USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 772 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.126 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0104 USER MOD Single : A 3 SER OG : rot 180:sc= -0.013 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 ASN : amide:sc= -0.226 K(o=-0.23,f=-2.3!) USER MOD Single : A 23 CYS SG : rot 180:sc=-0.00138 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 ASN : amide:sc= -0.144 K(o=-0.14,f=-1.2) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.08 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ -157:sc= -0.164 (180deg=-0.94) USER MOD Single : A 46 TYR OH : rot 180:sc= 0.111 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= -0.963 K(o=-0.96,f=-2.1!) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 97:sc= -1.66 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= -0.044 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.211 6.144 21.743 1.00 0.00 N ATOM 2 CA GLY A 1 6.933 7.365 21.007 1.00 0.00 C ATOM 3 C GLY A 1 6.317 8.428 21.920 1.00 0.00 C ATOM 4 O GLY A 1 5.972 8.142 23.065 1.00 0.00 O ATOM 0 H1 GLY A 1 8.237 5.972 21.755 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.865 6.241 22.719 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.731 5.344 21.283 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.855 7.747 20.568 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.253 7.150 20.183 1.00 0.00 H new ATOM 8 N SER A 2 6.200 9.631 21.378 1.00 0.00 N ATOM 9 CA SER A 2 5.632 10.738 22.130 1.00 0.00 C ATOM 10 C SER A 2 5.173 11.839 21.173 1.00 0.00 C ATOM 11 O SER A 2 3.999 12.208 21.163 1.00 0.00 O ATOM 12 CB SER A 2 6.641 11.296 23.136 1.00 0.00 C ATOM 13 OG SER A 2 7.903 11.566 22.532 1.00 0.00 O ATOM 0 H SER A 2 6.488 9.864 20.428 1.00 0.00 H new ATOM 0 HA SER A 2 4.772 10.367 22.687 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.246 12.212 23.576 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.774 10.583 23.950 1.00 0.00 H new ATOM 0 HG SER A 2 8.519 11.922 23.206 1.00 0.00 H new ATOM 19 N SER A 3 6.121 12.334 20.391 1.00 0.00 N ATOM 20 CA SER A 3 5.829 13.386 19.433 1.00 0.00 C ATOM 21 C SER A 3 6.697 13.214 18.185 1.00 0.00 C ATOM 22 O SER A 3 7.800 12.675 18.262 1.00 0.00 O ATOM 23 CB SER A 3 6.051 14.769 20.048 1.00 0.00 C ATOM 24 OG SER A 3 6.151 15.785 19.054 1.00 0.00 O ATOM 0 H SER A 3 7.093 12.025 20.402 1.00 0.00 H new ATOM 0 HA SER A 3 4.779 13.309 19.150 1.00 0.00 H new ATOM 0 HB2 SER A 3 5.228 15.002 20.723 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.961 14.757 20.648 1.00 0.00 H new ATOM 0 HG SER A 3 6.291 16.653 19.487 1.00 0.00 H new ATOM 30 N GLY A 4 6.167 13.681 17.065 1.00 0.00 N ATOM 31 CA GLY A 4 6.880 13.586 15.802 1.00 0.00 C ATOM 32 C GLY A 4 6.546 14.770 14.893 1.00 0.00 C ATOM 33 O GLY A 4 5.520 15.424 15.071 1.00 0.00 O ATOM 0 H GLY A 4 5.251 14.127 17.005 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.954 13.557 15.988 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.618 12.654 15.302 1.00 0.00 H new ATOM 37 N SER A 5 7.432 15.009 13.937 1.00 0.00 N ATOM 38 CA SER A 5 7.244 16.103 12.999 1.00 0.00 C ATOM 39 C SER A 5 8.004 15.817 11.703 1.00 0.00 C ATOM 40 O SER A 5 9.231 15.733 11.704 1.00 0.00 O ATOM 41 CB SER A 5 7.704 17.431 13.603 1.00 0.00 C ATOM 42 OG SER A 5 7.177 18.550 12.895 1.00 0.00 O ATOM 0 H SER A 5 8.282 14.464 13.792 1.00 0.00 H new ATOM 0 HA SER A 5 6.180 16.185 12.778 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.392 17.482 14.646 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.793 17.476 13.593 1.00 0.00 H new ATOM 0 HG SER A 5 7.492 19.379 13.312 1.00 0.00 H new ATOM 48 N SER A 6 7.244 15.675 10.627 1.00 0.00 N ATOM 49 CA SER A 6 7.830 15.401 9.326 1.00 0.00 C ATOM 50 C SER A 6 6.948 15.984 8.221 1.00 0.00 C ATOM 51 O SER A 6 5.739 16.123 8.395 1.00 0.00 O ATOM 52 CB SER A 6 8.022 13.898 9.115 1.00 0.00 C ATOM 53 OG SER A 6 9.391 13.515 9.216 1.00 0.00 O ATOM 0 H SER A 6 6.226 15.745 10.630 1.00 0.00 H new ATOM 0 HA SER A 6 8.811 15.875 9.286 1.00 0.00 H new ATOM 0 HB2 SER A 6 7.437 13.351 9.854 1.00 0.00 H new ATOM 0 HB3 SER A 6 7.639 13.618 8.134 1.00 0.00 H new ATOM 0 HG SER A 6 9.471 12.548 9.077 1.00 0.00 H new ATOM 59 N GLY A 7 7.588 16.310 7.107 1.00 0.00 N ATOM 60 CA GLY A 7 6.877 16.875 5.974 1.00 0.00 C ATOM 61 C GLY A 7 7.566 16.511 4.657 1.00 0.00 C ATOM 62 O GLY A 7 8.794 16.498 4.578 1.00 0.00 O ATOM 0 H GLY A 7 8.591 16.193 6.966 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.850 16.509 5.965 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.828 17.959 6.075 1.00 0.00 H new ATOM 66 N MET A 8 6.747 16.225 3.656 1.00 0.00 N ATOM 67 CA MET A 8 7.262 15.862 2.347 1.00 0.00 C ATOM 68 C MET A 8 6.160 15.922 1.288 1.00 0.00 C ATOM 69 O MET A 8 5.056 15.425 1.507 1.00 0.00 O ATOM 70 CB MET A 8 7.843 14.448 2.401 1.00 0.00 C ATOM 71 CG MET A 8 9.118 14.346 1.562 1.00 0.00 C ATOM 72 SD MET A 8 9.669 12.649 1.493 1.00 0.00 S ATOM 73 CE MET A 8 9.605 12.374 -0.270 1.00 0.00 C ATOM 0 H MET A 8 5.729 16.237 3.725 1.00 0.00 H new ATOM 0 HA MET A 8 8.041 16.574 2.074 1.00 0.00 H new ATOM 0 HB2 MET A 8 8.061 14.180 3.435 1.00 0.00 H new ATOM 0 HB3 MET A 8 7.105 13.734 2.036 1.00 0.00 H new ATOM 0 HG2 MET A 8 8.931 14.718 0.554 1.00 0.00 H new ATOM 0 HG3 MET A 8 9.898 14.973 1.993 1.00 0.00 H new ATOM 0 HE1 MET A 8 9.920 11.354 -0.491 1.00 0.00 H new ATOM 0 HE2 MET A 8 8.585 12.523 -0.625 1.00 0.00 H new ATOM 0 HE3 MET A 8 10.270 13.076 -0.772 1.00 0.00 H new ATOM 83 N SER A 9 6.498 16.534 0.162 1.00 0.00 N ATOM 84 CA SER A 9 5.550 16.666 -0.932 1.00 0.00 C ATOM 85 C SER A 9 5.869 15.644 -2.025 1.00 0.00 C ATOM 86 O SER A 9 7.019 15.240 -2.186 1.00 0.00 O ATOM 87 CB SER A 9 5.567 18.083 -1.508 1.00 0.00 C ATOM 88 OG SER A 9 4.581 18.259 -2.521 1.00 0.00 O ATOM 0 H SER A 9 7.415 16.944 -0.016 1.00 0.00 H new ATOM 0 HA SER A 9 4.550 16.474 -0.544 1.00 0.00 H new ATOM 0 HB2 SER A 9 5.396 18.802 -0.707 1.00 0.00 H new ATOM 0 HB3 SER A 9 6.553 18.295 -1.921 1.00 0.00 H new ATOM 0 HG SER A 9 4.623 19.177 -2.862 1.00 0.00 H new ATOM 94 N GLY A 10 4.829 15.256 -2.749 1.00 0.00 N ATOM 95 CA GLY A 10 4.984 14.289 -3.822 1.00 0.00 C ATOM 96 C GLY A 10 3.889 13.222 -3.761 1.00 0.00 C ATOM 97 O GLY A 10 3.412 12.878 -2.681 1.00 0.00 O ATOM 0 H GLY A 10 3.876 15.594 -2.613 1.00 0.00 H new ATOM 0 HA2 GLY A 10 4.946 14.799 -4.784 1.00 0.00 H new ATOM 0 HA3 GLY A 10 5.963 13.815 -3.751 1.00 0.00 H new ATOM 101 N GLY A 11 3.522 12.728 -4.935 1.00 0.00 N ATOM 102 CA GLY A 11 2.493 11.707 -5.028 1.00 0.00 C ATOM 103 C GLY A 11 1.770 11.779 -6.375 1.00 0.00 C ATOM 104 O GLY A 11 1.417 12.863 -6.837 1.00 0.00 O ATOM 0 H GLY A 11 3.919 13.016 -5.829 1.00 0.00 H new ATOM 0 HA2 GLY A 11 2.941 10.721 -4.904 1.00 0.00 H new ATOM 0 HA3 GLY A 11 1.775 11.835 -4.218 1.00 0.00 H new ATOM 108 N GLY A 12 1.572 10.611 -6.967 1.00 0.00 N ATOM 109 CA GLY A 12 0.898 10.527 -8.252 1.00 0.00 C ATOM 110 C GLY A 12 0.875 9.087 -8.767 1.00 0.00 C ATOM 111 O GLY A 12 1.844 8.348 -8.598 1.00 0.00 O ATOM 0 H GLY A 12 1.867 9.714 -6.581 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -0.122 10.899 -8.156 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.404 11.167 -8.975 1.00 0.00 H new ATOM 115 N VAL A 13 -0.241 8.731 -9.386 1.00 0.00 N ATOM 116 CA VAL A 13 -0.403 7.392 -9.927 1.00 0.00 C ATOM 117 C VAL A 13 -0.711 7.485 -11.422 1.00 0.00 C ATOM 118 O VAL A 13 -1.411 8.397 -11.860 1.00 0.00 O ATOM 119 CB VAL A 13 -1.476 6.636 -9.141 1.00 0.00 C ATOM 120 CG1 VAL A 13 -2.860 7.244 -9.379 1.00 0.00 C ATOM 121 CG2 VAL A 13 -1.463 5.146 -9.490 1.00 0.00 C ATOM 0 H VAL A 13 -1.042 9.347 -9.525 1.00 0.00 H new ATOM 0 HA VAL A 13 0.520 6.823 -9.820 1.00 0.00 H new ATOM 0 HB VAL A 13 -1.246 6.733 -8.080 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.604 6.688 -8.809 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.860 8.286 -9.057 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -3.103 7.192 -10.440 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -2.235 4.632 -8.918 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.656 5.020 -10.555 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -0.488 4.724 -9.246 1.00 0.00 H new ATOM 131 N ILE A 14 -0.173 6.529 -12.165 1.00 0.00 N ATOM 132 CA ILE A 14 -0.382 6.491 -13.603 1.00 0.00 C ATOM 133 C ILE A 14 -1.792 5.973 -13.896 1.00 0.00 C ATOM 134 O ILE A 14 -2.405 5.322 -13.051 1.00 0.00 O ATOM 135 CB ILE A 14 0.724 5.683 -14.284 1.00 0.00 C ATOM 136 CG1 ILE A 14 0.680 5.865 -15.803 1.00 0.00 C ATOM 137 CG2 ILE A 14 0.653 4.208 -13.881 1.00 0.00 C ATOM 138 CD1 ILE A 14 1.962 5.343 -16.454 1.00 0.00 C ATOM 0 H ILE A 14 0.407 5.775 -11.798 1.00 0.00 H new ATOM 0 HA ILE A 14 -0.317 7.494 -14.024 1.00 0.00 H new ATOM 0 HB ILE A 14 1.686 6.064 -13.942 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -0.181 5.336 -16.212 1.00 0.00 H new ATOM 0 HG13 ILE A 14 0.549 6.920 -16.043 1.00 0.00 H new ATOM 0 HG21 ILE A 14 1.450 3.656 -14.379 1.00 0.00 H new ATOM 0 HG22 ILE A 14 0.770 4.120 -12.801 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -0.312 3.796 -14.176 1.00 0.00 H new ATOM 0 HD11 ILE A 14 1.905 5.484 -17.533 1.00 0.00 H new ATOM 0 HD12 ILE A 14 2.819 5.890 -16.061 1.00 0.00 H new ATOM 0 HD13 ILE A 14 2.077 4.282 -16.232 1.00 0.00 H new ATOM 150 N ARG A 15 -2.264 6.282 -15.094 1.00 0.00 N ATOM 151 CA ARG A 15 -3.590 5.855 -15.509 1.00 0.00 C ATOM 152 C ARG A 15 -3.790 4.370 -15.202 1.00 0.00 C ATOM 153 O ARG A 15 -2.825 3.649 -14.953 1.00 0.00 O ATOM 154 CB ARG A 15 -3.802 6.093 -17.005 1.00 0.00 C ATOM 155 CG ARG A 15 -3.132 4.996 -17.835 1.00 0.00 C ATOM 156 CD ARG A 15 -3.251 5.291 -19.332 1.00 0.00 C ATOM 157 NE ARG A 15 -2.574 6.568 -19.652 1.00 0.00 N ATOM 158 CZ ARG A 15 -3.159 7.770 -19.566 1.00 0.00 C ATOM 159 NH1 ARG A 15 -4.435 7.868 -19.170 1.00 0.00 N ATOM 160 NH2 ARG A 15 -2.467 8.875 -19.876 1.00 0.00 N ATOM 0 H ARG A 15 -1.752 6.823 -15.791 1.00 0.00 H new ATOM 0 HA ARG A 15 -4.318 6.445 -14.952 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -4.869 6.120 -17.225 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -3.395 7.065 -17.284 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -2.081 4.917 -17.559 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -3.593 4.034 -17.613 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -2.805 4.480 -19.907 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -4.301 5.345 -19.618 1.00 0.00 H new ATOM 0 HE ARG A 15 -1.601 6.530 -19.957 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -4.962 7.027 -18.934 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -4.880 8.784 -19.105 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -1.495 8.801 -20.177 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -2.912 9.790 -19.811 1.00 0.00 H new ATOM 174 N GLY A 16 -5.048 3.957 -15.231 1.00 0.00 N ATOM 175 CA GLY A 16 -5.387 2.570 -14.959 1.00 0.00 C ATOM 176 C GLY A 16 -6.851 2.286 -15.301 1.00 0.00 C ATOM 177 O GLY A 16 -7.672 3.202 -15.341 1.00 0.00 O ATOM 0 H GLY A 16 -5.845 4.558 -15.439 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -4.740 1.913 -15.540 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -5.206 2.347 -13.908 1.00 0.00 H new ATOM 181 N PRO A 17 -7.141 0.980 -15.546 1.00 0.00 N ATOM 182 CA PRO A 17 -8.492 0.564 -15.883 1.00 0.00 C ATOM 183 C PRO A 17 -9.392 0.569 -14.646 1.00 0.00 C ATOM 184 O PRO A 17 -8.947 0.910 -13.551 1.00 0.00 O ATOM 185 CB PRO A 17 -8.336 -0.816 -16.499 1.00 0.00 C ATOM 186 CG PRO A 17 -6.969 -1.316 -16.063 1.00 0.00 C ATOM 187 CD PRO A 17 -6.195 -0.131 -15.508 1.00 0.00 C ATOM 0 HA PRO A 17 -8.980 1.244 -16.581 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -9.124 -1.487 -16.158 