NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
644191 | 6iws | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 HIS 1 H HIS 1 1.807 0.000 0.855 2 HA HIS 1 HA HIS 1 1.754 0.830 -1.842 3 HB2 HIS 1 2HB HIS 1 4.126 0.211 -1.882 4 HB3 HIS 1 3HB HIS 1 3.733 1.102 -0.414 5 HD1 HIS 1 HD1 HIS 1 4.569 -2.369 -1.610 6 HD2 HIS 1 HD2 HIS 1 4.169 -0.261 1.947 7 HE1 HIS 1 HE1 HIS 1 5.462 -3.894 0.179 8 H MET 2 H MET 2 0.038 -1.483 -1.229 9 HA MET 2 HA MET 2 1.269 -3.638 -2.767 10 HB2 MET 2 2HB MET 2 -0.735 -4.933 -2.142 11 HB3 MET 2 3HB MET 2 0.097 -4.280 -0.738 12 HG2 MET 2 2HG MET 2 -1.542 -2.529 -0.524 13 HG3 MET 2 3HG MET 2 -2.336 -3.050 -2.008 14 HE1 MET 2 1HE MET 2 -4.347 -6.103 -1.079 15 HE2 MET 2 2HE MET 2 -4.300 -4.630 -2.048 16 HE3 MET 2 3HE MET 2 -2.996 -5.811 -2.174 17 H LEU 3 H LEU 3 -0.230 -4.753 -4.379 18 HA LEU 3 HA LEU 3 -1.027 -2.787 -6.328 19 HB2 LEU 3 2HB LEU 3 -0.923 -5.788 -6.314 20 HB3 LEU 3 3HB LEU 3 -1.621 -4.885 -7.657 21 HG LEU 3 HG LEU 3 1.211 -4.479 -6.721 22 HD11 LEU 3 1HD1 LEU 3 0.045 -6.572 -8.474 23 HD12 LEU 3 2HD1 LEU 3 1.428 -6.647 -7.383 24 HD13 LEU 3 3HD1 LEU 3 1.583 -5.850 -8.949 25 HD21 LEU 3 1HD2 LEU 3 -0.230 -2.866 -8.260 26 HD22 LEU 3 2HD2 LEU 3 0.269 -4.019 -9.497 27 HD23 LEU 3 3HD2 LEU 3 1.485 -3.157 -8.553 28 H ALA 4 H ALA 4 -3.103 -2.753 -7.378 29 HA ALA 4 HA ALA 4 -5.267 -2.852 -5.513 30 HB1 ALA 4 1HB ALA 4 -6.586 -2.306 -7.700 31 HB2 ALA 4 2HB ALA 4 -5.508 -1.105 -6.990 32 HB3 ALA 4 3HB ALA 4 -4.975 -2.059 -8.374 33 H LYS 5 H LYS 5 -7.318 -3.970 -5.938 34 HA LYS 5 HA LYS 5 -6.816 -6.687 -6.934 35 HB2 LYS 5 2HB LYS 5 -7.650 -6.142 -4.524 36 HB3 LYS 5 3HB LYS 5 -9.210 -5.906 -5.302 37 HG2 LYS 5 2HG LYS 5 -9.387 -8.098 -4.728 38 HG3 LYS 5 3HG LYS 5 -8.672 -8.270 -6.333 39 HD2 LYS 5 2HD LYS 5 -7.400 -9.697 -4.987 40 HD3 LYS 5 3HD LYS 5 -6.413 -8.238 -5.116 41 HE2 LYS 5 2HE LYS 5 -6.892 -7.576 -2.937 42 HE3 LYS 5 3HE LYS 5 -8.331 -8.589 -2.843 43 HZ1 LYS 5 1HZ LYS 5 -5.937 -9.223 -1.797 44 HZ2 LYS 5 2HZ LYS 5 -5.880 -10.048 -3.273 45 HZ3 LYS 5 3HZ LYS 5 -7.141 -10.347 -2.185 46 H GLU 6 H GLU 6 -7.121 -6.035 -9.148 47 HA GLU 6 HA GLU 6 -9.770 -5.125 -9.925 48 HB2 GLU 6 2HB GLU 6 -8.844 -5.068 -12.204 49 HB3 GLU 6 3HB GLU 6 -7.852 -4.162 -11.070 50 HG2 GLU 6 2HG GLU 6 -6.196 -5.848 -11.025 51 HG3 GLU 6 3HG GLU 6 -7.242 -6.993 -11.863 52 H ASP 7 H ASP 7 -10.770 -6.266 -11.872 53 HA ASP 7 HA ASP 7 -10.735 -9.164 -11.355 54 HB2 ASP 7 2HB ASP 7 -12.961 -7.534 -12.593 55 HB3 ASP 7 3HB ASP 7 -13.031 -9.229 -12.119 56 H TYR 8 H TYR 8 -11.319 -10.532 -13.261 57 HA TYR 8 HA TYR 8 -9.492 -10.146 -15.345 58 HB2 TYR 8 2HB TYR 8 -11.959 -11.891 -15.425 59 HB3 TYR 8 3HB TYR 8 -10.499 -12.080 -16.389 60 HD1 TYR 8 HD1 TYR 8 -12.058 -13.885 -14.205 61 HD2 TYR 8 HD2 TYR 8 -8.424 -11.673 -14.296 62 HE1 TYR 8 HE1 TYR 8 -11.120 -15.367 -12.481 63 HE2 TYR 8 HE2 TYR 8 -7.475 -13.150 -12.573 64 HH TYR 8 HH TYR 8 -9.033 -16.070 -11.594 65 H TYR 9 H TYR 9 -12.821 -9.183 -14.989 66 HA TYR 9 HA TYR 9 -13.603 -8.761 -17.599 67 HB2 TYR 9 2HB TYR 9 -14.204 -6.995 -15.217 68 HB3 TYR 9 3HB TYR 9 -15.114 -7.030 -16.723 69 HD1 TYR 9 HD1 TYR 9 -14.632 -8.556 -13.494 70 HD2 TYR 9 HD2 TYR 9 -16.371 -9.120 -17.336 71 HE1 TYR 9 HE1 TYR 9 -16.062 -10.335 -12.578 72 HE2 TYR 9 HE2 TYR 9 -17.807 -10.900 -16.431 73 HH TYR 9 HH TYR 9 -17.276 -12.452 -13.644 74 H GLN 10 H GLN 10 -11.656 -6.662 -15.520 75 HA GLN 10 HA GLN 10 -11.447 -4.574 -17.467 76 HB2 GLN 10 2HB GLN 10 -9.957 -5.128 -14.902 77 HB3 GLN 10 3HB GLN 10 -9.650 -3.719 -15.907 78 HG2 GLN 10 2HG GLN 10 -11.112 -2.835 -14.405 79 HG3 GLN 10 3HG GLN 10 -12.235 -3.368 -15.655 80 HE21 GLN 10 1HE2 GLN 10 -13.754 -3.258 -13.834 81 HE22 GLN 10 2HE2 GLN 10 -13.913 -4.641 -12.811 82 H ILE 11 H ILE 11 -9.392 -7.246 -16.410 83 HA ILE 11 HA ILE 11 -7.086 -6.596 -17.848 84 HB ILE 11 HB ILE 11 -8.135 -9.351 -17.189 85 HG12 ILE 11 2HG1 ILE 11 -6.089 -7.730 -15.674 86 HG13 ILE 11 3HG1 ILE 11 -7.803 -7.707 -15.273 87 HG21 ILE 11 1HG2 ILE 11 -5.392 -9.462 -17.172 88 HG22 ILE 11 2HG2 ILE 11 -6.439 -10.031 -18.472 89 HG23 ILE 11 3HG2 ILE 11 -5.735 -8.416 -18.550 90 HD11 ILE 11 1HD1 ILE 11 -7.719 -9.708 -14.277 91 HD12 ILE 11 2HD1 ILE 11 -6.623 -10.381 -15.485 92 HD13 ILE 11 3HD1 ILE 11 -5.990 -9.380 -14.178 93 H LEU 12 H LEU 12 -10.128 -7.811 -18.914 94 HA LEU 12 HA LEU 12 -9.005 -8.441 -21.559 95 HB2 LEU 12 2HB LEU 12 -11.357 -9.420 -20.034 96 HB3 LEU 12 3HB LEU 12 -11.492 -9.343 -21.789 97 HG LEU 12 HG LEU 12 -9.321 -10.850 -20.337 98 HD11 LEU 12 1HD1 LEU 12 -12.104 -11.531 -20.816 99 HD12 LEU 12 2HD1 LEU 12 -10.898 -12.331 -19.808 100 HD13 LEU 12 3HD1 LEU 12 -10.985 -12.692 -21.532 101 HD21 LEU 12 1HD2 LEU 12 -10.271 -11.121 -23.180 102 HD22 LEU 12 2HD2 LEU 12 -8.828 -11.819 -22.443 103 HD23 LEU 12 3HD2 LEU 12 -8.932 -10.077 -22.705 104 H GLY 13 H GLY 13 -10.859 -6.167 -19.834 105 HA2 GLY 13 2HA GLY 13 -11.672 -4.125 -20.561 106 HA3 GLY 13 3HA GLY 13 -11.221 -4.569 -22.200 107 H VAL 14 H VAL 14 -13.209 -6.696 -20.311 108 HA VAL 14 HA VAL 14 -15.496 -6.003 -22.034 109 HB VAL 14 HB VAL 14 -16.301 -8.275 -21.736 110 HG11 VAL 14 1HG1 VAL 14 -13.527 -8.920 -22.424 111 HG12 VAL 14 2HG1 VAL 14 -15.003 -9.083 -23.378 112 HG13 VAL 14 3HG1 VAL 14 -14.184 -7.524 -23.277 113 HG21 VAL 14 1HG2 VAL 14 -13.836 -8.677 -20.043 114 HG22 VAL 14 2HG2 VAL 14 -15.508 -8.695 -19.483 115 HG23 VAL 14 3HG2 VAL 14 -14.929 -9.957 -20.570 116 HA PRO 15 HA PRO 15 -17.889 -4.844 -18.538 117 HB2 PRO 15 2HB PRO 15 -20.373 -5.570 -19.360 118 HB3 PRO 15 3HB PRO 15 -19.508 -4.179 -20.026 119 HG2 PRO 15 2HG PRO 15 -19.800 -6.941 -21.144 120 HG3 PRO 15 3HG PRO 15 -19.910 -5.379 -21.977 121 HD2 PRO 15 2HD PRO 15 -17.687 -6.924 -22.064 122 HD3 PRO 15 3HD PRO 15 -17.620 -5.150 -22.116 123 H ARG 16 H ARG 16 -19.664 -5.730 -17.050 124 HA ARG 16 HA ARG 16 -18.796 -8.300 -16.094 125 HB2 ARG 16 2HB ARG 16 -20.988 -6.469 -15.100 126 HB3 ARG 16 3HB ARG 16 -20.399 -7.898 -14.260 127 HG2 ARG 16 2HG ARG 16 -19.182 -6.328 -13.176 128 HG3 ARG 16 3HG ARG 16 -18.084 -6.629 -14.524 129 HD2 ARG 16 2HD ARG 16 -18.575 -4.638 -15.547 130 HD3 ARG 16 3HD ARG 16 -20.193 -4.558 -14.851 131 HE ARG 16 HE ARG 16 -18.490 -4.285 -12.723 132 HH11 ARG 16 1HH1 ARG 16 -19.005 -2.611 -15.732 133 HH12 ARG 16 2HH1 ARG 16 -18.497 -1.074 -15.114 134 HH21 ARG 16 1HH2 ARG 16 -17.818 -2.267 -11.898 135 HH22 ARG 16 2HH2 ARG 16 -17.821 -0.880 -12.934 136 H ASN 17 H ASN 17 -21.042 -7.309 -18.358 137 HA ASN 17 HA ASN 17 -22.661 -9.741 -17.974 138 HB2 ASN 17 2HB ASN 17 -24.375 -8.532 -19.393 139 HB3 ASN 17 3HB ASN 17 -24.099 -7.849 -17.793 140 HD21 ASN 17 1HD2 ASN 17 -24.945 -5.870 -18.537 141 HD22 ASN 17 2HD2 ASN 17 -23.999 -4.806 -19.516 142 H ALA 18 H ALA 18 -20.110 -8.759 -19.639 143 HA ALA 18 HA ALA 18 -20.607 -9.099 -22.340 144 HB1 ALA 18 1HB ALA 18 -18.384 -8.970 -22.557 145 HB2 ALA 18 2HB ALA 18 -18.376 -8.703 -20.814 146 HB3 ALA 18 3HB ALA 18 -18.102 -10.321 -21.459 147 H SER 19 H SER 19 -20.095 -10.941 -23.739 148 HA SER 19 HA SER 19 -21.012 -13.458 -22.523 149 HB2 SER 19 2HB SER 19 -21.101 -12.619 -25.431 150 HB3 SER 19 3HB SER 19 -21.783 -14.097 -24.752 151 HG SER 19 HG SER 19 -23.373 -12.484 -24.996 152 H GLN 20 H GLN 20 -20.132 -15.464 -23.460 153 HA GLN 20 HA GLN 20 -17.351 -15.561 -23.307 154 HB2 GLN 20 2HB GLN 20 -19.052 -17.585 -24.759 155 HB3 GLN 20 3HB GLN 20 -17.519 -17.857 -23.942 156 HG2 GLN 20 2HG GLN 20 -20.224 -17.392 -22.752 157 HG3 GLN 20 3HG GLN 20 -19.114 -18.737 -22.497 158 HE21 GLN 20 1HE2 GLN 20 -17.236 -18.381 -21.222 159 HE22 GLN 20 2HE2 GLN 20 -17.201 -17.122 -20.039 160 H LYS 21 H LYS 21 -19.443 -14.942 -26.002 161 HA LYS 21 HA LYS 21 -17.458 -15.444 -28.020 162 HB2 LYS 21 2HB LYS 21 -20.098 -13.976 -28.175 163 HB3 LYS 21 3HB LYS 21 -19.105 -14.422 -29.556 164 HG2 LYS 21 2HG LYS 21 -19.354 -16.833 -28.509 165 HG3 LYS 21 3HG LYS 21 -20.809 -16.115 -27.814 166 HD2 LYS 21 2HD LYS 21 -21.542 -17.033 -29.833 167 HD3 LYS 21 3HD LYS 21 -21.317 -15.321 -30.203 168 HE2 LYS 21 2HE LYS 21 -19.078 -15.860 -31.113 169 HE3 LYS 21 3HE LYS 21 -19.402 -17.569 -30.825 170 HZ1 LYS 21 1HZ LYS 21 -20.430 -15.810 -32.895 171 HZ2 LYS 21 2HZ LYS 21 -21.547 -16.897 -32.239 172 HZ3 LYS 21 3HZ LYS 21 -20.120 -17.473 -32.941 173 H GLU 22 H GLU 22 -18.875 -12.554 -26.520 174 HA GLU 22 HA GLU 22 -17.418 -10.667 -28.020 175 HB2 GLU 22 2HB GLU 22 -19.419 -10.078 -26.733 176 HB3 GLU 22 3HB GLU 22 -18.567 -10.423 -25.235 177 HG2 GLU 22 2HG GLU 22 -18.462 -8.122 -25.380 178 HG3 GLU 22 3HG GLU 22 -16.899 -8.630 -26.019 179 H ILE 23 H ILE 23 -16.625 -12.551 -25.200 180 HA ILE 23 HA ILE 23 -14.388 -11.025 -24.349 181 HB ILE 23 HB ILE 23 -15.011 -13.944 -23.892 182 HG12 ILE 23 2HG1 ILE 23 -15.283 -11.844 -21.793 183 HG13 ILE 23 3HG1 ILE 23 -16.521 -11.922 -23.042 184 HG21 ILE 23 1HG2 ILE 23 -13.025 -12.141 -22.516 185 HG22 ILE 23 2HG2 ILE 23 -13.434 -13.781 -22.017 186 HG23 ILE 23 3HG2 ILE 23 -12.646 -13.503 -23.570 187 HD11 ILE 23 1HD1 ILE 23 -16.090 -14.555 -22.130 188 HD12 ILE 23 2HD1 ILE 23 -16.232 -13.516 -20.712 189 HD13 ILE 23 3HD1 ILE 23 -17.516 -13.539 -21.921 190 H LYS 24 H LYS 24 -14.828 -13.597 -26.683 191 HA LYS 24 HA LYS 24 -12.130 -14.310 -27.037 192 HB2 LYS 24 2HB LYS 24 -14.636 -14.614 -28.614 193 HB3 LYS 24 3HB LYS 24 -13.113 -14.851 -29.460 194 HG2 LYS 24 2HG LYS 24 -12.482 -16.602 -27.934 195 HG3 LYS 24 3HG LYS 24 -13.920 -16.309 -26.952 196 HD2 LYS 24 2HD LYS 24 -14.473 -18.171 -28.263 197 HD3 LYS 24 3HD LYS 24 -15.253 -16.812 -29.076 198 HE2 LYS 24 2HE LYS 24 -13.276 -16.682 -30.592 199 HE3 LYS 24 3HE LYS 24 -12.665 -18.156 -29.844 200 HZ1 LYS 24 1HZ LYS 24 -13.822 -18.699 -31.856 201 HZ2 LYS 24 2HZ LYS 24 -15.205 -17.865 -31.353 202 HZ3 LYS 24 3HZ LYS 24 -14.726 -19.272 -30.546 203 H LYS 25 H LYS 25 -14.134 -11.825 -28.546 204 HA LYS 25 HA LYS 25 -12.175 -11.009 -30.445 205 HB2 LYS 25 2HB LYS 25 -14.559 -9.502 -29.354 206 HB3 LYS 25 3HB LYS 25 -13.626 -9.045 -30.772 207 HG2 LYS 25 2HG LYS 25 -14.512 -10.708 -32.066 208 HG3 LYS 25 3HG LYS 25 -14.842 -11.757 -30.685 209 HD2 LYS 25 2HD LYS 25 -16.959 -11.042 -31.366 210 HD3 LYS 25 3HD LYS 25 -16.572 -9.983 -30.007 211 HE2 LYS 25 2HE LYS 25 -15.838 -9.120 -32.763 212 HE3 LYS 25 3HE LYS 25 -17.525 -9.017 -32.263 213 HZ1 LYS 25 1HZ LYS 25 -17.098 -7.266 -30.980 214 HZ2 LYS 25 2HZ LYS 25 -15.617 -7.148 -31.787 215 HZ3 LYS 25 3HZ LYS 25 -15.711 -7.963 -30.308 216 H ALA 26 H ALA 26 -13.203 -9.733 -27.293 217 HA ALA 26 HA ALA 26 -11.434 -7.537 -27.252 218 HB1 ALA 26 1HB ALA 26 -12.570 -9.018 -24.885 219 HB2 ALA 26 2HB ALA 26 -11.948 -7.368 -24.904 220 HB3 ALA 26 3HB ALA 26 -13.418 -7.766 -25.792 221 H TYR 27 H TYR 27 -11.047 -10.906 -26.409 222 HA TYR 27 HA TYR 27 -8.606 -10.587 -24.966 223 HB2 TYR 27 2HB TYR 27 -9.907 -12.547 -24.532 224 HB3 TYR 27 3HB TYR 27 -9.931 -12.986 -26.236 225 HD1 TYR 27 HD1 TYR 27 -7.145 -12.006 -23.945 226 HD2 TYR 27 HD2 TYR 27 -8.795 -14.981 -26.500 227 HE1 TYR 27 HE1 TYR 27 -5.144 -13.396 -23.608 228 HE2 TYR 27 HE2 TYR 27 -6.800 -16.380 -26.169 229 HH TYR 27 HH TYR 27 -4.423 -16.074 -25.533 230 H TYR 28 H TYR 28 -9.451 -11.176 -28.321 231 HA TYR 28 HA TYR 28 -6.778 -11.765 -29.161 232 HB2 TYR 28 2HB TYR 28 -8.650 -12.630 -30.436 233 HB3 TYR 28 3HB TYR 28 -9.247 -11.001 -30.733 234 HD1 TYR 28 HD1 TYR 28 -8.942 -10.295 -32.899 235 HD2 TYR 28 HD2 TYR 28 -5.967 -12.766 -31.125 236 HE1 TYR 28 HE1 TYR 28 -7.623 -10.187 -34.973 237 HE2 TYR 28 HE2 TYR 28 -4.640 -12.663 -33.193 238 HH TYR 28 HH TYR 28 -4.638 -12.045 -35.351 239 H GLN 29 H GLN 29 -8.900 -8.925 -29.416 240 HA GLN 29 HA GLN 29 -7.126 -7.265 -30.799 241 HB2 GLN 29 2HB GLN 29 -8.553 -5.471 -30.229 242 HB3 GLN 29 3HB GLN 29 -9.598 -6.881 -30.342 243 HG2 GLN 29 2HG GLN 29 -9.619 -7.090 -27.927 244 HG3 GLN 29 3HG GLN 29 -8.514 -5.724 -27.784 245 HE21 GLN 29 1HE2 GLN 29 -10.094 -4.710 -26.462 246 HE22 GLN 29 2HE2 GLN 29 -11.461 -3.925 -27.169 247 H LEU 30 H LEU 30 -7.408 -8.014 -27.386 248 HA LEU 30 HA LEU 30 -5.650 -5.951 -26.491 249 HB2 LEU 30 2HB LEU 30 -7.215 -8.071 -25.329 250 HB3 LEU 30 3HB LEU 30 -5.603 -8.032 -24.619 251 HG LEU 30 HG LEU 30 -5.920 -5.769 -23.881 252 HD11 LEU 30 1HD1 LEU 30 -7.163 -4.457 -25.190 253 HD12 LEU 30 2HD1 LEU 30 -8.545 -5.096 -24.301 254 HD13 LEU 30 3HD1 LEU 30 -8.077 -5.818 -25.841 255 HD21 LEU 30 1HD2 LEU 30 -8.292 -7.526 -23.273 256 HD22 LEU 30 2HD2 LEU 30 -7.873 -6.067 -22.376 257 HD23 LEU 30 3HD2 LEU 30 -6.770 -7.444 -22.386 258 H ALA 31 H ALA 31 -5.268 -9.378 -27.272 259 HA ALA 31 HA ALA 31 -2.639 -9.731 -26.413 260 HB1 ALA 31 1HB ALA 31 -3.440 -11.753 -26.983 261 HB2 ALA 31 2HB ALA 31 -4.463 -11.103 -28.265 262 HB3 ALA 31 3HB ALA 31 -2.745 -11.375 -28.559 263 H LYS 32 H LYS 32 -3.898 -8.464 -29.460 264 HA LYS 32 HA LYS 32 -1.467 -8.339 -30.860 265 HB2 LYS 32 2HB LYS 32 -4.026 -6.764 -31.088 266 HB3 LYS 32 3HB LYS 32 -2.663 -6.494 -32.166 267 HG2 LYS 32 2HG LYS 32 -3.011 -8.407 -33.308 268 HG3 LYS 32 3HG LYS 32 -3.558 -9.289 -31.881 269 HD2 LYS 32 2HD LYS 32 -5.499 -9.123 -33.131 270 HD3 LYS 32 3HD LYS 32 -5.639 -7.742 -32.041 271 HE2 LYS 32 2HE LYS 32 -6.187 -6.849 -34.119 272 HE3 LYS 32 3HE LYS 32 -4.490 -6.413 -33.921 273 HZ1 LYS 32 1HZ LYS 32 -4.013 -7.497 -35.773 274 HZ2 LYS 32 2HZ LYS 32 -5.650 -7.858 -35.998 275 HZ3 LYS 32 3HZ LYS 32 -4.655 -8.934 -35.153 276 H LYS 33 H LYS 33 -2.772 -6.372 -28.339 277 HA LYS 33 HA LYS 33 -1.105 -4.087 -28.845 278 HB2 LYS 33 2HB LYS 33 -2.673 -4.855 -26.376 279 HB3 LYS 33 3HB LYS 33 -1.926 -3.289 -26.663 280 HG2 LYS 33 2HG LYS 33 -3.387 -2.971 -28.614 281 HG3 LYS 33 3HG LYS 33 -4.161 -4.519 -28.265 282 HD2 LYS 33 2HD LYS 33 -5.359 -3.675 -26.550 283 HD3 LYS 33 3HD LYS 33 -4.038 -2.639 -26.004 284 HE2 LYS 33 2HE LYS 33 -4.532 -1.188 -28.022 285 HE3 LYS 33 3HE LYS 33 -6.009 -2.129 -28.220 286 HZ1 LYS 33 1HZ LYS 33 -5.850 0.088 -26.754 287 HZ2 LYS 33 2HZ LYS 33 -5.546 -1.070 -25.560 288 HZ3 LYS 33 3HZ LYS 33 -6.974 -1.142 -26.464 289 H TYR 34 H TYR 34 -0.964 -6.944 -26.804 290 HA TYR 34 HA TYR 34 1.619 -6.053 -25.729 291 HB2 TYR 34 2HB TYR 34 -0.176 -8.320 -24.839 292 HB3 TYR 34 3HB TYR 34 1.337 -7.855 -24.070 293 HD1 TYR 34 HD1 TYR 34 1.494 -5.749 -22.809 294 HD2 TYR 34 HD2 TYR 34 -2.190 -7.059 -24.486 295 HE1 TYR 34 HE1 TYR 34 0.283 -4.156 -21.378 296 HE2 TYR 34 HE2 TYR 34 -3.411 -5.468 -23.062 297 HH TYR 34 HH TYR 34 -3.070 -4.268 -20.933 298 H HIS 35 H HIS 35 1.097 -7.152 -28.460 299 HA HIS 35 HA HIS 35 2.129 -9.788 -28.600 300 HB2 HIS 35 2HB HIS 35 1.313 -7.708 -30.464 301 HB3 HIS 35 3HB HIS 35 2.731 -8.583 -31.035 302 HD1 HIS 35 HD1 HIS 35 1.256 -9.619 -32.931 303 HD2 HIS 35 HD2 HIS 35 0.114 -10.657 -29.074 304 HE1 HIS 35 HE1 HIS 35 -0.315 -11.564 -33.196 305 HA PRO 36 HA PRO 36 6.474 -9.272 -28.299 306 HB2 PRO 36 2HB PRO 36 7.401 -10.964 -30.209 307 HB3 PRO 36 3HB PRO 36 6.676 -11.526 -28.698 308 HG2 PRO 36 2HG PRO 36 5.445 -11.288 -31.416 309 HG3 PRO 36 3HG PRO 36 5.299 -12.600 -30.233 310 HD2 PRO 36 2HD PRO 36 3.381 -10.718 -30.566 311 HD3 PRO 36 3HD PRO 36 3.712 -11.476 -28.995 312 H ASP 37 H ASP 37 4.840 -8.412 -31.165 313 HA ASP 37 HA ASP 37 7.129 -7.503 -32.641 314 HB2 ASP 37 2HB ASP 37 5.030 -8.207 -33.753 315 HB3 ASP 37 3HB ASP 37 4.204 -6.831 -33.027 316 H THR 38 H THR 38 5.102 -6.214 -30.177 317 HA THR 38 HA THR 38 6.126 -3.501 -30.659 318 HB THR 38 HB THR 38 4.341 -2.639 -29.359 319 HG1 THR 38 HG1 THR 38 4.294 -5.213 -28.323 320 HG21 THR 38 1HG2 THR 38 2.732 -3.000 -30.878 321 HG22 THR 38 2HG2 THR 38 2.664 -4.726 -30.523 322 HG23 THR 38 3HG2 THR 38 3.876 -4.103 -31.642 323 H ASN 39 H ASN 39 7.039 -6.134 -29.031 324 HA ASN 39 HA ASN 39 7.572 -4.978 -26.443 325 HB2 ASN 39 2HB ASN 39 8.026 -7.615 -27.749 326 HB3 ASN 39 3HB ASN 39 9.073 -7.188 -26.399 327 HD21 ASN 39 1HD2 ASN 39 5.662 -6.457 -26.974 328 HD22 ASN 39 2HD2 ASN 39 5.073 -7.248 -25.556 329 H LYS 40 H LYS 40 8.894 -4.476 -29.385 330 HA LYS 40 HA LYS 40 11.633 -4.705 -29.143 331 HB2 LYS 40 2HB LYS 40 9.790 -3.011 -30.700 332 HB3 LYS 40 3HB LYS 40 11.410 -2.355 -30.503 333 HG2 LYS 40 2HG LYS 40 11.819 -3.551 -32.359 334 HG3 LYS 40 3HG LYS 40 12.021 -4.874 -31.208 335 HD2 LYS 40 2HD LYS 40 9.276 -4.328 -32.189 336 HD3 LYS 40 3HD LYS 40 10.414 -5.050 -33.328 337 HE2 LYS 40 2HE LYS 40 10.355 -6.247 -30.635 338 HE3 LYS 40 3HE LYS 40 8.897 -6.467 -31.602 339 HZ1 LYS 40 1HZ LYS 40 11.607 -7.089 -32.625 340 HZ2 LYS 40 2HZ LYS 40 10.118 -7.542 -33.288 341 HZ3 LYS 40 3HZ LYS 40 10.643 -8.233 -31.836 342 H ASP 41 H ASP 41 9.515 -2.154 -27.926 343 HA ASP 41 HA ASP 41 11.808 -1.073 -26.422 344 HB2 ASP 41 2HB ASP 41 10.764 1.113 -26.496 345 HB3 ASP 41 3HB ASP 41 10.915 0.488 -28.136 346 H ASP 42 H ASP 42 9.631 -3.160 -25.853 347 HA ASP 42 HA ASP 42 9.102 -2.233 -23.146 348 HB2 ASP 42 2HB ASP 42 7.136 -1.755 -24.884 349 HB3 ASP 42 3HB ASP 42 6.763 -3.441 -24.538 350 HA PRO 43 HA PRO 43 10.370 -6.661 -23.379 351 HB2 PRO 43 2HB PRO 43 12.008 -6.527 -21.219 352 HB3 PRO 43 3HB PRO 43 12.532 -6.092 -22.850 353 HG2 PRO 43 2HG PRO 43 11.654 -4.316 -20.605 354 HG3 PRO 43 3HG PRO 43 13.011 -4.112 -21.728 355 HD2 PRO 43 2HD PRO 43 10.661 -2.802 -22.030 356 HD3 PRO 43 3HD PRO 43 11.661 -3.299 -23.410 357 H LYS 44 H LYS 44 8.676 -4.682 -21.225 358 HA LYS 44 HA LYS 44 8.158 -6.834 -19.315 359 HB2 LYS 44 2HB LYS 44 7.767 -3.884 -19.334 360 HB3 LYS 44 3HB LYS 44 6.645 -4.842 -18.377 361 HG2 LYS 44 2HG LYS 44 8.347 -5.649 -16.983 362 HG3 LYS 44 3HG LYS 44 9.616 -5.144 -18.100 363 HD2 LYS 44 2HD LYS 44 9.378 -2.890 -17.538 364 HD3 LYS 44 3HD LYS 44 7.775 -3.138 -16.840 365 HE2 LYS 44 2HE LYS 44 10.189 -4.456 -15.651 366 HE3 LYS 44 3HE LYS 44 9.794 -2.782 -15.262 367 HZ1 LYS 44 1HZ LYS 44 8.738 -5.074 -14.119 368 HZ2 LYS 44 2HZ LYS 44 7.487 -4.395 -15.033 369 HZ3 LYS 44 3HZ LYS 44 8.261 -3.474 -13.843 370 H ALA 45 H ALA 45 6.795 -5.371 -22.084 371 HA ALA 45 HA ALA 45 4.061 -5.671 -21.672 372 HB1 ALA 45 1HB ALA 45 5.811 -5.617 -24.075 373 HB2 ALA 45 2HB ALA 45 4.133 -6.124 -24.269 374 HB3 ALA 45 3HB ALA 45 4.502 -4.533 -23.603 375 H LYS 46 H LYS 46 6.501 -8.043 -22.525 376 HA LYS 46 HA LYS 46 4.870 -10.135 -23.378 377 HB2 LYS 46 2HB LYS 46 6.726 -11.621 -22.685 378 HB3 LYS 46 3HB LYS 46 7.277 -10.235 -23.617 379 HG2 LYS 46 2HG LYS 46 7.812 -9.120 -21.420 380 HG3 LYS 46 3HG LYS 46 7.516 -10.683 -20.655 381 HD2 LYS 46 2HD LYS 46 9.874 -10.461 -21.048 382 HD3 LYS 46 3HD LYS 46 9.235 -11.675 -22.158 383 HE2 LYS 46 2HE LYS 46 9.604 -10.389 -23.992 384 HE3 LYS 46 3HE LYS 46 9.294 -8.882 -23.131 385 HZ1 LYS 46 1HZ LYS 46 11.654 -10.217 -22.210 386 HZ2 LYS 46 2HZ LYS 46 11.448 -8.615 -22.711 387 HZ3 LYS 46 3HZ LYS 46 11.738 -9.828 -23.854 388 H GLU 47 H GLU 47 5.844 -9.192 -20.110 389 HA GLU 47 HA GLU 47 4.698 -11.389 -18.767 390 HB2 GLU 47 2HB GLU 47 6.354 -9.606 -17.895 391 HB3 GLU 47 3HB GLU 47 4.921 -8.643 -17.563 392 HG2 GLU 47 2HG GLU 47 4.063 -10.399 -16.110 393 HG3 GLU 47 3HG GLU 47 5.481 -11.386 -16.456 394 H LYS 48 H LYS 48 3.408 -8.261 -19.745 395 HA LYS 48 HA LYS 48 0.930 -8.529 -18.367 396 HB2 LYS 48 2HB LYS 48 1.499 -6.822 -20.793 397 HB3 LYS 48 3HB LYS 48 0.224 -6.587 -19.604 398 HG2 LYS 48 2HG LYS 48 3.180 -6.353 -19.076 399 HG3 LYS 48 3HG LYS 48 2.057 -5.009 -19.292 400 HD2 LYS 48 2HD LYS 48 0.842 -5.646 -17.309 401 HD3 LYS 48 3HD LYS 48 1.825 -7.101 -17.130 402 HE2 LYS 48 2HE LYS 48 3.707 -5.897 -16.482 403 HE3 LYS 48 3HE LYS 48 3.103 -4.394 -17.177 404 HZ1 LYS 48 1HZ LYS 48 1.932 -3.915 -15.339 405 HZ2 LYS 48 2HZ LYS 48 3.013 -4.969 -14.577 406 HZ3 LYS 48 3HZ LYS 48 1.486 -5.521 -15.052 407 H PHE 49 H PHE 49 2.074 -9.387 -21.573 408 HA PHE 49 HA PHE 49 -0.376 -9.892 -22.815 409 HB2 PHE 49 2HB PHE 49 1.620 -9.834 -24.139 410 HB3 PHE 49 3HB PHE 49 2.342 -11.146 -23.214 411 HD1 PHE 49 HD1 PHE 49 -0.023 -10.261 -25.842 412 HD2 PHE 49 HD2 PHE 49 1.639 -13.445 -23.558 413 HE1 PHE 49 HE1 PHE 49 -0.922 -11.885 -27.457 414 HE2 PHE 49 HE2 PHE 49 0.743 -15.074 -25.170 415 HZ PHE 49 HZ PHE 49 -0.539 -14.295 -27.123 416 H SER 50 H SER 50 1.490 -11.797 -20.557 417 HA SER 50 HA SER 50 0.109 -14.249 -20.960 418 HB2 SER 50 2HB SER 50 2.395 -13.867 -19.829 419 HB3 SER 50 3HB SER 50 1.465 -13.466 -18.386 420 HG SER 50 HG SER 50 2.180 -15.791 -18.900 421 H GLN 51 H GLN 51 -0.409 -11.455 -18.911 422 HA GLN 51 HA GLN 51 -2.280 -12.554 -17.136 423 HB2 GLN 51 2HB GLN 51 -2.007 -9.721 -18.151 424 HB3 GLN 51 3HB GLN 51 -3.022 -10.200 -16.797 425 HG2 GLN 51 2HG GLN 51 -0.029 -10.249 -16.988 426 HG3 GLN 51 3HG GLN 51 -1.043 -9.347 -15.863 427 HE21 GLN 51 1HE2 GLN 51 -2.250 -10.582 -14.281 428 HE22 GLN 51 2HE2 GLN 51 -1.597 -12.068 -13.690 429 H LEU 52 H LEU 52 -2.582 -11.429 -20.418 430 HA LEU 52 HA LEU 52 -5.384 -11.113 -20.498 431 HB2 LEU 52 2HB LEU 52 -3.613 -11.956 -22.781 432 HB3 LEU 52 3HB LEU 52 -5.171 -11.139 -22.879 433 HG LEU 52 HG LEU 52 -2.804 -9.833 -21.575 434 HD11 LEU 52 1HD1 LEU 52 -2.021 -8.983 -23.576 435 HD12 LEU 52 2HD1 LEU 52 -3.513 -9.354 -24.439 436 HD13 LEU 52 3HD1 LEU 52 -2.402 -10.652 -24.000 437 HD21 LEU 52 1HD2 LEU 52 -4.335 -8.270 -21.193 438 HD22 LEU 52 2HD2 LEU 52 -5.537 -9.134 -22.152 439 HD23 LEU 52 3HD2 LEU 52 -4.424 -8.011 -22.935 440 H ALA 53 H ALA 53 -3.296 -13.867 -21.327 441 HA ALA 53 HA ALA 53 -5.420 -15.598 -22.060 442 HB1 ALA 53 1HB ALA 53 -3.186 -16.015 -22.857 443 HB2 ALA 53 2HB ALA 53 -2.594 -16.210 -21.207 444 HB3 ALA 53 3HB ALA 53 -3.719 -17.387 -21.885 445 H GLU 54 H GLU 54 -3.849 -14.843 -19.025 446 HA GLU 54 HA GLU 54 -4.805 -17.050 -17.540 447 HB2 GLU 54 2HB GLU 54 -3.753 -14.336 -16.824 448 HB3 GLU 54 3HB GLU 54 -4.456 -15.359 -15.579 449 HG2 GLU 54 2HG GLU 54 -2.820 -17.036 -15.902 450 HG3 GLU 54 3HG GLU 54 -2.237 -16.277 -17.382 451 H ALA 55 H ALA 55 -6.011 -13.715 -17.842 452 HA ALA 55 HA ALA 55 -8.327 -14.183 -16.249 453 HB1 ALA 55 1HB ALA 55 -7.217 -11.956 -17.814 454 HB2 ALA 55 2HB ALA 55 -8.976 -11.980 -17.681 455 HB3 ALA 55 3HB ALA 55 -7.982 -11.961 -16.224 456 H TYR 56 H TYR 56 -7.667 -14.193 -19.715 457 HA TYR 56 HA TYR 56 -10.332 -14.392 -20.598 458 HB2 TYR 56 2HB TYR 56 -8.724 -13.799 -22.222 459 HB3 TYR 56 3HB TYR 56 -7.697 -15.172 -21.829 460 HD1 TYR 56 HD1 TYR 56 -10.740 -14.098 -23.584 461 HD2 TYR 56 HD2 TYR 56 -8.133 -17.356 -22.755 462 HE1 TYR 56 HE1 TYR 56 -11.790 -15.390 -25.394 463 HE2 TYR 56 HE2 TYR 56 -9.175 -18.657 -24.564 464 HH TYR 56 HH TYR 56 -11.691 -18.510 -25.721 465 H GLU 57 H GLU 57 -8.123 -16.725 -19.290 466 HA GLU 57 HA GLU 57 -9.286 -19.087 -20.265 467 HB2 GLU 57 2HB GLU 57 -7.419 -18.348 -18.122 468 HB3 GLU 57 3HB GLU 57 -8.350 -19.801 -17.790 469 HG2 GLU 57 2HG GLU 57 -7.620 -20.484 -20.193 470 HG3 GLU 57 3HG GLU 57 -6.358 -19.280 -19.944 471 H VAL 58 H VAL 58 -9.909 -17.242 -17.297 472 HA VAL 58 HA VAL 58 -11.965 -19.013 -16.387 473 HB VAL 58 HB VAL 58 -11.463 -16.167 -15.512 474 HG11 VAL 58 1HG1 VAL 58 -12.663 -18.421 -13.924 475 HG12 VAL 58 2HG1 VAL 58 -12.668 -16.696 -13.554 476 HG13 VAL 58 3HG1 VAL 58 -13.638 -17.315 -14.891 477 HG21 VAL 58 1HG2 VAL 58 -9.409 -17.168 -15.123 478 HG22 VAL 58 2HG2 VAL 58 -10.253 -17.428 -13.597 479 HG23 VAL 58 3HG2 VAL 58 -10.126 -18.740 -14.769 480 H LEU 59 H LEU 59 -11.902 -15.889 -18.047 481 HA LEU 59 HA LEU 59 -14.743 -15.579 -18.061 482 HB2 LEU 59 2HB LEU 59 -12.409 -14.145 -19.121 483 HB3 LEU 59 3HB LEU 59 -13.876 -13.986 -20.085 484 HG LEU 59 HG LEU 59 -15.057 -13.017 -18.231 485 HD11 LEU 59 1HD1 LEU 59 -14.243 -14.219 -16.368 486 HD12 LEU 59 2HD1 LEU 59 -13.788 -12.536 -16.104 487 HD13 LEU 59 3HD1 LEU 59 -12.584 -13.697 -16.662 488 HD21 LEU 59 1HD2 LEU 59 -13.774 -10.970 -17.914 489 HD22 LEU 59 2HD2 LEU 59 -13.681 -11.517 -19.588 490 HD23 LEU 59 3HD2 LEU 59 -12.319 -11.779 -18.497 491 H SER 60 H SER 60 -12.698 -17.606 -19.739 492 HA SER 60 HA SER 60 -13.962 -17.573 -22.301 493 HB2 SER 60 2HB SER 60 -11.751 -18.406 -22.287 494 HB3 SER 60 3HB SER 60 -12.077 -19.485 -20.931 495 HG SER 60 HG SER 60 -12.705 -20.942 -22.298 496 H ASP 61 H ASP 61 -14.808 -18.851 -19.273 497 HA ASP 61 HA ASP 61 -16.976 -20.392 -20.519 498 HB2 ASP 61 2HB ASP 61 -14.896 -21.678 -19.388 499 HB3 ASP 61 3HB ASP 61 -15.902 -21.440 -17.962 500 H GLU 62 H GLU 62 -18.931 -19.921 -19.737 501 HA GLU 62 HA GLU 62 -19.421 -17.797 -18.038 502 HB2 GLU 62 2HB GLU 62 -21.732 -18.753 -17.818 503 HB3 GLU 62 3HB GLU 62 -21.163 -18.577 -19.472 504 HG2 GLU 62 2HG GLU 62 -20.507 -21.010 -19.375 505 HG3 GLU 62 3HG GLU 62 -21.400 -21.097 -17.858 506 H VAL 63 H VAL 63 -19.185 -21.240 -17.276 507 HA VAL 63 HA VAL 63 -19.992 -21.097 -14.590 508 HB VAL 63 HB VAL 63 -17.982 -23.041 -15.725 509 HG11 VAL 63 1HG1 VAL 63 -19.352 -24.490 -13.993 510 HG12 VAL 63 2HG1 VAL 63 -17.987 -23.494 -13.484 511 HG13 VAL 63 3HG1 VAL 63 -19.637 -22.913 -13.258 512 HG21 VAL 63 1HG2 VAL 63 -20.512 -24.230 -15.676 513 HG22 VAL 63 2HG2 VAL 63 -20.752 -22.643 -16.408 514 HG23 VAL 63 3HG2 VAL 63 -19.577 -23.763 -17.098 515 H LYS 64 H LYS 64 -16.733 -21.034 -16.019 516 HA LYS 64 HA LYS 64 -15.344 -20.723 -13.588 517 HB2 LYS 64 2HB LYS 64 -14.631 -20.075 -16.443 518 HB3 LYS 64 3HB LYS 64 -13.513 -19.794 -15.115 519 HG2 LYS 64 2HG LYS 64 -14.086 -22.328 -14.591 520 HG3 LYS 64 3HG LYS 64 -14.432 -22.340 -16.321 521 HD2 LYS 64 2HD LYS 64 -12.148 -22.966 -16.044 522 HD3 LYS 64 3HD LYS 64 -12.169 -21.323 -16.688 523 HE2 LYS 64 2HE LYS 64 -11.682 -20.399 -14.544 524 HE3 LYS 64 3HE LYS 64 -11.920 -21.957 -13.754 525 HZ1 LYS 64 1HZ LYS 64 -9.546 -20.925 -14.671 526 HZ2 LYS 64 2HZ LYS 64 -9.946 -22.124 -15.795 527 HZ3 LYS 64 3HZ LYS 64 -9.824 -22.511 -14.153 528 H ARG 65 H ARG 65 -16.571 -18.366 -15.929 529 HA ARG 65 HA ARG 65 -15.493 -16.075 -14.691 530 HB2 ARG 65 2HB ARG 65 -16.368 -16.137 -17.013 531 HB3 ARG 65 3HB ARG 65 -17.998 -16.282 -16.370 532 HG2 ARG 65 2HG ARG 65 -17.848 -14.100 -15.364 533 HG3 ARG 65 3HG ARG 65 -16.157 -13.959 -15.847 534 HD2 ARG 65 2HD ARG 65 -17.607 -12.703 -17.352 535 HD3 ARG 65 3HD ARG 65 -16.817 -14.034 -18.197 536 HE ARG 65 HE ARG 65 -18.870 -15.010 -18.527 537 HH11 ARG 65 1HH1 ARG 65 -19.162 -12.431 -16.207 538 HH12 ARG 65 2HH1 ARG 65 -20.894 -12.461 -16.196 539 HH21 ARG 65 1HH2 ARG 65 -21.151 -15.060 -18.522 540 HH22 ARG 65 2HH2 ARG 65 -22.024 -13.957 -17.512 541 H LYS 66 H LYS 66 -18.678 -17.622 -14.418 542 HA LYS 66 HA LYS 66 -19.755 -15.760 -12.585 543 HB2 LYS 66 2HB LYS 66 -20.468 -18.616 -13.241 544 HB3 LYS 66 3HB LYS 66 -21.374 -17.660 -12.076 545 HG2 LYS 66 2HG LYS 66 -20.963 -16.911 -14.963 546 HG3 LYS 66 3HG LYS 66 -22.402 -17.700 -14.314 547 HD2 LYS 66 2HD LYS 66 -23.172 -15.600 -14.080 548 HD3 LYS 66 3HD LYS 66 -22.156 -15.574 -12.637 549 HE2 LYS 66 2HE LYS 66 -20.315 -14.855 -14.399 550 HE3 LYS 66 3HE LYS 66 -21.732 -14.307 -15.294 551 HZ1 LYS 66 1HZ LYS 66 -22.162 -12.683 -13.802 552 HZ2 LYS 66 2HZ LYS 66 -20.496 -12.792 -13.531 553 HZ3 LYS 66 3HZ LYS 66 -21.576 -13.561 -12.480 554 H GLN 67 H GLN 67 -18.149 -18.891 -12.137 555 HA GLN 67 HA GLN 67 -18.440 -19.084 -9.365 556 HB2 GLN 67 2HB GLN 67 -16.458 -20.194 -11.321 557 HB3 GLN 67 3HB GLN 67 -16.223 -20.442 -9.596 558 HG2 GLN 67 2HG GLN 67 -18.587 -21.315 -11.239 559 HG3 GLN 67 3HG GLN 67 -17.338 -22.345 -10.542 560 HE21 GLN 67 1HE2 GLN 67 -20.225 -20.557 -9.965 561 HE22 GLN 67 2HE2 GLN 67 -20.486 -21.086 -8.341 562 H TYR 68 H TYR 68 -15.942 -17.515 -11.314 563 HA TYR 68 HA TYR 68 -14.253 -16.817 -9.154 564 HB2 TYR 68 2HB TYR 68 -13.342 -16.815 -11.369 565 HB3 TYR 68 3HB TYR 68 -14.557 -15.673 -11.933 566 HD1 TYR 68 HD1 TYR 68 -11.748 -15.965 -9.496 567 HD2 TYR 68 HD2 TYR 68 -14.058 -13.404 -11.988 568 HE1 TYR 68 HE1 TYR 68 -10.225 -14.103 -8.984 569 HE2 TYR 68 HE2 TYR 68 -12.541 -11.535 -11.483 570 HH TYR 68 HH TYR 68 -10.955 -10.894 -9.656 571 H ASP 69 H ASP 69 -16.974 -15.213 -10.703 572 HA ASP 69 HA ASP 69 -16.665 -12.706 -9.422 573 HB2 ASP 69 2HB ASP 69 -18.023 -12.740 -11.360 574 HB3 ASP 69 3HB ASP 69 -19.003 -14.069 -10.746 575 H ALA 70 H ALA 70 -18.090 -15.727 -8.455 576 HA ALA 70 HA ALA 70 -19.756 -14.826 -6.384 577 HB1 ALA 70 1HB ALA 70 -18.460 -17.385 -5.856 578 HB2 ALA 70 2HB ALA 70 -20.168 -16.999 -6.067 579 HB3 ALA 70 3HB ALA 70 -19.144 -17.264 -7.477 580 H TYR 71 H TYR 71 -16.310 -15.538 -6.477 581 HA TYR 71 HA TYR 71 -16.078 -14.883 -3.629 582 HB2 TYR 71 2HB TYR 71 -14.135 -16.132 -5.576 583 HB3 TYR 71 3HB TYR 71 -13.707 -15.686 -3.928 584 HD1 TYR 71 HD1 TYR 71 -15.479 -16.634 -2.119 585 HD2 TYR 71 HD2 TYR 71 -14.672 -18.340 -5.932 586 HE1 TYR 71 HE1 TYR 71 -16.299 -18.808 -1.313 587 HE2 TYR 71 HE2 TYR 71 -15.490 -20.519 -5.137 588 HH TYR 71 HH TYR 71 -16.364 -21.035 -1.769 589 H GLY 72 H GLY 72 -16.587 -12.913 -5.800 590 HA2 GLY 72 2HA GLY 72 -14.092 -11.376 -5.816 591 HA3 GLY 72 3HA GLY 72 -15.518 -11.042 -6.787 592 H SER 73 H SER 73 -14.458 -8.916 -5.650 593 HA SER 73 HA SER 73 -16.204 -8.370 -3.339 594 HB2 SER 73 2HB SER 73 -13.519 -7.070 -3.836 595 HB3 SER 73 3HB SER 73 -14.528 -6.928 -2.396 596 HG SER 73 HG SER 73 -12.818 -8.425 -2.110 Start of MODEL 2 1 H1 HIS 1 H HIS 1 -5.684 4.498 -1.159 2 HA HIS 1 HA HIS 1 -2.862 4.347 -0.828 3 HB2 HIS 1 2HB HIS 1 -5.129 3.628 1.039 4 HB3 HIS 1 3HB HIS 1 -3.432 3.653 1.509 5 HD1 HIS 1 HD1 HIS 1 -6.347 5.716 1.526 6 HD2 HIS 1 HD2 HIS 1 -2.279 6.389 1.019 7 HE1 HIS 1 HE1 HIS 1 -6.010 8.167 1.975 8 H MET 2 H MET 2 -5.394 1.877 -0.336 9 HA MET 2 HA MET 2 -3.347 -0.193 -0.705 10 HB2 MET 2 2HB MET 2 -5.956 -0.078 0.730 11 HB3 MET 2 3HB MET 2 -5.435 -1.631 0.091 12 HG2 MET 2 2HG MET 2 -4.652 -1.622 2.276 13 HG3 MET 2 3HG MET 2 -3.239 -1.198 1.312 14 HE1 MET 2 1HE MET 2 -6.086 -0.207 3.394 15 HE2 MET 2 2HE MET 2 -5.486 1.096 4.420 16 HE3 MET 2 3HE MET 2 -6.222 1.469 2.861 17 H LEU 3 H LEU 3 -3.194 -1.088 -2.644 18 HA LEU 3 HA LEU 3 -5.069 -0.673 -4.715 19 HB2 LEU 3 2HB LEU 3 -2.609 -2.297 -4.356 20 HB3 LEU 3 3HB LEU 3 -3.678 -2.713 -5.694 21 HG LEU 3 HG LEU 3 -1.851 -1.253 -6.406 22 HD11 LEU 3 1HD1 LEU 3 -3.165 0.339 -7.621 23 HD12 LEU 3 2HD1 LEU 3 -4.484 0.209 -6.459 24 HD13 LEU 3 3HD1 LEU 3 -4.083 -1.161 -7.495 25 HD21 LEU 3 1HD2 LEU 3 -2.031 -0.051 -4.019 26 HD22 LEU 3 2HD2 LEU 3 -2.963 1.089 -4.989 27 HD23 LEU 3 3HD2 LEU 3 -1.298 0.711 -5.431 28 H ALA 4 H ALA 4 -6.994 -1.583 -4.919 29 HA ALA 4 HA ALA 4 -7.828 -3.838 -3.414 30 HB1 ALA 4 1HB ALA 4 -9.290 -1.963 -4.260 31 HB2 ALA 4 2HB ALA 4 -9.221 -2.738 -5.843 32 HB3 ALA 4 3HB ALA 4 -9.929 -3.594 -4.473 33 H LYS 5 H LYS 5 -8.716 -5.838 -4.343 34 HA LYS 5 HA LYS 5 -6.844 -7.307 -5.748 35 HB2 LYS 5 2HB LYS 5 -9.781 -7.691 -5.262 36 HB3 LYS 5 3HB LYS 5 -8.891 -8.830 -6.264 37 HG2 LYS 5 2HG LYS 5 -7.345 -9.230 -4.385 38 HG3 LYS 5 3HG LYS 5 -8.321 -8.150 -3.386 39 HD2 LYS 5 2HD LYS 5 -10.241 -9.611 -3.631 40 HD3 LYS 5 3HD LYS 5 -9.333 -10.661 -4.721 41 HE2 LYS 5 2HE LYS 5 -8.688 -10.129 -1.822 42 HE3 LYS 5 3HE LYS 5 -9.436 -11.591 -2.462 43 HZ1 LYS 5 1HZ LYS 5 -7.324 -12.310 -2.502 44 HZ2 LYS 5 2HZ LYS 5 -6.662 -10.754 -2.523 45 HZ3 LYS 5 3HZ LYS 5 -7.233 -11.448 -3.956 46 H GLU 6 H GLU 6 -7.095 -8.365 -7.886 47 HA GLU 6 HA GLU 6 -8.160 -6.454 -9.860 48 HB2 GLU 6 2HB GLU 6 -5.850 -8.383 -10.157 49 HB3 GLU 6 3HB GLU 6 -6.440 -7.296 -11.406 50 HG2 GLU 6 2HG GLU 6 -5.234 -6.473 -8.774 51 HG3 GLU 6 3HG GLU 6 -4.436 -6.425 -10.345 52 H ASP 7 H ASP 7 -9.586 -7.151 -11.340 53 HA ASP 7 HA ASP 7 -10.308 -10.001 -11.273 54 HB2 ASP 7 2HB ASP 7 -12.048 -7.836 -12.423 55 HB3 ASP 7 3HB ASP 7 -12.518 -9.413 -11.796 56 H TYR 8 H TYR 8 -10.734 -11.114 -13.214 57 HA TYR 8 HA TYR 8 -8.951 -10.611 -15.311 58 HB2 TYR 8 2HB TYR 8 -11.468 -12.275 -15.481 59 HB3 TYR 8 3HB TYR 8 -10.019 -12.437 -16.466 60 HD1 TYR 8 HD1 TYR 8 -11.634 -14.330 -14.384 61 HD2 TYR 8 HD2 TYR 8 -7.912 -12.268 -14.388 62 HE1 TYR 8 HE1 TYR 8 -10.734 -15.963 -12.780 63 HE2 TYR 8 HE2 TYR 8 -7.002 -13.896 -12.785 64 HH TYR 8 HH TYR 8 -8.799 -16.761 -11.855 65 H TYR 9 H TYR 9 -12.206 -9.534 -14.759 66 HA TYR 9 HA TYR 9 -13.084 -8.913 -17.298 67 HB2 TYR 9 2HB TYR 9 -13.485 -7.271 -14.789 68 HB3 TYR 9 3HB TYR 9 -14.465 -7.174 -16.248 69 HD1 TYR 9 HD1 TYR 9 -13.998 -8.820 -13.106 70 HD2 TYR 9 HD2 TYR 9 -15.764 -9.253 -16.952 71 HE1 TYR 9 HE1 TYR 9 -15.469 -10.583 -12.225 72 HE2 TYR 9 HE2 TYR 9 -17.242 -11.016 -16.082 73 HH TYR 9 HH TYR 9 -18.079 -11.495 -13.278 74 H GLN 10 H GLN 10 -10.964 -7.025 -15.182 75 HA GLN 10 HA GLN 10 -10.729 -4.840 -17.015 76 HB2 GLN 10 2HB GLN 10 -8.966 -5.563 -14.668 77 HB3 GLN 10 3HB GLN 10 -9.006 -4.012 -15.495 78 HG2 GLN 10 2HG GLN 10 -11.485 -5.113 -14.246 79 HG3 GLN 10 3HG GLN 10 -10.267 -4.308 -13.257 80 HE21 GLN 10 1HE2 GLN 10 -12.987 -3.889 -15.129 81 HE22 GLN 10 2HE2 GLN 10 -12.901 -2.177 -15.350 82 H ILE 11 H ILE 11 -8.745 -7.649 -16.192 83 HA ILE 11 HA ILE 11 -6.477 -7.024 -17.690 84 HB ILE 11 HB ILE 11 -7.631 -9.766 -17.170 85 HG12 ILE 11 2HG1 ILE 11 -5.456 -8.366 -15.619 86 HG13 ILE 11 3HG1 ILE 11 -7.153 -8.245 -15.170 87 HG21 ILE 11 1HG2 ILE 11 -5.208 -8.835 -18.514 88 HG22 ILE 11 2HG2 ILE 11 -4.913 -10.029 -17.251 89 HG23 ILE 11 3HG2 ILE 11 -6.011 -10.404 -18.579 90 HD11 ILE 11 1HD1 ILE 11 -7.123 -10.233 -14.189 91 HD12 ILE 11 2HD1 ILE 11 -6.321 -10.989 -15.566 92 HD13 ILE 11 3HD1 ILE 11 -5.367 -10.164 -14.334 93 H LEU 12 H LEU 12 -9.614 -8.018 -18.703 94 HA LEU 12 HA LEU 12 -8.626 -8.523 -21.428 95 HB2 LEU 12 2HB LEU 12 -10.946 -9.515 -19.865 96 HB3 LEU 12 3HB LEU 12 -11.162 -9.305 -21.602 97 HG LEU 12 HG LEU 12 -8.986 -10.995 -20.378 98 HD11 LEU 12 1HD1 LEU 12 -10.838 -12.645 -21.632 99 HD12 LEU 12 2HD1 LEU 12 -11.807 -11.526 -20.675 100 HD13 LEU 12 3HD1 LEU 12 -10.553 -12.493 -19.898 101 HD21 LEU 12 1HD2 LEU 12 -10.097 -11.053 -23.172 102 HD22 LEU 12 2HD2 LEU 12 -8.628 -11.817 -22.562 103 HD23 LEU 12 3HD2 LEU 12 -8.712 -10.061 -22.714 104 H GLY 13 H GLY 13 -10.309 -6.297 -19.480 105 HA2 GLY 13 2HA GLY 13 -11.064 -4.181 -20.038 106 HA3 GLY 13 3HA GLY 13 -10.700 -4.533 -21.721 107 H VAL 14 H VAL 14 -12.692 -6.713 -19.904 108 HA VAL 14 HA VAL 14 -15.018 -5.815 -21.473 109 HB VAL 14 HB VAL 14 -15.904 -8.065 -21.292 110 HG11 VAL 14 1HG1 VAL 14 -13.791 -7.310 -22.846 111 HG12 VAL 14 2HG1 VAL 14 -13.190 -8.796 -22.108 112 HG13 VAL 14 3HG1 VAL 14 -14.696 -8.813 -23.026 113 HG21 VAL 14 1HG2 VAL 14 -15.034 -8.626 -19.082 114 HG22 VAL 14 2HG2 VAL 14 -14.617 -9.872 -20.258 115 HG23 VAL 14 3HG2 VAL 14 -13.399 -8.709 -19.737 116 HA PRO 15 HA PRO 15 -17.218 -4.785 -17.814 117 HB2 PRO 15 2HB PRO 15 -19.761 -5.359 -18.573 118 HB3 PRO 15 3HB PRO 15 -18.866 -3.964 -19.188 119 HG2 PRO 15 2HG PRO 15 -19.318 -6.636 -20.460 120 HG3 PRO 15 3HG PRO 15 -19.395 -5.022 -21.190 121 HD2 PRO 15 2HD PRO 15 -17.245 -6.644 -21.466 122 HD3 PRO 15 3HD PRO 15 -17.106 -4.875 -21.412 123 H ARG 16 H ARG 16 -18.964 -5.692 -16.306 124 HA ARG 16 HA ARG 16 -18.169 -8.350 -15.551 125 HB2 ARG 16 2HB ARG 16 -20.234 -6.495 -14.350 126 HB3 ARG 16 3HB ARG 16 -19.681 -8.000 -13.628 127 HG2 ARG 16 2HG ARG 16 -18.380 -6.515 -12.497 128 HG3 ARG 16 3HG ARG 16 -17.322 -6.860 -13.867 129 HD2 ARG 16 2HD ARG 16 -17.749 -4.825 -14.877 130 HD3 ARG 16 3HD ARG 16 -19.286 -4.616 -14.038 131 HE ARG 16 HE ARG 16 -17.364 -4.560 -12.075 132 HH11 ARG 16 1HH1 ARG 16 -18.059 -2.747 -14.965 133 HH12 ARG 16 2HH1 ARG 16 -17.376 -1.273 -14.361 134 HH21 ARG 16 1HH2 ARG 16 -16.462 -2.626 -11.269 135 HH22 ARG 16 2HH2 ARG 16 -16.467 -1.206 -12.260 136 H ASN 17 H ASN 17 -20.461 -7.128 -17.648 137 HA ASN 17 HA ASN 17 -22.172 -9.507 -17.340 138 HB2 ASN 17 2HB ASN 17 -22.800 -6.739 -18.364 139 HB3 ASN 17 3HB ASN 17 -23.857 -8.115 -18.663 140 HD21 ASN 17 1HD2 ASN 17 -24.136 -5.595 -17.067 141 HD22 ASN 17 2HD2 ASN 17 -24.653 -6.126 -15.505 142 H ALA 18 H ALA 18 -19.644 -8.537 -19.052 143 HA ALA 18 HA ALA 18 -20.260 -8.703 -21.744 144 HB1 ALA 18 1HB ALA 18 -17.781 -10.078 -21.064 145 HB2 ALA 18 2HB ALA 18 -18.046 -8.628 -22.032 146 HB3 ALA 18 3HB ALA 18 -17.952 -8.510 -20.275 147 H SER 19 H SER 19 -19.908 -10.475 -23.265 148 HA SER 19 HA SER 19 -20.865 -13.023 -22.148 149 HB2 SER 19 2HB SER 19 -21.063 -12.025 -25.000 150 HB3 SER 19 3HB SER 19 -21.789 -13.497 -24.354 151 HG SER 19 HG SER 19 -23.007 -12.122 -22.933 152 H GLN 20 H GLN 20 -20.137 -14.999 -23.299 153 HA GLN 20 HA GLN 20 -17.349 -15.208 -23.289 154 HB2 GLN 20 2HB GLN 20 -19.205 -17.086 -24.745 155 HB3 GLN 20 3HB GLN 20 -17.644 -17.458 -24.026 156 HG2 GLN 20 2HG GLN 20 -20.245 -16.900 -22.643 157 HG3 GLN 20 3HG GLN 20 -19.254 -18.357 -22.577 158 HE21 GLN 20 1HE2 GLN 20 -17.239 -18.254 -21.449 159 HE22 GLN 20 2HE2 GLN 20 -17.020 -17.121 -20.163 160 H LYS 21 H LYS 21 -19.572 -14.384 -25.824 161 HA LYS 21 HA LYS 21 -17.720 -14.836 -27.975 162 HB2 LYS 21 2HB LYS 21 -19.416 -13.710 -29.366 163 HB3 LYS 21 3HB LYS 21 -20.112 -14.995 -28.387 164 HG2 LYS 21 2HG LYS 21 -20.531 -12.949 -26.732 165 HG3 LYS 21 3HG LYS 21 -20.532 -12.072 -28.264 166 HD2 LYS 21 2HD LYS 21 -22.190 -14.538 -27.775 167 HD3 LYS 21 3HD LYS 21 -22.780 -12.903 -27.472 168 HE2 LYS 21 2HE LYS 21 -22.219 -12.366 -29.860 169 HE3 LYS 21 3HE LYS 21 -21.898 -14.083 -30.100 170 HZ1 LYS 21 1HZ LYS 21 -24.050 -14.403 -30.416 171 HZ2 LYS 21 2HZ LYS 21 -24.359 -12.757 -30.180 172 HZ3 LYS 21 3HZ LYS 21 -24.395 -13.821 -28.866 173 H GLU 22 H GLU 22 -18.846 -12.045 -26.122 174 HA GLU 22 HA GLU 22 -17.454 -10.100 -27.649 175 HB2 GLU 22 2HB GLU 22 -19.357 -9.523 -26.215 176 HB3 GLU 22 3HB GLU 22 -18.432 -9.980 -24.791 177 HG2 GLU 22 2HG GLU 22 -18.566 -7.531 -25.208 178 HG3 GLU 22 3HG GLU 22 -16.927 -8.168 -25.083 179 H ILE 23 H ILE 23 -16.609 -12.092 -24.895 180 HA ILE 23 HA ILE 23 -14.269 -10.721 -24.117 181 HB ILE 23 HB ILE 23 -14.951 -13.647 -23.808 182 HG12 ILE 23 2HG1 ILE 23 -15.066 -11.692 -21.564 183 HG13 ILE 23 3HG1 ILE 23 -16.355 -11.629 -22.761 184 HG21 ILE 23 1HG2 ILE 23 -13.281 -13.645 -22.013 185 HG22 ILE 23 2HG2 ILE 23 -12.561 -13.269 -23.577 186 HG23 ILE 23 3HG2 ILE 23 -12.861 -11.980 -22.413 187 HD11 ILE 23 1HD1 ILE 23 -16.014 -14.336 -22.084 188 HD12 ILE 23 2HD1 ILE 23 -16.017 -13.421 -20.576 189 HD13 ILE 23 3HD1 ILE 23 -17.369 -13.275 -21.698 190 H LYS 24 H LYS 24 -14.906 -13.130 -26.576 191 HA LYS 24 HA LYS 24 -12.256 -13.898 -27.116 192 HB2 LYS 24 2HB LYS 24 -14.840 -14.006 -28.596 193 HB3 LYS 24 3HB LYS 24 -13.360 -14.264 -29.510 194 HG2 LYS 24 2HG LYS 24 -12.885 -16.237 -28.453 195 HG3 LYS 24 3HG LYS 24 -13.767 -15.793 -26.990 196 HD2 LYS 24 2HD LYS 24 -15.219 -17.325 -27.869 197 HD3 LYS 24 3HD LYS 24 -15.831 -15.859 -28.637 198 HE2 LYS 24 2HE LYS 24 -13.683 -17.354 -30.036 199 HE3 LYS 24 3HE LYS 24 -15.293 -18.072 -30.012 200 HZ1 LYS 24 1HZ LYS 24 -15.417 -16.794 -31.880 201 HZ2 LYS 24 2HZ LYS 24 -14.381 -15.595 -31.289 202 HZ3 LYS 24 3HZ LYS 24 -15.981 -15.675 -30.743 203 H LYS 25 H LYS 25 -14.246 -11.262 -28.364 204 HA LYS 25 HA LYS 25 -12.362 -10.383 -30.307 205 HB2 LYS 25 2HB LYS 25 -14.753 -9.081 -29.015 206 HB3 LYS 25 3HB LYS 25 -13.756 -8.240 -30.194 207 HG2 LYS 25 2HG LYS 25 -14.434 -9.590 -31.932 208 HG3 LYS 25 3HG LYS 25 -14.888 -10.918 -30.862 209 HD2 LYS 25 2HD LYS 25 -16.930 -10.034 -31.592 210 HD3 LYS 25 3HD LYS 25 -16.706 -9.345 -29.983 211 HE2 LYS 25 2HE LYS 25 -17.423 -7.563 -31.354 212 HE3 LYS 25 3HE LYS 25 -15.689 -7.333 -31.133 213 HZ1 LYS 25 1HZ LYS 25 -15.374 -7.470 -33.309 214 HZ2 LYS 25 2HZ LYS 25 -17.051 -7.473 -33.522 215 HZ3 LYS 25 3HZ LYS 25 -16.210 -8.936 -33.415 216 H ALA 26 H ALA 26 -13.179 -9.260 -27.035 217 HA ALA 26 HA ALA 26 -11.317 -7.148 -26.950 218 HB1 ALA 26 1HB ALA 26 -12.317 -8.721 -24.585 219 HB2 ALA 26 2HB ALA 26 -11.740 -7.054 -24.608 220 HB3 ALA 26 3HB ALA 26 -13.258 -7.472 -25.401 221 H TYR 27 H TYR 27 -11.023 -10.576 -26.345 222 HA TYR 27 HA TYR 27 -8.500 -10.445 -25.021 223 HB2 TYR 27 2HB TYR 27 -9.851 -12.381 -24.644 224 HB3 TYR 27 3HB TYR 27 -9.985 -12.702 -26.369 225 HD1 TYR 27 HD1 TYR 27 -7.109 -12.062 -24.061 226 HD2 TYR 27 HD2 TYR 27 -8.883 -14.639 -26.945 227 HE1 TYR 27 HE1 TYR 27 -5.151 -13.545 -23.932 228 HE2 TYR 27 HE2 TYR 27 -6.930 -16.130 -26.823 229 HH TYR 27 HH TYR 27 -4.043 -15.278 -25.566 230 H TYR 28 H TYR 28 -9.539 -10.773 -28.356 231 HA TYR 28 HA TYR 28 -6.943 -11.407 -29.379 232 HB2 TYR 28 2HB TYR 28 -8.918 -12.098 -30.606 233 HB3 TYR 28 3HB TYR 28 -9.450 -10.427 -30.759 234 HD1 TYR 28 HD1 TYR 28 -9.208 -9.569 -32.877 235 HD2 TYR 28 HD2 TYR 28 -6.293 -12.321 -31.452 236 HE1 TYR 28 HE1 TYR 28 -7.992 -9.375 -35.006 237 HE2 TYR 28 HE2 TYR 28 -5.069 -12.134 -33.577 238 HH TYR 28 HH TYR 28 -5.755 -11.490 -36.046 239 H GLN 29 H GLN 29 -8.944 -8.470 -29.325 240 HA GLN 29 HA GLN 29 -7.165 -6.792 -30.682 241 HB2 GLN 29 2HB GLN 29 -8.480 -4.984 -29.915 242 HB3 GLN 29 3HB GLN 29 -9.592 -6.337 -30.076 243 HG2 GLN 29 2HG GLN 29 -9.521 -6.718 -27.687 244 HG3 GLN 29 3HG GLN 29 -8.337 -5.427 -27.497 245 HE21 GLN 29 1HE2 GLN 29 -10.582 -5.310 -26.032 246 HE22 GLN 29 2HE2 GLN 29 -11.629 -4.064 -26.611 247 H LEU 30 H LEU 30 -7.322 -7.759 -27.314 248 HA LEU 30 HA LEU 30 -5.428 -5.842 -26.375 249 HB2 LEU 30 2HB LEU 30 -7.034 -7.967 -25.279 250 HB3 LEU 30 3HB LEU 30 -5.390 -8.046 -24.650 251 HG LEU 30 HG LEU 30 -5.564 -5.831 -23.744 252 HD11 LEU 30 1HD1 LEU 30 -7.827 -5.651 -25.583 253 HD12 LEU 30 2HD1 LEU 30 -6.789 -4.385 -24.929 254 HD13 LEU 30 3HD1 LEU 30 -8.150 -4.986 -23.982 255 HD21 LEU 30 1HD2 LEU 30 -6.396 -7.444 -22.248 256 HD22 LEU 30 2HD2 LEU 30 -7.898 -7.631 -23.153 257 HD23 LEU 30 3HD2 LEU 30 -7.593 -6.148 -22.246 258 H ALA 31 H ALA 31 -5.243 -9.221 -27.398 259 HA ALA 31 HA ALA 31 -2.597 -9.746 -26.698 260 HB1 ALA 31 1HB ALA 31 -3.539 -11.683 -27.355 261 HB2 ALA 31 2HB ALA 31 -4.559 -10.901 -28.564 262 HB3 ALA 31 3HB ALA 31 -2.867 -11.243 -28.925 263 H LYS 32 H LYS 32 -3.937 -8.223 -29.589 264 HA LYS 32 HA LYS 32 -1.576 -8.108 -31.101 265 HB2 LYS 32 2HB LYS 32 -4.066 -6.414 -31.083 266 HB3 LYS 32 3HB LYS 32 -2.744 -6.110 -32.202 267 HG2 LYS 32 2HG LYS 32 -3.221 -7.911 -33.472 268 HG3 LYS 32 3HG LYS 32 -3.740 -8.883 -32.093 269 HD2 LYS 32 2HD LYS 32 -5.714 -8.533 -33.279 270 HD3 LYS 32 3HD LYS 32 -5.772 -7.296 -32.020 271 HE2 LYS 32 2HE LYS 32 -5.099 -5.600 -33.544 272 HE3 LYS 32 3HE LYS 32 -4.692 -6.785 -34.784 273 HZ1 LYS 32 1HZ LYS 32 -6.925 -5.500 -34.899 274 HZ2 LYS 32 2HZ LYS 32 -7.448 -6.648 -33.772 275 HZ3 LYS 32 3HZ LYS 32 -6.886 -7.147 -35.288 276 H LYS 33 H LYS 33 -2.606 -6.318 -28.350 277 HA LYS 33 HA LYS 33 -0.883 -4.056 -28.793 278 HB2 LYS 33 2HB LYS 33 -2.117 -4.872 -26.167 279 HB3 LYS 33 3HB LYS 33 -1.633 -3.262 -26.683 280 HG2 LYS 33 2HG LYS 33 -3.427 -3.627 -28.540 281 HG3 LYS 33 3HG LYS 33 -4.048 -4.844 -27.423 282 HD2 LYS 33 2HD LYS 33 -5.196 -3.087 -26.585 283 HD3 LYS 33 3HD LYS 33 -3.685 -2.786 -25.723 284 HE2 LYS 33 2HE LYS 33 -4.440 -0.733 -26.725 285 HE3 LYS 33 3HE LYS 33 -2.990 -1.282 -27.564 286 HZ1 LYS 33 1HZ LYS 33 -5.581 -2.105 -28.640 287 HZ2 LYS 33 2HZ LYS 33 -4.141 -1.744 -29.451 288 HZ3 LYS 33 3HZ LYS 33 -5.117 -0.493 -28.864 289 H TYR 34 H TYR 34 -0.740 -7.076 -27.002 290 HA TYR 34 HA TYR 34 1.965 -6.387 -26.079 291 HB2 TYR 34 2HB TYR 34 0.128 -8.599 -25.139 292 HB3 TYR 34 3HB TYR 34 1.707 -8.215 -24.464 293 HD1 TYR 34 HD1 TYR 34 2.014 -6.279 -23.037 294 HD2 TYR 34 HD2 TYR 34 -1.795 -7.164 -24.713 295 HE1 TYR 34 HE1 TYR 34 0.966 -4.700 -21.471 296 HE2 TYR 34 HE2 TYR 34 -2.855 -5.586 -23.152 297 HH TYR 34 HH TYR 34 -0.946 -3.522 -21.049 298 H HIS 35 H HIS 35 1.145 -7.320 -28.799 299 HA HIS 35 HA HIS 35 1.944 -10.003 -29.165 300 HB2 HIS 35 2HB HIS 35 1.240 -7.733 -30.846 301 HB3 HIS 35 3HB HIS 35 2.534 -8.698 -31.550 302 HD1 HIS 35 HD1 HIS 35 0.854 -9.442 -33.419 303 HD2 HIS 35 HD2 HIS 35 -0.152 -10.661 -29.576 304 HE1 HIS 35 HE1 HIS 35 -0.907 -11.213 -33.714 305 HA PRO 36 HA PRO 36 6.328 -9.915 -29.081 306 HB2 PRO 36 2HB PRO 36 6.989 -11.552 -31.143 307 HB3 PRO 36 3HB PRO 36 6.290 -12.145 -29.631 308 HG2 PRO 36 2HG PRO 36 4.952 -11.609 -32.255 309 HG3 PRO 36 3HG PRO 36 4.740 -12.980 -31.150 310 HD2 PRO 36 2HD PRO 36 2.999 -10.909 -31.255 311 HD3 PRO 36 3HD PRO 36 3.334 -11.799 -29.756 312 H ASP 37 H ASP 37 4.644 -8.731 -31.804 313 HA ASP 37 HA ASP 37 6.944 -7.923 -33.326 314 HB2 ASP 37 2HB ASP 37 5.442 -7.059 -34.887 315 HB3 ASP 37 3HB ASP 37 4.534 -8.388 -34.171 316 H THR 38 H THR 38 5.126 -6.635 -30.707 317 HA THR 38 HA THR 38 6.315 -3.975 -31.087 318 HB THR 38 HB THR 38 4.675 -3.084 -29.624 319 HG1 THR 38 HG1 THR 38 4.495 -5.719 -28.758 320 HG21 THR 38 1HG2 THR 38 2.968 -3.234 -31.070 321 HG22 THR 38 2HG2 THR 38 2.782 -4.966 -30.796 322 HG23 THR 38 3HG2 THR 38 3.974 -4.380 -31.955 323 H ASN 39 H ASN 39 7.096 -6.773 -29.642 324 HA ASN 39 HA ASN 39 7.878 -5.808 -27.044 325 HB2 ASN 39 2HB ASN 39 8.067 -8.386 -28.522 326 HB3 ASN 39 3HB ASN 39 9.216 -8.113 -27.216 327 HD21 ASN 39 1HD2 ASN 39 5.839 -7.118 -27.541 328 HD22 ASN 39 2HD2 ASN 39 5.276 -7.952 -26.137 329 H LYS 40 H LYS 40 9.073 -5.277 -30.054 330 HA LYS 40 HA LYS 40 11.799 -5.687 -29.959 331 HB2 LYS 40 2HB LYS 40 9.994 -3.836 -31.372 332 HB3 LYS 40 3HB LYS 40 11.656 -3.276 -31.231 333 HG2 LYS 40 2HG LYS 40 11.923 -4.432 -33.135 334 HG3 LYS 40 3HG LYS 40 12.081 -5.807 -32.040 335 HD2 LYS 40 2HD LYS 40 9.341 -5.054 -32.884 336 HD3 LYS 40 3HD LYS 40 10.384 -5.793 -34.101 337 HE2 LYS 40 2HE LYS 40 10.375 -7.107 -31.466 338 HE3 LYS 40 3HE LYS 40 8.855 -7.183 -32.355 339 HZ1 LYS 40 1HZ LYS 40 9.707 -8.611 -33.822 340 HZ2 LYS 40 2HZ LYS 40 10.941 -8.863 -32.694 341 HZ3 LYS 40 3HZ LYS 40 11.167 -7.769 -33.964 342 H ASP 41 H ASP 41 9.916 -3.047 -28.559 343 HA ASP 41 HA ASP 41 12.347 -2.166 -27.142 344 HB2 ASP 41 2HB ASP 41 9.983 -0.547 -28.103 345 HB3 ASP 41 3HB ASP 41 11.195 0.074 -26.986 346 H ASP 42 H ASP 42 10.072 -4.129 -26.523 347 HA ASP 42 HA ASP 42 9.733 -3.255 -23.768 348 HB2 ASP 42 2HB ASP 42 7.717 -2.614 -25.395 349 HB3 ASP 42 3HB ASP 42 7.262 -4.285 -25.072 350 HA PRO 43 HA PRO 43 10.724 -7.739 -24.182 351 HB2 PRO 43 2HB PRO 43 12.470 -7.764 -22.103 352 HB3 PRO 43 3HB PRO 43 12.939 -7.312 -23.746 353 HG2 PRO 43 2HG PRO 43 12.277 -5.556 -21.414 354 HG3 PRO 43 3HG PRO 43 13.588 -5.397 -22.598 355 HD2 PRO 43 2HD PRO 43 11.308 -3.945 -22.747 356 HD3 PRO 43 3HD PRO 43 12.209 -4.458 -24.188 357 H LYS 44 H LYS 44 9.258 -5.730 -21.892 358 HA LYS 44 HA LYS 44 8.705 -7.905 -20.019 359 HB2 LYS 44 2HB LYS 44 8.396 -4.931 -19.945 360 HB3 LYS 44 3HB LYS 44 7.398 -5.918 -18.885 361 HG2 LYS 44 2HG LYS 44 9.250 -6.740 -17.716 362 HG3 LYS 44 3HG LYS 44 10.379 -6.225 -18.971 363 HD2 LYS 44 2HD LYS 44 9.906 -3.883 -18.432 364 HD3 LYS 44 3HD LYS 44 8.777 -4.400 -17.178 365 HE2 LYS 44 2HE LYS 44 10.832 -3.855 -16.106 366 HE3 LYS 44 3HE LYS 44 10.680 -5.612 -16.091 367 HZ1 LYS 44 1HZ LYS 44 12.772 -4.084 -17.113 368 HZ2 LYS 44 2HZ LYS 44 12.019 -4.827 -18.433 369 HZ3 LYS 44 3HZ LYS 44 12.600 -5.767 -17.152 370 H ALA 45 H ALA 45 7.303 -6.292 -22.680 371 HA ALA 45 HA ALA 45 4.578 -6.434 -22.141 372 HB1 ALA 45 1HB ALA 45 4.498 -6.828 -24.747 373 HB2 ALA 45 2HB ALA 45 4.997 -5.279 -24.067 374 HB3 ALA 45 3HB ALA 45 6.212 -6.430 -24.626 375 H LYS 46 H LYS 46 6.816 -8.927 -23.199 376 HA LYS 46 HA LYS 46 5.005 -10.891 -23.990 377 HB2 LYS 46 2HB LYS 46 6.803 -12.503 -23.492 378 HB3 LYS 46 3HB LYS 46 7.392 -11.108 -24.387 379 HG2 LYS 46 2HG LYS 46 8.107 -10.148 -22.159 380 HG3 LYS 46 3HG LYS 46 7.776 -11.742 -21.477 381 HD2 LYS 46 2HD LYS 46 10.115 -11.607 -22.003 382 HD3 LYS 46 3HD LYS 46 9.348 -12.714 -23.144 383 HE2 LYS 46 2HE LYS 46 9.642 -11.309 -24.913 384 HE3 LYS 46 3HE LYS 46 9.522 -9.857 -23.920 385 HZ1 LYS 46 1HZ LYS 46 11.818 -10.928 -24.912 386 HZ2 LYS 46 2HZ LYS 46 11.831 -11.431 -23.297 387 HZ3 LYS 46 3HZ LYS 46 11.718 -9.785 -23.669 388 H GLU 47 H GLU 47 6.225 -10.070 -20.777 389 HA GLU 47 HA GLU 47 5.041 -12.245 -19.414 390 HB2 GLU 47 2HB GLU 47 6.867 -10.548 -18.640 391 HB3 GLU 47 3HB GLU 47 5.496 -9.582 -18.113 392 HG2 GLU 47 2HG GLU 47 6.088 -10.765 -16.215 393 HG3 GLU 47 3HG GLU 47 4.739 -11.692 -16.870 394 H LYS 48 H LYS 48 3.926 -8.978 -20.151 395 HA LYS 48 HA LYS 48 1.530 -9.138 -18.630 396 HB2 LYS 48 2HB LYS 48 2.058 -7.374 -21.025 397 HB3 LYS 48 3HB LYS 48 0.884 -7.102 -19.744 398 HG2 LYS 48 2HG LYS 48 3.869 -7.141 -19.353 399 HG3 LYS 48 3HG LYS 48 2.892 -5.684 -19.551 400 HD2 LYS 48 2HD LYS 48 1.706 -6.118 -17.524 401 HD3 LYS 48 3HD LYS 48 2.427 -7.723 -17.380 402 HE2 LYS 48 2HE LYS 48 4.581 -6.795 -16.943 403 HE3 LYS 48 3HE LYS 48 4.027 -5.171 -17.346 404 HZ1 LYS 48 1HZ LYS 48 3.547 -6.751 -14.923 405 HZ2 LYS 48 2HZ LYS 48 2.363 -5.645 -15.408 406 HZ3 LYS 48 3HZ LYS 48 3.934 -5.111 -15.081 407 H PHE 49 H PHE 49 2.393 -9.960 -21.929 408 HA PHE 49 HA PHE 49 -0.185 -10.245 -22.993 409 HB2 PHE 49 2HB PHE 49 1.696 -10.213 -24.478 410 HB3 PHE 49 3HB PHE 49 2.418 -11.610 -23.687 411 HD1 PHE 49 HD1 PHE 49 -0.085 -10.459 -26.068 412 HD2 PHE 49 HD2 PHE 49 1.544 -13.848 -24.074 413 HE1 PHE 49 HE1 PHE 49 -1.204 -11.941 -27.682 414 HE2 PHE 49 HE2 PHE 49 0.428 -15.336 -25.685 415 HZ PHE 49 HZ PHE 49 -0.947 -14.383 -27.492 416 H SER 50 H SER 50 1.760 -12.363 -21.007 417 HA SER 50 HA SER 50 0.291 -14.742 -21.415 418 HB2 SER 50 2HB SER 50 2.367 -15.118 -20.437 419 HB3 SER 50 3HB SER 50 2.193 -13.773 -19.309 420 HG SER 50 HG SER 50 1.855 -16.183 -18.664 421 H GLN 51 H GLN 51 -0.138 -12.002 -19.277 422 HA GLN 51 HA GLN 51 -2.014 -13.149 -17.517 423 HB2 GLN 51 2HB GLN 51 -1.549 -10.286 -18.350 424 HB3 GLN 51 3HB GLN 51 -2.682 -10.754 -17.090 425 HG2 GLN 51 2HG GLN 51 -0.957 -11.559 -15.700 426 HG3 GLN 51 3HG GLN 51 0.224 -11.498 -17.007 427 HE21 GLN 51 1HE2 GLN 51 -0.219 -10.164 -14.246 428 HE22 GLN 51 2HE2 GLN 51 0.171 -8.510 -14.554 429 H LEU 52 H LEU 52 -2.300 -11.837 -20.725 430 HA LEU 52 HA LEU 52 -5.088 -11.389 -20.745 431 HB2 LEU 52 2HB LEU 52 -3.327 -12.135 -23.073 432 HB3 LEU 52 3HB LEU 52 -4.896 -11.337 -23.150 433 HG LEU 52 HG LEU 52 -2.543 -10.069 -21.779 434 HD11 LEU 52 1HD1 LEU 52 -1.754 -9.148 -23.723 435 HD12 LEU 52 2HD1 LEU 52 -3.281 -9.364 -24.577 436 HD13 LEU 52 3HD1 LEU 52 -2.229 -10.749 -24.290 437 HD21 LEU 52 1HD2 LEU 52 -5.292 -9.379 -22.268 438 HD22 LEU 52 2HD2 LEU 52 -4.215 -8.199 -23.015 439 HD23 LEU 52 3HD2 LEU 52 -4.084 -8.546 -21.290 440 H ALA 53 H ALA 53 -3.132 -14.165 -21.797 441 HA ALA 53 HA ALA 53 -5.356 -15.756 -22.568 442 HB1 ALA 53 1HB ALA 53 -3.819 -17.227 -23.281 443 HB2 ALA 53 2HB ALA 53 -2.673 -15.925 -22.958 444 HB3 ALA 53 3HB ALA 53 -2.931 -17.191 -21.757 445 H GLU 54 H GLU 54 -3.599 -15.310 -19.569 446 HA GLU 54 HA GLU 54 -4.585 -17.575 -18.203 447 HB2 GLU 54 2HB GLU 54 -3.294 -15.009 -17.412 448 HB3 GLU 54 3HB GLU 54 -4.112 -15.935 -16.162 449 HG2 GLU 54 2HG GLU 54 -2.052 -17.152 -17.971 450 HG3 GLU 54 3HG GLU 54 -1.632 -16.342 -16.463 451 H ALA 55 H ALA 55 -5.660 -14.181 -18.198 452 HA ALA 55 HA ALA 55 -7.918 -14.679 -16.531 453 HB1 ALA 55 1HB ALA 55 -7.514 -12.481 -16.351 454 HB2 ALA 55 2HB ALA 55 -6.765 -12.386 -17.946 455 HB3 ALA 55 3HB ALA 55 -8.522 -12.345 -17.792 456 H TYR 56 H TYR 56 -7.425 -14.429 -20.018 457 HA TYR 56 HA TYR 56 -10.130 -14.456 -20.783 458 HB2 TYR 56 2HB TYR 56 -8.574 -13.811 -22.436 459 HB3 TYR 56 3HB TYR 56 -7.590 -15.250 -22.193 460 HD1 TYR 56 HD1 TYR 56 -10.689 -13.946 -23.689 461 HD2 TYR 56 HD2 TYR 56 -8.131 -17.321 -23.282 462 HE1 TYR 56 HE1 TYR 56 -11.873 -15.058 -25.536 463 HE2 TYR 56 HE2 TYR 56 -9.308 -18.443 -25.128 464 HH TYR 56 HH TYR 56 -10.682 -17.790 -27.102 465 H GLU 57 H GLU 57 -7.971 -16.977 -19.766 466 HA GLU 57 HA GLU 57 -9.294 -19.203 -20.853 467 HB2 GLU 57 2HB GLU 57 -7.379 -18.746 -18.627 468 HB3 GLU 57 3HB GLU 57 -8.267 -20.263 -18.620 469 HG2 GLU 57 2HG GLU 57 -6.850 -19.360 -21.088 470 HG3 GLU 57 3HG GLU 57 -5.961 -20.135 -19.779 471 H VAL 58 H VAL 58 -9.692 -17.542 -17.744 472 HA VAL 58 HA VAL 58 -11.758 -19.296 -16.830 473 HB VAL 58 HB VAL 58 -10.993 -16.542 -15.849 474 HG11 VAL 58 1HG1 VAL 58 -13.227 -18.178 -15.220 475 HG12 VAL 58 2HG1 VAL 58 -12.145 -18.164 -13.825 476 HG13 VAL 58 3HG1 VAL 58 -12.746 -16.645 -14.493 477 HG21 VAL 58 1HG2 VAL 58 -9.119 -17.670 -15.285 478 HG22 VAL 58 2HG2 VAL 58 -10.122 -18.243 -13.952 479 HG23 VAL 58 3HG2 VAL 58 -9.906 -19.245 -15.387 480 H LEU 59 H LEU 59 -11.687 -16.059 -18.271 481 HA LEU 59 HA LEU 59 -14.516 -15.691 -18.142 482 HB2 LEU 59 2HB LEU 59 -12.195 -14.236 -19.199 483 HB3 LEU 59 3HB LEU 59 -13.693 -13.981 -20.091 484 HG LEU 59 HG LEU 59 -14.780 -13.114 -18.134 485 HD11 LEU 59 1HD1 LEU 59 -12.291 -14.014 -16.719 486 HD12 LEU 59 2HD1 LEU 59 -13.969 -14.422 -16.367 487 HD13 LEU 59 3HD1 LEU 59 -13.370 -12.797 -16.038 488 HD21 LEU 59 1HD2 LEU 59 -13.392 -11.569 -19.444 489 HD22 LEU 59 2HD2 LEU 59 -12.022 -11.919 -18.390 490 HD23 LEU 59 3HD2 LEU 59 -13.454 -11.119 -17.740 491 H SER 60 H SER 60 -12.598 -17.641 -20.046 492 HA SER 60 HA SER 60 -13.970 -17.400 -22.541 493 HB2 SER 60 2HB SER 60 -12.013 -18.419 -23.039 494 HB3 SER 60 3HB SER 60 -11.835 -19.076 -21.412 495 HG SER 60 HG SER 60 -13.282 -20.131 -23.595 496 H ASP 61 H ASP 61 -14.733 -18.847 -19.573 497 HA ASP 61 HA ASP 61 -16.997 -20.237 -20.821 498 HB2 ASP 61 2HB ASP 61 -14.920 -21.686 -19.942 499 HB3 ASP 61 3HB ASP 61 -15.792 -21.511 -18.421 500 H GLU 62 H GLU 62 -18.909 -20.007 -19.779 501 HA GLU 62 HA GLU 62 -19.257 -17.937 -17.935 502 HB2 GLU 62 2HB GLU 62 -21.156 -20.248 -18.336 503 HB3 GLU 62 3HB GLU 62 -21.551 -18.623 -17.796 504 HG2 GLU 62 2HG GLU 62 -20.839 -17.770 -20.013 505 HG3 GLU 62 3HG GLU 62 -20.615 -19.439 -20.535 506 H VAL 63 H VAL 63 -19.079 -21.440 -17.452 507 HA VAL 63 HA VAL 63 -19.708 -21.529 -14.737 508 HB VAL 63 HB VAL 63 -17.726 -23.319 -16.146 509 HG11 VAL 63 1HG1 VAL 63 -19.484 -24.482 -14.138 510 HG12 VAL 63 2HG1 VAL 63 -17.734 -24.612 -14.325 511 HG13 VAL 63 3HG1 VAL 63 -18.432 -23.226 -13.487 512 HG21 VAL 63 1HG2 VAL 63 -19.401 -23.994 -17.442 513 HG22 VAL 63 2HG2 VAL 63 -20.224 -24.577 -15.995 514 HG23 VAL 63 3HG2 VAL 63 -20.542 -22.949 -16.594 515 H LYS 64 H LYS 64 -16.485 -21.393 -16.257 516 HA LYS 64 HA LYS 64 -15.035 -21.181 -13.858 517 HB2 LYS 64 2HB LYS 64 -14.398 -20.396 -16.697 518 HB3 LYS 64 3HB LYS 64 -13.244 -20.182 -15.387 519 HG2 LYS 64 2HG LYS 64 -13.798 -22.734 -14.969 520 HG3 LYS 64 3HG LYS 64 -14.209 -22.667 -16.684 521 HD2 LYS 64 2HD LYS 64 -11.916 -23.305 -16.520 522 HD3 LYS 64 3HD LYS 64 -11.960 -21.635 -17.090 523 HE2 LYS 64 2HE LYS 64 -11.403 -20.810 -14.916 524 HE3 LYS 64 3HE LYS 64 -11.591 -22.410 -14.201 525 HZ1 LYS 64 1HZ LYS 64 -9.568 -21.796 -16.279 526 HZ2 LYS 64 2HZ LYS 64 -9.666 -23.177 -15.308 527 HZ3 LYS 64 3HZ LYS 64 -9.249 -21.689 -14.621 528 H ARG 65 H ARG 65 -16.199 -18.689 -16.106 529 HA ARG 65 HA ARG 65 -15.118 -16.463 -14.824 530 HB2 ARG 65 2HB ARG 65 -16.110 -16.337 -17.048 531 HB3 ARG 65 3HB ARG 65 -17.698 -16.695 -16.383 532 HG2 ARG 65 2HG ARG 65 -17.435 -14.578 -15.007 533 HG3 ARG 65 3HG ARG 65 -16.059 -14.205 -16.047 534 HD2 ARG 65 2HD ARG 65 -17.376 -13.605 -17.751 535 HD3 ARG 65 3HD ARG 65 -18.430 -15.003 -17.537 536 HE ARG 65 HE ARG 65 -18.797 -12.941 -15.562 537 HH11 ARG 65 1HH1 ARG 65 -19.717 -14.104 -18.712 538 HH12 ARG 65 2HH1 ARG 65 -21.241 -13.280 -18.714 539 HH21 ARG 65 1HH2 ARG 65 -20.801 -11.852 -15.553 540 HH22 ARG 65 2HH2 ARG 65 -21.856 -11.999 -16.917 541 H LYS 66 H LYS 66 -18.294 -17.998 -14.383 542 HA LYS 66 HA LYS 66 -19.207 -16.220 -12.389 543 HB2 LYS 66 2HB LYS 66 -19.995 -19.040 -13.112 544 HB3 LYS 66 3HB LYS 66 -20.803 -18.127 -11.844 545 HG2 LYS 66 2HG LYS 66 -20.620 -17.326 -14.742 546 HG3 LYS 66 3HG LYS 66 -22.030 -18.030 -13.947 547 HD2 LYS 66 2HD LYS 66 -21.939 -16.061 -12.352 548 HD3 LYS 66 3HD LYS 66 -20.769 -15.340 -13.460 549 HE2 LYS 66 2HE LYS 66 -22.329 -15.025 -15.116 550 HE3 LYS 66 3HE LYS 66 -23.351 -16.348 -14.553 551 HZ1 LYS 66 1HZ LYS 66 -23.755 -13.685 -14.096 552 HZ2 LYS 66 2HZ LYS 66 -23.146 -14.253 -12.624 553 HZ3 LYS 66 3HZ LYS 66 -24.526 -14.963 -13.298 554 H GLN 67 H GLN 67 -17.567 -19.356 -12.214 555 HA GLN 67 HA GLN 67 -17.664 -19.699 -9.443 556 HB2 GLN 67 2HB GLN 67 -15.811 -20.680 -11.586 557 HB3 GLN 67 3HB GLN 67 -15.458 -21.017 -9.897 558 HG2 GLN 67 2HG GLN 67 -17.915 -21.832 -11.428 559 HG3 GLN 67 3HG GLN 67 -16.619 -22.881 -10.859 560 HE21 GLN 67 1HE2 GLN 67 -19.493 -21.182 -10.036 561 HE22 GLN 67 2HE2 GLN 67 -19.646 -21.780 -8.422 562 H TYR 68 H TYR 68 -15.475 -17.840 -11.461 563 HA TYR 68 HA TYR 68 -13.589 -17.284 -9.392 564 HB2 TYR 68 2HB TYR 68 -12.844 -17.150 -11.668 565 HB3 TYR 68 3HB TYR 68 -14.105 -15.991 -12.073 566 HD1 TYR 68 HD1 TYR 68 -11.213 -16.358 -9.733 567 HD2 TYR 68 HD2 TYR 68 -13.541 -13.754 -12.162 568 HE1 TYR 68 HE1 TYR 68 -9.672 -14.512 -9.219 569 HE2 TYR 68 HE2 TYR 68 -12.005 -11.900 -11.656 570 HH TYR 68 HH TYR 68 -10.287 -11.480 -9.469 571 H ASP 69 H ASP 69 -16.422 -15.641 -10.686 572 HA ASP 69 HA ASP 69 -16.075 -13.209 -9.280 573 HB2 ASP 69 2HB ASP 69 -17.610 -13.687 -11.281 574 HB3 ASP 69 3HB ASP 69 -18.744 -14.341 -10.102 575 H ALA 70 H ALA 70 -17.444 -16.297 -8.422 576 HA ALA 70 HA ALA 70 -18.984 -15.550 -6.209 577 HB1 ALA 70 1HB ALA 70 -18.999 -17.788 -7.292 578 HB2 ALA 70 2HB ALA 70 -17.448 -18.124 -6.523 579 HB3 ALA 70 3HB ALA 70 -18.881 -17.849 -5.533 580 H TYR 71 H TYR 71 -15.535 -16.166 -6.530 581 HA TYR 71 HA TYR 71 -15.178 -15.541 -3.678 582 HB2 TYR 71 2HB TYR 71 -13.231 -16.833 -5.600 583 HB3 TYR 71 3HB TYR 71 -12.970 -16.578 -3.878 584 HD1 TYR 71 HD1 TYR 71 -15.072 -17.555 -2.421 585 HD2 TYR 71 HD2 TYR 71 -13.746 -18.990 -6.200 586 HE1 TYR 71 HE1 TYR 71 -16.086 -19.743 -1.939 587 HE2 TYR 71 HE2 TYR 71 -14.758 -21.182 -5.729 588 HH TYR 71 HH TYR 71 -16.094 -21.952 -2.589 589 H GLY 72 H GLY 72 -15.643 -13.609 -5.891 590 HA2 GLY 72 2HA GLY 72 -13.064 -12.197 -5.935 591 HA3 GLY 72 3HA GLY 72 -14.419 -11.883 -7.009 592 H SER 73 H SER 73 -13.623 -9.652 -6.181 593 HA SER 73 HA SER 73 -15.121 -8.974 -3.736 594 HB2 SER 73 2HB SER 73 -12.572 -8.605 -3.807 595 HB3 SER 73 3HB SER 73 -12.927 -7.275 -4.910 596 HG SER 73 HG SER 73 -13.479 -6.130 -3.250 Start of MODEL 3 1 H1 HIS 1 H HIS 1 -7.614 0.977 3.868 2 HA HIS 1 HA HIS 1 -4.879 2.025 3.561 3 HB2 HIS 1 2HB HIS 1 -6.193 0.806 5.968 4 HB3 HIS 1 3HB HIS 1 -4.453 0.654 5.740 5 HD1 HIS 1 HD1 HIS 1 -3.272 2.359 7.065 6 HD2 HIS 1 HD2 HIS 1 -6.857 3.812 5.550 7 HE1 HIS 1 HE1 HIS 1 -3.410 4.747 7.840 8 H MET 2 H MET 2 -6.440 0.176 1.895 9 HA MET 2 HA MET 2 -4.544 -2.056 1.951 10 HB2 MET 2 2HB MET 2 -7.533 -2.246 2.038 11 HB3 MET 2 3HB MET 2 -6.603 -3.500 1.229 12 HG2 MET 2 2HG MET 2 -5.252 -3.451 3.502 13 HG3 MET 2 3HG MET 2 -6.785 -2.826 4.108 14 HE1 MET 2 1HE MET 2 -6.306 -5.247 5.676 15 HE2 MET 2 2HE MET 2 -7.880 -4.470 5.508 16 HE3 MET 2 3HE MET 2 -7.738 -6.221 5.346 17 H LEU 3 H LEU 3 -3.885 -2.740 -0.031 18 HA LEU 3 HA LEU 3 -4.223 -1.059 -2.248 19 HB2 LEU 3 2HB LEU 3 -2.840 -2.517 -3.412 20 HB3 LEU 3 3HB LEU 3 -2.345 -2.717 -1.733 21 HG LEU 3 HG LEU 3 -4.175 -4.603 -3.215 22 HD11 LEU 3 1HD1 LEU 3 -1.382 -5.282 -2.433 23 HD12 LEU 3 2HD1 LEU 3 -1.661 -4.362 -3.911 24 HD13 LEU 3 3HD1 LEU 3 -2.392 -5.954 -3.713 25 HD21 LEU 3 1HD2 LEU 3 -2.853 -4.716 -0.510 26 HD22 LEU 3 2HD2 LEU 3 -3.613 -6.099 -1.296 27 HD23 LEU 3 3HD2 LEU 3 -4.581 -4.690 -0.861 28 H ALA 4 H ALA 4 -5.384 -1.269 -4.154 29 HA ALA 4 HA ALA 4 -7.934 -2.538 -3.917 30 HB1 ALA 4 1HB ALA 4 -6.607 -1.021 -6.151 31 HB2 ALA 4 2HB ALA 4 -8.231 -1.699 -6.280 32 HB3 ALA 4 3HB ALA 4 -7.882 -0.469 -5.064 33 H LYS 5 H LYS 5 -8.824 -4.087 -5.413 34 HA LYS 5 HA LYS 5 -6.812 -6.043 -6.283 35 HB2 LYS 5 2HB LYS 5 -8.655 -6.648 -4.606 36 HB3 LYS 5 3HB LYS 5 -9.762 -6.564 -5.969 37 HG2 LYS 5 2HG LYS 5 -9.125 -8.846 -5.610 38 HG3 LYS 5 3HG LYS 5 -8.412 -8.282 -7.123 39 HD2 LYS 5 2HD LYS 5 -6.266 -8.069 -6.134 40 HD3 LYS 5 3HD LYS 5 -6.921 -8.269 -4.507 41 HE2 LYS 5 2HE LYS 5 -7.339 -10.454 -6.484 42 HE3 LYS 5 3HE LYS 5 -5.734 -10.257 -5.782 43 HZ1 LYS 5 1HZ LYS 5 -6.535 -11.496 -4.128 44 HZ2 LYS 5 2HZ LYS 5 -8.147 -11.259 -4.582 45 HZ3 LYS 5 3HZ LYS 5 -7.360 -10.105 -3.628 46 H GLU 6 H GLU 6 -6.975 -7.045 -8.320 47 HA GLU 6 HA GLU 6 -8.508 -5.482 -10.289 48 HB2 GLU 6 2HB GLU 6 -5.810 -6.742 -10.350 49 HB3 GLU 6 3HB GLU 6 -6.726 -6.697 -11.850 50 HG2 GLU 6 2HG GLU 6 -6.643 -4.413 -11.998 51 HG3 GLU 6 3HG GLU 6 -6.445 -4.198 -10.260 52 H ASP 7 H ASP 7 -9.539 -6.571 -12.009 53 HA ASP 7 HA ASP 7 -9.993 -9.445 -11.537 54 HB2 ASP 7 2HB ASP 7 -12.057 -7.565 -12.679 55 HB3 ASP 7 3HB ASP 7 -12.294 -9.204 -12.079 56 H TYR 8 H TYR 8 -10.697 -10.653 -13.462 57 HA TYR 8 HA TYR 8 -8.950 -10.257 -15.624 58 HB2 TYR 8 2HB TYR 8 -11.483 -11.902 -15.674 59 HB3 TYR 8 3HB TYR 8 -10.044 -12.126 -16.663 60 HD1 TYR 8 HD1 TYR 8 -11.662 -13.905 -14.485 61 HD2 TYR 8 HD2 TYR 8 -7.919 -11.886 -14.609 62 HE1 TYR 8 HE1 TYR 8 -10.767 -15.474 -12.816 63 HE2 TYR 8 HE2 TYR 8 -7.013 -13.450 -12.942 64 HH TYR 8 HH TYR 8 -8.570 -16.331 -12.087 65 H TYR 9 H TYR 9 -12.208 -9.180 -15.034 66 HA TYR 9 HA TYR 9 -13.128 -8.632 -17.575 67 HB2 TYR 9 2HB TYR 9 -13.515 -6.876 -15.144 68 HB3 TYR 9 3HB TYR 9 -14.551 -6.938 -16.566 69 HD1 TYR 9 HD1 TYR 9 -13.951 -8.256 -13.313 70 HD2 TYR 9 HD2 TYR 9 -15.712 -9.178 -17.075 71 HE1 TYR 9 HE1 TYR 9 -15.303 -10.010 -12.243 72 HE2 TYR 9 HE2 TYR 9 -17.070 -10.934 -16.016 73 HH TYR 9 HH TYR 9 -17.741 -11.153 -12.972 74 H GLN 10 H GLN 10 -11.044 -6.629 -15.521 75 HA GLN 10 HA GLN 10 -10.845 -4.503 -17.415 76 HB2 GLN 10 2HB GLN 10 -9.313 -5.207 -14.920 77 HB3 GLN 10 3HB GLN 10 -8.873 -3.830 -15.922 78 HG2 GLN 10 2HG GLN 10 -10.211 -2.825 -14.371 79 HG3 GLN 10 3HG GLN 10 -11.387 -3.190 -15.633 80 HE21 GLN 10 1HE2 GLN 10 -9.964 -4.590 -12.706 81 HE22 GLN 10 2HE2 GLN 10 -11.419 -5.335 -12.146 82 H ILE 11 H ILE 11 -8.800 -7.255 -16.544 83 HA ILE 11 HA ILE 11 -6.572 -6.634 -18.104 84 HB ILE 11 HB ILE 11 -7.662 -9.376 -17.459 85 HG12 ILE 11 2HG1 ILE 11 -5.451 -7.916 -16.025 86 HG13 ILE 11 3HG1 ILE 11 -7.135 -7.745 -15.542 87 HG21 ILE 11 1HG2 ILE 11 -6.085 -9.596 -19.220 88 HG22 ILE 11 2HG2 ILE 11 -4.974 -8.461 -18.455 89 HG23 ILE 11 3HG2 ILE 11 -5.252 -10.045 -17.732 90 HD11 ILE 11 1HD1 ILE 11 -6.651 -9.453 -14.182 91 HD12 ILE 11 2HD1 ILE 11 -6.905 -10.434 -15.626 92 HD13 ILE 11 3HD1 ILE 11 -5.271 -9.971 -15.150 93 H LEU 12 H LEU 12 -9.706 -7.725 -19.023 94 HA LEU 12 HA LEU 12 -8.758 -8.313 -21.745 95 HB2 LEU 12 2HB LEU 12 -11.038 -9.273 -20.106 96 HB3 LEU 12 3HB LEU 12 -11.289 -9.128 -21.845 97 HG LEU 12 HG LEU 12 -9.095 -10.763 -20.574 98 HD11 LEU 12 1HD1 LEU 12 -10.685 -12.234 -20.070 99 HD12 LEU 12 2HD1 LEU 12 -10.888 -12.472 -21.805 100 HD13 LEU 12 3HD1 LEU 12 -11.914 -11.322 -20.948 101 HD21 LEU 12 1HD2 LEU 12 -9.305 -11.809 -22.962 102 HD22 LEU 12 2HD2 LEU 12 -8.354 -10.345 -22.709 103 HD23 LEU 12 3HD2 LEU 12 -9.986 -10.234 -23.371 104 H GLY 13 H GLY 13 -10.455 -6.045 -19.850 105 HA2 GLY 13 2HA GLY 13 -11.247 -3.960 -20.469 106 HA3 GLY 13 3HA GLY 13 -10.890 -4.360 -22.142 107 H VAL 14 H VAL 14 -12.844 -6.483 -20.207 108 HA VAL 14 HA VAL 14 -15.194 -5.676 -21.791 109 HB VAL 14 HB VAL 14 -16.048 -7.942 -21.507 110 HG11 VAL 14 1HG1 VAL 14 -13.203 -8.063 -22.491 111 HG12 VAL 14 2HG1 VAL 14 -14.561 -9.068 -22.999 112 HG13 VAL 14 3HG1 VAL 14 -14.531 -7.352 -23.407 113 HG21 VAL 14 1HG2 VAL 14 -13.472 -8.448 -20.022 114 HG22 VAL 14 2HG2 VAL 14 -15.101 -8.481 -19.347 115 HG23 VAL 14 3HG2 VAL 14 -14.611 -9.696 -20.527 116 HA PRO 15 HA PRO 15 -17.375 -4.593 -18.135 117 HB2 PRO 15 2HB PRO 15 -19.915 -5.235 -18.848 118 HB3 PRO 15 3HB PRO 15 -19.054 -3.841 -19.511 119 HG2 PRO 15 2HG PRO 15 -19.469 -6.554 -20.706 120 HG3 PRO 15 3HG PRO 15 -19.586 -4.962 -21.478 121 HD2 PRO 15 2HD PRO 15 -17.408 -6.550 -21.736 122 HD3 PRO 15 3HD PRO 15 -17.303 -4.778 -21.731 123 H ARG 16 H ARG 16 -19.085 -5.492 -16.583 124 HA ARG 16 HA ARG 16 -18.231 -8.114 -15.768 125 HB2 ARG 16 2HB ARG 16 -20.382 -6.360 -14.569 126 HB3 ARG 16 3HB ARG 16 -19.611 -7.744 -13.804 127 HG2 ARG 16 2HG ARG 16 -18.011 -5.373 -14.689 128 HG3 ARG 16 3HG ARG 16 -18.844 -5.394 -13.134 129 HD2 ARG 16 2HD ARG 16 -17.085 -7.681 -13.902 130 HD3 ARG 16 3HD ARG 16 -16.360 -6.186 -13.314 131 HE ARG 16 HE ARG 16 -17.672 -8.160 -11.757 132 HH11 ARG 16 1HH1 ARG 16 -17.202 -4.721 -12.027 133 HH12 ARG 16 2HH1 ARG 16 -17.444 -4.424 -10.338 134 HH21 ARG 16 1HH2 ARG 16 -17.992 -7.782 -9.531 135 HH22 ARG 16 2HH2 ARG 16 -17.892 -6.165 -8.918 136 H ASN 17 H ASN 17 -20.569 -6.992 -17.869 137 HA ASN 17 HA ASN 17 -22.246 -9.380 -17.463 138 HB2 ASN 17 2HB ASN 17 -22.917 -6.693 -18.675 139 HB3 ASN 17 3HB ASN 17 -23.977 -8.096 -18.780 140 HD21 ASN 17 1HD2 ASN 17 -24.473 -5.541 -17.528 141 HD22 ASN 17 2HD2 ASN 17 -24.803 -5.864 -15.864 142 H ALA 18 H ALA 18 -19.744 -8.414 -19.243 143 HA ALA 18 HA ALA 18 -20.382 -8.738 -21.916 144 HB1 ALA 18 1HB ALA 18 -18.197 -8.435 -22.145 145 HB2 ALA 18 2HB ALA 18 -18.031 -8.547 -20.392 146 HB3 ALA 18 3HB ALA 18 -17.862 -9.992 -21.387 147 H SER 19 H SER 19 -19.987 -10.572 -23.350 148 HA SER 19 HA SER 19 -20.835 -13.093 -22.092 149 HB2 SER 19 2HB SER 19 -21.339 -13.560 -24.678 150 HB3 SER 19 3HB SER 19 -22.491 -12.727 -23.635 151 HG SER 19 HG SER 19 -21.245 -11.814 -25.820 152 H GLN 20 H GLN 20 -20.117 -15.082 -23.367 153 HA GLN 20 HA GLN 20 -17.305 -15.227 -23.301 154 HB2 GLN 20 2HB GLN 20 -19.088 -17.184 -24.739 155 HB3 GLN 20 3HB GLN 20 -17.542 -17.494 -23.961 156 HG2 GLN 20 2HG GLN 20 -20.211 -17.005 -22.693 157 HG3 GLN 20 3HG GLN 20 -19.143 -18.398 -22.523 158 HE21 GLN 20 1HE2 GLN 20 -17.205 -18.145 -21.302 159 HE22 GLN 20 2HE2 GLN 20 -17.100 -16.943 -20.066 160 H LYS 21 H LYS 21 -19.546 -14.462 -25.829 161 HA LYS 21 HA LYS 21 -17.714 -14.931 -27.992 162 HB2 LYS 21 2HB LYS 21 -20.299 -13.361 -27.930 163 HB3 LYS 21 3HB LYS 21 -19.423 -13.832 -29.381 164 HG2 LYS 21 2HG LYS 21 -19.772 -16.200 -28.787 165 HG3 LYS 21 3HG LYS 21 -20.726 -15.682 -27.395 166 HD2 LYS 21 2HD LYS 21 -22.382 -14.696 -28.802 167 HD3 LYS 21 3HD LYS 21 -21.372 -14.907 -30.235 168 HE2 LYS 21 2HE LYS 21 -22.459 -17.168 -28.561 169 HE3 LYS 21 3HE LYS 21 -23.215 -16.569 -30.036 170 HZ1 LYS 21 1HZ LYS 21 -20.967 -18.313 -29.722 171 HZ2 LYS 21 2HZ LYS 21 -20.632 -17.022 -30.762 172 HZ3 LYS 21 3HZ LYS 21 -21.941 -18.045 -31.079 173 H GLU 22 H GLU 22 -18.869 -12.101 -26.204 174 HA GLU 22 HA GLU 22 -17.486 -10.177 -27.747 175 HB2 GLU 22 2HB GLU 22 -19.345 -9.531 -26.330 176 HB3 GLU 22 3HB GLU 22 -18.483 -10.071 -24.897 177 HG2 GLU 22 2HG GLU 22 -18.471 -7.632 -25.152 178 HG3 GLU 22 3HG GLU 22 -16.850 -8.325 -25.160 179 H ILE 23 H ILE 23 -16.584 -12.152 -25.003 180 HA ILE 23 HA ILE 23 -14.225 -10.755 -24.299 181 HB ILE 23 HB ILE 23 -14.949 -13.654 -23.863 182 HG12 ILE 23 2HG1 ILE 23 -14.944 -11.588 -21.710 183 HG13 ILE 23 3HG1 ILE 23 -16.286 -11.594 -22.849 184 HG21 ILE 23 1HG2 ILE 23 -12.498 -12.214 -23.387 185 HG22 ILE 23 2HG2 ILE 23 -13.185 -12.808 -21.876 186 HG23 ILE 23 3HG2 ILE 23 -12.847 -13.932 -23.193 187 HD11 ILE 23 1HD1 ILE 23 -17.231 -13.089 -21.514 188 HD12 ILE 23 2HD1 ILE 23 -16.037 -14.241 -22.114 189 HD13 ILE 23 3HD1 ILE 23 -15.732 -13.352 -20.622 190 H LYS 24 H LYS 24 -14.929 -13.273 -26.635 191 HA LYS 24 HA LYS 24 -12.300 -14.078 -27.204 192 HB2 LYS 24 2HB LYS 24 -14.892 -14.169 -28.701 193 HB3 LYS 24 3HB LYS 24 -13.401 -14.594 -29.531 194 HG2 LYS 24 2HG LYS 24 -12.972 -16.366 -27.964 195 HG3 LYS 24 3HG LYS 24 -14.361 -15.886 -26.987 196 HD2 LYS 24 2HD LYS 24 -15.251 -17.627 -28.202 197 HD3 LYS 24 3HD LYS 24 -15.678 -16.250 -29.220 198 HE2 LYS 24 2HE LYS 24 -14.128 -16.785 -30.826 199 HE3 LYS 24 3HE LYS 24 -13.073 -17.617 -29.684 200 HZ1 LYS 24 1HZ LYS 24 -14.113 -19.194 -31.154 201 HZ2 LYS 24 2HZ LYS 24 -15.655 -18.630 -30.746 202 HZ3 LYS 24 3HZ LYS 24 -14.709 -19.420 -29.587 203 H LYS 25 H LYS 25 -14.292 -11.474 -28.518 204 HA LYS 25 HA LYS 25 -12.411 -10.690 -30.513 205 HB2 LYS 25 2HB LYS 25 -14.841 -9.386 -29.310 206 HB3 LYS 25 3HB LYS 25 -13.827 -8.537 -30.470 207 HG2 LYS 25 2HG LYS 25 -14.366 -10.006 -32.198 208 HG3 LYS 25 3HG LYS 25 -14.967 -11.238 -31.086 209 HD2 LYS 25 2HD LYS 25 -16.945 -10.373 -31.869 210 HD3 LYS 25 3HD LYS 25 -16.691 -9.362 -30.444 211 HE2 LYS 25 2HE LYS 25 -15.796 -7.588 -31.800 212 HE3 LYS 25 3HE LYS 25 -15.842 -8.608 -33.237 213 HZ1 LYS 25 1HZ LYS 25 -17.751 -7.403 -33.485 214 HZ2 LYS 25 2HZ LYS 25 -18.049 -7.289 -31.824 215 HZ3 LYS 25 3HZ LYS 25 -18.362 -8.737 -32.642 216 H ALA 26 H ALA 26 -13.261 -9.404 -27.309 217 HA ALA 26 HA ALA 26 -11.423 -7.275 -27.313 218 HB1 ALA 26 1HB ALA 26 -13.346 -7.515 -25.754 219 HB2 ALA 26 2HB ALA 26 -12.441 -8.766 -24.900 220 HB3 ALA 26 3HB ALA 26 -11.824 -7.115 -24.955 221 H TYR 27 H TYR 27 -11.080 -10.669 -26.561 222 HA TYR 27 HA TYR 27 -8.560 -10.444 -25.242 223 HB2 TYR 27 2HB TYR 27 -9.890 -12.381 -24.785 224 HB3 TYR 27 3HB TYR 27 -10.007 -12.781 -26.495 225 HD1 TYR 27 HD1 TYR 27 -7.120 -11.950 -24.266 226 HD2 TYR 27 HD2 TYR 27 -8.906 -14.764 -26.912 227 HE1 TYR 27 HE1 TYR 27 -5.140 -13.395 -24.057 228 HE2 TYR 27 HE2 TYR 27 -6.932 -16.217 -26.708 229 HH TYR 27 HH TYR 27 -4.952 -16.510 -25.757 230 H TYR 28 H TYR 28 -9.592 -10.933 -28.560 231 HA TYR 28 HA TYR 28 -6.984 -11.570 -29.553 232 HB2 TYR 28 2HB TYR 28 -8.942 -12.353 -30.749 233 HB3 TYR 28 3HB TYR 28 -9.510 -10.702 -30.974 234 HD1 TYR 28 HD1 TYR 28 -9.282 -9.922 -33.123 235 HD2 TYR 28 HD2 TYR 28 -6.318 -12.563 -31.592 236 HE1 TYR 28 HE1 TYR 28 -8.072 -9.793 -35.260 237 HE2 TYR 28 HE2 TYR 28 -5.099 -12.440 -33.725 238 HH TYR 28 HH TYR 28 -6.310 -11.533 -36.486 239 H GLN 29 H GLN 29 -9.036 -8.669 -29.630 240 HA GLN 29 HA GLN 29 -7.289 -7.023 -31.064 241 HB2 GLN 29 2HB GLN 29 -8.633 -5.205 -30.376 242 HB3 GLN 29 3HB GLN 29 -9.722 -6.583 -30.473 243 HG2 GLN 29 2HG GLN 29 -9.635 -6.857 -28.068 244 HG3 GLN 29 3HG GLN 29 -8.478 -5.532 -27.941 245 HE21 GLN 29 1HE2 GLN 29 -11.669 -6.183 -29.355 246 HE22 GLN 29 2HE2 GLN 29 -12.378 -4.683 -28.872 247 H LEU 30 H LEU 30 -7.422 -7.841 -27.657 248 HA LEU 30 HA LEU 30 -5.558 -5.853 -26.811 249 HB2 LEU 30 2HB LEU 30 -7.125 -7.952 -25.615 250 HB3 LEU 30 3HB LEU 30 -5.479 -7.972 -24.985 251 HG LEU 30 HG LEU 30 -5.694 -5.724 -24.180 252 HD11 LEU 30 1HD1 LEU 30 -6.934 -4.361 -25.450 253 HD12 LEU 30 2HD1 LEU 30 -8.280 -4.916 -24.456 254 HD13 LEU 30 3HD1 LEU 30 -7.970 -5.670 -26.020 255 HD21 LEU 30 1HD2 LEU 30 -7.613 -5.992 -22.612 256 HD22 LEU 30 2HD2 LEU 30 -6.532 -7.384 -22.675 257 HD23 LEU 30 3HD2 LEU 30 -8.084 -7.434 -23.512 258 H ALA 31 H ALA 31 -5.321 -9.276 -27.667 259 HA ALA 31 HA ALA 31 -2.661 -9.717 -26.956 260 HB1 ALA 31 1HB ALA 31 -2.938 -11.322 -29.123 261 HB2 ALA 31 2HB ALA 31 -3.539 -11.709 -27.510 262 HB3 ALA 31 3HB ALA 31 -4.626 -11.013 -28.712 263 H LYS 32 H LYS 32 -4.048 -8.357 -29.904 264 HA LYS 32 HA LYS 32 -1.698 -8.289 -31.442 265 HB2 LYS 32 2HB LYS 32 -4.204 -6.613 -31.495 266 HB3 LYS 32 3HB LYS 32 -2.900 -6.392 -32.655 267 HG2 LYS 32 2HG LYS 32 -3.379 -8.303 -33.769 268 HG3 LYS 32 3HG LYS 32 -3.933 -9.142 -32.318 269 HD2 LYS 32 2HD LYS 32 -5.780 -8.735 -33.865 270 HD3 LYS 32 3HD LYS 32 -6.006 -7.847 -32.356 271 HE2 LYS 32 2HE LYS 32 -5.596 -5.805 -33.343 272 HE3 LYS 32 3HE LYS 32 -4.645 -6.508 -34.649 273 HZ1 LYS 32 1HZ LYS 32 -7.116 -7.579 -35.006 274 HZ2 LYS 32 2HZ LYS 32 -6.476 -6.271 -35.867 275 HZ3 LYS 32 3HZ LYS 32 -7.461 -5.996 -34.519 276 H LYS 33 H LYS 33 -2.742 -6.373 -28.782 277 HA LYS 33 HA LYS 33 -1.066 -4.107 -29.355 278 HB2 LYS 33 2HB LYS 33 -2.255 -4.813 -26.677 279 HB3 LYS 33 3HB LYS 33 -1.810 -3.221 -27.280 280 HG2 LYS 33 2HG LYS 33 -3.612 -3.655 -29.078 281 HG3 LYS 33 3HG LYS 33 -4.182 -4.904 -27.969 282 HD2 LYS 33 2HD LYS 33 -5.408 -3.180 -27.153 283 HD3 LYS 33 3HD LYS 33 -3.928 -2.876 -26.240 284 HE2 LYS 33 2HE LYS 33 -3.319 -1.484 -28.410 285 HE3 LYS 33 3HE LYS 33 -5.074 -1.412 -28.561 286 HZ1 LYS 33 1HZ LYS 33 -4.407 0.472 -27.330 287 HZ2 LYS 33 2HZ LYS 33 -3.412 -0.437 -26.309 288 HZ3 LYS 33 3HZ LYS 33 -5.094 -0.594 -26.210 289 H TYR 34 H TYR 34 -0.846 -7.029 -27.414 290 HA TYR 34 HA TYR 34 1.850 -6.240 -26.548 291 HB2 TYR 34 2HB TYR 34 0.061 -8.445 -25.503 292 HB3 TYR 34 3HB TYR 34 1.644 -8.019 -24.863 293 HD1 TYR 34 HD1 TYR 34 1.947 -6.037 -23.505 294 HD2 TYR 34 HD2 TYR 34 -1.871 -7.007 -25.114 295 HE1 TYR 34 HE1 TYR 34 0.900 -4.409 -21.987 296 HE2 TYR 34 HE2 TYR 34 -2.928 -5.381 -23.601 297 HH TYR 34 HH TYR 34 -1.243 -3.932 -20.994 298 H HIS 35 H HIS 35 0.967 -7.358 -29.211 299 HA HIS 35 HA HIS 35 