USER MOD reduce.3.24.130724 H: found=0, std=0, add=511, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 509 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+ 164:sc= 0 (180deg=-0.245) 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 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -135:sc= -1.24 (180deg=-4.19!) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -1.21 X(o=-1.2,f=-1.2) USER MOD Single : A 45 SER OG : rot 180:sc= -0.0395 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 30:sc= -0.296 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -133:sc= -0.313 (180deg=-1.42!) USER MOD Single : A 54 LYS NZ :NH3+ -114:sc= -0.327 (180deg=-1.66!) USER MOD Single : A 58 MET CE :methyl -124:sc= -0.33 (180deg=-1.15) USER MOD Single : A 59 GLN : amide:sc= -0.398 X(o=-0.4,f=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -22.941 -5.422 11.298 1.00 0.00 N ATOM 2 CA GLY A 1 -22.595 -4.304 12.154 1.00 0.00 C ATOM 3 C GLY A 1 -23.141 -2.987 11.638 1.00 0.00 C ATOM 4 O GLY A 1 -24.326 -2.693 11.799 1.00 0.00 O ATOM 0 H1 GLY A 1 -22.337 -6.236 11.529 1.00 0.00 H new ATOM 0 H2 GLY A 1 -23.938 -5.678 11.447 1.00 0.00 H new ATOM 0 H3 GLY A 1 -22.797 -5.155 10.303 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -22.981 -4.486 13.157 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -21.510 -4.236 12.237 1.00 0.00 H new ATOM 8 N SER A 2 -22.275 -2.192 11.017 1.00 0.00 N ATOM 9 CA SER A 2 -22.676 -0.896 10.480 1.00 0.00 C ATOM 10 C SER A 2 -22.774 -0.945 8.959 1.00 0.00 C ATOM 11 O SER A 2 -21.867 -0.501 8.254 1.00 0.00 O ATOM 12 CB SER A 2 -21.682 0.186 10.906 1.00 0.00 C ATOM 13 OG SER A 2 -22.297 1.137 11.758 1.00 0.00 O ATOM 0 H SER A 2 -21.292 -2.422 10.873 1.00 0.00 H new ATOM 0 HA SER A 2 -23.660 -0.652 10.881 1.00 0.00 H new ATOM 0 HB2 SER A 2 -20.837 -0.274 11.419 1.00 0.00 H new ATOM 0 HB3 SER A 2 -21.285 0.687 10.023 1.00 0.00 H new ATOM 0 HG SER A 2 -21.640 1.817 12.017 1.00 0.00 H new ATOM 19 N SER A 3 -23.879 -1.488 8.459 1.00 0.00 N ATOM 20 CA SER A 3 -24.095 -1.599 7.022 1.00 0.00 C ATOM 21 C SER A 3 -23.120 -2.596 6.402 1.00 0.00 C ATOM 22 O SER A 3 -22.001 -2.241 6.034 1.00 0.00 O ATOM 23 CB SER A 3 -23.936 -0.232 6.354 1.00 0.00 C ATOM 24 OG SER A 3 -24.870 -0.067 5.301 1.00 0.00 O ATOM 0 H SER A 3 -24.639 -1.858 9.029 1.00 0.00 H new ATOM 0 HA SER A 3 -25.111 -1.960 6.859 1.00 0.00 H new ATOM 0 HB2 SER A 3 -24.075 0.556 7.094 1.00 0.00 H new ATOM 0 HB3 SER A 3 -22.923 -0.129 5.965 1.00 0.00 H new ATOM 0 HG SER A 3 -24.749 0.815 4.892 1.00 0.00 H new ATOM 30 N GLY A 4 -23.556 -3.848 6.291 1.00 0.00 N ATOM 31 CA GLY A 4 -22.711 -4.879 5.716 1.00 0.00 C ATOM 32 C GLY A 4 -21.321 -4.895 6.324 1.00 0.00 C ATOM 33 O GLY A 4 -20.430 -4.178 5.872 1.00 0.00 O ATOM 0 H GLY A 4 -24.478 -4.166 6.589 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -23.180 -5.852 5.862 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.632 -4.722 4.640 1.00 0.00 H new ATOM 37 N SER A 5 -21.139 -5.716 7.354 1.00 0.00 N ATOM 38 CA SER A 5 -19.850 -5.820 8.029 1.00 0.00 C ATOM 39 C SER A 5 -19.374 -7.269 8.070 1.00 0.00 C ATOM 40 O SER A 5 -19.810 -8.053 8.913 1.00 0.00 O ATOM 41 CB SER A 5 -19.948 -5.262 9.449 1.00 0.00 C ATOM 42 OG SER A 5 -18.803 -4.494 9.776 1.00 0.00 O ATOM 0 H SER A 5 -21.867 -6.318 7.739 1.00 0.00 H new ATOM 0 HA SER A 5 -19.124 -5.234 7.466 1.00 0.00 H new ATOM 0 HB2 SER A 5 -20.842 -4.645 9.539 1.00 0.00 H new ATOM 0 HB3 SER A 5 -20.054 -6.082 10.159 1.00 0.00 H new ATOM 0 HG SER A 5 -18.891 -4.147 10.688 1.00 0.00 H new ATOM 48 N SER A 6 -18.476 -7.616 7.154 1.00 0.00 N ATOM 49 CA SER A 6 -17.942 -8.972 7.082 1.00 0.00 C ATOM 50 C SER A 6 -16.431 -8.950 6.878 1.00 0.00 C ATOM 51 O SER A 6 -15.943 -9.052 5.754 1.00 0.00 O ATOM 52 CB SER A 6 -18.611 -9.746 5.944 1.00 0.00 C ATOM 53 OG SER A 6 -19.313 -10.873 6.440 1.00 0.00 O ATOM 0 H SER A 6 -18.103 -6.978 6.451 1.00 0.00 H new ATOM 0 HA SER A 6 -18.156 -9.472 8.027 1.00 0.00 H new ATOM 0 HB2 SER A 6 -19.299 -9.091 5.409 1.00 0.00 H new ATOM 0 HB3 SER A 6 -17.857 -10.070 5.227 1.00 0.00 H new ATOM 0 HG SER A 6 -19.733 -11.351 5.695 1.00 0.00 H new ATOM 59 N GLY A 7 -15.693 -8.818 7.977 1.00 0.00 N ATOM 60 CA GLY A 7 -14.244 -8.786 7.898 1.00 0.00 C ATOM 61 C GLY A 7 -13.709 -7.389 7.649 1.00 0.00 C ATOM 62 O GLY A 7 -13.785 -6.523 8.520 1.00 0.00 O ATOM 0 H GLY A 7 -16.073 -8.733 8.920 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -13.824 -9.173 8.826 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -13.912 -9.447 7.098 1.00 0.00 H new ATOM 66 N VAL A 8 -13.163 -7.170 6.457 1.00 0.00 N ATOM 67 CA VAL A 8 -12.612 -5.870 6.095 1.00 0.00 C ATOM 68 C VAL A 8 -11.860 -5.247 7.267 1.00 0.00 C ATOM 69 O VAL A 8 -11.877 -4.031 7.452 1.00 0.00 O ATOM 70 CB VAL A 8 -13.716 -4.901 5.633 1.00 0.00 C ATOM 71 CG1 VAL A 8 -14.121 -5.199 4.198 1.00 0.00 C ATOM 72 CG2 VAL A 8 -14.917 -4.981 6.563 1.00 0.00 C ATOM 0 H VAL A 8 -13.091 -7.877 5.725 1.00 0.00 H new ATOM 0 HA VAL A 8 -11.919 -6.038 5.270 1.00 0.00 H new ATOM 0 HB VAL A 8 -13.324 -3.885 5.670 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -14.902 -4.504 3.889 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -13.256 -5.086 3.545 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -14.496 -6.220 4.130 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -15.688 -4.290 6.222 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -15.313 -5.997 6.559 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -14.612 -4.714 7.575 1.00 0.00 H new ATOM 82 N GLY A 9 -11.202 -6.089 8.057 1.00 0.00 N ATOM 83 CA GLY A 9 -10.454 -5.603 9.201 1.00 0.00 C ATOM 84 C GLY A 9 -9.050 -5.165 8.832 1.00 0.00 C ATOM 85 O GLY A 9 -8.529 -4.194 9.381 1.00 0.00 O ATOM 0 H GLY A 9 -11.174 -7.100 7.925 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.987 -4.765 9.650 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -10.400 -6.387 9.956 1.00 0.00 H new ATOM 89 N THR A 10 -8.434 -5.884 7.899 1.00 0.00 N ATOM 90 CA THR A 10 -7.081 -5.567 7.459 1.00 0.00 C ATOM 91 C THR A 10 -7.037 -4.222 6.742 1.00 0.00 C ATOM 92 O THR A 10 -6.170 -3.391 7.014 1.00 0.00 O ATOM 93 CB THR A 10 -6.525 -6.654 6.521 1.00 0.00 C ATOM 94 OG1 THR A 10 -6.558 -7.929 7.173 1.00 0.00 O ATOM 95 CG2 THR A 10 -5.099 -6.331 6.101 1.00 0.00 C ATOM 0 H THR A 10 -8.851 -6.690 7.433 1.00 0.00 H new ATOM 0 HA THR A 10 -6.461 -5.519 8.354 1.00 0.00 H new ATOM 0 HB THR A 10 -7.151 -6.686 5.629 1.00 0.00 H new ATOM 0 HG1 THR A 10 -6.204 -8.615 6.569 1.00 0.00 H new ATOM 0 HG21 THR A 10 -4.729 -7.114 5.439 1.00 0.00 H new ATOM 0 HG22 THR A 10 -5.081 -5.375 5.578 1.00 0.00 H new ATOM 0 HG23 THR A 10 -4.464 -6.273 6.985 1.00 0.00 H new ATOM 103 N ILE A 11 -7.976 -4.015 5.826 1.00 0.00 N ATOM 104 CA ILE A 11 -8.045 -2.770 5.072 1.00 0.00 C ATOM 105 C ILE A 11 -8.196 -1.571 6.002 1.00 0.00 C ATOM 106 O ILE A 11 -7.363 -0.664 6.002 1.00 0.00 O ATOM 107 CB ILE A 11 -9.218 -2.780 4.073 1.00 0.00 C ATOM 108 CG1 ILE A 11 -9.155 -4.031 3.193 1.00 0.00 C ATOM 109 CG2 ILE A 11 -9.197 -1.523 3.217 1.00 0.00 C ATOM 110 CD1 ILE A 11 -10.421 -4.859 3.229 1.00 0.00 C ATOM 0 H ILE A 11 -8.700 -4.693 5.588 1.00 0.00 H new ATOM 0 HA ILE A 11 -7.109 -2.684 4.520 1.00 0.00 H new ATOM 0 HB ILE A 11 -10.153 -2.798 4.633 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -8.955 -3.732 2.164 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -8.317 -4.649 3.514 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.032 -1.546 2.517 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -9.284 -0.645 3.857 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -8.260 -1.476 2.663 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -10.305 -5.729 2.583 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.611 -5.188 4.250 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -11.260 -4.257 2.880 1.00 0.00 H new ATOM 122 N ASP A 12 -9.262 -1.574 6.793 1.00 0.00 N ATOM 123 CA ASP A 12 -9.521 -0.488 7.732 1.00 0.00 C ATOM 124 C ASP A 12 -8.216 0.067 8.294 1.00 0.00 C ATOM 125 O ASP A 12 -8.112 1.258 8.584 1.00 0.00 O ATOM 126 CB ASP A 12 -10.417 -0.973 8.872 1.00 0.00 C ATOM 127 CG ASP A 12 -10.915 0.165 9.742 1.00 0.00 C ATOM 128 OD1 ASP A 12 -10.187 1.171 9.875 1.00 0.00 O ATOM 129 OD2 ASP A 12 -12.030 0.048 10.293 1.00 0.00 O ATOM 0 H ASP A 12 -9.962 -2.316 6.803 1.00 0.00 H new ATOM 0 HA ASP A 12 -10.032 0.310 7.194 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -11.270 -1.509 8.457 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -9.864 -1.682 9.488 1.00 0.00 H new ATOM 134 N GLN A 13 -7.225 -0.805 8.447 1.00 0.00 N ATOM 135 CA GLN A 13 -5.929 -0.402 8.977 1.00 0.00 C ATOM 136 C GLN A 13 -5.027 0.126 7.867 1.00 0.00 C ATOM 137 O GLN A 13 -4.369 1.156 8.024 1.00 0.00 O ATOM 138 CB GLN A 13 -5.252 -1.581 9.680 1.00 0.00 C ATOM 139 CG GLN A 13 -5.968 -2.026 10.946 1.00 0.00 C ATOM 140 CD GLN A 13 -5.181 -3.060 11.729 1.00 0.00 C ATOM 141 OE1 GLN A 13 -5.547 -4.234 11.768 1.00 0.00 O ATOM 142 NE2 GLN A 13 -4.094 -2.626 12.357 1.00 0.00 N ATOM 0 H GLN A 13 -7.295 -1.795 8.211 1.00 0.00 H new ATOM 0 HA GLN A 13 -6.094 0.398 9.699 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -5.196 -2.422 8.989 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -4.227 -1.305 9.930 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -6.151 -1.158 11.579 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -6.942 -2.439 10.682 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -3.828 -1.643 12.297 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -3.525 -3.276 12.899 1.00 0.00 H new ATOM 151 N LEU A 14 -5.002 -0.583 6.744 1.00 0.00 N ATOM 152 CA LEU A 14 -4.181 -0.185 5.606 1.00 0.00 C ATOM 153 C LEU A 14 -4.492 1.247 5.183 1.00 0.00 C ATOM 154 O LEU A 14 -3.632 2.126 5.248 1.00 0.00 O ATOM 155 CB LEU A 14 -4.409 -1.135 4.429 1.00 0.00 C ATOM 156 CG LEU A 14 -3.715 -0.762 3.119 1.00 0.00 C ATOM 157 CD1 LEU A 14 -2.205 -0.743 3.301 1.00 0.00 C ATOM 158 CD2 LEU A 14 -4.110 -1.728 2.012 1.00 0.00 C ATOM 0 H LEU A 14 -5.541 -1.436 6.597 1.00 0.00 H new ATOM 0 HA LEU A 14 -3.136 -0.236 5.910 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -4.076 -2.131 4.722 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -5.481 -1.200 4.243 1.00 0.00 H new ATOM 0 HG LEU A 14 -4.037 0.239 2.831 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.728 -0.476 2.358 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.940 -0.010 4.063 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -1.864 -1.730 3.613 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.606 -1.447 1.087 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -3.818 -2.740 2.291 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -5.189 -1.690 1.864 1.00 0.00 H new ATOM 170 N VAL A 15 -5.729 1.477 4.754 1.00 0.00 N ATOM 171 CA VAL A 15 -6.156 2.804 4.325 1.00 0.00 C ATOM 172 C VAL A 15 -5.568 3.886 5.223 1.00 0.00 C ATOM 173 O VAL A 15 -4.928 4.824 4.746 1.00 0.00 O ATOM 174 CB VAL A 15 -7.692 2.927 4.327 1.00 0.00 C ATOM 175 CG1 VAL A 15 -8.110 4.390 4.299 1.00 0.00 C ATOM 176 CG2 VAL A 15 -8.288 2.171 3.150 1.00 0.00 C ATOM 0 H VAL A 15 -6.453 0.761 4.694 1.00 0.00 H new ATOM 0 HA VAL A 15 -5.790 2.942 3.308 1.00 0.00 H new ATOM 0 HB VAL A 15 -8.074 2.482 5.246 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -9.198 4.458 4.301 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -7.713 4.899 5.178 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.719 4.863 3.398 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -9.373 2.269 3.167 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -7.901 2.584 2.219 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.017 1.117 3.220 1.00 0.00 H new ATOM 186 N LYS A 16 -5.790 3.752 6.526 1.00 0.00 N ATOM 187 CA LYS A 16 -5.282 4.718 7.493 1.00 0.00 C ATOM 188 C LYS A 16 -3.823 5.056 7.209 1.00 0.00 C ATOM 189 O LYS A 16 -3.406 6.207 7.337 1.00 0.00 O ATOM 190 CB LYS A 16 -5.421 4.168 8.915 1.00 0.00 C ATOM 191 CG LYS A 16 -4.104 3.729 9.529 1.00 0.00 C ATOM 192 CD LYS A 16 -4.315 3.039 10.866 1.00 0.00 C ATOM 193 CE LYS A 16 -3.149 2.125 11.211 1.00 0.00 C ATOM 194 NZ LYS A 16 -2.594 2.419 12.561 1.00 0.00 N ATOM 0 H LYS A 16 -6.319 2.983 6.937 1.00 0.00 H new ATOM 0 HA LYS A 16 -5.872 5.630 7.403 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -5.871 4.932 9.549 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -6.107 3.321 8.902 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.591 3.052 8.846 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -3.457 4.596 9.664 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -4.435 3.788 11.648 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -5.237 2.459 10.836 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -3.478 1.087 11.172 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -2.364 2.239 10.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -1.802 1.775 12.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -2.257 3.402 12.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.336 2.285 13.278 1.00 0.00 H new ATOM 208 N ARG A 17 -3.050 4.046 6.819 1.00 0.00 N ATOM 209 CA ARG A 17 -1.638 4.237 6.516 1.00 0.00 C ATOM 210 C ARG A 17 -1.458 5.180 5.330 1.00 0.00 C ATOM 211 O ARG A 17 -1.003 6.313 5.487 1.00 0.00 O ATOM 212 CB ARG A 17 -0.972 2.892 6.217 1.00 0.00 C ATOM 213 CG ARG A 17 -1.148 1.866 7.324 1.00 0.00 C ATOM 214 CD ARG A 17 -0.085 0.780 7.252 1.00 0.00 C ATOM 215 NE ARG A 17 0.126 0.134 8.544 1.00 0.00 N ATOM 216 CZ ARG A 17 0.713 -1.049 8.686 1.00 0.00 C ATOM 217 NH1 ARG A 17 1.145 -1.711 7.622 1.00 0.00 N ATOM 218 NH2 ARG A 17 0.868 -1.573 9.896 1.00 0.00 N ATOM 0 H ARG A 17 -3.379 3.087 6.706 1.00 0.00 H new ATOM 0 HA ARG A 17 -1.163 4.685 7.389 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -1.384 2.490 5.292 1.00 0.00 H new ATOM 0 HB3 ARG A 17 0.093 3.053 6.048 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -1.097 2.362 8.293 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -2.137 1.414 7.249 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -0.381 0.032 6.517 1.00 0.00 H new ATOM 0 HD3 ARG A 17 0.853 1.214 6.906 1.00 0.00 H new ATOM 0 HE ARG A 17 -0.195 0.617 9.383 1.00 0.00 H new ATOM 0 HH11 ARG A 17 1.027 -1.312 6.691 1.00 0.00 H new ATOM 0 HH12 ARG A 17 1.595 -2.619 7.735 1.00 0.00 H new ATOM 0 HH21 ARG A 17 0.536 -1.067 10.717 1.00 0.00 H new ATOM 0 HH22 ARG A 17 1.319 -2.482 10.004 1.00 0.00 H new ATOM 232 N VAL A 18 -1.820 4.704 4.143 1.00 0.00 N ATOM 233 CA VAL A 18 -1.700 5.505 2.930 1.00 0.00 C ATOM 234 C VAL A 18 -2.153 6.940 3.172 1.00 0.00 C ATOM 235 O VAL A 18 -1.752 7.857 2.454 1.00 0.00 O ATOM 236 CB VAL A 18 -2.529 4.905 1.777 1.00 0.00 C ATOM 237 CG1 VAL A 18 -2.001 3.528 1.401 1.00 0.00 C ATOM 238 CG2 VAL A 18 -3.999 4.835 2.159 1.00 0.00 C ATOM 0 H VAL A 18 -2.199 3.768 3.995 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.646 5.501 2.651 1.00 0.00 H new ATOM 0 HB VAL A 18 -2.434 5.555 0.907 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -2.598 3.120 0.586 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.962 3.611 1.083 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -2.065 2.866 2.264 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -4.570 4.409 1.334 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -4.116 4.208 3.043 