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -8.406 -0.769 -17.586 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -7.070 -2.094 -15.306 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -6.438 -1.758 -16.906 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -5.851 -0.324 -14.492 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -5.311 0.081 -16.109 1.00 0.00 H new ATOM 195 N ALA A 18 -10.642 0.186 -14.862 1.00 0.00 N ATOM 196 CA ALA A 18 -11.609 0.141 -13.778 1.00 0.00 C ATOM 197 C ALA A 18 -11.783 -1.306 -13.315 1.00 0.00 C ATOM 198 O ALA A 18 -11.248 -2.227 -13.930 1.00 0.00 O ATOM 199 CB ALA A 18 -12.925 0.768 -14.242 1.00 0.00 C ATOM 0 H ALA A 18 -11.007 -0.096 -15.772 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.256 0.719 -12.924 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.651 0.734 -13.429 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -12.752 1.805 -14.531 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.311 0.212 -15.096 1.00 0.00 H new ATOM 205 N GLY A 19 -12.535 -1.462 -12.235 1.00 0.00 N ATOM 206 CA GLY A 19 -12.786 -2.783 -11.683 1.00 0.00 C ATOM 207 C GLY A 19 -13.825 -2.719 -10.561 1.00 0.00 C ATOM 208 O GLY A 19 -14.227 -1.634 -10.143 1.00 0.00 O ATOM 0 H GLY A 19 -12.978 -0.696 -11.728 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -13.137 -3.450 -12.471 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -11.856 -3.204 -11.299 1.00 0.00 H new ATOM 212 N ASN A 20 -14.230 -3.895 -10.105 1.00 0.00 N ATOM 213 CA ASN A 20 -15.213 -3.987 -9.040 1.00 0.00 C ATOM 214 C ASN A 20 -14.537 -3.689 -7.700 1.00 0.00 C ATOM 215 O ASN A 20 -13.755 -4.497 -7.202 1.00 0.00 O ATOM 216 CB ASN A 20 -15.814 -5.391 -8.964 1.00 0.00 C ATOM 217 CG ASN A 20 -17.255 -5.400 -9.478 1.00 0.00 C ATOM 218 OD1 ASN A 20 -18.206 -5.581 -8.735 1.00 0.00 O ATOM 219 ND2 ASN A 20 -17.363 -5.195 -10.788 1.00 0.00 N ATOM 0 H ASN A 20 -13.895 -4.793 -10.454 1.00 0.00 H new ATOM 0 HA ASN A 20 -16.004 -3.267 -9.249 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -15.210 -6.081 -9.553 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -15.790 -5.745 -7.934 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -18.283 -5.183 -11.228 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -16.526 -5.050 -11.352 1.00 0.00 H new ATOM 226 N ASN A 21 -14.863 -2.526 -7.154 1.00 0.00 N ATOM 227 CA ASN A 21 -14.297 -2.112 -5.882 1.00 0.00 C ATOM 228 C ASN A 21 -12.771 -2.187 -5.959 1.00 0.00 C ATOM 229 O ASN A 21 -12.219 -2.674 -6.944 1.00 0.00 O ATOM 230 CB ASN A 21 -14.759 -3.030 -4.748 1.00 0.00 C ATOM 231 CG ASN A 21 -16.052 -2.511 -4.115 1.00 0.00 C ATOM 232 OD1 ASN A 21 -16.423 -1.358 -4.255 1.00 0.00 O ATOM 233 ND2 ASN A 21 -16.714 -3.426 -3.413 1.00 0.00 N ATOM 0 H ASN A 21 -15.512 -1.858 -7.570 1.00 0.00 H new ATOM 0 HA ASN A 21 -14.631 -1.094 -5.680 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -14.917 -4.038 -5.132 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -13.980 -3.097 -3.989 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -17.589 -3.179 -2.951 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -16.346 -4.374 -3.336 1.00 0.00 H new ATOM 240 N ASP A 22 -12.132 -1.698 -4.906 1.00 0.00 N ATOM 241 CA ASP A 22 -10.680 -1.704 -4.842 1.00 0.00 C ATOM 242 C ASP A 22 -10.228 -2.605 -3.692 1.00 0.00 C ATOM 243 O ASP A 22 -10.374 -2.247 -2.524 1.00 0.00 O ATOM 244 CB ASP A 22 -10.135 -0.298 -4.584 1.00 0.00 C ATOM 245 CG ASP A 22 -10.558 0.758 -5.607 1.00 0.00 C ATOM 246 OD1 ASP A 22 -11.666 1.309 -5.429 1.00 0.00 O ATOM 247 OD2 ASP A 22 -9.764 0.990 -6.544 1.00 0.00 O ATOM 0 H ASP A 22 -12.593 -1.295 -4.090 1.00 0.00 H new ATOM 0 HA ASP A 22 -10.302 -2.068 -5.797 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -10.460 0.025 -3.595 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -9.046 -0.345 -4.562 1.00 0.00 H new ATOM 252 N CYS A 23 -9.689 -3.758 -4.062 1.00 0.00 N ATOM 253 CA CYS A 23 -9.215 -4.713 -3.075 1.00 0.00 C ATOM 254 C CYS A 23 -7.708 -4.513 -2.898 1.00 0.00 C ATOM 255 O CYS A 23 -7.128 -4.976 -1.917 1.00 0.00 O ATOM 256 CB CYS A 23 -9.558 -6.151 -3.470 1.00 0.00 C ATOM 257 SG CYS A 23 -11.364 -6.320 -3.712 1.00 0.00 S ATOM 0 H CYS A 23 -9.570 -4.052 -5.031 1.00 0.00 H new ATOM 0 HA CYS A 23 -9.718 -4.537 -2.124 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -9.033 -6.420 -4.387 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -9.221 -6.840 -2.696 1.00 0.00 H new ATOM 0 HG CYS A 23 -11.644 -7.544 -4.049 1.00 0.00 H new ATOM 263 N ARG A 24 -7.118 -3.823 -3.863 1.00 0.00 N ATOM 264 CA ARG A 24 -5.690 -3.556 -3.826 1.00 0.00 C ATOM 265 C ARG A 24 -5.432 -2.105 -3.416 1.00 0.00 C ATOM 266 O ARG A 24 -5.780 -1.179 -4.147 1.00 0.00 O ATOM 267 CB ARG A 24 -5.046 -3.817 -5.188 1.00 0.00 C ATOM 268 CG ARG A 24 -5.365 -5.229 -5.685 1.00 0.00 C ATOM 269 CD ARG A 24 -5.884 -5.200 -7.123 1.00 0.00 C ATOM 270 NE ARG A 24 -4.749 -5.133 -8.070 1.00 0.00 N ATOM 271 CZ ARG A 24 -4.876 -5.215 -9.402 1.00 0.00 C ATOM 272 NH1 ARG A 24 -6.088 -5.367 -9.952 1.00 0.00 N ATOM 273 NH2 ARG A 24 -3.790 -5.144 -10.184 1.00 0.00 N ATOM 0 H ARG A 24 -7.603 -3.441 -4.675 1.00 0.00 H new ATOM 0 HA ARG A 24 -5.245 -4.228 -3.092 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -5.405 -3.084 -5.910 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -3.966 -3.689 -5.114 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -4.470 -5.848 -5.630 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.110 -5.687 -5.035 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -6.481 -6.090 -7.321 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -6.538 -4.340 -7.265 1.00 0.00 H new ATOM 0 HE ARG A 24 -3.811 -5.017 -7.685 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -6.915 -5.420 -9.357 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -6.184 -5.429 -10.966 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -2.867 -5.028 -9.766 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -3.886 -5.206 -11.198 1.00 0.00 H new ATOM 287 N ILE A 25 -4.823 -1.952 -2.250 1.00 0.00 N ATOM 288 CA ILE A 25 -4.514 -0.629 -1.734 1.00 0.00 C ATOM 289 C ILE A 25 -3.026 -0.339 -1.944 1.00 0.00 C ATOM 290 O ILE A 25 -2.200 -1.249 -1.890 1.00 0.00 O ATOM 291 CB ILE A 25 -4.966 -0.502 -0.278 1.00 0.00 C ATOM 292 CG1 ILE A 25 -4.328 -1.587 0.591 1.00 0.00 C ATOM 293 CG2 ILE A 25 -6.493 -0.509 -0.176 1.00 0.00 C ATOM 294 CD1 ILE A 25 -4.555 -1.303 2.077 1.00 0.00 C ATOM 0 H ILE A 25 -4.535 -2.723 -1.647 1.00 0.00 H new ATOM 0 HA ILE A 25 -5.068 0.133 -2.283 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.622 0.459 0.104 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -4.750 -2.559 0.334 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -3.259 -1.640 0.386 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -6.788 -0.418 0.869 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -6.899 0.329 -0.743 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -6.880 -1.443 -0.582 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -4.091 -2.089 2.673 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.111 -0.342 2.336 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -5.625 -1.275 2.283 1.00 0.00 H new ATOM 306 N TYR A 26 -2.730 0.931 -2.177 1.00 0.00 N ATOM 307 CA TYR A 26 -1.357 1.351 -2.395 1.00 0.00 C ATOM 308 C TYR A 26 -0.851 2.200 -1.227 1.00 0.00 C ATOM 309 O TYR A 26 -1.505 3.162 -0.826 1.00 0.00 O ATOM 310 CB TYR A 26 -1.373 2.208 -3.663 1.00 0.00 C ATOM 311 CG TYR A 26 -0.161 3.129 -3.807 1.00 0.00 C ATOM 312 CD1 TYR A 26 -0.095 4.303 -3.085 1.00 0.00 C ATOM 313 CD2 TYR A 26 0.869 2.786 -4.661 1.00 0.00 C ATOM 314 CE1 TYR A 26 1.046 5.170 -3.221 1.00 0.00 C ATOM 315 CE2 TYR A 26 2.010 3.653 -4.797 1.00 0.00 C ATOM 316 CZ TYR A 26 2.043 4.802 -4.070 1.00 0.00 C ATOM 317 OH TYR A 26 3.121 5.621 -4.199 1.00 0.00 O ATOM 0 H TYR A 26 -3.418 1.683 -2.220 1.00 0.00 H new ATOM 0 HA TYR A 26 -0.701 0.485 -2.484 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -1.423 1.552 -4.532 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -2.279 2.814 -3.668 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -0.900 4.572 -2.417 1.00 0.00 H new ATOM 0 HD2 TYR A 26 0.818 1.867 -5.227 1.00 0.00 H new ATOM 0 HE1 TYR A 26 1.109 6.092 -2.662 1.00 0.00 H new ATOM 0 HE2 TYR A 26 2.822 3.397 -5.462 1.00 0.00 H new ATOM 0 HH TYR A 26 3.754 5.231 -4.838 1.00 0.00 H new ATOM 327 N VAL A 27 0.307 1.814 -0.713 1.00 0.00 N ATOM 328 CA VAL A 27 0.907 2.527 0.401 1.00 0.00 C ATOM 329 C VAL A 27 2.135 3.295 -0.092 1.00 0.00 C ATOM 330 O VAL A 27 2.966 2.746 -0.815 1.00 0.00 O ATOM 331 CB VAL A 27 1.228 1.552 1.536 1.00 0.00 C ATOM 332 CG1 VAL A 27 1.771 2.293 2.759 1.00 0.00 C ATOM 333 CG2 VAL A 27 0.001 0.714 1.902 1.00 0.00 C ATOM 0 H VAL A 27 0.846 1.016 -1.048 1.00 0.00 H new ATOM 0 HA VAL A 27 0.207 3.258 0.807 1.00 0.00 H new ATOM 0 HB VAL A 27 2.005 0.873 1.185 1.00 0.00 H new ATOM 0 HG11 VAL A 27 1.991 1.577 3.551 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.683 2.825 2.487 1.00 0.00 H new ATOM 0 HG13 VAL A 27 1.027 3.007 3.112 1.00 0.00 H new ATOM 0 HG21 VAL A 27 0.256 0.029 2.711 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.806 1.372 2.224 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.322 0.143 1.032 1.00 0.00 H new ATOM 343 N GLY A 28 2.211 4.553 0.317 1.00 0.00 N ATOM 344 CA GLY A 28 3.324 5.401 -0.075 1.00 0.00 C ATOM 345 C GLY A 28 3.894 6.149 1.132 1.00 0.00 C ATOM 346 O GLY A 28 3.391 6.013 2.246 1.00 0.00 O ATOM 0 H GLY A 28 1.520 5.005 0.916 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.105 4.794 -0.533 1.00 0.00 H new ATOM 0 HA3 GLY A 28 2.993 6.116 -0.828 1.00 0.00 H new ATOM 350 N ASN A 29 4.936 6.924 0.869 1.00 0.00 N ATOM 351 CA ASN A 29 5.580 7.694 1.919 1.00 0.00 C ATOM 352 C ASN A 29 6.136 6.740 2.978 1.00 0.00 C ATOM 353 O ASN A 29 6.192 7.081 4.159 1.00 0.00 O ATOM 354 CB ASN A 29 4.584 8.632 2.604 1.00 0.00 C ATOM 355 CG ASN A 29 5.269 9.921 3.061 1.00 0.00 C ATOM 356 OD1 ASN A 29 6.484 10.025 3.112 1.00 0.00 O ATOM 357 ND2 ASN A 29 4.426 10.895 3.390 1.00 0.00 N ATOM 0 H ASN A 29 5.350 7.035 -0.056 1.00 0.00 H new ATOM 0 HA ASN A 29 6.377 8.283 1.464 1.00 0.00 H new ATOM 0 HB2 ASN A 29 3.773 8.871 1.917 1.00 0.00 H new ATOM 0 HB3 ASN A 29 4.137 8.130 3.462 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.786 11.795 3.708 1.00 0.00 H new ATOM 0 HD22 ASN A 29 3.420 10.742 3.325 1.00 0.00 H new ATOM 364 N LEU A 30 6.532 5.563 2.518 1.00 0.00 N ATOM 365 CA LEU A 30 7.082 4.556 3.411 1.00 0.00 C ATOM 366 C LEU A 30 8.548 4.884 3.701 1.00 0.00 C ATOM 367 O LEU A 30 9.182 5.623 2.951 1.00 0.00 O ATOM 368 CB LEU A 30 6.867 3.155 2.835 1.00 0.00 C ATOM 369 CG LEU A 30 5.446 2.597 2.940 1.00 0.00 C ATOM 370 CD1 LEU A 30 5.189 1.543 1.862 1.00 0.00 C ATOM 371 CD2 LEU A 30 5.171 2.058 4.346 1.00 0.00 C ATOM 0 H LEU A 30 6.483 5.283 1.538 1.00 0.00 H new ATOM 0 HA LEU A 30 6.558 4.566 4.367 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.154 3.168 1.784 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.544 2.468 3.342 1.00 0.00 H new ATOM 0 HG LEU A 30 4.745 3.413 2.765 1.00 0.00 H new ATOM 0 HD11 LEU A 30 4.172 1.163 1.960 1.00 0.00 H new ATOM 0 HD12 LEU A 30 5.316 1.992 0.877 1.00 0.00 H new ATOM 0 HD13 LEU A 30 5.896 0.722 1.980 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.154 1.667 4.394 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.877 1.260 4.574 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.285 2.862 5.073 1.00 0.00 H new ATOM 383 N PRO A 31 9.056 4.302 4.820 1.00 0.00 N ATOM 384 CA PRO A 31 10.435 4.524 5.219 1.00 0.00 C ATOM 385 C PRO A 31 11.397 3.734 4.329 1.00 0.00 C ATOM 386 O PRO A 31 10.977 2.847 3.588 1.00 0.00 O ATOM 387 CB PRO A 31 10.495 4.105 6.678 1.00 0.00 