1.832 -10.014 -29.483 300 HB2 HIS 35 2HB HIS 35 1.124 -7.810 -31.249 301 HB3 HIS 35 3HB HIS 35 2.424 -8.796 -31.911 302 HD1 HIS 35 HD1 HIS 35 0.722 -9.585 -33.756 303 HD2 HIS 35 HD2 HIS 35 -0.233 -10.723 -29.876 304 HE1 HIS 35 HE1 HIS 35 -1.023 -11.379 -33.992 305 HA PRO 36 HA PRO 36 6.215 -9.891 -29.386 306 HB2 PRO 36 2HB PRO 36 6.899 -11.587 -31.393 307 HB3 PRO 36 3HB PRO 36 6.197 -12.138 -29.867 308 HG2 PRO 36 2HG PRO 36 4.867 -11.695 -32.512 309 HG3 PRO 36 3HG PRO 36 4.660 -13.031 -31.365 310 HD2 PRO 36 2HD PRO 36 2.904 -10.978 -31.543 311 HD3 PRO 36 3HD PRO 36 3.239 -11.819 -30.015 312 H ASP 37 H ASP 37 4.550 -8.880 -32.213 313 HA ASP 37 HA ASP 37 6.807 -8.116 -33.775 314 HB2 ASP 37 2HB ASP 37 4.350 -8.493 -34.520 315 HB3 ASP 37 3HB ASP 37 4.101 -6.827 -34.006 316 H THR 38 H THR 38 5.167 -6.723 -31.097 317 HA THR 38 HA THR 38 6.524 -4.148 -31.544 318 HB THR 38 HB THR 38 4.916 -3.082 -30.166 319 HG1 THR 38 HG1 THR 38 4.512 -5.655 -29.219 320 HG21 THR 38 1HG2 THR 38 4.207 -4.245 -32.505 321 HG22 THR 38 2HG2 THR 38 3.153 -3.178 -31.578 322 HG23 THR 38 3HG2 THR 38 2.992 -4.927 -31.425 323 H ASN 39 H ASN 39 7.244 -6.894 -30.149 324 HA ASN 39 HA ASN 39 7.983 -5.904 -27.512 325 HB2 ASN 39 2HB ASN 39 7.880 -8.575 -28.830 326 HB3 ASN 39 3HB ASN 39 9.032 -8.357 -27.516 327 HD21 ASN 39 1HD2 ASN 39 5.802 -6.998 -27.982 328 HD22 ASN 39 2HD2 ASN 39 5.122 -7.669 -26.542 329 H LYS 40 H LYS 40 9.215 -5.252 -30.320 330 HA LYS 40 HA LYS 40 11.900 -6.121 -30.247 331 HB2 LYS 40 2HB LYS 40 10.388 -3.995 -31.689 332 HB3 LYS 40 3HB LYS 40 12.143 -3.885 -31.670 333 HG2 LYS 40 2HG LYS 40 11.766 -5.065 -33.602 334 HG3 LYS 40 3HG LYS 40 12.040 -6.366 -32.441 335 HD2 LYS 40 2HD LYS 40 9.284 -5.731 -32.363 336 HD3 LYS 40 3HD LYS 40 9.745 -5.861 -34.062 337 HE2 LYS 40 2HE LYS 40 10.291 -7.925 -31.930 338 HE3 LYS 40 3HE LYS 40 9.003 -8.012 -33.131 339 HZ1 LYS 40 1HZ LYS 40 10.468 -9.062 -34.405 340 HZ2 LYS 40 2HZ LYS 40 11.766 -8.677 -33.391 341 HZ3 LYS 40 3HZ LYS 40 11.276 -7.587 -34.589 342 H ASP 41 H ASP 41 10.285 -3.246 -28.980 343 HA ASP 41 HA ASP 41 12.773 -2.573 -27.549 344 HB2 ASP 41 2HB ASP 41 12.181 -0.250 -27.646 345 HB3 ASP 41 3HB ASP 41 12.048 -0.900 -29.278 346 H ASP 42 H ASP 42 10.157 -4.177 -26.975 347 HA ASP 42 HA ASP 42 9.852 -3.113 -24.260 348 HB2 ASP 42 2HB ASP 42 7.930 -2.558 -26.023 349 HB3 ASP 42 3HB ASP 42 7.408 -4.182 -25.585 350 HA PRO 43 HA PRO 43 10.713 -7.641 -24.222 351 HB2 PRO 43 2HB PRO 43 12.355 -7.526 -22.062 352 HB3 PRO 43 3HB PRO 43 12.917 -7.237 -23.713 353 HG2 PRO 43 2HG PRO 43 12.199 -5.260 -21.582 354 HG3 PRO 43 3HG PRO 43 13.570 -5.245 -22.707 355 HD2 PRO 43 2HD PRO 43 11.347 -3.750 -23.100 356 HD3 PRO 43 3HD PRO 43 12.300 -4.415 -24.442 357 H LYS 44 H LYS 44 9.201 -5.395 -22.198 358 HA LYS 44 HA LYS 44 8.503 -7.362 -20.155 359 HB2 LYS 44 2HB LYS 44 8.205 -4.392 -20.410 360 HB3 LYS 44 3HB LYS 44 7.178 -5.272 -19.285 361 HG2 LYS 44 2HG LYS 44 9.047 -6.026 -18.034 362 HG3 LYS 44 3HG LYS 44 10.179 -5.459 -19.265 363 HD2 LYS 44 2HD LYS 44 9.426 -3.138 -18.816 364 HD3 LYS 44 3HD LYS 44 8.412 -3.754 -17.509 365 HE2 LYS 44 2HE LYS 44 10.404 -2.980 -16.495 366 HE3 LYS 44 3HE LYS 44 10.510 -4.740 -16.511 367 HZ1 LYS 44 1HZ LYS 44 12.049 -2.770 -18.031 368 HZ2 LYS 44 2HZ LYS 44 11.725 -4.255 -18.773 369 HZ3 LYS 44 3HZ LYS 44 12.558 -4.210 -17.302 370 H ALA 45 H ALA 45 7.237 -5.931 -23.009 371 HA ALA 45 HA ALA 45 4.492 -6.061 -22.585 372 HB1 ALA 45 1HB ALA 45 4.435 -6.498 -25.126 373 HB2 ALA 45 2HB ALA 45 5.138 -4.989 -24.542 374 HB3 ALA 45 3HB ALA 45 6.187 -6.316 -25.041 375 H LYS 46 H LYS 46 6.771 -8.590 -23.501 376 HA LYS 46 HA LYS 46 4.960 -10.598 -24.189 377 HB2 LYS 46 2HB LYS 46 6.762 -12.165 -23.768 378 HB3 LYS 46 3HB LYS 46 7.402 -10.730 -24.557 379 HG2 LYS 46 2HG LYS 46 8.096 -9.900 -22.306 380 HG3 LYS 46 3HG LYS 46 7.623 -11.469 -21.650 381 HD2 LYS 46 2HD LYS 46 9.951 -11.600 -22.034 382 HD3 LYS 46 3HD LYS 46 9.193 -12.501 -23.349 383 HE2 LYS 46 2HE LYS 46 9.300 -10.084 -24.490 384 HE3 LYS 46 3HE LYS 46 10.678 -9.938 -23.399 385 HZ1 LYS 46 1HZ LYS 46 11.524 -10.797 -25.393 386 HZ2 LYS 46 2HZ LYS 46 10.268 -11.916 -25.562 387 HZ3 LYS 46 3HZ LYS 46 11.434 -12.131 -24.356 388 H GLU 47 H GLU 47 6.121 -9.533 -21.044 389 HA GLU 47 HA GLU 47 5.027 -11.687 -19.555 390 HB2 GLU 47 2HB GLU 47 6.822 -10.221 -18.701 391 HB3 GLU 47 3HB GLU 47 5.686 -8.881 -18.644 392 HG2 GLU 47 2HG GLU 47 4.482 -9.817 -16.880 393 HG3 GLU 47 3HG GLU 47 5.173 -11.418 -17.140 394 H LYS 48 H LYS 48 3.819 -8.515 -20.503 395 HA LYS 48 HA LYS 48 1.435 -8.644 -18.949 396 HB2 LYS 48 2HB LYS 48 1.959 -6.994 -21.426 397 HB3 LYS 48 3HB LYS 48 0.723 -6.699 -20.210 398 HG2 LYS 48 2HG LYS 48 3.694 -6.584 -19.731 399 HG3 LYS 48 3HG LYS 48 2.640 -5.191 -19.985 400 HD2 LYS 48 2HD LYS 48 1.375 -5.769 -17.982 401 HD3 LYS 48 3HD LYS 48 2.391 -7.193 -17.739 402 HE2 LYS 48 2HE LYS 48 4.331 -5.429 -17.796 403 HE3 LYS 48 3HE LYS 48 3.042 -4.303 -17.375 404 HZ1 LYS 48 1HZ LYS 48 2.517 -6.057 -15.567 405 HZ2 LYS 48 2HZ LYS 48 3.792 -4.972 -15.326 406 HZ3 LYS 48 3HZ LYS 48 4.113 -6.558 -15.821 407 H PHE 49 H PHE 49 2.312 -9.618 -22.202 408 HA PHE 49 HA PHE 49 -0.263 -10.027 -23.236 409 HB2 PHE 49 2HB PHE 49 1.608 -10.014 -24.734 410 HB3 PHE 49 3HB PHE 49 2.376 -11.348 -23.879 411 HD1 PHE 49 HD1 PHE 49 -0.176 -10.393 -26.295 412 HD2 PHE 49 HD2 PHE 49 1.572 -13.628 -24.150 413 HE1 PHE 49 HE1 PHE 49 -1.258 -11.988 -27.825 414 HE2 PHE 49 HE2 PHE 49 0.494 -15.228 -25.676 415 HZ PHE 49 HZ PHE 49 -0.923 -14.409 -27.517 416 H SER 50 H SER 50 1.770 -12.004 -21.185 417 HA SER 50 HA SER 50 0.374 -14.437 -21.457 418 HB2 SER 50 2HB SER 50 2.672 -14.035 -20.392 419 HB3 SER 50 3HB SER 50 1.789 -13.565 -18.940 420 HG SER 50 HG SER 50 2.436 -15.983 -19.650 421 H GLN 51 H GLN 51 -0.154 -11.610 -19.461 422 HA GLN 51 HA GLN 51 -2.004 -12.740 -17.657 423 HB2 GLN 51 2HB GLN 51 -1.725 -9.882 -18.603 424 HB3 GLN 51 3HB GLN 51 -2.688 -10.397 -17.225 425 HG2 GLN 51 2HG GLN 51 0.298 -10.524 -17.527 426 HG3 GLN 51 3HG GLN 51 -0.636 -9.543 -16.399 427 HE21 GLN 51 1HE2 GLN 51 -1.899 -10.709 -14.778 428 HE22 GLN 51 2HE2 GLN 51 -1.278 -12.193 -14.150 429 H LEU 52 H LEU 52 -2.320 -11.473 -20.895 430 HA LEU 52 HA LEU 52 -5.102 -11.104 -20.962 431 HB2 LEU 52 2HB LEU 52 -3.317 -11.956 -23.235 432 HB3 LEU 52 3HB LEU 52 -4.899 -11.191 -23.369 433 HG LEU 52 HG LEU 52 -2.556 -9.818 -22.076 434 HD11 LEU 52 1HD1 LEU 52 -2.272 -10.595 -24.556 435 HD12 LEU 52 2HD1 LEU 52 -1.834 -8.955 -24.076 436 HD13 LEU 52 3HD1 LEU 52 -3.371 -9.256 -24.888 437 HD21 LEU 52 1HD2 LEU 52 -4.287 -8.030 -23.350 438 HD22 LEU 52 2HD2 LEU 52 -4.113 -8.302 -21.616 439 HD23 LEU 52 3HD2 LEU 52 -5.328 -9.195 -22.532 440 H ALA 53 H ALA 53 -3.140 -13.901 -21.972 441 HA ALA 53 HA ALA 53 -5.346 -15.549 -22.619 442 HB1 ALA 53 1HB ALA 53 -2.493 -15.759 -22.625 443 HB2 ALA 53 2HB ALA 53 -3.190 -17.204 -21.890 444 HB3 ALA 53 3HB ALA 53 -3.682 -16.714 -23.512 445 H GLU 54 H GLU 54 -3.524 -15.019 -19.659 446 HA GLU 54 HA GLU 54 -4.493 -17.202 -18.183 447 HB2 GLU 54 2HB GLU 54 -3.346 -14.533 -17.450 448 HB3 GLU 54 3HB GLU 54 -4.018 -15.568 -16.198 449 HG2 GLU 54 2HG GLU 54 -1.763 -16.247 -18.070 450 HG3 GLU 54 3HG GLU 54 -1.638 -15.891 -16.348 451 H ALA 55 H ALA 55 -5.643 -13.837 -18.334 452 HA ALA 55 HA ALA 55 -7.889 -14.307 -16.643 453 HB1 ALA 55 1HB ALA 55 -7.548 -12.095 -16.563 454 HB2 ALA 55 2HB ALA 55 -6.779 -12.057 -18.150 455 HB3 ALA 55 3HB ALA 55 -8.538 -12.047 -18.022 456 H TYR 56 H TYR 56 -7.458 -14.056 -20.154 457 HA TYR 56 HA TYR 56 -10.135 -14.216 -20.911 458 HB2 TYR 56 2HB TYR 56 -8.586 -13.636 -22.593 459 HB3 TYR 56 3HB TYR 56 -7.586 -15.050 -22.280 460 HD1 TYR 56 HD1 TYR 56 -10.778 -13.909 -23.751 461 HD2 TYR 56 HD2 TYR 56 -8.018 -17.123 -23.360 462 HE1 TYR 56 HE1 TYR 56 -11.948 -15.123 -25.542 463 HE2 TYR 56 HE2 TYR 56 -9.179 -18.346 -25.151 464 HH TYR 56 HH TYR 56 -11.969 -18.044 -26.075 465 H GLU 57 H GLU 57 -7.934 -16.679 -19.819 466 HA GLU 57 HA GLU 57 -9.259 -18.956 -20.786 467 HB2 GLU 57 2HB GLU 57 -7.312 -18.394 -18.613 468 HB3 GLU 57 3HB GLU 57 -8.189 -19.915 -18.527 469 HG2 GLU 57 2HG GLU 57 -6.825 -19.112 -21.058 470 HG3 GLU 57 3HG GLU 57 -5.902 -19.816 -19.731 471 H VAL 58 H VAL 58 -9.651 -17.128 -17.778 472 HA VAL 58 HA VAL 58 -11.663 -18.868 -16.723 473 HB VAL 58 HB VAL 58 -11.020 -16.026 -15.923 474 HG11 VAL 58 1HG1 VAL 58 -13.137 -17.683 -15.162 475 HG12 VAL 58 2HG1 VAL 58 -11.984 -17.750 -13.828 476 HG13 VAL 58 3HG1 VAL 58 -12.609 -16.194 -14.378 477 HG21 VAL 58 1HG2 VAL 58 -9.038 -17.375 -15.732 478 HG22 VAL 58 2HG2 VAL 58 -9.691 -17.098 -14.117 479 HG23 VAL 58 3HG2 VAL 58 -9.935 -18.653 -14.913 480 H LEU 59 H LEU 59 -11.693 -15.711 -18.339 481 HA LEU 59 HA LEU 59 -14.530 -15.423 -18.212 482 HB2 LEU 59 2HB LEU 59 -12.261 -13.958 -19.370 483 HB3 LEU 59 3HB LEU 59 -13.782 -13.786 -20.244 484 HG LEU 59 HG LEU 59 -14.858 -12.864 -18.301 485 HD11 LEU 59 1HD1 LEU 59 -12.292 -13.570 -16.905 486 HD12 LEU 59 2HD1 LEU 59 -13.933 -14.078 -16.507 487 HD13 LEU 59 3HD1 LEU 59 -13.443 -12.403 -16.253 488 HD21 LEU 59 1HD2 LEU 59 -12.151 -11.589 -18.686 489 HD22 LEU 59 2HD2 LEU 59 -13.596 -10.807 -18.044 490 HD23 LEU 59 3HD2 LEU 59 -13.555 -11.342 -19.725 491 H SER 60 H SER 60 -12.564 -17.407 -20.028 492 HA SER 60 HA SER 60 -13.956 -17.335 -22.522 493 HB2 SER 60 2HB SER 60 -11.737 -18.154 -22.621 494 HB3 SER 60 3HB SER 60 -12.005 -19.275 -21.286 495 HG SER 60 HG SER 60 -12.616 -20.689 -22.699 496 H ASP 61 H ASP 61 -14.692 -18.610 -19.484 497 HA ASP 61 HA ASP 61 -16.911 -20.138 -20.640 498 HB2 ASP 61 2HB ASP 61 -14.774 -21.477 -19.698 499 HB3 ASP 61 3HB ASP 61 -15.676 -21.281 -18.197 500 H GLU 62 H GLU 62 -18.814 -19.739 -19.689 501 HA GLU 62 HA GLU 62 -19.185 -17.659 -17.898 502 HB2 GLU 62 2HB GLU 62 -21.475 -18.636 -17.550 503 HB3 GLU 62 3HB GLU 62 -21.024 -18.385 -19.230 504 HG2 GLU 62 2HG GLU 62 -20.439 -20.776 -19.395 505 HG3 GLU 62 3HG GLU 62 -21.001 -20.999 -17.739 506 H VAL 63 H VAL 63 -18.969 -21.135 -17.263 507 HA VAL 63 HA VAL 63 -19.577 -21.094 -14.537 508 HB VAL 63 HB VAL 63 -17.614 -22.964 -15.865 509 HG11 VAL 63 1HG1 VAL 63 -18.045 -24.463 -14.119 510 HG12 VAL 63 2HG1 VAL 63 -17.875 -22.899 -13.320 511 HG13 VAL 63 3HG1 VAL 63 -19.479 -23.580 -13.595 512 HG21 VAL 63 1HG2 VAL 63 -20.154 -24.160 -15.663 513 HG22 VAL 63 2HG2 VAL 63 -20.401 -22.574 -16.393 514 HG23 VAL 63 3HG2 VAL 63 -19.279 -23.718 -17.129 515 H LYS 64 H LYS 64 -16.384 -21.015 -16.118 516 HA LYS 64 HA LYS 64 -14.877 -20.737 -13.765 517 HB2 LYS 64 2HB LYS 64 -14.315 -19.982 -16.629 518 HB3 LYS 64 3HB LYS 64 -13.130 -19.762 -15.349 519 HG2 LYS 64 2HG LYS 64 -13.676 -22.310 -14.902 520 HG3 LYS 64 3HG LYS 64 -14.130 -22.254 -16.606 521 HD2 LYS 64 2HD LYS 64 -11.834 -22.896 -16.491 522 HD3 LYS 64 3HD LYS 64 -11.892 -21.233 -17.079 523 HE2 LYS 64 2HE LYS 64 -11.249 -20.375 -14.957 524 HE3 LYS 64 3HE LYS 64 -11.474 -21.943 -14.183 525 HZ1 LYS 64 1HZ LYS 64 -9.485 -22.677 -14.892 526 HZ2 LYS 64 2HZ LYS 64 -9.113 -21.030 -14.986 527 HZ3 LYS 64 3HZ LYS 64 -9.574 -21.874 -16.378 528 H ARG 65 H ARG 65 -16.130 -18.296 -16.022 529 HA ARG 65 HA ARG 65 -15.035 -16.044 -14.777 530 HB2 ARG 65 2HB ARG 65 -16.039 -15.992 -17.017 531 HB3 ARG 65 3HB ARG 65 -17.627 -16.275 -16.317 532 HG2 ARG 65 2HG ARG 65 -16.919 -14.085 -14.943 533 HG3 ARG 65 3HG ARG 65 -16.017 -13.810 -16.435 534 HD2 ARG 65 2HD ARG 65 -17.900 -13.562 -17.689 535 HD3 ARG 65 3HD ARG 65 -18.839 -14.675 -16.695 536 HE ARG 65 HE ARG 65 -18.737 -11.856 -16.440 537 HH11 ARG 65 1HH1 ARG 65 -18.920 -14.782 -14.563 538 HH12 ARG 65 2HH1 ARG 65 -19.740 -14.032 -13.233 539 HH21 ARG 65 1HH2 ARG 65 -19.815 -10.857 -14.695 540 HH22 ARG 65 2HH2 ARG 65 -20.249 -11.800 -13.310 541 H LYS 66 H LYS 66 -18.186 -17.614 -14.311 542 HA LYS 66 HA LYS 66 -19.167 -15.811 -12.385 543 HB2 LYS 66 2HB LYS 66 -19.821 -18.697 -12.968 544 HB3 LYS 66 3HB LYS 66 -20.675 -17.758 -11.751 545 HG2 LYS 66 2HG LYS 66 -20.476 -16.921 -14.631 546 HG3 LYS 66 3HG LYS 66 -21.790 -17.913 -13.995 547 HD2 LYS 66 2HD LYS 66 -22.634 -16.190 -12.697 548 HD3 LYS 66 3HD LYS 66 -21.099 -15.320 -12.673 549 HE2 LYS 66 2HE LYS 66 -22.279 -14.024 -14.145 550 HE3 LYS 66 3HE LYS 66 -21.527 -15.161 -15.263 551 HZ1 LYS 66 1HZ LYS 66 -24.081 -16.006 -14.200 552 HZ2 LYS 66 2HZ LYS 66 -23.492 -16.071 -15.784 553 HZ3 LYS 66 3HZ LYS 66 -24.150 -14.632 -15.185 554 H GLN 67 H GLN 67 -17.341 -18.827 -12.081 555 HA GLN 67 HA GLN 67 -17.436 -19.079 -9.300 556 HB2 GLN 67 2HB GLN 67 -15.494 -20.001 -11.393 557 HB3 GLN 67 3HB GLN 67 -15.150 -20.265 -9.689 558 HG2 GLN 67 2HG GLN 67 -17.531 -21.277 -11.224 559 HG3 GLN 67 3HG GLN 67 -16.171 -22.226 -10.627 560 HE21 GLN 67 1HE2 GLN 67 -19.145 -20.676 -9.841 561 HE22 GLN 67 2HE2 GLN 67 -19.271 -21.259 -8.220 562 H TYR 68 H TYR 68 -15.274 -17.225 -11.376 563 HA TYR 68 HA TYR 68 -13.508 -16.433 -9.282 564 HB2 TYR 68 2HB TYR 68 -12.722 -16.427 -11.568 565 HB3 TYR 68 3HB TYR 68 -13.981 -15.292 -12.042 566 HD1 TYR 68 HD1 TYR 68 -11.076 -15.585 -9.716 567 HD2 TYR 68 HD2 TYR 68 -13.489 -13.027 -12.110 568 HE1 TYR 68 HE1 TYR 68 -9.556 -13.711 -9.236 569 HE2 TYR 68 HE2 TYR 68 -11.976 -11.147 -11.638 570 HH TYR 68 HH TYR 68 -9.071 -11.306 -10.733 571 H ASP 69 H ASP 69 -16.362 -15.022 -10.787 572 HA ASP 69 HA ASP 69 -16.192 -12.488 -9.545 573 HB2 ASP 69 2HB ASP 69 -17.632 -13.164 -11.547 574 HB3 ASP 69 3HB ASP 69 -18.760 -13.835 -10.373 575 H ALA 70 H ALA 70 -17.392 -15.579 -8.491 576 HA ALA 70 HA ALA 70 -19.058 -14.779 -6.392 577 HB1 ALA 70 1HB ALA 70 -17.640 -17.167 -5.686 578 HB2 ALA 70 2HB ALA 70 -19.320 -16.973 -6.187 579 HB3 ALA 70 3HB ALA 70 -18.059 -17.203 -7.399 580 H TYR 71 H TYR 71 -15.562 -15.252 -6.520 581 HA TYR 71 HA TYR 71 -15.331 -14.465 -3.710 582 HB2 TYR 71 2HB TYR 71 -13.517 -15.824 -5.662 583 HB3 TYR 71 3HB TYR 71 -12.810 -14.964 -4.299 584 HD1 TYR 71 HD1 TYR 71 -13.584 -15.618 -1.952 585 HD2 TYR 71 HD2 TYR 71 -14.354 -17.995 -5.396 586 HE1 TYR 71 HE1 TYR 71 -13.983 -17.570 -0.509 587 HE2 TYR 71 HE2 TYR 71 -14.756 -19.952 -3.963 588 HH TYR 71 HH TYR 71 -15.545 -20.007 -1.102 589 H GLY 72 H GLY 72 -16.053 -12.611 -5.920 590 HA2 GLY 72 2HA GLY 72 -13.905 -10.961 -6.638 591 HA3 GLY 72 3HA GLY 72 -15.586 -10.455 -6.550 592 H SER 73 H SER 73 -14.371 -8.426 -5.904 593 HA SER 73 HA SER 73 -13.233 -8.338 -3.276 594 HB2 SER 73 2HB SER 73 -14.178 -6.012 -4.963 595 HB3 SER 73 3HB SER 73 -13.018 -5.963 -3.635 596 HG SER 73 HG SER 73 -12.368 -6.157 -6.069 Start of MODEL 4 1 H1 HIS 1 H HIS 1 -0.657 2.379 2.903 2 HA HIS 1 HA HIS 1 -3.264 3.009 1.835 3 HB2 HIS 1 2HB HIS 1 -0.753 3.430 0.214 4 HB3 HIS 1 3HB HIS 1 -2.330 3.178 -0.529 5 HD1 HIS 1 HD1 HIS 1 -3.919 4.957 1.561 6 HD2 HIS 1 HD2 HIS 1 -0.502 6.079 -0.519 7 HE1 HIS 1 HE1 HIS 1 -3.961 7.471 1.506 8 H MET 2 H MET 2 -3.637 1.524 -0.195 9 HA MET 2 HA MET 2 -2.187 -0.987 -0.039 10 HB2 MET 2 2HB MET 2 -4.249 -2.309 0.316 11 HB3 MET 2 3HB MET 2 -3.845 -1.299 1.698 12 HG2 MET 2 2HG MET 2 -5.497 0.372 0.862 13 HG3 MET 2 3HG MET 2 -5.976 -0.800 -0.363 14 HE1 MET 2 1HE MET 2 -6.996 0.654 2.890 15 HE2 MET 2 2HE MET 2 -7.147 -0.690 4.022 16 HE3 MET 2 3HE MET 2 -5.552 -0.180 3.465 17 H LEU 3 H LEU 3 -2.163 -2.057 -1.946 18 HA LEU 3 HA LEU 3 -3.233 -0.730 -4.248 19 HB2 LEU 3 2HB LEU 3 -1.646 -3.235 -3.811 20 HB3 LEU 3 3HB LEU 3 -2.307 -2.845 -5.398 21 HG LEU 3 HG LEU 3 -1.035 -0.644 -5.207 22 HD11 LEU 3 1HD1 LEU 3 -0.578 -0.654 -2.845 23 HD12 LEU 3 2HD1 LEU 3 0.946 -0.730 -3.728 24 HD13 LEU 3 3HD1 LEU 3 0.288 -2.185 -2.980 25 HD21 LEU 3 1HD2 LEU 3 1.126 -1.759 -5.835 26 HD22 LEU 3 2HD2 LEU 3 -0.290 -2.304 -6.734 27 HD23 LEU 3 3HD2 LEU 3 0.367 -3.299 -5.433 28 H ALA 4 H ALA 4 -5.019 -1.183 -5.395 29 HA ALA 4 HA ALA 4 -6.955 -2.991 -4.287 30 HB1 ALA 4 1HB ALA 4 -8.264 -2.238 -6.379 31 HB2 ALA 4 2HB ALA 4 -7.914 -1.048 -5.124 32 HB3 ALA 4 3HB ALA 4 -6.945 -1.086 -6.598 33 H LYS 5 H LYS 5 -7.754 -4.875 -5.166 34 HA LYS 5 HA LYS 5 -5.935 -6.362 -6.818 35 HB2 LYS 5 2HB LYS 5 -8.492 -6.961 -5.385 36 HB3 LYS 5 3HB LYS 5 -7.932 -8.069 -6.631 37 HG2 LYS 5 2HG LYS 5 -6.153 -7.212 -4.375 38 HG3 LYS 5 3HG LYS 5 -7.281 -8.560 -4.215 39 HD2 LYS 5 2HD LYS 5 -5.480 -8.511 -6.581 40 HD3 LYS 5 3HD LYS 5 -4.781 -8.919 -5.012 41 HE2 LYS 5 2HE LYS 5 -5.400 -11.000 -5.728 42 HE3 LYS 5 3HE LYS 5 -6.868 -10.519 -4.879 43 HZ1 LYS 5 1HZ LYS 5 -7.011 -11.494 -7.260 44 HZ2 LYS 5 2HZ LYS 5 -6.598 -9.928 -7.746 45 HZ3 LYS 5 3HZ LYS 5 -7.998 -10.188 -6.832 46 H GLU 6 H GLU 6 -6.271 -7.151 -8.886 47 HA GLU 6 HA GLU 6 -8.273 -5.680 -10.443 48 HB2 GLU 6 2HB GLU 6 -5.721 -7.088 -11.213 49 HB3 GLU 6 3HB GLU 6 -6.885 -6.528 -12.406 50 HG2 GLU 6 2HG GLU 6 -5.786 -4.650 -10.357 51 HG3 GLU 6 3HG GLU 6 -4.870 -5.036 -11.813 52 H ASP 7 H ASP 7 -9.543 -6.753 -12.031 53 HA ASP 7 HA ASP 7 -9.928 -9.625 -11.488 54 HB2 ASP 7 2HB ASP 7 -11.753 -7.654 -11.003 55 HB3 ASP 7 3HB ASP 7 -12.207 -8.149 -12.631 56 H TYR 8 H TYR 8 -10.717 -10.913 -13.277 57 HA TYR 8 HA TYR 8 -9.237 -10.649 -15.598 58 HB2 TYR 8 2HB TYR 8 -11.898 -12.067 -15.412 59 HB3 TYR 8 3HB TYR 8 -10.577 -12.422 -16.519 60 HD1 TYR 8 HD1 TYR 8 -12.131 -14.075 -14.226 61 HD2 TYR 8 HD2 TYR 8 -8.277 -12.314 -14.619 62 HE1 TYR 8 HE1 TYR 8 -11.229 -15.704 -12.619 63 HE2 TYR 8 HE2 TYR 8 -7.365 -13.939 -13.013 64 HH TYR 8 HH TYR 8 -8.383 -16.586 -12.294 65 H TYR 9 H TYR 9 -12.469 -9.473 -14.866 66 HA TYR 9 HA TYR 9 -13.384 -8.795 -17.377 67 HB2 TYR 9 2HB TYR 9 -13.750 -7.163 -14.857 68 HB3 TYR 9 3HB TYR 9 -14.780 -7.124 -16.283 69 HD1 TYR 9 HD1 TYR 9 -14.008 -8.845 -13.194 70 HD2 TYR 9 HD2 TYR 9 -16.189 -9.102 -16.838 71 HE1 TYR 9 HE1 TYR 9 -15.395 -10.634 -12.231 72 HE2 TYR 9 HE2 TYR 9 -17.582 -10.890 -15.885 73 HH TYR 9 HH TYR 9 -18.251 -11.553 -13.358 74 H GLN 10 H GLN 10 -11.358 -6.845 -15.203 75 HA GLN 10 HA GLN 10 -11.098 -4.685 -17.050 76 HB2 GLN 10 2HB GLN 10 -9.701 -5.422 -14.491 77 HB3 GLN 10 3HB GLN 10 -9.171 -4.052 -15.458 78 HG2 GLN 10 2HG GLN 10 -10.577 -2.994 -14.024 79 HG3 GLN 10 3HG GLN 10 -11.714 -3.395 -15.311 80 HE21 GLN 10 1HE2 GLN 10 -13.557 -4.178 -14.617 81 HE22 GLN 10 2HE2 GLN 10 -13.800 -5.113 -13.185 82 H ILE 11 H ILE 11 -9.123 -7.481 -16.196 83 HA ILE 11 HA ILE 11 -6.810 -6.810 -17.619 84 HB ILE 11 HB ILE 11 -7.940 -9.564 -17.106 85 HG12 ILE 11 2HG1 ILE 11 -5.812 -8.101 -15.543 86 HG13 ILE 11 3HG1 ILE 11 -7.516 -8.052 -15.104 87 HG21 ILE 11 1HG2 ILE 11 -5.261 -9.883 -17.161 88 HG22 ILE 11 2HG2 ILE 11 -6.312 -10.138 -18.552 89 HG23 ILE 11 3HG2 ILE 11 -5.457 -8.607 -18.363 90 HD11 ILE 11 1HD1 ILE 11 -6.049 -10.644 -15.415 91 HD12 ILE 11 2HD1 ILE 11 -6.029 -9.731 -13.906 92 HD13 ILE 11 3HD1 ILE 11 -7.557 -10.319 -14.561 93 H LEU 12 H LEU 12 -9.901 -7.883 -18.710 94 HA LEU 12 HA LEU 12 -8.831 -8.363 -21.408 95 HB2 LEU 12 2HB LEU 12 -11.176 -9.400 -19.910 96 HB3 LEU 12 3HB LEU 12 -11.334 -9.211 -21.655 97 HG LEU 12 HG LEU 12 -9.208 -10.865 -20.294 98 HD11 LEU 12 1HD1 LEU 12 -10.831 -12.352 -19.959 99 HD12 LEU 12 2HD1 LEU 12 -10.867 -12.551 -21.711 100 HD13 LEU 12 3HD1 LEU 12 -11.985 -11.434 -20.929 101 HD21 LEU 12 1HD2 LEU 12 -8.840 -11.759 -22.544 102 HD22 LEU 12 2HD2 LEU 12 -8.541 -10.022 -22.478 103 HD23 LEU 12 3HD2 LEU 12 -10.037 -10.634 -23.186 104 H GLY 13 H GLY 13 -10.589 -6.161 -19.511 105 HA2 GLY 13 2HA GLY 13 -11.373 -4.063 -20.097 106 HA3 GLY 13 3HA GLY 13 -10.982 -4.424 -21.772 107 H VAL 14 H VAL 14 -12.978 -6.572 -19.897 108 HA VAL 14 HA VAL 14 -15.299 -5.732 -21.508 109 HB VAL 14 HB VAL 14 -16.149 -8.006 -21.331 110 HG11 VAL 14 1HG1 VAL 14 -13.449 -8.681 -22.214 111 HG12 VAL 14 2HG1 VAL 14 -14.969 -8.673 -23.112 112 HG13 VAL 14 3HG1 VAL 14 -14.061 -7.176 -22.900 113 HG21 VAL 14 1HG2 VAL 14 -15.185 -8.543 -19.133 114 HG22 VAL 14 2HG2 VAL 14 -14.842 -9.793 -20.329 115 HG23 VAL 14 3HG2 VAL 14 -13.586 -8.643 -19.870 116 HA PRO 15 HA PRO 15 -17.536 -4.783 -17.849 117 HB2 PRO 15 2HB PRO 15 -20.064 -5.396 -18.627 118 HB3 PRO 15 3HB PRO 15 -19.192 -3.978 -19.223 119 HG2 PRO 15 2HG PRO 15 -19.589 -6.644 -20.525 120 HG3 PRO 15 3HG PRO 15 -19.693 -5.024 -21.239 121 HD2 PRO 15 2HD PRO 15 -17.511 -6.603 -21.521 122 HD3 PRO 15 3HD PRO 15 -17.405 -4.832 -21.448 123 H ARG 16 H ARG 16 -19.256 -5.735 -16.350 124 HA ARG 16 HA ARG 16 -18.423 -8.392 -15.630 125 HB2 ARG 16 2HB ARG 16 -20.576 -6.674 -14.384 126 HB3 ARG 16 3HB ARG 16 -19.821 -8.092 -13.667 127 HG2 ARG 16 2HG ARG 16 -18.254 -5.645 -14.422 128 HG3 ARG 16 3HG ARG 16 -19.029 -5.834 -12.847 129 HD2 ARG 16 2HD ARG 16 -17.283 -8.025 -13.855 130 HD3 ARG 16 3HD ARG 16 -16.524 -6.556 -13.243 131 HE ARG 16 HE ARG 16 -17.734 -8.610 -11.702 132 HH11 ARG 16 1HH1 ARG 16 -17.256 -5.164 -11.830 133 HH12 ARG 16 2HH1 ARG 16 -17.376 -4.953 -10.115 134 HH21 ARG 16 1HH2 ARG 16 -17.894 -8.345 -9.443 135 HH22 ARG 16 2HH2 ARG 16 -17.739 -6.762 -8.758 136 H ASN 17 H ASN 17 -20.724 -7.185 -17.719 137 HA ASN 17 HA ASN 17 -22.421 -9.574 -17.418 138 HB2 ASN 17 2HB ASN 17 -23.065 -6.838 -18.528 139 HB3 ASN 17 3HB ASN 17 -24.130 -8.229 -18.708 140 HD21 ASN 17 1HD2 ASN 17 -24.780 -5.809 -17.403 141 HD22 ASN 17 2HD2 ASN 17 -25.079 -6.170 -15.740 142 H ALA 18 H ALA 18 -19.895 -8.557 -19.133 143 HA ALA 18 HA ALA 18 -20.506 -8.774 -21.823 144 HB1 ALA 18 1HB ALA 18 -18.284 -8.714 -22.148 145 HB2 ALA 18 2HB ALA 18 -18.219 -8.425 -20.409 146 HB3 ALA 18 3HB ALA 18 -17.982 -10.054 -21.041 147 H SER 19 H SER 19 -20.083 -10.558 -23.320 148 HA SER 19 HA SER 19 -20.978 -13.115 -22.173 149 HB2 SER 19 2HB SER 19 -21.156 -12.227 -25.060 150 HB3 SER 19 3HB SER 19 -21.918 -13.642 -24.334 151 HG SER 19 HG SER 19 -23.509 -12.191 -24.288 152 H GLN 20 H GLN 20 -20.221 -15.076 -23.412 153 HA GLN 20 HA GLN 20 -17.420 -15.231 -23.323 154 HB2 GLN 20 2HB GLN 20 -19.188 -17.143 -24.839 155 HB3 GLN 20 3HB GLN 20 -17.653 -17.481 -24.050 156 HG2 GLN 20 2HG GLN 20 -20.344 -17.045 -22.820 157 HG3 GLN 20 3HG GLN 20 -19.245 -18.411 -22.636 158 HE21 GLN 20 1HE2 GLN 20 -17.347 -18.123 -21.365 159 HE22 GLN 20 2HE2 GLN 20 -17.299 -16.928 -20.119 160 H LYS 21 H LYS 21 -19.609 -14.404 -25.878 161 HA LYS 21 HA LYS 21 -17.728 -14.821 -28.011 162 HB2 LYS 21 2HB LYS 21 -20.134 -14.979 -28.422 163 HB3 LYS 21 3HB LYS 21 -20.341 -13.299 -27.946 164 HG2 LYS 21 2HG LYS 21 -20.387 -13.395 -30.319 165 HG3 LYS 21 3HG LYS 21 -18.856 -12.656 -29.845 166 HD2 LYS 21 2HD LYS 21 -17.703 -14.767 -30.192 167 HD3 LYS 21 3HD LYS 21 -19.231 -15.557 -30.591 168 HE2 LYS 21 2HE LYS 21 -18.086 -13.228 -32.124 169 HE3 LYS 21 3HE LYS 21 -17.829 -14.916 -32.564 170 HZ1 LYS 21 1HZ LYS 21 -20.587 -14.390 -32.162 171 HZ2 LYS 21 2HZ LYS 21 -19.803 -14.983 -33.538 172 HZ3 LYS 21 3HZ LYS 21 -19.946 -13.314 -33.300 173 H GLU 22 H GLU 22 -18.933 -12.038 -26.184 174 HA GLU 22 HA GLU 22 -17.526 -10.074 -27.655 175 HB2 GLU 22 2HB GLU 22 -19.417 -9.460 -26.273 176 HB3 GLU 22 3HB GLU 22 -18.596 -10.039 -24.830 177 HG2 GLU 22 2HG GLU 22 -17.205 -8.226 -24.721 178 HG3 GLU 22 3HG GLU 22 -17.305 -7.907 -26.452 179 H ILE 23 H ILE 23 -16.657 -12.153 -24.992 180 HA ILE 23 HA ILE 23 -14.319 -10.743 -24.196 181 HB ILE 23 HB ILE 23 -15.037 -13.651 -23.810 182 HG12 ILE 23 2HG1 ILE 23 -15.133 -11.624 -21.627 183 HG13 ILE 23 3HG1 ILE 23 -16.427 -11.605 -22.819 184 HG21 ILE 23 1HG2 ILE 23 -12.606 -12.246 -23.306 185 HG22 ILE 23 2HG2 ILE 23 -13.335 -12.706 -21.769 186 HG23 ILE 23 3HG2 ILE 23 -12.996 -13.935 -22.987 187 HD11 ILE 23 1HD1 ILE 23 -17.430 -13.158 -21.605 188 HD12 ILE 23 2HD1 ILE 23 -16.159 -14.276 -22.103 189 HD13 ILE 23 3HD1 ILE 23 -16.001 -13.377 -20.594 190 H LYS 24 H LYS 24 -14.971 -13.292 -26.527 191 HA LYS 24 HA LYS 24 -12.344 -14.085 -27.068 192 HB2 LYS 24 2HB LYS 24 -14.746 -13.996 -28.902 193 HB3 LYS 24 3HB LYS 24 -13.243 -14.835 -29.267 194 HG2 LYS 24 2HG LYS 24 -14.439 -15.556 -26.692 195 HG3 LYS 24 3HG LYS 24 -15.416 -15.969 -28.103 196 HD2 LYS 24 2HD LYS 24 -12.503 -16.629 -28.086 197 HD3 LYS 24 3HD LYS 24 -13.629 -17.650 -27.190 198 HE2 LYS 24 2HE LYS 24 -13.588 -18.691 -29.247 199 HE3 LYS 24 3HE LYS 24 -14.986 -17.630 -29.413 200 HZ1 LYS 24 1HZ LYS 24 -12.925 -17.752 -31.143 201 HZ2 LYS 24 2HZ LYS 24 -12.493 -16.418 -30.198 202 HZ3 LYS 24 3HZ LYS 24 -13.984 -16.441 -30.997 203 H LYS 25 H LYS 25 -14.270 -11.427 -28.357 204 HA LYS 25 HA LYS 25 -12.334 -10.642 -30.308 205 HB2 LYS 25 2HB LYS 25 -14.777 -9.307 -29.156 206 HB3 LYS 25 3HB LYS 25 -13.737 -8.498 -30.321 207 HG2 LYS 25 2HG LYS 25 -14.415 -9.807 -32.049 208 HG3 LYS 25 3HG LYS 25 -14.721 -11.206 -31.016 209 HD2 LYS 25 2HD LYS 25 -16.851 -10.506 -31.691 210 HD3 LYS 25 3HD LYS 25 -16.670 -9.841 -30.066 211 HE2 LYS 25 2HE LYS 25 -17.582 -8.107 -31.387 212 HE3 LYS 25 3HE LYS 25 -15.880 -7.708 -31.165 213 HZ1 LYS 25 1HZ LYS 25 -16.000 -7.411 -33.383 214 HZ2 LYS 25 2HZ LYS 25 -17.307 -8.465 -33.584 215 HZ3 LYS 25 3HZ LYS 25 -15.741 -9.083 -33.420 216 H ALA 26 H ALA 26 -13.276 -9.388 -27.117 217 HA ALA 26 HA ALA 26 -11.440 -7.262 -27.038 218 HB1 ALA 26 1HB ALA 26 -11.894 -7.147 -24.685 219 HB2 ALA 26 2HB ALA 26 -13.396 -7.523 -25.530 220 HB3 ALA 26 3HB ALA 26 -12.520 -8.796 -24.680 221 H TYR 27 H TYR 27 -11.110 -10.667 -26.324 222 HA TYR 27 HA TYR 27 -8.620 -10.454 -24.948 223 HB2 TYR 27 2HB TYR 27 -9.953 -12.396 -24.535 224 HB3 TYR 27 3HB TYR 27 -10.042 -12.778 -26.251 225 HD1 TYR 27 HD1 TYR 27 -7.194 -11.977 -23.961 226 HD2 TYR 27 HD2 TYR 27 -8.933 -14.754 -26.676 227 HE1 TYR 27 HE1 TYR 27 -5.220 -13.426 -23.735 228 HE2 TYR 27 HE2 TYR 27 -6.964 -16.210 -26.457 229 HH TYR 27 HH TYR 27 -4.075 -15.179 -24.942 230 H TYR 28 H TYR 28 -9.581 -10.912 -28.291 231 HA TYR 28 HA TYR 28 -6.950 -11.536 -29.234 232 HB2 TYR 28 2HB TYR 28 -8.878 -12.316 -30.478 233 HB3 TYR 28 3HB TYR 28 -9.449 -10.666 -30.699 234 HD1 TYR 28 HD1 TYR 28 -9.177 -9.858 -32.833 235 HD2 TYR 28 HD2 TYR 28 -6.243 -12.516 -31.274 236 HE1 TYR 28 HE1 TYR 28 -7.924 -9.704 -34.944 237 HE2 TYR 28 HE2 TYR 28 -4.981 -12.368 -33.379 238 HH TYR 28 HH TYR 28 -5.201 -11.765 -35.618 239 H GLN 29 H GLN 29 -9.008 -8.641 -29.325 240 HA GLN 29 HA GLN 29 -7.240 -6.977 -30.713 241 HB2 GLN 29 2HB GLN 29 -8.600 -5.169 -30.031 242 HB3 GLN 29 3HB GLN 29 -9.683 -6.548 -30.162 243 HG2 GLN 29 2HG GLN 29 -9.638 -6.845 -27.758 244 HG3 GLN 29 3HG GLN 29 -8.491 -5.516 -27.599 245 HE21 GLN 29 1HE2 GLN 29 -11.677 -6.208 -28.998 246 HE22 GLN 29 2HE2 GLN 29 -12.393 -4.703 -28.545 247 H LEU 30 H LEU 30 -7.434 -7.824 -27.315 248 HA LEU 30 HA LEU 30 -5.590 -5.839 -26.417 249 HB2 LEU 30 2HB LEU 30 -7.177 -7.949 -25.268 250 HB3 LEU 30 3HB LEU 30 -5.542 -7.979 -24.612 251 HG LEU 30 HG LEU 30 -5.765 -5.735 -23.791 252 HD11 LEU 30 1HD1 LEU 30 -6.997 -4.351 -25.038 253 HD12 LEU 30 2HD1 LEU 30 -8.365 -4.949 -24.100 254 HD13 LEU 30 3HD1 LEU 30 -7.997 -5.658 -25.672 255 HD21 LEU 30 1HD2 LEU 30 -6.583 -7.236 -22.211 256 HD22 LEU 30 2HD2 LEU 30 -8.021 -7.607 -23.163 257 HD23 LEU 30 3HD2 LEU 30 -7.877 -6.046 -22.354 258 H ALA 31 H ALA 31 -5.328 -9.251 -27.306 259 HA ALA 31 HA ALA 31 -2.682 -9.695 -26.548 260 HB1 ALA 31 1HB ALA 31 -4.605 -10.971 -28.368 261 HB2 ALA 31 2HB ALA 31 -2.906 -11.281 -28.728 262 HB3 ALA 31 3HB ALA 31 -3.557 -11.680 -27.139 263 H LYS 32 H LYS 32 -4.013 -8.322 -29.517 264 HA LYS 32 HA LYS 32 -1.640 -8.227 -31.009 265 HB2 LYS 32 2HB LYS 32 -4.149 -6.560 -31.078 266 HB3 LYS 32 3HB LYS 32 -2.823 -6.295 -32.202 267 HG2 LYS 32 2HG LYS 32 -3.262 -8.173 -33.381 268 HG3 LYS 32 3HG LYS 32 -3.824 -9.064 -31.965 269 HD2 LYS 32 2HD LYS 32 -5.666 -8.656 -33.499 270 HD3 LYS 32 3HD LYS 32 -5.911 -7.767 -31.994 271 HE2 LYS 32 2HE LYS 32 -5.443 -5.719 -32.982 272 HE3 LYS 32 3HE LYS 32 -4.569 -6.455 -34.325 273 HZ1 LYS 32 1HZ LYS 32 -7.358 -7.197 -34.134 274 HZ2 LYS 32 2HZ LYS 32 -6.445 -6.753 -35.487 275 HZ3 LYS 32 3HZ LYS 32 -7.088 -5.561 -34.473 276 H LYS 33 H LYS 33 -2.770 -6.292 -28.379 277 HA LYS 33 HA LYS 33 -1.118 -4.016 -28.871 278 HB2 LYS 33 2HB LYS 33 -2.200 -4.855 -26.187 279 HB3 LYS 33 3HB LYS 33 -1.824 -3.230 -26.746 280 HG2 LYS 33 2HG LYS 33 -3.673 -3.488 -28.424 281 HG3 LYS 33 3HG LYS 33 -4.114 -4.983 -27.595 282 HD2 LYS 33 2HD LYS 33 -4.916 -3.891 -25.764 283 HD3 LYS 33 3HD LYS 33 -3.778 -2.551 -25.930 284 HE2 LYS 33 2HE LYS 33 -6.065 -2.998 -27.833 285 HE3 LYS 33 3HE LYS 33 -6.218 -2.024 -26.372 286 HZ1 LYS 33 1HZ LYS 33 -4.646 -1.490 -28.800 287 HZ2 LYS 33 2HZ LYS 33 -4.153 -0.821 -27.327 288 HZ3 LYS 33 3HZ LYS 33 -5.685 -0.461 -27.949 289 H TYR 34 H TYR 34 -0.787 -6.967 -26.970 290 HA TYR 34 HA TYR 34 1.915 -6.149 -26.172 291 HB2 TYR 34 2HB TYR 34 0.244 -8.475 -25.196 292 HB3 TYR 34 3HB TYR 34 1.809 -7.986 -24.555 293 HD1 TYR 34 HD1 TYR 34 2.016 -6.051 -23.117 294 HD2 TYR 34 HD2 TYR 34 -1.760 -7.158 -24.735 295 HE1 TYR 34 HE1 TYR 34 0.900 -4.548 -21.523 296 HE2 TYR 34 HE2 TYR 34 -2.887 -5.656 -23.146 297 HH TYR 34 HH TYR 34 -2.305 -4.675 -20.811 298 H HIS 35 H HIS 35 0.970 -7.203 -28.858 299 HA HIS 35 HA HIS 35 1.917 -9.801 -29.280 300 HB2 HIS 35 2HB HIS 35 1.116 -7.535 -30.919 301 HB3 HIS 35 3HB HIS 35 2.437 -8.440 -31.651 302 HD1 HIS 35 HD1 HIS 35 -0.176 -10.181 -29.610 303 HD2 HIS 35 HD2 HIS 35 0.790 -9.562 -33.603 304 HE1 HIS 35 HE1 HIS 35 -1.635 -11.765 -30.909 305 HA PRO 36 HA PRO 36 6.297 -9.571 -29.243 306 HB2 PRO 36 2HB PRO 36 6.987 -11.158 -31.334 307 HB3 PRO 36 3HB PRO 36 6.325 -11.794 -29.824 308 HG2 PRO 36 2HG PRO 36 4.940 -11.267 -32.425 309 HG3 PRO 36 3HG PRO 36 4.785 -12.658 -31.336 310 HD2 PRO 36 2HD PRO 36 2.976 -10.644 -31.393 311 HD3 PRO 36 3HD PRO 36 3.358 -11.543 -29.910 312 H ASP 37 H ASP 37 4.530 -8.317 -31.848 313 HA ASP 37 HA ASP 37 6.739 -7.484 -33.477 314 HB2 ASP 37 2HB ASP 37 3.848 -6.590 -33.441 315 HB3 ASP 37 3HB ASP 37 5.029 -6.123 -34.662 316 H THR 38 H THR 38 5.137 -6.262 -30.687 317 HA THR 38 HA THR 38 6.473 -3.658 -31.007 318 HB THR 38 HB THR 38 4.884 -2.683 -29.542 319 HG1 THR 38 HG1 THR 38 4.490 -5.318 -28.752 320 HG21 THR 38 1HG2 THR 38 2.988 -2.794 -30.831 321 HG22 THR 38 2HG2 THR 38 3.051 -4.551 -30.967 322 HG23 THR 38 3HG2 THR 38 4.143 -3.553 -31.926 323 H ASN 39 H ASN 39 7.008 -6.549 -29.633 324 HA ASN 39 HA ASN 39 7.820 -5.725 -26.997 325 HB2 ASN 39 2HB ASN 39 7.838 -8.263 -28.553 326 HB3 ASN 39 3HB ASN 39 8.985 -8.119 -27.224 327 HD21 ASN 39 1HD2 ASN 39 5.698 -6.860 -27.559 328 HD22 ASN 39 2HD2 ASN 39 5.053 -7.692 -26.190 329 H LYS 40 H LYS 40 9.122 -5.305 -30.014 330 HA LYS 40 HA LYS 40 11.812 -5.883 -29.821 331 HB2 LYS 40 2HB LYS 40 10.220 -3.836 -31.276 332 HB3 LYS 40 3HB LYS 40 11.960 -3.593 -31.197 333 HG2 LYS 40 2HG LYS 40 11.429 -4.751 -33.221 334 HG3 LYS 40 3HG LYS 40 12.273 -5.862 -32.139 335 HD2 LYS 40 2HD LYS 40 9.333 -5.848 -31.917 336 HD3 LYS 40 3HD LYS 40 9.981 -6.464 -33.439 337 HE2 LYS 40 2HE LYS 40 11.582 -7.637 -31.511 338 HE3 LYS 40 3HE LYS 40 9.972 -7.665 -30.793 339 HZ1 LYS 40 1HZ LYS 40 9.931 -9.590 -31.981 340 HZ2 LYS 40 2HZ LYS 40 10.959 -9.017 -33.195 341 HZ3 LYS 40 3HZ LYS 40 9.338 -8.536 -33.165 342 H ASP 41 H ASP 41 10.060 -3.094 -28.544 343 HA ASP 41 HA ASP 41 12.497 -2.335 -27.068 344 HB2 ASP 41 2HB ASP 41 11.605 -0.701 -28.829 345 HB3 ASP 41 3HB ASP 41 10.249 -0.442 -27.736 346 H ASP 42 H ASP 42 10.139 -4.159 -26.449 347 HA ASP 42 HA ASP 42 9.721 -3.147 -23.751 348 HB2 ASP 42 2HB ASP 42 7.785 -2.551 -25.487 349 HB3 ASP 42 3HB ASP 42 7.284 -4.196 -25.103 350 HA PRO 43 HA PRO 43 10.637 -7.663 -23.901 351 HB2 PRO 43 2HB PRO 43 12.299 -7.615 -21.755 352 HB3 PRO 43 3HB PRO 43 12.841 -7.256 -23.398 353 HG2 PRO 43 2HG PRO 43 12.124 -5.372 -21.185 354 HG3 PRO 43 3HG PRO 43 13.483 -5.297 -22.321 355 HD2 PRO 43 2HD PRO 43 11.240 -3.813 -22.634 356 HD3 PRO 43 3HD PRO 43 12.187 -4.414 -24.010 357 H LYS 44 H LYS 44 9.121 -5.515 -21.776 358 HA LYS 44 HA LYS 44 8.453 -7.580 -19.819 359 HB2 LYS 44 2HB LYS 44 8.199 -4.602 -19.909 360 HB3 LYS 44 3HB LYS 44 7.139 -5.515 -18.843 361 HG2 LYS 44 2HG LYS 44 8.935 -6.325 -17.570 362 HG3 LYS 44 3HG LYS 44 10.119 -5.857 -18.792 363 HD2 LYS 44 2HD LYS 44 9.579 -3.486 -18.361 364 HD3 LYS 44 3HD LYS 44 8.467 -3.993 -17.087 365 HE2 LYS 44 2HE LYS 44 10.465 -3.416 -15.984 366 HE3 LYS 44 3HE LYS 44 10.449 -5.179 -16.034 367 HZ1 LYS 44 1HZ LYS 44 11.778 -3.767 -18.222 368 HZ2 LYS 44 2HZ LYS 44 12.165 -5.246 -17.499 369 HZ3 LYS 44 3HZ LYS 44 12.561 -3.797 -16.722 370 H ALA 45 H ALA 45 7.171 -6.032 -22.592 371 HA ALA 45 HA ALA 45 4.427 -6.142 -22.145 372 HB1 ALA 45 1HB ALA 45 4.959 -5.026 -24.077 373 HB2 ALA 45 2HB ALA 45 6.136 -6.238 -24.584 374 HB3 ALA 45 3HB ALA 45 4.410 -6.569 -24.732 375 H LYS 46 H LYS 46 6.661 -8.664 -23.193 376 HA LYS 46 HA LYS 46 4.824 -10.625 -23.926 377 HB2 LYS 46 2HB LYS 46 6.630 -12.245 -23.424 378 HB3 LYS 46 3HB LYS 46 7.186 -10.880 -24.384 379 HG2 LYS 46 2HG LYS 46 7.911 -9.861 -22.141 380 HG3 LYS 46 3HG LYS 46 7.726 -11.498 -21.506 381 HD2 LYS 46 2HD LYS 46 10.011 -11.228 -22.133 382 HD3 LYS 46 3HD LYS 46 9.256 -12.279 -23.333 383 HE2 LYS 46 2HE LYS 46 9.339 -10.683 -24.981 384 HE3 LYS 46 3HE LYS 46 9.313 -9.344 -23.834 385 HZ1 LYS 46 1HZ LYS 46 11.536 -9.375 -23.615 386 HZ2 LYS 46 2HZ LYS 46 11.499 -10.135 -25.125 387 HZ3 LYS 46 3HZ LYS 46 11.651 -11.060 -23.717 388 H GLU 47 H GLU 47 6.074 -9.741 -20.748 389 HA GLU 47 HA GLU 47 4.964 -11.910 -19.322 390 HB2 GLU 47 2HB GLU 47 5.710 -9.127 -18.415 391 HB3 GLU 47 3HB GLU 47 5.251 -10.428 -17.326 392 HG2 GLU 47 2HG GLU 47 7.529 -10.709 -19.253 393 HG3 GLU 47 3HG GLU 47 7.734 -9.981 -17.660 394 H LYS 48 H LYS 48 3.732 -8.705 -20.138 395 HA LYS 48 HA LYS 48 1.346 -8.927 -18.601 396 HB2 LYS 48 2HB LYS 48 1.848 -7.160 -21.000 397 HB3 LYS 48 3HB LYS 48 0.624 -6.928 -19.759 398 HG2 LYS 48 2HG LYS 48 3.606 -6.770 -19.366 399 HG3 LYS 48 3HG LYS 48 2.482 -5.410 -19.430 400 HD2 LYS 48 2HD LYS 48 1.350 -6.248 -17.432 401 HD3 LYS 48 3HD LYS 48 2.458 -7.621 -17.373 402 HE2 LYS 48 2HE LYS 48 4.304 -5.798 -17.326 403 HE3 LYS 48 3HE LYS 48 2.995 -4.725 -16.834 404 HZ1 LYS 48 1HZ LYS 48 2.558 -6.126 -14.948 405 HZ2 LYS 48 2HZ LYS 48 4.194 -5.698 -14.945 406 HZ3 LYS 48 3HZ LYS 48 3.726 -7.245 -15.443 407 H PHE 49 H PHE 49 2.240 -9.747 -21.891 408 HA PHE 49 HA PHE 49 -0.302 -10.104 -22.990 409 HB2 PHE 49 2HB PHE 49 1.616 -10.112 -24.429 410 HB3 PHE 49 3HB PHE 49 2.319 -11.485 -23.580 411 HD1 PHE 49 HD1 PHE 49 -0.127 -10.407 -26.052 412 HD2 PHE 49 HD2 PHE 49 1.457 -13.734 -23.922 413 HE1 PHE 49 HE1 PHE 49 -1.207 -11.938 -27.648 414 HE2 PHE 49 HE2 PHE 49 0.381 -15.270 -25.515 415 HZ PHE 49 HZ PHE 49 -0.952 -14.373 -27.381 416 H SER 50 H SER 50 1.612 -12.166 -20.910 417 HA SER 50 HA SER 50 0.142 -14.551 -21.274 418 HB2 SER 50 2HB SER 50 2.252 -14.824 -20.274 419 HB3 SER 50 3HB SER 50 1.961 -13.543 -19.098 420 HG SER 50 HG SER 50 1.459 -16.170 -18.887 421 H GLN 51 H GLN 51 -0.260 -11.787 -19.143 422 HA GLN 51 HA GLN 51 -2.165 -12.868 -17.396 423 HB2 GLN 51 2HB GLN 51 -1.788 -10.016 -18.321 424 HB3 GLN 51 3HB GLN 51 -2.812 -10.499 -16.976 425 HG2 GLN 51 2HG GLN 51 0.171 -10.589 -17.190 426 HG3 GLN 51 3HG GLN 51 -0.833 -9.790 -15.981 427 HE21 GLN 51 1HE2 GLN 51 1.300 -12.097 -16.198 428 HE22 GLN 51 2HE2 GLN 51 0.679 -13.263 -15.085 429 H LEU 52 H LEU 52 -2.462 -11.510 -20.609 430 HA LEU 52 HA LEU 52 -5.234 -11.111 -20.672 431 HB2 LEU 52 2HB LEU 52 -3.472 -11.952 -22.966 432 HB3 LEU 52 3HB LEU 52 -5.034 -11.144 -23.076 433 HG LEU 52 HG LEU 52 -2.644 -9.865 -21.771 434 HD11 LEU 52 1HD1 LEU 52 -1.852 -9.078 -23.741 435 HD12 LEU 52 2HD1 LEU 52 -3.437 -9.086 -24.512 436 HD13 LEU 52 3HD1 LEU 52 -2.535 -10.591 -24.335 437 HD21 LEU 52 1HD2 LEU 52 -5.399 -9.165 -22.132 438 HD22 LEU 52 2HD2 LEU 52 -4.372 -8.016 -22.991 439 HD23 LEU 52 3HD2 LEU 52 -4.131 -8.297 -21.266 440 H ALA 53 H ALA 53 -3.299 -13.936 -21.631 441 HA ALA 53 HA ALA 53 -5.521 -15.537 -22.365 442 HB1 ALA 53 1HB ALA 53 -4.005 -17.169 -22.847 443 HB2 ALA 53 2HB ALA 53 -2.928 -15.771 -22.844 444 HB3 ALA 53 3HB ALA 53 -3.013 -16.822 -21.430 445 H GLU 54 H GLU 54 -3.807 -15.006 -19.351 446 HA GLU 54 HA GLU 54 -4.831 -17.198 -17.912 447 HB2 GLU 54 2HB GLU 54 -3.759 -14.514 -17.074 448 HB3 GLU 54 3HB GLU 54 -4.349 -15.676 -15.895 449 HG2 GLU 54 2HG GLU 54 -2.686 -17.262 -16.505 450 HG3 GLU 54 3HG GLU 54 -2.196 -16.297 -17.897 451 H ALA 55 H ALA 55 -5.937 -13.821 -18.096 452 HA ALA 55 HA ALA 55 -8.232 -14.257 -16.464 453 HB1 ALA 55 1HB ALA 55 -7.547 -12.052 -16.461 454 HB2 ALA 55 2HB ALA 55 -7.283 -12.021 -18.205 455 HB3 ALA 55 3HB ALA 55 -8.925 -12.007 -17.561 456 H TYR 56 H TYR 56 -7.629 -14.270 -19.933 457 HA TYR 56 HA TYR 56 -10.332 -14.357 -20.757 458 HB2 TYR 56 2HB TYR 56 -8.771 -13.747 -22.413 459 HB3 TYR 56 3HB TYR 56 -7.739 -15.133 -22.075 460 HD1 TYR 56 HD1 TYR 56 -10.843 -14.024 -23.708 461 HD2 TYR 56 HD2 TYR 56 -8.183 -17.281 -23.059 462 HE1 TYR 56 HE1 TYR 56 -11.941 -15.274 -25.519 463 HE2 TYR 56 HE2 TYR 56 -9.274 -18.540 -24.869 464 HH TYR 56 HH TYR 56 -11.670 -18.490 -25.960 465 H GLU 57 H GLU 57 -8.136 -16.765 -19.569 466 HA GLU 57 HA GLU 57 -9.337 -19.083 -20.584 467 HB2 GLU 57 2HB GLU 57 -7.494 -18.424 -18.378 468 HB3 GLU 57 3HB GLU 57 -8.414 -19.906 -18.160 469 HG2 GLU 57 2HG GLU 57 -7.284 -19.685 -20.823 470 HG3 GLU 57 3HG GLU 57 -6.059 -19.631 -19.557 471 H VAL 58 H VAL 58 -9.927 -17.323 -17.555 472 HA VAL 58 HA VAL 58 -12.021 -19.083 -16.711 473 HB VAL 58 HB VAL 58 -11.445 -16.284 -15.731 474 HG11 VAL 58 1HG1 VAL 58 -12.657 -16.869 -13.779 475 HG12 VAL 58 2HG1 VAL 58 -13.659 -17.345 -15.152 476 HG13 VAL 58 3HG1 VAL 58 -12.748 -18.563 -14.259 477 HG21 VAL 58 1HG2 VAL 58 -10.215 -18.929 -15.044 478 HG22 VAL 58 2HG2 VAL 58 -9.424 -17.392 -15.392 479 HG23 VAL 58 3HG2 VAL 58 -10.272 -17.620 -13.863 480 H LEU 59 H LEU 59 -11.898 -15.881 -18.220 481 HA LEU 59 HA LEU 59 -14.719 -15.493 -18.220 482 HB2 LEU 59 2HB LEU 59 -12.351 -14.105 -19.229 483 HB3 LEU 59 3HB LEU 59 -13.777 -13.911 -20.246 484 HG LEU 59 HG LEU 59 -15.008 -12.931 -18.426 485 HD11 LEU 59 1HD1 LEU 59 -14.312 -14.102 -16.521 486 HD12 LEU 59 2HD1 LEU 59 -13.733 -12.455 -16.270 487 HD13 LEU 59 3HD1 LEU 59 -12.613 -13.713 -16.794 488 HD21 LEU 59 1HD2 LEU 59 -13.585 -11.442 -19.731 489 HD22 LEU 59 2HD2 LEU 59 -12.242 -11.742 -18.627 490 HD23 LEU 59 3HD2 LEU 59 -13.687 -10.908 -18.053 491 H SER 60 H SER 60 -12.737 -17.521 -19.996 492 HA SER 60 HA SER 60 -14.069 -17.403 -22.520 493 HB2 SER 60 2HB SER 60 -11.859 -18.259 -22.565 494 HB3 SER 60 3HB SER 60 -12.187 -19.396 -21.258 495 HG SER 60 HG SER 60 -13.507 -19.516 -23.759 496 H ASP 61 H ASP 61 -14.917 -18.667 -19.514 497 HA ASP 61 HA ASP 61 -17.120 -20.165 -20.737 498 HB2 ASP 61 2HB ASP 61 -15.041 -21.541 -19.737 499 HB3 ASP 61 3HB ASP 61 -15.966 -21.315 -18.255 500 H GLU 62 H GLU 62 -19.037 -19.667 -19.886 501 HA GLU 62 HA GLU 62 -19.404 -17.608 -18.067 502 HB2 GLU 62 2HB GLU 62 -21.752 -18.462 -17.871 503 HB3 GLU 62 3HB GLU 62 -21.196 -18.229 -19.522 504 HG2 GLU 62 2HG GLU 62 -20.680 -20.677 -19.599 505 HG3 GLU 62 3HG GLU 62 -21.487 -20.826 -18.038 506 H VAL 63 H VAL 63 -19.237 -21.086 -17.518 507 HA VAL 63 HA VAL 63 -20.020 -21.064 -14.808 508 HB VAL 63 HB VAL 63 -18.145 -23.041 -16.107 509 HG11 VAL 63 1HG1 VAL 63 -19.878 -23.094 -13.657 510 HG12 VAL 63 2HG1 VAL 63 -19.337 -24.577 -14.446 511 HG13 VAL 63 3HG1 VAL 63 -18.155 -23.439 -13.799 512 HG21 VAL 63 1HG2 VAL 63 -19.810 -23.628 -17.457 513 HG22 VAL 63 2HG2 VAL 63 -20.752 -24.079 -16.036 514 HG23 VAL 63 3HG2 VAL 63 -20.890 -22.453 -16.706 515 H LYS 64 H LYS 64 -16.790 -21.108 -16.305 516 HA LYS 64 HA LYS 64 -15.321 -21.029 -13.915 517 HB2 LYS 64 2HB LYS 64 -14.681 -20.199 -16.737 518 HB3 LYS 64 3HB LYS 64 -13.509 -20.023 -15.437 519 HG2 LYS 64 2HG LYS 64 -14.168 -22.582 -15.062 520 HG3 LYS 64 3HG LYS 64 -14.493 -22.456 -16.792 521 HD2 LYS 64 2HD LYS 64 -12.231 -23.159 -16.549 522 HD3 LYS 64 3HD LYS 64 -12.199 -21.467 -17.051 523 HE2 LYS 64 2HE LYS 64 -10.707 -21.333 -15.347 524 HE3 LYS 64 3HE LYS 64 -12.182 -21.112 -14.409 525 HZ1 LYS 64 1HZ LYS 64 -11.817 -22.995 -13.322 526 HZ2 LYS 64 2HZ LYS 64 -10.274 -23.035 -14.014 527 HZ3 LYS 64 3HZ LYS 64 -11.550 -23.870 -14.745 528 H ARG 65 H ARG 65 -16.519 -18.435 -16.006 529 HA ARG 65 HA ARG 65 -15.312 -16.313 -14.574 530 HB2 ARG 65 2HB ARG 65 -16.097 -16.040 -16.872 531 HB3 ARG 65 3HB ARG 65 -17.755 -16.314 -16.354 532 HG2 ARG 65 2HG ARG 65 -17.707 -14.275 -15.040 533 HG3 ARG 65 3HG ARG 65 -16.020 -14.011 -15.487 534 HD2 ARG 65 2HD ARG 65 -17.415 -12.631 -16.873 535 HD3 ARG 65 3HD ARG 65 -16.719 -13.913 -17.864 536 HE ARG 65 HE ARG 65 -18.827 -14.762 -18.201 537 HH11 ARG 65 1HH1 ARG 65 -18.914 -12.395 -15.649 538 HH12 ARG 65 2HH1 ARG 65 -20.644 -12.349 -15.573 539 HH21 ARG 65 1HH2 ARG 65 -21.106 -14.710 -18.111 540 HH22 ARG 65 2HH2 ARG 65 -21.890 -13.666 -16.974 541 H LYS 66 H LYS 66 -18.582 -17.700 -14.484 542 HA LYS 66 HA LYS 66 -19.625 -15.965 -12.534 543 HB2 LYS 66 2HB LYS 66 -20.373 -18.754 -13.394 544 HB3 LYS 66 3HB LYS 66 -21.260 -17.899 -12.138 545 HG2 LYS 66 2HG LYS 66 -20.854 -16.818 -14.916 546 HG3 LYS 66 3HG LYS 66 -22.258 -17.769 -14.425 547 HD2 LYS 66 2HD LYS 66 -23.142 -16.076 -13.194 548 HD3 LYS 66 3HD LYS 66 -21.560 -15.449 -12.723 549 HE2 LYS 66 2HE LYS 66 -21.271 -14.395 -14.849 550 HE3 LYS 66 3HE LYS 66 -22.705 -15.188 -15.498 551 HZ1 LYS 66 1HZ LYS 66 -23.834 -13.405 -14.870 552 HZ2 LYS 66 2HZ LYS 66 -22.509 -12.761 -14.041 553 HZ3 LYS 66 3HZ LYS 66 -23.556 -13.834 -13.258 554 H GLN 67 H GLN 67 -18.029 -19.116 -12.258 555 HA GLN 67 HA GLN 67 -18.365 -19.492 -9.510 556 HB2 GLN 67 2HB GLN 67 -16.332 -20.457 -11.493 557 HB3 GLN 67 3HB GLN 67 -16.147 -20.828 -9.784 558 HG2 GLN 67 2HG GLN 67 -18.484 -21.567 -11.531 559 HG3 GLN 67 3HG GLN 67 -17.230 -22.653 -10.934 560 HE21 GLN 67 1HE2 GLN 67 -20.111 -20.911 -10.176 561 HE22 GLN 67 2HE2 GLN 67 -20.376 -21.604 -8.616 562 H TYR 68 H TYR 68 -15.907 -17.720 -11.312 563 HA TYR 68 HA TYR 68 -14.279 -17.156 -9.037 564 HB2 TYR 68 2HB TYR 68 -13.525 -17.153 -11.460 565 HB3 TYR 68 3HB TYR 68 -14.346 -15.604 -11.626 566 HD1 TYR 68 HD1 TYR 68 -11.592 -17.355 -9.885 567 HD2 TYR 68 HD2 TYR 68 -13.349 -13.600 -10.841 568 HE1 TYR 68 HE1 TYR 68 -9.582 -16.209 -9.050 569 HE2 TYR 68 HE2 TYR 68 -11.343 -12.443 -10.011 570 HH TYR 68 HH TYR 68 -8.550 -14.261 -8.782 571 H ASP 69 H ASP 69 -16.862 -15.465 -10.732 572 HA ASP 69 HA ASP 69 -16.625 -12.976 -9.460 573 HB2 ASP 69 2HB ASP 69 -18.007 -13.011 -11.355 574 HB3 ASP 69 3HB ASP 69 -18.912 -14.409 -10.783 575 H ALA 70 H ALA 70 -18.037 -15.987 -8.423 576 HA ALA 70 HA ALA 70 -19.605 -14.957 -6.294 577 HB1 ALA 70 1HB ALA 70 -19.195 -17.450 -7.467 578 HB2 ALA 70 2HB ALA 70 -18.659 -17.635 -5.797 579 HB3 ALA 70 3HB ALA 70 -20.292 -17.064 -6.141 580 H TYR 71 H TYR 71 -16.242 -15.837 -6.615 581 HA TYR 71 HA TYR 71 -15.833 -15.374 -3.741 582 HB2 TYR 71 2HB TYR 71 -14.059 -16.722 -5.786 583 HB3 TYR 71 3HB TYR 71 -13.610 -16.444 -4.107 584 HD1 TYR 71 HD1 TYR 71 -15.701 -17.248 -2.462 585 HD2 TYR 71 HD2 TYR 71 -14.617 -18.907 -6.227 586 HE1 TYR 71 HE1 TYR 71 -16.758 -19.374 -1.822 587 HE2 TYR 71 HE2 TYR 71 -15.672 -21.038 -5.598 588 HH TYR 71 HH TYR 71 -16.639 -22.201 -3.960 589 H GLY 72 H GLY 72 -16.228 -13.297 -5.824 590 HA2 GLY 72 2HA GLY 72 -13.584 -11.998 -5.774 591 HA3 GLY 72 3HA GLY 72 -14.887 -11.599 -6.883 592 H SER 73 H SER 73 -13.835 -9.490 -5.776 593 HA SER 73 HA SER 73 -15.505 -8.813 -3.448 594 HB2 SER 73 2HB SER 73 -13.193 -8.519 -2.909 595 HB3 SER 73 3HB SER 73 -12.884 -7.664 -4.420 596 HG SER 73 HG SER 73 -13.317 -6.493 -2.245 Start of MODEL 5 1 H1 HIS 1 H HIS 1 -2.815 4.020 1.316 2 HA HIS 1 HA HIS 1 -0.947 3.409 -0.819 3 HB2 HIS 1 2HB HIS 1 -0.776 3.493 2.177 4 HB3 HIS 1 3HB HIS 1 0.477 2.685 1.241 5 HD1 HIS 1 HD1 HIS 1 -1.233 6.091 1.220 6 HD2 HIS 1 HD2 HIS 1 2.488 4.357 0.582 7 HE1 HIS 1 HE1 HIS 1 0.331 8.005 0.761 8 H MET 2 H MET 2 -3.371 1.828 -0.634 9 HA MET 2 HA MET 2 -2.151 -0.814 -0.187 10 HB2 MET 2 2HB MET 2 -3.772 -0.377 1.582 11 HB3 MET 2 3HB MET 2 -5.003 0.006 0.387 12 HG2 MET 2 2HG MET 2 -4.991 -2.272 -0.412 13 HG3 MET 2 3HG MET 2 -3.676 -2.676 0.690 14 HE1 MET 2 1HE MET 2 -6.206 -4.799 2.042 15 HE2 MET 2 2HE MET 2 -4.566 -4.501 1.467 16 HE3 MET 2 3HE MET 2 -4.958 -4.272 3.171 17 H LEU 3 H LEU 3 -2.388 -2.286 -1.786 18 HA LEU 3 HA LEU 3 -3.507 -1.355 -4.290 19 HB2 LEU 3 2HB LEU 3 -1.305 -2.710 -3.847 20 HB3 LEU 3 3HB LEU 3 -2.393 -4.095 -3.910 21 HG LEU 3 HG LEU 3 -2.333 -2.105 -6.149 22 HD11 LEU 3 1HD1 LEU 3 -0.042 -2.665 -5.974 23 HD12 LEU 3 2HD1 LEU 3 -0.705 -3.678 -7.256 24 HD13 LEU 3 3HD1 LEU 3 -0.406 -4.362 -5.658 25 HD21 LEU 3 1HD2 LEU 3 -2.676 -4.637 -7.145 26 HD22 LEU 3 2HD2 LEU 3 -3.967 -3.489 -6.786 27 HD23 LEU 3 3HD2 LEU 3 -3.517 -4.712 -5.597 28 H ALA 4 H ALA 4 -5.513 -1.756 -4.920 29 HA ALA 4 HA ALA 4 -7.197 -3.568 -3.448 30 HB1 ALA 4 1HB ALA 4 -8.623 -2.754 -5.679 31 HB2 ALA 4 2HB ALA 4 -8.652 -2.008 -4.081 32 HB3 ALA 4 3HB ALA 4 -7.562 -1.391 -5.322 33 H LYS 5 H LYS 5 -8.506 -5.235 -4.489 34 HA LYS 5 HA LYS 5 -6.896 -7.022 -6.010 35 HB2 LYS 5 2HB LYS 5 -9.839 -7.135 -5.323 36 HB3 LYS 5 3HB LYS 5 -8.918 -8.459 -6.024 37 HG2 LYS 5 2HG LYS 5 -7.403 -8.239 -3.971 38 HG3 LYS 5 3HG LYS 5 -8.711 -7.277 -3.280 39 HD2 LYS 5 2HD LYS 5 -9.061 -9.498 -2.540 40 HD3 LYS 5 3HD LYS 5 -10.247 -9.213 -3.816 41 HE2 LYS 5 2HE LYS 5 -8.967 -10.453 -5.391 42 HE3 LYS 5 3HE LYS 5 -7.582 -10.528 -4.302 43 HZ1 LYS 5 1HZ LYS 5 -9.728 -12.321 -4.516 44 HZ2 LYS 5 2HZ LYS 5 -9.777 -11.627 -2.974 45 HZ3 LYS 5 3HZ LYS 5 -8.376 -12.416 -3.502 46 H GLU 6 H GLU 6 -7.290 -7.848 -8.112 47 HA GLU 6 HA GLU 6 -8.764 -5.984 -9.855 48 HB2 GLU 6 2HB GLU 6 -6.291 -7.612 -10.464 49 HB3 GLU 6 3HB GLU 6 -7.174 -6.657 -11.646 50 HG2 GLU 6 2HG GLU 6 -5.698 -5.643 -9.231 51 HG3 GLU 6 3HG GLU 6 -5.260 -5.422 -10.924 52 H ASP 7 H ASP 7 -9.846 -6.866 -11.683 53 HA ASP 7 HA ASP 7 -10.503 -9.726 -11.393 54 HB2 ASP 7 2HB ASP 7 -12.364 -7.681 -12.587 55 HB3 ASP 7 3HB ASP 7 -12.748 -9.288 -11.975 56 H TYR 8 H TYR 8 -11.045 -10.872 -13.345 57 HA TYR 8 HA TYR 8 -9.228 -10.435 -15.436 58 HB2 TYR 8 2HB TYR 8 -11.764 -12.069 -15.603 59 HB3 TYR 8 3HB TYR 8 -10.300 -12.273 -16.558 60 HD1 TYR 8 HD1 TYR 8 -11.973 -14.109 -14.480 61 HD2 TYR 8 HD2 TYR 8 -8.233 -12.081 -14.435 62 HE1 TYR 8 HE1 TYR 8 -11.126 -15.719 -12.825 63 HE2 TYR 8 HE2 TYR 8 -7.375 -13.686 -12.782 64 HH TYR 8 HH TYR 8 -8.188 -16.363 -12.223 65 H TYR 9 H TYR 9 -12.496 -9.347 -14.939 66 HA TYR 9 HA TYR 9 -13.324 -8.745 -17.501 67 HB2 TYR 9 2HB TYR 9 -13.783 -7.086 -15.012 68 HB3 TYR 9 3HB TYR 9 -14.734 -7.008 -16.491 69 HD1 TYR 9 HD1 TYR 9 -14.199 -8.746 -13.370 70 HD2 TYR 9 HD2 TYR 9 -16.125 -8.980 -17.157 71 HE1 TYR 9 HE1 TYR 9 -15.678 -10.509 -12.502 72 HE2 TYR 9 HE2 TYR 9 -17.610 -10.743 -16.299 73 HH TYR 9 HH TYR 9 -18.284 -11.861 -14.484 74 H GLN 10 H GLN 10 -11.301 -6.795 -15.335 75 HA GLN 10 HA GLN 10 -11.017 -4.643 -17.194 76 HB2 GLN 10 2HB GLN 10 -9.298 -5.302 -14.797 77 HB3 GLN 10 3HB GLN 10 -9.384 -3.756 -15.630 78 HG2 GLN 10 2HG GLN 10 -11.789 -4.994 -14.338 79 HG3 GLN 10 3HG GLN 10 -10.652 -3.993 -13.437 80 HE21 GLN 10 1HE2 GLN 10 -13.545 -3.820 -14.638 81 HE22 GLN 10 2HE2 GLN 10 -13.589 -2.203 -15.245 82 H ILE 11 H ILE 11 -9.086 -7.461 -16.317 83 HA ILE 11 HA ILE 11 -6.757 -6.820 -17.735 84 HB ILE 11 HB ILE 11 -7.908 -9.559 -17.188 85 HG12 ILE 11 2HG1 ILE 11 -5.776 -8.089 -15.638 86 HG13 ILE 11 3HG1 ILE 11 -7.481 -8.024 -15.205 87 HG21 ILE 11 1HG2 ILE 11 -5.229 -9.893 -17.230 88 HG22 ILE 11 2HG2 ILE 11 -6.279 -10.165 -18.620 89 HG23 ILE 11 3HG2 ILE 11 -5.416 -8.636 -18.452 90 HD11 ILE 11 1HD1 ILE 11 -6.461 -10.733 -15.564 91 HD12 ILE 11 2HD1 ILE 11 -5.680 -9.832 -14.264 92 HD13 ILE 11 3HD1 ILE 11 -7.431 -10.042 -14.263 93 H LEU 12 H LEU 12 -9.853 -7.888 -18.818 94 HA LEU 12 HA LEU 12 -8.783 -8.430 -21.503 95 HB2 LEU 12 2HB LEU 12 -11.133 -9.403 -19.983 96 HB3 LEU 12 3HB LEU 12 -11.328 -9.203 -21.723 97 HG LEU 12 HG LEU 12 -9.173 -10.889 -20.456 98 HD11 LEU 12 1HD1 LEU 12 -12.000 -11.433 -20.932 99 HD12 LEU 12 2HD1 LEU 12 -10.825 -12.303 -19.946 100 HD13 LEU 12 3HD1 LEU 12 -10.915 -12.605 -21.681 101 HD21 LEU 12 1HD2 LEU 12 -8.809 -11.741 -22.643 102 HD22 LEU 12 2HD2 LEU 12 -8.811 -9.982 -22.770 103 HD23 LEU 12 3HD2 LEU 12 -10.227 -10.905 -23.276 104 H GLY 13 H GLY 13 -10.495 -6.149 -19.659 105 HA2 GLY 13 2HA GLY 13 -11.226 -4.044 -20.290 106 HA3 GLY 13 3HA GLY 13 -10.835 -4.447 -21.955 107 H VAL 14 H VAL 14 -12.870 -6.567 -20.120 108 HA VAL 14 HA VAL 14 -15.167 -5.686 -21.741 109 HB VAL 14 HB VAL 14 -16.070 -7.939 -21.512 110 HG11 VAL 14 1HG1 VAL 14 -14.531 -9.093 -22.952 111 HG12 VAL 14 2HG1 VAL 14 -14.520 -7.380 -23.374 112 HG13 VAL 14 3HG1 VAL 14 -13.199 -8.064 -22.426 113 HG21 VAL 14 1HG2 VAL 14 -14.735 -9.732 -20.501 114 HG22 VAL 14 2HG2 VAL 14 -13.535 -8.545 -19.990 115 HG23 VAL 14 3HG2 VAL 14 -15.166 -8.494 -19.321 116 HA PRO 15 HA PRO 15 -17.419 -4.609 -18.126 117 HB2 PRO 15 2HB PRO 15 -19.951 -5.188 -18.913 118 HB3 PRO 15 3HB PRO 15 -19.046 -3.803 -19.534 119 HG2 PRO 15 2HG PRO 15 -19.485 -6.490 -20.778 120 HG3 PRO 15 3HG PRO 15 -19.549 -4.885 -21.530 121 HD2 PRO 15 2HD PRO 15 -17.398 -6.514 -21.755 122 HD3 PRO 15 3HD PRO 15 -17.256 -4.745 -21.722 123 H ARG 16 H ARG 16 -19.182 -5.493 -16.629 124 HA ARG 16 HA ARG 16 -18.404 -8.144 -15.833 125 HB2 ARG 16 2HB ARG 16 -20.598 -6.449 -14.640 126 HB3 ARG 16 3HB ARG 16 -19.724 -7.767 -13.872 127 HG2 ARG 16 2HG ARG 16 -18.446 -5.187 -14.745 128 HG3 ARG 16 3HG ARG 16 -19.050 -5.496 -13.116 129 HD2 ARG 16 2HD ARG 16 -17.528 -7.636 -13.325 130 HD3 ARG 16 3HD ARG 16 -16.696 -6.651 -14.527 131 HE ARG 16 HE ARG 16 -15.878 -5.331 -12.839 132 HH11 ARG 16 1HH1 ARG 16 -18.431 -7.348 -11.600 133 HH12 ARG 16 2HH1 ARG 16 -18.136 -6.930 -9.945 134 HH21 ARG 16 1HH2 ARG 16 -15.480 -4.773 -10.663 135 HH22 ARG 16 2HH2 ARG 16 -16.458 -5.464 -9.413 136 H ASN 17 H ASN 17 -20.659 -6.947 -17.979 137 HA ASN 17 HA ASN 17 -22.400 -9.301 -17.646 138 HB2 ASN 17 2HB ASN 17 -24.040 -7.934 -19.042 139 HB3 ASN 17 3HB ASN 17 -23.750 -7.369 -17.400 140 HD21 ASN 17 1HD2 ASN 17 -24.201 -5.254 -17.694 141 HD22 ASN 17 2HD2 ASN 17 -23.292 -4.203 -18.721 142 H ALA 18 H ALA 18 -19.834 -8.364 -19.351 143 HA ALA 18 HA ALA 18 -20.411 -8.642 -22.043 144 HB1 ALA 18 1HB ALA 18 -18.216 -8.370 -22.205 145 HB2 ALA 18 2HB ALA 18 -18.094 -8.530 -20.452 146 HB3 ALA 18 3HB ALA 18 -17.931 -9.953 -21.481 147 H SER 19 H SER 19 -20.012 -10.466 -23.489 148 HA SER 19 HA SER 19 -20.949 -12.983 -22.288 149 HB2 SER 19 2HB SER 19 -21.040 -12.449 -25.236 150 HB3 SER 19 3HB SER 19 -22.095 -13.464 -24.253 151 HG SER 19 HG SER 19 -22.538 -11.001 -25.021 152 H GLN 20 H GLN 20 -20.212 -14.983 -23.473 153 HA GLN 20 HA GLN 20 -17.415 -15.177 -23.360 154 HB2 GLN 20 2HB GLN 20 -19.202 -17.093 -24.847 155 HB3 GLN 20 3HB GLN 20 -17.676 -17.438 -24.046 156 HG2 GLN 20 2HG GLN 20 -20.360 -16.925 -22.828 157 HG3 GLN 20 3HG GLN 20 -19.297 -18.317 -22.627 158 HE21 GLN 20 1HE2 GLN 20 -17.398 -18.068 -21.355 159 HE22 GLN 20 2HE2 GLN 20 -17.316 -16.855 -20.127 160 H LYS 21 H LYS 21 -19.568 -14.365 -25.948 161 HA LYS 21 HA LYS 21 -17.681 -14.861 -28.058 162 HB2 LYS 21 2HB LYS 21 -20.253 -13.269 -28.055 163 HB3 LYS 21 3HB LYS 21 -19.334 -13.710 -29.488 164 HG2 LYS 21 2HG LYS 21 -19.689 -16.103 -28.895 165 HG3 LYS 21 3HG LYS 21 -20.757 -15.567 -27.597 166 HD2 LYS 21 2HD LYS 21 -22.100 -16.140 -29.504 167 HD3 LYS 21 3HD LYS 21 -22.135 -14.387 -29.301 168 HE2 LYS 21 2HE LYS 21 -20.610 -14.068 -31.095 169 HE3 LYS 21 3HE LYS 21 -20.238 -15.789 -31.172 170 HZ1 LYS 21 1HZ LYS 21 -21.829 -14.837 -32.897 171 HZ2 LYS 21 2HZ LYS 21 -22.975 -14.790 -31.654 172 HZ3 LYS 21 3HZ LYS 21 -22.293 -16.266 -32.119 173 H GLU 22 H GLU 22 -18.859 -12.009 -26.316 174 HA GLU 22 HA GLU 22 -17.400 -10.106 -27.809 175 HB2 GLU 22 2HB GLU 22 -19.296 -9.457 -26.428 176 HB3 GLU 22 3HB GLU 22 -18.451 -9.979 -24.978 177 HG2 GLU 22 2HG GLU 22 -18.403 -7.564 -25.202 178 HG3 GLU 22 3HG GLU 22 -16.780 -8.243 -25.308 179 H ILE 23 H ILE 23 -16.602 -12.100 -25.047 180 HA ILE 23 HA ILE 23 -14.251 -10.742 -24.259 181 HB ILE 23 HB ILE 23 -14.994 -13.647 -23.899 182 HG12 ILE 23 2HG1 ILE 23 -15.074 -11.630 -21.705 183 HG13 ILE 23 3HG1 ILE 23 -16.367 -11.597 -22.898 184 HG21 ILE 23 1HG2 ILE 23 -12.934 -13.944 -23.127 185 HG22 ILE 23 2HG2 ILE 23 -12.560 -12.234 -23.333 186 HG23 ILE 23 3HG2 ILE 23 -13.301 -12.800 -21.837 187 HD11 ILE 23 1HD1 ILE 23 -15.986 -13.356 -20.670 188 HD12 ILE 23 2HD1 ILE 23 -17.385 -13.169 -21.727 189 HD13 ILE 23 3HD1 ILE 23 -16.087 -14.278 -22.170 190 H LYS 24 H LYS 24 -14.897 -13.233 -26.645 191 HA LYS 24 HA LYS 24 -12.259 -14.038 -27.155 192 HB2 LYS 24 2HB LYS 24 -14.737 -14.007 -28.870 193 HB3 LYS 24 3HB LYS 24 -13.206 -14.647 -29.451 194 HG2 LYS 24 2HG LYS 24 -13.431 -15.970 -27.110 195 HG3 LYS 24 3HG LYS 24 -15.131 -15.783 -27.545 196 HD2 LYS 24 2HD LYS 24 -13.168 -16.739 -29.588 197 HD3 LYS 24 3HD LYS 24 -13.792 -17.862 -28.377 198 HE2 LYS 24 2HE LYS 24 -15.635 -16.146 -30.006 199 HE3 LYS 24 3HE LYS 24 -15.021 -17.675 -30.633 200 HZ1 LYS 24 1HZ LYS 24 -17.239 -17.709 -29.427 201 HZ2 LYS 24 2HZ LYS 24 -16.353 -17.509 -28.000 202 HZ3 LYS 24 3HZ LYS 24 -16.100 -18.873 -28.968 203 H LYS 25 H LYS 25 -14.197 -11.402 -28.487 204 HA LYS 25 HA LYS 25 -12.253 -10.598 -30.411 205 HB2 LYS 25 2HB LYS 25 -14.591 -9.094 -29.222 206 HB3 LYS 25 3HB LYS 25 -13.639 -8.544 -30.595 207 HG2 LYS 25 2HG LYS 25 -14.539 -10.091 -32.019 208 HG3 LYS 25 3HG LYS 25 -14.901 -11.234 -30.724 209 HD2 LYS 25 2HD LYS 25 -17.002 -10.445 -31.331 210 HD3 LYS 25 3HD LYS 25 -16.593 -9.447 -29.934 211 HE2 LYS 25 2HE LYS 25 -16.201 -7.571 -31.228 212 HE3 LYS 25 3HE LYS 25 -15.889 -8.514 -32.684 213 HZ1 LYS 25 1HZ LYS 25 -18.219 -9.015 -32.856 214 HZ2 LYS 25 2HZ LYS 25 -18.027 -7.338 -32.746 215 HZ3 LYS 25 3HZ LYS 25 -18.551 -8.219 -31.400 216 H ALA 26 H ALA 26 -13.189 -9.365 -27.212 217 HA ALA 26 HA ALA 26 -11.335 -7.247 -27.132 218 HB1 ALA 26 1HB ALA 26 -12.423 -8.745 -24.756 219 HB2 ALA 26 2HB ALA 26 -11.835 -7.082 -24.805 220 HB3 ALA 26 3HB ALA 26 -13.326 -7.516 -25.642 221 H TYR 27 H TYR 27 -11.057 -10.652 -26.400 222 HA TYR 27 HA TYR 27 -8.580 -10.467 -24.995 223 HB2 TYR 27 2HB TYR 27 -9.944 -12.390 -24.594 224 HB3 TYR 27 3HB TYR 27 -10.015 -12.776 -26.309 225 HD1 TYR 27 HD1 TYR 27 -7.154 -11.969 -24.044 226 HD2 TYR 27 HD2 TYR 27 -8.959 -14.801 -26.656 227 HE1 TYR 27 HE1 TYR 27 -5.200 -13.441 -23.788 228 HE2 TYR 27 HE2 TYR 27 -7.010 -16.281 -26.407 229 HH TYR 27 HH TYR 27 -4.347 -15.718 -25.728 230 H TYR 28 H TYR 28 -9.506 -10.923 -28.348 231 HA TYR 28 HA TYR 28 -6.872 -11.581 -29.256 232 HB2 TYR 28 2HB TYR 28 -8.783 -12.346 -30.526 233 HB3 TYR 28 3HB TYR 28 -9.347 -10.694 -30.749 234 HD1 TYR 28 HD1 TYR 28 -9.102 -9.959 -32.914 235 HD2 TYR 28 HD2 TYR 28 -6.094 -12.475 -31.263 236 HE1 TYR 28 HE1 TYR 28 -7.829 -9.804 -35.012 237 HE2 TYR 28 HE2 TYR 28 -4.812 -12.326 -33.357 238 HH TYR 28 HH TYR 28 -5.489 -11.837 -35.897 239 H GLN 29 H GLN 29 -8.894 -8.662 -29.382 240 HA GLN 29 HA GLN 29 -7.089 -7.024 -30.753 241 HB2 GLN 29 2HB GLN 29 -8.438 -5.199 -30.100 242 HB3 GLN 29 3HB GLN 29 -9.536 -6.567 -30.232 243 HG2 GLN 29 2HG GLN 29 -9.516 -6.849 -27.825 244 HG3 GLN 29 3HG GLN 29 -8.360 -5.528 -27.664 245 HE21 GLN 29 1HE2 GLN 29 -10.074 -4.734 -26.206 246 HE22 GLN 29 2HE2 GLN 29 -11.348 -3.788 -26.889 247 H LEU 30 H LEU 30 -7.331 -7.864 -27.358 248 HA LEU 30 HA LEU 30 -5.478 -5.895 -26.443 249 HB2 LEU 30 2HB LEU 30 -7.103 -7.984 -25.307 250 HB3 LEU 30 3HB LEU 30 -5.478 -8.024 -24.626 251 HG LEU 30 HG LEU 30 -5.694 -5.772 -23.824 252 HD11 LEU 30 1HD1 LEU 30 -7.904 -5.692 -25.731 253 HD12 LEU 30 2HD1 LEU 30 -6.900 -4.388 -25.098 254 HD13 LEU 30 3HD1 LEU 30 -8.283 -4.967 -24.169 255 HD21 LEU 30 1HD2 LEU 30 -6.560 -7.367 -22.305 256 HD22 LEU 30 2HD2 LEU 30 -8.059 -7.533 -23.220 257 HD23 LEU 30 3HD2 LEU 30 -7.721 -6.040 -22.344 258 H ALA 31 H ALA 31 -5.247 -9.311 -27.322 259 HA ALA 31 HA ALA 31 -2.620 -9.792 -26.524 260 HB1 ALA 31 1HB ALA 31 -4.540 -11.043 -28.357 261 HB2 ALA 31 2HB ALA 31 -2.844 -11.362 -28.727 262 HB3 ALA 31 3HB ALA 31 -3.492 -11.768 -27.138 263 H LYS 32 H LYS 32 -3.877 -8.459 -29.553 264 HA LYS 32 HA LYS 32 -1.477 -8.374 -30.984 265 HB2 LYS 32 2HB LYS 32 -3.941 -6.638 -31.112 266 HB3 LYS 32 3HB LYS 32 -2.602 -6.474 -32.240 267 HG2 LYS 32 2HG LYS 32 -3.132 -8.362 -33.359 268 HG3 LYS 32 3HG LYS 32 -3.711 -9.189 -31.912 269 HD2 LYS 32 2HD LYS 32 -5.690 -8.869 -33.025 270 HD3 LYS 32 3HD LYS 32 -5.632 -7.395 -32.056 271 HE2 LYS 32 2HE LYS 32 -6.205 -6.689 -34.224 272 HE3 LYS 32 3HE LYS 32 -4.491 -6.313 -34.054 273 HZ1 LYS 32 1HZ LYS 32 -4.094 -7.531 -35.840 274 HZ2 LYS 32 2HZ LYS 32 -5.734 -7.919 -35.984 275 HZ3 LYS 32 3HZ LYS 32 -4.709 -8.906 -35.069 276 H LYS 33 H LYS 33 -2.731 -6.305 -28.478 277 HA LYS 33 HA LYS 33 -0.957 -4.119 -28.932 278 HB2 LYS 33 2HB LYS 33 -2.485 -4.913 -26.446 279 HB3 LYS 33 3HB LYS 33 -1.668 -3.373 -26.684 280 HG2 LYS 33 2HG LYS 33 -3.156 -2.888 -28.572 281 HG3 LYS 33 3HG LYS 33 -3.989 -4.420 -28.294 282 HD2 LYS 33 2HD LYS 33 -5.084 -3.645 -26.467 283 HD3 LYS 33 3HD LYS 33 -3.736 -2.625 -25.960 284 HE2 LYS 33 2HE LYS 33 -5.668 -1.285 -26.629 285 HE3 LYS 33 3HE LYS 33 -4.293 -1.008 -27.697 286 HZ1 LYS 33 1HZ LYS 33 -5.369 -1.877 -29.446 287 HZ2 LYS 33 2HZ LYS 33 -6.764 -1.536 -28.553 288 HZ3 LYS 33 3HZ LYS 33 -6.113 -3.098 -28.541 289 H TYR 34 H TYR 34 -0.843 -7.035 -26.974 290 HA TYR 34 HA TYR 34 1.799 -6.258 -25.959 291 HB2 TYR 34 2HB TYR 34 -0.052 -8.488 -25.088 292 HB3 TYR 34 3HB TYR 34 1.513 -8.131 -24.365 293 HD1 TYR 34 HD1 TYR 34 1.829 -6.052 -23.064 294 HD2 TYR 34 HD2 TYR 34 -1.988 -7.182 -24.566 295 HE1 TYR 34 HE1 TYR 34 0.758 -4.465 -21.520 296 HE2 TYR 34 HE2 TYR 34 -3.070 -5.598 -23.027 297 HH TYR 34 HH TYR 34 -2.691 -4.377 -21.075 298 H HIS 35 H HIS 35 1.140 -7.262 -28.706 299 HA HIS 35 HA HIS 35 2.084 -9.914 -28.978 300 HB2 HIS 35 2HB HIS 35 1.309 -7.729 -30.736 301 HB3 HIS 35 3HB HIS 35 2.681 -8.630 -31.374 302 HD1 HIS 35 HD1 HIS 35 0.015 -10.354 -29.386 303 HD2 HIS 35 HD2 HIS 35 1.150 -9.862 -33.353 304 HE1 HIS 35 HE1 HIS 35 -1.349 -12.019 -30.687 305 HA PRO 36 HA PRO 36 6.451 -9.579 -28.755 306 HB2 PRO 36 2HB PRO 36 7.270 -11.226 -30.753 307 HB3 PRO 36 3HB PRO 36 6.555 -11.821 -29.250 308 HG2 PRO 36 2HG PRO 36 5.277 -11.423 -31.928 309 HG3 PRO 36 3HG PRO 36 5.104 -12.777 -30.795 310 HD2 PRO 36 2HD PRO 36 3.256 -10.809 -31.008 311 HD3 PRO 36 3HD PRO 36 3.590 -11.644 -29.477 312 H ASP 37 H ASP 37 4.800 -8.571 -31.573 313 HA ASP 37 HA ASP 37 7.083 -7.687 -33.061 314 HB2 ASP 37 2HB ASP 37 4.166 -6.922 -33.319 315 HB3 ASP 37 3HB ASP 37 5.429 -6.543 -34.488 316 H THR 38 H THR 38 5.183 -6.409 -30.491 317 HA THR 38 HA THR 38 6.324 -3.729 -30.889 318 HB THR 38 HB THR 38 4.618 -2.840 -29.506 319 HG1 THR 38 HG1 THR 38 4.475 -5.450 -28.572 320 HG21 THR 38 1HG2 THR 38 4.018 -4.207 -31.826 321 HG22 THR 38 2HG2 THR 38 2.963 -3.060 -31.000 322 HG23 THR 38 3HG2 THR 38 2.802 -4.788 -30.689 323 H ASN 39 H ASN 39 7.135 -6.475 -29.385 324 HA ASN 39 HA ASN 39 7.797 -5.457 -26.772 325 HB2 ASN 39 2HB ASN 39 8.099 -8.050 -28.205 326 HB3 ASN 39 3HB ASN 39 9.198 -7.730 -26.866 327 HD21 ASN 39 1HD2 ASN 39 5.811 -6.821 -27.311 328 HD22 ASN 39 2HD2 ASN 39 5.223 -7.651 -25.915 329 H LYS 40 H LYS 40 9.072 -4.910 -29.736 330 HA LYS 40 HA LYS 40 11.803 -5.259 -29.562 331 HB2 LYS 40 2HB LYS 40 9.998 -3.455 -31.030 332 HB3 LYS 40 3HB LYS 40 11.638 -2.849 -30.837 333 HG2 LYS 40 2HG LYS 40 11.984 -3.994 -32.739 334 HG3 LYS 40 3HG LYS 40 12.173 -5.356 -31.633 335 HD2 LYS 40 2HD LYS 40 9.422 -4.723 -32.535 336 HD3 LYS 40 3HD LYS 40 10.520 -5.413 -33.732 337 HE2 LYS 40 2HE LYS 40 10.511 -6.728 -31.096 338 HE3 LYS 40 3HE LYS 40 9.021 -6.877 -32.025 339 HZ1 LYS 40 1HZ LYS 40 10.921 -7.400 -33.866 340 HZ2 LYS 40 2HZ LYS 40 10.061 -8.574 -33.005 341 HZ3 LYS 40 3HZ LYS 40 11.592 -8.090 -32.475 342 H ASP 41 H ASP 41 9.821 -2.662 -28.219 343 HA ASP 41 HA ASP 41 12.189 -1.726 -26.733 344 HB2 ASP 41 2HB ASP 41 9.780 -0.110 -27.597 345 HB3 ASP 41 3HB ASP 41 11.149 0.500 -26.671 346 H ASP 42 H ASP 42 9.951 -3.743 -26.174 347 HA ASP 42 HA ASP 42 9.514 -2.880 -23.432 348 HB2 ASP 42 2HB ASP 42 7.531 -2.273 -25.111 349 HB3 ASP 42 3HB ASP 42 7.099 -3.954 -24.806 350 HA PRO 43 HA PRO 43 10.601 -7.344 -23.827 351 HB2 PRO 43 2HB PRO 43 12.290 -7.340 -21.702 352 HB3 PRO 43 3HB PRO 43 12.795 -6.875 -23.331 353 HG2 PRO 43 2HG PRO 43 12.037 -5.137 -21.014 354 HG3 PRO 43 3HG PRO 43 13.376 -4.951 -22.162 355 HD2 PRO 43 2HD PRO 43 11.073 -3.542 -22.370 356 HD3 PRO 43 3HD PRO 43 12.022 -4.035 -23.787 357 H LYS 44 H LYS 44 9.034 -5.369 -21.575 358 HA LYS 44 HA LYS 44 8.473 -7.557 -19.720 359 HB2 LYS 44 2HB LYS 44 8.226 -4.598 -19.636 360 HB3 LYS 44 3HB LYS 44 7.053 -5.520 -18.705 361 HG2 LYS 44 2HG LYS 44 8.711 -6.469 -17.347 362 HG3 LYS 44 3HG LYS 44 10.004 -5.997 -18.451 363 HD2 LYS 44 2HD LYS 44 8.283 -3.931 -17.127 364 HD3 LYS 44 3HD LYS 44 9.661 -4.638 -16.280 365 HE2 LYS 44 2HE LYS 44 9.883 -3.405 -19.016 366 HE3 LYS 44 3HE LYS 44 10.088 -2.475 -17.532 367 HZ1 LYS 44 1HZ LYS 44 12.161 -3.421 -18.630 368 HZ2 LYS 44 2HZ LYS 44 11.659 -4.925 -18.041 369 HZ3 LYS 44 3HZ LYS 44 11.991 -3.663 -16.964 370 H ALA 45 H ALA 45 7.111 -5.962 -22.414 371 HA ALA 45 HA ALA 45 4.376 -6.165 -21.947 372 HB1 ALA 45 1HB ALA 45 6.075 -6.111 -24.388 373 HB2 ALA 45 2HB ALA 45 4.372 -6.542 -24.556 374 HB3 ALA 45 3HB ALA 45 4.823 -4.988 -23.855 375 H LYS 46 H LYS 46 6.701 -8.606 -22.914 376 HA LYS 46 HA LYS 46 4.974 -10.606 -23.796 377 HB2 LYS 46 2HB LYS 46 6.780 -12.185 -23.165 378 HB3 LYS 46 3HB LYS 46 7.367 -10.803 -24.081 379 HG2 LYS 46 2HG LYS 46 7.967 -9.757 -21.855 380 HG3 LYS 46 3HG LYS 46 7.661 -11.343 -21.142 381 HD2 LYS 46 2HD LYS 46 10.011 -11.154 -21.587 382 HD3 LYS 46 3HD LYS 46 9.320 -12.305 -22.733 383 HE2 LYS 46 2HE LYS 46 9.637 -10.925 -24.518 384 HE3 LYS 46 3HE LYS 46 9.444 -9.459 -23.559 385 HZ1 LYS 46 1HZ LYS 46 11.704 -10.443 -22.543 386 HZ2 LYS 46 2HZ LYS 46 11.656 -9.336 -23.821 387 HZ3 LYS 46 3HZ LYS 46 11.837 -10.988 -24.139 388 H GLU 47 H GLU 47 6.046 -9.806 -20.519 389 HA GLU 47 HA GLU 47 4.816 -11.990 -19.225 390 HB2 GLU 47 2HB GLU 47 6.576 -10.555 -18.213 391 HB3 GLU 47 3HB GLU 47 5.403 -9.251 -18.090 392 HG2 GLU 47 2HG GLU 47 5.798 -10.546 -15.988 393 HG3 GLU 47 3HG GLU 47 4.115 -10.430 -16.500 394 H LYS 48 H LYS 48 3.671 -8.776 -20.088 395 HA LYS 48 HA LYS 48 1.215 -8.947 -18.658 396 HB2 LYS 48 2HB LYS 48 1.852 -7.214 -21.050 397 HB3 LYS 48 3HB LYS 48 0.575 -6.952 -19.869 398 HG2 LYS 48 2HG LYS 48 3.540 -6.810 -19.363 399 HG3 LYS 48 3HG LYS 48 2.415 -5.452 -19.450 400 HD2 LYS 48 2HD LYS 48 1.236 -6.282 -17.488 401 HD3 LYS 48 3HD LYS 48 2.308 -7.683 -17.418 402 HE2 LYS 48 2HE LYS 48 3.370 -6.354 -15.909 403 HE3 LYS 48 3HE LYS 48 4.157 -5.775 -17.376 404 HZ1 LYS 48 1HZ LYS 48 1.714 -4.391 -16.818 405 HZ2 LYS 48 2HZ LYS 48 3.257 -3.771 -17.129 406 HZ3 LYS 48 3HZ LYS 48 2.835 -4.240 -15.559 407 H PHE 49 H PHE 49 2.235 -9.782 -21.913 408 HA PHE 49 HA PHE 49 -0.276 -10.140 -23.089 409 HB2 PHE 49 2HB PHE 49 1.678 -10.119 -24.477 410 HB3 PHE 49 3HB PHE 49 2.372 -11.491 -23.619 411 HD1 PHE 49 HD1 PHE 49 -0.045 -10.422 -26.130 412 HD2 PHE 49 HD2 PHE 49 1.571 -13.745 -24.018 413 HE1 PHE 49 HE1 PHE 49 -1.065 -11.952 -27.765 414 HE2 PHE 49 HE2 PHE 49 0.555 -15.281 -25.650 415 HZ PHE 49 HZ PHE 49 -0.764 -14.385 -27.527 416 H SER 50 H SER 50 1.584 -12.189 -20.956 417 HA SER 50 HA SER 50 0.101 -14.574 -21.386 418 HB2 SER 50 2HB SER 50 2.419 -14.349 -20.323 419 HB3 SER 50 3HB SER 50 1.577 -13.881 -18.846 420 HG SER 50 HG SER 50 0.779 -15.873 -18.645 421 H GLN 51 H GLN 51 -0.282 -11.811 -19.273 422 HA GLN 51 HA GLN 51 -2.141 -12.894 -17.470 423 HB2 GLN 51 2HB GLN 51 -1.697 -10.064 -18.421 424 HB3 GLN 51 3HB GLN 51 -2.832 -10.482 -17.144 425 HG2 GLN 51 2HG GLN 51 -1.171 -11.042 -15.659 426 HG3 GLN 51 3HG GLN 51 0.001 -11.378 -16.932 427 HE21 GLN 51 1HE2 GLN 51 1.143 -9.998 -15.174 428 HE22 GLN 51 2HE2 GLN 51 1.202 -8.304 -15.506 429 H LEU 52 H LEU 52 -2.500 -11.589 -20.695 430 HA LEU 52 HA LEU 52 -5.288 -11.221 -20.695 431 HB2 LEU 52 2HB LEU 52 -3.608 -12.028 -23.058 432 HB3 LEU 52 3HB LEU 52 -5.138 -11.153 -23.077 433 HG LEU 52 HG LEU 52 -2.706 -9.975 -21.776 434 HD11 LEU 52 1HD1 LEU 52 -3.399 -9.348 -24.608 435 HD12 LEU 52 2HD1 LEU 52 -2.389 -10.748 -24.249 436 HD13 LEU 52 3HD1 LEU 52 -1.874 -9.138 -23.748 437 HD21 LEU 52 1HD2 LEU 52 -5.417 -9.155 -22.366 438 HD22 LEU 52 2HD2 LEU 52 -4.234 -8.039 -23.050 439 HD23 LEU 52 3HD2 LEU 52 -4.211 -8.400 -21.324 440 H ALA 53 H ALA 53 -3.318 -13.981 -21.779 441 HA ALA 53 HA ALA 53 -5.512 -15.624 -22.475 442 HB1 ALA 53 1HB ALA 53 -3.131 -17.073 -21.633 443 HB2 ALA 53 2HB ALA 53 -3.938 -17.031 -23.201 444 HB3 ALA 53 3HB ALA 53 -2.783 -15.770 -22.770 445 H GLU 54 H GLU 54 -3.771 -15.087 -19.481 446 HA GLU 54 HA GLU 54 -4.737 -17.325 -18.061 447 HB2 GLU 54 2HB GLU 54 -3.470 -14.731 -17.342 448 HB3 GLU 54 3HB GLU 54 -4.306 -15.605 -16.066 449 HG2 GLU 54 2HG GLU 54 -2.887 -17.483 -16.294 450 HG3 GLU 54 3HG GLU 54 -2.201 -16.866 -17.796 451 H ALA 55 H ALA 55 -5.862 -13.950 -18.155 452 HA ALA 55 HA ALA 55 -8.121 -14.433 -16.486 453 HB1 ALA 55 1HB ALA 55 -6.996 -12.166 -17.964 454 HB2 ALA 55 2HB ALA 55 -8.754 -12.148 -17.819 455 HB3 ALA 55 3HB ALA 55 -7.751 -12.224 -16.371 456 H TYR 56 H TYR 56 -7.626 -14.245 -19.980 457 HA TYR 56 HA TYR 56 -10.322 -14.348 -20.753 458 HB2 TYR 56 2HB TYR 56 -8.776 -13.729 -22.421 459 HB3 TYR 56 3HB TYR 56 -7.763 -15.138 -22.128 460 HD1 TYR 56 HD1 TYR 56 -10.868 -13.941 -23.693 461 HD2 TYR 56 HD2 TYR 56 -8.266 -17.262 -23.140 462 HE1 TYR 56 HE1 TYR 56 -12.018 -15.136 -25.508 463 HE2 TYR 56 HE2 TYR 56 -9.408 -18.466 -24.955 464 HH TYR 56 HH TYR 56 -11.460 -18.482 -26.148 465 H GLU 57 H GLU 57 -8.138 -16.804 -19.644 466 HA GLU 57 HA GLU 57 -9.379 -19.089 -20.679 467 HB2 GLU 57 2HB GLU 57 -7.433 -18.478 -18.593 468 HB3 GLU 57 3HB GLU 57 -8.437 -19.865 -18.194 469 HG2 GLU 57 2HG GLU 57 -7.853 -20.657 -20.591 470 HG3 GLU 57 3HG GLU 57 -6.526 -19.504 -20.457 471 H VAL 58 H VAL 58 -9.911 -17.380 -17.610 472 HA VAL 58 HA VAL 58 -12.017 -19.127 -16.774 473 HB VAL 58 HB VAL 58 -11.431 -16.350 -15.745 474 HG11 VAL 58 1HG1 VAL 58 -12.768 -16.821 -13.958 475 HG12 VAL 58 2HG1 VAL 58 -13.587 -17.786 -15.188 476 HG13 VAL 58 3HG1 VAL 58 -12.477 -18.557 -14.054 477 HG21 VAL 58 1HG2 VAL 58 -10.120 -17.586 -13.979 478 HG22 VAL 58 2HG2 VAL 58 -10.193 -19.001 -15.030 479 HG23 VAL 58 3HG2 VAL 58 -9.382 -17.535 -15.581 480 H LEU 59 H LEU 59 -11.874 -15.891 -18.211 481 HA LEU 59 HA LEU 59 -14.685 -15.463 -18.171 482 HB2 LEU 59 2HB LEU 59 -12.313 -14.088 -19.143 483 HB3 LEU 59 3HB LEU 59 -13.696 -13.896 -20.219 484 HG LEU 59 HG LEU 59 -14.995 -12.900 -18.457 485 HD11 LEU 59 1HD1 LEU 59 -14.264 -14.173 -16.563 486 HD12 LEU 59 2HD1 LEU 59 -13.971 -12.465 -16.237 487 HD13 LEU 59 3HD1 LEU 59 -12.632 -13.518 -16.693 488 HD21 LEU 59 1HD2 LEU 59 -13.567 -11.393 -19.690 489 HD22 LEU 59 2HD2 LEU 59 -12.214 -11.741 -18.613 490 HD23 LEU 59 3HD2 LEU 59 -13.634 -10.891 -18.001 491 H SER 60 H SER 60 -12.753 -17.485 -20.020 492 HA SER 60 HA SER 60 -14.144 -17.320 -22.510 493 HB2 SER 60 2HB SER 60 -11.936 -18.186 -22.609 494 HB3 SER 60 3HB SER 60 -12.254 -19.354 -21.326 495 HG SER 60 HG SER 60 -12.262 -20.185 -23.545 496 H ASP 61 H ASP 61 -14.947 -18.603 -19.508 497 HA ASP 61 HA ASP 61 -17.173 -20.090 -20.706 498 HB2 ASP 61 2HB ASP 61 -15.084 -21.473 -19.734 499 HB3 ASP 61 3HB ASP 61 -15.992 -21.250 -18.241 500 H GLU 62 H GLU 62 -19.074 -19.570 -19.836 501 HA GLU 62 HA GLU 62 -19.401 -17.522 -17.996 502 HB2 GLU 62 2HB GLU 62 -21.389 -19.745 -18.468 503 HB3 GLU 62 3HB GLU 62 -21.732 -18.104 -17.936 504 HG2 GLU 62 2HG GLU 62 -20.877 -17.287 -20.125 505 HG3 GLU 62 3HG GLU 62 -20.744 -18.967 -20.642 506 H VAL 63 H VAL 63 -19.358 -21.018 -17.480 507 HA VAL 63 HA VAL 63 -20.091 -21.005 -14.766 508 HB VAL 63 HB VAL 63 -18.266 -23.004 -16.102 509 HG11 VAL 63 1HG1 VAL 63 -18.563 -24.348 -14.317 510 HG12 VAL 63 2HG1 VAL 63 -18.906 -22.831 -13.484 511 HG13 VAL 63 3HG1 VAL 63 -20.232 -23.834 -14.074 512 HG21 VAL 63 1HG2 VAL 63 -19.956 -23.548 -17.437 513 HG22 VAL 63 2HG2 VAL 63 -20.892 -23.992 -16.010 514 HG23 VAL 63 3HG2 VAL 63 -21.005 -22.359 -16.665 515 H LYS 64 H LYS 64 -16.869 -21.119 -16.279 516 HA LYS 64 HA LYS 64 -15.392 -21.076 -13.891 517 HB2 LYS 64 2HB LYS 64 -14.728 -20.248 -16.711 518 HB3 LYS 64 3HB LYS 64 -13.551 -20.140 -15.408 519 HG2 LYS 64 2HG LYS 64 -14.300 -22.672 -15.065 520 HG3 LYS 64 3HG LYS 64 -14.647 -22.515 -16.789 521 HD2 LYS 64 2HD LYS 64 -12.411 -23.308 -16.591 522 HD3 LYS 64 3HD LYS 64 -12.319 -21.613 -17.072 523 HE2 LYS 64 2HE LYS 64 -10.803 -21.548 -15.389 524 HE3 LYS 64 3HE LYS 64 -12.254 -21.302 -14.420 525 HZ1 LYS 64 1HZ LYS 64 -11.394 -24.053 -14.920 526 HZ2 LYS 64 2HZ LYS 64 -12.147 -23.388 -13.559 527 HZ3 LYS 64 3HZ LYS 64 -10.494 -23.137 -13.817 528 H ARG 65 H ARG 65 -16.505 -18.452 -15.997 529 HA ARG 65 HA ARG 65 -15.240 -16.355 -14.597 530 HB2 ARG 65 2HB ARG 65 -16.077 -16.057 -16.865 531 HB3 ARG 65 3HB ARG 65 -17.726 -16.328 -16.317 532 HG2 ARG 65 2HG ARG 65 -17.618 -14.294 -14.971 533 HG3 ARG 65 3HG ARG 65 -15.961 -14.024 -15.514 534 HD2 ARG 65 2HD ARG 65 -17.371 -12.649 -16.847 535 HD3 ARG 65 3HD ARG 65 -16.838 -13.988 -17.862 536 HE ARG 65 HE ARG 65 -19.362 -14.458 -16.575 537 HH11 ARG 65 1HH1 ARG 65 -17.779 -13.039 -19.332 538 HH12 ARG 65 2HH1 ARG 65 -19.179 -13.135 -20.349 539 HH21 ARG 65 1HH2 ARG 65 -21.211 -14.589 -17.903 540 HH22 ARG 65 2HH2 ARG 65 -21.131 -14.015 -19.535 541 H LYS 66 H LYS 66 -18.543 -17.656 -14.409 542 HA LYS 66 HA LYS 66 -19.474 -15.894 -12.425 543 HB2 LYS 66 2HB LYS 66 -20.339 -18.665 -13.241 544 HB3 LYS 66 3HB LYS 66 -21.174 -17.746 -11.996 545 HG2 LYS 66 2HG LYS 66 -20.760 -16.747 -14.803 546 HG3 LYS 66 3HG LYS 66 -22.195 -17.630 -14.274 547 HD2 LYS 66 2HD LYS 66 -22.980 -15.885 -13.035 548 HD3 LYS 66 3HD LYS 66 -21.363 -15.280 -12.664 549 HE2 LYS 66 2HE LYS 66 -22.313 -13.677 -14.099 550 HE3 LYS 66 3HE LYS 66 -21.216 -14.615 -15.111 551 HZ1 LYS 66 1HZ LYS 66 -23.250 -14.314 -16.284 552 HZ2 LYS 66 2HZ LYS 66 -24.169 -14.863 -14.975 553 HZ3 LYS 66 3HZ LYS 66 -23.172 -15.938 -15.818 554 H GLN 67 H GLN 67 -18.010 -19.117 -12.200 555 HA GLN 67 HA GLN 67 -18.265 -19.467 -9.440 556 HB2 GLN 67 2HB GLN 67 -16.367 -20.544 -11.497 557 HB3 GLN 67 3HB GLN 67 -16.121 -20.911 -9.794 558 HG2 GLN 67 2HG GLN 67 -18.545 -21.568 -11.451 559 HG3 GLN 67 3HG GLN 67 -17.339 -22.697 -10.835 560 HE21 GLN 67 1HE2 GLN 67 -20.142 -20.834 -10.122 561 HE22 GLN 67 2HE2 GLN 67 -20.405 -21.439 -8.525 562 H TYR 68 H TYR 68 -15.625 -18.027 -11.326 563 HA TYR 68 HA TYR 68 -13.905 -17.507 -9.169 564 HB2 TYR 68 2HB TYR 68 -13.034 -17.408 -11.396 565 HB3 TYR 68 3HB TYR 68 -14.197 -16.172 -11.862 566 HD1 TYR 68 HD1 TYR 68 -11.229 -16.812 -9.735 567 HD2 TYR 68 HD2 TYR 68 -13.718 -13.883 -11.559 568 HE1 TYR 68 HE1 TYR 68 -9.601 -15.066 -9.139 569 HE2 TYR 68 HE2 TYR 68 -12.096 -12.129 -10.970 570 HH TYR 68 HH TYR 68 -8.954 -12.877 -9.719 571 H ASP 69 H ASP 69 -16.598 -15.700 -10.513 572 HA ASP 69 HA ASP 69 -16.148 -13.256 -9.197 573 HB2 ASP 69 2HB ASP 69 -18.465 -14.571 -10.516 574 HB3 ASP 69 3HB ASP 69 -18.819 -13.235 -9.424 575 H ALA 70 H ALA 70 -17.600 -16.255 -8.148 576 HA ALA 70 HA ALA 70 -18.963 -15.340 -5.875 577 HB1 ALA 70 1HB ALA 70 -18.361 -17.836 -7.060 578 HB2 ALA 70 2HB ALA 70 -17.890 -17.927 -5.363 579 HB3 ALA 70 3HB ALA 70 -19.539 -17.479 -5.796 580 H TYR 71 H TYR 71 -15.585 -15.900 -6.465 581 HA TYR 71 HA TYR 71 -14.995 -15.458 -3.617 582 HB2 TYR 71 2HB TYR 71 -13.934 -17.288 -5.511 583 HB3 TYR 71 3HB TYR 71 -12.653 -16.149 -5.111 584 HD1 TYR 71 HD1 TYR 71 -11.278 -16.728 -3.358 585 HD2 TYR 71 HD2 TYR 71 -15.304 -18.103 -3.332 586 HE1 TYR 71 HE1 TYR 71 -10.841 -17.949 -1.268 587 HE2 TYR 71 HE2 TYR 71 -14.879 -19.326 -1.241 588 HH TYR 71 HH TYR 71 -13.204 -19.097 0.718 589 H GLY 72 H GLY 72 -14.955 -13.987 -6.668 590 HA2 GLY 72 2HA GLY 72 -12.742 -12.197 -6.118 591 HA3 GLY 72 3HA GLY 72 -13.789 -12.163 -7.529 592 H SER 73 H SER 73 -12.921 -9.914 -5.965 593 HA SER 73 HA SER 73 -15.315 -9.089 -4.510 594 HB2 SER 73 2HB SER 73 -12.568 -7.868 -4.802 595 HB3 SER 73 3HB SER 73 -13.900 -7.038 -3.998 596 HG SER 73 HG SER 73 -14.004 -8.765 -2.525 Start of MODEL 6 1 H1 HIS 1 H HIS 1 -5.741 5.339 1.390 2 HA HIS 1 HA HIS 1 -6.420 4.156 3.772 3 HB2 HIS 1 2HB HIS 1 -8.173 4.691 1.368 4 HB3 HIS 1 3HB HIS 1 -8.791 4.263 2.961 5 HD1 HIS 1 HD1 HIS 1 -6.439 6.170 4.289 6 HD2 HIS 1 HD2 HIS 1 -9.460 7.208 1.632 7 HE1 HIS 1 HE1 HIS 1 -6.782 8.643 4.593 8 H MET 2 H MET 2 -7.703 2.861 0.716 9 HA MET 2 HA MET 2 -7.261 0.152 1.789 10 HB2 MET 2 2HB MET 2 -9.623 1.319 0.349 11 HB3 MET 2 3HB MET 2 -9.301 -0.408 0.279 12 HG2 MET 2 2HG MET 2 -10.761 -0.276 2.040 13 HG3 MET 2 3HG MET 2 -9.205 -0.231 2.864 14 HE1 MET 2 1HE MET 2 -11.838 0.410 4.071 15 HE2 MET 2 2HE MET 2 -12.064 2.086 4.569 16 HE3 MET 2 3HE MET 2 -12.675 1.541 3.007 17 H LEU 3 H LEU 3 -6.262 -1.290 0.498 18 HA LEU 3 HA LEU 3 -5.054 -0.342 -1.927 19 HB2 LEU 3 2HB LEU 3 -4.898 -2.808 -0.274 20 HB3 LEU 3 3HB LEU 3 -4.361 -2.895 -1.950 21 HG LEU 3 HG LEU 3 -2.485 -2.525 -0.451 22 HD11 LEU 3 1HD1 LEU 3 -2.860 0.101 -1.816 23 HD12 LEU 3 2HD1 LEU 3 -2.775 -1.377 -2.774 24 HD13 LEU 3 3HD1 LEU 3 -1.430 -0.927 -1.725 25 HD21 LEU 3 1HD2 LEU 3 -2.281 -0.644 0.964 26 HD22 LEU 3 2HD2 LEU 3 -3.880 -1.319 1.280 27 HD23 LEU 3 3HD2 LEU 3 -3.713 0.123 0.277 28 H ALA 4 H ALA 4 -5.582 -0.794 -3.994 29 HA ALA 4 HA ALA 4 -8.169 -1.979 -4.495 30 HB1 ALA 4 1HB ALA 4 -6.205 -0.975 -6.543 31 HB2 ALA 4 2HB ALA 4 -7.950 -1.171 -6.715 32 HB3 ALA 4 3HB ALA 4 -7.303 0.080 -5.653 33 H LYS 5 H LYS 5 -8.483 -3.618 -6.179 34 HA LYS 5 HA LYS 5 -6.261 -5.555 -6.252 35 HB2 LYS 5 2HB LYS 5 -7.938 -7.346 -6.247 36 HB3 LYS 5 3HB LYS 5 -8.068 -6.344 -4.808 37 HG2 LYS 5 2HG LYS 5 -10.122 -5.600 -5.347 38 HG3 LYS 5 3HG LYS 5 -9.767 -5.543 -7.075 39 HD2 LYS 5 2HD LYS 5 -11.117 -7.337 -7.188 40 HD3 LYS 5 3HD LYS 5 -9.709 -8.223 -6.600 41 HE2 LYS 5 2HE LYS 5 -10.630 -7.534 -4.251 42 HE3 LYS 5 3HE LYS 5 -12.147 -7.328 -5.125 43 HZ1 LYS 5 1HZ LYS 5 -10.986 -9.777 -5.866 44 HZ2 LYS 5 2HZ LYS 5 -12.453 -9.504 -5.070 45 HZ3 LYS 5 3HZ LYS 5 -11.030 -9.695 -4.176 46 H GLU 6 H GLU 6 -6.530 -7.172 -8.087 47 HA GLU 6 HA GLU 6 -7.429 -5.739 -10.500 48 HB2 GLU 6 2HB GLU 6 -5.129 -7.662 -10.134 49 HB3 GLU 6 3HB GLU 6 -5.693 -7.103 -11.702 50 HG2 GLU 6 2HG GLU 6 -3.958 -5.666 -11.315 51 HG3 GLU 6 3HG GLU 6 -5.316 -4.736 -10.682 52 H ASP 7 H ASP 7 -8.820 -6.727 -11.843 53 HA ASP 7 HA ASP 7 -9.464 -9.553 -11.308 54 HB2 ASP 7 2HB ASP 7 -11.479 -7.582 -12.357 55 HB3 ASP 7 3HB ASP 7 -11.760 -9.139 -11.583 56 H TYR 8 H TYR 8 -10.081 -10.835 -13.092 57 HA TYR 8 HA TYR 8 -8.594 -10.547 -15.397 58 HB2 TYR 8 2HB TYR 8 -11.206 -12.036 -15.064 59 HB3 TYR 8 3HB TYR 8 -10.068 -12.268 -16.386 60 HD1 TYR 8 HD1 TYR 8 -11.189 -14.094 -13.957 61 HD2 TYR 8 HD2 TYR 8 -7.494 -12.210 -14.907 62 HE1 TYR 8 HE1 TYR 8 -9.993 -15.779 -12.622 63 HE2 TYR 8 HE2 TYR 8 -6.288 -13.889 -13.575 64 HH TYR 8 HH TYR 8 -7.543 -15.710 -11.339 65 H TYR 9 H TYR 9 -11.802 -9.338 -14.673 66 HA TYR 9 HA TYR 9 -12.751 -8.705 -17.182 67 HB2 TYR 9 2HB TYR 9 -13.038 -7.067 -14.655 68 HB3 TYR 9 3HB TYR 9 -14.051 -6.921 -16.087 69 HD1 TYR 9 HD1 TYR 9 -13.420 -8.773 -13.044 70 HD2 TYR 9 HD2 TYR 9 -15.564 -8.799 -16.719 71 HE1 TYR 9 HE1 TYR 9 -14.923 -10.503 -12.149 72 HE2 TYR 9 HE2 TYR 9 -17.073 -10.528 -15.834 73 HH TYR 9 HH TYR 9 -17.842 -11.340 -13.618 74 H GLN 10 H GLN 10 -10.515 -6.863 -15.149 75 HA GLN 10 HA GLN 10 -10.302 -4.685 -16.997 76 HB2 GLN 10 2HB GLN 10 -8.527 -5.446 -14.671 77 HB3 GLN 10 3HB GLN 10 -8.473 -3.917 -15.538 78 HG2 GLN 10 2HG GLN 10 -11.000 -4.834 -14.233 79 HG3 GLN 10 3HG GLN 10 -9.729 -4.055 -13.291 80 HE21 GLN 10 1HE2 GLN 10 -12.517 -3.507 -14.882 81 HE22 GLN 10 2HE2 GLN 10 -12.319 -1.836 -15.275 82 H ILE 11 H ILE 11 -8.484 -7.618 -16.341 83 HA ILE 11 HA ILE 11 -6.209 -7.009 -17.893 84 HB ILE 11 HB ILE 11 -7.382 -9.718 -17.255 85 HG12 ILE 11 2HG1 ILE 11 -5.111 -8.290 -15.869 86 HG13 ILE 11 3HG1 ILE 11 -6.778 -8.200 -15.310 87 HG21 ILE 11 1HG2 ILE 11 -5.011 -8.867 -18.747 88 HG22 ILE 11 2HG2 ILE 11 -4.691 -10.061 -17.490 89 HG23 ILE 11 3HG2 ILE 11 -5.867 -10.408 -18.757 90 HD11 ILE 11 1HD1 ILE 11 -6.706 -10.240 -14.402 91 HD12 ILE 11 2HD1 ILE 11 -5.787 -10.919 -15.746 92 HD13 ILE 11 3HD1 ILE 11 -4.958 -10.020 -14.476 93 H LEU 12 H LEU 12 -9.381 -8.186 -18.713 94 HA LEU 12 HA LEU 12 -8.539 -8.729 -21.467 95 HB2 LEU 12 2HB LEU 12 -10.837 -9.539 -19.776 96 HB3 LEU 12 3HB LEU 12 -11.116 -9.388 -21.509 97 HG LEU 12 HG LEU 12 -8.911 -11.096 -20.387 98 HD11 LEU 12 1HD1 LEU 12 -11.049 -12.707 -21.266 99 HD12 LEU 12 2HD1 LEU 12 -11.722 -11.527 -20.141 100 HD13 LEU 12 3HD1 LEU 12 -10.389 -12.565 -19.636 101 HD21 LEU 12 1HD2 LEU 12 -9.739 -12.229 -22.694 102 HD22 LEU 12 2HD2 LEU 12 -8.436 -11.046 -22.586 103 HD23 LEU 12 3HD2 LEU 12 -10.062 -10.529 -23.035 104 H GLY 13 H GLY 13 -10.035 -6.342 -19.558 105 HA2 GLY 13 2HA GLY 13 -10.711 -4.216 -20.178 106 HA3 GLY 13 3HA GLY 13 -10.426 -4.654 -21.855 107 H VAL 14 H VAL 14 -12.483 -6.531 -19.740 108 HA VAL 14 HA VAL 14 -14.815 -5.606 -21.291 109 HB VAL 14 HB VAL 14 -15.804 -7.802 -21.042 110 HG11 VAL 14 1HG1 VAL 14 -13.860 -7.199 -22.763 111 HG12 VAL 14 2HG1 VAL 14 -13.079 -8.548 -21.935 112 HG13 VAL 14 3HG1 VAL 14 -14.638 -8.781 -22.727 113 HG21 VAL 14 1HG2 VAL 14 -14.197 -9.637 -20.137 114 HG22 VAL 14 2HG2 VAL 14 -13.425 -8.292 -19.298 115 HG23 VAL 14 3HG2 VAL 14 -15.125 -8.655 -19.003 116 HA PRO 15 HA PRO 15 -16.783 -4.409 -17.551 117 HB2 PRO 15 2HB PRO 15 -19.385 -4.858 -18.181 118 HB3 PRO 15 3HB PRO 15 -18.449 -3.522 -18.860 119 HG2 PRO 15 2HG PRO 15 -19.099 -6.183 -20.066 120 HG3 PRO 15 3HG PRO 15 -19.126 -4.578 -20.818 121 HD2 PRO 15 2HD PRO 15 -17.079 -6.315 -21.167 122 HD3 PRO 15 3HD PRO 15 -16.845 -4.556 -21.149 123 H ARG 16 H ARG 16 -18.504 -5.201 -15.951 124 HA ARG 16 HA ARG 16 -17.813 -7.887 -15.189 125 HB2 ARG 16 2HB ARG 16 -19.746 -5.940 -13.917 126 HB3 ARG 16 3HB ARG 16 -19.171 -7.437 -13.193 127 HG2 ARG 16 2HG ARG 16 -17.756 -5.984 -12.184 128 HG3 ARG 16 3HG ARG 16 -16.816 -6.310 -13.641 129 HD2 ARG 16 2HD ARG 16 -17.265 -4.257 -14.555 130 HD3 ARG 16 3HD ARG 16 -18.797 -4.092 -13.698 131 HE ARG 16 HE ARG 16 -16.908 -4.001 -11.733 132 HH11 ARG 16 1HH1 ARG 16 -17.482 -2.226 -14.673 133 HH12 ARG 16 2HH1 ARG 16 -16.780 -0.758 -14.077 134 HH21 ARG 16 1HH2 ARG 16 -15.981 -2.074 -10.938 135 HH22 ARG 16 2HH2 ARG 16 -15.926 -0.673 -11.953 136 H ASN 17 H ASN 17 -20.136 -6.573 -17.196 137 HA ASN 17 HA ASN 17 -21.941 -8.865 -16.781 138 HB2 ASN 17 2HB ASN 17 -23.665 -7.437 -17.942 139 HB3 ASN 17 3HB ASN 17 -23.153 -6.843 -16.365 140 HD21 ASN 17 1HD2 ASN 17 -23.634 -4.726 -16.716 141 HD22 ASN 17 2HD2 ASN 17 -22.799 -3.734 -17.857 142 H ALA 18 H ALA 18 -19.466 -8.031 -18.622 143 HA ALA 18 HA ALA 18 -20.279 -8.196 -21.281 144 HB1 ALA 18 1HB ALA 18 -17.771 -9.556 -20.891 145 HB2 ALA 18 2HB ALA 18 -18.098 -7.999 -21.653 146 HB3 ALA 18 3HB ALA 18 -17.848 -8.092 -19.910 147 H SER 19 H SER 19 -19.988 -10.005 -22.790 148 HA SER 19 HA SER 19 -20.888 -12.526 -21.569 149 HB2 SER 19 2HB SER 19 -21.611 -12.981 -24.033 150 HB3 SER 19 3HB SER 19 -22.573 -11.878 -23.050 151 HG SER 19 HG SER 19 -21.599 -11.330 -25.351 152 H GLN 20 H GLN 20 -20.284 -14.509 -22.894 153 HA GLN 20 HA GLN 20 -17.487 -14.770 -22.933 154 HB2 GLN 20 2HB GLN 20 -19.403 -16.592 -24.379 155 HB3 GLN 20 3HB GLN 20 -17.839 -16.999 -23.684 156 HG2 GLN 20 2HG GLN 20 -20.417 -16.426 -22.266 157 HG3 GLN 20 3HG GLN 20 -19.440 -17.893 -22.225 158 HE21 GLN 20 1HE2 GLN 20 -17.344 -17.756 -21.184 159 HE22 GLN 20 2HE2 GLN 20 -17.129 -16.665 -19.862 160 H LYS 21 H LYS 21 -19.759 -13.823 -25.370 161 HA LYS 21 HA LYS 21 -18.011 -14.289 -27.599 162 HB2 LYS 21 2HB LYS 21 -20.548 -12.663 -27.361 163 HB3 LYS 21 3HB LYS 21 -19.709 -12.986 -28.872 164 HG2 LYS 21 2HG LYS 21 -20.105 -15.364 -28.616 165 HG3 LYS 21 3HG LYS 21 -20.885 -15.083 -27.057 166 HD2 LYS 21 2HD LYS 21 -22.684 -15.272 -28.517 167 HD3 LYS 21 3HD LYS 21 -22.461 -13.526 -28.388 168 HE2 LYS 21 2HE LYS 21 -22.662 -13.789 -30.665 169 HE3 LYS 21 3HE LYS 21 -20.912 -13.861 -30.462 170 HZ1 LYS 21 1HZ LYS 21 -21.618 -15.622 -31.901 171 HZ2 LYS 21 2HZ LYS 21 -22.754 -16.169 -30.774 172 HZ3 LYS 21 3HZ LYS 21 -21.100 -16.304 -30.441 173 H GLU 22 H GLU 22 -18.980 -11.478 -25.677 174 HA GLU 22 HA GLU 22 -17.561 -9.558 -27.188 175 HB2 GLU 22 2HB GLU 22 -19.319 -8.859 -25.692 176 HB3 GLU 22 3HB GLU 22 -18.476 -9.545 -24.310 177 HG2 GLU 22 2HG GLU 22 -18.215 -7.170 -24.281 178 HG3 GLU 22 3HG GLU 22 -16.659 -7.909 -24.653 179 H ILE 23 H ILE 23 -16.619 -11.779 -24.684 180 HA ILE 23 HA ILE 23 -14.175 -10.493 -23.981 181 HB ILE 23 HB ILE 23 -15.007 -13.376 -23.637 182 HG12 ILE 23 2HG1 ILE 23 -14.866 -11.407 -21.400 183 HG13 ILE 23 3HG1 ILE 23 -16.240 -11.314 -22.498 184 HG21 ILE 23 1HG2 ILE 23 -12.487 -12.081 -23.226 185 HG22 ILE 23 2HG2 ILE 23 -13.143 -12.614 -21.679 186 HG23 ILE 23 3HG2 ILE 23 -12.922 -13.773 -22.989 187 HD11 ILE 23 1HD1 ILE 23 -15.991 -14.014 -21.839 188 HD12 ILE 23 2HD1 ILE 23 -15.753 -13.127 -20.334 189 HD13 ILE 23 3HD1 ILE 23 -17.218 -12.877 -21.283 190 H LYS 24 H LYS 24 -15.100 -12.911 -26.354 191 HA LYS 24 HA LYS 24 -12.557 -13.820 -27.084 192 HB2 LYS 24 2HB LYS 24 -15.235 -13.751 -28.373 193 HB3 LYS 24 3HB LYS 24 -13.851 -14.042 -29.419 194 HG2 LYS 24 2HG LYS 24 -13.195 -15.910 -27.894 195 HG3 LYS 24 3HG LYS 24 -14.726 -15.674 -27.048 196 HD2 LYS 24 2HD LYS 24 -15.289 -17.333 -28.543 197 HD3 LYS 24 3HD LYS 24 -15.746 -15.888 -29.447 198 HE2 LYS 24 2HE LYS 24 -13.756 -15.978 -30.749 199 HE3 LYS 24 3HE LYS 24 -13.061 -17.224 -29.714 200 HZ1 LYS 24 1HZ LYS 24 -15.375 -17.512 -31.549 201 HZ2 LYS 24 2HZ LYS 24 -14.900 -18.697 -30.439 202 HZ3 LYS 24 3HZ LYS 24 -13.858 -18.248 -31.694 203 H LYS 25 H LYS 25 -14.436 -11.049 -28.220 204 HA LYS 25 HA LYS 25 -12.555 -10.281 -30.225 205 HB2 LYS 25 2HB LYS 25 -14.823 -8.792 -28.898 206 HB3 LYS 25 3HB LYS 25 -13.857 -8.122 -30.207 207 HG2 LYS 25 2HG LYS 25 -14.615 -9.807 -31.721 208 HG3 LYS 25 3HG LYS 25 -15.424 -10.682 -30.419 209 HD2 LYS 25 2HD LYS 25 -16.808 -8.575 -30.074 210 HD3 LYS 25 3HD LYS 25 -16.159 -8.023 -31.620 211 HE2 LYS 25 2HE LYS 25 -17.394 -10.732 -31.438 212 HE3 LYS 25 3HE LYS 25 -18.440 -9.314 -31.502 213 HZ1 LYS 25 1HZ LYS 25 -16.870 -8.729 -33.506 214 HZ2 LYS 25 2HZ LYS 25 -18.210 -9.741 -33.708 215 HZ3 LYS 25 3HZ LYS 25 -16.663 -10.408 -33.553 216 H ALA 26 H ALA 26 -13.291 -9.082 -26.960 217 HA ALA 26 HA ALA 26 -11.382 -7.031 -26.899 218 HB1 ALA 26 1HB ALA 26 -12.039 -8.511 -24.401 219 HB2 ALA 26 2HB ALA 26 -11.922 -6.774 -24.689 220 HB3 ALA 26 3HB ALA 26 -13.333 -7.669 -25.255 221 H TYR 27 H TYR 27 -11.107 -10.471 -26.360 222 HA TYR 27 HA TYR 27 -8.536 -10.392 -25.126 223 HB2 TYR 27 2HB TYR 27 -9.904 -12.317 -24.739 224 HB3 TYR 27 3HB TYR 27 -10.087 -12.610 -26.465 225 HD1 TYR 27 HD1 TYR 27 -7.212 -12.117 -24.117 226 HD2 TYR 27 HD2 TYR 27 -8.952 -14.465 -27.209 227 HE1 TYR 27 HE1 TYR 27 -5.266 -13.620 -24.062 228 HE2 TYR 27 HE2 TYR 27 -7.011 -15.976 -27.162 229 HH TYR 27 HH TYR 27 -5.207 -16.594 -25.254 230 H TYR 28 H TYR 28 -9.698 -10.648 -28.427 231 HA TYR 28 HA TYR 28 -7.146 -11.291 -29.554 232 HB2 TYR 28 2HB TYR 28 -9.171 -11.942 -30.720 233 HB3 TYR 28 3HB TYR 28 -9.691 -10.264 -30.825 234 HD1 TYR 28 HD1 TYR 28 -9.520 -9.373 -32.937 235 HD2 TYR 28 HD2 TYR 28 -6.579 -12.171 -31.663 236 HE1 TYR 28 HE1 TYR 28 -8.379 -9.153 -35.105 237 HE2 TYR 28 HE2 TYR 28 -5.430 -11.958 -33.827 238 HH TYR 28 HH TYR 28 -5.806 -11.264 -36.051 239 H GLN 29 H GLN 29 -9.114 -8.336 -29.380 240 HA GLN 29 HA GLN 29 -7.366 -6.653 -30.771 241 HB2 GLN 29 2HB GLN 29 -8.635 -4.846 -29.931 242 HB3 GLN 29 3HB GLN 29 -9.766 -6.186 -30.071 243 HG2 GLN 29 2HG GLN 29 -9.608 -6.604 -27.691 244 HG3 GLN 29 3HG GLN 29 -8.410 -5.321 -27.527 245 HE21 GLN 29 1HE2 GLN 29 -9.747 -4.265 -26.028 246 HE22 GLN 29 2HE2 GLN 29 -11.138 -3.373 -26.533 247 H LEU 30 H LEU 30 -7.411 -7.681 -27.419 248 HA LEU 30 HA LEU 30 -5.473 -5.796 -26.509 249 HB2 LEU 30 2HB LEU 30 -7.048 -7.937 -25.402 250 HB3 LEU 30 3HB LEU 30 -5.383 -8.037 -24.834 251 HG LEU 30 HG LEU 30 -5.514 -5.847 -23.870 252 HD11 LEU 30 1HD1 LEU 30 -8.104 -4.980 -24.016 253 HD12 LEU 30 2HD1 LEU 30 -7.819 -5.598 -25.643 254 HD13 LEU 30 3HD1 LEU 30 -6.760 -4.357 -24.973 255 HD21 LEU 30 1HD2 LEU 30 -8.059 -7.314 -23.193 256 HD22 LEU 30 2HD2 LEU 30 -7.151 -6.212 -22.157 257 HD23 LEU 30 3HD2 LEU 30 -6.459 -7.772 -22.606 258 H ALA 31 H ALA 31 -5.344 -9.153 -27.612 259 HA ALA 31 HA ALA 31 -2.676 -9.704 -27.020 260 HB1 ALA 31 1HB ALA 31 -3.047 -11.145 -29.278 261 HB2 ALA 31 2HB ALA 31 -3.634 -11.627 -27.685 262 HB3 ALA 31 3HB ALA 31 -4.718 -10.818 -28.817 263 H LYS 32 H LYS 32 -4.115 -8.124 -29.833 264 HA LYS 32 HA LYS 32 -1.810 -7.987 -31.427 265 HB2 LYS 32 2HB LYS 32 -4.291 -6.284 -31.286 266 HB3 LYS 32 3HB LYS 32 -3.010 -5.965 -32.447 267 HG2 LYS 32 2HG LYS 32 -3.543 -7.740 -33.732 268 HG3 LYS 32 3HG LYS 32 -4.012 -8.736 -32.352 269 HD2 LYS 32 2HD LYS 32 -6.033 -8.363 -33.438 270 HD3 LYS 32 3HD LYS 32 -6.030 -7.129 -32.176 271 HE2 LYS 32 2HE LYS 32 -5.317 -5.453 -33.756 272 HE3 LYS 32 3HE LYS 32 -5.141 -6.668 -35.021 273 HZ1 LYS 32 1HZ LYS 32 -7.394 -6.855 -35.283 274 HZ2 LYS 32 2HZ LYS 32 -7.273 -5.215 -34.890 275 HZ3 LYS 32 3HZ LYS 32 -7.750 -6.333 -33.713 276 H LYS 33 H LYS 33 -2.757 -6.218 -28.623 277 HA LYS 33 HA LYS 33 -1.001 -3.982 -29.089 278 HB2 LYS 33 2HB LYS 33 -2.421 -4.852 -26.565 279 HB3 LYS 33 3HB LYS 33 -1.615 -3.308 -26.807 280 HG2 LYS 33 2HG LYS 33 -3.207 -2.774 -28.598 281 HG3 LYS 33 3HG LYS 33 -4.031 -4.307 -28.303 282 HD2 LYS 33 2HD LYS 33 -5.063 -3.536 -26.457 283 HD3 LYS 33 3HD LYS 33 -3.642 -2.640 -25.916 284 HE2 LYS 33 2HE LYS 33 -5.168 -0.958 -26.390 285 HE3 LYS 33 3HE LYS 33 -4.200 -1.036 -27.862 286 HZ1 LYS 33 1HZ LYS 33 -6.897 -2.196 -27.432 287 HZ2 LYS 33 2HZ LYS 33 -5.950 -2.502 -28.800 288 HZ3 LYS 33 3HZ LYS 33 -6.482 -0.929 -28.474 289 H TYR 34 H TYR 34 -0.909 -6.997 -27.283 290 HA TYR 34 HA TYR 34 1.796 -6.357 -26.340 291 HB2 TYR 34 2HB TYR 34 -0.076 -8.584 -25.510 292 HB3 TYR 34 3HB TYR 34 1.515 -8.281 -24.821 293 HD1 TYR 34 HD1 TYR 34 1.900 -6.283 -23.425 294 HD2 TYR 34 HD2 TYR 34 -1.975 -7.263 -24.883 295 HE1 TYR 34 HE1 TYR 34 0.901 -4.752 -21.780 296 HE2 TYR 34 HE2 TYR 34 -2.985 -5.734 -23.242 297 HH TYR 34 HH TYR 34 -2.525 -4.631 -21.227 298 H HIS 35 H HIS 35 0.945 -7.235 -29.102 299 HA HIS 35 HA HIS 35 1.797 -9.883 -29.548 300 HB2 HIS 35 2HB HIS 35 1.054 -7.577 -31.161 301 HB3 HIS 35 3HB HIS 35 2.361 -8.501 -31.896 302 HD1 HIS 35 HD1 HIS 35 0.690 -9.218 -33.782 303 HD2 HIS 35 HD2 HIS 35 -0.290 -10.561 -29.974 304 HE1 HIS 35 HE1 HIS 35 -1.045 -11.006 -34.125 305 HA PRO 36 HA PRO 36 6.179 -9.734 -29.474 306 HB2 PRO 36 2HB PRO 36 6.859 -11.297 -31.587 307 HB3 PRO 36 3HB PRO 36 6.173 -11.946 -30.092 308 HG2 PRO 36 2HG PRO 36 4.820 -11.351 -32.695 309 HG3 PRO 36 3HG PRO 36 4.630 -12.757 -31.632 310 HD2 PRO 36 2HD PRO 36 2.859 -10.710 -31.669 311 HD3 PRO 36 3HD PRO 36 3.212 -11.641 -30.199 312 H ASP 37 H ASP 37 4.567 -8.806 -32.427 313 HA ASP 37 HA ASP 37 6.762 -7.871 -33.896 314 HB2 ASP 37 2HB ASP 37 4.993 -6.329 -34.956 315 HB3 ASP 37 3HB ASP 37 4.750 -8.069 -35.090 316 H THR 38 H THR 38 5.212 -6.607 -31.107 317 HA THR 38 HA THR 38 6.583 -4.024 -31.450 318 HB THR 38 HB THR 38 5.035 -3.029 -29.953 319 HG1 THR 38 HG1 THR 38 4.638 -5.650 -29.149 320 HG21 THR 38 1HG2 THR 38 3.358 -2.960 -31.430 321 HG22 THR 38 2HG2 THR 38 2.951 -4.653 -31.153 322 HG23 THR 38 3HG2 THR 38 4.207 -4.227 -32.315 323 H ASN 39 H ASN 39 7.239 -6.883 -30.181 324 HA ASN 39 HA ASN 39 8.087 -6.062 -27.533 325 HB2 ASN 39 2HB ASN 39 7.967 -8.626 -29.041 326 HB3 ASN 39 3HB ASN 39 9.164 -8.497 -27.756 327 HD21 ASN 39 1HD2 ASN 39 5.909 -7.140 -28.004 328 HD22 ASN 39 2HD2 ASN 39 5.286 -7.924 -26.596 329 H LYS 40 H LYS 40 9.289 -5.653 -30.567 330 HA LYS 40 HA LYS 40 11.957 -6.348 -30.506 331 HB2 LYS 40 2HB LYS 40 10.810 -3.796 -31.652 332 HB3 LYS 40 3HB LYS 40 12.336 -4.544 -32.105 333 HG2 LYS 40 2HG LYS 40 9.579 -5.667 -32.552 334 HG3 LYS 40 3HG LYS 40 10.672 -5.016 -33.775 335 HD2 LYS 40 2HD LYS 40 11.222 -7.189 -34.051 336 HD3 LYS 40 3HD LYS 40 12.263 -6.886 -32.657 337 HE2 LYS 40 2HE LYS 40 10.946 -8.082 -31.245 338 HE3 LYS 40 3HE LYS 40 9.461 -7.656 -32.094 339 HZ1 LYS 40 1HZ LYS 40 9.918 -9.983 -32.374 340 HZ2 LYS 40 2HZ LYS 40 11.471 -9.661 -32.962 341 HZ3 LYS 40 3HZ LYS 40 10.115 -9.206 -33.864 342 H ASP 41 H ASP 41 10.381 -3.525 -29.085 343 HA ASP 41 HA ASP 41 12.910 -2.904 -27.702 344 HB2 ASP 41 2HB ASP 41 11.862 -1.212 -29.408 345 HB3 ASP 41 3HB ASP 41 10.756 -0.855 -28.084 346 H ASP 42 H ASP 42 10.448 -4.616 -27.052 347 HA ASP 42 HA ASP 42 10.219 -3.682 -24.299 348 HB2 ASP 42 2HB ASP 42 8.244 -2.927 -25.926 349 HB3 ASP 42 3HB ASP 42 7.672 -4.555 -25.573 350 HA PRO 43 HA PRO 43 10.880 -8.234 -24.630 351 HB2 PRO 43 2HB PRO 43 12.634 -8.345 -22.561 352 HB3 PRO 43 3HB PRO 43 13.123 -7.960 -24.215 353 HG2 PRO 43 2HG PRO 43 12.606 -6.116 -21.915 354 HG3 PRO 43 3HG PRO 43 13.917 -6.076 -23.108 355 HD2 PRO 43 2HD PRO 43 11.747 -4.465 -23.273 356 HD3 PRO 43 3HD PRO 43 12.598 -5.070 -24.709 357 H LYS 44 H LYS 44 9.577 -6.081 -22.375 358 HA LYS 44 HA LYS 44 8.886 -8.168 -20.450 359 HB2 LYS 44 2HB LYS 44 8.899 -5.198 -20.436 360 HB3 LYS 44 3HB LYS 44 7.679 -5.992 -19.448 361 HG2 LYS 44 2HG LYS 44 9.293 -7.057 -18.119 362 HG3 LYS 44 3HG LYS 44 10.587 -6.710 -19.268 363 HD2 LYS 44 2HD LYS 44 10.358 -4.313 -18.782 364 HD3 LYS 44 3HD LYS 44 9.086 -4.679 -17.613 365 HE2 LYS 44 2HE LYS 44 10.557 -5.596 -16.100 366 HE3 LYS 44 3HE LYS 44 11.732 -6.027 -17.342 367 HZ1 LYS 44 1HZ LYS 44 12.710 -4.252 -16.250 368 HZ2 LYS 44 2HZ LYS 44 11.258 -3.401 -16.083 369 HZ3 LYS 44 3HZ LYS 44 12.007 -3.507 -17.596 370 H ALA 45 H ALA 45 7.563 -6.467 -23.115 371 HA ALA 45 HA ALA 45 4.837 -6.478 -22.544 372 HB1 ALA 45 1HB ALA 45 6.428 -6.538 -25.064 373 HB2 ALA 45 2HB ALA 45 4.682 -6.777 -25.141 374 HB3 ALA 45 3HB ALA 45 5.339 -5.295 -24.446 375 H LYS 46 H LYS 46 6.936 -9.051 -23.696 376 HA LYS 46 HA LYS 46 5.021 -10.905 -24.503 377 HB2 LYS 46 2HB LYS 46 6.743 -12.615 -24.070 378 HB3 LYS 46 3HB LYS 46 7.392 -11.227 -24.935 379 HG2 LYS 46 2HG LYS 46 8.149 -10.368 -22.663 380 HG3 LYS 46 3HG LYS 46 7.792 -11.989 -22.061 381 HD2 LYS 46 2HD LYS 46 10.118 -11.903 -22.612 382 HD3 LYS 46 3HD LYS 46 9.310 -12.894 -23.828 383 HE2 LYS 46 2HE LYS 46 9.645 -11.373 -25.487 384 HE3 LYS 46 3HE LYS 46 9.560 -9.995 -24.390 385 HZ1 LYS 46 1HZ LYS 46 11.766 -9.972 -24.803 386 HZ2 LYS 46 2HZ LYS 46 11.852 -11.625 -25.150 387 HZ3 LYS 46 3HZ LYS 46 11.799 -11.100 -23.543 388 H GLU 47 H GLU 47 6.316 -10.216 -21.289 389 HA GLU 47 HA GLU 47 5.066 -12.363 -19.951 390 HB2 GLU 47 2HB GLU 47 5.967 -9.669 -18.919 391 HB3 GLU 47 3HB GLU 47 5.456 -11.003 -17.895 392 HG2 GLU 47 2HG GLU 47 7.313 -12.303 -19.224 393 HG3 GLU 47 3HG GLU 47 7.940 -10.677 -19.491 394 H LYS 48 H LYS 48 4.009 -9.109 -20.755 395 HA LYS 48 HA LYS 48 1.643 -9.162 -19.171 396 HB2 LYS 48 2HB LYS 48 2.205 -7.477 -21.616 397 HB3 LYS 48 3HB LYS 48 1.013 -7.152 -20.365 398 HG2 LYS 48 2HG LYS 48 4.006 -7.128 -20.039 399 HG3 LYS 48 3HG LYS 48 2.932 -5.727 -20.065 400 HD2 LYS 48 2HD LYS 48 1.847 -6.499 -18.028 401 HD3 LYS 48 3HD LYS 48 2.860 -7.944 -18.017 402 HE2 LYS 48 2HE LYS 48 4.056 -6.647 -16.575 403 HE3 LYS 48 3HE LYS 48 4.795 -6.138 -18.092 404 HZ1 LYS 48 1HZ LYS 48 4.155 -4.289 -16.587 405 HZ2 LYS 48 2HZ LYS 48 2.532 -4.714 -16.806 406 HZ3 LYS 48 3HZ LYS 48 3.455 -4.191 -18.124 407 H PHE 49 H PHE 49 2.390 -9.972 -22.520 408 HA PHE 49 HA PHE 49 -0.212 -10.273 -23.486 409 HB2 PHE 49 2HB PHE 49 1.617 -10.267 -25.032 410 HB3 PHE 49 3HB PHE 49 2.359 -11.659 -24.252 411 HD1 PHE 49 HD1 PHE 49 -0.214 -10.522 -26.563 412 HD2 PHE 49 HD2 PHE 49 1.467 -13.897 -24.589 413 HE1 PHE 49 HE1 PHE 49 -1.388 -12.016 -28.125 414 HE2 PHE 49 HE2 PHE 49 0.296 -15.397 -26.149 415 HZ PHE 49 HZ PHE 49 -1.135 -14.457 -27.919 416 H SER 50 H SER 50 1.806 -12.431 -21.600 417 HA SER 50 HA SER 50 0.281 -14.780 -21.931 418 HB2 SER 50 2HB SER 50 2.204 -13.864 -19.797 419 HB3 SER 50 3HB SER 50 1.393 -15.427 -19.708 420 HG SER 50 HG SER 50 2.693 -16.161 -21.185 421 H GLN 51 H GLN 51 0.026 -12.065 -19.721 422 HA GLN 51 HA GLN 51 -1.781 -13.170 -17.886 423 HB2 GLN 51 2HB GLN 51 -1.427 -10.304 -18.777 424 HB3 GLN 51 3HB GLN 51 -2.393 -10.800 -17.394 425 HG2 GLN 51 2HG GLN 51 -0.573 -11.295 -16.118 426 HG3 GLN 51 3HG GLN 51 0.434 -11.691 -17.510 427 HE21 GLN 51 1HE2 GLN 51 1.662 -10.249 -15.733 428 HE22 GLN 51 2HE2 GLN 51 1.782 -8.587 -16.187 429 H LEU 52 H LEU 52 -2.237 -11.872 -21.084 430 HA LEU 52 HA LEU 52 -5.015 -11.414 -20.971 431 HB2 LEU 52 2HB LEU 52 -3.418 -12.248 -23.384 432 HB3 LEU 52 3HB LEU 52 -4.954 -11.385 -23.370 433 HG LEU 52 HG LEU 52 -2.451 -10.207 -22.194 434 HD11 LEU 52 1HD1 LEU 52 -3.419 -9.555 -24.946 435 HD12 LEU 52 2HD1 LEU 52 -2.306 -10.897 -24.683 436 HD13 LEU 52 3HD1 LEU 52 -1.841 -9.262 -24.215 437 HD21 LEU 52 1HD2 LEU 52 -3.892 -8.634 -21.575 438 HD22 LEU 52 2HD2 LEU 52 -5.204 -9.399 -22.472 439 HD23 LEU 52 3HD2 LEU 52 -4.125 -8.262 -23.283 440 H ALA 53 H ALA 53 -3.163 -14.222 -22.138 441 HA ALA 53 HA ALA 53 -5.396 -15.814 -22.778 442 HB1 ALA 53 1HB ALA 53 -2.731 -16.048 -23.171 443 HB2 ALA 53 2HB ALA 53 -2.980 -17.235 -21.890 444 HB3 ALA 53 3HB ALA 53 -3.886 -17.361 -23.398 445 H GLU 54 H GLU 54 -3.597 -15.347 -19.794 446 HA GLU 54 HA GLU 54 -4.677 -17.519 -18.356 447 HB2 GLU 54 2HB GLU 54 -3.435 -14.908 -17.523 448 HB3 GLU 54 3HB GLU 54 -4.062 -16.042 -16.335 449 HG2 GLU 54 2HG GLU 54 -2.077 -16.899 -18.405 450 HG3 GLU 54 3HG GLU 54 -1.569 -16.126 -16.904 451 H ALA 55 H ALA 55 -5.616 -14.088 -18.462 452 HA ALA 55 HA ALA 55 -7.875 -14.426 -16.761 453 HB1 ALA 55 1HB ALA 55 -8.077 -12.188 -16.874 454 HB2 ALA 55 2HB ALA 55 -6.475 -12.275 -17.606 455 HB3 ALA 55 3HB ALA 55 -7.906 -12.155 -18.629 456 H TYR 56 H TYR 56 -7.370 -14.533 -20.231 457 HA TYR 56 HA TYR 56 -10.121 -14.473 -20.952 458 HB2 TYR 56 2HB TYR 56 -8.596 -13.869 -22.652 459 HB3 TYR 56 3HB TYR 56 -7.614 -15.307 -22.399 460 HD1 TYR 56 HD1 TYR 56 -10.664 -13.979 -23.933 461 HD2 TYR 56 HD2 TYR 56 -8.262 -17.442 -23.350 462 HE1 TYR 56 HE1 TYR 56 -11.895 -15.127 -25.726 463 HE2 TYR 56 HE2 TYR 56 -9.486 -18.600 -25.142 464 HH TYR 56 HH TYR 56 -11.833 -18.389 -26.202 465 H GLU 57 H GLU 57 -7.941 -16.962 -19.910 466 HA GLU 57 HA GLU 57 -9.225 -19.230 -20.917 467 HB2 GLU 57 2HB GLU 57 -7.381 -18.669 -18.658 468 HB3 GLU 57 3HB GLU 57 -8.262 -20.189 -18.605 469 HG2 GLU 57 2HG GLU 57 -6.820 -19.419 -21.096 470 HG3 GLU 57 3HG GLU 57 -5.915 -20.057 -19.724 471 H VAL 58 H VAL 58 -9.658 -17.588 -17.789 472 HA VAL 58 HA VAL 58 -11.820 -19.287 -16.993 473 HB VAL 58 HB VAL 58 -10.949 -16.618 -15.874 474 HG11 VAL 58 1HG1 VAL 58 -12.224 -18.269 -13.950 475 HG12 VAL 58 2HG1 VAL 58 -12.737 -16.695 -14.561 476 HG13 VAL 58 3HG1 VAL 58 -13.272 -18.171 -15.365 477 HG21 VAL 58 1HG2 VAL 58 -10.300 -19.438 -15.022 478 HG22 VAL 58 2HG2 VAL 58 -9.182 -18.269 -15.723 479 HG23 VAL 58 3HG2 VAL 58 -9.869 -17.982 -14.125 480 H LEU 59 H LEU 59 -11.564 -16.007 -18.304 481 HA LEU 59 HA LEU 59 -14.334 -15.423 -18.170 482 HB2 LEU 59 2HB LEU 59 -11.957 -14.241 -19.494 483 HB3 LEU 59 3HB LEU 59 -13.543 -13.786 -20.113 484 HG LEU 59 HG LEU 59 -12.603 -12.181 -18.473 485 HD11 LEU 59 1HD1 LEU 59 -15.165 -13.614 -17.821 486 HD12 LEU 59 2HD1 LEU 59 -14.947 -12.136 -18.758 487 HD13 LEU 59 3HD1 LEU 59 -14.665 -12.125 -17.017 488 HD21 LEU 59 1HD2 LEU 59 -12.704 -12.867 -16.067 489 HD22 LEU 59 2HD2 LEU 59 -11.408 -13.620 -16.996 490 HD23 LEU 59 3HD2 LEU 59 -12.866 -14.536 -16.613 491 H SER 60 H SER 60 -12.580 -17.508 -20.146 492 HA SER 60 HA SER 60 -14.098 -17.242 -22.552 493 HB2 SER 60 2HB SER 60 -11.931 -18.188 -22.784 494 HB3 SER 60 3HB SER 60 -12.229 -19.372 -21.511 495 HG SER 60 HG SER 60 -13.371 -19.282 -24.103 496 H ASP 61 H ASP 61 -14.795 -18.538 -19.533 497 HA ASP 61 HA ASP 61 -17.134 -19.921 -20.631 498 HB2 ASP 61 2HB ASP 61 -15.042 -21.392 -19.782 499 HB3 ASP 61 3HB ASP 61 -15.888 -21.177 -18.252 500 H GLU 62 H GLU 62 -18.968 -19.374 -19.636 501 HA GLU 62 HA GLU 62 -19.097 -17.346 -17.731 502 HB2 GLU 62 2HB GLU 62 -21.486 -18.057 -17.446 503 HB3 GLU 62 3HB GLU 62 -20.999 -17.774 -19.112 504 HG2 GLU 62 2HG GLU 62 -20.721 -20.195 -19.422 505 HG3 GLU 62 3HG GLU 62 -21.273 -20.453 -17.768 506 H VAL 63 H VAL 63 -19.260 -20.857 -17.330 507 HA VAL 63 HA VAL 63 -19.881 -20.923 -14.602 508 HB VAL 63 HB VAL 63 -18.145 -22.923 -16.050 509 HG11 VAL 63 1HG1 VAL 63 -18.240 -23.186 -13.619 510 HG12 VAL 63 2HG1 VAL 63 -20.003 -23.222 -13.691 511 HG13 VAL 63 3HG1 VAL 63 -19.062 -24.511 -14.442 512 HG21 VAL 63 1HG2 VAL 63 -20.803 -23.826 -15.949 513 HG22 VAL 63 2HG2 VAL 63 -20.867 -22.170 -16.552 514 HG23 VAL 63 3HG2 VAL 63 -19.872 -23.371 -17.376 515 H LYS 64 H LYS 64 -16.708 -21.044 -16.211 516 HA LYS 64 HA LYS 64 -15.172 -21.134 -13.854 517 HB2 LYS 64 2HB LYS 64 -14.547 -20.254 -16.667 518 HB3 LYS 64 3HB LYS 64 -13.338 -20.217 -15.391 519 HG2 LYS 64 2HG LYS 64 -14.137 -22.729 -15.086 520 HG3 LYS 64 3HG LYS 64 -14.557 -22.526 -16.788 521 HD2 LYS 64 2HD LYS 64 -12.344 -23.377 -16.736 522 HD3 LYS 64 3HD LYS 64 -12.212 -21.664 -17.142 523 HE2 LYS 64 2HE LYS 64 -10.609 -21.771 -15.531 524 HE3 LYS 64 3HE LYS 64 -12.006 -21.448 -14.505 525 HZ1 LYS 64 1HZ LYS 64 -11.987 -24.155 -14.733 526 HZ2 LYS 64 2HZ LYS 64 -11.400 -23.274 -13.414 527 HZ3 LYS 64 3HZ LYS 64 -10.341 -23.776 -14.634 528 H ARG 65 H ARG 65 -16.133 -18.404 -15.918 529 HA ARG 65 HA ARG 65 -14.801 -16.392 -14.501 530 HB2 ARG 65 2HB ARG 65 -15.751 -16.042 -16.730 531 HB3 ARG 65 3HB ARG 65 -17.374 -16.220 -16.078 532 HG2 ARG 65 2HG ARG 65 -16.707 -14.234 -14.552 533 HG3 ARG 65 3HG ARG 65 -15.446 -13.966 -15.757 534 HD2 ARG 65 2HD ARG 65 -17.446 -12.638 -16.233 535 HD3 ARG 65 3HD ARG 65 -17.128 -13.814 -17.508 536 HE ARG 65 HE ARG 65 -18.974 -14.721 -15.490 537 HH11 ARG 65 1HH1 ARG 65 -18.606 -13.041 -18.517 538 HH12 ARG 65 2HH1 ARG 65 -20.236 -13.332 -19.026 539 HH21 ARG 65 1HH2 ARG 65 -21.122 -15.111 -16.149 540 HH22 ARG 65 2HH2 ARG 65 -21.667 -14.509 -17.678 541 H LYS 66 H LYS 66 -18.035 -17.762 -14.090 542 HA LYS 66 HA LYS 66 -18.828 -15.962 -12.032 543 HB2 LYS 66 2HB LYS 66 -19.873 -18.637 -12.946 544 HB3 LYS 66 3HB LYS 66 -20.591 -17.761 -11.601 545 HG2 LYS 66 2HG LYS 66 -20.316 -16.682 -14.398 546 HG3 LYS 66 3HG LYS 66 -21.776 -17.421 -13.737 547 HD2 LYS 66 2HD LYS 66 -21.836 -15.687 -11.989 548 HD3 LYS 66 3HD LYS 66 -20.408 -14.936 -12.705 549 HE2 LYS 66 2HE LYS 66 -21.566 -14.116 -14.489 550 HE3 LYS 66 3HE LYS 66 -22.732 -15.438 -14.480 551 HZ1 LYS 66 1HZ LYS 66 -23.603 -13.203 -13.795 552 HZ2 LYS 66 2HZ LYS 66 -22.673 -13.340 -12.389 553 HZ3 LYS 66 3HZ LYS 66 -23.901 -14.460 -12.702 554 H GLN 67 H GLN 67 -17.524 -19.260 -12.033 555 HA GLN 67 HA GLN 67 -17.661 -19.733 -9.283 556 HB2 GLN 67 2HB GLN 67 -15.899 -20.793 -11.470 557 HB3 GLN 67 3HB GLN 67 -15.633 -21.273 -9.799 558 HG2 GLN 67 2HG GLN 67 -18.170 -21.659 -11.371 559 HG3 GLN 67 3HG GLN 67 -16.986 -22.904 -10.977 560 HE21 GLN 67 1HE2 GLN 67 -19.569 -20.929 -9.805 561 HE22 GLN 67 2HE2 GLN 67 -19.764 -21.720 -8.281 562 H TYR 68 H TYR 68 -14.990 -18.413 -11.225 563 HA TYR 68 HA TYR 68 -13.203 -18.036 -9.087 564 HB2 TYR 68 2HB TYR 68 -13.429 -16.982 -11.869 565 HB3 TYR 68 3HB TYR 68 -12.322 -16.176 -10.763 566 HD1 TYR 68 HD1 TYR 68 -13.204 -19.686 -11.725 567 HD2 TYR 68 HD2 TYR 68 -10.132 -16.875 -10.849 568 HE1 TYR 68 HE1 TYR 68 -11.508 -21.407 -12.179 569 HE2 TYR 68 HE2 TYR 68 -8.427 -18.589 -11.302 570 HH TYR 68 HH TYR 68 -8.254 -20.709 -12.623 571 H ASP 69 H ASP 69 -15.762 -16.028 -10.406 572 HA ASP 69 HA ASP 69 -15.076 -13.687 -8.921 573 HB2 ASP 69 2HB ASP 69 -17.320 -14.546 -10.664 574 HB3 ASP 69 3HB ASP 69 -17.666 -13.267 -9.503 575 H ALA 70 H ALA 70 -16.946 -16.541 -8.288 576 HA ALA 70 HA ALA 70 -18.546 -15.590 -6.178 577 HB1 ALA 70 1HB ALA 70 -17.755 -18.344 -5.810 578 HB2 ALA 70 2HB ALA 70 -19.337 -17.668 -6.201 579 HB3 ALA 70 3HB ALA 70 -18.184 -18.015 -7.489 580 H TYR 71 H TYR 71 -15.205 -16.544 -6.330 581 HA TYR 71 HA TYR 71 -14.969 -16.535 -3.416 582 HB2 TYR 71 2HB TYR 71 -12.885 -17.151 -5.521 583 HB3 TYR 71 3HB TYR 71 -12.695 -17.362 -3.784 584 HD1 TYR 71 HD1 TYR 71 -14.620 -18.873 -2.690 585 HD2 TYR 71 HD2 TYR 71 -13.400 -19.021 -6.764 586 HE1 TYR 71 HE1 TYR 71 -15.508 -21.160 -2.867 587 HE2 TYR 71 HE2 TYR 71 -14.286 -21.308 -6.952 588 HH TYR 71 HH TYR 71 -15.160 -23.041 -5.852 589 H GLY 72 H GLY 72 -15.488 -14.101 -5.044 590 HA2 GLY 72 2HA GLY 72 -13.118 -12.541 -5.166 591 HA3 GLY 72 3HA GLY 72 -14.763 -11.926 -5.210 592 H SER 73 H SER 73 -12.085 -11.364 -3.681 593 HA SER 73 HA SER 73 -13.109 -11.421 -0.946 594 HB2 SER 73 2HB SER 73 -10.732 -12.116 -1.541 595 HB3 SER 73 3HB SER 73 -10.410 -10.410 -1.848 596 HG SER 73 HG SER 73 -9.861 -10.866 0.269 Start of MODEL 7 1 H1 HIS 1 H HIS 1 -3.261 -4.084 0.978 2 HA HIS 1 HA HIS 1 -0.716 -4.529 -0.147 3 HB2 HIS 1 2HB HIS 1 -2.009 -6.384 -1.253 4 HB3 HIS 1 3HB HIS 1 -2.993 -5.150 -2.035 5 HD1 HIS 1 HD1 HIS 1 0.787 -5.392 -1.645 6 HD2 HIS 1 HD2 HIS 1 -2.125 -5.083 -4.592 7 HE1 HIS 1 HE1 HIS 1 2.044 -5.195 -3.814 8 H MET 2 H MET 2 -0.084 -2.868 -1.593 9 HA MET 2 HA MET 2 -1.381 -0.389 -1.149 10 HB2 MET 2 2HB MET 2 0.779 -1.121 -3.134 11 HB3 MET 2 3HB MET 2 0.296 0.520 -2.725 12 HG2 MET 2 2HG MET 2 1.313 0.466 -0.689 13 HG3 MET 2 3HG MET 2 1.122 -1.278 -0.517 14 HE1 MET 2 1HE MET 2 4.763 0.962 -1.785 15 HE2 MET 2 2HE MET 2 3.151 1.653 -1.597 16 HE3 MET 2 3HE MET 2 3.948 0.885 -0.223 17 H LEU 3 H LEU 3 -1.002 -2.368 -4.088 18 HA LEU 3 HA LEU 3 -2.745 -0.692 -5.627 19 HB2 LEU 3 2HB LEU 3 -1.522 -3.396 -6.115 20 HB3 LEU 3 3HB LEU 3 -2.600 -2.616 -7.271 21 HG LEU 3 HG LEU 3 0.024 -1.462 -6.329 22 HD11 LEU 3 1HD1 LEU 3 -0.657 -2.930 -8.872 23 HD12 LEU 3 2HD1 LEU 3 0.421 -3.488 -7.593 24 HD13 LEU 3 3HD1 LEU 3 0.854 -2.077 -8.558 25 HD21 LEU 3 1HD2 LEU 3 -0.433 -0.171 -8.565 26 HD22 LEU 3 2HD2 LEU 3 -1.160 0.365 -7.050 27 HD23 LEU 3 3HD2 LEU 3 -2.113 -0.569 -8.203 28 H ALA 4 H ALA 4 -4.820 -1.175 -6.388 29 HA ALA 4 HA ALA 4 -6.399 -2.790 -4.559 30 HB1 ALA 4 1HB ALA 4 -6.895 -0.546 -6.354 31 HB2 ALA 4 2HB ALA 4 -8.161 -1.774 -6.398 32 HB3 ALA 4 3HB ALA 4 -7.721 -1.016 -4.868 33 H LYS 5 H LYS 5 -7.519 -4.615 -5.079 34 HA LYS 5 HA LYS 5 -6.591 -6.158 -7.284 35 HB2 LYS 5 2HB LYS 5 -7.511 -6.895 -4.937 36 HB3 LYS 5 3HB LYS 5 -9.067 -6.869 -5.756 37 HG2 LYS 5 2HG LYS 5 -8.599 -8.985 -6.283 38 HG3 LYS 5 3HG LYS 5 -7.544 -8.286 -7.514 39 HD2 LYS 5 2HD LYS 5 -6.416 -8.601 -4.792 40 HD3 LYS 5 3HD LYS 5 -6.691 -10.075 -5.722 41 HE2 LYS 5 2HE LYS 5 -5.196 -7.697 -6.805 42 HE3 LYS 5 3HE LYS 5 -4.406 -9.025 -5.957 43 HZ1 LYS 5 1HZ LYS 5 -5.544 -8.948 -8.628 44 HZ2 LYS 5 2HZ LYS 5 -5.816 -10.372 -7.757 45 HZ3 LYS 5 3HZ LYS 5 -4.235 -9.839 -8.034 46 H GLU 6 H GLU 6 -7.405 -6.397 -9.273 47 HA GLU 6 HA GLU 6 -9.966 -5.072 -9.868 48 HB2 GLU 6 2HB GLU 6 -7.817 -5.734 -11.875 49 HB3 GLU 6 3HB GLU 6 -9.177 -4.636 -12.067 50 HG2 GLU 6 2HG GLU 6 -7.991 -3.426 -10.025 51 HG3 GLU 6 3HG GLU 6 -6.578 -4.225 -10.713 52 H ASP 7 H ASP 7 -11.242 -6.038 -11.637 53 HA ASP 7 HA ASP 7 -11.262 -8.952 -11.366 54 HB2 ASP 7 2HB ASP 7 -13.372 -7.165 -12.589 55 HB3 ASP 7 3HB ASP 7 -13.545 -8.863 -12.152 56 H TYR 8 H TYR 8 -11.525 -10.318 -13.203 57 HA TYR 8 HA TYR 8 -9.781 -9.825 -15.302 58 HB2 TYR 8 2HB TYR 8 -12.163 -11.687 -15.376 59 HB3 TYR 8 3HB TYR 8 -10.712 -11.796 -16.367 60 HD1 TYR 8 HD1 TYR 8 -12.113 -13.733 -14.221 61 HD2 TYR 8 HD2 TYR 8 -8.651 -11.260 -14.255 62 HE1 TYR 8 HE1 TYR 8 -11.070 -15.179 -12.526 63 HE2 TYR 8 HE2 TYR 8 -7.598 -12.699 -12.562 64 HH TYR 8 HH TYR 8 -8.051 -15.416 -11.917 65 H TYR 9 H TYR 9 -13.168 -9.051 -14.973 66 HA TYR 9 HA TYR 9 -13.934 -8.642 -17.590 67 HB2 TYR 9 2HB TYR 9 -14.681 -6.945 -15.200 68 HB3 TYR 9 3HB TYR 9 -15.565 -7.028 -16.719 69 HD1 TYR 9 HD1 TYR 9 -15.000 -8.570 -13.504 70 HD2 TYR 9 HD2 TYR 9 -16.707 -9.163 -17.356 71 HE1 TYR 9 HE1 TYR 9 -16.323 -10.446 -12.622 72 HE2 TYR 9 HE2 TYR 9 -18.037 -11.040 -16.484 73 HH TYR 9 HH TYR 9 -17.589 -12.244 -13.212 74 H GLN 10 H GLN 10 -12.196 -6.428 -15.438 75 HA GLN 10 HA GLN 10 -12.063 -4.326 -17.377 76 HB2 GLN 10 2HB GLN 10 -10.523 -4.750 -14.811 77 HB3 GLN 10 3HB GLN 10 -10.485 -3.278 -15.773 78 HG2 GLN 10 2HG GLN 10 -12.983 -4.424 -14.550 79 HG3 GLN 10 3HG GLN 10 -11.981 -3.190 -13.787 80 HE21 GLN 10 1HE2 GLN 10 -14.031 -3.908 -16.536 81 HE22 GLN 10 2HE2 GLN 10 -14.412 -2.268 -16.922 82 H ILE 11 H ILE 11 -9.914 -6.904 -16.305 83 HA ILE 11 HA ILE 11 -7.586 -6.078 -17.629 84 HB ILE 11 HB ILE 11 -8.490 -8.899 -17.039 85 HG12 ILE 11 2HG1 ILE 11 -6.613 -7.155 -15.441 86 HG13 ILE 11 3HG1 ILE 11 -8.332 -7.290 -15.088 87 HG21 ILE 11 1HG2 ILE 11 -5.904 -9.185 -16.984 88 HG22 ILE 11 2HG2 ILE 11 -6.754 -9.196 -18.528 89 HG23 ILE 11 3HG2 ILE 11 -5.909 -7.742 -17.997 90 HD11 ILE 11 1HD1 ILE 11 -8.113 -9.324 -14.162 91 HD12 ILE 11 2HD1 ILE 11 -6.868 -9.831 -15.304 92 HD13 ILE 11 3HD1 ILE 11 -6.444 -8.803 -13.936 93 H LEU 12 H LEU 12 -10.505 -7.462 -18.825 94 HA LEU 12 HA LEU 12 -9.249 -7.980 -21.433 95 HB2 LEU 12 2HB LEU 12 -11.594 -9.127 -20.015 96 HB3 LEU 12 3HB LEU 12 -11.652 -9.044 -21.774 97 HG LEU 12 HG LEU 12 -9.455 -10.418 -20.234 98 HD11 LEU 12 1HD1 LEU 12 -10.924 -12.029 -19.799 99 HD12 LEU 12 2HD1 LEU 12 -10.973 -12.337 -21.535 100 HD13 LEU 12 3HD1 LEU 12 -12.164 -11.267 -20.795 101 HD21 LEU 12 1HD2 LEU 12 -8.513 -10.158 -22.272 102 HD22 LEU 12 2HD2 LEU 12 -10.064 -9.945 -23.085 103 HD23 LEU 12 3HD2 LEU 12 -9.507 -11.564 -22.657 104 H GLY 13 H GLY 13 -11.254 -5.825 -19.754 105 HA2 GLY 13 2HA GLY 13 -12.161 -3.827 -20.495 106 HA3 GLY 13 3HA GLY 13 -11.669 -4.250 -22.128 107 H VAL 14 H VAL 14 -13.545 -6.514 -20.304 108 HA VAL 14 HA VAL 14 -15.858 -5.917 -22.029 109 HB VAL 14 HB VAL 14 -16.532 -8.228 -21.795 110 HG11 VAL 14 1HG1 VAL 14 -13.639 -8.538 -22.388 111 HG12 VAL 14 2HG1 VAL 14 -15.047 -9.092 -23.296 112 HG13 VAL 14 3HG1 VAL 14 -14.565 -7.396 -23.361 113 HG21 VAL 14 1HG2 VAL 14 -15.798 -8.639 -19.522 114 HG22 VAL 14 2HG2 VAL 14 -15.117 -9.856 -20.601 115 HG23 VAL 14 3HG2 VAL 14 -14.110 -8.529 -20.021 116 HA PRO 15 HA PRO 15 -18.339 -4.939 -18.539 117 HB2 PRO 15 2HB PRO 15 -20.773 -5.783 -19.397 118 HB3 PRO 15 3HB PRO 15 -19.978 -4.338 -20.033 119 HG2 PRO 15 2HG PRO 15 -20.112 -7.094 -21.196 120 HG3 PRO 15 3HG PRO 15 -20.297 -5.527 -22.006 121 HD2 PRO 15 2HD PRO 15 -17.994 -6.949 -22.094 122 HD3 PRO 15 3HD PRO 15 -18.022 -5.175 -22.118 123 H ARG 16 H ARG 16 -20.068 -5.938 -17.075 124 HA ARG 16 HA ARG 16 -19.077 -8.478 -16.158 125 HB2 ARG 16 2HB ARG 16 -21.371 -6.790 -15.141 126 HB3 ARG 16 3HB ARG 16 -20.688 -8.186 -14.318 127 HG2 ARG 16 2HG ARG 16 -19.562 -6.564 -13.219 128 HG3 ARG 16 3HG ARG 16 -18.462 -6.756 -14.586 129 HD2 ARG 16 2HD ARG 16 -19.203 -4.814 -15.618 130 HD3 ARG 16 3HD ARG 16 -20.727 -4.809 -14.731 131 HE ARG 16 HE ARG 16 -19.699 -3.651 -13.048 132 HH11 ARG 16 1HH1 ARG 16 -17.271 -5.055 -15.109 133 HH12 ARG 16 2HH1 ARG 16 -15.955 -4.234 -14.338 134 HH21 ARG 16 1HH2 ARG 16 -17.975 -2.564 -12.024 135 HH22 ARG 16 2HH2 ARG 16 -16.356 -2.818 -12.583 136 H ASN 17 H ASN 17 -21.352 -7.567 -18.422 137 HA ASN 17 HA ASN 17 -22.868 -10.069 -18.074 138 HB2 ASN 17 2HB ASN 17 -24.611 -8.931 -19.510 139 HB3 ASN 17 3HB ASN 17 -24.380 -8.230 -17.911 140 HD21 ASN 17 1HD2 ASN 17 -24.942 -6.171 -18.267 141 HD22 ASN 17 2HD2 ASN 17 -24.165 -5.121 -19.398 142 H ALA 18 H ALA 18 -20.344 -8.947 -19.713 143 HA ALA 18 HA ALA 18 -20.797 -9.326 -22.417 144 HB1 ALA 18 1HB ALA 18 -18.541 -9.049 -20.719 145 HB2 ALA 18 2HB ALA 18 -18.240 -10.398 -21.814 146 HB3 ALA 18 3HB ALA 18 -18.642 -8.809 -22.463 147 H SER 19 H SER 19 -20.195 -11.136 -23.808 148 HA SER 19 HA SER 19 -20.949 -13.702 -22.581 149 HB2 SER 19 2HB SER 19 -21.038 -13.045 -25.527 150 HB3 SER 19 3HB SER 19 -21.837 -14.373 -24.686 151 HG SER 19 HG SER 19 -22.558 -11.699 -24.887 152 H GLN 20 H GLN 20 -19.975 -15.654 -23.592 153 HA GLN 20 HA GLN 20 -17.183 -15.582 -23.434 154 HB2 GLN 20 2HB GLN 20 -18.764 -17.708 -24.874 155 HB3 GLN 20 3HB GLN 20 -17.217 -17.883 -24.057 156 HG2 GLN 20 2HG GLN 20 -19.945 -17.581 -22.867 157 HG3 GLN 20 3HG GLN 20 -18.755 -18.856 -22.609 158 HE21 GLN 20 1HE2 GLN 20 -16.900 -18.381 -21.338 159 HE22 GLN 20 2HE2 GLN 20 -16.943 -17.120 -20.158 160 H LYS 21 H LYS 21 -19.333 -15.086 -26.107 161 HA LYS 21 HA LYS 21 -17.345 -15.474 -28.147 162 HB2 LYS 21 2HB LYS 21 -19.060 -14.565 -29.668 163 HB3 LYS 21 3HB LYS 21 -19.689 -15.862 -28.660 164 HG2 LYS 21 2HG LYS 21 -20.689 -14.169 -27.167 165 HG3 LYS 21 3HG LYS 21 -20.127 -12.908 -28.267 166 HD2 LYS 21 2HD LYS 21 -22.431 -13.377 -28.754 167 HD3 LYS 21 3HD LYS 21 -21.442 -13.991 -30.081 168 HE2 LYS 21 2HE LYS 21 -21.669 -16.230 -29.326 169 HE3 LYS 21 3HE LYS 21 -22.361 -15.713 -27.789 170 HZ1 LYS 21 1HZ LYS 21 -24.379 -15.270 -28.742 171 HZ2 LYS 21 2HZ LYS 21 -23.885 -16.581 -29.689 172 HZ3 LYS 21 3HZ LYS 21 -23.738 -15.004 -30.285 173 H GLU 22 H GLU 22 -18.798 -12.709 -26.492 174 HA GLU 22 HA GLU 22 -17.504 -10.722 -28.050 175 HB2 GLU 22 2HB GLU 22 -19.510 -10.229 -26.744 176 HB3 GLU 22 3HB GLU 22 -18.643 -10.573 -25.253 177 HG2 GLU 22 2HG GLU 22 -17.421 -8.625 -25.352 178 HG3 GLU 22 3HG GLU 22 -17.623 -8.462 -27.095 179 H ILE 23 H ILE 23 -16.653 -12.445 -25.108 180 HA ILE 23 HA ILE 23 -14.481 -10.863 -24.303 181 HB ILE 23 HB ILE 23 -14.899 -13.830 -23.922 182 HG12 ILE 23 2HG1 ILE 23 -15.310 -11.790 -21.781 183 HG13 ILE 23 3HG1 ILE 23 -16.552 -11.961 -23.017 184 HG21 ILE 23 1HG2 ILE 23 -12.568 -13.233 -23.598 185 HG22 ILE 23 2HG2 ILE 23 -13.034 -11.930 -22.507 186 HG23 ILE 23 3HG2 ILE 23 -13.325 -13.608 -22.050 187 HD11 ILE 23 1HD1 ILE 23 -15.998 -13.610 -20.729 188 HD12 ILE 23 2HD1 ILE 23 -17.398 -13.603 -21.802 189 HD13 ILE 23 3HD1 ILE 23 -15.976 -14.560 -22.214 190 H LYS 24 H LYS 24 -14.757 -13.396 -26.704 191 HA LYS 24 HA LYS 24 -12.023 -13.924 -27.088 192 HB2 LYS 24 2HB LYS 24 -14.316 -14.095 -29.053 193 HB3 LYS 24 3HB LYS 24 -12.719 -14.784 -29.311 194 HG2 LYS 24 2HG LYS 24 -14.050 -15.584 -26.814 195 HG3 LYS 24 3HG LYS 24 -14.813 -16.145 -28.304 196 HD2 LYS 24 2HD LYS 24 -11.864 -16.460 -27.824 197 HD3 LYS 24 3HD LYS 24 -13.031 -17.646 -27.235 198 HE2 LYS 24 2HE LYS 24 -13.159 -16.796 -30.087 199 HE3 LYS 24 3HE LYS 24 -11.884 -17.907 -29.591 200 HZ1 LYS 24 1HZ LYS 24 -14.252 -18.739 -30.369 201 HZ2 LYS 24 2HZ LYS 24 -14.602 -18.525 -28.728 202 HZ3 LYS 24 3HZ LYS 24 -13.353 -19.566 -29.197 203 H LYS 25 H LYS 25 -14.179 -11.522 -28.523 204 HA LYS 25 HA LYS 25 -12.314 -10.525 -30.412 205 HB2 LYS 25 2HB LYS 25 -14.767 -9.264 -29.176 206 HB3 LYS 25 3HB LYS 25 -13.851 -8.545 -30.494 207 HG2 LYS 25 2HG LYS 25 -14.548 -10.121 -32.020 208 HG3 LYS 25 3HG LYS 25 -14.905 -11.321 -30.776 209 HD2 LYS 25 2HD LYS 25 -16.811 -9.933 -30.035 210 HD3 LYS 25 3HD LYS 25 -16.474 -8.808 -31.352 211 HE2 LYS 25 2HE LYS 25 -16.833 -11.690 -32.002 212 HE3 LYS 25 3HE LYS 25 -18.261 -10.739 -31.599 213 HZ1 LYS 25 1HZ LYS 25 -16.681 -10.724 -33.985 214 HZ2 LYS 25 2HZ LYS 25 -16.902 -9.169 -33.358 215 HZ3 LYS 25 3HZ LYS 25 -18.244 -10.131 -33.724 216 H ALA 26 H ALA 26 -13.297 -9.393 -27.188 217 HA ALA 26 HA ALA 26 -11.580 -7.158 -27.111 218 HB1 ALA 26 1HB ALA 26 -12.163 -6.946 -24.852 219 HB2 ALA 26 2HB ALA 26 -13.578 -7.677 -25.610 220 HB3 ALA 26 3HB ALA 26 -12.464 -8.676 -24.676 221 H TYR 27 H TYR 27 -11.094 -10.542 -26.392 222 HA TYR 27 HA TYR 27 -8.635 -10.215 -24.985 223 HB2 TYR 27 2HB TYR 27 -9.865 -12.223 -24.594 224 HB3 TYR 27 3HB TYR 27 -9.934 -12.594 -26.314 225 HD1 TYR 27 HD1 TYR 27 -7.105 -11.653 -24.058 226 HD2 TYR 27 HD2 TYR 27 -8.759 -14.543 -26.707 227 HE1 TYR 27 HE1 TYR 27 -5.065 -13.009 -23.842 228 HE2 TYR 27 HE2 TYR 27 -6.724 -15.908 -26.498 229 HH TYR 27 HH TYR 27 -3.862 -14.728 -25.037 230 H TYR 28 H TYR 28 -9.527 -10.694 -28.343 231 HA TYR 28 HA TYR 28 -6.864 -11.194 -29.259 232 HB2 TYR 28 2HB TYR 28 -8.746 -12.028 -30.538 233 HB3 TYR 28 3HB TYR 28 -9.373 -10.397 -30.748 234 HD1 TYR 28 HD1 TYR 28 -9.094 -9.542 -32.862 235 HD2 TYR 28 HD2 TYR 28 -6.100 -12.132 -31.303 236 HE1 TYR 28 HE1 TYR 28 -7.818 -9.316 -34.953 237 HE2 TYR 28 HE2 TYR 28 -4.816 -11.913 -33.388 238 HH TYR 28 HH TYR 28 -5.026 -11.283 -35.623 239 H GLN 29 H GLN 29 -9.032 -8.379 -29.350 240 HA GLN 29 HA GLN 29 -7.302 -6.631 -30.683 241 HB2 GLN 29 2HB GLN 29 -8.745 -4.884 -30.008 242 HB3 GLN 29 3HB GLN 29 -9.770 -6.302 -30.187 243 HG2 GLN 29 2HG GLN 29 -9.789 -6.634 -27.793 244 HG3 GLN 29 3HG GLN 29 -8.678 -5.283 -27.574 245 HE21 GLN 29 1HE2 GLN 29 -10.437 -4.580 -26.126 246 HE22 GLN 29 2HE2 GLN 29 -11.731 -3.658 -26.804 247 H LEU 30 H LEU 30 -7.542 -7.516 -27.297 248 HA LEU 30 HA LEU 30 -5.792 -5.473 -26.342 249 HB2 LEU 30 2HB LEU 30 -7.324 -7.652 -25.246 250 HB3 LEU 30 3HB LEU 30 -5.705 -7.622 -24.551 251 HG LEU 30 HG LEU 30 -6.036 -5.407 -23.707 252 HD11 LEU 30 1HD1 LEU 30 -8.256 -5.394 -25.630 253 HD12 LEU 30 2HD1 LEU 30 -7.239 -4.074 -25.055 254 HD13 LEU 30 3HD1 LEU 30 -8.599 -4.628 -24.079 255 HD21 LEU 30 1HD2 LEU 30 -8.667 -6.332 -22.908 256 HD22 LEU 30 2HD2 LEU 30 -7.199 -6.133 -21.951 257 HD23 LEU 30 3HD2 LEU 30 -7.464 -7.620 -22.862 258 H ALA 31 H ALA 31 -5.386 -8.865 -27.254 259 HA ALA 31 HA ALA 31 -2.747 -9.227 -26.436 260 HB1 ALA 31 1HB ALA 31 -4.534 -10.517 -28.409 261 HB2 ALA 31 2HB ALA 31 -2.805 -10.823 -28.574 262 HB3 ALA 31 3HB ALA 31 -3.629 -11.217 -27.066 263 H LYS 32 H LYS 32 -4.033 -7.934 -29.471 264 HA LYS 32 HA LYS 32 -1.632 -7.711 -30.877 265 HB2 LYS 32 2HB LYS 32 -4.183 -6.109 -30.994 266 HB3 LYS 32 3HB LYS 32 -2.840 -5.817 -32.091 267 HG2 LYS 32 2HG LYS 32 -3.217 -7.704 -33.278 268 HG3 LYS 32 3HG LYS 32 -3.789 -8.607 -31.873 269 HD2 LYS 32 2HD LYS 32 -5.601 -8.225 -33.462 270 HD3 LYS 32 3HD LYS 32 -5.904 -7.375 -31.945 271 HE2 LYS 32 2HE LYS 32 -6.425 -6.024 -33.957 272 HE3 LYS 32 3HE LYS 32 -5.209 -5.288 -32.914 273 HZ1 LYS 32 1HZ LYS 32 -4.064 -6.973 -34.925 274 HZ2 LYS 32 2HZ LYS 32 -3.700 -5.370 -34.527 275 HZ3 LYS 32 3HZ LYS 32 -4.971 -5.710 -35.591 276 H LYS 33 H LYS 33 -2.838 -5.900 -28.214 277 HA LYS 33 HA LYS 33 -1.261 -3.548 -28.651 278 HB2 LYS 33 2HB LYS 33 -2.469 -4.495 -26.051 279 HB3 LYS 33 3HB LYS 33 -2.000 -2.853 -26.471 280 HG2 LYS 33 2HG LYS 33 -3.746 -2.904 -28.262 281 HG3 LYS 33 3HG LYS 33 -4.284 -4.450 -27.601 282 HD2 LYS 33 2HD LYS 33 -5.484 -3.394 -26.056 283 HD3 LYS 33 3HD LYS 33 -4.037 -2.572 -25.467 284 HE2 LYS 33 2HE LYS 33 -5.699 -0.937 -26.096 285 HE3 LYS 33 3HE LYS 33 -4.339 -0.857 -27.214 286 HZ1 LYS 33 1HZ LYS 33 -5.933 -0.947 -28.763 287 HZ2 LYS 33 2HZ LYS 33 -7.090 -1.584 -27.707 288 HZ3 LYS 33 3HZ LYS 33 -5.960 -2.608 -28.440 289 H TYR 34 H TYR 34 -0.875 -6.546 -26.860 290 HA TYR 34 HA TYR 34 1.836 -5.684 -26.092 291 HB2 TYR 34 2HB TYR 34 0.162 -7.849 -24.806 292 HB3 TYR 34 3HB TYR 34 1.722 -7.256 -24.248 293 HD1 TYR 34 HD1 TYR 34 1.879 -5.326 -22.881 294 HD2 TYR 34 HD2 TYR 34 -1.835 -6.342 -24.691 295 HE1 TYR 34 HE1 TYR 34 0.746 -3.648 -21.484 296 HE2 TYR 34 HE2 TYR 34 -2.978 -4.666 -23.300 297 HH TYR 34 HH TYR 34 -2.502 -3.547 -21.003 298 H HIS 35 H HIS 35 0.899 -6.896 -28.644 299 HA HIS 35 HA HIS 35 1.552 -9.584 -28.880 300 HB2 HIS 35 2HB HIS 35 1.192 -7.328 -30.675 301 HB3 HIS 35 3HB HIS 35 2.442 -8.425 -31.255 302 HD1 HIS 35 HD1 HIS 35 -0.521 -9.734 -29.378 303 HD2 HIS 35 HD2 HIS 35 0.822 -9.422 -33.297 304 HE1 HIS 35 HE1 HIS 35 -2.062 -11.186 -30.734 305 HA PRO 36 HA PRO 36 5.903 -9.955 -28.480 306 HB2 PRO 36 2HB PRO 36 6.516 -11.752 -30.420 307 HB3 PRO 36 3HB PRO 36 5.659 -12.193 -28.939 308 HG2 PRO 36 2HG PRO 36 4.563 -11.647 -31.671 309 HG3 PRO 36 3HG PRO 36 4.130 -12.931 -30.528 310 HD2 PRO 36 2HD PRO 36 2.636 -10.695 -30.841 311 HD3 PRO 36 3HD PRO 36 2.773 -11.542 -29.287 312 H ASP 37 H ASP 37 4.578 -8.940 -31.514 313 HA ASP 37 HA ASP 37 6.966 -8.445 -32.926 314 HB2 ASP 37 2HB ASP 37 4.377 -8.367 -33.615 315 HB3 ASP 37 3HB ASP 37 4.643 -6.644 -33.365 316 H THR 38 H THR 38 5.418 -6.779 -30.341 317 HA THR 38 HA THR 38 7.197 -4.463 -30.719 318 HB THR 38 HB THR 38 5.696 -3.122 -29.469 319 HG1 THR 38 HG1 THR 38 4.810 -5.578 -28.525 320 HG21 THR 38 1HG2 THR 38 3.523 -4.577 -30.770 321 HG22 THR 38 2HG2 THR 38 4.920 -4.326 -31.817 322 HG23 THR 38 3HG2 THR 38 4.126 -2.945 -31.061 323 H ASN 39 H ASN 39 7.244 -7.278 -29.189 324 HA ASN 39 HA ASN 39 7.985 -6.374 -26.536 325 HB2 ASN 39 2HB ASN 39 7.547 -9.003 -27.856 326 HB3 ASN 39 3HB ASN 39 8.653 -8.968 -26.486 327 HD21 ASN 39 1HD2 ASN 39 5.713 -7.105 -27.101 328 HD22 ASN 39 2HD2 ASN 39 4.862 -7.655 -25.702 329 H LYS 40 H LYS 40 9.503 -6.757 -29.520 330 HA LYS 40 HA LYS 40 12.017 -7.736 -28.963 331 HB2 LYS 40 2HB LYS 40 10.943 -5.770 -30.924 332 HB3 LYS 40 3HB LYS 40 12.690 -5.864 -30.739 333 HG2 LYS 40 2HG LYS 40 11.993 -7.284 -32.547 334 HG3 LYS 40 3HG LYS 40 12.582 -8.280 -31.215 335 HD2 LYS 40 2HD LYS 40 9.682 -7.678 -31.263 336 HD3 LYS 40 3HD LYS 40 10.291 -8.779 -32.501 337 HE2 LYS 40 2HE LYS 40 11.516 -9.770 -30.305 338 HE3 LYS 40 3HE LYS 40 10.030 -9.148 -29.589 339 HZ1 LYS 40 1HZ LYS 40 9.214 -11.124 -30.213 340 HZ2 LYS 40 2HZ LYS 40 10.423 -11.398 -31.363 341 HZ3 LYS 40 3HZ LYS 40 9.095 -10.424 -31.748 342 H ASP 41 H ASP 41 10.755 -4.483 -28.418 343 HA ASP 41 HA ASP 41 13.204 -3.870 -26.895 344 HB2 ASP 41 2HB ASP 41 11.523 -2.177 -28.703 345 HB3 ASP 41 3HB ASP 41 12.366 -1.416 -27.356 346 H ASP 42 H ASP 42 10.486 -5.074 -26.182 347 HA ASP 42 HA ASP 42 10.061 -3.384 -23.827 348 HB2 ASP 42 2HB ASP 42 8.320 -3.134 -25.828 349 HB3 ASP 42 3HB ASP 42 7.642 -4.582 -25.088 350 HA PRO 43 HA PRO 43 10.559 -7.818 -22.680 351 HB2 PRO 43 2HB PRO 43 12.027 -7.298 -20.456 352 HB3 PRO 43 3HB PRO 43 12.740 -7.432 -22.068 353 HG2 PRO 43 2HG PRO 43 12.008 -4.977 -20.519 354 HG3 PRO 43 3HG PRO 43 13.462 -5.300 -21.482 355 HD2 PRO 43 2HD PRO 43 11.398 -3.815 -22.413 356 HD3 PRO 43 3HD PRO 43 12.401 -4.827 -23.473 357 H LYS 44 H LYS 44 9.071 -5.080 -21.366 358 HA LYS 44 HA LYS 44 8.060 -6.480 -19.011 359 HB2 LYS 44 2HB LYS 44 8.292 -3.671 -19.860 360 HB3 LYS 44 3HB LYS 44 6.797 -4.057 -19.017 361 HG2 LYS 44 2HG LYS 44 9.566 -4.610 -17.971 362 HG3 LYS 44 3HG LYS 44 8.554 -3.240 -17.511 363 HD2 LYS 44 2HD LYS 44 6.827 -4.878 -16.743 364 HD3 LYS 44 3HD LYS 44 7.997 -6.166 -17.041 365 HE2 LYS 44 2HE LYS 44 8.346 -5.774 -14.806 366 HE3 LYS 44 3HE LYS 44 9.542 -4.694 -15.521 367 HZ1 LYS 44 1HZ LYS 44 8.560 -2.984 -14.547 368 HZ2 LYS 44 2HZ LYS 44 7.465 -4.031 -13.796 369 HZ3 LYS 44 3HZ LYS 44 7.084 -3.342 -15.293 370 H ALA 45 H ALA 45 7.126 -5.614 -22.211 371 HA ALA 45 HA ALA 45 4.337 -5.563 -21.962 372 HB1 ALA 45 1HB ALA 45 5.237 -4.788 -23.989 373 HB2 ALA 45 2HB ALA 45 6.148 -6.276 -24.250 374 HB3 ALA 45 3HB ALA 45 4.391 -6.279 -24.403 375 H LYS 46 H LYS 46 6.570 -8.259 -22.484 376 HA LYS 46 HA LYS 46 4.713 -10.282 -22.944 377 HB2 LYS 46 2HB LYS 46 6.446 -11.828 -22.402 378 HB3 LYS 46 3HB LYS 46 7.215 -10.446 -23.171 379 HG2 LYS 46 2HG LYS 46 7.812 -9.585 -20.930 380 HG3 LYS 46 3HG LYS 46 7.138 -11.056 -20.224 381 HD2 LYS 46 2HD LYS 46 9.506 -11.343 -20.407 382 HD3 LYS 46 3HD LYS 46 8.740 -12.368 -21.623 383 HE2 LYS 46 2HE LYS 46 9.555 -11.151 -23.355 384 HE3 LYS 46 3HE LYS 46 9.465 -9.630 -22.469 385 HZ1 LYS 46 1HZ LYS 46 11.659 -11.474 -22.728 386 HZ2 LYS 46 2HZ LYS 46 11.381 -10.981 -21.134 387 HZ3 LYS 46 3HZ LYS 46 11.670 -9.828 -22.338 388 H GLU 47 H GLU 47 5.733 -8.766 -19.961 389 HA GLU 47 HA GLU 47 4.560 -10.714 -18.230 390 HB2 GLU 47 2HB GLU 47 5.578 -7.911 -17.818 391 HB3 GLU 47 3HB GLU 47 4.807 -8.813 -16.521 392 HG2 GLU 47 2HG GLU 47 7.249 -9.709 -18.033 393 HG3 GLU 47 3HG GLU 47 7.259 -8.934 -16.451 394 H LYS 48 H LYS 48 3.533 -7.604 -19.551 395 HA LYS 48 HA LYS 48 1.106 -7.453 -18.080 396 HB2 LYS 48 2HB LYS 48 1.753 -6.138 -20.723 397 HB3 LYS 48 3HB LYS 48 0.518 -5.640 -19.573 398 HG2 LYS 48 2HG LYS 48 3.496 -5.573 -19.126 399 HG3 LYS 48 3HG LYS 48 2.451 -4.186 -19.445 400 HD2 LYS 48 2HD LYS 48 1.248 -4.591 -17.369 401 HD3 LYS 48 3HD LYS 48 2.231 -6.024 -17.060 402 HE2 LYS 48 2HE LYS 48 4.228 -4.378 -17.245 403 HE3 LYS 48 3HE LYS 48 3.009 -3.135 -16.970 404 HZ1 LYS 48 1HZ LYS 48 4.151 -3.973 -14.932 405 HZ2 LYS 48 2HZ LYS 48 3.386 -5.462 -15.173 406 HZ3 LYS 48 3HZ LYS 48 2.463 -4.075 -14.884 407 H PHE 49 H PHE 49 1.973 -8.728 -21.251 408 HA PHE 49 HA PHE 49 -0.603 -9.193 -22.237 409 HB2 PHE 49 2HB PHE 49 1.245 -9.363 -23.739 410 HB3 PHE 49 3HB PHE 49 2.018 -10.598 -22.752 411 HD1 PHE 49 HD1 PHE 49 -0.562 -9.905 -25.230 412 HD2 PHE 49 HD2 PHE 49 1.230 -12.894 -22.787 413 HE1 PHE 49 HE1 PHE 49 -1.651 -11.653 -26.576 414 HE2 PHE 49 HE2 PHE 49 0.145 -14.647 -24.130 415 HZ PHE 49 HZ PHE 49 -1.297 -14.028 -26.028 416 H SER 50 H SER 50 1.368 -11.000 -19.986 417 HA SER 50 HA SER 50 0.039 -13.454 -20.039 418 HB2 SER 50 2HB SER 50 2.075 -13.392 -18.848 419 HB3 SER 50 3HB SER 50 1.564 -12.011 -17.878 420 HG SER 50 HG SER 50 0.462 -14.626 -17.751 421 H GLN 51 H GLN 51 -0.776 -10.434 -18.469 422 HA GLN 51 HA GLN 51 -2.780 -11.446 -16.745 423 HB2 GLN 51 2HB GLN 51 -2.320 -8.691 -17.891 424 HB3 GLN 51 3HB GLN 51 -3.568 -9.050 -16.705 425 HG2 GLN 51 2HG GLN 51 -0.605 -9.412 -16.316 426 HG3 GLN 51 3HG GLN 51 -1.590 -8.106 -15.657 427 HE21 GLN 51 1HE2 GLN 51 -3.790 -9.391 -14.764 428 HE22 GLN 51 2HE2 GLN 51 -3.374 -10.497 -13.504 429 H LEU 52 H LEU 52 -2.734 -10.602 -20.112 430 HA LEU 52 HA LEU 52 -5.545 -10.329 -20.458 431 HB2 LEU 52 2HB LEU 52 -3.485 -11.096 -22.518 432 HB3 LEU 52 3HB LEU 52 -5.089 -10.434 -22.823 433 HG LEU 52 HG LEU 52 -2.961 -8.899 -21.349 434 HD11 LEU 52 1HD1 LEU 52 -3.520 -8.258 -24.173 435 HD12 LEU 52 2HD1 LEU 52 -2.570 -9.714 -23.877 436 HD13 LEU 52 3HD1 LEU 52 -2.015 -8.159 -23.258 437 HD21 LEU 52 1HD2 LEU 52 -4.595 -7.424 -21.086 438 HD22 LEU 52 2HD2 LEU 52 -5.712 -8.463 -21.971 439 HD23 LEU 52 3HD2 LEU 52 -4.730 -7.282 -22.839 440 H ALA 53 H ALA 53 -3.278 -12.987 -21.148 441 HA ALA 53 HA ALA 53 -5.300 -14.814 -21.954 442 HB1 ALA 53 1HB ALA 53 -2.424 -14.823 -21.658 443 HB2 ALA 53 2HB ALA 53 -3.140 -16.339 -21.109 444 HB3 ALA 53 3HB ALA 53 -3.449 -15.760 -22.746 445 H GLU 54 H GLU 54 -3.780 -14.052 -18.885 446 HA GLU 54 HA GLU 54 -4.663 -16.299 -17.435 447 HB2 GLU 54 2HB GLU 54 -3.827 -13.523 -16.648 448 HB3 GLU 54 3HB GLU 54 -4.426 -14.656 -15.445 449 HG2 GLU 54 2HG GLU 54 -2.172 -15.365 -17.288 450 HG3 GLU 54 3HG GLU 54 -1.904 -14.487 -15.783 451 H ALA 55 H ALA 55 -6.052 -13.037 -17.743 452 HA ALA 55 HA ALA 55 -8.367 -13.643 -16.196 453 HB1 ALA 55 1HB ALA 55 -8.078 -11.400 -16.166 454 HB2 ALA 55 2HB ALA 55 -7.402 -11.353 -17.794 455 HB3 ALA 55 3HB ALA 55 -9.146 -11.478 -17.567 456 H TYR 56 H TYR 56 -7.605 -13.699 -19.628 457 HA TYR 56 HA TYR 56 -10.257 -14.029 -20.563 458 HB2 TYR 56 2HB TYR 56 -8.675 -13.310 -22.160 459 HB3 TYR 56 3HB TYR 56 -7.555 -14.607 -21.760 460 HD1 TYR 56 HD1 TYR 56 -10.639 -13.744 -23.558 461 HD2 TYR 56 HD2 TYR 56 -7.818 -16.812 -22.702 462 HE1 TYR 56 HE1 TYR 56 -11.565 -15.099 -25.391 463 HE2 TYR 56 HE2 TYR 56 -8.736 -18.175 -24.533 464 HH TYR 56 HH TYR 56 -11.387 -18.076 -25.749 465 H GLU 57 H GLU 57 -7.906 -16.208 -19.237 466 HA GLU 57 HA GLU 57 -8.869 -18.641 -20.246 467 HB2 GLU 57 2HB GLU 57 -7.206 -17.805 -17.935 468 HB3 GLU 57 3HB GLU 57 -7.931 -19.404 -17.846 469 HG2 GLU 57 2HG GLU 57 -6.707 -20.214 -19.603 470 HG3 GLU 57 3HG GLU 57 -6.481 -18.621 -20.322 471 H VAL 58 H VAL 58 -9.690 -16.890 -17.266 472 HA VAL 58 HA VAL 58 -11.650 -18.809 -16.448 473 HB VAL 58 HB VAL 58 -11.243 -15.968 -15.503 474 HG11 VAL 58 1HG1 VAL 58 -12.348 -17.716 -13.535 475 HG12 VAL 58 2HG1 VAL 58 -13.030 -16.236 -14.214 476 HG13 VAL 58 3HG1 VAL 58 -13.337 -17.789 -14.993 477 HG21 VAL 58 1HG2 VAL 58 -9.244 -17.132 -15.056 478 HG22 VAL 58 2HG2 VAL 58 -10.154 -17.166 -13.545 479 HG23 VAL 58 3HG2 VAL 58 -10.107 -18.594 -14.580 480 H LEU 59 H LEU 59 -11.743 -15.651 -18.039 481 HA LEU 59 HA LEU 59 -14.592 -15.501 -18.110 482 HB2 LEU 59 2HB LEU 59 -12.324 -13.924 -19.081 483 HB3 LEU 59 3HB LEU 59 -13.747 -13.855 -20.118 484 HG LEU 59 HG LEU 59 -15.079 -12.965 -18.329 485 HD11 LEU 59 1HD1 LEU 59 -12.639 -13.407 -16.619 486 HD12 LEU 59 2HD1 LEU 59 -14.219 -14.170 -16.450 487 HD13 LEU 59 3HD1 LEU 59 -14.035 -12.446 -16.130 488 HD21 LEU 59 1HD2 LEU 59 -13.766 -11.363 -19.601 489 HD22 LEU 59 2HD2 LEU 59 -12.408 -11.571 -18.495 490 HD23 LEU 59 3HD2 LEU 59 -13.910 -10.847 -17.921 491 H SER 60 H SER 60 -12.407 -17.391 -19.777 492 HA SER 60 HA SER 60 -13.637 -17.404 -22.355 493 HB2 SER 60 2HB SER 60 -11.377 -18.103 -22.309 494 HB3 SER 60 3HB SER 60 -11.667 -19.226 -20.981 495 HG SER 60 HG SER 60 -11.504 -20.065 -23.258 496 H ASP 61 H ASP 61 -14.449 -18.759 -19.353 497 HA ASP 61 HA ASP 61 -16.522 -20.389 -20.640 498 HB2 ASP 61 2HB ASP 61 -14.395 -21.632 -19.606 499 HB3 ASP 61 3HB ASP 61 -15.327 -21.438 -18.124 500 H GLU 62 H GLU 62 -18.494 -20.028 -19.845 501 HA GLU 62 HA GLU 62 -19.061 -17.999 -18.045 502 HB2 GLU 62 2HB GLU 62 -21.346 -19.020 -17.912 503 HB3 GLU 62 3HB GLU 62 -20.761 -18.754 -19.548 504 HG2 GLU 62 2HG GLU 62 -20.081 -21.151 -19.617 505 HG3 GLU 62 3HG GLU 62 -20.881 -21.363 -18.060 506 H VAL 63 H VAL 63 -18.800 -21.484 -17.475 507 HA VAL 63 HA VAL 63 -19.611 -21.498 -14.792 508 HB VAL 63 HB VAL 63 -17.570 -23.351 -16.020 509 HG11 VAL 63 1HG1 VAL 63 -17.895 -23.422 -13.544 510 HG12 VAL 63 2HG1 VAL 63 -19.577 -23.869 -13.833 511 HG13 VAL 63 3HG1 VAL 63 -18.276 -24.931 -14.372 512 HG21 VAL 63 1HG2 VAL 63 -19.161 -23.939 -17.468 513 HG22 VAL 63 2HG2 VAL 63 -20.027 -24.621 -16.092 514 HG23 VAL 63 3HG2 VAL 63 -20.382 -22.980 -16.631 515 H LYS 64 H LYS 64 -16.348 -21.300 -16.198 516 HA LYS 64 HA LYS 64 -14.966 -21.126 -13.752 517 HB2 LYS 64 2HB LYS 64 -14.266 -20.253 -16.551 518 HB3 LYS 64 3HB LYS 64 -13.153 -20.059 -15.204 519 HG2 LYS 64 2HG LYS 64 -13.656 -22.625 -14.867 520 HG3 LYS 64 3HG LYS 64 -14.055 -22.528 -16.584 521 HD2 LYS 64 2HD LYS 64 -11.750 -23.129 -16.407 522 HD3 LYS 64 3HD LYS 64 -11.824 -21.452 -16.954 523 HE2 LYS 64 2HE LYS 64 -11.143 -20.622 -14.888 524 HE3 LYS 64 3HE LYS 64 -11.583 -22.104 -14.040 525 HZ1 LYS 64 1HZ LYS 64 -9.355 -22.392 -14.136 526 HZ2 LYS 64 2HZ LYS 64 -9.164 -21.470 -15.541 527 HZ3 LYS 64 3HZ LYS 64 -9.731 -23.061 -15.644 528 H ARG 65 H ARG 65 -16.157 -18.613 -15.959 529 HA ARG 65 HA ARG 65 -15.152 -16.402 -14.559 530 HB2 ARG 65 2HB ARG 65 -15.967 -16.171 -16.823 531 HB3 ARG 65 3HB ARG 65 -17.584 -16.656 -16.331 532 HG2 ARG 65 2HG ARG 65 -17.729 -14.627 -14.931 533 HG3 ARG 65 3HG ARG 65 -16.149 -14.131 -15.542 534 HD2 ARG 65 2HD ARG 65 -17.921 -13.015 -16.770 535 HD3 ARG 65 3HD ARG 65 -17.045 -14.124 -17.824 536 HE ARG 65 HE ARG 65 -19.381 -15.294 -16.641 537 HH11 ARG 65 1HH1 ARG 65 -18.196 -13.335 -19.264 538 HH12 ARG 65 2HH1 ARG 65 -19.515 -13.719 -20.319 539 HH21 ARG 65 1HH2 ARG 65 -21.122 -15.808 -18.022 540 HH22 ARG 65 2HH2 ARG 65 -21.179 -15.125 -19.612 541 H LYS 66 H LYS 66 -18.335 -17.977 -14.391 542 HA LYS 66 HA LYS 66 -19.399 -16.276 -12.405 543 HB2 LYS 66 2HB LYS 66 -20.112 -19.087 -13.243 544 HB3 LYS 66 3HB LYS 66 -21.028 -18.182 -12.046 545 HG2 LYS 66 2HG LYS 66 -20.581 -17.323 -14.898 546 HG3 LYS 66 3HG LYS 66 -22.042 -18.097 -14.279 547 HD2 LYS 66 2HD LYS 66 -22.770 -15.999 -13.952 548 HD3 LYS 66 3HD LYS 66 -21.723 -16.025 -12.531 549 HE2 LYS 66 2HE LYS 66 -20.968 -14.116 -13.529 550 HE3 LYS 66 3HE LYS 66 -19.903 -15.291 -14.300 551 HZ1 LYS 66 1HZ LYS 66 -21.407 -15.348 -16.195 552 HZ2 LYS 66 2HZ LYS 66 -20.846 -13.776 -15.919 553 HZ3 LYS 66 3HZ LYS 66 -22.415 -14.207 -15.457 554 H GLN 67 H GLN 67 -17.781 -19.427 -12.216 555 HA GLN 67 HA GLN 67 -18.054 -19.840 -9.467 556 HB2 GLN 67 2HB GLN 67 -16.094 -20.789 -11.525 557 HB3 GLN 67 3HB GLN 67 -15.822 -21.158 -9.827 558 HG2 GLN 67 2HG GLN 67 -18.202 -21.938 -11.492 559 HG3 GLN 67 3HG GLN 67 -16.942 -23.001 -10.866 560 HE21 GLN 67 1HE2 GLN 67 -19.844 -21.285 -10.172 561 HE22 GLN 67 2HE2 GLN 67 -20.088 -21.906 -8.578 562 H TYR 68 H TYR 68 -15.696 -17.983 -11.298 563 HA TYR 68 HA TYR 68 -13.927 -17.499 -9.128 564 HB2 TYR 68 2HB TYR 68 -13.083 -17.246 -11.354 565 HB3 TYR 68 3HB TYR 68 -14.341 -16.086 -11.765 566 HD1 TYR 68 HD1 TYR 68 -11.359 -16.571 -9.602 567 HD2 TYR 68 HD2 TYR 68 -13.994 -13.788 -11.449 568 HE1 TYR 68 HE1 TYR 68 -9.866 -14.731 -8.945 569 HE2 TYR 68 HE2 TYR 68 -12.508 -11.940 -10.798 570 HH TYR 68 HH TYR 68 -9.382 -12.534 -9.302 571 H ASP 69 H ASP 69 -16.709 -15.789 -10.447 572 HA ASP 69 HA ASP 69 -16.423 -13.429 -8.916 573 HB2 ASP 69 2HB ASP 69 -17.881 -13.769 -10.975 574 HB3 ASP 69 3HB ASP 69 -19.038 -14.561 -9.909 575 H ALA 70 H ALA 70 -17.666 -16.577 -8.192 576 HA ALA 70 HA ALA 70 -19.284 -15.885 -5.970 577 HB1 ALA 70 1HB ALA 70 -18.449 -18.283 -7.302 578 HB2 ALA 70 2HB ALA 70 -18.307 -18.481 -5.555 579 HB3 ALA 70 3HB ALA 70 -19.850 -18.010 -6.266 580 H TYR 71 H TYR 71 -15.873 -16.690 -6.328 581 HA TYR 71 HA TYR 71 -15.485 -16.357 -3.439 582 HB2 TYR 71 2HB TYR 71 -13.547 -17.383 -5.523 583 HB3 TYR 71 3HB TYR 71 -13.289 -17.370 -3.782 584 HD1 TYR 71 HD1 TYR 71 -14.912 -18.745 -2.341 585 HD2 TYR 71 HD2 TYR 71 -14.545 -19.226 -6.553 586 HE1 TYR 71 HE1 TYR 71 -15.930 -20.978 -2.169 587 HE2 TYR 71 HE2 TYR 71 -15.564 -21.459 -6.393 588 HH TYR 71 HH TYR 71 -15.798 -23.249 -4.589 589 H GLY 72 H GLY 72 -15.967 -14.157 -5.383 590 HA2 GLY 72 2HA GLY 72 -13.468 -12.782 -5.716 591 HA3 GLY 72 3HA GLY 72 -15.069 -12.122 -6.013 592 H SER 73 H SER 73 -13.244 -10.489 -4.903 593 HA SER 73 HA SER 73 -13.564 -10.541 -2.010 594 HB2 SER 73 2HB SER 73 -12.168 -8.351 -2.266 595 HB3 SER 73 3HB SER 73 -11.387 -9.904 -2.561 596 HG SER 73 HG SER 73 -11.498 -7.891 -4.201 Start of MODEL 8 1 H1 HIS 1 H HIS 1 -0.918 -5.268 1.516 2 HA HIS 1 HA HIS 1 -1.848 -4.921 -1.220 3 HB2 HIS 1 2HB HIS 1 -3.105 -6.373 1.118 4 HB3 HIS 1 3HB HIS 1 -3.711 -6.387 -0.536 5 HD1 HIS 1 HD1 HIS 1 -1.248 -6.979 -2.149 6 HD2 HIS 1 HD2 HIS 1 -2.054 -8.836 1.480 7 HE1 HIS 1 HE1 HIS 1 0.060 -9.127 -2.187 8 H MET 2 H MET 2 -1.935 -2.536 -0.858 9 HA MET 2 HA MET 2 -4.215 -1.635 0.728 10 HB2 MET 2 2HB MET 2 -1.919 -0.255 -0.621 11 HB3 MET 2 3HB MET 2 -3.351 0.658 -0.165 12 HG2 MET 2 2HG MET 2 -3.059 -0.028 2.155 13 HG3 MET 2 3HG MET 2 -1.632 -0.958 1.703 14 HE1 MET 2 1HE MET 2 0.610 -0.153 1.863 15 HE2 MET 2 2HE MET 2 1.023 1.422 2.540 16 HE3 MET 2 3HE MET 2 -0.004 0.313 3.450 17 H LEU 3 H LEU 3 -3.021 -1.390 -2.618 18 HA LEU 3 HA LEU 3 -5.313 -0.135 -3.664 19 HB2 LEU 3 2HB LEU 3 -4.388 -0.476 -5.767 20 HB3 LEU 3 3HB LEU 3 -2.989 -0.384 -4.698 21 HG LEU 3 HG LEU 3 -4.185 -2.955 -5.730 22 HD11 LEU 3 1HD1 LEU 3 -1.829 -2.847 -6.944 23 HD12 LEU 3 2HD1 LEU 3 -2.141 -1.115 -6.838 24 HD13 LEU 3 3HD1 LEU 3 -3.289 -2.169 -7.664 25 HD21 LEU 3 1HD2 LEU 3 -3.059 -3.513 -3.785 26 HD22 LEU 3 2HD2 LEU 3 -1.831 -2.267 -4.014 27 HD23 LEU 3 3HD2 LEU 3 -1.814 -3.718 -5.017 28 H ALA 4 H ALA 4 -7.127 -0.924 -4.683 29 HA ALA 4 HA ALA 4 -8.154 -3.394 -3.768 30 HB1 ALA 4 1HB ALA 4 -9.527 -2.363 -6.102 31 HB2 ALA 4 2HB ALA 4 -10.100 -2.550 -4.444 32 HB3 ALA 4 3HB ALA 4 -9.207 -1.103 -4.911 33 H LYS 5 H LYS 5 -8.440 -5.345 -4.778 34 HA LYS 5 HA LYS 5 -6.554 -6.071 -6.772 35 HB2 LYS 5 2HB LYS 5 -7.718 -7.496 -4.897 36 HB3 LYS 5 3HB LYS 5 -8.936 -7.771 -6.136 37 HG2 LYS 5 2HG LYS 5 -7.031 -8.529 -7.631 38 HG3 LYS 5 3HG LYS 5 -6.037 -8.546 -6.173 39 HD2 LYS 5 2HD LYS 5 -8.659 -10.007 -6.333 40 HD3 LYS 5 3HD LYS 5 -7.145 -10.742 -6.865 41 HE2 LYS 5 2HE LYS 5 -6.229 -10.156 -4.571 42 HE3 LYS 5 3HE LYS 5 -7.892 -9.799 -4.107 43 HZ1 LYS 5 1HZ LYS 5 -6.637 -12.373 -4.692 44 HZ2 LYS 5 2HZ LYS 5 -8.264 -12.184 -5.115 45 HZ3 LYS 5 3HZ LYS 5 -7.778 -11.972 -3.509 46 H GLU 6 H GLU 6 -6.720 -6.127 -8.926 47 HA GLU 6 HA GLU 6 -9.013 -4.999 -10.206 48 HB2 GLU 6 2HB GLU 6 -6.739 -6.415 -11.585 49 HB3 GLU 6 3HB GLU 6 -7.775 -5.148 -12.227 50 HG2 GLU 6 2HG GLU 6 -6.736 -3.790 -10.205 51 HG3 GLU 6 3HG GLU 6 -5.433 -4.957 -10.424 52 H ASP 7 H ASP 7 -10.235 -6.023 -11.922 53 HA ASP 7 HA ASP 7 -10.644 -8.892 -11.405 54 HB2 ASP 7 2HB ASP 7 -12.633 -6.945 -12.586 55 HB3 ASP 7 3HB ASP 7 -12.945 -8.599 -12.068 56 H TYR 8 H TYR 8 -10.974 -10.306 -13.142 57 HA TYR 8 HA TYR 8 -9.357 -9.998 -15.355 58 HB2 TYR 8 2HB TYR 8 -11.840 -11.710 -15.113 59 HB3 TYR 8 3HB TYR 8 -10.591 -11.901 -16.338 60 HD1 TYR 8 HD1 TYR 8 -11.717 -13.692 -13.881 61 HD2 TYR 8 HD2 TYR 8 -8.148 -11.524 -14.699 62 HE1 TYR 8 HE1 TYR 8 -10.473 -15.182 -12.371 63 HE2 TYR 8 HE2 TYR 8 -6.894 -13.009 -13.191 64 HH TYR 8 HH TYR 8 -7.069 -14.612 -11.620 65 H TYR 9 H TYR 9 -12.701 -9.054 -14.916 66 HA TYR 9 HA TYR 9 -13.527 -8.652 -17.515 67 HB2 TYR 9 2HB TYR 9 -14.129 -6.923 -15.106 68 HB3 TYR 9 3HB TYR 9 -15.041 -6.920 -16.611 69 HD1 TYR 9 HD1 TYR 9 -14.600 -8.485 -13.410 70 HD2 TYR 9 HD2 TYR 9 -16.246 -9.041 -17.294 71 HE1 TYR 9 HE1 TYR 9 -16.025 -10.292 -12.541 72 HE2 TYR 9 HE2 TYR 9 -17.676 -10.849 -16.436 73 HH TYR 9 HH TYR 9 -18.623 -11.355 -13.808 74 H GLN 10 H GLN 10 -11.703 -6.425 -15.436 75 HA GLN 10 HA GLN 10 -11.530 -4.368 -17.398 76 HB2 GLN 10 2HB GLN 10 -9.849 -4.844 -14.931 77 HB3 GLN 10 3HB GLN 10 -9.864 -3.365 -15.881 78 HG2 GLN 10 2HG GLN 10 -12.388 -4.426 -14.684 79 HG3 GLN 10 3HG GLN 10 -11.252 -3.491 -13.713 80 HE21 GLN 10 1HE2 GLN 10 -13.910 -3.317 -15.665 81 HE22 GLN 10 2HE2 GLN 10 -13.846 -1.641 -16.080 82 H ILE 11 H ILE 11 -9.419 -7.012 -16.399 83 HA ILE 11 HA ILE 11 -7.141 -6.292 -17.863 84 HB ILE 11 HB ILE 11 -8.110 -9.070 -17.178 85 HG12 ILE 11 2HG1 ILE 11 -6.070 -7.397 -15.713 86 HG13 ILE 11 3HG1 ILE 11 -7.775 -7.411 -15.275 87 HG21 ILE 11 1HG2 ILE 11 -5.706 -8.056 -18.523 88 HG22 ILE 11 2HG2 ILE 11 -5.403 -9.203 -17.219 89 HG23 ILE 11 3HG2 ILE 11 -6.444 -9.657 -18.567 90 HD11 ILE 11 1HD1 ILE 11 -7.646 -9.446 -14.325 91 HD12 ILE 11 2HD1 ILE 11 -6.473 -10.043 -15.499 92 HD13 ILE 11 3HD1 ILE 11 -5.944 -9.014 -14.168 93 H LEU 12 H LEU 12 -10.094 -7.911 -18.816 94 HA LEU 12 HA LEU 12 -9.025 -8.453 -21.482 95 HB2 LEU 12 2HB LEU 12 -11.358 -9.382 -19.906 96 HB3 LEU 12 3HB LEU 12 -11.537 -9.327 -21.659 97 HG LEU 12 HG LEU 12 -9.252 -10.780 -20.359 98 HD11 LEU 12 1HD1 LEU 12 -10.631 -12.307 -19.538 99 HD12 LEU 12 2HD1 LEU 12 -11.190 -12.639 -21.177 100 HD13 LEU 12 3HD1 LEU 12 -12.031 -11.450 -20.182 101 HD21 LEU 12 1HD2 LEU 12 -10.386 -10.488 -23.063 102 HD22 LEU 12 2HD2 LEU 12 -9.896 -12.119 -22.607 103 HD23 LEU 12 3HD2 LEU 12 -8.727 -10.799 -22.552 104 H GLY 13 H GLY 13 -10.827 -6.102 -19.819 105 HA2 GLY 13 2HA GLY 13 -11.622 -4.075 -20.606 106 HA3 GLY 13 3HA GLY 13 -11.203 -4.584 -22.235 107 H VAL 14 H VAL 14 -13.201 -6.588 -20.216 108 HA VAL 14 HA VAL 14 -15.510 -5.908 -21.918 109 HB VAL 14 HB VAL 14 -16.333 -8.168 -21.588 110 HG11 VAL 14 1HG1 VAL 14 -14.454 -9.424 -22.716 111 HG12 VAL 14 2HG1 VAL 14 -14.960 -7.927 -23.501 112 HG13 VAL 14 3HG1 VAL 14 -13.485 -7.962 -22.534 113 HG21 VAL 14 1HG2 VAL 14 -14.798 -9.847 -20.487 114 HG22 VAL 14 2HG2 VAL 14 -13.903 -8.473 -19.838 115 HG23 VAL 14 3HG2 VAL 14 -15.596 -8.707 -19.403 116 HA PRO 15 HA PRO 15 -17.807 -4.697 -18.375 117 HB2 PRO 15 2HB PRO 15 -20.317 -5.403 -19.131 118 HB3 PRO 15 3HB PRO 15 -19.454 -4.027 -19.829 119 HG2 PRO 15 2HG PRO 15 -19.802 -6.794 -20.917 120 HG3 PRO 15 3HG PRO 15 -19.915 -5.238 -21.760 121 HD2 PRO 15 2HD PRO 15 -17.712 -6.807 -21.888 122 HD3 PRO 15 3HD PRO 15 -17.628 -5.035 -21.956 123 H ARG 16 H ARG 16 -19.544 -5.550 -16.831 124 HA ARG 16 HA ARG 16 -18.685 -8.126 -15.884 125 HB2 ARG 16 2HB ARG 16 -20.707 -6.133 -14.859 126 HB3 ARG 16 3HB ARG 16 -20.382 -7.667 -14.062 127 HG2 ARG 16 2HG ARG 16 -18.264 -7.028 -13.401 128 HG3 ARG 16 3HG ARG 16 -18.140 -5.785 -14.648 129 HD2 ARG 16 2HD ARG 16 -19.339 -4.259 -13.439 130 HD3 ARG 16 3HD ARG 16 -20.268 -5.497 -12.595 131 HE ARG 16 HE ARG 16 -17.763 -4.349 -11.778 132 HH11 ARG 16 1HH1 ARG 16 -19.867 -7.111 -11.522 133 HH12 ARG 16 2HH1 ARG 16 -19.228 -7.620 -9.994 134 HH21 ARG 16 1HH2 ARG 16 -16.914 -5.009 -9.766 135 HH22 ARG 16 2HH2 ARG 16 -17.549 -6.423 -8.996 136 H ASN 17 H ASN 17 -20.972 -7.124 -18.095 137 HA ASN 17 HA ASN 17 -22.620 -9.525 -17.642 138 HB2 ASN 17 2HB ASN 17 -24.362 -8.307 -19.008 139 HB3 ASN 17 3HB ASN 17 -24.013 -7.594 -17.436 140 HD21 ASN 17 1HD2 ASN 17 -24.736 -5.574 -18.051 141 HD22 ASN 17 2HD2 ASN 17 -23.856 -4.566 -19.143 142 H ALA 18 H ALA 18 -20.103 -8.594 -19.388 143 HA ALA 18 HA ALA 18 -20.746 -9.014 -22.072 144 HB1 ALA 18 1HB ALA 18 -18.572 -8.656 -22.378 145 HB2 ALA 18 2HB ALA 18 -18.436 -8.505 -20.625 146 HB3 ALA 18 3HB ALA 18 -18.132 -10.059 -21.402 147 H SER 19 H SER 19 -20.199 -10.879 -23.426 148 HA SER 19 HA SER 19 -20.884 -13.393 -22.061 149 HB2 SER 19 2HB SER 19 -21.391 -14.062 -24.560 150 HB3 SER 19 3HB SER 19 -22.555 -13.109 -23.639 151 HG SER 19 HG SER 19 -21.980 -12.332 -25.818 152 H GLN 20 H GLN 20 -20.049 -15.373 -23.359 153 HA GLN 20 HA GLN 20 -17.230 -15.351 -23.209 154 HB2 GLN 20 2HB GLN 20 -18.858 -17.431 -24.658 155 HB3 GLN 20 3HB GLN 20 -17.317 -17.637 -23.837 156 HG2 GLN 20 2HG GLN 20 -20.017 -17.195 -22.598 157 HG3 GLN 20 3HG GLN 20 -18.991 -18.624 -22.482 158 HE21 GLN 20 1HE2 GLN 20 -16.904 -18.334 -21.393 159 HE22 GLN 20 2HE2 GLN 20 -16.814 -17.235 -20.063 160 H LYS 21 H LYS 21 -19.457 -14.758 -25.795 161 HA LYS 21 HA LYS 21 -17.567 -15.155 -27.918 162 HB2 LYS 21 2HB LYS 21 -20.192 -13.655 -27.956 163 HB3 LYS 21 3HB LYS 21 -19.289 -14.208 -29.360 164 HG2 LYS 21 2HG LYS 21 -20.496 -16.004 -27.266 165 HG3 LYS 21 3HG LYS 21 -21.215 -15.641 -28.837 166 HD2 LYS 21 2HD LYS 21 -18.504 -16.907 -28.453 167 HD3 LYS 21 3HD LYS 21 -19.990 -17.806 -28.769 168 HE2 LYS 21 2HE LYS 21 -18.759 -15.719 -30.568 169 HE3 LYS 21 3HE LYS 21 -18.702 -17.463 -30.817 170 HZ1 LYS 21 1HZ LYS 21 -20.879 -15.598 -31.269 171 HZ2 LYS 21 2HZ LYS 21 -21.323 -17.082 -30.591 172 HZ3 LYS 21 3HZ LYS 21 -20.503 -17.040 -32.070 173 H GLU 22 H GLU 22 -18.834 -12.376 -26.137 174 HA GLU 22 HA GLU 22 -17.548 -10.392 -27.690 175 HB2 GLU 22 2HB GLU 22 -19.397 -9.769 -26.293 176 HB3 GLU 22 3HB GLU 22 -18.584 -10.370 -24.855 177 HG2 GLU 22 2HG GLU 22 -18.526 -7.954 -24.925 178 HG3 GLU 22 3HG GLU 22 -16.899 -8.618 -25.068 179 H ILE 23 H ILE 23 -16.539 -12.335 -24.960 180 HA ILE 23 HA ILE 23 -14.238 -10.841 -24.266 181 HB ILE 23 HB ILE 23 -14.810 -13.778 -23.855 182 HG12 ILE 23 2HG1 ILE 23 -14.938 -11.712 -21.699 183 HG13 ILE 23 3HG1 ILE 23 -16.282 -11.833 -22.829 184 HG21 ILE 23 1HG2 ILE 23 -13.091 -13.656 -22.100 185 HG22 ILE 23 2HG2 ILE 23 -12.432 -13.338 -23.704 186 HG23 ILE 23 3HG2 ILE 23 -12.727 -12.002 -22.591 187 HD11 ILE 23 1HD1 ILE 23 -15.846 -14.444 -22.089 188 HD12 ILE 23 2HD1 ILE 23 -15.562 -13.539 -20.601 189 HD13 ILE 23 3HD1 ILE 23 -17.095 -13.373 -21.456 190 H LYS 24 H LYS 24 -14.855 -13.342 -26.638 191 HA LYS 24 HA LYS 24 -12.203 -14.047 -27.231 192 HB2 LYS 24 2HB LYS 24 -14.723 -14.093 -28.886 193 HB3 LYS 24 3HB LYS 24 -13.186 -14.697 -29.491 194 HG2 LYS 24 2HG LYS 24 -13.109 -16.396 -27.827 195 HG3 LYS 24 3HG LYS 24 -14.489 -15.702 -26.973 196 HD2 LYS 24 2HD LYS 24 -15.216 -17.626 -28.236 197 HD3 LYS 24 3HD LYS 24 -15.897 -16.165 -28.957 198 HE2 LYS 24 2HE LYS 24 -14.472 -16.261 -30.793 199 HE3 LYS 24 3HE LYS 24 -13.316 -17.301 -29.964 200 HZ1 LYS 24 1HZ LYS 24 -15.742 -18.663 -30.070 201 HZ2 LYS 24 2HZ LYS 24 -14.307 -19.035 -30.884 202 HZ3 LYS 24 3HZ LYS 24 -15.462 -18.042 -31.619 203 H LYS 25 H LYS 25 -14.285 -11.490 -28.501 204 HA LYS 25 HA LYS 25 -12.407 -10.597 -30.458 205 HB2 LYS 25 2HB LYS 25 -14.896 -9.374 -29.277 206 HB3 LYS 25 3HB LYS 25 -13.917 -8.538 -30.476 207 HG2 LYS 25 2HG LYS 25 -14.503 -9.982 -32.163 208 HG3 LYS 25 3HG LYS 25 -14.875 -11.301 -31.051 209 HD2 LYS 25 2HD LYS 25 -16.811 -9.839 -30.245 210 HD3 LYS 25 3HD LYS 25 -16.518 -8.865 -31.688 211 HE2 LYS 25 2HE LYS 25 -16.832 -11.825 -31.938 212 HE3 LYS 25 3HE LYS 25 -18.261 -10.813 -31.737 213 HZ1 LYS 25 1HZ LYS 25 -16.380 -10.949 -33.981 214 HZ2 LYS 25 2HZ LYS 25 -17.139 -9.472 -33.659 215 HZ3 LYS 25 3HZ LYS 25 -18.069 -10.844 -33.996 216 H ALA 26 H ALA 26 -13.384 -9.400 -27.257 217 HA ALA 26 HA ALA 26 -11.660 -7.181 -27.191 218 HB1 ALA 26 1HB ALA 26 -13.609 -7.617 -25.665 219 HB2 ALA 26 2HB ALA 26 -12.577 -8.749 -24.791 220 HB3 ALA 26 3HB ALA 26 -12.143 -7.042 -24.870 221 H TYR 27 H TYR 27 -11.146 -10.565 -26.495 222 HA TYR 27 HA TYR 27 -8.666 -10.234 -25.128 223 HB2 TYR 27 2HB TYR 27 -9.883 -12.251 -24.734 224 HB3 TYR 27 3HB TYR 27 -9.968 -12.613 -26.454 225 HD1 TYR 27 HD1 TYR 27 -7.218 -11.788 -24.050 226 HD2 TYR 27 HD2 TYR 27 -8.687 -14.427 -27.047 227 HE1 TYR 27 HE1 TYR 27 -5.167 -13.133 -23.863 228 HE2 TYR 27 HE2 TYR 27 -6.641 -15.780 -26.867 229 HH TYR 27 HH TYR 27 -4.833 -16.117 -24.802 230 H TYR 28 H TYR 28 -9.609 -10.697 -28.475 231 HA TYR 28 HA TYR 28 -6.959 -11.176 -29.437 232 HB2 TYR 28 2HB TYR 28 -8.860 -12.009 -30.690 233 HB3 TYR 28 3HB TYR 28 -9.494 -10.378 -30.880 234 HD1 TYR 28 HD1 TYR 28 -9.261 -9.529 -33.003 235 HD2 TYR 28 HD2 TYR 28 -6.214 -12.082 -31.486 236 HE1 TYR 28 HE1 TYR 28 -8.018 -9.289 -35.111 237 HE2 TYR 28 HE2 TYR 28 -4.962 -11.848 -33.590 238 HH TYR 28 HH TYR 28 -6.334 -10.321 -36.384 239 H GLN 29 H GLN 29 -9.141 -8.371 -29.477 240 HA GLN 29 HA GLN 29 -7.437 -6.607 -30.822 241 HB2 GLN 29 2HB GLN 29 -8.883 -4.873 -30.125 242 HB3 GLN 29 3HB GLN 29 -9.902 -6.297 -30.288 243 HG2 GLN 29 2HG GLN 29 -9.882 -6.629 -27.894 244 HG3 GLN 29 3HG GLN 29 -8.774 -5.273 -27.693 245 HE21 GLN 29 1HE2 GLN 29 -11.764 -5.778 -29.539 246 HE22 GLN 29 2HE2 GLN 29 -12.588 -4.397 -28.908 247 H LEU 30 H LEU 30 -7.623 -7.524 -27.442 248 HA LEU 30 HA LEU 30 -5.880 -5.474 -26.490 249 HB2 LEU 30 2HB LEU 30 -7.370 -7.686 -25.397 250 HB3 LEU 30 3HB LEU 30 -5.744 -7.633 -24.719 251 HG LEU 30 HG LEU 30 -6.104 -5.438 -23.846 252 HD11 LEU 30 1HD1 LEU 30 -7.320 -4.112 -25.196 253 HD12 LEU 30 2HD1 LEU 30 -8.663 -4.665 -24.196 254 HD13 LEU 30 3HD1 LEU 30 -8.346 -5.434 -25.751 255 HD21 LEU 30 1HD2 LEU 30 -8.534 -7.152 -23.339 256 HD22 LEU 30 2HD2 LEU 30 -7.967 -5.832 -22.315 257 HD23 LEU 30 3HD2 LEU 30 -6.982 -7.283 -22.512 258 H ALA 31 H ALA 31 -5.454 -8.854 -27.438 259 HA ALA 31 HA ALA 31 -2.798 -9.193 -26.663 260 HB1 ALA 31 1HB ALA 31 -4.655 -10.525 -28.499 261 HB2 ALA 31 2HB ALA 31 -2.949 -10.728 -28.901 262 HB3 ALA 31 3HB ALA 31 -3.543 -11.207 -27.311 263 H LYS 32 H LYS 32 -4.144 -7.918 -29.682 264 HA LYS 32 HA LYS 32 -1.773 -7.657 -31.124 265 HB2 LYS 32 2HB LYS 32 -4.332 -6.062 -31.183 266 HB3 LYS 32 3HB LYS 32 -3.013 -5.774 -32.311 267 HG2 LYS 32 2HG LYS 32 -3.414 -7.667 -33.483 268 HG3 LYS 32 3HG LYS 32 -3.968 -8.561 -32.065 269 HD2 LYS 32 2HD LYS 32 -5.804 -8.177 -33.621 270 HD3 LYS 32 3HD LYS 32 -6.076 -7.314 -32.106 271 HE2 LYS 32 2HE LYS 32 -6.626 -5.969 -34.110 272 HE3 LYS 32 3HE LYS 32 -5.374 -5.240 -33.106 273 HZ1 LYS 32 1HZ LYS 32 -3.784 -5.585 -34.670 274 HZ2 LYS 32 2HZ LYS 32 -5.117 -5.437 -35.700 275 HZ3 LYS 32 3HZ LYS 32 -4.521 -6.970 -35.304 276 H LYS 33 H LYS 33 -2.972 -5.843 -28.448 277 HA LYS 33 HA LYS 33 -1.398 -3.492 -28.897 278 HB2 LYS 33 2HB LYS 33 -2.511 -4.390 -26.244 279 HB3 LYS 33 3HB LYS 33 -2.176 -2.749 -26.782 280 HG2 LYS 33 2HG LYS 33 -3.972 -3.207 -28.573 281 HG3 LYS 33 3HG LYS 33 -4.442 -4.551 -27.530 282 HD2 LYS 33 2HD LYS 33 -5.796 -2.881 -26.718 283 HD3 LYS 33 3HD LYS 33 -4.392 -2.711 -25.661 284 HE2 LYS 33 2HE LYS 33 -3.546 -1.018 -27.397 285 HE3 LYS 33 3HE LYS 33 -5.202 -1.019 -28.004 286 HZ1 LYS 33 1HZ LYS 33 -5.232 0.699 -26.501 287 HZ2 LYS 33 2HZ LYS 33 -4.176 -0.061 -25.420 288 HZ3 LYS 33 3HZ LYS 33 -5.783 -0.578 -25.537 289 H TYR 34 H TYR 34 -0.992 -6.489 -27.107 290 HA TYR 34 HA TYR 34 1.715 -5.615 -26.341 291 HB2 TYR 34 2HB TYR 34 0.077 -7.823 -25.082 292 HB3 TYR 34 3HB TYR 34 1.618 -7.195 -24.511 293 HD1 TYR 34 HD1 TYR 34 1.742 -5.087 -23.324 294 HD2 TYR 34 HD2 TYR 34 -1.982 -6.554 -24.766 295 HE1 TYR 34 HE1 TYR 34 0.561 -3.451 -21.918 296 HE2 TYR 34 HE2 TYR 34 -3.174 -4.921 -23.365 297 HH TYR 34 HH TYR 34 -2.990 -3.285 -21.883 298 H HIS 35 H HIS 35 0.785 -6.805 -28.907 299 HA HIS 35 HA HIS 35 1.476 -9.486 -29.167 