USER MOD reduce.3.24.130724 H: found=0, std=0, add=633, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 636 hydrogens (7 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 NoAdj-H: A 15 HIP H2 : A 15 HIP N : A 14 ILE C :(H bumps) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 135:sc= -0.236 (180deg=-1.32!) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0.034 USER MOD Single : A 20 THR OG1 : rot 76:sc= 1.08 USER MOD Single : A 24 GLN : amide:sc= -0.19 K(o=-0.19,f=-0.9) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.0321 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 TYR OH : rot -39:sc= -3.2! USER MOD Single : A 34 ASN : amide:sc= -0.114 X(o=-0.11,f=-0.092) USER MOD Single : A 37 TYR OH : rot 180:sc= -0.831 USER MOD Single : A 38 ASN : amide:sc= -0.296 X(o=-0.3,f=-0.054) USER MOD Single : A 40 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.222) USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.131 USER MOD Single : A 43 ASN : amide:sc= -3.33 K(o=-3.3,f=-13!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 160:sc= -0.13 USER MOD Single : A 48 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot -21:sc= 0.711 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 48:sc= 0.299 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 ASN : amide:sc= -3.84 K(o=-3.8,f=-6.3!) USER MOD Single : A 80 THR OG1 : rot 77:sc= 0.485 USER MOD Single : A 81 MET CE :methyl -175:sc= -0.086 (180deg=-0.0883) USER MOD Single : A 82 LYS NZ :NH3+ -141:sc= 1.01 (180deg=0.138) USER MOD Single : A 83 SER OG : rot -36:sc= 0.165 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 -6.424 -9.248 -9.922 1.00 0.00 N ATOM 2 CA ALA A 2 -6.570 -8.949 -8.469 1.00 0.00 C ATOM 3 C ALA A 2 -5.845 -7.641 -8.135 1.00 0.00 C ATOM 4 O ALA A 2 -6.188 -6.960 -7.187 1.00 0.00 O ATOM 5 CB ALA A 2 -5.968 -10.094 -7.649 1.00 0.00 C ATOM 0 HA ALA A 2 -7.628 -8.845 -8.226 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -6.075 -9.876 -6.586 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -6.489 -11.022 -7.883 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -4.911 -10.200 -7.893 1.00 0.00 H new ATOM 13 N GLN A 3 -4.844 -7.285 -8.902 1.00 0.00 N ATOM 14 CA GLN A 3 -4.096 -6.020 -8.625 1.00 0.00 C ATOM 15 C GLN A 3 -5.041 -4.824 -8.728 1.00 0.00 C ATOM 16 O GLN A 3 -6.036 -4.866 -9.428 1.00 0.00 O ATOM 17 CB GLN A 3 -2.962 -5.856 -9.641 1.00 0.00 C ATOM 18 CG GLN A 3 -3.525 -5.922 -11.064 1.00 0.00 C ATOM 19 CD GLN A 3 -2.543 -6.663 -11.973 1.00 0.00 C ATOM 20 OE1 GLN A 3 -1.366 -6.357 -11.994 1.00 0.00 O ATOM 21 NE2 GLN A 3 -2.977 -7.634 -12.729 1.00 0.00 N ATOM 0 H GLN A 3 -4.513 -7.816 -9.708 1.00 0.00 H new ATOM 0 HA GLN A 3 -3.680 -6.068 -7.618 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -2.456 -4.903 -9.484 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -2.218 -6.639 -9.498 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -4.488 -6.432 -11.061 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -3.698 -4.915 -11.444 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -3.964 -7.891 -12.712 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -2.329 -8.136 -13.337 1.00 0.00 H new ATOM 30 N LYS A 4 -4.733 -3.761 -8.034 1.00 0.00 N ATOM 31 CA LYS A 4 -5.607 -2.551 -8.083 1.00 0.00 C ATOM 32 C LYS A 4 -4.738 -1.292 -8.113 1.00 0.00 C ATOM 33 O LYS A 4 -3.557 -1.336 -7.825 1.00 0.00 O ATOM 34 CB LYS A 4 -6.507 -2.519 -6.847 1.00 0.00 C ATOM 35 CG LYS A 4 -7.747 -1.673 -7.140 1.00 0.00 C ATOM 36 CD LYS A 4 -8.801 -1.916 -6.058 1.00 0.00 C ATOM 37 CE LYS A 4 -10.017 -1.027 -6.322 1.00 0.00 C ATOM 38 NZ LYS A 4 -9.772 0.332 -5.760 1.00 0.00 N ATOM 0 H LYS A 4 -3.912 -3.678 -7.434 1.00 0.00 H new ATOM 0 HA LYS A 4 -6.224 -2.588 -8.981 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -6.801 -3.532 -6.572 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -5.963 -2.104 -5.999 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -7.480 -0.617 -7.171 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.151 -1.929 -8.120 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.098 -2.965 -6.054 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -8.385 -1.698 -5.074 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -10.206 -0.960 -7.393 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -10.906 -1.465 -5.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -10.599 0.936 -5.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -9.612 0.260 -4.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -8.934 0.749 -6.213 1.00 0.00 H new ATOM 52 N THR A 5 -5.319 -0.170 -8.459 1.00 0.00 N ATOM 53 CA THR A 5 -4.538 1.100 -8.511 1.00 0.00 C ATOM 54 C THR A 5 -5.022 2.038 -7.403 1.00 0.00 C ATOM 55 O THR A 5 -6.204 2.291 -7.266 1.00 0.00 O ATOM 56 CB THR A 5 -4.740 1.767 -9.873 1.00 0.00 C ATOM 57 OG1 THR A 5 -4.590 0.796 -10.900 1.00 0.00 O ATOM 58 CG2 THR A 5 -3.701 2.875 -10.061 1.00 0.00 C ATOM 0 H THR A 5 -6.304 -0.081 -8.708 1.00 0.00 H new ATOM 0 HA THR A 5 -3.479 0.885 -8.368 1.00 0.00 H new ATOM 0 HB THR A 5 -5.740 2.198 -9.922 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.721 1.221 -11.773 1.00 0.00 H new ATOM 0 HG21 THR A 5 -3.846 3.349 -11.032 1.00 0.00 H new ATOM 0 HG22 THR A 5 -3.816 3.619 -9.273 1.00 0.00 H new ATOM 0 HG23 THR A 5 -2.700 2.447 -10.013 1.00 0.00 H new ATOM 66 N PHE A 6 -4.115 2.554 -6.612 1.00 0.00 N ATOM 67 CA PHE A 6 -4.512 3.477 -5.508 1.00 0.00 C ATOM 68 C PHE A 6 -3.886 4.852 -5.745 1.00 0.00 C ATOM 69 O PHE A 6 -2.824 4.968 -6.327 1.00 0.00 O ATOM 70 CB PHE A 6 -4.015 2.917 -4.173 1.00 0.00 C ATOM 71 CG PHE A 6 -4.822 1.697 -3.798 1.00 0.00 C ATOM 72 CD1 PHE A 6 -4.472 0.441 -4.310 1.00 0.00 C ATOM 73 CD2 PHE A 6 -5.918 1.820 -2.936 1.00 0.00 C ATOM 74 CE1 PHE A 6 -5.217 -0.691 -3.959 1.00 0.00 C ATOM 75 CE2 PHE A 6 -6.665 0.688 -2.587 1.00 0.00 C ATOM 76 CZ PHE A 6 -6.315 -0.567 -3.097 1.00 0.00 C ATOM 0 H PHE A 6 -3.114 2.374 -6.685 1.00 0.00 H new ATOM 0 HA PHE A 6 -5.598 3.569 -5.484 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -2.959 2.657 -4.248 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -4.102 3.675 -3.395 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -3.627 0.346 -4.976 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -6.188 2.788 -2.540 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -4.946 -1.660 -4.352 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -7.512 0.784 -1.924 1.00 0.00 H new ATOM 0 HZ PHE A 6 -6.891 -1.440 -2.826 1.00 0.00 H new ATOM 86 N LYS A 7 -4.537 5.896 -5.293 1.00 0.00 N ATOM 87 CA LYS A 7 -3.984 7.269 -5.484 1.00 0.00 C ATOM 88 C LYS A 7 -3.386 7.765 -4.167 1.00 0.00 C ATOM 89 O LYS A 7 -4.019 7.714 -3.129 1.00 0.00 O ATOM 90 CB LYS A 7 -5.104 8.216 -5.919 1.00 0.00 C ATOM 91 CG LYS A 7 -4.524 9.326 -6.798 1.00 0.00 C ATOM 92 CD LYS A 7 -4.192 8.762 -8.181 1.00 0.00 C ATOM 93 CE LYS A 7 -5.475 8.644 -9.006 1.00 0.00 C ATOM 94 NZ LYS A 7 -6.094 9.991 -9.158 1.00 0.00 N ATOM 0 H LYS A 7 -5.429 5.854 -4.800 1.00 0.00 H new ATOM 0 HA LYS A 7 -3.210 7.244 -6.251 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -5.867 7.665 -6.468 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -5.590 8.647 -5.044 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -5.239 10.143 -6.889 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -3.626 9.738 -6.337 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -3.479 9.412 -8.689 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -3.719 7.785 -8.083 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -5.252 8.222 -9.986 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -6.173 7.964 -8.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -6.389 10.128 -10.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -6.924 10.064 -8.