USER MOD reduce.3.24.130724 H: found=0, std=0, add=788, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 786 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+ -104:sc= 0.064 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 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 12 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.0132 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 38:sc= 0.928 USER MOD Single : A 22 SER OG : rot 180:sc= -0.411 USER MOD Single : A 23 SER OG : rot 180:sc= -2.48! USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 0:sc= 1.09 USER MOD Single : A 41 TYR OH : rot 180:sc= -0.169 USER MOD Single : A 44 LYS NZ :NH3+ 151:sc= -0.281 (180deg=-1.37!) USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -0.155 X(o=-0.16,f=-0.27) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 139:sc= 1 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 1.78 K(o=1.8,f=-15!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 73:sc= 0.00122 USER MOD Single : A 80 GLN : amide:sc= -7.34! C(o=-7.3!,f=-3.7!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -0.275 K(o=-0.28,f=-0.96) USER MOD Single : A 96 HIS : no HD1:sc= -2.91! X(o=-2.9!,f=-3.2) USER MOD Single : A 97 HIS : no HD1:sc= -0.239 X(o=-0.24,f=-0.59) USER MOD Single : A 98 SER OG : rot 120:sc= -0.0809 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= -0.0213 USER MOD Single : A 101 GLN : amide:sc= -0.417 K(o=-0.42,f=-1.2) 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 15.150 22.700 4.432 1.00 0.00 N ATOM 2 CA GLY A 1 15.174 21.283 4.746 1.00 0.00 C ATOM 3 C GLY A 1 14.975 21.014 6.224 1.00 0.00 C ATOM 4 O GLY A 1 15.206 21.889 7.058 1.00 0.00 O ATOM 0 H1 GLY A 1 14.239 22.943 3.993 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.271 23.251 5.306 1.00 0.00 H new ATOM 0 H3 GLY A 1 15.923 22.923 3.772 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.394 20.775 4.179 1.00 0.00 H new ATOM 0 HA3 GLY A 1 16.127 20.859 4.428 1.00 0.00 H new ATOM 8 N SER A 2 14.543 19.799 6.549 1.00 0.00 N ATOM 9 CA SER A 2 14.307 19.418 7.937 1.00 0.00 C ATOM 10 C SER A 2 15.570 18.832 8.562 1.00 0.00 C ATOM 11 O SER A 2 16.143 17.872 8.047 1.00 0.00 O ATOM 12 CB SER A 2 13.164 18.405 8.023 1.00 0.00 C ATOM 13 OG SER A 2 12.519 18.469 9.282 1.00 0.00 O ATOM 0 H SER A 2 14.350 19.062 5.870 1.00 0.00 H new ATOM 0 HA SER A 2 14.030 20.314 8.492 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.441 18.600 7.231 1.00 0.00 H new ATOM 0 HB3 SER A 2 13.552 17.400 7.861 1.00 0.00 H new ATOM 0 HG SER A 2 11.791 17.813 9.311 1.00 0.00 H new ATOM 19 N SER A 3 15.998 19.418 9.676 1.00 0.00 N ATOM 20 CA SER A 3 17.195 18.957 10.370 1.00 0.00 C ATOM 21 C SER A 3 16.937 17.628 11.073 1.00 0.00 C ATOM 22 O SER A 3 16.181 17.562 12.042 1.00 0.00 O ATOM 23 CB SER A 3 17.655 20.004 11.386 1.00 0.00 C ATOM 24 OG SER A 3 18.490 20.973 10.777 1.00 0.00 O ATOM 0 H SER A 3 15.534 20.212 10.117 1.00 0.00 H new ATOM 0 HA SER A 3 17.981 18.809 9.630 1.00 0.00 H new ATOM 0 HB2 SER A 3 16.787 20.493 11.827 1.00 0.00 H new ATOM 0 HB3 SER A 3 18.193 19.515 12.199 1.00 0.00 H new ATOM 0 HG SER A 3 18.769 21.632 11.447 1.00 0.00 H new ATOM 30 N GLY A 4 17.573 16.571 10.578 1.00 0.00 N ATOM 31 CA GLY A 4 17.400 15.257 11.170 1.00 0.00 C ATOM 32 C GLY A 4 16.194 14.525 10.615 1.00 0.00 C ATOM 33 O GLY A 4 15.066 14.753 11.052 1.00 0.00 O ATOM 0 H GLY A 4 18.205 16.601 9.778 1.00 0.00 H new ATOM 0 HA2 GLY A 4 18.296 14.661 10.993 1.00 0.00 H new ATOM 0 HA3 GLY A 4 17.294 15.360 12.250 1.00 0.00 H new ATOM 37 N SER A 5 16.432 13.644 9.649 1.00 0.00 N ATOM 38 CA SER A 5 15.355 12.880 9.029 1.00 0.00 C ATOM 39 C SER A 5 14.937 11.712 9.918 1.00 0.00 C ATOM 40 O SER A 5 15.737 11.190 10.694 1.00 0.00 O ATOM 41 CB SER A 5 15.792 12.361 7.658 1.00 0.00 C ATOM 42 OG SER A 5 16.213 13.424 6.821 1.00 0.00 O ATOM 0 H SER A 5 17.360 13.441 9.279 1.00 0.00 H new ATOM 0 HA SER A 5 14.499 13.543 8.902 1.00 0.00 H new ATOM 0 HB2 SER A 5 16.605 11.645 7.779 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.966 11.828 7.187 1.00 0.00 H new ATOM 0 HG SER A 5 16.489 13.066 5.951 1.00 0.00 H new ATOM 48 N SER A 6 13.676 11.307 9.798 1.00 0.00 N ATOM 49 CA SER A 6 13.149 10.204 10.592 1.00 0.00 C ATOM 50 C SER A 6 13.356 8.872 9.877 1.00 0.00 C ATOM 51 O SER A 6 13.657 7.858 10.505 1.00 0.00 O ATOM 52 CB SER A 6 11.661 10.417 10.876 1.00 0.00 C ATOM 53 OG SER A 6 11.184 9.484 11.829 1.00 0.00 O ATOM 0 H SER A 6 13.001 11.727 9.159 1.00 0.00 H new ATOM 0 HA SER A 6 13.692 10.178 11.537 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.499 11.431 11.243 1.00 0.00 H new ATOM 0 HB3 SER A 6 11.093 10.318 9.951 1.00 0.00 H new ATOM 0 HG SER A 6 10.231 9.643 11.994 1.00 0.00 H new ATOM 59 N GLY A 7 13.192 8.884 8.558 1.00 0.00 N ATOM 60 CA GLY A 7 13.365 7.673 7.778 1.00 0.00 C ATOM 61 C GLY A 7 13.621 7.959 6.311 1.00 0.00 C ATOM 62 O GLY A 7 14.062 9.046 5.937 1.00 0.00 O ATOM 0 H GLY A 7 12.942 9.711 8.016 1.00 0.00 H new ATOM 0 HA2 GLY A 7 14.198 7.099 8.184 1.00 0.00 H new ATOM 0 HA3 GLY A 7 12.474 7.053 7.874 1.00 0.00 H new ATOM 66 N PRO A 8 13.344 6.966 5.453 1.00 0.00 N ATOM 67 CA PRO A 8 13.541 7.092 4.006 1.00 0.00 C ATOM 68 C PRO A 8 12.545 8.055 3.367 1.00 0.00 C ATOM 69 O PRO A 8 11.580 8.493 3.993 1.00 0.00 O ATOM 70 CB PRO A 8 13.313 5.668 3.492 1.00 0.00 C ATOM 71 CG PRO A 8 12.430 5.034 4.510 1.00 0.00 C ATOM 72 CD PRO A 8 12.815 5.644 5.830 1.00 0.00 C ATOM 0 HA PRO A 8 14.524 7.496 3.762 1.00 0.00 H new ATOM 0 HB2 PRO A 8 12.843 5.673 2.508 1.00 0.00 H new ATOM 0 HB3 PRO A 8 14.254 5.128 3.393 1.00 0.00 H new ATOM 0 HG2 PRO A 8 11.380 5.220 4.286 1.00 0.00 H new ATOM 0 HG3 PRO A 8 12.566 3.953 4.525 1.00 0.00 H new ATOM 0 HD2 PRO A 8 11.958 5.730 6.498 1.00 0.00 H new ATOM 0 HD3 PRO A 8 13.564 5.044 6.347 1.00 0.00 H new ATOM 80 N PRO A 9 12.783 8.392 2.091 1.00 0.00 N ATOM 81 CA PRO A 9 11.917 9.305 1.339 1.00 0.00 C ATOM 82 C PRO A 9 10.558 8.690 1.026 1.00 0.00 C ATOM 83 O PRO A 9 10.461 7.504 0.710 1.00 0.00 O ATOM 84 CB PRO A 9 12.701 9.556 0.049 1.00 0.00 C ATOM 85 CG PRO A 9 13.564 8.352 -0.110 1.00 0.00 C ATOM 86 CD PRO A 9 13.915 7.907 1.283 1.00 0.00 C ATOM 0 HA PRO A 9 11.695 10.212 1.902 1.00 0.00 H new ATOM 0 HB2 PRO A 9 12.032 9.679 -0.803 1.00 0.00 H new ATOM 0 HB3 PRO A 9 13.299 10.465 0.119 1.00 0.00 H new ATOM 0 HG2 PRO A 9 13.039 7.564 -0.651 1.00 0.00 H new ATOM 0 HG3 PRO A 9 14.461 8.588 -0.682 1.00 0.00 H new ATOM 0 HD2 PRO A 9 14.018 6.824 1.345 1.00 0.00 H new ATOM 0 HD3 PRO A 9 14.860 8.337 1.616 1.00 0.00 H new ATOM 94 N ALA A 10 9.510 9.503 1.116 1.00 0.00 N ATOM 95 CA ALA A 10 8.157 9.038 0.839 1.00 0.00 C ATOM 96 C ALA A 10 8.096 8.278 -0.482 1.00 0.00 C ATOM 97 O ALA A 10 8.304 8.853 -1.550 1.00 0.00 O ATOM 98 CB ALA A 10 7.189 10.212 0.820 1.00 0.00 C ATOM 0 H ALA A 10 9.573 10.487 1.379 1.00 0.00 H new ATOM 0 HA ALA A 10 7.865 8.353 1.635 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.182 9.850 0.612 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.202 10.710 1.789 1.00 0.00 H new ATOM 0 HB3 ALA A 10 7.488 10.918 0.045 1.00 0.00 H new ATOM 104 N VAL A 11 7.811 6.982 -0.401 1.00 0.00 N ATOM 105 CA VAL A 11 7.723 6.143 -1.591 1.00 0.00 C ATOM 106 C VAL A 11 6.996 6.865 -2.719 1.00 0.00 C ATOM 107 O VAL A 11 5.951 7.481 -2.505 1.00 0.00 O ATOM 108 CB VAL A 11 6.996 4.819 -1.291 1.00 0.00 C ATOM 109 CG1 VAL A 11 7.151 3.850 -2.453 1.00 0.00 C ATOM 110 CG2 VAL A 11 7.519 4.205 -0.001 1.00 0.00 C ATOM 0 H VAL A 11 7.637 6.490 0.476 1.00 0.00 H new ATOM 0 HA VAL A 11 8.745 5.925 -1.902 1.00 0.00 H new ATOM 0 HB VAL A 11 5.934 5.028 -1.163 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.631 2.920 -2.223 1.00 0.00 H new ATOM 0 HG12 VAL A 11 6.725 4.291 -3.354 1.00 0.00 H new ATOM 0 HG13 VAL A 11 8.209 3.643 -2.616 1.00 0.00 H new ATOM 0 HG21 VAL A 11 6.994 3.270 0.196 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.587 4.008 -0.098 1.00 0.00 H new ATOM 0 HG23 VAL A 11 7.351 4.896 0.825 1.00 0.00 H new ATOM 120 N SER A 12 7.555 6.785 -3.923 1.00 0.00 N ATOM 121 CA SER A 12 6.961 7.433 -5.086 1.00 0.00 C ATOM 122 C SER A 12 6.866 6.463 -6.260 1.00 0.00 C ATOM 123 O SER A 12 7.309 5.318 -6.170 1.00 0.00 O ATOM 124 CB SER A 12 7.784 8.659 -5.488 1.00 0.00 C ATOM 125 OG SER A 12 9.148 8.321 -5.667 1.00 0.00 O ATOM 0 H SER A 12 8.418 6.278 -4.118 1.00 0.00 H new ATOM 0 HA SER A 12 5.953 7.751 -4.819 1.00 0.00 H new ATOM 0 HB2 SER A 12 7.387 9.081 -6.411 1.00 0.00 H new ATOM 0 HB3 SER A 12 7.694 9.428 -4.721 1.00 0.00 H new ATOM 0 HG SER A 12 9.652 9.121 -5.925 1.00 0.00 H new ATOM 131 N ASP A 13 6.286 6.930 -7.359 1.00 0.00 N ATOM 132 CA ASP A 13 6.133 6.105 -8.552 1.00 0.00 C ATOM 133 C ASP A 13 5.600 4.722 -8.192 1.00 0.00 C ATOM 134 O ASP A 13 6.200 3.705 -8.541 1.00 0.00 O ATOM 135 CB ASP A 13 7.470 5.975 -9.283 1.00 0.00 C ATOM 136 CG ASP A 13 7.725 7.129 -10.234 1.00 0.00 C ATOM 137 OD1 ASP A 13 7.889 8.269 -9.752 1.00 0.00 O ATOM 138 OD2 ASP A 13 7.758 6.892 -11.460 1.00 0.00 O ATOM 0 H ASP A 13 5.914 7.875 -7.449 1.00 0.00 H new ATOM 0 HA ASP A 13 5.413 6.592 -9.210 1.00 0.00 H new ATOM 0 HB2 ASP A 13 8.277 5.925 -8.552 1.00 0.00 H new ATOM 0 HB3 ASP A 13 7.487 5.038 -9.840 1.00 0.00 H new ATOM 143 N ILE A 14 4.471 4.692 -7.492 1.00 0.00 N ATOM 144 CA ILE A 14 3.858 3.434 -7.084 1.00 0.00 C ATOM 145 C ILE A 14 2.921 2.905 -8.164 1.00 0.00 C ATOM 146 O ILE A 14 1.796 3.382 -8.313 1.00 0.00 O ATOM 147 CB ILE A 14 3.071 3.591 -5.770 1.00 0.00 C ATOM 148 CG1 ILE A 14 4.019 3.947 -4.622 1.00 0.00 C ATOM 149 CG2 ILE A 14 2.306 2.315 -5.455 1.00 0.00 C ATOM 150 CD1 ILE A 14 3.315 4.528 -3.416 1.00 0.00 C ATOM 0 H ILE A 14 3.962 5.525 -7.196 1.00 0.00 H new ATOM 0 HA ILE A 14 4.669 2.723 -6.929 1.00 0.00 H new ATOM 0 HB ILE A 14 2.353 4.402 -5.889 1.00 0.00 H new ATOM 0 HG12 ILE A 14 4.562 3.052 -4.319 1.00 0.00 H new ATOM 0 HG13 ILE A 14 4.759 4.663 -4.981 1.00 0.00 H new ATOM 0 HG21 ILE A 14 1.755 2.442 -4.523 1.00 0.00 H new ATOM 0 HG22 ILE A 14 1.607 2.101 -6.264 1.00 0.00 H new ATOM 0 HG23 ILE A 14 3.007 1.487 -5.352 1.00 0.00 H new ATOM 0 HD11 ILE A 14 4.048 4.757 -2.642 1.00 0.00 H new ATOM 0 HD12 ILE A 14 2.794 5.441 -3.704 1.00 0.00 H new ATOM 0 HD13 ILE A 14 2.595 3.805 -3.032 1.00 0.00 H new ATOM 162 N ARG A 15 3.392 1.914 -8.915 1.00 0.00 N ATOM 163 CA ARG A 15 2.595 1.318 -9.981 1.00 0.00 C ATOM 164 C ARG A 15 1.900 0.050 -9.496 1.00 0.00 C ATOM 165 O ARG A 15 2.457 -0.715 -8.709 1.00 0.00 O ATOM 166 CB ARG A 15 3.479 0.998 -11.188 1.00 0.00 C ATOM 167 CG ARG A 15 4.053 2.231 -11.867 1.00 0.00 C ATOM 168 CD ARG A 15 3.068 2.832 -12.857 1.00 0.00 C ATOM 169 NE ARG A 15 3.687 3.861 -13.688 1.00 0.00 N ATOM 170 CZ ARG A 15 3.042 4.518 -14.646 1.00 0.00 C ATOM 171 NH1 ARG A 15 1.767 4.254 -14.893 1.00 0.00 N ATOM 172 NH2 ARG A 15 3.674 5.441 -15.360 1.00 0.00 N ATOM 0 H ARG A 15 4.321 1.507 -8.805 1.00 0.00 H new ATOM 0 HA ARG A 15 1.833 2.038 -10.277 1.00 0.00 H new ATOM 0 HB2 ARG A 15 4.299 0.356 -10.867 1.00 0.00 H new ATOM 0 HB3 ARG A 15 2.896 0.432 -11.915 1.00 0.00 H new ATOM 0 HG2 ARG A 15 4.313 2.975 -11.114 1.00 0.00 H new ATOM 0 HG3 ARG A 15 4.975 1.966 -12.385 1.00 0.00 H new ATOM 0 HD2 ARG A 15 2.668 2.043 -13.494 1.00 0.00 H new ATOM 0 HD3 ARG A 15 2.226 3.262 -12.315 1.00 0.00 H new ATOM 0 HE ARG A 15 4.668 4.088 -13.524 1.00 0.00 H new ATOM 0 HH11 ARG A 15 1.278 3.545 -14.347 1.00 0.00 H new ATOM 0 HH12 ARG A 15 1.275 4.760 -15.629 1.00 0.00 H new ATOM 0 HH21 ARG A 15 4.656 5.646 -15.174 1.00 0.00 H new ATOM 0 HH22 ARG A 15 3.178 5.945 -16.095 1.00 0.00 H new ATOM 186 N VAL A 16 0.677 -0.167 -9.972 1.00 0.00 N ATOM 187 CA VAL A 16 -0.095 -1.343 -9.588 1.00 0.00 C ATOM 188 C VAL A 