300 HB2 HIS 35 2HB HIS 35 1.053 -7.225 -30.943 301 HB3 HIS 35 3HB HIS 35 2.312 -8.299 -31.546 302 HD1 HIS 35 HD1 HIS 35 -0.613 -9.653 -29.638 303 HD2 HIS 35 HD2 HIS 35 0.689 -9.323 -33.569 304 HE1 HIS 35 HE1 HIS 35 -2.147 -11.125 -30.980 305 HA PRO 36 HA PRO 36 5.840 -9.774 -28.828 306 HB2 PRO 36 2HB PRO 36 6.464 -11.541 -30.793 307 HB3 PRO 36 3HB PRO 36 5.634 -12.012 -29.305 308 HG2 PRO 36 2HG PRO 36 4.493 -11.464 -32.018 309 HG3 PRO 36 3HG PRO 36 4.100 -12.767 -30.881 310 HD2 PRO 36 2HD PRO 36 2.558 -10.558 -31.155 311 HD3 PRO 36 3HD PRO 36 2.731 -11.416 -29.610 312 H ASP 37 H ASP 37 4.473 -8.826 -31.882 313 HA ASP 37 HA ASP 37 6.798 -8.268 -33.332 314 HB2 ASP 37 2HB ASP 37 4.052 -7.016 -33.407 315 HB3 ASP 37 3HB ASP 37 5.326 -6.594 -34.547 316 H THR 38 H THR 38 5.350 -6.631 -30.665 317 HA THR 38 HA THR 38 7.155 -4.336 -31.051 318 HB THR 38 HB THR 38 5.713 -3.001 -29.720 319 HG1 THR 38 HG1 THR 38 4.817 -5.462 -28.817 320 HG21 THR 38 1HG2 THR 38 3.484 -4.372 -31.014 321 HG22 THR 38 2HG2 THR 38 4.864 -4.127 -32.084 322 HG23 THR 38 3HG2 THR 38 4.119 -2.748 -31.276 323 H ASN 39 H ASN 39 7.289 -7.170 -29.626 324 HA ASN 39 HA ASN 39 8.108 -6.320 -26.966 325 HB2 ASN 39 2HB ASN 39 7.574 -8.932 -28.297 326 HB3 ASN 39 3HB ASN 39 8.695 -8.922 -26.939 327 HD21 ASN 39 1HD2 ASN 39 5.785 -7.001 -27.523 328 HD22 ASN 39 2HD2 ASN 39 4.939 -7.535 -26.114 329 H LYS 40 H LYS 40 9.498 -6.700 -30.009 330 HA LYS 40 HA LYS 40 12.001 -7.762 -29.569 331 HB2 LYS 40 2HB LYS 40 10.812 -5.902 -31.504 332 HB3 LYS 40 3HB LYS 40 12.547 -5.704 -31.300 333 HG2 LYS 40 2HG LYS 40 12.515 -7.246 -32.973 334 HG3 LYS 40 3HG LYS 40 12.544 -8.320 -31.573 335 HD2 LYS 40 2HD LYS 40 9.878 -7.464 -32.522 336 HD3 LYS 40 3HD LYS 40 10.775 -8.556 -33.580 337 HE2 LYS 40 2HE LYS 40 11.162 -9.902 -31.375 338 HE3 LYS 40 3HE LYS 40 9.756 -9.003 -30.807 339 HZ1 LYS 40 1HZ LYS 40 8.532 -10.537 -31.809 340 HZ2 LYS 40 2HZ LYS 40 9.873 -11.227 -32.576 341 HZ3 LYS 40 3HZ LYS 40 9.062 -9.928 -33.296 342 H ASP 41 H ASP 41 10.858 -4.487 -28.910 343 HA ASP 41 HA ASP 41 13.383 -3.973 -27.479 344 HB2 ASP 41 2HB ASP 41 11.565 -1.871 -28.663 345 HB3 ASP 41 3HB ASP 41 13.178 -1.639 -27.996 346 H ASP 42 H ASP 42 10.679 -5.128 -26.666 347 HA ASP 42 HA ASP 42 10.423 -3.514 -24.242 348 HB2 ASP 42 2HB ASP 42 8.628 -3.052 -26.160 349 HB3 ASP 42 3HB ASP 42 7.879 -4.481 -25.454 350 HA PRO 43 HA PRO 43 10.654 -8.030 -23.346 351 HB2 PRO 43 2HB PRO 43 12.255 -7.734 -21.174 352 HB3 PRO 43 3HB PRO 43 12.882 -7.833 -22.823 353 HG2 PRO 43 2HG PRO 43 12.404 -5.418 -21.120 354 HG3 PRO 43 3HG PRO 43 13.784 -5.792 -22.168 355 HD2 PRO 43 2HD PRO 43 11.795 -4.117 -22.922 356 HD3 PRO 43 3HD PRO 43 12.672 -5.139 -24.078 357 H LYS 44 H LYS 44 9.433 -5.267 -21.825 358 HA LYS 44 HA LYS 44 8.429 -6.714 -19.496 359 HB2 LYS 44 2HB LYS 44 8.776 -3.874 -20.235 360 HB3 LYS 44 3HB LYS 44 7.351 -4.237 -19.270 361 HG2 LYS 44 2HG LYS 44 8.637 -5.054 -17.484 362 HG3 LYS 44 3HG LYS 44 10.092 -5.168 -18.477 363 HD2 LYS 44 2HD LYS 44 9.909 -2.635 -18.731 364 HD3 LYS 44 3HD LYS 44 8.739 -2.703 -17.411 365 HE2 LYS 44 2HE LYS 44 10.612 -4.069 -16.209 366 HE3 LYS 44 3HE LYS 44 11.668 -3.296 -17.390 367 HZ1 LYS 44 1HZ LYS 44 11.728 -1.587 -15.996 368 HZ2 LYS 44 2HZ LYS 44 10.466 -2.196 -15.049 369 HZ3 LYS 44 3HZ LYS 44 10.122 -1.263 -16.417 370 H ALA 45 H ALA 45 7.449 -5.773 -22.626 371 HA ALA 45 HA ALA 45 4.668 -5.494 -22.228 372 HB1 ALA 45 1HB ALA 45 4.620 -6.169 -24.725 373 HB2 ALA 45 2HB ALA 45 5.414 -4.664 -24.259 374 HB3 ALA 45 3HB ALA 45 6.378 -6.099 -24.607 375 H LYS 46 H LYS 46 6.720 -8.286 -22.895 376 HA LYS 46 HA LYS 46 4.752 -10.181 -23.435 377 HB2 LYS 46 2HB LYS 46 6.391 -11.846 -22.934 378 HB3 LYS 46 3HB LYS 46 7.232 -10.490 -23.674 379 HG2 LYS 46 2HG LYS 46 7.839 -9.716 -21.378 380 HG3 LYS 46 3HG LYS 46 7.162 -11.224 -20.758 381 HD2 LYS 46 2HD LYS 46 9.543 -11.479 -20.995 382 HD3 LYS 46 3HD LYS 46 8.741 -12.470 -22.216 383 HE2 LYS 46 2HE LYS 46 9.502 -11.203 -23.936 384 HE3 LYS 46 3HE LYS 46 9.444 -9.708 -23.004 385 HZ1 LYS 46 1HZ LYS 46 11.665 -11.308 -23.560 386 HZ2 LYS 46 2HZ LYS 46 11.400 -11.378 -21.891 387 HZ3 LYS 46 3HZ LYS 46 11.608 -9.881 -22.652 388 H GLU 47 H GLU 47 5.875 -8.869 -20.387 389 HA GLU 47 HA GLU 47 4.643 -10.796 -18.708 390 HB2 GLU 47 2HB GLU 47 6.484 -9.172 -18.069 391 HB3 GLU 47 3HB GLU 47 5.243 -7.930 -17.984 392 HG2 GLU 47 2HG GLU 47 4.077 -9.213 -16.261 393 HG3 GLU 47 3HG GLU 47 5.332 -10.449 -16.340 394 H LYS 48 H LYS 48 3.601 -7.694 -20.027 395 HA LYS 48 HA LYS 48 1.158 -7.578 -18.570 396 HB2 LYS 48 2HB LYS 48 1.714 -6.216 -21.203 397 HB3 LYS 48 3HB LYS 48 0.610 -5.703 -19.933 398 HG2 LYS 48 2HG LYS 48 3.617 -5.742 -19.771 399 HG3 LYS 48 3HG LYS 48 2.592 -4.316 -19.954 400 HD2 LYS 48 2HD LYS 48 1.580 -4.746 -17.781 401 HD3 LYS 48 3HD LYS 48 2.551 -6.209 -17.602 402 HE2 LYS 48 2HE LYS 48 3.856 -4.763 -16.423 403 HE3 LYS 48 3HE LYS 48 4.529 -4.497 -18.030 404 HZ1 LYS 48 1HZ LYS 48 3.716 -2.424 -18.118 405 HZ2 LYS 48 2HZ LYS 48 3.649 -2.546 -16.432 406 HZ3 LYS 48 3HZ LYS 48 2.261 -2.829 -17.356 407 H PHE 49 H PHE 49 2.116 -8.913 -21.669 408 HA PHE 49 HA PHE 49 -0.488 -9.363 -22.683 409 HB2 PHE 49 2HB PHE 49 1.346 -9.381 -24.219 410 HB3 PHE 49 3HB PHE 49 2.177 -10.638 -23.307 411 HD1 PHE 49 HD1 PHE 49 -0.480 -9.910 -25.697 412 HD2 PHE 49 HD2 PHE 49 1.477 -12.954 -23.456 413 HE1 PHE 49 HE1 PHE 49 -1.534 -11.625 -27.113 414 HE2 PHE 49 HE2 PHE 49 0.428 -14.673 -24.869 415 HZ PHE 49 HZ PHE 49 -1.079 -14.010 -26.700 416 H SER 50 H SER 50 1.631 -11.196 -20.583 417 HA SER 50 HA SER 50 0.373 -13.688 -20.708 418 HB2 SER 50 2HB SER 50 2.493 -13.541 -19.621 419 HB3 SER 50 3HB SER 50 1.901 -12.331 -18.483 420 HG SER 50 HG SER 50 1.712 -15.058 -18.394 421 H GLN 51 H GLN 51 -0.410 -10.796 -18.880 422 HA GLN 51 HA GLN 51 -2.317 -11.957 -17.150 423 HB2 GLN 51 2HB GLN 51 -1.923 -9.132 -18.127 424 HB3 GLN 51 3HB GLN 51 -3.164 -9.570 -16.960 425 HG2 GLN 51 2HG GLN 51 -0.259 -10.180 -16.524 426 HG3 GLN 51 3HG GLN 51 -0.994 -8.652 -16.041 427 HE21 GLN 51 1HE2 GLN 51 -1.670 -8.566 -14.032 428 HE22 GLN 51 2HE2 GLN 51 -2.154 -9.908 -13.057 429 H LEU 52 H LEU 52 -2.449 -10.917 -20.456 430 HA LEU 52 HA LEU 52 -5.246 -10.608 -20.698 431 HB2 LEU 52 2HB LEU 52 -3.242 -11.421 -22.798 432 HB3 LEU 52 3HB LEU 52 -4.873 -10.825 -23.100 433 HG LEU 52 HG LEU 52 -2.748 -9.186 -21.734 434 HD11 LEU 52 1HD1 LEU 52 -2.413 -10.017 -24.237 435 HD12 LEU 52 2HD1 LEU 52 -1.977 -8.390 -23.714 436 HD13 LEU 52 3HD1 LEU 52 -3.505 -8.668 -24.551 437 HD21 LEU 52 1HD2 LEU 52 -4.496 -7.510 -23.000 438 HD22 LEU 52 2HD2 LEU 52 -4.555 -7.943 -21.291 439 HD23 LEU 52 3HD2 LEU 52 -5.555 -8.811 -22.456 440 H ALA 53 H ALA 53 -3.117 -13.356 -21.474 441 HA ALA 53 HA ALA 53 -5.214 -15.111 -22.205 442 HB1 ALA 53 1HB ALA 53 -2.341 -15.234 -21.932 443 HB2 ALA 53 2HB ALA 53 -3.110 -16.709 -21.344 444 HB3 ALA 53 3HB ALA 53 -3.413 -16.152 -22.989 445 H GLU 54 H GLU 54 -3.578 -14.442 -19.159 446 HA GLU 54 HA GLU 54 -4.563 -16.604 -17.673 447 HB2 GLU 54 2HB GLU 54 -3.654 -13.840 -16.905 448 HB3 GLU 54 3HB GLU 54 -4.234 -14.981 -15.700 449 HG2 GLU 54 2HG GLU 54 -2.102 -15.844 -17.586 450 HG3 GLU 54 3HG GLU 54 -1.685 -14.771 -16.251 451 H ALA 55 H ALA 55 -5.837 -13.300 -18.020 452 HA ALA 55 HA ALA 55 -8.158 -13.794 -16.445 453 HB1 ALA 55 1HB ALA 55 -8.296 -11.624 -18.424 454 HB2 ALA 55 2HB ALA 55 -8.574 -11.596 -16.682 455 HB3 ALA 55 3HB ALA 55 -6.928 -11.549 -17.312 456 H TYR 56 H TYR 56 -7.413 -14.002 -19.867 457 HA TYR 56 HA TYR 56 -10.102 -14.261 -20.759 458 HB2 TYR 56 2HB TYR 56 -8.533 -13.571 -22.387 459 HB3 TYR 56 3HB TYR 56 -7.434 -14.892 -22.007 460 HD1 TYR 56 HD1 TYR 56 -10.480 -13.933 -23.797 461 HD2 TYR 56 HD2 TYR 56 -7.819 -17.125 -22.884 462 HE1 TYR 56 HE1 TYR 56 -11.473 -15.271 -25.606 463 HE2 TYR 56 HE2 TYR 56 -8.803 -18.471 -24.691 464 HH TYR 56 HH TYR 56 -11.605 -17.335 -26.510 465 H GLU 57 H GLU 57 -7.756 -16.458 -19.457 466 HA GLU 57 HA GLU 57 -8.726 -18.891 -20.430 467 HB2 GLU 57 2HB GLU 57 -7.133 -18.048 -18.062 468 HB3 GLU 57 3HB GLU 57 -7.828 -19.663 -18.038 469 HG2 GLU 57 2HG GLU 57 -6.524 -20.404 -19.768 470 HG3 GLU 57 3HG GLU 57 -6.313 -18.790 -20.444 471 H VAL 58 H VAL 58 -9.547 -17.168 -17.426 472 HA VAL 58 HA VAL 58 -11.571 -19.051 -16.686 473 HB VAL 58 HB VAL 58 -11.220 -16.240 -15.643 474 HG11 VAL 58 1HG1 VAL 58 -12.548 -16.839 -13.855 475 HG12 VAL 58 2HG1 VAL 58 -13.325 -17.709 -15.180 476 HG13 VAL 58 3HG1 VAL 58 -12.249 -18.563 -14.073 477 HG21 VAL 58 1HG2 VAL 58 -9.112 -17.449 -15.470 478 HG22 VAL 58 2HG2 VAL 58 -9.836 -17.229 -13.877 479 HG23 VAL 58 3HG2 VAL 58 -9.934 -18.795 -14.682 480 H LEU 59 H LEU 59 -11.559 -15.837 -18.168 481 HA LEU 59 HA LEU 59 -14.383 -15.552 -18.244 482 HB2 LEU 59 2HB LEU 59 -12.056 -14.167 -19.461 483 HB3 LEU 59 3HB LEU 59 -13.638 -13.910 -20.195 484 HG LEU 59 HG LEU 59 -12.979 -12.155 -18.568 485 HD11 LEU 59 1HD1 LEU 59 -15.290 -12.368 -19.003 486 HD12 LEU 59 2HD1 LEU 59 -15.130 -12.269 -17.250 487 HD13 LEU 59 3HD1 LEU 59 -15.417 -13.828 -18.022 488 HD21 LEU 59 1HD2 LEU 59 -13.168 -12.759 -16.147 489 HD22 LEU 59 2HD2 LEU 59 -11.744 -13.411 -16.960 490 HD23 LEU 59 3HD2 LEU 59 -13.127 -14.456 -16.629 491 H SER 60 H SER 60 -12.286 -17.525 -19.971 492 HA SER 60 HA SER 60 -13.616 -17.517 -22.500 493 HB2 SER 60 2HB SER 60 -11.355 -18.252 -22.508 494 HB3 SER 60 3HB SER 60 -11.648 -19.406 -21.208 495 HG SER 60 HG SER 60 -11.777 -20.694 -22.906 496 H ASP 61 H ASP 61 -14.386 -18.796 -19.473 497 HA ASP 61 HA ASP 61 -16.515 -20.414 -20.675 498 HB2 ASP 61 2HB ASP 61 -14.344 -21.644 -19.623 499 HB3 ASP 61 3HB ASP 61 -15.349 -21.500 -18.183 500 H GLU 62 H GLU 62 -18.453 -20.330 -19.627 501 HA GLU 62 HA GLU 62 -18.922 -18.167 -17.869 502 HB2 GLU 62 2HB GLU 62 -20.767 -20.510 -18.336 503 HB3 GLU 62 3HB GLU 62 -21.208 -18.883 -17.837 504 HG2 GLU 62 2HG GLU 62 -20.506 -18.021 -20.008 505 HG3 GLU 62 3HG GLU 62 -20.053 -19.649 -20.509 506 H VAL 63 H VAL 63 -18.515 -21.626 -17.366 507 HA VAL 63 HA VAL 63 -19.327 -21.727 -14.672 508 HB VAL 63 HB VAL 63 -17.243 -23.490 -15.960 509 HG11 VAL 63 1HG1 VAL 63 -18.064 -23.409 -13.363 510 HG12 VAL 63 2HG1 VAL 63 -19.155 -24.615 -14.048 511 HG13 VAL 63 3HG1 VAL 63 -17.408 -24.832 -14.171 512 HG21 VAL 63 1HG2 VAL 63 -19.730 -24.778 -15.984 513 HG22 VAL 63 2HG2 VAL 63 -20.023 -23.157 -16.614 514 HG23 VAL 63 3HG2 VAL 63 -18.812 -24.192 -17.371 515 H LYS 64 H LYS 64 -16.090 -21.401 -16.115 516 HA LYS 64 HA LYS 64 -14.711 -21.195 -13.655 517 HB2 LYS 64 2HB LYS 64 -14.014 -20.412 -16.479 518 HB3 LYS 64 3HB LYS 64 -12.911 -20.124 -15.139 519 HG2 LYS 64 2HG LYS 64 -13.404 -22.704 -14.706 520 HG3 LYS 64 3HG LYS 64 -13.693 -22.658 -16.447 521 HD2 LYS 64 2HD LYS 64 -11.398 -23.198 -16.137 522 HD3 LYS 64 3HD LYS 64 -11.462 -21.520 -16.682 523 HE2 LYS 64 2HE LYS 64 -10.020 -21.256 -14.948 524 HE3 LYS 64 3HE LYS 64 -11.532 -21.092 -14.055 525 HZ1 LYS 64 1HZ LYS 64 -10.756 -23.819 -14.281 526 HZ2 LYS 64 2HZ LYS 64 -11.075 -22.909 -12.892 527 HZ3 LYS 64 3HZ LYS 64 -9.525 -22.902 -13.569 528 H ARG 65 H ARG 65 -15.957 -18.758 -15.910 529 HA ARG 65 HA ARG 65 -14.970 -16.504 -14.541 530 HB2 ARG 65 2HB ARG 65 -15.762 -16.409 -16.860 531 HB3 ARG 65 3HB ARG 65 -17.401 -16.748 -16.320 532 HG2 ARG 65 2HG ARG 65 -17.003 -14.598 -14.853 533 HG3 ARG 65 3HG ARG 65 -15.810 -14.251 -16.107 534 HD2 ARG 65 2HD ARG 65 -17.383 -13.825 -17.656 535 HD3 ARG 65 3HD ARG 65 -18.414 -15.148 -17.113 536 HE ARG 65 HE ARG 65 -18.358 -12.880 -15.336 537 HH11 ARG 65 1HH1 ARG 65 -19.885 -14.339 -18.104 538 HH12 ARG 65 2HH1 ARG 65 -21.367 -13.462 -17.911 539 HH21 ARG 65 1HH2 ARG 65 -20.304 -11.721 -15.072 540 HH22 ARG 65 2HH2 ARG 65 -21.604 -11.973 -16.187 541 H LYS 66 H LYS 66 -18.025 -18.268 -14.305 542 HA LYS 66 HA LYS 66 -19.315 -16.512 -12.523 543 HB2 LYS 66 2HB LYS 66 -19.663 -19.408 -13.222 544 HB3 LYS 66 3HB LYS 66 -20.587 -18.704 -11.901 545 HG2 LYS 66 2HG LYS 66 -20.571 -17.619 -14.708 546 HG3 LYS 66 3HG LYS 66 -21.775 -18.749 -14.084 547 HD2 LYS 66 2HD LYS 66 -22.385 -17.123 -12.349 548 HD3 LYS 66 3HD LYS 66 -21.196 -15.992 -12.999 549 HE2 LYS 66 2HE LYS 66 -22.402 -15.836 -15.072 550 HE3 LYS 66 3HE LYS 66 -23.516 -17.107 -14.570 551 HZ1 LYS 66 1HZ LYS 66 -23.525 -14.301 -13.932 552 HZ2 LYS 66 2HZ LYS 66 -23.735 -15.295 -12.579 553 HZ3 LYS 66 3HZ LYS 66 -24.791 -15.423 -13.894 554 H GLN 67 H GLN 67 -17.333 -19.400 -11.956 555 HA GLN 67 HA GLN 67 -17.606 -19.517 -9.179 556 HB2 GLN 67 2HB GLN 67 -15.427 -20.412 -11.050 557 HB3 GLN 67 3HB GLN 67 -15.298 -20.650 -9.312 558 HG2 GLN 67 2HG GLN 67 -17.432 -21.750 -11.126 559 HG3 GLN 67 3HG GLN 67 -16.127 -22.652 -10.357 560 HE21 GLN 67 1HE2 GLN 67 -19.260 -21.333 -10.012 561 HE22 GLN 67 2HE2 GLN 67 -19.553 -21.860 -8.393 562 H TYR 68 H TYR 68 -15.263 -17.776 -11.184 563 HA TYR 68 HA TYR 68 -13.752 -16.754 -9.007 564 HB2 TYR 68 2HB TYR 68 -12.845 -16.917 -11.289 565 HB3 TYR 68 3HB TYR 68 -13.999 -15.706 -11.836 566 HD1 TYR 68 HD1 TYR 68 -11.169 -16.215 -9.473 567 HD2 TYR 68 HD2 TYR 68 -13.456 -13.435 -11.741 568 HE1 TYR 68 HE1 TYR 68 -9.566 -14.440 -8.902 569 HE2 TYR 68 HE2 TYR 68 -11.858 -11.652 -11.177 570 HH TYR 68 HH TYR 68 -9.467 -12.023 -8.765 571 H ASP 69 H ASP 69 -16.579 -15.643 -10.748 572 HA ASP 69 HA ASP 69 -16.585 -12.980 -9.793 573 HB2 ASP 69 2HB ASP 69 -17.940 -14.050 -11.732 574 HB3 ASP 69 3HB ASP 69 -19.094 -14.486 -10.475 575 H ALA 70 H ALA 70 -17.608 -16.001 -8.421 576 HA ALA 70 HA ALA 70 -19.374 -15.033 -6.453 577 HB1 ALA 70 1HB ALA 70 -17.660 -17.510 -6.525 578 HB2 ALA 70 2HB ALA 70 -18.873 -17.184 -5.286 579 HB3 ALA 70 3HB ALA 70 -19.361 -17.365 -6.971 580 H TYR 71 H TYR 71 -15.872 -15.452 -6.494 581 HA TYR 71 HA TYR 71 -15.707 -14.371 -3.773 582 HB2 TYR 71 2HB TYR 71 -13.741 -15.855 -5.507 583 HB3 TYR 71 3HB TYR 71 -13.243 -15.022 -4.039 584 HD1 TYR 71 HD1 TYR 71 -13.960 -15.832 -1.845 585 HD2 TYR 71 HD2 TYR 71 -15.030 -17.895 -5.409 586 HE1 TYR 71 HE1 TYR 71 -14.584 -17.801 -0.510 587 HE2 TYR 71 HE2 TYR 71 -15.658 -19.870 -4.084 588 HH TYR 71 HH TYR 71 -14.949 -20.110 -0.694 589 H GLY 72 H GLY 72 -16.321 -12.795 -6.221 590 HA2 GLY 72 2HA GLY 72 -13.972 -11.218 -6.764 591 HA3 GLY 72 3HA GLY 72 -15.601 -10.899 -7.340 592 H SER 73 H SER 73 -14.709 -8.662 -6.802 593 HA SER 73 HA SER 73 -14.996 -8.035 -3.952 594 HB2 SER 73 2HB SER 73 -13.038 -7.234 -5.541 595 HB3 SER 73 3HB SER 73 -14.200 -5.980 -5.974 596 HG SER 73 HG SER 73 -13.336 -5.078 -4.253 Start of MODEL 9 1 H1 HIS 1 H HIS 1 1.988 2.080 0.060 2 HA HIS 1 HA HIS 1 0.424 2.706 -2.358 3 HB2 HIS 1 2HB HIS 1 3.031 3.008 -2.375 4 HB3 HIS 1 3HB HIS 1 3.038 1.253 -2.525 5 HD1 HIS 1 HD1 HIS 1 4.106 1.636 -4.914 6 HD2 HIS 1 HD2 HIS 1 0.210 3.007 -4.465 7 HE1 HIS 1 HE1 HIS 1 3.252 2.014 -7.250 8 H MET 2 H MET 2 -0.641 1.050 -3.343 9 HA MET 2 HA MET 2 -0.107 -1.700 -2.634 10 HB2 MET 2 2HB MET 2 -1.615 -0.763 -0.817 11 HB3 MET 2 3HB MET 2 -2.854 -0.597 -2.053 12 HG2 MET 2 2HG MET 2 -2.938 -2.944 -2.403 13 HG3 MET 2 3HG MET 2 -1.503 -3.202 -1.412 14 HE1 MET 2 1HE MET 2 -3.781 -4.918 -1.140 15 HE2 MET 2 2HE MET 2 -4.747 -4.759 0.327 16 HE3 MET 2 3HE MET 2 -5.245 -3.934 -1.151 17 H LEU 3 H LEU 3 -0.501 -2.981 -4.328 18 HA LEU 3 HA LEU 3 -1.443 -1.895 -6.774 19 HB2 LEU 3 2HB LEU 3 -0.577 -4.576 -5.821 20 HB3 LEU 3 3HB LEU 3 -1.476 -4.479 -7.333 21 HG LEU 3 HG LEU 3 0.326 -2.731 -7.998 22 HD11 LEU 3 1HD1 LEU 3 1.444 -3.940 -5.529 23 HD12 LEU 3 2HD1 LEU 3 1.623 -2.310 -6.175 24 HD13 LEU 3 3HD1 LEU 3 2.542 -3.641 -6.876 25 HD21 LEU 3 1HD2 LEU 3 0.031 -4.912 -9.056 26 HD22 LEU 3 2HD2 LEU 3 0.984 -5.667 -7.779 27 HD23 LEU 3 3HD2 LEU 3 1.740 -4.514 -8.879 28 H ALA 4 H ALA 4 -3.481 -1.531 -7.314 29 HA ALA 4 HA ALA 4 -5.703 -2.422 -5.846 30 HB1 ALA 4 1HB ALA 4 -6.738 -0.874 -7.052 31 HB2 ALA 4 2HB ALA 4 -5.236 -0.625 -7.943 32 HB3 ALA 4 3HB ALA 4 -6.438 -1.767 -8.543 33 H LYS 5 H LYS 5 -7.166 -4.054 -6.152 34 HA LYS 5 HA LYS 5 -6.291 -6.230 -7.901 35 HB2 LYS 5 2HB LYS 5 -8.435 -6.292 -5.775 36 HB3 LYS 5 3HB LYS 5 -7.687 -7.672 -6.568 37 HG2 LYS 5 2HG LYS 5 -5.549 -7.114 -5.521 38 HG3 LYS 5 3HG LYS 5 -6.306 -5.734 -4.721 39 HD2 LYS 5 2HD LYS 5 -7.717 -7.158 -3.431 40 HD3 LYS 5 3HD LYS 5 -7.248 -8.575 -4.374 41 HE2 LYS 5 2HE LYS 5 -5.381 -6.953 -2.647 42 HE3 LYS 5 3HE LYS 5 -6.151 -8.461 -2.155 43 HZ1 LYS 5 1HZ LYS 5 -4.092 -8.043 -4.232 44 HZ2 LYS 5 2HZ LYS 5 -5.055 -9.433 -4.220 45 HZ3 LYS 5 3HZ LYS 5 -4.053 -9.088 -2.901 46 H GLU 6 H GLU 6 -7.071 -5.890 -9.912 47 HA GLU 6 HA GLU 6 -9.895 -5.161 -10.220 48 HB2 GLU 6 2HB GLU 6 -9.266 -4.798 -12.623 49 HB3 GLU 6 3HB GLU 6 -8.448 -3.741 -11.481 50 HG2 GLU 6 2HG GLU 6 -6.419 -4.898 -11.696 51 HG3 GLU 6 3HG GLU 6 -7.192 -6.272 -12.484 52 H ASP 7 H ASP 7 -11.367 -6.510 -11.093 53 HA ASP 7 HA ASP 7 -10.868 -9.278 -11.170 54 HB2 ASP 7 2HB ASP 7 -13.164 -7.654 -12.278 55 HB3 ASP 7 3HB ASP 7 -13.146 -9.414 -12.215 56 H TYR 8 H TYR 8 -11.660 -10.562 -13.222 57 HA TYR 8 HA TYR 8 -9.683 -10.175 -15.208 58 HB2 TYR 8 2HB TYR 8 -12.160 -11.904 -15.365 59 HB3 TYR 8 3HB TYR 8 -10.706 -12.065 -16.344 60 HD1 TYR 8 HD1 TYR 8 -12.257 -13.934 -14.207 61 HD2 TYR 8 HD2 TYR 8 -8.616 -11.732 -14.254 62 HE1 TYR 8 HE1 TYR 8 -11.311 -15.474 -12.539 63 HE2 TYR 8 HE2 TYR 8 -7.660 -13.267 -12.587 64 HH TYR 8 HH TYR 8 -8.054 -14.979 -11.221 65 H TYR 9 H TYR 9 -12.971 -9.117 -14.887 66 HA TYR 9 HA TYR 9 -13.729 -8.657 -17.498 67 HB2 TYR 9 2HB TYR 9 -14.272 -6.813 -15.164 68 HB3 TYR 9 3HB TYR 9 -15.222 -6.946 -16.640 69 HD1 TYR 9 HD1 TYR 9 -14.822 -8.102 -13.301 70 HD2 TYR 9 HD2 TYR 9 -16.316 -9.233 -17.121 71 HE1 TYR 9 HE1 TYR 9 -16.222 -9.823 -12.238 72 HE2 TYR 9 HE2 TYR 9 -17.721 -10.956 -16.069 73 HH TYR 9 HH TYR 9 -18.613 -11.042 -13.105 74 H GLN 10 H GLN 10 -11.817 -6.550 -15.374 75 HA GLN 10 HA GLN 10 -11.477 -4.521 -17.359 76 HB2 GLN 10 2HB GLN 10 -10.225 -5.054 -14.678 77 HB3 GLN 10 3HB GLN 10 -9.642 -3.759 -15.715 78 HG2 GLN 10 2HG GLN 10 -11.129 -2.589 -14.470 79 HG3 GLN 10 3HG GLN 10 -12.204 -3.125 -15.761 80 HE21 GLN 10 1HE2 GLN 10 -14.102 -3.416 -14.806 81 HE22 GLN 10 2HE2 GLN 10 -14.384 -4.391 -13.408 82 H ILE 11 H ILE 11 -9.571 -7.257 -16.221 83 HA ILE 11 HA ILE 11 -7.173 -6.669 -17.549 84 HB ILE 11 HB ILE 11 -8.315 -9.395 -16.923 85 HG12 ILE 11 2HG1 ILE 11 -6.371 -7.740 -15.305 86 HG13 ILE 11 3HG1 ILE 11 -8.099 -7.807 -14.980 87 HG21 ILE 11 1HG2 ILE 11 -6.573 -9.859 -18.355 88 HG22 ILE 11 2HG2 ILE 11 -5.640 -8.452 -17.848 89 HG23 ILE 11 3HG2 ILE 11 -5.751 -9.862 -16.795 90 HD11 ILE 11 1HD1 ILE 11 -6.872 -10.437 -15.167 91 HD12 ILE 11 2HD1 ILE 11 -6.194 -9.434 -13.884 92 HD13 ILE 11 3HD1 ILE 11 -7.927 -9.758 -13.928 93 H LEU 12 H LEU 12 -10.203 -7.749 -18.745 94 HA LEU 12 HA LEU 12 -8.985 -8.443 -21.334 95 HB2 LEU 12 2HB LEU 12 -11.359 -9.426 -19.868 96 HB3 LEU 12 3HB LEU 12 -11.514 -9.286 -21.618 97 HG LEU 12 HG LEU 12 -9.352 -10.873 -20.237 98 HD11 LEU 12 1HD1 LEU 12 -12.137 -11.487 -20.662 99 HD12 LEU 12 2HD1 LEU 12 -10.899 -12.405 -19.805 100 HD13 LEU 12 3HD1 LEU 12 -11.096 -12.603 -21.546 101 HD21 LEU 12 1HD2 LEU 12 -8.758 -11.661 -22.338 102 HD22 LEU 12 2HD2 LEU 12 -9.085 -9.954 -22.636 103 HD23 LEU 12 3HD2 LEU 12 -10.288 -11.171 -23.066 104 H GLY 13 H GLY 13 -10.814 -6.110 -19.694 105 HA2 GLY 13 2HA GLY 13 -11.564 -4.061 -20.469 106 HA3 GLY 13 3HA GLY 13 -11.108 -4.549 -22.094 107 H VAL 14 H VAL 14 -13.153 -6.630 -20.236 108 HA VAL 14 HA VAL 14 -15.416 -5.876 -21.964 109 HB VAL 14 HB VAL 14 -16.265 -8.128 -21.707 110 HG11 VAL 14 1HG1 VAL 14 -13.611 -9.019 -22.351 111 HG12 VAL 14 2HG1 VAL 14 -14.998 -8.776 -23.414 112 HG13 VAL 14 3HG1 VAL 14 -13.912 -7.432 -23.059 113 HG21 VAL 14 1HG2 VAL 14 -14.988 -9.848 -20.506 114 HG22 VAL 14 2HG2 VAL 14 -13.852 -8.614 -19.962 115 HG23 VAL 14 3HG2 VAL 14 -15.532 -8.562 -19.429 116 HA PRO 15 HA PRO 15 -17.808 -4.689 -18.477 117 HB2 PRO 15 2HB PRO 15 -20.300 -5.358 -19.320 118 HB3 PRO 15 3HB PRO 15 -19.403 -3.981 -19.972 119 HG2 PRO 15 2HG PRO 15 -19.744 -6.729 -21.109 120 HG3 PRO 15 3HG PRO 15 -19.816 -5.160 -21.933 121 HD2 PRO 15 2HD PRO 15 -17.625 -6.750 -22.015 122 HD3 PRO 15 3HD PRO 15 -17.522 -4.978 -22.055 123 H ARG 16 H ARG 16 -19.587 -5.541 -16.990 124 HA ARG 16 HA ARG 16 -18.786 -8.136 -16.052 125 HB2 ARG 16 2HB ARG 16 -20.909 -6.223 -15.065 126 HB3 ARG 16 3HB ARG 16 -20.443 -7.706 -14.243 127 HG2 ARG 16 2HG ARG 16 -18.415 -6.862 -13.574 128 HG3 ARG 16 3HG ARG 16 -18.354 -5.682 -14.885 129 HD2 ARG 16 2HD ARG 16 -18.763 -4.434 -12.930 130 HD3 ARG 16 3HD ARG 16 -20.316 -4.541 -13.757 131 HE ARG 16 HE ARG 16 -20.034 -6.646 -11.884 132 HH11 ARG 16 1HH1 ARG 16 -20.649 -3.227 -12.106 133 HH12 ARG 16 2HH1 ARG 16 -21.556 -3.162 -10.631 134 HH21 ARG 16 1HH2 ARG 16 -21.226 -6.574 -9.940 135 HH22 ARG 16 2HH2 ARG 16 -21.883 -5.066 -9.400 136 H ASN 17 H ASN 17 -20.999 -7.087 -18.322 137 HA ASN 17 HA ASN 17 -22.673 -9.484 -17.957 138 HB2 ASN 17 2HB ASN 17 -24.338 -8.221 -19.407 139 HB3 ASN 17 3HB ASN 17 -24.085 -7.580 -17.786 140 HD21 ASN 17 1HD2 ASN 17 -24.705 -5.516 -18.279 141 HD22 ASN 17 2HD2 ASN 17 -23.781 -4.470 -19.298 142 H ALA 18 H ALA 18 -20.090 -8.551 -19.604 143 HA ALA 18 HA ALA 18 -20.577 -8.879 -22.308 144 HB1 ALA 18 1HB ALA 18 -18.102 -10.153 -21.425 145 HB2 ALA 18 2HB ALA 18 -18.352 -8.781 -22.506 146 HB3 ALA 18 3HB ALA 18 -18.346 -8.538 -20.759 147 H SER 19 H SER 19 -20.143 -10.717 -23.713 148 HA SER 19 HA SER 19 -21.074 -13.228 -22.493 149 HB2 SER 19 2HB SER 19 -21.118 -12.753 -25.451 150 HB3 SER 19 3HB SER 19 -22.193 -13.741 -24.460 151 HG SER 19 HG SER 19 -23.427 -12.066 -24.156 152 H GLN 20 H GLN 20 -20.234 -15.241 -23.428 153 HA GLN 20 HA GLN 20 -17.463 -15.392 -23.330 154 HB2 GLN 20 2HB GLN 20 -19.236 -17.352 -24.787 155 HB3 GLN 20 3HB GLN 20 -17.682 -17.673 -24.030 156 HG2 GLN 20 2HG GLN 20 -20.303 -17.087 -22.690 157 HG3 GLN 20 3HG GLN 20 -19.340 -18.561 -22.605 158 HE21 GLN 20 1HE2 GLN 20 -17.257 -18.418 -21.536 159 HE22 GLN 20 2HE2 GLN 20 -17.053 -17.304 -20.232 160 H LYS 21 H LYS 21 -19.563 -14.665 -25.986 161 HA LYS 21 HA LYS 21 -17.636 -15.191 -28.047 162 HB2 LYS 21 2HB LYS 21 -20.227 -13.634 -28.081 163 HB3 LYS 21 3HB LYS 21 -19.263 -13.989 -29.508 164 HG2 LYS 21 2HG LYS 21 -19.592 -16.378 -29.148 165 HG3 LYS 21 3HG LYS 21 -20.545 -16.032 -27.703 166 HD2 LYS 21 2HD LYS 21 -22.122 -16.411 -29.408 167 HD3 LYS 21 3HD LYS 21 -22.057 -14.657 -29.220 168 HE2 LYS 21 2HE LYS 21 -20.340 -14.694 -31.108 169 HE3 LYS 21 3HE LYS 21 -20.858 -16.355 -31.391 170 HZ1 LYS 21 1HZ LYS 21 -22.813 -15.694 -32.250 171 HZ2 LYS 21 2HZ LYS 21 -21.983 -14.253 -32.558 172 HZ3 LYS 21 3HZ LYS 21 -22.979 -14.380 -31.196 173 H GLU 22 H GLU 22 -18.943 -12.244 -26.539 174 HA GLU 22 HA GLU 22 -17.384 -10.414 -27.986 175 HB2 GLU 22 2HB GLU 22 -19.357 -9.765 -26.673 176 HB3 GLU 22 3HB GLU 22 -18.499 -10.152 -25.188 177 HG2 GLU 22 2HG GLU 22 -18.637 -7.707 -25.858 178 HG3 GLU 22 3HG GLU 22 -17.054 -8.336 -25.404 179 H ILE 23 H ILE 23 -16.742 -12.218 -25.036 180 HA ILE 23 HA ILE 23 -14.442 -10.872 -24.187 181 HB ILE 23 HB ILE 23 -15.119 -13.800 -23.883 182 HG12 ILE 23 2HG1 ILE 23 -15.396 -11.783 -21.700 183 HG13 ILE 23 3HG1 ILE 23 -16.626 -11.821 -22.959 184 HG21 ILE 23 1HG2 ILE 23 -13.565 -13.756 -21.983 185 HG22 ILE 23 2HG2 ILE 23 -12.754 -13.408 -23.509 186 HG23 ILE 23 3HG2 ILE 23 -13.129 -12.097 -22.391 187 HD11 ILE 23 1HD1 ILE 23 -16.148 -14.481 -22.084 188 HD12 ILE 23 2HD1 ILE 23 -16.404 -13.453 -20.674 189 HD13 ILE 23 3HD1 ILE 23 -17.617 -13.515 -21.952 190 H LYS 24 H LYS 24 -14.911 -13.314 -26.651 191 HA LYS 24 HA LYS 24 -12.222 -14.060 -27.018 192 HB2 LYS 24 2HB LYS 24 -14.555 -14.052 -28.937 193 HB3 LYS 24 3HB LYS 24 -12.993 -14.770 -29.303 194 HG2 LYS 24 2HG LYS 24 -13.270 -16.477 -27.757 195 HG3 LYS 24 3HG LYS 24 -14.514 -15.598 -26.865 196 HD2 LYS 24 2HD LYS 24 -15.727 -17.216 -28.016 197 HD3 LYS 24 3HD LYS 24 -15.891 -15.787 -29.039 198 HE2 LYS 24 2HE LYS 24 -13.611 -17.621 -29.556 199 HE3 LYS 24 3HE LYS 24 -15.224 -18.157 -30.025 200 HZ1 LYS 24 1HZ LYS 24 -13.562 -16.080 -31.166 201 HZ2 LYS 24 2HZ LYS 24 -15.194 -15.669 -30.996 202 HZ3 LYS 24 3HZ LYS 24 -14.755 -17.035 -31.893 203 H LYS 25 H LYS 25 -14.170 -11.471 -28.420 204 HA LYS 25 HA LYS 25 -12.189 -10.600 -30.268 205 HB2 LYS 25 2HB LYS 25 -14.668 -9.311 -29.139 206 HB3 LYS 25 3HB LYS 25 -13.615 -8.474 -30.272 207 HG2 LYS 25 2HG LYS 25 -14.204 -9.817 -32.029 208 HG3 LYS 25 3HG LYS 25 -14.623 -11.180 -30.989 209 HD2 LYS 25 2HD LYS 25 -16.316 -8.907 -30.445 210 HD3 LYS 25 3HD LYS 25 -16.373 -9.340 -32.156 211 HE2 LYS 25 2HE LYS 25 -16.864 -11.190 -29.824 212 HE3 LYS 25 3HE LYS 25 -18.088 -10.531 -30.908 213 HZ1 LYS 25 1HZ LYS 25 -16.530 -11.666 -32.686 214 HZ2 LYS 25 2HZ LYS 25 -17.751 -12.528 -31.894 215 HZ3 LYS 25 3HZ LYS 25 -16.147 -12.662 -31.373 216 H ALA 26 H ALA 26 -13.209 -9.431 -27.070 217 HA ALA 26 HA ALA 26 -11.405 -7.283 -26.905 218 HB1 ALA 26 1HB ALA 26 -11.993 -7.122 -24.640 219 HB2 ALA 26 2HB ALA 26 -13.429 -7.770 -25.435 220 HB3 ALA 26 3HB ALA 26 -12.365 -8.843 -24.526 221 H TYR 27 H TYR 27 -11.036 -10.700 -26.276 222 HA TYR 27 HA TYR 27 -8.574 -10.487 -24.848 223 HB2 TYR 27 2HB TYR 27 -9.956 -12.453 -24.559 224 HB3 TYR 27 3HB TYR 27 -9.863 -12.819 -26.278 225 HD1 TYR 27 HD1 TYR 27 -7.181 -11.852 -23.873 226 HD2 TYR 27 HD2 TYR 27 -8.754 -14.853 -26.446 227 HE1 TYR 27 HE1 TYR 27 -5.191 -13.238 -23.463 228 HE2 TYR 27 HE2 TYR 27 -6.769 -16.247 -26.043 229 HH TYR 27 HH TYR 27 -4.810 -16.410 -25.021 230 H TYR 28 H TYR 28 -9.467 -10.867 -28.219 231 HA TYR 28 HA TYR 28 -6.808 -11.423 -29.128 232 HB2 TYR 28 2HB TYR 28 -8.698 -12.205 -30.428 233 HB3 TYR 28 3HB TYR 28 -9.295 -10.561 -30.618 234 HD1 TYR 28 HD1 TYR 28 -9.000 -9.695 -32.726 235 HD2 TYR 28 HD2 TYR 28 -6.045 -12.335 -31.178 236 HE1 TYR 28 HE1 TYR 28 -7.712 -9.463 -34.808 237 HE2 TYR 28 HE2 TYR 28 -4.747 -12.110 -33.255 238 HH TYR 28 HH TYR 28 -5.522 -9.752 -35.660 239 H GLN 29 H GLN 29 -8.916 -8.563 -29.182 240 HA GLN 29 HA GLN 29 -7.154 -6.833 -30.495 241 HB2 GLN 29 2HB GLN 29 -8.559 -5.068 -29.794 242 HB3 GLN 29 3HB GLN 29 -9.615 -6.463 -29.975 243 HG2 GLN 29 2HG GLN 29 -9.597 -6.818 -27.576 244 HG3 GLN 29 3HG GLN 29 -8.483 -5.467 -27.370 245 HE21 GLN 29 1HE2 GLN 29 -11.578 -6.117 -28.988 246 HE22 GLN 29 2HE2 GLN 29 -12.356 -4.670 -28.453 247 H LEU 30 H LEU 30 -7.389 -7.774 -27.125 248 HA LEU 30 HA LEU 30 -5.595 -5.781 -26.147 249 HB2 LEU 30 2HB LEU 30 -7.168 -7.943 -25.077 250 HB3 LEU 30 3HB LEU 30 -5.546 -7.957 -24.388 251 HG LEU 30 HG LEU 30 -5.829 -5.734 -23.526 252 HD11 LEU 30 1HD1 LEU 30 -7.061 -4.357 -24.787 253 HD12 LEU 30 2HD1 LEU 30 -8.426 -4.978 -23.861 254 HD13 LEU 30 3HD1 LEU 30 -8.043 -5.670 -25.437 255 HD21 LEU 30 1HD2 LEU 30 -7.974 -7.730 -22.968 256 HD22 LEU 30 2HD2 LEU 30 -8.045 -6.145 -22.199 257 HD23 LEU 30 3HD2 LEU 30 -6.645 -7.188 -21.943 258 H ALA 31 H ALA 31 -5.267 -9.167 -27.109 259 HA ALA 31 HA ALA 31 -2.630 -9.593 -26.312 260 HB1 ALA 31 1HB ALA 31 -2.806 -11.115 -28.555 261 HB2 ALA 31 2HB ALA 31 -3.438 -11.579 -26.975 262 HB3 ALA 31 3HB ALA 31 -4.509 -10.857 -28.175 263 H LYS 32 H LYS 32 -3.926 -8.132 -29.250 264 HA LYS 32 HA LYS 32 -1.516 -7.975 -30.692 265 HB2 LYS 32 2HB LYS 32 -4.049 -6.342 -30.792 266 HB3 LYS 32 3HB LYS 32 -2.704 -6.063 -31.891 267 HG2 LYS 32 2HG LYS 32 -3.104 -7.946 -33.083 268 HG3 LYS 32 3HG LYS 32 -3.704 -8.838 -31.683 269 HD2 LYS 32 2HD LYS 32 -5.499 -8.419 -33.276 270 HD3 LYS 32 3HD LYS 32 -5.790 -7.554 -31.765 271 HE2 LYS 32 2HE LYS 32 -6.294 -6.144 -33.686 272 HE3 LYS 32 3HE LYS 32 -4.927 -5.501 -32.777 273 HZ1 LYS 32 1HZ LYS 32 -4.651 -5.498 -35.239 274 HZ2 LYS 32 2HZ LYS 32 -4.626 -7.188 -35.197 275 HZ3 LYS 32 3HZ LYS 32 -3.422 -6.305 -34.402 276 H LYS 33 H LYS 33 -2.725 -6.156 -28.028 277 HA LYS 33 HA LYS 33 -1.066 -3.847 -28.447 278 HB2 LYS 33 2HB LYS 33 -2.487 -4.738 -25.932 279 HB3 LYS 33 3HB LYS 33 -1.839 -3.135 -26.252 280 HG2 LYS 33 2HG LYS 33 -3.480 -2.692 -27.890 281 HG3 LYS 33 3HG LYS 33 -3.985 -4.383 -27.944 282 HD2 LYS 33 2HD LYS 33 -5.648 -3.458 -26.647 283 HD3 LYS 33 3HD LYS 33 -4.511 -3.999 -25.410 284 HE2 LYS 33 2HE LYS 33 -3.596 -1.761 -25.235 285 HE3 LYS 33 3HE LYS 33 -4.640 -1.205 -26.542 286 HZ1 LYS 33 1HZ LYS 33 -5.366 -1.942 -23.783 287 HZ2 LYS 33 2HZ LYS 33 -6.523 -2.019 -25.014 288 HZ3 LYS 33 3HZ LYS 33 -5.768 -0.549 -24.655 289 H TYR 34 H TYR 34 -0.881 -6.814 -26.566 290 HA TYR 34 HA TYR 34 1.750 -6.005 -25.545 291 HB2 TYR 34 2HB TYR 34 -0.021 -8.313 -24.715 292 HB3 TYR 34 3HB TYR 34 1.514 -7.881 -23.970 293 HD1 TYR 34 HD1 TYR 34 1.702 -5.849 -22.601 294 HD2 TYR 34 HD2 TYR 34 -2.027 -7.067 -24.249 295 HE1 TYR 34 HE1 TYR 34 0.531 -4.336 -21.056 296 HE2 TYR 34 HE2 TYR 34 -3.208 -5.556 -22.709 297 HH TYR 34 HH TYR 34 -2.864 -4.436 -20.604 298 H HIS 35 H HIS 35 1.045 -7.007 -28.307 299 HA HIS 35 HA HIS 35 2.036 -9.617 -28.650 300 HB2 HIS 35 2HB HIS 35 1.274 -7.381 -30.351 301 HB3 HIS 35 3HB HIS 35 2.650 -8.266 -31.003 302 HD1 HIS 35 HD1 HIS 35 1.066 -9.070 -32.943 303 HD2 HIS 35 HD2 HIS 35 0.027 -10.415 -29.152 304 HE1 HIS 35 HE1 HIS 35 -0.570 -10.942 -33.319 305 HA PRO 36 HA PRO 36 6.401 -9.281 -28.387 306 HB2 PRO 36 2HB PRO 36 7.240 -10.856 -30.433 307 HB3 PRO 36 3HB PRO 36 6.514 -11.504 -28.957 308 HG2 PRO 36 2HG PRO 36 5.257 -11.017 -31.630 309 HG3 PRO 36 3HG PRO 36 5.078 -12.409 -30.547 310 HD2 PRO 36 2HD PRO 36 3.227 -10.440 -30.706 311 HD3 PRO 36 3HD PRO 36 3.551 -11.326 -29.203 312 H ASP 37 H ASP 37 4.746 -8.080 -31.089 313 HA ASP 37 HA ASP 37 7.031 -7.183 -32.581 314 HB2 ASP 37 2HB ASP 37 5.510 -6.269 -34.103 315 HB3 ASP 37 3HB ASP 37 4.642 -7.659 -33.455 316 H THR 38 H THR 38 5.181 -6.004 -29.929 317 HA THR 38 HA THR 38 6.394 -3.337 -30.197 318 HB THR 38 HB THR 38 4.691 -2.457 -28.801 319 HG1 THR 38 HG1 THR 38 4.449 -5.098 -27.996 320 HG21 THR 38 1HG2 THR 38 4.100 -3.657 -31.203 321 HG22 THR 38 2HG2 THR 38 3.045 -2.551 -30.322 322 HG23 THR 38 3HG2 THR 38 2.852 -4.294 -30.133 323 H ASN 39 H ASN 39 7.200 -6.131 -28.880 324 HA ASN 39 HA ASN 39 7.826 -5.245 -26.191 325 HB2 ASN 39 2HB ASN 39 7.983 -7.812 -27.688 326 HB3 ASN 39 3HB ASN 39 9.103 -7.591 -26.346 327 HD21 ASN 39 1HD2 ASN 39 5.720 -6.669 -26.885 328 HD22 ASN 39 2HD2 ASN 39 5.109 -7.426 -25.457 329 H LYS 40 H LYS 40 9.163 -4.739 -29.150 330 HA LYS 40 HA LYS 40 11.869 -5.228 -28.939 331 HB2 LYS 40 2HB LYS 40 10.595 -2.767 -30.149 332 HB3 LYS 40 3HB LYS 40 12.197 -3.394 -30.515 333 HG2 LYS 40 2HG LYS 40 9.564 -4.726 -31.114 334 HG3 LYS 40 3HG LYS 40 10.668 -3.985 -32.276 335 HD2 LYS 40 2HD LYS 40 11.421 -6.095 -32.524 336 HD3 LYS 40 3HD LYS 40 12.331 -5.735 -31.055 337 HE2 LYS 40 2HE LYS 40 11.070 -7.108 -29.787 338 HE3 LYS 40 3HE LYS 40 9.580 -6.685 -30.628 339 HZ1 LYS 40 1HZ LYS 40 11.627 -8.668 -31.422 340 HZ2 LYS 40 2HZ LYS 40 10.485 -8.076 -32.520 341 HZ3 LYS 40 3HZ LYS 40 9.977 -8.918 -31.144 342 H ASP 41 H ASP 41 10.005 -2.539 -27.610 343 HA ASP 41 HA ASP 41 12.397 -1.730 -26.090 344 HB2 ASP 41 2HB ASP 41 10.266 -0.124 -27.427 345 HB3 ASP 41 3HB ASP 41 10.973 0.502 -25.940 346 H ASP 42 H ASP 42 10.051 -3.634 -25.571 347 HA ASP 42 HA ASP 42 9.607 -2.743 -22.834 348 HB2 ASP 42 2HB ASP 42 7.673 -2.100 -24.559 349 HB3 ASP 42 3HB ASP 42 7.189 -3.763 -24.239 350 HA PRO 43 HA PRO 43 10.574 -7.240 -23.176 351 HB2 PRO 43 2HB PRO 43 12.234 -7.266 -21.029 352 HB3 PRO 43 3HB PRO 43 12.774 -6.832 -22.655 353 HG2 PRO 43 2HG PRO 43 12.037 -5.050 -20.365 354 HG3 PRO 43 3HG PRO 43 13.396 -4.914 -21.496 355 HD2 PRO 43 2HD PRO 43 11.138 -3.441 -21.747 356 HD3 PRO 43 3HD PRO 43 12.091 -3.974 -23.147 357 H LYS 44 H LYS 44 9.034 -5.200 -20.966 358 HA LYS 44 HA LYS 44 8.386 -7.352 -19.097 359 HB2 LYS 44 2HB LYS 44 8.232 -4.388 -19.044 360 HB3 LYS 44 3HB LYS 44 7.007 -5.259 -18.131 361 HG2 LYS 44 2HG LYS 44 8.603 -6.255 -16.730 362 HG3 LYS 44 3HG LYS 44 9.935 -5.831 -17.809 363 HD2 LYS 44 2HD LYS 44 9.417 -3.418 -17.333 364 HD3 LYS 44 3HD LYS 44 8.293 -3.976 -16.091 365 HE2 LYS 44 2HE LYS 44 10.269 -3.539 -14.923 366 HE3 LYS 44 3HE LYS 44 10.281 -5.287 -15.150 367 HZ1 LYS 44 1HZ LYS 44 11.544 -3.952 -17.321 368 HZ2 LYS 44 2HZ LYS 44 12.156 -5.154 -16.302 369 HZ3 LYS 44 3HZ LYS 44 12.267 -3.528 -15.852 370 H ALA 45 H ALA 45 7.104 -5.740 -21.822 371 HA ALA 45 HA ALA 45 4.359 -5.866 -21.391 372 HB1 ALA 45 1HB ALA 45 4.412 -6.294 -24.010 373 HB2 ALA 45 2HB ALA 45 4.816 -4.728 -23.306 374 HB3 ALA 45 3HB ALA 45 6.101 -5.835 -23.791 375 H LYS 46 H LYS 46 6.618 -8.369 -22.391 376 HA LYS 46 HA LYS 46 4.819 -10.323 -23.230 377 HB2 LYS 46 2HB LYS 46 6.589 -11.938 -22.759 378 HB3 LYS 46 3HB LYS 46 7.248 -10.502 -23.532 379 HG2 LYS 46 2HG LYS 46 7.986 -9.680 -21.337 380 HG3 LYS 46 3HG LYS 46 7.368 -11.158 -20.594 381 HD2 LYS 46 2HD LYS 46 9.764 -11.333 -20.954 382 HD3 LYS 46 3HD LYS 46 8.906 -12.480 -21.985 383 HE2 LYS 46 2HE LYS 46 9.409 -9.833 -23.172 384 HE3 LYS 46 3HE LYS 46 10.845 -10.802 -22.850 385 HZ1 LYS 46 1HZ LYS 46 10.399 -11.784 -24.780 386 HZ2 LYS 46 2HZ LYS 46 8.839 -11.137 -24.865 387 HZ3 LYS 46 3HZ LYS 46 9.117 -12.561 -23.997 388 H GLU 47 H GLU 47 5.903 -9.456 -19.991 389 HA GLU 47 HA GLU 47 4.730 -11.645 -18.641 390 HB2 GLU 47 2HB GLU 47 6.468 -10.243 -17.624 391 HB3 GLU 47 3HB GLU 47 5.368 -8.871 -17.619 392 HG2 GLU 47 2HG GLU 47 5.233 -9.618 -15.450 393 HG3 GLU 47 3HG GLU 47 3.844 -10.403 -16.201 394 H LYS 48 H LYS 48 3.536 -8.458 -19.544 395 HA LYS 48 HA LYS 48 1.094 -8.642 -18.090 396 HB2 LYS 48 2HB LYS 48 1.629 -6.936 -20.523 397 HB3 LYS 48 3HB LYS 48 0.435 -6.655 -19.262 398 HG2 LYS 48 2HG LYS 48 3.405 -6.643 -18.784 399 HG3 LYS 48 3HG LYS 48 2.454 -5.199 -19.138 400 HD2 LYS 48 2HD LYS 48 1.405 -5.225 -17.102 401 HD3 LYS 48 3HD LYS 48 1.549 -6.976 -16.929 402 HE2 LYS 48 2HE LYS 48 4.073 -5.438 -16.959 403 HE3 LYS 48 3HE LYS 48 3.040 -5.224 -15.546 404 HZ1 LYS 48 1HZ LYS 48 3.020 -7.655 -15.290 405 HZ2 LYS 48 2HZ LYS 48 4.576 -7.007 -15.158 406 HZ3 LYS 48 3HZ LYS 48 4.107 -7.795 -16.579 407 H PHE 49 H PHE 49 2.093 -9.489 -21.351 408 HA PHE 49 HA PHE 49 -0.418 -9.896 -22.502 409 HB2 PHE 49 2HB PHE 49 1.512 -9.879 -23.913 410 HB3 PHE 49 3HB PHE 49 2.249 -11.210 -23.028 411 HD1 PHE 49 HD1 PHE 49 -0.201 -10.267 -25.553 412 HD2 PHE 49 HD2 PHE 49 1.485 -13.494 -23.350 413 HE1 PHE 49 HE1 PHE 49 -1.197 -11.864 -27.138 414 HE2 PHE 49 HE2 PHE 49 0.492 -15.097 -24.931 415 HZ PHE 49 HZ PHE 49 -0.852 -14.282 -26.828 416 H SER 50 H SER 50 1.474 -11.897 -20.351 417 HA SER 50 HA SER 50 0.077 -14.322 -20.739 418 HB2 SER 50 2HB SER 50 2.323 -13.996 -19.577 419 HB3 SER 50 3HB SER 50 1.407 -13.476 -18.163 420 HG SER 50 HG SER 50 1.858 -15.699 -18.063 421 H GLN 51 H GLN 51 -0.507 -11.522 -18.716 422 HA GLN 51 HA GLN 51 -2.429 -12.630 -16.996 423 HB2 GLN 51 2HB GLN 51 -2.092 -9.794 -17.980 424 HB3 GLN 51 3HB GLN 51 -3.179 -10.267 -16.681 425 HG2 GLN 51 2HG GLN 51 -0.185 -10.309 -16.726 426 HG3 GLN 51 3HG GLN 51 -1.263 -9.466 -15.614 427 HE21 GLN 51 1HE2 GLN 51 0.374 -12.391 -16.335 428 HE22 GLN 51 2HE2 GLN 51 -0.097 -13.265 -14.921 429 H LEU 52 H LEU 52 -2.663 -11.325 -20.242 430 HA LEU 52 HA LEU 52 -5.442 -11.043 -20.412 431 HB2 LEU 52 2HB LEU 52 -3.612 -11.885 -22.650 432 HB3 LEU 52 3HB LEU 52 -5.162 -11.058 -22.790 433 HG LEU 52 HG LEU 52 -2.777 -9.803 -21.453 434 HD11 LEU 52 1HD1 LEU 52 -2.624 -10.537 -24.004 435 HD12 LEU 52 2HD1 LEU 52 -1.959 -9.014 -23.417 436 HD13 LEU 52 3HD1 LEU 52 -3.532 -9.040 -24.214 437 HD21 LEU 52 1HD2 LEU 52 -4.267 -8.234 -20.960 438 HD22 LEU 52 2HD2 LEU 52 -5.522 -9.067 -21.880 439 HD23 LEU 52 3HD2 LEU 52 -4.446 -7.925 -22.687 440 H ALA 53 H ALA 53 -3.368 -13.813 -21.223 441 HA ALA 53 HA ALA 53 -5.495 -15.511 -22.019 442 HB1 ALA 53 1HB ALA 53 -2.885 -16.528 -20.957 443 HB2 ALA 53 2HB ALA 53 -3.901 -17.191 -22.238 444 HB3 ALA 53 3HB ALA 53 -2.977 -15.715 -22.520 445 H GLU 54 H GLU 54 -3.974 -14.815 -18.944 446 HA GLU 54 HA GLU 54 -4.998 -17.025 -17.508 447 HB2 GLU 54 2HB GLU 54 -3.854 -14.366 -16.766 448 HB3 GLU 54 3HB GLU 54 -4.670 -15.313 -15.530 449 HG2 GLU 54 2HG GLU 54 -2.538 -16.557 -17.210 450 HG3 GLU 54 3HG GLU 54 -2.112 -15.534 -15.839 451 H ALA 55 H ALA 55 -6.129 -13.663 -17.788 452 HA ALA 55 HA ALA 55 -8.480 -14.098 -16.238 453 HB1 ALA 55 1HB ALA 55 -8.672 -11.880 -16.328 454 HB2 ALA 55 2HB ALA 55 -7.134 -11.884 -17.192 455 HB3 ALA 55 3HB ALA 55 -8.651 -11.870 -18.091 456 H TYR 56 H TYR 56 -7.721 -14.241 -19.661 457 HA TYR 56 HA TYR 56 -10.426 -14.385 -20.554 458 HB2 TYR 56 2HB TYR 56 -8.865 -13.649 -22.164 459 HB3 TYR 56 3HB TYR 56 -7.773 -14.992 -21.842 460 HD1 TYR 56 HD1 TYR 56 -10.831 -13.947 -23.568 461 HD2 TYR 56 HD2 TYR 56 -8.164 -17.177 -22.820 462 HE1 TYR 56 HE1 TYR 56 -11.839 -15.203 -25.427 463 HE2 TYR 56 HE2 TYR 56 -9.165 -18.441 -24.677 464 HH TYR 56 HH TYR 56 -11.791 -18.203 -25.861 465 H GLU 57 H GLU 57 -8.113 -16.681 -19.370 466 HA GLU 57 HA GLU 57 -9.144 -19.047 -20.450 467 HB2 GLU 57 2HB GLU 57 -7.439 -18.327 -18.142 468 HB3 GLU 57 3HB GLU 57 -8.236 -19.891 -18.048 469 HG2 GLU 57 2HG GLU 57 -7.068 -20.754 -19.815 470 HG3 GLU 57 3HG GLU 57 -6.792 -19.173 -20.546 471 H VAL 58 H VAL 58 -9.879 -17.453 -17.354 472 HA VAL 58 HA VAL 58 -11.927 -19.330 -16.667 473 HB VAL 58 HB VAL 58 -11.493 -16.579 -15.501 474 HG11 VAL 58 1HG1 VAL 58 -12.606 -18.974 -14.085 475 HG12 VAL 58 2HG1 VAL 58 -12.772 -17.264 -13.681 476 HG13 VAL 58 3HG1 VAL 58 -13.642 -17.934 -15.062 477 HG21 VAL 58 1HG2 VAL 58 -9.480 -17.387 -14.915 478 HG22 VAL 58 2HG2 VAL 58 -10.387 -18.312 -13.719 479 HG23 VAL 58 3HG2 VAL 58 -9.938 -19.056 -15.254 480 H LEU 59 H LEU 59 -11.853 -16.105 -18.094 481 HA LEU 59 HA LEU 59 -14.690 -15.764 -18.086 482 HB2 LEU 59 2HB LEU 59 -12.341 -14.293 -19.046 483 HB3 LEU 59 3HB LEU 59 -13.790 -14.074 -20.025 484 HG LEU 59 HG LEU 59 -14.997 -13.197 -18.141 485 HD11 LEU 59 1HD1 LEU 59 -13.923 -12.899 -15.955 486 HD12 LEU 59 2HD1 LEU 59 -12.518 -13.793 -16.533 487 HD13 LEU 59 3HD1 LEU 59 -14.079 -14.600 -16.391 488 HD21 LEU 59 1HD2 LEU 59 -13.651 -11.189 -17.657 489 HD22 LEU 59 2HD2 LEU 59 -13.659 -11.603 -19.372 490 HD23 LEU 59 3HD2 LEU 59 -12.249 -11.978 -18.380 491 H SER 60 H SER 60 -12.680 -17.726 -19.871 492 HA SER 60 HA SER 60 -13.934 -17.528 -22.430 493 HB2 SER 60 2HB SER 60 -11.711 -18.395 -22.384 494 HB3 SER 60 3HB SER 60 -12.138 -19.610 -21.180 495 HG SER 60 HG SER 60 -11.996 -20.217 -23.540 496 H ASP 61 H ASP 61 -14.775 -19.004 -19.477 497 HA ASP 61 HA ASP 61 -16.983 -20.413 -20.811 498 HB2 ASP 61 2HB ASP 61 -14.966 -21.843 -19.836 499 HB3 ASP 61 3HB ASP 61 -15.836 -21.596 -18.325 500 H GLU 62 H GLU 62 -18.951 -20.265 -19.827 501 HA GLU 62 HA GLU 62 -19.421 -18.129 -18.068 502 HB2 GLU 62 2HB GLU 62 -21.726 -19.074 -17.890 503 HB3 GLU 62 3HB GLU 62 -21.167 -18.860 -19.543 504 HG2 GLU 62 2HG GLU 62 -20.611 -21.256 -19.638 505 HG3 GLU 62 3HG GLU 62 -21.258 -21.448 -18.010 506 H VAL 63 H VAL 63 -19.192 -21.614 -17.510 507 HA VAL 63 HA VAL 63 -19.967 -21.651 -14.822 508 HB VAL 63 HB VAL 63 -17.903 -23.469 -16.064 509 HG11 VAL 63 1HG1 VAL 63 -18.085 -24.746 -14.239 510 HG12 VAL 63 2HG1 VAL 63 -18.815 -23.332 -13.477 511 HG13 VAL 63 3HG1 VAL 63 -19.839 -24.578 -14.189 512 HG21 VAL 63 1HG2 VAL 63 -19.461 -24.177 -17.480 513 HG22 VAL 63 2HG2 VAL 63 -20.425 -24.702 -16.100 514 HG23 VAL 63 3HG2 VAL 63 -20.657 -23.089 -16.774 515 H LYS 64 H LYS 64 -16.678 -21.549 -16.197 516 HA LYS 64 HA LYS 64 -15.350 -21.264 -13.730 517 HB2 LYS 64 2HB LYS 64 -14.497 -20.455 -16.515 518 HB3 LYS 64 3HB LYS 64 -13.431 -20.475 -15.116 519 HG2 LYS 64 2HG LYS 64 -13.944 -22.917 -14.878 520 HG3 LYS 64 3HG LYS 64 -14.773 -22.820 -16.433 521 HD2 LYS 64 2HD LYS 64 -11.886 -22.075 -15.969 522 HD3 LYS 64 3HD LYS 64 -12.436 -23.620 -16.622 523 HE2 LYS 64 2HE LYS 64 -13.620 -22.251 -18.415 524 HE3 LYS 64 3HE LYS 64 -12.662 -20.884 -17.847 525 HZ1 LYS 64 1HZ LYS 64 -11.870 -23.138 -19.448 526 HZ2 LYS 64 2HZ LYS 64 -10.812 -22.827 -18.167 527 HZ3 LYS 64 3HZ LYS 64 -11.151 -21.614 -19.296 528 H ARG 65 H ARG 65 -16.366 -18.856 -16.138 529 HA ARG 65 HA ARG 65 -15.334 -16.589 -14.891 530 HB2 ARG 65 2HB ARG 65 -16.250 -16.620 -17.184 531 HB3 ARG 65 3HB ARG 65 -17.869 -16.805 -16.524 532 HG2 ARG 65 2HG ARG 65 -17.342 -14.607 -15.262 533 HG3 ARG 65 3HG ARG 65 -16.068 -14.424 -16.469 534 HD2 ARG 65 2HD ARG 65 -17.559 -14.187 -18.203 535 HD3 ARG 65 3HD ARG 65 -18.827 -15.089 -17.375 536 HE ARG 65 HE ARG 65 -18.435 -12.285 -17.317 537 HH11 ARG 65 1HH1 ARG 65 -19.398 -14.969 -15.321 538 HH12 ARG 65 2HH1 ARG 65 -20.395 -14.006 -14.281 539 HH21 ARG 65 1HH2 ARG 65 -19.744 -11.006 -15.955 540 HH22 ARG 65 2HH2 ARG 65 -20.592 -11.753 -14.643 541 H LYS 66 H LYS 66 -18.429 -18.235 -14.432 542 HA LYS 66 HA LYS 66 -19.519 -16.330 -12.637 543 HB2 LYS 66 2HB LYS 66 -20.156 -19.197 -13.277 544 HB3 LYS 66 3HB LYS 66 -20.994 -18.353 -11.981 545 HG2 LYS 66 2HG LYS 66 -20.912 -17.478 -14.862 546 HG3 LYS 66 3HG LYS 66 -22.252 -18.319 -14.080 547 HD2 LYS 66 2HD LYS 66 -22.387 -16.421 -12.455 548 HD3 LYS 66 3HD LYS 66 -21.188 -15.572 -13.434 549 HE2 LYS 66 2HE LYS 66 -23.439 -14.842 -14.001 550 HE3 LYS 66 3HE LYS 66 -22.694 -15.679 -15.362 551 HZ1 LYS 66 1HZ LYS 66 -25.098 -16.248 -14.747 552 HZ2 LYS 66 2HZ LYS 66 -24.429 -17.128 -13.467 553 HZ3 LYS 66 3HZ LYS 66 -24.036 -17.526 -15.063 554 H GLN 67 H GLN 67 -17.706 -19.333 -12.177 555 HA GLN 67 HA GLN 67 -17.915 -19.515 -9.398 556 HB2 GLN 67 2HB GLN 67 -15.841 -20.459 -11.358 557 HB3 GLN 67 3HB GLN 67 -15.647 -20.729 -9.631 558 HG2 GLN 67 2HG GLN 67 -17.934 -21.695 -11.333 559 HG3 GLN 67 3HG GLN 67 -16.603 -22.673 -10.717 560 HE21 GLN 67 1HE2 GLN 67 -19.607 -21.156 -10.004 561 HE22 GLN 67 2HE2 GLN 67 -19.796 -21.786 -8.406 562 H TYR 68 H TYR 68 -15.408 -17.958 -11.384 563 HA TYR 68 HA TYR 68 -13.969 -16.956 -9.131 564 HB2 TYR 68 2HB TYR 68 -13.808 -16.646 -12.088 565 HB3 TYR 68 3HB TYR 68 -13.032 -15.416 -11.097 566 HD1 TYR 68 HD1 TYR 68 -13.079 -19.023 -11.896 567 HD2 TYR 68 HD2 TYR 68 -10.993 -15.862 -9.958 568 HE1 TYR 68 HE1 TYR 68 -11.126 -20.492 -11.617 569 HE2 TYR 68 HE2 TYR 68 -9.033 -17.321 -9.675 570 HH TYR 68 HH TYR 68 -8.976 -20.344 -9.679 571 H ASP 69 H ASP 69 -16.577 -15.786 -11.116 572 HA ASP 69 HA ASP 69 -16.389 -13.042 -10.435 573 HB2 ASP 69 2HB ASP 69 -17.676 -13.557 -12.350 574 HB3 ASP 69 3HB ASP 69 -18.629 -14.760 -11.486 575 H ALA 70 H ALA 70 -17.675 -15.815 -8.809 576 HA ALA 70 HA ALA 70 -19.508 -14.610 -7.076 577 HB1 ALA 70 1HB ALA 70 -18.339 -16.654 -5.603 578 HB2 ALA 70 2HB ALA 70 -19.755 -16.779 -6.649 579 HB3 ALA 70 3HB ALA 70 -18.154 -17.156 -7.284 580 H TYR 71 H TYR 71 -16.005 -14.938 -6.867 581 HA TYR 71 HA TYR 71 -16.016 -13.499 -4.311 582 HB2 TYR 71 2HB TYR 71 -13.725 -14.889 -5.715 583 HB3 TYR 71 3HB TYR 71 -13.682 -14.192 -4.100 584 HD1 TYR 71 HD1 TYR 71 -14.893 -15.274 -2.249 585 HD2 TYR 71 HD2 TYR 71 -14.736 -17.030 -6.121 586 HE1 TYR 71 HE1 TYR 71 -15.631 -17.419 -1.300 587 HE2 TYR 71 HE2 TYR 71 -15.475 -19.179 -5.183 588 HH TYR 71 HH TYR 71 -16.932 -19.780 -2.881 589 H GLY 72 H GLY 72 -16.550 -12.259 -6.947 590 HA2 GLY 72 2HA GLY 72 -14.337 -10.814 -7.887 591 HA3 GLY 72 3HA GLY 72 -16.017 -10.329 -8.068 592 H SER 73 H SER 73 -14.336 -8.320 -7.814 593 HA SER 73 HA SER 73 -13.991 -7.588 -5.031 594 HB2 SER 73 2HB SER 73 -12.399 -7.039 -7.020 595 HB3 SER 73 3HB SER 73 -13.525 -5.721 -7.339 596 HG SER 73 HG SER 73 -12.026 -6.186 -4.978 Start of MODEL 10 1 H1 HIS 1 H HIS 1 0.196 0.627 3.922 2 HA HIS 1 HA HIS 1 -0.799 1.863 1.551 3 HB2 HIS 1 2HB HIS 1 1.532 1.022 1.802 4 HB3 HIS 1 3HB HIS 1 0.906 -0.623 1.804 5 HD1 HIS 1 HD1 HIS 1 2.799 -0.301 -0.338 6 HD2 HIS 1 HD2 HIS 1 -1.122 0.988 -0.812 7 HE1 HIS 1 HE1 HIS 1 2.425 -0.185 -2.822 8 H MET 2 H MET 2 -2.904 1.477 1.104 9 HA MET 2 HA MET 2 -4.154 -1.056 1.482 10 HB2 MET 2 2HB MET 2 -4.986 1.469 0.066 11 HB3 MET 2 3HB MET 2 -5.996 0.029 0.075 12 HG2 MET 2 2HG MET 2 -5.005 1.310 2.600 13 HG3 MET 2 3HG MET 2 -6.498 1.806 1.807 14 HE1 MET 2 1HE MET 2 -5.674 0.799 4.594 15 HE2 MET 2 2HE MET 2 -6.889 -0.352 5.152 16 HE3 MET 2 3HE MET 2 -5.305 -0.926 4.628 17 H LEU 3 H LEU 3 -4.056 -2.782 0.213 18 HA LEU 3 HA LEU 3 -2.784 -2.612 -2.377 19 HB2 LEU 3 2HB LEU 3 -2.528 -4.459 -0.581 20 HB3 LEU 3 3HB LEU 3 -4.036 -5.085 -1.244 21 HG LEU 3 HG LEU 3 -2.776 -5.042 -3.508 22 HD11 LEU 3 1HD1 LEU 3 -0.839 -3.792 -2.247 23 HD12 LEU 3 2HD1 LEU 3 -0.492 -4.948 -3.532 24 HD13 LEU 3 3HD1 LEU 3 -0.342 -5.435 -1.844 25 HD21 LEU 3 1HD2 LEU 3 -1.526 -7.143 -1.928 26 HD22 LEU 3 2HD2 LEU 3 -2.679 -7.258 -3.259 27 HD23 LEU 3 3HD2 LEU 3 -3.254 -6.978 -1.614 28 H ALA 4 H ALA 4 -3.738 -2.754 -4.330 29 HA ALA 4 HA ALA 4 -6.637 -2.589 -4.424 30 HB1 ALA 4 1HB ALA 4 -5.757 -2.485 -7.029 31 HB2 ALA 4 2HB ALA 4 -6.055 -1.098 -5.979 32 HB3 ALA 4 3HB ALA 4 -4.426 -1.760 -6.125 33 H LYS 5 H LYS 5 -7.895 -3.864 -5.936 34 HA LYS 5 HA LYS 5 -6.715 -6.483 -6.565 35 HB2 LYS 5 2HB LYS 5 -9.439 -6.010 -5.339 36 HB3 LYS 5 3HB LYS 5 -8.827 -7.567 -5.883 37 HG2 LYS 5 2HG LYS 5 -7.379 -7.772 -4.119 38 HG3 LYS 5 3HG LYS 5 -7.256 -6.028 -3.876 39 HD2 LYS 5 2HD LYS 5 -9.194 -5.926 -2.650 40 HD3 LYS 5 3HD LYS 5 -9.891 -7.346 -3.433 41 HE2 LYS 5 2HE LYS 5 -9.391 -8.053 -1.256 42 HE3 LYS 5 3HE LYS 5 -8.070 -8.681 -2.242 43 HZ1 LYS 5 1HZ LYS 5 -7.369 -7.624 -0.120 44 HZ2 LYS 5 2HZ LYS 5 -7.917 -6.140 -0.718 45 HZ3 LYS 5 3HZ LYS 5 -6.650 -6.948 -1.494 46 H GLU 6 H GLU 6 -6.851 -6.851 -8.670 47 HA GLU 6 HA GLU 6 -9.032 -5.587 -10.187 48 HB2 GLU 6 2HB GLU 6 -7.588 -5.858 -12.166 49 HB3 GLU 6 3HB GLU 6 -6.821 -4.890 -10.915 50 HG2 GLU 6 2HG GLU 6 -5.515 -6.837 -10.215 51 HG3 GLU 6 3HG GLU 6 -6.273 -7.794 -11.486 52 H ASP 7 H ASP 7 -10.143 -6.784 -11.777 53 HA ASP 7 HA ASP 7 -10.043 -9.696 -11.348 54 HB2 ASP 7 2HB ASP 7 -12.333 -7.864 -12.053 55 HB3 ASP 7 3HB ASP 7 -12.433 -9.612 -12.241 56 H TYR 8 H TYR 8 -10.737 -11.013 -13.244 57 HA TYR 8 HA TYR 8 -9.088 -10.572 -15.439 58 HB2 TYR 8 2HB TYR 8 -11.616 -12.229 -15.437 59 HB3 TYR 8 3HB TYR 8 -10.225 -12.423 -16.498 60 HD1 TYR 8 HD1 TYR 8 -11.697 -14.303 -14.342 61 HD2 TYR 8 HD2 TYR 8 -8.029 -12.151 -14.481 62 HE1 TYR 8 HE1 TYR 8 -10.709 -15.894 -12.747 63 HE2 TYR 8 HE2 TYR 8 -7.031 -13.737 -12.888 64 HH TYR 8 HH TYR 8 -7.509 -16.242 -12.240 65 H TYR 9 H TYR 9 -12.384 -9.574 -14.846 66 HA TYR 9 HA TYR 9 -13.272 -8.978 -17.389 67 HB2 TYR 9 2HB TYR 9 -13.757 -7.361 -14.878 68 HB3 TYR 9 3HB TYR 9 -14.735 -7.310 -16.341 69 HD1 TYR 9 HD1 TYR 9 -14.118 -9.011 -13.226 70 HD2 TYR 9 HD2 TYR 9 -16.018 -9.368 -17.017 71 HE1 TYR 9 HE1 TYR 9 -15.511 -10.838 -12.349 72 HE2 TYR 9 HE2 TYR 9 -17.417 -11.196 -16.150 73 HH TYR 9 HH TYR 9 -17.883 -12.493 -14.414 74 H GLN 10 H GLN 10 -11.269 -6.996 -15.240 75 HA GLN 10 HA GLN 10 -11.099 -4.810 -17.080 76 HB2 GLN 10 2HB GLN 10 -9.408 -5.454 -14.658 77 HB3 GLN 10 3HB GLN 10 -9.405 -3.924 -15.526 78 HG2 GLN 10 2HG GLN 10 -11.914 -5.025 -14.319 79 HG3 GLN 10 3HG GLN 10 -10.760 -4.098 -13.363 80 HE21 GLN 10 1HE2 GLN 10 -13.496 -3.895 -15.164 81 HE22 GLN 10 2HE2 GLN 10 -13.450 -2.219 -15.578 82 H ILE 11 H ILE 11 -9.083 -7.582 -16.272 83 HA ILE 11 HA ILE 11 -6.781 -6.840 -17.693 84 HB ILE 11 HB ILE 11 -7.838 -9.622 -17.174 85 HG12 ILE 11 2HG1 ILE 11 -5.748 -8.088 -15.625 86 HG13 ILE 11 3HG1 ILE 11 -7.448 -8.119 -15.169 87 HG21 ILE 11 1HG2 ILE 11 -6.205 -10.167 -18.621 88 HG22 ILE 11 2HG2 ILE 11 -5.401 -8.606 -18.462 89 HG23 ILE 11 3HG2 ILE 11 -5.144 -9.858 -17.246 90 HD11 ILE 11 1HD1 ILE 11 -6.403 -10.780 -15.586 91 HD12 ILE 11 2HD1 ILE 11 -5.488 -9.889 -14.370 92 HD13 ILE 11 3HD1 ILE 11 -7.230 -10.093 -14.188 93 H LEU 12 H LEU 12 -9.846 -8.026 -18.760 94 HA LEU 12 HA LEU 12 -8.784 -8.485 -21.463 95 HB2 LEU 12 2HB LEU 12 -11.104 -9.539 -19.944 96 HB3 LEU 12 3HB LEU 12 -11.291 -9.346 -21.685 97 HG LEU 12 HG LEU 12 -9.157 -11.003 -20.342 98 HD11 LEU 12 1HD1 LEU 12 -10.717 -12.563 -20.116 99 HD12 LEU 12 2HD1 LEU 12 -10.853 -12.609 -21.873 100 HD13 LEU 12 3HD1 LEU 12 -11.916 -11.561 -20.935 101 HD21 LEU 12 1HD2 LEU 12 -9.756 -10.272 -23.161 102 HD22 LEU 12 2HD2 LEU 12 -9.176 -11.904 -22.822 103 HD23 LEU 12 3HD2 LEU 12 -8.204 -10.507 -22.357 104 H GLY 13 H GLY 13 -10.520 -6.266 -19.580 105 HA2 GLY 13 2HA GLY 13 -11.319 -4.179 -20.184 106 HA3 GLY 13 3HA GLY 13 -10.956 -4.564 -21.860 107 H VAL 14 H VAL 14 -12.885 -6.766 -20.018 108 HA VAL 14 HA VAL 14 -15.246 -5.923 -21.566 109 HB VAL 14 HB VAL 14 -16.078 -8.198 -21.363 110 HG11 VAL 14 1HG1 VAL 14 -13.312 -8.741 -22.242 111 HG12 VAL 14 2HG1 VAL 14 -14.844 -9.003 -23.079 112 HG13 VAL 14 3HG1 VAL 14 -14.131 -7.390 -23.025 113 HG21 VAL 14 1HG2 VAL 14 -15.147 -8.751 -19.182 114 HG22 VAL 14 2HG2 VAL 14 -14.701 -9.972 -20.375 115 HG23 VAL 14 3HG2 VAL 14 -13.521 -8.764 -19.864 116 HA PRO 15 HA PRO 15 -17.437 -4.950 -17.886 117 HB2 PRO 15 2HB PRO 15 -19.972 -5.584 -18.623 118 HB3 PRO 15 3HB PRO 15 -19.117 -4.168 -19.245 119 HG2 PRO 15 2HG PRO 15 -19.516 -6.849 -20.516 120 HG3 PRO 15 3HG PRO 15 -19.639 -5.236 -21.244 121 HD2 PRO 15 2HD PRO 15 -17.452 -6.806 -21.541 122 HD3 PRO 15 3HD PRO 15 -17.355 -5.034 -21.486 123 H ARG 16 H ARG 16 -19.138 -5.898 -16.359 124 HA ARG 16 HA ARG 16 -18.276 -8.538 -15.616 125 HB2 ARG 16 2HB ARG 16 -20.412 -6.789 -14.382 126 HB3 ARG 16 3HB ARG 16 -19.709 -8.229 -13.658 127 HG2 ARG 16 2HG ARG 16 -17.888 -7.137 -12.952 128 HG3 ARG 16 3HG ARG 16 -17.755 -6.194 -14.438 129 HD2 ARG 16 2HD ARG 16 -19.840 -4.947 -13.535 130 HD3 ARG 16 3HD ARG 16 -19.376 -5.642 -11.983 131 HE ARG 16 HE ARG 16 -17.627 -4.167 -11.885 132 HH11 ARG 16 1HH1 ARG 16 -18.865 -4.258 -15.137 133 HH12 ARG 16 2HH1 ARG 16 -17.901 -2.925 -15.681 134 HH21 ARG 16 1HH2 ARG 16 -16.353 -2.411 -12.588 135 HH22 ARG 16 2HH2 ARG 16 -16.472 -1.876 -14.230 136 H ASN 17 H ASN 17 -20.614 -7.371 -17.692 137 HA ASN 17 HA ASN 17 -22.266 -9.790 -17.368 138 HB2 ASN 17 2HB ASN 17 -24.020 -8.466 -18.628 139 HB3 ASN 17 3HB ASN 17 -23.650 -7.882 -17.008 140 HD21 ASN 17 1HD2 ASN 17 -24.240 -5.792 -17.323 141 HD22 ASN 17 2HD2 ASN 17 -23.414 -4.714 -18.391 142 H ALA 18 H ALA 18 -19.780 -8.757 -19.104 143 HA ALA 18 HA ALA 18 -20.420 -8.935 -21.790 144 HB1 ALA 18 1HB ALA 18 -18.197 -8.914 -22.149 145 HB2 ALA 18 2HB ALA 18 -18.122 -8.594 -20.416 146 HB3 ALA 18 3HB ALA 18 -17.894 -10.235 -21.021 147 H SER 19 H SER 19 -20.016 -10.703 -23.315 148 HA SER 19 HA SER 19 -20.920 -13.269 -22.196 149 HB2 SER 19 2HB SER 19 -21.079 -12.457 -25.098 150 HB3 SER 19 3HB SER 19 -21.965 -13.740 -24.275 151 HG SER 19 HG SER 19 -23.139 -11.718 -24.688 152 H GLN 20 H GLN 20 -20.133 -15.233 -23.303 153 HA GLN 20 HA GLN 20 -17.354 -15.397 -23.284 154 HB2 GLN 20 2HB GLN 20 -19.166 -17.281 -24.790 155 HB3 GLN 20 3HB GLN 20 -17.603 -17.640 -24.069 156 HG2 GLN 20 2HG GLN 20 -20.240 -17.215 -22.726 157 HG3 GLN 20 3HG GLN 20 -19.136 -18.584 -22.604 158 HE21 GLN 20 1HE2 GLN 20 -17.129 -18.252 -21.466 159 HE22 GLN 20 2HE2 GLN 20 -17.055 -17.098 -20.182 160 H LYS 21 H LYS 21 -19.537 -14.532 -25.829 161 HA LYS 21 HA LYS 21 -17.669 -14.951 -27.971 162 HB2 LYS 21 2HB LYS 21 -20.309 -13.495 -27.814 163 HB3 LYS 21 3HB LYS 21 -19.365 -13.620 -29.293 164 HG2 LYS 21 2HG LYS 21 -20.765 -15.380 -29.595 165 HG3 LYS 21 3HG LYS 21 -19.469 -16.197 -28.719 166 HD2 LYS 21 2HD LYS 21 -20.696 -16.361 -26.783 167 HD3 LYS 21 3HD LYS 21 -21.688 -14.951 -27.167 168 HE2 LYS 21 2HE LYS 21 -23.110 -16.821 -27.387 169 HE3 LYS 21 3HE LYS 21 -22.696 -16.335 -29.030 170 HZ1 LYS 21 1HZ LYS 21 -22.592 -18.790 -28.506 171 HZ2 LYS 21 2HZ LYS 21 -21.208 -18.453 -27.595 172 HZ3 LYS 21 3HZ LYS 21 -21.228 -18.128 -29.255 173 H GLU 22 H GLU 22 -18.930 -12.110 -26.245 174 HA GLU 22 HA GLU 22 -17.449 -10.186 -27.661 175 HB2 GLU 22 2HB GLU 22 -19.357 -9.567 -26.288 176 HB3 GLU 22 3HB GLU 22 -18.528 -10.118 -24.839 177 HG2 GLU 22 2HG GLU 22 -18.371 -7.769 -24.852 178 HG3 GLU 22 3HG GLU 22 -16.779 -8.378 -25.301 179 H ILE 23 H ILE 23 -16.615 -12.300 -25.028 180 HA ILE 23 HA ILE 23 -14.282 -10.908 -24.180 181 HB ILE 23 HB ILE 23 -15.012 -13.820 -23.844 182 HG12 ILE 23 2HG1 ILE 23 -15.139 -11.814 -21.640 183 HG13 ILE 23 3HG1 ILE 23 -16.421 -11.796 -22.846 184 HG21 ILE 23 1HG2 ILE 23 -13.334 -12.889 -21.769 185 HG22 ILE 23 2HG2 ILE 23 -12.992 -14.121 -22.982 186 HG23 ILE 23 3HG2 ILE 23 -12.583 -12.435 -23.299 187 HD11 ILE 23 1HD1 ILE 23 -16.089 -13.513 -20.603 188 HD12 ILE 23 2HD1 ILE 23 -17.427 -13.425 -21.749 189 HD13 ILE 23 3HD1 ILE 23 -16.053 -14.479 -22.078 190 H LYS 24 H LYS 24 -14.919 -13.427 -26.549 191 HA LYS 24 HA LYS 24 -12.277 -14.201 -27.074 192 HB2 LYS 24 2HB LYS 24 -14.854 -14.329 -28.569 193 HB3 LYS 24 3HB LYS 24 -13.367 -14.636 -29.458 194 HG2 LYS 24 2HG LYS 24 -12.899 -16.262 -27.436 195 HG3 LYS 24 3HG LYS 24 -14.659 -16.226 -27.309 196 HD2 LYS 24 2HD LYS 24 -13.181 -16.834 -29.864 197 HD3 LYS 24 3HD LYS 24 -13.731 -18.074 -28.734 198 HE2 LYS 24 2HE LYS 24 -16.045 -17.065 -28.982 199 HE3 LYS 24 3HE LYS 24 -15.393 -16.142 -30.335 200 HZ1 LYS 24 1HZ LYS 24 -14.609 -18.525 -31.071 201 HZ2 LYS 24 2HZ LYS 24 -16.161 -17.960 -31.432 202 HZ3 LYS 24 3HZ LYS 24 -15.926 -19.010 -30.126 203 H LYS 25 H LYS 25 -14.246 -11.589 -28.405 204 HA LYS 25 HA LYS 25 -12.315 -10.776 -30.342 205 HB2 LYS 25 2HB LYS 25 -14.722 -9.378 -29.170 206 HB3 LYS 25 3HB LYS 25 -13.732 -8.692 -30.451 207 HG2 LYS 25 2HG LYS 25 -14.409 -10.289 -32.001 208 HG3 LYS 25 3HG LYS 25 -14.978 -11.397 -30.750 209 HD2 LYS 25 2HD LYS 25 -16.932 -10.489 -31.685 210 HD3 LYS 25 3HD LYS 25 -16.698 -9.601 -30.178 211 HE2 LYS 25 2HE LYS 25 -15.714 -7.747 -31.396 212 HE3 LYS 25 3HE LYS 25 -15.844 -8.643 -32.909 213 HZ1 LYS 25 1HZ LYS 25 -17.929 -7.310 -31.352 214 HZ2 LYS 25 2HZ LYS 25 -18.357 -8.720 -32.182 215 HZ3 LYS 25 3HZ LYS 25 -17.723 -7.399 -33.029 216 H ALA 26 H ALA 26 -13.268 -9.526 -27.154 217 HA ALA 26 HA ALA 26 -11.458 -7.379 -27.080 218 HB1 ALA 26 1HB ALA 26 -11.920 -7.251 -24.737 219 HB2 ALA 26 2HB ALA 26 -13.415 -7.687 -25.565 220 HB3 ALA 26 3HB ALA 26 -12.491 -8.919 -24.706 221 H TYR 27 H TYR 27 -11.082 -10.779 -26.368 222 HA TYR 27 HA TYR 27 -8.591 -10.534 -24.996 223 HB2 TYR 27 2HB TYR 27 -9.907 -12.493 -24.587 224 HB3 TYR 27 3HB TYR 27 -9.977 -12.878 -26.303 225 HD1 TYR 27 HD1 TYR 27 -7.164 -12.036 -23.985 226 HD2 TYR 27 HD2 TYR 27 -8.829 -14.832 -26.726 227 HE1 TYR 27 HE1 TYR 27 -5.169 -13.453 -23.742 228 HE2 TYR 27 HE2 TYR 27 -6.839 -16.257 -26.490 229 HH TYR 27 HH TYR 27 -4.048 -15.366 -25.484 230 H TYR 28 H TYR 28 -9.553 -11.001 -28.338 231 HA TYR 28 HA TYR 28 -6.917 -11.590 -29.287 232 HB2 TYR 28 2HB TYR 28 -8.834 -12.395 -30.528 233 HB3 TYR 28 3HB TYR 28 -9.431 -10.754 -30.745 234 HD1 TYR 28 HD1 TYR 28 -9.180 -9.941 -32.880 235 HD2 TYR 28 HD2 TYR 28 -6.197 -12.549 -31.330 236 HE1 TYR 28 HE1 TYR 28 -7.935 -9.763 -34.993 237 HE2 TYR 28 HE2 TYR 28 -4.943 -12.378 -33.439 238 HH TYR 28 HH TYR 28 -5.908 -11.691 -36.101 239 H GLN 29 H GLN 29 -9.013 -8.722 -29.371 240 HA GLN 29 HA GLN 29 -7.271 -7.034 -30.761 241 HB2 GLN 29 2HB GLN 29 -8.654 -5.245 -30.077 242 HB3 GLN 29 3HB GLN 29 -9.719 -6.639 -30.203 243 HG2 GLN 29 2HG GLN 29 -9.661 -6.934 -27.799 244 HG3 GLN 29 3HG GLN 29 -8.532 -5.589 -27.644 245 HE21 GLN 29 1HE2 GLN 29 -11.591 -6.144 -29.362 246 HE22 GLN 29 2HE2 GLN 29 -12.373 -4.718 -28.779 247 H LEU 30 H LEU 30 -7.444 -7.888 -27.364 248 HA LEU 30 HA LEU 30 -5.623 -5.879 -26.471 249 HB2 LEU 30 2HB LEU 30 -7.184 -8.004 -25.318 250 HB3 LEU 30 3HB LEU 30 -5.547 -8.018 -24.666 251 HG LEU 30 HG LEU 30 -5.790 -5.779 -23.841 252 HD11 LEU 30 1HD1 LEU 30 -7.031 -4.403 -25.089 253 HD12 LEU 30 2HD1 LEU 30 -8.395 -5.010 -24.150 254 HD13 LEU 30 3HD1 LEU 30 -8.023 -5.718 -25.722 255 HD21 LEU 30 1HD2 LEU 30 -6.609 -7.365 -22.305 256 HD22 LEU 30 2HD2 LEU 30 -8.096 -7.606 -23.221 257 HD23 LEU 30 3HD2 LEU 30 -7.827 -6.091 -22.358 258 H ALA 31 H ALA 31 -5.324 -9.288 -27.360 259 HA ALA 31 HA ALA 31 -2.672 -9.703 -26.606 260 HB1 ALA 31 1HB ALA 31 -2.880 -11.288 -28.789 261 HB2 ALA 31 2HB ALA 31 -3.525 -11.697 -27.199 262 HB3 ALA 31 3HB ALA 31 -4.582 -10.998 -28.426 263 H LYS 32 H LYS 32 -4.019 -8.360 -29.585 264 HA LYS 32 HA LYS 32 -1.651 -8.232 -31.076 265 HB2 LYS 32 2HB LYS 32 -4.170 -6.577 -31.137 266 HB3 LYS 32 3HB LYS 32 -2.850 -6.317 -32.270 267 HG2 LYS 32 2HG LYS 32 -3.291 -8.205 -33.434 268 HG3 LYS 32 3HG LYS 32 -3.851 -9.086 -32.010 269 HD2 LYS 32 2HD LYS 32 -5.689 -8.676 -33.559 270 HD3 LYS 32 3HD LYS 32 -5.939 -7.805 -32.045 271 HE2 LYS 32 2HE LYS 32 -6.491 -6.420 -33.986 272 HE3 LYS 32 3HE LYS 32 -5.138 -5.751 -33.075 273 HZ1 LYS 32 1HZ LYS 32 -4.766 -7.458 -35.467 274 HZ2 LYS 32 2HZ LYS 32 -3.618 -6.483 -34.697 275 HZ3 LYS 32 3HZ LYS 32 -4.889 -5.773 -35.559 276 H LYS 33 H LYS 33 -2.786 -6.317 -28.436 277 HA LYS 33 HA LYS 33 -1.147 -4.029 -28.932 278 HB2 LYS 33 2HB LYS 33 -2.239 -4.861 -26.250 279 HB3 LYS 33 3HB LYS 33 -1.871 -3.237 -26.815 280 HG2 LYS 33 2HG LYS 33 -3.711 -3.510 -28.498 281 HG3 LYS 33 3HG LYS 33 -4.145 -5.008 -27.671 282 HD2 LYS 33 2HD LYS 33 -4.967 -3.922 -25.846 283 HD3 LYS 33 3HD LYS 33 -3.836 -2.576 -26.002 284 HE2 LYS 33 2HE LYS 33 -6.086 -3.024 -27.944 285 HE3 LYS 33 3HE LYS 33 -6.292 -2.088 -26.464 286 HZ1 LYS 33 1HZ LYS 33 -5.728 -0.447 -27.915 287 HZ2 LYS 33 2HZ LYS 33 -4.754 -1.446 -28.870 288 HZ3 LYS 33 3HZ LYS 33 -4.178 -0.873 -27.386 289 H TYR 34 H TYR 34 -0.822 -6.965 -27.005 290 HA TYR 34 HA TYR 34 1.870 -6.136 -26.189 291 HB2 TYR 34 2HB TYR 34 0.213 -8.483 -25.241 292 HB3 TYR 34 3HB TYR 34 1.763 -7.975 -24.579 293 HD1 TYR 34 HD1 TYR 34 1.922 -6.068 -23.110 294 HD2 TYR 34 HD2 TYR 34 -1.812 -7.170 -24.826 295 HE1 TYR 34 HE1 TYR 34 0.763 -4.586 -21.526 296 HE2 TYR 34 HE2 TYR 34 -2.981 -5.689 -23.248 297 HH TYR 34 HH TYR 34 -1.227 -3.533 -21.109 298 H HIS 35 H HIS 35 0.901 -7.237 -28.878 299 HA HIS 35 HA HIS 35 1.882 -9.806 -29.309 300 HB2 HIS 35 2HB HIS 35 1.114 -7.524 -30.947 301 HB3 HIS 35 3HB HIS 35 2.438 -8.436 -31.665 302 HD1 HIS 35 HD1 HIS 35 -0.207 -10.175 -29.667 303 HD2 HIS 35 HD2 HIS 35 0.802 -9.529 -33.645 304 HE1 HIS 35 HE1 HIS 35 -1.662 -11.740 -30.993 305 HA PRO 36 HA PRO 36 6.260 -9.586 -29.210 306 HB2 PRO 36 2HB PRO 36 6.978 -11.154 -31.306 307 HB3 PRO 36 3HB PRO 36 6.293 -11.803 -29.811 308 HG2 PRO 36 2HG PRO 36 4.947 -11.249 -32.427 309 HG3 PRO 36 3HG PRO 36 4.773 -12.650 -31.354 310 HD2 PRO 36 2HD PRO 36 2.970 -10.632 -31.417 311 HD3 PRO 36 3HD PRO 36 3.328 -11.546 -29.938 312 H ASP 37 H ASP 37 4.548 -8.388 -31.908 313 HA ASP 37 HA ASP 37 6.830 -7.473 -33.399 314 HB2 ASP 37 2HB ASP 37 4.409 -7.997 -34.239 315 HB3 ASP 37 3HB ASP 37 4.075 -6.341 -33.738 316 H THR 38 H THR 38 5.009 -6.333 -30.733 317 HA THR 38 HA THR 38 6.139 -3.631 -31.040 318 HB THR 38 HB THR 38 4.418 -2.775 -29.652 319 HG1 THR 38 HG1 THR 38 4.230 -5.413 -28.825 320 HG21 THR 38 1HG2 THR 38 3.859 -3.833 -32.056 321 HG22 THR 38 2HG2 THR 38 2.660 -2.991 -31.074 322 HG23 THR 38 3HG2 THR 38 2.729 -4.753 -31.063 323 H ASN 39 H ASN 39 7.083 -6.358 -29.749 324 HA ASN 39 HA ASN 39 7.685 -5.420 -27.058 325 HB2 ASN 39 2HB ASN 39 7.822 -8.032 -28.479 326 HB3 ASN 39 3HB ASN 39 8.947 -7.774 -27.149 327 HD21 ASN 39 1HD2 ASN 39 5.614 -6.676 -27.588 328 HD22 ASN 39 2HD2 ASN 39 4.987 -7.458 -26.180 329 H LYS 40 H LYS 40 8.899 -4.532 -29.799 330 HA LYS 40 HA LYS 40 11.652 -5.174 -29.702 331 HB2 LYS 40 2HB LYS 40 9.971 -3.175 -31.126 332 HB3 LYS 40 3HB LYS 40 11.699 -2.857 -31.036 333 HG2 LYS 40 2HG LYS 40 11.537 -4.005 -33.016 334 HG3 LYS 40 3HG LYS 40 11.920 -5.306 -31.885 335 HD2 LYS 40 2HD LYS 40 9.098 -4.970 -31.925 336 HD3 LYS 40 3HD LYS 40 9.664 -5.048 -33.595 337 HE2 LYS 40 2HE LYS 40 10.350 -7.040 -31.436 338 HE3 LYS 40 3HE LYS 40 9.098 -7.265 -32.657 339 HZ1 LYS 40 1HZ LYS 40 10.857 -8.331 -33.620 340 HZ2 LYS 40 2HZ LYS 40 12.016 -7.288 -32.964 341 HZ3 LYS 40 3HZ LYS 40 11.067 -6.784 -34.271 342 H ASP 41 H ASP 41 9.761 -2.494 -28.388 343 HA ASP 41 HA ASP 41 12.148 -1.651 -26.878 344 HB2 ASP 41 2HB ASP 41 10.016 -0.077 -28.244 345 HB3 ASP 41 3HB ASP 41 10.692 0.570 -26.752 346 H ASP 42 H ASP 42 9.752 -3.537 -26.374 347 HA ASP 42 HA ASP 42 9.285 -2.592 -23.646 348 HB2 ASP 42 2HB ASP 42 7.351 -2.106 -25.418 349 HB3 ASP 42 3HB ASP 42 6.944 -3.780 -25.053 350 HA PRO 43 HA PRO 43 10.479 -7.042 -23.783 351 HB2 PRO 43 2HB PRO 43 12.072 -6.901 -21.589 352 HB3 PRO 43 3HB PRO 43 12.638 -6.499 -23.214 353 HG2 PRO 43 2HG PRO 43 11.740 -4.676 -21.016 354 HG3 PRO 43 3HG PRO 43 13.124 -4.510 -22.112 355 HD2 PRO 43 2HD PRO 43 10.802 -3.168 -22.484 356 HD3 PRO 43 3HD PRO 43 11.824 -3.701 -23.835 357 H LYS 44 H LYS 44 8.773 -5.004 -21.692 358 HA LYS 44 HA LYS 44 8.186 -7.109 -19.754 359 HB2 LYS 44 2HB LYS 44 7.823 -4.160 -19.853 360 HB3 LYS 44 3HB LYS 44 6.656 -5.080 -18.914 361 HG2 LYS 44 2HG LYS 44 9.643 -5.179 -18.542 362 HG3 LYS 44 3HG LYS 44 8.519 -4.242 -17.555 363 HD2 LYS 44 2HD LYS 44 7.333 -6.548 -17.232 364 HD3 LYS 44 3HD LYS 44 8.903 -7.202 -17.707 365 HE2 LYS 44 2HE LYS 44 9.955 -6.400 -15.829 366 HE3 LYS 44 3HE LYS 44 8.800 -5.087 -15.611 367 HZ1 LYS 44 1HZ LYS 44 8.831 -7.379 -14.189 368 HZ2 LYS 44 2HZ LYS 44 7.644 -7.710 -15.347 369 HZ3 LYS 44 3HZ LYS 44 7.493 -6.356 -14.345 370 H ALA 45 H ALA 45 6.884 -5.671 -22.576 371 HA ALA 45 HA ALA 45 4.143 -5.980 -22.217 372 HB1 ALA 45 1HB ALA 45 5.901 -6.062 -24.640 373 HB2 ALA 45 2HB ALA 45 4.165 -6.346 -24.770 374 HB3 ALA 45 3HB ALA 45 4.763 -4.815 -24.130 375 H LYS 46 H LYS 46 6.595 -8.340 -23.129 376 HA LYS 46 HA LYS 46 4.933 -10.435 -23.924 377 HB2 LYS 46 2HB LYS 46 6.839 -11.914 -23.300 378 HB3 LYS 46 3HB LYS 46 7.307 -10.549 -24.306 379 HG2 LYS 46 2HG LYS 46 7.865 -9.397 -22.057 380 HG3 LYS 46 3HG LYS 46 7.858 -11.040 -21.412 381 HD2 LYS 46 2HD LYS 46 10.105 -10.521 -22.017 382 HD3 LYS 46 3HD LYS 46 9.486 -11.656 -23.219 383 HE2 LYS 46 2HE LYS 46 9.368 -10.046 -24.869 384 HE3 LYS 46 3HE LYS 46 9.258 -8.720 -23.712 385 HZ1 LYS 46 1HZ LYS 46 11.722 -10.306 -23.793 386 HZ2 LYS 46 2HZ LYS 46 11.505 -8.673 -23.411 387 HZ3 LYS 46 3HZ LYS 46 11.454 -9.177 -25.025 388 H GLU 47 H GLU 47 6.123 -9.561 -20.701 389 HA GLU 47 HA GLU 47 5.004 -11.764 -19.339 390 HB2 GLU 47 2HB GLU 47 6.118 -9.120 -18.569 391 HB3 GLU 47 3HB GLU 47 5.092 -9.926 -17.391 392 HG2 GLU 47 2HG GLU 47 6.575 -11.618 -17.042 393 HG3 GLU 47 3HG GLU 47 7.260 -11.502 -18.662 394 H LYS 48 H LYS 48 3.755 -8.575 -20.155 395 HA LYS 48 HA LYS 48 1.373 -8.791 -18.610 396 HB2 LYS 48 2HB LYS 48 1.914 -7.049 -21.022 397 HB3 LYS 48 3HB LYS 48 0.623 -6.827 -19.848 398 HG2 LYS 48 2HG LYS 48 3.559 -6.691 -19.199 399 HG3 LYS 48 3HG LYS 48 2.534 -5.292 -19.530 400 HD2 LYS 48 2HD LYS 48 1.213 -5.695 -17.600 401 HD3 LYS 48 3HD LYS 48 1.927 -7.291 -17.361 402 HE2 LYS 48 2HE LYS 48 3.142 -6.139 -15.826 403 HE3 LYS 48 3HE LYS 48 4.153 -5.842 -17.239 404 HZ1 LYS 48 1HZ LYS 48 3.362 -3.691 -17.453 405 HZ2 LYS 48 2HZ LYS 48 3.492 -3.866 -15.776 406 HZ3 LYS 48 3HZ LYS 48 1.979 -3.980 -16.524 407 H PHE 49 H PHE 49 2.263 -9.644 -21.894 408 HA PHE 49 HA PHE 49 -0.282 -10.038 -22.975 409 HB2 PHE 49 2HB PHE 49 1.629 -10.040 -24.425 410 HB3 PHE 49 3HB PHE 49 2.350 -11.398 -23.567 411 HD1 PHE 49 HD1 PHE 49 -0.113 -10.367 -26.040 412 HD2 PHE 49 HD2 PHE 49 1.501 -13.659 -23.878 413 HE1 PHE 49 HE1 PHE 49 -1.186 -11.923 -27.615 414 HE2 PHE 49 HE2 PHE 49 0.431 -15.220 -25.450 415 HZ PHE 49 HZ PHE 49 -0.914 -14.353 -27.322 416 H SER 50 H SER 50 1.721 -12.122 -20.976 417 HA SER 50 HA SER 50 0.257 -14.502 -21.280 418 HB2 SER 50 2HB SER 50 2.572 -14.001 -20.112 419 HB3 SER 50 3HB SER 50 1.568 -13.855 -18.669 420 HG SER 50 HG SER 50 1.744 -16.095 -20.404 421 H GLN 51 H GLN 51 -0.189 -11.716 -19.197 422 HA GLN 51 HA GLN 51 -2.054 -12.811 -17.410 423 HB2 GLN 51 2HB GLN 51 -1.827 -9.957 -18.380 424 HB3 GLN 51 3HB GLN 51 -2.705 -10.485 -16.951 425 HG2 GLN 51 2HG GLN 51 0.251 -10.427 -17.419 426 HG3 GLN 51 3HG GLN 51 -0.684 -9.655 -16.140 427 HE21 GLN 51 1HE2 GLN 51 1.245 -12.247 -16.933 428 HE22 GLN 51 2HE2 GLN 51 0.886 -13.272 -15.590 429 H LEU 52 H LEU 52 -2.400 -11.517 -20.643 430 HA LEU 52 HA LEU 52 -5.181 -11.168 -20.690 431 HB2 LEU 52 2HB LEU 52 -3.418 -12.012 -22.983 432 HB3 LEU 52 3HB LEU 52 -4.998 -11.240 -23.096 433 HG LEU 52 HG LEU 52 -2.637 -9.882 -21.819 434 HD11 LEU 52 1HD1 LEU 52 -2.481 -10.665 -24.357 435 HD12 LEU 52 2HD1 LEU 52 -1.858 -9.110 -23.804 436 HD13 LEU 52 3HD1 LEU 52 -3.435 -9.200 -24.588 437 HD21 LEU 52 1HD2 LEU 52 -5.414 -9.236 -22.308 438 HD22 LEU 52 2HD2 LEU 52 -4.331 -8.054 -23.044 439 HD23 LEU 52 3HD2 LEU 52 -4.218 -8.399 -21.317 440 H ALA 53 H ALA 53 -3.205 -13.967 -21.651 441 HA ALA 53 HA ALA 53 -5.391 -15.624 -22.341 442 HB1 ALA 53 1HB ALA 53 -3.756 -17.464 -22.252 443 HB2 ALA 53 2HB ALA 53 -3.165 -16.080 -23.173 444 HB3 ALA 53 3HB ALA 53 -2.581 -16.362 -21.533 445 H GLU 54 H GLU 54 -3.679 -15.033 -19.332 446 HA GLU 54 HA GLU 54 -4.695 -17.207 -17.862 447 HB2 GLU 54 2HB GLU 54 -3.496 -14.562 -17.158 448 HB3 GLU 54 3HB GLU 54 -4.279 -15.499 -15.893 449 HG2 GLU 54 2HG GLU 54 -2.200 -16.732 -17.655 450 HG3 GLU 54 3HG GLU 54 -1.750 -15.763 -16.252 451 H ALA 55 H ALA 55 -5.811 -13.836 -18.091 452 HA ALA 55 HA ALA 55 -8.100 -14.251 -16.448 453 HB1 ALA 55 1HB ALA 55 -8.133 -12.034 -16.473 454 HB2 ALA 55 2HB ALA 55 -6.798 -12.049 -17.627 455 HB3 ALA 55 3HB ALA 55 -8.464 -12.028 -18.206 456 H TYR 56 H TYR 56 -7.511 -14.320 -19.919 457 HA TYR 56 HA TYR 56 -10.231 -14.460 -20.705 458 HB2 TYR 56 2HB TYR 56 -8.709 -13.794 -22.380 459 HB3 TYR 56 3HB TYR 56 -7.639 -15.157 -22.070 460 HD1 TYR 56 HD1 TYR 56 -10.746 -14.080 -23.694 461 HD2 TYR 56 HD2 TYR 56 -8.096 -17.338 -23.013 462 HE1 TYR 56 HE1 TYR 56 -11.845 -15.342 -25.496 463 HE2 TYR 56 HE2 TYR 56 -9.187 -18.609 -24.814 464 HH TYR 56 HH TYR 56 -10.740 -17.597 -27.101 465 H GLU 57 H GLU 57 -7.947 -16.801 -19.556 466 HA GLU 57 HA GLU 57 -9.057 -19.157 -20.565 467 HB2 GLU 57 2HB GLU 57 -7.215 -18.418 -18.419 468 HB3 GLU 57 3HB GLU 57 -8.149 -19.861 -18.055 469 HG2 GLU 57 2HG GLU 57 -6.920 -19.712 -20.737 470 HG3 GLU 57 3HG GLU 57 -5.831 -19.917 -19.365 471 H VAL 58 H VAL 58 -9.715 -17.485 -17.494 472 HA VAL 58 HA VAL 58 -11.796 -19.299 -16.740 473 HB VAL 58 HB VAL 58 -11.299 -16.530 -15.644 474 HG11 VAL 58 1HG1 VAL 58 -12.397 -18.859 -14.123 475 HG12 VAL 58 2HG1 VAL 58 -12.586 -17.131 -13.817 476 HG13 VAL 58 3HG1 VAL 58 -13.454 -17.892 -15.151 477 HG21 VAL 58 1HG2 VAL 58 -9.824 -19.066 -15.295 478 HG22 VAL 58 2HG2 VAL 58 -9.265 -17.399 -15.155 479 HG23 VAL 58 3HG2 VAL 58 -10.159 -18.143 -13.829 480 H LEU 59 H LEU 59 -11.674 -16.100 -18.227 481 HA LEU 59 HA LEU 59 -14.500 -15.700 -18.199 482 HB2 LEU 59 2HB LEU 59 -12.133 -14.306 -19.220 483 HB3 LEU 59 3HB LEU 59 -13.584 -14.082 -20.195 484 HG LEU 59 HG LEU 59 -14.759 -13.129 -18.327 485 HD11 LEU 59 1HD1 LEU 59 -13.578 -12.758 -16.168 486 HD12 LEU 59 2HD1 LEU 59 -12.295 -13.823 -16.740 487 HD13 LEU 59 3HD1 LEU 59 -13.927 -14.451 -16.516 488 HD21 LEU 59 1HD2 LEU 59 -13.358 -11.141 -17.901 489 HD22 LEU 59 2HD2 LEU 59 -13.407 -11.592 -19.605 490 HD23 LEU 59 3HD2 LEU 59 -11.988 -11.978 -18.630 491 H SER 60 H SER 60 -12.557 -17.748 -19.964 492 HA SER 60 HA SER 60 -13.841 -17.586 -22.510 493 HB2 SER 60 2HB SER 60 -11.625 -18.502 -22.432 494 HB3 SER 60 3HB SER 60 -12.103 -19.708 -21.238 495 HG SER 60 HG SER 60 -13.198 -19.563 -23.849 496 H ASP 61 H ASP 61 -14.703 -18.935 -19.511 497 HA ASP 61 HA ASP 61 -16.957 -20.327 -20.781 498 HB2 ASP 61 2HB ASP 61 -14.966 -21.794 -19.812 499 HB3 ASP 61 3HB ASP 61 -15.799 -21.490 -18.289 500 H GLU 62 H GLU 62 -18.903 -20.041 -19.811 501 HA GLU 62 HA GLU 62 -19.282 -17.880 -18.075 502 HB2 GLU 62 2HB GLU 62 -21.211 -20.170 -18.447 503 HB3 GLU 62 3HB GLU 62 -21.591 -18.512 -18.004 504 HG2 GLU 62 2HG GLU 62 -20.693 -17.823 -20.250 505 HG3 GLU 62 3HG GLU 62 -20.639 -19.536 -20.662 506 H VAL 63 H VAL 63 -19.191 -21.362 -17.444 507 HA VAL 63 HA VAL 63 -19.924 -21.328 -14.754 508 HB VAL 63 HB VAL 63 -17.913 -23.212 -15.986 509 HG11 VAL 63 1HG1 VAL 63 -18.157 -24.525 -14.173 510 HG12 VAL 63 2HG1 VAL 63 -18.654 -23.022 -13.393 511 HG13 VAL 63 3HG1 VAL 63 -19.871 -24.147 -13.999 512 HG21 VAL 63 1HG2 VAL 63 -20.666 -22.788 -16.657 513 HG22 VAL 63 2HG2 VAL 63 -19.514 -23.929 -17.351 514 HG23 VAL 63 3HG2 VAL 63 -20.467 -24.387 -15.939 515 H LYS 64 H LYS 64 -16.642 -21.324 -16.148 516 HA LYS 64 HA LYS 64 -15.297 -21.015 -13.691 517 HB2 LYS 64 2HB LYS 64 -14.434 -20.296 -16.498 518 HB3 LYS 64 3HB LYS 64 -13.364 -20.310 -15.102 519 HG2 LYS 64 2HG LYS 64 -13.946 -22.733 -14.805 520 HG3 LYS 64 3HG LYS 64 -14.768 -22.649 -16.365 521 HD2 LYS 64 2HD LYS 64 -11.863 -21.974 -15.905 522 HD3 LYS 64 3HD LYS 64 -12.454 -23.516 -16.529 523 HE2 LYS 64 2HE LYS 64 -13.607 -22.121 -18.342 524 HE3 LYS 64 3HE LYS 64 -12.563 -20.802 -17.812 525 HZ1 LYS 64 1HZ LYS 64 -11.911 -22.665 -19.658 526 HZ2 LYS 64 2HZ LYS 64 -11.159 -23.270 -18.269 527 HZ3 LYS 64 3HZ LYS 64 -10.803 -21.707 -18.811 528 H ARG 65 H ARG 65 -16.269 -18.645 -16.154 529 HA ARG 65 HA ARG 65 -15.175 -16.372 -14.973 530 HB2 ARG 65 2HB ARG 65 -16.104 -16.434 -17.258 531 HB3 ARG 65 3HB ARG 65 -17.723 -16.574 -16.587 532 HG2 ARG 65 2HG ARG 65 -17.566 -14.379 -15.616 533 HG3 ARG 65 3HG ARG 65 -15.879 -14.242 -16.117 534 HD2 ARG 65 2HD ARG 65 -17.551 -13.043 -17.570 535 HD3 ARG 65 3HD ARG 65 -16.472 -14.158 -18.408 536 HE ARG 65 HE ARG 65 -18.282 -15.469 -18.937 537 HH11 ARG 65 1HH1 ARG 65 -19.199 -13.137 -16.520 538 HH12 ARG 65 2HH1 ARG 65 -20.892 -13.490 -16.636 539 HH21 ARG 65 1HH2 ARG 65 -20.507 -15.941 -19.098 540 HH22 ARG 65 2HH2 ARG 65 -21.635 -15.085 -18.102 541 H LYS 66 H LYS 66 -18.298 -17.939 -14.445 542 HA LYS 66 HA LYS 66 -19.334 -15.961 -12.696 543 HB2 LYS 66 2HB LYS 66 -20.037 -18.841 -13.217 544 HB3 LYS 66 3HB LYS 66 -20.867 -17.902 -11.983 545 HG2 LYS 66 2HG LYS 66 -20.705 -17.121 -14.886 546 HG3 LYS 66 3HG LYS 66 -22.056 -17.991 -14.155 547 HD2 LYS 66 2HD LYS 66 -22.887 -16.133 -13.211 548 HD3 LYS 66 3HD LYS 66 -21.293 -15.565 -12.710 549 HE2 LYS 66 2HE LYS 66 -20.956 -14.389 -14.639 550 HE3 LYS 66 3HE LYS 66 -21.957 -15.473 -15.604 551 HZ1 LYS 66 1HZ LYS 66 -23.775 -14.412 -13.966 552 HZ2 LYS 66 2HZ LYS 66 -23.404 -13.779 -15.490 553 HZ3 LYS 66 3HZ LYS 66 -22.704 -13.109 -14.103 554 H GLN 67 H GLN 67 -17.564 -18.977 -12.174 555 HA GLN 67 HA GLN 67 -17.762 -19.097 -9.391 556 HB2 GLN 67 2HB GLN 67 -15.714 -20.109 -11.344 557 HB3 GLN 67 3HB GLN 67 -15.502 -20.335 -9.613 558 HG2 GLN 67 2HG GLN 67 -17.804 -21.333 -11.275 559 HG3 GLN 67 3HG GLN 67 -16.486 -22.301 -10.615 560 HE21 GLN 67 1HE2 GLN 67 -19.484 -20.744 -9.983 561 HE22 GLN 67 2HE2 GLN 67 -19.685 -21.304 -8.361 562 H TYR 68 H TYR 68 -15.514 -17.351 -11.469 563 HA TYR 68 HA TYR 68 -13.827 -16.469 -9.342 564 HB2 TYR 68 2HB TYR 68 -13.049 -16.630 -11.681 565 HB3 TYR 68 3HB TYR 68 -14.154 -15.335 -12.129 566 HD1 TYR 68 HD1 TYR 68 -11.326 -16.050 -9.800 567 HD2 TYR 68 HD2 TYR 68 -13.390 -13.146 -12.126 568 HE1 TYR 68 HE1 TYR 68 -9.593 -14.392 -9.257 569 HE2 TYR 68 HE2 TYR 68 -11.662 -11.480 -11.590 570 HH TYR 68 HH TYR 68 -8.799 -12.031 -10.668 571 H ASP 69 H ASP 69 -16.609 -15.133 -11.034 572 HA ASP 69 HA ASP 69 -16.499 -12.515 -10.055 573 HB2 ASP 69 2HB ASP 69 -18.038 -13.544 -11.862 574 HB3 ASP 69 3HB ASP 69 -19.095 -13.962 -10.516 575 H ALA 70 H ALA 70 -17.624 -15.478 -8.589 576 HA ALA 70 HA ALA 70 -19.121 -14.377 -6.476 577 HB1 ALA 70 1HB ALA 70 -19.561 -16.568 -6.431 578 HB2 ALA 70 2HB ALA 70 -18.015 -16.989 -7.169 579 HB3 ALA 70 3HB ALA 70 -18.113 -16.698 -5.433 580 H TYR 71 H TYR 71 -15.684 -14.956 -6.880 581 HA TYR 71 HA TYR 71 -15.214 -13.839 -4.196 582 HB2 TYR 71 2HB TYR 71 -13.288 -15.474 -5.855 583 HB3 TYR 71 3HB TYR 71 -13.087 -14.980 -4.178 584 HD1 TYR 71 HD1 TYR 71 -15.427 -15.672 -2.791 585 HD2 TYR 71 HD2 TYR 71 -13.640 -17.738 -6.053 586 HE1 TYR 71 HE1 TYR 71 -16.494 -17.759 -2.045 587 HE2 TYR 71 HE2 TYR 71 -14.702 -19.830 -5.317 588 HH TYR 71 HH TYR 71 -16.714 -20.497 -3.962 589 H GLY 72 H GLY 72 -15.731 -12.378 -6.729 590 HA2 GLY 72 2HA GLY 72 -13.138 -11.121 -7.253 591 HA3 GLY 72 3HA GLY 72 -14.610 -10.880 -8.181 592 H SER 73 H SER 73 -12.749 -8.920 -7.009 593 HA SER 73 HA SER 73 -13.771 -7.705 -4.717 594 HB2 SER 73 2HB SER 73 -12.767 -5.566 -5.864 595 HB3 SER 73 3HB SER 73 -11.698 -6.871 -5.349 596 HG SER 73 HG