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -5.402 10.722 -8.899 1.00 0.00 H new ATOM 108 N VAL A 8 -2.172 8.243 -4.208 1.00 0.00 N ATOM 109 CA VAL A 8 -1.516 8.748 -2.965 1.00 0.00 C ATOM 110 C VAL A 8 -1.802 10.242 -2.806 1.00 0.00 C ATOM 111 O VAL A 8 -1.425 11.045 -3.640 1.00 0.00 O ATOM 112 CB VAL A 8 -0.003 8.527 -3.052 1.00 0.00 C ATOM 113 CG1 VAL A 8 0.638 8.858 -1.703 1.00 0.00 C ATOM 114 CG2 VAL A 8 0.284 7.064 -3.402 1.00 0.00 C ATOM 0 H VAL A 8 -1.603 8.306 -5.052 1.00 0.00 H new ATOM 0 HA VAL A 8 -1.912 8.207 -2.106 1.00 0.00 H new ATOM 0 HB VAL A 8 0.412 9.174 -3.825 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.715 8.701 -1.764 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.437 9.899 -1.450 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.220 8.210 -0.933 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.361 6.909 -3.463 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.132 6.417 -2.630 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.172 6.823 -4.362 1.00 0.00 H new ATOM 124 N THR A 9 -2.463 10.619 -1.741 1.00 0.00 N ATOM 125 CA THR A 9 -2.774 12.063 -1.518 1.00 0.00 C ATOM 126 C THR A 9 -2.601 12.407 -0.035 1.00 0.00 C ATOM 127 O THR A 9 -3.199 13.343 0.463 1.00 0.00 O ATOM 128 CB THR A 9 -4.218 12.342 -1.942 1.00 0.00 C ATOM 129 OG1 THR A 9 -4.442 11.805 -3.238 1.00 0.00 O ATOM 130 CG2 THR A 9 -4.462 13.852 -1.964 1.00 0.00 C ATOM 0 H THR A 9 -2.801 9.987 -1.015 1.00 0.00 H new ATOM 0 HA THR A 9 -2.094 12.675 -2.110 1.00 0.00 H new ATOM 0 HB THR A 9 -4.902 11.876 -1.233 1.00 0.00 H new ATOM 0 HG1 THR A 9 -5.367 11.982 -3.510 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.490 14.050 -2.266 1.00 0.00 H new ATOM 0 HG22 THR A 9 -4.290 14.263 -0.969 1.00 0.00 H new ATOM 0 HG23 THR A 9 -3.779 14.321 -2.673 1.00 0.00 H new ATOM 138 N ALA A 10 -1.789 11.659 0.673 1.00 0.00 N ATOM 139 CA ALA A 10 -1.575 11.941 2.121 1.00 0.00 C ATOM 140 C ALA A 10 -0.622 13.129 2.274 1.00 0.00 C ATOM 141 O ALA A 10 0.245 13.347 1.450 1.00 0.00 O ATOM 142 CB ALA A 10 -0.966 10.710 2.795 1.00 0.00 C ATOM 0 H ALA A 10 -1.266 10.864 0.306 1.00 0.00 H new ATOM 0 HA ALA A 10 -2.530 12.178 2.590 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -0.809 10.915 3.854 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -1.643 9.863 2.686 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -0.011 10.473 2.326 1.00 0.00 H new ATOM 148 N ASP A 11 -0.778 13.894 3.324 1.00 0.00 N ATOM 149 CA ASP A 11 0.117 15.069 3.538 1.00 0.00 C ATOM 150 C ASP A 11 1.528 14.582 3.871 1.00 0.00 C ATOM 151 O ASP A 11 2.505 15.077 3.340 1.00 0.00 O ATOM 152 CB ASP A 11 -0.416 15.915 4.697 1.00 0.00 C ATOM 153 CG ASP A 11 -0.019 17.376 4.487 1.00 0.00 C ATOM 154 OD1 ASP A 11 -0.723 18.064 3.767 1.00 0.00 O ATOM 155 OD2 ASP A 11 0.984 17.784 5.051 1.00 0.00 O ATOM 0 H ASP A 11 -1.488 13.755 4.043 1.00 0.00 H new ATOM 0 HA ASP A 11 0.145 15.672 2.631 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -1.501 15.827 4.757 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -0.014 15.550 5.642 1.00 0.00 H new ATOM 160 N SER A 12 1.640 13.617 4.748 1.00 0.00 N ATOM 161 CA SER A 12 2.984 13.090 5.123 1.00 0.00 C ATOM 162 C SER A 12 3.513 12.190 4.005 1.00 0.00 C ATOM 163 O SER A 12 4.704 12.105 3.777 1.00 0.00 O ATOM 164 CB SER A 12 2.872 12.282 6.416 1.00 0.00 C ATOM 165 OG SER A 12 1.681 11.507 6.382 1.00 0.00 O ATOM 0 H SER A 12 0.854 13.171 5.221 1.00 0.00 H new ATOM 0 HA SER A 12 3.670 13.924 5.272 1.00 0.00 H new ATOM 0 HB2 SER A 12 3.740 11.632 6.529 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.860 12.951 7.277 1.00 0.00 H new ATOM 0 HG SER A 12 1.606 10.986 7.209 1.00 0.00 H new ATOM 171 N GLY A 13 2.632 11.517 3.308 1.00 0.00 N ATOM 172 CA GLY A 13 3.073 10.618 2.202 1.00 0.00 C ATOM 173 C GLY A 13 3.055 9.166 2.685 1.00 0.00 C ATOM 174 O GLY A 13 2.245 8.789 3.511 1.00 0.00 O ATOM 0 H GLY A 13 1.624 11.553 3.459 1.00 0.00 H new ATOM 0 HA2 GLY A 13 2.415 10.734 1.341 1.00 0.00 H new ATOM 0 HA3 GLY A 13 4.076 10.891 1.875 1.00 0.00 H new ATOM 178 N ILE A 14 3.943 8.350 2.175 1.00 0.00 N ATOM 179 CA ILE A 14 3.983 6.918 2.600 1.00 0.00 C ATOM 180 C ILE A 14 5.285 6.646 3.357 1.00 0.00 C ATOM 181 O ILE A 14 6.232 6.111 2.811 1.00 0.00 O ATOM 182 CB ILE A 14 3.906 6.016 1.367 1.00 0.00 C ATOM 183 CG1 ILE A 14 2.674 6.392 0.541 1.00 0.00 C ATOM 184 CG2 ILE A 14 3.796 4.555 1.809 1.00 0.00 C ATOM 185 CD1 ILE A 14 2.669 5.596 -0.766 1.00 0.00 C ATOM 0 H ILE A 14 4.643 8.614 1.482 1.00 0.00 H new ATOM 0 HA ILE A 14 3.135 6.709 3.253 1.00 0.00 H new ATOM 0 HB ILE A 14 4.804 6.146 0.764 1.00 0.00 H new ATOM 0 HG12 ILE A 14 1.767 6.185 1.108 1.00 0.00 H new ATOM 0 HG13 ILE A 14 2.679 7.461 0.327 1.00 0.00 H new ATOM 0 HG21 ILE A 14 3.741 3.912 0.930 1.00 0.00 H new ATOM 0 HG22 ILE A 14 4.671 4.287 2.401 1.00 0.00 H new ATOM 0 HG23 ILE A 14 2.897 4.424 2.411 1.00 0.00 H new ATOM 0 HD11 ILE A 14 1.791 5.865 -1.353 1.00 0.00 H new ATOM 0 HD12 ILE A 14 3.570 5.825 -1.335 1.00 0.00 H new ATOM 0 HD13 ILE A 14 2.643 4.530 -0.542 1.00 0.00 H new HETATM 197 N HIP A 15 5.335 7.013 4.612 1.00 0.00 N HETATM 198 CA HIP A 15 6.567 6.784 5.417 1.00 0.00 C HETATM 199 CB HIP A 15 6.921 8.055 6.215 1.00 0.00 C HETATM 200 CG HIP A 15 5.807 8.494 7.134 1.00 0.00 C HETATM 201 CD2 HIP A 15 4.555 8.987 6.874 1.00 0.00 C HETATM 202 NE2 HIP A 15 3.921 9.308 8.063 1.00 0.00 N HETATM 203 CE1 HIP A 15 4.791 9.008 9.023 1.00 0.00 C HETATM 204 ND1 HIP A 15 5.945 8.514 8.523 1.00 0.00 N HETATM 205 P HIP A 15 7.232 8.386 9.269 1.00 0.00 P HETATM 206 O1P HIP A 15 8.314 9.091 8.546 1.00 0.00 O HETATM 207 O2P HIP A 15 7.578 6.958 9.444 1.00 0.00 O HETATM 208 O3P HIP A 15 6.931 9.037 10.567 1.00 0.00 O HETATM 209 C HIP A 15 6.374 5.562 6.331 1.00 0.00 C HETATM 210 O HIP A 15 5.506 4.743 6.100 1.00 0.00 O HETATM 0 HE2 HIP A 15 2.984 9.694 8.178 1.00 0.00 H new HETATM 0 HE1 HIP A 15 4.596 9.144 10.087 1.00 0.00 H new HETATM 0 HD2 HIP A 15 4.123 9.108 5.881 1.00 0.00 H new HETATM 0 HB3 HIP A 15 7.820 7.871 6.803 1.00 0.00 H new HETATM 0 HB2 HIP A 15 7.153 8.862 5.521 1.00 0.00 H new HETATM 0 HA HIP A 15 7.406 6.571 4.754 1.00 0.00 H new HETATM 0 H HIP A 15 4.862 7.916 4.649 1.00 0.00 H new ATOM 218 N ALA A 16 7.204 5.405 7.329 1.00 0.00 N ATOM 219 CA ALA A 16 7.113 4.208 8.228 1.00 0.00 C ATOM 220 C ALA A 16 5.733 4.063 8.897 1.00 0.00 C ATOM 221 O ALA A 16 5.224 2.966 9.008 1.00 0.00 O ATOM 222 CB ALA A 16 8.187 4.312 9.312 1.00 0.00 C ATOM 0 H ALA A 16 7.950 6.060 7.565 1.00 0.00 H new ATOM 0 HA ALA A 16 7.265 3.325 7.607 1.00 0.00 H new ATOM 0 HB1 ALA A 16 8.126 3.444 9.969 1.00 0.00 H new ATOM 0 HB2 ALA A 16 9.172 4.346 8.846 1.00 0.00 H new ATOM 0 HB3 ALA A 16 8.030 5.220 9.894 1.00 0.00 H new ATOM 228 N ARG A 17 5.138 5.132 9.379 1.00 0.00 N ATOM 229 CA ARG A 17 3.809 5.001 10.074 1.00 0.00 C ATOM 230 C ARG A 17 2.765 4.326 9.155 1.00 0.00 C ATOM 231 O ARG A 17 2.213 3.306 9.526 1.00 0.00 O ATOM 232 CB ARG A 17 3.304 6.380 10.518 1.00 0.00 C ATOM 233 CG ARG A 17 2.879 6.327 11.989 1.00 0.00 C ATOM 234 CD ARG A 17 2.380 7.704 12.430 1.00 0.00 C ATOM 235 NE ARG A 17 2.135 7.693 13.900 1.00 0.00 N ATOM 236 CZ ARG A 17 2.943 8.333 14.700 1.00 0.00 C ATOM 237 NH1 ARG A 17 2.979 9.638 14.683 1.00 0.00 N ATOM 238 NH2 ARG A 17 3.713 7.669 15.517 1.00 0.00 N ATOM 0 H ARG A 17 5.509 6.081 9.323 1.00 0.00 H new ATOM 0 HA ARG A 17 3.948 4.371 10.953 1.00 0.00 H new ATOM 0 HB2 ARG A 17 4.088 7.125 10.383 1.00 0.00 H new ATOM 0 HB3 ARG A 17 2.462 6.686 9.897 1.00 0.00 H new ATOM 0 HG2 ARG A 17 2.093 5.584 12.124 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.720 6.018 12.610 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.116 8.468 12.178 1.00 0.00 H new ATOM 0 HD3 ARG A 17 1.463 7.958 11.899 1.00 0.00 H new ATOM 0 HE ARG A 17 1.336 7.185 14.280 1.00 0.00 H new ATOM 0 HH11 ARG A 17 2.376 10.157 14.045 1.00 0.00 H new ATOM 0 HH12 ARG A 17 3.610 10.139 15.308 1.00 0.00 H new ATOM 0 HH21 ARG A 17 3.683 6.650 15.530 1.00 0.00 H new ATOM 0 HH22 ARG A 17 4.345 8.169 16.142 1.00 0.00 H new ATOM 