C ATOM 388 CG PRO A 31 9.273 3.232 6.912 1.00 0.00 C ATOM 389 CD PRO A 31 8.333 3.420 5.732 1.00 0.00 C ATOM 0 HA PRO A 31 10.744 5.563 5.105 1.00 0.00 H new ATOM 0 HB2 PRO A 31 11.413 3.557 6.889 1.00 0.00 H new ATOM 0 HB3 PRO A 31 10.485 4.975 7.335 1.00 0.00 H new ATOM 0 HG2 PRO A 31 9.564 2.186 7.006 1.00 0.00 H new ATOM 0 HG3 PRO A 31 8.778 3.510 7.843 1.00 0.00 H new ATOM 0 HD2 PRO A 31 8.097 2.467 5.258 1.00 0.00 H new ATOM 0 HD3 PRO A 31 7.388 3.863 6.045 1.00 0.00 H new ATOM 397 N PRO A 32 12.704 4.094 4.435 1.00 0.00 N ATOM 398 CA PRO A 32 13.730 3.428 3.649 1.00 0.00 C ATOM 399 C PRO A 32 14.032 2.037 4.208 1.00 0.00 C ATOM 400 O PRO A 32 14.435 1.141 3.468 1.00 0.00 O ATOM 401 CB PRO A 32 14.929 4.361 3.697 1.00 0.00 C ATOM 402 CG PRO A 32 14.693 5.283 4.882 1.00 0.00 C ATOM 403 CD PRO A 32 13.239 5.140 5.302 1.00 0.00 C ATOM 0 HA PRO A 32 13.422 3.250 2.619 1.00 0.00 H new ATOM 0 HB2 PRO A 32 15.856 3.800 3.817 1.00 0.00 H new ATOM 0 HB3 PRO A 32 15.019 4.930 2.771 1.00 0.00 H new ATOM 0 HG2 PRO A 32 15.356 5.022 5.707 1.00 0.00 H new ATOM 0 HG3 PRO A 32 14.912 6.316 4.612 1.00 0.00 H new ATOM 0 HD2 PRO A 32 13.156 4.864 6.353 1.00 0.00 H new ATOM 0 HD3 PRO A 32 12.696 6.076 5.174 1.00 0.00 H new ATOM 411 N ASP A 33 13.825 1.899 5.510 1.00 0.00 N ATOM 412 CA ASP A 33 14.070 0.631 6.176 1.00 0.00 C ATOM 413 C ASP A 33 12.732 -0.026 6.520 1.00 0.00 C ATOM 414 O ASP A 33 12.515 -0.443 7.657 1.00 0.00 O ATOM 415 CB ASP A 33 14.845 0.835 7.480 1.00 0.00 C ATOM 416 CG ASP A 33 15.776 -0.316 7.865 1.00 0.00 C ATOM 417 OD1 ASP A 33 15.277 -1.462 7.898 1.00 0.00 O ATOM 418 OD2 ASP A 33 16.964 -0.024 8.120 1.00 0.00 O ATOM 0 H ASP A 33 13.491 2.644 6.121 1.00 0.00 H new ATOM 0 HA ASP A 33 14.654 0.004 5.503 1.00 0.00 H new ATOM 0 HB2 ASP A 33 15.435 1.747 7.395 1.00 0.00 H new ATOM 0 HB3 ASP A 33 14.131 0.991 8.289 1.00 0.00 H new ATOM 423 N ILE A 34 11.869 -0.099 5.517 1.00 0.00 N ATOM 424 CA ILE A 34 10.559 -0.699 5.699 1.00 0.00 C ATOM 425 C ILE A 34 10.602 -2.158 5.241 1.00 0.00 C ATOM 426 O ILE A 34 11.445 -2.533 4.427 1.00 0.00 O ATOM 427 CB ILE A 34 9.486 0.134 4.994 1.00 0.00 C ATOM 428 CG1 ILE A 34 8.084 -0.284 5.444 1.00 0.00 C ATOM 429 CG2 ILE A 34 9.646 0.062 3.474 1.00 0.00 C ATOM 430 CD1 ILE A 34 7.804 0.184 6.873 1.00 0.00 C ATOM 0 H ILE A 34 12.052 0.248 4.575 1.00 0.00 H new ATOM 0 HA ILE A 34 10.286 -0.703 6.754 1.00 0.00 H new ATOM 0 HB ILE A 34 9.619 1.177 5.282 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.340 0.137 4.767 1.00 0.00 H new ATOM 0 HG13 ILE A 34 7.988 -1.368 5.387 1.00 0.00 H new ATOM 0 HG21 ILE A 34 8.871 0.663 2.998 1.00 0.00 H new ATOM 0 HG22 ILE A 34 10.627 0.446 3.193 1.00 0.00 H new ATOM 0 HG23 ILE A 34 9.554 -0.974 3.147 1.00 0.00 H new ATOM 0 HD11 ILE A 34 6.801 -0.126 7.168 1.00 0.00 H new ATOM 0 HD12 ILE A 34 8.534 -0.258 7.550 1.00 0.00 H new ATOM 0 HD13 ILE A 34 7.876 1.271 6.921 1.00 0.00 H new ATOM 442 N ARG A 35 9.684 -2.943 5.785 1.00 0.00 N ATOM 443 CA ARG A 35 9.607 -4.353 5.443 1.00 0.00 C ATOM 444 C ARG A 35 8.169 -4.736 5.089 1.00 0.00 C ATOM 445 O ARG A 35 7.228 -4.318 5.763 1.00 0.00 O ATOM 446 CB ARG A 35 10.090 -5.228 6.601 1.00 0.00 C ATOM 447 CG ARG A 35 11.619 -5.277 6.651 1.00 0.00 C ATOM 448 CD ARG A 35 12.124 -6.718 6.555 1.00 0.00 C ATOM 449 NE ARG A 35 13.358 -6.876 7.358 1.00 0.00 N ATOM 450 CZ ARG A 35 13.906 -8.059 7.668 1.00 0.00 C ATOM 451 NH1 ARG A 35 13.334 -9.194 7.244 1.00 0.00 N ATOM 452 NH2 ARG A 35 15.026 -8.106 8.402 1.00 0.00 N ATOM 0 H ARG A 35 8.987 -2.629 6.460 1.00 0.00 H new ATOM 0 HA ARG A 35 10.254 -4.521 4.582 1.00 0.00 H new ATOM 0 HB2 ARG A 35 9.704 -4.837 7.542 1.00 0.00 H new ATOM 0 HB3 ARG A 35 9.694 -6.237 6.489 1.00 0.00 H new ATOM 0 HG2 ARG A 35 12.032 -4.688 5.833 1.00 0.00 H new ATOM 0 HG3 ARG A 35 11.971 -4.825 7.579 1.00 0.00 H new ATOM 0 HD2 ARG A 35 11.357 -7.405 6.912 1.00 0.00 H new ATOM 0 HD3 ARG A 35 12.322 -6.974 5.514 1.00 0.00 H new ATOM 0 HE ARG A 35 13.820 -6.032 7.696 1.00 0.00 H new ATOM 0 HH11 ARG A 35 12.481 -9.158 6.685 1.00 0.00 H new ATOM 0 HH12 ARG A 35 13.751 -10.094 7.480 1.00 0.00 H new ATOM 0 HH21 ARG A 35 15.461 -7.242 8.725 1.00 0.00 H new ATOM 0 HH22 ARG A 35 15.444 -9.006 8.638 1.00 0.00 H new ATOM 466 N THR A 36 8.043 -5.527 4.033 1.00 0.00 N ATOM 467 CA THR A 36 6.735 -5.971 3.582 1.00 0.00 C ATOM 468 C THR A 36 5.930 -6.535 4.754 1.00 0.00 C ATOM 469 O THR A 36 4.763 -6.191 4.934 1.00 0.00 O ATOM 470 CB THR A 36 6.942 -6.976 2.447 1.00 0.00 C ATOM 471 OG1 THR A 36 7.980 -6.400 1.659 1.00 0.00 O ATOM 472 CG2 THR A 36 5.745 -7.041 1.497 1.00 0.00 C ATOM 0 H THR A 36 8.825 -5.872 3.477 1.00 0.00 H new ATOM 0 HA THR A 36 6.147 -5.139 3.195 1.00 0.00 H new ATOM 0 HB THR A 36 7.126 -7.965 2.867 1.00 0.00 H new ATOM 0 HG1 THR A 36 8.180 -6.988 0.901 1.00 0.00 H new ATOM 0 HG21 THR A 36 5.944 -7.769 0.710 1.00 0.00 H new ATOM 0 HG22 THR A 36 4.856 -7.340 2.052 1.00 0.00 H new ATOM 0 HG23 THR A 36 5.581 -6.060 1.051 1.00 0.00 H new ATOM 480 N LYS A 37 6.585 -7.394 5.522 1.00 0.00 N ATOM 481 CA LYS A 37 5.945 -8.010 6.672 1.00 0.00 C ATOM 482 C LYS A 37 5.396 -6.917 7.591 1.00 0.00 C ATOM 483 O LYS A 37 4.206 -6.900 7.899 1.00 0.00 O ATOM 484 CB LYS A 37 6.908 -8.973 7.369 1.00 0.00 C ATOM 485 CG LYS A 37 6.143 -10.050 8.141 1.00 0.00 C ATOM 486 CD LYS A 37 6.471 -9.991 9.635 1.00 0.00 C ATOM 487 CE LYS A 37 6.490 -11.392 10.247 1.00 0.00 C ATOM 488 NZ LYS A 37 6.066 -11.344 11.665 1.00 0.00 N ATOM 0 H LYS A 37 7.553 -7.678 5.370 1.00 0.00 H new ATOM 0 HA LYS A 37 5.097 -8.617 6.356 1.00 0.00 H new ATOM 0 HB2 LYS A 37 7.557 -9.442 6.630 1.00 0.00 H new ATOM 0 HB3 LYS A 37 7.551 -8.419 8.052 1.00 0.00 H new ATOM 0 HG2 LYS A 37 5.071 -9.915 7.995 1.00 0.00 H new ATOM 0 HG3 LYS A 37 6.397 -11.034 7.748 1.00 0.00 H new ATOM 0 HD2 LYS A 37 7.440 -9.514 9.780 1.00 0.00 H new ATOM 0 HD3 LYS A 37 5.733 -9.376 10.149 1.00 0.00 H new ATOM 0 HE2 LYS A 37 5.827 -12.050 9.685 1.00 0.00 H new ATOM 0 HE3 LYS A 37 7.493 -11.813 10.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 6.084 -12.304 12.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 6.715 -10.733 12.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 5.101 -10.962 11.726 1.00 0.00 H new ATOM 502 N ASP A 38 6.291 -6.030 8.002 1.00 0.00 N ATOM 503 CA ASP A 38 5.911 -4.936 8.880 1.00 0.00 C ATOM 504 C ASP A 38 4.680 -4.232 8.306 1.00 0.00 C ATOM 505 O ASP A 38 3.788 -3.828 9.051 1.00 0.00 O ATOM 506 CB ASP A 38 7.036 -3.905 8.993 1.00 0.00 C ATOM 507 CG ASP A 38 8.273 -4.379 9.757 1.00 0.00 C ATOM 508 OD1 ASP A 38 8.465 -5.613 9.818 1.00 0.00 O ATOM 509 OD2 ASP A 38 9.000 -3.497 10.264 1.00 0.00 O ATOM 0 H ASP A 38 7.278 -6.047 7.743 1.00 0.00 H new ATOM 0 HA ASP A 38 5.702 -5.351 9.866 1.00 0.00 H new ATOM 0 HB2 ASP A 38 7.339 -3.609 7.989 1.00 0.00 H new ATOM 0 HB3 ASP A 38 6.644 -3.014 9.483 1.00 0.00 H new ATOM 514 N ILE A 39 4.671 -4.105 6.987 1.00 0.00 N ATOM 515 CA ILE A 39 3.564 -3.456 6.305 1.00 0.00 C ATOM 516 C ILE A 39 2.346 -4.382 6.325 1.00 0.00 C ATOM 517 O ILE A 39 1.208 -3.917 6.272 1.00 0.00 O ATOM 518 CB ILE A 39 3.982 -3.021 4.899 1.00 0.00 C ATOM 519 CG1 ILE A 39 5.239 -2.149 4.947 1.00 0.00 C ATOM 520 CG2 ILE A 39 2.828 -2.325 4.175 1.00 0.00 C ATOM 521 CD1 ILE A 39 5.923 -2.099 3.579 1.00 0.00 C ATOM 0 H ILE A 39 5.413 -4.441 6.372 1.00 0.00 H new ATOM 0 HA ILE A 39 3.279 -2.541 6.825 1.00 0.00 H new ATOM 0 HB ILE A 39 4.231 -3.913 4.324 1.00 0.00 H new ATOM 0 HG12 ILE A 39 4.974 -1.140 5.262 1.00 0.00 H new ATOM 0 HG13 ILE A 39 5.932 -2.544 5.690 1.00 0.00 H new ATOM 0 HG21 ILE A 39 3.152 -2.026 3.178 1.00 0.00 H new ATOM 0 HG22 ILE A 39 1.984 -3.010 4.092 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.525 -1.442 4.738 1.00 0.00 H new ATOM 0 HD11 ILE A 39 6.813 -1.473 3.640 1.00 0.00 H new ATOM 0 HD12 ILE A 39 6.208 -3.107 3.278 1.00 0.00 H new ATOM 0 HD13 ILE A 39 5.236 -1.681 2.844 1.00 0.00 H new ATOM 533 N GLU A 40 2.625 -5.674 6.403 1.00 0.00 N ATOM 534 CA GLU A 40 1.566 -6.669 6.431 1.00 0.00 C ATOM 535 C GLU A 40 0.864 -6.658 7.791 1.00 0.00 C ATOM 536 O GLU A 40 -0.303 -6.283 7.888 1.00 0.00 O ATOM 537 CB GLU A 40 2.112 -8.061 6.107 1.00 0.00 C ATOM 538 CG GLU A 40 1.352 -9.141 6.878 1.00 0.00 C ATOM 539 CD GLU A 40 1.457 -10.495 6.172 1.00 0.00 C ATOM 540 OE1 GLU A 40 2.603 -10.976 6.035 1.00 0.00 O ATOM 541 OE2 GLU A 40 0.390 -11.018 5.785 1.00 0.00 O ATOM 0 H GLU A 40 3.570 -6.056 6.448 1.00 0.00 H new ATOM 0 HA GLU A 40 0.835 -6.415 5.664 1.00 0.00 H new ATOM 0 HB2 GLU A 40 2.030 -8.248 5.036 1.00 0.00 H new ATOM 0 HB3 GLU A 40 3.172 -8.107 6.358 1.00 0.00 H new ATOM 0 HG2 GLU A 40 1.753 -9.222 7.888 1.00 0.00 H new ATOM 0 HG3 GLU A 40 0.304 -8.856 6.972 1.00 0.00 H new ATOM 548 N ASP A 41 1.605 -7.075 8.807 1.00 0.00 N ATOM 549 CA ASP A 41 1.068 -7.118 10.156 1.00 0.00 C ATOM 550 C ASP A 41 0.248 -5.853 10.415 1.00 0.00 C ATOM 551 O ASP A 41 -0.820 -5.914 11.022 1.00 0.00 O ATOM 552 CB ASP A 41 2.191 -7.174 11.194 1.00 0.00 C ATOM 553 CG ASP A 41 1.757 -6.885 12.633 1.00 0.00 C ATOM 554 OD1 ASP A 41 1.159 -7.799 13.240 1.00 0.00 O ATOM 555 OD2 ASP A 41 2.033 -5.756 13.093 1.00 0.00 O ATOM 0 H ASP A 41 2.573 -7.386 8.723 1.00 0.00 H new ATOM 0 HA ASP A 41 0.450 -8.011 10.244 1.00 0.00 H new ATOM 0 HB2 ASP A 41 2.648 -8.163 11.160 1.00 0.00 H new ATOM 0 HB3 ASP A 41 2.962 -6.457 10.912 1.00 0.00 H new ATOM 560 N VAL A 42 0.779 -4.735 9.942 1.00 0.00 N ATOM 561 CA VAL A 42 0.110 -3.457 10.115 1.00 0.00 C ATOM 562 C VAL A 42 -1.367 -3.606 9.745 1.00 0.00 C ATOM 563 O VAL A 42 -2.242 -3.471 10.599 1.00 0.00 O ATOM 564 CB VAL A 42 0.824 -2.377 9.299 1.00 0.00 C ATOM 565 CG1 VAL A 42 -0.123 -1.221 8.971 1.00 0.00 C ATOM 566 CG2 VAL A 42 2.071 -1.874 10.030 1.00 0.00 C ATOM 0 H VAL A 42 1.665 -4.688 9.439 1.00 0.00 H new ATOM 0 HA VAL A 42 0.155 -3.141 11.157 1.00 0.00 H new ATOM 0 HB VAL A 42 1.144 -2.824 8.358 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.410 -0.468 8.391 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -0.967 -1.595 8.392 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -0.487 -0.775 9.897 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.560 -1.107 9.429 1.00 0.00 H new ATOM 0 HG22 VAL A 42 1.783 -1.452 10.993 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.759 -2.704 10.189 1.00 0.00 H new ATOM 576 N PHE A 43 -1.600 -3.882 8.470 1.00 0.00 N ATOM 577 CA PHE A 43 -2.956 -4.050 7.976 1.00 0.00 C ATOM 578 C PHE A 43 -3.572 -5.350 8.498 1.00 0.00 C ATOM 579 O PHE A 43 -4.781 -5.427 8.710 1.00 0.00 O ATOM 580 CB PHE A 43 -2.872 -4.117 6.450 1.00 0.00 C ATOM 581 CG PHE A 43 -2.733 -2.751 5.774 1.00 0.00 C ATOM 582 CD1 PHE A 43 -1.502 -2.198 5.604 1.00 0.00 C ATOM 583 CD2 PHE A 43 -3.841 -2.089 5.344 1.00 0.00 C ATOM 584 CE1 PHE A 43 -1.374 -0.931 4.977 1.00 0.00 C ATOM 585 CE2 PHE A 43 -3.713 -0.822 4.717 1.00 0.00 C ATOM 586 CZ PHE A 43 -2.482 -0.269 4.547 1.00 0.00 C ATOM 0 H PHE A 43 -0.872 -3.993 7.764 1.00 0.00 H new ATOM 0 HA PHE A 43 -3.580 -3.222 8.313 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -2.021 -4.738 6.170 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -3.766 -4.611 6.068 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -0.622 -2.723 5.946 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -4.818 -2.528 5.480 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -0.397 -0.492 4.841 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -4.593 -0.297 4.375 1.00 0.00 H new ATOM 0 HZ PHE A 43 -2.384 0.695 4.071 1.00 0.00 H new ATOM 596 N TYR A 44 -2.712 -6.339 8.690 1.00 0.00 N ATOM 597 CA TYR A 44 -3.156 -7.632 9.183 1.00 0.00 C ATOM 598 C TYR A 44 -3.956 -7.479 10.479 1.00 0.00 C ATOM 599 O TYR A 44 -4.698 -8.381 10.864 1.00 0.00 O ATOM 600 CB TYR A 44 -1.885 -8.432 9.473 