16 -0.349 -2.249 -10.787 1.00 0.00 C ATOM 189 O VAL A 16 -1.039 -1.868 -11.733 1.00 0.00 O ATOM 190 CB VAL A 16 -1.446 -0.947 -8.962 1.00 0.00 C ATOM 191 CG1 VAL A 16 -2.053 0.233 -9.705 1.00 0.00 C ATOM 192 CG2 VAL A 16 -2.398 -2.133 -8.958 1.00 0.00 C ATOM 0 H VAL A 16 0.200 0.456 -10.624 1.00 0.00 H new ATOM 0 HA VAL A 16 0.496 -1.882 -8.848 1.00 0.00 H new ATOM 0 HB VAL A 16 -1.274 -0.645 -7.929 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -3.007 0.499 -9.249 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -1.375 1.085 -9.651 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -2.213 -0.038 -10.749 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -3.347 -1.836 -8.512 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -2.566 -2.468 -9.982 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -1.963 -2.946 -8.377 1.00 0.00 H new ATOM 202 N THR A 17 0.213 -3.453 -10.741 1.00 0.00 N ATOM 203 CA THR A 17 0.048 -4.415 -11.823 1.00 0.00 C ATOM 204 C THR A 17 -0.749 -5.630 -11.363 1.00 0.00 C ATOM 205 O THR A 17 -0.989 -5.811 -10.169 1.00 0.00 O ATOM 206 CB THR A 17 1.409 -4.885 -12.369 1.00 0.00 C ATOM 207 OG1 THR A 17 1.239 -5.487 -13.657 1.00 0.00 O ATOM 208 CG2 THR A 17 2.058 -5.881 -11.420 1.00 0.00 C ATOM 0 H THR A 17 0.787 -3.785 -9.966 1.00 0.00 H new ATOM 0 HA THR A 17 -0.498 -3.906 -12.617 1.00 0.00 H new ATOM 0 HB THR A 17 2.060 -4.015 -12.458 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.109 -5.782 -13.998 1.00 0.00 H new ATOM 0 HG21 THR A 17 3.018 -6.199 -11.827 1.00 0.00 H new ATOM 0 HG22 THR A 17 2.213 -5.410 -10.449 1.00 0.00 H new ATOM 0 HG23 THR A 17 1.409 -6.749 -11.303 1.00 0.00 H new ATOM 216 N ARG A 18 -1.156 -6.462 -12.316 1.00 0.00 N ATOM 217 CA ARG A 18 -1.926 -7.660 -12.008 1.00 0.00 C ATOM 218 C ARG A 18 -3.152 -7.317 -11.165 1.00 0.00 C ATOM 219 O ARG A 18 -3.355 -7.880 -10.090 1.00 0.00 O ATOM 220 CB ARG A 18 -1.054 -8.676 -11.268 1.00 0.00 C ATOM 221 CG ARG A 18 0.077 -9.238 -12.113 1.00 0.00 C ATOM 222 CD ARG A 18 -0.434 -10.251 -13.125 1.00 0.00 C ATOM 223 NE ARG A 18 0.570 -10.566 -14.139 1.00 0.00 N ATOM 224 CZ ARG A 18 0.389 -11.469 -15.096 1.00 0.00 C ATOM 225 NH1 ARG A 18 -0.750 -12.143 -15.170 1.00 0.00 N ATOM 226 NH2 ARG A 18 1.349 -11.699 -15.982 1.00 0.00 N ATOM 0 H ARG A 18 -0.965 -6.328 -13.309 1.00 0.00 H new ATOM 0 HA ARG A 18 -2.263 -8.096 -12.948 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -0.633 -8.203 -10.381 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -1.682 -9.498 -10.923 1.00 0.00 H new ATOM 0 HG2 ARG A 18 0.582 -8.425 -12.634 1.00 0.00 H new ATOM 0 HG3 ARG A 18 0.816 -9.710 -11.466 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -0.726 -11.165 -12.608 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -1.328 -9.860 -13.610 1.00 0.00 H new ATOM 0 HE ARG A 18 1.458 -10.065 -14.110 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -1.491 -11.969 -14.491 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -0.886 -12.836 -15.906 1.00 0.00 H new ATOM 0 HH21 ARG A 18 2.227 -11.182 -15.929 1.00 0.00 H new ATOM 0 HH22 ARG A 18 1.209 -12.393 -16.717 1.00 0.00 H new ATOM 240 N SER A 19 -3.964 -6.389 -11.663 1.00 0.00 N ATOM 241 CA SER A 19 -5.166 -5.968 -10.954 1.00 0.00 C ATOM 242 C SER A 19 -6.147 -7.128 -10.810 1.00 0.00 C ATOM 243 O SER A 19 -6.052 -8.127 -11.522 1.00 0.00 O ATOM 244 CB SER A 19 -5.837 -4.806 -11.691 1.00 0.00 C ATOM 245 OG SER A 19 -5.967 -5.087 -13.074 1.00 0.00 O ATOM 0 H SER A 19 -3.811 -5.915 -12.553 1.00 0.00 H new ATOM 0 HA SER A 19 -4.873 -5.637 -9.957 1.00 0.00 H new ATOM 0 HB2 SER A 19 -6.821 -4.618 -11.261 1.00 0.00 H new ATOM 0 HB3 SER A 19 -5.250 -3.897 -11.555 1.00 0.00 H new ATOM 0 HG SER A 19 -6.400 -4.331 -13.522 1.00 0.00 H new ATOM 251 N SER A 20 -7.089 -6.986 -9.884 1.00 0.00 N ATOM 252 CA SER A 20 -8.086 -8.023 -9.643 1.00 0.00 C ATOM 253 C SER A 20 -9.257 -7.473 -8.834 1.00 0.00 C ATOM 254 O SER A 20 -9.149 -6.454 -8.152 1.00 0.00 O ATOM 255 CB SER A 20 -7.454 -9.206 -8.907 1.00 0.00 C ATOM 256 OG SER A 20 -6.914 -10.145 -9.821 1.00 0.00 O ATOM 0 H SER A 20 -7.183 -6.163 -9.288 1.00 0.00 H new ATOM 0 HA SER A 20 -8.462 -8.363 -10.608 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.668 -8.847 -8.242 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.203 -9.692 -8.282 1.00 0.00 H new ATOM 0 HG SER A 20 -6.515 -9.671 -10.580 1.00 0.00 H new ATOM 262 N PRO A 21 -10.404 -8.164 -8.910 1.00 0.00 N ATOM 263 CA PRO A 21 -11.618 -7.766 -8.191 1.00 0.00 C ATOM 264 C PRO A 21 -11.489 -7.957 -6.684 1.00 0.00 C ATOM 265 O PRO A 21 -11.923 -7.112 -5.902 1.00 0.00 O ATOM 266 CB PRO A 21 -12.689 -8.700 -8.759 1.00 0.00 C ATOM 267 CG PRO A 21 -11.938 -9.897 -9.229 1.00 0.00 C ATOM 268 CD PRO A 21 -10.604 -9.389 -9.703 1.00 0.00 C ATOM 0 HA PRO A 21 -11.842 -6.708 -8.324 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -13.424 -8.967 -8.000 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -13.233 -8.228 -9.577 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -11.816 -10.622 -8.424 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -12.472 -10.401 -10.034 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.811 -10.116 -9.526 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -10.611 -9.179 -10.772 1.00 0.00 H new ATOM 276 N SER A 22 -10.889 -9.073 -6.283 1.00 0.00 N ATOM 277 CA SER A 22 -10.705 -9.377 -4.869 1.00 0.00 C ATOM 278 C SER A 22 -9.223 -9.429 -4.512 1.00 0.00 C ATOM 279 O SER A 22 -8.809 -10.192 -3.639 1.00 0.00 O ATOM 280 CB SER A 22 -11.372 -10.709 -4.521 1.00 0.00 C ATOM 281 OG SER A 22 -11.409 -10.910 -3.119 1.00 0.00 O ATOM 0 H SER A 22 -10.522 -9.782 -6.918 1.00 0.00 H new ATOM 0 HA SER A 22 -11.173 -8.582 -4.288 1.00 0.00 H new ATOM 0 HB2 SER A 22 -12.386 -10.727 -4.921 1.00 0.00 H new ATOM 0 HB3 SER A 22 -10.828 -11.526 -4.994 1.00 0.00 H new ATOM 0 HG SER A 22 -11.841 -11.767 -2.923 1.00 0.00 H new ATOM 287 N SER A 23 -8.427 -8.611 -5.194 1.00 0.00 N ATOM 288 CA SER A 23 -6.990 -8.566 -4.953 1.00 0.00 C ATOM 289 C SER A 23 -6.337 -7.457 -5.772 1.00 0.00 C ATOM 290 O SER A 23 -6.780 -7.141 -6.877 1.00 0.00 O ATOM 291 CB SER A 23 -6.351 -9.913 -5.297 1.00 0.00 C ATOM 292 OG SER A 23 -6.751 -10.354 -6.583 1.00 0.00 O ATOM 0 H SER A 23 -8.753 -7.971 -5.918 1.00 0.00 H new ATOM 0 HA SER A 23 -6.830 -8.356 -3.895 1.00 0.00 H new ATOM 0 HB2 SER A 23 -5.265 -9.824 -5.261 1.00 0.00 H new ATOM 0 HB3 SER A 23 -6.635 -10.655 -4.550 1.00 0.00 H new ATOM 0 HG SER A 23 -6.328 -11.216 -6.780 1.00 0.00 H new ATOM 298 N LEU A 24 -5.280 -6.868 -5.222 1.00 0.00 N ATOM 299 CA LEU A 24 -4.564 -5.793 -5.900 1.00 0.00 C ATOM 300 C LEU A 24 -3.078 -5.827 -5.556 1.00 0.00 C ATOM 301 O LEU A 24 -2.686 -5.549 -4.423 1.00 0.00 O ATOM 302 CB LEU A 24 -5.157 -4.437 -5.515 1.00 0.00 C ATOM 303 CG LEU A 24 -6.557 -4.139 -6.053 1.00 0.00 C ATOM 304 CD1 LEU A 24 -7.202 -3.009 -5.265 1.00 0.00 C ATOM 305 CD2 LEU A 24 -6.497 -3.792 -7.533 1.00 0.00 C ATOM 0 H LEU A 24 -4.900 -7.117 -4.309 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.673 -5.938 -6.975 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.186 -4.371 -4.427 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.482 -3.656 -5.864 1.00 0.00 H new ATOM 0 HG LEU A 24 -7.169 -5.033 -5.934 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -8.198 -2.811 -5.662 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.280 -3.295 -4.216 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.591 -2.110 -5.352 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -7.502 -3.583 -7.899 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -5.869 -2.913 -7.675 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -6.077 -4.632 -8.087 1.00 0.00 H new ATOM 317 N SER A 25 -2.256 -6.169 -6.543 1.00 0.00 N ATOM 318 CA SER A 25 -0.813 -6.241 -6.345 1.00 0.00 C ATOM 319 C SER A 25 -0.170 -4.869 -6.527 1.00 0.00 C ATOM 320 O SER A 25 -0.378 -4.203 -7.542 1.00 0.00 O ATOM 321 CB SER A 25 -0.192 -7.241 -7.322 1.00 0.00 C ATOM 322 OG SER A 25 1.194 -6.996 -7.491 1.00 0.00 O ATOM 0 H SER A 25 -2.564 -6.400 -7.487 1.00 0.00 H new ATOM 0 HA SER A 25 -0.628 -6.577 -5.325 1.00 0.00 H new ATOM 0 HB2 SER A 25 -0.343 -8.256 -6.953 1.00 0.00 H new ATOM 0 HB3 SER A 25 -0.697 -7.174 -8.286 1.00 0.00 H new ATOM 0 HG SER A 25 1.568 -7.649 -8.119 1.00 0.00 H new ATOM 328 N LEU A 26 0.611 -4.453 -5.536 1.00 0.00 N ATOM 329 CA LEU A 26 1.285 -3.160 -5.585 1.00 0.00 C ATOM 330 C LEU A 26 2.797 -3.338 -5.682 1.00 0.00 C ATOM 331 O LEU A 26 3.349 -4.323 -5.193 1.00 0.00 O ATOM 332 CB LEU A 26 0.936 -2.334 -4.346 1.00 0.00 C ATOM 333 CG LEU A 26 -0.549 -2.040 -4.131 1.00 0.00 C ATOM 334 CD1 LEU A 26 -0.857 -1.903 -2.649 1.00 0.00 C ATOM 335 CD2 LEU A 26 -0.958 -0.781 -4.882 1.00 0.00 C ATOM 0 H LEU A 26 0.793 -4.992 -4.689 1.00 0.00 H new ATOM 0 HA LEU A 26 0.942 -2.632 -6.475 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.313 -2.857 -3.467 1.00 0.00 H new ATOM 0 HB3 LEU A 26 1.469 -1.385 -4.405 1.00 0.00 H new ATOM 0 HG LEU A 26 -1.126 -2.877 -4.525 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.918 -1.694 -2.516 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.603 -2.831 -2.137 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.271 -1.085 -2.230 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.018 -0.587 -4.717 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -0.374 0.065 -4.519 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.775 -0.918 -5.948 1.00 0.00 H new ATOM 347 N ALA A 27 3.461 -2.377 -6.316 1.00 0.00 N ATOM 348 CA ALA A 27 4.909 -2.425 -6.474 1.00 0.00 C ATOM 349 C ALA A 27 5.488 -1.027 -6.666 1.00 0.00 C ATOM 350 O ALA A 27 5.040 -0.274 -7.530 1.00 0.00 O ATOM 351 CB ALA A 27 5.283 -3.319 -7.647 1.00 0.00 C ATOM 0 H ALA A 27 3.019 -1.556 -6.729 1.00 0.00 H new ATOM 0 HA ALA A 27 5.335 -2.844 -5.562 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.368 -3.345 -7.753 1.00 0.00 H new ATOM 0 HB2 ALA A 27 4.911 -4.328 -7.469 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.839 -2.925 -8.561 1.00 0.00 H new ATOM 357 N TRP A 28 6.483 -0.687 -5.855 1.00 0.00 N ATOM 358 CA TRP A 28 7.122 0.621 -5.936 1.00 0.00 C ATOM 359 C TRP A 28 8.560 0.496 -6.426 1.00 0.00 C ATOM 360 O TRP A 28 9.105 -0.605 -6.503 1.00 0.00 O ATOM 361 CB TRP A 28 7.092 1.311 -4.572 1.00 0.00 C ATOM 362 CG TRP A 28 7.118 0.352 -3.420 1.00 0.00 C ATOM 363 CD1 TRP A 28 8.089 0.242 -2.467 1.00 0.00 C ATOM 364 CD2 TRP A 28 6.128 -0.633 -3.104 1.00 0.00 C ATOM 365 NE1 TRP A 28 7.762 -0.752 -1.576 1.00 0.00 N ATOM 366 CE2 TRP A 28 6.564 -1.303 -1.944 1.00 0.00 C ATOM 367 CE3 TRP A 28 4.915 -1.012 -3.685 1.00 0.00 C ATOM 368 CZ2 TRP A 28 5.829 -2.331 -1.359 1.00 0.00 C ATOM 369 CZ3 TRP A 28 4.187 -2.032 -3.103 1.00 0.00 C ATOM 370 CH2 TRP A 28 4.645 -2.682 -1.949 1.00 0.00 C ATOM 0 H TRP A 28 6.865 -1.299 -5.134 1.00 0.00 H new ATOM 0 HA TRP A 28 6.566 1.225 -6.653 1.00 0.00 H new ATOM 0 HB2 TRP A 28 7.946 1.984 -4.494 1.00 0.00 H new ATOM 0 HB3 TRP A 28 6.194 1.926 -4.503 1.00 0.00 H new ATOM 0 HD1 TRP A 28 8.982 0.847 -2.420 1.00 0.00 H new ATOM 0 HE1 TRP A 28 8.321 -1.034 -0.771 1.00 0.00 H new ATOM 0 HE3 TRP A 28 4.553 -0.516 -4.574 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 6.181 -2.834 -0.470 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 3.249 -2.334 -3.545 1.00 0.00 H new ATOM 0 HH2 TRP A 28 4.052 -3.475 -1.517 1.00 0.00 H new ATOM 381 N ALA A 29 9.170 1.630 -6.754 1.00 0.00 N ATOM 382 CA ALA A 29 10.547 1.646 -7.234 1.00 0.00 C ATOM 383 C ALA A 29 11.524 1.890 -6.089 1.00 0.00 C ATOM 384 O ALA A 29 11.536 2.964 -5.488 1.00 0.00 O ATOM 385 CB ALA A 29 10.718 2.706 -8.312 1.00 0.00 C ATOM 0 H ALA A 29 8.733 2.550 -6.696 