252 N PRO A 18 2.511 4.885 7.982 1.00 0.00 N ATOM 253 CA PRO A 18 1.531 4.292 7.052 1.00 0.00 C ATOM 254 C PRO A 18 2.065 2.978 6.466 1.00 0.00 C ATOM 255 O PRO A 18 1.311 2.170 5.957 1.00 0.00 O ATOM 256 CB PRO A 18 1.351 5.363 5.971 1.00 0.00 C ATOM 257 CG PRO A 18 2.611 6.251 6.033 1.00 0.00 C ATOM 258 CD PRO A 18 3.163 6.114 7.462 1.00 0.00 C ATOM 0 HA PRO A 18 0.588 4.034 7.534 1.00 0.00 H new ATOM 0 HB2 PRO A 18 1.243 4.908 4.986 1.00 0.00 H new ATOM 0 HB3 PRO A 18 0.451 5.951 6.151 1.00 0.00 H new ATOM 0 HG2 PRO A 18 3.350 5.931 5.298 1.00 0.00 H new ATOM 0 HG3 PRO A 18 2.367 7.289 5.808 1.00 0.00 H new ATOM 0 HD2 PRO A 18 4.249 6.021 7.463 1.00 0.00 H new ATOM 0 HD3 PRO A 18 2.917 6.984 8.070 1.00 0.00 H new ATOM 266 N ALA A 19 3.353 2.754 6.550 1.00 0.00 N ATOM 267 CA ALA A 19 3.933 1.488 6.019 1.00 0.00 C ATOM 268 C ALA A 19 3.728 0.362 7.040 1.00 0.00 C ATOM 269 O ALA A 19 3.745 -0.805 6.696 1.00 0.00 O ATOM 270 CB ALA A 19 5.430 1.682 5.768 1.00 0.00 C ATOM 0 H ALA A 19 4.027 3.397 6.965 1.00 0.00 H new ATOM 0 HA ALA A 19 3.437 1.224 5.085 1.00 0.00 H new ATOM 0 HB1 ALA A 19 5.857 0.757 5.380 1.00 0.00 H new ATOM 0 HB2 ALA A 19 5.577 2.482 5.042 1.00 0.00 H new ATOM 0 HB3 ALA A 19 5.925 1.945 6.703 1.00 0.00 H new ATOM 276 N THR A 20 3.532 0.703 8.293 1.00 0.00 N ATOM 277 CA THR A 20 3.321 -0.338 9.338 1.00 0.00 C ATOM 278 C THR A 20 1.852 -0.757 9.341 1.00 0.00 C ATOM 279 O THR A 20 1.520 -1.890 9.634 1.00 0.00 O ATOM 280 CB THR A 20 3.688 0.234 10.708 1.00 0.00 C ATOM 281 OG1 THR A 20 4.840 1.058 10.585 1.00 0.00 O ATOM 282 CG2 THR A 20 3.978 -0.910 11.678 1.00 0.00 C ATOM 0 H THR A 20 3.510 1.664 8.633 1.00 0.00 H new ATOM 0 HA THR A 20 3.949 -1.203 9.125 1.00 0.00 H new ATOM 0 HB THR A 20 2.857 0.828 11.088 1.00 0.00 H new ATOM 0 HG1 THR A 20 4.589 1.912 10.174 1.00 0.00 H new ATOM 0 HG21 THR A 20 4.240 -0.502 12.654 1.00 0.00 H new ATOM 0 HG22 THR A 20 3.093 -1.540 11.773 1.00 0.00 H new ATOM 0 HG23 THR A 20 4.808 -1.506 11.300 1.00 0.00 H new ATOM 290 N VAL A 21 0.972 0.152 9.010 1.00 0.00 N ATOM 291 CA VAL A 21 -0.485 -0.177 8.981 1.00 0.00 C ATOM 292 C VAL A 21 -0.759 -1.103 7.804 1.00 0.00 C ATOM 293 O VAL A 21 -1.551 -2.023 7.883 1.00 0.00 O ATOM 294 CB VAL A 21 -1.293 1.104 8.793 1.00 0.00 C ATOM 295 CG1 VAL A 21 -2.781 0.804 8.985 1.00 0.00 C ATOM 296 CG2 VAL A 21 -0.849 2.157 9.813 1.00 0.00 C ATOM 0 H VAL A 21 1.201 1.113 8.757 1.00 0.00 H new ATOM 0 HA VAL A 21 -0.769 -0.659 9.917 1.00 0.00 H new ATOM 0 HB VAL A 21 -1.124 1.487 7.787 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -3.357 1.720 8.851 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -3.100 0.063 8.252 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -2.947 0.415 9.990 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -1.431 3.068 9.672 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -1.009 1.777 10.822 1.00 0.00 H new ATOM 0 HG23 VAL A 21 0.209 2.377 9.672 1.00 0.00 H new ATOM 306 N LEU A 22 -0.109 -0.844 6.707 1.00 0.00 N ATOM 307 CA LEU A 22 -0.307 -1.666 5.489 1.00 0.00 C ATOM 308 C LEU A 22 0.351 -3.037 5.654 1.00 0.00 C ATOM 309 O LEU A 22 -0.259 -4.054 5.400 1.00 0.00 O ATOM 310 CB LEU A 22 0.327 -0.931 4.314 1.00 0.00 C ATOM 311 CG LEU A 22 -0.440 0.365 4.053 1.00 0.00 C ATOM 312 CD1 LEU A 22 0.285 1.171 2.975 1.00 0.00 C ATOM 313 CD2 LEU A 22 -1.855 0.033 3.573 1.00 0.00 C ATOM 0 H LEU A 22 0.563 -0.083 6.603 1.00 0.00 H new ATOM 0 HA LEU A 22 -1.372 -1.819 5.317 1.00 0.00 H new ATOM 0 HB2 LEU A 22 1.372 -0.711 4.530 1.00 0.00 H new ATOM 0 HB3 LEU A 22 0.311 -1.561 3.425 1.00 0.00 H new ATOM 0 HG LEU A 22 -0.496 0.948 4.972 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -0.259 2.097 2.785 1.00 0.00 H new ATOM 0 HD12 LEU A 22 1.294 1.406 3.313 1.00 0.00 H new ATOM 0 HD13 LEU A 22 0.337 0.586 2.057 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -2.402 0.957 3.387 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -1.800 -0.548 2.652 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -2.372 -0.547 4.338 1.00 0.00 H new ATOM 325 N VAL A 23 1.593 -3.073 6.068 1.00 0.00 N ATOM 326 CA VAL A 23 2.297 -4.383 6.238 1.00 0.00 C ATOM 327 C VAL A 23 1.524 -5.274 7.223 1.00 0.00 C ATOM 328 O VAL A 23 1.565 -6.487 7.135 1.00 0.00 O ATOM 329 CB VAL A 23 3.721 -4.129 6.758 1.00 0.00 C ATOM 330 CG1 VAL A 23 3.662 -3.441 8.124 1.00 0.00 C ATOM 331 CG2 VAL A 23 4.470 -5.460 6.890 1.00 0.00 C ATOM 0 H VAL A 23 2.151 -2.251 6.296 1.00 0.00 H new ATOM 0 HA VAL A 23 2.349 -4.894 5.277 1.00 0.00 H new ATOM 0 HB VAL A 23 4.246 -3.485 6.052 1.00 0.00 H new ATOM 0 HG11 VAL A 23 4.675 -3.264 8.486 1.00 0.00 H new ATOM 0 HG12 VAL A 23 3.139 -2.489 8.030 1.00 0.00 H new ATOM 0 HG13 VAL A 23 3.130 -4.079 8.830 1.00 0.00 H new ATOM 0 HG21 VAL A 23 5.479 -5.275 7.259 1.00 0.00 H new ATOM 0 HG22 VAL A 23 3.941 -6.107 7.589 1.00 0.00 H new ATOM 0 HG23 VAL A 23 4.523 -5.946 5.916 1.00 0.00 H new ATOM 341 N GLN A 24 0.828 -4.680 8.159 1.00 0.00 N ATOM 342 CA GLN A 24 0.057 -5.486 9.152 1.00 0.00 C ATOM 343 C GLN A 24 -1.133 -6.159 8.463 1.00 0.00 C ATOM 344 O GLN A 24 -1.422 -7.317 8.701 1.00 0.00 O ATOM 345 CB GLN A 24 -0.452 -4.570 10.269 1.00 0.00 C ATOM 346 CG GLN A 24 0.687 -4.262 11.255 1.00 0.00 C ATOM 347 CD GLN A 24 0.337 -4.803 12.645 1.00 0.00 C ATOM 348 OE1 GLN A 24 -0.331 -5.811 12.768 1.00 0.00 O ATOM 349 NE2 GLN A 24 0.763 -4.171 13.704 1.00 0.00 N ATOM 0 H GLN A 24 0.761 -3.669 8.278 1.00 0.00 H new ATOM 0 HA GLN A 24 0.708 -6.252 9.575 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -0.837 -3.643 9.844 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -1.279 -5.048 10.794 1.00 0.00 H new ATOM 0 HG2 GLN A 24 1.615 -4.712 10.903 1.00 0.00 H new ATOM 0 HG3 GLN A 24 0.854 -3.186 11.306 1.00 0.00 H new ATOM 0 HE21 GLN A 24 1.324 -3.325 13.602 1.00 0.00 H new ATOM 0 HE22 GLN A 24 0.535 -4.523 14.634 1.00 0.00 H new ATOM 358 N THR A 25 -1.827 -5.441 7.616 1.00 0.00 N ATOM 359 CA THR A 25 -3.005 -6.032 6.912 1.00 0.00 C ATOM 360 C THR A 25 -2.542 -7.136 5.955 1.00 0.00 C ATOM 361 O THR A 25 -2.944 -8.277 6.073 1.00 0.00 O ATOM 362 CB THR A 25 -3.723 -4.939 6.119 1.00 0.00 C ATOM 363 OG1 THR A 25 -3.659 -3.715 6.839 1.00 0.00 O ATOM 364 CG2 THR A 25 -5.187 -5.332 5.910 1.00 0.00 C ATOM 0 H THR A 25 -1.628 -4.469 7.381 1.00 0.00 H new ATOM 0 HA THR A 25 -3.686 -6.459 7.648 1.00 0.00 H new ATOM 0 HB THR A 25 -3.240 -4.818 5.149 1.00 0.00 H new ATOM 0 HG1 THR A 25 -4.117 -3.013 6.332 1.00 0.00 H new ATOM 0 HG21 THR A 25 -5.696 -4.551 5.345 1.00 0.00 H new ATOM 0 HG22 THR A 25 -5.237 -6.271 5.358 1.00 0.00 H new ATOM 0 HG23 THR A 25 -5.673 -5.454 6.878 1.00 0.00 H new ATOM 372 N ALA A 26 -1.708 -6.799 5.005 1.00 0.00 N ATOM 373 CA ALA A 26 -1.216 -7.815 4.025 1.00 0.00 C ATOM 374 C ALA A 26 -0.482 -8.947 4.753 1.00 0.00 C ATOM 375 O ALA A 26 -0.377 -10.047 4.246 1.00 0.00 O ATOM 376 CB ALA A 26 -0.261 -7.143 3.036 1.00 0.00 C ATOM 0 H ALA A 26 -1.344 -5.857 4.865 1.00 0.00 H new ATOM 0 HA ALA A 26 -2.069 -8.234 3.491 1.00 0.00 H new ATOM 0 HB1 ALA A 26 0.100 -7.881 2.320 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -0.786 -6.349 2.505 1.00 0.00 H new ATOM 0 HB3 ALA A 26 0.585 -6.719 3.578 1.00 0.00 H new ATOM 382 N SER A 27 0.027 -8.688 5.933 1.00 0.00 N ATOM 383 CA SER A 27 0.755 -9.753 6.689 1.00 0.00 C ATOM 384 C SER A 27 -0.201 -10.912 6.984 1.00 0.00 C ATOM 385 O SER A 27 0.178 -12.067 6.944 1.00 0.00 O ATOM 386 CB SER A 27 1.280 -9.176 8.006 1.00 0.00 C ATOM 387 OG SER A 27 1.679 -10.239 8.860 1.00 0.00 O ATOM 0 H SER A 27 -0.031 -7.785 6.405 1.00 0.00 H new ATOM 0 HA SER A 27 1.592 -10.115 6.092 1.00 0.00 H new ATOM 0 HB2 SER A 27 2.123 -8.512 7.815 1.00 0.00 H new ATOM 0 HB3 SER A 27 0.507 -8.578 8.488 1.00 0.00 H new ATOM 0 HG SER A 27 2.017 -9.872 9.703 1.00 0.00 H new ATOM 393 N LYS A 28 -1.437 -10.604 7.278 1.00 0.00 N ATOM 394 CA LYS A 28 -2.433 -11.674 7.578 1.00 0.00 C ATOM 395 C LYS A 28 -2.848 -12.388 6.285 1.00 0.00 C ATOM 396 O LYS A 28 -3.344 -13.499 6.321 1.00 0.00 O ATOM 397 CB LYS A 28 -3.667 -11.047 8.233 1.00 0.00 C ATOM 398 CG LYS A 28 -3.369 -10.750 9.704 1.00 0.00 C ATOM 399 CD LYS A 28 -4.160 -9.516 10.146 1.00 0.00 C ATOM 400 CE LYS A 28 -3.967 -9.299 11.647 1.00 0.00 C ATOM 401 NZ LYS A 28 -5.076 -8.453 12.174 1.00 0.00 N ATOM 0 H LYS A 28 -1.801 -9.652 7.323 1.00 0.00 H new ATOM 0 HA LYS A 28 -1.984 -12.401 8.255 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -3.940 -10.128 7.714 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -4.518 -11.724 8.153 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -3.638 -11.608 10.321 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -2.301 -10.580 9.843 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -3.824 -8.638 9.594 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -5.218 -9.648 9.920 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -3.950 -10.258 12.165 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -3.007 -8.818 11.