1039 -0.407 -6.783 -0.333 1014 H ASP1040 H ASP1040 1.487 -8.770 3.882 1015 HA ASP1040 HA ASP1040 2.942 -11.013 3.873 1016 1HB ASP1040 1HB ASP1040 3.079 -8.501 5.103 1017 2HB ASP1040 2HB ASP1040 3.103 -9.597 6.470 1018 H GLN1041 H GLN1041 0.464 -9.957 6.298 1019 HA GLN1041 HA GLN1041 0.876 -12.150 7.997 1020 1HB GLN1041 1HB GLN1041 -0.629 -9.745 8.015 1021 2HB GLN1041 2HB GLN1041 -1.812 -11.027 8.178 1022 1HG GLN1041 1HG GLN1041 -0.287 -12.023 10.011 1023 2HG GLN1041 2HG GLN1041 0.619 -10.524 9.948 1024 1HE2 GLN1041 1HE2 GLN1041 -0.332 -8.582 10.570 1025 2HE2 GLN1041 2HE2 GLN1041 -1.751 -8.506 11.561 1026 H ALA1042 H ALA1042 -0.929 -11.642 5.021 1027 HA ALA1042 HA ALA1042 -2.704 -13.856 5.444 1028 1HB ALA1042 1HB ALA1042 -2.154 -11.807 3.334 1029 2HB ALA1042 2HB ALA1042 -2.916 -13.330 2.814 1030 3HB ALA1042 3HB ALA1042 -3.699 -12.320 4.054 1031 H ARG1043 H ARG1043 0.260 -13.151 3.484 1032 HA ARG1043 HA ARG1043 0.446 -15.415 2.091 1033 1HB ARG1043 1HB ARG1043 2.068 -13.454 2.098 1034 2HB ARG1043 2HB ARG1043 2.789 -14.102 3.558 1035 1HG ARG1043 1HG ARG1043 2.986 -16.335 2.096 1036 2HG ARG1043 2HG ARG1043 2.861 -15.220 0.749 1037 1HD ARG1043 1HD ARG1043 4.790 -14.464 2.926 1038 2HD ARG1043 2HD ARG1043 5.232 -15.844 1.940 1039 HE ARG1043 HE ARG1043 4.442 -13.935 0.078 1040 1HH1 ARG1043 2HH2 ARG1043 6.796 -14.009 2.693 1041 2HH1 ARG1043 1HH2 ARG1043 7.868 -12.881 1.931 1042 1HH2 ARG1043 2HH1 ARG1043 5.856 -12.447 -0.928 1043 2HH2 ARG1043 1HH1 ARG1043 7.329 -11.987 -0.142 1044 H LEU1044 H LEU1044 1.748 -14.890 5.451 1045 HA LEU1044 HA LEU1044 2.728 -17.448 5.829 1046 1HB LEU1044 1HB LEU1044 2.494 -16.902 8.254 1047 2HB LEU1044 2HB LEU1044 3.396 -15.747 7.292 1048 HG LEU1044 HG LEU1044 0.967 -14.585 7.171 1049 1HD1 LEU1044 1HD1 LEU1044 0.065 -16.478 8.629 1050 2HD1 LEU1044 2HD1 LEU1044 0.966 -15.723 9.966 1051 3HD1 LEU1044 3HD1 LEU1044 -0.312 -14.811 9.127 1052 1HD2 LEU1044 1HD2 LEU1044 1.788 -13.357 9.359 1053 2HD2 LEU1044 2HD2 LEU1044 3.257 -14.321 9.074 1054 3HD2 LEU1044 3HD2 LEU1044 2.670 -13.202 7.820 1055 H LYS1045 H LYS1045 -0.562 -16.082 6.411 1056 HA LYS1045 HA LYS1045 -1.750 -18.113 7.720 1057 1HB LYS1045 1HB LYS1045 -2.711 -15.891 6.897 1058 2HB LYS1045 2HB LYS1045 -3.056 -16.704 5.384 1059 1HG LYS1045 1HG LYS1045 -3.930 -18.101 7.899 1060 2HG LYS1045 2HG LYS1045 -4.810 -16.652 7.457 1061 1HD LYS1045 1HD LYS1045 -4.708 -17.911 5.018 1062 2HD LYS1045 2HD LYS1045 -4.704 -19.305 6.080 1063 1HE LYS1045 1HE LYS1045 -6.669 -17.385 7.038 1064 2HE LYS1045 2HE LYS1045 -6.940 -17.680 5.332 1065 1HZ LYS1045 1HZ LYS1045 -7.517 -19.354 7.462 1066 2HZ LYS1045 2HZ LYS1045 -7.800 -19.614 5.875 1067 3HZ LYS1045 3HZ LYS1045 -6.397 -20.111 6.546 1068 H MET1046 H MET1046 -0.626 -18.073 4.345 1069 HA MET1046 HA MET1046 -1.963 -20.549 3.798 1070 1HB MET1046 1HB MET1046 -1.815 -19.119 1.896 1071 2HB MET1046 2HB MET1046 -0.192 -18.592 2.295 1072 1HG MET1046 1HG MET1046 0.748 -20.762 1.630 1073 2HG MET1046 2HG MET1046 -0.853 -21.444 1.420 1074 1HE MET1046 1HE MET1046 -0.403 -17.718 0.521 1075 2HE MET1046 2HE MET1046 1.271 -18.305 0.384 1076 3HE MET1046 3HE MET1046 0.393 -17.775 -1.070 1077 H ILE1047 H ILE1047 1.432 -19.342 4.193 1078 HA ILE1047 HA ILE1047 2.768 -21.674 3.675 1079 HB ILE1047 HB ILE1047 3.297 -19.310 5.433 1080 1HG1 ILE1047 1HG1 ILE1047 5.240 -19.996 3.375 1081 2HG1 ILE1047 2HG1 ILE1047 3.623 -19.871 2.710 1082 1HG2 ILE1047 1HG2 ILE1047 4.437 -20.841 6.740 1083 2HG2 ILE1047 2HG2 ILE1047 4.857 -21.876 5.355 1084 3HG2 ILE1047 3HG2 ILE1047 5.689 -20.320 5.587 1085 1HD1 ILE1047 1HD1 ILE1047 3.363 -17.640 3.875 1086 2HD1 ILE1047 2HD1 ILE1047 5.065 -17.763 4.382 1087 3HD1 ILE1047 3HD1 ILE1047 4.656 -17.663 2.652 1088 H SER1048 H SER1048 2.043 -20.503 7.040 1089 HA SER1048 HA SER1048 2.407 -23.113 8.037 1090 1HB SER1048 1HB SER1048 2.779 -20.843 9.234 1091 2HB SER1048 2HB SER1048 1.045 -20.812 9.486 1092 HG SER1048 HG SER1048 2.994 -22.632 10.550 1093 H GLN1049 H GLN1049 0.768 -24.104 6.462 1094 HA GLN1049 HA GLN1049 -1.636 -24.527 7.888 1095 1HB GLN1049 1HB GLN1049 -1.651 -22.472 5.875 1096 2HB GLN1049 2HB GLN1049 -2.577 -23.824 5.255 1097 1HG GLN1049 1HG GLN1049 -3.145 -23.238 8.104 1098 2HG GLN1049 2HG GLN1049 -3.518 -21.897 7.040 1099 1HE2 GLN1049 1HE2 GLN1049 -5.717 -22.191 7.504 1100 2HE2 GLN1049 2HE2 GLN1049 -6.664 -23.431 6.753 1101 H SER1050 H SER1050 0.739 -25.989 6.871 1102 HA SER1050 HA SER1050 0.287 -27.338 4.557 1103 1HB SER1050 1HB SER1050 2.041 -27.530 6.795 1104 2HB SER1050 2HB SER1050 1.381 -29.137 6.567 1105 HG SER1050 HG SER1050 3.356 -28.666 5.306 1106 H ARG1051 H ARG1051 -0.573 -28.435 7.927 1107 HA ARG1051 HA ARG1051 -2.187 -30.505 6.831 1108 1HB ARG1051 1HB ARG1051 -0.801 -30.310 9.151 1109 2HB ARG1051 2HB ARG1051 -2.345 -29.730 9.743 1110 1HG ARG1051 1HG ARG1051 -3.352 -31.791 9.550 1111 2HG ARG1051 2HG ARG1051 -2.533 -32.169 8.048 1112 1HD ARG1051 1HD ARG1051 -0.413 -32.184 9.839 1113 2HD ARG1051 2HD ARG1051 -1.719 -32.774 10.847 1114 HE ARG1051 HE ARG1051 -1.863 -34.153 8.356 1115 1HH1 ARG1051 2HH2 ARG1051 0.258 -33.919 11.154 1116 2HH1 ARG1051 1HH2 ARG1051 0.870 -35.530 10.985 1117 1HH2 ARG1051 2HH1 ARG1051 -1.057 -36.279 8.132 1118 2HH2 ARG1051 1HH1 ARG1051 0.117 -36.882 9.254 1119 HA PRO1052 HA PRO1052 -5.746 -27.921 6.790 1120 1HB PRO1052 1HB PRO1052 -7.506 -29.730 5.742 1121 2HB PRO1052 2HB PRO1052 -6.436 -28.753 4.757 1122 1HG PRO1052 1HG PRO1052 -6.228 -31.623 5.433 1123 2HG PRO1052 2HG PRO1052 -5.440 -30.739 4.140 1124 1HD PRO1052 1HD PRO1052 -4.250 -31.601 6.604 1125 2HD PRO1052 2HD PRO1052 -3.497 -30.618 5.363 1126 H HIS1053 H HIS1053 -6.746 -31.222 7.563 1127 HA HIS1053 HA HIS1053 -8.577 -30.290 9.475 1128 1HB HIS1053 1HB HIS1053 -8.291 -32.579 8.103 1129 2HB HIS1053 2HB HIS1053 -7.540 -33.084 9.604 1130 HD1 HIS1053 HD1 HIS1053 -9.329 -34.563 10.594 1131 HD2 HIS1053 HD2 HIS1053 -10.816 -30.839 9.361 1132 HE1 HIS1053 HE1 HIS1053 -11.747 -34.455 11.402 Start of MODEL 23 1 H MET 915 H MET 915 12.080 -22.300 2.651 2 HA MET 915 HA MET 915 10.359 -21.015 4.373 3 1HB MET 915 1HB MET 915 12.717 -19.524 4.041 4 2HB MET 915 2HB MET 915 11.658 -18.814 2.839 5 1HG MET 915 1HG MET 915 10.369 -17.792 4.425 6 2HG MET 915 2HG MET 915 10.245 -19.253 5.385 7 1HE MET 915 1HE MET 915 11.715 -15.598 5.965 8 2HE MET 915 2HE MET 915 10.233 -16.533 6.278 9 3HE MET 915 3HE MET 915 11.421 -16.286 7.580 10 H ALA 916 H ALA 916 9.111 -19.112 2.897 11 HA ALA 916 HA ALA 916 8.208 -20.627 0.632 12 1HB ALA 916 1HB ALA 916 7.163 -17.904 0.931 13 2HB ALA 916 2HB ALA 916 6.307 -19.464 0.982 14 3HB ALA 916 3HB ALA 916 7.089 -18.830 2.450 15 H ASN 917 H ASN 917 8.142 -19.809 -1.578 16 HA ASN 917 HA ASN 917 10.570 -18.420 -2.171 17 1HB ASN 917 1HB ASN 917 8.680 -20.194 -3.570 18 2HB ASN 917 2HB ASN 917 9.099 -18.818 -4.570 19 1HD2 ASN 917 1HD2 ASN 917 11.067 -18.646 -5.462 20 2HD2 ASN 917 2HD2 ASN 917 12.347 -19.802 -5.302 21 H LEU 918 H LEU 918 10.670 -16.293 -3.073 22 HA LEU 918 HA LEU 918 8.080 -14.953 -3.424 23 1HB LEU 918 1HB LEU 918 10.499 -14.126 -1.873 24 2HB LEU 918 2HB LEU 918 9.524 -12.897 -2.651 25 HG LEU 918 HG LEU 918 7.544 -14.174 -1.405 26 1HD1 LEU 918 1HD1 LEU 918 9.578 -15.716 -0.500 27 2HD1 LEU 918 2HD1 LEU 918 9.492 -14.498 0.796 28 3HD1 LEU 918 3HD1 LEU 918 8.050 -15.454 0.376 29 1HD2 LEU 918 1HD2 LEU 918 7.796 -11.887 -1.036 30 2HD2 LEU 918 2HD2 LEU 918 8.007 -12.599 0.582 31 3HD2 LEU 918 3HD2 LEU 918 9.428 -12.074 -0.353 32 H ASP 919 H ASP 919 7.925 -14.973 -5.640 33 HA ASP 919 HA ASP 919 10.178 -14.706 -7.272 34 1HB ASP 919 1HB ASP 919 7.387 -15.240 -7.563 35 2HB ASP 919 2HB ASP 919 7.710 -13.843 -8.571 36 H ARG 920 H ARG 920 9.388 -12.795 -9.248 37 HA ARG 920 HA ARG 920 9.987 -10.393 -7.809 38 1HB ARG 920 1HB ARG 920 10.309 -9.422 -10.103 39 2HB ARG 920 2HB ARG 920 11.257 -10.876 -9.861 40 1HG ARG 920 1HG ARG 920 8.662 -11.669 -10.851 41 2HG ARG 920 2HG ARG 920 9.246 -10.366 -11.867 42 1HD ARG 920 1HD ARG 920 11.520 -11.709 -11.882 43 2HD ARG 920 2HD ARG 920 10.548 -13.057 -11.327 44 HE ARG 920 HE ARG 920 9.232 -11.870 -13.573 45 1HH1 ARG 920 2HH2 ARG 920 12.141 -13.755 -12.837 46 2HH1 ARG 920 1HH2 ARG 920 12.220 -14.479 -14.409 47 1HH2 ARG 920 1HH1 ARG 920 10.560 -13.918 -16.044 48 H SER 921 H SER 921 7.226 -11.847 -7.883 49 HA SER 921 HA SER 921 5.593 -9.978 -9.290 50 1HB SER 921 1HB SER 921 5.298 -12.610 -8.109 51 2HB SER 921 2HB SER 921 4.027 -11.570 -7.497 52 HG SER 921 HG SER 921 4.578 -11.483 -10.297 53 H ASN 922 H ASN 922 5.800 -11.068 -5.814 54 HA ASN 922 HA ASN 922 4.332 -8.865 -4.916 55 1HB ASN 922 1HB ASN 922 5.046 -9.644 -2.643 56 2HB ASN 922 2HB ASN 922 4.475 -10.977 -3.627 57 1HD2 ASN 922 1HD2 ASN 922 7.281 -9.332 -2.327 58 2HD2 ASN 922 2HD2 ASN 922 8.420 -10.627 -2.485 59 H ASP 923 H ASP 923 7.496 -9.165 -6.130 60 HA ASP 923 HA ASP 923 8.832 -7.476 -4.308 61 1HB ASP 923 1HB ASP 923 10.270 -8.885 -5.531 62 2HB ASP 923 2HB ASP 923 9.395 -8.650 -7.031 63 H LYS 924 H LYS 924 7.015 -7.159 -7.385 64 HA LYS 924 HA LYS 924 7.783 -4.419 -7.765 65 1HB LYS 924 1HB LYS 924 6.743 -6.489 -9.363 66 2HB LYS 924 2HB LYS 924 5.476 -5.281 -9.297 67 1HG LYS 924 1HG LYS 924 8.253 -4.230 -9.697 68 2HG LYS 924 2HG LYS 924 7.593 -5.160 -11.028 69 1HD LYS 924 1HD LYS 924 5.472 -3.460 -10.220 70 2HD LYS 924 2HD LYS 924 6.903 -2.451 -10.141 71 1HE LYS 924 1HE LYS 924 7.184 -3.926 -12.553 72 2HE LYS 924 2HE LYS 924 5.493 -3.469 -12.498 73 1HZ LYS 924 1HZ LYS 924 6.952 -1.798 -13.503 74 2HZ LYS 924 2HZ LYS 924 6.114 -1.212 -12.231 75 3HZ LYS 924 3HZ LYS 924 7.697 -1.577 -12.067 76 H VAL 925 H VAL 925 4.909 -6.258 -6.593 77 HA VAL 925 HA VAL 925 3.228 -4.066 -6.287 78 HB VAL 925 HB VAL 925 3.432 -6.761 -4.960 79 1HG1 VAL 925 1HG1 VAL 925 1.457 -4.538 -4.420 80 2HG1 VAL 925 2HG1 VAL 925 1.037 -6.250 -4.173 81 3HG1 VAL 925 3HG1 VAL 925 2.379 -5.522 -3.259 82 1HG2 VAL 925 1HG2 VAL 925 2.618 -6.101 -7.463 83 2HG2 VAL 925 2HG2 VAL 925 1.994 -7.495 -6.549 84 3HG2 VAL 925 3HG2 VAL 925 1.078 -5.970 -6.580 85 H TYR 926 H TYR 926 5.539 -5.627 -3.971 86 HA TYR 926 HA TYR 926 4.982 -3.858 -1.862 87 1HB TYR 926 1HB TYR 926 7.340 -5.619 -2.754 88 2HB TYR 926 2HB TYR 926 7.376 -4.772 -1.220 89 HD1 TYR 926 HD1 TYR 926 4.065 -5.822 -2.108 90 HD2 TYR 926 HD2 TYR 926 7.726 -7.176 -0.357 91 HE1 TYR 926 HE1 TYR 926 2.833 -7.756 -1.010 92 HE2 TYR 926 HE2 TYR 926 6.481 -9.105 0.736 93 HH TYR 926 HH TYR 926 4.378 -10.401 0.236 94 H GLU 927 H GLU 927 7.074 -3.655 -4.728 95 HA GLU 927 HA GLU 927 8.704 -1.612 -3.707 96 1HB GLU 927 1HB GLU 927 8.145 -2.757 -6.447 97 2HB GLU 927 2HB GLU 927 9.061 -1.268 -6.320 98 1HG GLU 927 1HG GLU 927 9.884 -3.508 -4.495 99 2HG GLU 927 2HG GLU 927 10.217 -3.726 -6.202 100 H ASN 928 H ASN 928 5.855 -1.632 -5.960 101 HA ASN 928 HA ASN 928 5.765 1.046 -6.427 102 1HB ASN 928 1HB ASN 928 3.294 -0.710 -6.018 103 2HB ASN 928 2HB ASN 928 3.429 0.687 -7.068 104 1HD2 ASN 928 1HD2 ASN 928 5.649 0.424 -8.445 105 2HD2 ASN 928 2HD2 ASN 928 5.695 -1.021 -9.398 106 H VAL 929 H VAL 929 4.121 -0.930 -3.849 107 HA VAL 929 HA VAL 929 2.705 1.057 -2.609 108 HB VAL 929 HB VAL 929 4.117 -1.339 -1.421 109 1HG1 VAL 929 1HG1 VAL 929 1.644 -0.079 -0.257 110 2HG1 VAL 929 2HG1 VAL 929 2.857 -1.126 0.518 111 3HG1 VAL 929 3HG1 VAL 929 3.252 0.569 0.145 112 1HG2 VAL 929 1HG2 VAL 929 1.186 -1.281 -2.015 113 2HG2 VAL 929 2HG2 VAL 929 2.316 -1.481 -3.376 114 3HG2 VAL 929 3HG2 VAL 929 2.331 -2.643 -2.027 115 H THR 930 H THR 930 6.078 -0.058 -1.833 116 HA THR 930 HA THR 930 6.539 1.915 0.100 117 HB THR 930 HB THR 930 9.004 1.259 -0.546 118 HG1 THR 930 HG1 THR 930 8.972 -0.573 -2.026 119 1HG2 THR 930 1HG2 THR 930 7.805 0.089 1.309 120 2HG2 THR 930 2HG2 THR 930 6.972 -0.939 0.117 121 3HG2 THR 930 3HG2 THR 930 8.735 -1.071 0.330 122 H GLY 931 H GLY 931 7.881 1.801 -3.273 123 1HA GLY 931 1HA GLY 931 9.042 4.181 -3.493 124 2HA GLY 931 2HA GLY 931 8.055 3.505 -4.774 125 H LEU 932 H LEU 932 5.460 3.698 -3.944 126 HA LEU 932 HA LEU 932 4.890 6.393 -4.322 127 1HB LEU 932 1HB LEU 932 2.851 5.622 -4.666 128 2HB LEU 932 2HB LEU 932 3.528 4.023 -4.427 129 HG LEU 932 HG LEU 932 2.923 4.179 -2.002 130 1HD1 LEU 932 1HD1 LEU 932 0.901 6.094 -1.984 131 2HD1 LEU 932 2HD1 LEU 932 2.477 6.189 -1.161 132 3HD1 LEU 932 3HD1 LEU 932 2.273 6.903 -2.779 133 1HD2 LEU 932 1HD2 LEU 932 0.831 4.272 -4.166 134 2HD2 LEU 932 2HD2 LEU 932 1.470 2.873 -3.270 135 3HD2 LEU 932 3HD2 LEU 932 0.388 4.030 -2.458 136 H VAL 933 H VAL 933 4.752 4.355 -1.322 137 HA VAL 933 HA VAL 933 3.926 6.384 0.375 138 HB VAL 933 HB VAL 933 5.168 3.719 0.573 139 1HG1 VAL 933 1HG1 VAL 933 5.463 4.066 3.105 140 2HG1 VAL 933 2HG1 VAL 933 6.740 4.688 2.032 141 3HG1 VAL 933 3HG1 VAL 933 5.541 5.804 2.729 142 1HG2 VAL 933 1HG2 VAL 933 3.382 3.571 2.406 143 2HG2 VAL 933 2HG2 VAL 933 2.858 5.184 1.864 144 3HG2 VAL 933 3HG2 VAL 933 2.816 3.808 0.735 145 H LYS 934 H LYS 934 7.295 5.173 -0.273 146 HA LYS 934 HA LYS 934 8.718 6.826 1.279 147 1HB LYS 934 1HB LYS 934 9.427 6.185 -1.597 148 2HB LYS 934 2HB LYS 934 10.537 6.584 -0.303 149 1HG LYS 934 1HG LYS 934 8.890 4.424 0.639 150 2HG LYS 934 2HG LYS 934 9.411 4.003 -0.980 151 1HD LYS 934 1HD LYS 934 11.628 3.819 -0.375 152 2HD LYS 934 2HD LYS 934 11.549 5.169 0.741 153 1HE LYS 934 1HE LYS 934 11.217 3.787 2.517 154 2HE LYS 934 2HE LYS 934 9.886 2.974 1.718 155 1HZ LYS 934 1HZ LYS 934 11.958 1.648 2.236 156 2HZ LYS 934 2HZ LYS 934 11.321 1.474 0.743 157 3HZ LYS 934 3HZ LYS 934 12.649 2.398 0.961 158 H ALA 935 H ALA 935 7.003 7.685 -1.745 159 HA ALA 935 HA ALA 935 8.118 10.313 -1.828 160 1HB ALA 935 1HB ALA 935 5.607 9.963 -3.261 161 2HB ALA 935 2HB ALA 935 7.243 10.250 -3.900 162 3HB ALA 935 3HB ALA 935 6.703 8.591 -3.549 163 H VAL 936 H VAL 936 4.931 8.861 -0.878 164 HA VAL 936 HA VAL 936 3.442 10.964 -0.295 165 HB VAL 936 HB VAL 936 3.439 8.322 0.357 166 1HG1 VAL 936 1HG1 VAL 936 4.765 8.772 2.412 167 2HG1 VAL 936 2HG1 VAL 936 3.451 9.820 2.999 168 3HG1 VAL 936 3HG1 VAL 936 3.161 8.080 2.756 169 1HG2 VAL 936 1HG2 VAL 936 1.202 8.770 1.362 170 2HG2 VAL 936 2HG2 VAL 936 1.580 10.510 1.345 171 3HG2 VAL 936 3HG2 VAL 936 1.464 9.609 -0.186 172 H ILE 937 H ILE 937 6.283 9.872 1.632 173 HA ILE 937 HA ILE 937 5.905 12.049 3.490 174 HB ILE 937 HB ILE 937 7.947 9.845 3.240 175 1HG1 ILE 937 1HG1 ILE 937 6.345 10.008 5.675 176 2HG1 ILE 937 2HG1 ILE 937 5.345 9.849 4.245 177 1HG2 ILE 937 1HG2 ILE 937 9.054 10.591 5.159 178 2HG2 ILE 937 2HG2 ILE 937 8.824 12.064 4.186 179 3HG2 ILE 937 3HG2 ILE 937 7.760 11.740 5.576 180 1HD1 ILE 937 1HD1 ILE 937 6.154 7.742 3.729 181 2HD1 ILE 937 2HD1 ILE 937 7.773 8.089 4.383 182 3HD1 ILE 937 3HD1 ILE 937 6.430 7.712 5.488 183 H GLU 938 H GLU 938 8.695 10.963 1.423 184 HA GLU 938 HA GLU 938 10.255 13.053 1.543 185 1HB GLU 938 1HB GLU 938 10.056 10.922 -0.156 186 2HB GLU 938 2HB GLU 938 9.707 12.223 -1.276 187 1HG GLU 938 1HG GLU 938 11.927 12.651 -1.413 188 2HG GLU 938 2HG GLU 938 11.905 13.152 0.266 189 H MET 939 H MET 939 7.387 12.902 -0.685 190 HA MET 939 HA MET 939 7.621 15.293 -1.876 191 1HB MET 939 1HB MET 939 5.669 13.310 -1.620 192 2HB MET 939 2HB MET 939 4.862 14.685 -0.892 193 1HG MET 939 1HG MET 939 5.421 16.048 -2.959 194 2HG MET 939 2HG MET 939 6.099 14.605 -3.687 195 1HE MET 939 1HE MET 939 2.992 14.090 -1.259 196 2HE MET 939 2HE MET 939 3.094 15.823 -1.649 197 3HE MET 939 3HE MET 939 1.730 14.854 -2.254 198 H SER 940 H SER 940 5.700 14.729 1.170 199 HA SER 940 HA SER 940 4.943 17.213 1.703 200 1HB SER 940 1HB SER 940 6.021 15.116 3.629 201 2HB SER 940 2HB SER 940 5.243 16.585 4.181 202 HG SER 940 HG SER 940 4.117 14.272 3.114 203 H SER 941 H SER 941 8.237 15.850 2.101 204 HA SER 941 HA SER 941 9.270 17.969 3.571 205 1HB SER 941 1HB SER 941 10.268 15.626 3.156 206 2HB SER 941 2HB SER 941 10.828 16.236 1.611 207 HG SER 941 HG SER 941 11.519 17.258 4.232 208 H LYS 942 H LYS 942 9.461 17.190 0.018 209 HA LYS 942 HA LYS 942 10.442 19.877 -0.478 210 1HB LYS 942 1HB LYS 942 10.794 19.059 -2.770 211 2HB LYS 942 2HB LYS 942 11.591 18.052 -1.578 212 1HG LYS 942 1HG LYS 942 10.318 16.226 -2.093 213 2HG LYS 942 2HG LYS 942 8.832 17.155 -2.117 214 1HD LYS 942 1HD LYS 942 10.450 17.942 -4.392 215 2HD LYS 942 2HD LYS 942 10.349 16.193 -4.358 216 1HE LYS 942 1HE LYS 942 7.723 17.002 -3.764 217 2HE LYS 942 2HE LYS 942 8.245 18.176 -4.955 218 1HZ LYS 942 1HZ LYS 942 7.998 16.638 -6.486 219 2HZ LYS 942 2HZ LYS 942 9.102 15.668 -5.774 220 3HZ LYS 942 3HZ LYS 942 7.524 15.539 -5.374 221 H ILE 943 H ILE 943 7.656 19.270 0.555 222 HA ILE 943 HA ILE 943 6.054 20.041 -1.749 223 HB ILE 943 HB ILE 943 5.627 18.356 0.404 224 1HG1 ILE 943 1HG1 ILE 943 4.600 18.629 -2.011 225 2HG1 ILE 943 2HG1 ILE 943 3.751 17.755 -0.751 226 1HG2 ILE 943 1HG2 ILE 943 3.614 19.385 1.508 227 2HG2 ILE 943 2HG2 ILE 943 5.181 20.096 1.963 228 3HG2 ILE 943 3HG2 ILE 943 4.117 20.945 0.815 229 1HD1 ILE 943 1HD1 ILE 943 2.296 19.402 -1.982 230 2HD1 ILE 943 2HD1 ILE 943 2.370 19.707 -0.230 231 3HD1 ILE 943 3HD1 ILE 943 3.317 20.716 -1.350 232 H GLN 944 H GLN 944 6.756 21.149 1.638 233 HA GLN 944 HA GLN 944 5.374 23.445 1.617 234 1HB GLN 944 1HB GLN 944 7.321 22.275 3.236 235 2HB GLN 944 2HB GLN 944 8.071 23.791 2.775 236 1HG GLN 944 1HG GLN 944 5.871 24.951 3.439 237 2HG GLN 944 2HG GLN 944 5.357 23.419 4.118 238 1HE2 GLN 944 1HE2 GLN 944 6.513 22.492 5.849 239 2HE2 GLN 944 2HE2 GLN 944 7.481 23.447 6.922 240 HA PRO 945 HA PRO 945 8.969 25.570 -0.645 241 1HB PRO 945 1HB PRO 945 10.926 24.054 -1.803 242 2HB PRO 945 2HB PRO 945 11.089 24.782 -0.218 243 1HG PRO 945 1HG PRO 945 10.588 21.953 -0.916 244 2HG PRO 945 2HG PRO 945 11.170 22.625 0.595 245 1HD PRO 945 1HD PRO 945 8.518 21.680 0.045 246 2HD PRO 945 2HD PRO 945 9.069 22.457 1.515 247 H ALA 946 H ALA 946 8.399 22.433 -2.154 248 HA ALA 946 HA ALA 946 8.456 23.030 -4.742 249 1HB ALA 946 1HB ALA 946 6.197 21.557 -4.729 250 2HB ALA 946 2HB ALA 946 7.797 20.864 -4.369 251 3HB ALA 946 3HB ALA 946 6.701 21.311 -3.039 252 HA PRO 947 HA PRO 947 5.651 26.289 -5.346 253 1HB PRO 947 1HB PRO 947 5.713 26.397 -8.076 254 2HB PRO 947 2HB PRO 947 6.923 27.153 -7.059 255 1HG PRO 947 1HG PRO 947 7.132 24.677 -8.661 256 2HG PRO 947 2HG PRO 947 8.417 25.665 -7.995 257 1HD PRO 947 1HD PRO 947 7.479 23.154 -6.974 258 2HD PRO 947 2HD PRO 947 8.682 24.198 -6.245 259 HA PRO 948 HA PRO 948 1.785 24.849 -6.372 260 1HB PRO 948 1HB PRO 948 0.553 26.833 -7.790 261 2HB PRO 948 2HB PRO 948 0.729 26.869 -6.047 262 1HG PRO 948 1HG PRO 948 2.214 28.403 -8.092 263 2HG PRO 948 2HG PRO 948 2.067 28.719 -6.374 264 1HD PRO 948 1HD PRO 948 4.331 27.588 -7.724 265 2HD PRO 948 2HD PRO 948 4.138 27.796 -5.995 266 H GLU 949 H GLU 949 3.820 25.672 -8.974 267 HA GLU 949 HA GLU 949 2.087 24.455 -10.890 268 1HB GLU 949 1HB GLU 949 3.945 24.913 -12.480 269 2HB GLU 949 2HB GLU 949 3.499 26.341 -11.566 270 1HG GLU 949 1HG GLU 949 5.455 25.133 -9.953 271 2HG GLU 949 2HG GLU 949 6.044 24.843 -11.577 272 H GLU 950 H GLU 950 4.768 23.544 -8.773 273 HA GLU 950 HA GLU 950 5.141 21.080 -10.229 274 1HB GLU 950 1HB GLU 950 6.899 22.710 -8.872 275 2HB GLU 950 2HB GLU 950 6.582 21.488 -7.657 276 1HG GLU 950 1HG GLU 950 8.267 20.373 -8.767 277 2HG GLU 950 2HG GLU 950 6.940 19.842 -9.780 278 H TYR 951 H TYR 951 3.072 22.318 -7.861 279 HA TYR 951 HA TYR 951 2.984 19.964 -6.200 280 1HB TYR 951 1HB TYR 951 2.513 22.545 -5.717 281 2HB TYR 951 2HB TYR 951 0.965 22.258 -6.487 282 HD1 TYR 951 HD1 TYR 951 2.149 22.824 -3.438 283 HD2 TYR 951 HD2 TYR 951 0.124 19.657 -5.482 284 HE1 TYR 951 HE1 TYR 951 1.197 21.998 -1.230 285 HE2 TYR 951 HE2 TYR 951 -0.821 18.841 -3.267 286 HH TYR 951 HH TYR 951 -1.334 20.143 -0.942 287 H VAL 952 H VAL 952 0.857 21.590 -8.651 288 HA VAL 952 HA VAL 952 -1.282 19.916 -8.553 289 HB VAL 952 HB VAL 952 -0.016 21.697 -10.513 290 1HG1 VAL 952 1HG1 VAL 952 -1.491 20.952 -12.387 291 2HG1 VAL 952 2HG1 VAL 952 -0.201 19.793 -11.987 292 3HG1 VAL 952 3HG1 VAL 952 -1.871 19.485 -11.453 293 1HG2 VAL 952 1HG2 VAL 952 -2.825 21.189 -9.501 294 2HG2 VAL 952 2HG2 VAL 952 -1.758 22.573 -9.160 295 3HG2 VAL 952 3HG2 VAL 952 -2.458 22.369 -10.783 296 HA PRO 953 HA PRO 953 1.090 16.922 -11.354 297 1HB PRO 953 1HB PRO 953 3.792 17.204 -11.656 298 2HB PRO 953 2HB PRO 953 2.629 17.830 -12.807 299 1HG PRO 953 1HG PRO 953 4.223 19.300 -10.798 300 2HG PRO 953 2HG PRO 953 3.397 19.922 -12.213 301 1HD PRO 953 1HD PRO 953 2.526 20.127 -9.487 302 2HD PRO 953 2HD PRO 953 1.645 20.646 -10.911 303 H MET 954 H MET 954 3.484 17.948 -8.958 304 HA MET 954 HA MET 954 4.547 15.746 -8.156 305 1HB MET 954 1HB MET 954 3.545 18.160 -6.792 306 2HB MET 954 2HB MET 954 3.565 16.796 -5.691 307 1HG MET 954 1HG MET 954 5.893 16.552 -5.800 308 2HG MET 954 2HG MET 954 5.998 17.206 -7.422 309 1HE MET 954 1HE MET 954 3.844 19.152 -4.593 310 2HE MET 954 2HE MET 954 4.912 17.928 -3.865 311 3HE MET 954 3HE MET 954 5.239 19.659 -3.611 312 H VAL 955 H VAL 955 1.276 16.671 -6.840 313 HA VAL 955 HA VAL 955 0.842 14.217 -5.583 314 HB VAL 955 HB VAL 955 -0.875 16.505 -6.489 315 1HG1 VAL 955 1HG1 VAL 955 -2.241 14.472 -6.795 316 2HG1 VAL 955 2HG1 VAL 955 -1.905 14.001 -5.112 317 3HG1 VAL 955 3HG1 VAL 955 -2.835 15.480 -5.454 318 1HG2 VAL 955 1HG2 VAL 955 -0.264 17.276 -4.486 319 2HG2 VAL 955 2HG2 VAL 955 -1.176 15.940 -3.741 320 3HG2 VAL 955 3HG2 VAL 955 0.558 15.746 -4.096 321 H LYS 956 H LYS 956 -0.278 15.488 -8.795 322 HA LYS 956 HA LYS 956 -1.761 