1.00 0.00 H new ATOM 0 HA ALA A 29 10.768 0.669 -7.663 1.00 0.00 H new ATOM 0 HB1 ALA A 29 11.751 2.707 -8.661 1.00 0.00 H new ATOM 0 HB2 ALA A 29 10.053 2.486 -9.147 1.00 0.00 H new ATOM 0 HB3 ALA A 29 10.473 3.686 -7.901 1.00 0.00 H new ATOM 391 N VAL A 30 12.343 0.886 -5.791 1.00 0.00 N ATOM 392 CA VAL A 30 13.324 0.992 -4.718 1.00 0.00 C ATOM 393 C VAL A 30 13.871 2.411 -4.612 1.00 0.00 C ATOM 394 O VAL A 30 14.783 2.807 -5.338 1.00 0.00 O ATOM 395 CB VAL A 30 14.496 0.016 -4.932 1.00 0.00 C ATOM 396 CG1 VAL A 30 15.562 0.220 -3.866 1.00 0.00 C ATOM 397 CG2 VAL A 30 13.999 -1.422 -4.932 1.00 0.00 C ATOM 0 H VAL A 30 12.346 -0.010 -6.278 1.00 0.00 H new ATOM 0 HA VAL A 30 12.810 0.734 -3.792 1.00 0.00 H new ATOM 0 HB VAL A 30 14.944 0.221 -5.904 1.00 0.00 H new ATOM 0 HG11 VAL A 30 16.382 -0.478 -4.033 1.00 0.00 H new ATOM 0 HG12 VAL A 30 15.939 1.242 -3.919 1.00 0.00 H new ATOM 0 HG13 VAL A 30 15.130 0.043 -2.881 1.00 0.00 H new ATOM 0 HG21 VAL A 30 14.841 -2.098 -5.084 1.00 0.00 H new ATOM 0 HG22 VAL A 30 13.525 -1.643 -3.976 1.00 0.00 H new ATOM 0 HG23 VAL A 30 13.275 -1.557 -5.736 1.00 0.00 H new ATOM 407 N PRO A 31 13.303 3.196 -3.686 1.00 0.00 N ATOM 408 CA PRO A 31 13.718 4.584 -3.462 1.00 0.00 C ATOM 409 C PRO A 31 15.105 4.680 -2.833 1.00 0.00 C ATOM 410 O PRO A 31 15.583 3.729 -2.215 1.00 0.00 O ATOM 411 CB PRO A 31 12.657 5.121 -2.499 1.00 0.00 C ATOM 412 CG PRO A 31 12.143 3.916 -1.790 1.00 0.00 C ATOM 413 CD PRO A 31 12.211 2.790 -2.786 1.00 0.00 C ATOM 0 HA PRO A 31 13.789 5.143 -4.395 1.00 0.00 H new ATOM 0 HB2 PRO A 31 13.085 5.839 -1.800 1.00 0.00 H new ATOM 0 HB3 PRO A 31 11.859 5.635 -3.036 1.00 0.00 H new ATOM 0 HG2 PRO A 31 12.745 3.695 -0.909 1.00 0.00 H new ATOM 0 HG3 PRO A 31 11.120 4.072 -1.446 1.00 0.00 H new ATOM 0 HD2 PRO A 31 12.423 1.837 -2.301 1.00 0.00 H new ATOM 0 HD3 PRO A 31 11.270 2.672 -3.324 1.00 0.00 H new ATOM 421 N ARG A 32 15.744 5.833 -2.995 1.00 0.00 N ATOM 422 CA ARG A 32 17.076 6.052 -2.444 1.00 0.00 C ATOM 423 C ARG A 32 16.993 6.577 -1.014 1.00 0.00 C ATOM 424 O ARG A 32 16.431 7.643 -0.764 1.00 0.00 O ATOM 425 CB ARG A 32 17.856 7.038 -3.316 1.00 0.00 C ATOM 426 CG ARG A 32 18.449 6.409 -4.566 1.00 0.00 C ATOM 427 CD ARG A 32 17.404 6.252 -5.659 1.00 0.00 C ATOM 428 NE ARG A 32 17.257 7.468 -6.455 1.00 0.00 N ATOM 429 CZ ARG A 32 18.169 7.893 -7.322 1.00 0.00 C ATOM 430 NH1 ARG A 32 19.288 7.205 -7.504 1.00 0.00 N ATOM 431 NH2 ARG A 32 17.963 9.010 -8.009 1.00 0.00 N ATOM 0 H ARG A 32 15.361 6.630 -3.503 1.00 0.00 H new ATOM 0 HA ARG A 32 17.599 5.096 -2.432 1.00 0.00 H new ATOM 0 HB2 ARG A 32 17.194 7.853 -3.609 1.00 0.00 H new ATOM 0 HB3 ARG A 32 18.659 7.477 -2.724 1.00 0.00 H new ATOM 0 HG2 ARG A 32 19.269 7.027 -4.931 1.00 0.00 H new ATOM 0 HG3 ARG A 32 18.869 5.434 -4.320 1.00 0.00 H new ATOM 0 HD2 ARG A 32 17.683 5.424 -6.311 1.00 0.00 H new ATOM 0 HD3 ARG A 32 16.445 5.995 -5.209 1.00 0.00 H new ATOM 0 HE ARG A 32 16.408 8.021 -6.339 1.00 0.00 H new ATOM 0 HH11 ARG A 32 19.450 6.347 -6.977 1.00 0.00 H new ATOM 0 HH12 ARG A 32 19.986 7.534 -8.171 1.00 0.00 H new ATOM 0 HH21 ARG A 32 17.104 9.542 -7.871 1.00 0.00 H new ATOM 0 HH22 ARG A 32 18.664 9.336 -8.675 1.00 0.00 H new ATOM 445 N ALA A 33 17.556 5.820 -0.077 1.00 0.00 N ATOM 446 CA ALA A 33 17.547 6.209 1.327 1.00 0.00 C ATOM 447 C ALA A 33 18.748 7.087 1.661 1.00 0.00 C ATOM 448 O ALA A 33 19.842 6.916 1.123 1.00 0.00 O ATOM 449 CB ALA A 33 17.530 4.974 2.217 1.00 0.00 C ATOM 0 H ALA A 33 18.024 4.934 -0.266 1.00 0.00 H new ATOM 0 HA ALA A 33 16.643 6.789 1.512 1.00 0.00 H new ATOM 0 HB1 ALA A 33 17.523 5.280 3.263 1.00 0.00 H new ATOM 0 HB2 ALA A 33 16.637 4.385 2.005 1.00 0.00 H new ATOM 0 HB3 ALA A 33 18.417 4.372 2.021 1.00 0.00 H new ATOM 455 N PRO A 34 18.542 8.052 2.570 1.00 0.00 N ATOM 456 CA PRO A 34 19.597 8.976 2.996 1.00 0.00 C ATOM 457 C PRO A 34 20.672 8.285 3.829 1.00 0.00 C ATOM 458 O PRO A 34 21.643 8.913 4.249 1.00 0.00 O ATOM 459 CB PRO A 34 18.845 10.006 3.843 1.00 0.00 C ATOM 460 CG PRO A 34 17.641 9.283 4.339 1.00 0.00 C ATOM 461 CD PRO A 34 17.264 8.314 3.253 1.00 0.00 C ATOM 0 HA PRO A 34 20.128 9.407 2.147 1.00 0.00 H new ATOM 0 HB2 PRO A 34 19.460 10.364 4.669 1.00 0.00 H new ATOM 0 HB3 PRO A 34 18.567 10.878 3.251 1.00 0.00 H new ATOM 0 HG2 PRO A 34 17.856 8.760 5.271 1.00 0.00 H new ATOM 0 HG3 PRO A 34 16.826 9.977 4.543 1.00 0.00 H new ATOM 0 HD2 PRO A 34 16.832 7.400 3.662 1.00 0.00 H new ATOM 0 HD3 PRO A 34 16.525 8.739 2.574 1.00 0.00 H new ATOM 469 N SER A 35 20.491 6.989 4.063 1.00 0.00 N ATOM 470 CA SER A 35 21.444 6.214 4.848 1.00 0.00 C ATOM 471 C SER A 35 21.248 4.719 4.618 1.00 0.00 C ATOM 472 O SER A 35 20.153 4.269 4.283 1.00 0.00 O ATOM 473 CB SER A 35 21.294 6.537 6.336 1.00 0.00 C ATOM 474 OG SER A 35 21.795 7.830 6.630 1.00 0.00 O ATOM 0 H SER A 35 19.693 6.454 3.720 1.00 0.00 H new ATOM 0 HA SER A 35 22.449 6.485 4.525 1.00 0.00 H new ATOM 0 HB2 SER A 35 20.243 6.477 6.620 1.00 0.00 H new ATOM 0 HB3 SER A 35 21.827 5.793 6.928 1.00 0.00 H new ATOM 0 HG SER A 35 22.131 8.245 5.808 1.00 0.00 H new ATOM 480 N GLY A 36 22.319 3.953 4.801 1.00 0.00 N ATOM 481 CA GLY A 36 22.245 2.516 4.609 1.00 0.00 C ATOM 482 C GLY A 36 21.313 2.129 3.479 1.00 0.00 C ATOM 483 O GLY A 36 21.542 2.491 2.325 1.00 0.00 O ATOM 0 H GLY A 36 23.236 4.302 5.079 1.00 0.00 H new ATOM 0 HA2 GLY A 36 23.243 2.129 4.402 1.00 0.00 H new ATOM 0 HA3 GLY A 36 21.906 2.046 5.532 1.00 0.00 H new ATOM 487 N ALA A 37 20.259 1.390 3.810 1.00 0.00 N ATOM 488 CA ALA A 37 19.288 0.954 2.814 1.00 0.00 C ATOM 489 C ALA A 37 17.968 0.561 3.468 1.00 0.00 C ATOM 490 O ALA A 37 17.918 0.276 4.665 1.00 0.00 O ATOM 491 CB ALA A 37 19.846 -0.209 2.007 1.00 0.00 C ATOM 0 H ALA A 37 20.056 1.081 4.761 1.00 0.00 H new ATOM 0 HA ALA A 37 19.095 1.790 2.141 1.00 0.00 H new ATOM 0 HB1 ALA A 37 19.110 -0.524 1.267 1.00 0.00 H new ATOM 0 HB2 ALA A 37 20.759 0.104 1.501 1.00 0.00 H new ATOM 0 HB3 ALA A 37 20.069 -1.041 2.675 1.00 0.00 H new ATOM 497 N VAL A 38 16.901 0.549 2.676 1.00 0.00 N ATOM 498 CA VAL A 38 15.580 0.190 3.179 1.00 0.00 C ATOM 499 C VAL A 38 15.571 -1.229 3.737 1.00 0.00 C ATOM 500 O VAL A 38 16.388 -2.065 3.350 1.00 0.00 O ATOM 501 CB VAL A 38 14.510 0.304 2.077 1.00 0.00 C ATOM 502 CG1 VAL A 38 13.127 0.024 2.645 1.00 0.00 C ATOM 503 CG2 VAL A 38 14.561 1.678 1.426 1.00 0.00 C ATOM 0 H VAL A 38 16.925 0.784 1.684 1.00 0.00 H new ATOM 0 HA VAL A 38 15.344 0.893 3.978 1.00 0.00 H new ATOM 0 HB VAL A 38 14.720 -0.443 1.312 1.00 0.00 H new ATOM 0 HG11 VAL A 38 12.384 0.109 1.852 1.00 0.00 H new ATOM 0 HG12 VAL A 38 13.101 -0.984 3.060 1.00 0.00 H new ATOM 0 HG13 VAL A 38 12.903 0.746 3.431 1.00 0.00 H new ATOM 0 HG21 VAL A 38 13.798 1.741 0.650 1.00 0.00 H new ATOM 0 HG22 VAL A 38 14.377 2.444 2.179 1.00 0.00 H new ATOM 0 HG23 VAL A 38 15.544 1.834 0.982 1.00 0.00 H new ATOM 513 N LEU A 39 14.641 -1.494 4.648 1.00 0.00 N ATOM 514 CA LEU A 39 14.524 -2.813 5.260 1.00 0.00 C ATOM 515 C LEU A 39 13.202 -3.473 4.882 1.00 0.00 C ATOM 516 O LEU A 39 13.179 -4.466 4.155 1.00 0.00 O ATOM 517 CB LEU A 39 14.635 -2.703 6.782 1.00 0.00 C ATOM 518 CG LEU A 39 15.898 -2.025 7.315 1.00 0.00 C ATOM 519 CD1 LEU A 39 15.762 -1.739 8.803 1.00 0.00 C ATOM 520 CD2 LEU A 39 17.122 -2.888 7.045 1.00 0.00 C ATOM 0 H LEU A 39 13.957 -0.813 4.979 1.00 0.00 H new ATOM 0 HA LEU A 39 15.339 -3.433 4.886 1.00 0.00 H new ATOM 0 HB2 LEU A 39 13.769 -2.154 7.151 1.00 0.00 H new ATOM 0 HB3 LEU A 39 14.580 -3.707 7.204 1.00 0.00 H new ATOM 0 HG LEU A 39 16.026 -1.076 6.793 1.00 0.00 H new ATOM 0 HD11 LEU A 39 16.670 -1.257 9.165 1.00 0.00 H new ATOM 0 HD12 LEU A 39 14.910 -1.081 8.971 1.00 0.00 H new ATOM 0 HD13 LEU A 39 15.609 -2.675 9.341 1.00 0.00 H new ATOM 0 HD21 LEU A 39 18.011 -2.389 7.431 1.00 0.00 H new ATOM 0 HD22 LEU A 39 17.003 -3.852 7.539 1.00 0.00 H new ATOM 0 HD23 LEU A 39 17.230 -3.041 5.971 1.00 0.00 H new ATOM 532 N ASP A 40 12.104 -2.914 5.379 1.00 0.00 N ATOM 533 CA ASP A 40 10.778 -3.447 5.090 1.00 0.00 C ATOM 534 C ASP A 40 9.831 -2.336 4.647 1.00 0.00 C ATOM 535 O ASP A 40 10.237 -1.183 4.499 1.00 0.00 O ATOM 536 CB ASP A 40 10.211 -4.155 6.321 1.00 0.00 C ATOM 537 CG ASP A 40 9.788 -3.184 7.405 1.00 0.00 C ATOM 538 OD1 ASP A 40 8.663 -2.649 7.317 1.00 0.00 O ATOM 539 OD2 ASP A 40 10.581 -2.959 8.343 1.00 0.00 O ATOM 0 H ASP A 40 12.106 -2.092 5.984 1.00 0.00 H new ATOM 0 HA ASP A 40 10.872 -4.167 4.277 1.00 0.00 H new ATOM 0 HB2 ASP A 40 9.354 -4.761 6.025 1.00 0.00 H new ATOM 0 HB3 ASP A 40 10.961 -4.837 6.721 1.00 0.00 H new ATOM 544 N TYR A 41 8.569 -2.691 4.435 1.00 0.00 N ATOM 545 CA TYR A 41 7.565 -1.725 4.004 1.00 0.00 C ATOM 546 C TYR A 41 6.195 -2.068 4.582 1.00 0.00 C ATOM 547 O TYR A 41 5.945 -3.206 4.979 1.00 0.00 O ATOM 548 CB TYR A 41 7.490 -1.682 2.477 1.00 0.00 C ATOM 549 CG TYR A 41 8.839 -1.543 1.809 1.00 0.00 C ATOM 550 CD1 TYR A 41 9.723 -2.614 1.755 1.00 0.00 C ATOM 551 CD2 TYR A 41 9.231 -0.341 1.232 1.00 0.00 C ATOM 552 CE1 TYR A 41 10.957 -2.492 1.146 1.00 0.00 C ATOM 553 CE2 TYR A 41 10.462 -0.210 0.620 1.00 0.00 C ATOM 554 CZ TYR A 41 11.322 -1.288 0.579 1.00 0.00 C ATOM 555 OH TYR A 41 12.550 -1.161 -0.029 1.00 0.00 O ATOM 0 H TYR A 41 8.217 -3.641 4.555 1.00 0.00 H new ATOM 0 HA TYR A 41 7.860 -0.743 4.374 1.00 0.00 H new ATOM 0 HB2 TYR A 41 7.009 -2.592 2.119 1.00 0.00 H new ATOM 0 HB3 TYR A 41 6.857 -0.847 2.176 1.00 0.00 H new ATOM 0 HD1 TYR A 41 9.440 -3.558 2.197 1.00 0.00 H new ATOM 0 HD2 TYR A 41 8.561 0.506 1.263 1.00 0.00 H new ATOM 0 HE1 TYR A 41 11.632 -3.334 1.114 1.00 0.00 H new ATOM 0 HE2 TYR A 41 10.750 0.731 0.176 1.00 0.00 H new ATOM 0 HH TYR A 41 12.650 -0.251 -0.378 1.00 0.00 H new ATOM 565 N GLU A 42 5.312 -1.076 4.624 1.00 0.00 N ATOM 566 CA GLU A 42 3.968 -1.272 5.153 1.00 0.00 C ATOM 567 C GLU A 42 2.920 -0.702 4.202 1.00 0.00 C ATOM 568 O GLU A 42 3.094 0.384 3.648 1.00 0.00 O ATOM 569 CB GLU A 42 3.836 -0.615 6.529 1.00 0.00 C ATOM 570 CG GLU A 42 2.825 -1.297 7.435 1.00 0.00 C ATOM 571 CD GLU A 42 1.395 -1.091 6.974 1.00 0.00 C ATOM 572 OE1 GLU A 42 1.087 0.008 6.467 1.00 0.00 O ATOM 573 OE2 GLU A 42 0.584 -2.029 7.119 1.00 0.00 O ATOM 0 H GLU A 42 5.503 -0.129 4.298 1.00 0.00 H new ATOM 0 HA GLU A 42 3.798 -2.344 5.253 1.00 0.00 H new ATOM 0 HB2 GLU A 42 4.810 -0.618 7.019 1.00 0.00 H new ATOM 0 HB3 GLU A 42 3.548 0.428 6.398 1.00 0.00 H new ATOM 0 HG2 GLU A 42 3.040 -2.365 7.474 1.00 0.00 H new ATOM 0 HG3 GLU A 42 2.935 -0.913 8.449 1.00 0.00 H new ATOM 580 N VAL A 43 1.831 -1.442 4.017 1.00 0.00 N ATOM 581 CA VAL A 43 0.755 -1.011 3.134 1.00 0.00 C ATOM 582 C VAL A 43 -0.551 -0.840 3.902 1.00 0.00 C ATOM 583 O VAL A 43 -1.156 -1.816 4.346 1.00 0.00 O ATOM 584 CB VAL A 43 0.535 -2.014 1.986 1.00 0.00 C ATOM 585 CG1 VAL A 43 -0.667 -1.609 1.145 1.00 0.00 C ATOM 586 CG2 VAL A 43 1.785 -2.123 1.126 1.00 0.00 C ATOM 0 H VAL A 43 1.671 -2.343 4.467 1.00 0.00 H new ATOM 0 HA VAL A 43 1.055 -0.051 2.715 1.00 0.00 H new ATOM 0 HB VAL A 43 0.332 -2.994 2.418 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -0.807 -2.329 0.339 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.559 -1.588 1.771 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.498 -0.619 0.721 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.611 -2.836 0.320 1.00 0.00 H new ATOM 0 HG22 VAL A 43 2.021 -1.147 0.702 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.619 -2.464 1.739 1.00 0.00 H new ATOM 596 N LYS A 44 -0.982 0.408 4.054 1.00 0.00 N ATOM 597 CA LYS A 44 -2.218 0.709 4.767 1.00 0.00 C ATOM 598 C LYS A 44 -3.341 1.045 3.791 1.00 0.00 C ATOM 599 O LYS A 44 -3.315 2.085 3.133 1.00 0.00 O ATOM 600 CB LYS A 44 -2.002 1.877 5.733 1.00 0.00 C ATOM 601 CG LYS A 44 -3.045 1.956 6.834 1.00 0.00 C ATOM 602 CD LYS A 44 -2.611 2.895 7.947 1.00 0.00 C ATOM 603 CE LYS A 44 -3.075 4.320 7.687 1.00 0.00 C ATOM 604 NZ LYS A 44 -4.460 4.551 8.183 1.00 0.00 N ATOM 0 H LYS A 44 -0.493 1.227 3.693 1.00 0.00 H new ATOM 0 HA LYS A 44 -2.506 -0.176 5.334 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -1.015 1.786 6.185 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -2.009 2.810 5.169 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -3.991 2.299 6.416 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -3.219 0.961 7.243 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.017 2.547 8.897 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -1.525 2.876 8.038 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -2.394 5.018 8.173 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -3.033 4.526 6.