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -4.945 -8.305 13.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -5.072 -7.534 11.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -5.985 -8.929 12.007 1.00 0.00 H new ATOM 415 N TYR A 29 -2.656 -11.764 5.146 1.00 0.00 N ATOM 416 CA TYR A 29 -3.048 -12.415 3.859 1.00 0.00 C ATOM 417 C TYR A 29 -1.876 -13.236 3.322 1.00 0.00 C ATOM 418 O TYR A 29 -0.770 -12.749 3.190 1.00 0.00 O ATOM 419 CB TYR A 29 -3.437 -11.346 2.834 1.00 0.00 C ATOM 420 CG TYR A 29 -4.734 -10.702 3.260 1.00 0.00 C ATOM 421 CD1 TYR A 29 -5.952 -11.343 2.999 1.00 0.00 C ATOM 422 CD2 TYR A 29 -4.721 -9.469 3.920 1.00 0.00 C ATOM 423 CE1 TYR A 29 -7.154 -10.750 3.398 1.00 0.00 C ATOM 424 CE2 TYR A 29 -5.924 -8.876 4.320 1.00 0.00 C ATOM 425 CZ TYR A 29 -7.140 -9.517 4.060 1.00 0.00 C ATOM 426 OH TYR A 29 -8.326 -8.932 4.455 1.00 0.00 O ATOM 0 H TYR A 29 -2.246 -10.835 5.054 1.00 0.00 H new ATOM 0 HA TYR A 29 -3.900 -13.071 4.035 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -2.651 -10.594 2.758 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -3.546 -11.794 1.846 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -5.963 -12.295 2.490 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -3.782 -8.974 4.121 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -8.093 -11.243 3.195 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -5.914 -7.924 4.829 1.00 0.00 H new ATOM 0 HH TYR A 29 -9.006 -9.072 3.764 1.00 0.00 H new ATOM 436 N ASP A 30 -2.119 -14.483 3.010 1.00 0.00 N ATOM 437 CA ASP A 30 -1.033 -15.357 2.478 1.00 0.00 C ATOM 438 C ASP A 30 -0.656 -14.909 1.063 1.00 0.00 C ATOM 439 O ASP A 30 0.448 -15.140 0.607 1.00 0.00 O ATOM 440 CB ASP A 30 -1.520 -16.807 2.439 1.00 0.00 C ATOM 441 CG ASP A 30 -1.795 -17.293 3.862 1.00 0.00 C ATOM 442 OD1 ASP A 30 -0.869 -17.784 4.488 1.00 0.00 O ATOM 443 OD2 ASP A 30 -2.924 -17.166 4.304 1.00 0.00 O ATOM 0 H ASP A 30 -3.029 -14.935 3.102 1.00 0.00 H new ATOM 0 HA ASP A 30 -0.159 -15.281 3.126 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -2.426 -16.881 1.837 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -0.770 -17.441 1.966 1.00 0.00 H new ATOM 448 N ALA A 31 -1.564 -14.269 0.365 1.00 0.00 N ATOM 449 CA ALA A 31 -1.264 -13.805 -1.023 1.00 0.00 C ATOM 450 C ALA A 31 -0.060 -12.857 -1.006 1.00 0.00 C ATOM 451 O ALA A 31 0.136 -12.106 -0.068 1.00 0.00 O ATOM 452 CB ALA A 31 -2.482 -13.069 -1.587 1.00 0.00 C ATOM 0 H ALA A 31 -2.502 -14.048 0.700 1.00 0.00 H new ATOM 0 HA ALA A 31 -1.033 -14.668 -1.648 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -2.265 -12.730 -2.600 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -3.338 -13.743 -1.606 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -2.711 -12.209 -0.957 1.00 0.00 H new ATOM 458 N ASP A 32 0.744 -12.893 -2.036 1.00 0.00 N ATOM 459 CA ASP A 32 1.940 -12.004 -2.093 1.00 0.00 C ATOM 460 C ASP A 32 1.562 -10.679 -2.756 1.00 0.00 C ATOM 461 O ASP A 32 1.562 -10.558 -3.966 1.00 0.00 O ATOM 462 CB ASP A 32 3.040 -12.683 -2.911 1.00 0.00 C ATOM 463 CG ASP A 32 3.682 -13.797 -2.082 1.00 0.00 C ATOM 464 OD1 ASP A 32 3.192 -14.913 -2.147 1.00 0.00 O ATOM 465 OD2 ASP A 32 4.650 -13.516 -1.396 1.00 0.00 O ATOM 0 H ASP A 32 0.622 -13.503 -2.844 1.00 0.00 H new ATOM 0 HA ASP A 32 2.299 -11.815 -1.081 1.00 0.00 H new ATOM 0 HB2 ASP A 32 2.623 -13.094 -3.830 1.00 0.00 H new ATOM 0 HB3 ASP A 32 3.794 -11.952 -3.203 1.00 0.00 H new ATOM 470 N VAL A 33 1.243 -9.684 -1.968 1.00 0.00 N ATOM 471 CA VAL A 33 0.866 -8.359 -2.538 1.00 0.00 C ATOM 472 C VAL A 33 2.128 -7.503 -2.692 1.00 0.00 C ATOM 473 O VAL A 33 3.027 -7.560 -1.873 1.00 0.00 O ATOM 474 CB VAL A 33 -0.137 -7.668 -1.603 1.00 0.00 C ATOM 475 CG1 VAL A 33 -1.415 -8.519 -1.487 1.00 0.00 C ATOM 476 CG2 VAL A 33 0.487 -7.504 -0.214 1.00 0.00 C ATOM 0 H VAL A 33 1.228 -9.735 -0.949 1.00 0.00 H new ATOM 0 HA VAL A 33 0.402 -8.490 -3.515 1.00 0.00 H new ATOM 0 HB VAL A 33 -0.389 -6.689 -2.011 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -2.123 -8.024 -0.822 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.864 -8.637 -2.473 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -1.164 -9.500 -1.083 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -0.225 -7.013 0.449 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.742 -8.484 0.188 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.389 -6.897 -0.290 1.00 0.00 H new ATOM 486 N ASN A 34 2.210 -6.724 -3.743 1.00 0.00 N ATOM 487 CA ASN A 34 3.422 -5.878 -3.958 1.00 0.00 C ATOM 488 C ASN A 34 3.014 -4.446 -4.308 1.00 0.00 C ATOM 489 O ASN A 34 2.198 -4.217 -5.181 1.00 0.00 O ATOM 490 CB ASN A 34 4.247 -6.461 -5.107 1.00 0.00 C ATOM 491 CG ASN A 34 4.564 -7.929 -4.815 1.00 0.00 C ATOM 492 OD1 ASN A 34 3.848 -8.814 -5.242 1.00 0.00 O ATOM 493 ND2 ASN A 34 5.614 -8.229 -4.100 1.00 0.00 N ATOM 0 H ASN A 34 1.490 -6.638 -4.460 1.00 0.00 H new ATOM 0 HA ASN A 34 4.013 -5.866 -3.042 1.00 0.00 H new ATOM 0 HB2 ASN A 34 3.696 -6.376 -6.044 1.00 0.00 H new ATOM 0 HB3 ASN A 34 5.171 -5.896 -5.229 1.00 0.00 H new ATOM 0 HD21 ASN A 34 5.833 -9.205 -3.900 1.00 0.00 H new ATOM 0 HD22 ASN A 34 6.216 -7.487 -3.741 1.00 0.00 H new ATOM 500 N LEU A 35 3.591 -3.482 -3.637 1.00 0.00 N ATOM 501 CA LEU A 35 3.262 -2.055 -3.924 1.00 0.00 C ATOM 502 C LEU A 35 4.216 -1.538 -5.006 1.00 0.00 C ATOM 503 O LEU A 35 5.395 -1.841 -4.995 1.00 0.00 O ATOM 504 CB LEU A 35 3.436 -1.226 -2.650 1.00 0.00 C ATOM 505 CG LEU A 35 2.470 -0.041 -2.671 1.00 0.00 C ATOM 506 CD1 LEU A 35 2.348 0.543 -1.262 1.00 0.00 C ATOM 507 CD2 LEU A 35 3.002 1.034 -3.624 1.00 0.00 C ATOM 0 H LEU A 35 4.280 -3.624 -2.898 1.00 0.00 H new ATOM 0 HA LEU A 35 2.231 -1.972 -4.268 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.248 -1.845 -1.773 1.00 0.00 H new ATOM 0 HB3 LEU A 35 4.463 -0.869 -2.574 1.00 0.00 H new ATOM 0 HG LEU A 35 1.490 -0.377 -3.011 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.659 1.388 -1.277 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.970 -0.221 -0.583 1.00 0.00 H new ATOM 0 HD13 LEU A 35 3.327 0.879 -0.921 1.00 0.00 H new ATOM 0 HD21 LEU A 35 2.314 1.879 -3.640 1.00 0.00 H new ATOM 0 HD22 LEU A 35 3.981 1.370 -3.283 1.00 0.00 H new ATOM 0 HD23 LEU A 35 3.090 0.619 -4.628 1.00 0.00 H new ATOM 519 N GLU A 36 3.716 -0.769 -5.940 1.00 0.00 N ATOM 520 CA GLU A 36 4.593 -0.240 -7.027 1.00 0.00 C ATOM 521 C GLU A 36 4.706 1.282 -6.909 1.00 0.00 C ATOM 522 O GLU A 36 3.740 1.999 -7.090 1.00 0.00 O ATOM 523 CB GLU A 36 3.990 -0.602 -8.387 1.00 0.00 C ATOM 524 CG GLU A 36 4.956 -0.199 -9.503 1.00 0.00 C ATOM 525 CD GLU A 36 4.162 0.258 -10.727 1.00 0.00 C ATOM 526 OE1 GLU A 36 3.209 -0.419 -11.078 1.00 0.00 O ATOM 527 OE2 GLU A 36 4.522 1.276 -11.296 1.00 0.00 O ATOM 0 H GLU A 36 2.738 -0.485 -5.996 1.00 0.00 H new ATOM 0 HA GLU A 36 5.585 -0.682 -6.936 1.00 0.00 H new ATOM 0 HB2 GLU A 