SER 73 -11.094 -6.507 -7.398 Start of MODEL 11 1 H1 HIS 1 H HIS 1 -0.400 3.299 0.530 2 HA HIS 1 HA HIS 1 -2.941 3.731 -0.898 3 HB2 HIS 1 2HB HIS 1 -0.095 3.895 -1.776 4 HB3 HIS 1 3HB HIS 1 -1.288 3.326 -2.940 5 HD1 HIS 1 HD1 HIS 1 -1.387 5.332 -4.449 6 HD2 HIS 1 HD2 HIS 1 -1.917 6.312 -0.447 7 HE1 HIS 1 HE1 HIS 1 -2.066 7.753 -4.434 8 H MET 2 H MET 2 -4.074 1.898 -0.873 9 HA MET 2 HA MET 2 -2.641 -0.642 -1.271 10 HB2 MET 2 2HB MET 2 -3.945 -0.387 0.849 11 HB3 MET 2 3HB MET 2 -5.406 -0.241 -0.119 12 HG2 MET 2 2HG MET 2 -5.453 -2.456 0.455 13 HG3 MET 2 3HG MET 2 -4.656 -2.517 -1.115 14 HE1 MET 2 1HE MET 2 -3.316 -3.977 -1.518 15 HE2 MET 2 2HE MET 2 -1.637 -3.789 -1.012 16 HE3 MET 2 3HE MET 2 -2.612 -5.108 -0.361 17 H LEU 3 H LEU 3 -2.996 -1.784 -3.068 18 HA LEU 3 HA LEU 3 -4.710 -0.714 -5.110 19 HB2 LEU 3 2HB LEU 3 -2.879 -3.084 -4.941 20 HB3 LEU 3 3HB LEU 3 -3.930 -2.830 -6.333 21 HG LEU 3 HG LEU 3 -2.783 -0.522 -6.495 22 HD11 LEU 3 1HD1 LEU 3 -0.273 -1.135 -5.650 23 HD12 LEU 3 2HD1 LEU 3 -1.257 -1.823 -4.359 24 HD13 LEU 3 3HD1 LEU 3 -1.412 -0.115 -4.771 25 HD21 LEU 3 1HD2 LEU 3 -2.394 -2.012 -8.237 26 HD22 LEU 3 2HD2 LEU 3 -1.574 -3.173 -7.193 27 HD23 LEU 3 3HD2 LEU 3 -0.773 -1.664 -7.634 28 H ALA 4 H ALA 4 -6.766 -1.211 -5.452 29 HA ALA 4 HA ALA 4 -8.179 -3.048 -3.834 30 HB1 ALA 4 1HB ALA 4 -9.592 -1.421 -4.548 31 HB2 ALA 4 2HB ALA 4 -8.834 -1.302 -6.137 32 HB3 ALA 4 3HB ALA 4 -9.939 -2.631 -5.784 33 H LYS 5 H LYS 5 -9.472 -4.877 -4.630 34 HA LYS 5 HA LYS 5 -7.920 -6.865 -5.788 35 HB2 LYS 5 2HB LYS 5 -10.846 -6.548 -5.271 36 HB3 LYS 5 3HB LYS 5 -10.303 -7.906 -6.249 37 HG2 LYS 5 2HG LYS 5 -8.804 -7.546 -3.762 38 HG3 LYS 5 3HG LYS 5 -10.517 -7.911 -3.538 39 HD2 LYS 5 2HD LYS 5 -9.751 -10.042 -3.694 40 HD3 LYS 5 3HD LYS 5 -9.941 -9.722 -5.420 41 HE2 LYS 5 2HE LYS 5 -7.797 -10.677 -5.170 42 HE3 LYS 5 3HE LYS 5 -7.532 -8.950 -5.405 43 HZ1 LYS 5 1HZ LYS 5 -6.689 -10.550 -3.276 44 HZ2 LYS 5 2HZ LYS 5 -7.810 -9.443 -2.662 45 HZ3 LYS 5 3HZ LYS 5 -6.446 -8.889 -3.494 46 H GLU 6 H GLU 6 -7.721 -7.716 -7.825 47 HA GLU 6 HA GLU 6 -8.827 -6.074 -10.004 48 HB2 GLU 6 2HB GLU 6 -6.222 -7.457 -9.617 49 HB3 GLU 6 3HB GLU 6 -6.871 -7.400 -11.250 50 HG2 GLU 6 2HG GLU 6 -6.927 -5.001 -11.202 51 HG3 GLU 6 3HG GLU 6 -6.447 -4.986 -9.506 52 H ASP 7 H ASP 7 -10.056 -6.989 -11.547 53 HA ASP 7 HA ASP 7 -10.476 -9.901 -11.384 54 HB2 ASP 7 2HB ASP 7 -12.474 -7.945 -12.504 55 HB3 ASP 7 3HB ASP 7 -12.747 -9.598 -11.959 56 H TYR 8 H TYR 8 -11.065 -10.975 -13.407 57 HA TYR 8 HA TYR 8 -9.248 -10.366 -15.478 58 HB2 TYR 8 2HB TYR 8 -11.673 -12.152 -15.710 59 HB3 TYR 8 3HB TYR 8 -10.185 -12.238 -16.646 60 HD1 TYR 8 HD1 TYR 8 -11.783 -14.219 -14.631 61 HD2 TYR 8 HD2 TYR 8 -8.158 -11.995 -14.499 62 HE1 TYR 8 HE1 TYR 8 -10.863 -15.824 -13.010 63 HE2 TYR 8 HE2 TYR 8 -7.229 -13.594 -12.879 64 HH TYR 8 HH TYR 8 -7.560 -15.473 -11.749 65 H TYR 9 H TYR 9 -12.544 -9.458 -14.894 66 HA TYR 9 HA TYR 9 -13.473 -8.851 -17.419 67 HB2 TYR 9 2HB TYR 9 -13.935 -7.209 -14.922 68 HB3 TYR 9 3HB TYR 9 -14.958 -7.242 -16.354 69 HD1 TYR 9 HD1 TYR 9 -14.404 -8.626 -13.140 70 HD2 TYR 9 HD2 TYR 9 -15.976 -9.549 -16.985 71 HE1 TYR 9 HE1 TYR 9 -15.705 -10.468 -12.159 72 HE2 TYR 9 HE2 TYR 9 -17.283 -11.393 -16.014 73 HH TYR 9 HH TYR 9 -16.715 -12.799 -13.263 74 H GLN 10 H GLN 10 -11.486 -6.841 -15.275 75 HA GLN 10 HA GLN 10 -11.351 -4.648 -17.097 76 HB2 GLN 10 2HB GLN 10 -9.798 -5.367 -14.617 77 HB3 GLN 10 3HB GLN 10 -9.445 -3.926 -15.560 78 HG2 GLN 10 2HG GLN 10 -10.836 -3.113 -13.919 79 HG3 GLN 10 3HG GLN 10 -11.955 -3.398 -15.251 80 HE21 GLN 10 1HE2 GLN 10 -13.771 -4.324 -14.671 81 HE22 GLN 10 2HE2 GLN 10 -13.988 -5.422 -13.355 82 H ILE 11 H ILE 11 -9.227 -7.359 -16.305 83 HA ILE 11 HA ILE 11 -6.991 -6.604 -17.791 84 HB ILE 11 HB ILE 11 -8.004 -9.411 -17.328 85 HG12 ILE 11 2HG1 ILE 11 -5.961 -7.885 -15.712 86 HG13 ILE 11 3HG1 ILE 11 -7.666 -7.947 -15.280 87 HG21 ILE 11 1HG2 ILE 11 -5.640 -8.329 -18.642 88 HG22 ILE 11 2HG2 ILE 11 -5.259 -9.483 -17.365 89 HG23 ILE 11 3HG2 ILE 11 -6.320 -9.956 -18.691 90 HD11 ILE 11 1HD1 ILE 11 -7.510 -10.028 -14.473 91 HD12 ILE 11 2HD1 ILE 11 -6.415 -10.555 -15.751 92 HD13 ILE 11 3HD1 ILE 11 -5.790 -9.656 -14.369 93 H LEU 12 H LEU 12 -10.074 -7.745 -18.823 94 HA LEU 12 HA LEU 12 -9.058 -8.150 -21.554 95 HB2 LEU 12 2HB LEU 12 -11.326 -9.295 -20.016 96 HB3 LEU 12 3HB LEU 12 -11.535 -9.082 -21.753 97 HG LEU 12 HG LEU 12 -9.246 -10.629 -20.553 98 HD11 LEU 12 1HD1 LEU 12 -12.046 -11.363 -20.824 99 HD12 LEU 12 2HD1 LEU 12 -10.741 -12.171 -19.958 100 HD13 LEU 12 3HD1 LEU 12 -10.962 -12.458 -21.683 101 HD21 LEU 12 1HD2 LEU 12 -10.444 -10.810 -23.306 102 HD22 LEU 12 2HD2 LEU 12 -8.905 -11.457 -22.737 103 HD23 LEU 12 3HD2 LEU 12 -9.120 -9.714 -22.911 104 H GLY 13 H GLY 13 -10.861 -6.056 -19.571 105 HA2 GLY 13 2HA GLY 13 -11.738 -3.978 -20.095 106 HA3 GLY 13 3HA GLY 13 -11.361 -4.284 -21.784 107 H VAL 14 H VAL 14 -13.218 -6.600 -19.993 108 HA VAL 14 HA VAL 14 -15.597 -5.815 -21.543 109 HB VAL 14 HB VAL 14 -16.357 -8.125 -21.353 110 HG11 VAL 14 1HG1 VAL 14 -13.545 -8.430 -22.277 111 HG12 VAL 14 2HG1 VAL 14 -15.050 -8.945 -23.043 112 HG13 VAL 14 3HG1 VAL 14 -14.573 -7.247 -23.085 113 HG21 VAL 14 1HG2 VAL 14 -14.933 -9.857 -20.395 114 HG22 VAL 14 2HG2 VAL 14 -13.748 -8.638 -19.924 115 HG23 VAL 14 3HG2 VAL 14 -15.348 -8.646 -19.182 116 HA PRO 15 HA PRO 15 -17.844 -4.965 -17.867 117 HB2 PRO 15 2HB PRO 15 -20.350 -5.683 -18.624 118 HB3 PRO 15 3HB PRO 15 -19.544 -4.230 -19.227 119 HG2 PRO 15 2HG PRO 15 -19.838 -6.910 -20.527 120 HG3 PRO 15 3HG PRO 15 -20.016 -5.295 -21.239 121 HD2 PRO 15 2HD PRO 15 -17.773 -6.781 -21.540 122 HD3 PRO 15 3HD PRO 15 -17.740 -5.008 -21.466 123 H ARG 16 H ARG 16 -19.526 -5.992 -16.364 124 HA ARG 16 HA ARG 16 -18.569 -8.606 -15.642 125 HB2 ARG 16 2HB ARG 16 -20.718 -6.869 -14.414 126 HB3 ARG 16 3HB ARG 16 -20.117 -8.367 -13.717 127 HG2 ARG 16 2HG ARG 16 -18.379 -7.338 -12.800 128 HG3 ARG 16 3HG ARG 16 -17.956 -6.550 -14.322 129 HD2 ARG 16 2HD ARG 16 -20.238 -5.576 -12.637 130 HD3 ARG 16 3HD ARG 16 -18.580 -5.073 -12.312 131 HE ARG 16 HE ARG 16 -19.029 -4.626 -15.006 132 HH11 ARG 16 1HH1 ARG 16 -20.319 -3.520 -11.967 133 HH12 ARG 16 2HH1 ARG 16 -20.760 -1.958 -12.574 134 HH21 ARG 16 1HH2 ARG 16 -19.606 -2.573 -15.817 135 HH22 ARG 16 2HH2 ARG 16 -20.355 -1.421 -14.764 136 H ASN 17 H ASN 17 -20.937 -7.502 -17.719 137 HA ASN 17 HA ASN 17 -22.523 -9.965 -17.413 138 HB2 ASN 17 2HB ASN 17 -23.273 -7.252 -18.508 139 HB3 ASN 17 3HB ASN 17 -24.271 -8.684 -18.743 140 HD21 ASN 17 1HD2 ASN 17 -24.593 -6.101 -17.218 141 HD22 ASN 17 2HD2 ASN 17 -25.093 -6.601 -15.642 142 H ALA 18 H ALA 18 -20.044 -8.838 -19.137 143 HA ALA 18 HA ALA 18 -20.645 -9.108 -21.824 144 HB1 ALA 18 1HB ALA 18 -18.416 -8.508 -20.545 145 HB2 ALA 18 2HB ALA 18 -18.059 -10.207 -20.855 146 HB3 ALA 18 3HB ALA 18 -18.393 -9.117 -22.200 147 H SER 19 H SER 19 -20.176 -10.875 -23.309 148 HA SER 19 HA SER 19 -20.912 -13.470 -22.134 149 HB2 SER 19 2HB SER 19 -21.231 -12.519 -24.991 150 HB3 SER 19 3HB SER 19 -21.792 -14.060 -24.342 151 HG SER 19 HG SER 19 -22.854 -11.517 -24.060 152 H GLN 20 H GLN 20 -20.111 -15.381 -23.492 153 HA GLN 20 HA GLN 20 -17.293 -15.405 -23.417 154 HB2 GLN 20 2HB GLN 20 -18.984 -17.390 -24.925 155 HB3 GLN 20 3HB GLN 20 -17.429 -17.657 -24.148 156 HG2 GLN 20 2HG GLN 20 -20.116 -17.302 -22.867 157 HG3 GLN 20 3HG GLN 20 -19.020 -18.679 -22.764 158 HE21 GLN 20 1HE2 GLN 20 -17.066 -18.426 -21.555 159 HE22 GLN 20 2HE2 GLN 20 -16.987 -17.287 -20.258 160 H LYS 21 H LYS 21 -19.565 -14.659 -25.923 161 HA LYS 21 HA LYS 21 -17.715 -14.975 -28.098 162 HB2 LYS 21 2HB LYS 21 -19.470 -13.893 -29.448 163 HB3 LYS 21 3HB LYS 21 -20.103 -15.226 -28.491 164 HG2 LYS 21 2HG LYS 21 -20.602 -13.250 -26.785 165 HG3 LYS 21 3HG LYS 21 -20.629 -12.321 -28.286 166 HD2 LYS 21 2HD LYS 21 -22.849 -13.000 -27.986 167 HD3 LYS 21 3HD LYS 21 -22.201 -14.143 -29.165 168 HE2 LYS 21 2HE LYS 21 -21.838 -15.778 -27.394 169 HE3 LYS 21 3HE LYS 21 -22.441 -14.633 -26.197 170 HZ1 LYS 21 1HZ LYS 21 -23.909 -16.451 -27.701 171 HZ2 LYS 21 2HZ LYS 21 -24.335 -14.913 -28.261 172 HZ3 LYS 21 3HZ LYS 21 -24.497 -15.290 -26.620 173 H GLU 22 H GLU 22 -18.934 -12.281 -26.164 174 HA GLU 22 HA GLU 22 -17.647 -10.241 -27.658 175 HB2 GLU 22 2HB GLU 22 -19.509 -9.663 -26.256 176 HB3 GLU 22 3HB GLU 22 -18.705 -10.307 -24.832 177 HG2 GLU 22 2HG GLU 22 -17.133 -8.539 -24.805 178 HG3 GLU 22 3HG GLU 22 -17.626 -7.989 -26.405 179 H ILE 23 H ILE 23 -16.692 -12.232 -24.931 180 HA ILE 23 HA ILE 23 -14.383 -10.784 -24.194 181 HB ILE 23 HB ILE 23 -14.977 -13.726 -23.855 182 HG12 ILE 23 2HG1 ILE 23 -15.112 -11.739 -21.635 183 HG13 ILE 23 3HG1 ILE 23 -16.431 -11.763 -22.800 184 HG21 ILE 23 1HG2 ILE 23 -13.282 -12.798 -21.819 185 HG22 ILE 23 2HG2 ILE 23 -12.898 -13.935 -23.111 186 HG23 ILE 23 3HG2 ILE 23 -12.601 -12.211 -23.336 187 HD11 ILE 23 1HD1 ILE 23 -15.829 -13.587 -20.634 188 HD12 ILE 23 2HD1 ILE 23 -17.329 -13.344 -21.531 189 HD13 ILE 23 3HD1 ILE 23 -16.085 -14.420 -22.167 190 H LYS 24 H LYS 24 -14.971 -13.286 -26.586 191 HA LYS 24 HA LYS 24 -12.312 -13.955 -27.175 192 HB2 LYS 24 2HB LYS 24 -14.931 -14.223 -28.534 193 HB3 LYS 24 3HB LYS 24 -13.509 -14.321 -29.565 194 HG2 LYS 24 2HG LYS 24 -12.624 -16.102 -28.077 195 HG3 LYS 24 3HG LYS 24 -14.151 -16.059 -27.193 196 HD2 LYS 24 2HD LYS 24 -14.247 -16.387 -30.148 197 HD3 LYS 24 3HD LYS 24 -13.734 -17.766 -29.173 198 HE2 LYS 24 2HE LYS 24 -16.290 -16.218 -28.765 199 HE3 LYS 24 3HE LYS 24 -16.166 -17.744 -29.639 200 HZ1 LYS 24 1HZ LYS 24 -14.963 -17.935 -27.073 201 HZ2 LYS 24 2HZ LYS 24 -16.209 -18.863 -27.741 202 HZ3 LYS 24 3HZ LYS 24 -16.568 -17.417 -26.939 203 H LYS 25 H LYS 25 -14.410 -11.405 -28.431 204 HA LYS 25 HA LYS 25 -12.555 -10.489 -30.394 205 HB2 LYS 25 2HB LYS 25 -14.957 -9.153 -29.137 206 HB3 LYS 25 3HB LYS 25 -14.045 -8.481 -30.482 207 HG2 LYS 25 2HG LYS 25 -14.724 -10.197 -31.938 208 HG3 LYS 25 3HG LYS 25 -15.315 -11.198 -30.610 209 HD2 LYS 25 2HD LYS 25 -17.287 -10.340 -31.427 210 HD3 LYS 25 3HD LYS 25 -16.898 -9.156 -30.177 211 HE2 LYS 25 2HE LYS 25 -15.888 -8.719 -32.947 212 HE3 LYS 25 3HE LYS 25 -17.587 -8.400 -32.601 213 HZ1 LYS 25 1HZ LYS 25 -15.216 -6.964 -31.730 214 HZ2 LYS 25 2HZ LYS 25 -16.435 -7.138 -30.570 215 HZ3 LYS 25 3HZ LYS 25 -16.775 -6.389 -32.049 216 H ALA 26 H ALA 26 -13.477 -9.322 -27.165 217 HA ALA 26 HA ALA 26 -11.729 -7.118 -27.106 218 HB1 ALA 26 1HB ALA 26 -12.734 -8.714 -24.753 219 HB2 ALA 26 2HB ALA 26 -12.135 -7.055 -24.731 220 HB3 ALA 26 3HB ALA 26 -13.640 -7.439 -25.567 221 H TYR 27 H TYR 27 -11.254 -10.512 -26.426 222 HA TYR 27 HA TYR 27 -8.755 -10.214 -25.083 223 HB2 TYR 27 2HB TYR 27 -10.005 -12.212 -24.676 224 HB3 TYR 27 3HB TYR 27 -10.098 -12.579 -26.395 225 HD1 TYR 27 HD1 TYR 27 -7.244 -11.667 -24.158 226 HD2 TYR 27 HD2 TYR 27 -8.930 -14.523 -26.824 227 HE1 TYR 27 HE1 TYR 27 -5.209 -13.036 -23.970 228 HE2 TYR 27 HE2 TYR 27 -6.900 -15.900 -26.642 229 HH TYR 27 HH TYR 27 -4.061 -14.860 -25.607 230 H TYR 28 H TYR 28 -9.743 -10.672 -28.418 231 HA TYR 28 HA TYR 28 -7.102 -11.178 -29.403 232 HB2 TYR 28 2HB TYR 28 -9.000 -12.028 -30.637 233 HB3 TYR 28 3HB TYR 28 -9.661 -10.407 -30.817 234 HD1 TYR 28 HD1 TYR 28 -9.540 -9.672 -32.993 235 HD2 TYR 28 HD2 TYR 28 -6.305 -11.948 -31.428 236 HE1 TYR 28 HE1 TYR 28 -8.336 -9.413 -35.122 237 HE2 TYR 28 HE2 TYR 28 -5.091 -11.695 -33.552 238 HH TYR 28 HH TYR 28 -6.562 -10.054 -36.324 239 H GLN 29 H GLN 29 -9.279 -8.370 -29.439 240 HA GLN 29 HA GLN 29 -7.599 -6.620 -30.830 241 HB2 GLN 29 2HB GLN 29 -9.026 -4.879 -30.118 242 HB3 GLN 29 3HB GLN 29 -10.053 -6.301 -30.241 243 HG2 GLN 29 2HG GLN 29 -9.953 -6.611 -27.838 244 HG3 GLN 29 3HG GLN 29 -8.866 -5.231 -27.690 245 HE21 GLN 29 1HE2 GLN 29 -10.427 -4.342 -26.238 246 HE22 GLN 29 2HE2 GLN 29 -11.828 -3.539 -26.851 247 H LEU 30 H LEU 30 -7.706 -7.520 -27.443 248 HA LEU 30 HA LEU 30 -5.938 -5.465 -26.546 249 HB2 LEU 30 2HB LEU 30 -7.416 -7.657 -25.401 250 HB3 LEU 30 3HB LEU 30 -5.774 -7.612 -24.761 251 HG LEU 30 HG LEU 30 -6.103 -5.368 -23.945 252 HD11 LEU 30 1HD1 LEU 30 -8.375 -5.436 -25.767 253 HD12 LEU 30 2HD1 LEU 30 -7.473 -4.063 -25.126 254 HD13 LEU 30 3HD1 LEU 30 -8.774 -4.783 -24.178 255 HD21 LEU 30 1HD2 LEU 30 -6.770 -6.786 -22.276 256 HD22 LEU 30 2HD2 LEU 30 -8.084 -7.473 -23.231 257 HD23 LEU 30 3HD2 LEU 30 -8.256 -5.869 -22.518 258 H ALA 31 H ALA 31 -5.547 -8.857 -27.467 259 HA ALA 31 HA ALA 31 -2.872 -9.192 -26.751 260 HB1 ALA 31 1HB ALA 31 -4.769 -10.541 -28.545 261 HB2 ALA 31 2HB ALA 31 -3.065 -10.777 -28.936 262 HB3 ALA 31 3HB ALA 31 -3.672 -11.211 -27.337 263 H LYS 32 H LYS 32 -4.317 -7.659 -29.548 264 HA LYS 32 HA LYS 32 -1.944 -7.508 -31.108 265 HB2 LYS 32 2HB LYS 32 -4.557 -6.008 -31.187 266 HB3 LYS 32 3HB LYS 32 -3.250 -5.674 -32.314 267 HG2 LYS 32 2HG LYS 32 -3.559 -7.602 -33.464 268 HG3 LYS 32 3HG LYS 32 -4.105 -8.494 -32.042 269 HD2 LYS 32 2HD LYS 32 -5.930 -8.188 -33.630 270 HD3 LYS 32 3HD LYS 32 -6.250 -7.315 -32.130 271 HE2 LYS 32 2HE LYS 32 -6.816 -6.007 -34.147 272 HE3 LYS 32 3HE LYS 32 -5.586 -5.233 -33.150 273 HZ1 LYS 32 1HZ LYS 32 -4.013 -5.495 -34.725 274 HZ2 LYS 32 2HZ LYS 32 -5.345 -5.524 -35.766 275 HZ3 LYS 32 3HZ LYS 32 -4.625 -6.974 -35.275 276 H LYS 33 H LYS 33 -3.050 -5.807 -28.371 277 HA LYS 33 HA LYS 33 -1.602 -3.370 -28.891 278 HB2 LYS 33 2HB LYS 33 -2.679 -4.296 -26.231 279 HB3 LYS 33 3HB LYS 33 -2.353 -2.647 -26.748 280 HG2 LYS 33 2HG LYS 33 -4.155 -2.992 -28.498 281 HG3 LYS 33 3HG LYS 33 -4.581 -4.461 -27.617 282 HD2 LYS 33 2HD LYS 33 -6.000 -2.941 -26.638 283 HD3 LYS 33 3HD LYS 33 -4.611 -2.842 -25.553 284 HE2 LYS 33 2HE LYS 33 -3.903 -0.807 -26.458 285 HE3 LYS 33 3HE LYS 33 -4.869 -1.016 -27.918 286 HZ1 LYS 33 1HZ LYS 33 -6.687 -1.033 -25.873 287 HZ2 LYS 33 2HZ LYS 33 -6.377 0.253 -26.927 288 HZ3 LYS 33 3HZ LYS 33 -5.591 0.178 -25.431 289 H TYR 34 H TYR 34 -1.087 -6.342 -27.092 290 HA TYR 34 HA TYR 34 1.579 -5.373 -26.307 291 HB2 TYR 34 2HB TYR 34 0.058 -7.724 -25.167 292 HB3 TYR 34 3HB TYR 34 1.559 -7.040 -24.553 293 HD1 TYR 34 HD1 TYR 34 1.546 -5.170 -23.092 294 HD2 TYR 34 HD2 TYR 34 -2.058 -6.403 -24.988 295 HE1 TYR 34 HE1 TYR 34 0.266 -3.669 -21.623 296 HE2 TYR 34 HE2 TYR 34 -3.348 -4.905 -23.525 297 HH TYR 34 HH TYR 34 -3.271 -3.573 -21.727 298 H HIS 35 H HIS 35 0.779 -6.458 -28.941 299 HA HIS 35 HA HIS 35 1.520 -9.074 -29.390 300 HB2 HIS 35 2HB HIS 35 2.277 -8.227 -31.675 301 HB3 HIS 35 3HB HIS 35 0.616 -7.867 -31.213 302 HD1 HIS 35 HD1 HIS 35 3.354 -5.797 -29.770 303 HD2 HIS 35 HD2 HIS 35 0.621 -5.604 -32.893 304 HE1 HIS 35 HE1 HIS 35 3.410 -3.412 -30.567 305 HA PRO 36 HA PRO 36 5.828 -9.447 -28.645 306 HB2 PRO 36 2HB PRO 36 6.574 -11.178 -30.599 307 HB3 PRO 36 3HB PRO 36 5.618 -11.668 -29.195 308 HG2 PRO 36 2HG PRO 36 4.711 -11.028 -31.976 309 HG3 PRO 36 3HG PRO 36 4.202 -12.350 -30.909 310 HD2 PRO 36 2HD PRO 36 2.730 -10.102 -31.248 311 HD3 PRO 36 3HD PRO 36 2.761 -11.002 -29.717 312 H ASP 37 H ASP 37 4.659 -8.086 -31.536 313 HA ASP 37 HA ASP 37 6.958 -7.693 -33.050 314 HB2 ASP 37 2HB ASP 37 4.438 -7.067 -33.488 315 HB3 ASP 37 3HB ASP 37 4.929 -5.504 -32.840 316 H THR 38 H THR 38 5.888 -6.122 -30.134 317 HA THR 38 HA THR 38 8.173 -4.270 -30.291 318 HB THR 38 HB THR 38 7.007 -2.943 -28.543 319 HG1 THR 38 HG1 THR 38 5.629 -5.026 -28.103 320 HG21 THR 38 1HG2 THR 38 6.752 -2.372 -30.917 321 HG22 THR 38 2HG2 THR 38 5.284 -2.014 -30.008 322 HG23 THR 38 3HG2 THR 38 5.362 -3.452 -31.026 323 H ASN 39 H ASN 39 7.685 -7.193 -29.200 324 HA ASN 39 HA ASN 39 8.569 -6.856 -26.452 325 HB2 ASN 39 2HB ASN 39 7.744 -9.206 -28.131 326 HB3 ASN 39 3HB ASN 39 8.609 -9.457 -26.618 327 HD21 ASN 39 1HD2 ASN 39 6.174 -7.045 -27.479 328 HD22 ASN 39 2HD2 ASN 39 5.029 -7.514 -26.273 329 H LYS 40 H LYS 40 9.977 -7.077 -29.494 330 HA LYS 40 HA LYS 40 12.232 -8.646 -29.133 331 HB2 LYS 40 2HB LYS 40 12.100 -6.039 -30.658 332 HB3 LYS 40 3HB LYS 40 13.267 -7.332 -30.900 333 HG2 LYS 40 2HG LYS 40 10.300 -7.606 -31.331 334 HG3 LYS 40 3HG LYS 40 11.479 -7.279 -32.603 335 HD2 LYS 40 2HD LYS 40 12.237 -9.407 -32.625 336 HD3 LYS 40 3HD LYS 40 12.075 -9.593 -30.877 337 HE2 LYS 40 2HE LYS 40 10.476 -11.054 -31.721 338 HE3 LYS 40 3HE LYS 40 9.540 -9.611 -31.335 339 HZ1 LYS 40 1HZ LYS 40 9.047 -9.269 -33.473 340 HZ2 LYS 40 2HZ LYS 40 9.492 -10.885 -33.703 341 HZ3 LYS 40 3HZ LYS 40 10.604 -9.649 -34.015 342 H ASP 41 H ASP 41 11.668 -5.287 -28.196 343 HA ASP 41 HA ASP 41 14.194 -5.367 -26.677 344 HB2 ASP 41 2HB ASP 41 12.832 -3.056 -28.060 345 HB3 ASP 41 3HB ASP 41 14.101 -2.831 -26.859 346 H ASP 42 H ASP 42 11.138 -5.884 -26.163 347 HA ASP 42 HA ASP 42 11.110 -4.445 -23.596 348 HB2 ASP 42 2HB ASP 42 9.453 -3.692 -25.534 349 HB3 ASP 42 3HB ASP 42 8.516 -5.057 -24.934 350 HA PRO 43 HA PRO 43 10.773 -8.973 -22.830 351 HB2 PRO 43 2HB PRO 43 12.285 -8.919 -20.577 352 HB3 PRO 43 3HB PRO 43 12.980 -9.043 -22.197 353 HG2 PRO 43 2HG PRO 43 12.688 -6.636 -20.440 354 HG3 PRO 43 3HG PRO 43 14.070 -7.135 -21.434 355 HD2 PRO 43 2HD PRO 43 12.320 -5.226 -22.226 356 HD3 PRO 43 3HD PRO 43 13.135 -6.309 -23.372 357 H LYS 44 H LYS 44 9.787 -6.133 -21.285 358 HA LYS 44 HA LYS 44 8.529 -7.507 -19.040 359 HB2 LYS 44 2HB LYS 44 9.170 -4.701 -19.720 360 HB3 LYS 44 3HB LYS 44 7.682 -4.946 -18.815 361 HG2 LYS 44 2HG LYS 44 8.826 -5.929 -17.004 362 HG3 LYS 44 3HG LYS 44 10.310 -6.107 -17.943 363 HD2 LYS 44 2HD LYS 44 10.183 -3.516 -18.134 364 HD3 LYS 44 3HD LYS 44 9.110 -3.644 -16.739 365 HE2 LYS 44 2HE LYS 44 11.207 -3.338 -15.779 366 HE3 LYS 44 3HE LYS 44 10.979 -5.085 -15.708 367 HZ1 LYS 44 1HZ LYS 44 12.383 -3.832 -17.982 368 HZ2 LYS 44 2HZ LYS 44 12.472 -5.429 -17.430 369 HZ3 LYS 44 3HZ LYS 44 13.205 -4.186 -16.546 370 H ALA 45 H ALA 45 7.787 -6.391 -22.189 371 HA ALA 45 HA ALA 45 5.001 -5.943 -21.857 372 HB1 ALA 45 1HB ALA 45 6.084 -4.979 -23.746 373 HB2 ALA 45 2HB ALA 45 6.658 -6.554 -24.295 374 HB3 ALA 45 3HB ALA 45 4.937 -6.176 -24.349 375 H LYS 46 H LYS 46 6.942 -8.763 -22.700 376 HA LYS 46 HA LYS 46 4.918 -10.489 -23.524 377 HB2 LYS 46 2HB LYS 46 6.448 -12.263 -23.164 378 HB3 LYS 46 3HB LYS 46 7.422 -10.873 -23.622 379 HG2 LYS 46 2HG LYS 46 7.887 -10.475 -21.217 380 HG3 LYS 46 3HG LYS 46 7.026 -11.971 -20.847 381 HD2 LYS 46 2HD LYS 46 9.309 -12.554 -20.911 382 HD3 LYS 46 3HD LYS 46 8.636 -13.118 -22.442 383 HE2 LYS 46 2HE LYS 46 9.398 -10.785 -23.316 384 HE3 LYS 46 3HE LYS 46 10.449 -10.802 -21.901 385 HZ1 LYS 46 1HZ LYS 46 10.402 -13.104 -23.739 386 HZ2 LYS 46 2HZ LYS 46 11.633 -12.600 -22.695 387 HZ3 LYS 46 3HZ LYS 46 11.323 -11.736 -24.116 388 H GLU 47 H GLU 47 5.908 -9.512 -20.313 389 HA GLU 47 HA GLU 47 4.487 -11.528 -18.899 390 HB2 GLU 47 2HB GLU 47 6.279 -10.384 -17.787 391 HB3 GLU 47 3HB GLU 47 5.526 -8.820 -18.064 392 HG2 GLU 47 2HG GLU 47 5.229 -9.449 -15.772 393 HG3 GLU 47 3HG GLU 47 3.668 -9.485 -16.589 394 H LYS 48 H LYS 48 3.705 -8.249 -19.943 395 HA LYS 48 HA LYS 48 1.190 -8.130 -18.611 396 HB2 LYS 48 2HB LYS 48 1.944 -6.537 -21.054 397 HB3 LYS 48 3HB LYS 48 0.845 -6.085 -19.758 398 HG2 LYS 48 2HG LYS 48 3.839 -6.340 -19.565 399 HG3 LYS 48 3HG LYS 48 2.901 -4.844 -19.566 400 HD2 LYS 48 2HD LYS 48 1.849 -5.474 -17.470 401 HD3 LYS 48 3HD LYS 48 2.703 -7.019 -17.482 402 HE2 LYS 48 2HE LYS 48 4.821 -5.471 -17.649 403 HE3 LYS 48 3HE LYS 48 3.735 -4.274 -16.945 404 HZ1 LYS 48 1HZ LYS 48 5.161 -5.848 -15.444 405 HZ2 LYS 48 2HZ LYS 48 3.883 -6.924 -15.703 406 HZ3 LYS 48 3HZ LYS 48 3.588 -5.417 -14.994 407 H PHE 49 H PHE 49 2.232 -9.082 -21.839 408 HA PHE 49 HA PHE 49 -0.337 -9.303 -22.989 409 HB2 PHE 49 2HB PHE 49 1.550 -9.214 -24.450 410 HB3 PHE 49 3HB PHE 49 2.303 -10.600 -23.668 411 HD1 PHE 49 HD1 PHE 49 -0.199 -9.490 -26.069 412 HD2 PHE 49 HD2 PHE 49 1.506 -12.858 -24.102 413 HE1 PHE 49 HE1 PHE 49 -1.248 -10.982 -27.721 414 HE2 PHE 49 HE2 PHE 49 0.461 -14.354 -25.751 415 HZ PHE 49 HZ PHE 49 -0.917 -13.417 -27.564 416 H SER 50 H SER 50 1.668 -11.545 -21.163 417 HA SER 50 HA SER 50 0.183 -13.883 -21.628 418 HB2 SER 50 2HB SER 50 2.490 -13.693 -20.564 419 HB3 SER 50 3HB SER 50 1.661 -13.265 -19.068 420 HG SER 50 HG SER 50 1.960 -15.702 -20.261 421 H GLN 51 H GLN 51 -0.256 -11.236 -19.382 422 HA GLN 51 HA GLN 51 -2.087 -12.431 -17.630 423 HB2 GLN 51 2HB GLN 51 -1.690 -9.564 -18.473 424 HB3 GLN 51 3HB GLN 51 -2.861 -10.037 -17.249 425 HG2 GLN 51 2HG GLN 51 0.127 -10.328 -17.148 426 HG3 GLN 51 3HG GLN 51 -0.901 -9.323 -16.127 427 HE21 GLN 51 1HE2 GLN 51 1.022 -11.397 -15.399 428 HE22 GLN 51 2HE2 GLN 51 0.140 -12.561 -14.475 429 H LEU 52 H LEU 52 -2.456 -11.202 -20.852 430 HA LEU 52 HA LEU 52 -5.269 -10.855 -20.828 431 HB2 LEU 52 2HB LEU 52 -3.498 -11.504 -23.178 432 HB3 LEU 52 3HB LEU 52 -5.108 -10.791 -23.237 433 HG LEU 52 HG LEU 52 -2.769 -9.420 -21.930 434 HD11 LEU 52 1HD1 LEU 52 -3.751 -8.765 -24.678 435 HD12 LEU 52 2HD1 LEU 52 -2.509 -9.993 -24.435 436 HD13 LEU 52 3HD1 LEU 52 -2.226 -8.336 -23.902 437 HD21 LEU 52 1HD2 LEU 52 -4.691 -7.666 -23.041 438 HD22 LEU 52 2HD2 LEU 52 -4.297 -7.926 -21.341 439 HD23 LEU 52 3HD2 LEU 52 -5.559 -8.889 -22.112 440 H ALA 53 H ALA 53 -3.193 -13.531 -21.908 441 HA ALA 53 HA ALA 53 -5.346 -15.225 -22.663 442 HB1 ALA 53 1HB ALA 53 -2.663 -15.263 -23.082 443 HB2 ALA 53 2HB ALA 53 -2.843 -16.540 -21.880 444 HB3 ALA 53 3HB ALA 53 -3.746 -16.620 -23.392 445 H GLU 54 H GLU 54 -3.579 -14.705 -19.680 446 HA GLU 54 HA GLU 54 -4.433 -17.017 -18.309 447 HB2 GLU 54 2HB GLU 54 -3.366 -14.349 -17.464 448 HB3 GLU 54 3HB GLU 54 -4.003 -15.452 -16.253 449 HG2 GLU 54 2HG GLU 54 -2.404 -17.165 -17.429 450 HG3 GLU 54 3HG GLU 54 -1.580 -15.699 -17.957 451 H ALA 55 H ALA 55 -5.700 -13.691 -18.296 452 HA ALA 55 HA ALA 55 -7.914 -14.314 -16.613 453 HB1 ALA 55 1HB ALA 55 -6.886 -11.964 -18.014 454 HB2 ALA 55 2HB ALA 55 -8.646 -12.021 -17.907 455 HB3 ALA 55 3HB ALA 55 -7.671 -12.096 -16.440 456 H TYR 56 H TYR 56 -7.495 -13.965 -20.110 457 HA TYR 56 HA TYR 56 -10.187 -14.175 -20.850 458 HB2 TYR 56 2HB TYR 56 -8.702 -13.452 -22.527 459 HB3 TYR 56 3HB TYR 56 -7.613 -14.811 -22.274 460 HD1 TYR 56 HD1 TYR 56 -10.870 -13.807 -23.696 461 HD2 TYR 56 HD2 TYR 56 -7.940 -16.879 -23.410 462 HE1 TYR 56 HE1 TYR 56 -11.976 -15.025 -25.525 463 HE2 TYR 56 HE2 TYR 56 -9.037 -18.105 -25.238 464 HH TYR 56 HH TYR 56 -10.643 -17.280 -27.303 465 H GLU 57 H GLU 57 -7.891 -16.572 -19.841 466 HA GLU 57 HA GLU 57 -9.084 -18.871 -20.919 467 HB2 GLU 57 2HB GLU 57 -7.105 -18.261 -18.845 468 HB3 GLU 57 3HB GLU 57 -8.020 -19.729 -18.532 469 HG2 GLU 57 2HG GLU 57 -7.437 -20.289 -21.007 470 HG3 GLU 57 3HG GLU 57 -6.158 -19.100 -20.772 471 H VAL 58 H VAL 58 -9.619 -17.191 -17.846 472 HA VAL 58 HA VAL 58 -11.569 -19.063 -16.911 473 HB VAL 58 HB VAL 58 -11.001 -16.244 -15.983 474 HG11 VAL 58 1HG1 VAL 58 -13.103 -18.061 -15.313 475 HG12 VAL 58 2HG1 VAL 58 -12.053 -17.840 -13.912 476 HG13 VAL 58 3HG1 VAL 58 -12.794 -16.440 -14.690 477 HG21 VAL 58 1HG2 VAL 58 -9.300 -17.030 -14.759 478 HG22 VAL 58 2HG2 VAL 58 -10.193 -18.474 -14.280 479 HG23 VAL 58 3HG2 VAL 58 -9.351 -18.431 -15.829 480 H LEU 59 H LEU 59 -11.710 -15.844 -18.390 481 HA LEU 59 HA LEU 59 -14.558 -15.679 -18.307 482 HB2 LEU 59 2HB LEU 59 -12.332 -14.075 -19.342 483 HB3 LEU 59 3HB LEU 59 -13.820 -13.947 -20.278 484 HG LEU 59 HG LEU 59 -15.022 -13.136 -18.361 485 HD11 LEU 59 1HD1 LEU 59 -12.487 -13.747 -16.865 486 HD12 LEU 59 2HD1 LEU 59 -14.107 -14.378 -16.571 487 HD13 LEU 59 3HD1 LEU 59 -13.746 -12.686 -16.232 488 HD21 LEU 59 1HD2 LEU 59 -13.746 -11.505 -19.669 489 HD22 LEU 59 2HD2 LEU 59 -12.361 -11.734 -18.602 490 HD23 LEU 59 3HD2 LEU 59 -13.854 -11.036 -17.973 491 H SER 60 H SER 60 -12.477 -17.505 -20.167 492 HA SER 60 HA SER 60 -13.841 -17.400 -22.675 493 HB2 SER 60 2HB SER 60 -11.583 -18.110 -22.769 494 HB3 SER 60 3HB SER 60 -11.820 -19.299 -21.489 495 HG SER 60 HG SER 60 -11.835 -20.424 -23.381 496 H ASP 61 H ASP 61 -14.552 -18.826 -19.699 497 HA ASP 61 HA ASP 61 -16.682 -20.410 -20.944 498 HB2 ASP 61 2HB ASP 61 -14.501 -21.686 -20.026 499 HB3 ASP 61 3HB ASP 61 -15.418 -21.578 -18.526 500 H GLU 62 H GLU 62 -18.612 -20.085 -20.035 501 HA GLU 62 HA GLU 62 -19.091 -18.112 -18.155 502 HB2 GLU 62 2HB GLU 62 -21.355 -19.190 -17.903 503 HB3 GLU 62 3HB GLU 62 -20.880 -18.819 -19.554 504 HG2 GLU 62 2HG GLU 62 -20.232 -21.160 -19.883 505 HG3 GLU 62 3HG GLU 62 -20.751 -21.522 -18.237 506 H VAL 63 H VAL 63 -18.749 -21.601 -17.682 507 HA VAL 63 HA VAL 63 -19.431 -21.716 -14.973 508 HB VAL 63 HB VAL 63 -17.370 -23.449 -16.337 509 HG11 VAL 63 1HG1 VAL 63 -19.254 -24.138 -14.092 510 HG12 VAL 63 2HG1 VAL 63 -17.895 -25.087 -14.696 511 HG13 VAL 63 3HG1 VAL 63 -17.603 -23.574 -13.837 512 HG21 VAL 63 1HG2 VAL 63 -18.973 -24.195 -17.680 513 HG22 VAL 63 2HG2 VAL 63 -19.867 -24.745 -16.263 514 HG23 VAL 63 3HG2 VAL 63 -20.156 -23.133 -16.917 515 H LYS 64 H LYS 64 -16.202 -21.463 -16.462 516 HA LYS 64 HA LYS 64 -14.774 -21.232 -14.054 517 HB2 LYS 64 2HB LYS 64 -14.153 -20.373 -16.875 518 HB3 LYS 64 3HB LYS 64 -13.013 -20.143 -15.555 519 HG2 LYS 64 2HG LYS 64 -13.501 -22.728 -15.196 520 HG3 LYS 64 3HG LYS 64 -13.866 -22.628 -16.920 521 HD2 LYS 64 2HD LYS 64 -11.558 -23.198 -16.702 522 HD3 LYS 64 3HD LYS 64 -11.642 -21.517 -17.236 523 HE2 LYS 64 2HE LYS 64 -11.153 -20.717 -15.047 524 HE3 LYS 64 3HE LYS 64 -11.346 -22.325 -14.350 525 HZ1 LYS 64 1HZ LYS 64 -9.060 -22.034 -14.510 526 HZ2 LYS 64 2HZ LYS 64 -9.146 -21.303 -16.033 527 HZ3 LYS 64 3HZ LYS 64 -9.425 -22.964 -15.875 528 H ARG 65 H ARG 65 -16.089 -18.765 -16.237 529 HA ARG 65 HA ARG 65 -15.079 -16.518 -14.900 530 HB2 ARG 65 2HB ARG 65 -16.036 -16.420 -17.158 531 HB3 ARG 65 3HB ARG 65 -17.628 -16.781 -16.504 532 HG2 ARG 65 2HG ARG 65 -17.020 -14.617 -15.039 533 HG3 ARG 65 3HG ARG 65 -16.104 -14.261 -16.505 534 HD2 ARG 65 2HD ARG 65 -17.971 -14.026 -17.781 535 HD3 ARG 65 3HD ARG 65 -18.885 -15.213 -16.852 536 HE ARG 65 HE ARG 65 -18.893 -12.404 -16.478 537 HH11 ARG 65 1HH1 ARG 65 -19.016 -15.415 -14.735 538 HH12 ARG 65 2HH1 ARG 65 -19.892 -14.754 -13.395 539 HH21 ARG 65 1HH2 ARG 65 -20.047 -11.522 -14.720 540 HH22 ARG 65 2HH2 ARG 65 -20.479 -12.539 -13.388 541 H LYS 66 H LYS 66 -18.163 -18.235 -14.538 542 HA LYS 66 HA LYS 66 -19.256 -16.525 -12.582 543 HB2 LYS 66 2HB LYS 66 -19.786 -19.409 -13.286 544 HB3 LYS 66 3HB LYS 66 -20.689 -18.563 -12.036 545 HG2 LYS 66 2HG LYS 66 -20.500 -17.588 -14.874 546 HG3 LYS 66 3HG LYS 66 -21.777 -18.660 -14.295 547 HD2 LYS 66 2HD LYS 66 -22.709 -17.032 -12.942 548 HD3 LYS 66 3HD LYS 66 -21.207 -16.110 -12.842 549 HE2 LYS 66 2HE LYS 66 -22.557 -14.821 -14.237 550 HE3 LYS 66 3HE LYS 66 -21.527 -15.708 -15.359 551 HZ1 LYS 66 1HZ LYS 66 -23.341 -16.496 -16.317 552 HZ2 LYS 66 2HZ LYS 66 -24.329 -15.692 -15.204 553 HZ3 LYS 66 3HZ LYS 66 -23.790 -17.262 -14.877 554 H GLN 67 H GLN 67 -17.344 -19.496 -12.330 555 HA GLN 67 HA GLN 67 -17.473 -19.820 -9.558 556 HB2 GLN 67 2HB GLN 67 -15.468 -20.635 -11.637 557 HB3 GLN 67 3HB GLN 67 -15.160 -20.945 -9.933 558 HG2 GLN 67 2HG GLN 67 -17.468 -21.966 -11.570 559 HG3 GLN 67 3HG GLN 67 -16.112 -22.900 -10.941 560 HE21 GLN 67 1HE2 GLN 67 -19.170 -21.499 -10.268 561 HE22 GLN 67 2HE2 GLN 67 -19.338 -22.095 -8.655 562 H TYR 68 H TYR 68 -15.258 -17.922 -11.554 563 HA TYR 68 HA TYR 68 -13.561 -17.125 -9.423 564 HB2 TYR 68 2HB TYR 68 -12.759 -17.025 -11.700 565 HB3 TYR 68 3HB TYR 68 -14.045 -15.910 -12.149 566 HD1 TYR 68 HD1 TYR 68 -11.188 -16.181 -9.756 567 HD2 TYR 68 HD2 TYR 68 -13.577 -13.645 -12.199 568 HE1 TYR 68 HE1 TYR 68 -9.724 -14.282 -9.207 569 HE2 TYR 68 HE2 TYR 68 -12.118 -11.740 -11.658 570 HH TYR 68 HH TYR 68 -10.176 -11.555 -9.189 571 H ASP 69 H ASP 69 -16.493 -15.808 -10.827 572 HA ASP 69 HA ASP 69 -16.388 -13.277 -9.561 573 HB2 ASP 69 2HB ASP 69 -17.834 -13.906 -11.536 574 HB3 ASP 69 3HB ASP 69 -18.885 -14.753 -10.403 575 H ALA 70 H ALA 70 -17.533 -16.423 -8.561 576 HA ALA 70 HA ALA 70 -19.101 -15.645 -6.363 577 HB1 ALA 70 1HB ALA 70 -17.835 -18.136 -7.297 578 HB2 ALA 70 2HB ALA 70 -18.195 -18.053 -5.572 579 HB3 ALA 70 3HB ALA 70 -19.485 -17.832 -6.753 580 H TYR 71 H TYR 71 -15.643 -16.271 -6.680 581 HA TYR 71 HA TYR 71 -15.265 -15.548 -3.859 582 HB2 TYR 71 2HB TYR 71 -13.417 -16.902 -5.831 583 HB3 TYR 71 3HB TYR 71 -12.946 -16.438 -4.199 584 HD1 TYR 71 HD1 TYR 71 -14.634 -17.333 -2.321 585 HD2 TYR 71 HD2 TYR 71 -14.085 -19.082 -6.160 586 HE1 TYR 71 HE1 TYR 71 -15.489 -19.473 -1.462 587 HE2 TYR 71 HE2 TYR 71 -14.939 -21.227 -5.312 588 HH TYR 71 HH TYR 71 -15.656 -21.699 -1.902 589 H GLY 72 H GLY 72 -15.833 -13.655 -6.076 590 HA2 GLY 72 2HA GLY 72 -13.312 -12.124 -6.075 591 HA3 GLY 72 3HA GLY 72 -14.591 -11.950 -7.268 592 H SER 73 H SER 73 -13.772 -9.666 -6.290 593 HA SER 73 HA SER 73 -15.936 -8.865 -4.476 594 HB2 SER 73 2HB SER 73 -13.185 -7.670 -4.208 595 HB3 SER 73 3HB SER 73 -14.526 -7.615 -3.065 596 HG SER 73 HG SER 73 -12.787 -9.126 -2.554 Start of MODEL 12 1 H1 HIS 1 H HIS 1 4.159 -0.262 -2.308 2 HA HIS 1 HA HIS 1 1.609 0.449 -1.129 3 HB2 HIS 1 2HB HIS 1 0.615 1.013 -3.360 4 HB3 HIS 1 3HB HIS 1 1.770 2.202 -2.766 5 HD1 HIS 1 HD1 HIS 1 1.469 -0.569 -5.312 6 HD2 HIS 1 HD2 HIS 1 3.931 2.652 -4.404 7 HE1 HIS 1 HE1 HIS 1 3.033 -0.346 -7.268 8 H MET 2 H MET 2 -0.185 -0.712 -2.604 9 HA MET 2 HA MET 2 0.841 -3.373 -3.324 10 HB2 MET 2 2HB MET 2 -1.499 -2.702 -1.548 11 HB3 MET 2 3HB MET 2 -1.329 -4.272 -2.322 12 HG2 MET 2 2HG MET 2 0.912 -3.182 -0.685 13 HG3 MET 2 3HG MET 2 -0.486 -3.904 0.108 14 HE1 MET 2 1HE MET 2 -0.596 -7.385 -0.542 15 HE2 MET 2 2HE MET 2 0.329 -6.830 0.853 16 HE3 MET 2 3HE MET 2 -1.091 -5.928 0.322 17 H LEU 3 H LEU 3 -0.297 -4.475 -4.939 18 HA LEU 3 HA LEU 3 -1.641 -2.770 -6.821 19 HB2 LEU 3 2HB LEU 3 -0.038 -4.824 -7.190 20 HB3 LEU 3 3HB LEU 3 -1.547 -5.732 -7.127 21 HG LEU 3 HG LEU 3 -0.894 -5.274 -9.424 22 HD11 LEU 3 1HD1 LEU 3 -2.972 -4.358 -10.209 23 HD12 LEU 3 2HD1 LEU 3 -3.278 -3.604 -8.645 24 HD13 LEU 3 3HD1 LEU 3 -3.288 -5.361 -8.794 25 HD21 LEU 3 1HD2 LEU 3 -0.383 -3.218 -10.272 26 HD22 LEU 3 2HD2 LEU 3 0.195 -3.006 -8.619 27 HD23 LEU 3 3HD2 LEU 3 -1.377 -2.360 -9.094 28 H ALA 4 H ALA 4 -3.731 -2.316 -6.749 29 HA ALA 4 HA ALA 4 -5.585 -3.538 -5.045 30 HB1 ALA 4 1HB ALA 4 -5.555 -1.350 -6.815 31 HB2 ALA 4 2HB ALA 4 -6.930 -2.355 -7.274 32 HB3 ALA 4 3HB ALA 4 -6.784 -1.763 -5.619 33 H LYS 5 H LYS 5 -6.859 -5.276 -5.221 34 HA LYS 5 HA LYS 5 -6.435 -7.275 -7.090 35 HB2 LYS 5 2HB LYS 5 -8.568 -8.252 -6.277 36 HB3 LYS 5 3HB LYS 5 -7.500 -7.746 -4.974 37 HG2 LYS 5 2HG LYS 5 -8.930 -5.525 -5.165 38 HG3 LYS 5 3HG LYS 5 -10.122 -6.652 -5.818 39 HD2 LYS 5 2HD LYS 5 -9.952 -8.021 -3.814 40 HD3 LYS 5 3HD LYS 5 -8.705 -6.952 -3.169 41 HE2 LYS 5 2HE LYS 5 -10.268 -5.131 -3.026 42 HE3 LYS 5 3HE LYS 5 -11.508 -6.075 -3.849 43 HZ1 LYS 5 1HZ LYS 5 -11.299 -5.865 -1.194 44 HZ2 LYS 5 2HZ LYS 5 -10.425 -7.289 -1.455 45 HZ3 LYS 5 3HZ LYS 5 -12.029 -7.174 -1.981 46 H GLU 6 H GLU 6 -6.849 -7.348 -9.189 47 HA GLU 6 HA GLU 6 -9.126 -5.796 -10.230 48 HB2 GLU 6 2HB GLU 6 -7.866 -5.962 -12.435 49 HB3 GLU 6 3HB GLU 6 -7.161 -4.924 -11.203 50 HG2 GLU 6 2HG GLU 6 -5.627 -6.762 -10.591 51 HG3 GLU 6 3HG GLU 6 -6.287 -7.712 -11.922 52 H ASP 7 H ASP 7 -10.673 -6.790 -11.406 53 HA ASP 7 HA ASP 7 -10.693 -9.682 -11.410 54 HB2 ASP 7 2HB ASP 7 -12.763 -7.727 -12.435 55 HB3 ASP 7 3HB ASP 7 -12.999 -9.457 -12.206 56 H TYR 8 H TYR 8 -11.259 -10.922 -13.340 57 HA TYR 8 HA TYR 8 -9.492 -10.485 -15.453 58 HB2 TYR 8 2HB TYR 8 -12.025 -12.120 -15.626 59 HB3 TYR 8 3HB TYR 8 -10.539 -12.345 -16.543 60 HD1 TYR 8 HD1 TYR 8 -12.274 -14.129 -14.461 61 HD2 TYR 8 HD2 TYR 8 -8.516 -12.135 -14.389 62 HE1 TYR 8 HE1 TYR 8 -11.471 -15.715 -12.761 63 HE2 TYR 8 HE2 TYR 8 -7.702 -13.716 -12.690 64 HH TYR 8 HH TYR 8 -8.803 -16.509 -12.101 65 H TYR 9 H TYR 9 -12.732 -9.354 -14.936 66 HA TYR 9 HA TYR 9 -13.558 -8.783 -17.522 67 HB2 TYR 9 2HB TYR 9 -14.070 -7.117 -15.050 68 HB3 TYR 9 3HB TYR 9 -15.022 -7.097 -16.530 69 HD1 TYR 9 HD1 TYR 9 -14.617 -8.586 -13.318 70 HD2 TYR 9 HD2 TYR 9 -16.174 -9.293 -17.214 71 HE1 TYR 9 HE1 TYR 9 -16.044 -10.374 -12.417 72 HE2 TYR 9 HE2 TYR 9 -17.606 -11.083 -16.323 73 HH TYR 9 HH TYR 9 -17.205 -12.373 -13.198 74 H GLN 10 H GLN 10 -11.660 -6.760 -15.301 75 HA GLN 10 HA GLN 10 -11.337 -4.650 -17.210 76 HB2 GLN 10 2HB GLN 10 -9.819 -5.189 -14.651 77 HB3 GLN 10 3HB GLN 10 -9.789 -3.688 -15.568 78 HG2 GLN 10 2HG GLN 10 -12.335 -4.814 -14.459 79 HG3 GLN 10 3HG GLN 10 -11.270 -3.786 -13.502 80 HE21 GLN 10 1HE2 GLN 10 -13.755 -3.887 -15.780 81 HE22 GLN 10 2HE2 GLN 10 -13.809 -2.204 -16.165 82 H ILE 11 H ILE 11 -9.521 -7.486 -16.275 83 HA ILE 11 HA ILE 11 -7.059 -6.792 -17.474 84 HB ILE 11 HB ILE 11 -8.217 -9.540 -16.995 85 HG12 ILE 11 2HG1 ILE 11 -6.251 -7.983 -15.308 86 HG13 ILE 11 3HG1 ILE 11 -7.979 -8.047 -14.981 87 HG21 ILE 11 1HG2 ILE 11 -5.519 -9.807 -16.839 88 HG22 ILE 11 2HG2 ILE 11 -6.481 -10.167 -18.271 89 HG23 ILE 11 3HG2 ILE 11 -5.677 -8.606 -18.121 90 HD11 ILE 11 1HD1 ILE 11 -7.671 -9.897 -13.820 91 HD12 ILE 11 2HD1 ILE 11 -7.067 -10.705 -15.267 92 HD13 ILE 11 3HD1 ILE 11 -5.949 -9.861 -14.196 93 H LEU 12 H LEU 12 -10.058 -7.891 -18.771 94 HA LEU 12 HA LEU 12 -8.787 -8.370 -21.383 95 HB2 LEU 12 2HB LEU 12 -11.170 -9.518 -20.034 96 HB3 LEU 12 3HB LEU 12 -11.226 -9.339 -21.787 97 HG LEU 12 HG LEU 12 -9.170 -10.922 -20.244 98 HD11 LEU 12 1HD1 LEU 12 -10.658 -12.564 -20.242 99 HD12 LEU 12 2HD1 LEU 12 -10.648 -12.535 -22.005 100 HD13 LEU 12 3HD1 LEU 12 -11.821 -11.565 -21.114 101 HD21 LEU 12 1HD2 LEU 12 -8.156 -10.088 -22.226 102 HD22 LEU 12 2HD2 LEU 12 -9.586 -10.454 -23.190 103 HD23 LEU 12 3HD2 LEU 12 -8.601 -11.766 -22.540 104 H GLY 13 H GLY 13 -10.774 -6.253 -19.620 105 HA2 GLY 13 2HA GLY 13 -11.621 -4.198 -20.269 106 HA3 GLY 13 3HA GLY 13 -11.099 -4.541 -21.911 107 H VAL 14 H VAL 14 -13.249 -6.486 -19.888 108 HA VAL 14 HA VAL 14 -15.435 -5.890 -21.774 109 HB VAL 14 HB VAL 14 -16.220 -8.168 -21.605 110 HG11 VAL 14 1HG1 VAL 14 -13.278 -8.408 -22.140 111 HG12 VAL 14 2HG1 VAL 14 -14.622 -9.209 -22.956 112 HG13 VAL 14 3HG1 VAL 14 -14.336 -7.486 -23.208 113 HG21 VAL 14 1HG2 VAL 14 -15.730 -9.436 -19.851 114 HG22 VAL 14 2HG2 VAL 14 -14.045 -9.501 -20.366 115 HG23 VAL 14 3HG2 VAL 14 -14.586 -8.222 -19.278 116 HA PRO 15 HA PRO 15 -17.930 -4.860 -18.309 117 HB2 PRO 15 2HB PRO 15 -20.384 -5.578 -19.221 118 HB3 PRO 15 3HB PRO 15 -19.514 -4.160 -19.819 119 HG2 PRO 15 2HG PRO 15 -19.753 -6.887 -21.031 120 HG3 PRO 15 3HG PRO 15 -19.853 -5.301 -21.817 121 HD2 PRO 15 2HD PRO 15 -17.617 -6.825 -21.892 122 HD3 PRO 15 3HD PRO 15 -17.563 -5.050 -21.887 123 H ARG 16 H ARG 16 -19.697 -5.796 -16.869 124 HA ARG 16 HA ARG 16 -18.851 -8.403 -16.000 125 HB2 ARG 16 2HB ARG 16 -21.022 -6.570 -14.964 126 HB3 ARG 16 3HB ARG 16 -20.503 -8.056 -14.180 127 HG2 ARG 16 2HG ARG 16 -18.525 -7.156 -13.467 128 HG3 ARG 16 3HG ARG 16 -18.463 -5.978 -14.779 129 HD2 ARG 16 2HD ARG 16 -20.079 -4.598 -13.742 130 HD3 ARG 16 3HD ARG 16 -20.517 -5.856 -12.588 131 HE ARG 16 HE ARG 16 -17.773 -5.041 -12.394 132 HH11 ARG 16 1HH1 ARG 16 -21.035 -4.328 -11.409 133 HH12 ARG 16 2HH1 ARG 16 -20.556 -3.489 -9.970 134 HH21 ARG 16 1HH2 ARG 16 -17.130 -3.939 -10.503 135 HH22 ARG 16 2HH2 ARG 16 -18.335 -3.268 -9.457 136 H ASN 17 H ASN 17 -21.045 -7.340 -18.268 137 HA ASN 17 HA ASN 17 -22.695 -9.764 -17.975 138 HB2 ASN 17 2HB ASN 17 -24.387 -8.510 -19.367 139 HB3 ASN 17 3HB ASN 17 -24.108 -7.846 -17.759 140 HD21 ASN 17 1HD2 ASN 17 -24.955 -5.862 -18.521 141 HD22 ASN 17 2HD2 ASN 17 -23.985 -4.794 -19.472 142 H ALA 18 H ALA 18 -20.109 -8.762 -19.569 143 HA ALA 18 HA ALA 18 -20.565 -9.018 -22.286 144 HB1 ALA 18 1HB ALA 18 -18.312 -8.938 -20.573 145 HB2 ALA 18 2HB ALA 18 -18.092 -10.288 -21.686 146 HB3 ALA 18 3HB ALA 18 -18.376 -8.665 -22.315 147 H SER 19 H SER 19 -20.077 -10.817 -23.735 148 HA SER 19 HA SER 19 -21.019 -13.364 -22.602 149 HB2 SER 19 2HB SER 19 -21.052 -12.549 -25.513 150 HB3 SER 19 3HB SER 19 -21.889 -13.912 -24.770 151 HG SER 19 HG SER 19 -23.074 -12.309 -23.537 152 H GLN 20 H GLN 20 -20.111 -15.344 -23.456 153 HA GLN 20 HA GLN 20 -17.341 -15.446 -23.361 154 HB2 GLN 20 2HB GLN 20 -19.074 -17.454 -24.801 155 HB3 GLN 20 3HB GLN 20 -17.518 -17.739 -24.034 156 HG2 GLN 20 2HG GLN 20 -20.133 -17.128 -22.685 157 HG3 GLN 20 3HG GLN 20 -19.225 -18.638 -22.637 158 HE21 GLN 20 1HE2 GLN 20 -17.001 -18.458 -21.718 159 HE22 GLN 20 2HE2 GLN 20 -16.790 -17.428 -20.347 160 H LYS 21 H LYS 21 -19.451 -14.812 -26.040 161 HA LYS 21 HA LYS 21 -17.480 -15.302 -28.073 162 HB2 LYS 21 2HB LYS 21 -19.134 -14.287 -29.596 163 HB3 LYS 21 3HB LYS 21 -19.840 -15.552 -28.598 164 HG2 LYS 21 2HG LYS 21 -20.743 -13.810 -27.096 165 HG3 LYS 21 3HG LYS 21 -20.111 -12.580 -28.194 166 HD2 LYS 21 2HD LYS 21 -21.468 -13.887 -29.995 167 HD3 LYS 21 3HD LYS 21 -22.348 -14.524 -28.604 168 HE2 LYS 21 2HE LYS 21 -21.907 -11.580 -28.865 169 HE3 LYS 21 3HE LYS 21 -23.177 -12.360 -29.807 170 HZ1 LYS 21 1HZ LYS 21 -23.408 -11.477 -27.247 171 HZ2 LYS 21 2HZ LYS 21 -23.199 -13.144 -27.052 172 HZ3 LYS 21 3HZ LYS 21 -24.459 -12.557 -28.016 173 H GLU 22 H GLU 22 -18.783 -12.464 -26.416 174 HA GLU 22 HA GLU 22 -17.337 -10.561 -27.957 175 HB2 GLU 22 2HB GLU 22 -19.356 -9.945 -26.727 176 HB3 GLU 22 3HB GLU 22 -18.562 -10.322 -25.204 177 HG2 GLU 22 2HG GLU 22 -17.079 -8.492 -25.417 178 HG3 GLU 22 3HG GLU 22 -17.548 -8.221 -27.095 179 H ILE 23 H ILE 23 -16.698 -12.296 -24.967 180 HA ILE 23 HA ILE 23 -14.440 -10.829 -24.141 181 HB ILE 23 HB ILE 23 -15.146 -13.719 -23.624 182 HG12 ILE 23 2HG1 ILE 23 -15.436 -11.353 -21.774 183 HG13 ILE 23 3HG1 ILE 23 -16.730 -11.881 -22.843 184 HG21 ILE 23 1HG2 ILE 23 -13.089 -13.910 -22.793 185 HG22 ILE 23 2HG2 ILE 23 -12.781 -12.184 -22.973 186 HG23 ILE 23 3HG2 ILE 23 -13.589 -12.789 -21.527 187 HD11 ILE 23 1HD1 ILE 23 -15.905 -12.928 -20.290 188 HD12 ILE 23 2HD1 ILE 23 -17.379 -13.226 -21.211 189 HD13 ILE 23 3HD1 ILE 23 -15.934 -14.187 -21.525 190 H LYS 24 H LYS 24 -14.848 -13.457 -26.418 191 HA LYS 24 HA LYS 24 -12.149 -14.212 -26.675 192 HB2 LYS 24 2HB LYS 24 -14.618 -14.540 -28.300 193 HB3 LYS 24 3HB LYS 24 -13.080 -14.800 -29.113 194 HG2 LYS 24 2HG LYS 24 -12.485 -16.453 -27.373 195 HG3 LYS 24 3HG LYS 24 -14.090 -16.240 -26.669 196 HD2 LYS 24 2HD LYS 24 -13.548 -17.148 -29.496 197 HD3 LYS 24 3HD LYS 24 -13.934 -18.219 -28.147 198 HE2 LYS 24 2HE LYS 24 -16.073 -16.994 -27.858 199 HE3 LYS 24 3HE LYS 24 -15.689 -16.053 -29.299 200 HZ1 LYS 24 1HZ LYS 24 -17.162 -18.174 -29.464 201 HZ2 LYS 24 2HZ LYS 24 -15.677 -18.984 -29.468 202 HZ3 LYS 24 3HZ LYS 24 -16.020 -17.840 -30.666 203 H LYS 25 H LYS 25 -14.080 -11.747 -28.307 204 HA LYS 25 HA LYS 25 -12.078 -11.009 -30.185 205 HB2 LYS 25 2HB LYS 25 -14.529 -9.573 -29.164 206 HB3 LYS 25 3HB LYS 25 -13.489 -8.923 -30.424 207 HG2 LYS 25 2HG LYS 25 -14.157 -10.477 -31.972 208 HG3 LYS 25 3HG LYS 25 -14.603 -11.666 -30.746 209 HD2 LYS 25 2HD LYS 25 -16.558 -10.356 -30.150 210 HD3 LYS 25 3HD LYS 25 -16.092 -9.099 -31.299 211 HE2 LYS 25 2HE LYS 25 -16.325 -10.711 -33.135 212 HE3 LYS 25 3HE LYS 25 -16.811 -11.950 -31.979 213 HZ1 LYS 25 1HZ LYS 25 -18.308 -9.648 -32.976 214 HZ2 LYS 25 2HZ LYS 25 -18.577 -10.111 -31.372 215 HZ3 LYS 25 3HZ LYS 25 -18.842 -11.215 -32.626 216 H ALA 26 H ALA 26 -13.117 -9.629 -27.081 217 HA ALA 26 HA ALA 26 -11.352 -7.454 -27.041 218 HB1 ALA 26 1HB ALA 26 -13.314 -7.801 -25.527 219 HB2 ALA 26 2HB ALA 26 -12.335 -8.957 -24.623 220 HB3 ALA 26 3HB ALA 26 -11.842 -7.267 -24.715 221 H TYR 27 H TYR 27 -10.889 -10.826 -26.249 222 HA TYR 27 HA TYR 27 -8.415 -10.487 -24.869 223 HB2 TYR 27 2HB TYR 27 -9.672 -12.474 -24.429 224 HB3 TYR 27 3HB TYR 27 -9.733 -12.889 -26.138 225 HD1 TYR 27 HD1 TYR 27 -7.006 -12.010 -23.727 226 HD2 TYR 27 HD2 TYR 27 -8.471 -14.746 -26.638 227 HE1 TYR 27 HE1 TYR 27 -4.975 -13.371 -23.462 228 HE2 TYR 27 HE2 TYR 27 -6.445 -16.115 -26.379 229 HH TYR 27 HH TYR 27 -4.120 -15.838 -25.625 230 H TYR 28 H TYR 28 -9.340 -11.039 -28.208 231 HA TYR 28 HA TYR 28 -6.686 -11.580 -29.132 232 HB2 TYR 28 2HB TYR 28 -8.588 -12.436 -30.371 233 HB3 TYR 28 3HB TYR 28 -9.200 -10.805 -30.624 234 HD1 TYR 28 HD1 TYR 28 -8.933 -10.024 -32.768 235 HD2 TYR 28 HD2 TYR 28 -5.942 -12.578 -31.144 236 HE1 TYR 28 HE1 TYR 28 -7.668 -9.872 -34.872 237 HE2 TYR 28 HE2 TYR 28 -4.669 -12.432 -33.243 238 HH TYR 28 HH TYR 28 -4.630 -11.654 -35.323 239 H GLN 29 H GLN 29 -8.840 -8.756 -29.277 240 HA GLN 29 HA GLN 29 -7.113 -7.053 -30.670 241 HB2 GLN 29 2HB GLN 29 -8.542 -5.283 -30.031 242 HB3 GLN 29 3HB GLN 29 -9.576 -6.700 -30.157 243 HG2 GLN 29 2HG GLN 29 -9.562 -6.962 -27.752 244 HG3 GLN 29 3HG GLN 29 -8.450 -5.604 -27.590 245 HE21 GLN 29 1HE2 GLN 29 -10.152 -4.808 -26.154 246 HE22 GLN 29 2HE2 GLN 29 -11.471 -3.927 -26.840 247 H LEU 30 H LEU 30 -7.321 -7.856 -27.262 248 HA LEU 30 HA LEU 30 -5.559 -5.797 -26.371 249 HB2 LEU 30 2HB LEU 30 -7.081 -7.949 -25.213 250 HB3 LEU 30 3HB LEU 30 -5.454 -7.907 -24.536 251 HG LEU 30 HG LEU 30 -5.775 -5.661 -23.753 252 HD11 LEU 30 1HD1 LEU 30 -7.046 -4.349 -25.040 253 HD12 LEU 30 2HD1 LEU 30 -8.397 -4.979 -24.097 254 HD13 LEU 30 3HD1 LEU 30 -7.994 -5.705 -25.653 255 HD21 LEU 30 1HD2 LEU 30 -8.007 -7.569 -23.125 256 HD22 LEU 30 2HD2 LEU 30 -7.837 -6.020 -22.299 257 HD23 LEU 30 3HD2 LEU 30 -6.554 -7.225 -22.187 258 H ALA 31 H ALA 31 -5.164 -9.208 -27.214 259 HA ALA 31 HA ALA 31 -2.515 -9.551 -26.417 260 HB1 ALA 31 1HB ALA 31 -4.360 -10.906 -28.266 261 HB2 ALA 31 2HB ALA 31 -2.643 -11.169 -28.574 262 HB3 ALA 31 3HB ALA 31 -3.328 -11.568 -26.999 263 H LYS 32 H LYS 32 -3.852 -8.242 -29.412 264 HA LYS 32 HA LYS 32 -1.453 -8.076 -30.864 265 HB2 LYS 32 2HB LYS 32 -4.030 -6.522 -31.011 266 HB3 LYS 32 3HB LYS 32 -2.694 -6.219 -32.113 267 HG2 LYS 32 2HG LYS 32 -3.033 -8.129 -33.272 268 HG3 LYS 32 3HG LYS 32 -3.573 -9.026 -31.851 269 HD2 LYS 32 2HD LYS 32 -5.460 -8.794 -33.276 270 HD3 LYS 32 3HD LYS 32 -5.693 -7.670 -31.935 271 HE2 LYS 32 2HE LYS 32 -6.220 -6.312 -33.701 272 HE3 LYS 32 3HE LYS 32 -4.491 -5.993 -33.566 273 HZ1 LYS 32 1HZ LYS 32 -4.357 -7.977 -35.237 274 HZ2 LYS 32 2HZ LYS 32 -4.681 -6.411 -35.787 275 HZ3 LYS 32 3HZ LYS 32 -5.945 -7.521 -35.603 276 H LYS 33 H LYS 33 -2.644 -6.233 -28.226 277 HA LYS 33 HA LYS 33 -1.051 -3.890 -28.747 278 HB2 LYS 33 2HB LYS 33 -2.318 -4.649 -26.119 279 HB3 LYS 33 3HB LYS 33 -1.902 -3.040 -26.695 280 HG2 LYS 33 2HG LYS 33 -3.613 -3.557 -28.578 281 HG3 LYS 33 3HG LYS 33 -4.198 -4.788 -27.456 282 HD2 LYS 33 2HD LYS 33 -5.494 -3.051 -26.763 283 HD3 LYS 33 3HD LYS 33 -4.072 -2.732 -25.766 284 HE2 LYS 33 2HE LYS 33 -4.767 -0.677 -26.792 285 HE3 LYS 33 3HE LYS 33 -3.251 -1.190 -27.532 286 HZ1 LYS 33 1HZ LYS 33 -4.259 -1.654 -29.503 287 HZ2 LYS 33 2HZ LYS 33 -5.270 -0.403 -28.979 288 HZ3 LYS 33 3HZ LYS 33 -5.757 -2.014 -28.803 289 H TYR 34 H TYR 34 -0.819 -6.764 -26.719 290 HA TYR 34 HA TYR 34 1.807 -5.878 -25.759 291 HB2 TYR 34 2HB TYR 34 0.096 -8.196 -24.836 292 HB3 TYR 34 3HB TYR 34 1.613 -7.683 -24.107 293 HD1 TYR 34 HD1 TYR 34 1.721 -5.689 -22.729 294 HD2 TYR 34 HD2 TYR 34 -1.942 -6.899 -24.523 295 HE1 TYR 34 HE1 TYR 34 0.496 -4.151 -21.251 296 HE2 TYR 34 HE2 TYR 34 -3.177 -5.364 -23.052 297 HH TYR 34 HH TYR 34 -1.506 -3.124 -20.916 298 H HIS 35 H HIS 35 1.126 -6.984 -28.480 299 HA HIS 35 HA HIS 35 2.162 -9.591 -28.728 300 HB2 HIS 35 2HB HIS 35 1.340 -7.441 -30.508 301 HB3 HIS 35 3HB HIS 35 2.733 -8.317 -31.135 302 HD1 HIS 35 HD1 HIS 35 1.193 -9.258 -33.033 303 HD2 HIS 35 HD2 HIS 35 0.141 -10.430 -29.188 304 HE1 HIS 35 HE1 HIS 35 -0.406 -11.176 -33.329 305 HA PRO 36 HA PRO 36 6.520 -9.151 -28.501 306 HB2 PRO 36 2HB PRO 36 7.382 -10.794 -30.482 307 HB3 PRO 36 3HB PRO 36 6.678 -11.393 -28.975 308 HG2 PRO 36 2HG PRO 36 5.397 -11.049 -31.659 309 HG3 PRO 36 3HG PRO 36 5.253 -12.396 -30.516 310 HD2 PRO 36 2HD PRO 36 3.359 -10.475 -30.749 311 HD3 PRO 36 3HD PRO 36 3.710 -11.289 -29.210 312 H ASP 37 H ASP 37 4.846 -8.187 -31.314 313 HA ASP 37 HA ASP 37 7.060 -7.317 -32.877 314 HB2 ASP 37 2HB ASP 37 5.478 -6.365 -34.334 315 HB3 ASP 37 3HB ASP 37 4.650 -7.762 -33.651 316 H THR 38 H THR 38 5.355 -6.003 -30.184 317 HA THR 38 HA THR 38 6.662 -3.394 -30.577 318 HB THR 38 HB THR 38 5.021 -2.389 -29.193 319 HG1 THR 38 HG1 THR 38 4.661 -4.991 -28.297 320 HG21 THR 38 1HG2 THR 38 4.339 -3.662 -31.539 321 HG22 THR 38 2HG2 THR 38 3.360 -2.460 -30.698 322 HG23 THR 38 3HG2 THR 38 3.074 -4.178 -30.425 323 H ASN 39 H ASN 39 7.225 -6.213 -29.080 324 HA ASN 39 HA ASN 39 7.948 -5.274 -26.457 325 HB2 ASN 39 2HB ASN 39 8.074 -7.866 -27.918 326 HB3 ASN 39 3HB ASN 39 9.173 -7.643 -26.560 327 HD21 ASN 39 1HD2 ASN 39 5.867 -6.489 -27.050 328 HD22 ASN 39 2HD2 ASN 39 5.198 -7.286 -25.670 329 H LYS 40 H LYS 40 9.314 -4.912 -29.447 330 HA LYS 40 HA LYS 40 12.011 -5.422 -29.176 331 HB2 LYS 40 2HB LYS 40 10.407 -3.453 -30.722 332 HB3 LYS 40 3HB LYS 40 12.138 -3.165 -30.609 333 HG2 LYS 40 2HG LYS 40 11.757 -4.384 -32.602 334 HG3 LYS 40 3HG LYS 40 12.492 -5.498 -31.446 335 HD2 LYS 40 2HD LYS 40 9.550 -5.409 -31.414 336 HD3 LYS 40 3HD LYS 40 10.269 -6.045 -32.895 337 HE2 LYS 40 2HE LYS 40 11.733 -7.278 -30.924 338 HE3 LYS 40 3HE LYS 40 10.116 -7.216 -30.226 339 HZ1 LYS 40 1HZ LYS 40 10.445 -9.242 -31.487 340 HZ2 LYS 40 2HZ LYS 40 10.816 -8.354 -32.878 341 HZ3 LYS 40 3HZ LYS 40 9.259 -8.285 -32.221 342 H ASP 41 H ASP 41 10.167 -2.644 -28.013 343 HA ASP 41 HA ASP 41 12.551 -1.789 -26.505 344 HB2 ASP 41 2HB ASP 41 11.315 0.488 -26.492 345 HB3 ASP 41 3HB ASP 41 12.143 -0.010 -27.964 346 H ASP 42 H ASP 42 10.214 -3.649 -25.895 347 HA ASP 42 HA ASP 42 9.726 -2.593 -23.227 348 HB2 ASP 42 2HB ASP 42 7.817 -2.053 -25.013 349 HB3 ASP 42 3HB ASP 42 7.327 -3.695 -24.605 350 HA PRO 43 HA PRO 43 10.696 -7.101 -23.282 351 HB2 PRO 43 2HB PRO 43 12.318 -6.996 -21.108 352 HB3 PRO 43 3HB PRO 43 12.886 -6.659 -22.747 353 HG2 PRO 43 2HG PRO 43 12.108 -4.745 -20.581 354 HG3 PRO 43 3HG PRO 43 13.487 -4.675 -21.694 355 HD2 PRO 43 2HD PRO 43 11.234 -3.222 -22.073 356 HD3 PRO 43 3HD PRO 43 12.211 -3.837 -23.421 357 H LYS 44 H LYS 44 9.119 -4.933 -21.222 358 HA LYS 44 HA LYS 44 8.438 -6.971 -19.241 359 HB2 LYS 44 2HB LYS 44 8.299 -4.011 -19.363 360 HB3 LYS 44 3HB LYS 44 7.040 -4.816 -18.436 361 HG2 LYS 44 2HG LYS 44 8.575 -5.725 -16.923 362 HG3 LYS 44 3HG LYS 44 9.944 -5.415 -17.993 363 HD2 LYS 44 2HD LYS 44 9.570 -2.984 -17.693 364 HD3 LYS 44 3HD LYS 44 8.286 -3.354 -16.539 365 HE2 LYS 44 2HE LYS 44 11.022 -4.498 -16.154 366 HE3 LYS 44 3HE LYS 44 10.694 -2.829 -15.689 367 HZ1 LYS 44 1HZ LYS 44 8.692 -3.886 -14.464 368 HZ2 LYS 44 2HZ LYS 44 10.231 -3.970 -13.767 369 HZ3 LYS 44 3HZ LYS 44 9.592 -5.315 -14.569 370 H ALA 45 H ALA 45 7.194 -5.499 -22.068 371 HA ALA 45 HA ALA 45 4.444 -5.622 -21.671 372 HB1 ALA 45 1HB ALA 45 6.210 -5.732 -24.061 373 HB2 ALA 45 2HB ALA 45 4.505 -6.137 -24.256 374 HB3 ALA 45 3HB ALA 45 4.969 -4.558 -23.624 375 H LYS 46 H LYS 46 6.721 -8.151 -22.593 376 HA LYS 46 HA LYS 46 4.922 -10.146 -23.325 377 HB2 LYS 46 2HB LYS 46 6.712 -11.731 -22.819 378 HB3 LYS 46 3HB LYS 46 7.343 -10.326 -23.667 379 HG2 LYS 46 2HG LYS 46 7.972 -9.411 -21.389 380 HG3 LYS 46 3HG LYS 46 7.622 -11.022 -20.760 381 HD2 LYS 46 2HD LYS 46 9.975 -10.878 -21.199 382 HD3 LYS 46 3HD LYS 46 9.252 -11.945 -22.405 383 HE2 LYS 46 2HE LYS 46 9.633 -10.494 -24.113 384 HE3 LYS 46 3HE LYS 46 9.436 -9.071 -23.091 385 HZ1 LYS 46 1HZ LYS 46 11.717 -9.295 -23.812 386 HZ2 LYS 46 2HZ LYS 46 11.812 -10.852 -23.160 387 HZ3 LYS 46 3HZ LYS 46 11.624 -9.518 -22.138 388 H GLU 47 H GLU 47 6.046 -9.142 -20.142 389 HA GLU 47 HA GLU 47 4.945 -11.286 -18.677 390 HB2 GLU 47 2HB GLU 47 6.608 -9.893 -17.651 391 HB3 GLU 47 3HB GLU 47 5.624 -8.455 -17.882 392 HG2 GLU 47 2HG GLU 47 3.987 -9.301 -16.294 393 HG3 GLU 47 3HG GLU 47 4.941 -10.767 -16.080 394 H LYS 48 H LYS 48 3.647 -8.155 -19.661 395 HA LYS 48 HA LYS 48 1.212 -8.397 -18.204 396 HB2 LYS 48 2HB LYS 48 1.672 -6.710 -20.664 397 HB3 LYS 48 3HB LYS 48 0.497 -6.442 -19.383 398 HG2 LYS 48 2HG LYS 48 3.487 -6.284 -19.059 399 HG3 LYS 48 3HG LYS 48 2.401 -4.906 -19.248 400 HD2 LYS 48 2HD LYS 48 1.265 -5.485 -17.183 401 HD3 LYS 48 3HD LYS 48 2.266 -6.928 -17.011 402 HE2 LYS 48 2HE LYS 48 4.246 -5.573 -16.751 403 HE3 LYS 48 3HE LYS 48 3.325 -4.104 -17.073 404 HZ1 LYS 48 1HZ LYS 48 3.249 -5.840 -14.688 405 HZ2 LYS 48 2HZ LYS 48 1.955 -4.814 -15.052 406 HZ3 LYS 48 3HZ LYS 48 3.494 -4.169 -14.775 407 H PHE 49 H PHE 49 2.239 -9.257 -21.453 408 HA PHE 49 HA PHE 49 -0.261 -9.761 -22.594 409 HB2 PHE 49 2HB PHE 49 1.676 -9.685 -24.002 410 HB3 PHE 49 3HB PHE 49 2.442 -11.000 -23.117 411 HD1 PHE 49 HD1 PHE 49 -0.022 -10.109 -25.645 412 HD2 PHE 49 HD2 PHE 49 1.722 -13.301 -23.436 413 HE1 PHE 49 HE1 PHE 49 -0.983 -11.727 -27.231 414 HE2 PHE 49 HE2 PHE 49 0.765 -14.924 -25.018 415 HZ PHE 49 HZ PHE 49 -0.589 -14.138 -26.919 416 H SER 50 H SER 50 1.709 -11.671 -20.430 417 HA SER 50 HA SER 50 0.399 -14.148 -20.788 418 HB2 SER 50 2HB SER 50 2.591 -13.991 -19.709 419 HB3 SER 50 3HB SER 50 1.885 -13.080 -18.374 420 HG SER 50 HG SER 50 1.170 -14.875 -17.537 421 H GLN 51 H GLN 51 -0.265 -11.357 -18.772 422 HA GLN 51 HA GLN 51 -2.149 -12.523 -17.046 423 HB2 GLN 51 2HB GLN 51 -1.805 -9.687 -18.014 424 HB3 GLN 51 3HB GLN 51 -2.995 -10.146 -16.804 425 HG2 GLN 51 2HG GLN 51 -0.003 -10.298 -16.603 426 HG3 GLN 51 3HG GLN 51 -1.111 -9.314 -15.648 427 HE21 GLN 51 1HE2 GLN 51 0.909 -11.579 -15.131 428 HE22 GLN 51 2HE2 GLN 51 0.053 -12.632 -14.062 429 H LEU 52 H LEU 52 -2.421 -11.250 -20.297 430 HA LEU 52 HA LEU 52 -5.206 -11.025 -20.465 431 HB2 LEU 52 2HB LEU 52 -3.346 -11.842 -22.688 432 HB3 LEU 52 3HB LEU 52 -4.927 -11.080 -22.849 433 HG LEU 52 HG LEU 52 -2.626 -9.698 -21.497 434 HD11 LEU 52 1HD1 LEU 52 -3.340 -9.169 -24.344 435 HD12 LEU 52 2HD1 LEU 52 -2.238 -10.489 -23.954 436 HD13 LEU 52 3HD1 LEU 52 -1.840 -8.838 -23.478 437 HD21 LEU 52 1HD2 LEU 52 -4.228 -8.212 -21.087 438 HD22 LEU 52 2HD2 LEU 52 -5.383 -9.079 -22.100 439 HD23 LEU 52 3HD2 LEU 52 -4.286 -7.902 -22.823 440 H ALA 53 H ALA 53 -3.070 -13.768 -21.178 441 HA ALA 53 HA ALA 53 -5.156 -15.520 -21.986 442 HB1 ALA 53 1HB ALA 53 -2.382 -16.170 -20.996 443 HB2 ALA 53 2HB ALA 53 -3.470 -17.282 -21.827 444 HB3 ALA 53 3HB ALA 53 -2.841 -15.867 -22.672 445 H GLU 54 H GLU 54 -3.701 -14.723 -18.908 446 HA GLU 54 HA GLU 54 -4.662 -16.931 -17.434 447 HB2 GLU 54 2HB GLU 54 -3.833 -14.148 -16.630 448 HB3 GLU 54 3HB GLU 54 -4.366 -15.342 -15.456 449 HG2 GLU 54 2HG GLU 54 -2.176 -16.018 -17.364 450 HG3 GLU 54 3HG GLU 54 -1.836 -15.028 -15.945 451 H ALA 55 H ALA 55 -5.941 -13.632 -17.818 452 HA ALA 55 HA ALA 55 -8.306 -14.148 -16.312 453 HB1 ALA 55 1HB ALA 55 -8.649 -11.963 -18.133 454 HB2 ALA 55 2HB ALA 55 -8.473 -11.936 -16.378 455 HB3 ALA 55 3HB ALA 55 -7.042 -11.892 -17.409 456 H TYR 56 H TYR 56 -7.511 -14.156 -19.750 457 HA TYR 56 HA TYR 56 -10.130 -14.427 -20.739 458 HB2 TYR 56 2HB TYR 56 -8.498 -13.817 -22.319 459 HB3 TYR 56 3HB TYR 56 -7.421 -15.127 -21.846 460 HD1 TYR 56 HD1 TYR 56 -10.466 -14.271 -23.727 461 HD2 TYR 56 HD2 TYR 56 -7.668 -17.330 -22.768 462 HE1 TYR 56 HE1 TYR 56 -11.368 -15.659 -25.547 463 HE2 TYR 56 HE2 TYR 56 -8.561 -18.725 -24.586 464 HH TYR 56 HH TYR 56 -9.844 -18.669 -26.490 465 H GLU 57 H GLU 57 -7.929 -16.699 -19.316 466 HA GLU 57 HA GLU 57 -8.992 -19.095 -20.318 467 HB2 GLU 57 2HB GLU 57 -7.298 -18.302 -18.029 468 HB3 GLU 57 3HB GLU 57 -8.151 -19.829 -17.850 469 HG2 GLU 57 2HG GLU 57 -7.004 -20.833 -19.563 470 HG3 GLU 57 3HG GLU 57 -6.639 -19.303 -20.359 471 H VAL 58 H VAL 58 -9.796 -17.240 -17.400 472 HA VAL 58 HA VAL 58 -11.854 -19.050 -16.574 473 HB VAL 58 HB VAL 58 -11.334 -16.204 -15.701 474 HG11 VAL 58 1HG1 VAL 58 -12.581 -17.806 -13.706 475 HG12 VAL 58 2HG1 VAL 58 -13.182 -16.339 -14.480 476 HG13 VAL 58 3HG1 VAL 58 -13.528 -17.916 -15.189 477 HG21 VAL 58 1HG2 VAL 58 -10.234 -18.840 -14.862 478 HG22 VAL 58 2HG2 VAL 58 -9.429 -17.278 -15.012 479 HG23 VAL 58 3HG2 VAL 58 -10.484 -17.598 -13.635 480 H LEU 59 H LEU 59 -11.774 -15.943 -18.262 481 HA LEU 59 HA LEU 59 -14.618 -15.689 -18.408 482 HB2 LEU 59 2HB LEU 59 -12.480 -14.329 -20.040 483 HB3 LEU 59 3HB LEU 59 -14.171 -13.842 -19.935 484 HG LEU 59 HG LEU 59 -12.046 -13.644 -17.814 485 HD11 LEU 59 1HD1 LEU 59 -13.411 -11.268 -18.006 486 HD12 LEU 59 2HD1 LEU 59 -13.341 -11.823 -19.678 487 HD13 LEU 59 3HD1 LEU 59 -11.853 -11.630 -18.750 488 HD21 LEU 59 1HD2 LEU 59 -14.037 -12.588 -16.518 489 HD22 LEU 59 2HD2 LEU 59 -13.820 -14.338 -16.510 490 HD23 LEU 59 3HD2 LEU 59 -15.024 -13.604 -17.569 491 H SER 60 H SER 60 -12.465 -17.695 -19.962 492 HA SER 60 HA SER 60 -13.610 -17.704 -22.583 493 HB2 SER 60 2HB SER 60 -11.381 -18.483 -22.461 494 HB3 SER 60 3HB SER 60 -11.745 -19.565 -21.117 495 HG SER 60 HG SER 60 -11.570 -20.708 -23.080 496 H ASP 61 H ASP 61 -14.565 -18.971 -19.586 497 HA ASP 61 HA ASP 61 -16.672 -20.527 -20.903 498 HB2 ASP 61 2HB ASP 61 -14.580 -21.823 -19.780 499 HB3 ASP 61 3HB ASP 61 -15.635 -21.670 -18.378 500 H GLU 62 H GLU 62 -18.651 -20.250 -20.041 501 HA GLU 62 HA GLU 62 -19.160 -18.151 -18.268 502 HB2 GLU 62 2HB GLU 62 -21.476 -19.176 -18.124 503 HB3 GLU 62 3HB GLU 62 -20.901 -18.785 -19.739 504 HG2 GLU 62 2HG GLU 62 -20.408 -21.079 -20.192 505 HG3 GLU 62 3HG GLU 62 -20.748 -21.531 -18.523 506 H VAL 63 H VAL 63 -18.873 -21.622 -17.716 507 HA VAL 63 HA VAL 63 -19.767 -21.680 -15.055 508 HB VAL 63 HB VAL 63 -17.663 -23.479 -16.260 509 HG11 VAL 63 1HG1 VAL 63 -17.918 -24.838 -14.482 510 HG12 VAL 63 2HG1 VAL 63 -18.483 -23.368 -13.685 511 HG13 VAL 63 3HG1 VAL 63 -19.647 -24.514 -14.351 512 HG21 VAL 63 1HG2 VAL 63 -20.395 -23.114 -17.017 513 HG22 VAL 63 2HG2 VAL 63 -19.201 -24.230 -17.677 514 HG23 VAL 63 3HG2 VAL 63 -20.196 -24.714 -16.304 515 H LYS 64 H LYS 64 -16.437 -21.546 -16.325 516 HA LYS 64 HA LYS 64 -15.181 -21.278 -13.823 517 HB2 LYS 64 2HB LYS 64 -14.334 -20.578 -16.626 518 HB3 LYS 64 3HB LYS 64 -13.288 -20.279 -15.245 519 HG2 LYS 64 2HG LYS 64 -13.853 -22.834 -14.769 520 HG3 LYS 64 3HG LYS 64 -14.070 -22.830 -16.521 521 HD2 LYS 64 2HD LYS 64 -11.801 -23.410 -16.099 522 HD3 LYS 64 3HD LYS 64 -11.806 -21.748 -16.695 523 HE2 LYS 64 2HE LYS 64 -10.445 -21.437 -14.912 524 HE3 LYS 64 3HE LYS 64 -11.985 -21.262 -14.073 525 HZ1 LYS 64 1HZ LYS 64 -10.070 -23.473 -14.003 526 HZ2 LYS 64 2HZ LYS 64 -11.711 -23.847 -13.839 527 HZ3 LYS 64 3HZ LYS 64 -10.973 -22.787 -12.747 528 H ARG 65 H ARG 65 -16.356 -18.879 -16.139 529 HA ARG 65 HA ARG 65 -15.334 -16.603 -14.828 530 HB2 ARG 65 2HB ARG 65 -16.086 -16.481 -17.127 531 HB3 ARG 65 3HB ARG 65 -17.722 -16.916 -16.652 532 HG2 ARG 65 2HG ARG 65 -17.770 -14.804 -15.286 533 HG3 ARG 65 3HG ARG 65 -16.252 -14.361 -16.070 534 HD2 ARG 65 2HD ARG 65 -17.241 -14.023 -18.103 535 HD3 ARG 65 3HD ARG 65 -18.522 -15.194 -17.795 536 HE ARG 65 HE ARG 65 -18.634 -12.404 -17.323 537 HH11 ARG 65 1HH1 ARG 65 -19.654 -15.458 -16.001 538 HH12 ARG 65 2HH1 ARG 65 -21.047 -14.798 -15.209 539 HH21 ARG 65 1HH2 ARG 65 -20.464 -11.523 -16.285 540 HH22 ARG 65 2HH2 ARG 65 -21.507 -12.560 -15.372 541 H LYS 66 H LYS 66 -18.485 -18.224 -14.631 542 HA LYS 66 HA LYS 66 -19.704 -16.429 -12.854 543 HB2 LYS 66 2HB LYS 66 -20.153 -19.356 -13.411 544 HB3 LYS 66 3HB LYS 66 -21.135 -18.467 -12.254 545 HG2 LYS 66 2HG LYS 66 -20.810 -17.530 -15.083 546 HG3 LYS 66 3HG LYS 66 -22.026 -18.726 -14.630 547 HD2 LYS 66 2HD LYS 66 -23.036 -17.174 -13.079 548 HD3 LYS 66 3HD LYS 66 -21.760 -15.992 -13.381 549 HE2 LYS 66 2HE LYS 66 -22.484 -15.988 -15.790 550 HE3 LYS 66 3HE LYS 66 -23.874 -16.955 -15.300 551 HZ1 LYS 66 1HZ LYS 66 -23.640 -14.199 -15.243 552 HZ2 LYS 66 2HZ LYS 66 -23.623 -14.691 -13.625 553 HZ3 LYS 66 3HZ LYS 66 -24.911 -15.133 -14.629 554 H GLN 67 H GLN 67 -17.744 -19.316 -12.272 555 HA GLN 67 HA GLN 67 -18.071 -19.479 -9.502 556 HB2 GLN 67 2HB GLN 67 -15.845 -20.317 -11.344 557 HB3 GLN 67 3HB GLN 67 -15.741 -20.573 -9.607 558 HG2 GLN 67 2HG GLN 67 -17.829 -21.684 -11.467 559 HG3 GLN 67 3HG GLN 67 -16.522 -22.574 -10.688 560 HE21 GLN 67 1HE2 GLN 67 -19.668 -21.256 -10.358 561 HE22 GLN 67 2HE2 GLN 67 -19.984 -21.827 -8.758 562 H TYR 68 H TYR 68 -15.853 -17.560 -11.454 563 HA TYR 68 HA TYR 68 -14.326 -16.591 -9.249 564 HB2 TYR 68 2HB TYR 68 -13.453 -16.653 -11.562 565 HB3 TYR 68 3HB TYR 68 -14.627 -15.427 -12.026 566 HD1 TYR 68 HD1 TYR 68 -11.727 -16.041 -9.784 567 HD2 TYR 68 HD2 TYR 68 -14.132 -13.150 -11.775 568 HE1 TYR 68 HE1 TYR 68 -10.132 -14.282 -9.143 569 HE2 TYR 68 HE2 TYR 68 -12.543 -11.383 -11.140 570 HH TYR 68 HH TYR 68 -10.635 -11.333 -8.925 571 H ASP 69 H ASP 69 -17.180 -15.490 -10.962 572 HA ASP 69 HA ASP 69 -17.260 -12.880 -9.853 573 HB2 ASP 69 2HB ASP 69 -18.493 -13.426 -11.884 574 HB3 ASP 69 3HB ASP 69 -19.477 -14.589 -10.999 575 H ALA 70 H ALA 70 -18.330 -16.006 -8.749 576 HA ALA 70 HA ALA 70 -20.169 -15.214 -6.787 577 HB1 ALA 70 1HB ALA 70 -19.692 -17.413 -5.746 578 HB2 ALA 70 2HB ALA 70 -20.023 -17.513 -7.476 579 HB3 ALA 70 3HB ALA 70 -18.364 -17.626 -6.887 580 H TYR 71 H TYR 71 -16.656 -15.519 -6.705 581 HA TYR 71 HA TYR 71 -16.673 -14.444 -3.963 582 HB2 TYR 71 2HB TYR 71 -14.518 -16.005 -5.403 583 HB3 TYR 71 3HB TYR 71 -14.381 -15.361 -3.771 584 HD1 TYR 71 HD1 TYR 71 -16.725 -16.034 -2.380 585 HD2 TYR 71 HD2 TYR 71 -14.772 -18.290 -5.413 586 HE1 TYR 71 HE1 TYR 71 -17.720 -18.095 -1.480 587 HE2 TYR 71 HE2 TYR 71 -15.762 -20.357 -4.521 588 HH TYR 71 HH TYR 71 -18.313 -20.416 -2.423 589 H GLY 72 H GLY 72 -16.917 -12.949 -6.522 590 HA2 GLY 72 2HA GLY 72 -14.380 -11.490 -6.624 591 HA3 GLY 72 3HA GLY 72 -15.714 -11.327 -7.756 592 H SER 73 H SER 73 -14.299 -9.190 -6.485 593 HA SER 73 HA SER 73 -16.153 -8.155 -4.486 594 HB2 SER 73 2HB SER 73 -14.529 -6.363 -4.172 595 HB3 SER 73 3HB SER 73 -13.709 -7.923 -4.123 596 HG SER 73 HG SER 73 -12.486 -6.737 -5.470 Start of MODEL 13 1 H1 HIS 1 H HIS 1 -1.150 4.078 0.451 2 HA HIS 1 HA HIS 1 -1.122 3.417 -1.976 3 HB2 HIS 1 2HB HIS 1 1.207 2.597 -0.234 4 HB3 HIS 1 3HB HIS 1 1.281 2.670 -1.992 5 HD1 HIS 1 HD1 HIS 1 2.148 4.610 0.820 6 HD2 HIS 1 HD2 HIS 1 0.401 5.477 -2.848 7 HE1 HIS 1 HE1 HIS 1 2.492 7.078 0.478 8 H MET 2 H MET 2 -2.707 1.411 -0.543 9 HA MET 2 HA MET 2 -1.543 -1.115 -1.432 10 HB2 MET 2 2HB MET 2 -4.072 -0.536 0.120 11 HB3 MET 2 3HB MET 2 -3.481 -2.144 -0.276 12 HG2 MET 2 2HG MET 2 -1.700 -1.995 1.190 13 HG3 MET 2 3HG MET 2 -1.746 -0.234 1.225 14 HE1 MET 2 1HE MET 2 -3.640 1.118 3.210 15 HE2 MET 2 2HE MET 2 -2.877 0.247 4.540 16 HE3 MET 2 3HE MET 2 -1.934 0.679 3.113 17 H LEU 3 H LEU 3 -2.017 -1.954 -3.347 18 HA LEU 3 HA LEU 3 -3.920 -0.743 -5.089 19 HB2 LEU 3 2HB LEU 3 -2.140 -3.143 -5.253 20 HB3 LEU 3 3HB LEU 3 -3.362 -2.852 -6.489 21 HG LEU 3 HG LEU 3 -1.369 -0.722 -5.816 22 HD11 LEU 3 1HD1 LEU 3 0.067 -2.563 -6.198 23 HD12 LEU 3 2HD1 LEU 3 0.011 -1.654 -7.707 24 HD13 LEU 3 3HD1 LEU 3 -0.917 -3.144 -7.542 25 HD21 LEU 3 1HD2 LEU 3 -3.522 -0.803 -7.489 26 HD22 LEU 3 2HD2 LEU 3 -2.201 -1.227 -8.577 27 HD23 LEU 3 3HD2 LEU 3 -2.142 0.281 -7.664 28 H ALA 4 H ALA 4 -5.930 -1.397 -5.688 29 HA ALA 4 HA ALA 4 -7.307 -3.206 -3.919 30 HB1 ALA 4 1HB ALA 4 -8.027 -1.031 -5.569 31 HB2 ALA 4 2HB ALA 4 -8.935 -2.435 -6.130 32 HB3 ALA 4 3HB ALA 4 -9.044 -1.931 -4.443 33 H LYS 5 H LYS 5 -8.575 -5.020 -4.627 34 HA LYS 5 HA LYS 5 -7.176 -6.869 -6.168 35 HB2 LYS 5 2HB LYS 5 -10.108 -6.787 -5.436 36 HB3 LYS 5 3HB LYS 5 -9.311 -8.181 -6.154 37 HG2 LYS 5 2HG LYS 5 -8.181 -8.699 -4.240 38 HG3 LYS 5 3HG LYS 5 -8.155 -7.028 -3.672 39 HD2 LYS 5 2HD LYS 5 -10.548 -7.166 -3.167 40 HD3 LYS 5 3HD LYS 5 -10.571 -8.837 -3.735 41 HE2 LYS 5 2HE LYS 5 -8.942 -9.426 -1.984 42 HE3 LYS 5 3HE LYS 5 -8.987 -7.763 -1.402 43 HZ1 LYS 5 1HZ LYS 5 -10.455 -9.512 -0.262 44 HZ2 LYS 5 2HZ LYS 5 -11.468 -9.343 -1.606 45 HZ3 LYS 5 3HZ LYS 5 -11.136 -8.006 -0.624 46 H GLU 6 H GLU 6 -7.445 -7.682 -8.248 47 HA GLU 6 HA GLU 6 -8.993 -5.961 -10.072 48 HB2 GLU 6 2HB GLU 6 -6.253 -7.135 -10.316 49 HB3 GLU 6 3HB GLU 6 -7.205 -6.878 -11.772 50 HG2 GLU 6 2HG GLU 6 -6.407 -4.784 -9.763 51 HG3 GLU 6 3HG GLU 6 -5.742 -5.000 -11.381 52 H ASP 7 H ASP 7 -10.177 -6.925 -11.692 53 HA ASP 7 HA ASP 7 -10.467 -9.848 -11.471 54 HB2 ASP 7 2HB ASP 7 -12.566 -8.064 -12.664 55 HB3 ASP 7 3HB ASP 7 -12.750 -9.651 -11.922 56 H TYR 8 H TYR 8 -11.004 -11.013 -13.439 57 HA TYR 8 HA TYR 8 -9.247 -10.459 -15.544 58 HB2 TYR 8 2HB TYR 8 -11.721 -12.184 -15.718 59 HB3 TYR 8 3HB TYR 8 -10.263 -12.312 -16.695 60 HD1 TYR 8 HD1 TYR 8 -11.846 -14.240 -14.618 61 HD2 TYR 8 HD2 TYR 8 -8.171 -12.096 -14.608 62 HE1 TYR 8 HE1 TYR 8 -10.917 -15.852 -13.009 63 HE2 TYR 8 HE2 TYR 8 -7.232 -13.703 -13.000 64 HH TYR 8 HH TYR 8 -8.436 -16.640 -12.417 65 H TYR 9 H TYR 9 -12.532 -9.479 -14.981 66 HA TYR 9 HA TYR 9 -13.428 -8.869 -17.517 67 HB2 TYR 9 2HB TYR 9 -13.881 -7.284 -14.980 68 HB3 TYR 9 3HB TYR 9 -14.845 -7.155 -16.447 69 HD1 TYR 9 HD1 TYR 9 -14.339 -8.943 -13.373 70 HD2 TYR 9 HD2 TYR 9 -16.159 -9.177 -17.211 71 HE1 TYR 9 HE1 TYR 9 -15.796 -10.753 -12.565 72 HE2 TYR 9 HE2 TYR 9 -17.622 -10.986 -16.414 73 HH TYR 9 HH TYR 9 -17.080 -12.754 -13.759 74 H GLN 10 H GLN 10 -11.424 -6.884 -15.366 75 HA GLN 10 HA GLN 10 -11.238 -4.699 -17.191 76 HB2 GLN 10 2HB GLN 10 -9.622 -5.431 -14.748 77 HB3 GLN 10 3HB GLN 10 -9.392 -3.944 -15.658 78 HG2 GLN 10 2HG GLN 10 -11.426 -3.067 -14.997 79 HG3 GLN 10 3HG GLN 10 -12.089 -4.649 -14.588 80 HE21 GLN 10 1HE2 GLN 10 -11.478 -5.631 -12.639 81 HE22 GLN 10 2HE2 GLN 10 -10.813 -4.715 -11.335 82 H ILE 11 H ILE 11 -9.155 -7.438 -16.377 83 HA ILE 11 HA ILE 11 -6.909 -6.726 -17.867 84 HB ILE 11 HB ILE 11 -7.970 -9.508 -17.357 85 HG12 ILE 11 2HG1 ILE 11 -5.831 -8.039 -15.817 86 HG13 ILE 11 3HG1 ILE 11 -7.529 -7.981 -15.354 87 HG21 ILE 11 1HG2 ILE 11 -5.515 -8.478 -18.625 88 HG22 ILE 11 2HG2 ILE 11 -5.299 -9.789 -17.467 89 HG23 ILE 11 3HG2 ILE 11 -6.360 -10.008 -18.858 90 HD11 ILE 11 1HD1 ILE 11 -6.537 -10.687 -15.773 91 HD12 ILE 11 2HD1 ILE 11 -5.701 -9.812 -14.489 92 HD13 ILE 11 3HD1 ILE 11 -7.453 -10.004 -14.430 93 H LEU 12 H LEU 12 -10.006 -7.834 -18.893 94 HA LEU 12 HA LEU 12 -8.994 -8.290 -21.617 95 HB2 LEU 12 2HB LEU 12 -11.289 -9.357 -20.068 96 HB3 LEU 12 3HB LEU 12 -11.503 -9.149 -21.805 97 HG LEU 12 HG LEU 12 -9.246 -10.748 -20.616 98 HD11 LEU 12 1HD1 LEU 12 -10.738 -12.283 -20.017 99 HD12 LEU 12 2HD1 LEU 12 -11.072 -12.511 -21.733 100 HD13 LEU 12 3HD1 LEU 12 -12.059 -11.400 -20.783 101 HD21 LEU 12 1HD2 LEU 12 -10.480 -10.979 -23.343 102 HD22 LEU 12 2HD2 LEU 12 -8.915 -11.570 -22.784 103 HD23 LEU 12 3HD2 LEU 12 -9.178 -9.839 -23.002 104 H GLY 13 H GLY 13 -10.736 -6.116 -19.670 105 HA2 GLY 13 2HA GLY 13 -11.550 -4.020 -20.225 106 HA3 GLY 13 3HA GLY 13 -11.184 -4.364 -21.909 107 H VAL 14 H VAL 14 -13.098 -6.619 -20.113 108 HA VAL 14 HA VAL 14 -15.459 -5.773 -21.657 109 HB VAL 14 HB VAL 14 -16.282 -8.058 -21.455 110 HG11 VAL 14 1HG1 VAL 14 -14.428 -7.230 -23.168 111 HG12 VAL 14 2HG1 VAL 14 -13.496 -8.501 -22.373 112 HG13 VAL 14 3HG1 VAL 14 -15.026 -8.888 -23.162 113 HG21 VAL 14 1HG2 VAL 14 -14.880 -9.824 -20.497 114 HG22 VAL 14 2HG2 VAL 14 -13.698 -8.615 -19.998 115 HG23 VAL 14 3HG2 VAL 14 -15.312 -8.615 -19.288 116 HA PRO 15 HA PRO 15 -17.674 -4.837 -17.982 117 HB2 PRO 15 2HB PRO 15 -20.201 -5.487 -18.732 118 HB3 PRO 15 3HB PRO 15 -19.354 -4.061 -19.343 119 HG2 PRO 15 2HG PRO 15 -19.728 -6.738 -20.629 120 HG3 PRO 15 3HG PRO 15 -19.860 -5.123 -21.349 121 HD2 PRO 15 2HD PRO 15 -17.661 -6.675 -21.645 122 HD3 PRO 15 3HD PRO 15 -17.578 -4.902 -21.582 123 H ARG 16 H ARG 16 -19.379 -5.807 -16.469 124 HA ARG 16 HA ARG 16 -18.498 -8.445 -15.737 125 HB2 ARG 16 2HB ARG 16 -20.625 -6.683 -14.505 126 HB3 ARG 16 3HB ARG 16 -19.979 -8.155 -13.793 127 HG2 ARG 16 2HG ARG 16 -18.737 -6.606 -12.684 128 HG3 ARG 16 3HG ARG 16 -17.690 -6.882 -14.077 129 HD2 ARG 16 2HD ARG 16 -18.231 -4.865 -15.051 130 HD3 ARG 16 3HD ARG 16 -19.784 -4.763 -14.222 131 HE ARG 16 HE ARG 16 -17.878 -4.596 -12.247 132 HH11 ARG 16 1HH1 ARG 16 -18.695 -2.806 -15.119 133 HH12 ARG 16 2HH1 ARG 16 -18.120 -1.295 -14.498 134 HH21 ARG 16 1HH2 ARG 16 -17.118 -2.612 -11.418 135 HH22 ARG 16 2HH2 ARG 16 -17.222 -1.185 -12.393 136 H ASN 17 H ASN 17 -20.837 -7.282 -17.814 137 HA ASN 17 HA ASN 17 -22.507 -9.685 -17.481 138 HB2 ASN 17 2HB ASN 17 -23.119 -6.904 -18.405 139 HB3 ASN 17 3HB ASN 17 -24.088 -8.242 -19.017 140 HD21 ASN 17 1HD2 ASN 17 -24.859 -6.021 -17.307 141 HD22 ASN 17 2HD2 ASN 17 -25.486 -6.724 -15.859 142 H ALA 18 H ALA 18 -19.986 -8.653 -19.223 143 HA ALA 18 HA ALA 18 -20.591 -8.974 -21.904 144 HB1 ALA 18 1HB ALA 18 -18.031 -10.105 -20.897 145 HB2 ALA 18 2HB ALA 18 -18.338 -9.051 -22.278 146 HB3 ALA 18 3HB ALA 18 -18.351 -8.389 -20.644 147 H SER 19 H SER 19 -20.187 -10.781 -23.349 148 HA SER 19 HA SER 19 -20.957 -13.335 -22.109 149 HB2 SER 19 2HB SER 19 -21.207 -12.730 -25.045 150 HB3 SER 19 3HB SER 19 -22.101 -13.903 -24.079 151 HG SER 19 HG SER 19 -23.456 -12.392 -23.492 152 H GLN 20 H GLN 20 -20.215 -15.288 -23.445 153 HA GLN 20 HA GLN 20 -17.400 -15.378 -23.394 154 HB2 GLN 20 2HB GLN 20 -19.151 -17.335 -24.871 155 HB3 GLN 20 3HB GLN 20 -17.595 -17.633 -24.108 156 HG2 GLN 20 2HG GLN 20 -20.251 -17.177 -22.790 157 HG3 GLN 20 3HG GLN 20 -19.223 -18.606 -22.715 158 HE21 GLN 20 1HE2 GLN 20 -17.235 -18.457 -21.542 159 HE22 GLN 20 2HE2 GLN 20 -17.077 -17.331 -20.242 160 H LYS 21 H LYS 21 -19.668 -14.599 -25.893 161 HA LYS 21 HA LYS 21 -17.858 -14.991 -28.083 162 HB2 LYS 21 2HB LYS 21 -20.450 -13.441 -27.927 163 HB3 LYS 21 3HB LYS 21 -19.582 -13.816 -29.410 164 HG2 LYS 21 2HG LYS 21 -19.921 -16.197 -29.020 165 HG3 LYS 21 3HG LYS 21 -20.770 -15.834 -27.516 166 HD2 LYS 21 2HD LYS 21 -22.523 -14.706 -28.716 167 HD3 LYS 21 3HD LYS 21 -21.638 -14.859 -30.235 168 HE2 LYS 21 2HE LYS 21 -21.740 -17.419 -29.668 169 HE3 LYS 21 3HE LYS 21 -23.108 -16.930 -28.669 170 HZ1 LYS 21 1HZ LYS 21 -24.360 -16.424 -30.467 171 HZ2 LYS 21 2HZ LYS 21 -23.370 -17.580 -31.205 172 HZ3 LYS 21 3HZ LYS 21 -23.044 -15.932 -31.409 173 H GLU 22 H GLU 22 -19.013 -12.195 -26.235 174 HA GLU 22 HA GLU 22 -17.626 -10.241 -27.729 175 HB2 GLU 22 2HB GLU 22 -19.473 -9.621 -26.290 176 HB3 GLU 22 3HB GLU 22 -18.613 -10.207 -24.873 177 HG2 GLU 22 2HG GLU 22 -17.136 -8.423 -24.869 178 HG3 GLU 22 3HG GLU 22 -17.444 -8.036 -26.561 179 H ILE 23 H ILE 23 -16.762 -12.141 -24.886 180 HA ILE 23 HA ILE 23 -14.399 -10.816 -24.192 181 HB ILE 23 HB ILE 23 -15.072 -13.745 -23.888 182 HG12 ILE 23 2HG1 ILE 23 -15.137 -11.779 -21.646 183 HG13 ILE 23 3HG1 ILE 23 -16.464 -11.757 -22.802 184 HG21 ILE 23 1HG2 ILE 23 -13.345 -12.918 -21.848 185 HG22 ILE 23 2HG2 ILE 23 -12.987 -14.017 -23.178 186 HG23 ILE 23 3HG2 ILE 23 -12.654 -12.294 -23.345 187 HD11 ILE 23 1HD1 ILE 23 -16.139 -14.437 -22.166 188 HD12 ILE 23 2HD1 ILE 23 -15.936 -13.580 -20.637 189 HD13 ILE 23 3HD1 ILE 23 -17.403 -13.351 -21.589 190 H LYS 24 H LYS 24 -15.051 -13.261 -26.624 191 HA LYS 24 HA LYS 24 -12.405 -13.986 -27.218 192 HB2 LYS 24 2HB LYS 24 -14.988 -14.072 -28.732 193 HB3 LYS 24 3HB LYS 24 -13.484 -14.450 -29.561 194 HG2 LYS 24 2HG LYS 24 -13.127 -16.066 -27.533 195 HG3 LYS 24 3HG LYS 24 -14.882 -15.937 -27.395 196 HD2 LYS 24 2HD LYS 24 -13.580 -16.565 -30.022 197 HD3 LYS 24 3HD LYS 24 -13.894 -17.834 -28.836 198 HE2 LYS 24 2HE LYS 24 -16.297 -16.828 -28.811 199 HE3 LYS 24 3HE LYS 24 -15.827 -16.140 -30.365 200 HZ1 LYS 24 1HZ LYS 24 -15.683 -18.195 -31.335 201 HZ2 LYS 24 2HZ LYS 24 -16.953 -18.462 -30.252 202 HZ3 LYS 24 3HZ LYS 24 -15.395 -19.005 -29.878 203 H LYS 25 H LYS 25 -14.449 -11.378 -28.437 204 HA LYS 25 HA LYS 25 -12.591 -10.482 -30.403 205 HB2 LYS 25 2HB LYS 25 -15.045 -9.283 -29.145 206 HB3 LYS 25 3HB LYS 25 -14.046 -8.351 -30.253 207 HG2 LYS 25 2HG LYS 25 -14.563 -9.712 -32.063 208 HG3 LYS 25 3HG LYS 25 -15.094 -11.043 -31.033 209 HD2 LYS 25 2HD LYS 25 -17.028 -10.017 -32.027 210 HD3 LYS 25 3HD LYS 25 -17.011 -9.639 -30.303 211 HE2 LYS 25 2HE LYS 25 -16.038 -7.442 -30.811 212 HE3 LYS 25 3HE LYS 25 -16.088 -7.825 -32.531 213 HZ1 LYS 25 1HZ LYS 25 -18.576 -8.184 -32.119 214 HZ2 LYS 25 2HZ LYS 25 -18.001 -6.595 -32.189 215 HZ3 LYS 25 3HZ LYS 25 -18.334 -7.308 -30.691 216 H ALA 26 H ALA 26 -13.449 -9.334 -27.149 217 HA ALA 26 HA ALA 26 -11.643 -7.178 -27.080 218 HB1 ALA 26 1HB ALA 26 -12.110 -7.025 -24.775 219 HB2 ALA 26 2HB ALA 26 -13.594 -7.616 -25.524 220 HB3 ALA 26 3HB ALA 26 -12.532 -8.734 -24.667 221 H TYR 27 H TYR 27 -11.251 -10.591 -26.449 222 HA TYR 27 HA TYR 27 -8.732 -10.377 -25.127 223 HB2 TYR 27 2HB TYR 27 -10.030 -12.346 -24.732 224 HB3 TYR 27 3HB TYR 27 -10.152 -12.688 -26.454 225 HD1 TYR 27 HD1 TYR 27 -7.238 -11.868 -24.261 226 HD2 TYR 27 HD2 TYR 27 -9.053 -14.671 -26.898 227 HE1 TYR 27 HE1 TYR 27 -5.239 -13.293 -24.112 228 HE2 TYR 27 HE2 TYR 27 -7.060 -16.104 -26.756 229 HH TYR 27 HH TYR 27 -5.171 -16.506 -25.425 230 H TYR 28 H TYR 28 -9.765 -10.772 -28.457 231 HA TYR 28 HA TYR 28 -7.146 -11.331 -29.473 232 HB2 TYR 28 2HB TYR 28 -9.078 -12.123 -30.695 233 HB3 TYR 28 3HB TYR 28 -9.699 -10.483 -30.855 234 HD1 TYR 28 HD1 TYR 28 -9.561 -9.702 -33.014 235 HD2 TYR 28 HD2 TYR 28 -6.406 -12.137 -31.523 236 HE1 TYR 28 HE1 TYR 28 -8.369 -9.456 -35.151 237 HE2 TYR 28 HE2 TYR 28 -5.205 -11.897 -33.656 238 HH TYR 28 HH TYR 28 -5.127 -10.306 -35.556 239 H GLN 29 H GLN 29 -9.255 -8.471 -29.453 240 HA GLN 29 HA GLN 29 -7.550 -6.747 -30.846 241 HB2 GLN 29 2HB GLN 29 -8.926 -4.981 -30.099 242 HB3 GLN 29 3HB GLN 29 -9.988 -6.377 -30.220 243 HG2 GLN 29 2HG GLN 29 -9.863 -6.712 -27.822 244 HG3 GLN 29 3HG GLN 29 -8.741 -5.359 -27.677 245 HE21 GLN 29 1HE2 GLN 29 -11.810 -5.869 -29.388 246 HE22 GLN 29 2HE2 GLN 29 -12.600 -4.477 -28.738 247 H LEU 30 H LEU 30 -7.627 -7.694 -27.474 248 HA LEU 30 HA LEU 30 -5.785 -5.691 -26.589 249 HB2 LEU 30 2HB LEU 30 -7.334 -7.828 -25.426 250 HB3 LEU 30 3HB LEU 30 -5.689 -7.829 -24.794 251 HG LEU 30 HG LEU 30 -5.959 -5.526 -24.047 252 HD11 LEU 30 1HD1 LEU 30 -7.418 -4.262 -25.159 253 HD12 LEU 30 2HD1 LEU 30 -8.660 -5.007 -24.154 254 HD13 LEU 30 3HD1 LEU 30 -8.309 -5.664 -25.752 255 HD21 LEU 30 1HD2 LEU 30 -7.749 -7.699 -23.155 256 HD22 LEU 30 2HD2 LEU 30 -8.117 -6.082 -22.555 257 HD23 LEU 30 3HD2 LEU 30 -6.529 -6.791 -22.262 258 H ALA 31 H ALA 31 -5.539 -9.098 -27.507 259 HA ALA 31 HA ALA 31 -2.876 -9.543 -26.810 260 HB1 ALA 31 1HB ALA 31 -3.758 -11.526 -27.393 261 HB2 ALA 31 2HB ALA 31 -4.839 -10.812 -28.591 262 HB3 ALA 31 3HB ALA 31 -3.149 -11.115 -28.996 263 H LYS 32 H LYS 32 -4.273 -7.948 -29.596 264 HA LYS 32 HA LYS 32 -1.866 -7.875 -31.132 265 HB2 LYS 32 2HB LYS 32 -4.389 -6.220 -31.329 266 HB3 LYS 32 3HB LYS 32 -3.090 -6.212 -32.515 267 HG2 LYS 32 2HG LYS 32 -3.655 -8.245 -33.358 268 HG3 LYS 32 3HG LYS 32 -4.298 -8.829 -31.821 269 HD2 LYS 32 2HD LYS 32 -6.219 -8.568 -33.082 270 HD3 LYS 32 3HD LYS 32 -6.139 -7.034 -32.212 271 HE2 LYS 32 2HE LYS 32 -5.373 -5.877 -34.101 272 HE3 LYS 32 3HE LYS 32 -4.919 -7.362 -34.935 273 HZ1 LYS 32 1HZ LYS 32 -7.706 -7.272 -34.286 274 HZ2 LYS 32 2HZ LYS 32 -6.955 -7.576 -35.770 275 HZ3 LYS 32 3HZ LYS 32 -7.240 -5.983 -35.278 276 H LYS 33 H LYS 33 -3.245 -5.914 -28.626 277 HA LYS 33 HA LYS 33 -1.734 -3.556 -29.123 278 HB2 LYS 33 2HB LYS 33 -3.146 -4.579 -26.659 279 HB3 LYS 33 3HB LYS 33 -2.349 -3.013 -26.730 280 HG2 LYS 33 2HG LYS 33 -3.835 -2.351 -28.564 281 HG3 LYS 33 3HG LYS 33 -4.649 -3.913 -28.454 282 HD2 LYS 33 2HD LYS 33 -5.741 -3.362 -26.538 283 HD3 LYS 33 3HD LYS 33 -4.425 -2.340 -25.955 284 HE2 LYS 33 2HE LYS 33 -6.043 -1.506 -28.329 285 HE3 LYS 33 3HE LYS 33 -6.672 -1.259 -26.700 286 HZ1 LYS 33 1HZ LYS 33 -5.553 0.664 -26.872 287 HZ2 LYS 33 2HZ LYS 33 -4.506 0.094 -28.072 288 HZ3 LYS 33 3HZ LYS 33 -4.210 -0.274 -26.447 289 H TYR 34 H TYR 34 -1.210 -6.446 -27.185 290 HA TYR 34 HA TYR 34 1.410 -5.404 -26.358 291 HB2 TYR 34 2HB TYR 34 -0.109 -7.796 -25.299 292 HB3 TYR 34 3HB TYR 34 1.401 -7.158 -24.657 293 HD1 TYR 34 HD1 TYR 34 1.430 -5.061 -23.396 294 HD2 TYR 34 HD2 TYR 34 -2.216 -6.706 -24.847 295 HE1 TYR 34 HE1 TYR 34 0.170 -3.577 -21.894 296 HE2 TYR 34 HE2 TYR 34 -3.487 -5.225 -23.350 297 HH TYR 34 HH TYR 34 -3.329 -3.830 -21.571 298 H HIS 35 H HIS 35 0.752 -6.472 -29.032 299 HA HIS 35 HA HIS 35 1.605 -9.050 -29.498 300 HB2 HIS 35 2HB HIS 