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -4.572 5.550 8.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -5.141 4.313 7.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.636 3.951 9.014 1.00 0.00 H new ATOM 618 N TYR A 45 -4.326 0.158 3.704 1.00 0.00 N ATOM 619 CA TYR A 45 -5.459 0.360 2.808 1.00 0.00 C ATOM 620 C TYR A 45 -6.776 0.323 3.577 1.00 0.00 C ATOM 621 O TYR A 45 -7.111 -0.679 4.209 1.00 0.00 O ATOM 622 CB TYR A 45 -5.465 -0.707 1.711 1.00 0.00 C ATOM 623 CG TYR A 45 -5.640 -2.114 2.237 1.00 0.00 C ATOM 624 CD1 TYR A 45 -4.604 -2.765 2.893 1.00 0.00 C ATOM 625 CD2 TYR A 45 -6.843 -2.791 2.077 1.00 0.00 C ATOM 626 CE1 TYR A 45 -4.760 -4.051 3.374 1.00 0.00 C ATOM 627 CE2 TYR A 45 -7.008 -4.076 2.556 1.00 0.00 C ATOM 628 CZ TYR A 45 -5.964 -4.702 3.203 1.00 0.00 C ATOM 629 OH TYR A 45 -6.123 -5.982 3.682 1.00 0.00 O ATOM 0 H TYR A 45 -4.363 -0.707 4.243 1.00 0.00 H new ATOM 0 HA TYR A 45 -5.356 1.343 2.349 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -6.268 -0.488 1.007 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -4.529 -0.650 1.155 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -3.660 -2.258 3.030 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -7.663 -2.304 1.570 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -3.944 -4.544 3.881 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -7.950 -4.588 2.424 1.00 0.00 H new ATOM 0 HH TYR A 45 -7.029 -6.296 3.481 1.00 0.00 H new ATOM 639 N HIS A 46 -7.520 1.422 3.516 1.00 0.00 N ATOM 640 CA HIS A 46 -8.802 1.517 4.206 1.00 0.00 C ATOM 641 C HIS A 46 -9.845 2.194 3.322 1.00 0.00 C ATOM 642 O HIS A 46 -9.579 3.231 2.716 1.00 0.00 O ATOM 643 CB HIS A 46 -8.645 2.291 5.515 1.00 0.00 C ATOM 644 CG HIS A 46 -8.629 3.777 5.333 1.00 0.00 C ATOM 645 ND1 HIS A 46 -7.635 4.440 4.644 1.00 0.00 N ATOM 646 CD2 HIS A 46 -9.493 4.730 5.754 1.00 0.00 C ATOM 647 CE1 HIS A 46 -7.888 5.737 4.651 1.00 0.00 C ATOM 648 NE2 HIS A 46 -9.010 5.939 5.318 1.00 0.00 N ATOM 0 H HIS A 46 -7.258 2.259 2.996 1.00 0.00 H new ATOM 0 HA HIS A 46 -9.142 0.506 4.430 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -9.462 2.024 6.186 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -7.719 1.983 6.001 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -10.395 4.569 6.326 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -7.281 6.502 4.190 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -9.447 6.846 5.482 1.00 0.00 H new ATOM 657 N GLU A 47 -11.032 1.599 3.254 1.00 0.00 N ATOM 658 CA GLU A 47 -12.114 2.145 2.443 1.00 0.00 C ATOM 659 C GLU A 47 -12.142 3.668 2.527 1.00 0.00 C ATOM 660 O GLU A 47 -11.665 4.257 3.498 1.00 0.00 O ATOM 661 CB GLU A 47 -13.460 1.574 2.897 1.00 0.00 C ATOM 662 CG GLU A 47 -14.495 1.502 1.787 1.00 0.00 C ATOM 663 CD GLU A 47 -15.552 0.445 2.043 1.00 0.00 C ATOM 664 OE1 GLU A 47 -15.248 -0.754 1.869 1.00 0.00 O ATOM 665 OE2 GLU A 47 -16.683 0.817 2.419 1.00 0.00 O ATOM 0 H GLU A 47 -11.268 0.740 3.750 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.936 1.858 1.406 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -13.303 0.574 3.302 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.851 2.188 3.708 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -14.977 2.474 1.681 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -13.995 1.289 0.842 1.00 0.00 H new ATOM 672 N LYS A 48 -12.703 4.301 1.503 1.00 0.00 N ATOM 673 CA LYS A 48 -12.795 5.756 1.459 1.00 0.00 C ATOM 674 C LYS A 48 -14.093 6.239 2.097 1.00 0.00 C ATOM 675 O LYS A 48 -14.835 7.020 1.503 1.00 0.00 O ATOM 676 CB LYS A 48 -12.711 6.249 0.012 1.00 0.00 C ATOM 677 CG LYS A 48 -12.374 7.725 -0.108 1.00 0.00 C ATOM 678 CD LYS A 48 -12.125 8.124 -1.553 1.00 0.00 C ATOM 679 CE LYS A 48 -12.367 9.610 -1.771 1.00 0.00 C ATOM 680 NZ LYS A 48 -12.350 9.969 -3.216 1.00 0.00 N ATOM 0 H LYS A 48 -13.101 3.829 0.691 1.00 0.00 H new ATOM 0 HA LYS A 48 -11.959 6.165 2.025 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.956 5.668 -0.518 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -13.664 6.061 -0.483 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -13.191 8.320 0.299 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.490 7.947 0.489 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -11.100 7.877 -1.828 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.778 7.548 -2.208 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -13.328 9.889 -1.339 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -11.603 10.183 -1.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -12.519 10.990 -3.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -11.424 9.727 -3.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -13.095 9.441 -3.714 1.00 0.00 H new ATOM 694 N GLY A 49 -14.361 5.769 3.312 1.00 0.00 N ATOM 695 CA GLY A 49 -15.569 6.165 4.011 1.00 0.00 C ATOM 696 C GLY A 49 -15.794 5.367 5.279 1.00 0.00 C ATOM 697 O GLY A 49 -16.883 4.840 5.505 1.00 0.00 O ATOM 0 H GLY A 49 -13.763 5.121 3.824 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -15.511 7.225 4.258 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -16.426 6.039 3.349 1.00 0.00 H new ATOM 701 N ALA A 50 -14.760 5.276 6.110 1.00 0.00 N ATOM 702 CA ALA A 50 -14.850 4.536 7.363 1.00 0.00 C ATOM 703 C ALA A 50 -14.094 5.251 8.478 1.00 0.00 C ATOM 704 O ALA A 50 -13.347 6.196 8.226 1.00 0.00 O ATOM 705 CB ALA A 50 -14.314 3.123 7.181 1.00 0.00 C ATOM 0 H ALA A 50 -13.851 5.705 5.938 1.00 0.00 H new ATOM 0 HA ALA A 50 -15.900 4.480 7.649 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -14.387 2.582 8.124 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -14.900 2.607 6.420 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -13.271 3.167 6.868 1.00 0.00 H new ATOM 711 N GLU A 51 -14.296 4.794 9.710 1.00 0.00 N ATOM 712 CA GLU A 51 -13.634 5.393 10.863 1.00 0.00 C ATOM 713 C GLU A 51 -13.195 4.320 11.856 1.00 0.00 C ATOM 714 O GLU A 51 -13.824 3.269 11.968 1.00 0.00 O ATOM 715 CB GLU A 51 -14.566 6.392 11.553 1.00 0.00 C ATOM 716 CG GLU A 51 -13.862 7.285 12.560 1.00 0.00 C ATOM 717 CD GLU A 51 -14.656 8.535 12.886 1.00 0.00 C ATOM 718 OE1 GLU A 51 -14.877 9.353 11.968 1.00 0.00 O ATOM 719 OE2 GLU A 51 -15.057 8.696 14.057 1.00 0.00 O ATOM 0 H GLU A 51 -14.912 4.012 9.935 1.00 0.00 H new ATOM 0 HA GLU A 51 -12.748 5.920 10.508 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -15.041 7.016 10.796 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -15.361 5.845 12.059 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -13.684 6.723 13.477 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -12.886 7.571 12.167 1.00 0.00 H new ATOM 726 N GLY A 52 -12.111 4.595 12.575 1.00 0.00 N ATOM 727 CA GLY A 52 -11.606 3.645 13.549 1.00 0.00 C ATOM 728 C GLY A 52 -10.262 3.066 13.151 1.00 0.00 C ATOM 729 O GLY A 52 -9.959 2.899 11.970 1.00 0.00 O ATOM 0 H GLY A 52 -11.574 5.459 12.500 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -11.514 4.136 14.518 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -12.326 2.835 13.669 1.00 0.00 H new ATOM 733 N PRO A 53 -9.429 2.752 14.154 1.00 0.00 N ATOM 734 CA PRO A 53 -8.096 2.185 13.928 1.00 0.00 C ATOM 735 C PRO A 53 -8.156 0.756 13.398 1.00 0.00 C ATOM 736 O PRO A 53 -7.308 0.341 12.609 1.00 0.00 O ATOM 737 CB PRO A 53 -7.458 2.213 15.319 1.00 0.00 C ATOM 738 CG PRO A 53 -8.608 2.178 16.264 1.00 0.00 C ATOM 739 CD PRO A 53 -9.724 2.924 15.586 1.00 0.00 C ATOM 0 HA PRO A 53 -7.538 2.743 13.177 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -6.797 1.359 15.468 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -6.856 3.111 15.461 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -8.902 1.151 16.483 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -8.347 2.645 17.214 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -10.699 2.513 15.848 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -9.735 3.976 15.870 1.00 0.00 H new ATOM 747 N SER A 54 -9.164 0.009 13.838 1.00 0.00 N ATOM 748 CA SER A 54 -9.332 -1.375 13.410 1.00 0.00 C ATOM 749 C SER A 54 -9.820 -1.442 11.966 1.00 0.00 C ATOM 750 O SER A 54 -9.382 -2.291 11.190 1.00 0.00 O ATOM 751 CB SER A 54 -10.319 -2.098 14.328 1.00 0.00 C ATOM 752 OG SER A 54 -9.662 -2.630 15.466 1.00 0.00 O ATOM 0 H SER A 54 -9.876 0.339 14.490 1.00 0.00 H new ATOM 0 HA SER A 54 -8.362 -1.869 13.470 1.00 0.00 H new ATOM 0 HB2 SER A 54 -11.099 -1.406 14.645 1.00 0.00 H new ATOM 0 HB3 SER A 54 -10.810 -2.902 13.779 1.00 0.00 H new ATOM 0 HG SER A 54 -10.315 -3.086 16.038 1.00 0.00 H new ATOM 758 N SER A 55 -10.731 -0.541 11.614 1.00 0.00 N ATOM 759 CA SER A 55 -11.283 -0.499 10.265 1.00 0.00 C ATOM 760 C SER A 55 -10.177 -0.624 9.221 1.00 0.00 C ATOM 761 O SER A 55 -10.311 -1.357 8.242 1.00 0.00 O ATOM 762 CB SER A 55 -12.059 0.802 10.049 1.00 0.00 C ATOM 763 OG SER A 55 -13.295 0.779 10.740 1.00 0.00 O ATOM 0 H SER A 55 -11.103 0.170 12.244 1.00 0.00 H new ATOM 0 HA SER A 55 -11.963 -1.343 10.151 1.00 0.00 H new ATOM 0 HB2 SER A 55 -11.462 1.647 10.393 1.00 0.00 H new ATOM 0 HB3 SER A 55 -12.237 0.950 8.984 1.00 0.00 H new ATOM 0 HG SER A 55 -13.453 1.652 11.157 1.00 0.00 H new ATOM 769 N VAL A 56 -9.082 0.099 9.439 1.00 0.00 N ATOM 770 CA VAL A 56 -7.951 0.069 8.519 1.00 0.00 C ATOM 771 C VAL A 56 -7.096 -1.173 8.740 1.00 0.00 C ATOM 772 O VAL A 56 -6.905 -1.615 9.873 1.00 0.00 O ATOM 773 CB VAL A 56 -7.068 1.321 8.675 1.00 0.00 C ATOM 774 CG1 VAL A 56 -6.569 1.448 10.106 1.00 0.00 C ATOM 775 CG2 VAL A 56 -5.904 1.277 7.697 1.00 0.00 C ATOM 0 H VAL A 56 -8.955 0.712 10.244 1.00 0.00 H new ATOM 0 HA VAL A 56 -8.364 0.048 7.510 1.00 0.00 H new ATOM 0 HB VAL A 56 -7.671 2.200 8.447 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -5.947 2.338 10.197 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -7.420 1.530 10.782 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -5.982 0.567 10.366 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -5.291 2.169 7.821 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -5.299 0.391 7.891 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -6.287 1.239 6.677 1.00 0.00 H new ATOM 785 N ARG A 57 -6.582 -1.733 7.649 1.00 0.00 N ATOM 786 CA ARG A 57 -5.747 -2.925 7.723 1.00 0.00 C ATOM 787 C ARG A 57 -4.275 -2.570 7.537 1.00 0.00 C ATOM 788 O ARG A 57 -3.942 -1.482 7.066 1.00 0.00 O ATOM 789 CB ARG A 57 -6.176 -3.941 6.663 1.00 0.00 C ATOM 790 CG ARG A 57 -7.368 -4.788 7.077 1.00 0.00 C ATOM 791 CD ARG A 57 -6.933 -6.015 7.864 1.00 0.00 C ATOM 792 NE ARG A 57 -8.054 -6.904 8.155 1.00 0.00 N ATOM 793 CZ ARG A 57 -7.930 -8.052 8.812 1.00 0.00 C ATOM 794 NH1 ARG A 57 -6.741 -8.447 9.244 1.00 0.00 N ATOM 795 NH2 ARG A 57 -8.998 -8.806 9.039 1.00 0.00 N ATOM 0 H ARG A 57 -6.730 -1.380 6.704 1.00 0.00 H new ATOM 0 HA ARG A 57 -5.874 -3.366 8.712 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -6.420 -3.411 5.742 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -5.335 -4.597 6.440 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -8.049 -4.189 7.682 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.920 -5.100 6.190 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -6.176 -6.559 7.299 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -6.468 -5.700 8.798 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.983 -6.629 7.836 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.918 -7.869 9.072 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -6.649 -9.329 9.748 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -9.915 -8.504 8.709 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -8.902 -9.687 9.543 1.00 0.00 H new ATOM 809 N PHE A 58 -3.397 -3.496 7.910 1.00 0.00 N ATOM 810 CA PHE A 58 -1.960 -3.280 7.786 1.00 0.00 C ATOM 811 C PHE A 58 -1.275 -4.507 7.192 1.00 0.00 C ATOM 812 O PHE A 58 -1.613 -5.644 7.526 1.00 0.00 O ATOM 813 CB PHE A 58 -1.351 -2.954 9.151 1.00 0.00 C ATOM 814 CG PHE A 58 -1.341 -1.485 9.467 1.00 0.00 C ATOM 815 CD1 PHE A 58 -2.524 -0.806 9.707 1.00 0.00 C ATOM 816 CD2 PHE A 58 -0.147 -0.784 9.525 1.00 0.00 C ATOM 817 CE1 PHE A 58 -2.517 0.545 9.997 1.00 0.00 C ATOM 818 CE2 PHE A 58 -0.133 0.567 9.815 1.00 0.00 C ATOM 819 CZ PHE A 58 -1.320 1.232 10.053 1.00 0.00 C ATOM 0 H PHE A 58 -3.655 -4.402 8.300 1.00 0.00 H new ATOM 0 HA PHE A 58 -1.802 -2.436 7.115 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -1.910 -3.480 9.925 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -0.329 -3.332 9.184 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -3.463 -1.339 9.667 1.00 0.00 H new ATOM 0 HD2 PHE A 58 0.784 -1.300 9.341 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -3.447 1.063 10.180 1.00 0.00 H new ATOM 0 HE2 PHE A 58 0.804 1.102 9.855 1.00 0.00 H new ATOM 0 HZ PHE A 58 -1.312 2.287 10.282 1.00 0.00 H new ATOM 829 N LEU A 59 -0.312 -4.270 6.308 1.00 0.00 N ATOM 830 CA LEU A 59 0.421 -5.356 5.665 1.00 0.00 C ATOM 831 C LEU A 59 1.927 -5.136 5.776 1.00 0.00 C ATOM 832 O LEU A 59 2.458 -4.141 5.284 1.00 0.00 O ATOM 833 CB LEU A 59 0.018 -5.469 4.194 1.00 0.00 C ATOM 834 CG LEU A 59 0.916 -6.342 3.317 1.00 0.00 C ATOM 835 CD1 LEU A 59 0.504 -7.803 3.419 1.00 0.00 C ATOM 836 CD2 LEU A 59 0.869 -5.872 1.871 1.00 0.00 C ATOM 0 H LEU A 59 -0.020 -3.336 6.020 1.00 0.00 H new ATOM 0 HA LEU A 59 0.169 -6.285 6.177 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -0.997 -5.863 4.145 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -0.009 -4.466 3.767 1.00 0.00 H new ATOM 0 HG LEU A 59 1.942 -6.249 3.675 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.154 -8.409 2.788 1.00 0.00 H new ATOM 0 HD12 LEU A 59 0.591 -8.134 4.454 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.529 -7.914 3.088 1.00 0.00 H new ATOM 0 HD21 LEU A 59 1.514 -6.505 1.262 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.154 -5.934 1.501 1.00 0.00 H new ATOM 0 HD23 LEU A 59 1.214 -4.840 1.813 1.00 0.00 H new ATOM 848 N LYS A 60 2.610 -6.074 6.424 1.00 0.00 N ATOM 849 CA LYS A 60 4.055 -5.987 6.597 1.00 0.00 C ATOM 850 C LYS A 60 4.779 -6.844 5.564 1.00 0.00 C ATOM 851 O LYS A 60 4.589 -8.059 5.506 1.00 0.00 O ATOM 852 CB LYS A 60 4.448 -6.429 8.008 1.00 0.00 C ATOM 853 CG LYS A 60 4.173 -5.381 9.073 1.00 0.00 C ATOM 854 CD LYS A 60 3.914 -6.017 10.428 1.00 0.00 C ATOM 855 CE LYS A 60 4.023 -4.998 11.552 1.00 0.00 C ATOM 856 NZ LYS A 60 2.852 -4.078 11.582 1.00 0.00 N ATOM 0 H LYS A 60 2.185 -6.904 6.838 1.00 0.00 H new ATOM 0 HA LYS A 60 4.351 -4.948 6.453 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.905 -7.340 8.258 1.00 0.00 H new ATOM 0 HB3 LYS A 60 5.509 -6.677 8.020 1.00 0.00 H new ATOM 0 HG2 LYS A 60 5.023 -4.703 9.145 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.311 -4.782 8.781 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.920 -6.465 10.437 1.00 0.00 H new ATOM 0 HD3 LYS A 60 4.629 -6.823 10.595 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.101 -5.518 12.507 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.938 -4.418 11.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.964 -3.399 12.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.792 -3.563 10.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 1.981 -4.629 11.725 1.00 0.00 H new ATOM 870 N THR A 61 5.613 -6.203 4.750 1.00 0.00 N ATOM 871 CA THR A 61 6.367 -6.907 3.720 1.00 0.00 C ATOM 872 C THR A 61 7.832 -6.487 3.727 1.00 0.00 C ATOM 873 O THR A 61 8.153 -5.322 3.962 1.00 0.00 O ATOM 874 CB THR A 61 5.778 -6.651 2.320 1.00 0.00 C ATOM 875 OG1 THR A 61 6.340 -7.569 1.376 1.00 0.00 O ATOM 876 CG2 THR A 61 6.052 -5.223 1.870 1.00 0.00 C ATOM 0 H THR A 61 5.783 -5.198 4.784 1.00 0.00 H new ATOM 0 HA THR A 61 6.296 -7.971 3.947 1.00 0.00 H new ATOM 0 HB THR A 61 4.699 -6.799 2.372 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.959 -7.400 0.489 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.627 -5.066 0.879 1.00 0.00 H new ATOM 0 HG22 THR A 61 5.598 -4.526 2.574 1.00 0.00 H new ATOM 0 HG23 THR A 61 7.128 -5.053 1.834 1.00 0.00 H new ATOM 884 N SER A 62 8.718 -7.443 3.468 1.00 0.00 N ATOM 885 CA SER A 62 10.151 -7.173 3.447 1.00 0.00 C ATOM 886 C SER A 62 10.635 -6.918 2.023 1.00 0.00 C ATOM 887 O SER A 62 11.835 -6.949 1.750 1.00 0.00 O ATOM 888 CB SER A 62 10.921 -8.346 4.058 1.00 0.00 C ATOM 889 OG SER A 62 10.927 -9.461 3.184 1.00 0.00 O ATOM 0 H SER A 62 8.469 -8.412 3.270 1.00 0.00 H new ATOM 0 HA SER A 62 10.336 -6.278 4.040 1.00 0.00 H new ATOM 0 HB2 SER A 62 11.946 -8.041 4.271 1.00 0.00 H new ATOM 0 HB3 SER A 62 10.468 -8.627 5.009 1.00 0.00 H new ATOM 0 HG SER A 62 11.426 -10.197 3.596 1.00 0.00 H new ATOM 895 N GLU A 63 9.693 -6.665 1.121 1.00 0.00 N ATOM 896 CA GLU A 63 10.023 -6.405 -0.276 1.00 0.00 C ATOM 897 C GLU A 63 9.340 -5.133 -0.769 1.00 0.00 C ATOM 898 O GLU A 63 8.623 -4.470 -0.020 1.00 0.00 O ATOM 899 CB GLU A 63 9.610 -7.591 -1.150 1.00 0.00 C ATOM 900 CG GLU A 63 9.967 -8.941 -0.552 1.00 0.00 C ATOM 901 CD GLU A 63 11.416 -9.320 -0.788 1.00 0.00 C ATOM 902 OE1 GLU A 63 12.203 -8.437 -1.189 1.00 0.00 O ATOM 903 OE2 GLU A 63 11.763 -10.500 -0.572 1.00 0.00 O ATOM 0 H GLU A 63 8.695 -6.634 1.332 1.00 0.00 H new ATOM 0 HA GLU A 63 11.102 -6.268 -0.348 1.00 0.00 H new ATOM 0 HB2 GLU A 63 8.534 -7.551 -1.318 1.00 0.00 H new ATOM 0 HB3 GLU A 63 10.088 -7.497 -2.125 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.770 -8.923 0.520 1.00 0.00 H new ATOM 0 HG3 GLU A 63 9.321 -9.707 -0.981 1.00 0.00 H new ATOM 910 N ASN A 64 9.568 -4.798 -2.034 1.00 0.00 N ATOM 911 CA ASN A 64 8.976 -3.605 -2.628 1.00 0.00 C ATOM 912 C ASN A 64 7.723 -3.958 -3.424 1.00 0.00 C ATOM 913 O ASN A 64 7.377 -3.279 -4.391 1.00 0.00 O ATOM 914 CB ASN A 64 9.989 -2.904 -3.536 1.00 0.00 C ATOM 915 CG ASN A 64 10.464 -3.795 -4.667 1.00 0.00 C ATOM 916 OD1 ASN A 64 10.560 -5.013 -4.515 1.00 0.00 O ATOM 917 ND2 ASN A 64 10.765 -3.189 -5.810 1.00 0.00 N ATOM 0 H ASN A 64 10.159 -5.336 -2.668 1.00 0.00 H new ATOM 0 HA ASN A 64 8.694 -2.930 -1.820 1.00 0.00 H new ATOM 0 HB2 ASN A 64 9.538 -2.003 -3.952 1.00 0.00 H new ATOM 0 HB3 ASN A 64 10.846 -2.587 -2.942 1.00 0.00 H new ATOM 0 HD21 ASN A 64 11.091 -3.736 -6.607 1.00 0.00 H new ATOM 0 HD22 ASN A 64 10.670 -2.177 -5.891 1.00 0.00 H new ATOM 924 N ARG A 65 7.047 -5.025 -3.010 1.00 0.00 N ATOM 925 CA ARG A 65 5.833 -5.469 -3.685 1.00 0.00 C ATOM 926 C ARG A 65 4.936 -6.251 -2.730 1.00 0.00 C ATOM 927 O ARG A 65 5.420 -6.971 -1.857 1.00 0.00 O ATOM 928 CB ARG A 65 6.184 -6.334 -4.896 1.00 0.00 C ATOM 929 CG ARG A 65 7.117 -7.490 -4.569 1.00 0.00 C ATOM 930 CD ARG A 65 7.955 -7.887 -5.774 1.00 0.00 C ATOM 931 NE ARG A 65 9.165 -7.078 -5.890 1.00 0.00 N ATOM 932 CZ ARG A 65 9.966 -7.101 -6.949 1.00 0.00 C ATOM 933 NH1 ARG A 65 9.686 -7.888 -7.979 1.00 0.00 N ATOM 934 NH2 ARG A 65 11.050 -6.336 -6.980 1.00 0.00 N ATOM 0 H ARG A 65 7.319 -5.598 -2.211 1.00 0.00 H new ATOM 0 HA ARG A 65 5.292 -4.586 -4.024 1.00 0.00 H new ATOM 0 HB2 ARG A 65 5.265 -6.731 -5.327 1.00 0.00 H new ATOM 0 HB3 ARG A 65 6.649 -5.707 -5.657 1.00 0.00 H new ATOM 0 HG2 ARG A 65 7.773 -7.208 -3.745 1.00 0.00 H new ATOM 0 HG3 ARG A 65 6.533 -8.347 -4.232 1.00 0.00 H new ATOM 0 HD2 ARG A 65 8.229 -8.939 -5.694 1.00 0.00 H new ATOM 0 HD3 ARG A 65 7.359 -7.780 -6.681 1.00 0.00 H new ATOM 0 HE ARG A 65 9.408 -6.461 -5.115 1.00 0.00 H new ATOM 0 HH11 ARG A 65 8.854 -8.477 -7.959 1.00 0.00 H new ATOM 0 HH12 ARG A 65 10.303 -7.904 -8.791 1.00 0.00 H new ATOM 0 HH21 ARG A 65 11.269 -5.729 -6.190 1.00 0.00 H new ATOM 0 HH22 ARG A 65 11.664 -6.355 -7.794 1.00 0.00 H new ATOM 948 N ALA A 66 3.626 -6.105 -2.902 1.00 0.00 N ATOM 949 CA ALA A 66 2.662 -6.798 -2.057 1.00 0.00 C ATOM 950 C ALA A 66 1.435 -7.220 -2.858 1.00 0.00 C ATOM 951 O ALA A 66 1.114 -6.618 -3.882 1.00 0.00 O ATOM 952 CB ALA A 66 2.254 -5.915 -0.888 1.00 0.00 C ATOM 0 H ALA A 66 3.208 -5.512 -3.620 1.00 0.00 H new ATOM 0 HA ALA A 66 3.137 -7.699 -1.668 1.00 0.00 H new ATOM 0 HB1 ALA A 66 1.534 -6.446 -0.265 1.00 0.00 H new ATOM 0 HB2 ALA A 66 3.134 -5.668 -0.294 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.801 -4.998 -1.265 1.00 0.00 H new ATOM 958 N GLU A 67 0.753 -8.259 -2.384 1.00 0.00 N ATOM 959 CA GLU A 67 -0.438 -8.761 -3.058 1.00 0.00 C ATOM 960 C GLU A 67 -1.640 -8.750 -2.118 1.00 0.00 C ATOM 961 O GLU A 67 -1.811 -9.655 -1.300 1.00 0.00 O ATOM 962 CB GLU A 67 -0.197 -10.179 -3.579 1.00 0.00 C ATOM 963 CG GLU A 67 -1.407 -10.789 -4.267 1.00 0.00 C ATOM 964 CD GLU A 67 -1.045 -11.977 -5.138 1.00 0.00 C ATOM 965 OE1 GLU A 67 -0.612 -13.008 -4.583 1.00 0.00 O ATOM 966 OE2 GLU A 67 -1.196 -11.875 -6.373 1.00 0.00 O ATOM 0 H GLU A 67 1.005 -8.768 -1.537 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.652 -8.104 -3.901 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.638 -10.163 -4.279 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.097 -10.818 -2.746 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -2.129 -11.102 -3.513 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.894 -10.030 -4.879 1.00 0.00 H new ATOM 973 N LEU A 68 -2.470 -7.720 -2.240 1.00 0.00 N ATOM 974 CA LEU A 68 -3.657 -7.590 -1.402 1.00 0.00 C ATOM 975 C LEU A 68 -4.757 -8.540 -1.864 1.00 0.00 C ATOM 976 O LEU A 68 -4.863 -8.854 -3.050 1.00 0.00 O ATOM 977 CB LEU A 68 -4.168 -6.149 -1.428 1.00 0.00 C ATOM 978 CG LEU A 68 -3.104 -5.057 -1.311 1.00 0.00 C ATOM 979 CD1 LEU A 68 -3.623 -3.743 -1.875 1.00 0.00 C ATOM 980 CD2 LEU A 68 -2.674 -4.884 0.138 1.00 0.00 C ATOM 0 H LEU A 68 -2.343 -6.963 -2.911 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.381 -7.853 -0.381 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -4.716 -5.996 -2.358 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.881 -6.023 -0.613 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.234 -5.361 -1.894 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -2.852 -2.978 -1.783 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.880 -3.875 -2.926 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.509 -3.434 -1.321 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.916 -4.103 0.202 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -3.537 -4.603 0.742 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.260 -5.822 0.509 1.00 0.00 H new ATOM 992 N ARG A 69 -5.575 -8.994 -0.919 1.00 0.00 N ATOM 993 CA ARG A 69 -6.668 -9.908 -1.230 1.00 0.00 C ATOM 994 C ARG A 69 -7.946 -9.491 -0.508 1.00 0.00 C ATOM 995 O ARG A 69 -7.914 -8.674 0.411 1.00 0.00 O ATOM 996 CB ARG A 69 -6.292 -11.338 -0.839 1.00 0.00 C ATOM 997 CG ARG A 69 -5.044 -11.853 -1.538 1.00 0.00 C ATOM 998 CD ARG A 69 -4.383 -12.971 -0.748 