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -4.367 5.838 2.375 1.00 0.00 H new ATOM 248 N ILE A 19 -2.989 7.127 4.187 1.00 0.00 N ATOM 249 CA ILE A 19 -3.495 8.453 4.525 1.00 0.00 C ATOM 250 C ILE A 19 -2.439 9.273 5.258 1.00 0.00 C ATOM 251 O ILE A 19 -2.009 10.321 4.778 1.00 0.00 O ATOM 252 CB ILE A 19 -4.761 8.366 5.397 1.00 0.00 C ATOM 253 CG1 ILE A 19 -5.871 7.623 4.653 1.00 0.00 C ATOM 254 CG2 ILE A 19 -5.225 9.759 5.797 1.00 0.00 C ATOM 255 CD1 ILE A 19 -6.718 8.521 3.779 1.00 0.00 C ATOM 0 H ILE A 19 -3.331 6.378 4.790 1.00 0.00 H new ATOM 0 HA ILE A 19 -3.745 8.946 3.585 1.00 0.00 H new ATOM 0 HB ILE A 19 -4.522 7.809 6.303 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -5.425 6.844 4.035 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -6.514 7.125 5.379 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -6.121 9.681 6.413 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.437 10.256 6.363 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.450 10.339 4.902 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.485 7.927 3.282 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.193 9.285 4.395 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -6.087 8.999 3.030 1.00 0.00 H new ATOM 267 N GLU A 20 -2.027 8.788 6.426 1.00 0.00 N ATOM 268 CA GLU A 20 -1.021 9.476 7.225 1.00 0.00 C ATOM 269 C GLU A 20 0.368 9.310 6.613 1.00 0.00 C ATOM 270 O GLU A 20 1.327 9.954 7.038 1.00 0.00 O ATOM 271 CB GLU A 20 -1.024 8.944 8.660 1.00 0.00 C ATOM 272 CG GLU A 20 -2.382 8.435 9.116 1.00 0.00 C ATOM 273 CD GLU A 20 -2.768 8.954 10.487 1.00 0.00 C ATOM 274 OE1 GLU A 20 -1.897 8.964 11.383 1.00 0.00 O ATOM 275 OE2 GLU A 20 -3.938 9.348 10.666 1.00 0.00 O ATOM 0 H GLU A 20 -2.374 7.922 6.839 1.00 0.00 H new ATOM 0 HA GLU A 20 -1.270 10.537 7.238 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -0.296 8.136 8.741 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -0.697 9.736 9.333 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -3.140 8.734 8.392 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -2.370 7.345 9.134 1.00 0.00 H new ATOM 282 N GLY A 21 0.467 8.440 5.613 1.00 0.00 N ATOM 283 CA GLY A 21 1.742 8.204 4.959 1.00 0.00 C ATOM 284 C GLY A 21 2.659 7.319 5.780 1.00 0.00 C ATOM 285 O GLY A 21 3.739 6.943 5.326 1.00 0.00 O ATOM 0 H GLY A 21 -0.312 7.894 5.244 1.00 0.00 H new ATOM 0 HA2 GLY A 21 1.569 7.741 3.988 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.234 9.159 4.773 1.00 0.00 H new ATOM 289 N SER A 22 2.229 6.989 6.994 1.00 0.00 N ATOM 290 CA SER A 22 3.022 6.149 7.882 1.00 0.00 C ATOM 291 C SER A 22 3.768 5.076 7.094 1.00 0.00 C ATOM 292 O SER A 22 4.853 4.643 7.484 1.00 0.00 O ATOM 293 CB SER A 22 2.126 5.493 8.934 1.00 0.00 C ATOM 294 OG SER A 22 2.878 4.658 9.797 1.00 0.00 O ATOM 0 H SER A 22 1.336 7.291 7.384 1.00 0.00 H new ATOM 0 HA SER A 22 3.754 6.783 8.382 1.00 0.00 H new ATOM 0 HB2 SER A 22 1.621 6.263 9.517 1.00 0.00 H new ATOM 0 HB3 SER A 22 1.350 4.907 8.441 1.00 0.00 H new ATOM 0 HG SER A 22 2.282 4.252 10.461 1.00 0.00 H new ATOM 300 N LEU A 23 3.179 4.652 5.981 1.00 0.00 N ATOM 301 CA LEU A 23 3.787 3.630 5.136 1.00 0.00 C ATOM 302 C LEU A 23 4.486 4.261 3.936 1.00 0.00 C ATOM 303 O LEU A 23 3.927 5.127 3.265 1.00 0.00 O ATOM 304 CB LEU A 23 2.724 2.638 4.658 1.00 0.00 C ATOM 305 CG LEU A 23 2.140 2.898 3.269 1.00 0.00 C ATOM 306 CD1 LEU A 23 1.444 1.652 2.742 1.00 0.00 C ATOM 307 CD2 LEU A 23 1.175 4.074 3.308 1.00 0.00 C ATOM 0 H LEU A 23 2.282 5.000 5.643 1.00 0.00 H new ATOM 0 HA LEU A 23 4.532 3.099 5.729 1.00 0.00 H new ATOM 0 HB2 LEU A 23 3.159 1.638 4.666 1.00 0.00 H new ATOM 0 HB3 LEU A 23 1.907 2.636 5.379 1.00 0.00 H new ATOM 0 HG LEU A 23 2.957 3.147 2.592 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.034 1.855 1.753 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.162 0.834 2.677 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.636 1.373 3.419 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.769 4.245 2.311 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.361 3.854 3.999 1.00 0.00 H new ATOM 0 HD23 LEU A 23 1.703 4.967 3.643 1.00 0.00 H new ATOM 319 N SER A 24 5.710 3.817 3.671 1.00 0.00 N ATOM 320 CA SER A 24 6.487 4.340 2.552 1.00 0.00 C ATOM 321 C SER A 24 5.681 4.285 1.258 1.00 0.00 C ATOM 322 O SER A 24 4.679 3.578 1.151 1.00 0.00 O ATOM 323 CB SER A 24 7.786 3.548 2.392 1.00 0.00 C ATOM 324 OG SER A 24 8.864 4.198 3.042 1.00 0.00 O ATOM 0 H SER A 24 6.185 3.097 4.215 1.00 0.00 H new ATOM 0 HA SER A 24 6.729 5.381 2.764 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.659 2.547 2.805 1.00 0.00 H new ATOM 0 HB3 SER A 24 8.015 3.429 1.333 1.00 0.00 H new ATOM 0 HG SER A 24 9.682 3.671 2.926 1.00 0.00 H new ATOM 330 N PRO A 25 6.127 5.049 0.251 1.00 0.00 N ATOM 331 CA PRO A 25 5.464 5.106 -1.055 1.00 0.00 C ATOM 332 C PRO A 25 5.619 3.808 -1.841 1.00 0.00 C ATOM 333 O PRO A 25 4.781 3.473 -2.678 1.00 0.00 O ATOM 334 CB PRO A 25 6.182 6.253 -1.769 1.00 0.00 C ATOM 335 CG PRO A 25 7.524 6.319 -1.126 1.00 0.00 C ATOM 336 CD PRO A 25 7.315 5.918 0.309 1.00 0.00 C ATOM 0 HA PRO A 25 4.388 5.253 -0.959 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.265 6.063 -2.839 1.00 0.00 H new ATOM 0 HB3 PRO A 25 5.641 7.192 -1.653 1.00 0.00 H new ATOM 0 HG2 PRO A 25 8.227 5.649 -1.620 1.00 0.00 H new ATOM 0 HG3 PRO A 25 7.940 7.324 -1.194 1.00 0.00 H new ATOM 0 HD2 PRO A 25 8.180 5.389 0.709 1.00 0.00 H new ATOM 0 HD3 PRO A 25 7.148 6.785 0.948 1.00 0.00 H new ATOM 344 N LYS A 26 6.696 3.081 -1.565 1.00 0.00 N ATOM 345 CA LYS A 26 6.962 1.818 -2.244 1.00 0.00 C ATOM 346 C LYS A 26 6.058 0.711 -1.709 1.00 0.00 C ATOM 347 O LYS A 26 5.528 -0.093 -2.474 1.00 0.00 O ATOM 348 CB LYS A 26 8.429 1.421 -2.071 1.00 0.00 C ATOM 349 CG LYS A 26 8.828 0.198 -2.878 1.00 0.00 C ATOM 350 CD LYS A 26 9.145 0.560 -4.320 1.00 0.00 C ATOM 351 CE LYS A 26 10.646 0.608 -4.565 1.00 0.00 C ATOM 352 NZ LYS A 26 11.024 1.725 -5.475 1.00 0.00 N ATOM 0 H LYS A 26 7.400 3.345 -0.875 1.00 0.00 H new ATOM 0 HA LYS A 26 6.752 1.954 -3.305 1.00 0.00 H new ATOM 0 HB2 LYS A 26 9.060 2.260 -2.363 1.00 0.00 H new ATOM 0 HB3 LYS A 26 8.622 1.228 -1.016 1.00 0.00 H new ATOM 0 HG2 LYS A 26 9.698 -0.273 -2.420 1.00 0.00 H new ATOM 0 HG3 LYS A 26 8.020 -0.534 -2.855 1.00 0.00 H new ATOM 0 HD2 LYS A 26 8.689 -0.170 -4.988 1.00 0.00 H new ATOM 0 HD3 LYS A 26 8.705 1.528 -4.558 1.00 0.00 H new ATOM 0 HE2 LYS A 26 11.166 0.723 -3.614 1.00 0.00 H new ATOM 0 HE3 LYS A 26 10.974 -0.338 -4.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 12.054 1.724 -5.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 10.548 1.602 -6.