13.388 -9.628 323 1HB LYS 956 1HB LYS 956 -0.446 15.635 -10.807 324 2HB LYS 956 2HB LYS 956 -0.156 14.247 -11.835 325 1HG LYS 956 1HG LYS 956 -2.367 14.053 -12.433 326 2HG LYS 956 2HG LYS 956 -2.945 14.424 -10.821 327 1HD LYS 956 1HD LYS 956 -3.346 16.580 -11.398 328 2HD LYS 956 2HD LYS 956 -1.686 16.795 -11.917 329 1HE LYS 956 1HE LYS 956 -2.296 16.727 -14.104 330 2HE LYS 956 2HE LYS 956 -3.085 15.177 -13.886 331 1HZ LYS 956 1HZ LYS 956 -5.068 16.192 -13.389 332 2HZ LYS 956 2HZ LYS 956 -4.394 17.620 -12.972 333 3HZ LYS 956 3HZ LYS 956 -4.477 17.183 -14.544 334 H GLU 957 H GLU 957 1.769 13.556 -9.236 335 HA GLU 957 HA GLU 957 2.340 11.292 -10.758 336 1HB GLU 957 1HB GLU 957 3.819 13.230 -9.492 337 2HB GLU 957 2HB GLU 957 4.092 11.873 -8.417 338 1HG GLU 957 1HG GLU 957 4.354 11.476 -11.410 339 2HG GLU 957 2HG GLU 957 5.663 12.234 -10.525 340 H VAL 958 H VAL 958 1.851 11.773 -7.192 341 HA VAL 958 HA VAL 958 2.298 9.196 -6.377 342 HB VAL 958 HB VAL 958 1.623 11.508 -5.201 343 1HG1 VAL 958 1HG1 VAL 958 -0.791 11.121 -5.975 344 2HG1 VAL 958 2HG1 VAL 958 -0.858 9.840 -4.741 345 3HG1 VAL 958 3HG1 VAL 958 -0.541 11.524 -4.259 346 1HG2 VAL 958 1HG2 VAL 958 1.115 9.956 -3.119 347 2HG2 VAL 958 2HG2 VAL 958 1.621 8.669 -4.239 348 3HG2 VAL 958 3HG2 VAL 958 2.734 10.005 -3.857 349 H GLY 959 H GLY 959 -0.564 10.640 -7.969 350 1HA GLY 959 1HA GLY 959 -2.349 8.508 -7.519 351 2HA GLY 959 2HA GLY 959 -2.450 9.723 -8.779 352 H LEU 960 H LEU 960 0.002 9.244 -10.177 353 HA LEU 960 HA LEU 960 -0.789 7.139 -11.833 354 1HB LEU 960 1HB LEU 960 1.101 9.232 -11.829 355 2HB LEU 960 2HB LEU 960 2.011 7.756 -12.083 356 HG LEU 960 HG LEU 960 -0.455 8.167 -13.722 357 1HD1 LEU 960 1HD1 LEU 960 0.455 10.342 -13.950 358 2HD1 LEU 960 2HD1 LEU 960 2.116 9.715 -14.090 359 3HD1 LEU 960 3HD1 LEU 960 0.946 9.435 -15.401 360 1HD2 LEU 960 1HD2 LEU 960 0.730 6.911 -15.365 361 2HD2 LEU 960 2HD2 LEU 960 2.267 7.084 -14.483 362 3HD2 LEU 960 3HD2 LEU 960 0.957 6.091 -13.801 363 H ALA 961 H ALA 961 1.504 7.352 -9.082 364 HA ALA 961 HA ALA 961 2.576 4.761 -9.491 365 1HB ALA 961 1HB ALA 961 2.676 6.923 -7.431 366 2HB ALA 961 2HB ALA 961 3.082 5.277 -6.889 367 3HB ALA 961 3HB ALA 961 4.000 6.028 -8.216 368 H LEU 962 H LEU 962 -0.092 6.151 -7.499 369 HA LEU 962 HA LEU 962 -0.662 3.778 -6.122 370 1HB LEU 962 1HB LEU 962 -1.651 5.456 -5.039 371 2HB LEU 962 2HB LEU 962 -1.822 6.437 -6.481 372 HG LEU 962 HG LEU 962 -3.640 4.122 -6.409 373 1HD1 LEU 962 1HD1 LEU 962 -5.030 5.831 -4.745 374 2HD1 LEU 962 2HD1 LEU 962 -4.266 4.294 -4.275 375 3HD1 LEU 962 3HD1 LEU 962 -3.392 5.828 -4.047 376 1HD2 LEU 962 1HD2 LEU 962 -4.392 5.483 -8.020 377 2HD2 LEU 962 2HD2 LEU 962 -5.156 6.383 -6.687 378 3HD2 LEU 962 3HD2 LEU 962 -3.584 6.913 -7.332 379 H ARG 963 H ARG 963 -1.578 5.042 -9.331 380 HA ARG 963 HA ARG 963 -3.692 3.341 -9.781 381 1HB ARG 963 1HB ARG 963 -2.477 5.362 -11.183 382 2HB ARG 963 2HB ARG 963 -1.900 3.986 -12.101 383 1HG ARG 963 1HG ARG 963 -3.896 4.259 -13.217 384 2HG ARG 963 2HG ARG 963 -4.511 3.269 -11.908 385 1HD ARG 963 1HD ARG 963 -6.005 5.034 -11.730 386 2HD ARG 963 2HD ARG 963 -4.747 5.659 -10.681 387 HE ARG 963 HE ARG 963 -4.388 7.360 -12.231 388 1HH1 ARG 963 2HH2 ARG 963 -5.829 4.620 -13.903 389 2HH1 ARG 963 1HH2 ARG 963 -5.941 5.443 -15.423 390 1HH2 ARG 963 2HH1 ARG 963 -4.535 8.447 -14.236 391 2HH2 ARG 963 1HH1 ARG 963 -5.200 7.634 -15.613 392 H THR 964 H THR 964 -0.213 3.047 -10.834 393 HA THR 964 HA THR 964 -0.408 0.533 -11.975 394 HB THR 964 HB THR 964 1.831 2.103 -10.620 395 HG1 THR 964 HG1 THR 964 1.199 2.920 -12.652 396 1HG2 THR 964 1HG2 THR 964 1.844 -0.717 -11.328 397 2HG2 THR 964 2HG2 THR 964 2.840 0.182 -12.498 398 3HG2 THR 964 3HG2 THR 964 3.202 0.282 -10.759 399 H LEU 965 H LEU 965 -0.347 1.484 -8.569 400 HA LEU 965 HA LEU 965 0.482 -0.936 -7.488 401 1HB LEU 965 1HB LEU 965 -0.662 1.549 -6.604 402 2HB LEU 965 2HB LEU 965 -1.441 0.217 -5.774 403 HG LEU 965 HG LEU 965 1.288 -0.400 -5.658 404 1HD1 LEU 965 1HD1 LEU 965 1.936 1.803 -6.369 405 2HD1 LEU 965 2HD1 LEU 965 0.847 2.559 -5.181 406 3HD1 LEU 965 3HD1 LEU 965 2.269 1.642 -4.628 407 1HD2 LEU 965 1HD2 LEU 965 0.969 0.303 -3.213 408 2HD2 LEU 965 2HD2 LEU 965 -0.700 0.710 -3.680 409 3HD2 LEU 965 3HD2 LEU 965 -0.106 -0.959 -3.863 410 H LEU 966 H LEU 966 -2.864 0.274 -8.210 411 HA LEU 966 HA LEU 966 -4.260 -1.909 -7.358 412 1HB LEU 966 1HB LEU 966 -4.734 -0.010 -9.650 413 2HB LEU 966 2HB LEU 966 -5.897 -1.236 -9.186 414 HG LEU 966 HG LEU 966 -5.769 -0.176 -6.822 415 1HD1 LEU 966 1HD1 LEU 966 -5.354 2.403 -7.189 416 2HD1 LEU 966 2HD1 LEU 966 -4.018 1.297 -6.789 417 3HD1 LEU 966 3HD1 LEU 966 -4.270 1.816 -8.473 418 1HD2 LEU 966 1HD2 LEU 966 -7.819 0.041 -7.828 419 2HD2 LEU 966 2HD2 LEU 966 -7.331 1.749 -7.704 420 3HD2 LEU 966 3HD2 LEU 966 -7.162 0.884 -9.251 421 H ALA 967 H ALA 967 -2.731 -1.379 -10.601 422 HA ALA 967 HA ALA 967 -3.547 -3.805 -11.696 423 1HB ALA 967 1HB ALA 967 -1.708 -3.376 -13.310 424 2HB ALA 967 2HB ALA 967 -2.683 -1.918 -13.005 425 3HB ALA 967 3HB ALA 967 -1.085 -2.096 -12.241 426 H THR 968 H THR 968 -0.339 -2.902 -10.231 427 HA THR 968 HA THR 968 0.779 -5.421 -10.315 428 HB THR 968 HB THR 968 2.299 -4.483 -8.588 429 HG1 THR 968 HG1 THR 968 1.474 -2.833 -7.295 430 1HG2 THR 968 1HG2 THR 968 1.989 -1.875 -9.660 431 2HG2 THR 968 2HG2 THR 968 3.096 -3.134 -10.256 432 3HG2 THR 968 3HG2 THR 968 1.472 -2.970 -10.965 433 H VAL 969 H VAL 969 -1.534 -4.039 -7.959 434 HA VAL 969 HA VAL 969 -1.271 -6.074 -6.058 435 HB VAL 969 HB VAL 969 -3.565 -4.237 -6.766 436 1HG1 VAL 969 1HG1 VAL 969 -3.499 -6.485 -4.971 437 2HG1 VAL 969 2HG1 VAL 969 -3.663 -4.982 -4.032 438 3HG1 VAL 969 3HG1 VAL 969 -4.834 -5.360 -5.317 439 1HG2 VAL 969 1HG2 VAL 969 -2.566 -2.635 -5.544 440 2HG2 VAL 969 2HG2 VAL 969 -2.054 -3.782 -4.283 441 3HG2 VAL 969 3HG2 VAL 969 -1.083 -3.595 -5.763 442 H ASP 970 H ASP 970 -3.352 -5.700 -8.981 443 HA ASP 970 HA ASP 970 -5.030 -7.764 -8.631 444 1HB ASP 970 1HB ASP 970 -4.789 -6.113 -10.611 445 2HB ASP 970 2HB ASP 970 -3.602 -7.220 -11.270 446 H GLU 971 H GLU 971 -1.584 -7.779 -9.679 447 HA GLU 971 HA GLU 971 -1.607 -10.544 -10.303 448 1HB GLU 971 1HB GLU 971 0.526 -8.407 -10.085 449 2HB GLU 971 2HB GLU 971 0.992 -10.089 -10.244 450 1HG GLU 971 1HG GLU 971 -0.871 -9.970 -12.232 451 2HG GLU 971 2HG GLU 971 -0.361 -8.294 -12.232 452 H SER 972 H SER 972 -1.196 -8.585 -7.423 453 HA SER 972 HA SER 972 0.223 -10.644 -6.032 454 1HB SER 972 1HB SER 972 -0.161 -7.849 -5.714 455 2HB SER 972 2HB SER 972 -0.934 -8.579 -4.321 456 HG SER 972 HG SER 972 1.645 -9.552 -5.062 457 H LEU 973 H LEU 973 -3.093 -9.549 -6.573 458 HA LEU 973 HA LEU 973 -4.450 -10.361 -4.396 459 1HB LEU 973 1HB LEU 973 -5.026 -9.704 -7.037 460 2HB LEU 973 2HB LEU 973 -5.727 -11.297 -6.836 461 HG LEU 973 HG LEU 973 -6.558 -8.702 -5.721 462 1HD1 LEU 973 1HD1 LEU 973 -8.102 -11.281 -6.077 463 2HD1 LEU 973 2HD1 LEU 973 -8.749 -9.630 -5.924 464 3HD1 LEU 973 3HD1 LEU 973 -7.826 -10.094 -7.374 465 1HD2 LEU 973 1HD2 LEU 973 -5.982 -9.385 -3.596 466 2HD2 LEU 973 2HD2 LEU 973 -7.646 -10.002 -3.731 467 3HD2 LEU 973 3HD2 LEU 973 -6.267 -11.106 -3.950 468 HA PRO 974 HA PRO 974 -4.162 -14.859 -5.813 469 1HB PRO 974 1HB PRO 974 -2.502 -15.554 -7.870 470 2HB PRO 974 2HB PRO 974 -4.216 -15.254 -8.081 471 1HG PRO 974 1HG PRO 974 -1.929 -13.532 -8.818 472 2HG PRO 974 2HG PRO 974 -3.585 -13.461 -9.386 473 1HD PRO 974 1HD PRO 974 -2.354 -11.725 -7.463 474 2HD PRO 974 2HD PRO 974 -4.039 -11.728 -7.945 475 H VAL 975 H VAL 975 -1.195 -13.051 -6.057 476 HA VAL 975 HA VAL 975 0.611 -14.925 -5.290 477 HB VAL 975 HB VAL 975 0.323 -11.994 -4.679 478 1HG1 VAL 975 1HG1 VAL 975 2.204 -13.915 -3.470 479 2HG1 VAL 975 2HG1 VAL 975 2.980 -12.502 -4.226 480 3HG1 VAL 975 3HG1 VAL 975 1.750 -12.271 -2.959 481 1HG2 VAL 975 1HG2 VAL 975 0.803 -12.932 -7.021 482 2HG2 VAL 975 2HG2 VAL 975 1.894 -11.667 -6.404 483 3HG2 VAL 975 3HG2 VAL 975 2.406 -13.372 -6.383 484 H LEU 976 H LEU 976 -1.940 -13.372 -3.352 485 HA LEU 976 HA LEU 976 -0.969 -14.884 -1.029 486 1HB LEU 976 1HB LEU 976 -2.844 -12.520 -1.032 487 2HB LEU 976 2HB LEU 976 -2.110 -13.300 0.355 488 HG LEU 976 HG LEU 976 -0.898 -11.322 0.075 489 1HD1 LEU 976 1HD1 LEU 976 0.613 -13.123 0.486 490 2HD1 LEU 976 2HD1 LEU 976 0.643 -13.573 -1.236 491 3HD1 LEU 976 3HD1 LEU 976 1.374 -12.040 -0.704 492 1HD2 LEU 976 1HD2 LEU 976 -0.301 -11.796 -2.830 493 2HD2 LEU 976 2HD2 LEU 976 -1.840 -11.049 -2.339 494 3HD2 LEU 976 3HD2 LEU 976 -0.298 -10.279 -1.897 495 HA PRO 977 HA PRO 977 -4.537 -17.300 -1.249 496 1HB PRO 977 1HB PRO 977 -4.895 -18.043 1.357 497 2HB PRO 977 2HB PRO 977 -3.719 -18.797 0.299 498 1HG PRO 977 1HG PRO 977 -3.270 -16.865 2.491 499 2HG PRO 977 2HG PRO 977 -2.118 -17.936 1.718 500 1HD PRO 977 1HD PRO 977 -2.393 -15.113 1.288 501 2HD PRO 977 2HD PRO 977 -1.321 -16.204 0.432 502 H ALA 978 H ALA 978 -6.754 -17.785 0.066 503 HA ALA 978 HA ALA 978 -8.301 -15.564 -0.465 504 1HB ALA 978 1HB ALA 978 -8.590 -18.185 0.888 505 2HB ALA 978 2HB ALA 978 -9.759 -16.946 1.404 506 3HB ALA 978 3HB ALA 978 -9.638 -17.396 -0.314 507 H SER 979 H SER 979 -9.833 -14.638 1.447 508 HA SER 979 HA SER 979 -10.002 -13.311 3.156 509 1HB SER 979 1HB SER 979 -8.009 -15.284 4.121 510 2HB SER 979 2HB SER 979 -7.942 -13.750 4.966 511 HG SER 979 HG SER 979 -10.533 -14.261 4.817 512 H THR 980 H THR 980 -8.340 -12.626 0.790 513 HA THR 980 HA THR 980 -6.556 -10.648 2.053 514 HB THR 980 HB THR 980 -5.474 -10.879 -0.382 515 HG1 THR 980 HG1 THR 980 -6.700 -13.480 0.172 516 1HG2 THR 980 1HG2 THR 980 -4.329 -13.116 0.453 517 2HG2 THR 980 2HG2 THR 980 -4.049 -11.617 1.372 518 3HG2 THR 980 3HG2 THR 980 -5.236 -12.810 1.954 519 H HIS 981 H HIS 981 -8.462 -11.257 -0.979 520 HA HIS 981 HA HIS 981 -8.581 -8.726 -1.882 521 1HB HIS 981 1HB HIS 981 -10.996 -9.460 -2.631 522 2HB HIS 981 2HB HIS 981 -9.562 -10.206 -3.308 523 HD1 HIS 981 HD1 HIS 981 -12.606 -10.943 -1.311 524 HD2 HIS 981 HD2 HIS 981 -9.009 -12.865 -2.291 525 HE1 HIS 981 HE1 HIS 981 -12.930 -13.405 -0.727 526 H ARG 982 H ARG 982 -10.837 -10.222 0.538 527 HA ARG 982 HA ARG 982 -12.492 -8.162 0.918 528 1HB ARG 982 1HB ARG 982 -11.930 -10.555 2.234 529 2HB ARG 982 2HB ARG 982 -11.579 -9.372 3.478 530 1HG ARG 982 1HG ARG 982 -13.839 -9.510 3.873 531 2HG ARG 982 2HG ARG 982 -13.933 -8.344 2.569 532 1HD ARG 982 1HD ARG 982 -15.387 -9.897 1.675 533 2HD ARG 982 2HD ARG 982 -13.906 -10.615 1.075 534 HE ARG 982 HE ARG 982 -14.325 -11.635 3.695 535 1HH1 ARG 982 2HH2 ARG 982 -15.862 -11.773 0.532 536 2HH1 ARG 982 1HH2 ARG 982 -16.557 -13.337 0.797 537 1HH2 ARG 982 2HH1 ARG 982 -15.242 -13.698 4.044 538 2HH2 ARG 982 1HH1 ARG 982 -16.202 -14.439 2.808 539 H GLU 983 H GLU 983 -9.790 -8.773 3.279 540 HA GLU 983 HA GLU 983 -9.848 -6.264 4.357 541 1HB GLU 983 1HB GLU 983 -7.671 -8.369 4.166 542 2HB GLU 983 2HB GLU 983 -7.381 -6.855 4.998 543 1HG GLU 983 1HG GLU 983 -9.735 -7.474 6.169 544 2HG GLU 983 2HG GLU 983 -9.251 -9.100 5.732 545 H ILE 984 H ILE 984 -7.887 -7.552 1.609 546 HA ILE 984 HA ILE 984 -6.292 -5.319 1.230 547 HB ILE 984 HB ILE 984 -7.287 -7.499 -0.583 548 1HG1 ILE 984 1HG1 ILE 984 -4.697 -6.900 0.850 549 2HG1 ILE 984 2HG1 ILE 984 -5.741 -8.297 1.024 550 1HG2 ILE 984 1HG2 ILE 984 -5.350 -5.286 -1.317 551 2HG2 ILE 984 2HG2 ILE 984 -5.700 -6.736 -2.288 552 3HG2 ILE 984 3HG2 ILE 984 -6.978 -5.533 -1.993 553 1HD1 ILE 984 1HD1 ILE 984 -3.975 -9.095 -0.336 554 2HD1 ILE 984 2HD1 ILE 984 -5.260 -8.728 -1.512 555 3HD1 ILE 984 3HD1 ILE 984 -3.907 -7.592 -1.288 556 H GLU 985 H GLU 985 -9.695 -5.941 0.447 557 HA GLU 985 HA GLU 985 -9.946 -3.907 -1.443 558 1HB GLU 985 1HB GLU 985 -11.608 -5.875 -0.230 559 2HB GLU 985 2HB GLU 985 -12.400 -4.339 0.063 560 1HG GLU 985 1HG GLU 985 -11.331 -4.609 -2.693 561 2HG GLU 985 2HG GLU 985 -12.553 -5.802 -2.300 562 H MET 986 H MET 986 -10.400 -4.027 2.138 563 HA MET 986 HA MET 986 -11.376 -1.419 2.331 564 1HB MET 986 1HB MET 986 -10.476 -3.619 4.099 565 2HB MET 986 2HB MET 986 -10.069 -2.051 4.767 566 1HG MET 986 1HG MET 986 -12.282 -1.457 5.102 567 2HG MET 986 2HG MET 986 -12.834 -2.267 3.649 568 1HE MET 986 1HE MET 986 -13.780 -4.817 3.645 569 2HE MET 986 2HE MET 986 -12.008 -4.953 3.552 570 3HE MET 986 3HE MET 986 -12.923 -5.995 4.668 571 H ALA 987 H ALA 987 -8.157 -2.748 1.899 572 HA ALA 987 HA ALA 987 -6.855 -0.370 2.907 573 1HB ALA 987 1HB ALA 987 -4.825 -1.696 1.935 574 2HB ALA 987 2HB ALA 987 -5.655 -2.332 3.376 575 3HB ALA 987 3HB ALA 987 -5.986 -3.035 1.775 576 H GLN 988 H GLN 988 -7.892 -1.862 -0.163 577 HA GLN 988 HA GLN 988 -6.348 -0.151 -1.772 578 1HB GLN 988 1HB GLN 988 -8.760 -1.924 -2.308 579 2HB GLN 988 2HB GLN 988 -8.025 -0.960 -3.574 580 1HG GLN 988 1HG GLN 988 -6.273 -2.747 -1.867 581 2HG GLN 988 2HG GLN 988 -7.220 -3.458 -3.159 582 1HE2 GLN 988 1HE2 GLN 988 -7.017 -2.520 -5.316 583 2HE2 GLN 988 2HE2 GLN 988 -5.486 -1.904 -5.843 584 H LYS 989 H LYS 989 -9.788 -0.160 -0.649 585 HA LYS 989 HA LYS 989 -10.520 2.144 -2.081 586 1HB LYS 989 1HB LYS 989 -11.716 0.275 -0.235 587 2HB LYS 989 2HB LYS 989 -12.137 1.910 0.231 588 1HG LYS 989 1HG LYS 989 -13.396 2.275 -1.660 589 2HG LYS 989 2HG LYS 989 -12.275 1.418 -2.700 590 1HD LYS 989 1HD LYS 989 -13.448 -0.532 -2.545 591 2HD LYS 989 2HD LYS 989 -13.594 -0.405 -0.803 592 1HE LYS 989 1HE LYS 989 -15.836 -0.197 -1.449 593 2HE LYS 989 2HE LYS 989 -15.367 1.488 -1.343 594 1HZ LYS 989 1HZ LYS 989 -15.144 1.610 -3.641 595 2HZ LYS 989 2HZ LYS 989 -15.148 -0.009 -3.850 596 3HZ LYS 989 3HZ LYS 989 -16.522 0.762 -3.423 597 H LEU 990 H LEU 990 -9.057 1.576 1.141 598 HA LEU 990 HA LEU 990 -9.413 4.071 2.233 599 1HB LEU 990 1HB LEU 990 -7.897 1.721 2.741 600 2HB LEU 990 2HB LEU 990 -6.811 3.088 2.887 601 HG LEU 990 HG LEU 990 -9.469 3.186 4.276 602 1HD1 LEU 990 1HD1 LEU 990 -8.707 1.018 4.930 603 2HD1 LEU 990 2HD1 LEU 990 -7.057 1.619 5.218 604 3HD1 LEU 990 3HD1 LEU 990 -8.390 2.136 6.278 605 1HD2 LEU 990 1HD2 LEU 990 -7.971 5.171 4.176 606 2HD2 LEU 990 2HD2 LEU 990 -8.318 4.612 5.830 607 3HD2 LEU 990 3HD2 LEU 990 -6.747 4.245 5.078 608 H LEU 991 H LEU 991 -6.632 2.901 0.206 609 HA LEU 991 HA LEU 991 -5.233 5.249 0.126 610 1HB LEU 991 1HB LEU 991 -5.117 2.743 -1.064 611 2HB LEU 991 2HB LEU 991 -5.246 3.841 -2.423 612 HG LEU 991 HG LEU 991 -2.970 3.695 -2.184 613 1HD1 LEU 991 1HD1 LEU 991 -2.389 5.833 -1.911 614 2HD1 LEU 991 2HD1 LEU 991 -4.099 6.111 -1.504 615 3HD1 LEU 991 3HD1 LEU 991 -2.906 5.856 -0.208 616 1HD2 LEU 991 1HD2 LEU 991 -3.604 2.842 0.484 617 2HD2 LEU 991 2HD2 LEU 991 -2.120 2.586 -0.463 618 3HD2 LEU 991 3HD2 LEU 991 -2.295 4.047 0.537 619 H ASN 992 H ASN 992 -7.489 4.131 -2.500 620 HA ASN 992 HA ASN 992 -7.565 6.312 -3.976 621 1HB ASN 992 1HB ASN 992 -8.927 4.318 -4.478 622 2HB ASN 992 2HB ASN 992 -9.949 4.610 -3.084 623 1HD2 ASN 992 1HD2 ASN 992 -9.448 5.158 -6.367 624 2HD2 ASN 992 2HD2 ASN 992 -10.673 6.345 -6.667 625 H SER 993 H SER 993 -9.768 5.685 -1.133 626 HA SER 993 HA SER 993 -11.138 7.991 -1.117 627 1HB SER 993 1HB SER 993 -10.624 5.854 0.704 628 2HB SER 993 2HB SER 993 -10.397 7.332 1.616 629 HG SER 993 HG SER 993 -12.651 6.423 1.508 630 H ASP 994 H ASP 994 -8.275 7.441 1.071 631 HA ASP 994 HA ASP 994 -7.935 9.962 1.887 632 1HB ASP 994 1HB ASP 994 -5.788 7.926 1.132 633 2HB ASP 994 2HB ASP 994 -5.454 9.377 2.057 634 H LEU 995 H LEU 995 -6.584 8.391 -1.098 635 HA LEU 995 HA LEU 995 -5.016 10.415 -2.035 636 1HB LEU 995 1HB LEU 995 -6.309 8.043 -3.070 637 2HB LEU 995 2HB LEU 995 -6.277 9.311 -4.280 638 HG LEU 995 HG LEU 995 -4.318 7.591 -4.101 639 1HD1 LEU 995 1HD1 LEU 995 -2.828 9.939 -4.454 640 2HD1 LEU 995 2HD1 LEU 995 -3.644 8.971 -5.705 641 3HD1 LEU 995 3HD1 LEU 995 -4.485 10.349 -4.955 642 1HD2 LEU 995 1HD2 LEU 995 -4.074 8.289 -1.585 643 2HD2 LEU 995 2HD2 LEU 995 -2.636 7.928 -2.571 644 3HD2 LEU 995 3HD2 LEU 995 -3.101 9.618 -2.259 645 H ALA 996 H ALA 996 -8.489 9.862 -2.972 646 HA ALA 996 HA ALA 996 -8.963 12.010 -4.468 647 1HB ALA 996 1HB ALA 996 -10.522 10.411 -2.516 648 2HB ALA 996 2HB ALA 996 -11.219 12.000 -2.912 649 3HB ALA 996 3HB ALA 996 -10.887 10.826 -4.208 650 H GLU 997 H GLU 997 -8.999 12.020 -0.835 651 HA GLU 997 HA GLU 997 -9.530 14.723 -0.621 652 1HB GLU 997 1HB GLU 997 -9.659 12.913 1.188 653 2HB GLU 997 2HB GLU 997 -7.921 13.056 1.357 654 1HG GLU 997 1HG GLU 997 -8.814 14.516 3.022 655 2HG GLU 997 2HG GLU 997 -8.285 15.580 1.734 656 H LEU 998 H LEU 998 -6.402 12.899 -0.662 657 HA LEU 998 HA LEU 998 -4.754 15.096 -0.216 658 1HB LEU 998 1HB LEU 998 -4.400 12.449 -0.367 659 2HB LEU 998 2HB LEU 998 -3.827 12.880 -1.966 660 HG LEU 998 HG LEU 998 -2.608 14.686 -0.134 661 1HD1 LEU 998 1HD1 LEU 998 -3.136 13.128 1.661 662 2HD1 LEU 998 2HD1 LEU 998 -2.382 11.796 0.752 663 3HD1 LEU 998 3HD1 LEU 998 -1.385 13.149 1.340 664 1HD2 LEU 998 1HD2 LEU 998 -0.667 14.063 -1.190 665 2HD2 LEU 998 2HD2 LEU 998 -1.145 12.352 -1.310 666 3HD2 LEU 998 3HD2 LEU 998 -1.878 13.559 -2.394 667 H ILE 999 H ILE 999 -6.207 13.743 -3.215 668 HA ILE 999 HA ILE 999 -4.765 15.399 -4.968 669 HB ILE 999 HB ILE 999 -7.453 14.067 -5.317 670 1HG1 ILE 999 1HG1 ILE 999 -5.441 12.625 -4.609 671 2HG1 ILE 999 2HG1 ILE 999 -6.376 12.126 -6.005 672 1HG2 ILE 999 1HG2 ILE 999 -7.518 15.092 -7.284 673 2HG2 ILE 999 2HG2 ILE 999 -5.899 15.790 -7.041 674 3HG2 ILE 999 3HG2 ILE 999 -6.071 14.168 -7.753 675 1HD1 ILE 999 1HD1 ILE 999 -3.590 12.605 -5.912 676 2HD1 ILE 999 2HD1 ILE 999 -4.574 12.308 -7.365 677 3HD1 ILE 999 3HD1 ILE 999 -4.270 13.976 -6.822 678 H ASN1000 H ASN1000 -8.307 15.607 -4.190 679 HA ASN1000 HA ASN1000 -8.799 18.008 -5.174 680 1HB ASN1000 1HB ASN1000 -10.159 16.282 -3.522 681 2HB ASN1000 2HB ASN1000 -9.883 17.601 -2.401 682 1HD2 ASN1000 1HD2 ASN1000 -12.275 16.494 -3.882 683 2HD2 ASN1000 2HD2 ASN1000 -13.046 17.864 -4.609 684 H LYS1001 H LYS1001 -7.102 17.214 -2.109 685 HA LYS1001 HA LYS1001 -7.105 19.762 -0.978 686 1HB LYS1001 1HB LYS1001 -5.564 17.234 -0.627 687 2HB LYS1001 2HB LYS1001 -4.855 18.694 0.032 688 1HG LYS1001 1HG LYS1001 -7.628 18.787 0.719 689 2HG LYS1001 2HG LYS1001 -7.107 17.144 1.035 690 1HD LYS1001 1HD LYS1001 -5.141 19.156 1.950 691 2HD LYS1001 2HD LYS1001 -6.704 19.344 2.719 692 1HE LYS1001 1HE LYS1001 -5.560 16.558 2.515 693 2HE LYS1001 2HE LYS1001 -4.853 17.650 3.689 694 1HZ LYS1001 1HZ LYS1001 -7.272 16.289 3.847 695 2HZ LYS1001 2HZ LYS1001 -6.567 17.233 4.978 696 3HZ LYS1001 3HZ LYS1001 -7.594 17.890 3.891 697 H MET1002 H MET1002 -4.613 18.097 -3.031 698 HA MET1002 HA MET1002 -2.881 20.223 -3.121 699 1HB MET1002 1HB MET1002 -1.849 19.007 -4.950 700 2HB MET1002 2HB MET1002 -2.570 17.783 -3.924 701 1HG MET1002 1HG MET1002 -3.979 17.101 -5.579 702 2HG MET1002 2HG MET1002 -4.522 18.738 -5.888 703 1HE MET1002 1HE MET1002 -3.354 19.156 -9.313 704 2HE MET1002 2HE MET1002 -4.724 18.878 -8.211 705 3HE MET1002 3HE MET1002 -3.613 20.238 -7.923 706 H LYS1003 H LYS1003 -6.010 19.835 -4.600 707 HA LYS1003 HA LYS1003 -5.510 21.608 -6.791 708 1HB LYS1003 1HB LYS1003 -7.728 19.949 -5.783 709 2HB LYS1003 2HB LYS1003 -8.241 21.456 -6.514 710 1HG LYS1003 1HG LYS1003 -6.539 20.817 -8.436 711 2HG LYS1003 2HG LYS1003 -6.647 19.200 -7.768 712 1HD LYS1003 1HD LYS1003 -8.320 19.342 -9.502 713 2HD LYS1003 2HD LYS1003 -9.180 19.353 -7.975 714 1HE LYS1003 1HE LYS1003 -9.899 21.530 -8.234 715 2HE LYS1003 2HE LYS1003 -8.394 22.054 -8.964 716 1HZ LYS1003 1HZ LYS1003 -10.328 21.994 -10.474 717 2HZ LYS1003 2HZ LYS1003 -9.051 21.129 -11.012 718 3HZ LYS1003 3HZ LYS1003 -10.341 20.364 -10.367 719 H LEU1004 H LEU1004 -6.508 21.839 -3.402 720 HA LEU1004 HA LEU1004 -7.368 24.585 -3.775 721 1HB LEU1004 1HB LEU1004 -7.189 23.004 -1.214 722 2HB LEU1004 2HB LEU1004 -8.083 24.484 -1.503 723 HG LEU1004 HG LEU1004 -8.694 21.821 -2.816 724 1HD1 LEU1004 1HD1 LEU1004 -9.023 21.957 -0.292 725 2HD1 LEU1004 2HD1 LEU1004 -10.306 23.143 -0.632 726 3HD1 LEU1004 3HD1 LEU1004 -10.435 21.486 -1.270 727 1HD2 LEU1004 1HD2 LEU1004 -9.331 23.905 -4.080 728 2HD2 LEU1004 2HD2 LEU1004 -10.677 22.816 -3.666 729 3HD2 LEU1004 3HD2 LEU1004 -10.416 24.306 -2.727 730 H ALA1005 H ALA1005 -4.828 22.703 -2.000 731 HA ALA1005 HA ALA1005 -3.503 24.758 -0.815 732 1HB ALA1005 1HB ALA1005 -1.536 22.978 -1.836 733 2HB ALA1005 2HB ALA1005 -2.305 22.950 -0.231 734 3HB ALA1005 3HB ALA1005 -3.008 22.013 -1.570 735 H GLN1006 H GLN1006 -3.552 23.812 -4.259 736 HA GLN1006 HA GLN1006 -1.343 25.226 -5.077 737 1HB GLN1006 1HB GLN1006 -3.166 23.620 -6.300 738 2HB GLN1006 2HB GLN1006 -3.727 25.172 -6.891 739 1HG GLN1006 1HG GLN1006 -1.016 25.461 -7.262 740 2HG GLN1006 2HG GLN1006 -1.176 23.728 -7.473 741 1HE2 GLN1006 1HE2 GLN1006 -0.789 26.247 -9.227 742 2HE2 GLN1006 2HE2 GLN1006 -1.856 26.003 -10.570 743 H GLN1007 H GLN1007 -4.677 26.281 -4.342 744 HA GLN1007 HA GLN1007 -3.961 28.956 -5.216 745 1HB GLN1007 1HB GLN1007 -6.169 27.711 -5.881 746 2HB GLN1007 2HB GLN1007 -6.709 28.096 -4.259 747 1HG GLN1007 1HG GLN1007 -5.896 30.556 -4.882 748 2HG GLN1007 2HG GLN1007 -6.048 29.983 -6.532 749 1HE2 GLN1007 1HE2 GLN1007 -7.683 30.766 -3.573 750 2HE2 GLN1007 2HE2 GLN1007 -9.311 30.743 -4.163 751 H TYR1008 H TYR1008 -4.591 26.943 -2.385 752 HA TYR1008 HA TYR1008 -4.876 29.236 -0.638 753 1HB TYR1008 1HB TYR1008 -4.998 26.202 -0.592 754 2HB TYR1008 2HB TYR1008 -4.614 26.980 0.931 755 HD1 TYR1008 HD1 TYR1008 -6.266 28.468 2.036 756 HD2 TYR1008 HD2 TYR1008 -7.220 26.327 -1.544 757 HE1 TYR1008 HE1 TYR1008 -8.743 28.874 2.444 758 HE2 TYR1008 HE2 TYR1008 -9.693 26.741 -1.123 759 HH TYR1008 HH TYR1008 -11.176 27.355 0.416 760 H VAL1009 H VAL1009 -2.338 28.796 -2.239 761 HA VAL1009 HA VAL1009 -0.515 28.442 0.039 762 HB VAL1009 HB VAL1009 -0.176 26.732 -1.588 763 1HG1 VAL1009 1HG1 VAL1009 -1.307 27.797 -3.494 764 2HG1 VAL1009 2HG1 VAL1009 0.056 28.928 -3.675 765 3HG1 VAL1009 3HG1 VAL1009 0.302 27.187 -3.951 766 1HG2 VAL1009 1HG2 VAL1009 1.809 28.146 -0.609 767 2HG2 VAL1009 2HG2 VAL1009 2.112 26.930 -1.874 768 3HG2 VAL1009 3HG2 VAL1009 2.020 28.656 -2.301 769 H MET1010 H MET1010 -1.144 30.281 -3.019 770 HA MET1010 HA MET1010 0.847 32.153 -2.591 771 1HB MET1010 1HB MET1010 -0.687 33.557 -4.173 772 2HB MET1010 2HB MET1010 -0.140 32.007 -4.781 773 1HG MET1010 1HG MET1010 -2.300 31.369 -5.054 774 2HG MET1010 2HG MET1010 -2.540 31.472 -3.321 775 1HE MET1010 1HE MET1010 -4.233 32.244 -2.621 776 2HE MET1010 2HE MET1010 -4.615 33.980 -2.533 777 3HE MET1010 3HE MET1010 -5.472 32.939 -3.694 778 H THR1011 H THR1011 -2.600 32.032 -1.558 779 HA THR1011 HA THR1011 -2.919 34.619 -0.681 780 HB THR1011 HB THR1011 -4.884 33.379 -0.570 781 HG1 THR1011 HG1 THR1011 -5.214 32.955 1.738 782 1HG2 THR1011 1HG2 THR1011 -3.008 31.127 0.082 783 2HG2 THR1011 2HG2 THR1011 -4.629 31.029 0.810 784 3HG2 THR1011 3HG2 THR1011 -4.452 31.127 -0.959 785 H SER1012 H SER1012 -1.879 31.823 1.393 786 HA SER1012 HA SER1012 0.283 32.860 2.490 787 1HB SER1012 1HB SER1012 -2.020 34.435 3.374 788 2HB SER1012 2HB SER1012 -1.210 33.701 4.743 789 HG SER1012 HG SER1012 0.847 34.569 3.682 790 H LEU1013 H LEU1013 -2.820 31.234 2.900 791 HA LEU1013 HA LEU1013 -2.009 29.765 5.224 792 1HB LEU1013 1HB LEU1013 -4.271 28.846 3.548 793 2HB LEU1013 2HB LEU1013 -4.135 28.994 5.289 794 HG LEU1013 HG LEU1013 -4.742 31.167 3.280 795 1HD1 LEU1013 1HD1 LEU1013 -6.854 30.796 3.833 796 2HD1 LEU1013 2HD1 LEU1013 -6.341 29.460 4.891 797 3HD1 LEU1013 3HD1 LEU1013 -6.482 31.109 5.546 798 1HD2 LEU1013 1HD2 LEU1013 -3.810 32.709 4.570 799 2HD2 LEU1013 2HD2 LEU1013 -4.867 32.216 5.914 800 3HD2 LEU1013 3HD2 LEU1013 -3.269 31.458 5.715 801 H GLN1014 H GLN1014 0.103 29.444 3.632 802 HA GLN1014 HA GLN1014 -0.288 27.157 1.956 803 1HB GLN1014 1HB GLN1014 1.274 28.843 1.191 804 2HB GLN1014 2HB GLN1014 2.156 28.810 2.705 805 1HG GLN1014 1HG GLN1014 2.700 26.353 2.233 806 2HG GLN1014 2HG GLN1014 1.990 26.564 0.645 807 1HE2 GLN1014 1HE2 GLN1014 4.445 27.820 2.860 808 2HE2 GLN1014 2HE2 GLN1014 5.579 28.359 1.666 809 H GLN1015 H GLN1015 2.226 27.782 4.504 810 HA GLN1015 HA GLN1015 2.835 25.228 5.017 811 1HB GLN1015 1HB GLN1015 3.254 26.148 7.465 812 2HB GLN1015 2HB GLN1015 4.199 26.754 6.119 813 1HG GLN1015 1HG GLN1015 3.272 28.846 6.243 814 2HG GLN1015 2HG GLN1015 1.653 28.221 6.488 815 1HE2 GLN1015 1HE2 GLN1015 2.059 30.299 7.902 816 2HE2 GLN1015 2HE2 GLN1015 2.415 29.993 9.570 817 H GLU1016 H GLU1016 -0.138 26.911 5.844 818 HA GLU1016 HA GLU1016 -0.892 25.200 7.939 819 1HB GLU1016 1HB GLU1016 -1.839 27.467 7.643 820 2HB GLU1016 2HB GLU1016 -2.568 26.989 6.123 821 1HG GLU1016 1HG GLU1016 -3.616 25.040 7.685 822 2HG GLU1016 2HG GLU1016 -3.360 26.247 8.929 823 H TYR1017 H TYR1017 -1.999 25.463 4.479 824 HA TYR1017 HA TYR1017 -3.539 23.117 4.572 825 1HB TYR1017 1HB TYR1017 -2.331 25.068 2.609 826 2HB TYR1017 2HB TYR1017 -2.749 23.510 1.925 827 HD1 TYR1017 HD1 TYR1017 -4.219 26.279 3.976 828 HD2 TYR1017 HD2 TYR1017 -4.932 23.117 1.184 829 HE1 TYR1017 HE1 TYR1017 -6.638 27.024 3.739 830 HE2 TYR1017 HE2 TYR1017 -7.349 23.873 0.956 831 HH TYR1017 HH TYR1017 -8.741 25.580 1.334 832 H LYS1018 H LYS1018 -0.082 23.711 4.173 833 HA LYS1018 HA LYS1018 0.510 21.308 2.817 834 1HB LYS1018 1HB LYS1018 1.963 23.551 4.036 835 2HB LYS1018 2HB LYS1018 2.804 22.021 4.184 836 1HG LYS1018 1HG LYS1018 3.465 23.054 2.077 837 2HG LYS1018 2HG LYS1018 2.498 21.639 1.713 838 1HD LYS1018 1HD LYS1018 0.591 22.934 1.110 839 2HD LYS1018 2HD LYS1018 1.168 24.355 1.957 840 1HE LYS1018 1HE LYS1018 2.876 24.777 0.292 841 2HE LYS1018 2HE LYS1018 2.660 23.198 -0.436 842 1HZ LYS1018 1HZ LYS1018 1.259 24.228 -1.777 843 2HZ LYS1018 2HZ LYS1018 0.199 24.302 -0.536 844 3HZ LYS1018 3HZ LYS1018 1.175 25.572 -0.854 845 H LYS1019 H LYS1019 0.025 22.221 6.228 846 HA LYS1019 HA LYS1019 1.125 19.808 7.253 847 1HB LYS1019 1HB LYS1019 -0.535 22.048 8.415 848 2HB LYS1019 2HB LYS1019 -0.139 20.619 9.350 849 1HG LYS1019 1HG LYS1019 1.867 22.501 8.019 850 2HG LYS1019 2HG LYS1019 1.532 22.405 9.737 851 1HD LYS1019 1HD LYS1019 3.137 20.814 9.910 852 2HD LYS1019 2HD LYS1019 2.118 19.739 8.974 853 1HE LYS1019 1HE LYS1019 3.446 19.923 7.129 854 2HE LYS1019 2HE LYS1019 3.489 21.671 7.236 855 1HZ LYS1019 1HZ LYS1019 4.984 20.609 9.328 856 2HZ LYS1019 2HZ LYS1019 5.472 19.893 7.944 857 3HZ LYS1019 3HZ LYS1019 5.500 21.521 8.076 858 H GLN1020 H GLN1020 -2.050 20.897 6.071 859 HA GLN1020 HA GLN1020 -3.609 18.968 7.233 860 1HB GLN1020 1HB GLN1020 -3.874 20.289 4.497 861 2HB GLN1020 2HB GLN1020 -5.148 19.366 5.268 862 1HG GLN1020 1HG GLN1020 -3.819 21.796 6.555 863 2HG GLN1020 2HG GLN1020 -5.293 21.889 5.611 864 1HE2 GLN1020 1HE2 GLN1020 -5.735 22.818 7.900 865 2HE2 GLN1020 2HE2 GLN1020 -6.495 21.738 9.021 866 H MET1021 H MET1021 -2.438 18.909 3.783 867 HA MET1021 HA MET1021 -3.090 16.315 3.307 868 1HB MET1021 1HB MET1021 -1.475 16.491 1.428 869 2HB MET1021 2HB MET1021 -2.321 18.014 1.612 870 1HG MET1021 1HG MET1021 -0.124 18.792 1.475 871 2HG MET1021 2HG MET1021 -0.270 18.620 3.213 872 1HE MET1021 1HE MET1021 0.040 16.689 0.130 873 2HE MET1021 2HE MET1021 1.809 16.511 0.037 874 3HE MET1021 3HE MET1021 0.809 15.166 0.638 875 H LEU1022 H LEU1022 -0.304 17.645 5.068 876 HA LEU1022 HA LEU1022 1.354 15.402 4.935 877 1HB LEU1022 1HB LEU1022 2.136 17.589 5.588 878 2HB LEU1022 2HB LEU1022 1.093 17.592 6.996 879 HG LEU1022 HG LEU1022 3.417 17.156 7.598 880 1HD1 LEU1022 1HD1 LEU1022 3.011 15.493 9.158 881 2HD1 LEU1022 2HD1 LEU1022 1.370 16.052 8.755 882 3HD1 LEU1022 3HD1 LEU1022 1.997 14.545 8.044 883 1HD2 LEU1022 1HD2 LEU1022 4.780 15.632 6.647 884 2HD2 LEU1022 2HD2 LEU1022 3.478 14.441 6.416 885 3HD2 LEU1022 3HD2 LEU1022 3.655 15.799 5.278 886 H THR1023 H THR1023 -0.924 16.456 7.568 887 HA THR1023 HA THR1023 -0.694 14.382 9.267 888 HB THR1023 HB THR1023 -3.443 15.390 8.461 889 HG1 THR1023 HG1 THR1023 -2.654 17.437 8.770 890 1HG2 THR1023 1HG2 THR1023 -3.792 15.531 10.838 891 2HG2 THR1023 2HG2 THR1023 -2.937 13.987 10.601 892 3HG2 THR1023 3HG2 THR1023 -2.047 15.418 11.174 893 H ALA1024 H ALA1024 -2.670 14.358 6.239 894 HA ALA1024 HA ALA1024 -3.626 11.751 6.625 895 1HB ALA1024 1HB ALA1024 -4.849 12.446 4.876 896 2HB ALA1024 2HB ALA1024 -3.800 13.873 4.699 897 3HB ALA1024 3HB ALA1024 -3.405 12.366 3.838 898 H ALA1025 H ALA1025 -0.799 13.081 4.786 899 HA ALA1025 HA ALA1025 0.099 10.761 3.658 900 1HB ALA1025 1HB ALA1025 2.424 11.970 4.118 901 2HB ALA1025 2HB ALA1025 1.239 12.660 2.983 902 3HB ALA1025 3HB ALA1025 1.366 13.304 4.638 903 H HIS1026 H HIS1026 0.069 11.740 7.048 904 HA HIS1026 HA HIS1026 2.090 9.960 7.889 905 1HB HIS1026 1HB HIS1026 0.598 12.029 9.008 906 2HB HIS1026 2HB HIS1026 0.059 10.613 9.887 907 HD1 HIS1026 HD1 HIS1026 1.515 12.483 11.618 908 HD2 HIS1026 HD2 HIS1026 3.571 9.696 9.250 909 HE1 HIS1026 HE1 HIS1026 3.816 12.198 12.684 910 H ALA1027 H ALA1027 -1.535 9.840 8.202 911 HA ALA1027 HA ALA1027 -1.528 7.160 9.068 912 1HB ALA1027 1HB ALA1027 -3.664 8.974 7.888 913 2HB ALA1027 2HB ALA1027 -3.995 7.354 8.547 914 3HB ALA1027 3HB ALA1027 -3.360 8.634 9.608 915 H LEU1028 H LEU1028 -1.675 8.770 5.875 916 HA LEU1028 HA LEU1028 -2.519 6.571 4.394 917 1HB LEU1028 1HB LEU1028 -1.069 9.116 3.836 918 2HB LEU1028 2HB LEU1028 -1.075 7.879 2.595 919 HG LEU1028 HG LEU1028 -2.909 9.774 2.676 920 1HD1 LEU1028 1HD1 LEU1028 -2.622 7.417 1.327 921 2HD1 LEU1028 2HD1 LEU1028 -4.216 7.202 2.090 922 3HD1 LEU1028 3HD1 LEU1028 -3.912 8.610 1.043 923 1HD2 LEU1028 1HD2 LEU1028 -4.436 7.691 4.209 924 2HD2 LEU1028 2HD2 LEU1028 -3.515 8.948 5.070 925 3HD2 LEU1028 3HD2 LEU1028 -4.809 9.411 3.939 926 H ALA1029 H ALA1029 0.867 7.824 4.859 927 HA ALA1029 HA ALA1029 2.266 5.918 3.613 928 1HB ALA1029 1HB ALA1029 4.062 6.381 5.222 929 2HB ALA1029 2HB ALA1029 3.191 7.880 4.822 930 3HB ALA1029 3HB ALA1029 2.882 7.058 6.370 931 H VAL1030 H VAL1030 0.743 5.637 6.875 932 HA VAL1030 HA VAL1030 1.746 3.007 7.286 933 HB VAL1030 HB VAL1030 -0.153 4.877 8.632 934 1HG1 VAL1030 1HG1 VAL1030 -1.506 3.116 9.120 935 2HG1 VAL1030 2HG1 VAL1030 -0.231 1.909 8.828 936 3HG1 VAL1030 3HG1 VAL1030 -0.268 2.812 10.361 937 1HG2 VAL1030 1HG2 VAL1030 2.460 4.621 8.917 938 2HG2 VAL1030 2HG2 VAL1030 1.413 4.926 10.323 939 3HG2 VAL1030 3HG2 VAL1030 1.993 3.277 9.986 940 H ASP1031 H ASP1031 -1.431 4.430 6.285 941 HA ASP1031 HA ASP1031 -2.960 2.269 6.198 942 1HB ASP1031 1HB ASP1031 -3.813 4.410 5.472 943 2HB ASP1031 2HB ASP1031 -2.653 4.511 4.163 944 H ALA1032 H ALA1032 -0.575 3.328 3.665 945 HA ALA1032 HA ALA1032 -1.048 1.290 1.843 946 1HB ALA1032 1HB ALA1032 1.122 1.931 0.923 947 2HB ALA1032 2HB ALA1032 0.245 3.390 1.446 948 3HB ALA1032 3HB ALA1032 1.563 2.736 2.448 949 H LYS1033 H LYS1033 1.212 1.489 4.661 950 HA LYS1033 HA LYS1033 2.403 -1.004 4.207 951 1HB LYS1033 1HB LYS1033 3.139 0.982 5.698 952 2HB LYS1033 2HB LYS1033 2.097 0.280 6.919 953 1HG LYS1033 1HG LYS1033 3.690 -1.245 7.434 954 2HG LYS1033 2HG LYS1033 3.647 -1.867 5.797 955 1HD LYS1033 1HD LYS1033 5.255 -0.082 5.081 956 2HD LYS1033 2HD LYS1033 5.304 0.528 6.723 957 1HE LYS1033 1HE LYS1033 6.083 -1.803 7.463 958 2HE LYS1033 2HE LYS1033 6.232 -2.218 5.767 959 1HZ LYS1033 1HZ LYS1033 7.760 -0.375 5.516 960 2HZ LYS1033 2HZ LYS1033 7.628 -0.002 7.101 961 3HZ LYS1033 3HZ LYS1033 8.299 -1.421 6.650 962 H ASN1034 H ASN1034 -0.565 0.029 5.931 963 HA ASN1034 HA ASN1034 -1.036 -2.314 7.274 964 1HB ASN1034 1HB ASN1034 -2.299 0.025 7.255 965 2HB ASN1034 2HB ASN1034 -3.286 -0.704 6.004 966 1HD2 ASN1034 1HD2 ASN1034 -4.835 -0.146 7.830 967 2HD2 ASN1034 2HD2 ASN1034 -5.209 -1.404 8.961 968 H LEU1035 H LEU1035 -1.670 -1.282 3.890 969 HA LEU1035 HA LEU1035 -3.432 -3.264 3.122 970 1HB LEU1035 1HB LEU1035 -2.882 -1.252 1.837 971 2HB LEU1035 2HB LEU1035 -1.280 -1.883 1.512 972 HG LEU1035 HG LEU1035 -3.595 -3.580 0.701 973 1HD1 LEU1035 1HD1 LEU1035 -4.283 -1.287 0.056 974 2HD1 LEU1035 2HD1 LEU1035 -2.786 -1.135 -0.894 975 3HD1 LEU1035 3HD1 LEU1035 -4.001 -2.358 -1.337 976 1HD2 LEU1035 1HD2 LEU1035 -0.772 -3.109 -0.125 977 2HD2 LEU1035 2HD2 LEU1035 -1.678 -4.628 0.073 978 3HD2 LEU1035 3HD2 LEU1035 -1.927 -3.626 -1.377 979 H LEU1036 H LEU1036 0.176 -3.235 2.651 980 HA LEU1036 HA LEU1036 0.269 -5.917 1.859 981 1HB LEU1036 1HB LEU1036 1.977 -3.801 1.866 982 2HB LEU1036 2HB LEU1036 2.649 -4.766 3.166 983 HG LEU1036 HG LEU1036 2.227 -6.634 1.154 984 1HD1 LEU1036 1HD1 LEU1036 2.040 -4.213 -0.153 985 2HD1 LEU1036 2HD1 LEU1036 3.749 -4.659 -0.377 986 3HD1 LEU1036 3HD1 LEU1036 2.462 -5.776 -0.893 987 1HD2 LEU1036 1HD2 LEU1036 4.619 -5.145 2.191 988 2HD2 LEU1036 2HD2 LEU1036 4.151 -6.849 2.412 989 3HD2 LEU1036 3HD2 LEU1036 4.794 -6.298 0.846 990 H ASP1037 H ASP1037 0.509 -4.290 5.053 991 HA ASP1037 HA ASP1037 1.480 -6.241 6.582 992 1HB ASP1037 1HB ASP1037 0.488 -3.907 7.197 993 2HB ASP1037 2HB ASP1037 -1.047 -4.735 7.371 994 H VAL1038 H VAL1038 -1.902 -5.877 5.334 995 HA VAL1038 HA VAL1038 -2.922 -8.133 6.694 996 HB VAL1038 HB VAL1038 -3.836 -6.491 4.335 997 1HG1 VAL1038 1HG1 VAL1038 -4.615 -8.991 4.412 998 2HG1 VAL1038 2HG1 VAL1038 -5.651 -8.431 5.747 999 3HG1 VAL1038 3HG1 VAL1038 -5.807 -7.698 4.132 1000 1HG2 VAL1038 1HG2 VAL1038 -5.245 -6.666 6.978 1001 2HG2 VAL1038 2HG2 VAL1038 -3.762 -5.690 6.849 1002 3HG2 VAL1038 3HG2 VAL1038 -5.162 -5.321 5.814 1003 H ILE1039 H ILE1039 -1.182 -7.603 3.639 1004 HA ILE1039 HA ILE1039 -1.848 -10.128 2.531 1005 HB ILE1039 HB ILE1039 0.016 -7.893 1.914 1006 1HG1 ILE1039 1HG1 ILE1039 -1.959 -9.421 0.197 1007 2HG1 ILE1039 2HG1 ILE1039 -2.366 -7.997 1.134 1008 1HG2 ILE1039 1HG2 ILE1039 0.550 -10.721 1.270 1009 2HG2 ILE1039 2HG2 ILE1039 0.598 -9.607 -0.118 1010 3HG2 ILE1039 3HG2 ILE1039 1.641 -9.314 1.295 1011 1HD1 ILE1039 1HD1 ILE1039 -1.770 -6.844 -0.744 1012 2HD1 ILE1039 2HD1 ILE1039 -0.100 -7.133 -0.201 1013 3HD1 ILE1039 3HD1 ILE1039 -0.846 -8.216 -1.401 1014 H ASP1040 H ASP1040 0.805 -8.837 4.581 1015 HA ASP1040 HA ASP1040 2.538 -10.910 4.394 1016 1HB ASP1040 1HB ASP1040 2.461 -8.634 5.835 1017 2HB ASP1040 2HB ASP1040 1.975 -9.729 7.114 1018 H GLN1041 H GLN1041 -0.343 -10.468 6.555 1019 HA GLN1041 HA GLN1041 0.049 -12.911 7.893 1020 1HB GLN1041 1HB GLN1041 -2.101 -12.454 8.933 1021 2HB GLN1041 2HB GLN1041 -1.206 -10.950 8.828 1022 1HG GLN1041 1HG GLN1041 -2.627 -10.042 7.233 1023 2HG GLN1041 2HG GLN1041 -2.959 -11.591 6.484 1024 1HE2 GLN1041 1HE2 GLN1041 -4.920 -12.315 6.721 1025 2HE2 GLN1041 2HE2 GLN1041 -6.005 -12.017 8.037 1026 H ALA1042 H ALA1042 -1.342 -11.983 4.820 1027 HA ALA1042 HA ALA1042 -3.100 -14.219 4.594 1028 1HB ALA1042 1HB ALA1042 -2.028 -12.085 2.732 1029 2HB ALA1042 2HB ALA1042 -3.016 -13.434 2.123 1030 3HB ALA1042 3HB ALA1042 -3.688 -12.314 3.331 1031 H ARG1043 H ARG1043 0.201 -13.351 3.382 1032 HA ARG1043 HA ARG1043 0.603 -15.540 1.835 1033 1HB ARG1043 1HB ARG1043 2.116 -13.384 2.603 1034 2HB ARG1043 2HB ARG1043 2.931 -14.645 3.507 1035 1HG ARG1043 1HG ARG1043 2.633 -15.870 1.044 1036 2HG ARG1043 2HG ARG1043 2.817 -14.195 0.563 1037 1HD ARG1043 1HD ARG1043 4.732 -15.152 2.659 1038 2HD ARG1043 2HD ARG1043 4.929 -15.868 1.072 1039 HE ARG1043 HE ARG1043 5.541 -13.754 0.187 1040 1HH1 ARG1043 2HH2 ARG1043 4.457 -13.448 3.521 1041 2HH1 ARG1043 1HH2 ARG1043 5.044 -11.828 3.697 1042 1HH2 ARG1043 2HH1 ARG1043 6.317 -11.617 0.420 1043 2HH2 ARG1043 1HH1 ARG1043 6.109 -10.780 1.921 1044 H LEU1044 H LEU1044 1.981 -15.136 5.188 1045 HA LEU1044 HA LEU1044 2.833 -17.642 5.629 1046 1HB LEU1044 1HB LEU1044 2.222 -17.195 8.058 1047 2HB LEU1044 2HB LEU1044 3.313 -16.083 7.256 1048 HG LEU1044 HG LEU1044 0.986 -14.798 6.795 1049 1HD1 LEU1044 1HD1 LEU1044 -0.576 -14.972 8.534 1050 2HD1 LEU1044 2HD1 LEU1044 -0.200 -16.656 8.096 1051 3HD1 LEU1044 3HD1 LEU1044 0.524 -15.933 9.552 1052 1HD2 LEU1044 1HD2 LEU1044 2.003 -13.211 7.975 1053 2HD2 LEU1044 2HD2 LEU1044 1.911 -14.161 9.478 1054 3HD2 LEU1044 3HD2 LEU1044 3.262 -14.413 8.347 1055 H LYS1045 H LYS1045 -0.565 -16.460 5.926 1056 HA LYS1045 HA LYS1045 -1.807 -18.537 7.052 1057 1HB LYS1045 1HB LYS1045 -2.700 -16.352 5.934 1058 2HB LYS1045 2HB LYS1045 -2.938 -17.361 4.522 1059 1HG LYS1045 1HG LYS1045 -3.909 -18.588 7.050 1060 2HG LYS1045 2HG LYS1045 -4.737 -17.105 6.621 1061 1HD LYS1045 1HD LYS1045 -4.838 -18.221 4.195 1062 2HD LYS1045 2HD LYS1045 -4.595 -19.709 5.088 1063 1HE LYS1045 1HE LYS1045 -6.964 -19.479 4.977 1064 2HE LYS1045 2HE LYS1045 -6.561 -18.956 6.601 1065 1HZ LYS1045 1HZ LYS1045 -6.416 -16.808 4.786 1066 2HZ LYS1045 2HZ LYS1045 -7.887 -17.513 4.715 1067 3HZ LYS1045 3HZ LYS1045 -7.318 -16.953 6.140 1068 H MET1046 H MET1046 -0.349 -18.460 3.787 1069 HA MET1046 HA MET1046 -1.433 -21.015 3.141 1070 1HB MET1046 1HB MET1046 -1.067 -19.577 1.264 1071 2HB MET1046 2HB MET1046 0.482 -19.022 1.870 1072 1HG MET1046 1HG MET1046 1.517 -21.206 1.376 1073 2HG MET1046 2HG MET1046 -0.035 -21.883 0.924 1074 1HE MET1046 1HE MET1046 1.425 -18.154 -1.314 1075 2HE MET1046 2HE MET1046 0.087 -18.173 -0.140 1076 3HE MET1046 3HE MET1046 1.748 -18.516 0.398 1077 H ILE1047 H ILE1047 1.864 -19.674 3.873 1078 HA ILE1047 HA ILE1047 3.262 -22.036 3.671 1079 HB ILE1047 HB ILE1047 3.644 -19.512 5.246 1080 1HG1 ILE1047 1HG1 ILE1047 5.734 -20.219 3.389 1081 2HG1 ILE1047 2HG1 ILE1047 4.179 -20.340 2.589 1082 1HG2 ILE1047 1HG2 ILE1047 5.001 -20.548 6.674 1083 2HG2 ILE1047 2HG2 ILE1047 4.931 -22.073 5.759 1084 3HG2 ILE1047 3HG2 ILE1047 6.099 -20.811 5.298 1085 1HD1 ILE1047 1HD1 ILE1047 3.754 -18.005 3.878 1086 2HD1 ILE1047 2HD1 ILE1047 5.529 -17.935 3.774 1087 3HD1 ILE1047 3HD1 ILE1047 4.556 -18.075 2.290 1088 H SER1048 H SER1048 1.310 -20.712 6.381 1089 HA SER1048 HA SER1048 1.912 -23.146 7.849 1090 1HB SER1048 1HB SER1048 2.179 -20.795 8.888 1091 2HB SER1048 2HB SER1048 0.429 -20.700 8.889 1092 HG SER1048 HG SER1048 0.532 -22.837 10.099 1093 H GLN1049 H GLN1049 0.477 -24.775 7.354 1094 HA GLN1049 HA GLN1049 -2.148 -24.627 8.053 1095 1HB GLN1049 1HB GLN1049 -1.806 -23.237 5.640 1096 2HB GLN1049 2HB GLN1049 -2.394 -24.805 5.125 1097 1HG GLN1049 1HG GLN1049 -4.470 -24.495 6.073 1098 2HG GLN1049 2HG GLN1049 -3.823 -23.682 7.484 1099 1HE2 GLN1049 1HE2 GLN1049 -3.985 -23.193 3.956 1100 2HE2 GLN1049 2HE2 GLN1049 -4.452 -21.525 3.987 1101 H SER1050 H SER1050 0.335 -25.947 5.846 1102 HA SER1050 HA SER1050 0.946 -27.982 5.397 1103 1HB SER1050 1HB SER1050 -0.467 -28.321 7.961 1104 2HB SER1050 2HB SER1050 -0.501 -29.780 6.991 1105 HG SER1050 HG SER1050 1.968 -29.143 6.720 1106 H ARG1051 H ARG1051 -0.479 -27.283 3.426 1107 HA ARG1051 HA ARG1051 -2.758 -29.079 3.243 1108 1HB ARG1051 1HB ARG1051 -3.224 -26.641 2.872 1109 2HB ARG1051 2HB ARG1051 -2.065 -26.618 1.558 1110 1HG ARG1051 1HG ARG1051 -3.420 -28.292 0.308 1111 2HG ARG1051 2HG ARG1051 -4.562 -28.378 1.634 1112 1HD ARG1051 1HD ARG1051 -5.552 -26.865 0.063 1113 2HD ARG1051 2HD ARG1051 -4.921 -25.841 1.337 1114 HE ARG1051 HE ARG1051 -2.812 -26.024 -0.470 1115 1HH1 ARG1051 2HH2 ARG1051 -6.182 -25.035 -0.689 1116 2HH1 ARG1051 1HH2 ARG1051 -5.902 -23.915 -1.981 1117 1HH2 ARG1051 2HH1 ARG1051 -2.442 -24.546 -2.173 1118 2HH2 ARG1051 1HH1 ARG1051 -3.760 -23.635 -2.830 1119 HA PRO1052 HA PRO1052 -0.382 -31.294 0.308 1120 1HB PRO1052 1HB PRO1052 -2.301 -33.021 -0.588 1121 2HB PRO1052 2HB PRO1052 -1.389 -33.282 0.885 1122 1HG PRO1052 1HG PRO1052 -4.190 -32.391 0.572 1123 2HG PRO1052 2HG PRO1052 -3.402 -33.057 1.988 1124 1HD PRO1052 1HD PRO1052 -4.038 -30.301 1.516 1125 2HD PRO1052 2HD PRO1052 -3.147 -30.953 2.877 1126 H HIS1053 H HIS1053 0.251 -29.730 -1.155 1127 HA HIS1053 HA HIS1053 -1.553 -28.606 -2.936 1128 1HB HIS1053 1HB HIS1053 0.254 -27.334 -3.153 1129 2HB HIS1053 2HB HIS1053 1.275 -28.552 -2.415 1130 HD1 HIS1053 HD1 HIS1053 0.649 -26.865 -5.591 1131 HD2 HIS1053 HD2 HIS1053 2.238 -30.559 -4.395 1132 HE1 HIS1053 HE1 HIS1053 1.949 -27.767 -7.593 Start of MODEL 24 1 H MET 915 H MET 915 0.681 -24.910 -6.652 2 HA MET 915 HA MET 915 0.817 -23.841 -4.575 3 1HB MET 915 1HB MET 915 2.003 -25.673 -3.217 4 2HB MET 915 2HB MET 915 0.825 -26.271 -4.368 5 1HG MET 915 1HG MET 915 2.496 -27.614 -5.152 6 2HG MET 915 2HG MET 915 3.141 -26.175 -5.916 7 1HE MET 915 1HE MET 915 5.170 -27.421 -6.006 8 2HE MET 915 2HE MET 915 5.962 -25.930 -5.441 9 3HE MET 915 3HE MET 915 6.402 -27.499 -4.725 10 H ALA 916 H ALA 916 3.421 -23.356 -6.563 11 HA ALA 916 HA ALA 916 5.435 -22.837 -4.596 12 1HB ALA 916 1HB ALA 916 6.317 -21.589 -6.826 13 2HB ALA 916 2HB ALA 916 6.438 -23.350 -6.592 14 3HB ALA 916 3HB ALA 916 5.108 -22.670 -7.560 15 H ASN 917 H ASN 917 6.358 -20.661 -4.198 16 HA ASN 917 HA ASN 917 4.205 -18.813 -3.834 17 1HB ASN 917 1HB ASN 917 5.942 -19.242 -2.052 18 2HB ASN 917 2HB ASN 917 7.177 -18.594 -3.113 19 1HD2 ASN 917 1HD2 ASN 917 3.866 -17.677 -2.149 20 2HD2 ASN 917 2HD2 ASN 917 4.210 -16.034 -1.721 21 H LEU 918 H LEU 918 3.848 -17.038 -5.196 22 HA LEU 918 HA LEU 918 5.579 -16.718 -7.460 23 1HB LEU 918 1HB LEU 918 3.018 -15.405 -6.565 24 2HB LEU 918 2HB LEU 918 3.893 -14.891 -7.993 25 HG LEU 918 HG LEU 918 3.697 -17.559 -8.487 26 1HD1 LEU 918 1HD1 LEU 918 1.327 -18.194 -7.977 27 2HD1 LEU 918 2HD1 LEU 918 2.402 -18.119 -6.561 28 3HD1 LEU 918 3HD1 LEU 918 1.250 -16.799 -6.875 29 1HD2 LEU 918 1HD2 LEU 918 1.327 -16.503 -9.539 30 2HD2 LEU 918 2HD2 LEU 918 2.437 -15.119 -9.399 31 3HD2 LEU 918 3HD2 LEU 918 2.927 -16.564 -10.317 32 H ASP 919 H ASP 919 7.592 -16.005 -6.679 33 HA ASP 919 HA ASP 919 7.543 -13.591 -5.095 34 1HB ASP 919 1HB ASP 919 9.050 -15.494 -4.464 35 2HB ASP 919 2HB ASP 919 9.863 -15.357 -6.011 36 H ARG 920 H ARG 920 6.778 -13.764 -8.043 37 HA ARG 920 HA ARG 920 9.001 -12.570 -9.378 38 1HB ARG 920 1HB ARG 920 6.566 -13.921 -10.134 39 2HB ARG 920 2HB ARG 920 6.534 -12.338 -10.884 40 1HG ARG 920 1HG ARG 920 9.209 -13.396 -11.161 41 2HG ARG 920 2HG ARG 920 8.082 -14.644 -11.655 42 1HD ARG 920 1HD ARG 920 7.218 -12.066 -12.718 43 2HD ARG 920 2HD ARG 920 8.892 -12.352 -13.151 44 HE ARG 920 HE ARG 920 6.602 -13.737 -14.220 45 1HH1 ARG 920 2HH2 ARG 920 9.964 -14.306 -13.257 46 2HH1 ARG 920 1HH2 ARG 920 10.178 -15.641 -14.339 47 1HH2 ARG 920 1HH1 ARG 920 8.354 -16.326 -15.734 48 H SER 921 H SER 921 5.499 -11.584 -9.167 49 HA SER 921 HA SER 921 6.343 -8.845 -9.313 50 1HB SER 921 1HB SER 921 3.603 -10.177 -9.293 51 2HB SER 921 2HB SER 921 3.814 -8.439 -9.349 52 HG SER 921 HG SER 921 4.091 -10.321 -11.375 53 H ASN 922 H ASN 922 6.785 -10.685 -6.877 54 HA ASN 922 HA ASN 922 5.012 -9.763 -4.901 55 1HB ASN 922 1HB ASN 922 6.300 -11.906 -4.719 56 2HB ASN 922 2HB ASN 922 7.803 -11.008 -4.663 57 1HD2 ASN 922 1HD2 ASN 922 8.584 -10.419 -2.778 58 2HD2 ASN 922 2HD2 ASN 922 7.746 -10.407 -1.263 59 H ASP 923 H ASP 923 8.394 -8.986 -5.958 60 HA ASP 923 HA ASP 923 8.757 -7.045 -3.947 61 1HB ASP 923 1HB ASP 923 10.881 -6.700 -4.926 62 2HB ASP 923 2HB ASP 923 10.537 -8.378 -5.298 63 H LYS 924 H LYS 924 7.230 -7.196 -7.098 64 HA LYS 924 HA LYS 924 7.568 -4.479 -7.828 65 1HB LYS 924 1HB LYS 924 7.151 -6.155 -9.510 66 2HB LYS 924 2HB LYS 924 5.651 -6.638 -8.745 67 1HG LYS 924 1HG LYS 924 4.789 -5.199 -10.346 68 2HG LYS 924 2HG LYS 924 5.039 -4.045 -9.051 69 1HD LYS 924 1HD LYS 924 6.468 -2.873 -10.360 70 2HD LYS 924 2HD LYS 924 7.535 -4.260 -10.448 71 1HE LYS 924 1HE LYS 924 5.077 -4.177 -12.217 72 2HE LYS 924 2HE LYS 924 6.484 -3.234 -12.667 73 1HZ LYS 924 1HZ LYS 924 7.233 -5.835 -11.901 74 2HZ LYS 924 2HZ LYS 924 6.109 -5.899 -13.084 75 3HZ LYS 924 3HZ LYS 924 7.493 -5.065 -13.317 76 H VAL 925 H VAL 925 4.677 -6.317 -6.601 77 HA VAL 925 HA VAL 925 3.093 -4.093 -6.195 78 HB VAL 925 HB VAL 925 3.143 -6.682 -4.630 79 1HG1 VAL 925 1HG1 VAL 925 1.506 -4.365 -4.387 80 2HG1 VAL 925 2HG1 VAL 925 0.511 -5.650 -5.111 81 3HG1 VAL 925 3HG1 VAL 925 1.337 -5.932 -3.560 82 1HG2 VAL 925 1HG2 VAL 925 2.303 -7.780 -6.397 83 2HG2 VAL 925 2HG2 VAL 925 1.193 -6.450 -6.806 84 3HG2 VAL 925 3HG2 VAL 925 2.879 -6.408 -7.374 85 H TYR 926 H TYR 926 5.644 -5.570 -4.157 86 HA TYR 926 HA TYR 926 5.050 -3.941 -1.894 87 1HB TYR 926 1HB TYR 926 7.283 -5.758 -2.935 88 2HB TYR 926 2HB TYR 926 7.556 -4.836 -1.470 89 HD1 TYR 926 HD1 TYR 926 4.412 -6.520 -2.603 90 HD2 TYR 926 HD2 TYR 926 7.626 -6.461 0.221 91 HE1 TYR 926 HE1 TYR 926 3.259 -8.332 -1.242 92 HE2 TYR 926 HE2 TYR 926 6.462 -8.273 1.572 93 HH TYR 926 HH TYR 926 4.488 -10.240 0.621 94 H GLU 927 H GLU 927 6.815 -3.510 -4.895 95 HA GLU 927 HA GLU 927 8.498 -1.476 -3.815 96 1HB GLU 927 1HB GLU 927 8.073 -2.755 -6.501 97 2HB GLU 927 2HB GLU 927 8.801 -1.161 -6.478 98 1HG GLU 927 1HG GLU 927 9.886 -3.194 -4.540 99 2HG GLU 927 2HG GLU 927 10.265 -3.424 -6.236 100 H ASN 928 H ASN 928 5.882 -1.546 -6.351 101 HA ASN 928 HA ASN 928 5.641 1.082 -6.764 102 1HB ASN 928 1HB ASN 928 4.250 -1.048 -7.619 103 2HB ASN 928 2HB ASN 928 3.105 -0.542 -6.392 104 1HD2 ASN 928 1HD2 ASN 928 3.694 -0.384 -9.536 105 2HD2 ASN 928 2HD2 ASN 928 3.023 1.154 -9.969 106 H VAL 929 H VAL 929 4.443 -0.883 -4.007 107 HA VAL 929 HA VAL 929 2.775 1.094 -2.892 108 HB VAL 929 HB VAL 929 4.140 -1.365 -1.797 109 1HG1 VAL 929 1HG1 VAL 929 3.845 -0.249 0.193 110 2HG1 VAL 929 2HG1 VAL 929 2.465 0.699 -0.412 111 3HG1 VAL 929 3HG1 VAL 929 2.247 -1.014 0.023 112 1HG2 VAL 929 1HG2 VAL 929 1.179 -1.090 -2.081 113 2HG2 VAL 929 2HG2 VAL 929 2.140 -1.286 -3.566 114 3HG2 VAL 929 3HG2 VAL 929 2.224 -2.517 -2.283 115 H THR 930 H THR 930 6.040 -0.096 -1.806 116 HA THR 930 HA THR 930 6.541 1.790 0.086 117 HB THR 930 HB THR 930 9.020 1.380 -0.830 118 HG1 THR 930 HG1 THR 930 8.838 0.297 -2.750 119 1HG2 THR 930 1HG2 THR 930 7.066 -0.611 0.344 120 2HG2 THR 930 2HG2 THR 930 8.647 -1.208 -0.215 121 3HG2 THR 930 3HG2 THR 930 8.564 0.040 1.051 122 H GLY 931 H GLY 931 7.647 2.100 -3.361 123 1HA GLY 931 1HA GLY 931 8.605 4.649 -3.257 124 2HA GLY 931 2HA GLY 931 7.835 3.932 -4.659 125 H LEU 932 H LEU 932 5.213 3.561 -3.147 126 HA LEU 932 HA LEU 932 4.119 6.087 -3.842 127 1HB LEU 932 1HB LEU 932 2.367 4.792 -4.122 128 2HB LEU 932 2HB LEU 932 3.217 3.440 -3.400 129 HG LEU 932 HG LEU 932 2.421 4.107 -1.169 130 1HD1 LEU 932 1HD1 LEU 932 0.322 5.905 -1.791 131 2HD1 LEU 932 2HD1 LEU 932 1.749 6.179 -0.762 132 3HD1 LEU 932 3HD1 LEU 932 1.814 6.572 -2.497 133 1HD2 LEU 932 1HD2 LEU 932 0.417 3.058 -1.384 134 2HD2 LEU 932 2HD2 LEU 932 -0.086 4.047 -2.775 135 3HD2 LEU 932 3HD2 LEU 932 1.073 2.715 -3.003 136 H VAL 933 H VAL 933 4.344 4.278 -0.694 137 HA VAL 933 HA VAL 933 3.512 6.498 0.819 138 HB VAL 933 HB VAL 933 4.302 5.154 2.723 139 1HG1 VAL 933 1HG1 VAL 933 2.905 3.274 0.823 140 2HG1 VAL 933 2HG1 VAL 933 2.638 3.522 2.566 141 3HG1 VAL 933 3HG1 VAL 933 2.105 4.756 1.399 142 1HG2 VAL 933 1HG2 VAL 933 5.246 2.899 2.324 143 2HG2 VAL 933 2HG2 VAL 933 5.362 3.272 0.587 144 3HG2 VAL 933 3HG2 VAL 933 6.326 4.198 1.763 145 H LYS 934 H LYS 934 6.707 5.247 -0.242 146 HA LYS 934 HA LYS 934 8.263 6.889 1.385 147 1HB LYS 934 1HB LYS 934 8.859 5.699 -1.340 148 2HB LYS 934 2HB LYS 934 10.051 6.404 -0.268 149 1HG LYS 934 1HG LYS 934 8.452 4.498 1.231 150 2HG LYS 934 2HG LYS 934 9.023 3.729 -0.237 151 1HD LYS 934 1HD LYS 934 11.294 5.094 0.611 152 2HD LYS 934 2HD LYS 934 10.558 4.644 2.136 153 1HE LYS 934 1HE LYS 934 10.439 2.264 1.388 154 2HE LYS 934 2HE LYS 934 11.144 2.705 -0.155 155 1HZ LYS 934 1HZ LYS 934 12.412 2.847 2.482 156 2HZ LYS 934 2HZ LYS 934 12.880 1.967 1.189 157 3HZ LYS 934 3HZ LYS 934 13.046 3.591 1.174 158 H ALA 935 H ALA 935 6.431 7.500 -1.586 159 HA ALA 935 HA ALA 935 7.734 10.071 -1.938 160 1HB ALA 935 1HB ALA 935 7.313 8.839 -3.951 161 2HB ALA 935 2HB ALA 935 5.630 8.509 -3.476 162 3HB ALA 935 3HB ALA 935 6.124 10.163 -3.911 163 H VAL 936 H VAL 936 4.435 8.705 -1.280 164 HA VAL 936 HA VAL 936 2.950 10.907 -1.069 165 HB VAL 936 HB VAL 936 2.991 8.264 0.106 166 1HG1 VAL 936 1HG1 VAL 936 1.374 8.781 1.960 167 2HG1 VAL 936 2HG1 VAL 936 3.044 9.319 2.263 168 3HG1 VAL 936 3HG1 VAL 936 1.803 10.499 1.778 169 1HG2 VAL 936 1HG2 VAL 936 0.567 8.414 -0.300 170 2HG2 VAL 936 2HG2 VAL 936 0.733 10.154 -0.639 171 3HG2 VAL 936 3HG2 VAL 936 1.505 8.961 -1.711 172 H ILE 937 H ILE 937 5.493 9.851 1.228 173 HA ILE 937 HA ILE 937 4.883 12.040 3.007 174 HB ILE 937 HB ILE 937 6.848 9.770 3.000 175 1HG1 ILE 937 1HG1 ILE 937 4.954 10.459 5.219 176 2HG1 ILE 937 2HG1 ILE 937 4.312 9.734 3.759 177 1HG2 ILE 937 1HG2 ILE 937 7.317 10.832 5.410 178 2HG2 ILE 937 2HG2 ILE 937 8.296 11.218 3.974 179 3HG2 ILE 937 3HG2 ILE 937 7.012 12.332 4.502 180 1HD1 ILE 937 1HD1 ILE 937 6.604 8.582 5.417 181 2HD1 ILE 937 2HD1 ILE 937 4.919 8.010 5.449 182 3HD1 ILE 937 3HD1 ILE 937 5.890 7.836 3.967 183 H GLU 938 H GLU 938 7.862 10.973 1.209 184 HA GLU 938 HA GLU 938 9.471 12.962 1.473 185 1HB GLU 938 1HB GLU 938 8.931 11.103 -0.636 186 2HB GLU 938 2HB GLU 938 9.252 12.648 -1.399 187 1HG GLU 938 1HG GLU 938 11.457 12.132 -1.136 188 2HG GLU 938 2HG GLU 938 11.229 12.581 0.543 189 H MET 939 H MET 939 6.564 13.166 -0.679 190 HA MET 939 HA MET 939 6.900 15.553 -1.801 191 1HB MET 939 1HB MET 939 4.890 14.324 -2.274 192 2HB MET 939 2HB MET 939 4.464 14.190 -0.579 193 1HG MET 939 1HG MET 939 3.397 16.221 -0.558 194 2HG MET 939 2HG MET 939 4.657 17.002 -1.491 195 1HE MET 939 1HE MET 939 1.459 14.215 -3.094 196 2HE MET 939 2HE MET 939 3.115 13.721 -3.521 197 3HE MET 939 3HE MET 939 2.662 13.930 -1.813 198 H SER 940 H SER 940 4.879 15.304 1.213 199 HA SER 940 HA SER 940 4.682 17.847 1.840 200 1HB SER 940 1HB SER 940 5.093 15.405 3.563 201 2HB SER 940 2HB SER 940 5.025 16.972 4.345 202 HG SER 940 HG SER 940 2.958 17.250 2.983 203 H SER 941 H SER 941 7.619 15.827 2.243 204 HA SER 941 HA SER 941 9.053 17.574 3.818 205 1HB SER 941 1HB SER 941 9.482 15.092 2.642 206 2HB SER 941 2HB SER 941 10.639 16.099 1.795 207 HG SER 941 HG SER 941 10.390 15.932 4.678 208 H LYS 942 H LYS 942 8.945 17.188 0.206 209 HA LYS 942 HA LYS 942 10.301 19.779 0.001 210 1HB LYS 942 1HB LYS 942 10.886 19.091 -2.276 211 2HB LYS 942 2HB LYS 942 11.481 17.953 -1.084 212 1HG LYS 942 1HG LYS 942 10.108 16.257 -1.815 213 2HG LYS 942 2HG LYS 942 8.749 17.331 -2.085 214 1HD LYS 942 1HD LYS 942 11.018 17.791 -3.948 215 2HD LYS 942 2HD LYS 942 10.314 16.192 -4.082 216 1HE LYS 942 1HE LYS 942 8.397 16.992 -5.035 217 2HE LYS 942 2HE LYS 942 8.246 18.283 -3.861 218 1HZ LYS 942 1HZ LYS 942 10.314 19.130 -5.257 219 2HZ LYS 942 2HZ LYS 942 9.530 18.308 -6.430 220 3HZ LYS 942 3HZ LYS 942 8.771 19.514 -5.631 221 H ILE 943 H ILE 943 7.451 19.389 0.754 222 HA ILE 943 HA ILE 943 6.090 20.266 -1.668 223 HB ILE 943 HB ILE 943 5.342 18.502 0.206 224 1HG1 ILE 943 1HG1 ILE 943 4.308 19.218 -2.053 225 2HG1 ILE 943 2HG1 ILE 943 3.280 18.467 -0.849 226 1HG2 ILE 943 1HG2 ILE 943 4.194 21.152 1.120 227 2HG2 ILE 943 2HG2 ILE 943 3.591 19.554 1.621 228 3HG2 ILE 943 3HG2 ILE 943 5.247 20.053 2.043 229 1HD1 ILE 943 1HD1 ILE 943 2.564 20.740 -2.077 230 2HD1 ILE 943 2HD1 ILE 943 2.136 20.436 -0.376 231 3HD1 ILE 943 3HD1 ILE 943 3.533 21.465 -0.772 232 H GLN 944 H GLN 944 6.691 21.303 1.754 233 HA GLN 944 HA GLN 944 5.424 23.647 1.763 234 1HB GLN 944 1HB GLN 944 7.495 22.409 3.271 235 2HB GLN 944 2HB GLN 944 8.067 24.029 2.927 236 1HG GLN 944 1HG GLN 944 6.065 25.030 3.894 237 2HG GLN 944 2HG GLN 944 5.273 23.472 4.017 238 1HE2 GLN 944 1HE2 GLN 944 6.769 21.774 5.167 239 2HE2 GLN 944 2HE2 GLN 944 7.407 22.270 6.698 240 HA PRO 945 HA PRO 945 9.052 25.713 -0.491 241 1HB PRO 945 1HB PRO 945 11.031 24.183 -1.592 242 2HB PRO 945 2HB PRO 945 11.163 24.930 -0.012 243 1HG PRO 945 1HG PRO 945 10.676 22.093 -0.687 244 2HG PRO 945 2HG PRO 945 11.227 22.783 0.827 245 1HD PRO 945 1HD PRO 945 8.586 21.831 0.235 246 2HD PRO 945 2HD PRO 945 9.109 22.626 1.707 247 H ALA 946 H ALA 946 8.695 22.557 -2.047 248 HA ALA 946 HA ALA 946 8.741 23.165 -4.612 249 1HB ALA 946 1HB ALA 946 8.177 20.963 -4.152 250 2HB ALA 946 2HB ALA 946 6.911 21.417 -2.986 251 3HB ALA 946 3HB ALA 946 6.613 21.584 -4.733 252 HA PRO 947 HA PRO 947 5.846 26.359 -5.201 253 1HB PRO 947 1HB PRO 947 6.118 26.642 -7.905 254 2HB PRO 947 2HB PRO 947 7.198 27.395 -6.749 255 1HG PRO 947 1HG PRO 947 7.676 25.039 -8.470 256 2HG PRO 947 2HG PRO 947 8.845 26.050 -7.644 257 1HD PRO 947 1HD PRO 947 7.975 23.434 -6.852 258 2HD PRO 947 2HD PRO 947 9.055 24.492 -5.966 259 HA PRO 948 HA PRO 948 2.163 24.774 -6.608 260 1HB PRO 948 1HB PRO 948 0.911 26.793 -7.959 261 2HB PRO 948 2HB PRO 948 0.962 26.698 -6.210 262 1HG PRO 948 1HG PRO 948 2.487 28.475 -8.014 263 2HG PRO 948 2HG PRO 948 2.201 28.641 -6.293 264 1HD PRO 948 1HD PRO 948 4.621 27.754 -7.551 265 2HD PRO 948 2HD PRO 948 4.294 27.811 -5.831 266 H GLU 949 H GLU 949 4.362 25.853 -8.950 267 HA GLU 949 HA GLU 949 2.834 24.694 -11.082 268 1HB GLU 949 1HB GLU 949 5.089 26.527 -10.821 269 2HB GLU 949 2HB GLU 949 5.467 25.266 -11.977 270 1HG GLU 949 1HG GLU 949 2.969 25.800 -12.838 271 2HG GLU 949 2HG GLU 949 3.288 27.347 -12.079 272 H GLU 950 H GLU 950 5.098 23.678 -8.681 273 HA GLU 950 HA GLU 950 5.780 21.362 -10.316 274 1HB GLU 950 1HB GLU 950 7.451 23.083 -8.859 275 2HB GLU 950 2HB GLU 950 7.314 21.675 -7.825 276 1HG GLU 950 1HG GLU 950 8.913 20.725 -9.134 277 2HG GLU 950 2HG GLU 950 7.658 20.522 -10.340 278 H TYR 951 H TYR 951 3.625 22.412 -8.000 279 HA TYR 951 HA TYR 951 3.722 19.992 -6.385 280 1HB TYR 951 1HB TYR 951 3.355 22.389 -5.509 281 2HB TYR 951 2HB TYR 951 1.881 22.465 -6.453 282 HD1 TYR 951 HD1 TYR 951 1.004 23.093 -4.073 283 HD2 TYR 951 HD2 TYR 951 2.353 19.181 -5.161 284 HE1 TYR 951 HE1 TYR 951 -0.292 22.096 -2.126 285 HE2 TYR 951 HE2 TYR 951 1.052 18.198 -3.211 286 HH TYR 951 HH TYR 951 -1.034 20.243 -1.222 287 H VAL 952 H VAL 952 1.642 21.691 -8.790 288 HA VAL 952 HA VAL 952 -0.596 20.118 -8.618 289 HB VAL 952 HB VAL 952 0.699 21.858 -10.606 290 1HG1 VAL 952 1HG1 VAL 952 -1.359 19.807 -11.492 291 2HG1 VAL 952 2HG1 VAL 952 -0.828 21.214 -12.443 292 3HG1 VAL 952 3HG1 VAL 952 0.330 19.922 -12.043 293 1HG2 VAL 952 1HG2 VAL 952 -2.083 22.145 -10.689 294 2HG2 VAL 952 2HG2 VAL 952 -1.723 21.720 -8.999 295 3HG2 VAL 952 3HG2 VAL 952 -0.932 23.126 -9.751 296 HA PRO 953 HA PRO 953 1.598 17.074 -11.508 297 1HB PRO 953 1HB PRO 953 4.300 17.259 -11.870 298 2HB PRO 953 2HB PRO 953 3.135 17.942 -12.986 299 1HG PRO 953 1HG PRO 953 4.829 19.326 -10.998 300 2HG PRO 953 2HG PRO 953 3.994 19.997 -12.386 301 1HD PRO 953 1HD PRO 953 3.194 20.199 -9.639 302 2HD PRO 953 2HD PRO 953 2.301 20.768 -11.035 303 H MET 954 H MET 954 3.901 18.053 -9.019 304 HA MET 954 HA MET 954 4.991 15.811 -8.289 305 1HB MET 954 1HB MET 954 4.321 18.257 -7.023 306 2HB MET 954 2HB MET 954 3.710 17.042 -5.918 307 1HG MET 954 1HG MET 954 6.183 15.974 -6.527 308 2HG MET 954 2HG MET 954 6.531 17.687 -6.652 309 1HE MET 954 1HE MET 954 5.748 19.242 -3.435 310 2HE MET 954 2HE MET 954 5.284 19.273 -5.153 311 3HE MET 954 3HE MET 954 4.151 18.637 -3.937 312 H VAL 955 H VAL 955 1.620 16.697 -7.254 313 HA VAL 955 HA VAL 955 1.178 14.223 -5.965 314 HB VAL 955 HB VAL 955 -0.697 16.359 -6.999 315 1HG1 VAL 955 1HG1 VAL 955 -1.634 14.679 -4.780 316 2HG1 VAL 955 2HG1 VAL 955 -2.477 15.208 -6.255 317 3HG1 VAL 955 3HG1 VAL 955 -1.411 13.784 -6.302 318 1HG2 VAL 955 1HG2 VAL 955 1.121 16.756 -5.111 319 2HG2 VAL 955 2HG2 VAL 955 -0.526 17.414 -4.963 320 3HG2 VAL 955 3HG2 VAL 955 -0.083 15.923 -4.099 321 H LYS 956 H LYS 956 0.228 15.571 -9.195 322 HA LYS 956 HA LYS 956 -1.276 13.537 -10.139 323 1HB LYS 956 1HB LYS 956 0.765 15.265 -11.557 324 2HB LYS 956 2HB LYS 956 -0.312 14.175 -12.406 325 1HG LYS 956 1HG LYS 956 -1.461 16.134 -10.400 326 2HG LYS 956 2HG LYS 956 -1.022 16.701 -11.999 327 1HD LYS 956 1HD LYS 956 -2.796 14.256 -11.599 328 2HD LYS 956 2HD LYS 956 -3.461 15.877 -11.654 329 1HE LYS 956 1HE LYS 956 -3.407 15.833 -13.919 330 2HE LYS 956 2HE LYS 956 -1.665 15.646 -13.883 331 1HZ LYS 956 1HZ LYS 956 -3.244 13.825 -14.867 332 2HZ LYS 956 2HZ LYS 956 -1.833 13.432 -14.145 333 3HZ LYS 956 3HZ LYS 956 -3.238 13.288 -13.325 334 H GLU 957 H GLU 957 2.270 13.609 -9.681 335 HA GLU 957 HA GLU 957 2.774 11.291 -11.141 336 1HB GLU 957 1HB GLU 957 4.677 12.588 -10.729 337 2HB GLU 957 2HB GLU 957 4.245 12.895 -9.058 338 1HG GLU 957 1HG GLU 957 4.978 10.753 -8.334 339 2HG GLU 957 2HG GLU 957 4.881 10.065 -9.943 340 H VAL 958 H VAL 958 2.913 11.704 -7.525 341 HA VAL 958 HA VAL 958 3.008 9.108 -6.814 342 HB VAL 958 HB VAL 958 1.570 11.442 -5.554 343 1HG1 VAL 958 1HG1 VAL 958 0.626 9.221 -4.805 344 2HG1 VAL 958 2HG1 VAL 958 2.242 8.829 -4.170 345 3HG1 VAL 958 3HG1 VAL 958 1.341 10.216 -3.514 346 1HG2 VAL 958 1HG2 VAL 958 3.601 11.171 -3.963 347 2HG2 VAL 958 2HG2 VAL 958 4.307 10.204 -5.281 348 3HG2 VAL 958 3HG2 VAL 958 3.860 11.904 -5.565 349 H GLY 959 H GLY 959 0.039 11.009 -7.631 350 1HA GLY 959 1HA GLY 959 -1.869 9.086 -7.080 351 2HA GLY 959 2HA GLY 959 -2.000 10.339 -8.298 352 H LEU 960 H LEU 960 0.210 9.534 -10.002 353 HA LEU 960 HA LEU 960 -1.115 7.642 -11.581 354 1HB LEU 960 1HB LEU 960 1.010 9.442 -11.826 355 2HB LEU 960 2HB LEU 960 1.721 7.870 -12.131 356 HG LEU 960 HG LEU 960 -0.775 8.821 -13.548 357 1HD1 LEU 960 1HD1 LEU 960 1.266 9.005 -15.395 358 2HD1 LEU 960 2HD1 LEU 960 0.477 10.365 -14.560 359 3HD1 LEU 960 3HD1 LEU 960 1.993 9.687 -13.920 360 1HD2 LEU 960 1HD2 LEU 960 -0.105 6.343 -13.442 361 2HD2 LEU 960 2HD2 LEU 960 -0.449 7.051 -15.039 362 3HD2 LEU 960 3HD2 LEU 960 1.235 6.797 -14.521 363 H ALA 961 H ALA 961 1.422 7.402 -9.076 364 HA ALA 961 HA ALA 961 2.309 4.839 -9.621 365 1HB ALA 961 1HB ALA 961 3.048 6.702 -7.900 366 2HB ALA 961 2HB ALA 961 1.956 5.830 -6.798 367 3HB ALA 961 3HB ALA 961 3.336 4.983 -7.537 368 H LEU 962 H LEU 962 -0.495 5.996 -7.649 369 HA LEU 962 HA LEU 962 -1.274 3.541 -6.660 370 1HB LEU 962 1HB LEU 962 -2.820 6.032 -7.357 371 2HB LEU 962 2HB LEU 962 -3.565 4.641 -6.595 372 HG LEU 962 HG LEU 962 -3.026 6.313 -4.936 373 1HD1 LEU 962 1HD1 LEU 962 -1.096 3.996 -4.649 374 2HD1 LEU 962 2HD1 LEU 962 -1.827 4.965 -3.346 375 3HD1 LEU 962 3HD1 LEU 962 -2.848 3.904 -4.346 376 1HD2 LEU 962 1HD2 LEU 962 -1.172 7.389 -6.196 377 2HD2 LEU 962 2HD2 LEU 962 -0.798 7.098 -4.480 378 3HD2 LEU 962 3HD2 LEU 962 -0.117 6.032 -5.732 379 H ARG 963 H ARG 963 -2.381 5.224 -9.684 380 HA ARG 963 HA ARG 963 -4.129 3.459 -10.590 381 1HB ARG 963 1HB ARG 963 -2.899 5.614 -11.677 382 2HB ARG 963 2HB ARG 963 -2.057 4.374 -12.585 383 1HG ARG 963 1HG ARG 963 -3.842 4.321 -13.987 384 2HG ARG 963 2HG ARG 963 -4.740 3.545 -12.697 385 1HD ARG 963 1HD ARG 963 -6.107 5.400 -13.161 386 2HD ARG 963 2HD ARG 963 -5.150 6.006 -11.824 387 HE ARG 963 HE ARG 963 -3.670 6.646 -14.118 388 1HH1 ARG 963 2HH2 ARG 963 -6.891 7.366 -12.898 389 2HH1 ARG 963 1HH2 ARG 963 -6.990 8.899 -13.698 390 1HH2 ARG 963 2HH1 ARG 963 -3.800 8.669 -15.174 391 2HH2 ARG 963 1HH1 ARG 963 -5.220 9.645 -15.001 392 H THR 964 H THR 964 -0.540 3.278 -11.189 393 HA THR 964 HA THR 964 -0.658 0.778 -12.493 394 HB THR 964 HB THR 964 1.573 2.337 -11.089 395 HG1 THR 964 HG1 THR 964 1.330 3.407 -13.008 396 1HG2 THR 964 1HG2 THR 964 3.121 0.804 -11.857 397 2HG2 THR 964 2HG2 THR 964 1.754 -0.335 -11.806 398 3HG2 THR 964 3HG2 THR 964 2.184 0.471 -13.334 399 H LEU 965 H LEU 965 -0.023 1.722 -9.068 400 HA LEU 965 HA LEU 965 0.674 -0.742 -8.105 401 1HB LEU 965 1HB LEU 965 0.941 0.931 -6.593 402 2HB LEU 965 2HB LEU 965 -0.577 1.710 -6.996 403 HG LEU 965 HG LEU 965 -0.883 -0.929 -5.714 404 1HD1 LEU 965 1HD1 LEU 965 -0.062 -0.475 -3.606 405 2HD1 LEU 965 2HD1 LEU 965 1.202 0.220 -4.649 406 3HD1 LEU 965 3HD1 LEU 965 -0.004 1.282 -3.884 407 1HD2 LEU 965 1HD2 LEU 965 -2.181 1.168 -4.308 408 2HD2 LEU 965 2HD2 LEU 965 -2.342 1.507 -6.048 409 3HD2 LEU 965 3HD2 LEU 965 -2.892 -0.053 -5.390 410 H LEU 966 H LEU 966 -2.643 0.640 -8.559 411 HA LEU 966 HA LEU 966 -4.102 -1.393 -7.486 412 1HB LEU 966 1HB LEU 966 -4.544 0.569 -9.690 413 2HB LEU 966 2HB LEU 966 -5.717 -0.715 -9.470 414 HG LEU 966 HG LEU 966 -5.583 0.139 -6.927 415 1HD1 LEU 966 1HD1 LEU 966 -5.621 2.737 -7.174 416 2HD1 LEU 966 2HD1 LEU 966 -4.071 1.880 -6.996 417 3HD1 LEU 966 3HD1 LEU 966 -4.605 2.428 -8.603 418 1HD2 LEU 966 1HD2 LEU 966 -7.732 0.413 -7.390 419 2HD2 LEU 966 2HD2 LEU 966 -7.366 1.949 -8.212 420 3HD2 LEU 966 3HD2 LEU 966 -7.367 0.425 -9.132 421 H ALA 967 H ALA 967 -3.113 -1.117 -10.977 422 HA ALA 967 HA ALA 967 -4.037 -3.596 -11.746 423 1HB ALA 967 1HB ALA 967 -2.284 -3.340 -13.568 424 2HB ALA 967 2HB ALA 967 -3.374 -1.947 -13.365 425 3HB ALA 967 3HB ALA 967 -1.718 -1.884 -12.714 426 H THR 968 H THR 968 -0.762 -2.644 -10.505 427 HA THR 968 HA THR 968 0.402 -5.155 -10.673 428 HB THR 968 HB THR 968 1.047 -2.553 -9.774 429 HG1 THR 968 HG1 THR 968 2.288 -4.290 -10.942 430 1HG2 THR 968 1HG2 THR 968 1.557 -4.655 -7.603 431 2HG2 THR 968 2HG2 THR 968 2.226 -3.006 -7.634 432 3HG2 THR 968 3HG2 THR 968 0.476 -3.252 -7.424 433 H VAL 969 H VAL 969 -1.795 -3.783 -8.209 434 HA VAL 969 HA VAL 969 -1.379 -5.806 -6.310 435 HB VAL 969 HB VAL 969 -3.767 -4.027 -6.839 436 1HG1 VAL 969 1HG1 VAL 969 -4.799 -4.919 -5.068 437 2HG1 VAL 969 2HG1 VAL 969 -3.589 -6.223 -5.114 438 3HG1 VAL 969 3HG1 VAL 969 -3.329 -4.805 -4.071 439 1HG2 VAL 969 1HG2 VAL 969 -1.152 -3.355 -6.037 440 2HG2 VAL 969 2HG2 VAL 969 -2.606 -2.329 -5.975 441 3HG2 VAL 969 3HG2 VAL 969 -2.141 -3.302 -4.558 442 H ASP 970 H ASP 970 -3.657 -5.437 -9.082 443 HA ASP 970 HA ASP 970 -5.303 -7.507 -8.605 444 1HB ASP 970 1HB ASP 970 -5.229 -5.848 -10.588 445 2HB ASP 970 2HB ASP 970 -4.087 -6.942 -11.343 446 H GLU 971 H GLU 971 -1.926 -7.500 -9.816 447 HA GLU 971 HA GLU 971 -1.978 -10.249 -10.519 448 1HB GLU 971 1HB GLU 971 -0.444 -8.236 -11.362 449 2HB GLU 971 2HB GLU 971 0.581 -8.725 -10.028 450 1HG GLU 971 1HG GLU 971 0.988 -10.871 -10.943 451 2HG GLU 971 2HG GLU 971 -0.457 -10.837 -11.933 452 H SER 972 H SER 972 -1.455 -8.368 -7.608 453 HA SER 972 HA SER 972 0.029 -10.460 -6.335 454 1HB SER 972 1HB SER 972 -0.276 -7.686 -5.946 455 2HB SER 972 2HB SER 972 -1.081 -8.398 -4.561 456 HG SER 972 HG SER 972 0.847 -9.580 -4.064 457 H LEU 973 H LEU 973 -3.308 -9.305 -6.653 458 HA LEU 973 HA LEU 973 -4.560 -10.192 -4.453 459 1HB LEU 973 1HB LEU 973 -5.253 -9.482 -7.068 460 2HB LEU 973 2HB LEU 973 -5.990 -11.053 -6.821 461 HG LEU 973 HG LEU 973 -6.659 -8.432 -5.646 462 1HD1 LEU 973 1HD1 LEU 973 -8.904 -9.720 -5.445 463 2HD1 LEU 973 2HD1 LEU 973 -8.285 -9.288 -7.057 464 3HD1 LEU 973 3HD1 LEU 973 -8.095 -10.949 -6.447 465 1HD2 LEU 973 1HD2 LEU 973 -7.697 -9.734 -3.623 466 2HD2 LEU 973 2HD2 LEU 973 -6.358 -10.868 -3.924 467 3HD2 LEU 973 3HD2 LEU 973 -6.014 -9.159 -3.562 468 HA PRO 974 HA PRO 974 -4.362 -14.644 -6.028 469 1HB PRO 974 1HB PRO 974 -2.782 -15.277 -8.166 470 2HB PRO 974 2HB PRO 974 -4.500 -14.964 -8.304 471 1HG PRO 974 1HG PRO 974 -2.233 -13.228 -9.067 472 2HG PRO 974 2HG PRO 974 -3.908 -13.131 -9.572 473 1HD PRO 974 1HD PRO 974 -2.598 -11.465 -7.639 474 2HD PRO 974 2HD PRO 974 -4.299 -11.444 -8.059 475 H VAL 975 H VAL 975 -1.384 -12.857 -6.349 476 HA VAL 975 HA VAL 975 0.422 -14.775 -5.687 477 HB VAL 975 HB VAL 975 0.207 -11.845 -5.052 478 1HG1 VAL 975 1HG1 VAL 975 2.202 -13.806 -4.016 479 2HG1 VAL 975 2HG1 VAL 975 2.817 -12.244 -4.607 480 3HG1 VAL 975 3HG1 VAL 975 1.606 -12.288 -3.303 481 1HG2 VAL 975 1HG2 VAL 975 1.726 -11.541 -6.822 482 2HG2 VAL 975 2HG2 VAL 975 2.232 -13.248 -6.803 483 3HG2 VAL 975 3HG2 VAL 975 0.616 -12.805 -7.405 484 H LEU 976 H LEU 976 -2.115 -13.349 -3.687 485 HA LEU 976 HA LEU 976 -1.002 -14.768 -1.371 486 1HB LEU 976 1HB LEU 976 -2.996 -12.499 -1.431 487 2HB LEU 976 2HB LEU 976 -2.339 -13.271 -0.001 488 HG LEU 976 HG LEU 976 -1.187 -11.230 -0.226 489 1HD1 LEU 976 1HD1 LEU 976 1.161 -11.900 -0.679 490 2HD1 LEU 976 2HD1 LEU 976 0.291 -13.031 0.385 491 3HD1 LEU 976 3HD1 LEU 976 0.563 -13.447 -1.324 492 1HD2 LEU 976 1HD2 LEU 976 -1.868 -10.866 -2.619 493 2HD2 LEU 976 2HD2 LEU 976 -0.212 -10.355 -2.214 494 3HD2 LEU 976 3HD2 LEU 976 -0.483 -11.876 -3.097 495 HA PRO 977 HA PRO 977 -4.347 -17.485 -1.655 496 1HB PRO 977 1HB PRO 977 -4.359 -18.535 0.868 497 2HB PRO 977 2HB PRO 977 -3.256 -19.066 -0.386 498 1HG PRO 977 1HG PRO 977 -2.709 -17.354 1.961 499 2HG PRO 977 2HG PRO 977 -1.575 -18.232 0.955 500 1HD PRO 977 1HD PRO 977 -2.101 -15.413 0.890 501 2HD PRO 977 2HD PRO 977 -1.053 -16.309 -0.192 502 H ALA 978 H ALA 978 -6.546 -18.009 -1.006 503 HA ALA 978 HA ALA 978 -7.976 -15.677 -0.546 504 1HB ALA 978 1HB ALA 978 -9.712 -17.038 -1.029 505 2HB ALA 978 2HB ALA 978 -8.494 -18.314 -1.264 506 3HB ALA 978 3HB ALA 978 -9.318 -18.148 0.305 507 H SER 979 H SER 