1.00 0.00 C ATOM 999 NE ARG A 69 -5.053 -14.254 -0.949 1.00 0.00 N ATOM 1000 CZ ARG A 69 -4.627 -15.396 -0.422 1.00 0.00 C ATOM 1001 NH1 ARG A 69 -3.539 -15.415 0.336 1.00 0.00 N ATOM 1002 NH2 ARG A 69 -5.290 -16.522 -0.651 1.00 0.00 N ATOM 0 H ARG A 69 -5.501 -8.744 0.067 1.00 0.00 H new ATOM 0 HA ARG A 69 -6.848 -9.868 -2.304 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -6.139 -11.382 0.239 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -7.127 -12.000 -1.070 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -5.306 -12.215 -2.532 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -4.337 -11.034 -1.672 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -3.338 -13.057 -1.046 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -4.392 -12.720 0.313 1.00 0.00 H new ATOM 0 HE ARG A 69 -5.894 -14.273 -1.526 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -3.027 -14.551 0.515 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -3.214 -16.294 0.740 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -6.128 -16.511 -1.232 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -4.962 -17.399 -0.246 1.00 0.00 H new ATOM 1016 N GLY A 70 -9.071 -10.059 -0.932 1.00 0.00 N ATOM 1017 CA GLY A 70 -10.344 -9.734 -0.316 1.00 0.00 C ATOM 1018 C GLY A 70 -10.583 -8.240 -0.233 1.00 0.00 C ATOM 1019 O GLY A 70 -10.374 -7.627 0.814 1.00 0.00 O ATOM 0 H GLY A 70 -9.123 -10.738 -1.691 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -11.149 -10.196 -0.887 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -10.378 -10.161 0.686 1.00 0.00 H new ATOM 1023 N LEU A 71 -11.021 -7.650 -1.341 1.00 0.00 N ATOM 1024 CA LEU A 71 -11.287 -6.217 -1.390 1.00 0.00 C ATOM 1025 C LEU A 71 -12.596 -5.931 -2.120 1.00 0.00 C ATOM 1026 O LEU A 71 -13.089 -6.763 -2.882 1.00 0.00 O ATOM 1027 CB LEU A 71 -10.135 -5.488 -2.082 1.00 0.00 C ATOM 1028 CG LEU A 71 -8.750 -5.680 -1.463 1.00 0.00 C ATOM 1029 CD1 LEU A 71 -7.664 -5.469 -2.506 1.00 0.00 C ATOM 1030 CD2 LEU A 71 -8.555 -4.733 -0.288 1.00 0.00 C ATOM 0 H LEU A 71 -11.199 -8.142 -2.216 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.376 -5.854 -0.366 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.095 -5.817 -3.121 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.361 -4.422 -2.093 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.677 -6.703 -1.095 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.686 -5.610 -2.046 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.792 -6.188 -3.315 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.735 -4.457 -2.905 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.564 -4.884 0.140 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.649 -3.703 -0.631 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -9.312 -4.933 0.470 1.00 0.00 H new ATOM 1042 N LYS A 72 -13.153 -4.749 -1.883 1.00 0.00 N ATOM 1043 CA LYS A 72 -14.403 -4.350 -2.520 1.00 0.00 C ATOM 1044 C LYS A 72 -14.141 -3.711 -3.880 1.00 0.00 C ATOM 1045 O LYS A 72 -13.921 -2.504 -3.977 1.00 0.00 O ATOM 1046 CB LYS A 72 -15.167 -3.372 -1.624 1.00 0.00 C ATOM 1047 CG LYS A 72 -16.073 -4.054 -0.614 1.00 0.00 C ATOM 1048 CD LYS A 72 -17.447 -4.338 -1.199 1.00 0.00 C ATOM 1049 CE LYS A 72 -17.409 -5.513 -2.164 1.00 0.00 C ATOM 1050 NZ LYS A 72 -18.737 -6.176 -2.282 1.00 0.00 N ATOM 0 H LYS A 72 -12.759 -4.050 -1.254 1.00 0.00 H new ATOM 0 HA LYS A 72 -15.007 -5.245 -2.669 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -14.452 -2.745 -1.092 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -15.767 -2.711 -2.250 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -15.616 -4.988 -0.286 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -16.176 -3.423 0.269 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -18.150 -4.550 -0.393 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -17.813 -3.452 -1.717 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -17.088 -5.166 -3.146 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -16.670 -6.238 -1.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -18.670 -6.972 -2.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -19.033 -6.529 -1.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -19.437 -5.491 -2.630 1.00 0.00 H new ATOM 1064 N ARG A 73 -14.169 -4.528 -4.928 1.00 0.00 N ATOM 1065 CA ARG A 73 -13.934 -4.042 -6.282 1.00 0.00 C ATOM 1066 C ARG A 73 -14.790 -2.813 -6.574 1.00 0.00 C ATOM 1067 O ARG A 73 -15.963 -2.759 -6.205 1.00 0.00 O ATOM 1068 CB ARG A 73 -14.237 -5.142 -7.301 1.00 0.00 C ATOM 1069 CG ARG A 73 -15.611 -5.769 -7.130 1.00 0.00 C ATOM 1070 CD ARG A 73 -15.834 -6.900 -8.121 1.00 0.00 C ATOM 1071 NE ARG A 73 -15.841 -6.426 -9.502 1.00 0.00 N ATOM 1072 CZ ARG A 73 -16.245 -7.163 -10.531 1.00 0.00 C ATOM 1073 NH1 ARG A 73 -16.673 -8.402 -10.334 1.00 0.00 N ATOM 1074 NH2 ARG A 73 -16.221 -6.661 -11.758 1.00 0.00 N ATOM 0 H ARG A 73 -14.352 -5.529 -4.865 1.00 0.00 H new ATOM 0 HA ARG A 73 -12.884 -3.760 -6.363 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -14.159 -4.726 -8.306 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -13.479 -5.921 -7.219 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -15.715 -6.149 -6.114 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -16.379 -5.008 -7.266 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -15.051 -7.648 -7.999 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -16.782 -7.392 -7.902 1.00 0.00 H new ATOM 0 HE ARG A 73 -15.518 -5.476 -9.687 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -16.693 -8.791 -9.391 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -16.983 -8.966 -11.125 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -15.892 -5.708 -11.913 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -16.531 -7.228 -12.547 1.00 0.00 H new ATOM 1088 N GLY A 74 -14.195 -1.827 -7.239 1.00 0.00 N ATOM 1089 CA GLY A 74 -14.917 -0.612 -7.569 1.00 0.00 C ATOM 1090 C GLY A 74 -14.808 0.440 -6.483 1.00 0.00 C ATOM 1091 O GLY A 74 -14.388 1.567 -6.742 1.00 0.00 O ATOM 0 H GLY A 74 -13.225 -1.848 -7.555 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -14.531 -0.206 -8.504 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -15.967 -0.851 -7.735 1.00 0.00 H new ATOM 1095 N ALA A 75 -15.187 0.072 -5.264 1.00 0.00 N ATOM 1096 CA ALA A 75 -15.129 0.992 -4.135 1.00 0.00 C ATOM 1097 C ALA A 75 -13.732 1.584 -3.981 1.00 0.00 C ATOM 1098 O ALA A 75 -12.759 0.859 -3.775 1.00 0.00 O ATOM 1099 CB ALA A 75 -15.548 0.285 -2.855 1.00 0.00 C ATOM 0 H ALA A 75 -15.538 -0.857 -5.033 1.00 0.00 H new ATOM 0 HA ALA A 75 -15.823 1.810 -4.329 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -15.500 0.984 -2.020 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -16.568 -0.084 -2.960 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -14.877 -0.553 -2.666 1.00 0.00 H new ATOM 1105 N SER A 76 -13.640 2.906 -4.083 1.00 0.00 N ATOM 1106 CA SER A 76 -12.361 3.596 -3.960 1.00 0.00 C ATOM 1107 C SER A 76 -11.611 3.131 -2.715 1.00 0.00 C ATOM 1108 O SER A 76 -12.209 2.921 -1.659 1.00 0.00 O ATOM 1109 CB SER A 76 -12.576 5.109 -3.903 1.00 0.00 C ATOM 1110 OG SER A 76 -11.437 5.804 -4.380 1.00 0.00 O ATOM 0 H SER A 76 -14.436 3.521 -4.251 1.00 0.00 H new ATOM 0 HA SER A 76 -11.761 3.355 -4.837 1.00 0.00 H new ATOM 0 HB2 SER A 76 -13.447 5.379 -4.500 1.00 0.00 H new ATOM 0 HB3 SER A 76 -12.787 5.411 -2.877 1.00 0.00 H new ATOM 0 HG SER A 76 -11.600 6.769 -4.335 1.00 0.00 H new ATOM 1116 N TYR A 77 -10.299 2.971 -2.847 1.00 0.00 N ATOM 1117 CA TYR A 77 -9.467 2.529 -1.735 1.00 0.00 C ATOM 1118 C TYR A 77 -8.170 3.330 -1.672 1.00 0.00 C ATOM 1119 O TYR A 77 -7.369 3.312 -2.608 1.00 0.00 O ATOM 1120 CB TYR A 77 -9.153 1.038 -1.867 1.00 0.00 C ATOM 1121 CG TYR A 77 -10.166 0.143 -1.190 1.00 0.00 C ATOM 1122 CD1 TYR A 77 -10.235 0.063 0.196 1.00 0.00 C ATOM 1123 CD2 TYR A 77 -11.054 -0.623 -1.935 1.00 0.00 C ATOM 1124 CE1 TYR A 77 -11.158 -0.754 0.819 1.00 0.00 C ATOM 1125 CE2 TYR A 77 -11.982 -1.442 -1.320 1.00 0.00 C ATOM 1126 CZ TYR A 77 -12.030 -1.504 0.057 1.00 0.00 C ATOM 1127 OH TYR A 77 -12.952 -2.319 0.673 1.00 0.00 O ATOM 0 H TYR A 77 -9.789 3.141 -3.714 1.00 0.00 H new ATOM 0 HA TYR A 77 -10.021 2.697 -0.811 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -9.101 0.779 -2.924 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.168 0.844 -1.442 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -9.555 0.650 0.796 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -11.018 -0.578 -3.013 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -11.197 -0.806 1.897 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -12.666 -2.030 -1.914 1.00 0.00 H new ATOM 0 HH TYR A 77 -13.658 -1.770 1.073 1.00 0.00 H new ATOM 1137 N LEU A 78 -7.969 4.032 -0.563 1.00 0.00 N ATOM 1138 CA LEU A 78 -6.769 4.840 -0.375 1.00 0.00 C ATOM 1139 C LEU A 78 -5.641 4.008 0.228 1.00 0.00 C ATOM 1140 O LEU A 78 -5.625 3.743 1.430 1.00 0.00 O ATOM 1141 CB LEU A 78 -7.073 6.038 0.526 1.00 0.00 C ATOM 1142 CG LEU A 78 -7.874 7.172 -0.114 1.00 0.00 C ATOM 1143 CD1 LEU A 78 -8.410 8.115 0.953 1.00 0.00 C ATOM 1144 CD2 LEU A 78 -7.018 7.931 -1.117 1.00 0.00 C ATOM 0 H LEU A 78 -8.622 4.058 0.220 1.00 0.00 H new ATOM 0 HA LEU A 78 -6.447 5.201 -1.352 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -7.620 5.681 1.399 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -6.128 6.445 0.886 1.00 0.00 H new ATOM 0 HG LEU A 78 -8.721 6.737 -0.645 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -8.977 8.916 0.479 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -9.059 7.564 1.633 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.578 8.542 1.512 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -7.605 8.734 -1.562 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -6.151 8.354 -0.609 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -6.684 7.250 -1.899 1.00 0.00 H new ATOM 1156 N VAL A 79 -4.697 3.601 -0.615 1.00 0.00 N ATOM 1157 CA VAL A 79 -3.563 2.803 -0.165 1.00 0.00 C ATOM 1158 C VAL A 79 -2.320 3.667 0.015 1.00 0.00 C ATOM 1159 O VAL A 79 -2.060 4.570 -0.779 1.00 0.00 O ATOM 1160 CB VAL A 79 -3.247 1.668 -1.157 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -2.090 0.821 -0.649 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -4.481 0.811 -1.397 1.00 0.00 C ATOM 0 H VAL A 79 -4.695 3.811 -1.613 1.00 0.00 H new ATOM 0 HA VAL A 79 -3.842 2.369 0.795 1.00 0.00 H new ATOM 0 HB VAL A 79 -2.951 2.112 -2.107 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.881 0.024 -1.363 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -1.205 1.446 -0.534 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.354 0.385 0.314 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.239 0.014 -2.100 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -4.810 0.375 -0.454 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.279 1.429 -1.809 1.00 0.00 H new ATOM 1172 N GLN A 80 -1.556 3.382 1.065 1.00 0.00 N ATOM 1173 CA GLN A 80 -0.339 4.134 1.350 1.00 0.00 C ATOM 1174 C GLN A 80 0.823 3.195 1.652 1.00 0.00 C ATOM 1175 O GLN A 80 0.763 2.398 2.589 1.00 0.00 O ATOM 1176 CB GLN A 80 -0.565 5.082 2.529 1.00 0.00 C ATOM 1177 CG GLN A 80 -1.469 6.259 2.200 1.00 0.00 C ATOM 1178 CD GLN A 80 -2.885 5.831 1.866 1.00 0.00 C ATOM 1179 OE1 GLN A 80 -3.562 5.198 2.677 1.00 0.00 O ATOM 1180 NE2 GLN A 80 -3.340 6.175 0.667 1.00 0.00 N ATOM 0 H GLN A 80 -1.758 2.637 1.732 1.00 0.00 H new ATOM 0 HA GLN A 80 -0.088 4.719 0.465 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -0.999 4.521 3.357 1.00 0.00 H new ATOM 0 HB3 GLN A 80 0.399 5.459 2.871 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -1.491 6.944 3.048 