36 3.791 -1.673 -8.434 1.00 0.00 H new ATOM 0 HB3 GLU A 36 3.035 -0.094 -8.519 1.00 0.00 H new ATOM 0 HG2 GLU A 36 5.609 0.603 -9.160 1.00 0.00 H new ATOM 0 HG3 GLU A 36 5.596 -1.041 -9.766 1.00 0.00 H new ATOM 534 N TYR A 37 5.882 1.777 -6.611 1.00 0.00 N ATOM 535 CA TYR A 37 6.066 3.252 -6.485 1.00 0.00 C ATOM 536 C TYR A 37 6.584 3.819 -7.813 1.00 0.00 C ATOM 537 O TYR A 37 7.706 4.280 -7.910 1.00 0.00 O ATOM 538 CB TYR A 37 7.067 3.551 -5.354 1.00 0.00 C ATOM 539 CG TYR A 37 7.290 5.050 -5.220 1.00 0.00 C ATOM 540 CD1 TYR A 37 6.211 5.943 -5.319 1.00 0.00 C ATOM 541 CD2 TYR A 37 8.582 5.542 -4.995 1.00 0.00 C ATOM 542 CE1 TYR A 37 6.427 7.320 -5.196 1.00 0.00 C ATOM 543 CE2 TYR A 37 8.796 6.920 -4.871 1.00 0.00 C ATOM 544 CZ TYR A 37 7.719 7.809 -4.972 1.00 0.00 C ATOM 545 OH TYR A 37 7.931 9.167 -4.853 1.00 0.00 O ATOM 0 H TYR A 37 6.722 1.221 -6.450 1.00 0.00 H new ATOM 0 HA TYR A 37 5.111 3.721 -6.247 1.00 0.00 H new ATOM 0 HB2 TYR A 37 6.692 3.148 -4.413 1.00 0.00 H new ATOM 0 HB3 TYR A 37 8.015 3.054 -5.559 1.00 0.00 H new ATOM 0 HD1 TYR A 37 5.213 5.567 -5.490 1.00 0.00 H new ATOM 0 HD2 TYR A 37 9.414 4.858 -4.917 1.00 0.00 H new ATOM 0 HE1 TYR A 37 5.596 8.006 -5.274 1.00 0.00 H new ATOM 0 HE2 TYR A 37 9.793 7.298 -4.697 1.00 0.00 H new ATOM 0 HH TYR A 37 8.884 9.337 -4.699 1.00 0.00 H new ATOM 555 N ASN A 38 5.762 3.794 -8.834 1.00 0.00 N ATOM 556 CA ASN A 38 6.169 4.339 -10.172 1.00 0.00 C ATOM 557 C ASN A 38 7.550 3.812 -10.589 1.00 0.00 C ATOM 558 O ASN A 38 8.557 4.459 -10.376 1.00 0.00 O ATOM 559 CB ASN A 38 6.215 5.867 -10.100 1.00 0.00 C ATOM 560 CG ASN A 38 4.840 6.438 -10.450 1.00 0.00 C ATOM 561 OD1 ASN A 38 4.295 7.236 -9.715 1.00 0.00 O ATOM 562 ND2 ASN A 38 4.251 6.062 -11.553 1.00 0.00 N ATOM 0 H ASN A 38 4.816 3.415 -8.799 1.00 0.00 H new ATOM 0 HA ASN A 38 5.438 4.014 -10.913 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.508 6.185 -9.100 1.00 0.00 H new ATOM 0 HB3 ASN A 38 6.966 6.251 -10.790 1.00 0.00 H new ATOM 0 HD21 ASN A 38 3.335 6.439 -11.796 1.00 0.00 H new ATOM 0 HD22 ASN A 38 4.707 5.392 -12.172 1.00 0.00 H new ATOM 569 N GLY A 39 7.598 2.649 -11.189 1.00 0.00 N ATOM 570 CA GLY A 39 8.904 2.084 -11.629 1.00 0.00 C ATOM 571 C GLY A 39 9.466 1.151 -10.552 1.00 0.00 C ATOM 572 O GLY A 39 10.018 0.110 -10.854 1.00 0.00 O ATOM 0 H GLY A 39 6.785 2.067 -11.392 1.00 0.00 H new ATOM 0 HA2 GLY A 39 8.776 1.537 -12.563 1.00 0.00 H new ATOM 0 HA3 GLY A 39 9.610 2.891 -11.826 1.00 0.00 H new ATOM 576 N LYS A 40 9.331 1.514 -9.300 1.00 0.00 N ATOM 577 CA LYS A 40 9.860 0.646 -8.207 1.00 0.00 C ATOM 578 C LYS A 40 8.779 -0.347 -7.780 1.00 0.00 C ATOM 579 O LYS A 40 7.604 -0.133 -8.014 1.00 0.00 O ATOM 580 CB LYS A 40 10.258 1.514 -7.011 1.00 0.00 C ATOM 581 CG LYS A 40 11.393 2.455 -7.419 1.00 0.00 C ATOM 582 CD LYS A 40 12.670 1.646 -7.650 1.00 0.00 C ATOM 583 CE LYS A 40 13.890 2.529 -7.379 1.00 0.00 C ATOM 584 NZ LYS A 40 13.839 3.728 -8.262 1.00 0.00 N ATOM 0 H LYS A 40 8.878 2.373 -8.990 1.00 0.00 H new ATOM 0 HA LYS A 40 10.734 0.102 -8.565 1.00 0.00 H new ATOM 0 HB2 LYS A 40 9.400 2.090 -6.665 1.00 0.00 H new ATOM 0 HB3 LYS A 40 10.575 0.884 -6.180 1.00 0.00 H new ATOM 0 HG2 LYS A 40 11.123 2.995 -8.327 1.00 0.00 H new ATOM 0 HG3 LYS A 40 11.558 3.201 -6.641 1.00 0.00 H new ATOM 0 HD2 LYS A 40 12.685 0.775 -6.994 1.00 0.00 H new ATOM 0 HD3 LYS A 40 12.697 1.274 -8.674 1.00 0.00 H new ATOM 0 HE2 LYS A 40 13.906 2.835 -6.333 1.00 0.00 H new ATOM 0 HE3 LYS A 40 14.807 1.968 -7.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 14.764 4.202 -8.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 13.605 3.435 -9.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 13.111 4.385 -7.914 1.00 0.00 H new ATOM 598 N THR A 41 9.168 -1.432 -7.159 1.00 0.00 N ATOM 599 CA THR A 41 8.165 -2.443 -6.718 1.00 0.00 C ATOM 600 C THR A 41 8.668 -3.163 -5.467 1.00 0.00 C ATOM 601 O THR A 41 9.346 -4.170 -5.550 1.00 0.00 O ATOM 602 CB THR A 41 7.942 -3.466 -7.835 1.00 0.00 C ATOM 603 OG1 THR A 41 7.658 -2.786 -9.050 1.00 0.00 O ATOM 604 CG2 THR A 41 6.769 -4.377 -7.466 1.00 0.00 C ATOM 0 H THR A 41 10.138 -1.660 -6.939 1.00 0.00 H new ATOM 0 HA THR A 41 7.226 -1.937 -6.491 1.00 0.00 H new ATOM 0 HB THR A 41 8.841 -4.070 -7.962 1.00 0.00 H new ATOM 0 HG1 THR A 41 7.517 -3.440 -9.766 1.00 0.00 H new ATOM 0 HG21 THR A 41 6.610 -5.105 -8.261 1.00 0.00 H new ATOM 0 HG22 THR A 41 6.992 -4.899 -6.535 1.00 0.00 H new ATOM 0 HG23 THR A 41 5.868 -3.777 -7.338 1.00 0.00 H new ATOM 612 N VAL A 42 8.325 -2.662 -4.308 1.00 0.00 N ATOM 613 CA VAL A 42 8.763 -3.326 -3.040 1.00 0.00 C ATOM 614 C VAL A 42 7.599 -4.127 -2.471 1.00 0.00 C ATOM 615 O VAL A 42 6.453 -3.736 -2.582 1.00 0.00 O ATOM 616 CB VAL A 42 9.211 -2.304 -1.973 1.00 0.00 C ATOM 617 CG1 VAL A 42 10.700 -2.000 -2.133 1.00 0.00 C ATOM 618 CG2 VAL A 42 8.405 -1.000 -2.080 1.00 0.00 C ATOM 0 H VAL A 42 7.760 -1.822 -4.183 1.00 0.00 H new ATOM 0 HA VAL A 42 9.611 -3.967 -3.281 1.00 0.00 H new ATOM 0 HB VAL A 42 9.030 -2.741 -0.991 1.00 0.00 H new ATOM 0 HG11 VAL A 42 11.007 -1.278 -1.376 1.00 0.00 H new ATOM 0 HG12 VAL A 42 11.274 -2.919 -2.012 1.00 0.00 H new ATOM 0 HG13 VAL A 42 10.882 -1.586 -3.125 1.00 0.00 H new ATOM 0 HG21 VAL A 42 8.743 -0.300 -1.316 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.553 -0.560 -3.066 1.00 0.00 H new ATOM 0 HG23 VAL A 42 7.346 -1.214 -1.934 1.00 0.00 H new ATOM 628 N ASN A 43 7.888 -5.234 -1.839 1.00 0.00 N ATOM 629 CA ASN A 43 6.805 -6.057 -1.233 1.00 0.00 C ATOM 630 C ASN A 43 6.168 -5.249 -0.106 1.00 0.00 C ATOM 631 O ASN A 43 6.843 -4.490 0.566 1.00 0.00 O ATOM 632 CB ASN A 43 7.404 -7.342 -0.659 1.00 0.00 C ATOM 633 CG ASN A 43 6.306 -8.396 -0.499 1.00 0.00 C ATOM 634 OD1 ASN A 43 5.180 -8.073 -0.177 1.00 0.00 O ATOM 635 ND2 ASN A 43 6.588 -9.651 -0.713 1.00 0.00 N ATOM 0 H ASN A 43 8.831 -5.603 -1.717 1.00 0.00 H new ATOM 0 HA ASN A 43 6.059 -6.314 -1.985 1.00 0.00 H new ATOM 0 HB2 ASN A 43 8.187 -7.716 -1.319 1.00 0.00 H new ATOM 0 HB3 ASN A 43 7.870 -7.139 0.305 1.00 0.00 H new ATOM 0 HD21 ASN A 43 5.863 -10.361 -0.610 1.00 0.00 H new ATOM 0 HD22 ASN A 43 7.533 -9.922 -0.983 1.00 0.00 H new ATOM 642 N LEU A 44 4.884 -5.395 0.113 1.00 0.00 N ATOM 643 CA LEU A 44 4.236 -4.618 1.207 1.00 0.00 C ATOM 644 C LEU A 44 4.780 -5.059 2.568 1.00 0.00 C ATOM 645 O LEU A 44 4.566 -4.393 3.565 1.00 0.00 O ATOM 646 CB LEU A 44 2.729 -4.800 1.187 1.00 0.00 C ATOM 647 CG LEU A 44 2.110 -3.701 2.047 1.00 0.00 C ATOM 648 CD1 LEU A 44 1.909 -2.446 1.205 1.00 0.00 C ATOM 649 CD2 LEU A 44 0.785 -4.189 2.614 1.00 0.00 C ATOM 0 H LEU A 44 4.265 -6.012 -0.413 1.00 0.00 H new ATOM 0 HA LEU A 44 4.465 -3.565 1.046 1.00 0.00 H new ATOM 0 HB2 LEU A 44 2.352 -4.743 0.166 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.459 -5.783 1.572 1.00 0.00 H new ATOM 0 HG LEU A 44 2.776 -3.459 2.875 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.467 -1.662 1.820 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.871 -2.107 0.822 1.00 0.00 H new ATOM 0 HD13 LEU A 44 1.245 -2.670 0.370 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.342 -3.405 3.228 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.108 -4.436 1.796 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.955 -5.076 3.224 1.00 0.00 H new ATOM 661 N LYS A 45 5.500 -6.152 2.630 1.00 0.00 N ATOM 662 CA LYS A 45 6.073 -6.587 3.932 1.00 0.00 C ATOM 663 C LYS A 45 7.441 -5.918 4.094 1.00 0.00 C ATOM 664 O LYS A 45 8.425 -6.562 4.409 1.00 0.00 O ATOM 665 CB LYS A 45 6.231 -8.110 3.943 1.00 0.00 C ATOM 666 CG LYS A 45 4.856 -8.767 3.811 1.00 0.00 C ATOM 667 CD LYS A 45 4.553 -9.023 2.333 1.00 0.00 C ATOM 668 CE LYS A 45 3.731 -10.306 2.196 1.00 0.00 C ATOM 669 NZ LYS A 45 4.646 -11.457 1.955 1.00 0.00 N ATOM 0 H LYS A 45 5.713 -6.757 1.837 1.00 0.00 H new ATOM 0 HA LYS A 45 5.415 -6.301 4.753 1.00 0.00 H new ATOM 0 HB2 LYS A 45 6.877 -8.425 3.123 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.711 -8.430 4.868 1.00 0.00 H new ATOM 0 HG2 LYS A 45 4.835 -9.705 4.365 1.00 0.00 H new ATOM 0 HG3 LYS A 45 4.090 -8.123 4.244 1.00 0.00 H new ATOM 0 HD2 LYS A 45 4.005 -8.180 1.912 1.00 0.00 H new ATOM 0 HD3 LYS A 45 5.482 -9.112 1.770 1.00 0.00 H new ATOM 0 HE2 LYS A 45 3.147 -10.475 3.101 1.00 0.00 H new ATOM 0 HE3 LYS A 45 3.023 -10.211 1.