1.00 0.00 C ATOM 601 CG TYR A 44 -2.074 -9.949 9.399 1.00 0.00 C ATOM 602 CD1 TYR A 44 -2.643 -10.626 10.458 1.00 0.00 C ATOM 603 CD2 TYR A 44 -1.675 -10.639 8.273 1.00 0.00 C ATOM 604 CE1 TYR A 44 -2.821 -12.053 10.388 1.00 0.00 C ATOM 605 CE2 TYR A 44 -1.852 -12.066 8.203 1.00 0.00 C ATOM 606 CZ TYR A 44 -2.417 -12.703 9.264 1.00 0.00 C ATOM 607 OH TYR A 44 -2.584 -14.051 9.197 1.00 0.00 O ATOM 0 H TYR A 44 -1.710 -6.271 8.513 1.00 0.00 H new ATOM 0 HA TYR A 44 -3.800 -8.121 8.452 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -1.113 -8.137 8.763 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -1.521 -8.169 10.466 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -2.955 -10.086 11.339 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -1.230 -10.109 7.444 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -3.265 -12.595 11.210 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -1.543 -12.618 7.328 1.00 0.00 H new ATOM 0 HH TYR A 44 -2.251 -14.379 8.336 1.00 0.00 H new ATOM 617 N LYS A 45 -3.777 -6.331 11.115 1.00 0.00 N ATOM 618 CA LYS A 45 -4.472 -6.049 12.359 1.00 0.00 C ATOM 619 C LYS A 45 -5.980 -6.013 12.099 1.00 0.00 C ATOM 620 O LYS A 45 -6.776 -6.038 13.036 1.00 0.00 O ATOM 621 CB LYS A 45 -3.928 -4.770 12.999 1.00 0.00 C ATOM 622 CG LYS A 45 -4.504 -3.527 12.316 1.00 0.00 C ATOM 623 CD LYS A 45 -3.812 -2.257 12.815 1.00 0.00 C ATOM 624 CE LYS A 45 -4.385 -1.814 14.162 1.00 0.00 C ATOM 625 NZ LYS A 45 -5.829 -1.513 14.038 1.00 0.00 N ATOM 0 H LYS A 45 -3.161 -5.585 10.792 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.292 -6.843 13.084 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -4.178 -4.755 14.060 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -2.840 -4.758 12.928 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.382 -3.612 11.236 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.574 -3.463 12.512 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -2.741 -2.436 12.912 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -3.936 -1.459 12.083 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -4.233 -2.598 14.904 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -3.853 -0.932 14.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -6.116 -0.868 14.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -6.012 -1.064 13.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -6.375 -2.396 14.107 1.00 0.00 H new ATOM 639 N TYR A 46 -6.326 -5.954 10.822 1.00 0.00 N ATOM 640 CA TYR A 46 -7.724 -5.915 10.426 1.00 0.00 C ATOM 641 C TYR A 46 -8.206 -7.296 9.976 1.00 0.00 C ATOM 642 O TYR A 46 -9.168 -7.831 10.525 1.00 0.00 O ATOM 643 CB TYR A 46 -7.800 -4.950 9.242 1.00 0.00 C ATOM 644 CG TYR A 46 -7.799 -3.473 9.641 1.00 0.00 C ATOM 645 CD1 TYR A 46 -6.604 -2.802 9.802 1.00 0.00 C ATOM 646 CD2 TYR A 46 -8.994 -2.811 9.839 1.00 0.00 C ATOM 647 CE1 TYR A 46 -6.603 -1.412 10.178 1.00 0.00 C ATOM 648 CE2 TYR A 46 -8.993 -1.421 10.215 1.00 0.00 C ATOM 649 CZ TYR A 46 -7.798 -0.790 10.366 1.00 0.00 C ATOM 650 OH TYR A 46 -7.797 0.523 10.721 1.00 0.00 O ATOM 0 H TYR A 46 -5.663 -5.932 10.047 1.00 0.00 H new ATOM 0 HA TYR A 46 -8.351 -5.602 11.261 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -6.955 -5.137 8.579 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -8.705 -5.161 8.672 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -5.669 -3.320 9.646 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -9.930 -3.335 9.712 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -5.675 -0.876 10.308 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -9.921 -0.891 10.374 1.00 0.00 H new ATOM 0 HH TYR A 46 -8.720 0.836 10.820 1.00 0.00 H new ATOM 660 N GLY A 47 -7.515 -7.833 8.981 1.00 0.00 N ATOM 661 CA GLY A 47 -7.861 -9.141 8.451 1.00 0.00 C ATOM 662 C GLY A 47 -6.615 -9.877 7.954 1.00 0.00 C ATOM 663 O GLY A 47 -5.626 -9.989 8.676 1.00 0.00 O ATOM 0 H GLY A 47 -6.718 -7.386 8.528 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -8.353 -9.732 9.223 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.573 -9.029 7.633 1.00 0.00 H new ATOM 667 N ALA A 48 -6.704 -10.360 6.723 1.00 0.00 N ATOM 668 CA ALA A 48 -5.597 -11.082 6.121 1.00 0.00 C ATOM 669 C ALA A 48 -5.183 -10.384 4.824 1.00 0.00 C ATOM 670 O ALA A 48 -5.941 -9.586 4.275 1.00 0.00 O ATOM 671 CB ALA A 48 -6.001 -12.540 5.894 1.00 0.00 C ATOM 0 H ALA A 48 -7.526 -10.265 6.127 1.00 0.00 H new ATOM 0 HA ALA A 48 -4.733 -11.082 6.786 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -5.170 -13.082 5.442 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -6.257 -12.999 6.849 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -6.864 -12.579 5.229 1.00 0.00 H new ATOM 677 N ILE A 49 -3.981 -10.709 4.371 1.00 0.00 N ATOM 678 CA ILE A 49 -3.457 -10.123 3.149 1.00 0.00 C ATOM 679 C ILE A 49 -3.289 -11.219 2.095 1.00 0.00 C ATOM 680 O ILE A 49 -2.882 -12.335 2.414 1.00 0.00 O ATOM 681 CB ILE A 49 -2.173 -9.344 3.437 1.00 0.00 C ATOM 682 CG1 ILE A 49 -2.460 -8.110 4.296 1.00 0.00 C ATOM 683 CG2 ILE A 49 -1.449 -8.982 2.138 1.00 0.00 C ATOM 684 CD1 ILE A 49 -1.228 -7.710 5.109 1.00 0.00 C ATOM 0 H ILE A 49 -3.355 -11.371 4.829 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.159 -9.395 2.743 1.00 0.00 H new ATOM 0 HB ILE A 49 -1.505 -9.987 4.011 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -2.764 -7.281 3.657 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -3.293 -8.316 4.968 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -0.539 -8.429 2.371 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -1.191 -9.894 1.599 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -2.100 -8.366 1.518 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.459 -6.831 5.710 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -0.941 -8.533 5.764 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -0.404 -7.481 4.433 1.00 0.00 H new ATOM 696 N ARG A 50 -3.610 -10.862 0.860 1.00 0.00 N ATOM 697 CA ARG A 50 -3.500 -11.801 -0.243 1.00 0.00 C ATOM 698 C ARG A 50 -2.079 -11.789 -0.810 1.00 0.00 C ATOM 699 O ARG A 50 -1.515 -12.842 -1.105 1.00 0.00 O ATOM 700 CB ARG A 50 -4.489 -11.459 -1.359 1.00 0.00 C ATOM 701 CG ARG A 50 -4.282 -12.367 -2.573 1.00 0.00 C ATOM 702 CD ARG A 50 -5.623 -12.823 -3.151 1.00 0.00 C ATOM 703 NE ARG A 50 -5.625 -12.651 -4.621 1.00 0.00 N ATOM 704 CZ ARG A 50 -4.804 -13.304 -5.455 1.00 0.00 C ATOM 705 NH1 ARG A 50 -3.909 -14.175 -4.968 1.00 0.00 N ATOM 706 NH2 ARG A 50 -4.876 -13.085 -6.775 1.00 0.00 N ATOM 0 H ARG A 50 -3.946 -9.935 0.599 1.00 0.00 H new ATOM 0 HA ARG A 50 -3.734 -12.793 0.142 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -5.509 -11.565 -0.991 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.364 -10.417 -1.654 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -3.715 -11.835 -3.337 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -3.691 -13.237 -2.285 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -5.801 -13.868 -2.899 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -6.435 -12.246 -2.708 1.00 0.00 H new ATOM 0 HE ARG A 50 -6.293 -11.994 -5.025 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -3.853 -14.341 -3.963 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -3.284 -14.672 -5.602 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.556 -12.421 -7.145 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -4.251 -13.582 -7.409 1.00 0.00 H new ATOM 720 N ASP A 51 -1.539 -10.586 -0.944 1.00 0.00 N ATOM 721 CA ASP A 51 -0.195 -10.424 -1.470 1.00 0.00 C ATOM 722 C ASP A 51 0.225 -8.958 -1.340 1.00 0.00 C ATOM 723 O ASP A 51 -0.619 -8.064 -1.350 1.00 0.00 O ATOM 724 CB ASP A 51 -0.132 -10.804 -2.951 1.00 0.00 C ATOM 725 CG ASP A 51 1.134 -11.552 -3.374 1.00 0.00 C ATOM 726 OD1 ASP A 51 1.304 -12.694 -2.896 1.00 0.00 O ATOM 727 OD2 ASP A 51 1.902 -10.964 -4.165 1.00 0.00 O ATOM 0 H ASP A 51 -2.008 -9.715 -0.697 1.00 0.00 H new ATOM 0 HA ASP A 51 0.470 -11.076 -0.903 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -0.998 -11.422 -3.189 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -0.215 -9.896 -3.547 1.00 0.00 H new ATOM 732 N ILE A 52 1.530 -8.757 -1.223 1.00 0.00 N ATOM 733 CA ILE A 52 2.072 -7.416 -1.091 1.00 0.00 C ATOM 734 C ILE A 52 3.167 -7.208 -2.138 1.00 0.00 C ATOM 735 O ILE A 52 4.198 -7.879 -2.105 1.00 0.00 O ATOM 736 CB ILE A 52 2.537 -7.164 0.344 1.00 0.00 C ATOM 737 CG1 ILE A 52 1.389 -7.359 1.336 1.00 0.00 C ATOM 738 CG2 ILE A 52 3.182 -5.783 0.478 1.00 0.00 C ATOM 739 CD1 ILE A 52 1.900 -7.917 2.665 1.00 0.00 C ATOM 0 H ILE A 52 2.227 -9.501 -1.217 1.00 0.00 H new ATOM 0 HA ILE A 52 1.299 -6.672 -1.285 1.00 0.00 H new ATOM 0 HB ILE A 52 3.302 -7.901 0.588 1.00 0.00 H new ATOM 0 HG12 ILE A 52 0.886 -6.407 1.507 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.650 -8.039 0.913 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.503 -5.630 1.508 1.00 0.00 H new ATOM 0 HG22 ILE A 52 4.045 -5.719 -0.185 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.458 -5.015 0.206 1.00 0.00 H new ATOM 0 HD11 ILE A 52 1.063 -8.046 3.351 1.00 0.00 H new ATOM 0 HD12 ILE A 52 2.381 -8.880 2.494 1.00 0.00 H new ATOM 0 HD13 ILE A 52 2.621 -7.223 3.098 1.00 0.00 H new ATOM 751 N ASP A 53 2.908 -6.276 -3.044 1.00 0.00 N ATOM 752 CA ASP A 53 3.859 -5.972 -4.099 1.00 0.00 C ATOM 753 C ASP A 53 4.577 -4.662 -3.770 1.00 0.00 C ATOM 754 O ASP A 53 3.972 -3.591 -3.807 1.00 0.00 O ATOM 755 CB ASP A 53 3.152 -5.798 -5.444 1.00 0.00 C ATOM 756 CG ASP A 53 3.323 -6.965 -6.420 1.00 0.00 C ATOM 757 OD1 ASP A 53 3.548 -8.090 -5.924 1.00 0.00 O ATOM 758 OD2 ASP A 53 3.224 -6.705 -7.638 1.00 0.00 O ATOM 0 H ASP A 53 2.052 -5.721 -3.069 1.00 0.00 H new ATOM 0 HA ASP A 53 4.564 -6.800 -4.166 1.00 0.00 H new ATOM 0 HB2 ASP A 53 2.088 -5.649 -5.262 1.00 0.00 H new ATOM 0 HB3 ASP A 53 3.524 -4.890 -5.918 1.00 0.00 H new ATOM 763 N LEU A 54 5.858 -4.789 -3.455 1.00 0.00 N ATOM 764 CA LEU A 54 6.665 -3.628 -3.120 1.00 0.00 C ATOM 765 C LEU A 54 7.745 -3.438 -4.187 1.00 0.00 C ATOM 766 O LEU A 54 8.525 -4.350 -4.456 1.00 0.00 O ATOM 767 CB LEU A 54 7.220 -3.753 -1.699 1.00 0.00 C ATOM 768 CG LEU A 54 8.389 -2.830 -1.352 1.00 0.00 C ATOM 769 CD1 LEU A 54 7.901 -1.581 -0.615 1.00 0.00 C ATOM 770 CD2 LEU A 54 9.463 -3.579 -0.561 1.00 0.00 C ATOM 0 H LEU A 54 6.357 -5.678 -3.425 1.00 0.00 H new ATOM 0 HA LEU A 54 6.053 -2.726 -3.121 1.00 0.00 H new ATOM 0 HB2 LEU A 54 6.410 -3.561 -0.996 1.00 0.00 H new ATOM 0 HB3 LEU A 54 7.538 -4.784 -1.544 1.00 0.00 H new ATOM 0 HG LEU A 54 8.849 -2.496 -2.282 1.00 0.00 H new ATOM 0 HD11 LEU A 54 8.752 -0.942 -0.380 1.00 0.00 H new ATOM 0 HD12 LEU A 54 7.201 -1.035 -1.248 1.00 0.00 H new ATOM 0 HD13 LEU A 54 7.402 -1.875 0.308 1.00 0.00 H new ATOM 0 HD21 LEU A 54 10.283 -2.900 -0.327 1.00 0.00 H new ATOM 0 HD22 LEU A 54 9.033 -3.961 0.365 1.00 0.00 H new ATOM 0 HD23 LEU A 54 9.840 -4.411 -1.156 1.00 0.00 H new ATOM 782 N LYS A 55 7.756 -2.246 -4.766 1.00 0.00 N ATOM 783 CA LYS A 55 8.727 -1.924 -5.798 1.00 0.00 C ATOM 784 C LYS A 55 10.111 -1.775 -5.161 1.00 0.00 C ATOM 785 O LYS A 55 10.928 -2.692 -5.221 1.00 0.00 O ATOM 786 CB LYS A 55 8.279 -0.695 -6.591 1.00 0.00 C ATOM 787 CG LYS A 55 7.332 -1.090 -7.725 1.00 0.00 C ATOM 788 CD LYS A 55 7.858 -0.599 -9.075 1.00 0.00 C ATOM 789 CE LYS A 55 6.715 -0.412 -10.075 1.00 0.00 C ATOM 790 NZ LYS A 55 7.236 -0.385 -11.459 1.00 0.00 N ATOM 0 H LYS A 55 7.108 -1.492 -4.540 1.00 0.00 H new ATOM 0 HA LYS A 55 8.795 -2.735 -6.524 1.00 0.00 H new ATOM 0 HB2 LYS A 55 7.781 0.010 -5.925 1.00 0.00 H new ATOM 0 HB3 LYS A 55 9.151 -0.185 -7.001 1.00 0.00 H new ATOM 0 HG2 LYS A 55 7.218 -2.174 -7.748 1.00 0.00 H new ATOM 0 HG3 LYS A 55 6.343 -0.669 -7.541 1.00 0.00 H new ATOM 0 HD2 LYS A 55 8.387 0.345 -8.942 1.00 0.00 H new ATOM 0 HD3 LYS A 55 8.578 -1.315 -9.471 1.00 0.00 H new ATOM 0 HE2 LYS A 55 5.994 -1.222 -9.967 1.00 0.00 H new ATOM 0 HE3 LYS A 55 6.185 0.516 -9.