USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=20 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+ -117:sc= 0.11 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 67:sc= 0.0813 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=-0.000411 USER MOD Single : A 20 ASN : amide:sc= -0.557 K(o=-0.56,f=-3.1!) USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 CYS SG : rot 180:sc= -0.444 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.0248 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot -81:sc= 0.0673 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=-0.0027) 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 120:sc= -0.478 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= 0.108 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 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.571 31.172 36.148 1.00 0.00 N ATOM 2 CA GLY A 1 -11.526 29.850 35.547 1.00 0.00 C ATOM 3 C GLY A 1 -10.221 29.642 34.776 1.00 0.00 C ATOM 4 O GLY A 1 -9.356 30.517 34.764 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.607 31.082 37.183 1.00 0.00 H new ATOM 0 H2 GLY A 1 -10.721 31.706 35.876 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.418 31.676 35.815 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -11.619 29.090 36.323 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -12.374 29.723 34.874 1.00 0.00 H new ATOM 8 N SER A 2 -10.118 28.478 34.152 1.00 0.00 N ATOM 9 CA SER A 2 -8.933 28.143 33.381 1.00 0.00 C ATOM 10 C SER A 2 -9.061 26.729 32.811 1.00 0.00 C ATOM 11 O SER A 2 -8.902 25.748 33.535 1.00 0.00 O ATOM 12 CB SER A 2 -7.669 28.259 34.236 1.00 0.00 C ATOM 13 OG SER A 2 -6.755 29.217 33.710 1.00 0.00 O ATOM 0 H SER A 2 -10.837 27.754 34.165 1.00 0.00 H new ATOM 0 HA SER A 2 -8.849 28.853 32.558 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.944 28.540 35.253 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.181 27.286 34.295 1.00 0.00 H new ATOM 0 HG SER A 2 -5.962 29.263 34.285 1.00 0.00 H new ATOM 19 N SER A 3 -9.347 26.670 31.519 1.00 0.00 N ATOM 20 CA SER A 3 -9.498 25.392 30.844 1.00 0.00 C ATOM 21 C SER A 3 -9.889 25.616 29.382 1.00 0.00 C ATOM 22 O SER A 3 -10.964 26.142 29.097 1.00 0.00 O ATOM 23 CB SER A 3 -10.541 24.519 31.545 1.00 0.00 C ATOM 24 OG SER A 3 -9.955 23.369 32.149 1.00 0.00 O ATOM 0 H SER A 3 -9.478 27.486 30.922 1.00 0.00 H new ATOM 0 HA SER A 3 -8.542 24.870 30.882 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.053 25.107 32.306 1.00 0.00 H new ATOM 0 HB3 SER A 3 -11.295 24.205 30.823 1.00 0.00 H new ATOM 0 HG SER A 3 -9.376 23.647 32.889 1.00 0.00 H new ATOM 30 N GLY A 4 -8.996 25.205 28.494 1.00 0.00 N ATOM 31 CA GLY A 4 -9.234 25.354 27.068 1.00 0.00 C ATOM 32 C GLY A 4 -9.627 24.018 26.435 1.00 0.00 C ATOM 33 O GLY A 4 -9.361 22.958 27.000 1.00 0.00 O ATOM 0 H GLY A 4 -8.106 24.769 28.734 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.025 26.086 26.902 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.337 25.740 26.584 1.00 0.00 H new ATOM 37 N SER A 5 -10.253 24.112 25.272 1.00 0.00 N ATOM 38 CA SER A 5 -10.685 22.923 24.556 1.00 0.00 C ATOM 39 C SER A 5 -9.871 22.762 23.270 1.00 0.00 C ATOM 40 O SER A 5 -9.452 23.750 22.669 1.00 0.00 O ATOM 41 CB SER A 5 -12.179 22.987 24.234 1.00 0.00 C ATOM 42 OG SER A 5 -12.549 24.238 23.661 1.00 0.00 O ATOM 0 H SER A 5 -10.472 24.993 24.807 1.00 0.00 H new ATOM 0 HA SER A 5 -10.516 22.057 25.196 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.436 22.183 23.545 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.754 22.822 25.145 1.00 0.00 H new ATOM 0 HG SER A 5 -13.510 24.238 23.468 1.00 0.00 H new ATOM 48 N SER A 6 -9.672 21.510 22.887 1.00 0.00 N ATOM 49 CA SER A 6 -8.916 21.207 21.684 1.00 0.00 C ATOM 50 C SER A 6 -9.312 19.828 21.150 1.00 0.00 C ATOM 51 O SER A 6 -9.425 18.872 21.915 1.00 0.00 O ATOM 52 CB SER A 6 -7.411 21.259 21.951 1.00 0.00 C ATOM 53 OG SER A 6 -6.694 21.824 20.857 1.00 0.00 O ATOM 0 H SER A 6 -10.021 20.693 23.388 1.00 0.00 H new ATOM 0 HA SER A 6 -9.151 21.962 20.934 1.00 0.00 H new ATOM 0 HB2 SER A 6 -7.222 21.846 22.850 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.042 20.252 22.145 1.00 0.00 H new ATOM 0 HG SER A 6 -5.737 21.841 21.067 1.00 0.00 H new ATOM 59 N GLY A 7 -9.512 19.771 19.842 1.00 0.00 N ATOM 60 CA GLY A 7 -9.893 18.526 19.197 1.00 0.00 C ATOM 61 C GLY A 7 -11.100 18.730 18.279 1.00 0.00 C ATOM 62 O GLY A 7 -11.667 19.821 18.227 1.00 0.00 O ATOM 0 H GLY A 7 -9.417 20.567 19.211 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -9.053 18.140 18.619 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -10.130 17.778 19.954 1.00 0.00 H new ATOM 66 N MET A 8 -11.458 17.664 17.579 1.00 0.00 N ATOM 67 CA MET A 8 -12.588 17.713 16.666 1.00 0.00 C ATOM 68 C MET A 8 -13.888 17.338 17.382 1.00 0.00 C ATOM 69 O MET A 8 -14.170 16.159 17.585 1.00 0.00 O ATOM 70 CB MET A 8 -12.348 16.748 15.504 1.00 0.00 C ATOM 71 CG MET A 8 -11.501 17.404 14.412 1.00 0.00 C ATOM 72 SD MET A 8 -10.242 16.270 13.852 1.00 0.00 S ATOM 73 CE MET A 8 -10.059 16.819 12.163 1.00 0.00 C ATOM 0 H MET A 8 -10.986 16.761 17.625 1.00 0.00 H new ATOM 0 HA MET A 8 -12.683 18.732 16.290 1.00 0.00 H new ATOM 0 HB2 MET A 8 -11.846 15.852 15.869 1.00 0.00 H new ATOM 0 HB3 MET A 8 -13.304 16.431 15.087 1.00 0.00 H new ATOM 0 HG2 MET A 8 -12.135 17.698 13.576 1.00 0.00 H new ATOM 0 HG3 MET A 8 -11.038 18.313 14.796 1.00 0.00 H new ATOM 0 HE1 MET A 8 -9.304 16.212 11.663 1.00 0.00 H new ATOM 0 HE2 MET A 8 -11.011 16.716 11.642 1.00 0.00 H new ATOM 0 HE3 MET A 8 -9.750 17.864 12.152 1.00 0.00 H new ATOM 83 N SER A 9 -14.643 18.365 17.744 1.00 0.00 N ATOM 84 CA SER A 9 -15.906 18.158 18.433 1.00 0.00 C ATOM 85 C SER A 9 -17.009 17.842 17.420 1.00 0.00 C ATOM 86 O SER A 9 -17.790 18.718 17.054 1.00 0.00 O ATOM 87 CB SER A 9 -16.286 19.383 19.266 1.00 0.00 C ATOM 88 OG SER A 9 -17.614 19.291 19.776 1.00 0.00 O ATOM 0 H SER A 9 -14.405 19.342 17.573 1.00 0.00 H new ATOM 0 HA SER A 9 -15.791 17.313 19.111 1.00 0.00 H new ATOM 0 HB2 SER A 9 -15.586 19.489 20.095 1.00 0.00 H new ATOM 0 HB3 SER A 9 -16.194 20.280 18.654 1.00 0.00 H new ATOM 0 HG SER A 9 -17.818 20.091 20.303 1.00 0.00 H new ATOM 94 N GLY A 10 -17.036 16.587 16.996 1.00 0.00 N ATOM 95 CA GLY A 10 -18.030 16.144 16.032 1.00 0.00 C ATOM 96 C GLY A 10 -17.385 15.309 14.924 1.00 0.00 C ATOM 97 O GLY A 10 -17.268 14.091 15.049 1.00 0.00 O ATOM 0 H GLY A 10 -16.386 15.863 17.302 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -18.795 15.555 16.538 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -18.530 17.009 15.596 1.00 0.00 H new ATOM 101 N GLY A 11 -16.984 15.997 13.866 1.00 0.00 N ATOM 102 CA GLY A 11 -16.355 15.335 12.736 1.00 0.00 C ATOM 103 C GLY A 11 -16.971 15.799 11.415 1.00 0.00 C ATOM 104 O GLY A 11 -18.099 16.288 11.390 1.00 0.00 O ATOM 0 H GLY A 11 -17.082 17.007 13.767 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -15.286 15.545 12.736 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -16.467 14.255 12.834 1.00 0.00 H new ATOM 108 N GLY A 12 -16.202 15.629 10.349 1.00 0.00 N ATOM 109 CA GLY A 12 -16.658 16.025 9.027 1.00 0.00 C ATOM 110 C GLY A 12 -16.197 15.024 7.966 1.00 0.00 C ATOM 111 O GLY A 12 -14.998 14.841 7.760 1.00 0.00 O ATOM 0 H GLY A 12 -15.267 15.223 10.374 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -17.746 16.094 9.019 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.274 17.017 8.788 1.00 0.00 H new ATOM 115 N VAL A 13 -17.173 14.403 7.320 1.00 0.00 N ATOM 116 CA VAL A 13 -16.881 13.426 6.284 1.00 0.00 C ATOM 117 C VAL A 13 -16.711 14.145 4.944 1.00 0.00 C ATOM 118 O VAL A 13 -17.605 14.866 4.505 1.00 0.00 O ATOM 119 CB VAL A 13 -17.973 12.355 6.254 1.00 0.00 C ATOM 120 CG1 VAL A 13 -19.289 12.928 5.725 1.00 0.00 C ATOM 121 CG2 VAL A 13 -17.531 11.145 5.429 1.00 0.00 C ATOM 0 H VAL A 13 -18.166 14.557 7.494 1.00 0.00 H new ATOM 0 HA VAL A 13 -15.944 12.911 6.497 1.00 0.00 H new ATOM 0 HB VAL A 13 -18.141 12.020 7.277 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -20.048 12.146 5.714 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -19.617 13.743 6.371 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -19.141 13.304 4.713 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -18.325 10.398 5.424 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -17.321 11.459 4.406 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -16.631 10.714 5.868 1.00 0.00 H new ATOM 131 N ILE A 14 -15.558 13.922 4.332 1.00 0.00 N ATOM 132 CA ILE A 14 -15.259 14.539 3.051 1.00 0.00 C ATOM 133 C ILE A 14 -16.023 13.806 1.946 1.00 0.00 C ATOM 134 O ILE A 14 -16.376 12.638 2.101 1.00 0.00 O ATOM 135 CB ILE A 14 -13.747 14.593 2.821 1.00 0.00 C ATOM 136 CG1 ILE A 14 -13.405 15.491 1.631 1.00 0.00 C ATOM 137 CG2 ILE A 14 -13.166 13.186 2.664 1.00 0.00 C ATOM 138 CD1 ILE A 14 -11.905 15.786 1.581 1.00 0.00 C ATOM 0 H ILE A 14 -14.819 13.322 4.699 1.00 0.00 H new ATOM 0 HA ILE A 14 -15.597 15.575 3.040 1.00 0.00 H new ATOM 0 HB ILE A 14 -13.283 15.036 3.702 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -13.715 15.007 0.705 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -13.961 16.426 1.704 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -12.090 13.253 2.502 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -13.362 12.609 3.568 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -13.632 12.693 1.811 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -11.688 16.426 0.726 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -11.603 16.291 2.498 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -11.353 14.851 1.483 1.00 0.00 H new ATOM 150 N ARG A 15 -16.256 14.523 0.856 1.00 0.00 N ATOM 151 CA ARG A 15 -16.972 13.955 -0.274 1.00 0.00 C ATOM 152 C ARG A 15 -16.536 12.507 -0.505 1.00 0.00 C ATOM 153 O ARG A 15 -15.355 12.184 -0.385 1.00 0.00 O ATOM 154 CB ARG A 15 -16.722 14.766 -1.547 1.00 0.00 C ATOM 155 CG ARG A 15 -15.282 14.589 -2.035 1.00 0.00 C ATOM 156 CD ARG A 15 -14.832 15.796 -2.861 1.00 0.00 C ATOM 157 NE ARG A 15 -14.194 15.341 -4.116 1.00 0.00 N ATOM 158 CZ ARG A 15 -13.540 16.149 -4.962 1.00 0.00 C ATOM 159 NH1 ARG A 15 -13.433 17.457 -4.692 1.00 0.00 N ATOM 160 NH2 ARG A 15 -12.992 15.648 -6.078 1.00 0.00 N ATOM 0 H ARG A 15 -15.962 15.492 0.731 1.00 0.00 H new ATOM 0 HA ARG A 15 -18.037 13.984 -0.042 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -17.415 14.450 -2.326 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -16.918 15.821 -1.355 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -14.618 14.460 -1.181 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -15.207 13.683 -2.637 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -15.688 16.431 -3.088 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -14.131 16.400 -2.285 1.00 0.00 H new ATOM 0 HE ARG A 15 -14.256 14.351 -4.352 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -13.849 17.838 -3.842 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -12.935 18.072 -5.336 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -13.073 14.652 -6.283 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -12.494 16.263 -6.722 1.00 0.00 H new ATOM 174 N GLY A 16 -17.513 11.674 -0.832 1.00 0.00 N ATOM 175 CA GLY A 16 -17.245 10.268 -1.081 1.00 0.00 C ATOM 176 C GLY A 16 -17.226 9.970 -2.582 1.00 0.00 C ATOM 177 O GLY A 16 -17.809 10.711 -3.372 1.00 0.00 O ATOM 0 H GLY A 16 -18.491 11.946 -0.930 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -16.287 9.993 -0.640 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -18.006 9.658 -0.595 1.00 0.00 H new ATOM 181 N PRO A 17 -16.533 8.856 -2.938 1.00 0.00 N ATOM 182 CA PRO A 17 -16.431 8.452 -4.330 1.00 0.00 C ATOM 183 C PRO A 17 -17.742 7.834 -4.819 1.00 0.00 C ATOM 184 O PRO A 17 -18.205 8.140 -5.917 1.00 0.00 O ATOM 185 CB PRO A 17 -15.264 7.479 -4.373 1.00 0.00 C ATOM 186 CG PRO A 17 -15.053 7.018 -2.939 1.00 0.00 C ATOM 187 CD PRO A 17 -15.830 7.955 -2.029 1.00 0.00 C ATOM 0 HA PRO A 17 -16.256 9.294 -5.000 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -15.483 6.635 -5.027 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -14.368 7.961 -4.764 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -15.397 5.991 -2.813 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -13.993 7.032 -2.686 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -16.528 7.405 -1.398 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -15.163 8.504 -1.364 1.00 0.00 H new ATOM 195 N ALA A 18 -18.304 6.976 -3.980 1.00 0.00 N ATOM 196 CA ALA A 18 -19.553 6.313 -4.313 1.00 0.00 C ATOM 197 C ALA A 18 -19.327 5.376 -5.502 1.00 0.00 C ATOM 198 O ALA A 18 -19.916 5.563 -6.565 1.00 0.00 O ATOM 199 CB ALA A 18 -20.630 7.363 -4.596 1.00 0.00 C ATOM 0 H ALA A 18 -17.917 6.725 -3.070 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.900 5.707 -3.476 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.567 6.865 -4.846 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -20.774 7.984 -3.712 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -20.317 7.989 -5.432 1.00 0.00 H new ATOM 205 N GLY A 19 -18.472 4.388 -5.281 1.00 0.00 N ATOM 206 CA GLY A 19 -18.160 3.422 -6.321 1.00 0.00 C ATOM 207 C GLY A 19 -17.358 2.248 -5.755 1.00 0.00 C ATOM 208 O GLY A 19 -16.196 2.058 -6.109 1.00 0.00 O ATOM 0 H GLY A 19 -17.986 4.236 -4.397 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -19.083 3.054 -6.770 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.591 3.907 -7.114 1.00 0.00 H new ATOM 212 N ASN A 20 -18.011 1.490 -4.886 1.00 0.00 N ATOM 213 CA ASN A 20 -17.373 0.340 -4.269 1.00 0.00 C ATOM 214 C ASN A 20 -16.648 -0.473 -5.342 1.00 0.00 C ATOM 215 O ASN A 20 -17.281 -1.182 -6.123 1.00 0.00 O ATOM 216 CB ASN A 20 -18.406 -0.571 -3.603 1.00 0.00 C ATOM 217 CG ASN A 20 -18.319 -0.477 -2.078 1.00 0.00 C ATOM 218 OD1 ASN A 20 -17.670 0.392 -1.520 1.00 0.00 O ATOM 219 ND2 ASN A 20 -19.007 -1.418 -1.438 1.00 0.00 N ATOM 0 H ASN A 20 -18.975 1.650 -4.595 1.00 0.00 H new ATOM 0 HA ASN A 20 -16.675 0.706 -3.516 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -19.407 -0.292 -3.931 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -18.243 -1.602 -3.917 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -19.012 -1.441 -0.418 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -19.530 -2.116 -1.967 1.00 0.00 H new ATOM 226 N ASN A 21 -15.329 -0.343 -5.348 1.00 0.00 N ATOM 227 CA ASN A 21 -14.511 -1.057 -6.313 1.00 0.00 C ATOM 228 C ASN A 21 -13.037 -0.722 -6.073 1.00 0.00 C ATOM 229 O ASN A 21 -12.564 0.339 -6.478 1.00 0.00 O ATOM 230 CB ASN A 21 -14.862 -0.646 -7.744 1.00 0.00 C ATOM 231 CG ASN A 21 -14.405 -1.707 -8.747 1.00 0.00 C ATOM 232 OD1 ASN A 21 -14.914 -2.815 -8.793 1.00 0.00 O ATOM 233 ND2 ASN A 21 -13.419 -1.307 -9.546 1.00 0.00 N ATOM 0 H ASN A 21 -14.807 0.246 -4.700 1.00 0.00 H new ATOM 0 HA ASN A 21 -14.697 -2.124 -6.188 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -15.939 -0.499 -7.830 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -14.390 0.308 -7.978 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -13.044 -1.942 -10.250 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -13.038 -0.365 -9.454 1.00 0.00 H new ATOM 240 N ASP A 22 -12.353 -1.646 -5.415 1.00 0.00 N ATOM 241 CA ASP A 22 -10.943 -1.462 -5.117 1.00 0.00 C ATOM 242 C ASP A 22 -10.562 -2.334 -3.918 1.00 0.00 C ATOM 243 O ASP A 22 -10.835 -1.975 -2.774 1.00 0.00 O ATOM 244 CB ASP A 22 -10.642 -0.006 -4.757 1.00 0.00 C ATOM 245 CG ASP A 22 -11.727 0.696 -3.938 1.00 0.00 C ATOM 246 OD1 ASP A 22 -12.389 -0.012 -3.149 1.00 0.00 O ATOM 247 OD2 ASP A 22 -11.869 1.924 -4.119 1.00 0.00 O ATOM 0 H ASP A 22 -12.749 -2.524 -5.080 1.00 0.00 H new ATOM 0 HA ASP A 22 -10.372 -1.740 -6.003 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -9.707 0.028 -4.198 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -10.483 0.555 -5.678 1.00 0.00 H new ATOM 252 N CYS A 23 -9.937 -3.462 -4.222 1.00 0.00 N ATOM 253 CA CYS A 23 -9.516 -4.387 -3.184 1.00 0.00 C ATOM 254 C CYS A 23 -8.035 -4.139 -2.892 1.00 0.00 C ATOM 255 O CYS A 23 -7.578 -4.343 -1.768 1.00 0.00 O ATOM 256 CB CYS A 23 -9.784 -5.841 -3.580 1.00 0.00 C ATOM 257 SG CYS A 23 -11.557 -6.065 -3.973 1.00 0.00 S ATOM 0 H CYS A 23 -9.712 -3.756 -5.172 1.00 0.00 H new ATOM 0 HA CYS A 23 -10.098 -4.212 -2.279 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -9.175 -6.110 -4.443 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -9.496 -6.507 -2.767 1.00 0.00 H new ATOM 0 HG CYS A 23 -11.774 -7.302 -4.310 1.00 0.00 H new ATOM 263 N ARG A 24 -7.326 -3.704 -3.923 1.00 0.00 N ATOM 264 CA ARG A 24 -5.906 -3.426 -3.791 1.00 0.00 C ATOM 265 C ARG A 24 -5.687 -1.978 -3.349 1.00 0.00 C ATOM 266 O ARG A 24 -6.250 -1.054 -3.935 1.00 0.00 O ATOM 267 CB ARG A 24 -5.172 -3.665 -5.112 1.00 0.00 C ATOM 268 CG ARG A 24 -5.663 -2.701 -6.194 1.00 0.00 C ATOM 269 CD ARG A 24 -5.748 -3.399 -7.552 1.00 0.00 C ATOM 270 NE ARG A 24 -4.872 -2.715 -8.529 1.00 0.00 N ATOM 271 CZ ARG A 24 -4.635 -3.163 -9.770 1.00 0.00 C ATOM 272 NH1 ARG A 24 -5.209 -4.298 -10.193 1.00 0.00 N ATOM 273 NH2 ARG A 24 -3.826 -2.476 -10.587 1.00 0.00 N ATOM 0 H ARG A 24 -7.708 -3.537 -4.854 1.00 0.00 H new ATOM 0 HA ARG A 24 -5.505 -4.104 -3.038 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -4.100 -3.536 -4.965 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -5.328 -4.693 -5.438 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -6.643 -2.310 -5.920 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -4.987 -1.849 -6.261 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -5.450 -4.443 -7.453 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -6.778 -3.394 -7.909 1.00 0.00 H new ATOM 0 HE ARG A 24 -4.420 -1.848 -8.240 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -5.826 -4.820 -9.571 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -5.029 -4.639 -11.137 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -3.390 -1.612 -10.265 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -3.646 -2.817 -11.531 1.00 0.00 H new ATOM 287 N ILE A 25 -4.868 -1.824 -2.318 1.00 0.00 N ATOM 288 CA ILE A 25 -4.568 -0.504 -1.791 1.00 0.00 C ATOM 289 C ILE A 25 -3.077 -0.213 -1.973 1.00 0.00 C ATOM 290 O ILE A 25 -2.243 -1.101 -1.803 1.00 0.00 O ATOM 291 CB ILE A 25 -5.046 -0.384 -0.343 1.00 0.00 C ATOM 292 CG1 ILE A 25 -4.413 -1.465 0.535 1.00 0.00 C ATOM 293 CG2 ILE A 25 -6.574 -0.405 -0.266 1.00 0.00 C ATOM 294 CD1 ILE A 25 -4.496 -1.089 2.016 1.00 0.00 C ATOM 0 H ILE A 25 -4.403 -2.592 -1.834 1.00 0.00 H new ATOM 0 HA ILE A 25 -5.112 0.260 -2.346 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.717 0.580 0.046 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -4.920 -2.416 0.369 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -3.370 -1.605 0.250 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -6.887 -0.318 0.774 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -6.979 0.430 -0.838 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -6.946 -1.342 -0.680 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -4.039 -1.875 2.617 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.968 -0.150 2.183 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -5.541 -0.974 2.304 1.00 0.00 H new ATOM 306 N TYR A 26 -2.787 1.033 -2.316 1.00 0.00 N ATOM 307 CA TYR A 26 -1.411 1.452 -2.522 1.00 0.00 C ATOM 308 C TYR A 26 -0.890 2.236 -1.317 1.00 0.00 C ATOM 309 O TYR A 26 -1.564 3.137 -0.819 1.00 0.00 O ATOM 310 CB TYR A 26 -1.429 2.371 -3.745 1.00 0.00 C ATOM 311 CG TYR A 26 -0.176 3.236 -3.891 1.00 0.00 C ATOM 312 CD1 TYR A 26 -0.109 4.465 -3.267 1.00 0.00 C ATOM 313 CD2 TYR A 26 0.888 2.789 -4.648 1.00 0.00 C ATOM 314 CE1 TYR A 26 1.070 5.280 -3.404 1.00 0.00 C ATOM 315 CE2 TYR A 26 2.067 3.603 -4.785 1.00 0.00 C ATOM 316 CZ TYR A 26 2.100 4.809 -4.157 1.00 0.00 C ATOM 317 OH TYR A 26 3.214 5.578 -4.286 1.00 0.00 O ATOM 0 H TYR A 26 -3.482 1.767 -2.457 1.00 0.00 H new ATOM 0 HA TYR A 26 -0.763 0.587 -2.659 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -1.545 1.763 -4.642 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -2.302 3.021 -3.686 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -0.942 4.816 -2.675 1.00 0.00 H new ATOM 0 HD2 TYR A 26 0.836 1.828 -5.138 1.00 0.00 H new ATOM 0 HE1 TYR A 26 1.135 6.243 -2.920 1.00 0.00 H new ATOM 0 HE2 TYR A 26 2.907 3.264 -5.373 1.00 0.00 H new ATOM 0 HH TYR A 26 3.868 5.115 -4.850 1.00 0.00 H new ATOM 327 N VAL A 27 0.306 1.866 -0.883 1.00 0.00 N ATOM 328 CA VAL A 27 0.926 2.524 0.255 1.00 0.00 C ATOM 329 C VAL A 27 2.120 3.349 -0.227 1.00 0.00 C ATOM 330 O VAL A 27 2.918 2.879 -1.036 1.00 0.00 O ATOM 331 CB VAL A 27 1.303 1.489 1.317 1.00 0.00 C ATOM 332 CG1 VAL A 27 1.774 2.169 2.603 1.00 0.00 C ATOM 333 CG2 VAL A 27 0.138 0.538 1.594 1.00 0.00 C ATOM 0 H VAL A 27 0.862 1.119 -1.299 1.00 0.00 H new ATOM 0 HA VAL A 27 0.225 3.212 0.727 1.00 0.00 H new ATOM 0 HB VAL A 27 2.132 0.898 0.928 1.00 0.00 H new ATOM 0 HG11 VAL A 27 2.036 1.411 3.341 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.648 2.785 2.390 1.00 0.00 H new ATOM 0 HG13 VAL A 27 0.975 2.797 2.996 1.00 0.00 H new ATOM 0 HG21 VAL A 27 0.433 -0.187 2.352 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.720 1.108 1.951 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.131 0.015 0.676 1.00 0.00 H new ATOM 343 N GLY A 28 2.206 4.566 0.291 1.00 0.00 N ATOM 344 CA GLY A 28 3.290 5.461 -0.076 1.00 0.00 C ATOM 345 C GLY A 28 3.908 6.112 1.163 1.00 0.00 C ATOM 346 O GLY A 28 3.405 5.942 2.273 1.00 0.00 O ATOM 0 H GLY A 28 1.542 4.953 0.962 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.055 4.907 -0.620 1.00 0.00 H new ATOM 0 HA3 GLY A 28 2.917 6.233 -0.749 1.00 0.00 H new ATOM 350 N ASN A 29 4.988 6.843 0.932 1.00 0.00 N ATOM 351 CA ASN A 29 5.679 7.520 2.016 1.00 0.00 C ATOM 352 C ASN A 29 6.124 6.489 3.055 1.00 0.00 C ATOM 353 O ASN A 29 5.764 6.588 4.227 1.00 0.00 O ATOM 354 CB ASN A 29 4.761 8.527 2.712 1.00 0.00 C ATOM 355 CG ASN A 29 4.827 9.894 2.028 1.00 0.00 C ATOM 356 OD1 ASN A 29 5.468 10.820 2.496 1.00 0.00 O ATOM 357 ND2 ASN A 29 4.131 9.967 0.897 1.00 0.00 N ATOM 0 H ASN A 29 5.402 6.981 0.010 1.00 0.00 H new ATOM 0 HA ASN A 29 6.535 8.046 1.593 1.00 0.00 H new ATOM 0 HB2 ASN A 29 3.735 8.159 2.698 1.00 0.00 H new ATOM 0 HB3 ASN A 29 5.051 8.626 3.758 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.112 10.837 0.365 1.00 0.00 H new ATOM 0 HD22 ASN A 29 3.616 9.153 0.562 1.00 0.00 H new ATOM 364 N LEU A 30 6.899 5.521 2.587 1.00 0.00 N ATOM 365 CA LEU A 30 7.396 4.472 3.461 1.00 0.00 C ATOM 366 C LEU A 30 8.873 4.727 3.768 1.00 0.00 C ATOM 367 O LEU A 30 9.541 5.468 3.049 1.00 0.00 O ATOM 368 CB LEU A 30 7.123 3.095 2.855 1.00 0.00 C ATOM 369 CG LEU A 30 5.700 2.558 3.023 1.00 0.00 C ATOM 370 CD1 LEU A 30 5.348 1.578 1.902 1.00 0.00 C ATOM 371 CD2 LEU A 30 5.508 1.938 4.408 1.00 0.00 C ATOM 0 H LEU A 30 7.195 5.441 1.614 1.00 0.00 H new ATOM 0 HA LEU A 30 6.865 4.486 4.413 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.351 3.137 1.790 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.815 2.380 3.301 1.00 0.00 H new ATOM 0 HG LEU A 30 5.007 3.396 2.947 1.00 0.00 H new ATOM 0 HD11 LEU A 30 4.332 1.211 2.045 1.00 0.00 H new ATOM 0 HD12 LEU A 30 5.419 2.085 0.940 1.00 0.00 H new ATOM 0 HD13 LEU A 30 6.043 0.738 1.921 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.488 1.564 4.501 1.00 0.00 H new ATOM 0 HD22 LEU A 30 6.210 1.114 4.538 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.689 2.693 5.173 1.00 0.00 H new ATOM 383 N PRO A 31 9.352 