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 4.089 -12.330 1.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 5.185 -11.295 1.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 5.304 -11.551 2.755 1.00 0.00 H new ATOM 683 N SER A 46 7.512 -4.623 3.872 1.00 0.00 N ATOM 684 CA SER A 46 8.817 -3.910 4.004 1.00 0.00 C ATOM 685 C SER A 46 8.559 -2.468 4.433 1.00 0.00 C ATOM 686 O SER A 46 8.288 -1.607 3.617 1.00 0.00 O ATOM 687 CB SER A 46 9.559 -3.930 2.662 1.00 0.00 C ATOM 688 OG SER A 46 10.803 -3.257 2.805 1.00 0.00 O ATOM 0 H SER A 46 6.722 -4.035 3.606 1.00 0.00 H new ATOM 0 HA SER A 46 9.431 -4.409 4.754 1.00 0.00 H new ATOM 0 HB2 SER A 46 9.723 -4.958 2.339 1.00 0.00 H new ATOM 0 HB3 SER A 46 8.957 -3.447 1.893 1.00 0.00 H new ATOM 0 HG SER A 46 11.408 -3.531 2.084 1.00 0.00 H new ATOM 694 N ILE A 47 8.631 -2.205 5.711 1.00 0.00 N ATOM 695 CA ILE A 47 8.382 -0.823 6.213 1.00 0.00 C ATOM 696 C ILE A 47 9.610 0.048 5.947 1.00 0.00 C ATOM 697 O ILE A 47 9.494 1.197 5.566 1.00 0.00 O ATOM 698 CB ILE A 47 8.096 -0.866 7.713 1.00 0.00 C ATOM 699 CG1 ILE A 47 6.994 -1.902 7.986 1.00 0.00 C ATOM 700 CG2 ILE A 47 7.641 0.523 8.172 1.00 0.00 C ATOM 701 CD1 ILE A 47 6.652 -1.924 9.478 1.00 0.00 C ATOM 0 H ILE A 47 8.853 -2.892 6.432 1.00 0.00 H new ATOM 0 HA ILE A 47 7.521 -0.400 5.695 1.00 0.00 H new ATOM 0 HB ILE A 47 8.994 -1.149 8.261 1.00 0.00 H new ATOM 0 HG12 ILE A 47 6.104 -1.660 7.404 1.00 0.00 H new ATOM 0 HG13 ILE A 47 7.325 -2.890 7.666 1.00 0.00 H new ATOM 0 HG21 ILE A 47 7.434 0.503 9.242 1.00 0.00 H new ATOM 0 HG22 ILE A 47 8.428 1.249 7.968 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.737 0.806 7.633 1.00 0.00 H new ATOM 0 HD11 ILE A 47 5.870 -2.661 9.661 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.541 -2.188 10.051 1.00 0.00 H new ATOM 0 HD13 ILE A 47 6.301 -0.939 9.785 1.00 0.00 H new ATOM 713 N MET A 48 10.784 -0.494 6.142 1.00 0.00 N ATOM 714 CA MET A 48 12.028 0.294 5.900 1.00 0.00 C ATOM 715 C MET A 48 12.235 0.473 4.394 1.00 0.00 C ATOM 716 O MET A 48 12.812 1.448 3.954 1.00 0.00 O ATOM 717 CB MET A 48 13.227 -0.447 6.496 1.00 0.00 C ATOM 718 CG MET A 48 14.369 0.542 6.742 1.00 0.00 C ATOM 719 SD MET A 48 15.344 0.729 5.227 1.00 0.00 S ATOM 720 CE MET A 48 16.634 1.795 5.917 1.00 0.00 C ATOM 0 H MET A 48 10.935 -1.452 6.459 1.00 0.00 H new ATOM 0 HA MET A 48 11.935 1.272 6.372 1.00 0.00 H new ATOM 0 HB2 MET A 48 12.942 -0.929 7.431 1.00 0.00 H new ATOM 0 HB3 MET A 48 13.554 -1.235 5.818 1.00 0.00 H new ATOM 0 HG2 MET A 48 13.968 1.507 7.050 1.00 0.00 H new ATOM 0 HG3 MET A 48 15.004 0.186 7.554 1.00 0.00 H new ATOM 0 HE1 MET A 48 17.358 2.040 5.140 1.00 0.00 H new ATOM 0 HE2 MET A 48 16.184 2.713 6.295 1.00 0.00 H new ATOM 0 HE3 MET A 48 17.138 1.275 6.732 1.00 0.00 H new ATOM 730 N GLY A 49 11.768 -0.461 3.603 1.00 0.00 N ATOM 731 CA GLY A 49 11.933 -0.353 2.122 1.00 0.00 C ATOM 732 C GLY A 49 11.020 0.747 1.577 1.00 0.00 C ATOM 733 O GLY A 49 11.319 1.375 0.579 1.00 0.00 O ATOM 0 H GLY A 49 11.278 -1.297 3.922 1.00 0.00 H new ATOM 0 HA2 GLY A 49 12.972 -0.130 1.878 1.00 0.00 H new ATOM 0 HA3 GLY A 49 11.692 -1.305 1.650 1.00 0.00 H new ATOM 737 N VAL A 50 9.906 0.983 2.224 1.00 0.00 N ATOM 738 CA VAL A 50 8.964 2.041 1.750 1.00 0.00 C ATOM 739 C VAL A 50 9.547 3.421 2.065 1.00 0.00 C ATOM 740 O VAL A 50 9.506 4.322 1.248 1.00 0.00 O ATOM 741 CB VAL A 50 7.616 1.875 2.459 1.00 0.00 C ATOM 742 CG1 VAL A 50 6.613 2.893 1.907 1.00 0.00 C ATOM 743 CG2 VAL A 50 7.084 0.454 2.225 1.00 0.00 C ATOM 0 H VAL A 50 9.608 0.486 3.063 1.00 0.00 H new ATOM 0 HA VAL A 50 8.820 1.948 0.673 1.00 0.00 H new ATOM 0 HB VAL A 50 7.749 2.042 3.528 1.00 0.00 H new ATOM 0 HG11 VAL A 50 5.656 2.772 2.414 1.00 0.00 H new ATOM 0 HG12 VAL A 50 6.988 3.902 2.077 1.00 0.00 H new ATOM 0 HG13 VAL A 50 6.481 2.730 0.837 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.125 0.337 2.730 1.00 0.00 H new ATOM 0 HG22 VAL A 50 6.954 0.285 1.156 1.00 0.00 H new ATOM 0 HG23 VAL A 50 7.794 -0.271 2.623 1.00 0.00 H new ATOM 753 N VAL A 51 10.087 3.589 3.245 1.00 0.00 N ATOM 754 CA VAL A 51 10.676 4.908 3.627 1.00 0.00 C ATOM 755 C VAL A 51 11.948 5.157 2.813 1.00 0.00 C ATOM 756 O VAL A 51 12.301 6.285 2.530 1.00 0.00 O ATOM 757 CB VAL A 51 11.022 4.899 5.117 1.00 0.00 C ATOM 758 CG1 VAL A 51 11.466 6.297 5.548 1.00 0.00 C ATOM 759 CG2 VAL A 51 9.789 4.484 5.924 1.00 0.00 C ATOM 0 H VAL A 51 10.146 2.867 3.963 1.00 0.00 H new ATOM 0 HA VAL A 51 9.954 5.699 3.424 1.00 0.00 H new ATOM 0 HB VAL A 51 11.831 4.191 5.297 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.712 6.289 6.610 1.00 0.00 H new ATOM 0 HG12 VAL A 51 12.344 6.593 4.974 1.00 0.00 H new ATOM 0 HG13 VAL A 51 10.659 7.007 5.368 1.00 0.00 H new ATOM 0 HG21 VAL A 51 10.035 4.477 6.986 1.00 0.00 H new ATOM 0 HG22 VAL A 51 8.980 5.192 5.743 1.00 0.00 H new ATOM 0 HG23 VAL A 51 9.473 3.487 5.618 1.00 0.00 H new ATOM 769 N SER A 52 12.638 4.109 2.439 1.00 0.00 N ATOM 770 CA SER A 52 13.890 4.271 1.645 1.00 0.00 C ATOM 771 C SER A 52 13.549 4.833 0.264 1.00 0.00 C ATOM 772 O SER A 52 14.332 5.546 -0.334 1.00 0.00 O ATOM 773 CB SER A 52 14.575 2.912 1.491 1.00 0.00 C ATOM 774 OG SER A 52 13.714 2.032 0.778 1.00 0.00 O ATOM 0 H SER A 52 12.385 3.144 2.652 1.00 0.00 H new ATOM 0 HA SER A 52 14.561 4.959 2.160 1.00 0.00 H new ATOM 0 HB2 SER A 52 15.520 3.026 0.959 1.00 0.00 H new ATOM 0 HB3 SER A 52 14.809 2.496 2.471 1.00 0.00 H new ATOM 0 HG SER A 52 12.790 2.352 0.845 1.00 0.00 H new ATOM 780 N LEU A 53 12.384 4.517 -0.242 1.00 0.00 N ATOM 781 CA LEU A 53 11.981 5.030 -1.583 1.00 0.00 C ATOM 782 C LEU A 53 11.878 6.555 -1.533 1.00 0.00 C ATOM 783 O LEU A 53 12.446 7.251 -2.353 1.00 0.00 O ATOM 784 CB LEU A 53 10.622 4.442 -1.966 1.00 0.00 C ATOM 785 CG LEU A 53 10.796 2.980 -2.382 1.00 0.00 C ATOM 786 CD1 LEU A 53 9.422 2.317 -2.503 1.00 0.00 C ATOM 787 CD2 LEU A 53 11.513 2.917 -3.732 1.00 0.00 C ATOM 0 H LEU A 53 11.694 3.924 0.219 1.00 0.00 H new ATOM 0 HA LEU A 53 12.726 4.738 -2.323 1.00 0.00 H new ATOM 0 HB2 LEU A 53 9.934 4.512 -1.124 1.00 0.00 H new ATOM 0 HB3 LEU A 53 10.184 5.014 -2.784 1.00 0.00 H new ATOM 0 HG LEU A 53 11.387 2.456 -1.631 1.00 0.00 H new ATOM 0 HD11 LEU A 53 9.545 1.275 -2.799 1.00 0.00 H new ATOM 0 HD12 LEU A 53 8.910 2.363 -1.542 1.00 0.00 H new ATOM 0 HD13 LEU A 53 8.830 2.840 -3.254 1.00 0.00 H new ATOM 0 HD21 LEU A 53 11.638 1.876 -4.030 1.00 0.00 H new ATOM 0 HD22 LEU A 53 10.921 3.441 -4.483 1.00 0.00 H new ATOM 0 HD23 LEU A 53 12.492 3.390 -3.647 1.00 0.00 H new ATOM 799 N GLY A 54 11.154 7.074 -0.574 1.00 0.00 N ATOM 800 CA GLY A 54 11.005 8.555 -0.459 1.00 0.00 C ATOM 801 C GLY A 54 9.743 8.999 -1.201 1.00 0.00 C ATOM 802 O GLY A 54 9.776 9.910 -2.006 1.00 0.00 O ATOM 0 H GLY A 54 10.659 6.534 0.136 1.00 0.00 H new ATOM 0 HA2 GLY A 54 10.944 8.845 0.590 1.00 0.00 H new ATOM 0 HA3 GLY A 54 11.880 9.053 -0.877 1.00 0.00 H new ATOM 806 N ILE A 55 8.631 8.362 -0.931 1.00 0.00 N ATOM 807 CA ILE A 55 7.359 8.741 -1.617 1.00 0.00 C ATOM 808 C ILE A 55 6.806 10.021 -0.990 1.00 0.00 C ATOM 809 O ILE A 55 7.153 10.378 0.120 1.00 0.00 O ATOM 810 CB ILE A 55 6.338 7.610 -1.465 1.00 0.00 C ATOM 811 CG1 ILE A 55 6.963 6.293 -1.936 1.00 0.00 C ATOM 812 CG2 ILE A 55 5.105 7.920 -2.316 1.00 0.00 C ATOM 813 CD1 ILE A 55 6.003 5.137 -1.644 1.00 0.00 C ATOM 0 H ILE A 55 8.550 7.595 -0.264 1.00 0.00 H new ATOM 0 HA ILE A 55 7.553 8.911 -2.676 1.00 0.00 H new ATOM 0 HB ILE A 55 6.046 7.521 -0.419 1.00 0.00 H new ATOM 0 HG12 ILE A 55 7.176 6.341 -3.004 1.00 0.00 H new ATOM 0 HG13 ILE A 