979 -8.166 -14.452 1.255 508 HA SER 979 HA SER 979 -9.048 -15.170 3.618 509 1HB SER 979 1HB SER 979 -6.715 -15.227 4.950 510 2HB SER 979 2HB SER 979 -7.490 -16.690 4.374 511 HG SER 979 HG SER 979 -5.052 -16.035 3.830 512 H THR 980 H THR 980 -6.715 -13.328 1.724 513 HA THR 980 HA THR 980 -7.134 -11.028 3.520 514 HB THR 980 HB THR 980 -4.775 -11.894 3.463 515 HG1 THR 980 HG1 THR 980 -3.978 -9.727 2.614 516 1HG2 THR 980 1HG2 THR 980 -5.084 -11.261 0.485 517 2HG2 THR 980 2HG2 THR 980 -3.505 -11.385 1.296 518 3HG2 THR 980 3HG2 THR 980 -4.572 -12.806 1.205 519 H HIS 981 H HIS 981 -9.015 -11.898 1.498 520 HA HIS 981 HA HIS 981 -8.535 -10.217 -0.772 521 1HB HIS 981 1HB HIS 981 -10.714 -12.089 0.105 522 2HB HIS 981 2HB HIS 981 -11.029 -10.942 -1.182 523 HD1 HIS 981 HD1 HIS 981 -11.167 -13.807 -2.006 524 HD2 HIS 981 HD2 HIS 981 -7.554 -11.676 -2.001 525 HE1 HIS 981 HE1 HIS 981 -9.612 -15.033 -3.615 526 H ARG 982 H ARG 982 -11.475 -10.365 1.340 527 HA ARG 982 HA ARG 982 -12.461 -7.987 0.860 528 1HB ARG 982 1HB ARG 982 -13.445 -9.614 2.463 529 2HB ARG 982 2HB ARG 982 -12.193 -9.253 3.634 530 1HG ARG 982 1HG ARG 982 -13.880 -7.851 4.416 531 2HG ARG 982 2HG ARG 982 -13.050 -6.744 3.341 532 1HD ARG 982 1HD ARG 982 -14.783 -7.914 1.561 533 2HD ARG 982 2HD ARG 982 -15.731 -8.042 3.029 534 HE ARG 982 HE ARG 982 -14.676 -5.401 2.932 535 1HH1 ARG 982 2HH2 ARG 982 -16.947 -7.414 1.151 536 2HH1 ARG 982 1HH2 ARG 982 -17.909 -6.077 0.614 537 1HH2 ARG 982 2HH1 ARG 982 -15.944 -3.636 2.224 538 2HH2 ARG 982 1HH1 ARG 982 -17.334 -3.913 1.228 539 H GLU 983 H GLU 983 -10.267 -8.506 3.731 540 HA GLU 983 HA GLU 983 -9.912 -5.987 4.484 541 1HB GLU 983 1HB GLU 983 -8.421 -8.473 4.713 542 2HB GLU 983 2HB GLU 983 -7.302 -7.129 4.600 543 1HG GLU 983 1HG GLU 983 -7.706 -6.662 6.780 544 2HG GLU 983 2HG GLU 983 -9.349 -6.229 6.350 545 H ILE 984 H ILE 984 -7.993 -7.651 1.888 546 HA ILE 984 HA ILE 984 -6.411 -5.438 1.268 547 HB ILE 984 HB ILE 984 -7.187 -7.967 -0.134 548 1HG1 ILE 984 1HG1 ILE 984 -4.566 -6.862 0.916 549 2HG1 ILE 984 2HG1 ILE 984 -5.559 -8.082 1.688 550 1HG2 ILE 984 1HG2 ILE 984 -5.672 -7.412 -1.980 551 2HG2 ILE 984 2HG2 ILE 984 -7.066 -6.307 -1.914 552 3HG2 ILE 984 3HG2 ILE 984 -5.475 -5.768 -1.325 553 1HD1 ILE 984 1HD1 ILE 984 -3.857 -8.299 -0.787 554 2HD1 ILE 984 2HD1 ILE 984 -4.046 -9.446 0.561 555 3HD1 ILE 984 3HD1 ILE 984 -5.316 -9.313 -0.679 556 H GLU 985 H GLU 985 -9.659 -6.494 0.161 557 HA GLU 985 HA GLU 985 -9.837 -4.646 -1.909 558 1HB GLU 985 1HB GLU 985 -11.528 -6.615 -0.620 559 2HB GLU 985 2HB GLU 985 -12.452 -5.146 -0.859 560 1HG GLU 985 1HG GLU 985 -11.092 -5.372 -3.279 561 2HG GLU 985 2HG GLU 985 -11.386 -7.051 -2.869 562 H MET 986 H MET 986 -10.429 -4.456 1.603 563 HA MET 986 HA MET 986 -11.774 -1.960 1.400 564 1HB MET 986 1HB MET 986 -10.720 -3.756 3.611 565 2HB MET 986 2HB MET 986 -11.139 -2.105 4.021 566 1HG MET 986 1HG MET 986 -13.376 -2.746 2.618 567 2HG MET 986 2HG MET 986 -12.929 -4.358 3.141 568 1HE MET 986 1HE MET 986 -14.125 -0.699 5.392 569 2HE MET 986 2HE MET 986 -14.118 -1.094 3.657 570 3HE MET 986 3HE MET 986 -15.449 -1.662 4.694 571 H ALA 987 H ALA 987 -8.438 -3.088 1.708 572 HA ALA 987 HA ALA 987 -7.432 -0.605 2.708 573 1HB ALA 987 1HB ALA 987 -6.541 -3.251 2.490 574 2HB ALA 987 2HB ALA 987 -5.509 -2.346 1.356 575 3HB ALA 987 3HB ALA 987 -5.594 -1.859 3.066 576 H GLN 988 H GLN 988 -8.486 -1.834 -0.361 577 HA GLN 988 HA GLN 988 -6.733 -0.161 -1.870 578 1HB GLN 988 1HB GLN 988 -9.072 -1.967 -2.573 579 2HB GLN 988 2HB GLN 988 -8.328 -0.935 -3.778 580 1HG GLN 988 1HG GLN 988 -6.263 -2.348 -2.275 581 2HG GLN 988 2HG GLN 988 -7.432 -3.494 -2.899 582 1HE2 GLN 988 1HE2 GLN 988 -7.691 -3.793 -5.075 583 2HE2 GLN 988 2HE2 GLN 988 -6.606 -3.171 -6.274 584 H LYS 989 H LYS 989 -10.221 -0.229 -0.917 585 HA LYS 989 HA LYS 989 -10.896 2.110 -2.334 586 1HB LYS 989 1HB LYS 989 -12.163 0.274 -0.400 587 2HB LYS 989 2HB LYS 989 -12.750 1.923 -0.323 588 1HG LYS 989 1HG LYS 989 -13.838 1.740 -2.317 589 2HG LYS 989 2HG LYS 989 -12.439 1.043 -3.108 590 1HD LYS 989 1HD LYS 989 -13.235 -1.083 -2.885 591 2HD LYS 989 2HD LYS 989 -13.645 -0.843 -1.198 592 1HE LYS 989 1HE LYS 989 -15.537 0.732 -2.566 593 2HE LYS 989 2HE LYS 989 -15.376 -0.688 -3.580 594 1HZ LYS 989 1HZ LYS 989 -16.456 -1.871 -2.088 595 2HZ LYS 989 2HZ LYS 989 -15.480 -1.409 -0.863 596 3HZ LYS 989 3HZ LYS 989 -16.780 -0.503 -1.256 597 H LEU 990 H LEU 990 -9.595 1.446 0.934 598 HA LEU 990 HA LEU 990 -10.024 4.025 1.952 599 1HB LEU 990 1HB LEU 990 -8.953 1.561 2.814 600 2HB LEU 990 2HB LEU 990 -7.695 2.755 3.063 601 HG LEU 990 HG LEU 990 -10.486 3.329 4.016 602 1HD1 LEU 990 1HD1 LEU 990 -8.946 2.241 6.166 603 2HD1 LEU 990 2HD1 LEU 990 -10.516 1.704 5.522 604 3HD1 LEU 990 3HD1 LEU 990 -9.006 1.052 4.842 605 1HD2 LEU 990 1HD2 LEU 990 -9.181 5.210 4.293 606 2HD2 LEU 990 2HD2 LEU 990 -9.000 4.409 5.873 607 3HD2 LEU 990 3HD2 LEU 990 -7.710 4.274 4.653 608 H LEU 991 H LEU 991 -7.370 2.521 0.052 609 HA LEU 991 HA LEU 991 -5.540 4.594 0.310 610 1HB LEU 991 1HB LEU 991 -5.151 2.289 -0.570 611 2HB LEU 991 2HB LEU 991 -5.944 2.764 -2.059 612 HG LEU 991 HG LEU 991 -4.220 4.373 -2.558 613 1HD1 LEU 991 1HD1 LEU 991 -3.479 5.416 -0.675 614 2HD1 LEU 991 2HD1 LEU 991 -3.432 3.915 0.281 615 3HD1 LEU 991 3HD1 LEU 991 -2.145 4.260 -0.899 616 1HD2 LEU 991 1HD2 LEU 991 -3.625 2.292 -3.408 617 2HD2 LEU 991 2HD2 LEU 991 -2.173 2.797 -2.510 618 3HD2 LEU 991 3HD2 LEU 991 -3.293 1.612 -1.796 619 H ASN 992 H ASN 992 -8.004 3.987 -2.292 620 HA ASN 992 HA ASN 992 -7.465 6.258 -3.714 621 1HB ASN 992 1HB ASN 992 -9.428 4.179 -3.715 622 2HB ASN 992 2HB ASN 992 -10.339 5.676 -3.688 623 1HD2 ASN 992 1HD2 ASN 992 -10.684 4.260 -5.838 624 2HD2 ASN 992 2HD2 ASN 992 -9.843 4.872 -7.223 625 H SER 993 H SER 993 -10.117 5.646 -1.277 626 HA SER 993 HA SER 993 -11.260 8.049 -1.197 627 1HB SER 993 1HB SER 993 -11.788 5.951 0.181 628 2HB SER 993 2HB SER 993 -10.572 6.484 1.325 629 HG SER 993 HG SER 993 -12.553 8.384 0.567 630 H ASP 994 H ASP 994 -8.474 7.054 0.935 631 HA ASP 994 HA ASP 994 -8.098 9.494 2.092 632 1HB ASP 994 1HB ASP 994 -5.904 7.516 1.318 633 2HB ASP 994 2HB ASP 994 -5.819 8.697 2.610 634 H LEU 995 H LEU 995 -6.638 8.037 -0.899 635 HA LEU 995 HA LEU 995 -4.841 9.993 -1.540 636 1HB LEU 995 1HB LEU 995 -6.254 7.835 -2.894 637 2HB LEU 995 2HB LEU 995 -5.897 9.171 -3.971 638 HG LEU 995 HG LEU 995 -4.211 7.165 -3.616 639 1HD1 LEU 995 1HD1 LEU 995 -3.684 8.769 -5.221 640 2HD1 LEU 995 2HD1 LEU 995 -3.599 10.085 -4.025 641 3HD1 LEU 995 3HD1 LEU 995 -2.317 8.851 -4.084 642 1HD2 LEU 995 1HD2 LEU 995 -2.862 8.982 -1.693 643 2HD2 LEU 995 2HD2 LEU 995 -4.195 7.987 -1.061 644 3HD2 LEU 995 3HD2 LEU 995 -2.800 7.210 -1.847 645 H ALA 996 H ALA 996 -8.304 9.788 -2.632 646 HA ALA 996 HA ALA 996 -8.474 12.068 -4.055 647 1HB ALA 996 1HB ALA 996 -10.426 10.830 -4.008 648 2HB ALA 996 2HB ALA 996 -10.346 10.568 -2.249 649 3HB ALA 996 3HB ALA 996 -10.870 12.143 -2.891 650 H GLU 997 H GLU 997 -8.802 11.783 -0.450 651 HA GLU 997 HA GLU 997 -9.227 14.462 -0.007 652 1HB GLU 997 1HB GLU 997 -9.320 12.339 1.577 653 2HB GLU 997 2HB GLU 997 -7.663 12.770 1.953 654 1HG GLU 997 1HG GLU 997 -8.815 13.996 3.579 655 2HG GLU 997 2HG GLU 997 -8.645 15.202 2.319 656 H LEU 998 H LEU 998 -6.228 12.611 -0.566 657 HA LEU 998 HA LEU 998 -4.514 14.735 0.265 658 1HB LEU 998 1HB LEU 998 -4.125 12.162 0.154 659 2HB LEU 998 2HB LEU 998 -3.705 12.465 -1.520 660 HG LEU 998 HG LEU 998 -1.665 12.453 -0.371 661 1HD1 LEU 998 1HD1 LEU 998 -0.734 14.573 -0.783 662 2HD1 LEU 998 2HD1 LEU 998 -2.103 14.436 -1.912 663 3HD1 LEU 998 3HD1 LEU 998 -2.265 15.411 -0.432 664 1HD2 LEU 998 1HD2 LEU 998 -1.243 13.153 1.754 665 2HD2 LEU 998 2HD2 LEU 998 -2.387 14.513 1.660 666 3HD2 LEU 998 3HD2 LEU 998 -2.992 12.856 1.896 667 H ILE 999 H ILE 999 -5.680 13.418 -2.898 668 HA ILE 999 HA ILE 999 -4.229 15.094 -4.534 669 HB ILE 999 HB ILE 999 -6.988 13.924 -4.907 670 1HG1 ILE 999 1HG1 ILE 999 -5.361 12.205 -4.436 671 2HG1 ILE 999 2HG1 ILE 999 -5.794 12.148 -6.133 672 1HG2 ILE 999 1HG2 ILE 999 -5.333 15.633 -6.632 673 2HG2 ILE 999 2HG2 ILE 999 -5.875 14.122 -7.402 674 3HG2 ILE 999 3HG2 ILE 999 -7.069 15.247 -6.711 675 1HD1 ILE 999 1HD1 ILE 999 -3.273 13.386 -4.941 676 2HD1 ILE 999 2HD1 ILE 999 -3.376 11.928 -5.957 677 3HD1 ILE 999 3HD1 ILE 999 -3.733 13.526 -6.655 678 H ASN1000 H ASN1000 -7.439 15.612 -2.952 679 HA ASN1000 HA ASN1000 -7.911 18.063 -4.128 680 1HB ASN1000 1HB ASN1000 -9.406 16.470 -2.590 681 2HB ASN1000 2HB ASN1000 -8.782 17.453 -1.281 682 1HD2 ASN1000 1HD2 ASN1000 -10.301 18.800 -0.686 683 2HD2 ASN1000 2HD2 ASN1000 -11.257 19.819 -1.710 684 H LYS1001 H LYS1001 -6.438 17.118 -0.938 685 HA LYS1001 HA LYS1001 -6.041 19.497 0.235 686 1HB LYS1001 1HB LYS1001 -4.322 17.025 0.107 687 2HB LYS1001 2HB LYS1001 -3.811 18.419 1.037 688 1HG LYS1001 1HG LYS1001 -6.641 17.448 1.413 689 2HG LYS1001 2HG LYS1001 -5.352 16.484 2.106 690 1HD LYS1001 1HD LYS1001 -4.537 18.373 3.419 691 2HD LYS1001 2HD LYS1001 -5.599 19.488 2.581 692 1HE LYS1001 1HE LYS1001 -7.102 17.245 3.755 693 2HE LYS1001 2HE LYS1001 -6.172 18.099 4.970 694 1HZ LYS1001 1HZ LYS1001 -8.489 18.934 3.652 695 2HZ LYS1001 2HZ LYS1001 -7.713 19.647 4.899 696 3HZ LYS1001 3HZ LYS1001 -7.301 20.016 3.363 697 H MET1002 H MET1002 -4.335 18.203 -2.627 698 HA MET1002 HA MET1002 -2.451 20.337 -2.599 699 1HB MET1002 1HB MET1002 -1.788 18.178 -3.540 700 2HB MET1002 2HB MET1002 -3.196 18.127 -4.582 701 1HG MET1002 1HG MET1002 -1.942 20.551 -5.286 702 2HG MET1002 2HG MET1002 -0.600 19.456 -5.019 703 1HE MET1002 1HE MET1002 -3.718 20.333 -6.538 704 2HE MET1002 2HE MET1002 -3.359 20.031 -8.255 705 3HE MET1002 3HE MET1002 -4.312 18.851 -7.325 706 H LYS1003 H LYS1003 -5.481 19.494 -4.349 707 HA LYS1003 HA LYS1003 -5.400 21.410 -6.316 708 1HB LYS1003 1HB LYS1003 -7.541 19.891 -4.898 709 2HB LYS1003 2HB LYS1003 -8.038 21.275 -5.850 710 1HG LYS1003 1HG LYS1003 -6.895 20.369 -7.846 711 2HG LYS1003 2HG LYS1003 -6.252 19.035 -6.910 712 1HD LYS1003 1HD LYS1003 -8.109 17.878 -7.535 713 2HD LYS1003 2HD LYS1003 -8.984 18.861 -6.377 714 1HE LYS1003 1HE LYS1003 -10.078 20.002 -8.020 715 2HE LYS1003 2HE LYS1003 -8.595 20.311 -8.902 716 1HZ LYS1003 1HZ LYS1003 -8.900 18.507 -10.167 717 2HZ LYS1003 2HZ LYS1003 -9.550 17.597 -8.977 718 3HZ LYS1003 3HZ LYS1003 -10.472 18.692 -9.765 719 H LEU1004 H LEU1004 -6.680 21.673 -2.935 720 HA LEU1004 HA LEU1004 -7.400 24.381 -3.223 721 1HB LEU1004 1HB LEU1004 -7.422 24.275 -0.689 722 2HB LEU1004 2HB LEU1004 -8.515 23.222 -1.565 723 HG LEU1004 HG LEU1004 -6.113 21.755 -1.137 724 1HD1 LEU1004 1HD1 LEU1004 -5.701 23.499 0.641 725 2HD1 LEU1004 2HD1 LEU1004 -7.155 22.886 1.466 726 3HD1 LEU1004 3HD1 LEU1004 -5.759 21.812 1.207 727 1HD2 LEU1004 1HD2 LEU1004 -8.878 21.393 -0.993 728 2HD2 LEU1004 2HD2 LEU1004 -7.614 20.164 -0.747 729 3HD2 LEU1004 3HD2 LEU1004 -8.285 21.044 0.648 730 H ALA1005 H ALA1005 -4.534 22.743 -1.714 731 HA ALA1005 HA ALA1005 -3.215 25.037 -0.936 732 1HB ALA1005 1HB ALA1005 -2.233 22.306 -1.838 733 2HB ALA1005 2HB ALA1005 -1.163 23.544 -1.138 734 3HB ALA1005 3HB ALA1005 -2.502 22.876 -0.173 735 H GLN1006 H GLN1006 -3.945 23.854 -4.120 736 HA GLN1006 HA GLN1006 -1.711 25.057 -5.378 737 1HB GLN1006 1HB GLN1006 -3.414 23.116 -6.144 738 2HB GLN1006 2HB GLN1006 -4.246 24.467 -6.886 739 1HG GLN1006 1HG GLN1006 -2.634 23.466 -8.473 740 2HG GLN1006 2HG GLN1006 -2.179 25.116 -8.096 741 1HE2 GLN1006 1HE2 GLN1006 -1.677 21.769 -7.009 742 2HE2 GLN1006 2HE2 GLN1006 -0.003 21.918 -6.590 743 H GLN1007 H GLN1007 -4.969 26.048 -4.390 744 HA GLN1007 HA GLN1007 -4.645 28.511 -5.893 745 1HB GLN1007 1HB GLN1007 -6.802 27.104 -5.986 746 2HB GLN1007 2HB GLN1007 -7.103 27.616 -4.337 747 1HG GLN1007 1HG GLN1007 -7.482 29.844 -4.940 748 2HG GLN1007 2HG GLN1007 -6.436 29.760 -6.343 749 1HE2 GLN1007 1HE2 GLN1007 -9.516 28.663 -5.003 750 2HE2 GLN1007 2HE2 GLN1007 -10.377 28.506 -6.497 751 H TYR1008 H TYR1008 -4.749 27.120 -2.628 752 HA TYR1008 HA TYR1008 -5.089 29.585 -1.264 753 1HB TYR1008 1HB TYR1008 -4.270 26.702 -0.761 754 2HB TYR1008 2HB TYR1008 -3.858 27.856 0.492 755 HD1 TYR1008 HD1 TYR1008 -5.999 25.406 0.131 756 HD2 TYR1008 HD2 TYR1008 -6.205 29.666 0.469 757 HE1 TYR1008 HE1 TYR1008 -8.351 25.224 1.081 758 HE2 TYR1008 HE2 TYR1008 -8.556 29.470 1.417 759 HH TYR1008 HH TYR1008 -9.818 27.600 2.723 760 H VAL1009 H VAL1009 -2.334 27.843 -2.663 761 HA VAL1009 HA VAL1009 -0.218 28.666 -1.242 762 HB VAL1009 HB VAL1009 0.112 27.305 -3.115 763 1HG1 VAL1009 1HG1 VAL1009 -0.457 29.224 -5.270 764 2HG1 VAL1009 2HG1 VAL1009 -0.900 27.508 -5.113 765 3HG1 VAL1009 3HG1 VAL1009 -1.891 28.759 -4.324 766 1HG2 VAL1009 1HG2 VAL1009 1.343 29.625 -4.446 767 2HG2 VAL1009 2HG2 VAL1009 1.684 29.524 -2.702 768 3HG2 VAL1009 3HG2 VAL1009 2.089 28.158 -3.768 769 H MET1010 H MET1010 -1.823 30.638 -3.841 770 HA MET1010 HA MET1010 -0.241 32.879 -3.308 771 1HB MET1010 1HB MET1010 -1.679 32.245 -5.407 772 2HB MET1010 2HB MET1010 -3.050 32.882 -4.522 773 1HG MET1010 1HG MET1010 -1.202 34.929 -4.209 774 2HG MET1010 2HG MET1010 -0.790 34.334 -5.805 775 1HE MET1010 1HE MET1010 -3.493 35.735 -3.470 776 2HE MET1010 2HE MET1010 -4.933 35.880 -4.507 777 3HE MET1010 3HE MET1010 -4.353 34.273 -4.010 778 H THR1011 H THR1011 -0.753 32.387 -0.785 779 HA THR1011 HA THR1011 -2.362 34.600 0.053 780 HB THR1011 HB THR1011 -3.238 31.777 0.855 781 HG1 THR1011 HG1 THR1011 -5.044 32.416 -0.612 782 1HG2 THR1011 1HG2 THR1011 -3.802 33.651 2.470 783 2HG2 THR1011 2HG2 THR1011 -4.606 34.505 1.131 784 3HG2 THR1011 3HG2 THR1011 -5.242 32.943 1.700 785 H SER1012 H SER1012 -0.424 31.686 0.787 786 HA SER1012 HA SER1012 1.467 31.798 2.021 787 1HB SER1012 1HB SER1012 1.051 34.354 2.318 788 2HB SER1012 2HB SER1012 0.257 33.926 3.820 789 HG SER1012 HG SER1012 2.275 34.108 4.576 790 H LEU1013 H LEU1013 -1.785 31.267 2.667 791 HA LEU1013 HA LEU1013 -1.471 30.340 5.378 792 1HB LEU1013 1HB LEU1013 -3.877 29.520 4.857 793 2HB LEU1013 2HB LEU1013 -3.547 31.221 5.115 794 HG LEU1013 HG LEU1013 -3.646 31.680 2.750 795 1HD1 LEU1013 1HD1 LEU1013 -3.696 28.684 2.469 796 2HD1 LEU1013 2HD1 LEU1013 -4.370 29.738 1.203 797 3HD1 LEU1013 3HD1 LEU1013 -2.655 29.881 1.660 798 1HD2 LEU1013 1HD2 LEU1013 -5.769 31.804 3.756 799 2HD2 LEU1013 2HD2 LEU1013 -6.012 30.872 2.259 800 3HD2 LEU1013 3HD2 LEU1013 -5.936 30.033 3.828 801 H GLN1014 H GLN1014 -0.656 29.201 2.288 802 HA GLN1014 HA GLN1014 -1.447 26.637 2.200 803 1HB GLN1014 1HB GLN1014 1.008 26.296 1.201 804 2HB GLN1014 2HB GLN1014 -0.200 27.236 0.348 805 1HG GLN1014 1HG GLN1014 0.968 29.177 0.608 806 2HG GLN1014 2HG GLN1014 1.248 28.879 2.312 807 1HE2 GLN1014 1HE2 GLN1014 2.610 29.070 -0.727 808 2HE2 GLN1014 2HE2 GLN1014 4.149 28.331 -0.432 809 H GLN1015 H GLN1015 1.489 27.906 3.926 810 HA GLN1015 HA GLN1015 2.623 25.730 4.837 811 1HB GLN1015 1HB GLN1015 2.932 27.041 7.080 812 2HB GLN1015 2HB GLN1015 3.552 27.745 5.599 813 1HG GLN1015 1HG GLN1015 1.565 29.179 5.381 814 2HG GLN1015 2HG GLN1015 0.794 28.388 6.742 815 1HE2 GLN1015 1HE2 GLN1015 0.840 30.910 7.065 816 2HE2 GLN1015 2HE2 GLN1015 2.083 31.493 8.121 817 H GLU1016 H GLU1016 -0.480 27.071 6.087 818 HA GLU1016 HA GLU1016 -0.698 25.233 8.179 819 1HB GLU1016 1HB GLU1016 -1.982 27.253 8.302 820 2HB GLU1016 2HB GLU1016 -2.692 27.000 6.720 821 1HG GLU1016 1HG GLU1016 -4.242 26.465 8.658 822 2HG GLU1016 2HG GLU1016 -4.045 25.156 7.510 823 H TYR1017 H TYR1017 -2.398 25.401 4.961 824 HA TYR1017 HA TYR1017 -3.665 22.936 5.193 825 1HB TYR1017 1HB TYR1017 -2.671 24.797 2.980 826 2HB TYR1017 2HB TYR1017 -3.395 23.269 2.522 827 HD1 TYR1017 HD1 TYR1017 -4.062 26.649 3.028 828 HD2 TYR1017 HD2 TYR1017 -5.744 22.792 3.800 829 HE1 TYR1017 HE1 TYR1017 -6.377 27.686 3.204 830 HE2 TYR1017 HE2 TYR1017 -8.053 23.841 3.974 831 HH TYR1017 HH TYR1017 -8.501 27.170 4.273 832 H LYS1018 H LYS1018 -0.311 23.749 4.547 833 HA LYS1018 HA LYS1018 0.327 21.398 3.106 834 1HB LYS1018 1HB LYS1018 1.657 23.784 4.049 835 2HB LYS1018 2HB LYS1018 2.631 22.376 4.421 836 1HG LYS1018 1HG LYS1018 3.343 22.565 2.254 837 2HG LYS1018 2HG LYS1018 1.842 21.750 1.865 838 1HD LYS1018 1HD LYS1018 0.753 23.756 1.235 839 2HD LYS1018 2HD LYS1018 1.841 24.762 2.169 840 1HE LYS1018 1HE LYS1018 3.122 25.082 0.326 841 2HE LYS1018 2HE LYS1018 3.469 23.366 0.269 842 1HZ LYS1018 1HZ LYS1018 1.002 24.500 -0.836 843 2HZ LYS1018 2HZ LYS1018 2.362 24.321 -1.722 844 3HZ LYS1018 3HZ LYS1018 1.617 23.010 -1.095 845 H LYS1019 H LYS1019 0.310 22.339 6.577 846 HA LYS1019 HA LYS1019 1.591 20.024 7.498 847 1HB LYS1019 1HB LYS1019 -0.287 21.986 8.839 848 2HB LYS1019 2HB LYS1019 0.528 20.690 9.692 849 1HG LYS1019 1HG LYS1019 1.971 22.818 8.041 850 2HG LYS1019 2HG LYS1019 1.747 22.912 9.776 851 1HD LYS1019 1HD LYS1019 3.703 21.766 9.959 852 2HD LYS1019 2HD LYS1019 2.804 20.349 9.454 853 1HE LYS1019 1HE LYS1019 3.648 20.401 7.292 854 2HE LYS1019 2HE LYS1019 3.735 22.151 7.247 855 1HZ LYS1019 1HZ LYS1019 5.750 20.339 7.892 856 2HZ LYS1019 2HZ LYS1019 5.857 21.961 7.731 857 3HZ LYS1019 3HZ LYS1019 5.500 21.306 9.184 858 H GLN1020 H GLN1020 -1.768 20.771 6.574 859 HA GLN1020 HA GLN1020 -2.934 18.582 7.815 860 1HB GLN1020 1HB GLN1020 -3.811 19.990 5.255 861 2HB GLN1020 2HB GLN1020 -4.829 18.994 6.277 862 1HG GLN1020 1HG GLN1020 -3.425 21.544 7.209 863 2HG GLN1020 2HG GLN1020 -5.098 21.471 6.692 864 1HE2 GLN1020 1HE2 GLN1020 -3.372 21.786 9.307 865 2HE2 GLN1020 2HE2 GLN1020 -4.267 20.891 10.490 866 H MET1021 H MET1021 -1.501 19.035 4.529 867 HA MET1021 HA MET1021 -2.255 16.629 3.466 868 1HB MET1021 1HB MET1021 -0.716 18.819 2.702 869 2HB MET1021 2HB MET1021 0.513 17.575 2.818 870 1HG MET1021 1HG MET1021 -1.729 16.390 1.471 871 2HG MET1021 2HG MET1021 -1.480 17.963 0.740 872 1HE MET1021 1HE MET1021 1.478 15.585 2.345 873 2HE MET1021 2HE MET1021 -0.018 14.724 1.910 874 3HE MET1021 3HE MET1021 1.464 14.470 0.958 875 H LEU1022 H LEU1022 0.581 17.462 5.531 876 HA LEU1022 HA LEU1022 1.883 15.005 5.284 877 1HB LEU1022 1HB LEU1022 2.856 17.122 6.121 878 2HB LEU1022 2HB LEU1022 1.913 16.958 7.589 879 HG LEU1022 HG LEU1022 4.296 16.271 7.808 880 1HD1 LEU1022 1HD1 LEU1022 3.800 14.752 9.407 881 2HD1 LEU1022 2HD1 LEU1022 2.133 15.247 9.030 882 3HD1 LEU1022 3HD1 LEU1022 2.802 13.759 8.318 883 1HD2 LEU1022 1HD2 LEU1022 3.818 13.676 6.462 884 2HD2 LEU1022 2HD2 LEU1022 4.041 15.086 5.398 885 3HD2 LEU1022 3HD2 LEU1022 5.296 14.660 6.586 886 H THR1023 H THR1023 -0.339 16.234 7.885 887 HA THR1023 HA THR1023 -0.468 14.117 9.517 888 HB THR1023 HB THR1023 -3.044 15.404 8.558 889 HG1 THR1023 HG1 THR1023 -0.880 16.604 10.132 890 1HG2 THR1023 1HG2 THR1023 -2.003 14.187 11.012 891 2HG2 THR1023 2HG2 THR1023 -2.486 15.874 11.307 892 3HG2 THR1023 3HG2 THR1023 -3.664 14.714 10.648 893 H ALA1024 H ALA1024 -2.266 14.359 6.385 894 HA ALA1024 HA ALA1024 -3.432 11.809 6.655 895 1HB ALA1024 1HB ALA1024 -2.852 13.164 4.016 896 2HB ALA1024 2HB ALA1024 -4.276 12.214 4.504 897 3HB ALA1024 3HB ALA1024 -4.039 13.857 5.148 898 H ALA1025 H ALA1025 -0.529 13.033 4.855 899 HA ALA1025 HA ALA1025 0.236 10.717 3.643 900 1HB ALA1025 1HB ALA1025 1.403 12.717 3.146 901 2HB ALA1025 2HB ALA1025 1.788 13.020 4.858 902 3HB ALA1025 3HB ALA1025 2.601 11.700 3.983 903 H HIS1026 H HIS1026 0.216 11.520 7.074 904 HA HIS1026 HA HIS1026 2.113 9.562 7.831 905 1HB HIS1026 1HB HIS1026 1.124 11.708 9.056 906 2HB HIS1026 2HB HIS1026 -0.007 10.536 9.704 907 HD1 HIS1026 HD1 HIS1026 2.573 12.147 11.081 908 HD2 HIS1026 HD2 HIS1026 2.137 8.056 10.260 909 HE1 HIS1026 HE1 HIS1026 4.170 10.928 12.653 910 H ALA1027 H ALA1027 -1.503 9.720 8.234 911 HA ALA1027 HA ALA1027 -1.700 7.005 8.943 912 1HB ALA1027 1HB ALA1027 -3.907 8.671 7.705 913 2HB ALA1027 2HB ALA1027 -4.029 7.409 8.953 914 3HB ALA1027 3HB ALA1027 -3.315 8.989 9.353 915 H LEU1028 H LEU1028 -1.691 8.782 5.849 916 HA LEU1028 HA LEU1028 -2.776 6.755 4.266 917 1HB LEU1028 1HB LEU1028 -1.145 9.205 3.837 918 2HB LEU1028 2HB LEU1028 -1.202 8.036 2.533 919 HG LEU1028 HG LEU1028 -2.898 9.998 2.579 920 1HD1 LEU1028 1HD1 LEU1028 -2.844 7.902 1.094 921 2HD1 LEU1028 2HD1 LEU1028 -4.132 7.281 2.154 922 3HD1 LEU1028 3HD1 LEU1028 -4.382 8.787 1.239 923 1HD2 LEU1028 1HD2 LEU1028 -4.710 9.956 3.957 924 2HD2 LEU1028 2HD2 LEU1028 -4.673 8.187 4.147 925 3HD2 LEU1028 3HD2 LEU1028 -3.515 9.202 5.040 926 H ALA1029 H ALA1029 0.721 7.691 4.639 927 HA ALA1029 HA ALA1029 1.884 5.685 3.304 928 1HB ALA1029 1HB ALA1029 2.723 6.765 6.027 929 2HB ALA1029 2HB ALA1029 3.787 5.960 4.849 930 3HB ALA1029 3HB ALA1029 3.054 7.534 4.456 931 H VAL1030 H VAL1030 0.287 5.484 6.505 932 HA VAL1030 HA VAL1030 1.154 2.782 6.917 933 HB VAL1030 HB VAL1030 -0.586 4.771 8.322 934 1HG1 VAL1030 1HG1 VAL1030 -1.247 3.114 9.988 935 2HG1 VAL1030 2HG1 VAL1030 -1.859 2.653 8.381 936 3HG1 VAL1030 3HG1 VAL1030 -0.436 1.828 9.061 937 1HG2 VAL1030 1HG2 VAL1030 1.064 4.811 9.898 938 2HG2 VAL1030 2HG2 VAL1030 1.472 3.093 9.681 939 3HG2 VAL1030 3HG2 VAL1030 2.045 4.299 8.504 940 H ASP1031 H ASP1031 -1.889 4.485 5.950 941 HA ASP1031 HA ASP1031 -3.620 2.479 5.902 942 1HB ASP1031 1HB ASP1031 -3.116 4.795 4.041 943 2HB ASP1031 2HB ASP1031 -4.307 3.611 3.540 944 H ALA1032 H ALA1032 -1.247 3.320 3.267 945 HA ALA1032 HA ALA1032 -1.928 1.217 1.562 946 1HB ALA1032 1HB ALA1032 -0.713 2.987 0.613 947 2HB ALA1032 2HB ALA1032 0.475 3.012 1.937 948 3HB ALA1032 3HB ALA1032 0.507 1.697 0.739 949 