4.082 4.865 1.00 0.00 N ATOM 384 CA PRO A 31 10.738 4.232 5.276 1.00 0.00 C ATOM 385 C PRO A 31 11.670 3.437 4.359 1.00 0.00 C ATOM 386 O PRO A 31 11.220 2.572 3.609 1.00 0.00 O ATOM 387 CB PRO A 31 10.775 3.754 6.718 1.00 0.00 C ATOM 388 CG PRO A 31 9.517 2.924 6.915 1.00 0.00 C ATOM 389 CD PRO A 31 8.590 3.197 5.741 1.00 0.00 C ATOM 0 HA PRO A 31 11.090 5.261 5.203 1.00 0.00 H new ATOM 0 HB2 PRO A 31 11.669 3.160 6.910 1.00 0.00 H new ATOM 0 HB3 PRO A 31 10.799 4.597 7.408 1.00 0.00 H new ATOM 0 HG2 PRO A 31 9.764 1.864 6.968 1.00 0.00 H new ATOM 0 HG3 PRO A 31 9.030 3.186 7.855 1.00 0.00 H new ATOM 0 HD2 PRO A 31 8.316 2.274 5.230 1.00 0.00 H new ATOM 0 HD3 PRO A 31 7.663 3.667 6.069 1.00 0.00 H new ATOM 397 N PRO A 32 12.986 3.767 4.451 1.00 0.00 N ATOM 398 CA PRO A 32 13.986 3.094 3.639 1.00 0.00 C ATOM 399 C PRO A 32 14.266 1.687 4.170 1.00 0.00 C ATOM 400 O PRO A 32 14.690 0.810 3.419 1.00 0.00 O ATOM 401 CB PRO A 32 15.205 4.000 3.685 1.00 0.00 C ATOM 402 CG PRO A 32 15.006 4.907 4.889 1.00 0.00 C ATOM 403 CD PRO A 32 13.556 4.787 5.328 1.00 0.00 C ATOM 0 HA PRO A 32 13.659 2.941 2.610 1.00 0.00 H new ATOM 0 HB2 PRO A 32 16.121 3.417 3.782 1.00 0.00 H new ATOM 0 HB3 PRO A 32 15.294 4.582 2.768 1.00 0.00 H new ATOM 0 HG2 PRO A 32 15.675 4.618 5.699 1.00 0.00 H new ATOM 0 HG3 PRO A 32 15.243 5.940 4.632 1.00 0.00 H new ATOM 0 HD2 PRO A 32 13.482 4.495 6.375 1.00 0.00 H new ATOM 0 HD3 PRO A 32 13.031 5.737 5.224 1.00 0.00 H new ATOM 411 N ASP A 33 14.018 1.515 5.460 1.00 0.00 N ATOM 412 CA ASP A 33 14.239 0.230 6.100 1.00 0.00 C ATOM 413 C ASP A 33 12.890 -0.390 6.468 1.00 0.00 C ATOM 414 O ASP A 33 12.677 -0.788 7.613 1.00 0.00 O ATOM 415 CB ASP A 33 15.054 0.387 7.385 1.00 0.00 C ATOM 416 CG ASP A 33 16.562 0.545 7.180 1.00 0.00 C ATOM 417 OD1 ASP A 33 17.208 -0.488 6.901 1.00 0.00 O ATOM 418 OD2 ASP A 33 17.034 1.696 7.306 1.00 0.00 O ATOM 0 H ASP A 33 13.666 2.245 6.079 1.00 0.00 H new ATOM 0 HA ASP A 33 14.786 -0.404 5.402 1.00 0.00 H new ATOM 0 HB2 ASP A 33 14.684 1.256 7.928 1.00 0.00 H new ATOM 0 HB3 ASP A 33 14.878 -0.483 8.018 1.00 0.00 H new ATOM 423 N ILE A 34 12.013 -0.452 5.477 1.00 0.00 N ATOM 424 CA ILE A 34 10.690 -1.017 5.683 1.00 0.00 C ATOM 425 C ILE A 34 10.698 -2.489 5.267 1.00 0.00 C ATOM 426 O ILE A 34 11.526 -2.905 4.459 1.00 0.00 O ATOM 427 CB ILE A 34 9.632 -0.180 4.961 1.00 0.00 C ATOM 428 CG1 ILE A 34 8.222 -0.573 5.408 1.00 0.00 C ATOM 429 CG2 ILE A 34 9.799 -0.275 3.443 1.00 0.00 C ATOM 430 CD1 ILE A 34 7.934 -0.065 6.822 1.00 0.00 C ATOM 0 H ILE A 34 12.192 -0.120 4.529 1.00 0.00 H new ATOM 0 HA ILE A 34 10.423 -0.985 6.739 1.00 0.00 H new ATOM 0 HB ILE A 34 9.778 0.865 5.236 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.489 -0.162 4.714 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.116 -1.657 5.379 1.00 0.00 H new ATOM 0 HG21 ILE A 34 9.034 0.329 2.954 1.00 0.00 H new ATOM 0 HG22 ILE A 34 10.786 0.092 3.162 1.00 0.00 H new ATOM 0 HG23 ILE A 34 9.696 -1.314 3.130 1.00 0.00 H new ATOM 0 HD11 ILE A 34 6.926 -0.358 7.115 1.00 0.00 H new ATOM 0 HD12 ILE A 34 8.654 -0.497 7.517 1.00 0.00 H new ATOM 0 HD13 ILE A 34 8.017 1.022 6.842 1.00 0.00 H new ATOM 442 N ARG A 35 9.766 -3.238 5.839 1.00 0.00 N ATOM 443 CA ARG A 35 9.656 -4.655 5.538 1.00 0.00 C ATOM 444 C ARG A 35 8.222 -5.001 5.130 1.00 0.00 C ATOM 445 O ARG A 35 7.268 -4.572 5.777 1.00 0.00 O ATOM 446 CB ARG A 35 10.055 -5.507 6.744 1.00 0.00 C ATOM 447 CG ARG A 35 11.569 -5.726 6.784 1.00 0.00 C ATOM 448 CD ARG A 35 11.918 -7.190 6.508 1.00 0.00 C ATOM 449 NE ARG A 35 13.249 -7.281 5.867 1.00 0.00 N ATOM 450 CZ ARG A 35 14.407 -7.080 6.511 1.00 0.00 C ATOM 451 NH1 ARG A 35 14.405 -6.776 7.816 1.00 0.00 N ATOM 452 NH2 ARG A 35 15.568 -7.183 5.849 1.00 0.00 N ATOM 0 H ARG A 35 9.080 -2.890 6.509 1.00 0.00 H new ATOM 0 HA ARG A 35 10.335 -4.872 4.713 1.00 0.00 H new ATOM 0 HB2 ARG A 35 9.730 -5.018 7.663 1.00 0.00 H new ATOM 0 HB3 ARG A 35 9.546 -6.470 6.698 1.00 0.00 H new ATOM 0 HG2 ARG A 35 12.052 -5.087 6.044 1.00 0.00 H new ATOM 0 HG3 ARG A 35 11.957 -5.434 7.760 1.00 0.00 H new ATOM 0 HD2 ARG A 35 11.915 -7.755 7.440 1.00 0.00 H new ATOM 0 HD3 ARG A 35 11.163 -7.637 5.862 1.00 0.00 H new ATOM 0 HE ARG A 35 13.287 -7.511 4.874 1.00 0.00 H new ATOM 0 HH11 ARG A 35 13.522 -6.697 8.320 1.00 0.00 H new ATOM 0 HH12 ARG A 35 15.287 -6.623 8.305 1.00 0.00 H new ATOM 0 HH21 ARG A 35 15.570 -7.414 4.856 1.00 0.00 H new ATOM 0 HH22 ARG A 35 16.450 -7.030 6.339 1.00 0.00 H new ATOM 466 N THR A 36 8.116 -5.773 4.059 1.00 0.00 N ATOM 467 CA THR A 36 6.815 -6.181 3.557 1.00 0.00 C ATOM 468 C THR A 36 5.982 -6.804 4.679 1.00 0.00 C ATOM 469 O THR A 36 4.763 -6.644 4.714 1.00 0.00 O ATOM 470 CB THR A 36 7.039 -7.122 2.372 1.00 0.00 C ATOM 471 OG1 THR A 36 7.954 -6.418 1.537 1.00 0.00 O ATOM 472 CG2 THR A 36 5.789 -7.280 1.504 1.00 0.00 C ATOM 0 H THR A 36 8.910 -6.127 3.525 1.00 0.00 H new ATOM 0 HA THR A 36 6.240 -5.324 3.206 1.00 0.00 H new ATOM 0 HB THR A 36 7.351 -8.099 2.740 1.00 0.00 H new ATOM 0 HG1 THR A 36 8.156 -6.958 0.744 1.00 0.00 H new ATOM 0 HG21 THR A 36 6.003 -7.958 0.678 1.00 0.00 H new ATOM 0 HG22 THR A 36 4.977 -7.687 2.106 1.00 0.00 H new ATOM 0 HG23 THR A 36 5.495 -6.308 1.109 1.00 0.00 H new ATOM 480 N LYS A 37 6.673 -7.502 5.568 1.00 0.00 N ATOM 481 CA LYS A 37 6.013 -8.151 6.688 1.00 0.00 C ATOM 482 C LYS A 37 5.507 -7.085 7.662 1.00 0.00 C ATOM 483 O LYS A 37 4.318 -7.040 7.976 1.00 0.00 O ATOM 484 CB LYS A 37 6.940 -9.183 7.332 1.00 0.00 C ATOM 485 CG LYS A 37 6.188 -10.479 7.640 1.00 0.00 C ATOM 486 CD LYS A 37 6.593 -11.592 6.671 1.00 0.00 C ATOM 487 CE LYS A 37 7.103 -12.819 7.429 1.00 0.00 C ATOM 488 NZ LYS A 37 5.979 -13.712 7.787 1.00 0.00 N ATOM 0 H LYS A 37 7.684 -7.632 5.535 1.00 0.00 H new ATOM 0 HA LYS A 37 5.142 -8.710 6.346 1.00 0.00 H new ATOM 0 HB2 LYS A 37 7.776 -9.393 6.664 1.00 0.00 H new ATOM 0 HB3 LYS A 37 7.361 -8.775 8.251 1.00 0.00 H new ATOM 0 HG2 LYS A 37 6.396 -10.790 8.664 1.00 0.00 H new ATOM 0 HG3 LYS A 37 5.114 -10.305 7.572 1.00 0.00 H new ATOM 0 HD2 LYS A 37 5.739 -11.870 6.054 1.00 0.00 H new ATOM 0 HD3 LYS A 37 7.368 -11.228 5.997 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.823 -13.360 6.815 1.00 0.00 H new ATOM 0 HE3 LYS A 37 7.627 -12.504 8.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 6.343 -14.540 8.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 5.306 -13.198 8.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 5.496 -14.027 6.921 1.00 0.00 H new ATOM 502 N ASP A 38 6.435 -6.253 8.113 1.00 0.00 N ATOM 503 CA ASP A 38 6.098 -5.191 9.046 1.00 0.00 C ATOM 504 C ASP A 38 4.871 -4.436 8.530 1.00 0.00 C ATOM 505 O ASP A 38 4.023 -4.013 9.314 1.00 0.00 O ATOM 506 CB ASP A 38 7.247 -4.190 9.179 1.00 0.00 C ATOM 507 CG ASP A 38 8.446 -4.687 9.990 1.00 0.00 C ATOM 508 OD1 ASP A 38 8.446 -5.892 10.323 1.00 0.00 O ATOM 509 OD2 ASP A 38 9.335 -3.851 10.258 1.00 0.00 O ATOM 0 H ASP A 38 7.420 -6.293 7.850 1.00 0.00 H new ATOM 0 HA ASP A 38 5.901 -5.645 10.017 1.00 0.00 H new ATOM 0 HB2 ASP A 38 7.590 -3.918 8.181 1.00 0.00 H new ATOM 0 HB3 ASP A 38 6.865 -3.281 9.643 1.00 0.00 H new ATOM 514 N ILE A 39 4.816 -4.290 7.214 1.00 0.00 N ATOM 515 CA ILE A 39 3.707 -3.593 6.585 1.00 0.00 C ATOM 516 C ILE A 39 2.461 -4.480 6.630 1.00 0.00 C ATOM 517 O ILE A 39 1.342 -3.980 6.728 1.00 0.00 O ATOM 518 CB ILE A 39 4.090 -3.141 5.174 1.00 0.00 C ATOM 519 CG1 ILE A 39 5.364 -2.294 5.196 1.00 0.00 C ATOM 520 CG2 ILE A 39 2.927 -2.411 4.498 1.00 0.00 C ATOM 521 CD1 ILE A 39 5.988 -2.205 3.802 1.00 0.00 C ATOM 0 H ILE A 39 5.521 -4.642 6.567 1.00 0.00 H new ATOM 0 HA ILE A 39 3.469 -2.682 7.133 1.00 0.00 H new ATOM 0 HB ILE A 39 4.304 -4.028 4.577 1.00 0.00 H new ATOM 0 HG12 ILE A 39 5.133 -1.293 5.559 1.00 0.00 H new ATOM 0 HG13 ILE A 39 6.081 -2.728 5.892 1.00 0.00 H new ATOM 0 HG21 ILE A 39 3.225 -2.100 3.497 1.00 0.00 H new ATOM 0 HG22 ILE A 39 2.068 -3.079 4.430 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.658 -1.533 5.085 1.00 0.00 H new ATOM 0 HD11 ILE A 39 6.892 -1.597 3.846 1.00 0.00 H new ATOM 0 HD12 ILE A 39 6.240 -3.206 3.452 1.00 0.00 H new ATOM 0 HD13 ILE A 39 5.277 -1.748 3.114 1.00 0.00 H new ATOM 533 N GLU A 40 2.698 -5.782 6.555 1.00 0.00 N ATOM 534 CA GLU A 40 1.609 -6.743 6.586 1.00 0.00 C ATOM 535 C GLU A 40 0.892 -6.690 7.937 1.00 0.00 C ATOM 536 O GLU A 40 -0.280 -6.324 8.007 1.00 0.00 O ATOM 537 CB GLU A 40 2.116 -8.156 6.290 1.00 0.00 C ATOM 538 CG GLU A 40 1.357 -9.196 7.116 1.00 0.00 C ATOM 539 CD GLU A 40 1.435 -10.578 6.464 1.00 0.00 C ATOM 540 OE1 GLU A 40 2.409 -10.796 5.712 1.00 0.00 O ATOM 541 OE2 GLU A 40 0.519 -11.385 6.733 1.00 0.00 O ATOM 0 H GLU A 40 3.628 -6.193 6.473 1.00 0.00 H new ATOM 0 HA GLU A 40 0.894 -6.478 5.807 1.00 0.00 H new ATOM 0 HB2 GLU A 40 1.998 -8.373 5.228 1.00 0.00 H new ATOM 0 HB3 GLU A 40 3.181 -8.218 6.512 1.00 0.00 H new ATOM 0 HG2 GLU A 40 1.774 -9.241 8.122 1.00 0.00 H new ATOM 0 HG3 GLU A 40 0.314 -8.896 7.216 1.00 0.00 H new ATOM 548 N ASP A 41 1.626 -7.061 8.975 1.00 0.00 N ATOM 549 CA ASP A 41 1.075 -7.060 10.320 1.00 0.00 C ATOM 550 C ASP A 41 0.223 -5.805 10.516 1.00 0.00 C ATOM 551 O ASP A 41 -0.907 -5.886 10.995 1.00 0.00 O ATOM 552 CB ASP A 41 2.187 -7.046 11.371 1.00 0.00 C ATOM 553 CG ASP A 41 1.735 -6.677 12.785 1.00 0.00 C ATOM 554 OD1 ASP A 41 0.891 -7.424 13.324 1.00 0.00 O ATOM 555 OD2 ASP A 41 2.245 -5.656 13.295 1.00 0.00 O ATOM 0 H ASP A 41 2.598 -7.364 8.912 1.00 0.00 H new ATOM 0 HA ASP A 41 0.477 -7.963 10.440 1.00 0.00 H new ATOM 0 HB2 ASP A 41 2.652 -8.032 11.400 1.00 0.00 H new ATOM 0 HB3 ASP A 41 2.956 -6.340 11.056 1.00 0.00 H new ATOM 560 N VAL A 42 0.798 -4.673 10.136 1.00 0.00 N ATOM 561 CA VAL A 42 0.105 -3.402 10.265 1.00 0.00 C ATOM 562 C VAL A 42 -1.346 -3.569 9.811 1.00 0.00 C ATOM 563 O VAL A 42 -2.269 -3.459 10.618 1.00 0.00 O ATOM 564 CB VAL A 42 0.853 -2.317 9.487 1.00 0.00 C ATOM 565 CG1 VAL A 42 0.005 -1.051 9.359 1.00 0.00 C ATOM 566 CG2 VAL A 42 2.203 -2.009 10.138 1.00 0.00 C ATOM 0 H VAL A 42 1.735 -4.610 9.739 1.00 0.00 H new ATOM 0 HA VAL A 42 0.085 -3.082 11.307 1.00 0.00 H new ATOM 0 HB VAL A 42 1.043 -2.695 8.483 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.560 -0.296 8.802 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -0.920 -1.284 8.831 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -0.231 -0.669 10.352 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.715 -1.235 9.566 1.00 0.00 H new ATOM 0 HG22 VAL A 42 2.044 -1.661 11.159 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.814 -2.912 10.154 1.00 0.00 H new ATOM 576 N PHE A 43 -1.504 -3.831 8.522 1.00 0.00 N ATOM 577 CA PHE A 43 -2.827 -4.015 7.952 1.00 0.00 C ATOM 578 C PHE A 43 -3.492 -5.277 8.503 1.00 0.00 C ATOM 579 O PHE A 43 -4.707 -5.312 8.692 1.00 0.00 O ATOM 580 CB PHE A 43 -2.646 -4.167 6.440 1.00 0.00 C ATOM 581 CG PHE A 43 -2.424 -2.844 5.704 1.00 0.00 C ATOM 582 CD1 PHE A 43 -3.487 -2.061 5.377 1.00 0.00 C ATOM 583 CD2 PHE A 43 -1.164 -2.452 5.376 1.00 0.00 C ATOM 584 CE1 PHE A 43 -3.281 -0.834 4.694 1.00 0.00 C ATOM 585 CE2 PHE A 43 -0.958 -1.224 4.692 1.00 0.00 C ATOM 586 CZ PHE A 43 -2.021 -0.441 4.365 1.00 0.00 C ATOM 0 H PHE A 43 -0.737 -3.920 7.856 1.00 0.00 H new ATOM 0 HA PHE A 43 -3.461 -3.164 8.203 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -1.797 -4.824 6.250 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -3.527 -4.658 6.026 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -4.488 -2.373 5.637 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -0.320 -3.074 5.635 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -4.125 -0.212 4.435 1.00 0.00 H new ATOM 0 HE2 PHE A 43 0.043 -0.912 4.432 1.00 0.00 H new ATOM 0 HZ PHE A 43 -1.865 0.492 3.844 1.00 0.00 H new ATOM 596 N TYR A 44 -2.666 -6.285 8.746 1.00 0.00 