55 7.913 6.127 -1.428 1.00 0.00 H new ATOM 0 HG21 ILE A 55 4.377 7.116 -2.209 1.00 0.00 H new ATOM 0 HG22 ILE A 55 4.660 8.858 -1.984 1.00 0.00 H new ATOM 0 HG23 ILE A 55 5.398 8.007 -3.362 1.00 0.00 H new ATOM 0 HD11 ILE A 55 6.449 4.200 -1.979 1.00 0.00 H new ATOM 0 HD12 ILE A 55 5.812 5.085 -0.572 1.00 0.00 H new ATOM 0 HD13 ILE A 55 5.064 5.302 -2.172 1.00 0.00 H new ATOM 825 N ALA A 56 5.954 10.718 -1.700 1.00 0.00 N ATOM 826 CA ALA A 56 5.380 11.983 -1.156 1.00 0.00 C ATOM 827 C ALA A 56 3.957 12.176 -1.682 1.00 0.00 C ATOM 828 O ALA A 56 3.449 11.370 -2.439 1.00 0.00 O ATOM 829 CB ALA A 56 6.253 13.159 -1.597 1.00 0.00 C ATOM 0 H ALA A 56 5.632 10.464 -2.634 1.00 0.00 H new ATOM 0 HA ALA A 56 5.353 11.932 -0.068 1.00 0.00 H new ATOM 0 HB1 ALA A 56 5.839 14.087 -1.203 1.00 0.00 H new ATOM 0 HB2 ALA A 56 7.266 13.023 -1.217 1.00 0.00 H new ATOM 0 HB3 ALA A 56 6.277 13.206 -2.686 1.00 0.00 H new ATOM 835 N LYS A 57 3.310 13.242 -1.282 1.00 0.00 N ATOM 836 CA LYS A 57 1.916 13.503 -1.747 1.00 0.00 C ATOM 837 C LYS A 57 1.900 13.669 -3.270 1.00 0.00 C ATOM 838 O LYS A 57 2.844 14.164 -3.857 1.00 0.00 O ATOM 839 CB LYS A 57 1.388 14.781 -1.084 1.00 0.00 C ATOM 840 CG LYS A 57 2.319 15.955 -1.397 1.00 0.00 C ATOM 841 CD LYS A 57 1.713 17.247 -0.844 1.00 0.00 C ATOM 842 CE LYS A 57 2.830 18.249 -0.542 1.00 0.00 C ATOM 843 NZ LYS A 57 2.288 19.360 0.291 1.00 0.00 N ATOM 0 H LYS A 57 3.691 13.946 -0.650 1.00 0.00 H new ATOM 0 HA LYS A 57 1.280 12.661 -1.472 1.00 0.00 H new ATOM 0 HB2 LYS A 57 0.382 14.998 -1.443 1.00 0.00 H new ATOM 0 HB3 LYS A 57 1.318 14.639 -0.006 1.00 0.00 H new ATOM 0 HG2 LYS A 57 3.300 15.783 -0.955 1.00 0.00 H new ATOM 0 HG3 LYS A 57 2.465 16.041 -2.474 1.00 0.00 H new ATOM 0 HD2 LYS A 57 1.015 17.671 -1.566 1.00 0.00 H new ATOM 0 HD3 LYS A 57 1.145 17.036 0.062 1.00 0.00 H new ATOM 0 HE2 LYS A 57 3.647 17.752 -0.018 1.00 0.00 H new ATOM 0 HE3 LYS A 57 3.240 18.644 -1.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 3.046 20.041 0.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 1.523 19.839 -0.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 1.917 18.976 1.183 1.00 0.00 H new ATOM 857 N GLY A 58 0.834 13.258 -3.908 1.00 0.00 N ATOM 858 CA GLY A 58 0.745 13.388 -5.392 1.00 0.00 C ATOM 859 C GLY A 58 1.591 12.298 -6.053 1.00 0.00 C ATOM 860 O GLY A 58 2.563 12.580 -6.729 1.00 0.00 O ATOM 0 H GLY A 58 0.019 12.837 -3.462 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -0.293 13.302 -5.713 1.00 0.00 H new ATOM 0 HA3 GLY A 58 1.094 14.373 -5.703 1.00 0.00 H new ATOM 864 N ALA A 59 1.228 11.054 -5.861 1.00 0.00 N ATOM 865 CA ALA A 59 2.006 9.937 -6.475 1.00 0.00 C ATOM 866 C ALA A 59 1.073 8.756 -6.750 1.00 0.00 C ATOM 867 O ALA A 59 0.397 8.271 -5.863 1.00 0.00 O ATOM 868 CB ALA A 59 3.111 9.498 -5.513 1.00 0.00 C ATOM 0 H ALA A 59 0.424 10.765 -5.304 1.00 0.00 H new ATOM 0 HA ALA A 59 2.450 10.275 -7.411 1.00 0.00 H new ATOM 0 HB1 ALA A 59 3.680 8.683 -5.960 1.00 0.00 H new ATOM 0 HB2 ALA A 59 3.776 10.339 -5.315 1.00 0.00 H new ATOM 0 HB3 ALA A 59 2.666 9.160 -4.577 1.00 0.00 H new ATOM 874 N GLU A 60 1.035 8.291 -7.972 1.00 0.00 N ATOM 875 CA GLU A 60 0.149 7.141 -8.313 1.00 0.00 C ATOM 876 C GLU A 60 0.871 5.830 -7.997 1.00 0.00 C ATOM 877 O GLU A 60 1.962 5.582 -8.477 1.00 0.00 O ATOM 878 CB GLU A 60 -0.197 7.187 -9.804 1.00 0.00 C ATOM 879 CG GLU A 60 -1.368 8.146 -10.029 1.00 0.00 C ATOM 880 CD GLU A 60 -0.834 9.530 -10.405 1.00 0.00 C ATOM 881 OE1 GLU A 60 0.113 9.970 -9.774 1.00 0.00 O ATOM 882 OE2 GLU A 60 -1.381 10.126 -11.318 1.00 0.00 O ATOM 0 H GLU A 60 1.582 8.660 -8.750 1.00 0.00 H new ATOM 0 HA GLU A 60 -0.767 7.202 -7.726 1.00 0.00 H new ATOM 0 HB2 GLU A 60 0.670 7.514 -10.379 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -0.457 6.190 -10.158 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -2.014 7.767 -10.821 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -1.975 8.212 -9.126 1.00 0.00 H new ATOM 889 N ILE A 61 0.269 4.990 -7.195 1.00 0.00 N ATOM 890 CA ILE A 61 0.911 3.690 -6.842 1.00 0.00 C ATOM 891 C ILE A 61 0.102 2.545 -7.455 1.00 0.00 C ATOM 892 O ILE A 61 -1.050 2.711 -7.811 1.00 0.00 O ATOM 893 CB ILE A 61 0.950 3.534 -5.320 1.00 0.00 C ATOM 894 CG1 ILE A 61 -0.462 3.710 -4.751 1.00 0.00 C ATOM 895 CG2 ILE A 61 1.874 4.596 -4.719 1.00 0.00 C ATOM 896 CD1 ILE A 61 -0.453 3.391 -3.256 1.00 0.00 C ATOM 0 H ILE A 61 -0.643 5.150 -6.768 1.00 0.00 H new ATOM 0 HA ILE A 61 1.929 3.667 -7.232 1.00 0.00 H new ATOM 0 HB ILE A 61 1.324 2.542 -5.069 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.806 4.731 -4.914 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -1.159 3.052 -5.270 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.901 4.484 -3.635 1.00 0.00 H new ATOM 0 HG22 ILE A 61 2.880 4.473 -5.121 1.00 0.00 H new ATOM 0 HG23 ILE A 61 1.501 5.588 -4.972 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.457 3.516 -2.851 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -0.127 2.362 -3.106 1.00 0.00 H new ATOM 0 HD13 ILE A 61 0.232 4.067 -2.744 1.00 0.00 H new ATOM 908 N THR A 62 0.698 1.387 -7.584 1.00 0.00 N ATOM 909 CA THR A 62 -0.031 0.227 -8.178 1.00 0.00 C ATOM 910 C THR A 62 0.241 -1.031 -7.349 1.00 0.00 C ATOM 911 O THR A 62 1.343 -1.546 -7.330 1.00 0.00 O ATOM 912 CB THR A 62 0.448 0.007 -9.615 1.00 0.00 C ATOM 913 OG1 THR A 62 0.548 1.261 -10.275 1.00 0.00 O ATOM 914 CG2 THR A 62 -0.548 -0.885 -10.356 1.00 0.00 C ATOM 0 H THR A 62 1.660 1.195 -7.303 1.00 0.00 H new ATOM 0 HA THR A 62 -1.101 0.433 -8.178 1.00 0.00 H new ATOM 0 HB THR A 62 1.425 -0.477 -9.604 1.00 0.00 H new ATOM 0 HG1 THR A 62 0.856 1.123 -11.195 1.00 0.00 H new ATOM 0 HG21 THR A 62 -0.206 -1.041 -11.379 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.623 -1.846 -9.848 1.00 0.00 H new ATOM 0 HG23 THR A 62 -1.526 -0.405 -10.370 1.00 0.00 H new ATOM 922 N ILE A 63 -0.760 -1.525 -6.669 1.00 0.00 N ATOM 923 CA ILE A 63 -0.579 -2.749 -5.837 1.00 0.00 C ATOM 924 C ILE A 63 -0.928 -3.984 -6.679 1.00 0.00 C ATOM 925 O ILE A 63 -1.606 -3.887 -7.685 1.00 0.00 O ATOM 926 CB ILE A 63 -1.503 -2.661 -4.612 1.00 0.00 C ATOM 927 CG1 ILE A 63 -1.066 -1.478 -3.742 1.00 0.00 C ATOM 928 CG2 ILE A 63 -1.423 -3.953 -3.790 1.00 0.00 C ATOM 929 CD1 ILE A 63 -2.059 -1.287 -2.595 1.00 0.00 C ATOM 0 H ILE A 63 -1.700 -1.130 -6.655 1.00 0.00 H new ATOM 0 HA ILE A 63 0.455 -2.829 -5.500 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.530 -2.521 -4.948 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.067 -1.656 -3.345 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.013 -0.571 -4.344 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -2.083 -3.876 -2.926 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.731 -4.797 -4.407 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.398 -4.106 -3.452 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -1.745 -0.445 -1.978 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -3.051 -1.089 -3.002 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -2.090 -2.191 -1.986 1.00 0.00 H new ATOM 941 N SER A 64 -0.464 -5.140 -6.272 1.00 0.00 N ATOM 942 CA SER A 64 -0.761 -6.381 -7.043 1.00 0.00 C ATOM 943 C SER A 64 -0.808 -7.586 -6.102 1.00 0.00 C ATOM 944 O SER A 64 0.213 -8.119 -5.711 1.00 0.00 O ATOM 945 CB SER A 64 0.329 -6.601 -8.089 1.00 0.00 C ATOM 946 OG SER A 64 1.603 -6.411 -7.489 1.00 0.00 O ATOM 0 H SER A 64 0.108 -5.275 -5.438 1.00 0.00 H new ATOM 0 HA SER A 64 -1.728 -6.272 -7.533 1.00 0.00 H new ATOM 0 HB2 SER A 64 0.255 -7.607 -8.501 1.00 0.00 H new ATOM 0 HB3 SER A 64 0.198 -5.906 -8.919 1.00 0.00 H new ATOM 0 HG SER A 64 1.646 -6.910 -6.647 1.00 0.00 H new ATOM 952 N ALA A 65 -1.988 -8.024 -5.750 1.00 0.00 N ATOM 953 CA ALA A 65 -2.120 -9.206 -4.849 1.00 0.00 C ATOM 954 C ALA A 65 -2.181 -10.471 -5.709 1.00 0.00 C ATOM 955 O ALA A 65 -2.982 -10.565 -6.620 1.00 0.00 O ATOM 956 CB ALA A 65 -3.406 -9.082 -4.026 1.00 