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 6.447 -0.257 -12.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 7.907 0.403 -11.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 7.721 -1.282 -11.665 1.00 0.00 H new ATOM 804 N ASN A 56 10.330 -0.612 -4.565 1.00 0.00 N ATOM 805 CA ASN A 56 11.600 -0.331 -3.918 1.00 0.00 C ATOM 806 C ASN A 56 12.739 -0.577 -4.910 1.00 0.00 C ATOM 807 O ASN A 56 13.124 -1.721 -5.148 1.00 0.00 O ATOM 808 CB ASN A 56 11.819 -1.247 -2.712 1.00 0.00 C ATOM 809 CG ASN A 56 12.437 -0.476 -1.544 1.00 0.00 C ATOM 810 OD1 ASN A 56 11.807 -0.226 -0.529 1.00 0.00 O ATOM 811 ND2 ASN A 56 13.701 -0.116 -1.742 1.00 0.00 N ATOM 0 H ASN A 56 9.649 0.146 -4.517 1.00 0.00 H new ATOM 0 HA ASN A 56 11.586 0.707 -3.585 1.00 0.00 H new ATOM 0 HB2 ASN A 56 10.868 -1.682 -2.403 1.00 0.00 H new ATOM 0 HB3 ASN A 56 12.471 -2.074 -2.992 1.00 0.00 H new ATOM 0 HD21 ASN A 56 14.203 0.402 -1.021 1.00 0.00 H new ATOM 0 HD22 ASN A 56 14.169 -0.358 -2.615 1.00 0.00 H new ATOM 818 N ARG A 57 13.246 0.515 -5.463 1.00 0.00 N ATOM 819 CA ARG A 57 14.332 0.433 -6.424 1.00 0.00 C ATOM 820 C ARG A 57 14.717 1.831 -6.912 1.00 0.00 C ATOM 821 O ARG A 57 15.898 2.171 -6.964 1.00 0.00 O ATOM 822 CB ARG A 57 13.941 -0.430 -7.626 1.00 0.00 C ATOM 823 CG ARG A 57 15.167 -0.785 -8.468 1.00 0.00 C ATOM 824 CD ARG A 57 15.349 -2.302 -8.559 1.00 0.00 C ATOM 825 NE ARG A 57 15.799 -2.677 -9.918 1.00 0.00 N ATOM 826 CZ ARG A 57 15.059 -2.520 -11.024 1.00 0.00 C ATOM 827 NH1 ARG A 57 13.829 -1.994 -10.939 1.00 0.00 N ATOM 828 NH2 ARG A 57 15.548 -2.889 -12.216 1.00 0.00 N ATOM 0 H ARG A 57 12.924 1.462 -5.263 1.00 0.00 H new ATOM 0 HA ARG A 57 15.183 -0.027 -5.923 1.00 0.00 H new ATOM 0 HB2 ARG A 57 13.456 -1.343 -7.280 1.00 0.00 H new ATOM 0 HB3 ARG A 57 13.216 0.103 -8.240 1.00 0.00 H new ATOM 0 HG2 ARG A 57 15.058 -0.367 -9.469 1.00 0.00 H new ATOM 0 HG3 ARG A 57 16.057 -0.334 -8.029 1.00 0.00 H new ATOM 0 HD2 ARG A 57 16.079 -2.634 -7.821 1.00 0.00 H new ATOM 0 HD3 ARG A 57 14.410 -2.804 -8.327 1.00 0.00 H new ATOM 0 HE ARG A 57 16.731 -3.080 -10.019 1.00 0.00 H new ATOM 0 HH11 ARG A 57 13.456 -1.713 -10.032 1.00 0.00 H new ATOM 0 HH12 ARG A 57 13.266 -1.875 -11.781 1.00 0.00 H new ATOM 0 HH21 ARG A 57 16.484 -3.290 -12.282 1.00 0.00 H new ATOM 0 HH22 ARG A 57 14.984 -2.769 -13.058 1.00 0.00 H new ATOM 842 N ARG A 58 13.697 2.603 -7.258 1.00 0.00 N ATOM 843 CA ARG A 58 13.913 3.957 -7.740 1.00 0.00 C ATOM 844 C ARG A 58 12.573 4.656 -7.976 1.00 0.00 C ATOM 845 O ARG A 58 11.546 4.000 -8.137 1.00 0.00 O ATOM 846 CB ARG A 58 14.717 3.956 -9.042 1.00 0.00 C ATOM 847 CG ARG A 58 15.830 5.004 -9.000 1.00 0.00 C ATOM 848 CD ARG A 58 16.214 5.453 -10.412 1.00 0.00 C ATOM 849 NE ARG A 58 16.857 6.785 -10.362 1.00 0.00 N ATOM 850 CZ ARG A 58 17.321 7.436 -11.437 1.00 0.00 C ATOM 851 NH1 ARG A 58 17.216 6.882 -12.652 1.00 0.00 N ATOM 852 NH2 ARG A 58 17.889 8.642 -11.297 1.00 0.00 N ATOM 0 H ARG A 58 12.719 2.317 -7.214 1.00 0.00 H new ATOM 0 HA ARG A 58 14.478 4.495 -6.978 1.00 0.00 H new ATOM 0 HB2 ARG A 58 15.148 2.969 -9.206 1.00 0.00 H new ATOM 0 HB3 ARG A 58 14.054 4.158 -9.883 1.00 0.00 H new ATOM 0 HG2 ARG A 58 15.502 5.865 -8.417 1.00 0.00 H new ATOM 0 HG3 ARG A 58 16.704 4.592 -8.495 1.00 0.00 H new ATOM 0 HD2 ARG A 58 16.894 4.729 -10.861 1.00 0.00 H new ATOM 0 HD3 ARG A 58 15.327 5.492 -11.044 1.00 0.00 H new ATOM 0 HE ARG A 58 16.953 7.236 -9.452 1.00 0.00 H new ATOM 0 HH11 ARG A 58 16.783 5.965 -12.759 1.00 0.00 H new ATOM 0 HH12 ARG A 58 17.569 7.377 -13.471 1.00 0.00 H new ATOM 0 HH21 ARG A 58 17.968 9.064 -10.372 1.00 0.00 H new ATOM 0 HH22 ARG A 58 18.242 9.137 -12.116 1.00 0.00 H new ATOM 866 N GLY A 59 12.627 5.980 -7.989 1.00 0.00 N ATOM 867 CA GLY A 59 11.431 6.776 -8.202 1.00 0.00 C ATOM 868 C GLY A 59 10.762 7.129 -6.872 1.00 0.00 C ATOM 869 O GLY A 59 9.954 6.358 -6.356 1.00 0.00 O ATOM 0 H GLY A 59 13.481 6.521 -7.855 1.00 0.00 H new ATOM 0 HA2 GLY A 59 11.689 7.690 -8.737 1.00 0.00 H new ATOM 0 HA3 GLY A 59 10.731 6.226 -8.830 1.00 0.00 H new ATOM 873 N GLY A 60 11.123 8.294 -6.355 1.00 0.00 N ATOM 874 CA GLY A 60 10.568 8.758 -5.095 1.00 0.00 C ATOM 875 C GLY A 60 10.813 7.739 -3.980 1.00 0.00 C ATOM 876 O GLY A 60 11.764 6.961 -4.043 1.00 0.00 O ATOM 0 H GLY A 60 11.793 8.931 -6.786 1.00 0.00 H new ATOM 0 HA2 GLY A 60 11.018 9.713 -4.825 1.00 0.00 H new ATOM 0 HA3 GLY A 60 9.497 8.930 -5.206 1.00 0.00 H new ATOM 880 N PRO A 61 9.916 7.778 -2.959 1.00 0.00 N ATOM 881 CA PRO A 61 10.026 6.868 -1.831 1.00 0.00 C ATOM 882 C PRO A 61 9.575 5.458 -2.219 1.00 0.00 C ATOM 883 O PRO A 61 9.075 5.244 -3.322 1.00 0.00 O ATOM 884 CB PRO A 61 9.167 7.487 -0.741 1.00 0.00 C ATOM 885 CG PRO A 61 8.242 8.468 -1.445 1.00 0.00 C ATOM 886 CD PRO A 61 8.778 8.686 -2.850 1.00 0.00 C ATOM 0 HA PRO A 61 11.053 6.745 -1.488 1.00 0.00 H new ATOM 0 HB2 PRO A 61 8.597 6.723 -0.212 1.00 0.00 H new ATOM 0 HB3 PRO A 61 9.783 7.995 0.001 1.00 0.00 H new ATOM 0 HG2 PRO A 61 7.225 8.076 -1.481 1.00 0.00 H new ATOM 0 HG3 PRO A 61 8.201 9.412 -0.901 1.00 0.00 H new ATOM 0 HD2 PRO A 61 8.021 8.463 -3.602 1.00 0.00 H new ATOM 0 HD3 PRO A 61 9.082 9.722 -3.001 1.00 0.00 H new ATOM 894 N PRO A 62 9.773 4.509 -1.265 1.00 0.00 N ATOM 895 CA PRO A 62 9.393 3.126 -1.496 1.00 0.00 C ATOM 896 C PRO A 62 7.876 2.951 -1.403 1.00 0.00 C ATOM 897 O PRO A 62 7.263 3.332 -0.407 1.00 0.00 O ATOM 898 CB PRO A 62 10.148 2.330 -0.444 1.00 0.00 C ATOM 899 CG PRO A 62 10.555 3.331 0.625 1.00 0.00 C ATOM 900 CD PRO A 62 10.362 4.727 0.053 1.00 0.00 C ATOM 0 HA PRO A 62 9.649 2.781 -2.498 1.00 0.00 H new ATOM 0 HB2 PRO A 62 9.520 1.544 -0.024 1.00 0.00 H new ATOM 0 HB3 PRO A 62 11.022 1.843 -0.876 1.00 0.00 H new ATOM 0 HG2 PRO A 62 9.950 3.199 1.522 1.00 0.00 H new ATOM 0 HG3 PRO A 62 11.594 3.178 0.916 1.00 0.00 H new ATOM 0 HD2 PRO A 62 9.707 5.327 0.685 1.00 0.00 H new ATOM 0 HD3 PRO A 62 11.310 5.260 -0.020 1.00 0.00 H new ATOM 908 N PHE A 63 7.313 2.376 -2.456 1.00 0.00 N ATOM 909 CA PHE A 63 5.879 2.146 -2.506 1.00 0.00 C ATOM 910 C PHE A 63 5.569 0.673 -2.776 1.00 0.00 C ATOM 911 O PHE A 63 6.379 -0.037 -3.370 1.00 0.00 O ATOM 912 CB PHE A 63 5.331 2.991 -3.658 1.00 0.00 C ATOM 913 CG PHE A 63 6.044 2.761 -4.992 1.00 0.00 C ATOM 914 CD1 PHE A 63 7.291 3.266 -5.192 1.00 0.00 C ATOM 915 CD2 PHE A 63 5.431 2.052 -5.977 1.00 0.00 C ATOM 916 CE1 PHE A 63 7.952 3.053 -6.430 1.00 0.00 C ATOM 917 CE2 PHE A 63 6.092 1.839 -7.215 1.00 0.00 C ATOM 918 CZ PHE A 63 7.339 2.344 -7.416 1.00 0.00 C ATOM 0 H PHE A 63 7.824 2.063 -3.281 1.00 0.00 H new ATOM 0 HA PHE A 63 5.425 2.415 -1.552 1.00 0.00 H new ATOM 0 HB2 PHE A 63 4.270 2.773 -3.782 1.00 0.00 H new ATOM 0 HB3 PHE A 63 5.411 4.045 -3.392 1.00 0.00 H new ATOM 0 HD1 PHE A 63 7.778 3.829 -4.409 1.00 0.00 H new ATOM 0 HD2 PHE A 63 4.441 1.651 -5.817 1.00 0.00 H new ATOM 0 HE1 PHE A 63 8.942 3.454 -6.589 1.00 0.00 H new ATOM 0 HE2 PHE A 63 5.605 1.276 -7.997 1.00 0.00 H new ATOM 0 HZ PHE A 63 7.842 2.182 -8.358 1.00 0.00 H new ATOM 928 N ALA A 64 4.393 0.257 -2.328 1.00 0.00 N ATOM 929 CA ALA A 64 3.966 -1.120 -2.515 1.00 0.00 C ATOM 930 C ALA A 64 2.438 -1.173 -2.558 1.00 0.00 C ATOM 931 O ALA A 64 1.768 -0.241 -2.115 1.00 0.00 O ATOM 932 CB ALA A 64 4.548 -1.991 -1.400 1.00 0.00 C ATOM 0 H ALA A 64 3.723 0.849 -1.836 1.00 0.00 H new ATOM 0 HA ALA A 64 4.337 -1.512 -3.462 1.00 0.00 H new ATOM 0 HB1 ALA A 64 4.228 -3.023 -1.540 1.00 0.00 H new ATOM 0 HB2 ALA A 64 5.636 -1.941 -1.430 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.195 -1.630 -0.434 1.00 0.00 H new ATOM 938 N PHE A 65 1.931 -2.273 -3.095 1.00 0.00 N ATOM 939 CA PHE A 65 0.494 -2.460 -3.202 1.00 0.00 C ATOM 940 C PHE A 65 0.036 -3.672 -2.388 1.00 0.00 C ATOM 941 O PHE A 65 0.311 -4.812 -2.758 1.00 0.00 O ATOM 942 CB PHE A 65 0.183 -2.706 -4.679 1.00 0.00 C ATOM 943 CG PHE A 65 0.490 -1.514 -5.587 1.00 0.00 C ATOM 944 CD1 PHE A 65 1.770 -1.270 -5.980 1.00 0.00 C ATOM 945 CD2 PHE A 65 -0.515 -0.697 -6.001 1.00 0.00 C ATOM 946 CE1 PHE A 65 2.055 -0.163 -6.823 1.00 0.00 C ATOM 947 CE2 PHE A 65 -0.230 0.410 -6.843 1.00 0.00 C ATOM 948 CZ PHE A 65 1.049 0.653 -7.236 1.00 0.00 C ATOM 0 H PHE A 65 2.490 -3.044 -3.461 1.00 0.00 H new ATOM 0 HA PHE A 65 -0.024 -1.581 -2.818 1.00 0.00 H new ATOM 0 HB2 PHE A 65 0.756 -3.568 -5.022 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -0.871 -2.964 -4.780 1.00 0.00 H new ATOM 0 HD1 PHE A 65 2.569 -1.918 -5.651 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -1.531 -0.890 -5.689 1.00 0.00 H new ATOM 0 HE1 PHE A 65 3.070 0.030 -7.136 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -1.029 1.059 -7.171 1.00 0.00 H new ATOM 0 HZ PHE A 65 1.266 1.495 -7.877 1.00 0.00 H new ATOM 958 N VAL A 66 -0.653 -3.384 -1.294 1.00 0.00 N ATOM 959 CA VAL A 66 -1.151 -4.436 -0.424 1.00 0.00 C ATOM 960 C VAL A 66 -2.525 -4.893 -0.919 1.00 0.00 C ATOM 961 O VAL A 66 -3.427 -4.077 -1.099 1.00 0.00 O ATOM 962 CB VAL A 66 -1.169 -3.951 1.027 1.00 0.00 C ATOM 963 CG1 VAL A 66 -1.661 -5.054 1.967 1.00 0.00 C ATOM 964 CG2 VAL A 66 0.210 -3.443 1.452 1.00 0.00 C ATOM 0 H VAL A 66 -0.878 -2.437 -0.990 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.490 -5.302 -0.455 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.868 -3.117 1.094 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.664 -4.684 2.992 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.672 -5.349 1.684 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -0.998 -5.916 1.895 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.170 -3.104 2.487 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.938 -4.249 1.362 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.506 -2.613 0.810 1.00 0.00 H new ATOM 974 N GLU A 67 -2.641 -6.197 -1.124 1.00 0.00 N ATOM 975 CA GLU A 67 -3.890 -6.772 -1.594 1.00 0.00 C ATOM 976 C GLU A 67 -4.675 -7.366 -0.423 1.00 0.00 C ATOM 977 O GLU A 67 -4.089 -7.935 0.496 1.00 0.00 O ATOM 978 CB GLU A 67 -3.636 -7.826 -2.674 1.00 0.00 C ATOM 979 CG GLU A 67 -4.938 -8.218 -3.375 1.00 0.00 C ATOM 980 CD GLU A 67 -4.656 -8.928 -4.700 1.00 0.00 C ATOM 981 OE1 GLU A 67 -3.667 -8.534 -5.356 1.00 0.00 O ATOM 982 OE2 GLU A 67 -5.434 -9.850 -5.028 1.00 0.00 O ATOM 0 H GLU A 67 -1.891 -6.871 -0.973 1.00 0.00 H new ATOM 0 HA GLU A 67 -4.488 -5.977 -2.041 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -2.927 -7.438 -3.406 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.180 -8.709 -2.226 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.522 -8.870 -2.726 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.540 -7.327 -3.557 1.00 0.00 H new ATOM 989 N PHE A 68 -5.989 -7.213 -0.495 1.00 0.00 N ATOM 990 CA PHE A 68 -6.860 -7.727 0.548 1.00 0.00 C ATOM 991 C PHE A 68 -7.814 -8.787 -0.007 1.00 0.00 C ATOM 992 O PHE A 68 -8.205 -8.726 -1.172 1.00 0.00 O ATOM 993 CB PHE A 68 -7.679 -6.545 1.070 1.00 0.00 C ATOM 994 CG PHE A 68 -7.119 -5.916 2.348 1.00 0.00 C ATOM 995 CD1 PHE A 68 -7.334 -6.514 3.551 1.00 0.00 C ATOM 996 CD2 PHE A 68 -6.405 -4.760 2.281 1.00 0.00 C ATOM 997 CE1 PHE A 68 -6.814 -5.930 4.736 1.00 0.00 C ATOM 998 CE2 PHE A 68 -5.885 -4.177 3.466 1.00 0.00 C ATOM 999 CZ PHE A 68 -6.101 -4.774 4.669 1.00 0.00 C ATOM 0 H PHE A 68 -6.472 -6.740 -1.259 1.00 0.00 H new ATOM 0 HA PHE A 68 -6.264 -8.189 1.335 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -7.731 -5.781 0.294 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -8.700 -6.878 1.258 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.900 -7.432 3.604 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -6.234 -4.286 1.326 