N ATOM 597 CA TYR A 44 -3.159 -7.546 9.272 1.00 0.00 C ATOM 598 C TYR A 44 -4.000 -7.324 10.531 1.00 0.00 C ATOM 599 O TYR A 44 -4.786 -8.188 10.917 1.00 0.00 O ATOM 600 CB TYR A 44 -1.918 -8.363 9.640 1.00 0.00 C ATOM 601 CG TYR A 44 -2.151 -9.875 9.654 1.00 0.00 C ATOM 602 CD1 TYR A 44 -2.658 -10.485 10.784 1.00 0.00 C ATOM 603 CD2 TYR A 44 -1.854 -10.630 8.537 1.00 0.00 C ATOM 604 CE1 TYR A 44 -2.876 -11.908 10.797 1.00 0.00 C ATOM 605 CE2 TYR A 44 -2.072 -12.053 8.551 1.00 0.00 C ATOM 606 CZ TYR A 44 -2.573 -12.622 9.680 1.00 0.00 C ATOM 607 OH TYR A 44 -2.779 -13.966 9.693 1.00 0.00 O ATOM 0 H TYR A 44 -1.659 -6.253 8.588 1.00 0.00 H new ATOM 0 HA TYR A 44 -3.788 -8.048 8.537 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -1.122 -8.135 8.931 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -1.568 -8.050 10.624 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -2.891 -9.895 11.658 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -1.458 -10.153 7.653 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -3.271 -12.398 11.675 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -1.843 -12.655 7.684 1.00 0.00 H new ATOM 0 HH TYR A 44 -2.519 -14.345 8.827 1.00 0.00 H new ATOM 617 N LYS A 45 -3.806 -6.162 11.136 1.00 0.00 N ATOM 618 CA LYS A 45 -4.537 -5.815 12.343 1.00 0.00 C ATOM 619 C LYS A 45 -6.038 -5.816 12.043 1.00 0.00 C ATOM 620 O LYS A 45 -6.857 -5.834 12.960 1.00 0.00 O ATOM 621 CB LYS A 45 -4.026 -4.493 12.918 1.00 0.00 C ATOM 622 CG LYS A 45 -4.721 -3.301 12.256 1.00 0.00 C ATOM 623 CD LYS A 45 -4.272 -1.983 12.890 1.00 0.00 C ATOM 624 CE LYS A 45 -5.421 -1.322 13.653 1.00 0.00 C ATOM 625 NZ LYS A 45 -4.899 -0.509 14.774 1.00 0.00 N ATOM 0 H LYS A 45 -3.153 -5.448 10.813 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.366 -6.561 13.119 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -4.201 -4.469 13.994 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -2.949 -4.419 12.768 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.496 -3.291 11.189 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.802 -3.406 12.353 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -3.439 -2.167 13.568 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -3.909 -1.308 12.115 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -5.999 -0.692 12.977 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -6.099 -2.086 14.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -5.692 -0.067 15.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -4.367 -1.119 15.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -4.270 0.232 14.402 1.00 0.00 H new ATOM 639 N TYR A 46 -6.352 -5.796 10.756 1.00 0.00 N ATOM 640 CA TYR A 46 -7.739 -5.794 10.325 1.00 0.00 C ATOM 641 C TYR A 46 -8.187 -7.198 9.914 1.00 0.00 C ATOM 642 O TYR A 46 -9.149 -7.733 10.464 1.00 0.00 O ATOM 643 CB TYR A 46 -7.799 -4.875 9.103 1.00 0.00 C ATOM 644 CG TYR A 46 -8.002 -3.397 9.446 1.00 0.00 C ATOM 645 CD1 TYR A 46 -9.235 -2.952 9.878 1.00 0.00 C ATOM 646 CD2 TYR A 46 -6.952 -2.510 9.323 1.00 0.00 C ATOM 647 CE1 TYR A 46 -9.426 -1.562 10.201 1.00 0.00 C ATOM 648 CE2 TYR A 46 -7.143 -1.119 9.645 1.00 0.00 C ATOM 649 CZ TYR A 46 -8.371 -0.714 10.068 1.00 0.00 C ATOM 650 OH TYR A 46 -8.551 0.599 10.373 1.00 0.00 O ATOM 0 H TYR A 46 -5.670 -5.781 9.998 1.00 0.00 H new ATOM 0 HA TYR A 46 -8.391 -5.460 11.132 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -6.875 -4.982 8.535 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -8.612 -5.202 8.455 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -10.057 -3.646 9.974 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -5.987 -2.859 8.985 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -10.385 -1.201 10.541 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -6.330 -0.414 9.553 1.00 0.00 H new ATOM 0 HH TYR A 46 -8.976 1.055 9.617 1.00 0.00 H new ATOM 660 N GLY A 47 -7.469 -7.755 8.950 1.00 0.00 N ATOM 661 CA GLY A 47 -7.781 -9.087 8.459 1.00 0.00 C ATOM 662 C GLY A 47 -6.523 -9.790 7.943 1.00 0.00 C ATOM 663 O GLY A 47 -5.521 -9.875 8.652 1.00 0.00 O ATOM 0 H GLY A 47 -6.672 -7.309 8.496 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -8.230 -9.677 9.258 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.519 -9.020 7.659 1.00 0.00 H new ATOM 667 N ALA A 48 -6.617 -10.275 6.714 1.00 0.00 N ATOM 668 CA ALA A 48 -5.499 -10.968 6.096 1.00 0.00 C ATOM 669 C ALA A 48 -5.102 -10.240 4.810 1.00 0.00 C ATOM 670 O ALA A 48 -5.876 -9.446 4.278 1.00 0.00 O ATOM 671 CB ALA A 48 -5.878 -12.429 5.846 1.00 0.00 C ATOM 0 H ALA A 48 -7.450 -10.202 6.129 1.00 0.00 H new ATOM 0 HA ALA A 48 -4.633 -10.965 6.758 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -5.039 -12.948 5.382 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -6.123 -12.909 6.794 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -6.742 -12.472 5.183 1.00 0.00 H new ATOM 677 N ILE A 49 -3.896 -10.537 4.348 1.00 0.00 N ATOM 678 CA ILE A 49 -3.387 -9.921 3.134 1.00 0.00 C ATOM 679 C ILE A 49 -3.156 -11.002 2.077 1.00 0.00 C ATOM 680 O ILE A 49 -2.583 -12.050 2.371 1.00 0.00 O ATOM 681 CB ILE A 49 -2.144 -9.084 3.440 1.00 0.00 C ATOM 682 CG1 ILE A 49 -2.511 -7.821 4.222 1.00 0.00 C ATOM 683 CG2 ILE A 49 -1.372 -8.760 2.158 1.00 0.00 C ATOM 684 CD1 ILE A 49 -1.285 -7.235 4.924 1.00 0.00 C ATOM 0 H ILE A 49 -3.257 -11.196 4.792 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.119 -9.225 2.723 1.00 0.00 H new ATOM 0 HB ILE A 49 -1.483 -9.674 4.074 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -2.935 -7.080 3.545 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -3.279 -8.056 4.959 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -0.493 -8.164 2.403 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -1.059 -9.687 1.677 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -2.013 -8.198 1.479 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.574 -6.338 5.472 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -0.878 -7.970 5.619 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -0.529 -6.979 4.182 1.00 0.00 H new ATOM 696 N ARG A 50 -3.614 -10.711 0.868 1.00 0.00 N ATOM 697 CA ARG A 50 -3.464 -11.645 -0.234 1.00 0.00 C ATOM 698 C ARG A 50 -2.016 -11.657 -0.727 1.00 0.00 C ATOM 699 O ARG A 50 -1.448 -12.720 -0.971 1.00 0.00 O ATOM 700 CB ARG A 50 -4.389 -11.278 -1.397 1.00 0.00 C ATOM 701 CG ARG A 50 -4.079 -12.125 -2.632 1.00 0.00 C ATOM 702 CD ARG A 50 -5.362 -12.684 -3.250 1.00 0.00 C ATOM 703 NE ARG A 50 -5.284 -14.160 -3.331 1.00 0.00 N ATOM 704 CZ ARG A 50 -4.719 -14.827 -4.346 1.00 0.00 C ATOM 705 NH1 ARG A 50 -4.179 -14.156 -5.372 1.00 0.00 N ATOM 706 NH2 ARG A 50 -4.694 -16.167 -4.335 1.00 0.00 N ATOM 0 H ARG A 50 -4.089 -9.841 0.628 1.00 0.00 H new ATOM 0 HA ARG A 50 -3.735 -12.635 0.132 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -5.428 -11.426 -1.101 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.274 -10.221 -1.638 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -3.550 -11.520 -3.369 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -3.416 -12.945 -2.358 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -6.223 -12.390 -2.650 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -5.509 -12.264 -4.245 1.00 0.00 H new ATOM 0 HE ARG A 50 -5.685 -14.703 -2.566 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -4.198 -13.136 -5.381 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -3.749 -14.665 -6.144 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.105 -16.678 -3.554 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -4.264 -16.675 -5.108 1.00 0.00 H new ATOM 720 N ASP A 51 -1.460 -10.462 -0.860 1.00 0.00 N ATOM 721 CA ASP A 51 -0.089 -10.321 -1.319 1.00 0.00 C ATOM 722 C ASP A 51 0.336 -8.856 -1.202 1.00 0.00 C ATOM 723 O ASP A 51 -0.508 -7.961 -1.177 1.00 0.00 O ATOM 724 CB ASP A 51 0.046 -10.736 -2.786 1.00 0.00 C ATOM 725 CG ASP A 51 1.484 -10.888 -3.285 1.00 0.00 C ATOM 726 OD1 ASP A 51 2.065 -11.963 -3.023 1.00 0.00 O ATOM 727 OD2 ASP A 51 1.970 -9.926 -3.918 1.00 0.00 O ATOM 0 H ASP A 51 -1.935 -9.582 -0.658 1.00 0.00 H new ATOM 0 HA ASP A 51 0.540 -10.963 -0.703 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -0.474 -11.683 -2.929 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -0.461 -9.996 -3.405 1.00 0.00 H new ATOM 732 N ILE A 52 1.644 -8.656 -1.133 1.00 0.00 N ATOM 733 CA ILE A 52 2.191 -7.315 -1.019 1.00 0.00 C ATOM 734 C ILE A 52 3.268 -7.115 -2.088 1.00 0.00 C ATOM 735 O ILE A 52 4.336 -7.721 -2.018 1.00 0.00 O ATOM 736 CB ILE A 52 2.683 -7.056 0.406 1.00 0.00 C ATOM 737 CG1 ILE A 52 1.538 -7.181 1.413 1.00 0.00 C ATOM 738 CG2 ILE A 52 3.390 -5.703 0.505 1.00 0.00 C ATOM 739 CD1 ILE A 52 2.063 -7.580 2.794 1.00 0.00 C ATOM 0 H ILE A 52 2.341 -9.401 -1.154 1.00 0.00 H new ATOM 0 HA ILE A 52 1.416 -6.571 -1.204 1.00 0.00 H new ATOM 0 HB ILE A 52 3.417 -7.821 0.658 1.00 0.00 H new ATOM 0 HG12 ILE A 52 1.005 -6.233 1.483 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.821 -7.924 1.064 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.730 -5.544 1.528 1.00 0.00 H new ATOM 0 HG22 ILE A 52 4.247 -5.690 -0.168 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.697 -4.909 0.225 1.00 0.00 H new ATOM 0 HD11 ILE A 52 1.229 -7.662 3.491 1.00 0.00 H new ATOM 0 HD12 ILE A 52 2.574 -8.540 2.725 1.00 0.00 H new ATOM 0 HD13 ILE A 52 2.761 -6.822 3.151 1.00 0.00 H new ATOM 751 N ASP A 53 2.950 -6.263 -3.051 1.00 0.00 N ATOM 752 CA ASP A 53 3.877 -5.976 -4.132 1.00 0.00 C ATOM 753 C ASP A 53 4.618 -4.672 -3.830 1.00 0.00 C ATOM 754 O ASP A 53 4.023 -3.595 -3.853 1.00 0.00 O ATOM 755 CB ASP A 53 3.138 -5.802 -5.460 1.00 0.00 C ATOM 756 CG ASP A 53 2.461 -7.067 -5.993 1.00 0.00 C ATOM 757 OD1 ASP A 53 1.559 -7.568 -5.288 1.00 0.00 O ATOM 758 OD2 ASP A 53 2.861 -7.504 -7.094 1.00 0.00 O ATOM 0 H ASP A 53 2.063 -5.762 -3.105 1.00 0.00 H new ATOM 0 HA ASP A 53 4.571 -6.813 -4.212 1.00 0.00 H new ATOM 0 HB2 ASP A 53 2.382 -5.027 -5.339 1.00 0.00 H new ATOM 0 HB3 ASP A 53 3.845 -5.444 -6.208 1.00 0.00 H new ATOM 763 N LEU A 54 5.906 -4.811 -3.554 1.00 0.00 N ATOM 764 CA LEU A 54 6.735 -3.657 -3.248 1.00 0.00 C ATOM 765 C LEU A 54 7.761 -3.460 -4.365 1.00 0.00 C ATOM 766 O LEU A 54 8.512 -4.378 -4.692 1.00 0.00 O ATOM 767 CB LEU A 54 7.359 -3.799 -1.858 1.00 0.00 C ATOM 768 CG LEU A 54 8.538 -2.872 -1.554 1.00 0.00 C ATOM 769 CD1 LEU A 54 8.063 -1.588 -0.871 1.00 0.00 C ATOM 770 CD2 LEU A 54 9.607 -3.596 -0.733 1.00 0.00 C ATOM 0 H LEU A 54 6.396 -5.705 -3.536 1.00 0.00 H new ATOM 0 HA LEU A 54 6.128 -2.752 -3.209 1.00 0.00 H new ATOM 0 HB2 LEU A 54 6.583 -3.623 -1.113 1.00 0.00 H new ATOM 0 HB3 LEU A 54 7.692 -4.830 -1.734 1.00 0.00 H new ATOM 0 HG LEU A 54 8.998 -2.583 -2.499 1.00 0.00 H new ATOM 0 HD11 LEU A 54 8.920 -0.947 -0.666 1.00 0.00 H new ATOM 0 HD12 LEU A 54 7.366 -1.064 -1.525 1.00 0.00 H new ATOM 0 HD13 LEU A 54 7.564 -1.837 0.065 1.00 0.00 H new ATOM 0 HD21 LEU A 54 10.434 -2.915 -0.531 1.00 0.00 H new ATOM 0 HD22 LEU A 54 9.176 -3.933 0.210 1.00 0.00 H new ATOM 0 HD23 LEU A 54 9.974 -4.457 -1.292 1.00 0.00 H new ATOM 782 N LYS A 55 7.761 -2.257 -4.921 1.00 0.00 N ATOM 783 CA LYS A 55 8.682 -1.929 -5.995 1.00 0.00 C ATOM 784 C LYS A 55 10.094 -1.784 -5.423 1.00 0.00 C ATOM 785 O LYS A 55 10.933 -2.665 -5.602 1.00 0.00 O ATOM 786 CB LYS A 55 8.198 -0.694 -6.758 1.00 0.00 C ATOM 787 CG LYS A 55 7.239 -1.086 -7.884 1.00 0.00 C ATOM 788 CD LYS A 55 5.880 -1.512 -7.324 1.00 0.00 C ATOM 789 CE LYS A 55 4.832 -1.599 -8.435 1.00 0.00 C ATOM 790 NZ LYS A 55 4.205 -2.939 -8.453 1.00 0.00 N ATOM 0 H LYS A 55 7.137 -1.498 -4.647 1.00 0.00 H new ATOM 0 HA LYS A 55 8.715 -2.735 -6.728 1.00 0.00 H new ATOM 0 HB2 LYS A 55 7.698 -0.011 -6.071 1.00 0.00 H new ATOM 0 HB3 LYS A 55 9.053 -0.160 -7.173 1.00 0.00 H new ATOM 0 HG2 LYS A 55 7.108 -0.245 -8.564 1.00 0.00 H new ATOM 0 HG3 LYS A 55 7.669 -1.902 -8.465 1.00 0.00 H new ATOM 0 HD2 LYS A 55 5.973 -2.479 -6.831 1.00 0.00 H new ATOM 0 HD3 LYS A 55 5.555 -0.798 -6.567 1.00 0.00 H new ATOM 0 HE2 LYS A 55 4.069 -0.836 -8.283 1.00 0.00 H new ATOM 0 HE3 LYS A 55 5.298 -1.396 -9.