35 2.405 -8.148 -31.738 301 HB3 HIS 35 3HB HIS 35 0.723 -7.826 -31.327 302 HD1 HIS 35 HD1 HIS 35 3.300 -5.707 -29.706 303 HD2 HIS 35 HD2 HIS 35 0.812 -5.558 -33.031 304 HE1 HIS 35 HE1 HIS 35 3.355 -3.315 -30.481 305 HA PRO 36 HA PRO 36 5.891 -9.282 -28.589 306 HB2 PRO 36 2HB PRO 36 6.773 -10.955 -30.536 307 HB3 PRO 36 3HB PRO 36 5.782 -11.500 -29.178 308 HG2 PRO 36 2HG PRO 36 4.960 -10.850 -31.982 309 HG3 PRO 36 3HG PRO 36 4.458 -12.206 -30.954 310 HD2 PRO 36 2HD PRO 36 2.921 -10.006 -31.318 311 HD3 PRO 36 3HD PRO 36 2.926 -10.927 -29.800 312 H ASP 37 H ASP 37 4.788 -7.931 -31.514 313 HA ASP 37 HA ASP 37 7.122 -7.432 -32.933 314 HB2 ASP 37 2HB ASP 37 4.805 -6.948 -33.727 315 HB3 ASP 37 3HB ASP 37 4.773 -5.547 -32.660 316 H THR 38 H THR 38 5.903 -5.945 -30.031 317 HA THR 38 HA THR 38 8.133 -4.021 -30.079 318 HB THR 38 HB THR 38 6.866 -2.757 -28.356 319 HG1 THR 38 HG1 THR 38 5.537 -4.897 -28.007 320 HG21 THR 38 1HG2 THR 38 6.669 -2.148 -30.719 321 HG22 THR 38 2HG2 THR 38 5.150 -1.873 -29.866 322 HG23 THR 38 3HG2 THR 38 5.335 -3.285 -30.905 323 H ASN 39 H ASN 39 7.725 -6.973 -29.064 324 HA ASN 39 HA ASN 39 8.488 -6.659 -26.276 325 HB2 ASN 39 2HB ASN 39 7.811 -9.005 -28.026 326 HB3 ASN 39 3HB ASN 39 8.626 -9.253 -26.484 327 HD21 ASN 39 1HD2 ASN 39 6.138 -6.916 -27.405 328 HD22 ASN 39 2HD2 ASN 39 4.966 -7.446 -26.251 329 H LYS 40 H LYS 40 9.997 -6.873 -29.297 330 HA LYS 40 HA LYS 40 12.295 -8.335 -28.859 331 HB2 LYS 40 2HB LYS 40 12.147 -5.720 -30.367 332 HB3 LYS 40 3HB LYS 40 13.339 -6.993 -30.589 333 HG2 LYS 40 2HG LYS 40 10.393 -7.196 -31.175 334 HG3 LYS 40 3HG LYS 40 11.691 -7.042 -32.361 335 HD2 LYS 40 2HD LYS 40 11.494 -9.298 -32.420 336 HD3 LYS 40 3HD LYS 40 12.567 -9.195 -31.022 337 HE2 LYS 40 2HE LYS 40 11.022 -10.133 -29.731 338 HE3 LYS 40 3HE LYS 40 9.863 -8.875 -30.156 339 HZ1 LYS 40 1HZ LYS 40 9.995 -10.564 -32.336 340 HZ2 LYS 40 2HZ LYS 40 8.725 -10.424 -31.228 341 HZ3 LYS 40 3HZ LYS 40 9.935 -11.581 -30.984 342 H ASP 41 H ASP 41 11.588 -5.003 -27.922 343 HA ASP 41 HA ASP 41 14.062 -5.010 -26.318 344 HB2 ASP 41 2HB ASP 41 12.652 -2.686 -27.644 345 HB3 ASP 41 3HB ASP 41 13.987 -2.513 -26.507 346 H ASP 42 H ASP 42 11.003 -5.621 -25.918 347 HA ASP 42 HA ASP 42 10.846 -4.213 -23.339 348 HB2 ASP 42 2HB ASP 42 9.238 -3.484 -25.330 349 HB3 ASP 42 3HB ASP 42 8.316 -4.877 -24.771 350 HA PRO 43 HA PRO 43 10.601 -8.758 -22.636 351 HB2 PRO 43 2HB PRO 43 12.035 -8.691 -20.332 352 HB3 PRO 43 3HB PRO 43 12.787 -8.778 -21.929 353 HG2 PRO 43 2HG PRO 43 12.373 -6.401 -20.157 354 HG3 PRO 43 3HG PRO 43 13.800 -6.853 -21.108 355 HD2 PRO 43 2HD PRO 43 12.030 -4.980 -21.938 356 HD3 PRO 43 3HD PRO 43 12.911 -6.028 -23.068 357 H LYS 44 H LYS 44 9.493 -5.962 -21.092 358 HA LYS 44 HA LYS 44 8.195 -7.394 -18.907 359 HB2 LYS 44 2HB LYS 44 8.867 -4.596 -19.495 360 HB3 LYS 44 3HB LYS 44 7.278 -4.811 -18.771 361 HG2 LYS 44 2HG LYS 44 8.412 -6.174 -16.978 362 HG3 LYS 44 3HG LYS 44 9.947 -5.612 -17.645 363 HD2 LYS 44 2HD LYS 44 9.699 -3.901 -16.210 364 HD3 LYS 44 3HD LYS 44 8.564 -3.276 -17.409 365 HE2 LYS 44 2HE LYS 44 7.561 -3.222 -15.205 366 HE3 LYS 44 3HE LYS 44 6.725 -4.396 -16.221 367 HZ1 LYS 44 1HZ LYS 44 8.922 -5.418 -14.614 368 HZ2 LYS 44 2HZ LYS 44 7.421 -6.114 -14.963 369 HZ3 LYS 44 3HZ LYS 44 7.545 -4.930 -13.760 370 H ALA 45 H ALA 45 7.529 -6.258 -22.067 371 HA ALA 45 HA ALA 45 4.724 -5.887 -21.826 372 HB1 ALA 45 1HB ALA 45 6.469 -6.443 -24.217 373 HB2 ALA 45 2HB ALA 45 4.745 -6.085 -24.317 374 HB3 ALA 45 3HB ALA 45 5.859 -4.881 -23.669 375 H LYS 46 H LYS 46 6.763 -8.648 -22.631 376 HA LYS 46 HA LYS 46 4.811 -10.416 -23.535 377 HB2 LYS 46 2HB LYS 46 6.373 -12.154 -23.146 378 HB3 LYS 46 3HB LYS 46 7.327 -10.734 -23.554 379 HG2 LYS 46 2HG LYS 46 7.698 -10.356 -21.129 380 HG3 LYS 46 3HG LYS 46 6.866 -11.879 -20.809 381 HD2 LYS 46 2HD LYS 46 9.167 -12.399 -20.801 382 HD3 LYS 46 3HD LYS 46 8.561 -12.961 -22.361 383 HE2 LYS 46 2HE LYS 46 9.278 -10.518 -23.097 384 HE3 LYS 46 3HE LYS 46 10.368 -10.688 -21.721 385 HZ1 LYS 46 1HZ LYS 46 11.222 -12.729 -22.707 386 HZ2 LYS 46 2HZ LYS 46 11.423 -11.420 -23.758 387 HZ3 LYS 46 3HZ LYS 46 10.189 -12.544 -24.034 388 H GLU 47 H GLU 47 5.671 -9.445 -20.286 389 HA GLU 47 HA GLU 47 4.256 -11.512 -18.939 390 HB2 GLU 47 2HB GLU 47 6.045 -10.211 -17.862 391 HB3 GLU 47 3HB GLU 47 5.051 -8.765 -17.959 392 HG2 GLU 47 2HG GLU 47 4.732 -9.439 -15.784 393 HG3 GLU 47 3HG GLU 47 3.336 -10.139 -16.601 394 H LYS 48 H LYS 48 3.424 -8.258 -20.008 395 HA LYS 48 HA LYS 48 0.875 -8.186 -18.740 396 HB2 LYS 48 2HB LYS 48 1.655 -6.598 -21.178 397 HB3 LYS 48 3HB LYS 48 0.511 -6.160 -19.916 398 HG2 LYS 48 2HG LYS 48 3.503 -6.340 -19.642 399 HG3 LYS 48 3HG LYS 48 2.529 -4.869 -19.679 400 HD2 LYS 48 2HD LYS 48 1.436 -5.516 -17.606 401 HD3 LYS 48 3HD LYS 48 2.338 -7.033 -17.583 402 HE2 LYS 48 2HE LYS 48 4.433 -5.540 -17.631 403 HE3 LYS 48 3HE LYS 48 3.340 -4.236 -17.167 404 HZ1 LYS 48 1HZ LYS 48 4.237 -5.122 -15.189 405 HZ2 LYS 48 2HZ LYS 48 3.937 -6.718 -15.662 406 HZ3 LYS 48 3HZ LYS 48 2.647 -5.696 -15.271 407 H PHE 49 H PHE 49 2.015 -9.135 -21.936 408 HA PHE 49 HA PHE 49 -0.516 -9.427 -23.146 409 HB2 PHE 49 2HB PHE 49 1.428 -9.308 -24.543 410 HB3 PHE 49 3HB PHE 49 2.156 -10.699 -23.747 411 HD1 PHE 49 HD1 PHE 49 -0.259 -9.572 -26.225 412 HD2 PHE 49 HD2 PHE 49 1.357 -12.954 -24.209 413 HE1 PHE 49 HE1 PHE 49 -1.259 -11.054 -27.916 414 HE2 PHE 49 HE2 PHE 49 0.361 -14.441 -25.897 415 HZ PHE 49 HZ PHE 49 -0.950 -13.492 -27.753 416 H SER 50 H SER 50 1.539 -11.666 -21.346 417 HA SER 50 HA SER 50 0.071 -14.008 -21.795 418 HB2 SER 50 2HB SER 50 2.239 -14.233 -20.846 419 HB3 SER 50 3HB SER 50 1.849 -13.147 -19.512 420 HG SER 50 HG SER 50 1.711 -15.207 -18.722 421 H GLN 51 H GLN 51 -0.393 -11.378 -19.531 422 HA GLN 51 HA GLN 51 -2.214 -12.603 -17.789 423 HB2 GLN 51 2HB GLN 51 -1.883 -9.719 -18.614 424 HB3 GLN 51 3HB GLN 51 -2.994 -10.238 -17.353 425 HG2 GLN 51 2HG GLN 51 -1.193 -11.053 -16.009 426 HG3 GLN 51 3HG GLN 51 -0.035 -10.770 -17.308 427 HE21 GLN 51 1HE2 GLN 51 1.267 -9.313 -16.354 428 HE22 GLN 51 2HE2 GLN 51 0.756 -7.757 -15.803 429 H LEU 52 H LEU 52 -2.596 -11.333 -20.997 430 HA LEU 52 HA LEU 52 -5.405 -11.004 -20.978 431 HB2 LEU 52 2HB LEU 52 -3.688 -11.690 -23.353 432 HB3 LEU 52 3HB LEU 52 -5.254 -10.883 -23.362 433 HG LEU 52 HG LEU 52 -2.845 -9.649 -22.058 434 HD11 LEU 52 1HD1 LEU 52 -2.466 -10.252 -24.502 435 HD12 LEU 52 2HD1 LEU 52 -2.247 -8.563 -24.047 436 HD13 LEU 52 3HD1 LEU 52 -3.722 -9.069 -24.870 437 HD21 LEU 52 1HD2 LEU 52 -4.416 -8.191 -21.450 438 HD22 LEU 52 2HD2 LEU 52 -5.614 -8.914 -22.523 439 HD23 LEU 52 3HD2 LEU 52 -4.485 -7.709 -23.145 440 H ALA 53 H ALA 53 -3.331 -13.681 -22.063 441 HA ALA 53 HA ALA 53 -5.488 -15.376 -22.806 442 HB1 ALA 53 1HB ALA 53 -2.755 -15.412 -23.147 443 HB2 ALA 53 2HB ALA 53 -3.048 -16.769 -22.059 444 HB3 ALA 53 3HB ALA 53 -3.877 -16.691 -23.613 445 H GLU 54 H GLU 54 -3.740 -14.821 -19.827 446 HA GLU 54 HA GLU 54 -4.598 -17.146 -18.456 447 HB2 GLU 54 2HB GLU 54 -3.418 -14.522 -17.653 448 HB3 GLU 54 3HB GLU 54 -4.130 -15.540 -16.410 449 HG2 GLU 54 2HG GLU 54 -2.066 -16.569 -18.325 450 HG3 GLU 54 3HG GLU 54 -1.638 -15.770 -16.814 451 H ALA 55 H ALA 55 -5.794 -13.794 -18.421 452 HA ALA 55 HA ALA 55 -7.999 -14.372 -16.711 453 HB1 ALA 55 1HB ALA 55 -8.719 -12.066 -17.949 454 HB2 ALA 55 2HB ALA 55 -7.659 -12.159 -16.542 455 HB3 ALA 55 3HB ALA 55 -6.968 -12.039 -18.161 456 H TYR 56 H TYR 56 -7.569 -14.156 -20.203 457 HA TYR 56 HA TYR 56 -10.297 -14.275 -20.910 458 HB2 TYR 56 2HB TYR 56 -8.829 -13.559 -22.605 459 HB3 TYR 56 3HB TYR 56 -7.750 -14.930 -22.372 460 HD1 TYR 56 HD1 TYR 56 -11.010 -13.884 -23.752 461 HD2 TYR 56 HD2 TYR 56 -8.117 -16.994 -23.506 462 HE1 TYR 56 HE1 TYR 56 -12.154 -15.084 -25.568 463 HE2 TYR 56 HE2 TYR 56 -9.253 -18.203 -25.322 464 HH TYR 56 HH TYR 56 -11.145 -18.312 -26.560 465 H GLU 57 H GLU 57 -8.008 -16.697 -19.943 466 HA GLU 57 HA GLU 57 -9.241 -18.981 -21.011 467 HB2 GLU 57 2HB GLU 57 -7.322 -18.435 -18.811 468 HB3 GLU 57 3HB GLU 57 -8.142 -19.989 -18.786 469 HG2 GLU 57 2HG GLU 57 -6.798 -19.035 -21.276 470 HG3 GLU 57 3HG GLU 57 -5.861 -19.768 -19.976 471 H VAL 58 H VAL 58 -9.700 -17.317 -17.916 472 HA VAL 58 HA VAL 58 -11.660 -19.172 -16.964 473 HB VAL 58 HB VAL 58 -11.158 -16.355 -15.997 474 HG11 VAL 58 1HG1 VAL 58 -12.561 -16.769 -14.299 475 HG12 VAL 58 2HG1 VAL 58 -13.192 -18.050 -15.337 476 HG13 VAL 58 3HG1 VAL 58 -11.989 -18.425 -14.103 477 HG21 VAL 58 1HG2 VAL 58 -9.814 -18.952 -15.284 478 HG22 VAL 58 2HG2 VAL 58 -9.068 -17.471 -15.883 479 HG23 VAL 58 3HG2 VAL 58 -9.749 -17.520 -14.257 480 H LEU 59 H LEU 59 -11.777 -15.943 -18.422 481 HA LEU 59 HA LEU 59 -14.620 -15.732 -18.278 482 HB2 LEU 59 2HB LEU 59 -12.389 -14.152 -19.326 483 HB3 LEU 59 3HB LEU 59 -13.877 -14.002 -20.259 484 HG LEU 59 HG LEU 59 -15.065 -13.185 -18.334 485 HD11 LEU 59 1HD1 LEU 59 -12.549 -13.897 -16.865 486 HD12 LEU 59 2HD1 LEU 59 -14.207 -14.391 -16.524 487 HD13 LEU 59 3HD1 LEU 59 -13.704 -12.728 -16.225 488 HD21 LEU 59 1HD2 LEU 59 -13.763 -11.573 -19.653 489 HD22 LEU 59 2HD2 LEU 59 -12.393 -11.804 -18.566 490 HD23 LEU 59 3HD2 LEU 59 -13.891 -11.095 -17.960 491 H SER 60 H SER 60 -12.608 -17.579 -20.189 492 HA SER 60 HA SER 60 -14.015 -17.433 -22.671 493 HB2 SER 60 2HB SER 60 -11.774 -18.184 -22.816 494 HB3 SER 60 3HB SER 60 -12.004 -19.372 -21.533 495 HG SER 60 HG SER 60 -12.804 -19.465 -24.219 496 H ASP 61 H ASP 61 -14.685 -18.881 -19.691 497 HA ASP 61 HA ASP 61 -16.882 -20.397 -20.901 498 HB2 ASP 61 2HB ASP 61 -14.703 -21.742 -20.083 499 HB3 ASP 61 3HB ASP 61 -15.568 -21.646 -18.551 500 H GLU 62 H GLU 62 -18.778 -20.138 -19.882 501 HA GLU 62 HA GLU 62 -19.163 -18.166 -17.965 502 HB2 GLU 62 2HB GLU 62 -20.982 -20.533 -18.425 503 HB3 GLU 62 3HB GLU 62 -21.433 -18.960 -17.784 504 HG2 GLU 62 2HG GLU 62 -20.679 -18.001 -20.007 505 HG3 GLU 62 3HG GLU 62 -20.639 -19.665 -20.589 506 H VAL 63 H VAL 63 -18.827 -21.663 -17.568 507 HA VAL 63 HA VAL 63 -19.423 -21.840 -14.845 508 HB VAL 63 HB VAL 63 -17.381 -23.524 -16.297 509 HG11 VAL 63 1HG1 VAL 63 -17.739 -23.607 -13.724 510 HG12 VAL 63 2HG1 VAL 63 -19.221 -24.470 -14.140 511 HG13 VAL 63 3HG1 VAL 63 -17.656 -25.111 -14.640 512 HG21 VAL 63 1HG2 VAL 63 -19.013 -24.235 -17.627 513 HG22 VAL 63 2HG2 VAL 63 -19.851 -24.855 -16.204 514 HG23 VAL 63 3HG2 VAL 63 -20.194 -23.227 -16.789 515 H LYS 64 H LYS 64 -16.229 -21.552 -16.405 516 HA LYS 64 HA LYS 64 -14.752 -21.339 -14.024 517 HB2 LYS 64 2HB LYS 64 -14.195 -20.474 -16.855 518 HB3 LYS 64 3HB LYS 64 -13.030 -20.223 -15.561 519 HG2 LYS 64 2HG LYS 64 -13.465 -22.807 -15.173 520 HG3 LYS 64 3HG LYS 64 -13.891 -22.731 -16.885 521 HD2 LYS 64 2HD LYS 64 -11.572 -23.262 -16.757 522 HD3 LYS 64 3HD LYS 64 -11.693 -21.580 -17.279 523 HE2 LYS 64 2HE LYS 64 -11.099 -20.776 -15.135 524 HE3 LYS 64 3HE LYS 64 -11.321 -22.362 -14.399 525 HZ1 LYS 64 1HZ LYS 64 -9.106 -21.387 -16.070 526 HZ2 LYS 64 2HZ LYS 64 -9.456 -23.042 -16.039 527 HZ3 LYS 64 3HZ LYS 64 -9.051 -22.236 -14.607 528 H ARG 65 H ARG 65 -16.077 -18.847 -16.178 529 HA ARG 65 HA ARG 65 -15.053 -16.611 -14.853 530 HB2 ARG 65 2HB ARG 65 -16.043 -16.420 -17.053 531 HB3 ARG 65 3HB ARG 65 -17.607 -16.932 -16.435 532 HG2 ARG 65 2HG ARG 65 -17.611 -14.885 -14.996 533 HG3 ARG 65 3HG ARG 65 -16.166 -14.357 -15.861 534 HD2 ARG 65 2HD ARG 65 -17.326 -13.792 -17.703 535 HD3 ARG 65 3HD ARG 65 -18.389 -15.194 -17.582 536 HE ARG 65 HE ARG 65 -18.891 -13.151 -15.613 537 HH11 ARG 65 1HH1 ARG 65 -19.609 -14.307 -18.818 538 HH12 ARG 65 2HH1 ARG 65 -21.136 -13.494 -18.910 539 HH21 ARG 65 1HH2 ARG 65 -20.900 -12.076 -15.723 540 HH22 ARG 65 2HH2 ARG 65 -21.869 -12.224 -17.150 541 H LYS 66 H LYS 66 -18.122 -18.335 -14.398 542 HA LYS 66 HA LYS 66 -19.108 -16.628 -12.365 543 HB2 LYS 66 2HB LYS 66 -19.778 -19.453 -13.175 544 HB3 LYS 66 3HB LYS 66 -20.599 -18.639 -11.849 545 HG2 LYS 66 2HG LYS 66 -20.522 -17.695 -14.708 546 HG3 LYS 66 3HG LYS 66 -21.876 -18.512 -13.924 547 HD2 LYS 66 2HD LYS 66 -21.955 -16.646 -12.272 548 HD3 LYS 66 3HD LYS 66 -20.723 -15.813 -13.224 549 HE2 LYS 66 2HE LYS 66 -22.163 -15.390 -14.964 550 HE3 LYS 66 3HE LYS 66 -23.192 -16.771 -14.589 551 HZ1 LYS 66 1HZ LYS 66 -24.522 -15.456 -13.432 552 HZ2 LYS 66 2HZ LYS 66 -23.590 -14.117 -13.880 553 HZ3 LYS 66 3HZ LYS 66 -23.246 -14.944 -12.445 554 H GLN 67 H GLN 67 -17.308 -19.677 -12.288 555 HA GLN 67 HA GLN 67 -17.369 -20.109 -9.529 556 HB2 GLN 67 2HB GLN 67 -15.468 -20.917 -11.705 557 HB3 GLN 67 3HB GLN 67 -15.105 -21.297 -10.026 558 HG2 GLN 67 2HG GLN 67 -17.532 -22.167 -11.579 559 HG3 GLN 67 3HG GLN 67 -16.169 -23.175 -11.094 560 HE21 GLN 67 1HE2 GLN 67 -19.089 -21.634 -10.100 561 HE22 GLN 67 2HE2 GLN 67 -19.183 -22.345 -8.528 562 H TYR 68 H TYR 68 -15.270 -18.097 -11.504 563 HA TYR 68 HA TYR 68 -13.427 -17.489 -9.410 564 HB2 TYR 68 2HB TYR 68 -12.662 -17.278 -11.669 565 HB3 TYR 68 3HB TYR 68 -13.983 -16.189 -12.079 566 HD1 TYR 68 HD1 TYR 68 -11.042 -16.432 -9.793 567 HD2 TYR 68 HD2 TYR 68 -13.607 -13.902 -12.056 568 HE1 TYR 68 HE1 TYR 68 -9.617 -14.505 -9.243 569 HE2 TYR 68 HE2 TYR 68 -12.188 -11.968 -11.513 570 HH TYR 68 HH TYR 68 -9.155 -12.158 -10.438 571 H ASP 69 H ASP 69 -16.350 -15.996 -10.667 572 HA ASP 69 HA ASP 69 -16.143 -13.542 -9.293 573 HB2 ASP 69 2HB ASP 69 -18.391 -15.066 -10.554 574 HB3 ASP 69 3HB ASP 69 -18.755 -13.660 -9.558 575 H ALA 70 H ALA 70 -17.130 -16.713 -8.297 576 HA ALA 70 HA ALA 70 -18.671 -16.066 -6.044 577 HB1 ALA 70 1HB ALA 70 -17.635 -18.411 -7.236 578 HB2 ALA 70 2HB ALA 70 -17.185 -18.439 -5.530 579 HB3 ALA 70 3HB ALA 70 -18.879 -18.272 -5.993 580 H TYR 71 H TYR 71 -15.186 -16.407 -6.475 581 HA TYR 71 HA TYR 71 -14.772 -15.696 -3.658 582 HB2 TYR 71 2HB TYR 71 -13.021 -16.983 -5.735 583 HB3 TYR 71 3HB TYR 71 -12.327 -16.268 -4.284 584 HD1 TYR 71 HD1 TYR 71 -14.074 -16.998 -2.148 585 HD2 TYR 71 HD2 TYR 71 -12.979 -19.283 -5.565 586 HE1 TYR 71 HE1 TYR 71 -14.534 -19.068 -0.903 587 HE2 TYR 71 HE2 TYR 71 -13.438 -21.360 -4.331 588 HH TYR 71 HH TYR 71 -14.712 -22.127 -2.426 589 H GLY 72 H GLY 72 -15.599 -13.821 -5.811 590 HA2 GLY 72 2HA GLY 72 -13.236 -12.056 -5.858 591 HA3 GLY 72 3HA GLY 72 -14.566 -11.982 -7.004 592 H SER 73 H SER 73 -13.403 -9.891 -5.282 593 HA SER 73 HA SER 73 -15.426 -9.343 -3.289 594 HB2 SER 73 2HB SER 73 -14.056 -7.610 -2.559 595 HB3 SER 73 3HB SER 73 -12.877 -8.736 -3.232 596 HG SER 73 HG SER 73 -13.115 -6.260 -3.876 Start of MODEL 14 1 H1 HIS 1 H HIS 1 -4.131 -5.457 3.357 2 HA HIS 1 HA HIS 1 -4.582 -5.738 0.458 3 HB2 HIS 1 2HB HIS 1 -6.869 -6.638 1.133 4 HB3 HIS 1 3HB HIS 1 -5.494 -7.701 1.419 5 HD1 HIS 1 HD1 HIS 1 -7.470 -5.125 3.415 6 HD2 HIS 1 HD2 HIS 1 -5.531 -8.768 3.895 7 HE1 HIS 1 HE1 HIS 1 -7.866 -5.787 5.809 8 H MET 2 H MET 2 -4.069 -3.264 1.331 9 HA MET 2 HA MET 2 -6.488 -1.895 2.110 10 HB2 MET 2 2HB MET 2 -3.683 -1.033 1.480 11 HB3 MET 2 3HB MET 2 -4.971 0.156 1.608 12 HG2 MET 2 2HG MET 2 -4.408 -1.827 3.785 13 HG3 MET 2 3HG MET 2 -3.571 -0.280 3.677 14 HE1 MET 2 1HE MET 2 -4.544 -0.824 6.080 15 HE2 MET 2 2HE MET 2 -4.876 0.901 6.241 16 HE3 MET 2 3HE MET 2 -6.132 -0.278 6.622 17 H LEU 3 H LEU 3 -4.297 -1.456 -0.675 18 HA LEU 3 HA LEU 3 -6.151 -0.021 -2.223 19 HB2 LEU 3 2HB LEU 3 -3.588 -1.433 -2.757 20 HB3 LEU 3 3HB LEU 3 -4.582 -0.959 -4.132 21 HG LEU 3 HG LEU 3 -2.850 0.690 -3.691 22 HD11 LEU 3 1HD1 LEU 3 -4.195 2.615 -3.803 23 HD12 LEU 3 2HD1 LEU 3 -5.478 1.874 -2.847 24 HD13 LEU 3 3HD1 LEU 3 -5.173 1.320 -4.493 25 HD21 LEU 3 1HD2 LEU 3 -2.547 1.792 -1.675 26 HD22 LEU 3 2HD2 LEU 3 -2.887 0.139 -1.163 27 HD23 LEU 3 3HD2 LEU 3 -4.153 1.365 -1.083 28 H ALA 4 H ALA 4 -7.643 -0.610 -3.720 29 HA ALA 4 HA ALA 4 -8.745 -3.222 -3.577 30 HB1 ALA 4 1HB ALA 4 -9.752 -1.933 -5.873 31 HB2 ALA 4 2HB ALA 4 -10.511 -2.083 -4.287 32 HB3 ALA 4 3HB ALA 4 -9.499 -0.685 -4.652 33 H LYS 5 H LYS 5 -8.593 -4.941 -4.929 34 HA LYS 5 HA LYS 5 -6.345 -5.033 -6.717 35 HB2 LYS 5 2HB LYS 5 -8.474 -7.117 -6.199 36 HB3 LYS 5 3HB LYS 5 -6.938 -7.384 -7.013 37 HG2 LYS 5 2HG LYS 5 -7.205 -6.486 -4.153 38 HG3 LYS 5 3HG LYS 5 -6.987 -8.162 -4.660 39 HD2 LYS 5 2HD LYS 5 -4.890 -7.394 -5.848 40 HD3 LYS 5 3HD LYS 5 -5.079 -5.857 -4.999 41 HE2 LYS 5 2HE LYS 5 -4.956 -8.518 -3.594 42 HE3 LYS 5 3HE LYS 5 -3.530 -7.532 -3.919 43 HZ1 LYS 5 1HZ LYS 5 -4.925 -5.704 -2.746 44 HZ2 LYS 5 2HZ LYS 5 -4.101 -6.855 -1.820 45 HZ3 LYS 5 3HZ LYS 5 -5.765 -7.015 -2.082 46 H GLU 6 H GLU 6 -6.880 -6.417 -8.852 47 HA GLU 6 HA GLU 6 -8.908 -4.841 -10.291 48 HB2 GLU 6 2HB GLU 6 -6.593 -6.307 -11.547 49 HB3 GLU 6 3HB GLU 6 -7.605 -5.063 -12.267 50 HG2 GLU 6 2HG GLU 6 -6.666 -3.550 -10.394 51 HG3 GLU 6 3HG GLU 6 -5.412 -4.782 -10.260 52 H ASP 7 H ASP 7 -9.920 -5.962 -12.166 53 HA ASP 7 HA ASP 7 -10.357 -8.817 -11.575 54 HB2 ASP 7 2HB ASP 7 -12.443 -6.999 -12.772 55 HB3 ASP 7 3HB ASP 7 -12.665 -8.598 -12.067 56 H TYR 8 H TYR 8 -10.884 -10.171 -13.378 57 HA TYR 8 HA TYR 8 -9.252 -9.799 -15.609 58 HB2 TYR 8 2HB TYR 8 -11.708 -11.554 -15.538 59 HB3 TYR 8 3HB TYR 8 -10.261 -11.774 -16.515 60 HD1 TYR 8 HD1 TYR 8 -11.794 -13.503 -14.248 61 HD2 TYR 8 HD2 TYR 8 -8.154 -11.311 -14.471 62 HE1 TYR 8 HE1 TYR 8 -10.833 -14.933 -12.493 63 HE2 TYR 8 HE2 TYR 8 -7.183 -12.736 -12.717 64 HH TYR 8 HH TYR 8 -7.567 -15.068 -11.817 65 H TYR 9 H TYR 9 -12.590 -8.926 -15.044 66 HA TYR 9 HA TYR 9 -13.516 -8.517 -17.611 67 HB2 TYR 9 2HB TYR 9 -14.084 -6.748 -15.224 68 HB3 TYR 9 3HB TYR 9 -15.088 -6.922 -16.660 69 HD1 TYR 9 HD1 TYR 9 -14.248 -8.276 -13.421 70 HD2 TYR 9 HD2 TYR 9 -16.242 -9.105 -17.087 71 HE1 TYR 9 HE1 TYR 9 -15.470 -10.114 -12.335 72 HE2 TYR 9 HE2 TYR 9 -17.470 -10.944 -16.011 73 HH TYR 9 HH TYR 9 -17.914 -11.305 -12.935 74 H GLN 10 H GLN 10 -11.677 -6.274 -15.564 75 HA GLN 10 HA GLN 10 -11.604 -4.206 -17.530 76 HB2 GLN 10 2HB GLN 10 -9.974 -4.648 -15.026 77 HB3 GLN 10 3HB GLN 10 -9.876 -3.202 -16.022 78 HG2 GLN 10 2HG GLN 10 -11.342 -2.491 -14.440 79 HG3 GLN 10 3HG GLN 10 -12.472 -3.149 -15.623 80 HE21 GLN 10 1HE2 GLN 10 -14.014 -4.326 -14.771 81 HE22 GLN 10 2HE2 GLN 10 -13.899 -5.288 -13.340 82 H ILE 11 H ILE 11 -9.392 -6.767 -16.527 83 HA ILE 11 HA ILE 11 -7.151 -5.987 -18.008 84 HB ILE 11 HB ILE 11 -8.032 -8.797 -17.333 85 HG12 ILE 11 2HG1 ILE 11 -6.067 -7.047 -15.851 86 HG13 ILE 11 3HG1 ILE 11 -7.769 -7.157 -15.414 87 HG21 ILE 11 1HG2 ILE 11 -6.373 -9.134 -18.890 88 HG22 ILE 11 2HG2 ILE 11 -5.517 -7.655 -18.457 89 HG23 ILE 11 3HG2 ILE 11 -5.433 -9.064 -17.400 90 HD11 ILE 11 1HD1 ILE 11 -5.762 -8.722 -14.428 91 HD12 ILE 11 2HD1 ILE 11 -7.483 -9.107 -14.379 92 HD13 ILE 11 3HD1 ILE 11 -6.471 -9.751 -15.672 93 H LEU 12 H LEU 12 -10.133 -7.428 -18.998 94 HA LEU 12 HA LEU 12 -9.037 -7.985 -21.668 95 HB2 LEU 12 2HB LEU 12 -11.293 -9.079 -20.085 96 HB3 LEU 12 3HB LEU 12 -11.493 -9.000 -21.834 97 HG LEU 12 HG LEU 12 -9.231 -10.426 -20.439 98 HD11 LEU 12 1HD1 LEU 12 -10.843 -12.284 -21.717 99 HD12 LEU 12 2HD1 LEU 12 -11.976 -11.209 -20.898 100 HD13 LEU 12 3HD1 LEU 12 -10.708 -12.020 -19.978 101 HD21 LEU 12 1HD2 LEU 12 -8.363 -10.154 -22.506 102 HD22 LEU 12 2HD2 LEU 12 -9.937 -9.874 -23.251 103 HD23 LEU 12 3HD2 LEU 12 -9.413 -11.519 -22.885 104 H GLY 13 H GLY 13 -10.917 -5.765 -19.925 105 HA2 GLY 13 2HA GLY 13 -11.835 -3.769 -20.655 106 HA3 GLY 13 3HA GLY 13 -11.435 -4.229 -22.303 107 H VAL 14 H VAL 14 -13.247 -6.425 -20.337 108 HA VAL 14 HA VAL 14 -15.641 -5.817 -21.943 109 HB VAL 14 HB VAL 14 -16.337 -8.130 -21.607 110 HG11 VAL 14 1HG1 VAL 14 -14.840 -9.148 -23.114 111 HG12 VAL 14 2HG1 VAL 14 -14.773 -7.423 -23.483 112 HG13 VAL 14 3HG1 VAL 14 -13.482 -8.177 -22.546 113 HG21 VAL 14 1HG2 VAL 14 -13.716 -8.483 -20.155 114 HG22 VAL 14 2HG2 VAL 14 -15.312 -8.477 -19.405 115 HG23 VAL 14 3HG2 VAL 14 -14.874 -9.757 -20.537 116 HA PRO 15 HA PRO 15 -17.916 -4.798 -18.327 117 HB2 PRO 15 2HB PRO 15 -20.400 -5.634 -19.035 118 HB3 PRO 15 3HB PRO 15 -19.634 -4.200 -19.729 119 HG2 PRO 15 2HG PRO 15 -19.852 -6.964 -20.857 120 HG3 PRO 15 3HG PRO 15 -20.074 -5.404 -21.669 121 HD2 PRO 15 2HD PRO 15 -17.789 -6.842 -21.877 122 HD3 PRO 15 3HD PRO 15 -17.807 -5.067 -21.917 123 H ARG 16 H ARG 16 -19.564 -5.773 -16.757 124 HA ARG 16 HA ARG 16 -18.536 -8.310 -15.874 125 HB2 ARG 16 2HB ARG 16 -20.718 -6.541 -14.756 126 HB3 ARG 16 3HB ARG 16 -20.106 -7.990 -13.970 127 HG2 ARG 16 2HG ARG 16 -18.104 -7.013 -13.415 128 HG3 ARG 16 3HG ARG 16 -18.197 -5.833 -14.724 129 HD2 ARG 16 2HD ARG 16 -19.774 -4.521 -13.566 130 HD3 ARG 16 3HD ARG 16 -20.109 -5.807 -12.408 131 HE ARG 16 HE ARG 16 -18.355 -5.061 -11.159 132 HH11 ARG 16 1HH1 ARG 16 -17.977 -3.890 -14.416 133 HH12 ARG 16 2HH1 ARG 16 -16.592 -2.918 -14.044 134 HH21 ARG 16 1HH2 ARG 16 -16.532 -3.785 -10.657 135 HH22 ARG 16 2HH2 ARG 16 -15.770 -2.860 -11.906 136 H ASN 17 H ASN 17 -20.928 -7.408 -18.016 137 HA ASN 17 HA ASN 17 -22.443 -9.893 -17.553 138 HB2 ASN 17 2HB ASN 17 -23.258 -7.200 -18.581 139 HB3 ASN 17 3HB ASN 17 -24.145 -8.628 -19.107 140 HD21 ASN 17 1HD2 ASN 17 -24.964 -6.350 -17.444 141 HD22 ASN 17 2HD2 ASN 17 -25.539 -7.036 -15.966 142 H ALA 18 H ALA 18 -20.004 -8.805 -19.347 143 HA ALA 18 HA ALA 18 -20.607 -9.231 -22.014 144 HB1 ALA 18 1HB ALA 18 -17.994 -10.226 -21.011 145 HB2 ALA 18 2HB ALA 18 -18.359 -9.197 -22.396 146 HB3 ALA 18 3HB ALA 18 -18.384 -8.523 -20.767 147 H SER 19 H SER 19 -20.078 -11.068 -23.403 148 HA SER 19 HA SER 19 -20.771 -13.609 -22.092 149 HB2 SER 19 2HB SER 19 -21.284 -14.223 -24.601 150 HB3 SER 19 3HB SER 19 -22.442 -13.279 -23.664 151 HG SER 19 HG SER 19 -22.237 -12.020 -25.369 152 H GLN 20 H GLN 20 -19.903 -15.579 -23.277 153 HA GLN 20 HA GLN 20 -17.091 -15.531 -23.202 154 HB2 GLN 20 2HB GLN 20 -18.731 -17.645 -24.586 155 HB3 GLN 20 3HB GLN 20 -17.170 -17.828 -23.797 156 HG2 GLN 20 2HG GLN 20 -19.874 -17.501 -22.556 157 HG3 GLN 20 3HG GLN 20 -18.694 -18.790 -22.323 158 HE21 GLN 20 1HE2 GLN 20 -16.815 -18.345 -21.082 159 HE22 GLN 20 2HE2 GLN 20 -16.818 -17.083 -19.902 160 H LYS 21 H LYS 21 -19.361 -14.998 -25.764 161 HA LYS 21 HA LYS 21 -17.482 -15.404 -27.901 162 HB2 LYS 21 2HB LYS 21 -19.262 -14.437 -29.325 163 HB3 LYS 21 3HB LYS 21 -19.840 -15.761 -28.321 164 HG2 LYS 21 2HG LYS 21 -21.523 -14.363 -27.855 165 HG3 LYS 21 3HG LYS 21 -20.375 -13.640 -26.725 166 HD2 LYS 21 2HD LYS 21 -21.001 -11.762 -27.857 167 HD3 LYS 21 3HD LYS 21 -19.674 -12.284 -28.897 168 HE2 LYS 21 2HE LYS 21 -21.587 -13.636 -30.095 169 HE3 LYS 21 3HE LYS 21 -22.616 -12.412 -29.352 170 HZ1 LYS 21 1HZ LYS 21 -21.948 -10.891 -30.809 171 HZ2 LYS 21 2HZ LYS 21 -21.278 -12.158 -31.708 172 HZ3 LYS 21 3HZ LYS 21 -20.313 -11.287 -30.625 173 H GLU 22 H GLU 22 -18.807 -12.628 -26.161 174 HA GLU 22 HA GLU 22 -17.567 -10.650 -27.773 175 HB2 GLU 22 2HB GLU 22 -19.484 -10.106 -26.383 176 HB3 GLU 22 3HB GLU 22 -18.585 -10.523 -24.931 177 HG2 GLU 22 2HG GLU 22 -17.198 -8.643 -25.114 178 HG3 GLU 22 3HG GLU 22 -17.681 -8.347 -26.783 179 H ILE 23 H ILE 23 -16.582 -12.419 -24.905 180 HA ILE 23 HA ILE 23 -14.338 -10.863 -24.223 181 HB ILE 23 HB ILE 23 -14.814 -13.812 -23.773 182 HG12 ILE 23 2HG1 ILE 23 -15.038 -11.756 -21.627 183 HG13 ILE 23 3HG1 ILE 23 -16.344 -11.856 -22.803 184 HG21 ILE 23 1HG2 ILE 23 -12.508 -12.170 -23.284 185 HG22 ILE 23 2HG2 ILE 23 -13.174 -12.762 -21.762 186 HG23 ILE 23 3HG2 ILE 23 -12.723 -13.902 -23.030 187 HD11 ILE 23 1HD1 ILE 23 -15.777 -13.539 -20.548 188 HD12 ILE 23 2HD1 ILE 23 -17.215 -13.469 -21.569 189 HD13 ILE 23 3HD1 ILE 23 -15.852 -14.487 -22.034 190 H LYS 24 H LYS 24 -14.791 -13.471 -26.528 191 HA LYS 24 HA LYS 24 -12.083 -14.019 -27.060 192 HB2 LYS 24 2HB LYS 24 -14.650 -14.447 -28.534 193 HB3 LYS 24 3HB LYS 24 -13.129 -14.707 -29.379 194 HG2 LYS 24 2HG LYS 24 -12.476 -16.401 -27.830 195 HG3 LYS 24 3HG LYS 24 -13.847 -16.040 -26.779 196 HD2 LYS 24 2HD LYS 24 -14.688 -17.851 -27.889 197 HD3 LYS 24 3HD LYS 24 -15.211 -16.571 -28.986 198 HE2 LYS 24 2HE LYS 24 -12.554 -17.893 -29.365 199 HE3 LYS 24 3HE LYS 24 -14.025 -18.679 -29.938 200 HZ1 LYS 24 1HZ LYS 24 -13.790 -17.448 -31.755 201 HZ2 LYS 24 2HZ LYS 24 -12.599 -16.473 -31.055 202 HZ3 LYS 24 3HZ LYS 24 -14.234 -16.104 -30.828 203 H LYS 25 H LYS 25 -14.330 -11.668 -28.426 204 HA LYS 25 HA LYS 25 -12.604 -10.763 -30.490 205 HB2 LYS 25 2HB LYS 25 -14.945 -9.405 -29.144 206 HB3 LYS 25 3HB LYS 25 -14.146 -8.810 -30.593 207 HG2 LYS 25 2HG LYS 25 -14.923 -10.591 -31.893 208 HG3 LYS 25 3HG LYS 25 -15.343 -11.556 -30.476 209 HD2 LYS 25 2HD LYS 25 -17.357 -10.681 -31.484 210 HD3 LYS 25 3HD LYS 25 -17.099 -9.907 -29.918 211 HE2 LYS 25 2HE LYS 25 -16.346 -7.906 -30.928 212 HE3 LYS 25 3HE LYS 25 -16.183 -8.677 -32.505 213 HZ1 LYS 25 1HZ LYS 25 -18.801 -8.445 -31.151 214 HZ2 LYS 25 2HZ LYS 25 -18.486 -8.743 -32.786 215 HZ3 LYS 25 3HZ LYS 25 -18.198 -7.208 -32.135 216 H ALA 26 H ALA 26 -13.365 -9.492 -27.258 217 HA ALA 26 HA ALA 26 -11.631 -7.266 -27.405 218 HB1 ALA 26 1HB ALA 26 -12.505 -8.683 -24.895 219 HB2 ALA 26 2HB ALA 26 -12.009 -6.999 -25.066 220 HB3 ALA 26 3HB ALA 26 -13.521 -7.551 -25.789 221 H TYR 27 H TYR 27 -11.146 -10.612 -26.527 222 HA TYR 27 HA TYR 27 -8.616 -10.253 -25.267 223 HB2 TYR 27 2HB TYR 27 -9.849 -12.227 -24.731 224 HB3 TYR 27 3HB TYR 27 -9.996 -12.674 -26.427 225 HD1 TYR 27 HD1 TYR 27 -7.222 -11.856 -24.048 226 HD2 TYR 27 HD2 TYR 27 -8.697 -14.456 -27.075 227 HE1 TYR 27 HE1 TYR 27 -5.186 -13.223 -23.858 228 HE2 TYR 27 HE2 TYR 27 -6.666 -15.830 -26.894 229 HH TYR 27 HH TYR 27 -4.298 -15.524 -26.135 230 H TYR 28 H TYR 28 -9.675 -10.862 -28.554 231 HA TYR 28 HA TYR 28 -7.075 -11.450 -29.582 232 HB2 TYR 28 2HB TYR 28 -9.055 -12.266 -30.732 233 HB3 TYR 28 3HB TYR 28 -9.625 -10.620 -30.982 234 HD1 TYR 28 HD1 TYR 28 -9.395 -9.843 -33.132 235 HD2 TYR 28 HD2 TYR 28 -6.467 -12.531 -31.613 236 HE1 TYR 28 HE1 TYR 28 -8.206 -9.755 -35.284 237 HE2 TYR 28 HE2 TYR 28 -5.269 -12.449 -33.760 238 HH TYR 28 HH TYR 28 -5.881 -10.134 -36.119 239 H GLN 29 H GLN 29 -9.172 -8.581 -29.667 240 HA GLN 29 HA GLN 29 -7.442 -6.930 -31.129 241 HB2 GLN 29 2HB GLN 29 -8.830 -5.129 -30.497 242 HB3 GLN 29 3HB GLN 29 -9.892 -6.529 -30.566 243 HG2 GLN 29 2HG GLN 29 -9.865 -6.732 -28.172 244 HG3 GLN 29 3HG GLN 29 -8.672 -5.440 -28.041 245 HE21 GLN 29 1HE2 GLN 29 -9.548 -3.480 -29.562 246 HE22 GLN 29 2HE2 GLN 29 -11.115 -2.937 -29.079 247 H LEU 30 H LEU 30 -7.590 -7.703 -27.714 248 HA LEU 30 HA LEU 30 -5.781 -5.660 -26.876 249 HB2 LEU 30 2HB LEU 30 -7.310 -7.784 -25.667 250 HB3 LEU 30 3HB LEU 30 -5.672 -7.745 -25.017 251 HG LEU 30 HG LEU 30 -5.960 -5.499 -24.243 252 HD11 LEU 30 1HD1 LEU 30 -8.520 -4.702 -24.567 253 HD12 LEU 30 2HD1 LEU 30 -8.241 -5.535 -26.097 254 HD13 LEU 30 3HD1 LEU 30 -7.187 -4.207 -25.612 255 HD21 LEU 30 1HD2 LEU 30 -8.315 -5.937 -23.002 256 HD22 LEU 30 2HD2 LEU 30 -6.792 -6.682 -22.515 257 HD23 LEU 30 3HD2 LEU 30 -7.925 -7.574 -23.532 258 H ALA 31 H ALA 31 -5.460 -9.089 -27.680 259 HA ALA 31 HA ALA 31 -2.800 -9.463 -26.937 260 HB1 ALA 31 1HB ALA 31 -4.691 -10.807 -28.760 261 HB2 ALA 31 2HB ALA 31 -2.978 -11.125 -29.037 262 HB3 ALA 31 3HB ALA 31 -3.695 -11.469 -27.463 263 H LYS 32 H LYS 32 -4.170 -8.276 -29.980 264 HA LYS 32 HA LYS 32 -1.810 -8.143 -31.467 265 HB2 LYS 32 2HB LYS 32 -4.362 -6.547 -31.575 266 HB3 LYS 32 3HB LYS 32 -3.045 -6.268 -32.707 267 HG2 LYS 32 2HG LYS 32 -3.439 -8.176 -33.848 268 HG3 LYS 32 3HG LYS 32 -3.945 -9.063 -32.409 269 HD2 LYS 32 2HD LYS 32 -5.816 -8.748 -33.941 270 HD3 LYS 32 3HD LYS 32 -6.086 -7.875 -32.431 271 HE2 LYS 32 2HE LYS 32 -6.707 -6.564 -34.432 272 HE3 LYS 32 3HE LYS 32 -5.447 -5.795 -33.468 273 HZ1 LYS 32 1HZ LYS 32 -3.804 -6.451 -35.020 274 HZ2 LYS 32 2HZ LYS 32 -5.067 -5.774 -35.919 275 HZ3 LYS 32 3HZ LYS 32 -4.878 -7.454 -35.859 276 H LYS 33 H LYS 33 -2.910 -6.213 -28.845 277 HA LYS 33 HA LYS 33 -1.318 -3.900 -29.435 278 HB2 LYS 33 2HB LYS 33 -2.428 -4.677 -26.740 279 HB3 LYS 33 3HB LYS 33 -2.027 -3.065 -27.317 280 HG2 LYS 33 2HG LYS 33 -3.848 -3.504 -29.097 281 HG3 LYS 33 3HG LYS 33 -4.374 -4.784 -28.002 282 HD2 LYS 33 2HD LYS 33 -5.634 -3.061 -27.194 283 HD3 LYS 33 3HD LYS 33 -4.180 -2.832 -26.220 284 HE2 LYS 33 2HE LYS 33 -4.925 -0.712 -27.132 285 HE3 LYS 33 3HE LYS 33 -3.377 -1.169 -27.839 286 HZ1 LYS 33 1HZ LYS 33 -5.371 -0.327 -29.308 287 HZ2 LYS 33 2HZ LYS 33 -5.807 -1.961 -29.258 288 HZ3 LYS 33 3HZ LYS 33 -4.297 -1.507 -29.872 289 H TYR 34 H TYR 34 -0.941 -6.805 -27.485 290 HA TYR 34 HA TYR 34 1.798 -5.950 -26.820 291 HB2 TYR 34 2HB TYR 34 0.108 -8.033 -25.422 292 HB3 TYR 34 3HB TYR 34 1.701 -7.474 -24.923 293 HD1 TYR 34 HD1 TYR 34 1.954 -5.507 -23.626 294 HD2 TYR 34 HD2 TYR 34 -1.836 -6.455 -25.311 295 HE1 TYR 34 HE1 TYR 34 0.912 -3.749 -22.257 296 HE2 TYR 34 HE2 TYR 34 -2.888 -4.699 -23.948 297 HH TYR 34 HH TYR 34 -2.528 -3.401 -22.020 298 H HIS 35 H HIS 35 0.804 -7.248 -29.307 299 HA HIS 35 HA HIS 35 1.445 -9.953 -29.438 300 HB2 HIS 35 2HB HIS 35 1.021 -7.780 -31.322 301 HB3 HIS 35 3HB HIS 35 2.247 -8.907 -31.894 302 HD1 HIS 35 HD1 HIS 35 0.565 -9.639 -33.771 303 HD2 HIS 35 HD2 HIS 35 -0.663 -10.476 -29.891 304 HE1 HIS 35 HE1 HIS 35 -1.334 -11.271 -34.004 305 HA PRO 36 HA PRO 36 5.810 -10.291 -29.173 306 HB2 PRO 36 2HB PRO 36 6.366 -12.170 -31.052 307 HB3 PRO 36 3HB PRO 36 5.561 -12.548 -29.524 308 HG2 PRO 36 2HG PRO 36 4.371 -12.127 -32.238 309 HG3 PRO 36 3HG PRO 36 3.983 -13.361 -31.026 310 HD2 PRO 36 2HD PRO 36 2.468 -11.146 -31.386 311 HD3 PRO 36 3HD PRO 36 2.661 -11.923 -29.802 312 H ASP 37 H ASP 37 4.395 -9.491 -32.247 313 HA ASP 37 HA ASP 37 6.724 -9.029 -33.744 314 HB2 ASP 37 2HB ASP 37 4.405 -9.144 -34.671 315 HB3 ASP 37 3HB ASP 37 4.095 -7.553 -33.980 316 H THR 38 H THR 38 5.277 -7.255 -31.177 317 HA THR 38 HA THR 38 7.019 -4.947 -31.735 318 HB THR 38 HB THR 38 5.566 -3.565 -30.466 319 HG1 THR 38 HG1 THR 38 4.742 -5.985 -29.398 320 HG21 THR 38 1HG2 THR 38 3.983 -3.441 -32.042 321 HG22 THR 38 2HG2 THR 38 3.330 -5.022 -31.614 322 HG23 THR 38 3HG2 THR 38 4.691 -4.902 -32.729 323 H ASN 39 H ASN 39 7.222 -7.686 -30.128 324 HA ASN 39 HA ASN 39 8.066 -6.653 -27.544 325 HB2 ASN 39 2HB ASN 39 7.563 -9.350 -28.702 326 HB3 ASN 39 3HB ASN 39 8.720 -9.240 -27.378 327 HD21 ASN 39 1HD2 ASN 39 5.753 -7.417 -27.993 328 HD22 ASN 39 2HD2 ASN 39 4.958 -7.881 -26.531 329 H LYS 40 H LYS 40 9.428 -6.799 -30.510 330 HA LYS 40 HA LYS 40 11.959 -7.915 -30.134 331 HB2 LYS 40 2HB LYS 40 10.676 -6.140 -32.059 332 HB3 LYS 40 3HB LYS 40 12.382 -5.772 -31.843 333 HG2 LYS 40 2HG LYS 40 12.531 -7.308 -33.509 334 HG3 LYS 40 3HG LYS 40 12.622 -8.386 -32.114 335 HD2 LYS 40 2HD LYS 40 9.921 -7.747 -33.150 336 HD3 LYS 40 3HD LYS 40 10.937 -8.788 -34.150 337 HE2 LYS 40 2HE LYS 40 10.882 -9.460 -31.287 338 HE3 LYS 40 3HE LYS 40 9.349 -9.664 -32.134 339 HZ1 LYS 40 1HZ LYS 40 10.855 -10.869 -33.863 340 HZ2 LYS 40 2HZ LYS 40 10.326 -11.686 -32.480 341 HZ3 LYS 40 3HZ LYS 40 11.897 -11.062 -32.544 342 H ASP 41 H ASP 41 10.755 -4.666 -29.445 343 HA ASP 41 HA ASP 41 13.280 -4.114 -28.027 344 HB2 ASP 41 2HB ASP 41 12.665 -1.668 -28.406 345 HB3 ASP 41 3HB ASP 41 13.184 -2.575 -29.824 346 H ASP 42 H ASP 42 10.474 -5.232 -27.297 347 HA ASP 42 HA ASP 42 10.212 -3.615 -24.860 348 HB2 ASP 42 2HB ASP 42 8.394 -3.312 -26.785 349 HB3 ASP 42 3HB ASP 42 7.729 -4.763 -26.039 350 HA PRO 43 HA PRO 43 10.703 -8.078 -23.822 351 HB2 PRO 43 2HB PRO 43 12.279 -7.621 -21.659 352 HB3 PRO 43 3HB PRO 43 12.915 -7.733 -23.304 353 HG2 PRO 43 2HG PRO 43 12.291 -5.299 -21.677 354 HG3 PRO 43 3HG PRO 43 13.694 -5.624 -22.712 355 HD2 PRO 43 2HD PRO 43 11.611 -4.093 -23.519 356 HD3 PRO 43 3HD PRO 43 12.550 -5.097 -24.643 357 H LYS 44 H LYS 44 9.317 -5.346 -22.390 358 HA LYS 44 HA LYS 44 8.404 -6.766 -20.010 359 HB2 LYS 44 2HB LYS 44 8.653 -3.962 -20.825 360 HB3 LYS 44 3HB LYS 44 7.147 -4.318 -19.988 361 HG2 LYS 44 2HG LYS 44 9.664 -5.336 -18.794 362 HG3 LYS 44 3HG LYS 44 9.340 -3.604 -18.698 363 HD2 LYS 44 2HD LYS 44 8.253 -4.217 -16.808 364 HD3 LYS 44 3HD LYS 44 6.943 -4.547 -17.945 365 HE2 LYS 44 2HE LYS 44 7.217 -6.420 -16.438 366 HE3 LYS 44 3HE LYS 44 7.681 -6.894 -18.072 367 HZ1 LYS 44 1HZ LYS 44 9.853 -5.880 -16.467 368 HZ2 LYS 44 2HZ LYS 44 9.783 -7.255 -17.449 369 HZ3 LYS 44 3HZ LYS 44 9.171 -7.310 -15.873 370 H ALA 45 H ALA 45 7.321 -5.861 -23.154 371 HA ALA 45 HA ALA 45 4.552 -5.793 -22.789 372 HB1 ALA 45 1HB ALA 45 5.395 -5.052 -24.860 373 HB2 ALA 45 2HB ALA 45 6.242 -6.572 -25.150 374 HB3 ALA 45 3HB ALA 45 4.480 -6.517 -25.218 375 H LYS 46 H LYS 46 6.737 -8.519 -23.326 376 HA LYS 46 HA LYS 46 4.852 -10.532 -23.715 377 HB2 LYS 46 2HB LYS 46 6.581 -12.087 -23.161 378 HB3 LYS 46 3HB LYS 46 7.339 -10.737 -23.997 379 HG2 LYS 46 2HG LYS 46 7.926 -9.805 -21.737 380 HG3 LYS 46 3HG LYS 46 7.385 -11.340 -21.052 381 HD2 LYS 46 2HD LYS 46 9.762 -11.443 -21.337 382 HD3 LYS 46 3HD LYS 46 9.018 -12.498 -22.541 383 HE2 LYS 46 2HE LYS 46 9.600 -11.143 -24.287 384 HE3 LYS 46 3HE LYS 46 9.567 -9.680 -23.305 385 HZ1 LYS 46 1HZ LYS 46 11.746 -9.827 -23.061 386 HZ2 LYS 46 2HZ LYS 46 11.782 -11.213 -24.029 387 HZ3 LYS 46 3HZ LYS 46 11.603 -11.357 -22.353 388 H GLU 47 H GLU 47 5.979 -9.004 -20.769 389 HA GLU 47 HA GLU 47 4.796 -10.902 -18.992 390 HB2 GLU 47 2HB GLU 47 6.002 -8.178 -18.692 391 HB3 GLU 47 3HB GLU 47 5.076 -8.863 -17.364 392 HG2 GLU 47 2HG GLU 47 7.250 -10.466 -18.624 393 HG3 GLU 47 3HG GLU 47 7.653 -9.188 -17.478 394 H LYS 48 H LYS 48 3.814 -7.771 -20.306 395 HA LYS 48 HA LYS 48 1.424 -7.554 -18.790 396 HB2 LYS 48 2HB LYS 48 1.980 -6.286 -21.473 397 HB3 LYS 48 3HB LYS 48 0.861 -5.724 -20.238 398 HG2 LYS 48 2HG LYS 48 3.848 -5.855 -19.890 399 HG3 LYS 48 3HG LYS 48 2.955 -4.410 -20.371 400 HD2 LYS 48 2HD LYS 48 1.978 -4.161 -18.296 401 HD3 LYS 48 3HD LYS 48 2.153 -5.871 -17.893 402 HE2 LYS 48 2HE LYS 48 4.623 -4.267 -18.290 403 HE3 LYS 48 3HE LYS 48 3.696 -4.003 -16.814 404 HZ1 LYS 48 1HZ LYS 48 5.387 -6.189 -17.521 405 HZ2 LYS 48 2HZ LYS 48 3.849 -6.723 -17.059 406 HZ3 LYS 48 3HZ LYS 48 4.761 -5.760 -16.008 407 H PHE 49 H PHE 49 2.198 -8.917 -21.943 408 HA PHE 49 HA PHE 49 -0.420 -9.327 -22.862 409 HB2 PHE 49 2HB PHE 49 1.374 -9.535 -24.420 410 HB3 PHE 49 3HB PHE 49 2.164 -10.770 -23.447 411 HD1 PHE 49 HD1 PHE 49 -0.469 -10.071 -25.862 412 HD2 PHE 49 HD2 PHE 49 1.335 -13.057 -23.423 413 HE1 PHE 49 HE1 PHE 49 -1.618 -11.819 -27.157 414 HE2 PHE 49 HE2 PHE 49 0.189 -14.809 -24.715 415 HZ PHE 49 HZ PHE 49 -1.291 -14.191 -26.584 416 H SER 50 H SER 50 1.595 -11.155 -20.666 417 HA SER 50 HA SER 50 0.203 -13.582 -20.663 418 HB2 SER 50 2HB SER 50 2.448 -12.882 -19.503 419 HB3 SER 50 3HB SER 50 1.402 -12.491 -18.138 420 HG SER 50 HG SER 50 1.666 -14.551 -17.736 421 H GLN 51 H GLN 51 -0.452 -10.540 -19.063 422 HA GLN 51 HA GLN 51 -2.381 -11.480 -17.225 423 HB2 GLN 51 2HB GLN 51 -1.890 -8.766 -18.443 424 HB3 GLN 51 3HB GLN 51 -3.144 -9.054 -17.244 425 HG2 GLN 51 2HG GLN 51 -0.304 -9.816 -16.703 426 HG3 GLN 51 3HG GLN 51 -0.860 -8.159 -16.475 427 HE21 GLN 51 1HE2 GLN 51 -2.984 -8.044 -15.199 428 HE22 GLN 51 2HE2 GLN 51 -3.053 -9.018 -13.774 429 H LEU 52 H LEU 52 -2.518 -10.660 -20.604 430 HA LEU 52 HA LEU 52 -5.341 -10.376 -20.791 431 HB2 LEU 52 2HB LEU 52 -3.430 -11.193 -22.971 432 HB3 LEU 52 3HB LEU 52 -5.028 -10.476 -23.169 433 HG LEU 52 HG LEU 52 -2.795 -8.997 -21.810 434 HD11 LEU 52 1HD1 LEU 52 -3.420 -8.506 -24.672 435 HD12 LEU 52 2HD1 LEU 52 -2.374 -9.866 -24.265 436 HD13 LEU 52 3HD1 LEU 52 -1.926 -8.233 -23.774 437 HD21 LEU 52 1HD2 LEU 52 -5.534 -8.487 -22.335 438 HD22 LEU 52 2HD2 LEU 52 -4.577 -7.390 -23.331 439 HD23 LEU 52 3HD2 LEU 52 -4.342 -7.426 -21.583 440 H ALA 53 H ALA 53 -3.144 -13.053 -21.632 441 HA ALA 53 HA ALA 53 -5.210 -14.872 -22.300 442 HB1 ALA 53 1HB ALA 53 -2.768 -16.132 -21.357 443 HB2 ALA 53 2HB ALA 53 -3.526 -16.181 -22.949 444 HB3 ALA 53 3HB ALA 53 -2.461 -14.842 -22.521 445 H GLU 54 H GLU 54 -3.547 -14.098 -19.308 446 HA GLU 54 HA GLU 54 -4.395 -16.324 -17.802 447 HB2 GLU 54 2HB GLU 54 -3.325 -13.616 -17.176 448 HB3 GLU 54 3HB GLU 54 -4.110 -14.503 -15.877 449 HG2 GLU 54 2HG GLU 54 -1.801 -15.510 -17.525 450 HG3 GLU 54 3HG GLU 54 -1.684 -14.829 -15.904 451 H ALA 55 H ALA 55 -5.742 -13.042 -18.077 452 HA ALA 55 HA ALA 55 -7.989 -13.590 -16.414 453 HB1 ALA 55 1HB ALA 55 -7.034 -11.336 -18.048 454 HB2 ALA 55 2HB ALA 55 -8.781 -11.429 -17.821 455 HB3 ALA 55 3HB ALA 55 -7.712 -11.355 -16.420 456 H TYR 56 H TYR 56 -7.403 -13.680 -19.883 457 HA TYR 56 HA TYR 56 -10.109 -14.000 -20.664 458 HB2 TYR 56 2HB TYR 56 -8.626 -13.276 -22.351 459 HB3 TYR 56 3HB TYR 56 -7.480 -14.570 -22.018 460 HD1 TYR 56 HD1 TYR 56 -10.667 -13.716 -23.633 461 HD2 TYR 56 HD2 TYR 56 -7.791 -16.776 -22.945 462 HE1 TYR 56 HE1 TYR 56 -11.692 -15.071 -25.411 463 HE2 TYR 56 HE2 TYR 56 -8.808 -18.139 -24.721 464 HH TYR 56 HH TYR 56 -11.836 -17.465 -26.049 465 H GLU 57 H GLU 57 -7.683 -16.180 -19.482 466 HA GLU 57 HA GLU 57 -8.670 -18.614 -20.440 467 HB2 GLU 57 2HB GLU 57 -6.943 -17.764 -18.184 468 HB3 GLU 57 3HB GLU 57 -7.659 -19.366 -18.064 469 HG2 GLU 57 2HG GLU 57 -6.499 -20.173 -19.874 470 HG3 GLU 57 3HG GLU 57 -6.273 -18.573 -20.578 471 H VAL 58 H VAL 58 -9.389 -16.901 -17.408 472 HA VAL 58 HA VAL 58 -11.332 -18.824 -16.561 473 HB VAL 58 HB VAL 58 -10.943 -15.996 -15.574 474 HG11 VAL 58 1HG1 VAL 58 -11.867 -17.975 -13.667 475 HG12 VAL 58 2HG1 VAL 58 -12.533 -16.389 -14.062 476 HG13 VAL 58 3HG1 VAL 58 -12.974 -17.797 -15.028 477 HG21 VAL 58 1HG2 VAL 58 -9.685 -18.584 -14.674 478 HG22 VAL 58 2HG2 VAL 58 -8.864 -17.180 -15.358 479 HG23 VAL 58 3HG2 VAL 58 -9.614 -17.074 -13.765 480 H LEU 59 H LEU 59 -11.472 -15.618 -18.057 481 HA LEU 59 HA LEU 59 -14.306 -15.426 -18.026 482 HB2 LEU 59 2HB LEU 59 -12.055 -13.901 -19.090 483 HB3 LEU 59 3HB LEU 59 -13.493 -13.830 -20.106 484 HG LEU 59 HG LEU 59 -14.785 -12.895 -18.307 485 HD11 LEU 59 1HD1 LEU 59 -13.704 -12.349 -16.139 486 HD12 LEU 59 2HD1 LEU 59 -12.312 -13.310 -16.636 487 HD13 LEU 59 3HD1 LEU 59 -13.885 -14.080 -16.427 488 HD21 LEU 59 1HD2 LEU 59 -12.105 -11.542 -18.589 489 HD22 LEU 59 2HD2 LEU 59 -13.562 -10.785 -17.946 490 HD23 LEU 59 3HD2 LEU 59 -13.513 -11.318 -19.627 491 H SER 60 H SER 60 -12.210 -17.326 -19.832 492 HA SER 60 HA SER 60 -13.624 -17.353 -22.314 493 HB2 SER 60 2HB SER 60 -11.343 -18.019 -22.399 494 HB3 SER 60 3HB SER 60 -11.557 -19.185 -21.094 495 HG SER 60 HG SER 60 -11.803 -20.527 -22.702 496 H ASP 61 H ASP 61 -14.291 -18.621 -19.272 497 HA ASP 61 HA ASP 61 -16.370 -20.347 -20.416 498 HB2 ASP 61 2HB ASP 61 -14.173 -21.498 -19.400 499 HB3 ASP 61 3HB ASP 61 -15.081 -21.282 -17.905 500 H GLU 62 H GLU 62 -18.317 -19.970 -19.575 501 HA GLU 62 HA GLU 62 -18.835 -17.894 -17.804 502 HB2 GLU 62 2HB GLU 62 -20.595 -20.298 -18.312 503 HB3 GLU 62 3HB GLU 62 -21.115 -18.735 -17.699 504 HG2 GLU 62 2HG GLU 62 -20.413 -17.705 -19.828 505 HG3 GLU 62 3HG GLU 62 -20.006 -19.308 -20.437 506 H VAL 63 H VAL 63 -18.574 -21.370 -17.183 507 HA VAL 63 HA VAL 63 -19.301 -21.301 -14.465 508 HB VAL 63 HB VAL 63 -17.389 -23.261 -15.734 509 HG11 VAL 63 1HG1 VAL 63 -17.537 -23.353 -13.288 510 HG12 VAL 63 2HG1 VAL 63 -19.287 -23.546 -13.406 511 HG13 VAL 63 3HG1 VAL 63 -18.216 -24.797 -14.038 512 HG21 VAL 63 1HG2 VAL 63 -19.065 -23.777 -17.118 513 HG22 VAL 63 2HG2 VAL 63 -19.873 -24.450 -15.702 514 HG23 VAL 63 3HG2 VAL 63 -20.223 -22.800 -16.215 515 H LYS 64 H LYS 64 -16.105 -21.230 -16.025 516 HA LYS 64 HA LYS 64 -14.589 -21.097 -13.663 517 HB2 LYS 64 2HB LYS 64 -14.018 -20.197 -16.484 518 HB3 LYS 64 3HB LYS 64 -12.827 -20.078 -15.195 519 HG2 LYS 64 2HG LYS 64 -13.431 -22.637 -14.898 520 HG3 LYS 64 3HG LYS 64 -13.880 -22.469 -16.597 521 HD2 LYS 64 2HD LYS 64 -11.599 -23.167 -16.521 522 HD3 LYS 64 3HD LYS 64 -11.619 -21.469 -17.004 523 HE2 LYS 64 2HE LYS 64 -10.982 -20.765 -14.815 524 HE3 LYS 64 3HE LYS 64 -11.207 -22.388 -14.165 525 HZ1 LYS 64 1HZ LYS 64 -8.852 -21.394 -14.947 526 HZ2 LYS 64 2HZ LYS 64 -9.328 -22.195 -16.358 527 HZ3 LYS 64 3HZ LYS 64 -9.210 -23.047 -14.901 528 H ARG 65 H ARG 65 -15.789 -18.525 -15.803 529 HA ARG 65 HA ARG 65 -14.670 -16.359 -14.432 530 HB2 ARG 65 2HB ARG 65 -15.596 -16.095 -16.653 531 HB3 ARG 65 3HB ARG 65 -17.200 -16.525 -16.075 532 HG2 ARG 65 2HG ARG 65 -17.118 -14.493 -14.612 533 HG3 ARG 65 3HG ARG 65 -15.632 -14.039 -15.449 534 HD2 ARG 65 2HD ARG 65 -17.492 -12.892 -16.460 535 HD3 ARG 65 3HD ARG 65 -16.869 -14.094 -17.589 536 HE ARG 65 HE ARG 65 -18.850 -15.430 -16.354 537 HH11 ARG 65 1HH1 ARG 65 -18.712 -12.294 -17.860 538 HH12 ARG 65 2HH1 ARG 65 -20.376 -12.308 -18.342 539 HH21 ARG 65 1HH2 ARG 65 -21.042 -15.461 -16.984 540 HH22 ARG 65 2HH2 ARG 65 -21.701 -14.109 -17.843 541 H LYS 66 H LYS 66 -17.870 -17.869 -14.102 542 HA LYS 66 HA LYS 66 -18.809 -16.153 -12.071 543 HB2 LYS 66 2HB LYS 66 -19.590 -18.959 -12.860 544 HB3 LYS 66 3HB LYS 66 -20.430 -18.048 -11.612 545 HG2 LYS 66 2HG LYS 66 -20.123 -17.134 -14.463 546 HG3 LYS 66 3HG LYS 66 -21.535 -17.981 -13.828 547 HD2 LYS 66 2HD LYS 66 -21.928 -16.176 -12.244 548 HD3 LYS 66 3HD LYS 66 -20.480 -15.342 -12.810 549 HE2 LYS 66 2HE LYS 66 -22.612 -14.455 -13.753 550 HE3 LYS 66 3HE LYS 66 -21.447 -14.982 -14.966 551 HZ1 LYS 66 1HZ LYS 66 -23.295 -17.031 -14.127 552 HZ2 LYS 66 2HZ LYS 66 -22.809 -16.584 -15.684 553 HZ3 LYS 66 3HZ LYS 66 -24.033 -15.719 -14.899 554 H GLN 67 H GLN 67 -17.150 -19.279 -11.962 555 HA GLN 67 HA GLN 67 -17.300 -19.685 -9.191 556 HB2 GLN 67 2HB GLN 67 -15.463 -20.667 -11.346 557 HB3 GLN 67 3HB GLN 67 -15.106 -21.028 -9.662 558 HG2 GLN 67 2HG GLN 67 -17.595 -21.781 -11.176 559 HG3 GLN 67 3HG GLN 67 -16.302 -22.861 -10.657 560 HE21 GLN 67 1HE2 GLN 67 -19.122 -21.118 -9.727 561 HE22 GLN 67 2HE2 GLN 67 -19.256 -21.760 -8.128 562 H TYR 68 H TYR 68 -14.803 -18.118 -11.169 563 HA TYR 68 HA TYR 68 -13.101 -17.503 -8.979 564 HB2 TYR 68 2HB TYR 68 -13.241 -16.760 -11.857 565 HB3 TYR 68 3HB TYR 68 -12.302 -15.714 -10.797 566 HD1 TYR 68 HD1 TYR 68 -12.745 -19.401 -11.280 567 HD2 TYR 68 HD2 TYR 68 -10.046 -16.151 -10.778 568 HE1 TYR 68 HE1 TYR 68 -10.849 -20.961 -11.430 569 HE2 TYR 68 HE2 TYR 68 -8.142 -17.701 -10.927 570 HH TYR 68 HH TYR 68 -8.524 -20.991 -11.901 571 H ASP 69 H ASP 69 -15.800 -15.892 -10.495 572 HA ASP 69 HA ASP 69 -15.352 -13.336 -9.308 573 HB2 ASP 69 2HB ASP 69 -16.699 -13.619 -11.353 574 HB3 ASP 69 3HB ASP 69 -17.900 -14.521 -10.432 575 H ALA 70 H ALA 70 -16.911 -16.272 -8.301 576 HA ALA 70 HA ALA 70 -18.601 -15.294 -6.300 577 HB1 ALA 70 1HB ALA 70 -19.094 -17.455 -6.244 578 HB2 ALA 70 2HB ALA 70 -17.641 -17.841 -7.168 579 HB3 ALA 70 3HB ALA 70 -17.571 -17.759 -5.407 580 H TYR 71 H TYR 71 -15.152 -15.703 -6.377 581 HA TYR 71 HA TYR 71 -14.968 -15.146 -3.501 582 HB2 TYR 71 2HB TYR 71 -13.087 -16.344 -5.503 583 HB3 TYR 71 3HB TYR 71 -12.448 -15.613 -4.035 584 HD1 TYR 71 HD1 TYR 71 -13.830 -16.398 -1.835 585 HD2 TYR 71 HD2 TYR 71 -13.411 -18.620 -5.439 586 HE1 TYR 71 HE1 TYR 71 -14.280 -18.477 -0.599 587 HE2 TYR 71 HE2 TYR 71 -13.861 -20.704 -4.214 588 HH TYR 71 HH TYR 71 -13.756 -21.570 -1.954 589 H GLY 72 H GLY 72 -14.736 -13.647 -6.529 590 HA2 GLY 72 2HA GLY 72 -12.865 -11.592 -5.657 591 HA3 GLY 72 3HA GLY 72 -13.617 -11.714 -7.240 592 H SER 73 H SER 73 -13.368 -9.597 -4.977 593 HA SER 73 HA SER 73 -16.099 -9.028 -4.294 594 HB2 SER 73 2HB SER 73 -14.201 -8.394 -2.824 595 HB3 SER 73 3HB SER 73 -13.657 -7.252 -4.054 596 HG SER 73 HG SER 73 -15.025 -5.893 -3.250 Start of MODEL 15 1 H1 HIS 1 H HIS 1 1.865 -4.439 3.385 2 HA HIS 1 HA HIS 1 2.067 -4.224 0.840 3 HB2 HIS 1 2HB HIS 1 0.730 -6.413 2.343 4 HB3 HIS 1 3HB HIS 1 0.613 -6.460 0.587 5 HD1 HIS 1 HD1 HIS 1 2.790 -6.895 -0.736 6 HD2 HIS 1 HD2 HIS 1 3.276 -6.913 3.390 7 HE1 HIS 1 HE1 HIS 1 5.068 -7.880 -0.331 8 H MET 2 H MET 2 1.074 -3.017 -0.628 9 HA MET 2 HA MET 2 -1.864 -2.892 -0.606 10 HB2 MET 2 2HB MET 2 -0.399 -0.775 -0.386 11 HB3 MET 2 3HB MET 2 -0.081 -0.990 -2.102 12 HG2 MET 2 2HG MET 2 -1.855 0.562 -1.902 13 HG3 MET 2 3HG MET 2 -2.547 -0.951 -2.482 14 HE1 MET 2 1HE MET 2 -1.633 0.356 1.289 15 HE2 MET 2 2HE MET 2 -2.208 1.632 0.216 16 HE3 MET 2 3HE MET 2 -3.218 1.084 1.554 17 H LEU 3 H LEU 3 -2.069 -4.887 -1.751 18 HA LEU 3 HA LEU 3 -0.979 -5.039 -4.439 19 HB2 LEU 3 2HB LEU 3 -2.384 -6.895 -2.595 20 HB3 LEU 3 3HB LEU 3 -2.509 -7.203 -4.326 21 HG LEU 3 HG LEU 3 -0.731 -8.517 -3.237 22 HD11 LEU 3 1HD1 LEU 3 0.663 -6.566 -5.007 23 HD12 LEU 3 2HD1 LEU 3 -0.676 -7.516 -5.651 24 HD13 LEU 3 3HD1 LEU 3 0.742 -8.328 -4.987 25 HD21 LEU 3 1HD2 LEU 3 1.241 -7.475 -2.366 26 HD22 LEU 3 2HD2 LEU 3 -0.156 -6.793 -1.533 27 HD23 LEU 3 3HD2 LEU 3 0.649 -5.873 -2.805 28 H ALA 4 H ALA 4 -2.126 -4.878 -6.313 29 HA ALA 4 HA ALA 4 -4.684 -3.538 -6.153 30 HB1 ALA 4 1HB ALA 4 -3.015 -4.300 -8.547 31 HB2 ALA 4 2HB ALA 4 -4.459 -3.288 -8.582 32 HB3 ALA 4 3HB ALA 4 -3.017 -2.737 -7.730 33 H LYS 5 H LYS 5 -6.640 -4.374 -6.611 34 HA LYS 5 HA LYS 5 -6.741 -7.210 -7.400 35 HB2 LYS 5 2HB LYS 5 -9.053 -7.115 -6.312 36 HB3 LYS 5 3HB LYS 5 -7.660 -7.063 -5.240 37 HG2 LYS 5 2HG LYS 5 -8.774 -4.474 -6.152 38 HG3 LYS 5 3HG LYS 5 -9.716 -5.409 -4.988 39 HD2 LYS 5 2HD LYS 5 -6.810 -5.055 -4.471 40 HD3 LYS 5 3HD LYS 5 -7.870 -3.666 -4.222 41 HE2 LYS 5 2HE LYS 5 -9.323 -5.260 -2.844 42 HE3 LYS 5 3HE LYS 5 -7.934 -6.346 -2.865 43 HZ1 LYS 5 1HZ LYS 5 -8.110 -4.825 -0.894 44 HZ2 LYS 5 2HZ LYS 5 -7.755 -3.539 -1.934 45 HZ3 LYS 5 3HZ LYS 5 -6.629 -4.782 -1.711 46 H GLU 6 H GLU 6 -6.749 -6.776 -9.633 47 HA GLU 6 HA GLU 6 -9.044 -5.269 -10.664 48 HB2 GLU 6 2HB GLU 6 -7.882 -5.222 -12.788 49 HB3 GLU 6 3HB GLU 6 -6.800 -4.672 -11.516 50 HG2 GLU 6 2HG GLU 6 -5.930 -7.068 -11.458 51 HG3 GLU 6 3HG GLU 6 -6.779 -7.281 -12.988 52 H ASP 7 H ASP 7 -10.691 -6.230 -11.694 53 HA ASP 7 HA ASP 7 -10.857 -9.101 -11.663 54 HB2 ASP 7 2HB ASP 7 -12.846 -7.217 -12.924 55 HB3 ASP 7 3HB ASP 7 -13.136 -8.828 -12.273 56 H TYR 8 H TYR 8 -11.312 -10.431 -13.497 57 HA TYR 8 HA TYR 8 -9.576 -10.077 -15.646 58 HB2 TYR 8 2HB TYR 8 -12.080 -11.765 -15.706 59 HB3 TYR 8 3HB TYR 8 -10.602 -12.010 -16.629 60 HD1 TYR 8 HD1 TYR 8 -12.278 -13.710 -14.429 61 HD2 TYR 8 HD2 TYR 8 -8.557 -11.648 -14.516 62 HE1 TYR 8 HE1 TYR 8 -11.425 -15.188 -12.658 63 HE2 TYR 8 HE2 TYR 8 -7.693 -13.121 -12.746 64 HH TYR 8 HH TYR 8 -8.070 -15.122 -11.668 65 H TYR 9 H TYR 9 -12.808 -8.936 -15.156 66 HA TYR 9 HA TYR 9 -13.665 -8.535 -17.772 67 HB2 TYR 9 2HB TYR 9 -14.201 -6.762 -15.380 68 HB3 TYR 9 3HB TYR 9 -15.153 -6.821 -16.860 69 HD1 TYR 9 HD1 TYR 9 -14.720 -8.165 -13.587 70 HD2 TYR 9 HD2 TYR 9 -16.282 -9.053 -17.444 71 HE1 TYR 9 HE1 TYR 9 -16.121 -9.933 -12.607 72 HE2 TYR 9 HE2 TYR 9 -17.688 -10.823 -16.474 73 HH TYR 9 HH TYR 9 -18.667 -11.143 -13.814 74 H GLN 10 H GLN 10 -11.802 -6.363 -15.664 75 HA GLN 10 HA GLN 10 -11.522 -4.352 -17.684 76 HB2 GLN 10 2HB GLN 10 -10.157 -4.763 -15.023 77 HB3 GLN 10 3HB GLN 10 -9.851 -3.380 -16.065 78 HG2 GLN 10 2HG GLN 10 -12.002 -2.527 -15.767 79 HG3 GLN 10 3HG GLN 10 -12.620 -4.059 -15.150 80 HE21 GLN 10 1HE2 GLN 10 -13.205 -3.745 -13.125 81 HE22 GLN 10 2HE2 GLN 10 -12.268 -2.952 -11.909 82 H ILE 11 H ILE 11 -9.684 -7.123 -16.639 83 HA ILE 11 HA ILE 11 -7.220 -6.441 -17.852 84 HB ILE 11 HB ILE 11 -8.341 -9.180 -17.249 85 HG12 ILE 11 2HG1 ILE 11 -6.399 -7.517 -15.637 86 HG13 ILE 11 3HG1 ILE 11 -8.125 -7.598 -15.304 87 HG21 ILE 11 1HG2 ILE 11 -6.596 -9.846 -18.492 88 HG22 ILE 11 2HG2 ILE 11 -5.817 -8.267 -18.423 89 HG23 ILE 11 3HG2 ILE 11 -5.636 -9.398 -17.083 90 HD11 ILE 11 1HD1 ILE 11 -6.039 -9.374 -14.499 91 HD12 ILE 11 2HD1 ILE 11 -7.738 -9.355 -14.024 92 HD13 ILE 11 3HD1 ILE 11 -7.232 -10.250 -15.457 93 H LEU 12 H LEU 12 -10.200 -7.636 -19.105 94 HA LEU 12 HA LEU 12 -8.914 -8.212 -21.690 95 HB2 LEU 12 2HB LEU 12 -11.298 -9.327 -20.307 96 HB3 LEU 12 3HB LEU 12 -11.320 -9.250 -22.067 97 HG LEU 12 HG LEU 12 -9.275 -10.710 -20.395 98 HD11 LEU 12 1HD1 LEU 12 -10.733 -12.377 -20.336 99 HD12 LEU 12 2HD1 LEU 12 -10.694 -12.438 -22.098 100 HD13 LEU 12 3HD1 LEU 12 -11.896 -11.443 -21.276 101 HD21 LEU 12 1HD2 LEU 12 -8.233 -9.967 -22.401 102 HD22 LEU 12 2HD2 LEU 12 -9.634 -10.421 -23.372 103 HD23 LEU 12 3HD2 LEU 12 -8.637 -11.670 -22.623 104 H GLY 13 H GLY 13 -10.920 -6.041 -20.027 105 HA2 GLY 13 2HA GLY 13 -11.796 -4.031 -20.771 106 HA3 GLY 13 3HA GLY 13 -11.281 -4.449 -22.398 107 H VAL 14 H VAL 14 -13.409 -6.280 -20.241 108 HA VAL 14 HA VAL 14 -15.613 -5.808 -22.140 109 HB VAL 14 HB VAL 14 -16.374 -8.091 -21.844 110 HG11 VAL 14 1HG1 VAL 14 -14.661 -7.507 -23.592 111 HG12 VAL 14 2HG1 VAL 14 -13.440 -8.180 -22.512 112 HG13 VAL 14 3HG1 VAL 14 -14.728 -9.209 -23.139 113 HG21 VAL 14 1HG2 VAL 14 -14.705 -8.025 -19.565 114 HG22 VAL 14 2HG2 VAL 14 -15.777 -9.322 -20.094 115 HG23 VAL 14 3HG2 VAL 14 -14.095 -9.297 -20.624 116 HA PRO 15 HA PRO 15 -18.084 -4.669 -18.692 117 HB2 PRO 15 2HB PRO 15 -20.538 -5.453 -19.545 118 HB3 PRO 15 3HB PRO 15 -19.693 -4.050 -20.210 119 HG2 PRO 15 2HG PRO 15 -19.910 -6.827 -21.308 120 HG3 PRO 15 3HG PRO 15 -20.039 -5.275 -22.157 121 HD2 PRO 15 2HD PRO 15 -17.784 -6.774 -22.195 122 HD3 PRO 15 3HD PRO 15 -17.753 -5.000 -22.263 123 H ARG 16 H ARG 16 -19.840 -5.572 -17.207 124 HA ARG 16 HA ARG 16 -18.944 -8.125 -16.233 125 HB2 ARG 16 2HB ARG 16 -21.163 -6.316 -15.257 126 HB3 ARG 16 3HB ARG 16 -20.557 -7.731 -14.406 127 HG2 ARG 16 2HG ARG 16 -18.597 -6.703 -13.804 128 HG3 ARG 16 3HG ARG 16 -18.651 -5.570 -15.156 129 HD2 ARG 16 2HD ARG 16 -20.098 -4.147 -14.082 130 HD3 ARG 16 3HD ARG 16 -20.783 -5.428 -13.083 131 HE ARG 16 HE ARG 16 -18.560 -3.760 -12.443 132 HH11 ARG 16 1HH1 ARG 16 -19.907 -6.937 -11.983 133 HH12 ARG 16 2HH1 ARG 16 -19.098 -7.204 -10.474 134 HH21 ARG 16 1HH2 ARG 16 -17.489 -4.099 -10.458 135 HH22 ARG 16 2HH2 ARG 16 -17.723 -5.589 -9.607 136 H ASN 17 H ASN 17 -21.174 -7.189 -18.525 137 HA ASN 17 HA ASN 17 -22.781 -9.625 -18.122 138 HB2 ASN 17 2HB ASN 17 -24.488 -8.451 -19.578 139 HB3 ASN 17 3HB ASN 17 -24.234 -7.740 -17.987 140 HD21 ASN 17 1HD2 ASN 17 -24.883 -5.704 -18.518 141 HD22 ASN 17 2HD2 ASN 17 -24.012 -4.679 -19.602 142 H ALA 18 H ALA 18 -20.222 -8.636 -19.780 143 HA ALA 18 HA ALA 18 -20.692 -9.033 -22.478 144 HB1 ALA 18 1HB ALA 18 -18.176 -10.199 -21.557 145 HB2 ALA 18 2HB ALA 18 -18.470 -8.870 -22.680 146 HB3 ALA 18 3HB ALA 18 -18.480 -8.574 -20.941 147 H SER 19 H SER 19 -20.168 -10.886 -23.843 148 HA SER 19 HA SER 19 -21.031 -13.400 -22.581 149 HB2 SER 19 2HB SER 19 -21.415 -13.973 -25.136 150 HB3 SER 19 3HB SER 19 -22.602 -13.032 -24.233 151 HG SER 19 HG SER 19 -21.410 -12.318 -26.427 152 H GLN 20 H GLN 20 -20.083 -15.396 -23.371 153 HA GLN 20 HA GLN 20 -17.322 -15.451 -23.262 154 HB2 GLN 20 2HB GLN 20 -19.000 -17.506 -24.700 155 HB3 GLN 20 3HB GLN 20 -17.450 -17.755 -23.908 156 HG2 GLN 20 2HG GLN 20 -20.114 -17.225 -22.629 157 HG3 GLN 20 3HG GLN 20 -19.107 -18.665 -22.494 158 HE21 GLN 20 1HE2 GLN 20 -17.000 -18.380 -21.444 159 HE22 GLN 20 2HE2 GLN 20 -16.874 -17.252 -20.142 160 H LYS 21 H LYS 21 -19.412 -14.932 -25.990 161 HA LYS 21 HA LYS 21 -17.423 -15.413 -27.993 162 HB2 LYS 21 2HB LYS 21 -19.997 -13.846 -28.227 163 HB3 LYS 21 3HB LYS 21 -19.046 -14.500 -29.554 164 HG2 LYS 21 2HG LYS 21 -19.540 -16.758 -28.840 165 HG3 LYS 21 3HG LYS 21 -20.420 -16.145 -27.438 166 HD2 LYS 21 2HD LYS 21 -21.825 -14.868 -29.220 167 HD3 LYS 21 3HD LYS 21 -21.173 -16.072 -30.333 168 HE2 LYS 21 2HE LYS 21 -22.265 -17.817 -29.293 169 HE3 LYS 21 3HE LYS 21 -22.390 -16.962 -27.757 170 HZ1 LYS 21 1HZ LYS 21 -24.030 -15.482 -28.795 171 HZ2 LYS 21 2HZ LYS 21 -24.539 -17.096 -28.792 172 HZ3 LYS 21 3HZ LYS 21 -23.954 -16.396 -30.217 173 H GLU 22 H GLU 22 -18.891 -12.476 -26.618 174 HA GLU 22 HA GLU 22 -17.368 -10.632 -28.085 175 HB2 GLU 22 2HB GLU 22 -19.390 -9.988 -26.880 176 HB3 GLU 22 3HB GLU 22 -18.613 -10.347 -25.345 177 HG2 GLU 22 2HG GLU 22 -18.630 -7.975 -25.698 178 HG3 GLU 22 3HG GLU 22 -16.972 -8.567 -25.787 179 H ILE 23 H ILE 23 -16.708 -12.373 -25.116 180 HA ILE 23 HA ILE 23 -14.449 -10.862 -24.312 181 HB ILE 23 HB ILE 23 -15.201 -13.717 -23.680 182 HG12 ILE 23 2HG1 ILE 23 -15.435 -11.271 -21.927 183 HG13 ILE 23 3HG1 ILE 23 -16.747 -11.825 -22.963 184 HG21 ILE 23 1HG2 ILE 23 -12.807 -12.195 -23.090 185 HG22 ILE 23 2HG2 ILE 23 -13.617 -12.752 -21.627 186 HG23 ILE 23 3HG2 ILE 23 -13.137 -13.912 -22.865 187 HD11 ILE 23 1HD1 ILE 23 -17.404 -13.104 -21.284 188 HD12 ILE 23 2HD1 ILE 23 -15.956 -14.078 -21.537 189 HD13 ILE 23 3HD1 ILE 23 -15.937 -12.758 -20.369 190 H LYS 24 H LYS 24 -14.895 -13.569 -26.486 191 HA LYS 24 HA LYS 24 -12.203 -14.364 -26.714 192 HB2 LYS 24 2HB LYS 24 -14.716 -14.916 -28.061 193 HB3 LYS 24 3HB LYS 24 -13.376 -14.852 -29.198 194 HG2 LYS 24 2HG LYS 24 -12.164 -16.481 -27.756 195 HG3 LYS 24 3HG LYS 24 -13.628 -16.625 -26.780 196 HD2 LYS 24 2HD LYS 24 -14.085 -16.944 -29.651 197 HD3 LYS 24 3HD LYS 24 -13.014 -18.165 -28.961 198 HE2 LYS 24 2HE LYS 24 -14.766 -18.472 -27.154 199 HE3 LYS 24 3HE LYS 24 -15.836 -17.496 -28.160 200 HZ1 LYS 24 1HZ LYS 24 -14.482 -19.829 -29.328 201 HZ2 LYS 24 2HZ LYS 24 -15.950 -19.113 -29.765 202 HZ3 LYS 24 3HZ LYS 24 -15.855 -20.063 -28.369 203 H LYS 25 H LYS 25 -14.108 -11.930 -28.409 204 HA LYS 25 HA LYS 25 -12.097 -11.299 -30.330 205 HB2 LYS 25 2HB LYS 25 -14.566 -9.837 -29.396 206 HB3 LYS 25 3HB LYS 25 -13.506 -9.211 -30.653 207 HG2 LYS 25 2HG LYS 25 -14.059 -10.918 -32.139 208 HG3 LYS 25 3HG LYS 25 -14.706 -11.947 -30.860 209 HD2 LYS 25 2HD LYS 25 -16.645 -11.170 -31.824 210 HD3 LYS 25 3HD LYS 25 -16.402 -9.974 -30.548 211 HE2 LYS 25 2HE LYS 25 -15.255 -9.524 -33.274 212 HE3 LYS 25 3HE LYS 25 -16.959 -9.192 -32.966 213 HZ1 LYS 25 1HZ LYS 25 -15.480 -8.049 -30.895 214 HZ2 LYS 25 2HZ LYS 25 -16.372 -7.260 -32.096 215 HZ3 LYS 25 3HZ LYS 25 -14.734 -7.600 -32.346 216 H ALA 26 H ALA 26 -13.154 -9.780 -27.297 217 HA ALA 26 HA ALA 26 -11.389 -7.606 -27.344 218 HB1 ALA 26 1HB ALA 26 -12.400 -9.010 -24.877 219 HB2 ALA 26 2HB ALA 26 -11.878 -7.331 -25.019 220 HB3 ALA 26 3HB ALA 26 -13.352 -7.868 -25.826 221 H TYR 27 H TYR 27 -10.928 -10.939 -26.405 222 HA TYR 27 HA TYR 27 -8.460 -10.538 -25.030 223 HB2 TYR 27 2HB TYR 27 -9.718 -12.504 -24.507 224 HB3 TYR 27 3HB TYR 27 -9.773 -12.995 -26.196 225 HD1 TYR 27 HD1 TYR 27 -7.050 -12.005 -23.824 226 HD2 TYR 27 HD2 TYR 27 -8.513 -14.876 -26.603 227 HE1 TYR 27 HE1 TYR 27 -5.019 -13.353 -23.492 228 HE2 TYR 27 HE2 TYR 27 -6.487 -16.232 -26.277 229 HH TYR 27 HH TYR 27 -4.199 -15.972 -25.528 230 H TYR 28 H TYR 28 -9.370 -11.239 -28.345 231 HA TYR 28 HA TYR 28 -6.710 -11.815 -29.231 232 HB2 TYR 28 2HB TYR 28 -8.590 -12.740 -30.443 233 HB3 TYR 28 3HB TYR 28 -9.229 -11.131 -30.759 234 HD1 TYR 28 HD1 TYR 28 -9.025 -10.522 -32.967 235 HD2 TYR 28 HD2 TYR 28 -5.893 -12.778 -31.178 236 HE1 TYR 28 HE1 TYR 28 -7.764 -10.432 -35.076 237 HE2 TYR 28 HE2 TYR 28 -4.622 -12.694 -33.283 238 HH TYR 28 HH TYR 28 -5.996 -11.703 -36.220 239 H GLN 29 H GLN 29 -8.874 -9.010 -29.514 240 HA GLN 29 HA GLN 29 -7.151 -7.366 -30.980 241 HB2 GLN 29 2HB GLN 29 -8.588 -5.574 -30.428 242 HB3 GLN 29 3HB GLN 29 -9.617 -7.000 -30.486 243 HG2 GLN 29 2HG GLN 29 -9.596 -7.147 -28.068 244 HG3 GLN 29 3HG GLN 29 -8.499 -5.771 -27.976 245 HE21 GLN 29 1HE2 GLN 29 -11.649 -6.674 -29.329 246 HE22 GLN 29 2HE2 GLN 29 -12.420 -5.165 -28.992 247 H LEU 30 H LEU 30 -7.355 -8.020 -27.542 248 HA LEU 30 HA LEU 30 -5.605 -5.913 -26.742 249 HB2 LEU 30 2HB LEU 30 -7.124 -8.011 -25.489 250 HB3 LEU 30 3HB LEU 30 -5.497 -7.944 -24.816 251 HG LEU 30 HG LEU 30 -5.813 -5.658 -24.139 252 HD11 LEU 30 1HD1 LEU 30 -8.001 -5.777 -26.047 253 HD12 LEU 30 2HD1 LEU 30 -7.120 -4.386 -25.417 254 HD13 LEU 30 3HD1 LEU 30 -8.475 -5.056 -24.509 255 HD21 LEU 30 1HD2 LEU 30 -6.575 -6.899 -22.392 256 HD22 LEU 30 2HD2 LEU 30 -7.809 -7.708 -23.358 257 HD23 LEU 30 3HD2 LEU 30 -8.071 -6.056 -22.797 258 H ALA 31 H ALA 31 -5.196 -9.351 -27.447 259 HA ALA 31 HA ALA 31 -2.552 -9.661 -26.624 260 HB1 ALA 31 1HB ALA 31 -3.371 -11.696 -27.140 261 HB2 ALA 31 2HB ALA 31 -4.375 -11.079 -28.453 262 HB3 ALA 31 3HB ALA 31 -2.653 -11.356 -28.715 263 H LYS 32 H LYS 32 -3.841 -8.636 -29.769 264 HA LYS 32 HA LYS 32 -1.438 -8.458 -31.165 265 HB2 LYS 32 2HB LYS 32 -3.969 -6.828 -31.423 266 HB3 LYS 32 3HB LYS 32 -2.640 -6.754 -32.574 267 HG2 LYS 32 2HG LYS 32 -3.138 -8.759 -33.491 268 HG3 LYS 32 3HG LYS 32 -3.719 -9.437 -31.968 269 HD2 LYS 32 2HD LYS 32 -5.669 -9.251 -33.206 270 HD3 LYS 32 3HD LYS 32 -5.678 -7.760 -32.262 271 HE2 LYS 32 2HE LYS 32 -6.198 -7.034 -34.407 272 HE3 LYS 32 3HE LYS 32 -4.466 -6.730 -34.290 273 HZ1 LYS 32 1HZ LYS 32 -5.888 -8.476 -36.052 274 HZ2 LYS 32 2HZ LYS 32 -4.636 -9.278 -35.246 275 HZ3 LYS 32 3HZ LYS 32 -4.303 -7.894 -36.161 276 H LYS 33 H LYS 33 -2.746 -6.423 -28.697 277 HA LYS 33 HA LYS 33 -1.143 -4.123 -29.290 278 HB2 LYS 33 2HB LYS 33 -2.448 -4.802 -26.654 279 HB3 LYS 33 3HB LYS 33 -1.987 -3.209 -27.242 280 HG2 LYS 33 2HG LYS 33 -3.670 -3.859 -29.187 281 HG3 LYS 33 3HG LYS 33 -4.344 -4.874 -27.910 282 HD2 LYS 33 2HD LYS 33 -5.506 -2.994 -27.429 283 HD3 LYS 33 3HD LYS 33 -4.033 -2.577 -26.550 284 HE2 LYS 33 2HE LYS 33 -4.235 -1.866 -29.436 285 HE3 LYS 33 3HE LYS 33 -5.127 -0.900 -28.262 286 HZ1 LYS 33 1HZ LYS 33 -2.966 -0.659 -27.046 287 HZ2 LYS 33 2HZ LYS 33 -3.037 0.122 -28.545 288 HZ3 LYS 33 3HZ LYS 33 -2.200 -1.340 -28.392 289 H TYR 34 H TYR 34 -0.902 -6.863 -27.074 290 HA TYR 34 HA TYR 34 1.724 -5.911 -26.184 291 HB2 TYR 34 2HB TYR 34 0.017 -8.169 -25.114 292 HB3 TYR 34 3HB TYR 34 1.538 -7.615 -24.423 293 HD1 TYR 34 HD1 TYR 34 1.660 -5.492 -23.223 294 HD2 TYR 34 HD2 TYR 34 -2.022 -6.903 -24.820 295 HE1 TYR 34 HE1 TYR 34 0.443 -3.862 -21.840 296 HE2 TYR 34 HE2 TYR 34 -3.250 -5.277 -23.442 297 HH TYR 34 HH TYR 34 -1.547 -3.115 -21.197 298 H HIS 35 H HIS 35 1.075 -7.168 -28.832 299 HA HIS 35 HA HIS 35 2.086 -9.790 -28.936 300 HB2 HIS 35 2HB HIS 35 1.343 -7.711 -30.833 301 HB3 HIS 35 3HB HIS 35 2.736 -8.637 -31.384 302 HD1 HIS 35 HD1 HIS 35 0.027 -10.263 -29.372 303 HD2 HIS 35 HD2 HIS 35 1.266 -9.991 -33.329 304 HE1 HIS 35 HE1 HIS 35 -1.294 -12.008 -30.612 305 HA PRO 36 HA PRO 36 6.444 -9.406 -28.621 306 HB2 PRO 36 2HB PRO 36 7.325 -11.155 -30.501 307 HB3 PRO 36 3HB PRO 36 6.576 -11.671 -28.986 308 HG2 PRO 36 2HG PRO 36 5.366 -11.434 -31.714 309 HG3 PRO 36 3HG PRO 36 5.172 -12.724 -30.512 310 HD2 PRO 36 2HD PRO 36 3.316 -10.787 -30.882 311 HD3 PRO 36 3HD PRO 36 3.616 -11.532 -29.299 312 H ASP 37 H ASP 37 4.852 -8.542 -31.511 313 HA ASP 37 HA ASP 37 7.187 -7.711 -32.969 314 HB2 ASP 37 2HB ASP 37 4.761 -8.368 -33.817 315 HB3 ASP 37 3HB ASP 37 4.474 -6.642 -33.608 316 H THR 38 H THR 38 5.141 -6.348 -30.567 317 HA THR 38 HA THR 38 6.185 -3.652 -31.099 318 HB THR 38 HB THR 38 4.401 -2.756 -29.822 319 HG1 THR 38 HG1 THR 38 4.321 -5.319 -28.747 320 HG21 THR 38 1HG2 THR 38 3.924 -4.045 -32.109 321 HG22 THR 38 2HG2 THR 38 2.648 -3.239 -31.197 322 HG23 THR 38 3HG2 THR 38 2.872 -4.982 -31.051 323 H ASN 39 H ASN 39 7.024 -6.273 -29.374 324 HA ASN 39 HA ASN 39 7.576 -5.056 -26.825 325 HB2 ASN 39 2HB ASN 39 8.012 -7.725 -28.068 326 HB3 ASN 39 3HB ASN 39 9.059 -7.277 -26.725 327 HD21 ASN 39 1HD2 ASN 39 5.657 -6.524 -27.324 328 HD22 ASN 39 2HD2 ASN 39 5.056 -7.280 -25.891 329 H LYS 40 H LYS 40 8.955 -4.749 -29.805 330 HA LYS 40 HA LYS 40 11.686 -4.947 -29.471 331 HB2 LYS 40 2HB LYS 40 9.886 -3.378 -31.203 332 HB3 LYS 40 3HB LYS 40 11.506 -2.717 -31.020 333 HG2 LYS 40 2HG LYS 40 11.955 -4.061 -32.762 334 HG3 LYS 40 3HG LYS 40 12.108 -5.292 -31.506 335 HD2 LYS 40 2HD LYS 40 9.393 -4.804 -32.584 336 HD3 LYS 40 3HD LYS 40 10.548 -5.595 -33.658 337 HE2 LYS 40 2HE LYS 40 10.423 -6.621 -30.893 338 HE3 LYS 40 3HE LYS 40 9.001 -6.914 -31.893 339 HZ1 LYS 40 1HZ LYS 40 10.074 -8.470 -33.030 340 HZ2 LYS 40 2HZ LYS 40 11.306 -8.388 -31.874 341 HZ3 LYS 40 3HZ LYS 40 11.418 -7.479 -33.296 342 H ASP 41 H ASP 41 9.533 -2.315 -28.517 343 HA ASP 41 HA ASP 41 11.782 -1.110 -27.041 344 HB2 ASP 41 2HB ASP 41 9.384 0.238 -28.295 345 HB3 ASP 41 3HB ASP 41 10.535 1.050 -27.237 346 H ASP 42 H ASP 42 9.624 -3.162 -26.350 347 HA ASP 42 HA ASP 42 8.991 -2.004 -23.756 348 HB2 ASP 42 2HB ASP 42 7.071 -1.746 -25.589 349 HB3 ASP 42 3HB ASP 42 6.731 -3.404 -25.100 350 HA PRO 43 HA PRO 43 10.381 -6.393 -23.527 351 HB2 PRO 43 2HB PRO 43 11.937 -6.010 -21.336 352 HB3 PRO 43 3HB PRO 43 12.507 -5.713 -22.982 353 HG2 PRO 43 2HG PRO 43 11.502 -3.763 -20.946 354 HG3 PRO 43 3HG PRO 43 12.893 -3.624 -22.038 355 HD2 PRO 43 2HD PRO 43 10.520 -2.418 -22.539 356 HD3 PRO 43 3HD PRO 43 11.582 -3.012 -23.832 357 H LYS 44 H LYS 44 8.560 -4.274 -21.625 358 HA LYS 44 HA LYS 44 8.032 -6.251 -19.538 359 HB2 LYS 44 2HB LYS 44 7.688 -3.335 -19.818 360 HB3 LYS 44 3HB LYS 44 6.395 -4.156 -18.953 361 HG2 LYS 44 2HG LYS 44 9.320 -4.362 -18.269 362 HG3 LYS 44 3HG LYS 44 8.164 -3.293 -17.471 363 HD2 LYS 44 2HD LYS 44 7.396 -6.138 -17.637 364 HD3 LYS 44 3HD LYS 44 8.770 -5.768 -16.592 365 HE2 LYS 44 2HE LYS 44 6.053 -4.464 -16.450 366 HE3 LYS 44 3HE LYS 44 6.637 -5.730 -15.371 367 HZ1 LYS 44 1HZ LYS 44 7.636 -2.953 -15.620 368 HZ2 LYS 44 2HZ LYS 44 8.501 -4.160 -14.812 369 HZ3 LYS 44 3HZ LYS 44 6.970 -3.702 -14.257 370 H ALA 45 H ALA 45 6.721 -5.082 -22.473 371 HA ALA 45 HA ALA 45 3.986 -5.442 -22.119 372 HB1 ALA 45 1HB ALA 45 5.806 -5.567 -24.475 373 HB2 ALA 45 2HB ALA 45 4.130 -6.089 -24.656 374 HB3 ALA 45 3HB ALA 45 4.490 -4.446 -24.123 375 H LYS 46 H LYS 46 6.521 -7.793 -22.771 376 HA LYS 46 HA LYS 46 4.960 -9.999 -23.444 377 HB2 LYS 46 2HB LYS 46 6.869 -11.362 -22.627 378 HB3 LYS 46 3HB LYS 46 7.361 -10.053 -23.694 379 HG2 LYS 46 2HG LYS 46 7.793 -8.730 -21.536 380 HG3 LYS 46 3HG LYS 46 7.720 -10.299 -20.732 381 HD2 LYS 46 2HD LYS 46 10.012 -9.840 -21.225 382 HD3 LYS 46 3HD LYS 46 9.470 -11.106 -22.329 383 HE2 LYS 46 2HE LYS 46 9.512 -9.715 -24.158 384 HE3 LYS 46 3HE LYS 46 9.272 -8.261 -23.192 385 HZ1 LYS 46 1HZ LYS 46 11.499 -8.219 -22.567 386 HZ2 LYS 46 2HZ LYS 46 11.559 -8.646 -24.203 387 HZ3 LYS 46 3HZ LYS 46 11.769 -9.829 -23.012 388 H GLU 47 H GLU 47 5.933 -8.788 -20.262 389 HA GLU 47 HA GLU 47 4.814 -10.911 -18.767 390 HB2 GLU 47 2HB GLU 47 6.508 -9.291 -17.909 391 HB3 GLU 47 3HB GLU 47 5.256 -8.057 -17.876 392 HG2 GLU 47 2HG GLU 47 5.327 -8.793 -15.689 393 HG3 GLU 47 3HG GLU 47 3.975 -9.698 -16.368 394 H LYS 48 H LYS 48 3.534 -7.833 -19.903 395 HA LYS 48 HA LYS 48 1.081 -7.993 -18.467 396 HB2 LYS 48 2HB LYS 48 1.650 -6.438 -20.995 397 HB3 LYS 48 3HB LYS 48 0.361 -6.134 -19.838 398 HG2 LYS 48 2HG LYS 48 3.316 -5.815 -19.361 399 HG3 LYS 48 3HG LYS 48 2.125 -4.525 -19.538 400 HD2 LYS 48 2HD LYS 48 0.964 -5.405 -17.520 401 HD3 LYS 48 3HD LYS 48 2.281 -6.563 -17.318 402 HE2 LYS 48 2HE LYS 48 3.823 -4.902 -16.797 403 HE3 LYS 48 3HE LYS 48 2.849 -3.631 -17.533 404 HZ1 LYS 48 1HZ LYS 48 2.399 -5.004 -14.950 405 HZ2 LYS 48 2HZ LYS 48 1.196 -4.086 -15.705 406 HZ3 LYS 48 3HZ LYS 48 2.644 -3.353 -15.226 407 H PHE 49 H PHE 49 2.144 -9.030 -21.653 408 HA PHE 49 HA PHE 49 -0.343 -9.601 -22.790 409 HB2 PHE 49 2HB PHE 49 1.607 -9.599 -24.181 410 HB3 PHE 49 3HB PHE 49 2.368 -10.860 -23.216 411 HD1 PHE 49 HD1 PHE 49 -0.077 -10.121 -25.813 412 HD2 PHE 49 HD2 PHE 49 1.662 -13.178 -23.414 413 HE1 PHE 49 HE1 PHE 49 -1.017 -11.829 -27.314 414 HE2 PHE 49 HE2 PHE 49 0.726 -14.890 -24.912 415 HZ PHE 49 HZ PHE 49 -0.615 -14.217 -26.865 416 H SER 50 H SER 50 1.610 -11.388 -20.508 417 HA SER 50 HA SER 50 0.303 -13.882 -20.742 418 HB2 SER 50 2HB SER 50 1.990 -12.601 -18.609 419 HB3 SER 50 3HB SER 50 1.213 -14.157 -18.321 420 HG SER 50 HG SER 50 3.290 -13.491 -20.055 421 H GLN 51 H GLN 51 -0.393 -10.978 -18.912 422 HA GLN 51 HA GLN 51 -2.279 -12.044 -17.124 423 HB2 GLN 51 2HB GLN 51 -2.044 -9.265 -18.286 424 HB3 GLN 51 3HB GLN 51 -3.111 -9.695 -16.955 425 HG2 GLN 51 2HG GLN 51 -0.118 -9.624 -17.008 426 HG3 GLN 51 3HG GLN 51 -1.228 -8.761 -15.945 427 HE21 GLN 51 1HE2 GLN 51 -1.804 -9.662 -14.063 428 HE22 GLN 51 2HE2 GLN 51 -1.336 -11.240 -13.540 429 H LEU 52 H LEU 52 -2.541 -10.974 -20.450 430 HA LEU 52 HA LEU 52 -5.329 -10.793 -20.644 431 HB2 LEU 52 2HB LEU 52 -3.448 -11.710 -22.809 432 HB3 LEU 52 3HB LEU 52 -5.035 -10.975 -23.019 433 HG LEU 52 HG LEU 52 -2.781 -9.481 -21.714 434 HD11 LEU 52 1HD1 LEU 52 -1.921 -8.766 -23.717 435 HD12 LEU 52 2HD1 LEU 52 -3.390 -9.151 -24.613 436 HD13 LEU 52 3HD1 LEU 52 -2.306 -10.444 -24.100 437 HD21 LEU 52 1HD2 LEU 52 -4.463 -8.042 -21.441 438 HD22 LEU 52 2HD2 LEU 52 -5.517 -8.934 -22.538 439 HD23 LEU 52 3HD2 LEU 52 -4.361 -7.766 -23.180 440 H ALA 53 H ALA 53 -3.159 -13.539 -21.265 441 HA ALA 53 HA ALA 53 -5.221 -15.358 -21.954 442 HB1 ALA 53 1HB ALA 53 -2.880 -15.683 -22.609 443 HB2 ALA 53 2HB ALA 53 -2.451 -15.952 -20.918 444 HB3 ALA 53 3HB ALA 53 -3.522 -17.082 -21.747 445 H GLU 54 H GLU 54 -3.741 -14.417 -18.921 446 HA GLU 54 HA GLU 54 -4.683 -16.550 -17.338 447 HB2 GLU 54 2HB GLU 54 -3.666 -13.799 -16.805 448 HB3 GLU 54 3HB GLU 54 -4.509 -14.632 -15.507 449 HG2 GLU 54 2HG GLU 54 -2.875 -16.582 -16.089 450 HG3 GLU 54 3HG GLU 54 -1.915 -15.292 -16.812 451 H ALA 55 H ALA 55 -6.001 -13.288 -17.880 452 HA ALA 55 HA ALA 55 -8.354 -13.755 -16.340 453 HB1 ALA 55 1HB ALA 55 -8.732 -11.668 -18.264 454 HB2 ALA 55 2HB ALA 55 -8.543 -11.551 -16.514 455 HB3 ALA 55 3HB ALA 55 -7.121 -11.543 -17.557 456 H TYR 56 H TYR 56 -7.577 -13.913 -19.780 457 HA TYR 56 HA TYR 56 -10.194 -14.265 -20.743 458 HB2 TYR 56 2HB TYR 56 -8.571 -13.719 -22.355 459 HB3 TYR 56 3HB TYR 56 -7.483 -14.997 -21.823 460 HD1 TYR 56 HD1 TYR 56 -10.535 -14.252 -23.738 461 HD2 TYR 56 HD2 TYR 56 -7.725 -17.248 -22.628 462 HE1 TYR 56 HE1 TYR 56 -11.433 -15.733 -25.485 463 HE2 TYR 56 HE2 TYR 56 -8.614 -18.737 -24.372 464 HH TYR 56 HH TYR 56 -10.218 -19.039 -25.893 465 H GLU 57 H GLU 57 -7.967 -16.441 -19.214 466 HA GLU 57 HA GLU 57 -9.006 -18.895 -20.091 467 HB2 GLU 57 2HB GLU 57 -7.306 -17.967 -17.865 468 HB3 GLU 57 3HB GLU 57 -8.161 -19.475 -17.573 469 HG2 GLU 57 2HG GLU 57 -6.644 -19.109 -20.113 470 HG3 GLU 57 3HG GLU 57 -5.785 -19.495 -18.623 471 H VAL 58 H VAL 58 -9.823 -16.912 -17.260 472 HA VAL 58 HA VAL 58 -11.870 -18.697 -16.354 473 HB VAL 58 HB VAL 58 -11.485 -15.798 -15.600 474 HG11 VAL 58 1HG1 VAL 58 -13.433 -17.740 -14.887 475 HG12 VAL 58 2HG1 VAL 58 -12.427 -17.422 -13.473 476 HG13 VAL 58 3HG1 VAL 58 -13.250 -16.092 -14.288 477 HG21 VAL 58 1HG2 VAL 58 -10.091 -18.285 -14.710 478 HG22 VAL 58 2HG2 VAL 58 -9.428 -16.686 -15.045 479 HG23 VAL 58 3HG2 VAL 58 -10.345 -16.967 -13.565 480 H LEU 59 H LEU 59 -11.805 -15.673 -18.185 481 HA LEU 59 HA LEU 59 -14.650 -15.433 -18.333 482 HB2 LEU 59 2HB LEU 59 -12.518 -14.146 -20.031 483 HB3 LEU 59 3HB LEU 59 -14.211 -13.661 -19.952 484 HG LEU 59 HG LEU 59 -12.090 -13.353 -17.840 485 HD11 LEU 59 1HD1 LEU 59 -11.902 -11.389 -18.880 486 HD12 LEU 59 2HD1 LEU 59 -13.455 -10.992 -18.145 487 HD13 LEU 59 3HD1 LEU 59 -13.395 -11.627 -19.789 488 HD21 LEU 59 1HD2 LEU 59 -14.089 -12.240 -16.602 489 HD22 LEU 59 2HD2 LEU 59 -13.861 -13.986 -16.504 490 HD23 LEU 59 3HD2 LEU 59 -15.068 -13.314 -17.602 491 H SER 60 H SER 60 -12.494 -17.503 -19.800 492 HA SER 60 HA SER 60 -13.640 -17.639 -22.414 493 HB2 SER 60 2HB SER 60 -11.412 -18.417 -22.247 494 HB3 SER 60 3HB SER 60 -11.785 -19.437 -20.858 495 HG SER 60 HG SER 60 -11.648 -20.732 -22.673 496 H ASP 61 H ASP 61 -14.573 -18.793 -19.354 497 HA ASP 61 HA ASP 61 -16.707 -20.373 -20.595 498 HB2 ASP 61 2HB ASP 61 -14.607 -21.648 -19.459 499 HB3 ASP 61 3HB ASP 61 -15.646 -21.449 -18.051 500 H GLU 62 H GLU 62 -18.662 -19.930 -19.791 501 HA GLU 62 HA GLU 62 -19.113 -17.824 -18.030 502 HB2 GLU 62 2HB GLU 62 -21.457 -18.773 -17.874 503 HB3 GLU 62 3HB GLU 62 -20.870 -18.436 -19.496 504 HG2 GLU 62 2HG GLU 62 -20.425 -20.764 -19.878 505 HG3 GLU 62 3HG GLU 62 -20.833 -21.154 -18.208 506 H VAL 63 H VAL 63 -18.916 -21.291 -17.425 507 HA VAL 63 HA VAL 63 -19.810 -21.278 -14.761 508 HB VAL 63 HB VAL 63 -17.768 -23.168 -15.930 509 HG11 VAL 63 1HG1 VAL 63 -19.787 -24.159 -14.057 510 HG12 VAL 63 2HG1 VAL 63 -18.046 -24.446 -14.109 511 HG13 VAL 63 3HG1 VAL 63 -18.677 -22.977 -13.364 512 HG21 VAL 63 1HG2 VAL 63 -20.324 -24.330 -15.994 513 HG22 VAL 63 2HG2 VAL 63 -20.497 -22.723 -16.698 514 HG23 VAL 63 3HG2 VAL 63 -19.321 -23.856 -17.365 515 H LYS 64 H LYS 64 -16.501 -21.192 -16.075 516 HA LYS 64 HA LYS 64 -15.192 -20.985 -13.593 517 HB2 LYS 64 2HB LYS 64 -14.387 -20.222 -16.394 518 HB3 LYS 64 3HB LYS 64 -13.310 -19.996 -15.022 519 HG2 LYS 64 2HG LYS 64 -13.914 -22.550 -14.621 520 HG3 LYS 64 3HG LYS 64 -14.184 -22.486 -16.364 521 HD2 LYS 64 2HD LYS 64 -11.917 -23.128 -16.032 522 HD3 LYS 64 3HD LYS 64 -11.903 -21.448 -16.575 523 HE2 LYS 64 2HE LYS 64 -10.477 -21.232 -14.826 524 HE3 LYS 64 3HE LYS 64 -11.987 -21.036 -13.938 525 HZ1 LYS 64 1HZ LYS 64 -10.803 -22.600 -12.720 526 HZ2 LYS 64 2HZ LYS 64 -10.241 -23.412 -14.093 527 HZ3 LYS 64 3HZ LYS 64 -11.863 -23.551 -13.634 528 H ARG 65 H ARG 65 -16.265 -18.506 -15.893 529 HA ARG 65 HA ARG 65 -15.240 -16.288 -14.499 530 HB2 ARG 65 2HB ARG 65 -15.894 -16.010 -16.780 531 HB3 ARG 65 3HB ARG 65 -17.529 -16.563 -16.444 532 HG2 ARG 65 2HG ARG 65 -17.899 -14.556 -15.066 533 HG3 ARG 65 3HG ARG 65 -16.280 -13.996 -15.490 534 HD2 ARG 65 2HD ARG 65 -17.594 -12.878 -17.026 535 HD3 ARG 65 3HD ARG 65 -17.096 -14.304 -17.935 536 HE ARG 65 HE ARG 65 -19.568 -14.709 -16.569 537 HH11 ARG 65 1HH1 ARG 65 -18.125 -13.289 -19.401 538 HH12 ARG 65 2HH1 ARG 65 -19.570 -13.397 -20.352 539 HH21 ARG 65 1HH2 ARG 65 -21.476 -14.857 -17.810 540 HH22 ARG 65 2HH2 ARG 65 -21.476 -14.288 -19.446 541 H LYS 66 H LYS 66 -18.421 -17.853 -14.405 542 HA LYS 66 HA LYS 66 -19.621 -16.057 -12.597 543 HB2 LYS 66 2HB LYS 66 -20.192 -18.921 -13.331 544 HB3 LYS 66 3HB LYS 66 -21.151 -18.069 -12.127 545 HG2 LYS 66 2HG LYS 66 -20.756 -17.076 -14.938 546 HG3 LYS 66 3HG LYS 66 -22.108 -18.095 -14.438 547 HD2 LYS 66 2HD LYS 66 -23.096 -16.426 -13.229 548 HD3 LYS 66 3HD LYS 66 -21.562 -15.636 -12.860 549 HE2 LYS 66 2HE LYS 66 -22.792 -14.228 -14.356 550 HE3 LYS 66 3HE LYS 66 -21.433 -14.921 -15.241 551 HZ1 LYS 66 1HZ LYS 66 -23.171 -16.704 -15.897 552 HZ2 LYS 66 2HZ LYS 66 -23.161 -15.217 -16.702 553 HZ3 LYS 66 3HZ LYS 66 -24.302 -15.514 -15.489 554 H GLN 67 H GLN 67 -17.888 -19.108 -12.091 555 HA GLN 67 HA GLN 67 -18.278 -19.328 -9.333 556 HB2 GLN 67 2HB GLN 67 -16.128 -20.311 -11.187 557 HB3 GLN 67 3HB GLN 67 -16.024 -20.598 -9.455 558 HG2 GLN 67 2HG GLN 67 -18.269 -21.479 -11.256 559 HG3 GLN 67 3HG GLN 67 -16.981 -22.504 -10.625 560 HE21 GLN 67 1HE2 GLN 67 -19.930 -20.845 -9.922 561 HE22 GLN 67 2HE2 GLN 67 -20.194 -21.535 -8.361 562 H TYR 68 H TYR 68 -15.647 -17.773 -11.146 563 HA TYR 68 HA TYR 68 -14.189 -16.933 -8.878 564 HB2 TYR 68 2HB TYR 68 -13.079 -17.023 -11.001 565 HB3 TYR 68 3HB TYR 68 -14.244 -15.919 -11.724 566 HD1 TYR 68 HD1 TYR 68 -11.393 -16.178 -9.405 567 HD2 TYR 68 HD2 TYR 68 -14.033 -13.549 -11.459 568 HE1 TYR 68 HE1 TYR 68 -9.935 -14.280 -8.837 569 HE2 TYR 68 HE2 TYR 68 -12.582 -11.644 -10.898 570 HH TYR 68 HH TYR 68 -9.448 -12.086 -9.449 571 H ASP 69 H ASP 69 -16.889 -15.567 -10.615 572 HA ASP 69 HA ASP 69 -16.726 -12.932 -9.615 573 HB2 ASP 69 2HB ASP 69 -18.120 -13.690 -11.569 574 HB3 ASP 69 3HB ASP 69 -19.243 -14.403 -10.413 575 H ALA 70 H ALA 70 -17.919 -15.901 -8.268 576 HA ALA 70 HA ALA 70 -19.588 -14.829 -6.260 577 HB1 ALA 70 1HB ALA 70 -20.041 -16.992 -6.079 578 HB2 ALA 70 2HB ALA 70 -18.615 -17.410 -7.029 579 HB3 ALA 70 3HB ALA 70 -18.485 -17.219 -5.280 580 H TYR 71 H TYR 71 -16.133 -15.336 -6.464 581 HA TYR 71 HA TYR 71 -15.851 -14.276 -3.729 582 HB2 TYR 71 2HB TYR 71 -13.973 -16.060 -5.290 583 HB3 TYR 71 3HB TYR 71 -13.621 -15.375 -3.707 584 HD1 TYR 71 HD1 TYR 71 -15.705 -15.817 -1.979 585 HD2 TYR 71 HD2 TYR 71 -14.591 -18.273 -5.270 586 HE1 TYR 71 HE1 TYR 71 -16.787 -17.744 -0.900 587 HE2 TYR 71 HE2 TYR 71 -15.671 -20.206 -4.201 588 HH TYR 71 HH TYR 71 -16.229 -20.807 -1.621 589 H GLY 72 H GLY 72 -16.162 -12.809 -6.296 590 HA2 GLY 72 2HA GLY 72 -13.545 -11.443 -6.374 591 HA3 GLY 72 3HA GLY 72 -14.693 -11.470 -7.705 592 H SER 73 H SER 73 -13.381 -9.317 -5.935 593 HA SER 73 HA SER 73 -15.624 -8.032 -4.668 594 HB2 SER 73 2HB SER 73 -13.108 -7.885 -4.021 595 HB3 SER 73 3HB SER 73 -13.023 -6.657 -5.284 596 HG SER 73 HG SER 73 -14.621 -5.489 -4.173 Start of MODEL 