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 10.734 2.630 -5.053 1.00 0.00 H new ATOM 366 N GLU A 27 5.888 0.679 -0.391 1.00 0.00 N ATOM 367 CA GLU A 27 5.047 -0.329 0.245 1.00 0.00 C ATOM 368 C GLU A 27 3.674 -0.389 -0.417 1.00 0.00 C ATOM 369 O GLU A 27 3.163 -1.469 -0.714 1.00 0.00 O ATOM 370 CB GLU A 27 4.894 -0.029 1.738 1.00 0.00 C ATOM 371 CG GLU A 27 5.682 -0.970 2.633 1.00 0.00 C ATOM 372 CD GLU A 27 4.853 -2.141 3.121 1.00 0.00 C ATOM 373 OE1 GLU A 27 4.405 -2.944 2.276 1.00 0.00 O ATOM 374 OE2 GLU A 27 4.651 -2.255 4.348 1.00 0.00 O ATOM 0 H GLU A 27 6.320 1.338 0.256 1.00 0.00 H new ATOM 0 HA GLU A 27 5.531 -1.298 0.124 1.00 0.00 H new ATOM 0 HB2 GLU A 27 5.216 0.995 1.929 1.00 0.00 H new ATOM 0 HB3 GLU A 27 3.839 -0.086 2.005 1.00 0.00 H new ATOM 0 HG2 GLU A 27 6.548 -1.345 2.087 1.00 0.00 H new ATOM 0 HG3 GLU A 27 6.062 -0.416 3.491 1.00 0.00 H new ATOM 381 N ARG A 28 3.082 0.779 -0.646 1.00 0.00 N ATOM 382 CA ARG A 28 1.767 0.860 -1.271 1.00 0.00 C ATOM 383 C ARG A 28 1.724 0.037 -2.555 1.00 0.00 C ATOM 384 O ARG A 28 0.833 -0.791 -2.746 1.00 0.00 O ATOM 385 CB ARG A 28 1.413 2.317 -1.573 1.00 0.00 C ATOM 386 CG ARG A 28 1.283 3.183 -0.331 1.00 0.00 C ATOM 387 CD ARG A 28 0.836 4.594 -0.680 1.00 0.00 C ATOM 388 NE ARG A 28 1.888 5.350 -1.355 1.00 0.00 N ATOM 389 CZ ARG A 28 1.828 6.659 -1.573 1.00 0.00 C ATOM 390 NH1 ARG A 28 0.773 7.354 -1.171 1.00 0.00 N ATOM 391 NH2 ARG A 28 2.824 7.276 -2.195 1.00 0.00 N ATOM 0 H ARG A 28 3.492 1.682 -0.408 1.00 0.00 H new ATOM 0 HA ARG A 28 1.034 0.452 -0.575 1.00 0.00 H new ATOM 0 HB2 ARG A 28 2.179 2.741 -2.222 1.00 0.00 H new ATOM 0 HB3 ARG A 28 0.474 2.347 -2.126 1.00 0.00 H new ATOM 0 HG2 ARG A 28 0.566 2.732 0.355 1.00 0.00 H new ATOM 0 HG3 ARG A 28 2.240 3.222 0.189 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -0.045 4.547 -1.320 1.00 0.00 H new ATOM 0 HD3 ARG A 28 0.541 5.116 0.230 1.00 0.00 H new ATOM 0 HE ARG A 28 2.714 4.845 -1.677 1.00 0.00 H new ATOM 0 HH11 ARG A 28 0.004 6.884 -0.693 1.00 0.00 H new ATOM 0 HH12 ARG A 28 0.730 8.359 -1.340 1.00 0.00 H new ATOM 0 HH21 ARG A 28 3.637 6.745 -2.507 1.00 0.00 H new ATOM 0 HH22 ARG A 28 2.776 8.281 -2.362 1.00 0.00 H new ATOM 405 N THR A 29 2.693 0.271 -3.434 1.00 0.00 N ATOM 406 CA THR A 29 2.766 -0.446 -4.701 1.00 0.00 C ATOM 407 C THR A 29 3.093 -1.919 -4.480 1.00 0.00 C ATOM 408 O THR A 29 2.819 -2.761 -5.337 1.00 0.00 O ATOM 409 CB THR A 29 3.825 0.169 -5.635 1.00 0.00 C ATOM 410 OG1 THR A 29 3.315 1.367 -6.232 1.00 0.00 O ATOM 411 CG2 THR A 29 4.223 -0.816 -6.723 1.00 0.00 C ATOM 0 H THR A 29 3.439 0.952 -3.292 1.00 0.00 H new ATOM 0 HA THR A 29 1.786 -0.360 -5.170 1.00 0.00 H new ATOM 0 HB THR A 29 4.708 0.407 -5.041 1.00 0.00 H new ATOM 0 HG1 THR A 29 3.995 1.753 -6.823 1.00 0.00 H new ATOM 0 HG21 THR A 29 4.972 -0.360 -7.371 1.00 0.00 H new ATOM 0 HG22 THR A 29 4.637 -1.715 -6.266 1.00 0.00 H new ATOM 0 HG23 THR A 29 3.346 -1.080 -7.313 1.00 0.00 H new ATOM 419 N LEU A 30 3.679 -2.224 -3.329 1.00 0.00 N ATOM 420 CA LEU A 30 4.043 -3.596 -2.995 1.00 0.00 C ATOM 421 C LEU A 30 2.843 -4.359 -2.440 1.00 0.00 C ATOM 422 O LEU A 30 2.752 -5.579 -2.577 1.00 0.00 O ATOM 423 CB LEU A 30 5.186 -3.610 -1.979 1.00 0.00 C ATOM 424 CG LEU A 30 6.520 -3.041 -2.460 1.00 0.00 C ATOM 425 CD1 LEU A 30 7.464 -2.824 -1.288 1.00 0.00 C ATOM 426 CD2 LEU A 30 7.152 -3.965 -3.492 1.00 0.00 C ATOM 0 H LEU A 30 3.913 -1.539 -2.610 1.00 0.00 H new ATOM 0 HA LEU A 30 4.373 -4.090 -3.909 1.00 0.00 H new ATOM 0 HB2 LEU A 30 4.870 -3.048 -1.100 1.00 0.00 H new ATOM 0 HB3 LEU A 30 5.348 -4.639 -1.659 1.00 0.00 H new ATOM 0 HG LEU A 30 6.332 -2.076 -2.930 1.00 0.00 H new ATOM 0 HD11 LEU A 30 8.408 -2.418 -1.652 1.00 0.00 H new ATOM 0 HD12 LEU A 30 7.015 -2.123 -0.584 1.00 0.00 H new ATOM 0 HD13 LEU A 30 7.646 -3.775 -0.787 1.00 0.00 H new ATOM 0 HD21 LEU A 30 8.101 -3.545 -3.824 1.00 0.00 H new ATOM 0 HD22 LEU A 30 7.325 -4.944 -3.046 1.00 0.00 H new ATOM 0 HD23 LEU A 30 6.483 -4.068 -4.346 1.00 0.00 H new ATOM 438 N LEU A 31 1.925 -3.630 -1.815 1.00 0.00 N ATOM 439 CA LEU A 31 0.730 -4.236 -1.240 1.00 0.00 C ATOM 440 C LEU A 31 0.094 -5.221 -2.218 1.00 0.00 C ATOM 441 O LEU A 31 -0.341 -6.305 -1.829 1.00 0.00 O ATOM 442 CB LEU A 31 -0.282 -3.154 -0.860 1.00 0.00 C ATOM 443 CG LEU A 31 0.152 -2.187 0.243 1.00 0.00 C ATOM 444 CD1 LEU A 31 -0.901 -1.111 0.455 1.00 0.00 C ATOM 445 CD2 LEU A 31 0.415 -2.940 1.538 1.00 0.00 C ATOM 0 H LEU A 31 1.986 -2.619 -1.694 1.00 0.00 H new ATOM 0 HA LEU A 31 1.025 -4.781 -0.343 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.516 -2.574 -1.753 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.205 -3.642 -0.546 1.00 0.00 H new ATOM 0 HG LEU A 31 1.078 -1.703 -0.068 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.575 -0.433 1.243 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -1.041 -0.552 -0.470 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -1.843 -1.576 0.744 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.723 -2.237 2.312 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.495 -3.451 1.853 1.00 0.00 H new ATOM 0 HD23 LEU A 31 1.206 -3.673 1.379 1.00 0.00 H new ATOM 457 N LYS A 32 0.047 -4.837 -3.489 1.00 0.00 N ATOM 458 CA LYS A 32 -0.531 -5.685 -4.524 1.00 0.00 C ATOM 459 C LYS A 32 0.169 -7.040 -4.569 1.00 0.00 C ATOM 460 O LYS A 32 -0.471 -8.072 -4.772 1.00 0.00 O ATOM 461 CB LYS A 32 -0.429 -5.001 -5.889 1.00 0.00 C ATOM 462 CG LYS A 32 -0.874 -3.548 -5.875 1.00 0.00 C ATOM 463 CD LYS A 32 -1.975 -3.293 -6.889 1.00 0.00 C ATOM 464 CE LYS A 32 -2.520 -1.878 -6.777 1.00 0.00 C ATOM 465 NZ LYS A 32 -4.008 -1.857 -6.738 1.00 0.00 N ATOM 0 H LYS A 32 0.403 -3.943 -3.827 1.00 0.00 H new ATOM 0 HA LYS A 32 -1.582 -5.845 -4.283 1.00 0.00 H new ATOM 0 HB2 LYS A 32 0.603 -5.053 -6.236 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -1.035 -5.551 -6.608 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -1.228 -3.284 -4.878 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.022 -2.903 -6.092 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -1.589 -3.457 -7.895 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -2.783 -4.008 -6.737 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -2.127 -1.408 -5.876 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -2.171 -1.287 -7.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -4.361 -1.113 -7.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -4.376 -2.779 -7.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -4.327 -1.664 -5.767 1.00 0.00 H new ATOM 479 N GLU A 33 1.484 -7.029 -4.379 1.00 0.00 N ATOM 480 CA GLU A 33 2.269 -8.258 -4.398 1.00 0.00 C ATOM 481 C GLU A 33 1.919 -9.145 -3.206 1.00 0.00 C ATOM 482 O GLU A 33 2.226 -10.337 -3.196 1.00 0.00 O ATOM 483 CB GLU A 33 3.764 -7.935 -4.386 1.00 0.00 C ATOM 484 CG GLU A 33 4.160 -6.849 -5.372 1.00 0.00 C ATOM 485 CD GLU A 33 5.656 -6.799 -5.615 1.00 0.00 C ATOM 486 OE1 GLU A 33 6.325 -7.834 -5.408 1.00 0.00 O ATOM 487 OE2 GLU A 33 6.158 -5.727 -6.012 1.00 0.00 O ATOM 0 H GLU A 33 2.028 -6.183 -4.210 1.00 0.00 H new ATOM 0 HA GLU A 33 2.029 -8.798 -5.314 1.00 0.00 H new ATOM 0 HB2 GLU A 33 4.052 -7.625 -3.382 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.325 -8.842 -4.613 1.00 0.00 H new ATOM 0 HG2 GLU A 33 3.647 -7.019 -6.319 1.00 0.00 H new ATOM 0 HG3 GLU A 33 3.824 -5.882 -4.996 1.00 0.00 H new ATOM 494 N ASP A 34 1.275 -8.555 -2.206 1.00 0.00 N ATOM 495 CA ASP A 34 0.883 -9.291 -1.009 1.00 0.00 C ATOM 496 C ASP A 34 -0.470 -9.969 -1.207 1.00 0.00 C ATOM 497 O ASP A 34 -1.385 -9.416 -1.817 1.00 0.00 O ATOM 498 CB ASP A 34 0.825 -8.352 0.197 1.00 0.00 C ATOM 499 CG ASP A 34 1.443 -8.965 1.438 1.00 0.00 C ATOM 500 OD1 ASP A 34 2.469 -9.663 1.307 1.00 0.00 O ATOM 501 OD2 ASP A 34 0.899 -8.746 2.541 1.00 0.00 O ATOM 0 H ASP A 34 1.013 -7.569 -2.200 1.00 0.00 H new ATOM 0 HA ASP A 34 1.632 -10.061 -0.824 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.344 -7.424 -0.043 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -0.214 -8.092 0.402 1.00 0.00 H new ATOM 506 N PRO A 35 -0.599 -11.196 -0.681 1.00 0.00 N ATOM 507 CA PRO A 35 -1.836 -11.975 -0.787 1.00 0.00 C ATOM 508 C PRO A 35 -2.965 -11.389 0.053 1.00 0.00 C ATOM 509 O PRO A 35 -4.141 -11.538 -0.280 1.00 0.00 O ATOM 510 CB PRO A 35 -1.433 -13.353 -0.254 1.00 0.00 C ATOM 511 CG PRO A 35 -0.282 -13.086 0.653 1.00 0.00 C ATOM 512 CD PRO A 35 0.452 -11.915 0.059 1.00 0.00 C ATOM 0 HA PRO A 35 -2.221 -11.992 -1.807 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -2.256 -13.827 0.280 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -1.151 -14.024 -1.065 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -0.625 -12.860 1.663 1.00 0.00 H new ATOM 0 HG3 PRO A 35 0.368 -13.958 0.725 1.00 0.00 H new ATOM 0 HD2 PRO A 35 0.901 -11.289 0.830 1.00 0.00 H new ATOM 0 HD3 PRO A 35 1.258 -12.238 -0.599 1.00 0.00 H new ATOM 520 N ALA A 36 -2.601 -10.722 1.143 1.00 0.00 N ATOM 521 CA ALA A 36 -3.584 -10.111 2.029 1.00 0.00 C ATOM 522 C ALA A 36 -4.354 -9.005 1.315 1.00 0.00 C ATOM 523 O ALA A 36 -5.501 -8.714 1.656 1.00 0.00 O ATOM 524 CB ALA A 36 -2.904 -9.563 3.274 1.00 0.00 C ATOM 0 H ALA A 36 -1.632 -10.591 1.434 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.296 -10.881 2.326 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.650 -9.110 3.926 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -2.405 -10.375 3.803 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.169 -8.811 2.986 1.00 0.00 H new ATOM 530 N TYR A 37 -3.717 -8.392 0.324 1.00 0.00 N ATOM 531 CA TYR A 37 -4.340 -7.316 -0.437 1.00 0.00 C ATOM 532 C TYR A 37 -4.548 -7.725 -1.891 1.00 0.00 C ATOM 533 O TYR A 37 -4.090 -7.046 -2.811 1.00 0.00 O ATOM 534 CB TYR A 37 -3.484 -6.050 -0.368 1.00 0.00 C ATOM 535 CG TYR A 37 -3.088 -5.662 1.038 1.00 0.00 C ATOM 536 CD1 TYR A 37 -4.028 -5.161 1.931 1.00 0.00 C ATOM 537 CD2 TYR A 37 -1.776 -5.795 1.474 1.00 0.00 C ATOM 538 CE1 TYR A 37 -3.672 -4.804 3.217 1.00 0.00 C ATOM 539 CE2 TYR A 37 -1.411 -5.442 2.759 1.00 0.00 C ATOM 540 CZ TYR A 37 -2.362 -4.946 3.627 1.00 0.00 C ATOM 541 OH TYR A 37 -2.002 -4.593 4.906 1.00 0.00 O ATOM 0 H TYR A 37 -2.768 -8.622 0.029 1.00 0.00 H new ATOM 0 HA TYR A 37 -5.315 -7.111 0.006 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -2.582 -6.198 -0.962 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -4.033 -5.225 -0.822 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -5.054 -5.049 1.614 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -1.028 -6.181 0.797 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -4.415 -4.416 3.898 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -0.387 -5.554 3.082 1.00 0.00 H new ATOM 0 HH TYR A 37 -1.044 -4.756 5.033 1.00 0.00 H new ATOM 551 N TRP A 38 -5.242 -8.840 -2.092 1.00 0.00 N ATOM 552 CA TRP A 38 -5.511 -9.342 -3.435 1.00 0.00 C ATOM 553 C TRP A 38 -6.661 -8.576 -4.081 1.00 0.00 C ATOM 554 O TRP A 38 -6.710 -8.426 -5.302 1.00 0.00 O ATOM 555 CB TRP A 38 -5.838 -10.834 -3.388 1.00 0.00 C ATOM 556 CG TRP A 38 -7.070 -11.148 -2.593 1.00 0.00 C ATOM 557 CD1 TRP A 38 -7.120 -11.674 -1.333 1.00 0.00 C ATOM 558 CD2 TRP A 38 -8.428 -10.956 -3.004 1.00 0.00 C ATOM 559 NE1 TRP A 38 -8.428 -11.821 -0.937 1.00 0.00 N ATOM 560 CE2 TRP A 38 -9.249 -11.387 -1.944 1.00 0.00 C ATOM 561 CE3 TRP A 38 -9.029 -10.460 -4.164 1.00 0.00 C ATOM 562 CZ2 TRP A 38 -10.639 -11.337 -2.011 1.00 0.00 C ATOM 563 CZ3 TRP A 38 -10.409 -10.412 -4.229 1.00 0.00 C ATOM 564 CH2 TRP A 38 -11.201 -10.848 -3.159 1.00 0.00 C ATOM 0 H TRP A 38 -5.629 -9.413 -1.342 1.00 0.00 H new ATOM 0 HA TRP A 38 -4.615 -9.193 -4.038 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -5.967 -11.202 -4.406 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -4.991 -11.371 -2.960 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -6.259 -11.936 -0.736 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -8.737 -12.193 -0.039 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -8.427 -10.121 -4.994 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -11.251 -11.672 -1.187 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -10.885 -10.032 -5.121 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -12.277 -10.797 -3.242 1.00 0.00 H new ATOM 575 N PHE A 39 -7.583 -8.093 -3.255 1.00 0.00 N ATOM 576 CA PHE A 39 -8.733 -7.344 -3.747 1.00 0.00 C ATOM 577 C PHE A 39 -8.286 -6.099 -4.506 1.00 0.00 C ATOM 578 O PHE A 39 -8.954 -5.653 -5.440 1.00 0.00 O ATOM 579 CB PHE A 39 -9.644 -6.945 -2.585 1.00 0.00 C ATOM 580 CG PHE A 39 -8.969 -6.074 -1.565 1.00 0.00 C ATOM 581 CD1 PHE A 39 -8.836 -4.712 -1.777 1.00 0.00 C ATOM 582 CD2 PHE A 39 -8.468 -6.617 -0.392 1.00 0.00 C ATOM 583 CE1 PHE A 39 -8.213 -3.908 -0.840 1.00 0.00 C ATOM 584 CE2 PHE A 39 -7.845 -5.818 0.548 1.00 0.00 C ATOM 585 CZ PHE A 39 -7.719 -4.462 0.325 1.00 0.00 C ATOM 0 H PHE A 39 -7.556 -8.207 -2.242 1.00 0.00 H new ATOM 0 HA PHE A 39 -9.288 -7.987 -4.431 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -10.514 -6.421 -2.980 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -10.011 -7.847 -2.095 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -9.223 -4.273 -2.684 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -8.566 -7.677 -0.211 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -8.113 -2.848 -1.019 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -7.457 -6.255 1.456 1.00 0.00 H new ATOM 0 HZ PHE A 39 -7.235 -3.835 1.060 1.00 0.00 H new ATOM 595 N LEU A 40 -7.151 -5.541 -4.100 1.00 0.00 N ATOM 596 CA LEU A 40 -6.613 -4.345 -4.741 1.00 0.00 C ATOM 597 C LEU A 40 -6.915 -4.347 -6.236 1.00 0.00 C ATOM 598 O LEU A 40 -7.525 -3.412 -6.756 1.00 0.00 O ATOM 599 CB LEU A 40 -5.103 -4.258 -4.516 1.00 0.00 C ATOM 600 CG LEU A 40 -4.656 -3.827 -3.118 1.00 0.00 C ATOM 601 CD1 LEU A 40 -3.139 -3.820 -3.020 1.00 0.00 C ATOM 602 CD2 LEU A 40 -5.221 -2.456 -2.776 1.00 0.00 C ATOM 0 H LEU A 40 -6.585 -5.897 -3.330 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.092 -3.475 -4.292 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.667 -5.234 -4.730 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -4.688 -3.557 -5.240 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.042 -4.547 -2.397 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -2.841 -3.511 -2.018 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.757 -4.821 -3.220 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.730 -3.123 -3.752 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.893 -2.166 -1.778 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.866 -1.725 -3.502 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.310 -2.494 -2.803 1.00 0.00 H new ATOM 614 N SER A 41 -6.488 -5.403 -6.921 1.00 0.00 N ATOM 615 CA SER A 41 -6.712 -5.524 -8.356 1.00 0.00 C ATOM 616 C SER A 41 -8.202 -5.646 -8.666 1.00 0.00 C ATOM 617 O SER A 41 -8.688 -5.097 -9.655 1.00 0.00 O ATOM 618 CB SER A 41 -5.965 -6.739 -8.909 1.00 0.00 C ATOM 619 OG SER A 41 -4.564 -6.596 -8.742 1.00 0.00 O ATOM 0 H SER A 41 -5.985 -6.187 -6.505 1.00 0.00 H new ATOM 0 HA SER A 41 -6.331 -4.622 -8.835 1.00 0.00 H new ATOM 0 HB2 SER A 41 -6.305 -7.641 -8.400 1.00 0.00 H new ATOM 0 HB3 SER A 41 -6.198 -6.862 -9.967 1.00 0.00 H new ATOM 0 HG SER A 41 -4.109 -7.386 -9.102 1.00 0.00 H new ATOM 625 N ASP A 42 -8.918 -6.368 -7.812 1.00 0.00 N ATOM 626 CA ASP A 42 -10.353 -6.561 -7.992 1.00 0.00 C ATOM 627 C ASP A 42 -11.119 -5.286 -7.659 1.00 0.00 C ATOM 628 O ASP A 42 -10.680 -4.483 -6.836 1.00 0.00 O ATOM 629 CB ASP A 42 -10.848 -7.712 -7.115 1.00 0.00 C ATOM 630 CG ASP A 42 -11.953 -8.511 -7.776 1.00 0.00 C ATOM 631 OD1 ASP A 42 -11.653 -9.269 -8.723 1.00 0.00 O ATOM 632 OD2 ASP A 42 -13.119 -8.378 -7.348 1.00 0.00 O ATOM 0 H ASP A 42 -8.530 -6.829 -6.989 1.00 0.00 H new ATOM 0 HA ASP A 42 -10.533 -6.808 -9.038 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -10.013 -8.374 -6.885 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -11.209 -7.313 -6.167 1.00 0.00 H new ATOM 637 N GLU A 43 -12.266 -5.104 -8.306 1.00 0.00 N ATOM 638 CA GLU A 43 -13.093 -3.924 -8.079 1.00 0.00 C ATOM 639 C GLU A 43 -14.509 -4.321 -7.676 1.00 0.00 C ATOM 640 O GLU A 43 -15.135 -3.666 -6.843 1.00 0.00 O ATOM 641 CB GLU A 43 -13.133 -3.053 -9.337 1.00 0.00 C ATOM 642 CG GLU A 43 -11.919 -2.154 -9.495 1.00 0.00 C ATOM 643 CD GLU A 43 -12.294 -0.708 -9.758 1.00 0.00 C ATOM 644 OE1 GLU A 43 -13.357 -0.272 -9.269 1.00 0.00 O ATOM 645 OE2 GLU A 43 -11.524 -0.014 -10.454 1.00 0.00 O ATOM 0 H GLU A 43 -12.644 -5.758 -8.991 1.00 0.00 H new ATOM 0 HA GLU A 43 -12.650 -3.352 -7.264 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.213 -3.698 -10.212 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -14.031 -2.435 -9.312 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -11.311 -2.209 -8.592 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.304 -2.521 -10.317 1.00 0.00 H new ATOM 652 N ASN A 44 -15.009 -5.399 -8.272 1.00 0.00 N ATOM 653 CA ASN A 44 -16.352 -5.882 -7.977 1.00 0.00 C ATOM 654 C ASN A 44 -16.358 -6.727 -6.706 1.00 0.00 C ATOM 655 O ASN A 44 -17.008 -7.771 -6.646 1.00 0.00 O ATOM 656 CB ASN A 44 -16.891 -6.703 -9.150 1.00 0.00 C ATOM 657 CG ASN A 44 -16.207 -8.050 -9.277 1.00 0.00 C ATOM 658 OD1 ASN A 44 -15.072 -8.140 -9.745 1.00 0.00 O ATOM 659 ND2 ASN A 44 -16.896 -9.105 -8.859 1.00 0.00 N ATOM 0 H ASN A 44 -14.503 -5.954 -8.962 1.00 0.00 H new ATOM 0 HA ASN A 44 -16.996 -5.017 -7.821 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -17.963 -6.854 -9.022 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -16.756 -6.142 -10.075 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -16.487 -10.038 -8.919 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -17.834 -8.983 -8.478 1.00 0.00 H new ATOM 666 N SER A 45 -15.632 -6.267 -5.692 1.00 0.00 N ATOM 667 CA SER A 45 -15.551 -6.981 -4.424 1.00 0.00 C ATOM 668 C SER A 45 -15.846 -6.047 -3.254 1.00 0.00 C ATOM 669 O SER A 45 -16.117 -4.861 -3.445 1.00 0.00 O ATOM 670 CB SER A 45 -14.165 -7.607 -4.254 1.00 0.00 C ATOM 671 OG SER A 45 -13.159 -6.611 -4.203 1.00 0.00 O ATOM 0 H SER A 45 -15.091 -5.403 -5.724 1.00 0.00 H new ATOM 0 HA SER A 45 -16.301 -7.772 -4.433 1.00 0.00 H new ATOM 0 HB2 SER A 45 -14.140 -8.201 -3.340 1.00 0.00 H new ATOM 0 HB3 SER A 45 -13.966 -8.288 -5.082 1.00 0.00 H new ATOM 0 HG SER A 45 -12.283 -7.036 -4.092 1.00 0.00 H new ATOM 677 N LEU A 46 -15.792 -6.590 -2.044 1.00 0.00 N ATOM 678 CA LEU A 46 -16.053 -5.806 -0.841 1.00 0.00 C ATOM 679 C LEU A 46 -14.754 -5.280 -0.241 1.00 0.00 C ATOM 680 O LEU A 46 -14.659 -4.110 0.128 1.00 0.00 O ATOM 681 CB LEU A 46 -16.799 -6.653 0.191 1.00 0.00 C ATOM 682 CG LEU A 46 -16.526 -6.318 1.658 1.00 0.00 C ATOM 683 CD1 LEU A 46 -15.225 -6.957 2.119 1.00 0.00 C ATOM 684 CD2 LEU A 46 -16.483 -4.810 1.862 1.00 0.00 C ATOM 0 H LEU A 46 -15.570 -7.570 -1.869 1.00 0.00 H new ATOM 0 HA LEU A 46 -16.673 -4.954 -1.120 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -17.869 -6.552 0.009 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -16.545 -7.700 0.025 1.00 0.00 H new ATOM 0 HG LEU A 46 -17.339 -6.723 2.260 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -15.048 -6.707 3.165 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -15.293 -8.039 2.011 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -14.401 -6.583 1.512 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -16.288 -4.590 2.912 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -15.690 -4.382 1.248 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -17.440 -4.376 1.572 1.00 0.00 H new ATOM 696 N GLU A 47 -13.755 -6.152 -0.148 1.00 0.00 N ATOM 697 CA GLU A 47 -12.461 -5.774 0.406 1.00 0.00 C ATOM 698 C GLU A 47 -11.870 -4.588 -0.352 1.00 0.00 C ATOM 699 O GLU A 47 -11.072 -3.824 0.194 1.00 0.00 O ATOM 700 CB GLU A 47 -11.493 -6.958 0.356 1.00 0.00 C ATOM 701 CG GLU A 47 -12.012 -8.198 1.064 1.00 0.00 C ATOM 702 CD GLU A 47 -10.909 -9.187 1.393 1.00 0.00 C ATOM 703 OE1 GLU A 47 -10.247 -9.672 0.452 1.00 0.00 O ATOM 704 OE2 GLU A 47 -10.709 -9.473 2.592 1.00 0.00 O ATOM 0 H GLU A 47 -13.817 -7.125 -0.449 1.00 0.00 H new ATOM 0 HA GLU A 47 -12.612 -5.481 1.445 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -11.287 -7.204 -0.686 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.546 -6.662 0.807 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -12.516 -7.902 1.984 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -12.757 -8.686 0.435 1.00 0.00 H new ATOM 711 N TYR A 48 -12.266 -4.442 -1.610 1.00 0.00 N ATOM 712 CA TYR A 48 -11.774 -3.351 -2.445 1.00 0.00 C ATOM 713 C TYR A 48 -12.644 -2.108 -2.283 1.00 0.00 C ATOM 714 O TYR A 48 -12.188 -0.984 -2.499 1.00 0.00 O ATOM 715 CB TYR A 48 -11.743 -3.778 -3.913 1.00 0.00 C ATOM 716 CG TYR A 48 -11.331 -2.672 -4.858 1.00 0.00 C ATOM 717 CD1 TYR A 48 -12.268 -1.786 -5.372 1.00 0.00 C ATOM 718 CD2 TYR A 48 -10.002 -2.513 -5.233 1.00 0.00 C ATOM 719 CE1 TYR A 48 -11.895 -0.774 -6.235 1.00 0.00 C ATOM 720 CE2 TYR A 48 -9.620 -1.503 -6.095 1.00 0.00 C ATOM 721 CZ TYR A 48 -10.570 -0.637 -6.594 1.00 0.00 C ATOM 722 OH TYR A 48 -10.195 0.371 -7.453 1.00 0.00 O ATOM 0 H TYR A 48 -12.926 -5.065 -2.075 1.00 0.00 H new ATOM 0 HA TYR A 48 -10.761 -3.109 -2.123 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -11.054 -4.615 -4.024 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -12.731 -4.139 -4.198 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -13.306 -1.890 -5.092 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -9.256 -3.190 -4.844 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -12.637 -0.094 -6.627 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -8.583 -1.392 -6.376 1.00 0.00 H new ATOM 0 HH TYR A 48 -9.227 0.330 -7.603 1.00 0.00 H new ATOM 732 N LYS A 49 -13.899 -2.317 -1.901 1.00 0.00 N ATOM 733 CA LYS A 49 -14.833 -1.215 -1.707 1.00 0.00 C ATOM 734 C LYS A 49 -14.401 -0.333 -0.540 1.00 0.00 C ATOM 735 O LYS A 49 -14.823 0.819 -0.429 1.00 0.00 O ATOM 736 CB LYS A 49 -16.245 -1.752 -1.459 1.00 0.00 C ATOM 737 CG LYS A 49 -17.161 -1.635 -2.664 1.00 0.00 C ATOM 738 CD LYS A 49 -18.123 -2.809 -2.750 1.00 0.00 C ATOM 739 CE LYS A 49 -18.445 -3.161 -4.193 1.00 0.00 C ATOM 740 NZ LYS A 49 -19.452 -2.233 -4.780 1.00 0.00 N ATOM 0 H LYS A 49 -14.293 -3.240 -1.720 1.00 0.00 H new ATOM 0 HA LYS A 49 -14.835 -0.611 -2.614 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -16.180 -2.799 -1.163 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -16.688 -1.212 -0.623 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -17.726 -0.705 -2.604 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -16.563 -1.587 -3.574 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -17.687 -3.675 -2.252 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -19.044 -2.566 -2.220 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -17.532 -3.128 -4.787 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -18.821 -4.183 -4.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -19.644 -2.507 -5.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -20.333 -2.282 -4.