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 3.496 -2.980 -9.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 4.934 -3.661 -8.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 3.743 -3.118 -7.539 1.00 0.00 H new ATOM 804 N ASN A 56 10.312 -0.665 -4.748 1.00 0.00 N ATOM 805 CA ASN A 56 11.608 -0.393 -4.149 1.00 0.00 C ATOM 806 C ASN A 56 12.640 -0.169 -5.256 1.00 0.00 C ATOM 807 O ASN A 56 13.135 -1.126 -5.851 1.00 0.00 O ATOM 808 CB ASN A 56 12.079 -1.573 -3.296 1.00 0.00 C ATOM 809 CG ASN A 56 12.890 -1.089 -2.092 1.00 0.00 C ATOM 810 OD1 ASN A 56 12.356 -0.725 -1.057 1.00 0.00 O ATOM 811 ND2 ASN A 56 14.206 -1.107 -2.284 1.00 0.00 N ATOM 0 H ASN A 56 9.613 0.064 -4.603 1.00 0.00 H new ATOM 0 HA ASN A 56 11.509 0.491 -3.519 1.00 0.00 H new ATOM 0 HB2 ASN A 56 11.217 -2.145 -2.952 1.00 0.00 H new ATOM 0 HB3 ASN A 56 12.687 -2.245 -3.902 1.00 0.00 H new ATOM 0 HD21 ASN A 56 14.834 -0.804 -1.540 1.00 0.00 H new ATOM 0 HD22 ASN A 56 14.587 -1.424 -3.176 1.00 0.00 H new ATOM 818 N ARG A 57 12.934 1.100 -5.500 1.00 0.00 N ATOM 819 CA ARG A 57 13.898 1.461 -6.525 1.00 0.00 C ATOM 820 C ARG A 57 13.911 2.977 -6.730 1.00 0.00 C ATOM 821 O ARG A 57 13.025 3.681 -6.246 1.00 0.00 O ATOM 822 CB ARG A 57 13.571 0.777 -7.854 1.00 0.00 C ATOM 823 CG ARG A 57 14.816 0.117 -8.451 1.00 0.00 C ATOM 824 CD ARG A 57 14.994 0.511 -9.919 1.00 0.00 C ATOM 825 NE ARG A 57 15.592 -0.611 -10.675 1.00 0.00 N ATOM 826 CZ ARG A 57 14.997 -1.799 -10.853 1.00 0.00 C ATOM 827 NH1 ARG A 57 13.784 -2.025 -10.330 1.00 0.00 N ATOM 828 NH2 ARG A 57 15.614 -2.759 -11.554 1.00 0.00 N ATOM 0 H ARG A 57 12.521 1.891 -5.005 1.00 0.00 H new ATOM 0 HA ARG A 57 14.880 1.127 -6.189 1.00 0.00 H new ATOM 0 HB2 ARG A 57 12.796 0.027 -7.700 1.00 0.00 H new ATOM 0 HB3 ARG A 57 13.171 1.509 -8.555 1.00 0.00 H new ATOM 0 HG2 ARG A 57 15.697 0.413 -7.882 1.00 0.00 H new ATOM 0 HG3 ARG A 57 14.732 -0.967 -8.369 1.00 0.00 H new ATOM 0 HD2 ARG A 57 14.030 0.779 -10.352 1.00 0.00 H new ATOM 0 HD3 ARG A 57 15.632 1.391 -9.993 1.00 0.00 H new ATOM 0 HE ARG A 57 16.515 -0.472 -11.087 1.00 0.00 H new ATOM 0 HH11 ARG A 57 13.314 -1.293 -9.797 1.00 0.00 H new ATOM 0 HH12 ARG A 57 13.331 -2.929 -10.465 1.00 0.00 H new ATOM 0 HH21 ARG A 57 16.537 -2.586 -11.953 1.00 0.00 H new ATOM 0 HH22 ARG A 57 15.161 -3.663 -11.689 1.00 0.00 H new ATOM 842 N ARG A 58 14.926 3.437 -7.447 1.00 0.00 N ATOM 843 CA ARG A 58 15.066 4.856 -7.722 1.00 0.00 C ATOM 844 C ARG A 58 13.758 5.421 -8.279 1.00 0.00 C ATOM 845 O ARG A 58 13.213 4.894 -9.248 1.00 0.00 O ATOM 846 CB ARG A 58 16.193 5.115 -8.724 1.00 0.00 C ATOM 847 CG ARG A 58 17.073 6.281 -8.271 1.00 0.00 C ATOM 848 CD ARG A 58 17.217 7.324 -9.382 1.00 0.00 C ATOM 849 NE ARG A 58 18.644 7.663 -9.576 1.00 0.00 N ATOM 850 CZ ARG A 58 19.084 8.611 -10.415 1.00 0.00 C ATOM 851 NH1 ARG A 58 18.210 9.320 -11.141 1.00 0.00 N ATOM 852 NH2 ARG A 58 20.398 8.850 -10.527 1.00 0.00 N ATOM 0 H ARG A 58 15.660 2.851 -7.846 1.00 0.00 H new ATOM 0 HA ARG A 58 15.309 5.353 -6.783 1.00 0.00 H new ATOM 0 HB2 ARG A 58 16.801 4.217 -8.833 1.00 0.00 H new ATOM 0 HB3 ARG A 58 15.770 5.334 -9.704 1.00 0.00 H new ATOM 0 HG2 ARG A 58 16.640 6.746 -7.385 1.00 0.00 H new ATOM 0 HG3 ARG A 58 18.057 5.909 -7.987 1.00 0.00 H new ATOM 0 HD2 ARG A 58 16.797 6.938 -10.311 1.00 0.00 H new ATOM 0 HD3 ARG A 58 16.653 8.221 -9.125 1.00 0.00 H new ATOM 0 HE ARG A 58 19.336 7.143 -9.037 1.00 0.00 H new ATOM 0 HH11 ARG A 58 17.210 9.138 -11.055 1.00 0.00 H new ATOM 0 HH12 ARG A 58 18.544 10.042 -11.780 1.00 0.00 H new ATOM 0 HH21 ARG A 58 21.064 8.310 -9.974 1.00 0.00 H new ATOM 0 HH22 ARG A 58 20.733 9.572 -11.166 1.00 0.00 H new ATOM 866 N GLY A 59 13.292 6.486 -7.643 1.00 0.00 N ATOM 867 CA GLY A 59 12.058 7.128 -8.064 1.00 0.00 C ATOM 868 C GLY A 59 11.208 7.526 -6.855 1.00 0.00 C ATOM 869 O GLY A 59 10.031 7.176 -6.778 1.00 0.00 O ATOM 0 H GLY A 59 13.746 6.920 -6.840 1.00 0.00 H new ATOM 0 HA2 GLY A 59 12.288 8.012 -8.658 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.492 6.452 -8.705 1.00 0.00 H new ATOM 873 N GLY A 60 11.837 8.251 -5.942 1.00 0.00 N ATOM 874 CA GLY A 60 11.153 8.700 -4.742 1.00 0.00 C ATOM 875 C GLY A 60 11.243 7.648 -3.634 1.00 0.00 C ATOM 876 O GLY A 60 12.165 6.834 -3.619 1.00 0.00 O ATOM 0 H GLY A 60 12.813 8.539 -6.009 1.00 0.00 H new ATOM 0 HA2 GLY A 60 11.593 9.636 -4.397 1.00 0.00 H new ATOM 0 HA3 GLY A 60 10.107 8.905 -4.970 1.00 0.00 H new ATOM 880 N PRO A 61 10.247 7.701 -2.709 1.00 0.00 N ATOM 881 CA PRO A 61 10.205 6.763 -1.600 1.00 0.00 C ATOM 882 C PRO A 61 9.744 5.381 -2.068 1.00 0.00 C ATOM 883 O PRO A 61 9.257 5.231 -3.187 1.00 0.00 O ATOM 884 CB PRO A 61 9.261 7.392 -0.588 1.00 0.00 C ATOM 885 CG PRO A 61 8.452 8.424 -1.358 1.00 0.00 C ATOM 886 CD PRO A 61 9.139 8.651 -2.695 1.00 0.00 C ATOM 0 HA PRO A 61 11.186 6.592 -1.157 1.00 0.00 H new ATOM 0 HB2 PRO A 61 8.611 6.640 -0.141 1.00 0.00 H new ATOM 0 HB3 PRO A 61 9.816 7.859 0.226 1.00 0.00 H new ATOM 0 HG2 PRO A 61 7.431 8.074 -1.508 1.00 0.00 H new ATOM 0 HG3 PRO A 61 8.390 9.357 -0.797 1.00 0.00 H new ATOM 0 HD2 PRO A 61 8.456 8.475 -3.526 1.00 0.00 H new ATOM 0 HD3 PRO A 61 9.496 9.677 -2.788 1.00 0.00 H new ATOM 894 N PRO A 62 9.920 4.380 -1.164 1.00 0.00 N ATOM 895 CA PRO A 62 9.528 3.016 -1.473 1.00 0.00 C ATOM 896 C PRO A 62 8.008 2.854 -1.409 1.00 0.00 C ATOM 897 O PRO A 62 7.385 3.199 -0.406 1.00 0.00 O ATOM 898 CB PRO A 62 10.260 2.156 -0.455 1.00 0.00 C ATOM 899 CG PRO A 62 10.663 3.095 0.670 1.00 0.00 C ATOM 900 CD PRO A 62 10.494 4.521 0.171 1.00 0.00 C ATOM 0 HA PRO A 62 9.794 2.722 -2.488 1.00 0.00 H new ATOM 0 HB2 PRO A 62 9.618 1.356 -0.085 1.00 0.00 H new ATOM 0 HB3 PRO A 62 11.135 1.682 -0.901 1.00 0.00 H new ATOM 0 HG2 PRO A 62 10.044 2.923 1.551 1.00 0.00 H new ATOM 0 HG3 PRO A 62 11.696 2.914 0.966 1.00 0.00 H new ATOM 0 HD2 PRO A 62 9.838 5.095 0.826 1.00 0.00 H new ATOM 0 HD3 PRO A 62 11.449 5.045 0.138 1.00 0.00 H new ATOM 908 N PHE A 63 7.454 2.329 -2.492 1.00 0.00 N ATOM 909 CA PHE A 63 6.019 2.117 -2.572 1.00 0.00 C ATOM 910 C PHE A 63 5.695 0.644 -2.826 1.00 0.00 C ATOM 911 O PHE A 63 6.525 -0.096 -3.352 1.00 0.00 O ATOM 912 CB PHE A 63 5.509 2.950 -3.750 1.00 0.00 C ATOM 913 CG PHE A 63 6.208 2.645 -5.076 1.00 0.00 C ATOM 914 CD1 PHE A 63 7.474 3.091 -5.296 1.00 0.00 C ATOM 915 CD2 PHE A 63 5.564 1.928 -6.035 1.00 0.00 C ATOM 916 CE1 PHE A 63 8.123 2.809 -6.527 1.00 0.00 C ATOM 917 CE2 PHE A 63 6.213 1.645 -7.266 1.00 0.00 C ATOM 918 CZ PHE A 63 7.478 2.091 -7.486 1.00 0.00 C ATOM 0 H PHE A 63 7.974 2.044 -3.322 1.00 0.00 H new ATOM 0 HA PHE A 63 5.547 2.408 -1.633 1.00 0.00 H new ATOM 0 HB2 PHE A 63 4.439 2.778 -3.867 1.00 0.00 H new ATOM 0 HB3 PHE A 63 5.638 4.007 -3.517 1.00 0.00 H new ATOM 0 HD1 PHE A 63 7.986 3.660 -4.534 1.00 0.00 H new ATOM 0 HD2 PHE A 63 4.559 1.574 -5.861 1.00 0.00 H new ATOM 0 HE1 PHE A 63 9.128 3.164 -6.702 1.00 0.00 H new ATOM 0 HE2 PHE A 63 5.701 1.075 -8.028 1.00 0.00 H new ATOM 0 HZ PHE A 63 7.971 1.875 -8.422 1.00 0.00 H new ATOM 928 N ALA A 64 4.487 0.261 -2.440 1.00 0.00 N ATOM 929 CA ALA A 64 4.044 -1.111 -2.619 1.00 0.00 C ATOM 930 C ALA A 64 2.515 -1.147 -2.658 1.00 0.00 C ATOM 931 O ALA A 64 1.856 -0.212 -2.204 1.00 0.00 O ATOM 932 CB ALA A 64 4.619 -1.984 -1.502 1.00 0.00 C ATOM 0 H ALA A 64 3.801 0.877 -2.004 1.00 0.00 H new ATOM 0 HA ALA A 64 4.408 -1.511 -3.565 1.00 0.00 H new ATOM 0 HB1 ALA A 64 4.286 -3.013 -1.637 1.00 0.00 H new ATOM 0 HB2 ALA A 64 5.708 -1.947 -1.535 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.273 -1.614 -0.537 1.00 0.00 H new ATOM 938 N PHE A 65 1.994 -2.235 -3.205 1.00 0.00 N ATOM 939 CA PHE A 65 0.555 -2.406 -3.309 1.00 0.00 C ATOM 940 C PHE A 65 0.082 -3.601 -2.480 1.00 0.00 C ATOM 941 O PHE A 65 0.381 -4.748 -2.811 1.00 0.00 O ATOM 942 CB PHE A 65 0.241 -2.667 -4.784 1.00 0.00 C ATOM 943 CG PHE A 65 0.257 -1.410 -5.656 1.00 0.00 C ATOM 944 CD1 PHE A 65 1.441 -0.884 -6.069 1.00 0.00 C ATOM 945 CD2 PHE A 65 -0.913 -0.819 -6.018 1.00 0.00 C ATOM 946 CE1 PHE A 65 1.455 0.283 -6.878 1.00 0.00 C ATOM 947 CE2 PHE A 65 -0.899 0.348 -6.828 1.00 0.00 C ATOM 948 CZ PHE A 65 0.285 0.874 -7.241 1.00 0.00 C ATOM 0 H PHE A 65 2.543 -3.008 -3.581 1.00 0.00 H new ATOM 0 HA PHE A 65 0.047 -1.517 -2.936 1.00 0.00 H new ATOM 0 HB2 PHE A 65 0.965 -3.379 -5.178 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -0.740 -3.136 -4.858 1.00 0.00 H new ATOM 0 HD1 PHE A 65 2.370 -1.354 -5.782 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -1.853 -1.237 -5.690 1.00 0.00 H new ATOM 0 HE1 PHE A 65 2.395 0.702 -7.205 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -1.828 0.817 -7.116 1.00 0.00 H new ATOM 0 HZ PHE A 65 0.296 1.761 -7.857 1.00 0.00 H new ATOM 958 N VAL A 66 -0.648 -3.293 -1.418 1.00 0.00 N ATOM 959 CA VAL A 66 -1.165 -4.328 -0.539 1.00 0.00 C ATOM 960 C VAL A 66 -2.544 -4.768 -1.032 1.00 0.00 C ATOM 961 O VAL A 66 -3.420 -3.935 -1.264 1.00 0.00 O ATOM 962 CB VAL A 66 -1.178 -3.827 0.907 1.00 0.00 C ATOM 963 CG1 VAL A 66 -1.670 -4.918 1.860 1.00 0.00 C ATOM 964 CG2 VAL A 66 0.202 -3.316 1.323 1.00 0.00 C ATOM 0 H VAL A 66 -0.894 -2.341 -1.146 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.518 -5.205 -0.559 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.875 -2.991 0.966 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.670 -4.536 2.881 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.682 -5.213 1.583 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.009 -5.782 1.796 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.165 -2.966 2.355 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.929 -4.124 1.240 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.497 -2.494 0.671 1.00 0.00 H new ATOM 974 N GLU A 67 -2.695 -6.076 -1.179 1.00 0.00 N ATOM 975 CA GLU A 67 -3.953 -6.637 -1.641 1.00 0.00 C ATOM 976 C GLU A 67 -4.676 -7.339 -0.489 1.00 0.00 C ATOM 977 O GLU A 67 -4.043 -7.992 0.340 1.00 0.00 O ATOM 978 CB GLU A 67 -3.730 -7.595 -2.813 1.00 0.00 C ATOM 979 CG GLU A 67 -5.061 -8.028 -3.429 1.00 0.00 C ATOM 980 CD GLU A 67 -4.927 -8.225 -4.940 1.00 0.00 C ATOM 981 OE1 GLU A 67 -3.973 -8.927 -5.339 1.00 0.00 O ATOM 982 OE2 GLU A 67 -5.783 -7.670 -5.663 1.00 0.00 O ATOM 0 H GLU A 67 -1.967 -6.764 -0.986 1.00 0.00 H new ATOM 0 HA GLU A 67 -4.583 -5.821 -1.997 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -3.115 -7.110 -3.571 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.181 -8.472 -2.471 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.395 -8.956 -2.966 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.823 -7.276 -3.223 1.00 0.00 H new ATOM 989 N PHE A 68 -5.991 -7.182 -0.474 1.00 0.00 N ATOM 990 CA PHE A 68 -6.806 -7.793 0.562 1.00 0.00 C ATOM 991 C PHE A 68 -7.727 -8.864 -0.026 1.00 0.00 C ATOM 992 O PHE A 68 -7.992 -8.870 -1.227 1.00 0.00 O ATOM 993 CB PHE A 68 -7.662 -6.681 1.172 1.00 0.00 C ATOM 994 CG PHE A 68 -7.004 -5.968 2.355 1.00 0.00 C ATOM 995 CD1 PHE A 68 -6.934 -6.583 3.566 1.00 0.00 C ATOM 996 CD2 PHE A 68 -6.488 -4.720 2.196 1.00 0.00 C ATOM 997 CE1 PHE A 68 -6.324 -5.921 4.664 1.00 0.00 C ATOM 998 CE2 PHE A 68 -5.878 -4.058 3.294 1.00 0.00 C ATOM 999 CZ PHE A 68 -5.808 -4.673 4.505 1.00 0.00 C ATOM 0 H PHE A 68 -6.513 -6.640 -1.163 1.00 0.00 H new ATOM 0 HA PHE A 68 -6.167 -8.269 1.306 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -7.890 -5.947 0.399 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -8.611 -7.105 1.499 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.342 -7.575 3.692 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -6.542 -4.232 1.234 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.270 -6.409 5.626 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.470 -3.066 3.168 1.00 0.00 H new ATOM 0 HZ PHE A 68 -5.343 -4.170 5.340 1.00 0.00 H new ATOM 1009 N GLU A 69 -8.191 -9.745 0.849 1.00 0.00 N ATOM 1010 CA GLU A 69 -9.077 -10.818 0.432 1.00 0.00 C ATOM 1011 C GLU A 69 -10.487 -10.278 0.186 1.00 0.00 C ATOM 1012 O GLU A 69 -11.197 -10.763 -0.694 1.00 0.00 O ATOM 1013 CB GLU A 69 -9.096 -11.946 1.466 1.00 0.00 C ATOM 1014 CG GLU A 69 -7.763 -12.698 1.481 1.00 0.00 C ATOM 1015 CD GLU A 69 -7.679 -13.690 0.320 1.00 0.00 C ATOM 1016 OE1 GLU A 69 -7.896 -13.241 -0.827 1.00 0.00 O ATOM 1017 OE2 GLU A 69 -7.401 -14.875 0.604 1.00 0.00 O ATOM 0 H GLU A 69 -7.970 -9.737 1.845 1.00 0.00 H new ATOM 0 HA GLU A 69 -8.699 -11.231 -0.503 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.297 -11.534 2.455 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -9.906 -12.639 1.239 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -6.940 -11.987 1.416 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.652 -13.229 2.426 1.00 0.00 H new ATOM 1024 N ASP A 70 -10.850 -9.280 0.978 1.00 0.00 N ATOM 1025 CA ASP A 70 -12.163 -8.668 0.856 1.00 0.00 C ATOM 1026 C ASP A 70 -12.000 -7.163 0.635 1.00 0.00 C ATOM 1027 O ASP A 70 -11.014 -6.570 1.071 1.00 0.00 O ATOM 1028 CB ASP A 70 -12.986 -8.872 2.130 1.00 0.00 C ATOM 1029 CG ASP A 70 -13.060 -10.317 2.627 1.00 0.00 C ATOM 1030 OD1 ASP A 70 -12.662 -11.207 1.845 1.00 0.00 O ATOM 1031 OD2 ASP A 70 -13.513 -10.499 3.777 1.00 0.00 O ATOM 0 H ASP A 70 -10.259 -8.880 1.706 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.677 -9.135 0.016 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -12.563 -8.253 2.921 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -13.999 -8.513 1.951 1.00 0.00 H new ATOM 1036 N PRO A 71 -13.009 -6.572 -0.061 1.00 0.00 N ATOM 1037 CA PRO A 71 -12.987 -5.147 -0.345 1.00 0.00 C ATOM 1038 C PRO A 71 -13.326 -4.333 0.905 1.00 0.00 C ATOM 1039 O PRO A 71 -12.656 -3.347 1.209 1.00 0.00 O ATOM 1040 CB PRO A 71 -13.992 -4.955 -1.469 1.00 0.00 C ATOM 1041 CG PRO A 71 -14.874 -6.193 -1.456 1.00 0.00 C ATOM 1042 CD PRO A 71 -14.192 -7.242 -0.592 1.00 0.00 C ATOM 0 HA PRO A 71 -12.001 -4.793 -0.645 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -14.583 -4.053 -1.314 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -13.488 -4.845 -2.429 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -15.861 -5.955 -1.059 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -15.020 -6.569 -2.469 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -14.848 -7.582 0.209 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -13.920 -8.121 -1.177 1.00 0.00 H new ATOM 1050 N ARG A 72 -14.366 -4.775 1.597 1.00 0.00 N ATOM 1051 CA ARG A 72 -14.802 -4.100 2.807 1.00 0.00 C ATOM 1052 C ARG A 72 -13.593 -3.697 3.655 1.00 0.00 C ATOM 1053 O ARG A 72 -13.356 -2.511 3.879 1.00 0.00 O ATOM 1054 CB ARG A 72 -15.721 -4.998 3.638 1.00 0.00 C ATOM 1055 CG ARG A 72 -16.997 -5.340 2.866 1.00 0.00 C ATOM 1056 CD ARG A 72 -18.107 -5.795 3.815 1.00 0.00 C ATOM 1057 NE ARG A 72 -17.982 -7.245 4.082 1.00 0.00 N ATOM 1058 CZ ARG A 72 -17.210 -7.768 5.044 1.00 0.00 C ATOM 1059 NH1 ARG A 72 -16.491 -6.963 5.838 1.00 0.00 N ATOM 1060 NH2 ARG A 72 -17.158 -9.096 5.214 1.00 0.00 N ATOM 0 H ARG A 72 -14.920 -5.593 1.342 1.00 0.00 H new ATOM 0 HA ARG A 72 -15.355 -3.209 2.509 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -15.196 -5.915 3.904 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -15.979 -4.497 4.571 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -17.330 -4.468 2.303 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -16.788 -6.127 2.141 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -18.048 -5.238 4.750 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -19.082 -5.580 3.377 1.00 0.00 H new ATOM 0 HE ARG A 72 -18.517 -7.887 3.497 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -16.531 -5.952 5.710 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -15.903 -7.361 6.570 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -17.706 -9.709 4.611 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -16.570 -9.494 5.947 1.00 0.00 H new ATOM 1074 N ASP A 73 -12.861 -4.706 4.102 1.00 0.00 N ATOM 1075 CA ASP A 73 -11.683 -4.472 4.920 1.00 0.00 C ATOM 1076 C ASP A 73 -10.721 -3.550 4.168 1.00 0.00 C ATOM 1077 O ASP A 73 -10.310 -2.516 4.692 1.00 0.00 O ATOM 1078 CB ASP A 73 -10.949 -5.781 5.216 1.00 0.00 C ATOM 1079 CG ASP A 73 -11.207 -6.367 6.605 1.00 0.00 C ATOM 1080 OD1 ASP A 73 -10.648 -5.805 7.572 1.00 0.00 O ATOM 1081 OD2 ASP A 73 -11.957 -7.365 6.670 1.00 0.00 O ATOM 0 H ASP A 73 -13.061 -5.688 3.913 1.00 0.00 H new ATOM 0 HA ASP A 73 -12.007 -4.021 5.858 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -11.237 -6.519 4.468 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -9.878 -5.613 5.102 1.00 0.00 H new ATOM 1086 N ALA A 74 -10.390 -3.958 2.952 1.00 0.00 N ATOM 1087 CA ALA A 74 -9.484 -3.181 2.122 1.00 0.00 C ATOM 1088 C ALA A 74 -9.833 -1.696 2.246 1.00 0.00 C ATOM 1089 O ALA A 74 -8.953 -0.840 2.171 1.00 0.00 O ATOM 1090 CB ALA A 74 -9.560 -3.679 0.678 1.00 0.00 C ATOM 0 H ALA A 74 -10.733 -4.817 2.521 1.00 0.00 H new ATOM 0 HA ALA A 74 -8.454 -3.307 2.456 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -8.881 -3.096 0.056 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.275 -4.730 0.640 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -10.579 -3.566 0.307 1.00 0.00 H new ATOM 1096 N GLU A 75 -11.118 -1.437 2.434 1.00 0.00 N ATOM 1097 CA GLU A 75 -11.594 -0.070 2.568 1.00 0.00 C ATOM 1098 C GLU A 75 -11.381 0.427 4.000 1.00 0.00 C ATOM 1099 O GLU A 75 -10.949 1.560 4.209 1.00 0.00 O ATOM 1100 CB GLU A 75 -13.065 0.041 2.163 1.00 0.00 C ATOM 1101 CG GLU A 75 -13.262 -0.362 0.700 1.00 0.00 C ATOM 1102 CD GLU A 75 -14.197 0.615 -0.017 1.00 0.00 C ATOM 1103 OE1 GLU A 75 -13.822 1.805 -0.095 1.00 0.00 O ATOM 1104 OE2 GLU A 75 -15.265 0.150 -0.470 1.00 0.00 O ATOM 0 H GLU A 75 -11.845 -2.150 2.497 1.00 0.00 H new ATOM 0 HA GLU A 75 -11.017 0.563 1.894 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -13.672 -0.598 2.805 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -13.411 1.064 2.312 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -12.298 -0.386 0.193 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -13.675 -1.370 0.649 1.00 0.00 H new ATOM 1111 N ASP A 76 -11.693 -0.444 4.948 1.00 0.00 N ATOM 1112 CA ASP A 76 -11.541 -0.108 6.353 1.00 0.00 C ATOM 1113 C ASP A 76 -10.065 0.159 6.652 1.00 0.00 C ATOM 1114 O ASP A 76 -9.739 0.998 7.491 1.00 0.00 O ATOM 1115 CB ASP A 76 -12.005 -1.259 7.248 1.00 0.00 C ATOM 1116 CG ASP A 76 -13.485 -1.223 7.633 1.00 0.00 C ATOM 1117 OD1 ASP A 76 -13.973 -0.106 7.909 1.00 0.00 O ATOM 1118 OD2 ASP A 76 -14.096 -2.314 7.642 1.00 0.00 O ATOM 0 H ASP A 76 -12.051 -1.383 4.770 1.00 0.00 H new ATOM 0 HA ASP A 76 -12.148 0.774 6.557 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -11.801 -2.201 6.738 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -11.408 -1.254 8.160 1.00 0.00 H new ATOM 1123 N ALA A 77 -9.210 -0.571 5.950 1.00 0.00 N ATOM 1124 CA ALA A 77 -7.776 -0.424 6.131 1.00 0.00 C ATOM 1125 C ALA A 77 -7.337 0.940 5.595 1.00 0.00 C ATOM 1126 O ALA A 77 -6.735 1.731 6.320 1.00 0.00 O ATOM 1127 CB ALA A 77 -7.053 -1.582 5.440 1.00 0.00 C ATOM 0 H ALA A 77 -9.483 -1.266 5.255 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.516 -0.462 7.189 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -5.977 -1.472 5.576 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -7.379 -2.526 5.876 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.287 -1.574 4.375 1.00 0.00 H new ATOM 1133 N VAL A 78 -7.655 1.174 4.331 1.00 0.00 N ATOM 1134 CA VAL A 78 -7.300 2.429 3.690 1.00 0.00 C ATOM 1135 C VAL A 78 -8.015 3.580 4.401 1.00 0.00 C ATOM 1136 O VAL A 78 -7.501 4.696 4.455 1.00 0.00 O ATOM 1137 CB VAL A 78 -7.617 2.362 2.195 1.00 0.00 C ATOM 1138 CG1 VAL A 78 -9.042 2.845 1.914 1.00 0.00 C ATOM 1139 CG2 VAL A 78 -6.597 3.160 1.381 1.00 0.00 C ATOM 0 H VAL A 78 -8.155 0.516 3.733 1.00 0.00 H new ATOM 0 HA VAL A 78 -6.228 2.610 3.773 1.00 0.00 H new ATOM 0 HB VAL A 78 -7.550 1.319 1.885 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -9.241 2.787 0.844 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -9.752 2.215 2.450 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -9.149 3.877 2.248 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.846 3.095 0.322 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -6.617 4.203 1.695 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.600 2.751 1.545 1.00 0.00 H new ATOM 1149 N TYR A 79 -9.189 3.268 4.929 1.00 0.00 N ATOM 1150 CA TYR A 79 -9.980 4.263 5.635 1.00 0.00 C ATOM 1151 C TYR A 79 -9.290 4.693 6.931 1.00 0.00 C ATOM 1152 O TYR A 79 -9.630 5.725 7.507 1.00 0.00 O ATOM 1153 CB TYR A 79 -11.305 3.580 5.979 1.00 0.00 C ATOM 1154 CG TYR A 79 -12.371 3.704 4.888 1.00 0.00 C ATOM 1155 CD1 TYR A 79 -11.997 3.960 3.584 1.00 0.00 C ATOM 1156 CD2 TYR A 79 -13.705 3.559 5.207 1.00 0.00 C ATOM 1157 CE1 TYR A 79 -12.999 4.076 2.557 1.00 0.00 C ATOM 1158 CE2 TYR A 79 -14.708 3.675 4.180 1.00 0.00 C ATOM 1159 CZ TYR A 79 -14.305 3.928 2.906 1.00 0.00 C ATOM 1160 OH TYR A 79 -15.252 4.037 1.936 1.00 0.00 O ATOM 0 H TYR A 79 -9.612 2.341 4.883 1.00 0.00 H new ATOM 0 HA TYR A 79 -10.115 5.153 5.021 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -11.118 2.524 6.172 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.694 4.008 6.903 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -10.952 4.073 3.334 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -13.997 3.358 6.227 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -12.720 4.276 1.533 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -15.756 3.564 4.416 1.00 0.00 H new ATOM 0 HH TYR A 79 -16.140 3.907 2.330 1.00 0.00 H new ATOM 1170 N GLY A 80 -8.332 3.880 7.352 1.00 0.00 N ATOM 1171 CA GLY A 80 -7.591 4.163 8.570 1.00 0.00 C ATOM 1172 C GLY A 80 -6.096 4.310 8.280 1.00 0.00 C ATOM 1173 O GLY A 80 -5.543 5.403 8.392 1.00 0.00 O ATOM 0 H GLY A 80 -8.052 3.025 6.871 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -7.969 5.079 9.025 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -7.748 3.360 9.290 1.00 0.00 H new ATOM 1177 N ARG A 81 -5.485 3.193 7.913 1.00 0.00 N ATOM 1178 CA ARG A 81 -4.065 3.184 7.606 1.00 0.00 C ATOM 1179 C ARG A 81 -3.674 4.463 6.863 1.00 0.00 C ATOM 1180 O ARG A 81 -2.546 4.938 6.988 1.00 0.00 O ATOM 1181 CB ARG A 81 -3.694 1.971 6.750 1.00 0.00 C ATOM 1182 CG ARG A 81 -4.091 0.667 7.445 1.00 0.00 C ATOM 1183 CD ARG A 81 -3.636 0.664 8.906 1.00 0.00 C ATOM 1184 NE ARG A 81 -4.637 1.352 9.750 1.00 0.00 N ATOM 1185 CZ ARG A 81 -4.359 1.930 10.927 1.00 0.00 C ATOM 1186 NH1 ARG A 81 -3.107 1.905 11.405 1.00 0.00 N ATOM 1187 NH2 ARG A 81 -5.331 2.531 11.625 1.00 0.00 N ATOM 0 H ARG A 81 -5.947 2.288 7.821 1.00 0.00 H new ATOM 0 HA ARG A 81 -3.522 3.128 8.550 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -4.192 2.038 5.783 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -2.621 1.972 6.557 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -5.172 0.540 7.397 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -3.647 -0.179 6.920 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -3.500 -0.361 9.251 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -2.670 1.161 8.995 1.00 0.00 H new ATOM 0 HE ARG A 81 -5.600 1.389 9.415 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -2.367 1.447 10.873 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -2.894 2.344 12.301 