16 1 H1 HIS 1 H HIS 1 -0.402 1.761 0.132 2 HA HIS 1 HA HIS 1 0.588 2.250 -2.592 3 HB2 HIS 1 2HB HIS 1 2.605 1.079 -1.941 4 HB3 HIS 1 3HB HIS 1 2.254 2.325 -0.747 5 HD1 HIS 1 HD1 HIS 1 1.259 1.470 1.564 6 HD2 HIS 1 HD2 HIS 1 2.739 -1.482 -0.958 7 HE1 HIS 1 HE1 HIS 1 1.537 -0.571 3.008 8 H MET 2 H MET 2 -0.868 -0.136 -0.501 9 HA MET 2 HA MET 2 -0.463 -2.414 -2.103 10 HB2 MET 2 2HB MET 2 -2.438 -1.678 0.029 11 HB3 MET 2 3HB MET 2 -2.649 -3.168 -0.882 12 HG2 MET 2 2HG MET 2 -0.111 -3.502 -0.217 13 HG3 MET 2 3HG MET 2 -0.575 -2.429 1.101 14 HE1 MET 2 1HE MET 2 -2.497 -5.809 -0.584 15 HE2 MET 2 2HE MET 2 -0.746 -5.612 -0.660 16 HE3 MET 2 3HE MET 2 -1.456 -6.772 0.464 17 H LEU 3 H LEU 3 -1.277 -2.942 -4.017 18 HA LEU 3 HA LEU 3 -3.348 -1.313 -5.208 19 HB2 LEU 3 2HB LEU 3 -2.892 -2.552 -7.237 20 HB3 LEU 3 3HB LEU 3 -1.393 -1.976 -6.510 21 HG LEU 3 HG LEU 3 -1.376 -4.415 -5.480 22 HD11 LEU 3 1HD1 LEU 3 -3.114 -5.611 -6.223 23 HD12 LEU 3 2HD1 LEU 3 -2.185 -5.743 -7.716 24 HD13 LEU 3 3HD1 LEU 3 -3.432 -4.506 -7.561 25 HD21 LEU 3 1HD2 LEU 3 -0.264 -5.077 -7.788 26 HD22 LEU 3 2HD2 LEU 3 0.486 -3.913 -6.695 27 HD23 LEU 3 3HD2 LEU 3 -0.437 -3.347 -8.088 28 H ALA 4 H ALA 4 -5.334 -2.070 -5.995 29 HA ALA 4 HA ALA 4 -6.471 -4.227 -4.428 30 HB1 ALA 4 1HB ALA 4 -7.475 -1.898 -5.854 31 HB2 ALA 4 2HB ALA 4 -8.462 -3.338 -6.110 32 HB3 ALA 4 3HB ALA 4 -8.152 -2.761 -4.473 33 H LYS 5 H LYS 5 -7.240 -6.148 -5.195 34 HA LYS 5 HA LYS 5 -6.041 -7.307 -7.432 35 HB2 LYS 5 2HB LYS 5 -8.304 -8.061 -5.638 36 HB3 LYS 5 3HB LYS 5 -8.074 -8.976 -7.122 37 HG2 LYS 5 2HG LYS 5 -6.900 -10.183 -5.519 38 HG3 LYS 5 3HG LYS 5 -5.651 -9.258 -6.355 39 HD2 LYS 5 2HD LYS 5 -5.713 -7.580 -4.561 40 HD3 LYS 5 3HD LYS 5 -6.936 -8.537 -3.720 41 HE2 LYS 5 2HE LYS 5 -4.121 -9.410 -4.368 42 HE3 LYS 5 3HE LYS 5 -4.720 -8.927 -2.781 43 HZ1 LYS 5 1HZ LYS 5 -4.918 -11.449 -4.095 44 HZ2 LYS 5 2HZ LYS 5 -6.438 -10.890 -3.610 45 HZ3 LYS 5 3HZ LYS 5 -5.197 -11.059 -2.473 46 H GLU 6 H GLU 6 -6.370 -6.893 -9.508 47 HA GLU 6 HA GLU 6 -8.768 -5.579 -10.414 48 HB2 GLU 6 2HB GLU 6 -6.547 -6.681 -12.132 49 HB3 GLU 6 3HB GLU 6 -7.687 -5.405 -12.534 50 HG2 GLU 6 2HG GLU 6 -6.627 -4.166 -10.522 51 HG3 GLU 6 3HG GLU 6 -5.304 -5.311 -10.741 52 H ASP 7 H ASP 7 -10.404 -6.415 -11.623 53 HA ASP 7 HA ASP 7 -10.715 -9.287 -11.578 54 HB2 ASP 7 2HB ASP 7 -12.639 -7.366 -12.866 55 HB3 ASP 7 3HB ASP 7 -12.975 -8.919 -12.104 56 H TYR 8 H TYR 8 -11.170 -10.587 -13.416 57 HA TYR 8 HA TYR 8 -9.435 -10.247 -15.567 58 HB2 TYR 8 2HB TYR 8 -11.970 -11.887 -15.636 59 HB3 TYR 8 3HB TYR 8 -10.497 -12.153 -16.562 60 HD1 TYR 8 HD1 TYR 8 -12.203 -13.841 -14.377 61 HD2 TYR 8 HD2 TYR 8 -8.446 -11.843 -14.445 62 HE1 TYR 8 HE1 TYR 8 -11.376 -15.348 -12.618 63 HE2 TYR 8 HE2 TYR 8 -7.609 -13.346 -12.687 64 HH TYR 8 HH TYR 8 -8.089 -15.569 -11.782 65 H TYR 9 H TYR 9 -12.641 -9.046 -15.058 66 HA TYR 9 HA TYR 9 -13.498 -8.609 -17.668 67 HB2 TYR 9 2HB TYR 9 -13.995 -6.847 -15.260 68 HB3 TYR 9 3HB TYR 9 -14.950 -6.873 -16.738 69 HD1 TYR 9 HD1 TYR 9 -14.534 -8.260 -13.480 70 HD2 TYR 9 HD2 TYR 9 -16.127 -9.075 -17.340 71 HE1 TYR 9 HE1 TYR 9 -15.967 -10.009 -12.513 72 HE2 TYR 9 HE2 TYR 9 -17.566 -10.825 -16.383 73 HH TYR 9 HH TYR 9 -18.355 -11.093 -13.334 74 H GLN 10 H GLN 10 -11.600 -6.481 -15.545 75 HA GLN 10 HA GLN 10 -11.286 -4.459 -17.545 76 HB2 GLN 10 2HB GLN 10 -9.957 -4.934 -14.880 77 HB3 GLN 10 3HB GLN 10 -9.549 -3.573 -15.916 78 HG2 GLN 10 2HG GLN 10 -11.083 -2.616 -14.523 79 HG3 GLN 10 3HG GLN 10 -12.118 -3.128 -15.855 80 HE21 GLN 10 1HE2 GLN 10 -10.799 -4.384 -12.810 81 HE22 GLN 10 2HE2 GLN 10 -12.248 -5.181 -12.312 82 H ILE 11 H ILE 11 -9.475 -7.262 -16.521 83 HA ILE 11 HA ILE 11 -7.012 -6.622 -17.744 84 HB ILE 11 HB ILE 11 -8.187 -9.350 -17.194 85 HG12 ILE 11 2HG1 ILE 11 -6.217 -7.768 -15.536 86 HG13 ILE 11 3HG1 ILE 11 -7.948 -7.796 -15.221 87 HG21 ILE 11 1HG2 ILE 11 -6.441 -10.052 -18.403 88 HG22 ILE 11 2HG2 ILE 11 -5.668 -8.468 -18.374 89 HG23 ILE 11 3HG2 ILE 11 -5.465 -9.573 -17.015 90 HD11 ILE 11 1HD1 ILE 11 -7.209 -10.470 -15.391 91 HD12 ILE 11 2HD1 ILE 11 -5.918 -9.688 -14.478 92 HD13 ILE 11 3HD1 ILE 11 -7.589 -9.555 -13.932 93 H LEU 12 H LEU 12 -10.021 -7.728 -19.009 94 HA LEU 12 HA LEU 12 -8.755 -8.287 -21.608 95 HB2 LEU 12 2HB LEU 12 -11.167 -9.370 -20.243 96 HB3 LEU 12 3HB LEU 12 -11.172 -9.274 -22.003 97 HG LEU 12 HG LEU 12 -9.165 -10.789 -20.333 98 HD11 LEU 12 1HD1 LEU 12 -11.800 -11.464 -21.185 99 HD12 LEU 12 2HD1 LEU 12 -10.635 -12.445 -20.297 100 HD13 LEU 12 3HD1 LEU 12 -10.640 -12.463 -22.060 101 HD21 LEU 12 1HD2 LEU 12 -8.060 -10.127 -22.299 102 HD22 LEU 12 2HD2 LEU 12 -9.492 -10.392 -23.294 103 HD23 LEU 12 3HD2 LEU 12 -8.621 -11.769 -22.617 104 H GLY 13 H GLY 13 -10.713 -6.106 -19.900 105 HA2 GLY 13 2HA GLY 13 -11.550 -4.065 -20.606 106 HA3 GLY 13 3HA GLY 13 -11.048 -4.465 -22.242 107 H VAL 14 H VAL 14 -13.207 -6.288 -20.109 108 HA VAL 14 HA VAL 14 -15.406 -5.738 -21.992 109 HB VAL 14 HB VAL 14 -16.205 -8.004 -21.769 110 HG11 VAL 14 1HG1 VAL 14 -14.746 -8.960 -23.235 111 HG12 VAL 14 2HG1 VAL 14 -14.153 -7.299 -23.293 112 HG13 VAL 14 3HG1 VAL 14 -13.326 -8.498 -22.298 113 HG21 VAL 14 1HG2 VAL 14 -14.951 -9.704 -20.528 114 HG22 VAL 14 2HG2 VAL 14 -13.831 -8.464 -19.963 115 HG23 VAL 14 3HG2 VAL 14 -15.522 -8.418 -19.466 116 HA PRO 15 HA PRO 15 -17.841 -4.609 -18.515 117 HB2 PRO 15 2HB PRO 15 -20.315 -5.321 -19.377 118 HB3 PRO 15 3HB PRO 15 -19.439 -3.925 -20.017 119 HG2 PRO 15 2HG PRO 15 -19.722 -6.675 -21.167 120 HG3 PRO 15 3HG PRO 15 -19.818 -5.105 -21.985 121 HD2 PRO 15 2HD PRO 15 -17.597 -6.652 -22.059 122 HD3 PRO 15 3HD PRO 15 -17.526 -4.879 -22.092 123 H ARG 16 H ARG 16 -19.604 -5.498 -17.036 124 HA ARG 16 HA ARG 16 -18.768 -8.094 -16.121 125 HB2 ARG 16 2HB ARG 16 -20.929 -6.244 -15.093 126 HB3 ARG 16 3HB ARG 16 -20.363 -7.695 -14.277 127 HG2 ARG 16 2HG ARG 16 -18.382 -6.739 -13.647 128 HG3 ARG 16 3HG ARG 16 -18.383 -5.594 -14.989 129 HD2 ARG 16 2HD ARG 16 -19.975 -4.210 -13.940 130 HD3 ARG 16 3HD ARG 16 -20.396 -5.454 -12.764 131 HE ARG 16 HE ARG 16 -18.232 -3.583 -12.600 132 HH11 ARG 16 1HH1 ARG 16 -19.342 -6.734 -11.621 133 HH12 ARG 16 2HH1 ARG 16 -18.345 -6.789 -10.205 134 HH21 ARG 16 1HH2 ARG 16 -16.914 -3.644 -10.739 135 HH22 ARG 16 2HH2 ARG 16 -16.965 -5.030 -9.704 136 H ASN 17 H ASN 17 -20.988 -7.054 -18.378 137 HA ASN 17 HA ASN 17 -22.650 -9.460 -18.016 138 HB2 ASN 17 2HB ASN 17 -24.336 -8.201 -19.440 139 HB3 ASN 17 3HB ASN 17 -24.070 -7.562 -17.820 140 HD21 ASN 17 1HD2 ASN 17 -24.533 -5.468 -18.125 141 HD22 ASN 17 2HD2 ASN 17 -23.694 -4.426 -19.219 142 H ALA 18 H ALA 18 -20.079 -8.516 -19.663 143 HA ALA 18 HA ALA 18 -20.574 -8.812 -22.369 144 HB1 ALA 18 1HB ALA 18 -18.346 -8.740 -22.580 145 HB2 ALA 18 2HB ALA 18 -18.341 -8.480 -20.835 146 HB3 ALA 18 3HB ALA 18 -18.102 -10.102 -21.486 147 H SER 19 H SER 19 -20.068 -10.655 -23.784 148 HA SER 19 HA SER 19 -21.073 -13.158 -22.610 149 HB2 SER 19 2HB SER 19 -21.029 -12.474 -25.549 150 HB3 SER 19 3HB SER 19 -21.970 -13.726 -24.738 151 HG SER 19 HG SER 19 -22.363 -10.944 -24.779 152 H GLN 20 H GLN 20 -20.166 -15.167 -23.340 153 HA GLN 20 HA GLN 20 -17.408 -15.312 -23.221 154 HB2 GLN 20 2HB GLN 20 -19.153 -17.331 -24.629 155 HB3 GLN 20 3HB GLN 20 -17.610 -17.620 -23.836 156 HG2 GLN 20 2HG GLN 20 -20.243 -16.960 -22.549 157 HG3 GLN 20 3HG GLN 20 -19.317 -18.454 -22.419 158 HE21 GLN 20 1HE2 GLN 20 -17.094 -18.179 -21.488 159 HE22 GLN 20 2HE2 GLN 20 -16.931 -17.097 -20.151 160 H LYS 21 H LYS 21 -19.475 -14.772 -25.964 161 HA LYS 21 HA LYS 21 -17.459 -15.320 -27.936 162 HB2 LYS 21 2HB LYS 21 -19.087 -14.374 -29.529 163 HB3 LYS 21 3HB LYS 21 -19.805 -15.607 -28.501 164 HG2 LYS 21 2HG LYS 21 -20.754 -13.822 -27.083 165 HG3 LYS 21 3HG LYS 21 -20.106 -12.626 -28.207 166 HD2 LYS 21 2HD LYS 21 -21.957 -14.833 -29.076 167 HD3 LYS 21 3HD LYS 21 -22.544 -13.267 -28.512 168 HE2 LYS 21 2HE LYS 21 -20.549 -13.555 -30.745 169 HE3 LYS 21 3HE LYS 21 -22.291 -13.546 -31.019 170 HZ1 LYS 21 1HZ LYS 21 -21.131 -11.369 -29.442 171 HZ2 LYS 21 2HZ LYS 21 -22.456 -11.352 -30.492 172 HZ3 LYS 21 3HZ LYS 21 -20.884 -11.352 -31.115 173 H GLU 22 H GLU 22 -18.815 -12.433 -26.411 174 HA GLU 22 HA GLU 22 -17.363 -10.572 -27.992 175 HB2 GLU 22 2HB GLU 22 -19.404 -9.949 -26.782 176 HB3 GLU 22 3HB GLU 22 -18.594 -10.242 -25.250 177 HG2 GLU 22 2HG GLU 22 -18.704 -7.871 -25.744 178 HG3 GLU 22 3HG GLU 22 -17.034 -8.433 -25.713 179 H ILE 23 H ILE 23 -16.660 -12.358 -25.083 180 HA ILE 23 HA ILE 23 -14.425 -10.798 -24.256 181 HB ILE 23 HB ILE 23 -15.164 -13.653 -23.607 182 HG12 ILE 23 2HG1 ILE 23 -15.411 -11.193 -21.875 183 HG13 ILE 23 3HG1 ILE 23 -16.721 -11.772 -22.898 184 HG21 ILE 23 1HG2 ILE 23 -13.096 -13.833 -22.796 185 HG22 ILE 23 2HG2 ILE 23 -12.777 -12.114 -23.025 186 HG23 ILE 23 3HG2 ILE 23 -13.583 -12.673 -21.560 187 HD11 ILE 23 1HD1 ILE 23 -15.941 -14.009 -21.475 188 HD12 ILE 23 2HD1 ILE 23 -15.855 -12.692 -20.304 189 HD13 ILE 23 3HD1 ILE 23 -17.358 -13.004 -21.173 190 H LYS 24 H LYS 24 -14.860 -13.519 -26.415 191 HA LYS 24 HA LYS 24 -12.172 -14.316 -26.639 192 HB2 LYS 24 2HB LYS 24 -14.627 -14.648 -28.300 193 HB3 LYS 24 3HB LYS 24 -13.073 -15.025 -29.033 194 HG2 LYS 24 2HG LYS 24 -12.646 -16.528 -27.049 195 HG3 LYS 24 3HG LYS 24 -14.345 -16.301 -26.630 196 HD2 LYS 24 2HD LYS 24 -13.694 -17.108 -29.415 197 HD3 LYS 24 3HD LYS 24 -13.527 -18.321 -28.144 198 HE2 LYS 24 2HE LYS 24 -16.014 -16.666 -28.497 199 HE3 LYS 24 3HE LYS 24 -15.772 -18.205 -29.322 200 HZ1 LYS 24 1HZ LYS 24 -17.019 -18.241 -27.129 201 HZ2 LYS 24 2HZ LYS 24 -15.525 -17.963 -26.386 202 HZ3 LYS 24 3HZ LYS 24 -15.763 -19.360 -27.310 203 H LYS 25 H LYS 25 -14.065 -11.892 -28.371 204 HA LYS 25 HA LYS 25 -12.046 -11.256 -30.269 205 HB2 LYS 25 2HB LYS 25 -14.498 -9.774 -29.326 206 HB3 LYS 25 3HB LYS 25 -13.435 -9.154 -30.581 207 HG2 LYS 25 2HG LYS 25 -14.097 -10.716 -32.111 208 HG3 LYS 25 3HG LYS 25 -14.521 -11.905 -30.878 209 HD2 LYS 25 2HD LYS 25 -16.576 -11.189 -31.768 210 HD3 LYS 25 3HD LYS 25 -16.415 -10.323 -30.238 211 HE2 LYS 25 2HE LYS 25 -17.073 -8.627 -31.645 212 HE3 LYS 25 3HE LYS 25 -15.319 -8.483 -31.736 213 HZ1 LYS 25 1HZ LYS 25 -16.822 -10.121 -33.680 214 HZ2 LYS 25 2HZ LYS 25 -15.272 -9.462 -33.829 215 HZ3 LYS 25 3HZ LYS 25 -16.629 -8.455 -33.904 216 H ALA 26 H ALA 26 -13.055 -9.791 -27.200 217 HA ALA 26 HA ALA 26 -11.282 -7.614 -27.244 218 HB1 ALA 26 1HB ALA 26 -12.262 -9.021 -24.769 219 HB2 ALA 26 2HB ALA 26 -11.780 -7.332 -24.936 220 HB3 ALA 26 3HB ALA 26 -13.251 -7.910 -25.717 221 H TYR 27 H TYR 27 -10.846 -10.960 -26.339 222 HA TYR 27 HA TYR 27 -8.368 -10.592 -24.972 223 HB2 TYR 27 2HB TYR 27 -9.640 -12.551 -24.457 224 HB3 TYR 27 3HB TYR 27 -9.711 -13.027 -26.150 225 HD1 TYR 27 HD1 TYR 27 -6.966 -12.086 -23.783 226 HD2 TYR 27 HD2 TYR 27 -8.471 -14.915 -26.583 227 HE1 TYR 27 HE1 TYR 27 -4.946 -13.456 -23.476 228 HE2 TYR 27 HE2 TYR 27 -6.456 -16.293 -26.283 229 HH TYR 27 HH TYR 27 -4.582 -16.583 -25.104 230 H TYR 28 H TYR 28 -9.302 -11.258 -28.288 231 HA TYR 28 HA TYR 28 -6.651 -11.850 -29.191 232 HB2 TYR 28 2HB TYR 28 -8.549 -12.752 -30.398 233 HB3 TYR 28 3HB TYR 28 -9.170 -11.134 -30.705 234 HD1 TYR 28 HD1 TYR 28 -8.904 -10.411 -32.870 235 HD2 TYR 28 HD2 TYR 28 -5.916 -12.927 -31.183 236 HE1 TYR 28 HE1 TYR 28 -7.649 -10.328 -34.984 237 HE2 TYR 28 HE2 TYR 28 -4.652 -12.850 -33.292 238 HH TYR 28 HH TYR 28 -5.321 -12.420 -35.824 239 H GLN 29 H GLN 29 -8.794 -9.026 -29.440 240 HA GLN 29 HA GLN 29 -7.069 -7.386 -30.907 241 HB2 GLN 29 2HB GLN 29 -8.486 -5.586 -30.326 242 HB3 GLN 29 3HB GLN 29 -9.527 -7.002 -30.390 243 HG2 GLN 29 2HG GLN 29 -9.489 -7.173 -27.974 244 HG3 GLN 29 3HG GLN 29 -8.380 -5.805 -27.878 245 HE21 GLN 29 1HE2 GLN 29 -11.540 -6.661 -29.243 246 HE22 GLN 29 2HE2 GLN 29 -12.300 -5.154 -28.875 247 H LEU 30 H LEU 30 -7.258 -8.054 -27.469 248 HA LEU 30 HA LEU 30 -5.477 -5.972 -26.673 249 HB2 LEU 30 2HB LEU 30 -7.013 -8.056 -25.418 250 HB3 LEU 30 3HB LEU 30 -5.380 -8.012 -24.756 251 HG LEU 30 HG LEU 30 -5.662 -5.733 -24.056 252 HD11 LEU 30 1HD1 LEU 30 -8.283 -5.036 -24.417 253 HD12 LEU 30 2HD1 LEU 30 -7.879 -5.808 -25.950 254 HD13 LEU 30 3HD1 LEU 30 -6.923 -4.444 -25.372 255 HD21 LEU 30 1HD2 LEU 30 -7.902 -6.075 -22.703 256 HD22 LEU 30 2HD2 LEU 30 -6.453 -7.011 -22.336 257 HD23 LEU 30 3HD2 LEU 30 -7.741 -7.723 -23.308 258 H ALA 31 H ALA 31 -5.114 -9.418 -27.377 259 HA ALA 31 HA ALA 31 -2.463 -9.749 -26.582 260 HB1 ALA 31 1HB ALA 31 -3.308 -11.780 -27.073 261 HB2 ALA 31 2HB ALA 31 -4.323 -11.162 -28.376 262 HB3 ALA 31 3HB ALA 31 -2.608 -11.458 -28.660 263 H LYS 32 H LYS 32 -3.806 -8.548 -29.617 264 HA LYS 32 HA LYS 32 -1.418 -8.464 -31.092 265 HB2 LYS 32 2HB LYS 32 -3.975 -6.880 -31.277 266 HB3 LYS 32 3HB LYS 32 -2.645 -6.644 -32.403 267 HG2 LYS 32 2HG LYS 32 -3.021 -8.599 -33.475 268 HG3 LYS 32 3HG LYS 32 -3.574 -9.422 -32.015 269 HD2 LYS 32 2HD LYS 32 -5.423 -9.172 -33.549 270 HD3 LYS 32 3HD LYS 32 -5.687 -8.143 -32.140 271 HE2 LYS 32 2HE LYS 32 -5.275 -6.198 -33.324 272 HE3 LYS 32 3HE LYS 32 -4.344 -7.031 -34.567 273 HZ1 LYS 32 1HZ LYS 32 -6.367 -6.491 -35.571 274 HZ2 LYS 32 2HZ LYS 32 -7.280 -6.953 -34.224 275 HZ3 LYS 32 3HZ LYS 32 -6.528 -8.129 -35.180 276 H LYS 33 H LYS 33 -2.546 -6.526 -28.503 277 HA LYS 33 HA LYS 33 -0.949 -4.211 -29.126 278 HB2 LYS 33 2HB LYS 33 -2.152 -4.873 -26.444 279 HB3 LYS 33 3HB LYS 33 -1.761 -3.287 -27.096 280 HG2 LYS 33 2HG LYS 33 -3.529 -3.664 -28.829 281 HG3 LYS 33 3HG LYS 33 -3.992 -5.118 -27.943 282 HD2 LYS 33 2HD LYS 33 -4.901 -3.942 -26.218 283 HD3 LYS 33 3HD LYS 33 -3.766 -2.601 -26.392 284 HE2 LYS 33 2HE LYS 33 -5.840 -3.121 -28.488 285 HE3 LYS 33 3HE LYS 33 -6.261 -2.251 -27.013 286 HZ1 LYS 33 1HZ LYS 33 -4.181 -0.851 -27.630 287 HZ2 LYS 33 2HZ LYS 33 -5.656 -0.551 -28.401 288 HZ3 LYS 33 3HZ LYS 33 -4.458 -1.448 -29.189 289 H TYR 34 H TYR 34 -0.726 -6.970 -26.924 290 HA TYR 34 HA TYR 34 1.930 -6.088 -26.070 291 HB2 TYR 34 2HB TYR 34 0.230 -8.380 -25.064 292 HB3 TYR 34 3HB TYR 34 1.758 -7.850 -24.369 293 HD1 TYR 34 HD1 TYR 34 1.875 -5.893 -22.975 294 HD2 TYR 34 HD2 TYR 34 -1.792 -7.004 -24.823 295 HE1 TYR 34 HE1 TYR 34 0.672 -4.316 -21.521 296 HE2 TYR 34 HE2 TYR 34 -3.006 -5.430 -23.376 297 HH TYR 34 HH TYR 34 -2.822 -4.196 -21.436 298 H HIS 35 H HIS 35 1.118 -7.343 -28.735 299 HA HIS 35 HA HIS 35 2.152 -9.928 -28.950 300 HB2 HIS 35 2HB HIS 35 1.387 -7.785 -30.765 301 HB3 HIS 35 3HB HIS 35 2.760 -8.706 -31.374 302 HD1 HIS 35 HD1 HIS 35 1.173 -9.613 -33.263 303 HD2 HIS 35 HD2 HIS 35 0.138 -10.746 -29.402 304 HE1 HIS 35 HE1 HIS 35 -0.467 -11.501 -33.533 305 HA PRO 36 HA PRO 36 6.518 -9.588 -28.718 306 HB2 PRO 36 2HB PRO 36 7.346 -11.279 -30.674 307 HB3 PRO 36 3HB PRO 36 6.624 -11.840 -29.161 308 HG2 PRO 36 2HG PRO 36 5.359 -11.503 -31.853 309 HG3 PRO 36 3HG PRO 36 5.180 -12.830 -30.691 310 HD2 PRO 36 2HD PRO 36 3.333 -10.869 -30.956 311 HD3 PRO 36 3HD PRO 36 3.660 -11.669 -29.406 312 H ASP 37 H ASP 37 4.879 -8.642 -31.563 313 HA ASP 37 HA ASP 37 7.195 -7.761 -33.023 314 HB2 ASP 37 2HB ASP 37 4.829 -8.427 -33.920 315 HB3 ASP 37 3HB ASP 37 4.424 -6.751 -33.560 316 H THR 38 H THR 38 5.256 -6.504 -30.507 317 HA THR 38 HA THR 38 6.292 -3.788 -30.979 318 HB THR 38 HB THR 38 4.497 -2.901 -29.709 319 HG1 THR 38 HG1 THR 38 4.379 -5.478 -28.698 320 HG21 THR 38 1HG2 THR 38 4.057 -4.310 -32.024 321 HG22 THR 38 2HG2 THR 38 2.904 -3.215 -31.260 322 HG23 THR 38 3HG2 THR 38 2.816 -4.948 -30.946 323 H ASN 39 H ASN 39 7.295 -6.375 -29.468 324 HA ASN 39 HA ASN 39 7.774 -5.225 -26.835 325 HB2 ASN 39 2HB ASN 39 8.040 -7.925 -28.056 326 HB3 ASN 39 3HB ASN 39 9.126 -7.532 -26.725 327 HD21 ASN 39 1HD2 ASN 39 5.752 -6.654 -27.348 328 HD22 ASN 39 2HD2 ASN 39 5.126 -7.328 -25.886 329 H LYS 40 H LYS 40 9.040 -4.471 -29.585 330 HA LYS 40 HA LYS 40 11.806 -5.010 -29.390 331 HB2 LYS 40 2HB LYS 40 10.086 -3.175 -30.962 332 HB3 LYS 40 3HB LYS 40 11.781 -2.729 -30.818 333 HG2 LYS 40 2HG LYS 40 11.912 -3.988 -32.693 334 HG3 LYS 40 3HG LYS 40 12.111 -5.273 -31.499 335 HD2 LYS 40 2HD LYS 40 9.330 -4.608 -32.232 336 HD3 LYS 40 3HD LYS 40 10.307 -5.354 -33.500 337 HE2 LYS 40 2HE LYS 40 10.425 -6.567 -30.798 338 HE3 LYS 40 3HE LYS 40 8.931 -6.776 -31.710 339 HZ1 LYS 40 1HZ LYS 40 11.632 -7.460 -32.736 340 HZ2 LYS 40 2HZ LYS 40 10.154 -7.770 -33.497 341 HZ3 LYS 40 3HZ LYS 40 10.553 -8.576 -32.065 342 H ASP 41 H ASP 41 9.804 -2.333 -28.246 343 HA ASP 41 HA ASP 41 12.128 -1.344 -26.727 344 HB2 ASP 41 2HB ASP 41 9.778 0.388 -27.437 345 HB3 ASP 41 3HB ASP 41 11.415 0.870 -27.000 346 H ASP 42 H ASP 42 9.767 -3.274 -26.193 347 HA ASP 42 HA ASP 42 9.225 -2.231 -23.517 348 HB2 ASP 42 2HB ASP 42 7.319 -1.845 -25.343 349 HB3 ASP 42 3HB ASP 42 6.930 -3.510 -24.920 350 HA PRO 43 HA PRO 43 10.489 -6.664 -23.463 351 HB2 PRO 43 2HB PRO 43 12.042 -6.415 -21.250 352 HB3 PRO 43 3HB PRO 43 12.630 -6.066 -22.880 353 HG2 PRO 43 2HG PRO 43 11.667 -4.175 -20.769 354 HG3 PRO 43 3HG PRO 43 13.067 -4.029 -21.847 355 HD2 PRO 43 2HD PRO 43 10.732 -2.738 -22.309 356 HD3 PRO 43 3HD PRO 43 11.785 -3.307 -23.621 357 H LYS 44 H LYS 44 8.717 -4.575 -21.482 358 HA LYS 44 HA LYS 44 8.127 -6.616 -19.477 359 HB2 LYS 44 2HB LYS 44 7.804 -3.681 -19.668 360 HB3 LYS 44 3HB LYS 44 6.537 -4.534 -18.796 361 HG2 LYS 44 2HG LYS 44 9.478 -4.760 -18.194 362 HG3 LYS 44 3HG LYS 44 8.350 -3.705 -17.340 363 HD2 LYS 44 2HD LYS 44 7.566 -6.543 -17.554 364 HD3 LYS 44 3HD LYS 44 8.963 -6.200 -16.533 365 HE2 LYS 44 2HE LYS 44 7.280 -4.269 -15.700 366 HE3 LYS 44 3HE LYS 44 6.117 -5.512 -16.161 367 HZ1 LYS 44 1HZ LYS 44 7.654 -7.039 -14.778 368 HZ2 LYS 44 2HZ LYS 44 6.555 -6.031 -13.980 369 HZ3 LYS 44 3HZ LYS 44 8.188 -5.596 -14.073 370 H ALA 45 H ALA 45 6.863 -5.318 -22.378 371 HA ALA 45 HA ALA 45 4.118 -5.634 -22.056 372 HB1 ALA 45 1HB ALA 45 5.931 -5.791 -24.431 373 HB2 ALA 45 2HB ALA 45 4.208 -6.133 -24.594 374 HB3 ALA 45 3HB ALA 45 4.743 -4.557 -24.010 375 H LYS 46 H LYS 46 6.613 -8.011 -22.743 376 HA LYS 46 HA LYS 46 4.975 -10.158 -23.488 377 HB2 LYS 46 2HB LYS 46 6.879 -11.589 -22.815 378 HB3 LYS 46 3HB LYS 46 7.372 -10.235 -23.823 379 HG2 LYS 46 2HG LYS 46 7.902 -9.041 -21.616 380 HG3 LYS 46 3HG LYS 46 7.804 -10.647 -20.889 381 HD2 LYS 46 2HD LYS 46 10.094 -10.238 -21.418 382 HD3 LYS 46 3HD LYS 46 9.484 -11.417 -22.582 383 HE2 LYS 46 2HE LYS 46 9.514 -9.911 -24.324 384 HE3 LYS 46 3HE LYS 46 9.371 -8.514 -23.258 385 HZ1 LYS 46 1HZ LYS 46 11.689 -9.600 -24.361 386 HZ2 LYS 46 2HZ LYS 46 11.774 -9.851 -22.691 387 HZ3 LYS 46 3HZ LYS 46 11.558 -8.288 -23.301 388 H GLU 47 H GLU 47 6.070 -9.068 -20.305 389 HA GLU 47 HA GLU 47 4.997 -11.225 -18.834 390 HB2 GLU 47 2HB GLU 47 6.702 -9.486 -18.065 391 HB3 GLU 47 3HB GLU 47 5.332 -8.419 -17.789 392 HG2 GLU 47 2HG GLU 47 4.615 -9.571 -15.974 393 HG3 GLU 47 3HG GLU 47 5.211 -11.116 -16.578 394 H LYS 48 H LYS 48 3.666 -8.126 -19.852 395 HA LYS 48 HA LYS 48 1.255 -8.342 -18.353 396 HB2 LYS 48 2HB LYS 48 1.790 -6.709 -20.841 397 HB3 LYS 48 3HB LYS 48 0.475 -6.467 -19.698 398 HG2 LYS 48 2HG LYS 48 3.414 -6.104 -19.156 399 HG3 LYS 48 3HG LYS 48 2.201 -4.832 -19.321 400 HD2 LYS 48 2HD LYS 48 1.043 -5.680 -17.340 401 HD3 LYS 48 3HD LYS 48 2.248 -6.961 -17.180 402 HE2 LYS 48 2HE LYS 48 3.005 -5.369 -15.680 403 HE3 LYS 48 3HE LYS 48 3.952 -5.011 -17.123 404 HZ1 LYS 48 1HZ LYS 48 3.123 -2.975 -17.141 405 HZ2 LYS 48 2HZ LYS 48 2.269 -3.298 -15.717 406 HZ3 LYS 48 3HZ LYS 48 1.540 -3.568 -17.220 407 H PHE 49 H PHE 49 2.254 -9.334 -21.565 408 HA PHE 49 HA PHE 49 -0.255 -9.869 -22.677 409 HB2 PHE 49 2HB PHE 49 1.677 -9.863 -24.095 410 HB3 PHE 49 3HB PHE 49 2.441 -11.143 -23.158 411 HD1 PHE 49 HD1 PHE 49 -0.027 -10.346 -25.714 412 HD2 PHE 49 HD2 PHE 49 1.706 -13.452 -23.376 413 HE1 PHE 49 HE1 PHE 49 -1.003 -12.024 -27.226 414 HE2 PHE 49 HE2 PHE 49 0.734 -15.135 -24.885 415 HZ PHE 49 HZ PHE 49 -0.621 -14.422 -26.813 416 H SER 50 H SER 50 1.724 -11.708 -20.457 417 HA SER 50 HA SER 50 0.404 -14.188 -20.701 418 HB2 SER 50 2HB SER 50 2.611 -13.913 -19.613 419 HB3 SER 50 3HB SER 50 1.834 -13.053 -18.284 420 HG SER 50 HG SER 50 2.247 -15.520 -18.247 421 H GLN 51 H GLN 51 -0.287 -11.300 -18.850 422 HA GLN 51 HA GLN 51 -2.181 -12.405 -17.078 423 HB2 GLN 51 2HB GLN 51 -1.900 -9.589 -18.138 424 HB3 GLN 51 3HB GLN 51 -2.967 -10.051 -16.819 425 HG2 GLN 51 2HG GLN 51 0.025 -10.013 -16.885 426 HG3 GLN 51 3HG GLN 51 -1.071 -9.190 -15.776 427 HE21 GLN 51 1HE2 GLN 51 -2.212 -10.474 -14.222 428 HE22 GLN 51 2HE2 GLN 51 -1.533 -11.961 -13.663 429 H LEU 52 H LEU 52 -2.406 -11.236 -20.369 430 HA LEU 52 HA LEU 52 -5.185 -10.974 -20.573 431 HB2 LEU 52 2HB LEU 52 -3.268 -11.864 -22.721 432 HB3 LEU 52 3HB LEU 52 -4.874 -11.181 -22.968 433 HG LEU 52 HG LEU 52 -2.687 -9.626 -21.616 434 HD11 LEU 52 1HD1 LEU 52 -1.797 -8.910 -23.587 435 HD12 LEU 52 2HD1 LEU 52 -3.276 -9.214 -24.497 436 HD13 LEU 52 3HD1 LEU 52 -2.227 -10.558 -24.047 437 HD21 LEU 52 1HD2 LEU 52 -5.431 -9.146 -22.499 438 HD22 LEU 52 2HD2 LEU 52 -4.285 -7.919 -23.038 439 HD23 LEU 52 3HD2 LEU 52 -4.448 -8.279 -21.319 440 H ALA 53 H ALA 53 -3.088 -13.773 -21.186 441 HA ALA 53 HA ALA 53 -5.202 -15.516 -21.940 442 HB1 ALA 53 1HB ALA 53 -3.474 -16.744 -22.587 443 HB2 ALA 53 2HB ALA 53 -2.370 -15.636 -21.772 444 HB3 ALA 53 3HB ALA 53 -3.033 -17.019 -20.902 445 H GLU 54 H GLU 54 -3.702 -14.679 -18.886 446 HA GLU 54 HA GLU 54 -4.707 -16.811 -17.344 447 HB2 GLU 54 2HB GLU 54 -3.801 -14.026 -16.656 448 HB3 GLU 54 3HB GLU 54 -4.413 -15.122 -15.425 449 HG2 GLU 54 2HG GLU 54 -2.210 -15.991 -17.243 450 HG3 GLU 54 3HG GLU 54 -1.867 -14.961 -15.854 451 H ALA 55 H ALA 55 -5.944 -13.511 -17.836 452 HA ALA 55 HA ALA 55 -8.314 -13.945 -16.312 453 HB1 ALA 55 1HB ALA 55 -8.427 -11.735 -16.441 454 HB2 ALA 55 2HB ALA 55 -7.026 -11.746 -17.514 455 HB3 ALA 55 3HB ALA 55 -8.654 -11.819 -18.188 456 H TYR 56 H TYR 56 -7.531 -14.056 -19.755 457 HA TYR 56 HA TYR 56 -10.151 -14.335 -20.730 458 HB2 TYR 56 2HB TYR 56 -8.522 -13.802 -22.335 459 HB3 TYR 56 3HB TYR 56 -7.451 -15.097 -21.812 460 HD1 TYR 56 HD1 TYR 56 -10.488 -14.299 -23.730 461 HD2 TYR 56 HD2 TYR 56 -7.712 -17.335 -22.645 462 HE1 TYR 56 HE1 TYR 56 -11.395 -15.751 -25.495 463 HE2 TYR 56 HE2 TYR 56 -8.610 -18.795 -24.408 464 HH TYR 56 HH TYR 56 -9.872 -18.372 -26.682 465 H GLU 57 H GLU 57 -7.978 -16.588 -19.236 466 HA GLU 57 HA GLU 57 -9.076 -19.001 -20.157 467 HB2 GLU 57 2HB GLU 57 -7.360 -18.157 -17.906 468 HB3 GLU 57 3HB GLU 57 -8.238 -19.659 -17.662 469 HG2 GLU 57 2HG GLU 57 -7.181 -20.710 -19.454 470 HG3 GLU 57 3HG GLU 57 -6.635 -19.183 -20.145 471 H VAL 58 H VAL 58 -9.839 -17.051 -17.288 472 HA VAL 58 HA VAL 58 -11.925 -18.802 -16.409 473 HB VAL 58 HB VAL 58 -11.376 -15.940 -15.611 474 HG11 VAL 58 1HG1 VAL 58 -12.554 -17.265 -13.490 475 HG12 VAL 58 2HG1 VAL 58 -13.336 -16.101 -14.561 476 HG13 VAL 58 3HG1 VAL 58 -13.458 -17.829 -14.894 477 HG21 VAL 58 1HG2 VAL 58 -9.705 -16.660 -14.329 478 HG22 VAL 58 2HG2 VAL 58 -10.689 -17.967 -13.670 479 HG23 VAL 58 3HG2 VAL 58 -9.810 -18.201 -15.181 480 H LEU 59 H LEU 59 -11.794 -15.750 -18.189 481 HA LEU 59 HA LEU 59 -14.633 -15.440 -18.326 482 HB2 LEU 59 2HB LEU 59 -12.473 -14.177 -20.007 483 HB3 LEU 59 3HB LEU 59 -14.154 -13.654 -19.918 484 HG LEU 59 HG LEU 59 -12.022 -13.427 -17.807 485 HD11 LEU 59 1HD1 LEU 59 -13.304 -11.640 -19.718 486 HD12 LEU 59 2HD1 LEU 59 -11.799 -11.451 -18.819 487 HD13 LEU 59 3HD1 LEU 59 -13.336 -11.033 -18.062 488 HD21 LEU 59 1HD2 LEU 59 -14.998 -13.332 -17.556 489 HD22 LEU 59 2HD2 LEU 59 -13.995 -12.294 -16.542 490 HD23 LEU 59 3HD2 LEU 59 -13.802 -14.047 -16.475 491 H SER 60 H SER 60 -12.529 -17.536 -19.832 492 HA SER 60 HA SER 60 -13.694 -17.603 -22.443 493 HB2 SER 60 2HB SER 60 -11.479 -18.418 -22.314 494 HB3 SER 60 3HB SER 60 -11.851 -19.453 -20.935 495 HG SER 60 HG SER 60 -12.545 -19.799 -23.648 496 H ASP 61 H ASP 61 -14.653 -18.754 -19.403 497 HA ASP 61 HA ASP 61 -16.783 -20.331 -20.659 498 HB2 ASP 61 2HB ASP 61 -14.714 -21.600 -19.463 499 HB3 ASP 61 3HB ASP 61 -15.775 -21.367 -18.076 500 H GLU 62 H GLU 62 -18.767 -20.092 -19.751 501 HA GLU 62 HA GLU 62 -19.251 -17.871 -18.091 502 HB2 GLU 62 2HB GLU 62 -21.583 -18.762 -17.971 503 HB3 GLU 62 3HB GLU 62 -20.959 -18.602 -19.606 504 HG2 GLU 62 2HG GLU 62 -20.494 -20.992 -19.675 505 HG3 GLU 62 3HG GLU 62 -21.097 -21.161 -18.027 506 H VAL 63 H VAL 63 -19.040 -21.327 -17.416 507 HA VAL 63 HA VAL 63 -19.931 -21.236 -14.744 508 HB VAL 63 HB VAL 63 -17.950 -23.203 -15.891 509 HG11 VAL 63 1HG1 VAL 63 -18.100 -23.442 -13.534 510 HG12 VAL 63 2HG1 VAL 63 -19.858 -23.296 -13.564 511 HG13 VAL 63 3HG1 VAL 63 -19.079 -24.728 -14.237 512 HG21 VAL 63 1HG2 VAL 63 -19.532 -23.888 -17.291 513 HG22 VAL 63 2HG2 VAL 63 -20.538 -24.299 -15.902 514 HG23 VAL 63 3HG2 VAL 63 -20.671 -22.706 -16.646 515 H LYS 64 H LYS 64 -16.640 -21.235 -16.103 516 HA LYS 64 HA LYS 64 -15.288 -21.027 -13.646 517 HB2 LYS 64 2HB LYS 64 -14.521 -20.306 -16.468 518 HB3 LYS 64 3HB LYS 64 -13.418 -20.071 -15.118 519 HG2 LYS 64 2HG LYS 64 -14.037 -22.612 -14.667 520 HG3 LYS 64 3HG LYS 64 -14.340 -22.572 -16.406 521 HD2 LYS 64 2HD LYS 64 -12.074 -23.230 -16.111 522 HD3 LYS 64 3HD LYS 64 -12.054 -21.557 -16.674 523 HE2 LYS 64 2HE LYS 64 -10.588 -21.343 -14.956 524 HE3 LYS 64 3HE LYS 64 -12.080 -21.104 -14.047 525 HZ1 LYS 64 1HZ LYS 64 -12.027 -23.325 -13.290 526 HZ2 LYS 64 2HZ LYS 64 -10.465 -22.719 -13.061 527 HZ3 LYS 64 3HZ LYS 64 -10.788 -23.754 -14.360 528 H ARG 65 H ARG 65 -16.416 -18.559 -15.923 529 HA ARG 65 HA ARG 65 -15.319 -16.345 -14.554 530 HB2 ARG 65 2HB ARG 65 -16.011 -16.163 -16.872 531 HB3 ARG 65 3HB ARG 65 -17.676 -16.524 -16.436 532 HG2 ARG 65 2HG ARG 65 -17.636 -14.429 -15.032 533 HG3 ARG 65 3HG ARG 65 -16.095 -14.050 -15.805 534 HD2 ARG 65 2HD ARG 65 -17.898 -12.921 -16.960 535 HD3 ARG 65 3HD ARG 65 -17.196 -14.158 -18.003 536 HE ARG 65 HE ARG 65 -19.255 -15.462 -16.869 537 HH11 ARG 65 1HH1 ARG 65 -19.022 -12.370 -18.451 538 HH12 ARG 65 2HH1 ARG 65 -20.649 -12.404 -19.045 539 HH21 ARG 65 1HH2 ARG 65 -21.399 -15.519 -17.645 540 HH22 ARG 65 2HH2 ARG 65 -22.001 -14.196 -18.585 541 H LYS 66 H LYS 66 -18.573 -17.777 -14.513 542 HA LYS 66 HA LYS 66 -19.721 -15.980 -12.692 543 HB2 LYS 66 2HB LYS 66 -20.358 -18.837 -13.404 544 HB3 LYS 66 3HB LYS 66 -21.310 -17.936 -12.232 545 HG2 LYS 66 2HG LYS 66 -20.843 -17.009 -15.054 546 HG3 LYS 66 3HG LYS 66 -22.232 -17.977 -14.555 547 HD2 LYS 66 2HD LYS 66 -23.192 -16.255 -13.403 548 HD3 LYS 66 3HD LYS 66 -21.640 -15.510 -13.010 549 HE2 LYS 66 2HE LYS 66 -22.849 -14.109 -14.566 550 HE3 LYS 66 3HE LYS 66 -21.425 -14.785 -15.356 551 HZ1 LYS 66 1HZ LYS 66 -22.770 -16.359 -16.495 552 HZ2 LYS 66 2HZ LYS 66 -23.485 -14.843 -16.717 553 HZ3 LYS 66 3HZ LYS 66 -24.148 -15.936 -15.609 554 H GLN 67 H GLN 67 -18.079 -19.080 -12.170 555 HA GLN 67 HA GLN 67 -18.481 -19.273 -9.412 556 HB2 GLN 67 2HB GLN 67 -16.382 -20.344 -11.269 557 HB3 GLN 67 3HB GLN 67 -16.250 -20.604 -9.535 558 HG2 GLN 67 2HG GLN 67 -18.518 -21.478 -11.309 559 HG3 GLN 67 3HG GLN 67 -17.280 -22.510 -10.595 560 HE21 GLN 67 1HE2 GLN 67 -20.199 -20.748 -10.062 561 HE22 GLN 67 2HE2 GLN 67 -20.517 -21.338 -8.470 562 H TYR 68 H TYR 68 -15.954 -17.643 -11.264 563 HA TYR 68 HA TYR 68 -14.366 -16.914 -9.032 564 HB2 TYR 68 2HB TYR 68 -13.487 -16.958 -11.330 565 HB3 TYR 68 3HB TYR 68 -14.546 -15.620 -11.761 566 HD1 TYR 68 HD1 TYR 68 -11.741 -16.545 -9.500 567 HD2 TYR 68 HD2 TYR 68 -13.836 -13.410 -11.472 568 HE1 TYR 68 HE1 TYR 68 -10.000 -14.952 -8.806 569 HE2 TYR 68 HE2 TYR 68 -12.100 -11.810 -10.784 570 HH TYR 68 HH TYR 68 -10.374 -11.681 -8.859 571 H ASP 69 H ASP 69 -17.101 -15.438 -10.645 572 HA ASP 69 HA ASP 69 -16.873 -12.893 -9.385 573 HB2 ASP 69 2HB ASP 69 -18.121 -12.932 -11.391 574 HB3 ASP 69 3HB ASP 69 -19.100 -14.294 -10.851 575 H ALA 70 H ALA 70 -18.312 -15.937 -8.509 576 HA ALA 70 HA ALA 70 -20.071 -15.020 -6.502 577 HB1 ALA 70 1HB ALA 70 -18.804 -17.646 -7.141 578 HB2 ALA 70 2HB ALA 70 -19.665 -17.441 -5.615 579 HB3 ALA 70 3HB ALA 70 -20.508 -17.188 -7.143 580 H TYR 71 H TYR 71 -16.638 -15.569 -6.557 581 HA TYR 71 HA TYR 71 -16.471 -15.246 -3.649 582 HB2 TYR 71 2HB TYR 71 -14.658 -16.361 -5.736 583 HB3 TYR 71 3HB TYR 71 -13.926 -15.656 -4.299 584 HD1 TYR 71 HD1 TYR 71 -13.553 -17.032 -2.482 585 HD2 TYR 71 HD2 TYR 71 -16.630 -18.061 -5.234 586 HE1 TYR 71 HE1 TYR 71 -13.946 -19.125 -1.251 587 HE2 TYR 71 HE2 TYR 71 -17.032 -20.156 -4.010 588 HH TYR 71 HH TYR 71 -15.023 -21.081 -1.242 589 H GLY 72 H GLY 72 -16.194 -13.478 -6.525 590 HA2 GLY 72 2HA GLY 72 -14.169 -11.628 -5.787 591 HA3 GLY 72 3HA GLY 72 -15.393 -11.382 -7.025 592 H SER 73 H SER 73 -14.507 -9.325 -5.374 593 HA SER 73 HA SER 73 -16.372 -8.964 -3.208 594 HB2 SER 73 2HB SER 73 -14.115 -8.027 -3.047 595 HB3 SER 73 3HB SER 73 -14.413 -7.028 -4.469 596 HG SER 73 HG SER 73 -14.747 -6.151 -2.185 Start of MODEL 17 1 H1 HIS 1 H HIS 1 -5.479 2.273 5.080 2 HA HIS 1 HA HIS 1 -5.495 2.231 2.144 3 HB2 HIS 1 2HB HIS 1 -3.440 1.376 4.179 4 HB3 HIS 1 3HB HIS 1 -3.325 0.921 2.481 5 HD1 HIS 1 HD1 HIS 1 -1.710 3.118 4.498 6 HD2 HIS 1 HD2 HIS 1 -3.900 3.722 1.020 7 HE1 HIS 1 HE1 HIS 1 -0.900 5.309 3.566 8 H MET 2 H MET 2 -5.974 0.416 1.007 9 HA MET 2 HA MET 2 -6.442 -2.074 2.482 10 HB2 MET 2 2HB MET 2 -8.426 -0.559 0.824 11 HB3 MET 2 3HB MET 2 -8.519 -2.313 0.912 12 HG2 MET 2 2HG MET 2 -8.344 -0.758 3.441 13 HG3 MET 2 3HG MET 2 -9.870 -0.792 2.560 14 HE1 MET 2 1HE MET 2 -11.419 -4.023 3.209 15 HE2 MET 2 2HE MET 2 -11.580 -2.479 4.047 16 HE3 MET 2 3HE MET 2 -11.357 -2.514 2.297 17 H LEU 3 H LEU 3 -6.445 -3.979 1.150 18 HA LEU 3 HA LEU 3 -4.493 -3.874 -0.918 19 HB2 LEU 3 2HB LEU 3 -6.239 -6.037 0.204 20 HB3 LEU 3 3HB LEU 3 -5.227 -6.326 -1.210 21 HG LEU 3 HG LEU 3 -3.276 -5.555 0.264 22 HD11 LEU 3 1HD1 LEU 3 -5.403 -6.009 2.345 23 HD12 LEU 3 2HD1 LEU 3 -4.443 -4.554 2.079 24 HD13 LEU 3 3HD1 LEU 3 -3.674 -6.017 2.693 25 HD21 LEU 3 1HD2 LEU 3 -4.385 -8.069 1.370 26 HD22 LEU 3 2HD2 LEU 3 -2.794 -7.732 0.687 27 HD23 LEU 3 3HD2 LEU 3 -4.178 -7.979 -0.380 28 H ALA 4 H ALA 4 -4.758 -3.531 -3.019 29 HA ALA 4 HA ALA 4 -7.343 -3.061 -4.131 30 HB1 ALA 4 1HB ALA 4 -6.253 -2.278 -6.003 31 HB2 ALA 4 2HB ALA 4 -5.038 -2.018 -4.751 32 HB3 ALA 4 3HB ALA 4 -4.912 -3.409 -5.828 33 H LYS 5 H LYS 5 -8.512 -4.261 -5.589 34 HA LYS 5 HA LYS 5 -7.565 -7.010 -6.075 35 HB2 LYS 5 2HB LYS 5 -10.415 -6.120 -5.594 36 HB3 LYS 5 3HB LYS 5 -9.891 -7.766 -5.926 37 HG2 LYS 5 2HG LYS 5 -8.731 -6.322 -3.595 38 HG3 LYS 5 3HG LYS 5 -10.366 -6.977 -3.481 39 HD2 LYS 5 2HD LYS 5 -9.581 -9.190 -3.952 40 HD3 LYS 5 3HD LYS 5 -7.963 -8.592 -4.326 41 HE2 LYS 5 2HE LYS 5 -7.479 -8.147 -2.096 42 HE3 LYS 5 3HE LYS 5 -9.180 -8.110 -1.633 43 HZ1 LYS 5 1HZ LYS 5 -7.488 -10.216 -1.320 44 HZ2 LYS 5 2HZ LYS 5 -8.377 -10.647 -2.693 45 HZ3 LYS 5 3HZ LYS 5 -9.177 -10.288 -1.247 46 H GLU 6 H GLU 6 -7.286 -7.452 -8.152 47 HA GLU 6 HA GLU 6 -8.686 -5.811 -10.146 48 HB2 GLU 6 2HB GLU 6 -6.089 -7.306 -10.158 49 HB3 GLU 6 3HB GLU 6 -6.903 -6.961 -11.678 50 HG2 GLU 6 2HG GLU 6 -5.249 -5.271 -11.215 51 HG3 GLU 6 3HG GLU 6 -6.866 -4.571 -11.149 52 H ASP 7 H ASP 7 -9.885 -6.718 -11.776 53 HA ASP 7 HA ASP 7 -10.396 -9.612 -11.546 54 HB2 ASP 7 2HB ASP 7 -12.402 -7.625 -12.592 55 HB3 ASP 7 3HB ASP 7 -12.682 -9.264 -12.011 56 H TYR 8 H TYR 8 -10.836 -10.769 -13.471 57 HA TYR 8 HA TYR 8 -9.180 -10.195 -15.626 58 HB2 TYR 8 2HB TYR 8 -11.681 -11.887 -15.757 59 HB3 TYR 8 3HB TYR 8 -10.250 -12.021 -16.774 60 HD1 TYR 8 HD1 TYR 8 -11.810 -13.940 -14.659 61 HD2 TYR 8 HD2 TYR 8 -8.093 -11.873 -14.764 62 HE1 TYR 8 HE1 TYR 8 -10.860 -15.581 -13.093 63 HE2 TYR 8 HE2 TYR 8 -7.132 -13.509 -13.199 64 HH TYR 8 HH TYR 8 -7.578 -15.900 -12.533 65 H TYR 9 H TYR 9 -12.460 -9.215 -14.990 66 HA TYR 9 HA TYR 9 -13.373 -8.544 -17.509 67 HB2 TYR 9 2HB TYR 9 -13.828 -7.022 -14.934 68 HB3 TYR 9 3HB TYR 9 -14.808 -6.887 -16.390 69 HD1 TYR 9 HD1 TYR 9 -14.179 -8.774 -13.377 70 HD2 TYR 9 HD2 TYR 9 -16.159 -8.857 -17.142 71 HE1 TYR 9 HE1 TYR 9 -15.598 -10.620 -12.584 72 HE2 TYR 9 HE2 TYR 9 -17.584 -10.703 -16.359 73 HH TYR 9 HH TYR 9 -18.376 -11.657 -14.270 74 H GLN 10 H GLN 10 -11.469 -6.536 -15.275 75 HA GLN 10 HA GLN 10 -11.253 -4.359 -17.113 76 HB2 GLN 10 2HB GLN 10 -9.623 -4.968 -14.641 77 HB3 GLN 10 3HB GLN 10 -9.652 -3.432 -15.498 78 HG2 GLN 10 2HG GLN 10 -12.128 -4.649 -14.325 79 HG3 GLN 10 3HG GLN 10 -11.047 -3.621 -13.387 80 HE21 GLN 10 1HE2 GLN 10 -13.687 -3.700 -15.430 81 HE22 GLN 10 2HE2 GLN 10 -13.774 -2.018 -15.815 82 H ILE 11 H ILE 11 -9.336 -7.184 -16.365 83 HA ILE 11 HA ILE 11 -6.935 -6.403 -17.612 84 HB ILE 11 HB ILE 11 -8.050 -9.192 -17.293 85 HG12 ILE 11 2HG1 ILE 11 -6.086 -7.718 -15.530 86 HG13 ILE 11 3HG1 ILE 11 -7.807 -7.847 -15.181 87 HG21 ILE 11 1HG2 ILE 11 -6.334 -9.484 -18.796 88 HG22 ILE 11 2HG2 ILE 11 -5.402 -8.130 -18.160 89 HG23 ILE 11 3HG2 ILE 11 -5.476 -9.647 -17.264 90 HD11 ILE 11 1HD1 ILE 11 -6.622 -10.431 -15.701 91 HD12 ILE 11 2HD1 ILE 11 -5.823 -9.586 -14.375 92 HD13 ILE 11 3HD1 ILE 11 -7.562 -9.872 -14.317 93 H LEU 12 H LEU 12 -9.964 -7.443 -18.886 94 HA LEU 12 HA LEU 12 -8.770 -7.733 -21.562 95 HB2 LEU 12 2HB LEU 12 -11.135 -8.974 -20.243 96 HB3 LEU 12 3HB LEU 12 -11.166 -8.736 -21.989 97 HG LEU 12 HG LEU 12 -9.080 -10.324 -20.494 98 HD11 LEU 12 1HD1 LEU 12 -10.547 -11.973 -22.203 99 HD12 LEU 12 2HD1 LEU 12 -11.743 -11.003 -21.344 100 HD13 LEU 12 3HD1 LEU 12 -10.573 -11.964 -20.439 101 HD21 LEU 12 1HD2 LEU 12 -9.427 -10.779 -23.348 102 HD22 LEU 12 2HD2 LEU 12 -7.955 -10.519 -22.412 103 HD23 LEU 12 3HD2 LEU 12 -8.901 -9.138 -22.970 104 H GLY 13 H GLY 13 -10.696 -5.750 -19.601 105 HA2 GLY 13 2HA GLY 13 -11.586 -3.669 -20.091 106 HA3 GLY 13 3HA GLY 13 -11.142 -3.915 -21.774 107 H VAL 14 H VAL 14 -13.182 -5.981 -19.754 108 HA VAL 14 HA VAL 14 -15.461 -5.301 -21.496 109 HB VAL 14 HB VAL 14 -16.223 -7.594 -21.418 110 HG11 VAL 14 1HG1 VAL 14 -14.280 -6.728 -22.986 111 HG12 VAL 14 2HG1 VAL 14 -13.360 -7.963 -22.124 112 HG13 VAL 14 3HG1 VAL 14 -14.814 -8.408 -23.019 113 HG21 VAL 14 1HG2 VAL 14 -15.635 -8.931 -19.746 114 HG22 VAL 14 2HG2 VAL 14 -13.997 -8.999 -20.398 115 HG23 VAL 14 3HG2 VAL 14 -14.422 -7.768 -19.208 116 HA PRO 15 HA PRO 15 -17.786 -4.499 -17.856 117 HB2 PRO 15 2HB PRO 15 -20.278 -5.180 -18.687 118 HB3 PRO 15 3HB PRO 15 -19.446 -3.723 -19.241 119 HG2 PRO 15 2HG PRO 15 -19.731 -6.374 -20.602 120 HG3 PRO 15 3HG PRO 15 -19.878 -4.744 -21.285 121 HD2 PRO 15 2HD PRO 15 -17.640 -6.243 -21.562 122 HD3 PRO 15 3HD PRO 15 -17.595 -4.471 -21.452 123 H ARG 16 H ARG 16 -19.457 -5.530 -16.379 124 HA ARG 16 HA ARG 16 -18.566 -8.187 -15.728 125 HB2 ARG 16 2HB ARG 16 -20.669 -6.433 -14.446 126 HB3 ARG 16 3HB ARG 16 -20.090 -7.957 -13.788 127 HG2 ARG 16 2HG ARG 16 -18.784 -6.537 -12.601 128 HG3 ARG 16 3HG ARG 16 -17.750 -6.736 -14.017 129 HD2 ARG 16 2HD ARG 16 -18.300 -4.653 -14.872 130 HD3 ARG 16 3HD ARG 16 -19.799 -4.560 -13.947 131 HE ARG 16 HE ARG 16 -17.867 -4.561 -12.041 132 HH11 ARG 16 1HH1 ARG 16 -18.458 -2.646 -14.888 133 HH12 ARG 16 2HH1 ARG 16 -17.720 -1.219 -14.240 134 HH21 ARG 16 1HH2 ARG 16 -16.893 -2.688 -11.177 135 HH22 ARG 16 2HH2 ARG 16 -16.829 -1.244 -12.130 136 H ASN 17 H ASN 17 -20.880 -6.990 -17.795 137 HA ASN 17 HA ASN 17 -22.572 -9.384 -17.510 138 HB2 ASN 17 2HB ASN 17 -23.147 -6.584 -18.382 139 HB3 ASN 17 3HB ASN 17 -24.099 -7.893 -19.077 140 HD21 ASN 17 1HD2 ASN 17 -24.756 -5.675 -17.198 141 HD22 ASN 17 2HD2 ASN 17 -25.502 -6.448 -15.845 142 H ALA 18 H ALA 18 -20.026 -8.331 -19.219 143 HA ALA 18 HA ALA 18 -20.604 -8.643 -21.907 144 HB1 ALA 18 1HB ALA 18 -18.049 -9.722 -20.796 145 HB2 ALA 18 2HB ALA 18 -18.329 -8.795 -22.270 146 HB3 ALA 18 3HB ALA 18 -18.395 -7.995 -20.700 147 H SER 19 H SER 19 -20.165 -10.442 -23.355 148 HA SER 19 HA SER 19 -20.939 -13.005 -22.136 149 HB2 SER 19 2HB SER 19 -21.444 -13.472 -24.706 150 HB3 SER 19 3HB SER 19 -22.604 -12.629 -23.678 151 HG SER 19 HG SER 19 -20.882 -11.596 -25.645 152 H GLN 20 H GLN 20 -20.049 -14.968 -23.106 153 HA GLN 20 HA GLN 20 -17.280 -15.013 -23.135 154 HB2 GLN 20 2HB GLN 20 -19.027 -17.012 -24.570 155 HB3 GLN 20 3HB GLN 20 -17.437 -17.287 -23.872 156 HG2 GLN 20 2HG GLN 20 -20.016 -16.788 -22.413 157 HG3 GLN 20 3HG GLN 20 -19.057 -18.266 -22.434 158 HE21 GLN 20 1HE2 GLN 20 -16.877 -18.117 -21.510 159 HE22 GLN 20 2HE2 GLN 20 -16.628 -17.081 -20.151 160 H LYS 21 H LYS 21 -19.513 -14.347 -25.706 161 HA LYS 21 HA LYS 21 -17.655 -14.752 -27.847 162 HB2 LYS 21 2HB LYS 21 -20.297 -13.290 -27.723 163 HB3 LYS 21 3HB LYS 21 -19.378 -13.536 -29.203 164 HG2 LYS 21 2HG LYS 21 -20.829 -15.283 -29.341 165 HG3 LYS 21 3HG LYS 21 -19.505 -16.059 -28.469 166 HD2 LYS 21 2HD LYS 21 -20.634 -15.918 -26.413 167 HD3 LYS 21 3HD LYS 21 -21.787 -14.733 -27.032 168 HE2 LYS 21 2HE LYS 21 -21.631 -17.485 -28.207 169 HE3 LYS 21 3HE LYS 21 -22.545 -17.187 -26.729 170 HZ1 LYS 21 1HZ LYS 21 -24.210 -16.637 -28.075 171 HZ2 LYS 21 2HZ LYS 21 -23.213 -16.553 -29.438 172 HZ3 LYS 21 3HZ LYS 21 -23.362 -15.213 -28.417 173 H GLU 22 H GLU 22 -18.988 -11.870 -26.238 174 HA GLU 22 HA GLU 22 -17.523 -9.975 -27.701 175 HB2 GLU 22 2HB GLU 22 -19.463 -9.369 -26.346 176 HB3 GLU 22 3HB GLU 22 -18.597 -9.807 -24.880 177 HG2 GLU 22 2HG GLU 22 -18.535 -7.454 -25.036 178 HG3 GLU 22 3HG GLU 22 -16.923 -8.033 -25.451 179 H ILE 23 H ILE 23 -16.742 -11.821 -24.815 180 HA ILE 23 HA ILE 23 -14.413 -10.400 -24.086 181 HB ILE 23 HB ILE 23 -15.161 -13.278 -23.559 182 HG12 ILE 23 2HG1 ILE 23 -15.289 -10.915 -21.684 183 HG13 ILE 23 3HG1 ILE 23 -16.657 -11.427 -22.667 184 HG21 ILE 23 1HG2 ILE 23 -13.062 -13.529 -22.860 185 HG22 ILE 23 2HG2 ILE 23 -12.726 -11.806 -23.025 186 HG23 ILE 23 3HG2 ILE 23 -13.464 -12.422 -21.546 187 HD11 ILE 23 1HD1 ILE 23 -15.823 -13.744 -21.406 188 HD12 ILE 23 2HD1 ILE 23 -15.671 -12.490 -20.174 189 HD13 ILE 23 3HD1 ILE 23 -17.216 -12.750 -20.983 190 H LYS 24 H LYS 24 -15.014 -12.990 -26.364 191 HA LYS 24 HA LYS 24 -12.355 -13.808 -26.782 192 HB2 LYS 24 2HB LYS 24 -14.806 -13.905 -28.535 193 HB3 LYS 24 3HB LYS 24 -13.261 -14.574 -29.041 194 HG2 LYS 24 2HG LYS 24 -14.258 -15.437 -26.401 195 HG3 LYS 24 3HG LYS 24 -15.156 -16.003 -27.810 196 HD2 LYS 24 2HD LYS 24 -12.193 -16.205 -27.880 197 HD3 LYS 24 3HD LYS 24 -13.071 -17.330 -26.841 198 HE2 LYS 24 2HE LYS 24 -12.974 -18.494 -28.831 199 HE3 LYS 24 3HE LYS 24 -14.547 -17.707 -28.947 200 HZ1 LYS 24 1HZ LYS 24 -13.887 -16.491 -30.679 201 HZ2 LYS 24 2HZ LYS 24 -12.610 -17.590 -30.822 202 HZ3 LYS 24 3HZ LYS 24 -12.381 -16.130 -29.998 203 H LYS 25 H LYS 25 -14.309 -11.277 -28.280 204 HA LYS 25 HA LYS 25 -12.401 -10.564 -30.259 205 HB2 LYS 25 2HB LYS 25 -14.695 -8.999 -29.064 206 HB3 LYS 25 3HB LYS 25 -13.758 -8.478 -30.459 207 HG2 LYS 25 2HG LYS 25 -14.594 -10.193 -31.808 208 HG3 LYS 25 3HG LYS 25 -15.179 -11.117 -30.422 209 HD2 LYS 25 2HD LYS 25 -16.738 -9.148 -29.980 210 HD3 LYS 25 3HD LYS 25 -16.308 -8.590 -31.599 211 HE2 LYS 25 2HE LYS 25 -17.059 -10.775 -32.497 212 HE3 LYS 25 3HE LYS 25 -17.584 -11.227 -30.875 213 HZ1 LYS 25 1HZ LYS 25 -18.653 -9.043 -32.572 214 HZ2 LYS 25 2HZ LYS 25 -19.035 -9.213 -30.933 215 HZ3 LYS 25 3HZ LYS 25 -19.468 -10.424 -32.033 216 H ALA 26 H ALA 26 -13.218 -9.186 -27.086 217 HA ALA 26 HA ALA 26 -11.397 -7.066 -27.116 218 HB1 ALA 26 1HB ALA 26 -13.299 -7.566 -25.464 219 HB2 ALA 26 2HB ALA 26 -12.105 -8.538 -24.603 220 HB3 ALA 26 3HB ALA 26 -11.831 -6.812 -24.841 221 H TYR 27 H TYR 27 -10.957 -10.462 -26.434 222 HA TYR 27 HA TYR 27 -8.393 -10.210 -25.210 223 HB2 TYR 27 2HB TYR 27 -9.669 -12.182 -24.743 224 HB3 TYR 27 3HB TYR 27 -9.836 -12.554 -26.455 225 HD1 TYR 27 HD1 TYR 27 -6.943 -11.767 -24.212 226 HD2 TYR 27 HD2 TYR 27 -8.659 -14.441 -27.042 227 HE1 TYR 27 HE1 TYR 27 -4.927 -13.171 -24.098 228 HE2 TYR 27 HE2 TYR 27 -6.648 -15.854 -26.935 229 HH TYR 27 HH TYR 27 -3.763 -14.828 -25.375 230 H TYR 28 H TYR 28 -9.542 -10.655 -28.495 231 HA TYR 28 HA TYR 28 -6.965 -11.224 -29.602 232 HB2 TYR 28 2HB TYR 28 -8.952 -12.011 -30.742 233 HB3 TYR 28 3HB TYR 28 -9.558 -10.366 -30.901 234 HD1 TYR 28 HD1 TYR 28 -9.420 -9.516 -33.032 235 HD2 TYR 28 HD2 TYR 28 -6.370 -12.165 -31.698 236 HE1 TYR 28 HE1 TYR 28 -8.298 -9.312 -35.211 237 HE2 TYR 28 HE2 TYR 28 -5.239 -11.967 -33.873 238 HH TYR 28 HH TYR 28 -6.728 -10.426 -36.585 239 H GLN 29 H GLN 29 -9.062 -8.355 -29.535 240 HA GLN 29 HA GLN 29 -7.393 -6.650 -30.995 241 HB2 GLN 29 2HB GLN 29 -8.738 -4.869 -30.216 242 HB3 GLN 29 3HB GLN 29 -9.808 -6.261 -30.308 243 HG2 GLN 29 2HG GLN 29 -9.642 -6.588 -27.917 244 HG3 GLN 29 3HG GLN 29 -8.489 -5.260 -27.795 245 HE21 GLN 29 1HE2 GLN 29 -11.758 -5.961 -28.972 246 HE22 GLN 29 2HE2 GLN 29 -12.445 -4.453 -28.481 247 H LEU 30 H LEU 30 -7.398 -7.533 -27.599 248 HA LEU 30 HA LEU 30 -5.526 -5.538 -26.785 249 HB2 LEU 30 2HB LEU 30 -7.037 -7.665 -25.569 250 HB3 LEU 30 3HB LEU 30 -5.369 -7.692 -25.000 251 HG LEU 30 HG LEU 30 -5.555 -5.477 -24.127 252 HD11 LEU 30 1HD1 LEU 30 -7.884 -5.353 -25.906 253 HD12 LEU 30 2HD1 LEU 30 -6.791 -4.078 -25.370 254 HD13 LEU 30 3HD1 LEU 30 -8.114 -4.601 -24.328 255 HD21 LEU 30 1HD2 LEU 30 -8.115 -6.159 -23.065 256 HD22 LEU 30 2HD2 LEU 30 -6.528 -6.291 -22.308 257 HD23 LEU 30 3HD2 LEU 30 -7.162 -7.630 -23.265 258 H ALA 31 H ALA 31 -5.287 -8.941 -27.715 259 HA ALA 31 HA ALA 31 -2.606 -9.381 -27.094 260 HB1 ALA 31 1HB ALA 31 -3.558 -11.350 -27.660 261 HB2 ALA 31 2HB ALA 31 -4.585 -10.625 -28.897 262 HB3 ALA 31 3HB ALA 31 -2.889 -10.959 -29.244 263 H LYS 32 H LYS 32 -4.074 -8.060 -30.036 264 HA LYS 32 HA LYS 32 -1.786 -7.906 -31.619 265 HB2 LYS 32 2HB LYS 32 -4.276 -6.208 -31.530 266 HB3 LYS 32 3HB LYS 32 -3.014 -5.965 -32.731 267 HG2 LYS 32 2HG LYS 32 -3.559 -7.830 -33.885 268 HG3 LYS 32 3HG LYS 32 -4.050 -8.716 -32.440 269 HD2 LYS 32 2HD LYS 32 -5.968 -8.260 -33.875 270 HD3 LYS 32 3HD LYS 32 -6.115 -7.403 -32.340 271 HE2 LYS 32 2HE LYS 32 -4.728 -5.754 -34.219 272 HE3 LYS 32 3HE LYS 32 -6.220 -6.339 -34.952 273 HZ1 LYS 32 1HZ LYS 32 -7.275 -5.614 -32.742 274 HZ2 LYS 32 2HZ LYS 32 -6.874 -4.422 -33.872 275 HZ3 LYS 32 3HZ LYS 32 -5.874 -4.689 -32.535 276 H LYS 33 H LYS 33 -2.736 -6.038 -28.883 277 HA LYS 33 HA LYS 33 -1.088 -3.761 -29.437 278 HB2 LYS 33 2HB LYS 33 -2.199 -4.659 -26.774 279 HB3 LYS 33 3HB LYS 33 -1.632 -3.047 -27.191 280 HG2 LYS 33 2HG LYS 33 -3.460 -2.808 -28.787 281 HG3 LYS 33 3HG LYS 33 -4.026 -4.432 -28.386 282 HD2 LYS 33 2HD LYS 33 -5.338 -2.781 -27.193 283 HD3 LYS 33 3HD LYS 33 -4.361 -3.709 -26.052 284 HE2 LYS 33 2HE LYS 33 -4.398 -1.258 -25.606 285 HE3 LYS 33 3HE LYS 33 -2.783 -1.923 -25.849 286 HZ1 LYS 33 1HZ LYS 33 -3.302 0.234 -27.018 287 HZ2 LYS 33 2HZ LYS 33 -4.315 -0.654 -28.041 288 HZ3 LYS 33 3HZ LYS 33 -2.659 -0.996 -27.985 289 H TYR 34 H TYR 34 -0.724 -6.757 -27.629 290 HA TYR 34 HA TYR 34 2.058 -6.006 -27.022 291 HB2 TYR 34 2HB TYR 34 0.337 -8.105 -25.685 292 HB3 TYR 34 3HB TYR 34 1.980 -7.669 -25.227 293 HD1 TYR 34 HD1 TYR 34 2.427 -5.682 -23.951 294 HD2 TYR 34 HD2 TYR 34 -1.528 -6.560 -25.253 295 HE1 TYR 34 HE1 TYR 34 1.550 -3.960 -22.429 296 HE2 TYR 34 HE2 TYR 34 -2.416 -4.840 -23.736 297 HH TYR 34 HH TYR 34 -0.556 -2.493 -22.327 298 H HIS 35 H HIS 35 0.939 -7.146 -29.541 299 HA HIS 35 HA HIS 35 1.520 -9.850 -29.844 300 HB2 HIS 35 2HB HIS 35 1.069 -7.569 -31.589 301 HB3 HIS 35 3HB HIS 35 2.252 -8.683 -32.268 302 HD1 HIS 35 HD1 HIS 35 -0.602 -9.939 -30.190 303 HD2 HIS 35 HD2 HIS 35 0.481 -9.648 -34.191 304 HE1 HIS 35 HE1 HIS 35 -2.262 -11.354 -31.441 305 HA PRO 36 HA PRO 36 5.883 -10.286 -29.767 306 HB2 PRO 36 2HB PRO 36 6.330 -12.064 -31.769 307 HB3 PRO 36 3HB PRO 36 5.574 -12.513 -30.236 308 HG2 PRO 36 2HG PRO 36 4.293 -11.915 -32.875 309 HG3 PRO 36 3HG PRO 36 3.925 -13.209 -31.720 310 HD2 PRO 36 2HD PRO 36 2.445 -10.949 -31.896 311 HD3 PRO 36 3HD PRO 36 2.680 -11.819 -30.367 312 H ASP 37 H ASP 37 4.341 -9.085 -32.591 313 HA ASP 37 HA ASP 37 6.633 -8.641 -34.202 314 HB2 ASP 37 2HB ASP 37 4.043 -8.549 -34.753 315 HB3 ASP 37 3HB ASP 37 4.260 -6.839 -34.389 316 H THR 38 H THR 38 5.287 -7.000 -31.485 317 HA THR 38 HA THR 38 7.082 -4.709 -31.937 318 HB THR 38 HB THR 38 5.692 -3.369 -30.561 319 HG1 THR 38 HG1 THR 38 4.821 -5.829 -29.618 320 HG21 THR 38 1HG2 THR 38 4.016 -3.126 -32.037 321 HG22 THR 38 2HG2 THR 38 3.423 -4.765 -31.769 322 HG23 THR 38 3HG2 THR 38 4.757 -4.482 -32.887 323 H ASN 39 H ASN 39 7.152 -7.556 -30.448 324 HA ASN 39 HA ASN 39 8.082 -6.718 -27.837 325 HB2 ASN 39 2HB ASN 39 7.537 -9.313 -29.186 326 HB3 ASN 39 3HB ASN 39 8.720 -9.319 -27.882 327 HD21 ASN 39 1HD2 ASN 39 5.771 -7.412 -28.284 328 HD22 ASN 39 2HD2 ASN 39 4.996 -7.985 -26.850 329 H LYS 40 H LYS 40 9.409 -7.052 -30.917 330 HA LYS 40 HA LYS 40 11.942 -8.068 -30.534 331 HB2 LYS 40 2HB LYS 40 10.770 -6.056 -32.389 332 HB3 LYS 40 3HB LYS 40 12.524 -6.165 -32.311 333 HG2 LYS 40 2HG LYS 40 11.719 -7.546 -34.100 334 HG3 LYS 40 3HG LYS 40 12.362 -8.576 -32.819 335 HD2 LYS 40 2HD LYS 40 9.477 -7.941 -32.681 336 HD3 LYS 40 3HD LYS 40 9.989 -8.999 -33.998 337 HE2 LYS 40 2HE LYS 40 11.337 -10.081 -31.910 338 HE3 LYS 40 3HE LYS 40 9.889 -9.487 -31.098 339 HZ1 LYS 40 1HZ LYS 40 8.907 -10.687 -33.318 340 HZ2 LYS 40 2HZ LYS 40 8.971 -11.384 -31.779 341 HZ3 LYS 40 3HZ LYS 40 10.196 -11.701 -32.901 342 H ASP 41 H ASP 41 10.752 -4.814 -29.851 343 HA ASP 41 HA ASP 41 13.296 -4.255 -28.471 344 HB2 ASP 41 2HB ASP 41 12.617 -2.849 -30.550 345 HB3 ASP 41 3HB ASP 41 11.461 -2.091 -29.459 346 H ASP 42 H ASP 42 10.625 -5.454 -27.607 347 HA ASP 42 HA ASP 42 10.368 -3.814 -25.195 348 HB2 ASP 42 2HB ASP 42 8.511 -3.484 -27.079 349 HB3 ASP 42 3HB ASP 42 7.852 -4.935 -26.329 350 HA PRO 43 HA PRO 43 10.851 -8.286 -24.195 351 HB2 PRO 43 2HB PRO 43 12.463 -7.851 -22.054 352 HB3 PRO 43 3HB PRO 43 13.072 -7.954 -23.710 353 HG2 PRO 43 2HG PRO 43 12.484 -5.529 -22.056 354 HG3 PRO 43 3HG PRO 43 13.869 -5.852 -23.116 355 HD2 PRO 43 2HD PRO 43 11.780 -4.307 -23.878 356 HD3 PRO 43 3HD PRO 43 12.697 -5.306 -25.024 357 H LYS 44 H LYS 44 9.501 -5.558 -22.720 358 HA LYS 44 HA LYS 44 8.610 -7.002 -20.343 359 HB2 LYS 44 2HB LYS 44 8.900 -4.190 -21.108 360 HB3 LYS 44 3HB LYS 44 7.392 -4.531 -20.269 361 HG2 LYS 44 2HG LYS 44 10.021 -5.467 -19.180 362 HG3 LYS 44 3HG LYS 44 9.427 -3.832 -18.882 363 HD2 LYS 44 2HD LYS 44 8.489 -4.823 -17.075 364 HD3 LYS 44 3HD LYS 44 7.228 -5.231 -18.240 365 HE2 LYS 44 2HE LYS 44 7.832 -7.428 -18.330 366 HE3 LYS 44 3HE LYS 44 9.531 -7.087 -18.001 367 HZ1 LYS 44 1HZ LYS 44 7.482 -6.707 -15.912 368 HZ2 LYS 44 2HZ LYS 44 9.146 -6.949 -15.734 369 HZ3 LYS 44 3HZ LYS 44 8.150 -8.235 -16.199 370 H ALA 45 H ALA 45 7.499 -6.042 -23.457 371 HA ALA 45 HA ALA 45 4.733 -5.940 -23.041 372 HB1 ALA 45 1HB ALA 45 4.629 -6.628 -25.493 373 HB2 ALA 45 2HB ALA 45 5.514 -5.152 -25.107 374 HB3 ALA 45 3HB ALA 45 6.393 -6.644 -25.442 375 H LYS 46 H LYS 46 6.866 -8.676 -23.753 376 HA LYS 46 HA LYS 46 4.934 -10.647 -24.121 377 HB2 LYS 46 2HB LYS 46 6.658 -12.236 -23.771 378 HB3 LYS 46 3HB LYS 46 7.434 -10.834 -24.497 379 HG2 LYS 46 2HG LYS 46 8.117 -10.117 -22.210 380 HG3 LYS 46 3HG LYS 46 7.485 -11.648 -21.601 381 HD2 LYS 46 2HD LYS 46 9.862 -11.855 -21.930 382 HD3 LYS 46 3HD LYS 46 9.029 -12.839 -23.136 383 HE2 LYS 46 2HE LYS 46 9.701 -11.531 -24.863 384 HE3 LYS 46 3HE LYS 46 9.656 -10.053 -23.904 385 HZ1 LYS 46 1HZ LYS 46 11.678 -11.377 -22.756 386 HZ2 LYS 46 2HZ LYS 46 11.873 -10.240 -23.993 387 HZ3 LYS 46 3HZ LYS 46 11.842 -11.891 -24.360 388 H GLU 47 H GLU 47 6.169 -9.196 -21.193 389 HA GLU 47 HA GLU 47 5.088 -11.154 -19.414 390 HB2 GLU 47 2HB GLU 47 6.993 -9.438 -19.003 391 HB3 GLU 47 3HB GLU 47 5.689 -8.320 -18.625 392 HG2 GLU 47 2HG GLU 47 6.605 -9.353 -16.619 393 HG3 GLU 47 3HG GLU 47 4.911 -9.781 -16.856 394 H LYS 48 H LYS 48 4.017 -8.013 -20.623 395 HA LYS 48 HA LYS 48 1.684 -7.876 -18.997 396 HB2 LYS 48 2HB LYS 48 2.158 -6.479 -21.633 397 HB3 LYS 48 3HB LYS 48 1.051 -5.993 -20.355 398 HG2 LYS 48 2HG LYS 48 4.056 -6.034 -20.161 399 HG3 LYS 48 3HG LYS 48 3.048 -4.603 -20.385 400 HD2 LYS 48 2HD LYS 48 1.973 -5.021 -18.228 401 HD3 LYS 48 3HD LYS 48 2.968 -6.462 -18.007 402 HE2 LYS 48 2HE LYS 48 4.225 -4.977 -16.828 403 HE3 LYS 48 3HE LYS 48 4.919 -4.714 -18.427 404 HZ1 LYS 48 1HZ LYS 48 4.284 -2.668 -17.126 405 HZ2 LYS 48 2HZ LYS 48 2.669 -3.091 -17.395 406 HZ3 LYS 48 3HZ LYS 48 3.684 -2.755 -18.706 407 H PHE 49 H PHE 49 2.365 -9.085 -22.233 408 HA PHE 49 HA PHE 49 -0.254 -9.463 -23.123 409 HB2 PHE 49 2HB PHE 49 1.526 -9.675 -24.697 410 HB3 PHE 49 3HB PHE 49 2.301 -10.941 -23.750 411 HD1 PHE 49 HD1 PHE 49 -0.350 -10.153 -26.124 412 HD2 PHE 49 HD2 PHE 49 1.448 -13.213 -23.774 413 HE1 PHE 49 HE1 PHE 49 -1.537 -11.858 -27.442 414 HE2 PHE 49 HE2 PHE 49 0.265 -14.923 -25.090 415 HZ PHE 49 HZ PHE 49 -1.231 -14.246 -26.926 416 H SER 50 H SER 50 1.758 -11.395 -21.005 417 HA SER 50 HA SER 50 0.307 -13.783 -21.030 418 HB2 SER 50 2HB SER 50 2.580 -13.249 -19.920 419 HB3 SER 50 3HB SER 50 1.621 -12.716 -18.540 420 HG SER 50 HG SER 50 1.609 -15.291 -19.734 421 H GLN 51 H GLN 51 -0.254 -10.766 -19.349 422 HA GLN 51 HA GLN 51 -2.171 -11.695 -17.499 423 HB2 GLN 51 2HB GLN 51 -1.853 -8.946 -18.716 424 HB3 GLN 51 3HB GLN 51 -2.830 -9.324 -17.303 425 HG2 GLN 51 2HG GLN 51 -0.994 -9.676 -15.958 426 HG3 GLN 51 3HG GLN 51 0.071 -10.012 -17.322 427 HE21 GLN 51 1HE2 GLN 51 0.266 -8.115 -15.042 428 HE22 GLN 51 2HE2 GLN 51 0.545 -6.571 -15.766 429 H LEU 52 H LEU 52 -2.388 -10.668 -20.842 430 HA LEU 52 HA LEU 52 -5.194 -10.393 -20.977 431 HB2 LEU 52 2HB LEU 52 -3.362 -11.218 -23.218 432 HB3 LEU 52 3HB LEU 52 -4.935 -10.433 -23.355 433 HG LEU 52 HG LEU 52 -2.583 -9.092 -22.046 434 HD11 LEU 52 1HD1 LEU 52 -1.731 -8.392 -24.012 435 HD12 LEU 52 2HD1 LEU 52 -3.305 -8.350 -24.806 436 HD13 LEU 52 3HD1 LEU 52 -2.455 -9.884 -24.612 437 HD21 LEU 52 1HD2 LEU 52 -4.302 -7.297 -23.349 438 HD22 LEU 52 2HD2 LEU 52 -4.105 -7.537 -21.612 439 HD23 LEU 52 3HD2 LEU 52 -5.339 -8.439 -22.493 440 H ALA 53 H ALA 53 -3.076 -13.092 -21.941 441 HA ALA 53 HA ALA 53 -5.181 -14.858 -22.599 442 HB1 ALA 53 1HB ALA 53 -3.552 -16.289 -23.191 443 HB2 ALA 53 2HB ALA 53 -2.499 -14.892 -22.964 444 HB3 ALA 53 3HB ALA 53 -2.676 -16.082 -21.674 445 H GLU 54 H GLU 54 -3.459 -14.190 -19.611 446 HA GLU 54 HA GLU 54 -4.301 -16.411 -18.123 447 HB2 GLU 54 2HB GLU 54 -3.314 -13.677 -17.460 448 HB3 GLU 54 3HB GLU 54 -4.060 -14.619 -16.177 449 HG2 GLU 54 2HG GLU 54 -1.775 -15.600 -17.866 450 HG3 GLU 54 3HG GLU 54 -1.582 -14.803 -16.306 451 H ALA 55 H ALA 55 -5.718 -13.156 -18.370 452 HA ALA 55 HA ALA 55 -7.964 -13.776 -16.730 453 HB1 ALA 55 1HB ALA 55 -6.864 -11.465 -17.922 454 HB2 ALA 55 2HB ALA 55 -8.537 -11.591 -18.468 455 HB3 ALA 55 3HB ALA 55 -8.172 -11.569 -16.743 456 H TYR 56 H TYR 56 -7.444 -13.596 -20.230 457 HA TYR 56 HA TYR 56 -10.086 -13.994 -21.047 458 HB2 TYR 56 2HB TYR 56 -8.612 -13.314 -22.733 459 HB3 TYR 56 3HB TYR 56 -7.426 -14.550 -22.327 460 HD1 TYR 56 HD1 TYR 56 -10.613 -13.889 -24.037 461 HD2 TYR 56 HD2 TYR 56 -7.598 -16.777 -23.219 462 HE1 TYR 56 HE1 TYR 56 -11.530 -15.337 -25.801 463 HE2 TYR 56 HE2 TYR 56 -8.505 -18.232 -24.982 464 HH TYR 56 HH TYR 56 -10.338 -18.596 -26.308 465 H GLU 57 H GLU 57 -7.724 -16.210 -19.806 466 HA GLU 57 HA GLU 57 -8.758 -18.628 -20.779 467 HB2 GLU 57 2HB GLU 57 -6.874 -17.787 -18.723 468 HB3 GLU 57 3HB GLU 57 -7.771 -19.224 -18.255 469 HG2 GLU 57 2HG GLU 57 -6.421 -19.014 -20.920 470 HG3 GLU 57 3HG GLU 57 -5.557 -19.541 -19.477 471 H VAL 58 H VAL 58 -9.426 -16.899 -17.745 472 HA VAL 58 HA VAL 58 -11.410 -18.778 -16.892 473 HB VAL 58 HB VAL 58 -11.012 -15.958 -15.891 474 HG11 VAL 58 1HG1 VAL 58 -11.919 -18.211 -14.181 475 HG12 VAL 58 2HG1 VAL 58 -12.324 -16.495 -14.104 476 HG13 VAL 58 3HG1 VAL 58 -13.071 -17.525 -15.325 477 HG21 VAL 58 1HG2 VAL 58 -9.761 -17.431 -14.050 478 HG22 VAL 58 2HG2 VAL 58 -9.439 -18.433 -15.466 479 HG23 VAL 58 3HG2 VAL 58 -8.927 -16.745 -15.445 480 H LEU 59 H LEU 59 -11.455 -15.625 -18.477 481 HA LEU 59 HA LEU 59 -14.302 -15.365 -18.412 482 HB2 LEU 59 2HB LEU 59 -12.279 -13.964 -20.153 483 HB3 LEU 59 3HB LEU 59 -13.959 -13.481 -19.924 484 HG LEU 59 HG LEU 59 -11.706 -13.346 -17.932 485 HD11 LEU 59 1HD1 LEU 59 -13.032 -11.479 -19.708 486 HD12 LEU 59 2HD1 LEU 59 -11.536 -11.302 -18.792 487 HD13 LEU 59 3HD1 LEU 59 -13.086 -10.952 -18.026 488 HD21 LEU 59 1HD2 LEU 59 -14.664 -13.280 -17.523 489 HD22 LEU 59 2HD2 LEU 59 -13.616 -12.283 -16.514 490 HD23 LEU 59 3HD2 LEU 59 -13.410 -14.035 -16.539 491 H SER 60 H SER 60 -12.267 -17.329 -20.168 492 HA SER 60 HA SER 60 -13.611 -17.273 -22.695 493 HB2 SER 60 2HB SER 60 -11.366 -18.022 -22.762 494 HB3 SER 60 3HB SER 60 -11.621 -19.160 -21.439 495 HG SER 60 HG SER 60 -12.517 -20.554 -22.785 496 H ASP 61 H ASP 61 -14.296 -18.649 -19.668 497 HA ASP 61 HA ASP 61 -16.493 -20.185 -20.854 498 HB2 ASP 61 2HB ASP 61 -14.299 -21.491 -19.958 499 HB3 ASP 61 3HB ASP 61 -15.236 -21.403 -18.469 500 H GLU 62 H GLU 62 -18.393 -19.893 -19.853 501 HA GLU 62 HA GLU 62 -18.774 -17.885 -17.969 502 HB2 GLU 62 2HB GLU 62 -21.055 -18.877 -17.672 503 HB3 GLU 62 3HB GLU 62 -20.605 -18.577 -19.344 504 HG2 GLU 62 2HG GLU 62 -19.987 -20.973 -19.547 505 HG3 GLU 62 3HG GLU 62 -20.616 -21.226 -17.920 506 H VAL 63 H VAL 63 -18.552 -21.392 -17.514 507 HA VAL 63 HA VAL 63 -19.133 -21.486 -14.783 508 HB VAL 63 HB VAL 63 -17.187 -23.292 -16.220 509 HG11 VAL 63 1HG1 VAL 63 -18.879 -23.624 -13.751 510 HG12 VAL 63 2HG1 VAL 63 -18.074 -24.962 -14.572 511 HG13 VAL 63 3HG1 VAL 63 -17.120 -23.656 -13.867 512 HG21 VAL 63 1HG2 VAL 63 -19.977 -22.868 -16.703 513 HG22 VAL 63 2HG2 VAL 63 -18.864 -23.973 -17.509 514 HG23 VAL 63 3HG2 VAL 63 -19.727 -24.492 -16.062 515 H LYS 64 H LYS 64 -15.970 -21.277 -16.405 516 HA LYS 64 HA LYS 64 -14.425 -21.149 -14.059 517 HB2 LYS 64 2HB LYS 64 -13.926 -20.251 -16.890 518 HB3 LYS 64 3HB LYS 64 -12.723 -20.031 -15.625 519 HG2 LYS 64 2HG LYS 64 -13.505 -22.698 -15.423 520 HG3 LYS 64 3HG LYS 64 -13.373 -22.381 -17.154 521 HD2 LYS 64 2HD LYS 64 -11.241 -23.140 -16.333 522 HD3 LYS 64 3HD LYS 64 -11.115 -21.431 -16.758 523 HE2 LYS 64 2HE LYS 64 -11.212 -20.777 -14.471 524 HE3 LYS 64 3HE LYS 64 -11.654 -22.405 -13.960 525 HZ1 LYS 64 1HZ LYS 64 -9.314 -21.887 -13.532 526 HZ2 LYS 64 2HZ LYS 64 -9.056 -21.657 -15.187 527 HZ3 LYS 64 3HZ LYS 64 -9.483 -23.186 -14.604 528 H ARG 65 H ARG 65 -15.730 -18.581 -16.137 529 HA ARG 65 HA ARG 65 -14.628 -16.407 -14.755 530 HB2 ARG 65 2HB ARG 65 -15.577 -16.105 -16.950 531 HB3 ARG 65 3HB ARG 65 -17.160 -16.623 -16.387 532 HG2 ARG 65 2HG ARG 65 -17.201 -14.633 -14.888 533 HG3 ARG 65 3HG ARG 65 -15.706 -14.093 -15.657 534 HD2 ARG 65 2HD ARG 65 -17.505 -12.968 -16.735 535 HD3 ARG 65 3HD ARG 65 -16.907 -14.193 -17.853 536 HE ARG 65 HE ARG 65 -18.915 -15.477 -16.611 537 HH11 ARG 65 1HH1 ARG 65 -18.714 -12.353 -18.133 538 HH12 ARG 65 2HH1 ARG 65 -20.378 -12.335 -18.615 539 HH21 ARG 65 1HH2 ARG 65 -21.108 -15.466 -17.240 540 HH22 ARG 65 2HH2 ARG 65 -21.739 -14.106 -18.105 541 H LYS 66 H LYS 66 -17.717 -18.093 -14.342 542 HA LYS 66 HA LYS 66 -18.735 -16.399 -12.324 543 HB2 LYS 66 2HB LYS 66 -19.343 -19.257 -13.073 544 HB3 LYS 66 3HB LYS 66 -20.206 -18.406 -11.798 545 HG2 LYS 66 2HG LYS 66 -20.032 -17.344 -14.600 546 HG3 LYS 66 3HG LYS 66 -21.294 -18.465 -14.085 547 HD2 LYS 66 2HD LYS 66 -22.268 -16.923 -12.666 548 HD3 LYS 66 3HD LYS 66 -20.780 -15.989 -12.493 549 HE2 LYS 66 2HE LYS 66 -22.240 -14.683 -13.823 550 HE3 LYS 66 3HE LYS 66 -21.035 -15.356 -14.920 551 HZ1 LYS 66 1HZ LYS 66 -23.465 -15.445 -15.626 552 HZ2 LYS 66 2HZ LYS 66 -23.637 -16.689 -14.493 553 HZ3 LYS 66 3HZ LYS 66 -22.560 -16.866 -15.786 554 H GLN 67 H GLN 67 -16.840 -19.384 -12.210 555 HA GLN 67 HA GLN 67 -16.920 -19.812 -9.450 556 HB2 GLN 67 2HB GLN 67 -14.961 -20.551 -11.599 557 HB3 GLN 67 3HB GLN 67 -14.609 -20.917 -9.915 558 HG2 GLN 67 2HG GLN 67 -16.979 -21.876 -11.502 559 HG3 GLN 67 3HG GLN 67 -15.587 -22.834 -10.997 560 HE21 GLN 67 1HE2 GLN 67 -18.573 -21.393 -10.042 561 HE22 GLN 67 2HE2 GLN 67 -18.664 -22.110 -8.473 562 H TYR 68 H TYR 68 -14.805 -17.785 -11.410 563 HA TYR 68 HA TYR 68 -13.035 -17.088 -9.297 564 HB2 TYR 68 2HB TYR 68 -12.271 -16.856 -11.561 565 HB3 TYR 68 3HB TYR 68 -13.612 -15.788 -11.963 566 HD1 TYR 68 HD1 TYR 68 -10.482 -16.039 -10.001 567 HD2 TYR 68 HD2 TYR 68 -13.471 -13.456 -11.581 568 HE1 TYR 68 HE1 TYR 68 -9.093 -14.091 -9.428 569 HE2 TYR 68 HE2 TYR 68 -12.090 -11.501 -11.014 570 HH TYR 68 HH TYR 68 -8.816 -11.772 -10.079 571 H ASP 69 H ASP 69 -15.985 -15.679 -10.596 572 HA ASP 69 HA ASP 69 -15.874 -13.229 -9.203 573 HB2 ASP 69 2HB ASP 69 -17.387 -13.808 -11.152 574 HB3 ASP 69 3HB ASP 69 -18.394 -14.687 -10.005 575 H ALA 70 H ALA 70 -16.775 -16.434 -8.242 576 HA ALA 70 HA ALA 70 -18.350 -15.794 -5.987 577 HB1 ALA 70 1HB ALA 70 -18.582 -18.001 -5.861 578 HB2 ALA 70 2HB ALA 70 -17.519 -18.123 -7.264 579 HB3 ALA 70 3HB ALA 70 -16.848 -18.234 -5.637 580 H TYR 71 H TYR 71 -14.914 -15.889 -6.525 581 HA TYR 71 HA TYR 71 -14.443 -15.426 -3.657 582 HB2 TYR 71 2HB TYR 71 -12.675 -16.518 -5.838 583 HB3 TYR 71 3HB TYR 71 -12.014 -15.937 -4.313 584 HD1 TYR 71 HD1 TYR 71 -11.834 -17.398 -2.517 585 HD2 TYR 71 HD2 TYR 71 -14.547 -18.321 -5.662 586 HE1 TYR 71 HE1 TYR 71 -12.272 -19.589 -1.489 587 HE2 TYR 71 HE2 TYR 71 -14.994 -20.514 -4.642 588 HH TYR 71 HH TYR 71 -13.843 -21.335 -1.475 589 H GLY 72 H GLY 72 -15.356 -13.442 -5.658 590 HA2 GLY 72 2HA GLY 72 -13.029 -11.626 -5.633 591 HA3 GLY 72 3HA GLY 72 -14.355 -11.529 -6.782 592 H SER 73 H SER 73 -13.513 -9.315 -5.353 593 HA SER 73 HA SER 73 -15.057 -8.903 -2.995 594 HB2 SER 73 2HB SER 73 -13.759 -6.884 -4.842 595 HB3 SER 73 3HB SER 73 -14.388 -6.540 -3.231 596 HG SER 73 HG SER 73 -12.123 -8.016 -3.986 Start of MODEL 18 1 H1 HIS 1 H HIS 1 -6.217 2.338 5.317 2 HA HIS 1 HA HIS 1 -7.646 1.960 2.932 3 HB2 HIS 1 2HB HIS 1 -4.733 1.864 3.648 4 HB3 HIS 1 3HB HIS 1 -5.259 1.421 2.027 5 HD1 HIS 1 HD1 HIS 1 -5.396 4.365 4.410 6 HD2 HIS 1 HD2 HIS 1 -5.672 3.530 0.349 7 HE1 HIS 1 HE1 HIS 1 -5.464 6.604 3.266 8 H MET 2 H MET 2 -7.534 0.196 1.416 9 HA MET 2 HA MET 2 -7.061 -2.422 2.677 10 HB2 MET 2 2HB MET 2 -9.365 -1.634 0.887 11 HB3 MET 2 3HB MET 2 -9.007 -3.285 1.375 12 HG2 MET 2 2HG MET 2 -9.327 -2.640 3.723 13 HG3 MET 2 3HG MET 2 -9.740 -1.009 3.201 14 HE1 MET 2 1HE MET 2 -12.144 -0.271 2.721 15 HE2 MET 2 2HE MET 2 -11.621 -0.800 1.122 16 HE3 MET 2 3HE MET 2 -13.213 -1.261 1.726 17 H LEU 3 H LEU 3 -6.816 -4.197 1.050 18 HA LEU 3 HA LEU 3 -4.947 -3.349 -0.981 19 HB2 LEU 3 2HB LEU 3 -4.919 -5.459 0.595 20 HB3 LEU 3 3HB LEU 3 -5.862 -6.171 -0.712 21 HG LEU 3 HG LEU 3 -3.533 -6.762 -0.952 22 HD11 LEU 3 1HD1 LEU 3 -3.931 -4.688 -3.058 23 HD12 LEU 3 2HD1 LEU 3 -5.059 -6.039 -2.940 24 HD13 LEU 3 3HD1 LEU 3 -3.342 -6.344 -3.204 25 HD21 LEU 3 1HD2 LEU 3 -2.923 -4.419 0.190 26 HD22 LEU 3 2HD2 LEU 3 -2.666 -3.989 -1.502 27 HD23 LEU 3 3HD2 LEU 3 -1.780 -5.339 -0.790 28 H ALA 4 H ALA 4 -5.551 -2.792 -2.957 29 HA ALA 4 HA ALA 4 -8.151 -3.170 -3.982 30 HB1 ALA 4 1HB ALA 4 -5.564 -2.292 -5.225 31 HB2 ALA 4 2HB ALA 4 -7.042 -2.456 -6.173 32 HB3 ALA 4 3HB ALA 4 -6.982 -1.325 -4.822 33 H LYS 5 H LYS 5 -9.038 -4.723 -5.217 34 HA LYS 5 HA LYS 5 -7.388 -7.073 -5.810 35 HB2 LYS 5 2HB LYS 5 -10.336 -6.648 -5.430 36 HB3 LYS 5 3HB LYS 5 -9.742 -8.079 -6.262 37 HG2 LYS 5 2HG LYS 5 -8.825 -7.288 -3.512 38 HG3 LYS 5 3HG LYS 5 -10.208 -8.344 -3.806 39 HD2 LYS 5 2HD LYS 5 -7.621 -8.992 -5.131 40 HD3 LYS 5 3HD LYS 5 -7.787 -9.321 -3.404 41 HE2 LYS 5 2HE LYS 5 -9.411 -10.915 -3.728 42 HE3 LYS 5 3HE LYS 5 -9.945 -10.215 -5.255 43 HZ1 LYS 5 1HZ LYS 5 -8.838 -12.041 -6.001 44 HZ2 LYS 5 2HZ LYS 5 -7.726 -12.051 -4.727 45 HZ3 LYS 5 3HZ LYS 5 -7.553 -10.941 -5.992 46 H GLU 6 H GLU 6 -7.104 -7.849 -7.845 47 HA GLU 6 HA GLU 6 -8.011 -6.120 -10.028 48 HB2 GLU 6 2HB GLU 6 -5.855 -8.234 -9.919 49 HB3 GLU 6 3HB GLU 6 -6.290 -7.341 -11.370 50 HG2 GLU 6 2HG GLU 6 -4.499 -6.131 -10.642 51 HG3 GLU 6 3HG GLU 6 -5.820 -5.254 -9.873 52 H ASP 7 H ASP 7 -9.332 -6.804 -11.623 53 HA ASP 7 HA ASP 7 -10.287 -9.588 -11.466 54 HB2 ASP 7 2HB ASP 7 -11.902 -7.380 -12.697 55 HB3 ASP 7 3HB ASP 7 -12.452 -8.895 -11.985 56 H TYR 8 H TYR 8 -10.633 -10.733 -13.373 57 HA TYR 8 HA TYR 8 -8.828 -10.271 -15.461 58 HB2 TYR 8 2HB TYR 8 -11.333 -11.960 -15.573 59 HB3 TYR 8 3HB TYR 8 -9.916 -12.114 -16.605 60 HD1 TYR 8 HD1 TYR 8 -11.410 -14.045 -14.501 61 HD2 TYR 8 HD2 TYR 8 -7.765 -11.851 -14.549 62 HE1 TYR 8 HE1 TYR 8 -10.432 -15.646 -12.912 63 HE2 TYR 8 HE2 TYR 8 -6.777 -13.447 -12.960 64 HH TYR 8 HH TYR 8 -7.476 -15.061 -11.298 65 H TYR 9 H TYR 9 -12.052 -9.134 -14.939 66 HA TYR 9 HA TYR 9 -12.955 -8.603 -17.490 67 HB2 TYR 9 2HB TYR 9 -13.286 -6.894 -15.017 68 HB3 TYR 9 3HB TYR 9 -14.251 -6.748 -16.481 69 HD1 TYR 9 HD1 TYR 9 -13.882 -8.417 -13.336 70 HD2 TYR 9 HD2 TYR 9 -15.650 -8.758 -17.191 71 HE1 TYR 9 HE1 TYR 9 -15.447 -10.102 -12.463 72 HE2 TYR 9 HE2 TYR 9 -17.221 -10.442 -16.329 73 HH TYR 9 HH TYR 9 -16.955 -12.195 -14.026 74 H GLN 10 H GLN 10 -10.912 -6.535 -15.441 75 HA GLN 10 HA GLN 10 -10.612 -4.494 -17.397 76 HB2 GLN 10 2HB GLN 10 -8.855 -5.112 -15.016 77 HB3 GLN 10 3HB GLN 10 -8.879 -3.605 -15.923 78 HG2 GLN 10 2HG GLN 10 -11.338 -4.644 -14.568 79 HG3 GLN 10 3HG GLN 10 -10.127 -3.709 -13.691 80 HE21 GLN 10 1HE2 GLN 10 -12.940 -3.521 -15.385 81 HE22 GLN 10 2HE2 GLN 10 -12.896 -1.853 -15.833 82 H ILE 11 H ILE 11 -8.645 -7.271 -16.435 83 HA ILE 11 HA ILE 11 -6.377 -6.736 -17.968 84 HB ILE 11 HB ILE 11 -7.550 -9.433 -17.277 85 HG12 ILE 11 2HG1 ILE 11 -5.327 -7.959 -15.866 86 HG13 ILE 11 3HG1 ILE 11 -7.013 -7.814 -15.380 87 HG21 ILE 11 1HG2 ILE 11 -5.021 -8.590 -18.577 88 HG22 ILE 11 2HG2 ILE 11 -4.942 -9.914 -17.415 89 HG23 ILE 11 3HG2 ILE 11 -5.995 -10.039 -18.824 90 HD11 ILE 11 1HD1 ILE 11 -5.272 -9.618 -14.378 91 HD12 ILE 11 2HD1 ILE 11 -7.024 -9.823 -14.393 92 HD13 ILE 11 3HD1 ILE 11 -6.039 -10.565 -15.653 93 H LEU 12 H LEU 12 -9.521 -7.774 -18.918 94 HA LEU 12 HA LEU 12 -8.545 -8.436 -21.612 95 HB2 LEU 12 2HB LEU 12 -10.815 -9.356 -19.964 96 HB3 LEU 12 3HB LEU 12 -11.138 -9.152 -21.685 97 HG LEU 12 HG LEU 12 -8.914 -10.866 -20.589 98 HD11 LEU 12 1HD1 LEU 12 -11.772 -11.370 -20.804 99 HD12 LEU 12 2HD1 LEU 12 -10.519 -12.280 -19.961 100 HD13 LEU 12 3HD1 LEU 12 -10.794 -12.545 -21.683 101 HD21 LEU 12 1HD2 LEU 12 -8.637 -11.654 -22.771 102 HD22 LEU 12 2HD2 LEU 12 -8.835 -9.912 -22.964 103 HD23 LEU 12 3HD2 LEU 12 -10.185 -10.997 -23.304 104 H GLY 13 H GLY 13 -10.164 -6.066 -19.798 105 HA2 GLY 13 2HA GLY 13 -10.887 -3.975 -20.481 106 HA3 GLY 13 3HA GLY 13 -10.557 -4.443 -22.143 107 H VAL 14 H VAL 14 -12.553 -6.485 -20.189 108 HA VAL 14 HA VAL 14 -14.893 -5.617 -21.753 109 HB VAL 14 HB VAL 14 -15.809 -7.843 -21.469 110 HG11 VAL 14 1HG1 VAL 14 -13.193 -8.755 -22.306 111 HG12 VAL 14 2HG1 VAL 14 -14.676 -8.571 -23.243 112 HG13 VAL 14 3HG1 VAL 14 -13.599 -7.193 -23.016 113 HG21 VAL 14 1HG2 VAL 14 -14.969 -8.382 -19.273 114 HG22 VAL 14 2HG2 VAL 14 -14.463 -9.632 -20.410 115 HG23 VAL 14 3HG2 VAL 14 -13.311 -8.408 -19.875 116 HA PRO 15 HA PRO 15 -17.006 -4.406 -18.097 117 HB2 PRO 15 2HB PRO 15 -19.572 -4.966 -18.787 118 HB3 PRO 15 3HB PRO 15 -18.666 -3.612 -19.473 119 HG2 PRO 15 2HG PRO 15 -19.186 -6.323 -20.630 120 HG3 PRO 15 3HG PRO 15 -19.250 -4.738 -21.422 121 HD2 PRO 15 2HD PRO 15 -17.133 -6.406 -21.672 122 HD3 PRO 15 3HD PRO 15 -16.963 -4.639 -21.691 123 H ARG 16 H ARG 16 -18.743 -5.224 -16.527 124 HA ARG 16 HA ARG 16 -17.975 -7.862 -15.678 125 HB2 ARG 16 2HB ARG 16 -20.092 -6.067 -14.485 126 HB3 ARG 16 3HB ARG 16 -19.282 -7.418 -13.703 127 HG2 ARG 16 2HG ARG 16 -17.819 -4.974 -14.659 128 HG3 ARG 16 3HG ARG 16 -18.506 -5.116 -13.040 129 HD2 ARG 16 2HD ARG 16 -16.563 -7.103 -14.200 130 HD3 ARG 16 3HD ARG 16 -16.067 -5.706 -13.244 131 HE ARG 16 HE ARG 16 -17.219 -8.142 -12.272 132 HH11 ARG 16 1HH1 ARG 16 -16.842 -4.737 -11.654 133 HH12 ARG 16 2HH1 ARG 16 -17.059 -4.891 -9.941 134 HH21 ARG 16 1HH2 ARG 16 -17.506 -8.358 -10.019 135 HH22 ARG 16 2HH2 ARG 16 -17.435 -6.951 -9.013 136 H ASN 17 H ASN 17 -20.283 -6.690 -17.786 137 HA ASN 17 HA ASN 17 -22.050 -9.001 -17.333 138 HB2 ASN 17 2HB ASN 17 -22.589 -6.310 -18.592 139 HB3 ASN 17 3HB ASN 17 -23.699 -7.669 -18.737 140 HD21 ASN 17 1HD2 ASN 17 -24.153 -5.108 -17.499 141 HD22 ASN 17 2HD2 ASN 17 -24.546 -5.419 -15.845 142 H ALA 18 H ALA 18 -19.510 -8.150 -19.145 143 HA ALA 18 HA ALA 18 -20.163 -8.562 -21.803 144 HB1 ALA 18 1HB ALA 18 -17.934 -8.643 -22.186 145 HB2 ALA 18 2HB ALA 18 -17.869 -8.068 -20.519 146 HB3 ALA 18 3HB ALA 18 -17.637 -9.781 -20.871 147 H SER 19 H SER 19 -19.896 -10.433 -23.173 148 HA SER 19 HA SER 19 -20.706 -12.908 -21.805 149 HB2 SER 19 2HB SER 19 -21.089 -12.208 -24.723 150 HB3 SER 19 3HB SER 19 -21.802 -13.565 -23.852 151 HG SER 19 HG SER 19 -22.344 -10.805 -23.514 152 H GLN 20 H GLN 20 -20.063 -14.942 -23.033 153 HA GLN 20 HA GLN 20 -17.270 -15.150 -23.078 154 HB2 GLN 20 2HB GLN 20 -19.157 -17.046 -24.469 155 HB3 GLN 20 3HB GLN 20 -17.580 -17.407 -23.779 156 HG2 GLN 20 2HG GLN 20 -20.172 -16.897 -22.376 157 HG3 GLN 20 3HG GLN 20 -19.097 -18.288 -22.254 158 HE21 GLN 20 1HE2 GLN 20 -17.096 -18.026 -21.134 159 HE22 GLN 20 2HE2 GLN 20 -16.939 -16.827 -19.900 160 H LYS 21 H LYS 21 -19.548 -14.314 -25.550 161 HA LYS 21 HA LYS 21 -17.812 -14.831 -27.769 162 HB2 LYS 21 2HB LYS 21 -20.260 -14.821 -28.009 163 HB3 LYS 21 3HB LYS 21 -20.294 -13.112 -27.595 164 HG2 LYS 21 2HG LYS 21 -19.438 -12.460 -29.619 165 HG3 LYS 21 3HG LYS 21 -18.630 -14.005 -29.897 166 HD2 LYS 21 2HD LYS 21 -20.383 -14.130 -31.389 167 HD3 LYS 21 3HD LYS 21 -21.071 -14.936 -29.977 168 HE2 LYS 21 2HE LYS 21 -22.691 -13.397 -30.866 169 HE3 LYS 21 3HE LYS 21 -22.112 -12.786 -29.317 170 HZ1 LYS 21 1HZ LYS 21 -22.283 -11.078 -31.083 171 HZ2 LYS 21 2HZ LYS 21 -21.071 -11.883 -31.945 172 HZ3 LYS 21 3HZ LYS 21 -20.729 -11.216 -30.429 173 H GLU 22 H GLU 22 -18.830 -11.907 -26.024 174 HA GLU 22 HA GLU 22 -17.333 -10.082 -27.554 175 HB2 GLU 22 2HB GLU 22 -19.127 -9.328 -26.110 176 HB3 GLU 22 3HB GLU 22 -18.279 -9.922 -24.689 177 HG2 GLU 22 2HG GLU 22 -16.731 -8.213 -24.729 178 HG3 GLU 22 3HG GLU 22 -16.994 -7.876 -26.439 179 H ILE 23 H ILE 23 -16.538 -11.965 -24.683 180 HA ILE 23 HA ILE 23 -14.102 -10.756 -24.037 181 HB ILE 23 HB ILE 23 -14.908 -13.645 -23.681 182 HG12 ILE 23 2HG1 ILE 23 -14.889 -11.639 -21.473 183 HG13 ILE 23 3HG1 ILE 23 -16.217 -11.587 -22.627 184 HG21 ILE 23 1HG2 ILE 23 -12.420 -12.327 -23.211 185 HG22 ILE 23 2HG2 ILE 23 -13.129 -12.794 -21.666 186 HG23 ILE 23 3HG2 ILE 23 -12.858 -14.009 -22.914 187 HD11 ILE 23 1HD1 ILE 23 -15.921 -14.276 -21.890 188 HD12 ILE 23 2HD1 ILE 23 -15.820 -13.331 -20.404 189 HD13 ILE 23 3HD1 ILE 23 -17.223 -13.167 -21.461 190 H LYS 24 H LYS 24 -14.898 -13.235 -26.398 191 HA LYS 24 HA LYS 24 -12.289 -14.073 -27.014 192 HB2 LYS 24 2HB LYS 24 -14.894 -14.104 -28.499 193 HB3 LYS 24 3HB LYS 24 -13.413 -14.595 -29.311 194 HG2 LYS 24 2HG LYS 24 -13.082 -16.194 -27.342 195 HG3 LYS 24 3HG LYS 24 -14.777 -15.871 -26.968 196 HD2 LYS 24 2HD LYS 24 -13.918 -16.724 -29.715 197 HD3 LYS 24 3HD LYS 24 -14.220 -17.906 -28.440 198 HE2 LYS 24 2HE LYS 24 -16.240 -15.797 -29.125 199 HE3 LYS 24 3HE LYS 24 -16.146 -17.303 -30.037 200 HZ1 LYS 24 1HZ LYS 24 -16.743 -18.550 -28.191 201 HZ2 LYS 24 2HZ LYS 24 -17.735 -17.186 -28.058 202 HZ3 LYS 24 3HZ LYS 24 -16.353 -17.324 -27.093 203 H LYS 25 H LYS 25 -14.260 -11.426 -28.263 204 HA LYS 25 HA LYS 25 -12.413 -10.661 -30.297 205 HB2 LYS 25 2HB LYS 25 -14.675 -9.133 -28.998 206 HB3 LYS 25 3HB LYS 25 -13.781 -8.583 -30.409 207 HG2 LYS 25 2HG LYS 25 -14.615 -10.362 -31.738 208 HG3 LYS 25 3HG LYS 25 -15.290 -11.183 -30.328 209 HD2 LYS 25 2HD LYS 25 -17.048 -9.696 -30.140 210 HD3 LYS 25 3HD LYS 25 -16.188 -8.411 -30.992 211 HE2 LYS 25 2HE LYS 25 -16.692 -9.263 -33.064 212 HE3 LYS 25 3HE LYS 25 -16.855 -10.913 -32.465 213 HZ1 LYS 25 1HZ LYS 25 -18.886 -9.896 -31.220 214 HZ2 LYS 25 2HZ LYS 25 -19.026 -10.356 -32.841 215 HZ3 LYS 25 3HZ LYS 25 -18.813 -8.727 -32.440 216 H ALA 26 H ALA 26 -13.166 -9.388 -27.064 217 HA ALA 26 HA ALA 26 -11.289 -7.292 -27.096 218 HB1 ALA 26 1HB ALA 26 -12.277 -8.775 -24.666 219 HB2 ALA 26 2HB ALA 26 -11.644 -7.130 -24.734 220 HB3 ALA 26 3HB ALA 26 -13.187 -7.513 -25.497 221 H TYR 27 H TYR 27 -10.999 -10.696 -26.367 222 HA TYR 27 HA TYR 27 -8.449 -10.529 -25.099 223 HB2 TYR 27 2HB TYR 27 -9.839 -12.438 -24.644 224 HB3 TYR 27 3HB TYR 27 -9.936 -12.841 -26.354 225 HD1 TYR 27 HD1 TYR 27 -7.040 -12.004 -24.147 226 HD2 TYR 27 HD2 TYR 27 -8.886 -14.873 -26.689 227 HE1 TYR 27 HE1 TYR 27 -5.079 -13.470 -23.907 228 HE2 TYR 27 HE2 TYR 27 -6.932 -16.347 -26.455 229 HH TYR 27 HH TYR 27 -3.990 -15.299 -25.110 230 H TYR 28 H TYR 28 -9.556 -10.975 -28.398 231 HA TYR 28 HA TYR 28 -6.980 -11.657 -29.446 232 HB2 TYR 28 2HB TYR 28 -8.977 -12.397 -30.606 233 HB3 TYR 28 3HB TYR 28 -9.517 -10.735 -30.813 234 HD1 TYR 28 HD1 TYR 28 -9.311 -9.943 -32.960 235 HD2 TYR 28 HD2 TYR 28 -6.382 -12.664 -31.505 236 HE1 TYR 28 HE1 TYR 28 -8.140 -9.828 -35.120 237 HE2 TYR 28 HE2 TYR 28 -5.202 -12.556 -33.661 238 HH TYR 28 HH TYR 28 -6.145 -11.908 -36.243 239 H GLN 29 H GLN 29 -8.980 -8.719 -29.468 240 HA GLN 29 HA GLN 29 -7.232 -7.097 -30.929 241 HB2 GLN 29 2HB GLN 29 -8.531 -5.260 -30.209 242 HB3 GLN 29 3HB GLN 29 -9.646 -6.618 -30.285 243 HG2 GLN 29 2HG GLN 29 -9.507 -6.900 -27.882 244 HG3 GLN 29 3HG GLN 29 -8.331 -5.591 -27.781 245 HE21 GLN 29 1HE2 GLN 29 -10.091 -4.930 -26.210 246 HE22 GLN 29 2HE2 GLN 29 -11.339 -3.913 -26.838 247 H LEU 30 H LEU 30 -7.310 -7.935 -27.526 248 HA LEU 30 HA LEU 30 -5.397 -5.982 -26.704 249 HB2 LEU 30 2HB LEU 30 -6.973 -8.068 -25.490 250 HB3 LEU 30 3HB LEU 30 -5.316 -8.112 -24.892 251 HG LEU 30 HG LEU 30 -5.487 -5.864 -24.073 252 HD11 LEU 30 1HD1 LEU 30 -7.793 -5.772 -25.869 253 HD12 LEU 30 2HD1 LEU 30 -6.736 -4.478 -25.307 254 HD13 LEU 30 3HD1 LEU 30 -8.071 -5.027 -24.295 255 HD21 LEU 30 1HD2 LEU 30 -7.881 -7.551 -23.366 256 HD22 LEU 30 2HD2 LEU 30 -7.381 -6.117 -22.470 257 HD23 LEU 30 3HD2 LEU 30 -6.314 -7.519 -22.558 258 H ALA 31 H ALA 31 -5.234 -9.404 -27.586 259 HA ALA 31 HA ALA 31 -2.568 -9.892 -26.932 260 HB1 ALA 31 1HB ALA 31 -3.478 -11.868 -27.480 261 HB2 ALA 31 2HB ALA 31 -4.593 -11.149 -28.641 262 HB3 ALA 31 3HB ALA 31 -2.924 -11.475 -29.108 263 H LYS 32 H LYS 32 -3.993 -8.484 -29.837 264 HA LYS 32 HA LYS 32 -1.674 -8.447 -31.424 265 HB2 LYS 32 2HB LYS 32 -4.157 -6.738 -31.419 266 HB3 LYS 32 3HB LYS 32 -2.872 -6.523 -32.601 267 HG2 LYS 32 2HG LYS 32 -3.393 -8.420 -33.721 268 HG3 LYS 32 3HG LYS 32 -3.932 -9.263 -32.267 269 HD2 LYS 32 2HD LYS 32 -5.806 -8.829 -33.764 270 HD3 LYS 32 3HD LYS 32 -5.986 -7.928 -32.257 271 HE2 LYS 32 2HE LYS 32 -6.559 -6.571 -34.222 272 HE3 LYS 32 3HE LYS 32 -5.185 -5.910 -33.337 273 HZ1 LYS 32 1HZ LYS 32 -3.694 -6.740 -34.964 274 HZ2 LYS 32 2HZ LYS 32 -4.928 -5.941 -35.799 275 HZ3 LYS 32 3HZ LYS 32 -4.907 -7.631 -35.737 276 H LYS 33 H LYS 33 -2.653 -6.513 -28.747 277 HA LYS 33 HA LYS 33 -0.952 -4.274 -29.337 278 HB2 LYS 33 2HB LYS 33 -2.088 -4.976 -26.636 279 HB3 LYS 33 3HB LYS 33 -1.643 -3.388 -27.247 280 HG2 LYS 33 2HG LYS 33 -3.493 -3.817 -29.007 281 HG3 LYS 33 3HG LYS 33 -4.050 -5.045 -27.867 282 HD2 LYS 33 2HD LYS 33 -5.254 -3.131 -27.274 283 HD3 LYS 33 3HD LYS 33 -3.932 -3.182 -26.106 284 HE2 LYS 33 2HE LYS 33 -4.163 -0.930 -26.891 285 HE3 LYS 33 3HE LYS 33 -2.674 -1.599 -27.556 286 HZ1 LYS 33 1HZ LYS 33 -5.198 -1.661 -29.088 287 HZ2 LYS 33 2HZ LYS 33 -3.611 -1.788 -29.660 288 HZ3 LYS 33 3HZ LYS 33 -4.195 -0.299 -29.110 289 H TYR 34 H TYR 34 -0.733 -7.201 -27.401 290 HA TYR 34 HA TYR 34 1.988 -6.453 -26.585 291 HB2 TYR 34 2HB TYR 34 0.204 -8.662 -25.538 292 HB3 TYR 34 3HB TYR 34 1.797 -8.245 -24.916 293 HD1 TYR 34 HD1 TYR 34 2.127 -6.221 -23.595 294 HD2 TYR 34 HD2 TYR 34 -1.727 -7.283 -25.053 295 HE1 TYR 34 HE1 TYR 34 1.103 -4.609 -22.045 296 HE2 TYR 34 HE2 TYR 34 -2.761 -5.673 -23.508 297 HH TYR 34 HH TYR 34 -0.802 -3.815 -21.207 298 H HIS 35 H HIS 35 1.056 -7.526 -29.247 299 HA HIS 35 HA HIS 35 1.904 -10.186 -29.561 300 HB2 HIS 35 2HB HIS 35 1.149 -7.969 -31.289 301 HB3 HIS 35 3HB HIS 35 2.434 -8.947 -31.992 302 HD1 HIS 35 