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.985 -6.404 5.691 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.318 -3.259 3.413 1.00 0.00 H new ATOM 0 HZ PHE A 68 -5.706 -4.330 5.571 1.00 0.00 H new ATOM 1009 N GLU A 69 -8.161 -9.734 0.852 1.00 0.00 N ATOM 1010 CA GLU A 69 -9.062 -10.805 0.462 1.00 0.00 C ATOM 1011 C GLU A 69 -10.448 -10.243 0.142 1.00 0.00 C ATOM 1012 O GLU A 69 -11.105 -10.697 -0.793 1.00 0.00 O ATOM 1013 CB GLU A 69 -9.142 -11.877 1.551 1.00 0.00 C ATOM 1014 CG GLU A 69 -7.878 -12.739 1.566 1.00 0.00 C ATOM 1015 CD GLU A 69 -7.919 -13.792 0.457 1.00 0.00 C ATOM 1016 OE1 GLU A 69 -8.204 -13.393 -0.693 1.00 0.00 O ATOM 1017 OE2 GLU A 69 -7.663 -14.971 0.783 1.00 0.00 O ATOM 0 H GLU A 69 -7.834 -9.782 1.817 1.00 0.00 H new ATOM 0 HA GLU A 69 -8.667 -11.277 -0.438 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.275 -11.403 2.524 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -10.015 -12.508 1.382 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -7.000 -12.106 1.439 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.779 -13.229 2.534 1.00 0.00 H new ATOM 1024 N ASP A 70 -10.852 -9.263 0.938 1.00 0.00 N ATOM 1025 CA ASP A 70 -12.149 -8.635 0.751 1.00 0.00 C ATOM 1026 C ASP A 70 -11.959 -7.127 0.573 1.00 0.00 C ATOM 1027 O ASP A 70 -10.954 -6.568 1.011 1.00 0.00 O ATOM 1028 CB ASP A 70 -13.050 -8.857 1.967 1.00 0.00 C ATOM 1029 CG ASP A 70 -13.506 -10.303 2.178 1.00 0.00 C ATOM 1030 OD1 ASP A 70 -12.619 -11.183 2.181 1.00 0.00 O ATOM 1031 OD2 ASP A 70 -14.732 -10.494 2.331 1.00 0.00 O ATOM 0 H ASP A 70 -10.304 -8.889 1.713 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.615 -9.080 -0.128 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -12.519 -8.525 2.859 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -13.932 -8.224 1.867 1.00 0.00 H new ATOM 1036 N PRO A 71 -12.966 -6.494 -0.087 1.00 0.00 N ATOM 1037 CA PRO A 71 -12.919 -5.062 -0.327 1.00 0.00 C ATOM 1038 C PRO A 71 -13.221 -4.281 0.953 1.00 0.00 C ATOM 1039 O PRO A 71 -12.488 -3.360 1.310 1.00 0.00 O ATOM 1040 CB PRO A 71 -13.938 -4.815 -1.428 1.00 0.00 C ATOM 1041 CG PRO A 71 -14.844 -6.035 -1.439 1.00 0.00 C ATOM 1042 CD PRO A 71 -14.171 -7.123 -0.619 1.00 0.00 C ATOM 0 HA PRO A 71 -11.931 -4.719 -0.632 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -14.509 -3.907 -1.235 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -13.447 -4.684 -2.392 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -15.820 -5.790 -1.020 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -15.013 -6.376 -2.460 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -14.821 -7.474 0.182 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -13.927 -7.989 -1.234 1.00 0.00 H new ATOM 1050 N ARG A 72 -14.302 -4.677 1.609 1.00 0.00 N ATOM 1051 CA ARG A 72 -14.710 -4.025 2.842 1.00 0.00 C ATOM 1052 C ARG A 72 -13.485 -3.681 3.691 1.00 0.00 C ATOM 1053 O ARG A 72 -13.278 -2.522 4.047 1.00 0.00 O ATOM 1054 CB ARG A 72 -15.650 -4.920 3.653 1.00 0.00 C ATOM 1055 CG ARG A 72 -17.046 -4.957 3.029 1.00 0.00 C ATOM 1056 CD ARG A 72 -18.092 -5.403 4.052 1.00 0.00 C ATOM 1057 NE ARG A 72 -19.392 -5.630 3.381 1.00 0.00 N ATOM 1058 CZ ARG A 72 -20.238 -4.651 3.032 1.00 0.00 C ATOM 1059 NH1 ARG A 72 -19.926 -3.373 3.288 1.00 0.00 N ATOM 1060 NH2 ARG A 72 -21.395 -4.949 2.427 1.00 0.00 N ATOM 0 H ARG A 72 -14.908 -5.441 1.310 1.00 0.00 H new ATOM 0 HA ARG A 72 -15.239 -3.110 2.574 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -15.243 -5.930 3.703 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -15.715 -4.552 4.677 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -17.304 -3.969 2.647 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -17.050 -5.639 2.178 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -17.763 -6.318 4.545 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -18.201 -4.644 4.827 1.00 0.00 H new ATOM 0 HE ARG A 72 -19.660 -6.591 3.171 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -19.045 -3.146 3.748 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -20.570 -2.628 3.022 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -21.633 -5.921 2.232 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -22.039 -4.203 2.162 1.00 0.00 H new ATOM 1074 N ASP A 73 -12.705 -4.709 3.990 1.00 0.00 N ATOM 1075 CA ASP A 73 -11.506 -4.531 4.791 1.00 0.00 C ATOM 1076 C ASP A 73 -10.528 -3.622 4.042 1.00 0.00 C ATOM 1077 O ASP A 73 -10.048 -2.633 4.594 1.00 0.00 O ATOM 1078 CB ASP A 73 -10.808 -5.868 5.045 1.00 0.00 C ATOM 1079 CG ASP A 73 -11.254 -6.600 6.312 1.00 0.00 C ATOM 1080 OD1 ASP A 73 -11.579 -5.894 7.291 1.00 0.00 O ATOM 1081 OD2 ASP A 73 -11.261 -7.850 6.273 1.00 0.00 O ATOM 0 H ASP A 73 -12.880 -5.669 3.692 1.00 0.00 H new ATOM 0 HA ASP A 73 -11.800 -4.092 5.744 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -10.980 -6.519 4.188 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -9.733 -5.694 5.103 1.00 0.00 H new ATOM 1086 N ALA A 74 -10.263 -3.990 2.797 1.00 0.00 N ATOM 1087 CA ALA A 74 -9.352 -3.221 1.967 1.00 0.00 C ATOM 1088 C ALA A 74 -9.645 -1.730 2.143 1.00 0.00 C ATOM 1089 O ALA A 74 -8.745 -0.899 2.030 1.00 0.00 O ATOM 1090 CB ALA A 74 -9.482 -3.674 0.512 1.00 0.00 C ATOM 0 H ALA A 74 -10.664 -4.811 2.343 1.00 0.00 H new ATOM 0 HA ALA A 74 -8.319 -3.392 2.270 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -8.799 -3.097 -0.111 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.235 -4.733 0.437 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -10.505 -3.515 0.171 1.00 0.00 H new ATOM 1096 N GLU A 75 -10.908 -1.435 2.416 1.00 0.00 N ATOM 1097 CA GLU A 75 -11.331 -0.059 2.608 1.00 0.00 C ATOM 1098 C GLU A 75 -11.092 0.373 4.057 1.00 0.00 C ATOM 1099 O GLU A 75 -10.299 1.276 4.316 1.00 0.00 O ATOM 1100 CB GLU A 75 -12.798 0.124 2.216 1.00 0.00 C ATOM 1101 CG GLU A 75 -13.031 -0.278 0.758 1.00 0.00 C ATOM 1102 CD GLU A 75 -13.984 0.697 0.065 1.00 0.00 C ATOM 1103 OE1 GLU A 75 -13.678 1.909 0.098 1.00 0.00 O ATOM 1104 OE2 GLU A 75 -14.997 0.210 -0.481 1.00 0.00 O ATOM 0 H GLU A 75 -11.652 -2.126 2.509 1.00 0.00 H new ATOM 0 HA GLU A 75 -10.733 0.578 1.956 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -13.430 -0.478 2.868 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -13.090 1.164 2.361 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -12.079 -0.301 0.227 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -13.443 -1.286 0.717 1.00 0.00 H new ATOM 1111 N ASP A 76 -11.793 -0.294 4.962 1.00 0.00 N ATOM 1112 CA ASP A 76 -11.668 0.009 6.377 1.00 0.00 C ATOM 1113 C ASP A 76 -10.196 0.263 6.712 1.00 0.00 C ATOM 1114 O ASP A 76 -9.885 1.083 7.574 1.00 0.00 O ATOM 1115 CB ASP A 76 -12.152 -1.161 7.236 1.00 0.00 C ATOM 1116 CG ASP A 76 -13.633 -1.114 7.617 1.00 0.00 C ATOM 1117 OD1 ASP A 76 -14.148 0.017 7.754 1.00 0.00 O ATOM 1118 OD2 ASP A 76 -14.217 -2.209 7.761 1.00 0.00 O ATOM 0 H ASP A 76 -12.449 -1.043 4.743 1.00 0.00 H new ATOM 0 HA ASP A 76 -12.277 0.888 6.588 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -11.960 -2.090 6.699 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -11.558 -1.192 8.149 1.00 0.00 H new ATOM 1123 N ALA A 77 -9.331 -0.455 6.012 1.00 0.00 N ATOM 1124 CA ALA A 77 -7.900 -0.318 6.223 1.00 0.00 C ATOM 1125 C ALA A 77 -7.443 1.051 5.716 1.00 0.00 C ATOM 1126 O ALA A 77 -7.029 1.902 6.502 1.00 0.00 O ATOM 1127 CB ALA A 77 -7.168 -1.470 5.532 1.00 0.00 C ATOM 0 H ALA A 77 -9.594 -1.134 5.298 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.662 -0.372 7.285 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -6.095 -1.366 5.691 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -7.507 -2.418 5.949 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.380 -1.447 4.463 1.00 0.00 H new ATOM 1133 N VAL A 78 -7.533 1.221 4.405 1.00 0.00 N ATOM 1134 CA VAL A 78 -7.134 2.472 3.783 1.00 0.00 C ATOM 1135 C VAL A 78 -7.844 3.633 4.482 1.00 0.00 C ATOM 1136 O VAL A 78 -7.289 4.725 4.600 1.00 0.00 O ATOM 1137 CB VAL A 78 -7.411 2.421 2.279 1.00 0.00 C ATOM 1138 CG1 VAL A 78 -8.827 2.906 1.965 1.00 0.00 C ATOM 1139 CG2 VAL A 78 -6.370 3.229 1.502 1.00 0.00 C ATOM 0 H VAL A 78 -7.877 0.513 3.756 1.00 0.00 H new ATOM 0 HA VAL A 78 -6.062 2.630 3.897 1.00 0.00 H new ATOM 0 HB VAL A 78 -7.335 1.382 1.960 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -8.997 2.859 0.889 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -9.551 2.270 2.475 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -8.943 3.935 2.307 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.590 3.176 0.436 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -6.400 4.269 1.827 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.378 2.819 1.688 1.00 0.00 H new ATOM 1149 N TYR A 79 -9.061 3.359 4.928 1.00 0.00 N ATOM 1150 CA TYR A 79 -9.853 4.367 5.612 1.00 0.00 C ATOM 1151 C TYR A 79 -9.215 4.751 6.949 1.00 0.00 C ATOM 1152 O TYR A 79 -9.572 5.767 7.542 1.00 0.00 O ATOM 1153 CB TYR A 79 -11.216 3.725 5.877 1.00 0.00 C ATOM 1154 CG TYR A 79 -12.263 4.022 4.803 1.00 0.00 C ATOM 1155 CD1 TYR A 79 -11.866 4.433 3.546 1.00 0.00 C ATOM 1156 CD2 TYR A 79 -13.606 3.880 5.089 1.00 0.00 C ATOM 1157 CE1 TYR A 79 -12.852 4.713 2.535 1.00 0.00 C ATOM 1158 CE2 TYR A 79 -14.592 4.159 4.078 1.00 0.00 C ATOM 1159 CZ TYR A 79 -14.166 4.562 2.850 1.00 0.00 C ATOM 1160 OH TYR A 79 -15.097 4.827 1.895 1.00 0.00 O ATOM 0 H TYR A 79 -9.518 2.453 4.829 1.00 0.00 H new ATOM 0 HA TYR A 79 -9.927 5.271 5.008 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -11.088 2.645 5.957 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.589 4.074 6.840 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -10.816 4.544 3.321 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -13.917 3.559 6.072 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -12.555 5.036 1.548 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -15.646 4.051 4.289 1.00 0.00 H new ATOM 0 HH TYR A 79 -15.993 4.675 2.261 1.00 0.00 H new ATOM 1170 N GLY A 80 -8.281 3.917 7.383 1.00 0.00 N ATOM 1171 CA GLY A 80 -7.590 4.157 8.639 1.00 0.00 C ATOM 1172 C GLY A 80 -6.081 4.284 8.418 1.00 0.00 C ATOM 1173 O GLY A 80 -5.515 5.364 8.583 1.00 0.00 O ATOM 0 H GLY A 80 -7.987 3.075 6.888 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -7.972 5.068 9.100 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -7.792 3.340 9.332 1.00 0.00 H new ATOM 1177 N ARG A 81 -5.473 3.166 8.049 1.00 0.00 N ATOM 1178 CA ARG A 81 -4.041 3.139 7.804 1.00 0.00 C ATOM 1179 C ARG A 81 -3.598 4.423 7.100 1.00 0.00 C ATOM 1180 O ARG A 81 -2.481 4.895 7.305 1.00 0.00 O ATOM 1181 CB ARG A 81 -3.651 1.935 6.946 1.00 0.00 C ATOM 1182 CG ARG A 81 -4.115 0.628 7.592 1.00 0.00 C ATOM 1183 CD ARG A 81 -3.768 0.600 9.082 1.00 0.00 C ATOM 1184 NE ARG A 81 -4.853 1.230 9.866 1.00 0.00 N ATOM 1185 CZ ARG A 81 -4.682 1.786 11.074 1.00 0.00 C ATOM 1186 NH1 ARG A 81 -3.468 1.793 11.642 1.00 0.00 N ATOM 1187 NH2 ARG A 81 -5.724 2.336 11.712 1.00 0.00 N ATOM 0 H ARG A 81 -5.946 2.272 7.914 1.00 0.00 H new ATOM 0 HA ARG A 81 -3.542 3.059 8.770 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -4.093 2.032 5.955 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -2.569 1.915 6.812 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -5.192 0.517 7.463 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -3.645 -0.217 7.089 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -3.621 -0.429 9.410 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -2.830 1.127 9.255 1.00 0.00 H new ATOM 0 HE ARG A 81 -5.790 1.242 9.462 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -2.675 1.375 11.155 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -3.337 2.216 12.561 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -6.647 2.332 11.279 