H LYS1033 H LYS1033 0.456 1.507 4.253 950 HA LYS1033 HA LYS1033 1.793 -0.862 3.880 951 1HB LYS1033 1HB LYS1033 1.966 1.151 5.642 952 2HB LYS1033 2HB LYS1033 1.150 -0.012 6.667 953 1HG LYS1033 1HG LYS1033 3.481 -0.426 7.000 954 2HG LYS1033 2HG LYS1033 2.936 -1.724 5.956 955 1HD LYS1033 1HD LYS1033 4.472 -1.118 4.405 956 2HD LYS1033 2HD LYS1033 3.679 0.434 4.228 957 1HE LYS1033 1HE LYS1033 5.325 0.271 6.683 958 2HE LYS1033 2HE LYS1033 6.263 0.020 5.224 959 1HZ LYS1033 1HZ LYS1033 4.608 2.335 5.907 960 2HZ LYS1033 2HZ LYS1033 6.203 2.300 5.558 961 3HZ LYS1033 3HZ LYS1033 5.102 2.062 4.375 962 H ASN1034 H ASN1034 -1.295 -0.244 5.666 963 HA ASN1034 HA ASN1034 -1.686 -2.705 6.684 964 1HB ASN1034 1HB ASN1034 -3.927 -1.126 5.337 965 2HB ASN1034 2HB ASN1034 -4.053 -2.149 6.754 966 1HD2 ASN1034 1HD2 ASN1034 -4.953 0.469 6.673 967 2HD2 ASN1034 2HD2 ASN1034 -4.022 1.456 7.750 968 H LEU1035 H LEU1035 -2.487 -1.447 3.375 969 HA LEU1035 HA LEU1035 -3.888 -3.493 2.319 970 1HB LEU1035 1HB LEU1035 -3.120 -1.287 1.299 971 2HB LEU1035 2HB LEU1035 -1.648 -2.122 0.842 972 HG LEU1035 HG LEU1035 -4.192 -3.435 0.044 973 1HD1 LEU1035 1HD1 LEU1035 -5.070 -1.507 -0.728 974 2HD1 LEU1035 2HD1 LEU1035 -3.501 -0.667 -0.749 975 3HD1 LEU1035 3HD1 LEU1035 -3.935 -1.776 -2.072 976 1HD2 LEU1035 1HD2 LEU1035 -1.596 -2.896 -1.425 977 2HD2 LEU1035 2HD2 LEU1035 -1.997 -4.378 -0.524 978 3HD2 LEU1035 3HD2 LEU1035 -2.929 -3.940 -1.976 979 H LEU1036 H LEU1036 -0.257 -3.270 2.257 980 HA LEU1036 HA LEU1036 -0.033 -5.967 1.391 981 1HB LEU1036 1HB LEU1036 1.548 -3.789 1.258 982 2HB LEU1036 2HB LEU1036 2.271 -4.586 2.641 983 HG LEU1036 HG LEU1036 1.957 -6.617 0.725 984 1HD1 LEU1036 1HD1 LEU1036 2.225 -5.817 -1.331 985 2HD1 LEU1036 2HD1 LEU1036 1.886 -4.201 -0.666 986 3HD1 LEU1036 3HD1 LEU1036 3.567 -4.764 -0.824 987 1HD2 LEU1036 1HD2 LEU1036 3.854 -6.902 1.901 988 2HD2 LEU1036 2HD2 LEU1036 4.590 -6.000 0.554 989 3HD2 LEU1036 3HD2 LEU1036 4.151 -5.154 2.058 990 H ASP1037 H ASP1037 0.294 -4.228 4.534 991 HA ASP1037 HA ASP1037 1.336 -6.081 6.099 992 1HB ASP1037 1HB ASP1037 0.104 -3.763 6.585 993 2HB ASP1037 2HB ASP1037 -1.249 -4.793 7.007 994 H VAL1038 H VAL1038 -2.088 -5.922 4.924 995 HA VAL1038 HA VAL1038 -2.971 -8.177 6.370 996 HB VAL1038 HB VAL1038 -4.032 -6.821 3.883 997 1HG1 VAL1038 1HG1 VAL1038 -4.771 -9.305 4.827 998 2HG1 VAL1038 2HG1 VAL1038 -5.945 -8.224 5.616 999 3HG1 VAL1038 3HG1 VAL1038 -5.786 -8.224 3.843 1000 1HG2 VAL1038 1HG2 VAL1038 -5.505 -6.421 6.369 1001 2HG2 VAL1038 2HG2 VAL1038 -3.827 -5.840 6.484 1002 3HG2 VAL1038 3HG2 VAL1038 -4.895 -5.228 5.197 1003 H ILE1039 H ILE1039 -1.638 -7.662 3.060 1004 HA ILE1039 HA ILE1039 -2.104 -10.183 2.053 1005 HB ILE1039 HB ILE1039 -0.172 -7.987 1.532 1006 1HG1 ILE1039 1HG1 ILE1039 -2.183 -9.494 -0.165 1007 2HG1 ILE1039 2HG1 ILE1039 -2.423 -7.927 0.582 1008 1HG2 ILE1039 1HG2 ILE1039 0.373 -10.821 0.928 1009 2HG2 ILE1039 2HG2 ILE1039 0.504 -9.715 -0.460 1010 3HG2 ILE1039 3HG2 ILE1039 1.472 -9.423 1.006 1011 1HD1 ILE1039 1HD1 ILE1039 0.009 -7.668 -0.843 1012 2HD1 ILE1039 2HD1 ILE1039 -1.073 -8.582 -1.921 1013 3HD1 ILE1039 3HD1 ILE1039 -1.573 -6.992 -1.298 1014 H ASP1040 H ASP1040 0.791 -8.965 3.873 1015 HA ASP1040 HA ASP1040 2.263 -11.210 3.838 1016 1HB ASP1040 1HB ASP1040 2.218 -8.790 5.288 1017 2HB ASP1040 2HB ASP1040 2.186 -10.021 6.535 1018 H GLN1041 H GLN1041 -0.508 -10.336 5.993 1019 HA GLN1041 HA GLN1041 -0.282 -12.492 7.711 1020 1HB GLN1041 1HB GLN1041 -2.205 -10.365 7.133 1021 2HB GLN1041 2HB GLN1041 -3.033 -11.857 7.530 1022 1HG GLN1041 1HG GLN1041 -1.558 -12.060 9.590 1023 2HG GLN1041 2HG GLN1041 -0.882 -10.488 9.212 1024 1HE2 GLN1041 1HE2 GLN1041 -3.968 -12.175 9.700 1025 2HE2 GLN1041 2HE2 GLN1041 -4.816 -10.876 10.471 1026 H ALA1042 H ALA1042 -1.341 -12.273 4.391 1027 HA ALA1042 HA ALA1042 -2.986 -14.626 4.492 1028 1HB ALA1042 1HB ALA1042 -1.898 -13.546 1.923 1029 2HB ALA1042 2HB ALA1042 -3.553 -14.051 2.342 1030 3HB ALA1042 3HB ALA1042 -2.943 -12.468 2.880 1031 H ARG1043 H ARG1043 0.221 -13.735 3.024 1032 HA ARG1043 HA ARG1043 0.887 -16.116 2.020 1033 1HB ARG1043 1HB ARG1043 2.605 -14.042 3.452 1034 2HB ARG1043 2HB ARG1043 3.324 -15.433 2.667 1035 1HG ARG1043 1HG ARG1043 1.596 -14.496 0.697 1036 2HG ARG1043 2HG ARG1043 2.109 -13.006 1.463 1037 1HD ARG1043 1HD ARG1043 4.021 -15.170 0.455 1038 2HD ARG1043 2HD ARG1043 3.610 -13.720 -0.440 1039 HE ARG1043 HE ARG1043 4.524 -13.039 2.220 1040 1HH1 ARG1043 2HH2 ARG1043 5.679 -14.068 -0.940 1041 2HH1 ARG1043 1HH2 ARG1043 7.247 -13.362 -0.739 1042 1HH2 ARG1043 2HH1 ARG1043 6.593 -12.107 2.487 1043 2HH2 ARG1043 1HH1 ARG1043 7.771 -12.239 1.224 1044 H LEU1044 H LEU1044 1.769 -14.971 5.370 1045 HA LEU1044 HA LEU1044 2.910 -17.289 6.268 1046 1HB LEU1044 1HB LEU1044 2.234 -16.469 8.535 1047 2HB LEU1044 2HB LEU1044 3.142 -15.346 7.542 1048 HG LEU1044 HG LEU1044 0.682 -14.507 6.902 1049 1HD1 LEU1044 1HD1 LEU1044 -0.830 -15.700 8.079 1050 2HD1 LEU1044 2HD1 LEU1044 0.332 -16.131 9.356 1051 3HD1 LEU1044 3HD1 LEU1044 -0.435 -14.525 9.356 1052 1HD2 LEU1044 1HD2 LEU1044 2.680 -13.740 8.912 1053 2HD2 LEU1044 2HD2 LEU1044 1.845 -12.762 7.681 1054 3HD2 LEU1044 3HD2 LEU1044 1.046 -13.110 9.234 1055 H LYS1045 H LYS1045 -0.578 -16.335 6.275 1056 HA LYS1045 HA LYS1045 -1.573 -18.480 7.660 1057 1HB LYS1045 1HB LYS1045 -3.171 -16.903 7.275 1058 2HB LYS1045 2HB LYS1045 -2.615 -16.555 5.650 1059 1HG LYS1045 1HG LYS1045 -3.889 -19.237 6.292 1060 2HG LYS1045 2HG LYS1045 -4.892 -17.835 5.974 1061 1HD LYS1045 1HD LYS1045 -3.192 -17.631 3.854 1062 2HD LYS1045 2HD LYS1045 -3.110 -19.363 4.103 1063 1HE LYS1045 1HE LYS1045 -5.872 -18.267 4.214 1064 2HE LYS1045 2HE LYS1045 -5.089 -18.054 2.661 1065 1HZ LYS1045 1HZ LYS1045 -4.672 -20.642 3.758 1066 2HZ LYS1045 2HZ LYS1045 -6.254 -20.314 3.520 1067 3HZ LYS1045 3HZ LYS1045 -5.203 -20.216 2.273 1068 H MET1046 H MET1046 -0.145 -18.341 4.443 1069 HA MET1046 HA MET1046 -1.189 -20.973 3.849 1070 1HB MET1046 1HB MET1046 -1.206 -19.969 1.776 1071 2HB MET1046 2HB MET1046 -0.215 -18.640 2.344 1072 1HG MET1046 1HG MET1046 1.836 -19.855 1.924 1073 2HG MET1046 2HG MET1046 0.983 -21.372 1.716 1074 1HE MET1046 1HE MET1046 0.521 -17.752 -1.052 1075 2HE MET1046 2HE MET1046 0.670 -17.768 0.722 1076 3HE MET1046 3HE MET1046 2.110 -18.015 -0.295 1077 H ILE1047 H ILE1047 1.863 -19.226 4.559 1078 HA ILE1047 HA ILE1047 3.539 -21.441 4.006 1079 HB ILE1047 HB ILE1047 3.840 -18.777 5.332 1080 1HG1 ILE1047 1HG1 ILE1047 5.526 -19.900 3.112 1081 2HG1 ILE1047 2HG1 ILE1047 3.899 -19.347 2.768 1082 1HG2 ILE1047 1HG2 ILE1047 5.529 -21.149 5.800 1083 2HG2 ILE1047 2HG2 ILE1047 6.405 -19.683 5.300 1084 3HG2 ILE1047 3HG2 ILE1047 5.359 -19.647 6.739 1085 1HD1 ILE1047 1HD1 ILE1047 6.318 -17.778 3.423 1086 2HD1 ILE1047 2HD1 ILE1047 4.843 -17.283 2.559 1087 3HD1 ILE1047 3HD1 ILE1047 4.877 -17.275 4.338 1088 H SER1048 H SER1048 2.392 -19.929 7.108 1089 HA SER1048 HA SER1048 3.199 -22.361 8.441 1090 1HB SER1048 1HB SER1048 3.739 -20.003 9.311 1091 2HB SER1048 2HB SER1048 2.037 -19.840 9.693 1092 HG SER1048 HG SER1048 3.683 -22.011 10.672 1093 H GLN1049 H GLN1049 1.546 -23.819 7.682 1094 HA GLN1049 HA GLN1049 -0.658 -24.018 9.259 1095 1HB GLN1049 1HB GLN1049 -1.111 -21.954 7.428 1096 2HB GLN1049 2HB GLN1049 -1.903 -23.324 6.675 1097 1HG GLN1049 1HG GLN1049 -3.657 -22.826 8.049 1098 2HG GLN1049 2HG GLN1049 -2.723 -23.631 9.295 1099 1HE2 GLN1049 1HE2 GLN1049 -2.598 -22.552 11.095 1100 2HE2 GLN1049 2HE2 GLN1049 -2.514 -20.834 11.296 1101 H SER1050 H SER1050 0.842 -26.005 8.838 1102 HA SER1050 HA SER1050 1.301 -27.902 7.837 1103 1HB SER1050 1HB SER1050 -1.721 -27.924 7.419 1104 2HB SER1050 2HB SER1050 -0.689 -29.340 7.427 1105 HG SER1050 HG SER1050 -1.573 -29.164 9.498 1106 H ARG1051 H ARG1051 2.187 -26.248 6.030 1107 HA ARG1051 HA ARG1051 0.705 -26.561 3.586 1108 1HB ARG1051 1HB ARG1051 1.810 -24.363 4.282 1109 2HB ARG1051 2HB ARG1051 3.368 -25.130 4.053 1110 1HG ARG1051 1HG ARG1051 2.465 -25.727 1.649 1111 2HG ARG1051 2HG ARG1051 1.261 -24.492 1.962 1112 1HD ARG1051 1HD ARG1051 2.768 -22.901 1.375 1113 2HD ARG1051 2HD ARG1051 3.760 -23.353 2.747 1114 HE ARG1051 HE ARG1051 4.254 -25.271 0.717 1115 1HH1 ARG1051 2HH2 ARG1051 4.712 -21.821 1.232 1116 2HH1 ARG1051 1HH2 ARG1051 6.097 -21.720 0.196 1117 1HH2 ARG1051 2HH1 ARG1051 6.081 -25.140 -0.649 1118 2HH2 ARG1051 1HH1 ARG1051 6.881 -23.621 -0.881 1119 HA PRO1052 HA PRO1052 3.332 -29.992 2.670 1120 1HB PRO1052 1HB PRO1052 1.981 -30.878 0.466 1121 2HB PRO1052 2HB PRO1052 1.558 -31.345 2.102 1122 1HG PRO1052 1HG PRO1052 0.190 -29.436 0.306 1123 2HG PRO1052 2HG PRO1052 -0.428 -30.228 1.742 1124 1HD PRO1052 1HD PRO1052 0.449 -27.505 1.526 1125 2HD PRO1052 2HD PRO1052 -0.059 -28.330 2.986 1126 H HIS1053 H HIS1053 5.051 -30.542 1.311 1127 HA HIS1053 HA HIS1053 5.683 -28.302 -0.426 1128 1HB HIS1053 1HB HIS1053 7.249 -29.229 1.377 1129 2HB HIS1053 2HB HIS1053 7.484 -30.610 0.325 1130 HD1 HIS1053 HD1 HIS1053 7.378 -26.878 -0.571 1131 HD2 HIS1053 HD2 HIS1053 9.944 -30.189 -0.784 1132 HE1 HIS1053 HE1 HIS1053 9.453 -26.094 -1.831 Start of MODEL 25 1 H MET 915 H MET 915 6.524 -24.878 -5.023 2 HA MET 915 HA MET 915 8.008 -23.516 -3.546 3 1HB MET 915 1HB MET 915 8.554 -25.866 -5.209 4 2HB MET 915 2HB MET 915 10.045 -24.981 -4.952 5 1HG MET 915 1HG MET 915 9.456 -24.943 -2.442 6 2HG MET 915 2HG MET 915 8.161 -26.066 -2.809 7 1HE MET 915 1HE MET 915 9.803 -29.282 -3.844 8 2HE MET 915 2HE MET 915 8.343 -28.269 -3.733 9 3HE MET 915 3HE MET 915 9.464 -28.068 -5.101 10 H ALA 916 H ALA 916 9.397 -23.952 -6.885 11 HA ALA 916 HA ALA 916 10.697 -21.349 -6.534 12 1HB ALA 916 1HB ALA 916 11.349 -23.902 -7.962 13 2HB ALA 916 2HB ALA 916 11.918 -22.379 -8.686 14 3HB ALA 916 3HB ALA 916 12.405 -22.814 -7.031 15 H ASN 917 H ASN 917 8.257 -20.661 -6.926 16 HA ASN 917 HA ASN 917 7.545 -20.820 -9.696 17 1HB ASN 917 1HB ASN 917 5.559 -19.404 -8.905 18 2HB ASN 917 2HB ASN 917 5.710 -20.959 -8.111 19 1HD2 ASN 917 1HD2 ASN 917 4.307 -18.783 -7.073 20 2HD2 ASN 917 2HD2 ASN 917 5.062 -18.240 -5.611 21 H LEU 918 H LEU 918 7.112 -18.774 -10.972 22 HA LEU 918 HA LEU 918 8.816 -16.569 -10.040 23 1HB LEU 918 1HB LEU 918 8.521 -17.881 -12.710 24 2HB LEU 918 2HB LEU 918 8.896 -16.171 -12.641 25 HG LEU 918 HG LEU 918 10.853 -16.813 -11.112 26 1HD1 LEU 918 1HD1 LEU 918 9.927 -19.526 -12.002 27 2HD1 LEU 918 2HD1 LEU 918 11.657 -19.219 -11.717 28 3HD1 LEU 918 3HD1 LEU 918 10.481 -18.978 -10.402 29 1HD2 LEU 918 1HD2 LEU 918 12.002 -16.358 -12.951 30 2HD2 LEU 918 2HD2 LEU 918 11.739 -18.016 -13.543 31 3HD2 LEU 918 3HD2 LEU 918 10.572 -16.732 -13.941 32 H ASP 919 H ASP 919 5.992 -17.010 -9.376 33 HA ASP 919 HA ASP 919 4.257 -15.738 -11.028 34 1HB ASP 919 1HB ASP 919 4.331 -16.633 -8.314 35 2HB ASP 919 2HB ASP 919 3.757 -14.978 -8.256 36 H ARG 920 H ARG 920 3.210 -13.460 -10.532 37 HA ARG 920 HA ARG 920 4.820 -11.483 -11.139 38 1HB ARG 920 1HB ARG 920 2.265 -11.451 -10.740 39 2HB ARG 920 2HB ARG 920 2.615 -11.100 -9.059 40 1HG ARG 920 1HG ARG 920 2.251 -8.976 -10.155 41 2HG ARG 920 2HG ARG 920 3.968 -9.087 -9.824 42 1HD ARG 920 1HD ARG 920 3.503 -8.264 -12.146 43 2HD ARG 920 2HD ARG 920 4.438 -9.747 -12.145 44 HE ARG 920 HE ARG 920 1.558 -10.237 -12.269 45 1HH1 ARG 920 2HH2 ARG 920 4.432 -9.508 -14.209 46 2HH1 ARG 920 1HH2 ARG 920 3.769 -10.171 -15.666 47 1HH2 ARG 920 1HH1 ARG 920 1.564 -11.107 -15.632 48 H SER 921 H SER 921 6.895 -11.350 -10.199 49 HA SER 921 HA SER 921 7.810 -11.851 -7.849 50 1HB SER 921 1HB SER 921 8.441 -9.855 -9.862 51 2HB SER 921 2HB SER 921 8.792 -9.200 -8.275 52 HG SER 921 HG SER 921 10.546 -10.410 -8.237 53 H ASN 922 H ASN 922 6.897 -11.646 -5.833 54 HA ASN 922 HA ASN 922 4.953 -9.855 -5.192 55 1HB ASN 922 1HB ASN 922 7.011 -10.935 -3.204 56 2HB ASN 922 2HB ASN 922 5.342 -10.517 -2.869 57 1HD2 ASN 922 1HD2 ASN 922 4.752 -12.496 -2.123 58 2HD2 ASN 922 2HD2 ASN 922 4.604 -13.913 -3.108 59 H ASP 923 H ASP 923 8.383 -9.405 -5.601 60 HA ASP 923 HA ASP 923 8.712 -7.305 -3.761 61 1HB ASP 923 1HB ASP 923 10.542 -8.759 -4.789 62 2HB ASP 923 2HB ASP 923 10.314 -7.892 -6.294 63 H LYS 924 H LYS 924 7.942 -7.635 -7.271 64 HA LYS 924 HA LYS 924 8.195 -4.953 -7.974 65 1HB LYS 924 1HB LYS 924 8.117 -6.667 -9.649 66 2HB LYS 924 2HB LYS 924 6.541 -7.216 -9.116 67 1HG LYS 924 1HG LYS 924 5.611 -5.786 -10.610 68 2HG LYS 924 2HG LYS 924 6.173 -4.460 -9.611 69 1HD LYS 924 1HD LYS 924 7.792 -3.882 -11.107 70 2HD LYS 924 2HD LYS 924 8.352 -5.536 -11.262 71 1HE LYS 924 1HE LYS 924 6.122 -5.864 -12.677 72 2HE LYS 924 2HE LYS 924 6.183 -4.120 -12.833 73 1HZ LYS 924 1HZ LYS 924 7.579 -4.528 -14.480 74 2HZ LYS 924 2HZ LYS 924 8.709 -4.885 -13.356 75 3HZ LYS 924 3HZ LYS 924 7.836 -6.081 -14.044 76 H VAL 925 H VAL 925 5.431 -6.841 -6.631 77 HA VAL 925 HA VAL 925 3.621 -4.671 -6.792 78 HB VAL 925 HB VAL 925 3.669 -7.276 -5.268 79 1HG1 VAL 925 1HG1 VAL 925 2.048 -6.504 -3.942 80 2HG1 VAL 925 2HG1 VAL 925 1.980 -4.961 -4.827 81 3HG1 VAL 925 3HG1 VAL 925 1.017 -6.350 -5.385 82 1HG2 VAL 925 1HG2 VAL 925 3.280 -6.816 -7.933 83 2HG2 VAL 925 2HG2 VAL 925 2.602 -8.194 -7.033 84 3HG2 VAL 925 3HG2 VAL 925 1.610 -6.744 -7.321 85 H TYR 926 H TYR 926 5.755 -6.022 -4.207 86 HA TYR 926 HA TYR 926 4.872 -4.284 -2.192 87 1HB TYR 926 1HB TYR 926 7.139 -6.143 -2.879 88 2HB TYR 926 2HB TYR 926 7.559 -4.924 -1.692 89 HD1 TYR 926 HD1 TYR 926 4.352 -6.804 -2.190 90 HD2 TYR 926 HD2 TYR 926 7.696 -6.022 0.361 91 HE1 TYR 926 HE1 TYR 926 3.294 -8.215 -0.359 92 HE2 TYR 926 HE2 TYR 926 6.627 -7.436 2.184 93 HH TYR 926 HH TYR 926 5.057 -8.961 2.586 94 H GLU 927 H GLU 927 6.984 -3.827 -4.968 95 HA GLU 927 HA GLU 927 8.467 -1.713 -3.872 96 1HB GLU 927 1HB GLU 927 7.986 -2.812 -6.640 97 2HB GLU 927 2HB GLU 927 8.748 -1.241 -6.488 98 1HG GLU 927 1HG GLU 927 9.817 -3.437 -4.734 99 2HG GLU 927 2HG GLU 927 10.155 -3.563 -6.449 100 H ASN 928 H ASN 928 5.972 -1.621 -6.526 101 HA ASN 928 HA ASN 928 5.610 1.023 -6.609 102 1HB ASN 928 1HB ASN 928 3.328 -1.017 -6.723 103 2HB ASN 928 2HB ASN 928 3.343 0.556 -7.495 104 1HD2 ASN 928 1HD2 ASN 928 5.117 0.978 -9.044 105 2HD2 ASN 928 2HD2 ASN 928 5.630 -0.299 -10.094 106 H VAL 929 H VAL 929 4.707 -1.235 -4.060 107 HA VAL 929 HA VAL 929 2.687 0.407 -2.888 108 HB VAL 929 HB VAL 929 4.191 -2.076 -2.114 109 1HG1 VAL 929 1HG1 VAL 929 3.938 -1.578 0.056 110 2HG1 VAL 929 2HG1 VAL 929 2.900 -0.177 -0.301 111 3HG1 VAL 929 3HG1 VAL 929 2.193 -1.807 -0.206 112 1HG2 VAL 929 1HG2 VAL 929 2.070 -1.815 -3.714 113 2HG2 VAL 929 2HG2 VAL 929 2.265 -3.205 -2.619 114 3HG2 VAL 929 3HG2 VAL 929 1.212 -1.847 -2.155 115 H THR 930 H THR 930 5.962 -0.628 -1.683 116 HA THR 930 HA THR 930 6.067 1.412 0.253 117 HB THR 930 HB THR 930 7.352 -0.673 0.446 118 HG1 THR 930 HG1 THR 930 8.306 1.348 1.258 119 1HG2 THR 930 1HG2 THR 930 8.835 -1.473 -1.150 120 2HG2 THR 930 2HG2 THR 930 7.801 -0.540 -2.259 121 3HG2 THR 930 3HG2 THR 930 9.321 0.163 -1.655 122 H GLY 931 H GLY 931 7.502 1.157 -3.057 123 1HA GLY 931 1HA GLY 931 8.960 3.477 -3.099 124 2HA GLY 931 2HA GLY 931 8.143 2.776 -4.482 125 H LEU 932 H LEU 932 5.404 3.028 -3.593 126 HA LEU 932 HA LEU 932 4.868 5.623 -4.437 127 1HB LEU 932 1HB LEU 932 3.123 4.259 -4.843 128 2HB LEU 932 2HB LEU 932 3.358 3.316 -3.385 129 HG LEU 932 HG LEU 932 2.454 6.052 -2.835 130 1HD1 LEU 932 1HD1 LEU 932 1.102 4.511 -4.933 131 2HD1 LEU 932 2HD1 LEU 932 0.032 5.005 -3.599 132 3HD1 LEU 932 3HD1 LEU 932 0.965 6.230 -4.492 133 1HD2 LEU 932 1HD2 LEU 932 2.433 3.574 -1.580 134 2HD2 LEU 932 2HD2 LEU 932 1.621 5.058 -1.026 135 3HD2 LEU 932 3HD2 LEU 932 0.727 3.863 -1.997 136 H VAL 933 H VAL 933 4.290 4.226 -1.127 137 HA VAL 933 HA VAL 933 3.793 6.631 0.108 138 HB VAL 933 HB VAL 933 4.456 5.420 2.182 139 1HG1 VAL 933 1HG1 VAL 933 2.757 3.653 0.407 140 2HG1 VAL 933 2HG1 VAL 933 2.604 3.951 2.155 141 3HG1 VAL 933 3HG1 VAL 933 2.197 5.237 0.994 142 1HG2 VAL 933 1HG2 VAL 933 5.103 3.059 2.039 143 2HG2 VAL 933 2HG2 VAL 933 5.161 3.172 0.264 144 3HG2 VAL 933 3HG2 VAL 933 6.313 4.102 1.253 145 H LYS 934 H LYS 934 6.906 5.004 -0.643 146 HA LYS 934 HA LYS 934 8.600 6.507 0.886 147 1HB LYS 934 1HB LYS 934 8.950 5.296 -1.866 148 2HB LYS 934 2HB LYS 934 10.267 6.037 -0.979 149 1HG LYS 934 1HG LYS 934 8.754 4.180 0.724 150 2HG LYS 934 2HG LYS 934 9.341 3.379 -0.720 151 1HD LYS 934 1HD LYS 934 11.328 5.173 0.595 152 2HD LYS 934 2HD LYS 934 10.844 3.792 1.559 153 1HE LYS 934 1HE LYS 934 12.336 2.566 0.358 154 2HE LYS 934 2HE LYS 934 11.222 2.680 -0.990 155 1HZ LYS 934 1HZ LYS 934 13.512 3.483 -1.416 156 2HZ LYS 934 2HZ LYS 934 12.344 4.562 -1.787 157 3HZ LYS 934 3HZ LYS 934 13.225 4.747 -0.423 158 H ALA 935 H ALA 935 6.805 7.401 -2.050 159 HA ALA 935 HA ALA 935 8.291 9.874 -2.300 160 1HB ALA 935 1HB ALA 935 7.734 8.934 -4.380 161 2HB ALA 935 2HB ALA 935 6.103 8.466 -3.842 162 3HB ALA 935 3HB ALA 935 6.481 10.177 -4.155 163 H VAL 936 H VAL 936 5.012 8.688 -1.357 164 HA VAL 936 HA VAL 936 3.652 10.984 -1.064 165 HB VAL 936 HB VAL 936 3.779 8.537 0.693 166 1HG1 VAL 936 1HG1 VAL 936 2.157 11.028 1.008 167 2HG1 VAL 936 2HG1 VAL 936 1.355 9.466 1.301 168 3HG1 VAL 936 3HG1 VAL 936 2.800 9.915 2.239 169 1HG2 VAL 936 1HG2 VAL 936 1.379 9.149 -0.921 170 2HG2 VAL 936 2HG2 VAL 936 2.856 8.825 -1.859 171 3HG2 VAL 936 3HG2 VAL 936 2.257 7.617 -0.698 172 H ILE 937 H ILE 937 6.076 9.637 1.265 173 HA ILE 937 HA ILE 937 5.795 11.853 3.028 174 HB ILE 937 HB ILE 937 7.663 9.514 2.801 175 1HG1 ILE 937 1HG1 ILE 937 5.988 10.212 5.187 176 2HG1 ILE 937 2HG1 ILE 937 5.199 9.555 3.767 177 1HG2 ILE 937 1HG2 ILE 937 8.405 10.455 5.172 178 2HG2 ILE 937 2HG2 ILE 937 9.236 10.917 3.667 179 3HG2 ILE 937 3HG2 ILE 937 8.033 12.011 4.391 180 1HD1 ILE 937 1HD1 ILE 937 7.021 7.699 3.818 181 2HD1 ILE 937 2HD1 ILE 937 7.371 8.279 5.464 182 3HD1 ILE 937 3HD1 ILE 937 5.756 7.643 5.069 183 H GLU 938 H GLU 938 8.579 10.745 0.961 184 HA GLU 938 HA GLU 938 10.251 12.718 1.182 185 1HB GLU 938 1HB GLU 938 9.986 10.740 -0.620 186 2HB GLU 938 2HB GLU 938 9.530 12.069 -1.667 187 1HG GLU 938 1HG GLU 938 11.745 12.461 -1.977 188 2HG GLU 938 2HG GLU 938 11.796 13.053 -0.328 189 H MET 939 H MET 939 7.196 12.944 -0.734 190 HA MET 939 HA MET 939 7.515 15.317 -1.929 191 1HB MET 939 1HB MET 939 5.349 13.593 -1.134 192 2HB MET 939 2HB MET 939 4.868 15.217 -0.686 193 1HG MET 939 1HG MET 939 5.370 16.005 -3.015 194 2HG MET 939 2HG MET 939 5.840 14.377 -3.461 195 1HE MET 939 1HE MET 939 3.101 16.455 -1.755 196 2HE MET 939 2HE MET 939 1.618 15.499 -1.990 197 3HE MET 939 3HE MET 939 2.872 14.934 -0.860 198 H SER 940 H SER 940 5.735 15.060 1.236 199 HA SER 940 HA SER 940 5.573 17.629 1.844 200 1HB SER 940 1HB SER 940 5.270 16.990 4.102 201 2HB SER 940 2HB SER 940 4.853 15.547 3.200 202 HG SER 940 HG SER 940 7.212 14.926 3.542 203 H SER 941 H SER 941 8.508 15.598 1.981 204 HA SER 941 HA SER 941 10.078 17.220 3.535 205 1HB SER 941 1HB SER 941 10.465 14.841 2.398 206 2HB SER 941 2HB SER 941 11.246 15.787 1.147 207 HG SER 941 HG SER 941 12.348 14.971 3.407 208 H LYS 942 H LYS 942 9.712 17.141 -0.084 209 HA LYS 942 HA LYS 942 10.938 19.807 -0.137 210 1HB LYS 942 1HB LYS 942 11.845 19.329 -2.209 211 2HB LYS 942 2HB LYS 942 11.982 17.788 -1.386 212 1HG LYS 942 1HG LYS 942 10.739 16.808 -3.004 213 2HG LYS 942 2HG LYS 942 9.381 17.834 -2.587 214 1HD LYS 942 1HD LYS 942 10.806 19.639 -4.021 215 2HD LYS 942 2HD LYS 942 11.427 18.179 -4.766 216 1HE LYS 942 1HE LYS 942 9.177 17.447 -5.387 217 2HE LYS 942 2HE LYS 942 8.441 18.727 -4.442 218 1HZ LYS 942 1HZ LYS 942 8.965 20.259 -5.989 219 2HZ LYS 942 2HZ LYS 942 10.335 19.519 -6.479 220 3HZ LYS 942 3HZ LYS 942 8.884 18.971 -6.989 221 H ILE 943 H ILE 943 8.177 19.292 0.688 222 HA ILE 943 HA ILE 943 6.657 20.134 -1.650 223 HB ILE 943 HB ILE 943 6.065 18.307 0.182 224 1HG1 ILE 943 1HG1 ILE 943 4.824 19.041 -1.923 225 2HG1 ILE 943 2HG1 ILE 943 3.871 18.333 -0.634 226 1HG2 ILE 943 1HG2 ILE 943 4.981 20.883 1.346 227 2HG2 ILE 943 2HG2 ILE 943 4.415 19.256 1.793 228 3HG2 ILE 943 3HG2 ILE 943 6.101 19.731 2.111 229 1HD1 ILE 943 1HD1 ILE 943 4.186 21.278 -0.409 230 2HD1 ILE 943 2HD1 ILE 943 3.304 20.739 -1.858 231 3HD1 ILE 943 3HD1 ILE 943 2.726 20.273 -0.240 232 H GLN 944 H GLN 944 7.354 21.166 1.758 233 HA GLN 944 HA GLN 944 6.002 23.453 1.851 234 1HB GLN 944 1HB GLN 944 8.284 22.322 3.188 235 2HB GLN 944 2HB GLN 944 8.625 24.018 2.909 236 1HG GLN 944 1HG GLN 944 6.086 24.300 3.775 237 2HG GLN 944 2HG GLN 944 6.429 22.766 4.550 238 1HE2 GLN 944 1HE2 GLN 944 6.011 24.267 6.414 239 2HE2 GLN 944 2HE2 GLN 944 7.371 25.058 7.137 240 HA PRO 945 HA PRO 945 9.408 25.702 -0.566 241 1HB PRO 945 1HB PRO 945 11.404 24.278 -1.773 242 2HB PRO 945 2HB PRO 945 11.576 25.021 -0.195 243 1HG PRO 945 1HG PRO 945 11.195 22.168 -0.867 244 2HG PRO 945 2HG PRO 945 11.786 22.875 0.623 245 1HD PRO 945 1HD PRO 945 9.169 21.798 0.153 246 2HD PRO 945 2HD PRO 945 9.723 22.610 1.604 247 H ALA 946 H ALA 946 9.040 22.534 -2.085 248 HA ALA 946 HA ALA 946 8.968 23.117 -4.658 249 1HB ALA 946 1HB ALA 946 6.798 21.533 -4.605 250 2HB ALA 946 2HB ALA 946 8.428 20.922 -4.234 251 3HB ALA 946 3HB ALA 946 7.311 21.337 -2.912 252 HA PRO 947 HA PRO 947 6.025 26.299 -5.094 253 1HB PRO 947 1HB PRO 947 6.275 26.674 -7.789 254 2HB PRO 947 2HB PRO 947 7.344 27.415 -6.615 255 1HG PRO 947 1HG PRO 947 7.867 25.127 -8.412 256 2HG PRO 947 2HG PRO 947 9.017 26.138 -7.559 257 1HD PRO 947 1HD PRO 947 8.212 23.479 -6.847 258 