HD1 HIS 35 0.685 -9.721 -33.801 303 HD2 HIS 35 HD2 HIS 35 -0.165 -10.899 -29.909 304 HE1 HIS 35 HE1 HIS 35 -1.062 -11.518 -34.009 305 HA PRO 36 HA PRO 36 6.288 -10.061 -29.574 306 HB2 PRO 36 2HB PRO 36 6.921 -11.741 -31.610 307 HB3 PRO 36 3HB PRO 36 6.259 -12.304 -30.072 308 HG2 PRO 36 2HG PRO 36 4.863 -11.841 -32.679 309 HG3 PRO 36 3HG PRO 36 4.685 -13.187 -31.538 310 HD2 PRO 36 2HD PRO 36 2.924 -11.133 -31.654 311 HD3 PRO 36 3HD PRO 36 3.298 -11.986 -30.143 312 H ASP 37 H ASP 37 4.534 -8.928 -32.265 313 HA ASP 37 HA ASP 37 6.790 -8.151 -33.869 314 HB2 ASP 37 2HB ASP 37 4.814 -8.547 -35.094 315 HB3 ASP 37 3HB ASP 37 3.838 -7.578 -33.994 316 H THR 38 H THR 38 5.094 -6.838 -31.196 317 HA THR 38 HA THR 38 6.321 -4.199 -31.644 318 HB THR 38 HB THR 38 4.667 -3.213 -30.261 319 HG1 THR 38 HG1 THR 38 4.393 -5.803 -29.312 320 HG21 THR 38 1HG2 THR 38 2.856 -3.429 -31.621 321 HG22 THR 38 2HG2 THR 38 2.880 -5.191 -31.555 322 HG23 THR 38 3HG2 THR 38 4.010 -4.332 -32.602 323 H ASN 39 H ASN 39 7.184 -6.905 -30.260 324 HA ASN 39 HA ASN 39 7.879 -5.887 -27.622 325 HB2 ASN 39 2HB ASN 39 7.897 -8.555 -28.944 326 HB3 ASN 39 3HB ASN 39 9.052 -8.287 -27.642 327 HD21 ASN 39 1HD2 ASN 39 5.759 -7.075 -28.063 328 HD22 ASN 39 2HD2 ASN 39 5.126 -7.784 -26.620 329 H LYS 40 H LYS 40 9.068 -5.155 -30.423 330 HA LYS 40 HA LYS 40 11.795 -5.892 -30.360 331 HB2 LYS 40 2HB LYS 40 10.181 -3.832 -31.792 332 HB3 LYS 40 3HB LYS 40 11.931 -3.662 -31.790 333 HG2 LYS 40 2HG LYS 40 11.598 -4.861 -33.712 334 HG3 LYS 40 3HG LYS 40 11.890 -6.157 -32.550 335 HD2 LYS 40 2HD LYS 40 9.138 -5.634 -32.438 336 HD3 LYS 40 3HD LYS 40 9.559 -5.630 -34.152 337 HE2 LYS 40 2HE LYS 40 10.190 -7.817 -32.172 338 HE3 LYS 40 3HE LYS 40 8.925 -7.865 -33.398 339 HZ1 LYS 40 1HZ LYS 40 11.808 -8.169 -33.691 340 HZ2 LYS 40 2HZ LYS 40 11.006 -7.342 -34.930 341 HZ3 LYS 40 3HZ LYS 40 10.549 -8.922 -34.534 342 H ASP 41 H ASP 41 10.037 -3.102 -29.093 343 HA ASP 41 HA ASP 41 12.489 -2.302 -27.666 344 HB2 ASP 41 2HB ASP 41 10.264 -0.620 -28.811 345 HB3 ASP 41 3HB ASP 41 11.381 0.001 -27.599 346 H ASP 42 H ASP 42 10.022 -4.071 -27.054 347 HA ASP 42 HA ASP 42 9.662 -3.027 -24.345 348 HB2 ASP 42 2HB ASP 42 7.707 -2.520 -26.087 349 HB3 ASP 42 3HB ASP 42 7.244 -4.165 -25.662 350 HA PRO 43 HA PRO 43 10.678 -7.523 -24.368 351 HB2 PRO 43 2HB PRO 43 12.331 -7.378 -22.220 352 HB3 PRO 43 3HB PRO 43 12.871 -7.050 -23.871 353 HG2 PRO 43 2HG PRO 43 12.102 -5.125 -21.711 354 HG3 PRO 43 3HG PRO 43 13.463 -5.049 -22.846 355 HD2 PRO 43 2HD PRO 43 11.187 -3.627 -23.204 356 HD3 PRO 43 3HD PRO 43 12.151 -4.243 -24.561 357 H LYS 44 H LYS 44 9.107 -5.355 -22.305 358 HA LYS 44 HA LYS 44 8.487 -7.374 -20.287 359 HB2 LYS 44 2HB LYS 44 8.009 -4.412 -20.490 360 HB3 LYS 44 3HB LYS 44 7.157 -5.388 -19.300 361 HG2 LYS 44 2HG LYS 44 9.190 -6.003 -18.231 362 HG3 LYS 44 3HG LYS 44 10.155 -5.303 -19.533 363 HD2 LYS 44 2HD LYS 44 9.311 -3.077 -18.953 364 HD3 LYS 44 3HD LYS 44 8.352 -3.781 -17.649 365 HE2 LYS 44 2HE LYS 44 10.356 -2.866 -16.706 366 HE3 LYS 44 3HE LYS 44 10.462 -4.624 -16.637 367 HZ1 LYS 44 1HZ LYS 44 12.536 -3.610 -17.379 368 HZ2 LYS 44 2HZ LYS 44 11.742 -2.911 -18.699 369 HZ3 LYS 44 3HZ LYS 44 11.873 -4.594 -18.584 370 H ALA 45 H ALA 45 7.173 -5.974 -23.121 371 HA ALA 45 HA ALA 45 4.432 -6.157 -22.683 372 HB1 ALA 45 1HB ALA 45 6.125 -6.372 -25.142 373 HB2 ALA 45 2HB ALA 45 4.379 -6.606 -25.227 374 HB3 ALA 45 3HB ALA 45 5.036 -5.076 -24.646 375 H LYS 46 H LYS 46 6.753 -8.638 -23.637 376 HA LYS 46 HA LYS 46 4.983 -10.684 -24.302 377 HB2 LYS 46 2HB LYS 46 6.841 -12.224 -23.749 378 HB3 LYS 46 3HB LYS 46 7.355 -10.872 -24.751 379 HG2 LYS 46 2HG LYS 46 8.072 -9.752 -22.577 380 HG3 LYS 46 3HG LYS 46 7.877 -11.343 -21.836 381 HD2 LYS 46 2HD LYS 46 10.158 -11.178 -22.435 382 HD3 LYS 46 3HD LYS 46 9.414 -12.225 -23.646 383 HE2 LYS 46 2HE LYS 46 9.089 -9.878 -24.871 384 HE3 LYS 46 3HE LYS 46 10.512 -9.483 -23.908 385 HZ1 LYS 46 1HZ LYS 46 11.691 -11.305 -24.888 386 HZ2 LYS 46 2HZ LYS 46 11.045 -10.359 -26.133 387 HZ3 LYS 46 3HZ LYS 46 10.313 -11.827 -25.719 388 H GLU 47 H GLU 47 6.276 -9.726 -21.151 389 HA GLU 47 HA GLU 47 5.170 -11.861 -19.676 390 HB2 GLU 47 2HB GLU 47 6.982 -10.358 -18.864 391 HB3 GLU 47 3HB GLU 47 5.798 -9.068 -18.704 392 HG2 GLU 47 2HG GLU 47 4.732 -10.091 -16.919 393 HG3 GLU 47 3HG GLU 47 5.400 -11.677 -17.301 394 H LYS 48 H LYS 48 3.933 -8.688 -20.577 395 HA LYS 48 HA LYS 48 1.583 -8.831 -18.975 396 HB2 LYS 48 2HB LYS 48 2.128 -7.164 -21.439 397 HB3 LYS 48 3HB LYS 48 0.819 -6.907 -20.293 398 HG2 LYS 48 2HG LYS 48 3.767 -6.650 -19.738 399 HG3 LYS 48 3HG LYS 48 2.596 -5.336 -19.878 400 HD2 LYS 48 2HD LYS 48 1.374 -6.314 -17.935 401 HD3 LYS 48 3HD LYS 48 2.689 -7.478 -17.755 402 HE2 LYS 48 2HE LYS 48 4.257 -5.542 -17.534 403 HE3 LYS 48 3HE LYS 48 2.852 -4.478 -17.509 404 HZ1 LYS 48 1HZ LYS 48 2.331 -5.072 -15.420 405 HZ2 LYS 48 2HZ LYS 48 3.962 -5.506 -15.322 406 HZ3 LYS 48 3HZ LYS 48 2.791 -6.686 -15.628 407 H PHE 49 H PHE 49 2.396 -9.796 -22.248 408 HA PHE 49 HA PHE 49 -0.177 -10.195 -23.260 409 HB2 PHE 49 2HB PHE 49 1.687 -10.253 -24.760 410 HB3 PHE 49 3HB PHE 49 2.435 -11.578 -23.875 411 HD1 PHE 49 HD1 PHE 49 -0.120 -10.640 -26.299 412 HD2 PHE 49 HD2 PHE 49 1.611 -13.850 -24.105 413 HE1 PHE 49 HE1 PHE 49 -1.229 -12.252 -27.790 414 HE2 PHE 49 HE2 PHE 49 0.506 -15.468 -25.593 415 HZ PHE 49 HZ PHE 49 -0.916 -14.670 -27.439 416 H SER 50 H SER 50 1.823 -12.192 -21.190 417 HA SER 50 HA SER 50 0.361 -14.590 -21.411 418 HB2 SER 50 2HB SER 50 2.689 -14.106 -20.315 419 HB3 SER 50 3HB SER 50 1.736 -13.810 -18.860 420 HG SER 50 HG SER 50 1.738 -16.184 -20.419 421 H GLN 51 H GLN 51 -0.072 -11.723 -19.446 422 HA GLN 51 HA GLN 51 -1.929 -12.768 -17.606 423 HB2 GLN 51 2HB GLN 51 -1.495 -9.960 -18.625 424 HB3 GLN 51 3HB GLN 51 -2.613 -10.356 -17.327 425 HG2 GLN 51 2HG GLN 51 -0.811 -11.172 -15.958 426 HG3 GLN 51 3HG GLN 51 0.337 -10.944 -17.276 427 HE21 GLN 51 1HE2 GLN 51 -2.238 -8.908 -15.934 428 HE22 GLN 51 2HE2 GLN 51 -1.228 -7.544 -15.611 429 H LEU 52 H LEU 52 -2.257 -11.602 -20.877 430 HA LEU 52 HA LEU 52 -5.040 -11.191 -20.913 431 HB2 LEU 52 2HB LEU 52 -3.347 -12.126 -23.219 432 HB3 LEU 52 3HB LEU 52 -4.873 -11.249 -23.298 433 HG LEU 52 HG LEU 52 -2.379 -10.061 -22.104 434 HD11 LEU 52 1HD1 LEU 52 -2.268 -10.820 -24.594 435 HD12 LEU 52 2HD1 LEU 52 -1.718 -9.208 -24.136 436 HD13 LEU 52 3HD1 LEU 52 -3.309 -9.423 -24.867 437 HD21 LEU 52 1HD2 LEU 52 -5.120 -9.229 -22.416 438 HD22 LEU 52 2HD2 LEU 52 -4.028 -8.126 -23.256 439 HD23 LEU 52 3HD2 LEU 52 -3.803 -8.453 -21.536 440 H ALA 53 H ALA 53 -3.121 -14.013 -21.941 441 HA ALA 53 HA ALA 53 -5.341 -15.655 -22.528 442 HB1 ALA 53 1HB ALA 53 -2.602 -15.846 -22.825 443 HB2 ALA 53 2HB ALA 53 -2.990 -17.129 -21.678 444 HB3 ALA 53 3HB ALA 53 -3.789 -17.080 -23.249 445 H GLU 54 H GLU 54 -3.511 -15.076 -19.585 446 HA GLU 54 HA GLU 54 -4.507 -17.237 -18.076 447 HB2 GLU 54 2HB GLU 54 -3.299 -14.582 -17.365 448 HB3 GLU 54 3HB GLU 54 -3.942 -15.631 -16.110 449 HG2 GLU 54 2HG GLU 54 -1.919 -16.592 -18.102 450 HG3 GLU 54 3HG GLU 54 -1.457 -15.785 -16.605 451 H ALA 55 H ALA 55 -5.559 -13.842 -18.257 452 HA ALA 55 HA ALA 55 -7.791 -14.217 -16.526 453 HB1 ALA 55 1HB ALA 55 -7.357 -12.015 -16.498 454 HB2 ALA 55 2HB ALA 55 -6.662 -12.027 -18.119 455 HB3 ALA 55 3HB ALA 55 -8.412 -11.967 -17.911 456 H TYR 56 H TYR 56 -7.360 -14.192 -20.031 457 HA TYR 56 HA TYR 56 -10.108 -14.302 -20.696 458 HB2 TYR 56 2HB TYR 56 -8.681 -13.621 -22.434 459 HB3 TYR 56 3HB TYR 56 -7.579 -14.970 -22.181 460 HD1 TYR 56 HD1 TYR 56 -10.788 -13.941 -23.642 461 HD2 TYR 56 HD2 TYR 56 -8.018 -17.133 -23.153 462 HE1 TYR 56 HE1 TYR 56 -11.939 -15.203 -25.411 463 HE2 TYR 56 HE2 TYR 56 -9.161 -18.404 -24.922 464 HH TYR 56 HH TYR 56 -11.784 -18.290 -25.866 465 H GLU 57 H GLU 57 -7.801 -16.697 -19.709 466 HA GLU 57 HA GLU 57 -8.989 -19.015 -20.716 467 HB2 GLU 57 2HB GLU 57 -7.123 -18.370 -18.511 468 HB3 GLU 57 3HB GLU 57 -7.966 -19.907 -18.381 469 HG2 GLU 57 2HG GLU 57 -6.591 -19.170 -20.924 470 HG3 GLU 57 3HG GLU 57 -5.664 -19.790 -19.560 471 H VAL 58 H VAL 58 -9.475 -17.408 -17.579 472 HA VAL 58 HA VAL 58 -11.536 -19.214 -16.760 473 HB VAL 58 HB VAL 58 -10.818 -16.491 -15.664 474 HG11 VAL 58 1HG1 VAL 58 -11.974 -18.236 -13.733 475 HG12 VAL 58 2HG1 VAL 58 -12.565 -16.675 -14.307 476 HG13 VAL 58 3HG1 VAL 58 -13.043 -18.158 -15.134 477 HG21 VAL 58 1HG2 VAL 58 -10.051 -19.215 -14.628 478 HG22 VAL 58 2HG2 VAL 58 -8.997 -18.195 -15.607 479 HG23 VAL 58 3HG2 VAL 58 -9.520 -17.649 -14.014 480 H LEU 59 H LEU 59 -11.457 -15.996 -18.205 481 HA LEU 59 HA LEU 59 -14.277 -15.574 -18.033 482 HB2 LEU 59 2HB LEU 59 -11.947 -14.165 -19.088 483 HB3 LEU 59 3HB LEU 59 -13.401 -13.942 -20.059 484 HG LEU 59 HG LEU 59 -14.577 -13.007 -18.180 485 HD11 LEU 59 1HD1 LEU 59 -12.111 -13.742 -16.621 486 HD12 LEU 59 2HD1 LEU 59 -13.765 -14.293 -16.359 487 HD13 LEU 59 3HD1 LEU 59 -13.333 -12.614 -16.034 488 HD21 LEU 59 1HD2 LEU 59 -13.250 -11.452 -19.457 489 HD22 LEU 59 2HD2 LEU 59 -11.816 -11.838 -18.505 490 HD23 LEU 59 3HD2 LEU 59 -13.180 -11.011 -17.751 491 H SER 60 H SER 60 -12.439 -17.607 -19.917 492 HA SER 60 HA SER 60 -13.837 -17.386 -22.400 493 HB2 SER 60 2HB SER 60 -11.617 -18.316 -22.423 494 HB3 SER 60 3HB SER 60 -12.070 -19.560 -21.258 495 HG SER 60 HG SER 60 -12.160 -20.527 -23.226 496 H ASP 61 H ASP 61 -14.557 -18.799 -19.390 497 HA ASP 61 HA ASP 61 -16.862 -20.180 -20.585 498 HB2 ASP 61 2HB ASP 61 -14.869 -21.658 -19.700 499 HB3 ASP 61 3HB ASP 61 -15.579 -21.303 -18.127 500 H GLU 62 H GLU 62 -18.779 -19.998 -19.493 501 HA GLU 62 HA GLU 62 -19.113 -17.789 -17.776 502 HB2 GLU 62 2HB GLU 62 -21.439 -18.726 -17.462 503 HB3 GLU 62 3HB GLU 62 -20.959 -18.426 -19.126 504 HG2 GLU 62 2HG GLU 62 -20.567 -20.756 -19.501 505 HG3 GLU 62 3HG GLU 62 -20.821 -21.120 -17.795 506 H VAL 63 H VAL 63 -18.867 -21.254 -17.172 507 HA VAL 63 HA VAL 63 -19.578 -21.239 -14.456 508 HB VAL 63 HB VAL 63 -17.608 -23.112 -15.769 509 HG11 VAL 63 1HG1 VAL 63 -17.720 -24.389 -13.928 510 HG12 VAL 63 2HG1 VAL 63 -18.290 -22.918 -13.136 511 HG13 VAL 63 3HG1 VAL 63 -19.449 -24.111 -13.723 512 HG21 VAL 63 1HG2 VAL 63 -20.176 -24.273 -15.589 513 HG22 VAL 63 2HG2 VAL 63 -20.373 -22.692 -16.344 514 HG23 VAL 63 3HG2 VAL 63 -19.262 -23.870 -17.043 515 H LYS 64 H LYS 64 -16.340 -21.219 -15.950 516 HA LYS 64 HA LYS 64 -14.911 -20.930 -13.545 517 HB2 LYS 64 2HB LYS 64 -14.173 -20.162 -16.373 518 HB3 LYS 64 3HB LYS 64 -13.046 -20.152 -15.022 519 HG2 LYS 64 2HG LYS 64 -13.623 -22.604 -14.715 520 HG3 LYS 64 3HG LYS 64 -14.404 -22.506 -16.295 521 HD2 LYS 64 2HD LYS 64 -11.528 -21.763 -15.766 522 HD3 LYS 64 3HD LYS 64 -12.056 -23.333 -16.376 523 HE2 LYS 64 2HE LYS 64 -12.899 -20.833 -17.778 524 HE3 LYS 64 3HE LYS 64 -11.276 -21.472 -18.033 525 HZ1 LYS 64 1HZ LYS 64 -12.886 -22.275 -19.680 526 HZ2 LYS 64 2HZ LYS 64 -13.782 -23.010 -18.448 527 HZ3 LYS 64 3HZ LYS 64 -12.211 -23.540 -18.783 528 H ARG 65 H ARG 65 -16.006 -18.521 -15.916 529 HA ARG 65 HA ARG 65 -14.892 -16.258 -14.738 530 HB2 ARG 65 2HB ARG 65 -15.884 -16.218 -16.964 531 HB3 ARG 65 3HB ARG 65 -17.476 -16.521 -16.283 532 HG2 ARG 65 2HG ARG 65 -17.179 -14.347 -15.006 533 HG3 ARG 65 3HG ARG 65 -15.801 -14.043 -16.065 534 HD2 ARG 65 2HD ARG 65 -17.113 -13.769 -17.922 535 HD3 ARG 65 3HD ARG 65 -18.391 -14.815 -17.305 536 HE ARG 65 HE ARG 65 -18.197 -11.993 -16.995 537 HH11 ARG 65 1HH1 ARG 65 -19.286 -14.901 -15.422 538 HH12 ARG 65 2HH1 ARG 65 -20.496 -14.094 -14.480 539 HH21 ARG 65 1HH2 ARG 65 -19.785 -10.919 -15.760 540 HH22 ARG 65 2HH2 ARG 65 -20.779 -11.829 -14.673 541 H LYS 66 H LYS 66 -17.983 -17.860 -14.113 542 HA LYS 66 HA LYS 66 -18.958 -15.938 -12.275 543 HB2 LYS 66 2HB LYS 66 -19.644 -18.810 -12.842 544 HB3 LYS 66 3HB LYS 66 -20.411 -17.939 -11.521 545 HG2 LYS 66 2HG LYS 66 -20.454 -17.072 -14.404 546 HG3 LYS 66 3HG LYS 66 -21.750 -17.949 -13.588 547 HD2 LYS 66 2HD LYS 66 -21.924 -16.087 -11.962 548 HD3 LYS 66 3HD LYS 66 -20.710 -15.203 -12.890 549 HE2 LYS 66 2HE LYS 66 -22.965 -14.469 -13.463 550 HE3 LYS 66 3HE LYS 66 -22.175 -15.231 -14.842 551 HZ1 LYS 66 1HZ LYS 66 -23.801 -16.943 -13.128 552 HZ2 LYS 66 2HZ LYS 66 -23.590 -16.980 -14.805 553 HZ3 LYS 66 3HZ LYS 66 -24.626 -15.839 -14.109 554 H GLN 67 H GLN 67 -17.099 -18.918 -11.896 555 HA GLN 67 HA GLN 67 -17.172 -19.105 -9.110 556 HB2 GLN 67 2HB GLN 67 -15.171 -20.010 -11.164 557 HB3 GLN 67 3HB GLN 67 -14.904 -20.286 -9.448 558 HG2 GLN 67 2HG GLN 67 -17.262 -21.265 -11.042 559 HG3 GLN 67 3HG GLN 67 -15.879 -22.234 -10.534 560 HE21 GLN 67 1HE2 GLN 67 -18.820 -20.703 -9.560 561 HE22 GLN 67 2HE2 GLN 67 -18.910 -21.401 -7.983 562 H TYR 68 H TYR 68 -14.819 -17.476 -11.217 563 HA TYR 68 HA TYR 68 -13.150 -16.535 -9.156 564 HB2 TYR 68 2HB TYR 68 -12.473 -16.621 -11.527 565 HB3 TYR 68 3HB TYR 68 -13.619 -15.336 -11.895 566 HD1 TYR 68 HD1 TYR 68 -10.563 -16.107 -9.929 567 HD2 TYR 68 HD2 TYR 68 -13.009 -13.081 -11.651 568 HE1 TYR 68 HE1 TYR 68 -8.836 -14.431 -9.423 569 HE2 TYR 68 HE2 TYR 68 -11.287 -11.397 -11.152 570 HH TYR 68 HH TYR 68 -8.209 -12.310 -9.635 571 H ASP 69 H ASP 69 -16.087 -15.271 -10.582 572 HA ASP 69 HA ASP 69 -15.958 -12.645 -9.599 573 HB2 ASP 69 2HB ASP 69 -18.368 -14.379 -10.181 574 HB3 ASP 69 3HB ASP 69 -18.431 -12.643 -9.887 575 H ALA 70 H ALA 70 -16.952 -15.653 -8.107 576 HA ALA 70 HA ALA 70 -18.311 -14.647 -5.880 577 HB1 ALA 70 1HB ALA 70 -18.543 -16.809 -5.441 578 HB2 ALA 70 2HB ALA 70 -17.466 -17.163 -6.792 579 HB3 ALA 70 3HB ALA 70 -16.809 -16.982 -5.165 580 H TYR 71 H TYR 71 -14.896 -14.912 -6.564 581 HA TYR 71 HA TYR 71 -14.273 -13.945 -3.857 582 HB2 TYR 71 2HB TYR 71 -12.585 -15.361 -5.919 583 HB3 TYR 71 3HB TYR 71 -11.900 -14.603 -4.485 584 HD1 TYR 71 HD1 TYR 71 -12.479 -15.481 -2.232 585 HD2 TYR 71 HD2 TYR 71 -13.693 -17.466 -5.794 586 HE1 TYR 71 HE1 TYR 71 -12.923 -17.524 -0.936 587 HE2 TYR 71 HE2 TYR 71 -14.141 -19.514 -4.508 588 HH TYR 71 HH TYR 71 -13.455 -19.688 -1.034 589 H GLY 72 H GLY 72 -15.296 -12.320 -6.111 590 HA2 GLY 72 2HA GLY 72 -12.966 -10.584 -6.603 591 HA3 GLY 72 3HA GLY 72 -14.432 -10.606 -7.571 592 H SER 73 H SER 73 -13.023 -8.395 -6.172 593 HA SER 73 HA SER 73 -15.088 -7.584 -4.248 594 HB2 SER 73 2HB SER 73 -12.893 -7.404 -3.312 595 HB3 SER 73 3HB SER 73 -12.282 -6.575 -4.744 596 HG SER 73 HG SER 73 -12.754 -5.163 -2.962 Start of MODEL 19 1 H1 HIS 1 H HIS 1 -3.033 3.274 2.106 2 HA HIS 1 HA HIS 1 -4.264 3.399 -0.563 3 HB2 HIS 1 2HB HIS 1 -1.614 4.561 0.302 4 HB3 HIS 1 3HB HIS 1 -2.048 4.306 -1.385 5 HD1 HIS 1 HD1 HIS 1 -1.471 7.122 -0.638 6 HD2 HIS 1 HD2 HIS 1 -5.257 5.463 -0.216 7 HE1 HIS 1 HE1 HIS 1 -3.061 9.071 -0.623 8 H MET 2 H MET 2 -4.444 1.098 -0.412 9 HA MET 2 HA MET 2 -1.879 -0.336 -0.568 10 HB2 MET 2 2HB MET 2 -4.586 -1.088 0.429 11 HB3 MET 2 3HB MET 2 -3.588 -2.350 -0.281 12 HG2 MET 2 2HG MET 2 -2.974 -2.542 1.897 13 HG3 MET 2 3HG MET 2 -1.773 -1.376 1.347 14 HE1 MET 2 1HE MET 2 -2.868 -1.037 5.006 15 HE2 MET 2 2HE MET 2 -4.509 -1.495 4.552 16 HE3 MET 2 3HE MET 2 -3.136 -2.427 3.954 17 H LEU 3 H LEU 3 -2.275 -2.506 -1.906 18 HA LEU 3 HA LEU 3 -2.624 -1.670 -4.599 19 HB2 LEU 3 2HB LEU 3 -2.057 -4.257 -3.230 20 HB3 LEU 3 3HB LEU 3 -2.537 -4.274 -4.926 21 HG LEU 3 HG LEU 3 -0.572 -2.509 -5.124 22 HD11 LEU 3 1HD1 LEU 3 -0.319 -3.463 -2.442 23 HD12 LEU 3 2HD1 LEU 3 0.655 -2.267 -3.296 24 HD13 LEU 3 3HD1 LEU 3 1.081 -3.976 -3.384 25 HD21 LEU 3 1HD2 LEU 3 -0.937 -4.994 -5.983 26 HD22 LEU 3 2HD2 LEU 3 0.363 -5.310 -4.833 27 HD23 LEU 3 3HD2 LEU 3 0.609 -4.161 -6.149 28 H ALA 4 H ALA 4 -4.355 -1.746 -5.892 29 HA ALA 4 HA ALA 4 -6.917 -2.401 -4.788 30 HB1 ALA 4 1HB ALA 4 -7.630 -1.907 -7.231 31 HB2 ALA 4 2HB ALA 4 -7.014 -0.592 -6.229 32 HB3 ALA 4 3HB ALA 4 -5.966 -1.356 -7.424 33 H LYS 5 H LYS 5 -8.378 -3.984 -5.527 34 HA LYS 5 HA LYS 5 -7.098 -6.450 -6.334 35 HB2 LYS 5 2HB LYS 5 -9.816 -5.694 -5.331 36 HB3 LYS 5 3HB LYS 5 -9.592 -7.242 -6.134 37 HG2 LYS 5 2HG LYS 5 -7.799 -6.442 -3.882 38 HG3 LYS 5 3HG LYS 5 -9.404 -7.102 -3.561 39 HD2 LYS 5 2HD LYS 5 -7.519 -8.507 -5.418 40 HD3 LYS 5 3HD LYS 5 -7.378 -8.712 -3.671 41 HE2 LYS 5 2HE LYS 5 -10.041 -9.051 -4.973 42 HE3 LYS 5 3HE LYS 5 -8.851 -10.345 -5.098 43 HZ1 LYS 5 1HZ LYS 5 -9.231 -10.949 -3.011 44 HZ2 LYS 5 2HZ LYS 5 -10.568 -9.913 -3.013 45 HZ3 LYS 5 3HZ LYS 5 -9.077 -9.367 -2.429 46 H GLU 6 H GLU 6 -6.595 -6.452 -8.465 47 HA GLU 6 HA GLU 6 -8.369 -5.394 -10.461 48 HB2 GLU 6 2HB GLU 6 -5.711 -6.761 -10.478 49 HB3 GLU 6 3HB GLU 6 -6.634 -6.684 -11.972 50 HG2 GLU 6 2HG GLU 6 -6.480 -4.385 -12.108 51 HG3 GLU 6 3HG GLU 6 -6.159 -4.203 -10.384 52 H ASP 7 H ASP 7 -9.677 -6.481 -11.867 53 HA ASP 7 HA ASP 7 -10.048 -9.358 -11.341 54 HB2 ASP 7 2HB ASP 7 -12.159 -7.434 -12.331 55 HB3 ASP 7 3HB ASP 7 -12.393 -9.100 -11.809 56 H TYR 8 H TYR 8 -10.618 -10.701 -13.118 57 HA TYR 8 HA TYR 8 -9.115 -10.376 -15.407 58 HB2 TYR 8 2HB TYR 8 -11.662 -11.976 -15.087 59 HB3 TYR 8 3HB TYR 8 -10.498 -12.174 -16.392 60 HD1 TYR 8 HD1 TYR 8 -11.571 -13.999 -13.926 61 HD2 TYR 8 HD2 TYR 8 -7.945 -11.999 -14.907 62 HE1 TYR 8 HE1 TYR 8 -10.317 -15.612 -12.557 63 HE2 TYR 8 HE2 TYR 8 -6.682 -13.607 -13.541 64 HH TYR 8 HH TYR 8 -8.310 -16.016 -11.563 65 H TYR 9 H TYR 9 -12.410 -9.348 -14.761 66 HA TYR 9 HA TYR 9 -13.324 -8.771 -17.296 67 HB2 TYR 9 2HB TYR 9 -13.775 -7.164 -14.773 68 HB3 TYR 9 3HB TYR 9 -14.747 -7.053 -16.235 69 HD1 TYR 9 HD1 TYR 9 -14.101 -8.926 -13.201 70 HD2 TYR 9 HD2 TYR 9 -16.161 -8.979 -16.924 71 HE1 TYR 9 HE1 TYR 9 -15.542 -10.738 -12.371 72 HE2 TYR 9 HE2 TYR 9 -17.608 -10.791 -16.104 73 HH TYR 9 HH TYR 9 -17.040 -12.330 -12.991 74 H GLN 10 H GLN 10 -11.410 -6.672 -15.157 75 HA GLN 10 HA GLN 10 -11.231 -4.535 -17.021 76 HB2 GLN 10 2HB GLN 10 -9.441 -5.158 -14.666 77 HB3 GLN 10 3HB GLN 10 -9.540 -3.619 -15.510 78 HG2 GLN 10 2HG GLN 10 -11.995 -4.787 -14.288 79 HG3 GLN 10 3HG GLN 10 -10.807 -3.978 -13.268 80 HE21 GLN 10 1HE2 GLN 10 -13.560 -3.549 -15.003 81 HE22 GLN 10 2HE2 GLN 10 -13.478 -1.843 -15.262 82 H ILE 11 H ILE 11 -9.131 -7.256 -16.207 83 HA ILE 11 HA ILE 11 -6.891 -6.521 -17.706 84 HB ILE 11 HB ILE 11 -7.912 -9.308 -17.146 85 HG12 ILE 11 2HG1 ILE 11 -5.779 -7.779 -15.657 86 HG13 ILE 11 3HG1 ILE 11 -7.470 -7.758 -15.170 87 HG21 ILE 11 1HG2 ILE 11 -6.315 -9.435 -18.902 88 HG22 ILE 11 2HG2 ILE 11 -5.238 -8.302 -18.089 89 HG23 ILE 11 3HG2 ILE 11 -5.490 -9.913 -17.418 90 HD11 ILE 11 1HD1 ILE 11 -7.325 -9.761 -14.215 91 HD12 ILE 11 2HD1 ILE 11 -6.425 -10.443 -15.570 92 HD13 ILE 11 3HD1 ILE 11 -5.580 -9.535 -14.317 93 H LEU 12 H LEU 12 -9.901 -8.040 -18.658 94 HA LEU 12 HA LEU 12 -8.925 -8.456 -21.378 95 HB2 LEU 12 2HB LEU 12 -11.247 -9.393 -19.790 96 HB3 LEU 12 3HB LEU 12 -11.466 -9.243 -21.532 97 HG LEU 12 HG LEU 12 -9.191 -10.824 -20.378 98 HD11 LEU 12 1HD1 LEU 12 -10.578 -12.356 -19.580 99 HD12 LEU 12 2HD1 LEU 12 -11.226 -12.580 -21.204 100 HD13 LEU 12 3HD1 LEU 12 -11.975 -11.419 -20.109 101 HD21 LEU 12 1HD2 LEU 12 -10.404 -10.367 -23.020 102 HD22 LEU 12 2HD2 LEU 12 -9.975 -12.039 -22.660 103 HD23 LEU 12 3HD2 LEU 12 -8.745 -10.777 -22.585 104 H GLY 13 H GLY 13 -10.604 -6.139 -19.547 105 HA2 GLY 13 2HA GLY 13 -11.354 -4.051 -20.206 106 HA3 GLY 13 3HA GLY 13 -10.995 -4.486 -21.870 107 H VAL 14 H VAL 14 -12.992 -6.560 -19.935 108 HA VAL 14 HA VAL 14 -15.323 -5.721 -21.532 109 HB VAL 14 HB VAL 14 -16.210 -7.965 -21.272 110 HG11 VAL 14 1HG1 VAL 14 -13.362 -7.871 -22.251 111 HG12 VAL 14 2HG1 VAL 14 -14.458 -9.225 -22.532 112 HG13 VAL 14 3HG1 VAL 14 -14.832 -7.634 -23.196 113 HG21 VAL 14 1HG2 VAL 14 -13.756 -8.410 -19.589 114 HG22 VAL 14 2HG2 VAL 14 -15.446 -8.621 -19.131 115 HG23 VAL 14 3HG2 VAL 14 -14.698 -9.734 -20.276 116 HA PRO 15 HA PRO 15 -17.500 -4.583 -17.891 117 HB2 PRO 15 2HB PRO 15 -20.047 -5.181 -18.615 118 HB3 PRO 15 3HB PRO 15 -19.158 -3.805 -19.279 119 HG2 PRO 15 2HG PRO 15 -19.617 -6.515 -20.465 120 HG3 PRO 15 3HG PRO 15 -19.700 -4.924 -21.244 121 HD2 PRO 15 2HD PRO 15 -17.551 -6.553 -21.485 122 HD3 PRO 15 3HD PRO 15 -17.413 -4.783 -21.486 123 H ARG 16 H ARG 16 -19.238 -5.445 -16.347 124 HA ARG 16 HA ARG 16 -18.434 -8.078 -15.516 125 HB2 ARG 16 2HB ARG 16 -20.481 -6.176 -14.359 126 HB3 ARG 16 3HB ARG 16 -19.947 -7.669 -13.598 127 HG2 ARG 16 2HG ARG 16 -18.514 -6.327 -12.523 128 HG3 ARG 16 3HG ARG 16 -17.574 -6.441 -14.012 129 HD2 ARG 16 2HD ARG 16 -17.808 -4.121 -13.284 130 HD3 ARG 16 3HD ARG 16 -18.606 -4.391 -14.832 131 HE ARG 16 HE ARG 16 -20.489 -4.728 -12.787 132 HH11 ARG 16 1HH1 ARG 16 -18.575 -2.218 -14.255 133 HH12 ARG 16 2HH1 ARG 16 -19.712 -0.961 -13.897 134 HH21 ARG 16 1HH2 ARG 16 -21.994 -3.082 -12.310 135 HH22 ARG 16 2HH2 ARG 16 -21.657 -1.454 -12.790 136 H ASN 17 H ASN 17 -20.750 -6.915 -17.626 137 HA ASN 17 HA ASN 17 -22.442 -9.297 -17.246 138 HB2 ASN 17 2HB ASN 17 -24.194 -7.979 -18.493 139 HB3 ASN 17 3HB ASN 17 -23.777 -7.341 -16.906 140 HD21 ASN 17 1HD2 ASN 17 -24.408 -6.498 -19.987 141 HD22 ASN 17 2HD2 ASN 17 -23.563 -4.993 -20.068 142 H ALA 18 H ALA 18 -19.943 -8.368 -19.000 143 HA ALA 18 HA ALA 18 -20.652 -8.612 -21.687 144 HB1 ALA 18 1HB ALA 18 -18.082 -9.808 -21.188 145 HB2 ALA 18 2HB ALA 18 -18.475 -8.285 -21.986 146 HB3 ALA 18 3HB ALA 18 -18.282 -8.339 -20.233 147 H SER 19 H SER 19 -20.197 -10.423 -23.153 148 HA SER 19 HA SER 19 -20.982 -12.975 -21.918 149 HB2 SER 19 2HB SER 19 -21.193 -12.451 -24.863 150 HB3 SER 19 3HB SER 19 -22.165 -13.516 -23.847 151 HG SER 19 HG SER 19 -23.249 -11.564 -24.503 152 H GLN 20 H GLN 20 -20.239 -14.925 -23.280 153 HA GLN 20 HA GLN 20 -17.424 -15.028 -23.188 154 HB2 GLN 20 2HB GLN 20 -19.166 -16.964 -24.704 155 HB3 GLN 20 3HB GLN 20 -17.619 -17.276 -23.929 156 HG2 GLN 20 2HG GLN 20 -20.276 -16.793 -22.616 157 HG3 GLN 20 3HG GLN 20 -19.294 -18.256 -22.578 158 HE21 GLN 20 1HE2 GLN 20 -17.157 -18.048 -21.539 159 HE22 GLN 20 2HE2 GLN 20 -17.020 -17.019 -20.158 160 H LYS 21 H LYS 21 -19.656 -14.216 -25.709 161 HA LYS 21 HA LYS 21 -17.808 -14.589 -27.874 162 HB2 LYS 21 2HB LYS 21 -20.419 -13.070 -27.748 163 HB3 LYS 21 3HB LYS 21 -19.520 -13.411 -29.220 164 HG2 LYS 21 2HG LYS 21 -19.783 -15.844 -28.725 165 HG3 LYS 21 3HG LYS 21 -20.853 -15.396 -27.395 166 HD2 LYS 21 2HD LYS 21 -22.369 -15.764 -29.089 167 HD3 LYS 21 3HD LYS 21 -22.095 -14.027 -29.247 168 HE2 LYS 21 2HE LYS 21 -21.893 -14.728 -31.432 169 HE3 LYS 21 3HE LYS 21 -20.214 -14.758 -30.896 170 HZ1 LYS 21 1HZ LYS 21 -20.161 -16.868 -31.519 171 HZ2 LYS 21 2HZ LYS 21 -21.822 -16.892 -31.836 172 HZ3 LYS 21 3HZ LYS 21 -21.253 -17.238 -30.281 173 H GLU 22 H GLU 22 -18.960 -11.846 -25.963 174 HA GLU 22 HA GLU 22 -17.608 -9.846 -27.437 175 HB2 GLU 22 2HB GLU 22 -19.442 -9.250 -25.984 176 HB3 GLU 22 3HB GLU 22 -18.594 -9.888 -24.583 177 HG2 GLU 22 2HG GLU 22 -17.175 -8.097 -24.447 178 HG3 GLU 22 3HG GLU 22 -17.322 -7.711 -26.161 179 H ILE 23 H ILE 23 -16.623 -12.022 -24.910 180 HA ILE 23 HA ILE 23 -14.262 -10.614 -24.151 181 HB ILE 23 HB ILE 23 -14.977 -13.527 -23.798 182 HG12 ILE 23 2HG1 ILE 23 -14.971 -11.498 -21.601 183 HG13 ILE 23 3HG1 ILE 23 -16.339 -11.544 -22.708 184 HG21 ILE 23 1HG2 ILE 23 -12.878 -13.823 -23.136 185 HG22 ILE 23 2HG2 ILE 23 -12.526 -12.106 -23.324 186 HG23 ILE 23 3HG2 ILE 23 -13.191 -12.707 -21.806 187 HD11 ILE 23 1HD1 ILE 23 -17.184 -13.050 -21.308 188 HD12 ILE 23 2HD1 ILE 23 -16.035 -14.176 -22.031 189 HD13 ILE 23 3HD1 ILE 23 -15.626 -13.338 -20.535 190 H LYS 24 H LYS 24 -15.021 -13.068 -26.540 191 HA LYS 24 HA LYS 24 -12.418 -13.871 -27.193 192 HB2 LYS 24 2HB LYS 24 -15.020 -13.845 -28.683 193 HB3 LYS 24 3HB LYS 24 -13.539 -14.309 -29.509 194 HG2 LYS 24 2HG LYS 24 -13.186 -16.114 -27.943 195 HG3 LYS 24 3HG LYS 24 -14.601 -15.616 -27.012 196 HD2 LYS 24 2HD LYS 24 -15.284 -17.441 -28.368 197 HD3 LYS 24 3HD LYS 24 -15.964 -15.985 -29.100 198 HE2 LYS 24 2HE LYS 24 -14.338 -15.982 -30.819 199 HE3 LYS 24 3HE LYS 24 -13.351 -17.182 -29.988 200 HZ1 LYS 24 1HZ LYS 24 -14.389 -18.501 -31.498 201 HZ2 LYS 24 2HZ LYS 24 -15.785 -17.548 -31.567 202 HZ3 LYS 24 3HZ LYS 24 -15.537 -18.591 -30.258 203 H LYS 25 H LYS 25 -14.397 -11.201 -28.394 204 HA LYS 25 HA LYS 25 -12.490 -10.361 -30.352 205 HB2 LYS 25 2HB LYS 25 -14.889 -8.981 -29.141 206 HB3 LYS 25 3HB LYS 25 -13.916 -8.288 -30.432 207 HG2 LYS 25 2HG LYS 25 -14.716 -9.731 -32.003 208 HG3 LYS 25 3HG LYS 25 -15.017 -11.016 -30.830 209 HD2 LYS 25 2HD LYS 25 -17.139 -10.223 -31.553 210 HD3 LYS 25 3HD LYS 25 -16.888 -9.602 -29.920 211 HE2 LYS 25 2HE LYS 25 -17.748 -7.795 -31.165 212 HE3 LYS 25 3HE LYS 25 -16.020 -7.486 -31.009 213 HZ1 LYS 25 1HZ LYS 25 -16.939 -7.108 -33.271 214 HZ2 LYS 25 2HZ LYS 25 -17.251 -8.766 -33.385 215 HZ3 LYS 25 3HZ LYS 25 -15.659 -8.214 -33.228 216 H ALA 26 H ALA 26 -13.428 -9.164 -27.138 217 HA ALA 26 HA ALA 26 -11.644 -7.002 -27.036 218 HB1 ALA 26 1HB ALA 26 -12.126 -6.871 -24.732 219 HB2 ALA 26 2HB ALA 26 -13.597 -7.479 -25.494 220 HB3 ALA 26 3HB ALA 26 -12.525 -8.587 -24.638 221 H TYR 27 H TYR 27 -11.199 -10.412 -26.428 222 HA TYR 27 HA TYR 27 -8.698 -10.172 -25.079 223 HB2 TYR 27 2HB TYR 27 -9.958 -12.172 -24.729 224 HB3 TYR 27 3HB TYR 27 -10.063 -12.486 -26.457 225 HD1 TYR 27 HD1 TYR 27 -7.268 -11.769 -24.071 226 HD2 TYR 27 HD2 TYR 27 -8.836 -14.325 -27.089 227 HE1 TYR 27 HE1 TYR 27 -5.245 -13.161 -23.935 228 HE2 TYR 27 HE2 TYR 27 -6.818 -15.725 -26.961 229 HH TYR 27 HH TYR 27 -4.020 -14.801 -25.666 230 H TYR 28 H TYR 28 -9.683 -10.524 -28.427 231 HA TYR 28 HA TYR 28 -7.055 -11.037 -29.430 232 HB2 TYR 28 2HB TYR 28 -8.995 -11.783 -30.685 233 HB3 TYR 28 3HB TYR 28 -9.579 -10.129 -30.828 234 HD1 TYR 28 HD1 TYR 28 -9.340 -9.239 -32.933 235 HD2 TYR 28 HD2 TYR 28 -6.356 -11.913 -31.503 236 HE1 TYR 28 HE1 TYR 28 -8.106 -8.981 -35.045 237 HE2 TYR 28 HE2 TYR 28 -5.113 -11.663 -33.610 238 HH TYR 28 HH TYR 28 -4.901 -10.112 -35.450 239 H GLN 29 H GLN 29 -9.167 -8.178 -29.375 240 HA GLN 29 HA GLN 29 -7.428 -6.420 -30.681 241 HB2 GLN 29 2HB GLN 29 -8.824 -4.670 -29.921 242 HB3 GLN 29 3HB GLN 29 -9.880 -6.062 -30.123 243 HG2 GLN 29 2HG GLN 29 -9.858 -6.470 -27.742 244 HG3 GLN 29 3HG GLN 29 -8.715 -5.149 -27.503 245 HE21 GLN 29 1HE2 GLN 29 -11.881 -5.758 -28.986 246 HE22 GLN 29 2HE2 GLN 29 -12.607 -4.285 -28.448 247 H LEU 30 H LEU 30 -7.616 -7.423 -27.326 248 HA LEU 30 HA LEU 30 -5.813 -5.447 -26.333 249 HB2 LEU 30 2HB LEU 30 -7.354 -7.649 -25.287 250 HB3 LEU 30 3HB LEU 30 -5.724 -7.648 -24.615 251 HG LEU 30 HG LEU 30 -6.030 -5.470 -23.687 252 HD11 LEU 30 1HD1 LEU 30 -7.210 -4.096 -25.033 253 HD12 LEU 30 2HD1 LEU 30 -8.549 -4.600 -24.002 254 HD13 LEU 30 3HD1 LEU 30 -8.302 -5.374 -25.567 255 HD21 LEU 30 1HD2 LEU 30 -7.934 -5.851 -22.181 256 HD22 LEU 30 2HD2 LEU 30 -6.938 -7.294 -22.372 257 HD23 LEU 30 3HD2 LEU 30 -8.480 -7.167 -23.221 258 H ALA 31 H ALA 31 -5.486 -8.814 -27.364 259 HA ALA 31 HA ALA 31 -2.836 -9.245 -26.617 260 HB1 ALA 31 1HB ALA 31 -3.036 -10.722 -28.885 261 HB2 ALA 31 2HB ALA 31 -3.652 -11.219 -27.309 262 HB3 ALA 31 3HB ALA 31 -4.736 -10.476 -28.485 263 H LYS 32 H LYS 32 -4.166 -7.848 -29.589 264 HA LYS 32 HA LYS 32 -1.793 -7.618 -31.039 265 HB2 LYS 32 2HB LYS 32 -4.310 -5.957 -31.049 266 HB3 LYS 32 3HB LYS 32 -2.990 -5.681 -32.178 267 HG2 LYS 32 2HG LYS 32 -3.449 -7.537 -33.387 268 HG3 LYS 32 3HG LYS 32 -4.020 -8.445 -31.985 269 HD2 LYS 32 2HD LYS 32 -5.852 -7.977 -33.525 270 HD3 LYS 32 3HD LYS 32 -6.094 -7.142 -31.989 271 HE2 LYS 32 2HE LYS 32 -5.444 -5.060 -32.920 272 HE3 LYS 32 3HE LYS 32 -4.832 -5.828 -34.384 273 HZ1 LYS 32 1HZ LYS 32 -7.681 -6.011 -33.621 274 HZ2 LYS 32 2HZ LYS 32 -6.979 -6.264 -35.138 275 HZ3 LYS 32 3HZ LYS 32 -7.088 -4.698 -34.508 276 H LYS 33 H LYS 33 -2.916 -5.862 -28.301 277 HA LYS 33 HA LYS 33 -1.303 -3.528 -28.702 278 HB2 LYS 33 2HB LYS 33 -2.396 -4.480 -26.061 279 HB3 LYS 33 3HB LYS 33 -2.041 -2.831 -26.559 280 HG2 LYS 33 2HG LYS 33 -3.875 -3.058 -28.259 281 HG3 LYS 33 3HG LYS 33 -4.300 -4.585 -27.484 282 HD2 LYS 33 2HD LYS 33 -5.115 -3.565 -25.612 283 HD3 LYS 33 3HD LYS 33 -4.011 -2.194 -25.747 284 HE2 LYS 33 2HE LYS 33 -5.330 -1.362 -27.659 285 HE3 LYS 33 3HE LYS 33 -6.454 -2.703 -27.443 286 HZ1 LYS 33 1HZ LYS 33 -7.552 -1.395 -26.050 287 HZ2 LYS 33 2HZ LYS 33 -6.333 -0.223 -26.060 288 HZ3 LYS 33 3HZ LYS 33 -6.252 -1.516 -24.973 289 H TYR 34 H TYR 34 -0.935 -6.585 -27.010 290 HA TYR 34 HA TYR 34 1.806 -5.794 -26.272 291 HB2 TYR 34 2HB TYR 34 0.115 -7.960 -25.010 292 HB3 TYR 34 3HB TYR 34 1.699 -7.416 -24.470 293 HD1 TYR 34 HD1 TYR 34 1.949 -5.391 -23.195 294 HD2 TYR 34 HD2 TYR 34 -1.869 -6.550 -24.673 295 HE1 TYR 34 HE1 TYR 34 0.883 -3.729 -21.728 296 HE2 TYR 34 HE2 TYR 34 -2.945 -4.891 -23.211 297 HH TYR 34 HH TYR 34 -1.731 -3.620 -20.665 298 H HIS 35 H HIS 35 0.803 -6.912 -28.838 299 HA HIS 35 HA HIS 35 1.395 -9.606 -29.160 300 HB2 HIS 35 2HB HIS 35 1.047 -7.294 -30.885 301 HB3 HIS 35 3HB HIS 35 2.261 -8.400 -31.520 302 HD1 HIS 35 HD1 HIS 35 -0.696 -9.691 -29.620 303 HD2 HIS 35 HD2 HIS 35 0.585 -9.314 -33.554 304 HE1 HIS 35 HE1 HIS 35 -2.294 -11.075 -30.983 305 HA PRO 36 HA PRO 36 5.745 -10.072 -28.858 306 HB2 PRO 36 2HB PRO 36 6.285 -11.824 -30.861 307 HB3 PRO 36 3HB PRO 36 5.448 -12.291 -29.376 308 HG2 PRO 36 2HG PRO 36 4.311 -11.646 -32.069 309 HG3 PRO 36 3HG PRO 36 3.874 -12.954 -30.954 310 HD2 PRO 36 2HD PRO 36 2.419 -10.681 -31.174 311 HD3 PRO 36 3HD PRO 36 2.569 -11.575 -29.647 312 H ASP 37 H ASP 37 4.403 -9.039 -31.902 313 HA ASP 37 HA ASP 37 6.775 -8.516 -33.311 314 HB2 ASP 37 2HB ASP 37 4.283 -8.477 -34.093 315 HB3 ASP 37 3HB ASP 37 4.344 -6.783 -33.612 316 H THR 38 H THR 38 5.300 -6.901 -30.662 317 HA THR 38 HA THR 38 7.067 -4.575 -31.036 318 HB THR 38 HB THR 38 5.609 -3.273 -29.691 319 HG1 THR 38 HG1 THR 38 4.754 -5.756 -28.804 320 HG21 THR 38 1HG2 THR 38 3.969 -3.043 -31.212 321 HG22 THR 38 2HG2 THR 38 3.420 -4.707 -31.012 322 HG23 THR 38 3HG2 THR 38 4.787 -4.349 -32.067 323 H ASN 39 H ASN 39 7.162 -7.430 -29.579 324 HA ASN 39 HA ASN 39 7.991 -6.590 -26.931 325 HB2 ASN 39 2HB ASN 39 7.510 -9.188 -28.299 326 HB3 ASN 39 3HB ASN 39 8.654 -9.183 -26.960 327 HD21 ASN 39 1HD2 ASN 39 5.698 -7.308 -27.451 328 HD22 ASN 39 2HD2 ASN 39 4.887 -7.889 -26.040 329 H LYS 40 H LYS 40 9.409 -6.689 -29.928 330 HA LYS 40 HA LYS 40 11.939 -7.761 -29.529 331 HB2 LYS 40 2HB LYS 40 10.679 -5.942 -31.422 332 HB3 LYS 40 3HB LYS 40 12.371 -5.546 -31.152 333 HG2 LYS 40 2HG LYS 40 12.593 -7.022 -32.863 334 HG3 LYS 40 3HG LYS 40 12.673 -8.144 -31.503 335 HD2 LYS 40 2HD LYS 40 9.983 -7.528 -32.578 336 HD3 LYS 40 3HD LYS 40 11.044 -8.506 -33.594 337 HE2 LYS 40 2HE LYS 40 10.977 -9.307 -30.774 338 HE3 LYS 40 3HE LYS 40 9.437 -9.474 -31.615 339 HZ1 LYS 40 1HZ LYS 40 11.878 -10.492 -32.892 340 HZ2 LYS 40 2HZ LYS 40 10.281 -11.029 -33.047 341 HZ3 LYS 40 3HZ LYS 40 11.165 -11.396 -31.652 342 H ASP 41 H ASP 41 10.701 -4.547 -28.747 343 HA ASP 41 HA ASP 41 13.199 -4.027 -27.269 344 HB2 ASP 41 2HB ASP 41 11.443 -2.206 -28.881 345 HB3 ASP 41 3HB ASP 41 12.399 -1.553 -27.553 346 H ASP 42 H ASP 42 10.427 -5.222 -26.598 347 HA ASP 42 HA ASP 42 10.112 -3.702 -24.109 348 HB2 ASP 42 2HB ASP 42 8.320 -3.310 -26.047 349 HB3 ASP 42 3HB ASP 42 7.641 -4.786 -25.367 350 HA PRO 43 HA PRO 43 10.578 -8.210 -23.274 351 HB2 PRO 43 2HB PRO 43 12.123 -7.859 -21.069 352 HB3 PRO 43 3HB PRO 43 12.783 -7.896 -22.708 353 HG2 PRO 43 2HG PRO 43 12.139 -5.539 -20.978 354 HG3 PRO 43 3HG PRO 43 13.557 -5.818 -22.007 355 HD2 PRO 43 2HD PRO 43 11.489 -4.246 -22.771 356 HD3 PRO 43 3HD PRO 43 12.442 -5.199 -23.927 357 H LYS 44 H LYS 44 9.179 -5.544 -21.733 358 HA LYS 44 HA LYS 44 8.227 -7.072 -19.437 359 HB2 LYS 44 2HB LYS 44 8.445 -4.222 -20.138 360 HB3 LYS 44 3HB LYS 44 6.975 -4.649 -19.271 361 HG2 LYS 44 2HG LYS 44 9.780 -5.241 -18.349 362 HG3 LYS 44 3HG LYS 44 8.761 -3.924 -17.766 363 HD2 LYS 44 2HD LYS 44 7.070 -5.728 -17.145 364 HD3 LYS 44 3HD LYS 44 8.377 -6.885 -17.409 365 HE2 LYS 44 2HE LYS 44 9.718 -5.825 -15.710 366 HE3 LYS 44 3HE LYS 44 8.526 -4.541 -15.518 367 HZ1 LYS 44 1HZ LYS 44 7.652 -5.793 -13.925 368 HZ2 LYS 44 2HZ LYS 44 8.590 -7.138 -14.341 369 HZ3 LYS 44 3HZ LYS 44 7.120 -6.855 -15.130 370 H ALA 45 H ALA 45 7.197 -6.038 -22.554 371 HA ALA 45 HA ALA 45 4.418 -5.987 -22.216 372 HB1 ALA 45 1HB ALA 45 5.267 -5.118 -24.229 373 HB2 ALA 45 2HB ALA 45 6.147 -6.603 -24.594 374 HB3 ALA 45 3HB ALA 45 4.386 -6.576 -24.688 375 H LYS 46 H LYS 46 6.626 -8.663 -22.886 376 HA LYS 46 HA LYS 46 4.760 -10.660 -23.418 377 HB2 LYS 46 2HB LYS 46 6.490 -12.231 -22.964 378 HB3 LYS 46 3HB LYS 46 7.265 -10.814 -23.661 379 HG2 LYS 46 2HG LYS 46 7.827 -10.073 -21.348 380 HG3 LYS 46 3HG LYS 46 7.205 -11.618 -20.762 381 HD2 LYS 46 2HD LYS 46 9.593 -11.781 -20.980 382 HD3 LYS 46 3HD LYS 46 8.845 -12.770 -22.236 383 HE2 LYS 46 2HE LYS 46 9.555 -11.413 -23.917 384 HE3 LYS 46 3HE LYS 46 9.470 -9.958 -22.926 385 HZ1 LYS 46 1HZ LYS 46 11.756 -10.606 -23.514 386 HZ2 LYS 46 2HZ LYS 46 11.558 -12.052 -22.658 387 HZ3 LYS 46 3HZ LYS 46 11.502 -10.571 -21.841 388 H GLU 47 H GLU 47 5.807 -9.277 -20.380 389 HA GLU 47 HA GLU 47 4.636 -11.291 -18.725 390 HB2 GLU 47 2HB GLU 47 5.703 -8.526 -18.221 391 HB3 GLU 47 3HB GLU 47 4.885 -9.426 -16.952 392 HG2 GLU 47 2HG GLU 47 7.110 -10.736 -18.425 393 HG3 GLU 47 3HG GLU 47 7.490 -9.507 -17.220 394 H LYS 48 H LYS 48 3.636 -8.071 -19.812 395 HA LYS 48 HA LYS 48 1.198 -8.032 -18.358 396 HB2 LYS 48 2HB LYS 48 1.784 -6.512 -20.898 397 HB3 LYS 48 3HB LYS 48 0.655 -6.075 -19.622 398 HG2 LYS 48 2HG LYS 48 3.659 -6.128 -19.411 399 HG3 LYS 48 3HG LYS 48 2.633 -4.695 -19.505 400 HD2 LYS 48 2HD LYS 48 1.541 -5.408 -17.389 401 HD3 LYS 48 3HD LYS 48 2.700 -6.735 -17.282 402 HE2 LYS 48 2HE LYS 48 3.638 -5.084 -15.937 403 HE3 LYS 48 3HE LYS 48 4.494 -4.902 -17.467 404 HZ1 LYS 48 1HZ LYS 48 3.775 -2.829 -17.626 405 HZ2 LYS 48 2HZ LYS 48 3.077 -2.962 -16.091 406 HZ3 LYS 48 3HZ LYS 48 2.161 -3.310 -17.470 407 H PHE 49 H PHE 49 2.116 -9.184 -21.540 408 HA PHE 49 HA PHE 49 -0.492 -9.525 -22.574 409 HB2 PHE 49 2HB PHE 49 1.343 -9.508 -24.107 410 HB3 PHE 49 3HB PHE 49 2.143 -10.829 -23.261 411 HD1 PHE 49 HD1 PHE 49 -0.474 -9.918 -25.627 412 HD2 PHE 49 HD2 PHE 49 1.377 -13.118 -23.517 413 HE1 PHE 49 HE1 PHE 49 -1.562 -11.533 -27.130 414 HE2 PHE 49 HE2 PHE 49 0.293 -14.739 -25.019 415 HZ PHE 49 HZ PHE 49 -1.179 -13.947 -26.827 416 H SER 50 H SER 50 1.564 -11.508 -20.554 417 HA SER 50 HA SER 50 0.270 -13.967 -20.818 418 HB2 SER 50 2HB SER 50 2.432 -13.668 -19.658 419 HB3 SER 50 3HB SER 50 1.602 -12.835 -18.344 420 HG SER 50 HG SER 50 0.387 -14.793 -18.042 421 H GLN 51 H GLN 51 -0.501 -11.162 -18.848 422 HA GLN 51 HA GLN 51 -2.462 -12.371 -17.222 423 HB2 GLN 51 2HB GLN 51 -2.030 -9.507 -18.066 424 HB3 GLN 51 3HB GLN 51 -3.282 -9.990 -16.930 425 HG2 GLN 51 2HG GLN 51 -1.257 -11.131 -15.699 426 HG3 GLN 51 3HG GLN 51 -0.332 -9.925 -16.593 427 HE21 GLN 51 1HE2 GLN 51 -3.345 -10.098 -14.719 428 HE22 GLN 51 2HE2 GLN 51 -3.070 -8.647 -13.823 429 H LEU 52 H LEU 52 -2.518 -11.173 -20.479 430 HA LEU 52 HA LEU 52 -5.311 -10.833 -20.754 431 HB2 LEU 52 2HB LEU 52 -3.273 -11.536 -22.861 432 HB3 LEU 52 3HB LEU 52 -4.894 -10.909 -23.155 433 HG LEU 52 HG LEU 52 -2.781 -9.371 -21.659 434 HD11 LEU 52 1HD1 LEU 52 -2.397 -10.057 -24.194 435 HD12 LEU 52 2HD1 LEU 52 -1.972 -8.462 -23.576 436 HD13 LEU 52 3HD1 LEU 52 -3.482 -8.692 -24.457 437 HD21 LEU 52 1HD2 LEU 52 -4.573 -7.676 -22.947 438 HD22 LEU 52 2HD2 LEU 52 -4.504 -8.036 -21.222 439 HD23 LEU 52 3HD2 LEU 52 -5.572 -8.965 -22.276 440 H ALA 53 H ALA 53 -3.180 -13.529 -21.699 441 HA ALA 53 HA ALA 53 -5.275 -15.233 -22.538 442 HB1 ALA 53 1HB ALA 53 -3.634 -16.644 -23.127 443 HB2 ALA 53 2HB ALA 53 -2.565 -15.293 -22.745 444 HB3 ALA 53 3HB ALA 53 -2.853 -16.554 -21.547 445 H GLU 54 H GLU 54 -3.631 -14.781 -19.453 446 HA GLU 54 HA GLU 54 -4.696 -17.030 -18.132 447 HB2 GLU 54 2HB GLU 54 -3.154 -14.681 -17.434 448 HB3 GLU 54 3HB GLU 54 -4.346 -15.041 -16.193 449 HG2 GLU 54 2HG GLU 54 -3.474 -17.411 -16.224 450 HG3 GLU 54 3HG GLU 54 -2.143 -16.807 -17.209 451 H ALA 55 H ALA 55 -5.783 -13.648 -18.249 452 HA ALA 55 HA ALA 55 -8.082 -14.089 -16.627 453 HB1 ALA 55 1HB ALA 55 -6.870 -11.883 -17.071 454 HB2 ALA 55 2HB ALA 55 -7.784 -11.828 -18.579 455 HB3 ALA 55 3HB ALA 55 -8.633 -11.851 -17.033 456 H TYR 56 H TYR 56 -7.449 -14.175 -20.077 457 HA TYR 56 HA TYR 56 -10.182 -14.261 -20.881 458 HB2 TYR 56 2HB TYR 56 -8.661 -13.540 -22.534 459 HB3 TYR 56 3HB TYR 56 -7.583 -14.904 -22.260 460 HD1 TYR 56 HD1 TYR 56 -10.703 -13.807 -23.851 461 HD2 TYR 56 HD2 TYR 56 -8.016 -17.055 -23.273 462 HE1 TYR 56 HE1 TYR 56 -11.791 -15.027 -25.688 463 HE2 TYR 56 HE2 TYR 56 -9.097 -18.283 -25.110 464 HH TYR 56 HH TYR 56 -11.954 -17.770 -26.234 465 H GLU 57 H GLU 57 -7.883 -16.618 -19.795 466 HA GLU 57 HA GLU 57 -8.975 -18.953 -20.869 467 HB2 GLU 57 2HB GLU 57 -7.265 -18.295 -18.535 468 HB3 GLU 57 3HB GLU 57 -8.054 -19.866 -18.518 469 HG2 GLU 57 2HG GLU 57 -6.862 -20.643 -20.307 470 HG3 GLU 57 3HG GLU 57 -6.598 -19.031 -20.971 471 H VAL 58 H VAL 58 -9.656 -17.368 -17.757 472 HA VAL 58 HA VAL 58 -11.726 -19.216 -17.060 473 HB VAL 58 HB VAL 58 -11.254 -16.475 -15.887 474 HG11 VAL 58 1HG1 VAL 58 -13.400 -17.842 -15.431 475 HG12 VAL 58 2HG1 VAL 58 -12.347 -18.864 -14.451 476 HG13 VAL 58 3HG1 VAL 58 -12.524 -17.151 -14.066 477 HG21 VAL 58 1HG2 VAL 58 -9.184 -17.758 -15.832 478 HG22 VAL 58 2HG2 VAL 58 -9.860 -17.597 -14.211 479 HG23 VAL 58 3HG2 VAL 58 -10.030 -19.116 -15.091 480 H LEU 59 H LEU 59 -11.647 -15.917 -18.349 481 HA LEU 59 HA LEU 59 -14.456 -15.538 -18.344 482 HB2 LEU 59 2HB LEU 59 -12.114 -14.174 -19.553 483 HB3 LEU 59 3HB LEU 59 -13.703 -13.827 -20.232 484 HG LEU 59 HG LEU 59 -12.933 -12.182 -18.533 485 HD11 LEU 59 1HD1 LEU 59 -15.072 -12.318 -17.160 486 HD12 LEU 59 2HD1 LEU 59 -15.438 -13.775 -18.083 487 HD13 LEU 59 3HD1 LEU 59 -15.247 -12.230 -18.913 488 HD21 LEU 59 1HD2 LEU 59 -11.731 -13.611 -17.027 489 HD22 LEU 59 2HD2 LEU 59 -13.182 -14.558 -16.693 490 HD23 LEU 59 3HD2 LEU 59 -13.077 -12.882 -16.151 491 H SER 60 H SER 60 -12.466 -17.477 -20.239 492 HA SER 60 HA SER 60 -13.877 -17.299 -22.718 493 HB2 SER 60 2HB SER 60 -11.633 -18.085 -22.831 494 HB3 SER 60 3HB SER 60 -11.925 -19.312 -21.598 495 HG SER 60 HG SER 60 -12.604 -20.603 -23.101 496 H ASP 61 H ASP 61 -14.596 -18.703 -19.740 497 HA ASP 61 HA ASP 61 -16.788 -20.224 -20.958 498 HB2 ASP 61 2HB ASP 61 -14.651 -21.569 -20.057 499 HB3 ASP 61 3HB ASP 61 -15.528 -21.404 -18.538 500 H GLU 62 H GLU 62 -18.707 -20.056 -19.917 501 HA GLU 62 HA GLU 62 -19.089 -17.983 -18.054 502 HB2 GLU 62 2HB GLU 62 -21.407 -18.885 -17.865 503 HB3 GLU 62 3HB GLU 62 -20.884 -18.613 -19.521 504 HG2 GLU 62 2HG GLU 62 -20.401 -21.006 -19.749 505 HG3 GLU 62 3HG GLU 62 -20.971 -21.266 -18.102 506 H VAL 63 H VAL 63 -18.867 -21.487 -17.675 507 HA VAL 63 HA VAL 63 -19.571 -21.612 -14.953 508 HB VAL 63 HB VAL 63 -17.675 -23.477 -16.380 509 HG11 VAL 63 1HG1 VAL 63 -19.473 -23.813 -13.984 510 HG12 VAL 63 2HG1 VAL 63 -18.627 -25.137 -14.788 511 HG13 VAL 63 3HG1 VAL 63 -17.710 -23.847 -14.009 512 HG21 VAL 63 1HG2 VAL 63 -19.346 -24.048 -17.728 513 HG22 VAL 63 2HG2 VAL 63 -20.261 -24.573 -16.315 514 HG23 VAL 63 3HG2 VAL 63 -20.437 -22.924 -16.916 515 H LYS 64 H LYS 64 -16.377 -21.486 -16.519 516 HA LYS 64 HA LYS 64 -14.871 -21.473 -14.140 517 HB2 LYS 64 2HB LYS 64 -14.278 -20.552 -16.945 518 HB3 LYS 64 3HB LYS 64 -13.092 -20.411 -15.654 519 HG2 LYS 64 2HG LYS 64 -13.697 -22.980 -15.347 520 HG3 LYS 64 3HG LYS 64 -14.098 -22.815 -17.059 521 HD2 LYS 64 2HD LYS 64 -11.822 -23.493 -16.941 522 HD3 LYS 64 3HD LYS 64 -11.825 -21.783 -17.381 523 HE2 LYS 64 2HE LYS 64 -10.261 -21.701 -15.738 524 HE3 LYS 64 3HE LYS 64 -11.699 -21.518 -14.734 525 HZ1 LYS 64 1HZ LYS 64 -10.013 -23.216 -13.987 526 HZ2 LYS 64 2HZ LYS 64 -10.495 -24.161 -15.304 527 HZ3 LYS 64 3HZ LYS 64 -11.611 -23.761 -14.098 528 H ARG 65 H ARG 65 -16.098 -18.837 -16.168 529 HA ARG 65 HA ARG 65 -14.909 -16.729 -14.726 530 HB2 ARG 65 2HB ARG 65 -15.822 -16.450 -16.987 531 HB3 ARG 65 3HB ARG 65 -17.446 -16.727 -16.371 532 HG2 ARG 65 2HG ARG 65 -16.817 -14.696 -14.806 533 HG3 ARG 65 3HG ARG 65 -15.701 -14.341 -16.126 534 HD2 ARG 65 2HD ARG 65 -17.353 -13.720 -17.513 535 HD3 ARG 65 3HD ARG 65 -18.408 -15.035 -16.996 536 HE ARG 65 HE ARG 65 -18.133 -12.921 -15.062 537 HH11 ARG 65 1HH1 ARG 65 -19.887 -14.064 -17.843 538 HH12 ARG 65 2HH1 ARG 65 -21.306 -13.133 -17.493 539 HH21 ARG 65 1HH2 ARG 65 -19.994 -11.690 -14.591 540 HH22 ARG 65 2HH2 ARG 65 -21.365 -11.782 -15.644 541 H LYS 66 H LYS 66 -18.037 -18.347 -14.415 542 HA LYS 66 HA LYS 66 -19.126 -16.637 -12.459 543 HB2 LYS 66 2HB LYS 66 -19.680 -19.469 -13.290 544 HB3 LYS 66 3HB LYS 66 -20.508 -18.766 -11.906 545 HG2 LYS 66 2HG LYS 66 -20.513 -17.473 -14.616 546 HG3 LYS 66 3HG LYS 66 -21.715 -18.668 -14.124 547 HD2 LYS 66 2HD LYS 66 -22.673 -17.264 -12.575 548 HD3 LYS 66 3HD LYS 66 -21.190 -16.335 -12.342 549 HE2 LYS 66 2HE LYS 66 -22.350 -16.206 -15.043 550 HE3 LYS 66 3HE LYS 66 -23.328 -15.479 -13.770 551 HZ1 LYS 66 1HZ LYS 66 -21.953 -13.774 -14.537 552 HZ2 LYS 66 2HZ LYS 66 -20.583 -14.763 -14.602 553 HZ3 LYS 66 3HZ LYS 66 -21.210 -14.285 -13.105 554 H GLN 67 H GLN 67 -17.319 -19.680 -12.183 555 HA GLN 67 HA GLN 67 -17.435 -19.918 -9.395 556 HB2 GLN 67 2HB GLN 67 -15.445 -20.907 -11.429 557 HB3 GLN 67 3HB GLN 67 -15.291 -21.274 -9.716 558 HG2 GLN 67 2HG GLN 67 -17.558 -22.041 -11.537 559 HG3 GLN 67 3HG GLN 67 -16.351 -23.111 -10.825 560 HE21 GLN 67 1HE2 GLN 67 -19.255 -21.317 -10.305 561 HE22 GLN 67 2HE2 GLN 67 -19.622 -21.955 -8.742 562 H TYR 68 H TYR 68 -14.942 -18.449 -11.464 563 HA TYR 68 HA TYR 68 -13.291 -17.609 -9.321 564 HB2 TYR 68 2HB TYR 68 -13.436 -17.093 -12.242 565 HB3 TYR 68 3HB TYR 68 -12.564 -15.914 -11.270 566 HD1 TYR 68 HD1 TYR 68 -12.638 -19.408 -12.409 567 HD2 TYR 68 HD2 TYR 68 -10.461 -16.470 -10.233 568 HE1 TYR 68 HE1 TYR 68 -10.663 -20.873 -12.420 569 HE2 TYR 68 HE2 TYR 68 -8.479 -17.926 -10.239 570 HH TYR 68 HH TYR 68 -8.582 -21.167 -10.985 571 H ASP 69 H ASP 69 -16.069 -16.227 -10.894 572 HA ASP 69 HA ASP 69 -15.726 -13.555 -10.015 573 HB2 ASP 69 2HB ASP 69 -17.223 -13.950 -11.833 574 HB3 ASP 69 3HB ASP 69 -18.159 -15.110 -10.895 575 H ALA 70 H ALA 70 -16.921 -16.431 -8.498 576 HA ALA 70 HA ALA 70 -18.419 -15.192 -6.427 577 HB1 ALA 70 1HB ALA 70 -17.589 -17.607 -5.395 578 HB2 ALA 70 2HB ALA 70 -19.054 -17.328 -6.338 579 HB3 ALA 70 3HB ALA 70 -17.583 -17.885 -7.136 580 H TYR 71 H TYR 71 -15.061 -16.251 -6.714 581 HA TYR 71 HA TYR 71 -14.498 -15.295 -4.008 582 HB2 TYR 71 2HB TYR 71 -12.572 -16.623 -5.917 583 HB3 TYR 71 3HB TYR 71 -12.404 -16.438 -4.175 584 HD1 TYR 71 HD1 TYR 71 -14.932 -17.334 -3.110 585 HD2 TYR 71 HD2 TYR 71 -12.709 -18.882 -6.392 586 HE1 TYR 71 HE1 TYR 71 -15.977 -19.535 -2.773 587 HE2 TYR 71 HE2 TYR 71 -13.749 -21.086 -6.064 588 HH TYR 71 HH TYR 71 -14.872 -22.273 -3.811 589 H GLY 72 H GLY 72 -15.108 -13.508 -6.304 590 HA2 GLY 72 2HA GLY 72 -12.542 -12.159 -6.722 591 HA3 GLY 72 3HA GLY 72 -14.040 -11.817 -7.573 592 H SER 73 H SER 73 -13.141 -9.587 -6.989 593 HA SER 73 HA SER 73 -13.103 -8.562 -4.422 594 HB2 SER 73 2HB SER 73 -13.912 -6.385 -5.665 595 HB3 SER 73 3HB SER 73 -12.319 -7.063 -6.005 596 HG SER 73 HG SER 73 -14.505 -6.830 -7.631 Start of MODEL 20 1 H1 HIS 1 H HIS 1 1.982 1.658 -0.756 2 HA HIS 1 HA HIS 1 -0.685 2.891 -0.517 3 HB2 HIS 1 2HB HIS 1 0.523 1.482 -2.907 4 HB3 HIS 1 3HB HIS 1 -1.111 2.134 -2.825 5 HD1 HIS 1 HD1 HIS 1 -1.323 4.354 -3.872 6 HD2 HIS 1 HD2 HIS 1 2.502 3.722 -2.376 7 HE1 HIS 1 HE1 HIS 1 -0.018 6.419 -4.467 8 H MET 2 H MET 2 -2.514 1.488 -0.636 9 HA MET 2 HA MET 2 -2.161 -0.938 0.807 10 HB2 MET 2 2HB MET 2 -4.509 0.446 -0.445 11 HB3 MET 2 3HB MET 2 -4.677 -1.191 0.173 12 HG2 MET 2 2HG MET 2 -5.308 -0.022 2.012 13 HG3 MET 2 3HG MET 2 -3.576 -0.134 2.315 14 HE1 MET 2 1HE MET 2 -4.881 3.361 3.622 15 HE2 MET 2 2HE MET 2 -6.243 2.483 2.926 16 HE3 MET 2 3HE MET 2 -5.055 1.630 3.912 17 H LEU 3 H LEU 3 -3.459 -2.949 -0.043 18 HA LEU 3 HA LEU 3 -2.092 -3.804 -2.430 19 HB2 LEU 3 2HB LEU 3 -2.704 -5.118 -0.226 20 HB3 LEU 3 3HB LEU 3 -4.189 -5.456 -1.112 21 HG LEU 3 HG LEU 3 -2.594 -7.284 -1.325 22 HD11 LEU 3 1HD1 LEU 3 -4.135 -6.477 -3.228 23 HD12 LEU 3 2HD1 LEU 3 -2.856 -7.631 -3.603 24 HD13 LEU 3 3HD1 LEU 3 -2.644 -5.924 -3.991 25 HD21 LEU 3 1HD2 LEU 3 -0.630 -5.516 -1.208 26 HD22 LEU 3 2HD2 LEU 3 -0.751 -5.627 -2.964 27 HD23 LEU 3 3HD2 LEU 3 -0.429 -7.075 -2.008 28 H ALA 4 H ALA 4 -2.864 -3.736 -4.430 29 HA ALA 4 HA ALA 4 -5.623 -2.939 -4.873 30 HB1 ALA 4 1HB ALA 4 -3.160 -2.562 -6.238 31 HB2 ALA 4 2HB ALA 4 -4.279 -3.384 -7.327 32 HB3 ALA 4 3HB ALA 4 -4.736 -1.850 -6.588 33 H LYS 5 H LYS 5 -7.157 -4.125 -5.960 34 HA LYS 5 HA LYS 5 -6.460 -6.906 -6.628 35 HB2 LYS 5 2HB LYS 5 -8.678 -7.597 -5.756 36 HB3 LYS 5 3HB LYS 5 -7.617 -6.958 -4.507 37 HG2 LYS 5 2HG LYS 5 -8.868 -4.709 -5.072 38 HG3 LYS 5 3HG LYS 5 -10.114 -5.821 -5.645 39 HD2 LYS 5 2HD LYS 5 -10.542 -6.636 -3.550 40 HD3 LYS 5 3HD LYS 5 -8.900 -6.331 -2.978 41 HE2 LYS 5 2HE LYS 5 -9.409 -3.898 -3.005 42 HE3 LYS 5 3HE LYS 5 -11.076 -4.291 -3.426 43 HZ1 LYS 5 1HZ LYS 5 -10.173 -4.000 -0.919 44 HZ2 LYS 5 2HZ LYS 5 -10.057 -5.677 -1.103 45 HZ3 LYS 5 3HZ LYS 5 -11.542 -4.901 -1.337 46 H GLU 6 H GLU 6 -6.815 -7.280 -8.706 47 HA GLU 6 HA GLU 6 -9.035 -5.863 -10.030 48 HB2 GLU 6 2HB GLU 6 -7.722 -5.985 -12.117 49 HB3 GLU 6 3HB GLU 6 -6.909 -5.051 -10.869 50 HG2 GLU 6 2HG GLU 6 -5.576 -7.102 -10.334 51 HG3 GLU 6 3HG GLU 6 -6.280 -7.849 -11.766 52 H ASP 7 H ASP 7 -10.228 -7.002 -11.598 53 HA ASP 7 HA ASP 7 -10.106 -9.918 -11.264 54 HB2 ASP 7 2HB ASP 7 -12.371 -8.145 -12.199 55 HB3 ASP 7 3HB ASP 7 -12.450 -9.901 -12.084 56 H TYR 8 H TYR 8 -10.930 -11.154 -13.240 57 HA TYR 8 HA TYR 8 -9.141 -10.753 -15.365 58 HB2 TYR 8 2HB TYR 8 -11.694 -12.375 -15.400 59 HB3 TYR 8 3HB TYR 8 -10.321 -12.561 -16.486 60 HD1 TYR 8 HD1 TYR 8 -11.793 -14.436 -14.298 61 HD2 TYR 8 HD2 TYR 8 -8.074 -12.385 -14.548 62 HE1 TYR 8 HE1 TYR 8 -10.797 -16.067 -12.750 63 HE2 TYR 8 HE2 TYR 8 -7.067 -14.011 -13.001 64 HH TYR 8 HH TYR 8 -7.541 -16.448 -12.328 65 H TYR 9 H TYR 9 -12.440 -9.712 -14.859 66 HA TYR 9 HA TYR 9 -13.244 -9.077 -17.419 67 HB2 TYR 9 2HB TYR 9 -13.776 -7.470 -14.911 68 HB3 TYR 9 3HB TYR 9 -14.713 -7.399 -16.399 69 HD1 TYR 9 HD1 TYR 9 -14.159 -9.166 -13.297 70 HD2 TYR 9 HD2 TYR 9 -16.050 -9.392 -17.101 71 HE1 TYR 9 HE1 TYR 9 -15.598 -10.980 -12.467 72 HE2 TYR 9 HE2 TYR 9 -17.495 -11.206 -16.282 73 HH TYR 9 HH TYR 9 -18.056 -12.475 -14.553 74 H GLN 10 H GLN 10 -11.192 -7.215 -15.226 75 HA GLN 10 HA GLN 10 -10.974 -4.968 -16.988 76 HB2 GLN 10 2HB GLN 10 -9.348 -5.774 -14.572 77 HB3 GLN 10 3HB GLN 10 -9.173 -4.245 -15.423 78 HG2 GLN 10 2HG GLN 10 -11.287 -3.498 -14.751 79 HG3 GLN 10 3HG GLN 10 -11.797 -5.115 -14.267 80 HE21 GLN 10 1HE2 GLN 10 -12.023 -5.214 -12.159 81 HE22 GLN 10 2HE2 GLN 10 -10.971 -4.509 -10.984 82 H ILE 11 H ILE 11 -8.975 -7.782 -16.239 83 HA ILE 11 HA ILE 11 -6.695 -7.069 -17.692 84 HB ILE 11 HB ILE 11 -7.798 -9.843 -17.231 85 HG12 ILE 11 2HG1 ILE 11 -5.641 -8.454 -15.651 86 HG13 ILE 11 3HG1 ILE 11 -7.340 -8.330 -15.208 87 HG21 ILE 11 1HG2 ILE 11 -5.399 -8.846 -18.563 88 HG22 ILE 11 2HG2 ILE 11 -5.070 -10.042 -17.310 89 HG23 ILE 11 3HG2 ILE 11 -6.162 -10.434 -18.638 90 HD11 ILE 11 1HD1 ILE 11 -5.644 -10.209 -14.275 91 HD12 ILE 11 2HD1 ILE 11 -7.395 -10.403 -14.365 92 HD13 ILE 11 3HD1 ILE 11 -6.369 -11.063 -15.638 93 H LEU 12 H LEU 12 -9.806 -8.084 -18.753 94 HA LEU 12 HA LEU 12 -8.788 -8.538 -21.476 95 HB2 LEU 12 2HB LEU 12 -11.162 -9.528 -19.976 96 HB3 LEU 12 3HB LEU 12 -11.282 -9.355 -21.726 97 HG LEU 12 HG LEU 12 -9.188 -11.020 -20.334 98 HD11 LEU 12 1HD1 LEU 12 -10.774 -12.527 -19.967 99 HD12 LEU 12 2HD1 LEU 12 -10.959 -12.673 -21.714 100 HD13 LEU 12 3HD1 LEU 12 -11.978 -11.553 -20.810 101 HD21 LEU 12 1HD2 LEU 12 -9.793 -10.310 -23.130 102 HD22 LEU 12 2HD2 LEU 12 -9.442 -12.012 -22.826 103 HD23 LEU 12 3HD2 LEU 12 -8.266 -10.775 -22.378 104 H GLY 13 H GLY 13 -10.509 -6.354 -19.511 105 HA2 GLY 13 2HA GLY 13 -11.267 -4.231 -20.042 106 HA3 GLY 13 3HA GLY 13 -10.878 -4.552 -21.725 107 H VAL 14 H VAL 14 -12.888 -6.761 -19.957 108 HA VAL 14 HA VAL 14 -15.194 -5.857 -21.551 109 HB VAL 14 HB VAL 14 -16.075 -8.117 -21.396 110 HG11 VAL 14 1HG1 VAL 14 -13.880 -7.326 -22.884 111 HG12 VAL 14 2HG1 VAL 14 -13.413 -8.901 -22.238 112 HG13 VAL 14 3HG1 VAL 14 -14.895 -8.737 -23.182 113 HG21 VAL 14 1HG2 VAL 14 -15.207 -8.709 -19.198 114 HG22 VAL 14 2HG2 VAL 14 -14.764 -9.928 -20.392 115 HG23 VAL 14 3HG2 VAL 14 -13.567 -8.755 -19.844 116 HA PRO 15 HA PRO 15 -17.451 -4.882 -17.912 117 HB2 PRO 15 2HB PRO 15 -19.980 -5.456 -18.714 118 HB3 PRO 15 3HB PRO 15 -19.082 -4.051 -19.299 119 HG2 PRO 15 2HG PRO 15 -19.505 -6.708 -20.611 120 HG3 PRO 15 3HG PRO 15 -19.579 -5.085 -21.322 121 HD2 PRO 15 2HD PRO 15 -17.418 -6.695 -21.587 122 HD3 PRO 15 3HD PRO 15 -17.287 -4.927 -21.509 123 H ARG 16 H ARG 16 -19.204 -5.812 -16.434 124 HA ARG 16 HA ARG 16 -18.413 -8.480 -15.707 125 HB2 ARG 16 2HB ARG 16 -20.502 -6.658 -14.498 126 HB3 ARG 16 3HB ARG 16 -19.925 -8.160 -13.788 127 HG2 ARG 16 2HG ARG 16 -18.515 -6.841 -12.667 128 HG3 ARG 16 3HG ARG 16 -17.594 -6.814 -14.172 129 HD2 ARG 16 2HD ARG 16 -17.927 -4.560 -13.295 130 HD3 ARG 16 3HD ARG 16 -18.738 -4.770 -14.846 131 HE ARG 16 HE ARG 16 -20.748 -4.431 -13.803 132 HH11 ARG 16 1HH1 ARG 16 -18.307 -5.075 -11.405 133 HH12 ARG 16 2HH1 ARG 16 -19.337 -4.693 -10.065 134 HH21 ARG 16 1HH2 ARG 16 -22.113 -3.925 -12.047 135 HH22 ARG 16 2HH2 ARG 16 -21.502 -4.040 -10.432 136 H ASN 17 H ASN 17 -20.682 -7.235 -17.814 137 HA ASN 17 HA ASN 17 -22.405 -9.610 -17.544 138 HB2 ASN 17 2HB ASN 17 -24.090 -8.239 -18.838 139 HB3 ASN 17 3HB ASN 17 -23.733 -7.653 -17.216 140 HD21 ASN 17 1HD2 ASN 17 -24.525 -5.609 -17.878 141 HD22 ASN 17 2HD2 ASN 17 -23.541 -4.542 -18.815 142 H ALA 18 H ALA 18 -19.850 -8.628 -19.221 143 HA ALA 18 HA ALA 18 -20.431 -8.801 -21.920 144 HB1 ALA 18 1HB ALA 18 -18.236 -8.524 -22.060 145 HB2 ALA 18 2HB ALA 18 -18.108 -8.790 -20.320 146 HB3 ALA 18 3HB ALA 18 -17.964 -10.150 -21.433 147 H SER 19 H SER 19 -20.033 -10.578 -23.433 148 HA SER 19 HA SER 19 -21.002 -13.126 -22.328 149 HB2 SER 19 2HB SER 19 -21.129 -12.181 -25.200 150 HB3 SER 19 3HB SER 19 -21.912 -13.607 -24.519 151 HG SER 19 HG SER 19 -23.106 -12.137 -23.164 152 H GLN 20 H GLN 20 -20.204 -15.107 -23.341 153 HA GLN 20 HA GLN 20 -17.432 -15.300 -23.307 154 HB2 GLN 20 2HB GLN 20 -19.254 -17.193 -24.788 155 HB3 GLN 20 3HB GLN 20 -17.698 -17.556 -24.054 156 HG2 GLN 20 2HG GLN 20 -20.332 -17.063 -22.724 157 HG3 GLN 20 3HG GLN 20 -19.262 -18.457 -22.586 158 HE21 GLN 20 1HE2 GLN 20 -17.321 -18.232 -21.379 159 HE22 GLN 20 2HE2 GLN 20 -17.189 -17.038 -20.138 160 H LYS 21 H LYS 21 -19.592 -14.505 -25.904 161 HA LYS 21 HA LYS 21 -17.683 -14.960 -28.004 162 HB2 LYS 21 2HB LYS 21 -20.352 -13.554 -27.925 163 HB3 LYS 21 3HB LYS 21 -19.379 -13.679 -29.385 164 HG2 LYS 21 2HG LYS 21 -20.198 -16.107 -27.831 165 HG3 LYS 21 3HG LYS 21 -21.248 -15.380 -29.049 166 HD2 LYS 21 2HD LYS 21 -18.401 -16.086 -29.678 167 HD3 LYS 21 3HD LYS 21 -19.680 -17.300 -29.759 168 HE2 LYS 21 2HE LYS 21 -19.922 -14.665 -31.175 169 HE3 LYS 21 3HE LYS 21 -19.075 -16.027 -31.907 170 HZ1 LYS 21 1HZ LYS 21 -21.359 -17.179 -31.133 171 HZ2 LYS 21 2HZ LYS 21 -21.106 -16.529 -32.673 172 HZ3 LYS 21 3HZ LYS 21 -21.911 -15.621 -31.495 173 H GLU 22 H GLU 22 -18.994 -12.102 -26.351 174 HA GLU 22 HA GLU 22 -17.534 -10.187 -27.806 175 HB2 GLU 22 2HB GLU 22 -19.474 -9.598 -26.439 176 HB3 GLU 22 3HB GLU 22 -18.602 -10.049 -24.981 177 HG2 GLU 22 2HG GLU 22 -18.460 -7.733 -25.035 178 HG3 GLU 22 3HG GLU 22 -16.902 -8.271 -25.658 179 H ILE 23 H ILE 23 -16.703 -12.202 -25.085 180 HA ILE 23 HA ILE 23 -14.416 -10.775 -24.223 181 HB ILE 23 HB ILE 23 -15.073 -13.709 -23.939 182 HG12 ILE 23 2HG1 ILE 23 -15.223 -11.750 -21.697 183 HG13 ILE 23 3HG1 ILE 23 -16.507 -11.720 -22.901 184 HG21 ILE 23 1HG2 ILE 23 -13.426 -13.698 -22.114 185 HG22 ILE 23 2HG2 ILE 23 -12.692 -13.343 -23.677 186 HG23 ILE 23 3HG2 ILE 23 -12.996 -12.039 -22.530 187 HD11 ILE 23 1HD1 ILE 23 -16.063 -14.417 -22.150 188 HD12 ILE 23 2HD1 ILE 23 -16.208 -13.443 -20.686 189 HD13 ILE 23 3HD1 ILE 23 -17.492 -13.416 -21.895 190 H LYS 24 H LYS 24 -14.955 -13.183 -26.707 191 HA LYS 24 HA LYS 24 -12.286 -13.915 -27.189 192 HB2 LYS 24 2HB LYS 24 -14.772 -13.925 -28.877 193 HB3 LYS 24 3HB LYS 24 -13.220 -14.391 -29.561 194 HG2 LYS 24 2HG LYS 24 -13.005 -16.187 -27.970 195 HG3 LYS 24 3HG LYS 24 -14.482 -15.677 -27.149 196 HD2 LYS 24 2HD LYS 24 -15.184 -17.445 -28.498 197 HD3 LYS 24 3HD LYS 24 -15.618 -16.012 -29.434 198 HE2 LYS 24 2HE LYS 24 -13.822 -16.302 -30.915 199 HE3 LYS 24 3HE LYS 24 -12.996 -17.420 -29.830 200 HZ1 LYS 24 1HZ LYS 24 -15.476 -18.529 -30.398 201 HZ2 LYS 24 2HZ LYS 24 -13.960 -19.070 -30.918 202 HZ3 LYS 24 3HZ LYS 24 -14.848 -17.995 -31.876 203 H LYS 25 H LYS 25 -14.265 -11.284 -28.472 204 HA LYS 25 HA LYS 25 -12.364 -10.365 -30.363 205 HB2 LYS 25 2HB LYS 25 -14.655 -8.927 -29.012 206 HB3 LYS 25 3HB LYS 25 -13.731 -8.279 -30.361 207 HG2 LYS 25 2HG LYS 25 -14.720 -9.645 -31.877 208 HG3 LYS 25 3HG LYS 25 -14.944 -10.956 -30.717 209 HD2 LYS 25 2HD LYS 25 -17.113 -10.195 -31.122 210 HD3 LYS 25 3HD LYS 25 -16.668 -9.405 -29.607 211 HE2 LYS 25 2HE LYS 25 -16.178 -7.354 -30.760 212 HE3 LYS 25 3HE LYS 25 -16.410 -8.129 -32.326 213 HZ1 LYS 25 1HZ LYS 25 -18.728 -8.420 -31.843 214 HZ2 LYS 25 2HZ LYS 25 -18.329 -6.792 -31.618 215 HZ3 LYS 25 3HZ LYS 25 -18.535 -7.805 -30.279 216 H ALA 26 H ALA 26 -13.180 -9.294 -27.072 217 HA ALA 26 HA ALA 26 -11.292 -7.209 -26.942 218 HB1 ALA 26 1HB ALA 26 -12.397 -8.825 -24.649 219 HB2 ALA 26 2HB ALA 26 -11.681 -7.216 -24.562 220 HB3 ALA 26 3HB ALA 26 -13.211 -7.455 -25.405 221 H TYR 27 H TYR 27 -11.043 -10.651 -26.402 222 HA TYR 27 HA TYR 27 -8.524 -10.575 -25.063 223 HB2 TYR 27 2HB TYR 27 -9.909 -12.499 -24.729 224 HB3 TYR 27 3HB TYR 27 -10.027 -12.791 -26.460 225 HD1 TYR 27 HD1 TYR 27 -7.187 -12.241 -24.083 226 HD2 TYR 27 HD2 TYR 27 -8.920 -14.709 -27.084 227 HE1 TYR 27 HE1 TYR 27 -5.248 -13.748 -23.954 228 HE2 TYR 27 HE2 TYR 27 -6.987 -16.225 -26.962 229 HH TYR 27 HH TYR 27 -5.209 -16.828 -25.514 230 H TYR 28 H TYR 28 -9.554 -10.839 -28.407 231 HA TYR 28 HA TYR 28 -6.940 -11.459 -29.415 232 HB2 TYR 28 2HB TYR 28 -8.882 -12.195 -30.657 233 HB3 TYR 28 3HB TYR 28 -9.464 -10.540 -30.804 234 HD1 TYR 28 HD1 TYR 28 -9.227 -9.636 -32.904 235 HD2 TYR 28 HD2 TYR 28 -6.271 -12.364 -31.515 236 HE1 TYR 28 HE1 TYR 28 -8.014 -9.395 -35.030 237 HE2 TYR 28 HE2 TYR 28 -5.049 -12.128 -33.637 238 HH TYR 28 HH TYR 28 -5.869 -9.715 -35.973 239 H GLN 29 H GLN 29 -8.991 -8.558 -29.371 240 HA GLN 29 HA GLN 29 -7.242 -6.851 -30.730 241 HB2 GLN 29 2HB GLN 29 -8.603 -5.078 -30.007 242 HB3 GLN 29 3HB GLN 29 -9.688 -6.460 -30.089 243 HG2 GLN 29 2HG GLN 29 -10.317 -5.741 -28.061 244 HG3 GLN 29 3HG GLN 29 -8.902 -6.649 -27.531 245 HE21 GLN 29 1HE2 GLN 29 -10.225 -4.309 -26.356 246 HE22 GLN 29 2HE2 GLN 29 -9.002 -3.097 -26.222 247 H LEU 30 H LEU 30 -7.304 -7.916 -27.410 248 HA LEU 30 HA LEU 30 -5.480 -5.931 -26.441 249 HB2 LEU 30 2HB LEU 30 -7.001 -8.140 -25.368 250 HB3 LEU 30 3HB LEU 30 -5.356 -8.133 -24.734 251 HG LEU 30 HG LEU 30 -5.655 -5.926 -23.830 252 HD11 LEU 30 1HD1 LEU 30 -8.034 -5.933 -25.575 253 HD12 LEU 30 2HD1 LEU 30 -6.954 -4.613 -25.127 254 HD13 LEU 30 3HD1 LEU 30 -8.211 -5.142 -24.009 255 HD21 LEU 30 1HD2 LEU 30 -7.583 -8.072 -23.193 256 HD22 LEU 30 2HD2 LEU 30 -7.925 -6.480 -22.516 257 HD23 LEU 30 3HD2 LEU 30 -6.388 -7.275 -22.169 258 H ALA 31 H ALA 31 -5.211 -9.283 -27.527 259 HA ALA 31 HA ALA 31 -2.549 -9.754 -26.848 260 HB1 ALA 31 1HB ALA 31 -2.838 -11.175 -29.158 261 HB2 ALA 31 2HB ALA 31 -3.369 -11.713 -27.564 262 HB3 ALA 31 3HB ALA 31 -4.515 -10.943 -28.661 263 H LYS 32 H LYS 32 -3.937 -8.252 -29.735 264 HA LYS 32 HA LYS 32 -1.571 -8.025 -31.225 265 HB2 LYS 32 2HB LYS 32 -4.082 -6.349 -31.215 266 HB3 LYS 32 3HB LYS 32 -2.784 -6.135 -32.382 267 HG2 LYS 32 2HG LYS 32 -3.306 -8.022 -33.520 268 HG3 LYS 32 3HG LYS 32 -3.878 -8.867 -32.080 269 HD2 LYS 32 2HD LYS 32 -5.728 -8.405 -33.592 270 HD3 LYS 32 3HD LYS 32 -5.911 -7.490 -32.094 271 HE2 LYS 32 2HE LYS 32 -5.234 -5.476 -33.133 272 HE3 LYS 32 3HE LYS 32 -4.644 -6.325 -34.561 273 HZ1 LYS 32 1HZ LYS 32 -7.496 -6.306 -33.752 274 HZ2 LYS 32 2HZ LYS 32 -6.844 -6.821 -35.225 275 HZ3 LYS 32 3HZ LYS 32 -6.833 -5.177 -34.824 276 H LYS 33 H LYS 33 -2.645 -6.349 -28.438 277 HA LYS 33 HA LYS 33 -1.030 -3.997 -28.858 278 HB2 LYS 33 2HB LYS 33 -2.267 -4.907 -26.262 279 HB3 LYS 33 3HB LYS 33 -1.803 -3.273 -26.719 280 HG2 LYS 33 2HG LYS 33 -3.560 -3.636 -28.625 281 HG3 LYS 33 3HG LYS 33 -4.185 -4.867 -27.525 282 HD2 LYS 33 2HD LYS 33 -5.370 -3.091 -26.745 283 HD3 LYS 33 3HD LYS 33 -3.907 -2.864 -25.784 284 HE2 LYS 33 2HE LYS 33 -4.554 -0.756 -26.753 285 HE3 LYS 33 3HE LYS 33 -3.063 -1.309 -27.513 286 HZ1 LYS 33 1HZ LYS 33 -4.847 -0.402 -29.032 287 HZ2 LYS 33 2HZ LYS 33 -5.719 -1.815 -28.715 288 HZ3 LYS 33 3HZ LYS 33 -4.201 -1.907 -29.455 289 H TYR 34 H TYR 34 -0.807 -6.992 -27.011 290 HA TYR 34 HA TYR 34 1.867 -6.217 -26.084 291 HB2 TYR 34 2HB TYR 34 0.102 -8.515 -25.213 292 HB3 TYR 34 3HB TYR 34 1.670 -8.112 -24.522 293 HD1 TYR 34 HD1 TYR 34 1.928 -6.210 -23.042 294 HD2 TYR 34 HD2 TYR 34 -1.856 -7.139 -24.752 295 HE1 TYR 34 HE1 TYR 34 0.839 -4.698 -21.437 296 HE2 TYR 34 HE2 TYR 34 -2.956 -5.629 -23.152 297 HH TYR 34 HH TYR 34 -2.027 -4.729 -20.536 298 H HIS 35 H HIS 35 1.046 -7.197 -28.827 299 HA HIS 35 HA HIS 35 1.980 -9.806 -29.248 300 HB2 HIS 35 2HB HIS 35 1.257 -7.510 -30.885 301 HB3 HIS 35 3HB HIS 35 2.594 -8.422 -31.580 302 HD1 HIS 35 HD1 HIS 35 0.971 -9.149 -33.510 303 HD2 HIS 35 HD2 HIS 35 -0.078 -10.516 -29.730 304 HE1 HIS 35 HE1 HIS 35 -0.732 -10.958 -33.898 305 HA PRO 36 HA PRO 36 6.356 -9.603 -29.049 306 HB2 PRO 36 2HB PRO 36 7.115 -11.158 -31.141 307 HB3 PRO 36 3HB PRO 36 6.395 -11.816 -29.666 308 HG2 PRO 36 2HG PRO 36 5.109 -11.237 -32.307 309 HG3 PRO 36 3HG PRO 36 4.907 -12.645 -31.249 310 HD2 PRO 36 2HD PRO 36 3.112 -10.620 -31.338 311 HD3 PRO 36 3HD PRO 36 3.434 -11.547 -29.858 312 H ASP 37 H ASP 37 4.712 -8.394 -31.790 313 HA ASP 37 HA ASP 37 7.034 -7.467 -33.210 314 HB2 ASP 37 2HB ASP 37 4.145 -6.628 -33.529 315 HB3 ASP 37 3HB ASP 37 5.450 -6.345 -34.678 316 H THR 38 H THR 38 5.147 -6.349 -30.586 317 HA THR 38 HA THR 38 6.258 -3.636 -30.858 318 HB THR 38 HB THR 38 4.507 -2.805 -29.490 319 HG1 THR 38 HG1 THR 38 4.335 -5.450 -28.683 320 HG21 THR 38 1HG2 THR 38 3.994 -4.030 -31.900 321 HG22 THR 38 2HG2 THR 38 2.896 -2.947 -31.044 322 HG23 THR 38 3HG2 THR 38 2.742 -4.692 -30.849 323 H ASN 39 H ASN 39 7.216 -6.357 -29.571 324 HA ASN 39 HA ASN 39 7.765 -5.428 -26.864 325 HB2 ASN 39 2HB ASN 39 7.931 -8.030 -28.293 326 HB3 ASN 39 3HB ASN 39 9.058 -7.773 -26.965 327 HD21 ASN 39 1HD2 ASN 39 5.686 -6.803 -27.463 328 HD22 ASN 39 2HD2 ASN 39 5.080 -7.553 -26.029 329 H LYS 40 H LYS 40 9.008 -4.491 -29.566 330 HA LYS 40 HA LYS 40 11.761 -5.116 -29.464 331 HB2 LYS 40 2HB LYS 40 10.066 -3.120 -30.857 332 HB3 LYS 40 3HB LYS 40 11.774 -2.728 -30.707 333 HG2 LYS 40 2HG LYS 40 11.835 -3.835 -32.681 334 HG3 LYS 40 3HG LYS 40 12.038 -5.211 -31.594 335 HD2 LYS 40 2HD LYS 40 9.256 -4.439 -32.223 336 HD3 LYS 40 3HD LYS 40 10.195 -5.122 -33.552 337 HE2 LYS 40 2HE LYS 40 10.330 -6.512 -30.938 338 HE3 LYS 40 3HE LYS 40 8.815 -6.626 -31.833 339 HZ1 LYS 40 1HZ LYS 40 10.684 -7.112 -33.728 340 HZ2 LYS 40 2HZ LYS 40 9.808 -8.297 -32.897 341 HZ3 LYS 40 3HZ LYS 40 11.355 -7.861 -32.368 342 H ASP 41 H ASP 41 9.851 -2.487 -28.078 343 HA ASP 41 HA ASP 41 12.225 -1.682 -26.528 344 HB2 ASP 41 2HB ASP 41 9.913 0.164 -27.050 345 HB3 ASP 41 3HB ASP 41 11.573 0.564 -26.618 346 H ASP 42 H ASP 42 9.812 -3.581 -26.110 347 HA ASP 42 HA ASP 42 9.340 -2.737 -23.350 348 HB2 ASP 42 2HB ASP 42 7.417 -2.170 -25.110 349 HB3 ASP 42 3HB ASP 42 6.997 -3.854 -24.810 350 HA PRO 43 HA PRO 43 10.502 -7.187 -23.651 351 HB2 PRO 43 2HB PRO 43 12.088 -7.141 -21.448 352 HB3 PRO 43 3HB PRO 43 12.663 -6.682 -23.055 353 HG2 PRO 43 2HG PRO 43 11.770 -4.937 -20.792 354 HG3 PRO 43 3HG PRO 43 13.160 -4.740 -21.876 355 HD2 PRO 43 2HD PRO 43 10.849 -3.367 -22.206 356 HD3 PRO 43 3HD PRO 43 11.871 -3.857 -23.572 357 H LYS 44 H LYS 44 8.803 -5.218 -21.491 358 HA LYS 44 HA LYS 44 8.193 -7.392 -19.638 359 HB2 LYS 44 2HB LYS 44 7.913 -4.443 -19.608 360 HB3 LYS 44 3HB LYS 44 6.662 -5.347 -18.765 361 HG2 LYS 44 2HG LYS 44 9.615 -5.655 -18.265 362 HG3 LYS 44 3HG LYS 44 8.534 -4.635 -17.313 363 HD2 LYS 44 2HD LYS 44 7.548 -6.407 -16.286 364 HD3 LYS 44 3HD LYS 44 7.717 -7.456 -17.696 365 HE2 LYS 44 2HE LYS 44 10.155 -6.608 -16.197 366 HE3 LYS 44 3HE LYS 44 9.134 -7.883 -15.533 367 HZ1 LYS 44 1HZ LYS 44 9.564 -8.400 -18.256 368 HZ2 LYS 44 2HZ LYS 44 10.063 -9.312 -16.922 369 HZ3 LYS 44 3HZ LYS 44 11.065 -8.095 -17.536 370 H ALA 45 H ALA 45 6.918 -5.844 -22.411 371 HA ALA 45 HA ALA 45 4.172 -6.133 -22.074 372 HB1 ALA 45 1HB ALA 45 4.207 -6.422 -24.640 373 HB2 ALA 45 2HB ALA 45 4.805 -4.914 -23.945 374 HB3 ALA 45 3HB ALA 45 5.943 -6.147 -24.488 375 H LYS 46 H LYS 46 6.606 -8.493 -23.018 376 HA LYS 46 HA LYS 46 4.931 -10.542 -23.907 377 HB2 LYS 46 2HB LYS 46 6.807 -12.062 -23.316 378 HB3 LYS 46 3HB LYS 46 7.315 -10.662 -24.251 379 HG2 LYS 46 2HG LYS 46 7.855 -9.611 -21.958 380 HG3 LYS 46 3HG LYS 46 7.782 -11.270 -21.361 381 HD2 LYS 46 2HD LYS 46 10.059 -10.805 -21.891 382 HD3 LYS 46 3HD LYS 46 9.440 -11.884 -23.142 383 HE2 LYS 46 2HE LYS 46 9.493 -10.267 -24.756 384 HE3 LYS 46 3HE LYS 46 9.244 -8.956 -23.604 385 HZ1 LYS 46 1HZ LYS 46 11.764 -10.488 -23.959 386 HZ2 LYS 46 2HZ LYS 46 11.525 -9.229 -22.855 387 HZ3 LYS 46 3HZ LYS 46 11.478 -8.917 -24.517 388 H GLU 47 H GLU 47 6.061 -9.760 -20.642 389 HA GLU 47 HA GLU 47 4.904 -11.996 -19.363 390 HB2 GLU 47 2HB GLU 47 6.665 -10.648 -18.321 391 HB3 GLU 47 3HB GLU 47 5.576 -9.271 -18.241 392 HG2 GLU 47 2HG GLU 47 4.078 -10.668 -16.792 393 HG3 GLU 47 3HG GLU 47 5.374 -11.861 -16.734 394 H LYS 48 H LYS 48 3.699 -8.776 -20.116 395 HA LYS 48 HA LYS 48 1.290 -9.007 -18.615 396 HB2 LYS 48 2HB LYS 48 1.898 -7.209 -20.970 397 HB3 LYS 48 3HB LYS 48 0.577 -7.007 -19.826 398 HG2 LYS 48 2HG LYS 48 3.519 -6.800 -19.221 399 HG3 LYS 48 3HG LYS 48 2.360 -5.472 -19.308 400 HD2 LYS 48 2HD LYS 48 1.121 -6.466 -17.422 401 HD3 LYS 48 3HD LYS 48 2.335 -7.742 -17.318 402 HE2 LYS 48 2HE LYS 48 4.047 -5.914 -17.002 403 HE3 LYS 48 3HE LYS 48 2.697 -4.794 -16.822 404 HZ1 LYS 48 1HZ LYS 48 3.648 -6.866 -15.004 405 HZ2 LYS 48 2HZ LYS 48 1.975 -6.630 -15.078 406 HZ3 LYS 48 3HZ LYS 48 2.993 -5.344 -14.662 407 H PHE 49 H PHE 49 2.226 -9.787 -21.904 408 HA PHE 49 HA PHE 49 -0.305 -10.128 -23.036 409 HB2 PHE 49 2HB PHE 49 1.620 -10.113 -24.461 410 HB3 PHE 49 3HB PHE 49 2.328 -11.488 -23.619 411 HD1 PHE 49 HD1 PHE 49 -0.106 -10.408 -26.102 412 HD2 PHE 49 HD2 PHE 49 1.489 -13.741 -23.990 413 HE1 PHE 49 HE1 PHE 49 -1.158 -11.933 -27.721 414 HE2 PHE 49 HE2 PHE 49 0.441 -15.271 -25.606 415 HZ PHE 49 HZ PHE 49 -0.886 -14.368 -27.474 416 H SER 50 H SER 50 1.681 -12.326 -21.125 417 HA SER 50 HA SER 50 0.176 -14.661 -21.494 418 HB2 SER 50 2HB SER 50 2.000 -13.717 -19.293 419 HB3 SER 50 3HB SER 50 1.163 -15.265 -19.180 420 HG SER 50 HG SER 50 3.413 -14.882 -20.343 421 H GLN 51 H GLN 51 -0.231 -11.948 -19.304 422 HA GLN 51 HA GLN 51 -2.125 -13.076 -17.572 423 HB2 GLN 51 2HB GLN 51 -1.754 -10.203 -18.433 424 HB3 GLN 51 3HB GLN 51 -2.778 -10.718 -17.099 425 HG2 GLN 51 2HG GLN 51 -1.007 -11.231 -15.749 426 HG3 GLN 51 3HG GLN 51 0.075 -11.550 -17.104 427 HE21 GLN 51 1HE2 GLN 51 1.147 -10.120 -15.200 428 HE22 GLN 51 2HE2 GLN 51 1.243 -8.444 -15.608 429 H LEU 52 H LEU 52 -2.411 -11.775 -20.788 430 HA LEU 52 HA LEU 52 -5.198 -11.343 -20.824 431 HB2 LEU 52 2HB LEU 52 -3.428 -12.115 -23.137 432 HB3 LEU 52 3HB LEU 52 -4.999 -11.322 -23.230 433 HG LEU 52 HG LEU 52 -2.646 -10.034 -21.874 434 HD11 LEU 52 1HD1 LEU 52 -1.873 -9.125 -23.831 435 HD12 LEU 52 2HD1 LEU 52 -3.404 -9.356 -24.674 436 HD13 LEU 52 3HD1 LEU 52 -2.344 -10.734 -24.379 437 HD21 LEU 52 1HD2 LEU 52 -5.405 -9.334 -22.447 438 HD22 LEU 52 2HD2 LEU 52 -4.266 -8.134 -23.058 439 HD23 LEU 52 3HD2 LEU 52 -4.250 -8.577 -21.350 440 H ALA 53 H ALA 53 -3.237 -14.128 -21.845 441 HA ALA 53 HA ALA 53 -5.455 -15.731 -22.600 442 HB1 ALA 53 1HB ALA 53 -2.996 -17.111 -21.752 443 HB2 ALA 53 2HB ALA 53 -3.920 -17.248 -23.248 444 HB3 ALA 53 3HB ALA 53 -2.799 -15.905 -23.024 445 H GLU 54 H GLU 54 -3.704 -15.253 -19.601 446 HA GLU 54 HA GLU 54 -4.683 -17.499 -18.207 447 HB2 GLU 54 2HB GLU 54 -3.400 -14.922 -17.466 448 HB3 GLU 54 3HB GLU 54 -4.260 -15.782 -16.197 449 HG2 GLU 54 2HG GLU 54 -2.873 -17.823 -16.999 450 HG3 GLU 54 3HG GLU 54 -1.830 -16.598 -17.720 451 H ALA 55 H ALA 55 -5.804 -14.121 -18.266 452 HA ALA 55 HA ALA 55 -8.067 -14.619 -16.608 453 HB1 ALA 55 1HB ALA 55 -8.275 -12.397 -16.594 454 HB2 ALA 55 2HB ALA 55 -6.758 -12.370 -17.495 455 HB3 ALA 55 3HB ALA 55 -8.296 -12.302 -18.355 456 H TYR 56 H TYR 56 -7.568 -14.383 -20.100 457 HA TYR 56 HA TYR 56 -10.262 -14.480 -20.879 458 HB2 TYR 56 2HB TYR 56 -8.695 -13.839 -22.529 459 HB3 TYR 56 3HB TYR 56 -7.705 -15.270 -22.264 460 HD1 TYR 56 HD1 TYR 56 -10.811 -14.004 -23.782 461 HD2 TYR 56 HD2 TYR 56 -8.223 -17.352 -23.338 462 HE1 TYR 56 HE1 TYR 56 -11.981 -15.145 -25.621 463 HE2 TYR 56 HE2 TYR 56 -9.385 -18.502 -25.176 464 HH TYR 56 HH TYR 56 -10.767 -17.811 -27.198 465 H GLU 57 H GLU 57 -8.060 -16.959 -19.836 466 HA GLU 57 HA GLU 57 -9.358 -19.216 -20.884 467 HB2 GLU 57 2HB GLU 57 -7.460 -18.713 -18.647 468 HB3 GLU 57 3HB GLU 57 -8.307 -20.253 -18.666 469 HG2 GLU 57 2HG GLU 57 -7.317 -20.921 -20.654 470 HG3 GLU 57 3HG GLU 57 -6.873 -19.274 -21.099 471 H VAL 58 H VAL 58 -9.758 -17.533 -17.786 472 HA VAL 58 HA VAL 58 -11.813 -19.298 -16.860 473 HB VAL 58 HB VAL 58 -11.048 -16.545 -15.877 474 HG11 VAL 58 1HG1 VAL 58 -13.270 -18.198 -15.235 475 HG12 VAL 58 2HG1 VAL 58 -12.183 -18.160 -13.845 476 HG13 VAL 58 3HG1 VAL 58 -12.802 -16.654 -14.523 477 HG21 VAL 58 1HG2 VAL 58 -9.158 -17.851 -15.533 478 HG22 VAL 58 2HG2 VAL 58 -10.027 -18.008 -14.007 479 HG23 VAL 58 3HG2 VAL 58 -10.100 -19.305 -15.201 480 H LEU 59 H LEU 59 -11.750 -16.075 -18.324 481 HA LEU 59 HA LEU 59 -14.577 -15.696 -18.167 482 HB2 LEU 59 2HB LEU 59 -12.261 -14.241 -19.184 483 HB3 LEU 59 3HB LEU 59 -13.705 -14.032 -20.172 484 HG LEU 59 HG LEU 59 -14.918 -13.123 -18.311 485 HD11 LEU 59 1HD1 LEU 59 -14.062 -14.489 -16.522 486 HD12 LEU 59 2HD1 LEU 59 -13.823 -12.789 -16.121 487 HD13 LEU 59 3HD1 LEU 59 -12.463 -13.761 -16.683 488 HD21 LEU 59 1HD2 LEU 59 -12.159 -11.922 -18.523 489 HD22 LEU 59 2HD2 LEU 59 -13.572 -11.116 -17.841 490 HD23 LEU 59 3HD2 LEU 59 -13.546 -11.556 -19.549 491 H SER 60 H SER 60 -12.685 -17.667 -20.074 492 HA SER 60 HA SER 60 -14.082 -17.444 -22.555 493 HB2 SER 60 2HB SER 60 -11.899 -18.335 -22.711 494 HB3 SER 60 3HB SER 60 -12.186 -19.488 -21.408 495 HG SER 60 HG SER 60 -12.773 -20.834 -22.895 496 H ASP 61 H ASP 61 -14.815 -18.867 -19.568 497 HA ASP 61 HA ASP 61 -17.093 -20.266 -20.781 498 HB2 ASP 61 2HB ASP 61 -14.993 -21.688 -19.864 499 HB3 ASP 61 3HB ASP 61 -15.910 -21.522 -18.370 500 H GLU 62 H GLU 62 -18.994 -19.932 -19.779 501 HA GLU 62 HA GLU 62 -19.314 -17.870 -17.935 502 HB2 GLU 62 2HB GLU 62 -21.227 -20.165 -18.391 503 HB3 GLU 62 3HB GLU 62 -21.624 -18.576 -17.752 504 HG2 GLU 62 2HG GLU 62 -20.757 -17.671 -19.983 505 HG3 GLU 62 3HG GLU 62 -20.877 -19.336 -20.549 506 H VAL 63 H VAL 63 -19.177 -21.370 -17.432 507 HA VAL 63 HA VAL 63 -19.807 -21.419 -14.709 508 HB VAL 63 HB VAL 63 -17.880 -23.283 -16.098 509 HG11 VAL 63 1HG1 VAL 63 -19.750 -24.240 -14.030 510 HG12 VAL 63 2HG1 VAL 63 -18.063 -24.666 -14.323 511 HG13 VAL 63 3HG1 VAL 63 -18.461 -23.175 -13.469 512 HG21 VAL 63 1HG2 VAL 63 -19.572 -23.845 -17.433 513 HG22 VAL 63 2HG2 VAL 63 -20.377 -24.496 -16.005 514 HG23 VAL 63 3HG2 VAL 63 -20.709 -22.845 -16.529 515 H LYS 64 H LYS 64 -16.607 -21.333 -16.274 516 HA LYS 64 HA LYS 64 -15.106 -21.189 -13.904 517 HB2 LYS 64 2HB LYS 64 -14.511 -20.330 -16.732 518 HB3 LYS 64 3HB LYS 64 -13.329 -20.193 -15.438 519 HG2 LYS 64 2HG LYS 64 -13.907 -22.737 -15.092 520 HG3 LYS 64 3HG LYS 64 -14.402 -22.615 -16.782 521 HD2 LYS 64 2HD LYS 64 -12.116 -23.305 -16.743 522 HD3 LYS 64 3HD LYS 64 -12.157 -21.623 -17.279 523 HE2 LYS 64 2HE LYS 64 -11.392 -20.835 -15.196 524 HE3 LYS 64 3HE LYS 64 -11.723 -22.374 -14.402 525 HZ1 LYS 64 1HZ LYS 64 -9.332 -21.922 -14.894 526 HZ2 LYS 64 2HZ LYS 64 -9.695 -22.054 -16.541 527 HZ3 LYS 64 3HZ LYS 64 -9.914 -23.384 -15.518 528 H ARG 65 H ARG 65 -16.291 -18.633 -16.068 529 HA ARG 65 HA ARG 65 -15.157 -16.460 -14.715 530 HB2 ARG 65 2HB ARG 65 -16.106 -16.277 -16.965 531 HB3 ARG 65 3HB ARG 65 -17.716 -16.574 -16.322 532 HG2 ARG 65 2HG ARG 65 -17.300 -14.487 -14.881 533 HG3 ARG 65 3HG ARG 65 -15.984 -14.155 -16.010 534 HD2 ARG 65 2HD ARG 65 -17.555 -13.109 -17.219 535 HD3 ARG 65 3HD ARG 65 -18.036 -14.734 -17.706 536 HE ARG 65 HE ARG 65 -19.455 -14.359 -15.452 537 HH11 ARG 65 1HH1 ARG 65 -19.021 -12.419 -18.309 538 HH12 ARG 65 2HH1 ARG 65 -20.592 -11.694 -18.214 539 HH21 ARG 65 1HH2 ARG 65 -21.525 -13.412 -15.315 540 HH22 ARG 65 2HH2 ARG 65 -22.015 -12.259 -16.510 541 H LYS 66 H LYS 66 -18.265 -18.094 -14.290 542 HA LYS 66 HA LYS 66 -19.346 -16.325 -12.389 543 HB2 LYS 66 2HB LYS 66 -19.853 -19.218 -13.035 544 HB3 LYS 66 3HB LYS 66 -20.700 -18.418 -11.719 545 HG2 LYS 66 2HG LYS 66 -20.698 -17.283 -14.492 546 HG3 LYS 66 3HG LYS 66 -21.847 -18.528 -13.998 547 HD2 LYS 66 2HD LYS 66 -23.129 -16.846 -13.275 548 HD3 LYS 66 3HD LYS 66 -21.980 -16.697 -11.943 549 HE2 LYS 66 2HE LYS 66 -20.965 -14.859 -12.845 550 HE3 LYS 66 3HE LYS 66 -21.331 -15.335 -14.503 551 HZ1 LYS 66 1HZ LYS 66 -23.349 -14.337 -12.568 552 HZ2 LYS 66 2HZ LYS 66 -23.590 -14.652 -14.212 553 HZ3 LYS 66 3HZ LYS 66 -22.590 -13.374 -13.734 554 H GLN 67 H GLN 67 -17.341 -19.216 -12.047 555 HA GLN 67 HA GLN 67 -17.449 -19.466 -9.267 556 HB2 GLN 67 2HB GLN 67 -15.342 -20.215 -11.283 557 HB3 GLN 67 3HB GLN 67 -15.152 -20.560 -9.569 558 HG2 GLN 67 2HG GLN 67 -17.430 -21.528 -11.281 559 HG3 GLN 67 3HG GLN 67 -16.005 -22.474 -10.854 560 HE21 GLN 67 1HE2 GLN 67 -18.979 -21.093 -9.725 561 HE22 GLN 67 2HE2 GLN 67 -19.043 -21.941 -8.222 562 H TYR 68 H TYR 68 -15.302 -17.550 -11.323 563 HA TYR 68 HA TYR 68 -13.699 -16.593 -9.163 564 HB2 TYR 68 2HB TYR 68 -12.992 -16.722 -11.587 565 HB3 TYR 68 3HB TYR 68 -14.018 -15.323 -11.885 566 HD1 TYR 68 HD1 TYR 68 -11.116 -16.469 -9.860 567 HD2 TYR 68 HD2 TYR 68 -13.198 -13.160 -11.538 568 HE1 TYR 68 HE1 TYR 68 -9.269 -14.983 -9.206 569 HE2 TYR 68 HE2 TYR 68 -11.356 -11.664 -10.890 570 HH TYR 68 HH TYR 68 -9.509 -11.514 -9.500 571 H ASP 69 H ASP 69 -16.524 -15.401 -10.888 572 HA ASP 69 HA ASP 69 -16.537 -12.798 -9.782 573 HB2 ASP 69 2HB ASP 69 -17.815 -13.249 -11.774 574 HB3 ASP 69 3HB ASP 69 -18.760 -14.483 -10.945 575 H ALA 70 H ALA 70 -17.581 -15.883 -8.596 576 HA ALA 70 HA ALA 70 -19.387 -14.995 -6.611 577 HB1 ALA 70 1HB ALA 70 -18.377 -17.324 -5.600 578 HB2 ALA 70 2HB ALA 70 -19.706 -17.205 -6.754 579 HB3 ALA 70 3HB ALA 70 -18.064 -17.500 -7.326 580 H TYR 71 H TYR 71 -15.899 -15.543 -6.610 581 HA TYR 71 HA TYR 71 -15.769 -14.553 -3.845 582 HB2 TYR 71 2HB TYR 71 -13.552 -15.882 -5.406 583 HB3 TYR 71 3HB TYR 71 -13.618 -15.592 -3.671 584 HD1 TYR 71 HD1 TYR 71 -15.994 -16.617 -2.665 585 HD2 TYR 71 HD2 TYR 71 -13.763 -18.099 -5.971 586 HE1 TYR 71 HE1 TYR 71 -16.983 -18.844 -2.327 587 HE2 TYR 71 HE2 TYR 71 -14.747 -20.329 -5.643 588 HH TYR 71 HH TYR 71 -17.029 -20.959 -2.994 589 H GLY 72 H GLY 72 -16.130 -12.911 -6.298 590 HA2 GLY 72 2HA GLY 72 -13.591 -11.481 -6.498 591 HA3 GLY 72 3HA GLY 72 -15.024 -11.197 -7.475 592 H SER 73 H SER 73 -14.381 -8.923 -6.957 593 HA SER 73 HA SER 73 -15.318 -8.099 -4.294 594 HB2 SER 73 2HB SER 73 -13.969 -6.192 -4.455 595 HB3 SER 73 3HB SER 73 -12.986 -7.435 -5.228 596 HG SER 73 HG SER 73 -12.954 -5.763 -6.627
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