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -19.083 -1.261 -4.757 1.00 0.00 H new ATOM 754 N TYR A 50 -13.558 -0.881 0.328 1.00 0.00 N ATOM 755 CA TYR A 50 -13.070 -0.144 1.488 1.00 0.00 C ATOM 756 C TYR A 50 -11.836 0.680 1.130 1.00 0.00 C ATOM 757 O TYR A 50 -11.807 1.894 1.332 1.00 0.00 O ATOM 758 CB TYR A 50 -12.739 -1.108 2.629 1.00 0.00 C ATOM 759 CG TYR A 50 -13.953 -1.566 3.405 1.00 0.00 C ATOM 760 CD1 TYR A 50 -15.137 -1.891 2.753 1.00 0.00 C ATOM 761 CD2 TYR A 50 -13.917 -1.673 4.790 1.00 0.00 C ATOM 762 CE1 TYR A 50 -16.248 -2.310 3.458 1.00 0.00 C ATOM 763 CE2 TYR A 50 -15.023 -2.093 5.503 1.00 0.00 C ATOM 764 CZ TYR A 50 -16.186 -2.409 4.832 1.00 0.00 C ATOM 765 OH TYR A 50 -17.291 -2.826 5.540 1.00 0.00 O ATOM 0 H TYR A 50 -13.198 -1.832 0.251 1.00 0.00 H new ATOM 0 HA TYR A 50 -13.858 0.536 1.812 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -12.229 -1.980 2.220 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -12.043 -0.623 3.313 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -15.189 -1.814 1.677 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -13.009 -1.423 5.318 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -17.160 -2.559 2.936 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -14.977 -2.173 6.579 1.00 0.00 H new ATOM 0 HH TYR A 50 -17.823 -3.435 4.987 1.00 0.00 H new ATOM 775 N TYR A 51 -10.820 0.011 0.597 1.00 0.00 N ATOM 776 CA TYR A 51 -9.583 0.680 0.212 1.00 0.00 C ATOM 777 C TYR A 51 -9.873 1.931 -0.611 1.00 0.00 C ATOM 778 O TYR A 51 -9.128 2.910 -0.558 1.00 0.00 O ATOM 779 CB TYR A 51 -8.690 -0.273 -0.585 1.00 0.00 C ATOM 780 CG TYR A 51 -7.430 0.376 -1.111 1.00 0.00 C ATOM 781 CD1 TYR A 51 -6.370 0.670 -0.262 1.00 0.00 C ATOM 782 CD2 TYR A 51 -7.300 0.695 -2.457 1.00 0.00 C ATOM 783 CE1 TYR A 51 -5.217 1.263 -0.739 1.00 0.00 C ATOM 784 CE2 TYR A 51 -6.150 1.287 -2.942 1.00 0.00 C ATOM 785 CZ TYR A 51 -5.112 1.570 -2.080 1.00 0.00 C ATOM 786 OH TYR A 51 -3.965 2.161 -2.559 1.00 0.00 O ATOM 0 H TYR A 51 -10.828 -0.994 0.422 1.00 0.00 H new ATOM 0 HA TYR A 51 -9.063 0.979 1.122 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -8.417 -1.117 0.049 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -9.259 -0.675 -1.423 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -6.449 0.431 0.788 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -8.111 0.477 -3.135 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -4.402 1.485 -0.066 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -6.064 1.527 -3.992 1.00 0.00 H new ATOM 0 HH TYR A 51 -4.052 2.310 -3.524 1.00 0.00 H new ATOM 796 N LYS A 52 -10.962 1.891 -1.372 1.00 0.00 N ATOM 797 CA LYS A 52 -11.354 3.020 -2.206 1.00 0.00 C ATOM 798 C LYS A 52 -12.266 3.973 -1.439 1.00 0.00 C ATOM 799 O LYS A 52 -12.224 5.187 -1.642 1.00 0.00 O ATOM 800 CB LYS A 52 -12.062 2.526 -3.470 1.00 0.00 C ATOM 801 CG LYS A 52 -11.118 1.943 -4.507 1.00 0.00 C ATOM 802 CD LYS A 52 -10.256 3.019 -5.145 1.00 0.00 C ATOM 803 CE LYS A 52 -11.088 3.972 -5.989 1.00 0.00 C ATOM 804 NZ LYS A 52 -11.479 5.190 -5.227 1.00 0.00 N ATOM 0 H LYS A 52 -11.589 1.088 -1.428 1.00 0.00 H new ATOM 0 HA LYS A 52 -10.451 3.560 -2.490 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -12.796 1.769 -3.193 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -12.611 3.355 -3.916 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -10.479 1.194 -4.038 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -11.694 1.432 -5.279 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -9.736 3.579 -4.367 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -9.492 2.553 -5.767 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -10.521 4.263 -6.873 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -11.984 3.459 -6.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -12.492 5.377 -5.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -11.292 5.041 -4.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -10.927 6.004 -5.565 1.00 0.00 H new ATOM 818 N LEU A 53 -13.088 3.414 -0.558 1.00 0.00 N ATOM 819 CA LEU A 53 -14.010 4.214 0.242 1.00 0.00 C ATOM 820 C LEU A 53 -13.297 4.831 1.441 1.00 0.00 C ATOM 821 O LEU A 53 -13.089 6.043 1.497 1.00 0.00 O ATOM 822 CB LEU A 53 -15.182 3.354 0.718 1.00 0.00 C ATOM 823 CG LEU A 53 -16.047 3.952 1.828 1.00 0.00 C ATOM 824 CD1 LEU A 53 -15.598 3.443 3.189 1.00 0.00 C ATOM 825 CD2 LEU A 53 -15.995 5.473 1.783 1.00 0.00 C ATOM 0 H LEU A 53 -13.135 2.411 -0.379 1.00 0.00 H new ATOM 0 HA LEU A 53 -14.390 5.020 -0.385 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -15.822 3.141 -0.139 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -14.788 2.399 1.067 1.00 0.00 H new ATOM 0 HG LEU A 53 -17.078 3.637 1.667 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -16.225 3.880 3.966 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -15.687 2.357 3.219 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -14.559 3.727 3.359 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -16.616 5.882 2.580 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -14.966 5.806 1.918 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -16.366 5.821 0.819 1.00 0.00 H new ATOM 837 N LYS A 54 -12.924 3.989 2.398 1.00 0.00 N ATOM 838 CA LYS A 54 -12.230 4.449 3.595 1.00 0.00 C ATOM 839 C LYS A 54 -11.128 5.441 3.238 1.00 0.00 C ATOM 840 O LYS A 54 -10.859 6.382 3.987 1.00 0.00 O ATOM 841 CB LYS A 54 -11.634 3.260 4.353 1.00 0.00 C ATOM 842 CG LYS A 54 -11.550 3.476 5.854 1.00 0.00 C ATOM 843 CD LYS A 54 -12.875 3.174 6.535 1.00 0.00 C ATOM 844 CE LYS A 54 -12.870 3.623 7.989 1.00 0.00 C ATOM 845 NZ LYS A 54 -12.841 2.467 8.927 1.00 0.00 N ATOM 0 H LYS A 54 -13.091 2.983 2.368 1.00 0.00 H new ATOM 0 HA LYS A 54 -12.955 4.953 4.234 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -12.238 2.374 4.155 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -10.635 3.058 3.967 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -10.771 2.838 6.272 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -11.261 4.507 6.059 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -13.682 3.675 6.001 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -13.076 2.104 6.484 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -12.003 4.259 8.170 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -13.755 4.228 8.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -13.731 2.433 9.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -12.727 1.585 8.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -12.044 2.575 9.586 1.00 0.00 H new ATOM 859 N LEU A 55 -10.495 5.229 2.090 1.00 0.00 N ATOM 860 CA LEU A 55 -9.424 6.106 1.632 1.00 0.00 C ATOM 861 C LEU A 55 -9.972 7.473 1.234 1.00 0.00 C ATOM 862 O LEU A 55 -9.436 8.507 1.632 1.00 0.00 O ATOM 863 CB LEU A 55 -8.691 5.474 0.448 1.00 0.00 C ATOM 864 CG LEU A 55 -7.512 6.269 -0.114 1.00 0.00 C ATOM 865 CD1 LEU A 55 -6.441 6.460 0.949 1.00 0.00 C ATOM 866 CD2 LEU A 55 -6.933 5.572 -1.338 1.00 0.00 C ATOM 0 H LEU A 55 -10.705 4.456 1.458 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.723 6.242 2.455 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -8.329 4.492 0.753 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.410 5.313 -0.355 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.873 7.252 -0.417 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -5.610 7.028 0.530 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.861 7.003 1.796 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.083 5.486 1.284 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.095 6.152 -1.725 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -6.588 4.576 -1.060 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.701 5.488 -2.107 1.00 0.00 H new ATOM 878 N ALA A 56 -11.044 7.469 0.449 1.00 0.00 N ATOM 879 CA ALA A 56 -11.666 8.708 0.000 1.00 0.00 C ATOM 880 C ALA A 56 -12.153 9.538 1.184 1.00 0.00 C ATOM 881 O ALA A 56 -11.864 10.730 1.279 1.00 0.00 O ATOM 882 CB ALA A 56 -12.820 8.407 -0.944 1.00 0.00 C ATOM 0 H ALA A 56 -11.500 6.621 0.111 1.00 0.00 H new ATOM 0 HA ALA A 56 -10.915 9.290 -0.535 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -13.275 9.342 -1.272 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -12.448 7.861 -1.811 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -13.565 7.802 -0.427 1.00 0.00 H new ATOM 888 N GLU A 57 -12.893 8.898 2.085 1.00 0.00 N ATOM 889 CA GLU A 57 -13.419 9.578 3.262 1.00 0.00 C ATOM 890 C GLU A 57 -12.287 10.044 4.174 1.00 0.00 C ATOM 891 O GLU A 57 -12.315 11.157 4.697 1.00 0.00 O ATOM 892 CB GLU