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -6.284 2.549 11.261 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -5.119 2.971 12.521 1.00 0.00 H new ATOM 1201 N ASP A 82 -4.627 4.983 6.104 1.00 0.00 N ATOM 1202 CA ASP A 82 -4.397 6.198 5.341 1.00 0.00 C ATOM 1203 C ASP A 82 -4.081 7.347 6.301 1.00 0.00 C ATOM 1204 O ASP A 82 -4.989 7.997 6.815 1.00 0.00 O ATOM 1205 CB ASP A 82 -5.637 6.584 4.532 1.00 0.00 C ATOM 1206 CG ASP A 82 -5.593 7.980 3.908 1.00 0.00 C ATOM 1207 OD1 ASP A 82 -4.703 8.193 3.056 1.00 0.00 O ATOM 1208 OD2 ASP A 82 -6.450 8.803 4.297 1.00 0.00 O ATOM 0 H ASP A 82 -5.560 4.585 6.001 1.00 0.00 H new ATOM 0 HA ASP A 82 -3.565 6.016 4.660 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -5.776 5.851 3.737 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -6.510 6.520 5.181 1.00 0.00 H new ATOM 1213 N GLY A 83 -2.791 7.561 6.513 1.00 0.00 N ATOM 1214 CA GLY A 83 -2.345 8.619 7.403 1.00 0.00 C ATOM 1215 C GLY A 83 -1.778 8.042 8.701 1.00 0.00 C ATOM 1216 O GLY A 83 -1.948 8.627 9.771 1.00 0.00 O ATOM 0 H GLY A 83 -2.040 7.020 6.084 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -1.584 9.221 6.906 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -3.179 9.283 7.630 1.00 0.00 H new ATOM 1220 N TYR A 84 -1.117 6.902 8.566 1.00 0.00 N ATOM 1221 CA TYR A 84 -0.525 6.239 9.716 1.00 0.00 C ATOM 1222 C TYR A 84 0.912 6.713 9.941 1.00 0.00 C ATOM 1223 O TYR A 84 1.634 6.993 8.986 1.00 0.00 O ATOM 1224 CB TYR A 84 -0.511 4.746 9.381 1.00 0.00 C ATOM 1225 CG TYR A 84 0.037 3.862 10.503 1.00 0.00 C ATOM 1226 CD1 TYR A 84 -0.746 3.582 11.605 1.00 0.00 C ATOM 1227 CD2 TYR A 84 1.313 3.345 10.413 1.00 0.00 C ATOM 1228 CE1 TYR A 84 -0.231 2.749 12.661 1.00 0.00 C ATOM 1229 CE2 TYR A 84 1.828 2.513 11.470 1.00 0.00 C ATOM 1230 CZ TYR A 84 1.031 2.256 12.541 1.00 0.00 C ATOM 1231 OH TYR A 84 1.518 1.470 13.539 1.00 0.00 O ATOM 0 H TYR A 84 -0.978 6.420 7.678 1.00 0.00 H new ATOM 0 HA TYR A 84 -1.092 6.459 10.621 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -1.526 4.428 9.144 1.00 0.00 H new ATOM 0 HB3 TYR A 84 0.089 4.591 8.484 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.745 3.988 11.675 1.00 0.00 H new ATOM 0 HD2 TYR A 84 1.925 3.564 9.551 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -0.833 2.521 13.528 1.00 0.00 H new ATOM 0 HE2 TYR A 84 2.825 2.102 11.413 1.00 0.00 H new ATOM 0 HH TYR A 84 2.430 1.189 13.318 1.00 0.00 H new ATOM 1241 N ASP A 85 1.285 6.787 11.211 1.00 0.00 N ATOM 1242 CA ASP A 85 2.623 7.221 11.574 1.00 0.00 C ATOM 1243 C ASP A 85 3.454 6.006 11.988 1.00 0.00 C ATOM 1244 O ASP A 85 3.391 5.569 13.137 1.00 0.00 O ATOM 1245 CB ASP A 85 2.585 8.194 12.754 1.00 0.00 C ATOM 1246 CG ASP A 85 1.337 8.094 13.634 1.00 0.00 C ATOM 1247 OD1 ASP A 85 1.079 6.975 14.129 1.00 0.00 O ATOM 1248 OD2 ASP A 85 0.669 9.139 13.792 1.00 0.00 O ATOM 0 H ASP A 85 0.683 6.554 12.001 1.00 0.00 H new ATOM 0 HA ASP A 85 3.062 7.720 10.710 1.00 0.00 H new ATOM 0 HB2 ASP A 85 3.464 8.023 13.375 1.00 0.00 H new ATOM 0 HB3 ASP A 85 2.660 9.211 12.369 1.00 0.00 H new ATOM 1253 N TYR A 86 4.214 5.494 11.031 1.00 0.00 N ATOM 1254 CA TYR A 86 5.057 4.338 11.283 1.00 0.00 C ATOM 1255 C TYR A 86 6.442 4.765 11.774 1.00 0.00 C ATOM 1256 O TYR A 86 7.288 5.174 10.980 1.00 0.00 O ATOM 1257 CB TYR A 86 5.205 3.623 9.938 1.00 0.00 C ATOM 1258 CG TYR A 86 5.953 2.291 10.021 1.00 0.00 C ATOM 1259 CD1 TYR A 86 7.333 2.272 9.997 1.00 0.00 C ATOM 1260 CD2 TYR A 86 5.248 1.109 10.119 1.00 0.00 C ATOM 1261 CE1 TYR A 86 8.037 1.018 10.074 1.00 0.00 C ATOM 1262 CE2 TYR A 86 5.952 -0.145 10.196 1.00 0.00 C ATOM 1263 CZ TYR A 86 7.312 -0.128 10.170 1.00 0.00 C ATOM 1264 OH TYR A 86 7.977 -1.312 10.243 1.00 0.00 O ATOM 0 H TYR A 86 4.263 5.859 10.080 1.00 0.00 H new ATOM 0 HA TYR A 86 4.615 3.701 12.050 1.00 0.00 H new ATOM 0 HB2 TYR A 86 4.214 3.446 9.521 1.00 0.00 H new ATOM 0 HB3 TYR A 86 5.730 4.280 9.244 1.00 0.00 H new ATOM 0 HD1 TYR A 86 7.885 3.197 9.920 1.00 0.00 H new ATOM 0 HD2 TYR A 86 4.168 1.124 10.138 1.00 0.00 H new ATOM 0 HE1 TYR A 86 9.116 0.989 10.056 1.00 0.00 H new ATOM 0 HE2 TYR A 86 5.413 -1.078 10.273 1.00 0.00 H new ATOM 0 HH TYR A 86 7.750 -1.764 11.082 1.00 0.00 H new ATOM 1274 N ASP A 87 6.630 4.656 13.081 1.00 0.00 N ATOM 1275 CA ASP A 87 7.898 5.026 13.688 1.00 0.00 C ATOM 1276 C ASP A 87 8.252 6.459 13.285 1.00 0.00 C ATOM 1277 O ASP A 87 9.423 6.780 13.090 1.00 0.00 O ATOM 1278 CB ASP A 87 9.025 4.108 13.212 1.00 0.00 C ATOM 1279 CG ASP A 87 10.197 3.965 14.184 1.00 0.00 C ATOM 1280 OD1 ASP A 87 10.895 4.982 14.386 1.00 0.00 O ATOM 1281 OD2 ASP A 87 10.369 2.841 14.705 1.00 0.00 O ATOM 0 H ASP A 87 5.926 4.317 13.737 1.00 0.00 H new ATOM 0 HA ASP A 87 7.793 4.937 14.769 1.00 0.00 H new ATOM 0 HB2 ASP A 87 8.610 3.119 13.019 1.00 0.00 H new ATOM 0 HB3 ASP A 87 9.404 4.486 12.262 1.00 0.00 H new ATOM 1286 N GLY A 88 7.219 7.281 13.173 1.00 0.00 N ATOM 1287 CA GLY A 88 7.407 8.671 12.796 1.00 0.00 C ATOM 1288 C GLY A 88 7.104 8.884 11.312 1.00 0.00 C ATOM 1289 O GLY A 88 6.545 9.911 10.929 1.00 0.00 O ATOM 0 H GLY A 88 6.249 7.011 13.337 1.00 0.00 H new ATOM 0 HA2 GLY A 88 6.757 9.306 13.398 1.00 0.00 H new ATOM 0 HA3 GLY A 88 8.433 8.973 13.008 1.00 0.00 H new ATOM 1293 N TYR A 89 7.485 7.896 10.516 1.00 0.00 N ATOM 1294 CA TYR A 89 7.261 7.962 9.081 1.00 0.00 C ATOM 1295 C TYR A 89 5.771 7.843 8.754 1.00 0.00 C ATOM 1296 O TYR A 89 5.200 6.756 8.830 1.00 0.00 O ATOM 1297 CB TYR A 89 8.000 6.763 8.484 1.00 0.00 C ATOM 1298 CG TYR A 89 9.512 6.784 8.716 1.00 0.00 C ATOM 1299 CD1 TYR A 89 10.331 7.496 7.863 1.00 0.00 C ATOM 1300 CD2 TYR A 89 10.056 6.093 9.779 1.00 0.00 C ATOM 1301 CE1 TYR A 89 11.754 7.516 8.082 1.00 0.00 C ATOM 1302 CE2 TYR A 89 11.480 6.114 9.998 1.00 0.00 C ATOM 1303 CZ TYR A 89 12.258 6.824 9.139 1.00 0.00 C ATOM 1304 OH TYR A 89 13.602 6.844 9.346 1.00 0.00 O ATOM 0 H TYR A 89 7.947 7.045 10.837 1.00 0.00 H new ATOM 0 HA TYR A 89 7.614 8.912 8.680 1.00 0.00 H new ATOM 0 HB2 TYR A 89 7.590 5.848 8.911 1.00 0.00 H new ATOM 0 HB3 TYR A 89 7.808 6.728 7.412 1.00 0.00 H new ATOM 0 HD1 TYR A 89 9.905 8.038 7.032 1.00 0.00 H new ATOM 0 HD2 TYR A 89 9.415 5.537 10.447 1.00 0.00 H new ATOM 0 HE1 TYR A 89 12.407 8.068 7.422 1.00 0.00 H new ATOM 0 HE2 TYR A 89 11.919 5.578 10.826 1.00 0.00 H new ATOM 0 HH TYR A 89 13.819 6.308 10.137 1.00 0.00 H new ATOM 1314 N ARG A 90 5.184 8.975 8.396 1.00 0.00 N ATOM 1315 CA ARG A 90 3.772 9.012 8.056 1.00 0.00 C ATOM 1316 C ARG A 90 3.537 8.359 6.692 1.00 0.00 C ATOM 1317 O ARG A 90 3.996 8.866 5.670 1.00 0.00 O ATOM 1318 CB ARG A 90 3.250 10.450 8.022 1.00 0.00 C ATOM 1319 CG ARG A 90 2.113 10.644 9.028 1.00 0.00 C ATOM 1320 CD ARG A 90 1.235 11.835 8.638 1.00 0.00 C ATOM 1321 NE ARG A 90 0.579 12.395 9.840 1.00 0.00 N ATOM 1322 CZ ARG A 90 1.213 13.115 10.775 1.00 0.00 C ATOM 1323 NH1 ARG A 90 2.523 13.367 10.652 1.00 0.00 N ATOM 1324 NH2 ARG A 90 0.537 13.583 11.833 1.00 0.00 N ATOM 0 H ARG A 90 5.661 9.874 8.334 1.00 0.00 H new ATOM 0 HA ARG A 90 3.232 8.460 8.825 1.00 0.00 H new ATOM 0 HB2 ARG A 90 4.062 11.141 8.248 1.00 0.00 H new ATOM 0 HB3 ARG A 90 2.898 10.689 7.019 1.00 0.00 H new ATOM 0 HG2 ARG A 90 1.506 9.740 9.075 1.00 0.00 H new ATOM 0 HG3 ARG A 90 2.527 10.803 10.024 1.00 0.00 H new ATOM 0 HD2 ARG A 90 1.841 12.601 8.154 1.00 0.00 H new ATOM 0 HD3 ARG A 90 0.482 11.521 7.915 1.00 0.00 H new ATOM 0 HE ARG A 90 -0.418 12.222 9.965 1.00 0.00 H new ATOM 0 HH11 ARG A 90 3.037 13.011 9.847 1.00 0.00 H new ATOM 0 HH12 ARG A 90 3.006 13.915 11.364 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -0.460 13.391 11.927 1.00 0.00 H new ATOM 0 HH22 ARG A 90 1.020 14.131 12.545 1.00 0.00 H new ATOM 1338 N LEU A 91 2.822 7.244 6.721 1.00 0.00 N ATOM 1339 CA LEU A 91 2.521 6.517 5.500 1.00 0.00 C ATOM 1340 C LEU A 91 1.336 7.180 4.795 1.00 0.00 C ATOM 1341 O LEU A 91 0.597 7.950 5.407 1.00 0.00 O ATOM 1342 CB LEU A 91 2.305 5.032 5.800 1.00 0.00 C ATOM 1343 CG LEU A 91 3.398 4.348 6.623 1.00 0.00 C ATOM 1344 CD1 LEU A 91 3.003 2.912 6.973 1.00 0.00 C ATOM 1345 CD2 LEU A 91 4.747 4.413 5.905 1.00 0.00 C ATOM 0 H LEU A 91 2.443 6.827 7.571 1.00 0.00 H new ATOM 0 HA LEU A 91 3.366 6.561 4.813 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.358 4.923 6.328 1.00 0.00 H new ATOM 0 HB3 LEU A 91 2.205 4.501 4.853 1.00 0.00 H new ATOM 0 HG LEU A 91 3.508 4.890 7.563 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.797 2.448 7.558 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.081 2.920 7.555 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.849 2.343 6.056 1.00 0.00 H new ATOM 0 HD21 LEU A 91 5.506 3.920 6.512 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.670 3.911 4.941 1.00 0.00 H new ATOM 0 HD23 LEU A 91 5.027 5.455 5.750 1.00 0.00 H new ATOM 1357 N ARG A 92 1.191 6.858 3.518 1.00 0.00 N ATOM 1358 CA ARG A 92 0.109 7.413 2.724 1.00 0.00 C ATOM 1359 C ARG A 92 -0.618 6.301 1.966 1.00 0.00 C ATOM 1360 O ARG A 92 -0.156 5.854 0.917 1.00 0.00 O ATOM 1361 CB ARG A 92 0.633 8.445 1.723 1.00 0.00 C ATOM 1362 CG ARG A 92 -0.421 9.517 1.438 1.00 0.00 C ATOM 1363 CD ARG A 92 -0.754 9.574 -0.054 1.00 0.00 C ATOM 1364 NE ARG A 92 0.276 10.358 -0.773 1.00 0.00 N ATOM 1365 CZ ARG A 92 0.409 11.688 -0.679 1.00 0.00 C ATOM 1366 NH1 ARG A 92 -0.421 12.391 0.103 1.00 0.00 N ATOM 1367 NH2 ARG A 92 1.372 12.315 -1.368 1.00 0.00 N ATOM 0 H ARG A 92 1.806 6.219 3.013 1.00 0.00 H new ATOM 0 HA ARG A 92 -0.584 7.905 3.407 1.00 0.00 H new ATOM 0 HB2 ARG A 92 1.535 8.913 2.116 1.00 0.00 H new ATOM 0 HB3 ARG A 92 0.911 7.947 0.794 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -1.325 9.304 2.008 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -0.056 10.489 1.770 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -0.805 8.565 -0.462 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -1.735 10.027 -0.199 1.00 0.00 H new ATOM 0 HE ARG A 92 0.925 9.854 -1.378 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -1.154 11.914 0.627 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -0.319 13.403 0.174 1.00 0.00 H new ATOM 0 HH21 ARG A 92 2.004 11.780 -1.964 1.00 0.00 H new ATOM 0 HH22 ARG A 92 1.473 13.327 -1.297 1.00 0.00 H new ATOM 1381 N VAL A 93 -1.744 5.884 2.527 1.00 0.00 N ATOM 1382 CA VAL A 93 -2.540 4.832 1.917 1.00 0.00 C ATOM 1383 C VAL A 93 -3.660 5.462 1.087 1.00 0.00 C ATOM 1384 O VAL A 93 -4.375 6.340 1.568 1.00 0.00 O ATOM 1385 CB VAL A 93 -3.058 3.877 2.994 1.00 0.00 C ATOM 1386 CG1 VAL A 93 -3.575 2.578 2.372 1.00 0.00 C ATOM 1387 CG2 VAL A 93 -1.979 3.593 4.040 1.00 0.00 C ATOM 0 H VAL A 93 -2.124 6.256 3.398 1.00 0.00 H new ATOM 0 HA VAL A 93 -1.930 4.235 1.239 1.00 0.00 H new ATOM 0 HB VAL A 93 -3.893 4.362 3.499 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -3.937 1.917 3.159 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -4.390 2.803 1.684 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -2.767 2.087 1.830 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -2.373 2.912 4.794 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -1.114 3.138 3.557 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -1.679 4.527 4.516 1.00 0.00 H new ATOM 1397 N GLU A 94 -3.778 4.990 -0.145 1.00 0.00 N ATOM 1398 CA GLU A 94 -4.799 5.496 -1.047 1.00 0.00 C ATOM 1399 C GLU A 94 -5.045 4.501 -2.183 1.00 0.00 C ATOM 1400 O GLU A 94 -4.162 3.716 -2.527 1.00 0.00 O ATOM 1401 CB GLU A 94 -4.414 6.871 -1.596 1.00 0.00 C ATOM 1402 CG GLU A 94 -3.175 6.776 -2.489 1.00 0.00 C ATOM 1403 CD GLU A 94 -3.317 7.675 -3.719 1.00 0.00 C ATOM 1404 OE1 GLU A 94 -4.135 7.315 -4.593 1.00 0.00 O ATOM 1405 OE2 GLU A 94 -2.603 8.700 -3.759 1.00 0.00 O ATOM 0 H GLU A 94 -3.183 4.262 -0.540 1.00 0.00 H new ATOM 0 HA GLU A 94 -5.726 5.612 -0.485 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -5.246 7.286 -2.165 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -4.220 7.555 -0.770 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -2.290 7.066 -1.922 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -3.027 5.743 -2.804 1.00 0.00 H new ATOM 1412 N PHE A 95 -6.248 4.565 -2.733 1.00 0.00 N ATOM 1413 CA PHE A 95 -6.621 3.680 -3.823 1.00 0.00 C ATOM 1414 C PHE A 95 -6.030 4.163 -5.149 1.00 0.00 C ATOM 1415 O PHE A 95 -5.830 5.361 -5.344 1.00 0.00 O ATOM 1416 CB PHE A 95 -8.148 3.707 -3.919 1.00 0.00 C ATOM 1417 CG PHE A 95 -8.853 2.836 -2.877 1.00 0.00 C ATOM 1418 CD1 PHE A 95 -8.543 1.516 -2.773 1.00 0.00 C ATOM 1419 CD2 PHE A 95 -9.789 3.382 -2.056 1.00 0.00 C ATOM 1420 CE1 PHE A 95 -9.197 0.708 -1.806 1.00 0.00 C ATOM 1421 CE2 PHE A 95 -10.443 2.574 -1.089 1.00 0.00 C ATOM 1422 CZ PHE A 95 -10.133 1.254 -0.984 1.00 0.00 C ATOM 0 H PHE A 95 -6.978 5.216 -2.444 1.00 0.00 H new ATOM 0 HA PHE A 95 -6.243 2.676 -3.632 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -8.490 4.736 -3.809 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -8.445 3.377 -4.914 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -7.800 1.083 -3.426 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.035 4.430 -2.139 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -8.951 -0.340 -1.723 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -11.187 3.008 -0.437 1.00 0.00 H new ATOM 0 HZ PHE A 95 -10.630 0.639 -0.248 1.00 0.00 H new ATOM 1432 N PRO A 96 -5.759 3.180 -6.049 1.00 0.00 N ATOM 1433 CA PRO A 96 -5.194 3.493 -7.351 1.00 0.00 C ATOM 1434 C PRO A 96 -6.252 4.098 -8.277 1.00 0.00 C ATOM 1435 O PRO A 96 -7.307 3.503 -8.491 1.00 0.00 O ATOM 1436 CB PRO A 96 -4.638 2.176 -7.866 1.00 0.00 C ATOM 1437 CG PRO A 96 -5.318 1.089 -7.049 1.00 0.00 C ATOM 1438 CD PRO A 96 -5.982 1.751 -5.853 1.00 0.00 C ATOM 0 HA PRO A 96 -4.409 4.248 -7.298 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -4.846 2.053 -8.929 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -3.555 2.135 -7.746 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -6.057 0.563 -7.653 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -4.590 0.348 -6.719 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -7.046 1.518 -5.812 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -5.544 1.407 -4.916 1.00 0.00 H new ATOM 1446 N ARG A 97 -5.933 5.272 -8.800 1.00 0.00 N ATOM 1447 CA ARG A 97 -6.842 5.964 -9.698 1.00 0.00 C ATOM 1448 C ARG A 97 -8.178 6.228 -8.999 1.00 0.00 C ATOM 1449 O ARG A 97 -9.021 5.337 -8.908 1.00 0.00 O ATOM 1450 CB ARG A 97 -7.091 5.147 -10.967 1.00 0.00 C ATOM 1451 CG ARG A 97 -6.335 5.739 -12.158 1.00 0.00 C ATOM 1452 CD ARG A 97 -7.284 6.020 -13.325 1.00 0.00 C ATOM 1453 NE ARG A 97 -6.785 7.164 -14.119 1.00 0.00 N ATOM 1454 CZ ARG A 97 -5.674 7.132 -14.868 1.00 0.00 C ATOM 1455 NH1 ARG A 97 -4.939 6.013 -14.929 1.00 0.00 N ATOM 1456 NH2 ARG A 97 -5.297 8.219 -15.555 1.00 0.00 N ATOM 0 H ARG A 97 -5.057 5.762 -8.619 1.00 0.00 H new ATOM 0 HA ARG A 97 -6.379 6.911 -9.975 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -6.775 4.116 -10.808 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.159 5.123 -11.185 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -5.840 6.662 -11.857 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -5.554 5.049 -12.477 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -7.367 5.136 -13.958 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -8.283 6.237 -12.948 1.00 0.00 H new ATOM 0 HE ARG A 97 -7.320 8.032 -14.095 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -5.225 5.186 -14.405 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -4.093 5.989 -15.499 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -5.856 9.071 -15.508 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -4.451 8.194 -16.125 1.00 0.00 H new ATOM 1470 N SER A 98 -8.329 7.456 -8.526 1.00 0.00 N ATOM 1471 CA SER A 98 -9.547 7.849 -7.839 1.00 0.00 C ATOM 1472 C SER A 98 -10.231 8.989 -8.596 1.00 0.00 C ATOM 1473 O SER A 98 -9.616 9.629 -9.449 1.00 0.00 O ATOM 1474 CB SER A 98 -9.256 8.269 -6.397 1.00 0.00 C ATOM 1475 OG SER A 98 -9.355 7.173 -5.491 1.00 0.00 O ATOM 0 H SER A 98 -7.628 8.192 -8.605 1.00 0.00 H new ATOM 0 HA SER A 98 -10.215 6.988 -7.810 1.00 0.00 H new ATOM 0 HB2 SER A 98 -8.256 8.698 -6.339 1.00 0.00 H new ATOM 0 HB3 SER A 98 -9.955 9.050 -6.099 1.00 0.00 H new ATOM 0 HG SER A 98 -9.161 7.482 -4.581 1.00 0.00 H new ATOM 1481 N GLY A 99 -11.493 9.209 -8.257 1.00 0.00 N ATOM 1482 CA GLY A 99 -12.266 10.262 -8.894 1.00 0.00 C ATOM 1483 C GLY A 99 -12.871 9.775 -10.213 1.00 0.00 C ATOM 1484 O GLY A 99 -12.320 10.029 -11.284 1.00 0.00 O ATOM 0 H GLY A 99 -11.999 8.676 -7.550 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -13.061 10.591 -8.224 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -11.628 11.126 -9.079 1.00 0.00 H new ATOM 1488 N ARG A 100 -13.995 9.085 -10.092 1.00 0.00 N ATOM 1489 CA ARG A 100 -14.681 8.561 -11.261 1.00 0.00 C ATOM 1490 C ARG A 100 -15.113 9.706 -12.181 1.00 0.00 C ATOM 1491 O ARG A 100 -15.098 10.868 -11.780 1.00 0.00 O ATOM 1492 CB ARG A 100 -15.912 7.747 -10.859 1.00 0.00 C ATOM 1493 CG ARG A 100 -15.551 6.277 -10.642 1.00 0.00 C ATOM 1494 CD ARG A 100 -16.265 5.381 -11.656 1.00 0.00 C ATOM 1495 NE ARG A 100 -17.150 4.426 -10.953 1.00 0.00 N ATOM 1496 CZ ARG A 100 -18.307 4.764 -10.368 1.00 0.00 C ATOM 1497 NH1 ARG A 100 -18.726 6.036 -10.398 1.00 0.00 N ATOM 1498 NH2 ARG A 100 -19.045 3.830 -9.752 1.00 0.00 N ATOM 0 H ARG A 100 -14.448 8.876 -9.202 1.00 0.00 H new ATOM 0 HA ARG A 100 -13.985 7.909 -11.789 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -16.342 8.158 -9.946 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -16.674 7.827 -11.634 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -14.473 6.147 -10.732 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -15.825 5.977 -9.630 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -16.849 5.991 -12.345 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -15.532 4.838 -12.253 1.00 0.00 H new ATOM 0 HE ARG A 100 -16.861 3.449 -10.911 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -18.164 6.747 -10.866 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -19.607 6.293 -9.953 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -18.726 2.862 -9.728 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -19.926 4.088 -9.307 1.00 0.00 H new ATOM 1512 N GLY A 101 -15.487 9.336 -13.397 1.00 0.00 N ATOM 1513 CA GLY A 101 -15.923 10.317 -14.376 1.00 0.00 C ATOM 1514 C GLY A 101 -17.362 10.048 -14.820 1.00 0.00 C ATOM 1515 O GLY A 101 -18.301 10.255 -14.053 1.00 0.00 O ATOM 0 H GLY A 101 -15.497 8.371 -13.726 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -15.851 11.318 -13.950 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -15.261 10.291 -15.242 1.00 0.00 H new ATOM 1519 N THR A 102 -17.490 9.590 -16.056 1.00 0.00 N ATOM 1520 CA THR A 102 -18.799 9.290 -16.611 1.00 0.00 C ATOM 1521 C THR A 102 -19.428 8.101 -15.882 1.00 0.00 C ATOM 1522 O THR A 102 -18.743 7.130 -15.564 1.00 0.00 O ATOM 1523 CB THR A 102 -18.635 9.063 -18.115 1.00 0.00 C ATOM 1524 OG1 THR A 102 -17.405 8.351 -18.226 1.00 0.00 O ATOM 1525 CG2 THR A 102 -18.383 10.364 -18.880 1.00 0.00 C ATOM 0 H THR A 102 -16.709 9.419 -16.689 1.00 0.00 H new ATOM 0 HA THR A 102 -19.489 10.121 -16.467 1.00 0.00 H new ATOM 0 HB THR A 102 -19.529 8.578 -18.508 1.00 0.00 H new ATOM 0 HG1 THR A 102 -17.221 8.160 -19.170 1.00 0.00 H new ATOM 0 HG21 THR A 102 -18.274 10.146 -19.942 1.00 0.00 H new ATOM 0 HG22 THR A 102 -19.224 11.041 -18.733 1.00 0.00 H new ATOM 0 HG23 THR A 102 -17.471 10.833 -18.510 1.00 0.00 H new ATOM 1533 N GLY A 103 -20.725 8.216 -15.639 1.00 0.00 N ATOM 1534 CA GLY A 103 -21.454 7.162 -14.953 1.00 0.00 C ATOM 1535 C GLY A 103 -22.817 7.662 -14.471 1.00 0.00 C ATOM 1536 O GLY A 103 -22.892 8.523 -13.596 1.00 0.00 O ATOM 0 H GLY A 103 -21.290 9.022 -15.905 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -21.590 6.314 -15.624 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -20.872 6.806 -14.103 1.00 0.00 H new ATOM 1540 N SER A 104 -23.861 7.101 -15.063 1.00 0.00 N ATOM 1541 CA SER A 104 -25.218 7.480 -14.705 1.00 0.00 C ATOM 1542 C SER A 104 -26.193 6.371 -15.106 1.00 0.00 C ATOM 1543 O SER A 104 -26.126 5.853 -16.220 1.00 0.00 O ATOM 1544 CB SER A 104 -25.614 8.801 -15.367 1.00 0.00 C ATOM 1545 OG SER A 104 -26.446 9.592 -14.523 1.00 0.00 O ATOM 0 H SER A 104 -23.795 6.387 -15.788 1.00 0.00 H new ATOM 0 HA SER A 104 -25.261 7.620 -13.625 1.00 0.00 H new ATOM 0 HB2 SER A 104 -24.715 9.363 -15.620 1.00 0.00 H new ATOM 0 HB3 SER A 104 -26.136 8.596 -16.302 1.00 0.00 H new ATOM 0 HG SER A 104 -26.676 10.428 -14.980 1.00 0.00 H new ATOM 1551 N GLY A 105 -27.078 6.041 -14.177 1.00 0.00 N ATOM 1552 CA GLY A 105 -28.066 5.004 -14.420 1.00 0.00 C ATOM 1553 C GLY A 105 -28.673 4.506 -13.107 1.00 0.00 C ATOM 1554 O GLY A 105 -28.306 3.441 -12.613 1.00 0.00 O ATOM 0 H GLY A 105 -27.131 6.473 -13.255 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -28.854 5.392 -15.065 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -27.602 4.172 -14.949 1.00 0.00 H new ATOM 1558 N PRO A 106 -29.616 5.322 -12.564 1.00 0.00 N ATOM 1559 CA PRO A 106 -30.277 4.976 -11.317 1.00 0.00 C ATOM 1560 C PRO A 106 -31.311 3.869 -11.534 1.00 0.00 C ATOM 1561 O PRO A 106 -31.803 3.683 -12.646 1.00 0.00 O ATOM 1562 CB PRO A 106 -30.894 6.276 -10.825 1.00 0.00 C ATOM 1563 CG PRO A 106 -30.953 7.194 -12.035 1.00 0.00 C ATOM 1564 CD PRO A 106 -30.076 6.591 -13.120 1.00 0.00 C ATOM 0 HA PRO A 106 -29.589 4.571 -10.575 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -31.890 6.105 -10.415 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -30.293 6.717 -10.029 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -31.980 7.296 -12.387 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -30.604 8.193 -11.774 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -30.636 6.439 -14.043 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -29.238 7.245 -13.360 1.00 0.00 H new ATOM 1572 N SER A 107 -31.609 3.162 -10.453 1.00 0.00 N ATOM 1573 CA SER A 107 -32.575 2.078 -10.511 1.00 0.00 C ATOM 1574 C SER A 107 -32.958 1.642 -9.095 1.00 0.00 C ATOM 1575 O SER A 107 -32.207 1.869 -8.148 1.00 0.00 O ATOM 1576 CB SER A 107 -32.023 0.890 -11.301 1.00 0.00 C ATOM 1577 OG SER A 107 -30.852 0.346 -10.698 1.00 0.00 O ATOM 0 H SER A 107 -31.199 3.319 -9.533 1.00 0.00 H new ATOM 0 HA SER A 107 -33.465 2.440 -11.026 1.00 0.00 H new ATOM 0 HB2 SER A 107 -32.787 0.116 -11.373 1.00 0.00 H new ATOM 0 HB3 SER A 107 -31.793 1.206 -12.318 1.00 0.00 H new ATOM 0 HG SER A 107 -30.531 -0.411 -11.231 1.00 0.00 H new ATOM 1583 N SER A 108 -34.125 1.024 -8.996 1.00 0.00 N ATOM 1584 CA SER A 108 -34.617 0.554 -7.712 1.00 0.00 C ATOM 1585 C SER A 108 -35.936 -0.198 -7.900 1.00 0.00 C ATOM 1586 O SER A 108 -36.726 0.138 -8.781 1.00 0.00 O ATOM 1587 CB SER A 108 -34.803 1.717 -6.735 1.00 0.00 C ATOM 1588 OG SER A 108 -35.983 2.465 -7.015 1.00 0.00 O ATOM 0 H SER A 108 -34.745 0.838 -9.784 1.00 0.00 H new ATOM 0 HA SER A 108 -33.877 -0.125 -7.290 1.00 0.00 H new ATOM 0 HB2 SER A 108 -34.851 1.331 -5.717 1.00 0.00 H new ATOM 0 HB3 SER A 108 -33.936 2.375 -6.786 1.00 0.00 H new ATOM 0 HG SER A 108 -36.067 3.197 -6.369 1.00 0.00 H new ATOM 1594 N GLY A 109 -36.133 -1.201 -7.057 1.00 0.00 N ATOM 1595 CA GLY A 109 -37.343 -2.003 -7.120 1.00 0.00 C ATOM 1596 C GLY A 109 -37.635 -2.444 -8.555 1.00 0.00 C ATOM 1597 O GLY A 109 -38.460 -1.839 -9.239 1.00 0.00 O ATOM 0 H GLY A 109 -35.476 -1.476 -6.327 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -37.236 -2.880 -6.481 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -38.185 -1.428 -6.734 1.00 0.00 H new TER 1601 GLY A 109