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -1.051 6.809 1.357 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -2.744 6.700 0.027 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -4.285 5.915 0.386 1.00 0.00 H new ATOM 1189 N VAL A 81 1.880 3.293 0.853 1.00 0.00 N ATOM 1190 CA VAL A 81 3.058 2.452 1.035 1.00 0.00 C ATOM 1191 C VAL A 81 4.202 3.238 1.664 1.00 0.00 C ATOM 1192 O VAL A 81 4.631 4.262 1.133 1.00 0.00 O ATOM 1193 CB VAL A 81 3.533 1.854 -0.302 1.00 0.00 C ATOM 1194 CG1 VAL A 81 4.754 0.972 -0.089 1.00 0.00 C ATOM 1195 CG2 VAL A 81 2.410 1.072 -0.966 1.00 0.00 C ATOM 0 H VAL A 81 1.945 3.947 0.073 1.00 0.00 H new ATOM 0 HA VAL A 81 2.768 1.641 1.703 1.00 0.00 H new ATOM 0 HB VAL A 81 3.816 2.672 -0.965 1.00 0.00 H new ATOM 0 HG11 VAL A 81 5.075 0.558 -1.045 1.00 0.00 H new ATOM 0 HG12 VAL A 81 5.562 1.566 0.339 1.00 0.00 H new ATOM 0 HG13 VAL A 81 4.501 0.159 0.592 1.00 0.00 H new ATOM 0 HG21 VAL A 81 2.764 0.657 -1.910 1.00 0.00 H new ATOM 0 HG22 VAL A 81 2.093 0.262 -0.309 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.567 1.736 -1.156 1.00 0.00 H new ATOM 1205 N ARG A 82 4.694 2.751 2.799 1.00 0.00 N ATOM 1206 CA ARG A 82 5.789 3.409 3.501 1.00 0.00 C ATOM 1207 C ARG A 82 7.001 2.487 3.603 1.00 0.00 C ATOM 1208 O ARG A 82 6.866 1.264 3.583 1.00 0.00 O ATOM 1209 CB ARG A 82 5.342 3.838 4.900 1.00 0.00 C ATOM 1210 CG ARG A 82 5.371 2.712 5.920 1.00 0.00 C ATOM 1211 CD ARG A 82 5.160 3.234 7.333 1.00 0.00 C ATOM 1212 NE ARG A 82 4.776 2.172 8.258 1.00 0.00 N ATOM 1213 CZ ARG A 82 4.618 2.356 9.564 1.00 0.00 C ATOM 1214 NH1 ARG A 82 4.809 3.556 10.095 1.00 0.00 N ATOM 1215 NH2 ARG A 82 4.266 1.340 10.341 1.00 0.00 N ATOM 0 H ARG A 82 4.352 1.903 3.251 1.00 0.00 H new ATOM 0 HA ARG A 82 6.073 4.293 2.931 1.00 0.00 H new ATOM 0 HB2 ARG A 82 5.986 4.647 5.246 1.00 0.00 H new ATOM 0 HB3 ARG A 82 4.330 4.239 4.842 1.00 0.00 H new ATOM 0 HG2 ARG A 82 4.597 1.983 5.681 1.00 0.00 H new ATOM 0 HG3 ARG A 82 6.327 2.192 5.862 1.00 0.00 H new ATOM 0 HD2 ARG A 82 6.077 3.707 7.685 1.00 0.00 H new ATOM 0 HD3 ARG A 82 4.388 4.003 7.324 1.00 0.00 H new ATOM 0 HE ARG A 82 4.620 1.237 7.881 1.00 0.00 H new ATOM 0 HH11 ARG A 82 5.078 4.340 9.500 1.00 0.00 H new ATOM 0 HH12 ARG A 82 4.687 3.695 11.098 1.00 0.00 H new ATOM 0 HH21 ARG A 82 4.116 0.416 9.936 1.00 0.00 H new ATOM 0 HH22 ARG A 82 4.145 1.483 11.344 1.00 0.00 H new ATOM 1229 N ALA A 83 8.184 3.083 3.713 1.00 0.00 N ATOM 1230 CA ALA A 83 9.419 2.316 3.819 1.00 0.00 C ATOM 1231 C ALA A 83 10.016 2.428 5.218 1.00 0.00 C ATOM 1232 O ALA A 83 9.880 3.457 5.880 1.00 0.00 O ATOM 1233 CB ALA A 83 10.422 2.784 2.776 1.00 0.00 C ATOM 0 H ALA A 83 8.313 4.095 3.731 1.00 0.00 H new ATOM 0 HA ALA A 83 9.184 1.268 3.636 1.00 0.00 H new ATOM 0 HB1 ALA A 83 11.339 2.203 2.867 1.00 0.00 H new ATOM 0 HB2 ALA A 83 10.002 2.646 1.780 1.00 0.00 H new ATOM 0 HB3 ALA A 83 10.644 3.839 2.933 1.00 0.00 H new ATOM 1239 N ARG A 84 10.675 1.363 5.662 1.00 0.00 N ATOM 1240 CA ARG A 84 11.291 1.342 6.983 1.00 0.00 C ATOM 1241 C ARG A 84 12.802 1.160 6.876 1.00 0.00 C ATOM 1242 O ARG A 84 13.282 0.263 6.183 1.00 0.00 O ATOM 1243 CB ARG A 84 10.690 0.219 7.831 1.00 0.00 C ATOM 1244 CG ARG A 84 11.426 -0.016 9.140 1.00 0.00 C ATOM 1245 CD ARG A 84 10.890 0.876 10.249 1.00 0.00 C ATOM 1246 NE ARG A 84 11.031 0.258 11.565 1.00 0.00 N ATOM 1247 CZ ARG A 84 12.163 0.257 12.259 1.00 0.00 C ATOM 1248 NH1 ARG A 84 13.247 0.839 11.765 1.00 0.00 N ATOM 1249 NH2 ARG A 84 12.213 -0.326 13.450 1.00 0.00 N ATOM 0 H ARG A 84 10.796 0.503 5.126 1.00 0.00 H new ATOM 0 HA ARG A 84 11.091 2.299 7.465 1.00 0.00 H new ATOM 0 HB2 ARG A 84 9.648 0.456 8.047 1.00 0.00 H new ATOM 0 HB3 ARG A 84 10.693 -0.704 7.251 1.00 0.00 H new ATOM 0 HG2 ARG A 84 11.326 -1.061 9.432 1.00 0.00 H new ATOM 0 HG3 ARG A 84 12.490 0.175 9.000 1.00 0.00 H new ATOM 0 HD2 ARG A 84 11.421 1.828 10.237 1.00 0.00 H new ATOM 0 HD3 ARG A 84 9.839 1.095 10.062 1.00 0.00 H new ATOM 0 HE ARG A 84 10.215 -0.198 11.973 1.00 0.00 H new ATOM 0 HH11 ARG A 84 13.212 1.289 10.850 1.00 0.00 H new ATOM 0 HH12 ARG A 84 14.116 0.837 12.300 1.00 0.00 H new ATOM 0 HH21 ARG A 84 11.381 -0.774 13.834 1.00 0.00 H new ATOM 0 HH22 ARG A 84 13.083 -0.326 13.982 1.00 0.00 H new ATOM 1263 N SER A 85 13.547 2.018 7.566 1.00 0.00 N ATOM 1264 CA SER A 85 15.003 1.955 7.545 1.00 0.00 C ATOM 1265 C SER A 85 15.562 1.825 8.959 1.00 0.00 C ATOM 1266 O SER A 85 14.815 1.843 9.936 1.00 0.00 O ATOM 1267 CB SER A 85 15.579 3.201 6.870 1.00 0.00 C ATOM 1268 OG SER A 85 16.850 2.933 6.303 1.00 0.00 O ATOM 0 H SER A 85 13.166 2.765 8.146 1.00 0.00 H new ATOM 0 HA SER A 85 15.295 1.073 6.975 1.00 0.00 H new ATOM 0 HB2 SER A 85 14.896 3.546 6.093 1.00 0.00 H new ATOM 0 HB3 SER A 85 15.665 4.006 7.599 1.00 0.00 H new ATOM 0 HG SER A 85 17.196 3.745 5.876 1.00 0.00 H new ATOM 1274 N GLU A 86 16.881 1.693 9.057 1.00 0.00 N ATOM 1275 CA GLU A 86 17.540 1.560 10.351 1.00 0.00 C ATOM 1276 C GLU A 86 17.188 2.730 11.265 1.00 0.00 C ATOM 1277 O GLU A 86 17.099 2.575 12.483 1.00 0.00 O ATOM 1278 CB GLU A 86 19.058 1.479 10.170 1.00 0.00 C ATOM 1279 CG GLU A 86 19.575 0.061 9.993 1.00 0.00 C ATOM 1280 CD GLU A 86 21.074 -0.043 10.196 1.00 0.00 C ATOM 1281 OE1 GLU A 86 21.594 0.619 11.119 1.00 0.00 O ATOM 1282 OE2 GLU A 86 21.726 -0.785 9.433 1.00 0.00 O ATOM 0 H GLU A 86 17.514 1.675 8.257 1.00 0.00 H new ATOM 0 HA GLU A 86 17.187 0.640 10.816 1.00 0.00 H new ATOM 0 HB2 GLU A 86 19.344 2.072 9.301 1.00 0.00 H new ATOM 0 HB3 GLU A 86 19.543 1.928 11.037 1.00 0.00 H new ATOM 0 HG2 GLU A 86 19.070 -0.597 10.700 1.00 0.00 H new ATOM 0 HG3 GLU A 86 19.322 -0.292 8.993 1.00 0.00 H new ATOM 1289 N ALA A 87 16.989 3.900 10.668 1.00 0.00 N ATOM 1290 CA ALA A 87 16.646 5.096 11.427 1.00 0.00 C ATOM 1291 C ALA A 87 15.275 4.957 12.080 1.00 0.00 C ATOM 1292 O ALA A 87 15.144 5.059 13.299 1.00 0.00 O ATOM 1293 CB ALA A 87 16.681 6.321 10.525 1.00 0.00 C ATOM 0 H ALA A 87 17.059 4.045 9.661 1.00 0.00 H new ATOM 0 HA ALA A 87 17.386 5.219 12.218 1.00 0.00 H new ATOM 0 HB1 ALA A 87 16.423 7.207 11.105 1.00 0.00 H new ATOM 0 HB2 ALA A 87 17.682 6.438 10.109 1.00 0.00 H new ATOM 0 HB3 ALA A 87 15.963 6.196 9.714 1.00 0.00 H new ATOM 1299 N GLY A 88 14.254 4.724 11.260 1.00 0.00 N ATOM 1300 CA GLY A 88 12.906 4.576 11.776 1.00 0.00 C ATOM 1301 C GLY A 88 11.862 4.569 10.678 1.00 0.00 C ATOM 1302 O GLY A 88 12.192 4.674 9.497 1.00 0.00 O ATOM 0 H GLY A 88 14.337 4.635 10.247 1.00 0.00 H new ATOM 0 HA2 GLY A 88 12.838 3.648 12.344 1.00 0.00 H new ATOM 0 HA3 GLY A 88 12.694 5.390 12.469 1.00 0.00 H new ATOM 1306 N TYR A 89 10.598 4.443 11.067 1.00 0.00 N ATOM 1307 CA TYR A 89 9.502 4.418 10.106 1.00 0.00 C ATOM 1308 C TYR A 89 9.392 5.750 9.370 1.00 0.00 C ATOM 1309 O TYR A 89 9.270 6.806 9.989 1.00 0.00 O ATOM 1310 CB TYR A 89 8.182 4.103 10.813 1.00 0.00 C ATOM 1311 CG TYR A 89 7.872 2.625 10.886 1.00 0.00 C ATOM 1312 CD1 TYR A 89 7.444 1.929 9.762 1.00 0.00 C ATOM 1313 CD2 TYR A 89 8.008 1.925 12.078 1.00 0.00 C ATOM 1314 CE1 TYR A 89 7.158 0.579 9.825 1.00 0.00 C ATOM 1315 CE2 TYR A 89 7.726 0.574 12.150 1.00 0.00 C ATOM 1316 CZ TYR A 89 7.301 -0.094 11.020 1.00 0.00 C ATOM 1317 OH TYR A 89 7.019 -1.439 11.086 1.00 0.00 O ATOM 0 H TYR A 89 10.307 4.357 12.041 1.00 0.00 H new ATOM 0 HA TYR A 89 9.711 3.636 9.376 1.00 0.00 H new ATOM 0 HB2 TYR A 89 8.215 4.509 11.824 1.00 0.00 H new ATOM 0 HB3 TYR A 89 7.370 4.611 10.292 1.00 0.00 H new ATOM 0 HD1 TYR A 89 7.333 2.452 8.824 1.00 0.00 H new ATOM 0 HD2 TYR A 89 8.340 2.446 12.964 1.00 0.00 H new ATOM 0 HE1 TYR A 89 6.824 0.053 8.943 1.00 0.00 H new ATOM 0 HE2 TYR A 89 7.838 0.045 13.085 1.00 0.00 H new ATOM 0 HH TYR A 89 7.172 -1.761 11.999 1.00 0.00 H new ATOM 1327 N GLY A 90 9.436 5.691 8.042 1.00 0.00 N ATOM 1328 CA GLY A 90 9.339 6.898 7.242 1.00 0.00 C ATOM 1329 C GLY A 90 7.904 7.309 6.983 1.00 0.00 C ATOM 1330 O GLY A 90 6.964 6.554 7.236 1.00 0.00 O ATOM 0 H GLY A 90 9.537 4.829 7.506 1.00 0.00 H new ATOM 0 HA2 GLY A 90 9.860 7.710 7.750 1.00 0.00 H new ATOM 0 HA3 GLY A 90 9.846 6.741 6.290 1.00 0.00 H new ATOM 1334 N PRO A 91 7.718 8.533 6.468 1.00 0.00 N ATOM 1335 CA PRO A 91 6.389 9.071 6.165 1.00 0.00 C ATOM 1336 C PRO A 91 5.735 8.367 4.981 1.00 0.00 C ATOM 1337 O PRO A 91 6.388 8.081 3.977 1.00 0.00 O ATOM 1338 CB PRO A 91 6.669 10.538 5.826 1.00 0.00 C ATOM 1339 CG PRO A 91 8.082 10.555 5.357 1.00 0.00 C ATOM 1340 CD PRO A 91 8.792 9.486 6.141 1.00 0.00 C ATOM 0 HA PRO A 91 5.696 8.936 6.995 1.00 0.00 H new ATOM 0 HB2 PRO A 91 5.991 10.902 5.054 1.00 0.00 H new ATOM 0 HB3 PRO A 91 6.533 11.179 6.697 1.00 0.00 H new ATOM 0 HG2 PRO A 91 8.140 10.357 4.287 1.00 0.00 H new ATOM 0 HG3 PRO A 91 8.538 11.531 5.526 1.00 0.00 H new ATOM 0 HD2 PRO A 91 9.582 9.016 5.555 1.00 0.00 H new ATOM 0 HD3 PRO A 91 9.259 9.890 7.040 1.00 0.00 H new ATOM 1348 N PHE A 92 4.441 8.090 5.104 1.00 0.00 N ATOM 1349 CA PHE A 92 3.698 7.419 4.044 1.00 0.00 C ATOM 1350 C PHE A 92 3.810 8.188 2.731 1.00 0.00 C ATOM 1351 O PHE A 92 3.515 9.380 2.669 1.00 0.00 O ATOM 1352 CB PHE A 92 2.227 7.271 4.438 1.00 0.00 C ATOM 1353 CG PHE A 92 1.954 6.070 5.296 1.00 0.00 C ATOM 1354 CD1 PHE A 92 1.889 4.803 4.738 1.00 0.00 C ATOM 1355 CD2 PHE A 92 1.761 6.207 6.662 1.00 0.00 C ATOM 1356 CE1 PHE A 92 1.638 3.695 5.526 1.00 0.00 C ATOM 1357 CE2 PHE A 92 1.510 5.103 7.454 1.00 0.00 C ATOM 1358 CZ PHE A 92 1.448 3.845 6.885 1.00 0.00 C ATOM 0 H PHE A 92 3.885 8.320 5.928 1.00 0.00 H new ATOM 0 HA PHE A 92 4.130 6.428 3.902 1.00 0.00 H new ATOM 0 HB2 PHE A 92 1.910 8.168 4.971 1.00 0.00 H new ATOM 0 HB3 PHE A 92 1.622 7.207 3.534 1.00 0.00 H new ATOM 0 HD1 PHE A 92 2.036 4.680 3.675 1.00 0.00 H new ATOM 0 HD2 PHE A 92 1.807 7.188 7.112 1.00 0.00 H new ATOM 0 HE1 PHE A 92 1.591 2.713 5.079 1.00 0.00 H new ATOM 0 HE2 PHE A 92 1.362 5.223 8.517 1.00 0.00 H new ATOM 0 HZ PHE A 92 1.251 2.981 7.502 1.00 0.00 H new ATOM 1368 N GLY A 93 4.240 7.494 1.681 1.00 0.00 N ATOM 1369 CA GLY A 93 4.384 8.127 0.382 1.00 0.00 C ATOM 1370 C GLY A 93 3.125 8.849 -0.054 1.00 0.00 C ATOM 1371 O GLY A 93 2.100 8.787 0.625 1.00 0.00 O ATOM 0 H GLY A 93 4.491 6.506 1.707 1.00 0.00 H new ATOM 0 HA2 GLY A 93 5.212 8.835 0.416 1.00 0.00 H new ATOM 0 HA3 GLY A 93 4.641 7.371 -0.360 1.00 0.00 H new ATOM 1375 N GLN A 94 3.203 9.537 -1.189 1.00 0.00 N ATOM 1376 CA GLN A 94 2.060 10.276 -1.713 1.00 0.00 C ATOM 1377 C GLN A 94 0.867 9.351 -1.932 1.00 0.00 C ATOM 1378 O GLN A 94 0.996 8.292 -2.545 1.00 0.00 O ATOM 1379 CB GLN A 94 2.432 10.967 -3.025 1.00 0.00 C ATOM 1380 CG GLN A 94 3.019 12.357 -2.836 1.00 0.00 C ATOM 1381 CD GLN A 94 2.043 13.320 -2.191 1.00 0.00 C ATOM 1382 OE1 GLN A 94 0.828 13.167 -2.316 1.00 0.00 O ATOM 1383 NE2 GLN A 94 2.571 14.321 -1.495 1.00 0.00 N ATOM 0 H GLN A 94 4.044 9.598 -1.762 1.00 0.00 H new ATOM 0 HA GLN A 94 1.780 11.031 -0.979 1.00 0.00 H new ATOM 0 HB2 GLN A 94 3.151 10.348 -3.561 1.00 0.00 H new ATOM 0 HB3 GLN A 94 1.544 11.039 -3.653 1.00 0.00 H new ATOM 0 HG2 GLN A 94 3.916 12.288 -2.220 1.00 0.00 H new ATOM 0 HG3 GLN A 94 3.327 12.752 -3.804 1.00 0.00 H new ATOM 0 HE21 GLN A 94 3.584 14.410 -1.418 1.00 0.00 H new ATOM 0 HE22 GLN A 94 1.963 15.001 -1.038 1.00 0.00 H new ATOM 1392 N GLU A 95 -0.292 9.759 -1.425 1.00 0.00 N ATOM 1393 CA GLU A 95 -1.507 8.965 -1.565 1.00 0.00 C ATOM 1394 C GLU A 95 -1.529 8.235 -2.904 1.00 0.00 C ATOM 1395 O GLU A 95 -1.070 8.761 -3.919 1.00 0.00 O ATOM 1396 CB GLU A 95 -2.744 9.858 -1.438 1.00 0.00 C ATOM 1397 CG GLU A 95 -2.714 11.072 -2.351 1.00 0.00 C ATOM 1398 CD GLU A 95 -3.853 12.035 -2.079 1.00 0.00 C ATOM 1399 OE1 GLU A 95 -5.001 11.714 -2.451 1.00 0.00 O ATOM 1400 OE2 GLU A 95 -3.597 13.108 -1.495 1.00 0.00 O ATOM 0 H GLU A 95 -0.415 