2HD PRO 947 2HD PRO 947 9.272 24.533 -5.933 259 HA PRO 948 HA PRO 948 2.372 24.671 -6.531 260 1HB PRO 948 1HB PRO 948 1.062 26.705 -7.802 261 2HB PRO 948 2HB PRO 948 1.127 26.549 -6.057 262 1HG PRO 948 1HG PRO 948 2.595 28.426 -7.806 263 2HG PRO 948 2HG PRO 948 2.317 28.524 -6.079 264 1HD PRO 948 1HD PRO 948 4.749 27.743 -7.383 265 2HD PRO 948 2HD PRO 948 4.433 27.730 -5.660 266 H GLU 949 H GLU 949 4.596 25.766 -8.798 267 HA GLU 949 HA GLU 949 3.060 24.706 -10.987 268 1HB GLU 949 1HB GLU 949 5.163 26.631 -10.686 269 2HB GLU 949 2HB GLU 949 5.785 25.354 -11.713 270 1HG GLU 949 1HG GLU 949 3.709 25.541 -13.143 271 2HG GLU 949 2HG GLU 949 3.172 26.878 -12.146 272 H GLU 950 H GLU 950 5.531 23.730 -8.701 273 HA GLU 950 HA GLU 950 6.161 21.438 -10.378 274 1HB GLU 950 1HB GLU 950 7.769 23.133 -8.759 275 2HB GLU 950 2HB GLU 950 7.715 21.598 -7.916 276 1HG GLU 950 1HG GLU 950 9.243 20.784 -9.376 277 2HG GLU 950 2HG GLU 950 8.053 20.921 -10.655 278 H TYR 951 H TYR 951 4.069 22.410 -7.920 279 HA TYR 951 HA TYR 951 4.162 19.880 -6.483 280 1HB TYR 951 1HB TYR 951 3.906 22.146 -5.358 281 2HB TYR 951 2HB TYR 951 2.471 22.453 -6.315 282 HD1 TYR 951 HD1 TYR 951 0.549 22.386 -5.028 283 HD2 TYR 951 HD2 TYR 951 3.653 19.549 -4.235 284 HE1 TYR 951 HE1 TYR 951 -0.879 21.318 -3.216 285 HE2 TYR 951 HE2 TYR 951 2.214 18.492 -2.426 286 HH TYR 951 HH TYR 951 0.418 19.044 -1.005 287 H VAL 952 H VAL 952 2.091 21.766 -8.738 288 HA VAL 952 HA VAL 952 -0.217 20.300 -8.572 289 HB VAL 952 HB VAL 952 1.122 22.043 -10.525 290 1HG1 VAL 952 1HG1 VAL 952 -0.974 20.043 -11.427 291 2HG1 VAL 952 2HG1 VAL 952 -0.562 21.527 -12.319 292 3HG1 VAL 952 3HG1 VAL 952 0.669 20.265 -12.075 293 1HG2 VAL 952 1HG2 VAL 952 -1.826 22.035 -10.168 294 2HG2 VAL 952 2HG2 VAL 952 -0.859 22.355 -8.709 295 3HG2 VAL 952 3HG2 VAL 952 -0.668 23.386 -10.148 296 HA PRO 953 HA PRO 953 1.752 17.251 -11.613 297 1HB PRO 953 1HB PRO 953 4.447 17.326 -12.058 298 2HB PRO 953 2HB PRO 953 3.280 18.096 -13.114 299 1HG PRO 953 1HG PRO 953 5.097 19.339 -11.142 300 2HG PRO 953 2HG PRO 953 4.251 20.090 -12.480 301 1HD PRO 953 1HD PRO 953 3.547 20.241 -9.704 302 2HD PRO 953 2HD PRO 953 2.638 20.893 -11.053 303 H MET 954 H MET 954 4.232 18.025 -9.218 304 HA MET 954 HA MET 954 5.171 15.665 -8.603 305 1HB MET 954 1HB MET 954 4.698 18.156 -7.216 306 2HB MET 954 2HB MET 954 4.315 16.870 -6.088 307 1HG MET 954 1HG MET 954 6.668 15.914 -7.185 308 2HG MET 954 2HG MET 954 6.950 17.643 -7.255 309 1HE MET 954 1HE MET 954 6.347 18.923 -3.828 310 2HE MET 954 2HE MET 954 5.499 18.896 -5.393 311 3HE MET 954 3HE MET 954 4.847 17.983 -4.011 312 H VAL 955 H VAL 955 2.230 16.870 -6.821 313 HA VAL 955 HA VAL 955 1.584 14.458 -5.669 314 HB VAL 955 HB VAL 955 -0.116 16.804 -6.521 315 1HG1 VAL 955 1HG1 VAL 955 -1.149 15.159 -4.323 316 2HG1 VAL 955 2HG1 VAL 955 -1.986 15.840 -5.738 317 3HG1 VAL 955 3HG1 VAL 955 -1.105 14.300 -5.881 318 1HG2 VAL 955 1HG2 VAL 955 1.232 17.682 -4.896 319 2HG2 VAL 955 2HG2 VAL 955 -0.028 16.975 -3.857 320 3HG2 VAL 955 3HG2 VAL 955 1.505 16.108 -4.110 321 H LYS 956 H LYS 956 0.300 15.895 -8.750 322 HA LYS 956 HA LYS 956 -1.423 14.002 -9.521 323 1HB LYS 956 1HB LYS 956 0.150 16.038 -10.791 324 2HB LYS 956 2HB LYS 956 0.140 14.622 -11.823 325 1HG LYS 956 1HG LYS 956 -2.126 14.761 -12.235 326 2HG LYS 956 2HG LYS 956 -2.501 15.286 -10.605 327 1HD LYS 956 1HD LYS 956 -2.965 17.118 -12.168 328 2HD LYS 956 2HD LYS 956 -1.620 17.568 -11.137 329 1HE LYS 956 1HE LYS 956 -0.033 17.342 -12.863 330 2HE LYS 956 2HE LYS 956 -1.011 16.199 -13.762 331 1HZ LYS 956 1HZ LYS 956 -2.571 18.326 -13.803 332 2HZ LYS 956 2HZ LYS 956 -1.116 19.068 -13.759 333 3HZ LYS 956 3HZ LYS 956 -1.459 18.013 -14.958 334 H GLU 957 H GLU 957 2.120 13.699 -9.337 335 HA GLU 957 HA GLU 957 2.265 11.353 -10.848 336 1HB GLU 957 1HB GLU 957 4.094 13.099 -9.837 337 2HB GLU 957 2HB GLU 957 4.258 11.810 -8.661 338 1HG GLU 957 1HG GLU 957 4.217 11.079 -11.593 339 2HG GLU 957 2HG GLU 957 5.673 11.800 -10.936 340 H VAL 958 H VAL 958 2.379 11.905 -7.250 341 HA VAL 958 HA VAL 958 2.488 9.341 -6.403 342 HB VAL 958 HB VAL 958 2.196 11.750 -5.252 343 1HG1 VAL 958 1HG1 VAL 958 -0.476 10.359 -4.866 344 2HG1 VAL 958 2HG1 VAL 958 0.110 11.728 -3.890 345 3HG1 VAL 958 3HG1 VAL 958 -0.189 11.940 -5.631 346 1HG2 VAL 958 1HG2 VAL 958 1.533 9.158 -3.819 347 2HG2 VAL 958 2HG2 VAL 958 3.176 9.648 -4.301 348 3HG2 VAL 958 3HG2 VAL 958 2.264 10.626 -3.125 349 H GLY 959 H GLY 959 -0.450 11.163 -7.466 350 1HA GLY 959 1HA GLY 959 -2.369 9.256 -6.883 351 2HA GLY 959 2HA GLY 959 -2.456 10.440 -8.172 352 H LEU 960 H LEU 960 -0.166 9.564 -9.731 353 HA LEU 960 HA LEU 960 -1.410 7.572 -11.257 354 1HB LEU 960 1HB LEU 960 0.748 9.368 -11.486 355 2HB LEU 960 2HB LEU 960 1.421 7.772 -11.751 356 HG LEU 960 HG LEU 960 -1.097 8.397 -13.207 357 1HD1 LEU 960 1HD1 LEU 960 1.465 9.898 -13.619 358 2HD1 LEU 960 2HD1 LEU 960 0.455 9.472 -15.022 359 3HD1 LEU 960 3HD1 LEU 960 -0.220 10.465 -13.707 360 1HD2 LEU 960 1HD2 LEU 960 0.885 7.381 -14.916 361 2HD2 LEU 960 2HD2 LEU 960 1.108 6.538 -13.365 362 3HD2 LEU 960 3HD2 LEU 960 -0.475 6.501 -14.178 363 H ALA 961 H ALA 961 1.187 7.508 -8.769 364 HA ALA 961 HA ALA 961 1.952 4.860 -9.137 365 1HB ALA 961 1HB ALA 961 3.216 6.506 -7.820 366 2HB ALA 961 2HB ALA 961 1.900 6.581 -6.624 367 3HB ALA 961 3HB ALA 961 2.833 5.079 -6.828 368 H LEU 962 H LEU 962 -0.680 6.357 -7.174 369 HA LEU 962 HA LEU 962 -1.455 4.038 -5.851 370 1HB LEU 962 1HB LEU 962 -2.935 6.543 -6.638 371 2HB LEU 962 2HB LEU 962 -3.675 5.267 -5.692 372 HG LEU 962 HG LEU 962 -1.074 6.281 -4.679 373 1HD1 LEU 962 1HD1 LEU 962 -1.593 8.441 -4.745 374 2HD1 LEU 962 2HD1 LEU 962 -3.239 8.100 -5.333 375 3HD1 LEU 962 3HD1 LEU 962 -2.897 8.086 -3.586 376 1HD2 LEU 962 1HD2 LEU 962 -3.192 4.716 -3.724 377 2HD2 LEU 962 2HD2 LEU 962 -1.781 5.305 -2.814 378 3HD2 LEU 962 3HD2 LEU 962 -3.291 6.247 -2.821 379 H ARG 963 H ARG 963 -2.677 5.498 -8.942 380 HA ARG 963 HA ARG 963 -4.579 3.675 -9.488 381 1HB ARG 963 1HB ARG 963 -3.524 5.804 -10.819 382 2HB ARG 963 2HB ARG 963 -2.823 4.521 -11.785 383 1HG ARG 963 1HG ARG 963 -4.795 4.258 -12.867 384 2HG ARG 963 2HG ARG 963 -5.561 3.801 -11.359 385 1HD ARG 963 1HD ARG 963 -6.794 5.705 -11.511 386 2HD ARG 963 2HD ARG 963 -5.331 6.603 -11.159 387 HE ARG 963 HE ARG 963 -5.271 7.293 -13.387 388 1HH1 ARG 963 2HH2 ARG 963 -7.226 4.375 -13.164 389 2HH1 ARG 963 1HH2 ARG 963 -7.705 4.416 -14.828 390 1HH2 ARG 963 2HH1 ARG 963 -5.903 7.347 -15.582 391 2HH2 ARG 963 1HH1 ARG 963 -6.948 6.118 -16.213 392 H THR 964 H THR 964 -1.094 3.556 -10.547 393 HA THR 964 HA THR 964 -1.237 1.061 -11.784 394 HB THR 964 HB THR 964 1.011 2.669 -10.475 395 HG1 THR 964 HG1 THR 964 1.139 3.386 -12.619 396 1HG2 THR 964 1HG2 THR 964 2.585 1.131 -11.187 397 2HG2 THR 964 2HG2 THR 964 1.248 -0.032 -11.014 398 3HG2 THR 964 3HG2 THR 964 1.619 0.668 -12.608 399 H LEU 965 H LEU 965 -0.530 1.952 -8.365 400 HA LEU 965 HA LEU 965 0.255 -0.489 -7.440 401 1HB LEU 965 1HB LEU 965 0.417 1.304 -5.986 402 2HB LEU 965 2HB LEU 965 -1.243 1.806 -6.237 403 HG LEU 965 HG LEU 965 -0.778 -0.851 -4.949 404 1HD1 LEU 965 1HD1 LEU 965 0.848 0.661 -3.850 405 2HD1 LEU 965 2HD1 LEU 965 -0.492 1.754 -3.428 406 3HD1 LEU 965 3HD1 LEU 965 -0.444 0.106 -2.758 407 1HD2 LEU 965 1HD2 LEU 965 -3.044 -0.300 -5.345 408 2HD2 LEU 965 2HD2 LEU 965 -2.766 -0.044 -3.606 409 3HD2 LEU 965 3HD2 LEU 965 -2.836 1.350 -4.710 410 H LEU 966 H LEU 966 -3.137 0.751 -7.781 411 HA LEU 966 HA LEU 966 -4.483 -1.377 -6.775 412 1HB LEU 966 1HB LEU 966 -5.246 0.195 -9.238 413 2HB LEU 966 2HB LEU 966 -6.329 -0.709 -8.198 414 HG LEU 966 HG LEU 966 -4.798 1.807 -7.497 415 1HD1 LEU 966 1HD1 LEU 966 -7.521 2.130 -6.966 416 2HD1 LEU 966 2HD1 LEU 966 -6.597 2.815 -8.325 417 3HD1 LEU 966 3HD1 LEU 966 -7.457 1.269 -8.523 418 1HD2 LEU 966 1HD2 LEU 966 -6.340 1.518 -5.355 419 2HD2 LEU 966 2HD2 LEU 966 -6.139 -0.206 -5.750 420 3HD2 LEU 966 3HD2 LEU 966 -4.709 0.811 -5.449 421 H ALA 967 H ALA 967 -3.548 -0.973 -10.268 422 HA ALA 967 HA ALA 967 -4.349 -3.501 -11.057 423 1HB ALA 967 1HB ALA 967 -3.442 -2.888 -13.069 424 2HB ALA 967 2HB ALA 967 -3.399 -1.289 -12.288 425 3HB ALA 967 3HB ALA 967 -1.933 -2.297 -12.332 426 H THR 968 H THR 968 -1.078 -2.332 -9.994 427 HA THR 968 HA THR 968 0.274 -4.716 -10.243 428 HB THR 968 HB THR 968 0.570 -2.525 -8.119 429 HG1 THR 968 HG1 THR 968 2.086 -1.804 -9.912 430 1HG2 THR 968 1HG2 THR 968 2.822 -4.055 -9.455 431 2HG2 THR 968 2HG2 THR 968 2.822 -3.203 -7.892 432 3HG2 THR 968 3HG2 THR 968 2.006 -4.777 -8.047 433 H VAL 969 H VAL 969 -1.686 -3.544 -7.441 434 HA VAL 969 HA VAL 969 -1.131 -5.712 -5.792 435 HB VAL 969 HB VAL 969 -3.671 -4.079 -5.936 436 1HG1 VAL 969 1HG1 VAL 969 -4.258 -4.957 -3.952 437 2HG1 VAL 969 2HG1 VAL 969 -3.083 -6.239 -4.330 438 3HG1 VAL 969 3HG1 VAL 969 -2.600 -4.861 -3.312 439 1HG2 VAL 969 1HG2 VAL 969 -1.790 -3.148 -3.958 440 2HG2 VAL 969 2HG2 VAL 969 -1.026 -3.150 -5.565 441 3HG2 VAL 969 3HG2 VAL 969 -2.545 -2.261 -5.304 442 H ASP 970 H ASP 970 -3.505 -5.246 -8.440 443 HA ASP 970 HA ASP 970 -5.177 -7.294 -7.998 444 1HB ASP 970 1HB ASP 970 -4.853 -5.571 -10.020 445 2HB ASP 970 2HB ASP 970 -4.040 -6.925 -10.778 446 H GLU 971 H GLU 971 -1.873 -7.341 -9.475 447 HA GLU 971 HA GLU 971 -1.960 -10.063 -10.142 448 1HB GLU 971 1HB GLU 971 0.456 -8.255 -9.694 449 2HB GLU 971 2HB GLU 971 0.480 -9.797 -10.524 450 1HG GLU 971 1HG GLU 971 -1.148 -8.895 -12.215 451 2HG GLU 971 2HG GLU 971 -1.123 -7.346 -11.396 452 H SER 972 H SER 972 -1.411 -8.296 -7.172 453 HA SER 972 HA SER 972 0.057 -10.432 -5.965 454 1HB SER 972 1HB SER 972 -0.643 -7.651 -5.325 455 2HB SER 972 2HB SER 972 -0.837 -8.699 -3.934 456 HG SER 972 HG SER 972 1.530 -9.105 -5.426 457 H LEU 973 H LEU 973 -3.285 -9.278 -6.260 458 HA LEU 973 HA LEU 973 -4.575 -10.232 -4.130 459 1HB LEU 973 1HB LEU 973 -5.216 -9.515 -6.752 460 2HB LEU 973 2HB LEU 973 -5.916 -11.109 -6.548 461 HG LEU 973 HG LEU 973 -6.707 -8.526 -5.384 462 1HD1 LEU 973 1HD1 LEU 973 -8.641 -10.670 -5.215 463 2HD1 LEU 973 2HD1 LEU 973 -8.677 -9.173 -6.178 464 3HD1 LEU 973 3HD1 LEU 973 -7.877 -10.627 -6.822 465 1HD2 LEU 973 1HD2 LEU 973 -7.722 -9.824 -3.362 466 2HD2 LEU 973 2HD2 LEU 973 -6.365 -10.942 -3.637 467 3HD2 LEU 973 3HD2 LEU 973 -6.047 -9.226 -3.287 468 HA PRO 974 HA PRO 974 -4.256 -14.672 -5.711 469 1HB PRO 974 1HB PRO 974 -2.644 -15.269 -7.836 470 2HB PRO 974 2HB PRO 974 -4.367 -14.989 -7.989 471 1HG PRO 974 1HG PRO 974 -2.127 -13.207 -8.727 472 2HG PRO 974 2HG PRO 974 -3.799 -13.142 -9.247 473 1HD PRO 974 1HD PRO 974 -2.541 -11.455 -7.299 474 2HD PRO 974 2HD PRO 974 -4.238 -11.467 -7.735 475 H VAL 975 H VAL 975 -1.298 -12.847 -6.034 476 HA VAL 975 HA VAL 975 0.516 -14.749 -5.324 477 HB VAL 975 HB VAL 975 0.326 -11.811 -4.670 478 1HG1 VAL 975 1HG1 VAL 975 2.100 -13.726 -3.499 479 2HG1 VAL 975 2HG1 VAL 975 3.037 -12.697 -4.608 480 3HG1 VAL 975 3HG1 VAL 975 2.080 -11.957 -3.303 481 1HG2 VAL 975 1HG2 VAL 975 1.686 -11.455 -6.554 482 2HG2 VAL 975 2HG2 VAL 975 2.180 -13.163 -6.636 483 3HG2 VAL 975 3HG2 VAL 975 0.521 -12.694 -7.080 484 H LEU 976 H LEU 976 -1.936 -13.127 -3.319 485 HA LEU 976 HA LEU 976 -0.899 -14.617 -1.010 486 1HB LEU 976 1HB LEU 976 -2.636 -12.145 -1.061 487 2HB LEU 976 2HB LEU 976 -2.068 -12.979 0.372 488 HG LEU 976 HG LEU 976 -0.731 -11.025 0.054 489 1HD1 LEU 976 1HD1 LEU 976 0.341 -13.624 0.184 490 2HD1 LEU 976 2HD1 LEU 976 1.397 -12.708 -0.918 491 3HD1 LEU 976 3HD1 LEU 976 1.088 -12.102 0.727 492 1HD2 LEU 976 1HD2 LEU 976 0.077 -11.999 -2.692 493 2HD2 LEU 976 2HD2 LEU 976 -1.233 -10.828 -2.413 494 3HD2 LEU 976 3HD2 LEU 976 0.432 -10.432 -1.926 495 HA PRO 977 HA PRO 977 -4.552 -16.911 -0.964 496 1HB PRO 977 1HB PRO 977 -4.948 -17.406 1.695 497 2HB PRO 977 2HB PRO 977 -3.786 -18.283 0.719 498 1HG PRO 977 1HG PRO 977 -3.300 -16.174 2.733 499 2HG PRO 977 2HG PRO 977 -2.172 -17.341 2.070 500 1HD PRO 977 1HD PRO 977 -2.367 -14.562 1.386 501 2HD PRO 977 2HD PRO 977 -1.320 -15.754 0.642 502 H ALA 978 H ALA 978 -6.817 -16.958 -0.826 503 HA ALA 978 HA ALA 978 -8.002 -14.498 -0.894 504 1HB ALA 978 1HB ALA 978 -10.051 -15.688 -0.923 505 2HB ALA 978 2HB ALA 978 -8.861 -16.833 -1.587 506 3HB ALA 978 3HB ALA 978 -9.406 -16.995 0.099 507 H SER 979 H SER 979 -6.896 -16.346 1.874 508 HA SER 979 HA SER 979 -8.519 -15.646 3.860 509 1HB SER 979 1HB SER 979 -6.571 -15.749 5.357 510 2HB SER 979 2HB SER 979 -6.454 -16.989 4.124 511 HG SER 979 HG SER 979 -4.814 -14.764 4.590 512 H THR 980 H THR 980 -6.392 -13.516 1.986 513 HA THR 980 HA THR 980 -7.240 -11.265 3.691 514 HB THR 980 HB THR 980 -4.799 -11.713 3.825 515 HG1 THR 980 HG1 THR 980 -5.826 -9.485 3.545 516 1HG2 THR 980 1HG2 THR 980 -4.888 -11.292 0.790 517 2HG2 THR 980 2HG2 THR 980 -3.406 -11.374 1.772 518 3HG2 THR 980 3HG2 THR 980 -4.446 -12.810 1.608 519 H HIS 981 H HIS 981 -9.056 -12.186 1.841 520 HA HIS 981 HA HIS 981 -8.648 -10.765 -0.614 521 1HB HIS 981 1HB HIS 981 -10.468 -12.783 0.440 522 2HB HIS 981 2HB HIS 981 -11.329 -11.544 -0.450 523 HD1 HIS 981 HD1 HIS 981 -11.422 -14.191 -1.764 524 HD2 HIS 981 HD2 HIS 981 -8.196 -11.575 -2.359 525 HE1 HIS 981 HE1 HIS 981 -10.324 -14.896 -3.957 526 H ARG 982 H ARG 982 -11.606 -10.662 1.449 527 HA ARG 982 HA ARG 982 -12.467 -8.274 0.761 528 1HB ARG 982 1HB ARG 982 -13.583 -9.812 2.399 529 2HB ARG 982 2HB ARG 982 -12.426 -9.344 3.630 530 1HG ARG 982 1HG ARG 982 -14.437 -8.035 3.987 531 2HG ARG 982 2HG ARG 982 -13.201 -6.946 3.388 532 1HD ARG 982 1HD ARG 982 -15.252 -6.463 2.175 533 2HD ARG 982 2HD ARG 982 -14.146 -7.229 1.052 534 HE ARG 982 HE ARG 982 -15.850 -9.173 2.400 535 1HH1 ARG 982 2HH2 ARG 982 -15.717 -6.876 -0.263 536 2HH1 ARG 982 1HH2 ARG 982 -16.933 -7.687 -1.192 537 1HH2 ARG 982 2HH1 ARG 982 -17.455 -10.244 1.175 538 2HH2 ARG 982 1HH1 ARG 982 -17.929 -9.615 -0.368 539 H GLU 983 H GLU 983 -10.382 -8.778 3.714 540 HA GLU 983 HA GLU 983 -9.987 -6.283 4.477 541 1HB GLU 983 1HB GLU 983 -7.901 -8.493 4.257 542 2HB GLU 983 2HB GLU 983 -7.633 -7.014 5.157 543 1HG GLU 983 1HG GLU 983 -9.508 -7.496 6.653 544 2HG GLU 983 2HG GLU 983 -10.013 -8.855 5.668 545 H ILE 984 H ILE 984 -8.111 -7.917 1.833 546 HA ILE 984 HA ILE 984 -6.543 -5.673 1.232 547 HB ILE 984 HB ILE 984 -7.198 -8.276 -0.045 548 1HG1 ILE 984 1HG1 ILE 984 -4.591 -6.878 0.623 549 2HG1 ILE 984 2HG1 ILE 984 -5.407 -8.046 1.642 550 1HG2 ILE 984 1HG2 ILE 984 -5.878 -5.984 -1.522 551 2HG2 ILE 984 2HG2 ILE 984 -5.851 -7.687 -2.040 552 3HG2 ILE 984 3HG2 ILE 984 -7.396 -6.809 -1.950 553 1HD1 ILE 984 1HD1 ILE 984 -4.014 -9.516 0.542 554 2HD1 ILE 984 2HD1 ILE 984 -5.325 -9.489 -0.662 555 3HD1 ILE 984 3HD1 ILE 984 -3.882 -8.474 -0.896 556 H GLU 985 H GLU 985 -9.716 -6.863 0.005 557 HA GLU 985 HA GLU 985 -9.924 -4.980 -2.021 558 1HB GLU 985 1HB GLU 985 -11.395 -7.154 -1.167 559 2HB GLU 985 2HB GLU 985 -12.459 -5.835 -0.722 560 1HG GLU 985 1HG GLU 985 -11.305 -5.439 -3.402 561 2HG GLU 985 2HG GLU 985 -12.168 -6.960 -3.290 562 H MET 986 H MET 986 -10.595 -4.863 1.476 563 HA MET 986 HA MET 986 -12.022 -2.404 1.255 564 1HB MET 986 1HB MET 986 -11.147 -4.312 3.419 565 2HB MET 986 2HB MET 986 -11.406 -2.654 3.924 566 1HG MET 986 1HG MET 986 -13.684 -2.895 2.558 567 2HG MET 986 2HG MET 986 -13.406 -4.613 2.767 568 1HE MET 986 1HE MET 986 -13.303 -1.221 4.521 569 2HE MET 986 2HE MET 986 -15.047 -1.554 4.404 570 3HE MET 986 3HE MET 986 -14.259 -1.488 5.998 571 H ALA 987 H ALA 987 -8.687 -3.445 1.586 572 HA ALA 987 HA ALA 987 -7.787 -0.973 2.742 573 1HB ALA 987 1HB ALA 987 -5.813 -2.722 1.421 574 2HB ALA 987 2HB ALA 987 -5.882 -2.142 3.102 575 3HB ALA 987 3HB ALA 987 -6.833 -3.565 2.612 576 H GLN 988 H GLN 988 -8.605 -2.203 -0.414 577 HA GLN 988 HA GLN 988 -6.839 -0.445 -1.793 578 1HB GLN 988 1HB GLN 988 -9.101 -2.282 -2.657 579 2HB GLN 988 2HB GLN 988 -8.299 -1.221 -3.798 580 1HG GLN 988 1HG GLN 988 -6.372 -2.707 -2.132 581 2HG GLN 988 2HG GLN 988 -7.435 -3.781 -3.019 582 1HE2 GLN 988 1HE2 GLN 988 -7.752 -3.300 -5.343 583 2HE2 GLN 988 2HE2 GLN 988 -6.394 -2.765 -6.276 584 H LYS 989 H LYS 989 -10.412 -0.655 -1.188 585 HA LYS 989 HA LYS 989 -11.093 1.660 -2.561 586 1HB LYS 989 1HB LYS 989 -12.478 -0.311 -1.392 587 2HB LYS 989 2HB LYS 989 -12.621 0.882 -0.117 588 1HG LYS 989 1HG LYS 989 -13.127 1.783 -2.952 589 2HG LYS 989 2HG LYS 989 -14.352 0.800 -2.175 590 1HD LYS 989 1HD LYS 989 -13.295 3.016 -0.485 591 2HD LYS 989 2HD LYS 989 -14.150 3.544 -1.921 592 1HE LYS 989 1HE LYS 989 -16.175 2.460 -1.270 593 2HE LYS 989 2HE LYS 989 -15.358 1.410 -0.129 594 1HZ LYS 989 1HZ LYS 989 -15.838 2.912 1.387 595 2HZ LYS 989 2HZ LYS 989 -14.800 3.957 0.681 596 3HZ LYS 989 3HZ LYS 989 -16.384 3.988 0.286 597 H LEU 990 H LEU 990 -10.028 1.128 0.842 598 HA LEU 990 HA LEU 990 -10.465 3.731 1.720 599 1HB LEU 990 1HB LEU 990 -9.741 1.426 2.871 600 2HB LEU 990 2HB LEU 990 -8.163 2.182 2.782 601 HG LEU 990 HG LEU 990 -10.615 3.320 4.152 602 1HD1 LEU 990 1HD1 LEU 990 -9.848 1.601 5.529 603 2HD1 LEU 990 2HD1 LEU 990 -8.139 1.932 5.161 604 3HD1 LEU 990 3HD1 LEU 990 -9.062 3.055 6.188 605 1HD2 LEU 990 1HD2 LEU 990 -8.223 4.624 3.190 606 2HD2 LEU 990 2HD2 LEU 990 -9.670 5.319 3.960 607 3HD2 LEU 990 3HD2 LEU 990 -8.325 4.725 4.964 608 H LEU 991 H LEU 991 -7.470 2.177 0.377 609 HA LEU 991 HA LEU 991 -5.817 4.342 0.507 610 1HB LEU 991 1HB LEU 991 -5.169 2.064 -0.113 611 2HB LEU 991 2HB LEU 991 -5.983 2.238 -1.655 612 HG LEU 991 HG LEU 991 -4.405 3.862 -2.419 613 1HD1 LEU 991 1HD1 LEU 991 -3.772 4.129 0.457 614 2HD1 LEU 991 2HD1 LEU 991 -2.385 4.228 -0.654 615 3HD1 LEU 991 3HD1 LEU 991 -3.761 5.340 -0.847 616 1HD2 LEU 991 1HD2 LEU 991 -3.790 1.358 -2.307 617 2HD2 LEU 991 2HD2 LEU 991 -2.505 2.539 -2.658 618 3HD2 LEU 991 3HD2 LEU 991 -2.656 1.846 -1.025 619 H ASN 992 H ASN 992 -8.034 3.448 -2.228 620 HA ASN 992 HA ASN 992 -7.446 5.576 -3.816 621 1HB ASN 992 1HB ASN 992 -9.267 3.467 -3.861 622 2HB ASN 992 2HB ASN 992 -10.339 4.846 -3.726 623 1HD2 ASN 992 1HD2 ASN 992 -11.123 4.459 -5.801 624 2HD2 ASN 992 2HD2 ASN 992 -10.245 4.888 -7.231 625 H SER 993 H SER 993 -10.383 5.225 -1.667 626 HA SER 993 HA SER 993 -11.406 7.657 -1.844 627 1HB SER 993 1HB SER 993 -11.822 5.513 -0.207 628 2HB SER 993 2HB SER 993 -11.178 6.646 0.964 629 HG SER 993 HG SER 993 -13.305 7.165 1.002 630 H ASP 994 H ASP 994 -8.841 6.716 0.565 631 HA ASP 994 HA ASP 994 -8.520 9.252 1.590 632 1HB ASP 994 1HB ASP 994 -7.218 6.661 1.752 633 2HB ASP 994 2HB ASP 994 -5.985 7.899 1.623 634 H LEU 995 H LEU 995 -7.152 7.557 -1.258 635 HA LEU 995 HA LEU 995 -5.022 9.257 -1.796 636 1HB LEU 995 1HB LEU 995 -4.772 7.536 -3.160 637 2HB LEU 995 2HB LEU 995 -6.471 7.113 -3.085 638 HG LEU 995 HG LEU 995 -7.009 8.619 -4.888 639 1HD1 LEU 995 1HD1 LEU 995 -4.405 9.794 -4.233 640 2HD1 LEU 995 2HD1 LEU 995 -4.674 9.580 -5.980 641 3HD1 LEU 995 3HD1 LEU 995 -5.835 10.516 -5.009 642 1HD2 LEU 995 1HD2 LEU 995 -4.836 7.612 -6.399 643 2HD2 LEU 995 2HD2 LEU 995 -5.202 6.408 -5.140 644 3HD2 LEU 995 3HD2 LEU 995 -6.483 6.952 -6.250 645 H ALA 996 H ALA 996 -8.356 9.275 -3.254 646 HA ALA 996 HA ALA 996 -8.119 11.551 -4.724 647 1HB ALA 996 1HB ALA 996 -10.104 10.387 -5.028 648 2HB ALA 996 2HB ALA 996 -10.373 10.176 -3.282 649 3HB ALA 996 3HB ALA 996 -10.674 11.756 -4.044 650 H GLU 997 H GLU 997 -9.049 11.267 -1.229 651 HA GLU 997 HA GLU 997 -9.494 13.924 -0.794 652 1HB GLU 997 1HB GLU 997 -9.745 11.777 0.740 653 2HB GLU 997 2HB GLU 997 -8.150 12.221 1.312 654 1HG GLU 997 1HG GLU 997 -9.226 13.617 2.755 655 2HG GLU 997 2HG GLU 997 -9.464 14.667 1.373 656 H LEU 998 H LEU 998 -6.437 12.113 -1.061 657 HA LEU 998 HA LEU 998 -4.841 14.218 0.013 658 1HB LEU 998 1HB LEU 998 -3.899 12.145 0.292 659 2HB LEU 998 2HB LEU 998 -4.378 11.578 -1.296 660 HG LEU 998 HG LEU 998 -2.281 13.723 -0.967 661 1HD1 LEU 998 1HD1 LEU 998 -0.972 12.260 0.090 662 2HD1 LEU 998 2HD1 LEU 998 -2.075 10.901 -0.237 663 3HD1 LEU 998 3HD1 LEU 998 -0.880 11.392 -1.462 664 1HD2 LEU 998 1HD2 LEU 998 -3.472 12.279 -3.187 665 2HD2 LEU 998 2HD2 LEU 998 -2.426 13.719 -3.185 666 3HD2 LEU 998 3HD2 LEU 998 -1.702 12.093 -3.153 667 H ILE 999 H ILE 999 -5.636 12.995 -3.301 668 HA ILE 999 HA ILE 999 -4.042 14.773 -4.694 669 HB ILE 999 HB ILE 999 -6.632 13.399 -5.390 670 1HG1 ILE 999 1HG1 ILE 999 -4.574 12.028 -4.880 671 2HG1 ILE 999 2HG1 ILE 999 -5.299 11.766 -6.454 672 1HG2 ILE 999 1HG2 ILE 999 -5.420 13.955 -7.787 673 2HG2 ILE 999 2HG2 ILE 999 -6.801 14.838 -7.093 674 3HG2 ILE 999 3HG2 ILE 999 -5.147 15.454 -6.867 675 1HD1 ILE 999 1HD1 ILE 999 -3.429 13.911 -6.772 676 2HD1 ILE 999 2HD1 ILE 999 -2.615 12.637 -5.833 677 3HD1 ILE 999 3HD1 ILE 999 -3.317 12.258 -7.424 678 H ASN1000 H ASN1000 -7.366 15.130 -3.360 679 HA ASN1000 HA ASN1000 -7.865 17.574 -4.570 680 1HB ASN1000 1HB ASN1000 -9.290 15.814 -2.975 681 2HB ASN1000 2HB ASN1000 -9.016 17.123 -1.842 682 1HD2 ASN1000 1HD2 ASN1000 -11.512 16.307 -2.887 683 2HD2 ASN1000 2HD2 ASN1000 -12.200 17.610 -3.796 684 H LYS1001 H LYS1001 -6.841 16.704 -1.175 685 HA LYS1001 HA LYS1001 -6.578 19.115 -0.047 686 1HB LYS1001 1HB LYS1001 -5.459 16.486 0.340 687 2HB LYS1001 2HB LYS1001 -4.241 17.694 0.695 688 1HG LYS1001 1HG LYS1001 -5.266 17.785 2.743 689 2HG LYS1001 2HG LYS1001 -6.400 18.844 1.927 690 1HD LYS1001 1HD LYS1001 -7.656 16.615 1.282 691 2HD LYS1001 2HD LYS1001 -6.706 15.892 2.565 692 1HE LYS1001 1HE LYS1001 -8.407 18.395 2.971 693 2HE LYS1001 2HE LYS1001 -9.013 16.776 3.258 