A 57 -14.363 8.654 4.033 1.00 0.00 C ATOM 893 CG GLU A 57 -13.726 7.336 4.440 1.00 0.00 C ATOM 894 CD GLU A 57 -14.627 6.502 5.331 1.00 0.00 C ATOM 895 OE1 GLU A 57 -15.852 6.487 5.088 1.00 0.00 O ATOM 896 OE2 GLU A 57 -14.107 5.866 6.271 1.00 0.00 O ATOM 0 H GLU A 57 -13.141 7.911 2.022 1.00 0.00 H new ATOM 0 HA GLU A 57 -13.974 10.454 2.926 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -14.713 9.170 4.927 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -15.240 8.450 3.419 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -13.478 6.765 3.545 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -12.790 7.535 4.961 1.00 0.00 H new ATOM 903 N MET A 58 -11.293 9.181 4.360 1.00 0.00 N ATOM 904 CA MET A 58 -10.152 9.504 5.209 1.00 0.00 C ATOM 905 C MET A 58 -9.288 10.587 4.569 1.00 0.00 C ATOM 906 O MET A 58 -8.591 11.325 5.264 1.00 0.00 O ATOM 907 CB MET A 58 -9.311 8.251 5.466 1.00 0.00 C ATOM 908 CG MET A 58 -9.983 7.248 6.390 1.00 0.00 C ATOM 909 SD MET A 58 -9.770 7.658 8.133 1.00 0.00 S ATOM 910 CE MET A 58 -8.005 7.416 8.324 1.00 0.00 C ATOM 0 H MET A 58 -11.255 8.255 3.935 1.00 0.00 H new ATOM 0 HA MET A 58 -10.532 9.880 6.159 1.00 0.00 H new ATOM 0 HB2 MET A 58 -9.094 7.767 4.514 1.00 0.00 H new ATOM 0 HB3 MET A 58 -8.355 8.547 5.898 1.00 0.00 H new ATOM 0 HG2 MET A 58 -11.047 7.203 6.159 1.00 0.00 H new ATOM 0 HG3 MET A 58 -9.574 6.255 6.202 1.00 0.00 H new ATOM 0 HE1 MET A 58 -7.820 6.700 9.125 1.00 0.00 H new ATOM 0 HE2 MET A 58 -7.587 7.035 7.392 1.00 0.00 H new ATOM 0 HE3 MET A 58 -7.532 8.366 8.571 1.00 0.00 H new ATOM 920 N GLN A 59 -9.340 10.673 3.244 1.00 0.00 N ATOM 921 CA GLN A 59 -8.562 11.665 2.513 1.00 0.00 C ATOM 922 C GLN A 59 -9.245 13.029 2.549 1.00 0.00 C ATOM 923 O GLN A 59 -8.583 14.066 2.570 1.00 0.00 O ATOM 924 CB GLN A 59 -8.361 11.220 1.063 1.00 0.00 C ATOM 925 CG GLN A 59 -7.067 10.456 0.835 1.00 0.00 C ATOM 926 CD GLN A 59 -6.484 10.694 -0.544 1.00 0.00 C ATOM 927 OE1 GLN A 59 -5.852 11.721 -0.794 1.00 0.00 O ATOM 928 NE2 GLN A 59 -6.693 9.744 -1.447 1.00 0.00 N ATOM 0 H GLN A 59 -9.912 10.068 2.655 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.589 11.754 2.997 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.201 10.593 0.764 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -8.373 12.098 0.417 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -6.338 10.751 1.589 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -7.251 9.390 0.969 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -7.223 8.909 -1.196 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -6.324 9.849 -2.392 1.00 0.00 H new ATOM 937 N ARG A 60 -10.574 13.018 2.556 1.00 0.00 N ATOM 938 CA ARG A 60 -11.348 14.253 2.588 1.00 0.00 C ATOM 939 C ARG A 60 -11.381 14.838 3.997 1.00 0.00 C ATOM 940 O ARG A 60 -11.471 16.052 4.174 1.00 0.00 O ATOM 941 CB ARG A 60 -12.773 14.000 2.094 1.00 0.00 C ATOM 942 CG ARG A 60 -13.761 13.706 3.212 1.00 0.00 C ATOM 943 CD ARG A 60 -15.176 13.548 2.677 1.00 0.00 C ATOM 944 NE ARG A 60 -16.147 14.295 3.472 1.00 0.00 N ATOM 945 CZ ARG A 60 -16.334 15.605 3.363 1.00 0.00 C ATOM 946 NH1 ARG A 60 -15.619 16.310 2.497 1.00 0.00 N ATOM 947 NH2 ARG A 60 -17.238 16.213 4.121 1.00 0.00 N ATOM 0 H ARG A 60 -11.137 12.168 2.540 1.00 0.00 H new ATOM 0 HA ARG A 60 -10.865 14.972 1.927 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -13.116 14.872 1.537 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -12.764 13.161 1.398 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -13.464 12.795 3.732 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -13.735 14.514 3.944 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -15.213 13.891 1.643 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -15.446 12.492 2.673 1.00 0.00 H new ATOM 0 HE ARG A 60 -16.713 13.782 4.148 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -14.923 15.846 1.913 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -15.765 17.316 2.415 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -17.790 15.674 4.788 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -17.381 17.219 4.036 1.00 0.00 H new ATOM 961 N SER A 61 -11.310 13.964 4.996 1.00 0.00 N ATOM 962 CA SER A 61 -11.337 14.392 6.389 1.00 0.00 C ATOM 963 C SER A 61 -10.190 15.354 6.684 1.00 0.00 C ATOM 964 O SER A 61 -10.399 16.440 7.226 1.00 0.00 O ATOM 965 CB SER A 61 -11.252 13.180 7.319 1.00 0.00 C ATOM 966 OG SER A 61 -12.519 12.875 7.877 1.00 0.00 O ATOM 0 H SER A 61 -11.233 12.955 4.866 1.00 0.00 H new ATOM 0 HA SER A 61 -12.279 14.911 6.565 1.00 0.00 H new ATOM 0 HB2 SER A 61 -10.878 12.319 6.766 1.00 0.00 H new ATOM 0 HB3 SER A 61 -10.538 13.380 8.118 1.00 0.00 H new ATOM 0 HG SER A 61 -12.438 12.096 8.466 1.00 0.00 H new ATOM 972 N GLY A 62 -8.977 14.947 6.324 1.00 0.00 N ATOM 973 CA GLY A 62 -7.814 15.783 6.558 1.00 0.00 C ATOM 974 C GLY A 62 -6.884 15.204 7.605 1.00 0.00 C ATOM 975 O GLY A 62 -7.065 14.079 8.073 1.00 0.00 O ATOM 0 H GLY A 62 -8.779 14.053 5.874 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -7.268 15.911 5.623 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -8.140 16.774 6.875 1.00 0.00 H new ATOM 979 N PRO A 63 -5.860 15.981 7.988 1.00 0.00 N ATOM 980 CA PRO A 63 -4.877 15.558 8.990 1.00 0.00 C ATOM 981 C PRO A 63 -5.473 15.484 10.392 1.00 0.00 C ATOM 982 O PRO A 63 -5.586 16.497 11.082 1.00 0.00 O ATOM 983 CB PRO A 63 -3.808 16.650 8.920 1.00 0.00 C ATOM 984 CG PRO A 63 -4.525 17.851 8.407 1.00 0.00 C ATOM 985 CD PRO A 63 -5.583 17.332 7.473 1.00 0.00 C ATOM 0 HA PRO A 63 -4.496 14.556 8.791 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -3.371 16.839 9.900 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -2.992 16.363 8.257 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -4.970 18.419 9.224 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -3.841 18.522 7.888 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -6.475 17.958 7.488 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -5.230 17.305 6.442 1.00 0.00 H new ATOM 993 N SER A 64 -5.853 14.280 10.805 1.00 0.00 N ATOM 994 CA SER A 64 -6.441 14.075 12.125 1.00 0.00 C ATOM 995 C SER A 64 -6.011 12.733 12.709 1.00 0.00 C ATOM 996 O SER A 64 -5.750 11.779 11.976 1.00 0.00 O ATOM 997 CB SER A 64 -7.967 14.142 12.042 1.00 0.00 C ATOM 998 OG SER A 64 -8.514 14.751 13.199 1.00 0.00 O ATOM 0 H SER A 64 -5.765 13.431 10.246 1.00 0.00 H new ATOM 0 HA SER A 64 -6.084 14.868 12.782 1.00 0.00 H new ATOM 0 HB2 SER A 64 -8.262 14.705 11.157 1.00 0.00 H new ATOM 0 HB3 SER A 64 -8.373 13.137 11.930 1.00 0.00 H new ATOM 0 HG SER A 64 -9.490 14.784 13.121 1.00 0.00 H new ATOM 1004 N SER A 65 -5.937 12.668 14.034 1.00 0.00 N ATOM 1005 CA SER A 65 -5.534 11.446 14.719 1.00 0.00 C ATOM 1006 C SER A 65 -6.506 11.108 15.847 1.00 0.00 C ATOM 1007 O SER A 65 -6.851 11.965 16.660 1.00 0.00 O ATOM 1008 CB SER A 65 -4.118 11.592 15.278 1.00 0.00 C ATOM 1009 OG SER A 65 -3.192 11.892 14.248 1.00 0.00 O ATOM 0 H SER A 65 -6.151 13.448 14.655 1.00 0.00 H new ATOM 0 HA SER A 65 -5.549 10.632 13.994 1.00 0.00 H new ATOM 0 HB2 SER A 65 -4.100 12.382 16.029 1.00 0.00 H new ATOM 0 HB3 SER A 65 -3.824 10.669 15.778 1.00 0.00 H new ATOM 0 HG SER A 65 -2.294 11.982 14.631 1.00 0.00 H new ATOM 1015 N GLY A 66 -6.943 9.854 15.887 1.00 0.00 N ATOM 1016 CA GLY A 66 -7.871 9.425 16.918 1.00 0.00 C ATOM 1017 C GLY A 66 -9.318 9.564 16.489 1.00 0.00 C ATOM 1018 O GLY A 66 -9.684 10.529 15.819 1.00 0.00 O ATOM 0 H GLY A 66 -6.672 9.127 15.225 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -7.669 8.385 17.174 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -7.704 10.013 17.820 1.00 0.00 H new TER 1022 GLY A 66