10.633 -0.914 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.519 8.223 -0.766 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -3.633 9.268 -1.662 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -2.835 10.193 -0.405 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -1.765 11.593 -2.225 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -2.762 10.743 -3.389 1.00 0.00 H new ATOM 1407 N HIS A 96 -2.065 7.018 -2.900 1.00 0.00 N ATOM 1408 CA HIS A 96 -2.147 6.214 -4.114 1.00 0.00 C ATOM 1409 C HIS A 96 -3.569 5.709 -4.337 1.00 0.00 C ATOM 1410 O HIS A 96 -4.182 5.132 -3.438 1.00 0.00 O ATOM 1411 CB HIS A 96 -1.180 5.032 -4.035 1.00 0.00 C ATOM 1412 CG HIS A 96 -1.393 4.012 -5.110 1.00 0.00 C ATOM 1413 ND1 HIS A 96 -0.431 3.691 -6.045 1.00 0.00 N ATOM 1414 CD2 HIS A 96 -2.465 3.236 -5.395 1.00 0.00 C ATOM 1415 CE1 HIS A 96 -0.903 2.764 -6.859 1.00 0.00 C ATOM 1416 NE2 HIS A 96 -2.135 2.471 -6.486 1.00 0.00 N ATOM 0 H HIS A 96 -2.449 6.567 -2.069 1.00 0.00 H new ATOM 0 HA HIS A 96 -1.869 6.846 -4.957 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -0.158 5.405 -4.097 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -1.286 4.551 -3.063 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -3.405 3.221 -4.863 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -0.372 2.321 -7.688 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -2.743 1.787 -6.936 1.00 0.00 H new ATOM 1425 N HIS A 97 -4.090 5.931 -5.540 1.00 0.00 N ATOM 1426 CA HIS A 97 -5.440 5.498 -5.880 1.00 0.00 C ATOM 1427 C HIS A 97 -5.412 4.443 -6.981 1.00 0.00 C ATOM 1428 O HIS A 97 -4.730 4.606 -7.993 1.00 0.00 O ATOM 1429 CB HIS A 97 -6.284 6.693 -6.325 1.00 0.00 C ATOM 1430 CG HIS A 97 -6.098 7.909 -5.470 1.00 0.00 C ATOM 1431 ND1 HIS A 97 -5.074 8.813 -5.660 1.00 0.00 N ATOM 1432 CD2 HIS A 97 -6.814 8.370 -4.418 1.00 0.00 C ATOM 1433 CE1 HIS A 97 -5.167 9.775 -4.760 1.00 0.00 C ATOM 1434 NE2 HIS A 97 -6.215 9.530 -3.994 1.00 0.00 N ATOM 0 H HIS A 97 -3.597 6.408 -6.295 1.00 0.00 H new ATOM 0 HA HIS A 97 -5.888 5.056 -4.990 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -6.032 6.942 -7.356 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -7.336 6.409 -6.314 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -7.693 7.910 -3.991 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -4.500 10.619 -4.666 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -6.528 10.109 -3.214 1.00 0.00 H new ATOM 1443 N SER A 98 -6.155 3.360 -6.776 1.00 0.00 N ATOM 1444 CA SER A 98 -6.211 2.276 -7.749 1.00 0.00 C ATOM 1445 C SER A 98 -7.334 2.506 -8.755 1.00 0.00 C ATOM 1446 O SER A 98 -8.156 3.407 -8.588 1.00 0.00 O ATOM 1447 CB SER A 98 -6.413 0.935 -7.040 1.00 0.00 C ATOM 1448 OG SER A 98 -6.226 -0.148 -7.934 1.00 0.00 O ATOM 0 H SER A 98 -6.727 3.210 -5.945 1.00 0.00 H new ATOM 0 HA SER A 98 -5.263 2.255 -8.287 1.00 0.00 H new ATOM 0 HB2 SER A 98 -5.712 0.850 -6.209 1.00 0.00 H new ATOM 0 HB3 SER A 98 -7.416 0.892 -6.616 1.00 0.00 H new ATOM 0 HG SER A 98 -5.493 -0.714 -7.614 1.00 0.00 H new ATOM 1454 N GLN A 99 -7.361 1.685 -9.800 1.00 0.00 N ATOM 1455 CA GLN A 99 -8.383 1.800 -10.835 1.00 0.00 C ATOM 1456 C GLN A 99 -9.542 0.847 -10.562 1.00 0.00 C ATOM 1457 O GLN A 99 -10.709 1.208 -10.725 1.00 0.00 O ATOM 1458 CB GLN A 99 -7.781 1.510 -12.210 1.00 0.00 C ATOM 1459 CG GLN A 99 -6.990 2.673 -12.786 1.00 0.00 C ATOM 1460 CD GLN A 99 -5.894 2.223 -13.732 1.00 0.00 C ATOM 1461 OE1 GLN A 99 -6.133 1.433 -14.646 1.00 0.00 O ATOM 1462 NE2 GLN A 99 -4.684 2.724 -13.518 1.00 0.00 N ATOM 0 H GLN A 99 -6.688 0.934 -9.953 1.00 0.00 H new ATOM 0 HA GLN A 99 -8.765 2.821 -10.822 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -7.129 0.640 -12.136 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -8.583 1.249 -12.901 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -7.669 3.342 -13.315 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -6.548 3.246 -11.971 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -4.531 3.376 -12.749 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -3.907 2.457 -14.123 1.00 0.00 H new ATOM 1471 N THR A 100 -9.215 -0.373 -10.147 1.00 0.00 N ATOM 1472 CA THR A 100 -10.228 -1.378 -9.854 1.00 0.00 C ATOM 1473 C THR A 100 -11.383 -1.300 -10.846 1.00 0.00 C ATOM 1474 O THR A 100 -12.529 -1.584 -10.500 1.00 0.00 O ATOM 1475 CB THR A 100 -10.781 -1.219 -8.425 1.00 0.00 C ATOM 1476 OG1 THR A 100 -11.426 0.052 -8.289 1.00 0.00 O ATOM 1477 CG2 THR A 100 -9.667 -1.340 -7.397 1.00 0.00 C ATOM 0 H THR A 100 -8.255 -0.689 -10.006 1.00 0.00 H new ATOM 0 HA THR A 100 -9.743 -2.350 -9.941 1.00 0.00 H new ATOM 0 HB THR A 100 -11.505 -2.015 -8.248 1.00 0.00 H new ATOM 0 HG1 THR A 100 -11.776 0.145 -7.379 1.00 0.00 H new ATOM 0 HG21 THR A 100 -10.082 -1.224 -6.396 1.00 0.00 H new ATOM 0 HG22 THR A 100 -9.196 -2.319 -7.484 1.00 0.00 H new ATOM 0 HG23 THR A 100 -8.923 -0.563 -7.574 1.00 0.00 H new ATOM 1485 N GLN A 101 -11.073 -0.915 -12.079 1.00 0.00 N ATOM 1486 CA GLN A 101 -12.087 -0.800 -13.121 1.00 0.00 C ATOM 1487 C GLN A 101 -12.982 -2.034 -13.147 1.00 0.00 C ATOM 1488 O GLN A 101 -12.707 -3.028 -12.475 1.00 0.00 O ATOM 1489 CB GLN A 101 -11.426 -0.605 -14.486 1.00 0.00 C ATOM 1490 CG GLN A 101 -11.175 0.853 -14.838 1.00 0.00 C ATOM 1491 CD GLN A 101 -12.412 1.714 -14.676 1.00 0.00 C ATOM 1492 OE1 GLN A 101 -13.531 1.265 -14.927 1.00 0.00 O ATOM 1493 NE2 GLN A 101 -12.217 2.958 -14.256 1.00 0.00 N ATOM 0 H GLN A 101 -10.128 -0.677 -12.381 1.00 0.00 H new ATOM 0 HA GLN A 101 -12.705 0.070 -12.898 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -10.478 -1.142 -14.501 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -12.058 -1.052 -15.254 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -10.379 1.244 -14.204 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -10.823 0.919 -15.868 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -11.272 3.288 -14.060 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -13.012 3.584 -14.129 1.00 0.00 H new ATOM 1502 N LEU A 102 -14.055 -1.964 -13.928 1.00 0.00 N ATOM 1503 CA LEU A 102 -14.992 -3.076 -14.042 1.00 0.00 C ATOM 1504 C LEU A 102 -15.296 -3.383 -15.505 1.00 0.00 C ATOM 1505 O LEU A 102 -16.121 -4.245 -15.810 1.00 0.00 O ATOM 1506 CB LEU A 102 -16.288 -2.756 -13.296 1.00 0.00 C ATOM 1507 CG LEU A 102 -16.724 -1.290 -13.307 1.00 0.00 C ATOM 1508 CD1 LEU A 102 -17.086 -0.852 -14.718 1.00 0.00 C ATOM 1509 CD2 LEU A 102 -17.898 -1.076 -12.363 1.00 0.00 C ATOM 0 H LEU A 102 -14.297 -1.149 -14.491 1.00 0.00 H new ATOM 0 HA LEU A 102 -14.530 -3.956 -13.593 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -17.089 -3.356 -13.727 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -16.175 -3.073 -12.259 1.00 0.00 H new ATOM 0 HG LEU A 102 -15.890 -0.680 -12.961 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -17.394 0.194 -14.707 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -16.219 -0.968 -15.369 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -17.905 -1.467 -15.091 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -18.195 -0.027 -12.384 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -18.736 -1.697 -12.679 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -17.605 -1.350 -11.350 1.00 0.00 H new ATOM 1521 N ASP A 103 -14.624 -2.675 -16.405 1.00 0.00 N ATOM 1522 CA ASP A 103 -14.820 -2.873 -17.837 1.00 0.00 C ATOM 1523 C ASP A 103 -14.070 -4.110 -18.321 1.00 0.00 C ATOM 1524 O ASP A 103 -13.195 -4.629 -17.628 1.00 0.00 O ATOM 1525 CB ASP A 103 -14.352 -1.642 -18.613 1.00 0.00 C ATOM 1526 CG ASP A 103 -12.860 -1.408 -18.483 1.00 0.00 C ATOM 1527 OD1 ASP A 103 -12.266 -1.898 -17.501 1.00 0.00 O ATOM 1528 OD2 ASP A 103 -12.286 -0.733 -19.364 1.00 0.00 O ATOM 0 H ASP A 103 -13.938 -1.958 -16.169 1.00 0.00 H new ATOM 0 HA ASP A 103 -15.885 -3.022 -18.016 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -14.608 -1.761 -19.666 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -14.887 -0.764 -18.252 1.00 0.00 H new ATOM 1533 N SER A 104 -14.421 -4.579 -19.515 1.00 0.00 N ATOM 1534 CA SER A 104 -13.784 -5.758 -20.090 1.00 0.00 C ATOM 1535 C SER A 104 -12.997 -5.393 -21.345 1.00 0.00 C ATOM 1536 O SER A 104 -11.800 -5.658 -21.440 1.00 0.00 O ATOM 1537 CB SER A 104 -14.835 -6.819 -20.423 1.00 0.00 C ATOM 1538 OG SER A 104 -14.270 -8.119 -20.407 1.00 0.00 O ATOM 0 H SER A 104 -15.142 -4.161 -20.102 1.00 0.00 H new ATOM 0 HA SER A 104 -13.090 -6.162 -19.353 1.00 0.00 H new ATOM 0 HB2 SER A 104 -15.652 -6.765 -19.703 1.00 0.00 H new ATOM 0 HB3 SER A 104 -15.262 -6.617 -21.405 1.00 0.00 H new ATOM 0 HG SER A 104 -14.962 -8.779 -20.621 1.00 0.00 H new ATOM 1544 N GLY A 105 -13.681 -4.782 -22.308 1.00 0.00 N ATOM 1545 CA GLY A 105 -13.032 -4.390 -23.545 1.00 0.00 C ATOM 1546 C GLY A 105 -12.932 -2.885 -23.696 1.00 0.00 C ATOM 1547 O GLY A 105 -13.756 -2.250 -24.354 1.00 0.00 O ATOM 0 H GLY A 105 -14.673 -4.552 -22.253 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -12.032 -4.823 -23.580 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -13.587 -4.801 -24.389 1.00 0.00 H new ATOM 1551 N PRO A 106 -11.902 -2.292 -23.074 1.00 0.00 N ATOM 1552 CA PRO A 106 -11.673 -0.845 -23.127 1.00 0.00 C ATOM 1553 C PRO A 106 -11.235 -0.377 -24.511 1.00 0.00 C ATOM 1554 O PRO A 106 -10.371 -0.989 -25.138 1.00 0.00 O ATOM 1555 CB PRO A 106 -10.552 -0.625 -22.108 1.00 0.00 C ATOM 1556 CG PRO A 106 -9.836 -1.930 -22.047 1.00 0.00 C ATOM 1557 CD PRO A 106 -10.881 -2.987 -22.273 1.00 0.00 C ATOM 0 HA PRO A 106 -12.580 -0.281 -22.911 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -9.885 0.179 -22.420 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -10.952 -0.347 -21.133 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -9.056 -1.983 -22.807 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -9.349 -2.063 -21.081 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -10.473 -3.848 -22.802 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -11.290 -3.355 -21.332 1.00 0.00 H new ATOM 1565 N SER A 107 -11.836 0.712 -24.980 1.00 0.00 N ATOM 1566 CA SER A 107 -11.510 1.260 -26.291 1.00 0.00 C ATOM 1567 C SER A 107 -10.343 2.239 -26.196 1.00 0.00 C ATOM 1568 O SER A 107 -10.395 3.211 -25.443 1.00 0.00 O ATOM 1569 CB SER A 107 -12.730 1.959 -26.893 1.00 0.00 C ATOM 1570 OG SER A 107 -12.442 2.465 -28.186 1.00 0.00 O ATOM 0 H SER A 107 -12.551 1.232 -24.471 1.00 0.00 H new ATOM 0 HA SER A 107 -11.217 0.435 -26.940 1.00 0.00 H new ATOM 0 HB2 SER A 107 -13.563 1.258 -26.951 1.00 0.00 H new ATOM 0 HB3 SER A 107 -13.044 2.775 -26.242 1.00 0.00 H new ATOM 0 HG SER A 107 -13.238 2.906 -28.550 1.00 0.00 H new ATOM 1576 N SER A 108 -9.293 1.974 -26.966 1.00 0.00 N ATOM 1577 CA SER A 108 -8.111 2.829 -26.967 1.00 0.00 C ATOM 1578 C SER A 108 -8.268 3.972 -27.965 1.00 0.00 C ATOM 1579 O SER A 108 -8.188 5.144 -27.601 1.00 0.00 O ATOM 1580 CB SER A 108 -6.863 2.010 -27.303 1.00 0.00 C ATOM 1581 OG SER A 108 -5.749 2.852 -27.541 1.00 0.00 O ATOM 0 H SER A 108 -9.236 1.175 -27.597 1.00 0.00 H new ATOM 0 HA SER A 108 -8.000 3.254 -25.970 1.00 0.00 H new ATOM 0 HB2 SER A 108 -6.639 1.329 -26.482 1.00 0.00 H new ATOM 0 HB3 SER A 108 -7.053 1.396 -28.183 1.00 0.00 H new ATOM 0 HG SER A 108 -4.964 2.304 -27.752 1.00 0.00 H new ATOM 1587 N GLY A 109 -8.491 3.620 -29.228 1.00 0.00 N ATOM 1588 CA GLY A 109 -8.655 4.626 -30.260 1.00 0.00 C ATOM 1589 C GLY A 109 -7.353 4.952 -30.965 1.00 0.00 C ATOM 1590 O GLY A 109 -6.854 6.073 -30.874 1.00 0.00 O ATOM 0 H GLY A 109 -8.561 2.656 -29.554 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -9.383 4.276 -30.992 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -9.061 5.535 -29.816 1.00 0.00 H new TER 1594 GLY A 109