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -5.594 2.759 12.631 1.00 0.00 H new ATOM 1201 N ASP A 82 -4.498 4.953 6.283 1.00 0.00 N ATOM 1202 CA ASP A 82 -4.214 6.173 5.547 1.00 0.00 C ATOM 1203 C ASP A 82 -3.865 7.289 6.534 1.00 0.00 C ATOM 1204 O ASP A 82 -4.753 7.897 7.129 1.00 0.00 O ATOM 1205 CB ASP A 82 -5.431 6.622 4.736 1.00 0.00 C ATOM 1206 CG ASP A 82 -5.340 8.039 4.166 1.00 0.00 C ATOM 1207 OD1 ASP A 82 -5.667 8.978 4.924 1.00 0.00 O ATOM 1208 OD2 ASP A 82 -4.946 8.151 2.985 1.00 0.00 O ATOM 0 H ASP A 82 -5.424 4.559 6.115 1.00 0.00 H new ATOM 0 HA ASP A 82 -3.383 5.974 4.870 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -5.578 5.924 3.912 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -6.315 6.557 5.370 1.00 0.00 H new ATOM 1213 N GLY A 83 -2.569 7.525 6.677 1.00 0.00 N ATOM 1214 CA GLY A 83 -2.091 8.557 7.582 1.00 0.00 C ATOM 1215 C GLY A 83 -1.686 7.959 8.931 1.00 0.00 C ATOM 1216 O GLY A 83 -1.959 8.543 9.979 1.00 0.00 O ATOM 0 H GLY A 83 -1.835 7.019 6.181 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -1.238 9.070 7.137 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.870 9.305 7.731 1.00 0.00 H new ATOM 1220 N TYR A 84 -1.042 6.804 8.861 1.00 0.00 N ATOM 1221 CA TYR A 84 -0.597 6.121 10.063 1.00 0.00 C ATOM 1222 C TYR A 84 0.826 6.541 10.438 1.00 0.00 C ATOM 1223 O TYR A 84 1.624 6.887 9.568 1.00 0.00 O ATOM 1224 CB TYR A 84 -0.603 4.628 9.728 1.00 0.00 C ATOM 1225 CG TYR A 84 0.012 3.744 10.814 1.00 0.00 C ATOM 1226 CD1 TYR A 84 -0.670 3.525 11.994 1.00 0.00 C ATOM 1227 CD2 TYR A 84 1.248 3.164 10.614 1.00 0.00 C ATOM 1228 CE1 TYR A 84 -0.091 2.692 13.016 1.00 0.00 C ATOM 1229 CE2 TYR A 84 1.827 2.332 11.636 1.00 0.00 C ATOM 1230 CZ TYR A 84 1.129 2.137 12.787 1.00 0.00 C ATOM 1231 OH TYR A 84 1.676 1.351 13.752 1.00 0.00 O ATOM 0 H TYR A 84 -0.818 6.323 7.990 1.00 0.00 H new ATOM 0 HA TYR A 84 -1.247 6.363 10.904 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -1.631 4.309 9.554 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.059 4.473 8.796 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.638 3.978 12.151 1.00 0.00 H new ATOM 0 HD2 TYR A 84 1.781 3.334 9.690 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -0.614 2.512 13.944 1.00 0.00 H new ATOM 0 HE2 TYR A 84 2.794 1.873 11.492 1.00 0.00 H new ATOM 0 HH TYR A 84 2.548 1.022 13.450 1.00 0.00 H new ATOM 1241 N ASP A 85 1.100 6.498 11.733 1.00 0.00 N ATOM 1242 CA ASP A 85 2.412 6.870 12.233 1.00 0.00 C ATOM 1243 C ASP A 85 3.256 5.608 12.428 1.00 0.00 C ATOM 1244 O ASP A 85 3.091 4.894 13.415 1.00 0.00 O ATOM 1245 CB ASP A 85 2.306 7.581 13.584 1.00 0.00 C ATOM 1246 CG ASP A 85 3.644 7.956 14.225 1.00 0.00 C ATOM 1247 OD1 ASP A 85 4.655 7.919 13.491 1.00 0.00 O ATOM 1248 OD2 ASP A 85 3.625 8.270 15.434 1.00 0.00 O ATOM 0 H ASP A 85 0.435 6.211 12.452 1.00 0.00 H new ATOM 0 HA ASP A 85 2.871 7.541 11.507 1.00 0.00 H new ATOM 0 HB2 ASP A 85 1.715 8.488 13.455 1.00 0.00 H new ATOM 0 HB3 ASP A 85 1.757 6.939 14.273 1.00 0.00 H new ATOM 1253 N TYR A 86 4.141 5.373 11.471 1.00 0.00 N ATOM 1254 CA TYR A 86 5.010 4.210 11.525 1.00 0.00 C ATOM 1255 C TYR A 86 6.429 4.605 11.940 1.00 0.00 C ATOM 1256 O TYR A 86 7.168 5.197 11.154 1.00 0.00 O ATOM 1257 CB TYR A 86 5.047 3.645 10.103 1.00 0.00 C ATOM 1258 CG TYR A 86 5.819 2.331 9.976 1.00 0.00 C ATOM 1259 CD1 TYR A 86 7.199 2.340 9.963 1.00 0.00 C ATOM 1260 CD2 TYR A 86 5.136 1.136 9.874 1.00 0.00 C ATOM 1261 CE1 TYR A 86 7.927 1.103 9.844 1.00 0.00 C ATOM 1262 CE2 TYR A 86 5.864 -0.101 9.755 1.00 0.00 C ATOM 1263 CZ TYR A 86 7.223 -0.057 9.745 1.00 0.00 C ATOM 1264 OH TYR A 86 7.910 -1.225 9.632 1.00 0.00 O ATOM 0 H TYR A 86 4.275 5.968 10.654 1.00 0.00 H new ATOM 0 HA TYR A 86 4.640 3.488 12.253 1.00 0.00 H new ATOM 0 HB2 TYR A 86 4.025 3.489 9.758 1.00 0.00 H new ATOM 0 HB3 TYR A 86 5.497 4.385 9.441 1.00 0.00 H new ATOM 0 HD1 TYR A 86 7.733 3.275 10.042 1.00 0.00 H new ATOM 0 HD2 TYR A 86 4.056 1.129 9.883 1.00 0.00 H new ATOM 0 HE1 TYR A 86 9.007 1.096 9.834 1.00 0.00 H new ATOM 0 HE2 TYR A 86 5.342 -1.043 9.675 1.00 0.00 H new ATOM 0 HH TYR A 86 7.987 -1.646 10.514 1.00 0.00 H new ATOM 1274 N ASP A 87 6.767 4.262 13.174 1.00 0.00 N ATOM 1275 CA ASP A 87 8.083 4.573 13.704 1.00 0.00 C ATOM 1276 C ASP A 87 8.354 6.071 13.540 1.00 0.00 C ATOM 1277 O ASP A 87 9.504 6.488 13.419 1.00 0.00 O ATOM 1278 CB ASP A 87 9.175 3.811 12.950 1.00 0.00 C ATOM 1279 CG ASP A 87 10.508 3.690 13.690 1.00 0.00 C ATOM 1280 OD1 ASP A 87 11.044 4.753 14.072 1.00 0.00 O ATOM 1281 OD2 ASP A 87 10.962 2.537 13.856 1.00 0.00 O ATOM 0 H ASP A 87 6.151 3.771 13.823 1.00 0.00 H new ATOM 0 HA ASP A 87 8.100 4.283 14.755 1.00 0.00 H new ATOM 0 HB2 ASP A 87 8.809 2.809 12.726 1.00 0.00 H new ATOM 0 HB3 ASP A 87 9.350 4.307 11.996 1.00 0.00 H new ATOM 1286 N GLY A 88 7.273 6.838 13.541 1.00 0.00 N ATOM 1287 CA GLY A 88 7.379 8.279 13.394 1.00 0.00 C ATOM 1288 C GLY A 88 7.052 8.710 11.963 1.00 0.00 C ATOM 1289 O GLY A 88 6.440 9.756 11.751 1.00 0.00 O ATOM 0 H GLY A 88 6.320 6.488 13.641 1.00 0.00 H new ATOM 0 HA2 GLY A 88 6.699 8.770 14.090 1.00 0.00 H new ATOM 0 HA3 GLY A 88 8.387 8.601 13.653 1.00 0.00 H new ATOM 1293 N TYR A 89 7.473 7.882 11.019 1.00 0.00 N ATOM 1294 CA TYR A 89 7.233 8.164 9.614 1.00 0.00 C ATOM 1295 C TYR A 89 5.735 8.149 9.301 1.00 0.00 C ATOM 1296 O TYR A 89 4.966 7.455 9.963 1.00 0.00 O ATOM 1297 CB TYR A 89 7.916 7.039 8.835 1.00 0.00 C ATOM 1298 CG TYR A 89 9.442 7.040 8.950 1.00 0.00 C ATOM 1299 CD1 TYR A 89 10.055 6.379 9.995 1.00 0.00 C ATOM 1300 CD2 TYR A 89 10.205 7.701 8.009 1.00 0.00 C ATOM 1301 CE1 TYR A 89 11.491 6.380 10.104 1.00 0.00 C ATOM 1302 CE2 TYR A 89 11.640 7.701 8.117 1.00 0.00 C ATOM 1303 CZ TYR A 89 12.213 7.041 9.159 1.00 0.00 C ATOM 1304 OH TYR A 89 13.569 7.041 9.262 1.00 0.00 O ATOM 0 H TYR A 89 7.979 7.015 11.199 1.00 0.00 H new ATOM 0 HA TYR A 89 7.618 9.149 9.349 1.00 0.00 H new ATOM 0 HB2 TYR A 89 7.536 6.082 9.191 1.00 0.00 H new ATOM 0 HB3 TYR A 89 7.641 7.120 7.783 1.00 0.00 H new ATOM 0 HD1 TYR A 89 9.458 5.861 10.731 1.00 0.00 H new ATOM 0 HD2 TYR A 89 9.725 8.218 7.191 1.00 0.00 H new ATOM 0 HE1 TYR A 89 11.984 5.868 10.917 1.00 0.00 H new ATOM 0 HE2 TYR A 89 12.248 8.214 7.387 1.00 0.00 H new ATOM 0 HH TYR A 89 13.954 7.550 8.518 1.00 0.00 H new ATOM 1314 N ARG A 90 5.367 8.923 8.290 1.00 0.00 N ATOM 1315 CA ARG A 90 3.975 9.008 7.881 1.00 0.00 C ATOM 1316 C ARG A 90 3.754 8.224 6.586 1.00 0.00 C ATOM 1317 O ARG A 90 4.492 8.400 5.617 1.00 0.00 O ATOM 1318 CB ARG A 90 3.551 10.462 7.668 1.00 0.00 C ATOM 1319 CG ARG A 90 2.198 10.540 6.958 1.00 0.00 C ATOM 1320 CD ARG A 90 1.569 11.925 7.127 1.00 0.00 C ATOM 1321 NE ARG A 90 0.915 12.025 8.452 1.00 0.00 N ATOM 1322 CZ ARG A 90 0.230 13.097 8.872 1.00 0.00 C ATOM 1323 NH1 ARG A 90 0.105 14.167 8.075 1.00 0.00 N ATOM 1324 NH2 ARG A 90 -0.329 13.099 10.090 1.00 0.00 N ATOM 0 H ARG A 90 6.008 9.497 7.742 1.00 0.00 H new ATOM 0 HA ARG A 90 3.368 8.578 8.678 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.491 10.972 8.630 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.306 10.982 7.078 1.00 0.00 H new ATOM 0 HG2 ARG A 90 2.327 10.322 5.898 1.00 0.00 H new ATOM 0 HG3 ARG A 90 1.528 9.781 7.361 1.00 0.00 H new ATOM 0 HD2 ARG A 90 2.334 12.695 7.031 1.00 0.00 H new ATOM 0 HD3 ARG A 90 0.839 12.101 6.337 1.00 0.00 H new ATOM 0 HE ARG A 90 0.991 11.228 9.084 1.00 0.00 H new ATOM 0 HH11 ARG A 90 0.531 14.165 7.148 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -0.417 14.983 8.395 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -0.233 12.285 10.697 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -0.851 13.915 10.410 1.00 0.00 H new ATOM 1338 N LEU A 91 2.736 7.377 6.610 1.00 0.00 N ATOM 1339 CA LEU A 91 2.409 6.566 5.450 1.00 0.00 C ATOM 1340 C LEU A 91 1.184 7.157 4.749 1.00 0.00 C ATOM 1341 O LEU A 91 0.362 7.818 5.381 1.00 0.00 O ATOM 1342 CB LEU A 91 2.241 5.099 5.851 1.00 0.00 C ATOM 1343 CG LEU A 91 3.304 4.536 6.796 1.00 0.00 C ATOM 1344 CD1 LEU A 91 3.005 3.078 7.152 1.00 0.00 C ATOM 1345 CD2 LEU A 91 4.706 4.706 6.207 1.00 0.00 C ATOM 0 H LEU A 91 2.126 7.235 7.415 1.00 0.00 H new ATOM 0 HA LEU A 91 3.228 6.583 4.730 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.265 4.981 6.322 1.00 0.00 H new ATOM 0 HB3 LEU A 91 2.232 4.494 4.944 1.00 0.00 H new ATOM 0 HG LEU A 91 3.273 5.107 7.724 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.776 2.702 7.825 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.033 3.015 7.642 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.992 2.477 6.243 1.00 0.00 H new ATOM 0 HD21 LEU A 91 5.443 4.298 6.898 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.768 4.177 5.256 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.907 5.765 6.046 1.00 0.00 H new ATOM 1357 N ARG A 92 1.101 6.897 3.452 1.00 0.00 N ATOM 1358 CA ARG A 92 -0.010 7.394 2.659 1.00 0.00 C ATOM 1359 C ARG A 92 -0.713 6.238 1.945 1.00 0.00 C ATOM 1360 O ARG A 92 -0.241 5.762 0.914 1.00 0.00 O ATOM 1361 CB ARG A 92 0.467 8.411 1.620 1.00 0.00 C ATOM 1362 CG ARG A 92 0.716 9.777 2.264 1.00 0.00 C ATOM 1363 CD ARG A 92 0.004 10.887 1.488 1.00 0.00 C ATOM 1364 NE ARG A 92 0.688 12.180 1.712 1.00 0.00 N ATOM 1365 CZ ARG A 92 0.366 13.319 1.084 1.00 0.00 C ATOM 1366 NH1 ARG A 92 -0.633 13.332 0.191 1.00 0.00 N ATOM 1367 NH2 ARG A 92 1.042 14.445 1.350 1.00 0.00 N ATOM 0 H ARG A 92 1.785 6.349 2.931 1.00 0.00 H new ATOM 0 HA ARG A 92 -0.708 7.884 3.338 1.00 0.00 H new ATOM 0 HB2 ARG A 92 1.383 8.054 1.150 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -0.279 8.507 0.831 1.00 0.00 H new ATOM 0 HG2 ARG A 92 0.364 9.766 3.296 1.00 0.00 H new ATOM 0 HG3 ARG A 92 1.787 9.979 2.295 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -0.005 10.650 0.424 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -1.036 10.956 1.808 1.00 0.00 H new ATOM 0 HE ARG A 92 1.452 12.206 2.387 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -1.148 12.475 -0.011 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -0.878 14.199 -0.287 1.00 0.00 H new ATOM 0 HH21 ARG A 92 1.802 14.435 2.031 1.00 0.00 H new ATOM 0 HH22 ARG A 92 0.797 15.312 0.872 1.00 0.00 H new ATOM 1381 N VAL A 93 -1.829 5.818 2.523 1.00 0.00 N ATOM 1382 CA VAL A 93 -2.601 4.726 1.955 1.00 0.00 C ATOM 1383 C VAL A 93 -3.753 5.299 1.127 1.00 0.00 C ATOM 1384 O VAL A 93 -4.570 6.063 1.638 1.00 0.00 O ATOM 1385 CB VAL A 93 -3.073 3.786 3.066 1.00 0.00 C ATOM 1386 CG1 VAL A 93 -3.548 2.451 2.488 1.00 0.00 C ATOM 1387 CG2 VAL A 93 -1.973 3.573 4.108 1.00 0.00 C ATOM 0 H VAL A 93 -2.217 6.214 3.379 1.00 0.00 H new ATOM 0 HA VAL A 93 -1.983 4.130 1.284 1.00 0.00 H new ATOM 0 HB VAL A 93 -3.920 4.255 3.566 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -3.878 1.801 3.298 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -4.377 2.626 1.802 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -2.728 1.974 1.952 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -2.334 2.901 4.886 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -1.097 3.135 3.629 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -1.702 4.531 4.552 1.00 0.00 H new ATOM 1397 N GLU A 94 -3.781 4.908 -0.139 1.00 0.00 N ATOM 1398 CA GLU A 94 -4.820 5.373 -1.043 1.00 0.00 C ATOM 1399 C GLU A 94 -4.934 4.436 -2.247 1.00 0.00 C ATOM 1400 O GLU A 94 -3.956 3.800 -2.638 1.00 0.00 O ATOM 1401 CB GLU A 94 -4.553 6.811 -1.490 1.00 0.00 C ATOM 1402 CG GLU A 94 -3.418 6.866 -2.514 1.00 0.00 C ATOM 1403 CD GLU A 94 -3.039 8.312 -2.838 1.00 0.00 C ATOM 1404 OE1 GLU A 94 -2.701 9.039 -1.878 1.00 0.00 O ATOM 1405 OE2 GLU A 94 -3.097 8.660 -4.037 1.00 0.00 O ATOM 0 H GLU A 94 -3.101 4.275 -0.560 1.00 0.00 H new ATOM 0 HA GLU A 94 -5.770 5.364 -0.510 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -5.459 