694 1HZ LYS1001 1HZ LYS1001 -7.316 16.451 4.883 695 2HZ LYS1001 2HZ LYS1001 -6.628 17.896 4.559 696 3HZ LYS1001 3HZ LYS1001 -8.111 17.831 5.240 697 H MET1002 H MET1002 -4.588 17.769 -2.663 698 HA MET1002 HA MET1002 -2.622 19.811 -2.399 699 1HB MET1002 1HB MET1002 -1.930 17.657 -3.298 700 2HB MET1002 2HB MET1002 -3.247 17.634 -4.454 701 1HG MET1002 1HG MET1002 -1.713 20.045 -4.904 702 2HG MET1002 2HG MET1002 -0.590 18.704 -4.802 703 1HE MET1002 1HE MET1002 -2.158 20.329 -8.087 704 2HE MET1002 2HE MET1002 -3.792 19.808 -7.609 705 3HE MET1002 3HE MET1002 -2.779 20.721 -6.466 706 H LYS1003 H LYS1003 -5.236 19.000 -4.789 707 HA LYS1003 HA LYS1003 -4.866 21.079 -6.519 708 1HB LYS1003 1HB LYS1003 -7.035 19.240 -5.798 709 2HB LYS1003 2HB LYS1003 -7.618 20.771 -6.419 710 1HG LYS1003 1HG LYS1003 -6.038 20.524 -8.385 711 2HG LYS1003 2HG LYS1003 -5.583 18.944 -7.781 712 1HD LYS1003 1HD LYS1003 -8.502 19.629 -8.281 713 2HD LYS1003 2HD LYS1003 -7.471 19.100 -9.596 714 1HE LYS1003 1HE LYS1003 -7.363 16.929 -8.824 715 2HE LYS1003 2HE LYS1003 -7.294 17.415 -7.142 716 1HZ LYS1003 1HZ LYS1003 -9.606 17.756 -7.128 717 2HZ LYS1003 2HZ LYS1003 -9.741 17.612 -8.749 718 3HZ LYS1003 3HZ LYS1003 -9.373 16.305 -7.841 719 H LEU1004 H LEU1004 -5.940 21.148 -3.185 720 HA LEU1004 HA LEU1004 -7.072 23.799 -3.483 721 1HB LEU1004 1HB LEU1004 -6.668 22.238 -0.939 722 2HB LEU1004 2HB LEU1004 -7.758 23.580 -1.226 723 HG LEU1004 HG LEU1004 -8.038 20.919 -2.637 724 1HD1 LEU1004 1HD1 LEU1004 -8.187 21.021 0.017 725 2HD1 LEU1004 2HD1 LEU1004 -9.823 21.618 -0.354 726 3HD1 LEU1004 3HD1 LEU1004 -9.296 20.030 -0.962 727 1HD2 LEU1004 1HD2 LEU1004 -9.566 22.006 -3.824 728 2HD2 LEU1004 2HD2 LEU1004 -10.520 22.191 -2.333 729 3HD2 LEU1004 3HD2 LEU1004 -9.383 23.469 -2.826 730 H ALA1005 H ALA1005 -4.205 22.134 -2.078 731 HA ALA1005 HA ALA1005 -3.080 24.238 -0.736 732 1HB ALA1005 1HB ALA1005 -0.957 22.859 -1.965 733 2HB ALA1005 2HB ALA1005 -1.694 22.501 -0.384 734 3HB ALA1005 3HB ALA1005 -2.274 21.667 -1.846 735 H GLN1006 H GLN1006 -3.612 23.825 -4.172 736 HA GLN1006 HA GLN1006 -1.540 25.556 -4.985 737 1HB GLN1006 1HB GLN1006 -2.599 23.806 -6.443 738 2HB GLN1006 2HB GLN1006 -4.081 24.740 -6.463 739 1HG GLN1006 1HG GLN1006 -3.162 25.636 -8.372 740 2HG GLN1006 2HG GLN1006 -2.356 26.695 -7.232 741 1HE2 GLN1006 1HE2 GLN1006 -1.340 26.166 -9.733 742 2HE2 GLN1006 2HE2 GLN1006 0.134 25.264 -9.614 743 H GLN1007 H GLN1007 -4.989 25.909 -4.089 744 HA GLN1007 HA GLN1007 -4.925 28.682 -4.862 745 1HB GLN1007 1HB GLN1007 -6.921 26.884 -5.003 746 2HB GLN1007 2HB GLN1007 -7.247 27.466 -3.382 747 1HG GLN1007 1HG GLN1007 -7.076 29.864 -4.417 748 2HG GLN1007 2HG GLN1007 -7.207 29.064 -5.970 749 1HE2 GLN1007 1HE2 GLN1007 -8.999 30.903 -4.483 750 2HE2 GLN1007 2HE2 GLN1007 -10.546 30.127 -4.404 751 H TYR1008 H TYR1008 -4.963 26.606 -1.937 752 HA TYR1008 HA TYR1008 -5.135 28.903 -0.191 753 1HB TYR1008 1HB TYR1008 -4.768 25.859 0.043 754 2HB TYR1008 2HB TYR1008 -4.723 26.880 1.466 755 HD1 TYR1008 HD1 TYR1008 -6.853 25.360 -1.083 756 HD2 TYR1008 HD2 TYR1008 -6.765 28.067 2.230 757 HE1 TYR1008 HE1 TYR1008 -9.387 25.242 -0.909 758 HE2 TYR1008 HE2 TYR1008 -9.298 27.940 2.392 759 HH TYR1008 HH TYR1008 -11.165 26.080 0.022 760 H VAL1009 H VAL1009 -2.928 29.238 -1.867 761 HA VAL1009 HA VAL1009 -0.767 28.889 0.075 762 HB VAL1009 HB VAL1009 -0.433 27.114 -1.471 763 1HG1 VAL1009 1HG1 VAL1009 -0.265 28.858 -3.885 764 2HG1 VAL1009 2HG1 VAL1009 -0.771 27.159 -3.728 765 3HG1 VAL1009 3HG1 VAL1009 -1.888 28.467 -3.268 766 1HG2 VAL1009 1HG2 VAL1009 1.363 29.453 -1.507 767 2HG2 VAL1009 2HG2 VAL1009 1.710 27.741 -1.166 768 3HG2 VAL1009 3HG2 VAL1009 1.612 28.310 -2.850 769 H MET1010 H MET1010 -2.013 30.487 -2.918 770 HA MET1010 HA MET1010 -0.383 32.398 -3.458 771 1HB MET1010 1HB MET1010 -2.602 33.978 -3.303 772 2HB MET1010 2HB MET1010 -2.437 32.726 -4.519 773 1HG MET1010 1HG MET1010 -4.063 31.413 -3.570 774 2HG MET1010 2HG MET1010 -3.480 31.697 -1.942 775 1HE MET1010 1HE MET1010 -6.817 31.993 -1.801 776 2HE MET1010 2HE MET1010 -5.327 31.796 -0.847 777 3HE MET1010 3HE MET1010 -6.345 33.238 -0.621 778 H THR1011 H THR1011 -2.893 33.424 -1.061 779 HA THR1011 HA THR1011 -1.526 35.546 -0.037 780 HB THR1011 HB THR1011 -3.797 35.342 0.584 781 HG1 THR1011 HG1 THR1011 -2.385 34.080 2.817 782 1HG2 THR1011 1HG2 THR1011 -3.204 32.493 0.604 783 2HG2 THR1011 2HG2 THR1011 -3.944 32.948 2.157 784 3HG2 THR1011 3HG2 THR1011 -4.796 33.289 0.632 785 H SER1012 H SER1012 -1.803 32.509 1.907 786 HA SER1012 HA SER1012 0.805 31.921 2.133 787 1HB SER1012 1HB SER1012 1.252 33.011 4.491 788 2HB SER1012 2HB SER1012 1.566 33.933 3.034 789 HG SER1012 HG SER1012 -0.818 34.077 4.676 790 H LEU1013 H LEU1013 -1.922 30.843 2.240 791 HA LEU1013 HA LEU1013 -2.301 29.986 4.970 792 1HB LEU1013 1HB LEU1013 -4.011 30.533 2.961 793 2HB LEU1013 2HB LEU1013 -3.857 28.801 2.745 794 HG LEU1013 HG LEU1013 -4.712 28.340 4.915 795 1HD1 LEU1013 1HD1 LEU1013 -5.399 30.334 6.412 796 2HD1 LEU1013 2HD1 LEU1013 -3.693 29.830 6.376 797 3HD1 LEU1013 3HD1 LEU1013 -4.219 31.258 5.453 798 1HD2 LEU1013 1HD2 LEU1013 -6.178 29.871 3.007 799 2HD2 LEU1013 2HD2 LEU1013 -6.767 28.632 4.141 800 3HD2 LEU1013 3HD2 LEU1013 -6.718 30.341 4.637 801 H GLN1014 H GLN1014 -0.376 29.086 2.294 802 HA GLN1014 HA GLN1014 -0.430 26.476 2.030 803 1HB GLN1014 1HB GLN1014 1.266 27.929 0.989 804 2HB GLN1014 2HB GLN1014 2.071 28.150 2.530 805 1HG GLN1014 1HG GLN1014 1.921 25.361 2.299 806 2HG GLN1014 2HG GLN1014 2.213 25.873 0.649 807 1HE2 GLN1014 1HE2 GLN1014 3.273 26.572 3.975 808 2HE2 GLN1014 2HE2 GLN1014 4.962 26.752 3.636 809 H GLN1015 H GLN1015 1.857 27.832 4.511 810 HA GLN1015 HA GLN1015 2.495 25.685 5.839 811 1HB GLN1015 1HB GLN1015 2.418 27.120 7.980 812 2HB GLN1015 2HB GLN1015 3.338 27.757 6.631 813 1HG GLN1015 1HG GLN1015 1.223 29.053 5.945 814 2HG GLN1015 2HG GLN1015 0.518 28.563 7.472 815 1HE2 GLN1015 1HE2 GLN1015 2.175 30.931 5.914 816 2HE2 GLN1015 2HE2 GLN1015 2.909 31.764 7.243 817 H GLU1016 H GLU1016 -0.731 27.229 5.960 818 HA GLU1016 HA GLU1016 -1.669 25.726 8.118 819 1HB GLU1016 1HB GLU1016 -2.596 27.878 6.720 820 2HB GLU1016 2HB GLU1016 -3.611 26.628 6.029 821 1HG GLU1016 1HG GLU1016 -4.299 25.920 8.334 822 2HG GLU1016 2HG GLU1016 -3.292 27.180 9.018 823 H TYR1017 H TYR1017 -2.574 25.460 4.598 824 HA TYR1017 HA TYR1017 -3.759 22.944 4.887 825 1HB TYR1017 1HB TYR1017 -2.776 24.861 2.792 826 2HB TYR1017 2HB TYR1017 -2.817 23.197 2.243 827 HD1 TYR1017 HD1 TYR1017 -4.809 22.300 1.406 828 HD2 TYR1017 HD2 TYR1017 -4.975 25.771 3.901 829 HE1 TYR1017 HE1 TYR1017 -7.300 22.520 0.946 830 HE2 TYR1017 HE2 TYR1017 -7.465 25.980 3.432 831 HH TYR1017 HH TYR1017 -9.315 23.730 2.494 832 H LYS1018 H LYS1018 -0.390 23.973 4.401 833 HA LYS1018 HA LYS1018 0.690 21.713 3.298 834 1HB LYS1018 1HB LYS1018 1.619 24.100 4.366 835 2HB LYS1018 2HB LYS1018 2.348 22.893 5.407 836 1HG LYS1018 1HG LYS1018 2.422 22.239 2.496 837 2HG LYS1018 2HG LYS1018 3.359 23.647 2.956 838 1HD LYS1018 1HD LYS1018 4.822 21.724 3.133 839 2HD LYS1018 2HD LYS1018 4.468 22.256 4.764 840 1HE LYS1018 1HE LYS1018 4.301 19.739 4.409 841 2HE LYS1018 2HE LYS1018 2.874 20.473 5.113 842 1HZ LYS1018 1HZ LYS1018 2.911 20.381 2.243 843 2HZ LYS1018 2HZ LYS1018 2.823 18.926 2.980 844 3HZ LYS1018 3HZ LYS1018 1.691 20.063 3.282 845 H LYS1019 H LYS1019 0.091 22.428 6.803 846 HA LYS1019 HA LYS1019 1.056 19.952 7.695 847 1HB LYS1019 1HB LYS1019 -0.299 22.300 8.806 848 2HB LYS1019 2HB LYS1019 -0.791 20.809 9.584 849 1HG LYS1019 1HG LYS1019 1.114 21.302 10.832 850 2HG LYS1019 2HG LYS1019 1.822 20.287 9.592 851 1HD LYS1019 1HD LYS1019 1.625 23.268 9.107 852 2HD LYS1019 2HD LYS1019 2.882 22.664 10.168 853 1HE LYS1019 1HE LYS1019 2.782 21.013 7.773 854 2HE LYS1019 2HE LYS1019 2.879 22.700 7.305 855 1HZ LYS1019 1HZ LYS1019 4.878 22.936 8.326 856 2HZ LYS1019 2HZ LYS1019 4.628 21.750 9.421 857 3HZ LYS1019 3HZ LYS1019 4.998 21.371 7.877 858 H GLN1020 H GLN1020 -2.175 21.101 6.618 859 HA GLN1020 HA GLN1020 -3.669 18.996 7.461 860 1HB GLN1020 1HB GLN1020 -3.948 20.515 4.830 861 2HB GLN1020 2HB GLN1020 -5.216 19.582 5.600 862 1HG GLN1020 1HG GLN1020 -3.868 22.092 6.693 863 2HG GLN1020 2HG GLN1020 -5.532 21.937 6.167 864 1HE2 GLN1020 1HE2 GLN1020 -3.962 22.476 8.783 865 2HE2 GLN1020 2HE2 GLN1020 -4.782 21.524 9.977 866 H MET1021 H MET1021 -1.867 19.338 4.326 867 HA MET1021 HA MET1021 -2.609 16.982 3.204 868 1HB MET1021 1HB MET1021 -0.637 19.028 2.812 869 2HB MET1021 2HB MET1021 0.245 17.515 2.767 870 1HG MET1021 1HG MET1021 -2.259 18.094 1.110 871 2HG MET1021 2HG MET1021 -0.621 18.240 0.506 872 1HE MET1021 1HE MET1021 0.816 14.749 0.630 873 2HE MET1021 2HE MET1021 1.100 16.460 1.027 874 3HE MET1021 3HE MET1021 0.574 15.328 2.295 875 H LEU1022 H LEU1022 0.103 17.608 5.518 876 HA LEU1022 HA LEU1022 1.236 15.093 5.459 877 1HB LEU1022 1HB LEU1022 1.654 17.460 6.777 878 2HB LEU1022 2HB LEU1022 1.168 16.402 8.087 879 HG LEU1022 HG LEU1022 3.128 15.113 6.361 880 1HD1 LEU1022 1HD1 LEU1022 4.305 16.972 5.843 881 2HD1 LEU1022 2HD1 LEU1022 3.642 17.912 7.202 882 3HD1 LEU1022 3HD1 LEU1022 4.949 16.738 7.486 883 1HD2 LEU1022 1HD2 LEU1022 4.275 15.308 8.815 884 2HD2 LEU1022 2HD2 LEU1022 2.556 15.508 9.231 885 3HD2 LEU1022 3HD2 LEU1022 3.095 14.060 8.348 886 H THR1023 H THR1023 -1.609 16.339 7.272 887 HA THR1023 HA THR1023 -2.004 14.202 8.972 888 HB THR1023 HB THR1023 -4.302 15.630 7.599 889 HG1 THR1023 HG1 THR1023 -3.589 17.457 9.042 890 1HG2 THR1023 1HG2 THR1023 -4.412 14.093 9.762 891 2HG2 THR1023 2HG2 THR1023 -3.672 15.497 10.567 892 3HG2 THR1023 3HG2 THR1023 -5.255 15.660 9.771 893 H ALA1024 H ALA1024 -3.006 14.572 5.528 894 HA ALA1024 HA ALA1024 -4.281 12.007 5.548 895 1HB ALA1024 1HB ALA1024 -5.250 13.548 4.070 896 2HB ALA1024 2HB ALA1024 -3.672 14.149 3.506 897 3HB ALA1024 3HB ALA1024 -4.251 12.548 2.988 898 H ALA1025 H ALA1025 -1.277 13.426 4.078 899 HA ALA1025 HA ALA1025 -0.345 11.107 2.915 900 1HB ALA1025 1HB ALA1025 0.670 13.752 3.687 901 2HB ALA1025 2HB ALA1025 1.924 12.491 3.748 902 3HB ALA1025 3HB ALA1025 1.020 12.775 2.242 903 H HIS1026 H HIS1026 -0.645 11.987 6.287 904 HA HIS1026 HA HIS1026 1.408 10.247 7.205 905 1HB HIS1026 1HB HIS1026 0.852 12.134 8.546 906 2HB HIS1026 2HB HIS1026 -0.853 11.732 8.550 907 HD1 HIS1026 HD1 HIS1026 2.229 9.632 9.491 908 HD2 HIS1026 HD2 HIS1026 -1.436 10.914 11.081 909 HE1 HIS1026 HE1 HIS1026 2.033 8.556 11.796 910 H ALA1027 H ALA1027 -2.225 10.130 7.209 911 HA ALA1027 HA ALA1027 -2.251 7.437 8.117 912 1HB ALA1027 1HB ALA1027 -4.167 9.563 7.363 913 2HB ALA1027 2HB ALA1027 -4.730 7.909 7.027 914 3HB ALA1027 3HB ALA1027 -4.246 8.366 8.677 915 H LEU1028 H LEU1028 -2.250 9.104 4.957 916 HA LEU1028 HA LEU1028 -3.081 6.949 3.400 917 1HB LEU1028 1HB LEU1028 -1.573 9.481 2.952 918 2HB LEU1028 2HB LEU1028 -1.540 8.268 1.688 919 HG LEU1028 HG LEU1028 -3.364 10.196 1.768 920 1HD1 LEU1028 1HD1 LEU1028 -3.022 8.407 0.038 921 2HD1 LEU1028 2HD1 LEU1028 -4.149 7.386 0.965 922 3HD1 LEU1028 3HD1 LEU1028 -4.709 8.925 0.268 923 1HD2 LEU1028 1HD2 LEU1028 -5.444 9.554 2.763 924 2HD2 LEU1028 2HD2 LEU1028 -4.781 7.980 3.267 925 3HD2 LEU1028 3HD2 LEU1028 -4.183 9.479 4.017 926 H ALA1029 H ALA1029 0.311 8.140 3.971 927 HA ALA1029 HA ALA1029 1.674 6.159 2.759 928 1HB ALA1029 1HB ALA1029 3.430 6.592 4.549 929 2HB ALA1029 2HB ALA1029 2.800 8.042 3.731 930 3HB ALA1029 3HB ALA1029 2.230 7.622 5.364 931 H VAL1030 H VAL1030 0.208 6.072 6.062 932 HA VAL1030 HA VAL1030 1.171 3.472 6.627 933 HB VAL1030 HB VAL1030 -0.797 5.389 7.804 934 1HG1 VAL1030 1HG1 VAL1030 -1.917 3.191 7.940 935 2HG1 VAL1030 2HG1 VAL1030 -0.477 2.517 8.741 936 3HG1 VAL1030 3HG1 VAL1030 -1.426 3.792 9.543 937 1HG2 VAL1030 1HG2 VAL1030 1.880 5.014 8.155 938 2HG2 VAL1030 2HG2 VAL1030 0.794 5.730 9.371 939 3HG2 VAL1030 3HG2 VAL1030 1.222 4.004 9.465 940 H ASP1031 H ASP1031 -1.950 4.811 5.385 941 HA ASP1031 HA ASP1031 -3.471 2.625 5.404 942 1HB ASP1031 1HB ASP1031 -3.751 5.061 4.331 943 2HB ASP1031 2HB ASP1031 -3.338 4.230 2.844 944 H ALA1032 H ALA1032 -1.226 3.631 2.707 945 HA ALA1032 HA ALA1032 -1.569 1.425 1.095 946 1HB ALA1032 1HB ALA1032 -0.238 2.775 -0.110 947 2HB ALA1032 2HB ALA1032 0.208 3.697 1.345 948 3HB ALA1032 3HB ALA1032 1.137 2.248 0.891 949 H LYS1033 H LYS1033 0.459 1.900 4.012 950 HA LYS1033 HA LYS1033 1.901 -0.514 3.683 951 1HB LYS1033 1HB LYS1033 1.524 1.490 5.890 952 2HB LYS1033 2HB LYS1033 2.292 -0.045 6.238 953 1HG LYS1033 1HG LYS1033 3.203 1.613 3.863 954 2HG LYS1033 2HG LYS1033 3.780 1.990 5.474 955 1HD LYS1033 1HD LYS1033 4.201 -0.713 5.467 956 2HD LYS1033 2HD LYS1033 4.369 -0.391 3.753 957 1HE LYS1033 1HE LYS1033 5.891 1.086 5.955 958 2HE LYS1033 2HE LYS1033 6.549 -0.223 4.994 959 1HZ LYS1033 1HZ LYS1033 5.479 2.236 3.804 960 2HZ LYS1033 2HZ LYS1033 7.055 2.040 4.184 961 3HZ LYS1033 3HZ LYS1033 6.360 1.079 3.061 962 H ASN1034 H ASN1034 -0.751 0.421 5.992 963 HA ASN1034 HA ASN1034 -1.178 -1.908 7.165 964 1HB ASN1034 1HB ASN1034 -2.525 0.367 7.242 965 2HB ASN1034 2HB ASN1034 -3.558 -0.376 6.037 966 1HD2 ASN1034 1HD2 ASN1034 -5.095 0.035 7.848 967 2HD2 ASN1034 2HD2 ASN1034 -5.343 -1.219 9.017 968 H LEU1035 H LEU1035 -2.180 -0.923 3.845 969 HA LEU1035 HA LEU1035 -3.880 -2.994 3.228 970 1HB LEU1035 1HB LEU1035 -3.632 -1.048 1.848 971 2HB LEU1035 2HB LEU1035 -1.954 -1.426 1.515 972 HG LEU1035 HG LEU1035 -4.001 -3.457 0.735 973 1HD1 LEU1035 1HD1 LEU1035 -4.284 -2.227 -1.466 974 2HD1 LEU1035 2HD1 LEU1035 -5.155 -1.559 -0.065 975 3HD1 LEU1035 3HD1 LEU1035 -3.656 -0.785 -0.633 976 1HD2 LEU1035 1HD2 LEU1035 -2.459 -3.705 -1.204 977 2HD2 LEU1035 2HD2 LEU1035 -1.414 -2.457 -0.483 978 3HD2 LEU1035 3HD2 LEU1035 -1.687 -3.993 0.374 979 H LEU1036 H LEU1036 -0.349 -2.822 2.367 980 HA LEU1036 HA LEU1036 -0.215 -5.517 1.646 981 1HB LEU1036 1HB LEU1036 1.339 -3.754 0.926 982 2HB LEU1036 2HB LEU1036 1.973 -3.643 2.556 983 HG LEU1036 HG LEU1036 2.051 -6.268 1.089 984 1HD1 LEU1036 1HD1 LEU1036 4.543 -5.317 0.631 985 2HD1 LEU1036 2HD1 LEU1036 3.213 -5.253 -0.551 986 3HD1 LEU1036 3HD1 LEU1036 3.589 -3.826 0.444 987 1HD2 LEU1036 1HD2 LEU1036 3.220 -6.959 2.845 988 2HD2 LEU1036 2HD2 LEU1036 4.348 -5.589 2.709 989 3HD2 LEU1036 3HD2 LEU1036 2.840 -5.411 3.638 990 H ASP1037 H ASP1037 0.240 -3.800 4.760 991 HA ASP1037 HA ASP1037 1.488 -5.605 6.244 992 1HB ASP1037 1HB ASP1037 0.259 -3.357 6.860 993 2HB ASP1037 2HB ASP1037 -1.104 -4.385 7.255 994 H VAL1038 H VAL1038 -2.043 -5.572 5.386 995 HA VAL1038 HA VAL1038 -2.705 -7.886 6.831 996 HB VAL1038 HB VAL1038 -4.064 -6.799 4.364 997 1HG1 VAL1038 1HG1 VAL1038 -5.626 -7.793 6.673 998 2HG1 VAL1038 2HG1 VAL1038 -5.863 -8.047 4.928 999 3HG1 VAL1038 3HG1 VAL1038 -4.668 -9.023 5.815 1000 1HG2 VAL1038 1HG2 VAL1038 -3.514 -5.411 6.795 1001 2HG2 VAL1038 2HG2 VAL1038 -4.515 -4.889 5.419 1002 3HG2 VAL1038 3HG2 VAL1038 -5.253 -5.792 6.763 1003 H ILE1039 H ILE1039 -1.477 -7.290 3.514 1004 HA ILE1039 HA ILE1039 -1.939 -9.848 2.513 1005 HB ILE1039 HB ILE1039 -0.340 -7.481 1.810 1006 1HG1 ILE1039 1HG1 ILE1039 -1.972 -9.418 0.142 1007 2HG1 ILE1039 2HG1 ILE1039 -2.623 -8.003 0.946 1008 1HG2 ILE1039 1HG2 ILE1039 0.682 -9.050 -0.090 1009 2HG2 ILE1039 2HG2 ILE1039 1.530 -8.716 1.439 1010 3HG2 ILE1039 3HG2 ILE1039 0.629 -10.237 1.235 1011 1HD1 ILE1039 1HD1 ILE1039 -0.350 -7.052 -0.452 1012 2HD1 ILE1039 2HD1 ILE1039 -1.161 -8.173 -1.571 1013 3HD1 ILE1039 3HD1 ILE1039 -2.058 -6.797 -0.885 1014 H ASP1040 H ASP1040 1.023 -8.426 4.061 1015 HA ASP1040 HA ASP1040 2.621 -10.575 3.923 1016 1HB ASP1040 1HB ASP1040 3.175 -8.321 4.912 1017 2HB ASP1040 2HB ASP1040 2.273 -8.753 6.352 1018 H GLN1041 H GLN1041 0.055 -9.813 6.368 1019 HA GLN1041 HA GLN1041 0.565 -12.008 7.997 1020 1HB GLN1041 1HB GLN1041 -1.562 -9.958 7.692 1021 2HB GLN1041 2HB GLN1041 -2.117 -11.464 8.395 1022 1HG GLN1041 1HG GLN1041 -0.708 -11.277 10.271 1023 2HG GLN1041 2HG GLN1041 0.456 -10.270 9.433 1024 1HE2 GLN1041 1HE2 GLN1041 -2.856 -10.356 10.680 1025 2HE2 GLN1041 2HE2 GLN1041 -2.998 -8.675 11.070 1026 H ALA1042 H ALA1042 -0.923 -11.711 4.865 1027 HA ALA1042 HA ALA1042 -2.521 -14.097 5.146 1028 1HB ALA1042 1HB ALA1042 -1.958 -12.938 2.465 1029 2HB ALA1042 2HB ALA1042 -3.507 -13.397 3.212 1030 3HB ALA1042 3HB ALA1042 -2.743 -11.845 3.630 1031 H ARG1043 H ARG1043 0.318 -13.043 3.127 1032 HA ARG1043 HA ARG1043 0.913 -15.239 1.850 1033 1HB ARG1043 1HB ARG1043 2.279 -13.025 2.150 1034 2HB ARG1043 2HB ARG1043 3.108 -13.856 3.451 1035 1HG ARG1043 1HG ARG1043 4.114 -15.421 2.008 1036 2HG ARG1043 2HG ARG1043 2.869 -15.257 0.785 1037 1HD ARG1043 1HD ARG1043 4.225 -13.808 -0.319 1038 2HD ARG1043 2HD ARG1043 4.005 -12.667 0.993 1039 HE ARG1043 HE ARG1043 6.002 -14.627 1.711 1040 1HH1 ARG1043 2HH2 ARG1043 5.518 -11.774 -0.291 1041 2HH1 ARG1043 1HH2 ARG1043 7.190 -11.321 -0.274 1042 1HH2 ARG1043 2HH1 ARG1043 8.208 -14.030 1.734 1043 2HH2 ARG1043 1HH1 ARG1043 8.730 -12.613 0.885 1044 H LEU1044 H LEU1044 1.616 -14.669 5.353 1045 HA LEU1044 HA LEU1044 2.943 -17.134 5.729 1046 1HB LEU1044 1HB LEU1044 2.628 -16.613 8.131 1047 2HB LEU1044 2HB LEU1044 3.417 -15.355 7.200 1048 HG LEU1044 HG LEU1044 0.898 -14.436 7.049 1049 1HD1 LEU1044 1HD1 LEU1044 0.874 -16.419 9.231 1050 2HD1 LEU1044 2HD1 LEU1044 0.225 -14.817 9.658 1051 3HD1 LEU1044 3HD1 LEU1044 -0.464 -15.720 8.288 1052 1HD2 LEU1044 1HD2 LEU1044 2.374 -12.886 7.811 1053 2HD2 LEU1044 2HD2 LEU1044 1.549 -13.247 9.346 1054 3HD2 LEU1044 3HD2 LEU1044 3.120 -14.000 8.982 1055 H LYS1045 H LYS1045 -0.435 -15.985 6.363 1056 HA LYS1045 HA LYS1045 -1.510 -18.123 7.560 1057 1HB LYS1045 1HB LYS1045 -2.504 -16.094 5.638 1058 2HB LYS1045 2HB LYS1045 -3.511 -17.515 5.828 1059 1HG LYS1045 1HG LYS1045 -2.965 -17.031 8.453 1060 2HG LYS1045 2HG LYS1045 -2.811 -15.397 7.837 1061 1HD LYS1045 1HD LYS1045 -5.095 -15.745 6.690 1062 2HD LYS1045 2HD LYS1045 -5.241 -17.226 7.615 1063 1HE LYS1045 1HE LYS1045 -4.651 -14.564 8.971 1064 2HE LYS1045 2HE LYS1045 -6.293 -15.066 8.622 1065 1HZ LYS1045 1HZ LYS1045 -5.668 -15.757 10.799 1066 2HZ LYS1045 2HZ LYS1045 -5.845 -17.092 9.875 1067 3HZ LYS1045 3HZ LYS1045 -4.351 -16.552 10.251 1068 H MET1046 H MET1046 -0.319 -17.936 4.220 1069 HA MET1046 HA MET1046 -1.522 -20.444 3.551 1070 1HB MET1046 1HB MET1046 -1.337 -19.090 1.639 1071 2HB MET1046 2HB MET1046 0.129 -18.313 2.205 1072 1HG MET1046 1HG MET1046 1.462 -20.318 1.658 1073 2HG MET1046 2HG MET1046 0.015 -21.209 1.232 1074 1HE MET1046 1HE MET1046 2.367 -18.051 -0.691 1075 2HE MET1046 2HE MET1046 0.823 -17.208 -0.423 1076 3HE MET1046 3HE MET1046 1.669 -17.972 0.944 1077 H ILE1047 H ILE1047 1.848 -19.153 3.988 1078 HA ILE1047 HA ILE1047 3.202 -21.501 3.561 1079 HB ILE1047 HB ILE1047 3.730 -19.036 5.171 1080 1HG1 ILE1047 1HG1 ILE1047 5.663 -19.834 3.145 1081 2HG1 ILE1047 2HG1 ILE1047 4.041 -19.762 2.485 1082 1HG2 ILE1047 1HG2 ILE1047 5.244 -21.612 5.303 1083 2HG2 ILE1047 2HG2 ILE1047 6.149 -20.079 5.301 1084 3HG2 ILE1047 3HG2 ILE1047 4.936 -20.395 6.564 1085 1HD1 ILE1047 1HD1 ILE1047 5.738 -17.565 3.608 1086 2HD1 ILE1047 2HD1 ILE1047 4.577 -17.529 2.260 1087 3HD1 ILE1047 3HD1 ILE1047 3.992 -17.469 3.940 1088 H SER1048 H SER1048 2.533 -20.153 6.869 1089 HA SER1048 HA SER1048 2.926 -22.697 8.004 1090 1HB SER1048 1HB SER1048 2.934 -20.084 8.928 1091 2HB SER1048 2HB SER1048 1.439 -20.692 9.612 1092 HG SER1048 HG SER1048 2.584 -21.763 11.058 1093 H GLN1049 H GLN1049 1.314 -23.883 6.606 1094 HA GLN1049 HA GLN1049 -1.018 -24.339 8.045 1095 1HB GLN1049 1HB GLN1049 -1.258 -22.141 6.273 1096 2HB GLN1049 2HB GLN1049 -2.054 -23.470 5.454 1097 1HG GLN1049 1HG GLN1049 -2.616 -22.915 8.388 1098 2HG GLN1049 2HG GLN1049 -3.441 -22.003 7.139 1099 1HE2 GLN1049 1HE2 GLN1049 -4.282 -24.069 9.153 1100 2HE2 GLN1049 2HE2 GLN1049 -5.171 -25.261 8.264 1101 H SER1050 H SER1050 1.266 -25.754 6.918 1102 HA SER1050 HA SER1050 1.776 -27.545 5.803 1103 1HB SER1050 1HB SER1050 0.161 -28.780 6.992 1104 2HB SER1050 2HB SER1050 -1.186 -27.953 6.233 1105 HG SER1050 HG SER1050 -0.784 -30.203 5.486 1106 H ARG1051 H ARG1051 2.557 -26.503 3.888 1107 HA ARG1051 HA ARG1051 0.597 -26.390 1.741 1108 1HB ARG1051 1HB ARG1051 1.657 -24.208 2.242 1109 2HB ARG1051 2HB ARG1051 3.255 -24.912 2.087 1110 1HG ARG1051 1HG ARG1051 2.969 -23.939 -0.029 1111 2HG ARG1051 2HG ARG1051 2.467 -25.590 -0.337 1112 1HD ARG1051 1HD ARG1051 0.062 -24.875 0.102 1113 2HD ARG1051 2HD ARG1051 0.623 -23.220 0.232 1114 HE ARG1051 HE ARG1051 1.639 -24.228 -2.214 1115 1HH1 ARG1051 2HH2 ARG1051 -1.495 -23.549 -0.764 1116 2HH1 ARG1051 1HH2 ARG1051 -2.270 -23.230 -2.280 1117 1HH2 ARG1051 2HH1 ARG1051 0.617 -23.807 -4.214 1118 2HH2 ARG1051 1HH1 ARG1051 -1.060 -23.377 -4.256 1119 HA PRO1052 HA PRO1052 3.175 -29.790 0.426 1120 1HB PRO1052 1HB PRO1052 1.288 -31.043 -1.103 1121 2HB PRO1052 2HB PRO1052 1.508 -31.368 0.604 1122 1HG PRO1052 1HG PRO1052 -0.626 -29.815 -0.727 1123 2HG PRO1052 2HG PRO1052 -0.612 -30.503 0.885 1124 1HD PRO1052 1HD PRO1052 -0.228 -27.746 0.192 1125 2HD PRO1052 2HD PRO1052 -0.099 -28.452 1.790 1126 H HIS1053 H HIS1053 0.891 -28.404 -1.896 1127 HA HIS1053 HA HIS1053 3.087 -28.421 -3.812 1128 1HB HIS1053 1HB HIS1053 0.769 -29.462 -4.255 1129 2HB HIS1053 2HB HIS1053 0.189 -27.815 -4.404 1130 HD1 HIS1053 HD1 HIS1053 -0.065 -29.488 -6.875 1131 HD2 HIS1053 HD2 HIS1053 3.420 -27.324 -5.999 1132 HE1 HIS1053 HE1 HIS1053 1.143 -29.148 -9.097
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