7.235 -1.923 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -4.297 7.423 -0.625 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -2.548 6.337 -2.126 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -3.722 6.353 -3.427 1.00 0.00 H new ATOM 1412 N PHE A 95 -6.136 4.381 -2.802 1.00 0.00 N ATOM 1413 CA PHE A 95 -6.390 3.532 -3.953 1.00 0.00 C ATOM 1414 C PHE A 95 -5.782 4.134 -5.222 1.00 0.00 C ATOM 1415 O PHE A 95 -5.702 5.353 -5.358 1.00 0.00 O ATOM 1416 CB PHE A 95 -7.909 3.448 -4.120 1.00 0.00 C ATOM 1417 CG PHE A 95 -8.614 2.669 -3.008 1.00 0.00 C ATOM 1418 CD1 PHE A 95 -8.375 1.340 -2.851 1.00 0.00 C ATOM 1419 CD2 PHE A 95 -9.481 3.307 -2.176 1.00 0.00 C ATOM 1420 CE1 PHE A 95 -9.030 0.618 -1.818 1.00 0.00 C ATOM 1421 CE2 PHE A 95 -10.136 2.585 -1.144 1.00 0.00 C ATOM 1422 CZ PHE A 95 -9.897 1.255 -0.987 1.00 0.00 C ATOM 0 H PHE A 95 -6.944 4.911 -2.476 1.00 0.00 H new ATOM 0 HA PHE A 95 -5.943 2.550 -3.798 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -8.317 4.458 -4.157 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -8.134 2.978 -5.078 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -7.687 0.833 -3.512 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -9.671 4.363 -2.301 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -8.839 -0.438 -1.693 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -10.824 3.092 -0.483 1.00 0.00 H new ATOM 0 HZ PHE A 95 -10.396 0.705 -0.202 1.00 0.00 H new ATOM 1432 N PRO A 96 -5.360 3.226 -6.143 1.00 0.00 N ATOM 1433 CA PRO A 96 -4.762 3.654 -7.396 1.00 0.00 C ATOM 1434 C PRO A 96 -5.826 4.186 -8.358 1.00 0.00 C ATOM 1435 O PRO A 96 -5.604 5.180 -9.047 1.00 0.00 O ATOM 1436 CB PRO A 96 -4.040 2.426 -7.928 1.00 0.00 C ATOM 1437 CG PRO A 96 -4.644 1.239 -7.195 1.00 0.00 C ATOM 1438 CD PRO A 96 -5.439 1.774 -6.015 1.00 0.00 C ATOM 0 HA PRO A 96 -4.067 4.484 -7.268 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -4.175 2.330 -9.005 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -2.968 2.494 -7.745 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -5.289 0.667 -7.862 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -3.860 0.563 -6.852 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -6.473 1.429 -6.045 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -5.018 1.436 -5.068 1.00 0.00 H new ATOM 1446 N ARG A 97 -6.959 3.499 -8.374 1.00 0.00 N ATOM 1447 CA ARG A 97 -8.058 3.890 -9.240 1.00 0.00 C ATOM 1448 C ARG A 97 -9.207 4.469 -8.412 1.00 0.00 C ATOM 1449 O ARG A 97 -9.283 4.241 -7.206 1.00 0.00 O ATOM 1450 CB ARG A 97 -8.573 2.697 -10.049 1.00 0.00 C ATOM 1451 CG ARG A 97 -7.457 2.090 -10.901 1.00 0.00 C ATOM 1452 CD ARG A 97 -7.586 0.566 -10.968 1.00 0.00 C ATOM 1453 NE ARG A 97 -6.519 -0.068 -10.162 1.00 0.00 N ATOM 1454 CZ ARG A 97 -5.209 0.082 -10.399 1.00 0.00 C ATOM 1455 NH1 ARG A 97 -4.795 0.845 -11.420 1.00 0.00 N ATOM 1456 NH2 ARG A 97 -4.311 -0.532 -9.616 1.00 0.00 N ATOM 0 H ARG A 97 -7.139 2.674 -7.801 1.00 0.00 H new ATOM 0 HA ARG A 97 -7.684 4.648 -9.928 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -8.972 1.940 -9.374 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -9.394 3.016 -10.692 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -7.495 2.506 -11.908 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -6.487 2.359 -10.482 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -8.564 0.259 -10.598 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -7.518 0.232 -12.003 1.00 0.00 H new ATOM 0 HE ARG A 97 -6.798 -0.656 -9.377 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -5.477 1.312 -12.017 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -3.797 0.959 -11.600 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -4.625 -1.114 -8.839 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -3.314 -0.417 -9.797 1.00 0.00 H new ATOM 1470 N SER A 98 -10.071 5.207 -9.092 1.00 0.00 N ATOM 1471 CA SER A 98 -11.212 5.821 -8.434 1.00 0.00 C ATOM 1472 C SER A 98 -12.187 6.368 -9.479 1.00 0.00 C ATOM 1473 O SER A 98 -11.811 6.586 -10.630 1.00 0.00 O ATOM 1474 CB SER A 98 -10.767 6.938 -7.488 1.00 0.00 C ATOM 1475 OG SER A 98 -10.531 8.161 -8.180 1.00 0.00 O ATOM 0 H SER A 98 -10.004 5.394 -10.092 1.00 0.00 H new ATOM 0 HA SER A 98 -11.716 5.058 -7.840 1.00 0.00 H new ATOM 0 HB2 SER A 98 -11.531 7.094 -6.726 1.00 0.00 H new ATOM 0 HB3 SER A 98 -9.858 6.633 -6.970 1.00 0.00 H new ATOM 0 HG SER A 98 -10.250 8.849 -7.541 1.00 0.00 H new ATOM 1481 N GLY A 99 -13.421 6.572 -9.041 1.00 0.00 N ATOM 1482 CA GLY A 99 -14.452 7.089 -9.924 1.00 0.00 C ATOM 1483 C GLY A 99 -15.758 6.308 -9.757 1.00 0.00 C ATOM 1484 O GLY A 99 -16.243 5.694 -10.706 1.00 0.00 O ATOM 0 H GLY A 99 -13.730 6.388 -8.086 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -14.625 8.144 -9.709 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -14.115 7.025 -10.959 1.00 0.00 H new ATOM 1488 N ARG A 100 -16.289 6.358 -8.545 1.00 0.00 N ATOM 1489 CA ARG A 100 -17.529 5.663 -8.242 1.00 0.00 C ATOM 1490 C ARG A 100 -17.993 6.000 -6.824 1.00 0.00 C ATOM 1491 O ARG A 100 -17.206 5.950 -5.880 1.00 0.00 O ATOM 1492 CB ARG A 100 -17.356 4.148 -8.368 1.00 0.00 C ATOM 1493 CG ARG A 100 -18.313 3.572 -9.413 1.00 0.00 C ATOM 1494 CD ARG A 100 -18.027 2.090 -9.661 1.00 0.00 C ATOM 1495 NE ARG A 100 -18.495 1.703 -11.011 1.00 0.00 N ATOM 1496 CZ ARG A 100 -19.759 1.366 -11.300 1.00 0.00 C ATOM 1497 NH1 ARG A 100 -20.689 1.366 -10.335 1.00 0.00 N ATOM 1498 NH2 ARG A 100 -20.093 1.028 -12.553 1.00 0.00 N ATOM 0 H ARG A 100 -15.884 6.869 -7.761 1.00 0.00 H new ATOM 0 HA ARG A 100 -18.279 5.993 -8.961 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -16.327 3.918 -8.646 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -17.539 3.676 -7.403 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -19.342 3.696 -9.076 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -18.214 4.126 -10.346 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -16.958 1.897 -9.568 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -18.527 1.483 -8.906 1.00 0.00 H new ATOM 0 HE ARG A 100 -17.812 1.692 -11.769 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -20.434 1.623 -9.381 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -21.652 1.110 -10.554 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -19.385 1.027 -13.287 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -21.055 0.771 -12.773 1.00 0.00 H new ATOM 1512 N GLY A 101 -19.270 6.337 -6.718 1.00 0.00 N ATOM 1513 CA GLY A 101 -19.849 6.682 -5.431 1.00 0.00 C ATOM 1514 C GLY A 101 -20.621 8.001 -5.512 1.00 0.00 C ATOM 1515 O GLY A 101 -21.176 8.336 -6.558 1.00 0.00 O ATOM 0 H GLY A 101 -19.920 6.378 -7.503 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -20.517 5.885 -5.104 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -19.060 6.764 -4.684 1.00 0.00 H new ATOM 1519 N THR A 102 -20.630 8.714 -4.396 1.00 0.00 N ATOM 1520 CA THR A 102 -21.324 9.989 -4.328 1.00 0.00 C ATOM 1521 C THR A 102 -22.823 9.793 -4.558 1.00 0.00 C ATOM 1522 O THR A 102 -23.230 9.189 -5.549 1.00 0.00 O ATOM 1523 CB THR A 102 -20.673 10.936 -5.339 1.00 0.00 C ATOM 1524 OG1 THR A 102 -19.399 11.227 -4.772 1.00 0.00 O ATOM 1525 CG2 THR A 102 -21.372 12.295 -5.402 1.00 0.00 C ATOM 0 H THR A 102 -20.168 8.433 -3.531 1.00 0.00 H new ATOM 0 HA THR A 102 -21.235 10.436 -3.338 1.00 0.00 H new ATOM 0 HB THR A 102 -20.685 10.476 -6.327 1.00 0.00 H new ATOM 0 HG1 THR A 102 -18.908 11.834 -5.364 1.00 0.00 H new ATOM 0 HG21 THR A 102 -20.871 12.928 -6.134 1.00 0.00 H new ATOM 0 HG22 THR A 102 -22.413 12.156 -5.695 1.00 0.00 H new ATOM 0 HG23 THR A 102 -21.331 12.771 -4.422 1.00 0.00 H new ATOM 1533 N GLY A 103 -23.606 10.315 -3.624 1.00 0.00 N ATOM 1534 CA GLY A 103 -25.052 10.205 -3.712 1.00 0.00 C ATOM 1535 C GLY A 103 -25.717 10.679 -2.418 1.00 0.00 C ATOM 1536 O GLY A 103 -25.783 11.878 -2.153 1.00 0.00 O ATOM 0 H GLY A 103 -23.266 10.815 -2.803 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -25.415 10.799 -4.551 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -25.330 9.170 -3.910 1.00 0.00 H new ATOM 1540 N SER A 104 -26.194 9.712 -1.647 1.00 0.00 N ATOM 1541 CA SER A 104 -26.852 10.016 -0.388 1.00 0.00 C ATOM 1542 C SER A 104 -28.172 10.743 -0.649 1.00 0.00 C ATOM 1543 O SER A 104 -28.386 11.278 -1.736 1.00 0.00 O ATOM 1544 CB SER A 104 -25.951 10.860 0.515 1.00 0.00 C ATOM 1545 OG SER A 104 -25.322 10.076 1.525 1.00 0.00 O ATOM 0 H SER A 104 -26.138 8.718 -1.870 1.00 0.00 H new ATOM 0 HA SER A 104 -27.057 9.077 0.125 1.00 0.00 H new ATOM 0 HB2 SER A 104 -25.189 11.351 -0.090 1.00 0.00 H new ATOM 0 HB3 SER A 104 -26.542 11.647 0.983 1.00 0.00 H new ATOM 0 HG SER A 104 -24.754 10.651 2.079 1.00 0.00 H new ATOM 1551 N GLY A 105 -29.024 10.739 0.365 1.00 0.00 N ATOM 1552 CA GLY A 105 -30.318 11.392 0.259 1.00 0.00 C ATOM 1553 C GLY A 105 -31.356 10.699 1.144 1.00 0.00 C ATOM 1554 O GLY A 105 -32.189 9.940 0.651 1.00 0.00 O ATOM 0 H GLY A 105 -28.844 10.294 1.265 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -30.226 12.438 0.551 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -30.652 11.379 -0.778 1.00 0.00 H new ATOM 1558 N PRO A 106 -31.270 10.993 2.469 1.00 0.00 N ATOM 1559 CA PRO A 106 -32.192 10.407 3.426 1.00 0.00 C ATOM 1560 C PRO A 106 -33.570 11.065 3.334 1.00 0.00 C ATOM 1561 O PRO A 106 -33.752 12.198 3.779 1.00 0.00 O ATOM 1562 CB PRO A 106 -31.530 10.603 4.780 1.00 0.00 C ATOM 1563 CG PRO A 106 -30.492 11.695 4.583 1.00 0.00 C ATOM 1564 CD PRO A 106 -30.297 11.888 3.088 1.00 0.00 C ATOM 0 HA PRO A 106 -32.378 9.350 3.237 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -32.262 10.892 5.534 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -31.065 9.679 5.124 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -30.822 12.624 5.048 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -29.551 11.418 5.058 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -30.470 12.924 2.796 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -29.280 11.638 2.786 1.00 0.00 H new ATOM 1572 N SER A 107 -34.506 10.327 2.755 1.00 0.00 N ATOM 1573 CA SER A 107 -35.862 10.825 2.599 1.00 0.00 C ATOM 1574 C SER A 107 -36.562 10.872 3.959 1.00 0.00 C ATOM 1575 O SER A 107 -36.503 9.911 4.725 1.00 0.00 O ATOM 1576 CB SER A 107 -36.658 9.958 1.622 1.00 0.00 C ATOM 1577 OG SER A 107 -36.608 10.468 0.293 1.00 0.00 O ATOM 0 H SER A 107 -34.352 9.388 2.388 1.00 0.00 H new ATOM 0 HA SER A 107 -35.811 11.834 2.189 1.00 0.00 H new ATOM 0 HB2 SER A 107 -36.264 8.942 1.635 1.00 0.00 H new ATOM 0 HB3 SER A 107 -37.696 9.902 1.950 1.00 0.00 H new ATOM 0 HG SER A 107 -37.127 9.886 -0.301 1.00 0.00 H new ATOM 1583 N SER A 108 -37.208 11.999 4.217 1.00 0.00 N ATOM 1584 CA SER A 108 -37.918 12.184 5.472 1.00 0.00 C ATOM 1585 C SER A 108 -39.407 12.414 5.201 1.00 0.00 C ATOM 1586 O SER A 108 -40.252 11.661 5.683 1.00 0.00 O ATOM 1587 CB SER A 108 -37.337 13.355 6.267 1.00 0.00 C ATOM 1588 OG SER A 108 -37.240 14.539 5.480 1.00 0.00 O ATOM 0 H SER A 108 -37.255 12.793 3.579 1.00 0.00 H new ATOM 0 HA SER A 108 -37.798 11.280 6.069 1.00 0.00 H new ATOM 0 HB2 SER A 108 -37.964 13.549 7.137 1.00 0.00 H new ATOM 0 HB3 SER A 108 -36.349 13.085 6.640 1.00 0.00 H new ATOM 0 HG SER A 108 -36.866 15.264 6.024 1.00 0.00 H new ATOM 1594 N GLY A 109 -39.682 13.456 4.431 1.00 0.00 N ATOM 1595 CA GLY A 109 -41.053 13.794 4.091 1.00 0.00 C ATOM 1596 C GLY A 109 -41.914 13.923 5.349 1.00 0.00 C ATOM 1597 O GLY A 109 -41.745 14.860 6.128 1.00 0.00 O ATOM 0 H GLY A 109 -38.978 14.078 4.033 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -41.073 14.731 3.535 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -41.469 13.027 3.438 1.00 0.00 H new TER 1601 GLY A 109