0.00 C ATOM 0 H ALA A 65 -2.871 -7.611 -6.050 1.00 0.00 H new ATOM 0 HA ALA A 65 -1.267 -9.256 -4.172 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -3.502 -9.946 -3.368 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -3.368 -8.172 -3.427 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -4.264 -9.040 -4.696 1.00 0.00 H new ATOM 962 N SER A 66 -1.339 -11.438 -5.440 1.00 0.00 N ATOM 963 CA SER A 66 -1.349 -12.690 -6.258 1.00 0.00 C ATOM 964 C SER A 66 -1.073 -13.900 -5.360 1.00 0.00 C ATOM 965 O SER A 66 0.020 -14.071 -4.856 1.00 0.00 O ATOM 966 CB SER A 66 -0.275 -12.593 -7.347 1.00 0.00 C ATOM 967 OG SER A 66 -0.894 -12.685 -8.623 1.00 0.00 O ATOM 0 H SER A 66 -0.647 -11.415 -4.691 1.00 0.00 H new ATOM 0 HA SER A 66 -2.327 -12.812 -6.724 1.00 0.00 H new ATOM 0 HB2 SER A 66 0.265 -11.650 -7.259 1.00 0.00 H new ATOM 0 HB3 SER A 66 0.456 -13.392 -7.226 1.00 0.00 H new ATOM 0 HG SER A 66 -0.211 -12.622 -9.323 1.00 0.00 H new ATOM 973 N GLY A 67 -2.058 -14.740 -5.165 1.00 0.00 N ATOM 974 CA GLY A 67 -1.865 -15.946 -4.305 1.00 0.00 C ATOM 975 C GLY A 67 -3.196 -16.684 -4.156 1.00 0.00 C ATOM 976 O GLY A 67 -3.915 -16.881 -5.117 1.00 0.00 O ATOM 0 H GLY A 67 -2.991 -14.642 -5.566 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.119 -16.606 -4.748 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.489 -15.651 -3.325 1.00 0.00 H new ATOM 980 N ALA A 68 -3.527 -17.092 -2.957 1.00 0.00 N ATOM 981 CA ALA A 68 -4.813 -17.817 -2.736 1.00 0.00 C ATOM 982 C ALA A 68 -5.927 -16.805 -2.468 1.00 0.00 C ATOM 983 O ALA A 68 -6.926 -16.771 -3.162 1.00 0.00 O ATOM 984 CB ALA A 68 -4.672 -18.752 -1.532 1.00 0.00 C ATOM 0 H ALA A 68 -2.960 -16.953 -2.120 1.00 0.00 H new ATOM 0 HA ALA A 68 -5.058 -18.402 -3.623 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.611 -19.281 -1.371 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.877 -19.473 -1.722 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -4.427 -18.168 -0.645 1.00 0.00 H new ATOM 990 N ASP A 69 -5.760 -15.979 -1.466 1.00 0.00 N ATOM 991 CA ASP A 69 -6.801 -14.960 -1.144 1.00 0.00 C ATOM 992 C ASP A 69 -6.321 -13.582 -1.608 1.00 0.00 C ATOM 993 O ASP A 69 -6.412 -12.603 -0.889 1.00 0.00 O ATOM 994 CB ASP A 69 -7.051 -14.943 0.369 1.00 0.00 C ATOM 995 CG ASP A 69 -5.721 -14.820 1.119 1.00 0.00 C ATOM 996 OD1 ASP A 69 -4.852 -14.111 0.637 1.00 0.00 O ATOM 997 OD2 ASP A 69 -5.593 -15.437 2.163 1.00 0.00 O ATOM 0 H ASP A 69 -4.943 -15.968 -0.855 1.00 0.00 H new ATOM 0 HA ASP A 69 -7.730 -15.210 -1.656 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -7.703 -14.109 0.629 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -7.565 -15.855 0.671 1.00 0.00 H new ATOM 1002 N GLU A 70 -5.801 -13.506 -2.806 1.00 0.00 N ATOM 1003 CA GLU A 70 -5.298 -12.202 -3.336 1.00 0.00 C ATOM 1004 C GLU A 70 -6.438 -11.179 -3.393 1.00 0.00 C ATOM 1005 O GLU A 70 -6.238 -10.006 -3.144 1.00 0.00 O ATOM 1006 CB GLU A 70 -4.727 -12.411 -4.744 1.00 0.00 C ATOM 1007 CG GLU A 70 -5.798 -13.013 -5.660 1.00 0.00 C ATOM 1008 CD GLU A 70 -5.213 -13.235 -7.056 1.00 0.00 C ATOM 1009 OE1 GLU A 70 -4.394 -12.430 -7.470 1.00 0.00 O ATOM 1010 OE2 GLU A 70 -5.595 -14.204 -7.690 1.00 0.00 O ATOM 0 H GLU A 70 -5.702 -14.296 -3.444 1.00 0.00 H new ATOM 0 HA GLU A 70 -4.518 -11.826 -2.674 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.382 -11.460 -5.150 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -3.861 -13.072 -4.700 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -6.153 -13.958 -5.249 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -6.659 -12.347 -5.717 1.00 0.00 H new ATOM 1017 N ASN A 71 -7.625 -11.615 -3.728 1.00 0.00 N ATOM 1018 CA ASN A 71 -8.780 -10.670 -3.814 1.00 0.00 C ATOM 1019 C ASN A 71 -9.138 -10.152 -2.417 1.00 0.00 C ATOM 1020 O ASN A 71 -9.492 -9.000 -2.246 1.00 0.00 O ATOM 1021 CB ASN A 71 -9.986 -11.397 -4.412 1.00 0.00 C ATOM 1022 CG ASN A 71 -9.638 -11.892 -5.816 1.00 0.00 C ATOM 1023 OD1 ASN A 71 -9.318 -11.108 -6.688 1.00 0.00 O ATOM 1024 ND2 ASN A 71 -9.688 -13.170 -6.076 1.00 0.00 N ATOM 0 H ASN A 71 -7.845 -12.587 -3.946 1.00 0.00 H new ATOM 0 HA ASN A 71 -8.507 -9.827 -4.448 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -10.268 -12.238 -3.778 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -10.844 -10.727 -4.454 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -9.459 -13.510 -7.010 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -9.956 -13.829 -5.345 1.00 0.00 H new ATOM 1031 N ASP A 72 -9.054 -10.993 -1.421 1.00 0.00 N ATOM 1032 CA ASP A 72 -9.394 -10.554 -0.035 1.00 0.00 C ATOM 1033 C ASP A 72 -8.321 -9.595 0.493 1.00 0.00 C ATOM 1034 O ASP A 72 -8.578 -8.789 1.368 1.00 0.00 O ATOM 1035 CB ASP A 72 -9.472 -11.777 0.881 1.00 0.00 C ATOM 1036 CG ASP A 72 -10.641 -12.664 0.451 1.00 0.00 C ATOM 1037 OD1 ASP A 72 -10.461 -13.440 -0.473 1.00 0.00 O ATOM 1038 OD2 ASP A 72 -11.696 -12.552 1.053 1.00 0.00 O ATOM 0 H ASP A 72 -8.764 -11.967 -1.507 1.00 0.00 H new ATOM 0 HA ASP A 72 -10.356 -10.041 -0.051 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -8.539 -12.339 0.835 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -9.603 -11.461 1.916 1.00 0.00 H new ATOM 1043 N ALA A 73 -7.118 -9.687 -0.019 1.00 0.00 N ATOM 1044 CA ALA A 73 -6.021 -8.799 0.470 1.00 0.00 C ATOM 1045 C ALA A 73 -6.114 -7.404 -0.160 1.00 0.00 C ATOM 1046 O ALA A 73 -5.908 -6.409 0.511 1.00 0.00 O ATOM 1047 CB ALA A 73 -4.670 -9.421 0.113 1.00 0.00 C ATOM 0 H ALA A 73 -6.849 -10.340 -0.755 1.00 0.00 H new ATOM 0 HA ALA A 73 -6.119 -8.697 1.551 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -3.867 -8.775 0.468 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -4.584 -10.400 0.585 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -4.595 -9.531 -0.969 1.00 0.00 H new ATOM 1053 N LEU A 74 -6.397 -7.315 -1.439 1.00 0.00 N ATOM 1054 CA LEU A 74 -6.469 -5.971 -2.091 1.00 0.00 C ATOM 1055 C LEU A 74 -7.583 -5.131 -1.455 1.00 0.00 C ATOM 1056 O LEU A 74 -7.411 -3.948 -1.222 1.00 0.00 O ATOM 1057 CB LEU A 74 -6.695 -6.117 -3.608 1.00 0.00 C ATOM 1058 CG LEU A 74 -8.090 -6.678 -3.910 1.00 0.00 C ATOM 1059 CD1 LEU A 74 -9.113 -5.533 -3.986 1.00 0.00 C ATOM 1060 CD2 LEU A 74 -8.058 -7.425 -5.247 1.00 0.00 C ATOM 0 H LEU A 74 -6.580 -8.108 -2.054 1.00 0.00 H new ATOM 0 HA LEU A 74 -5.520 -5.458 -1.937 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -6.578 -5.147 -4.091 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -5.936 -6.776 -4.030 1.00 0.00 H new ATOM 0 HG LEU A 74 -8.381 -7.362 -3.113 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -10.101 -5.941 -4.201 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -9.138 -5.004 -3.033 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -8.826 -4.841 -4.778 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -9.048 -7.825 -5.464 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -7.762 -6.739 -6.040 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -7.341 -8.244 -5.189 1.00 0.00 H new ATOM 1072 N ASN A 75 -8.721 -5.723 -1.177 1.00 0.00 N ATOM 1073 CA ASN A 75 -9.832 -4.934 -0.563 1.00 0.00 C ATOM 1074 C ASN A 75 -9.541 -4.698 0.924 1.00 0.00 C ATOM 1075 O ASN A 75 -10.044 -3.762 1.514 1.00 0.00 O ATOM 1076 CB ASN A 75 -11.172 -5.666 -0.734 1.00 0.00 C ATOM 1077 CG ASN A 75 -11.155 -7.005 0.008 1.00 0.00 C ATOM 1078 OD1 ASN A 75 -11.070 -8.045 -0.607 1.00 0.00 O ATOM 1079 ND2 ASN A 75 -11.248 -7.023 1.309 1.00 0.00 N ATOM 0 H ASN A 75 -8.926 -6.708 -1.347 1.00 0.00 H new ATOM 0 HA ASN A 75 -9.901 -3.971 -1.070 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -11.983 -5.044 -0.354 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -11.368 -5.834 -1.793 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -11.249 -7.913 1.808 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -11.320 -6.147 1.827 1.00 0.00 H new ATOM 1086 N ALA A 76 -8.734 -5.534 1.532 1.00 0.00 N ATOM 1087 CA ALA A 76 -8.412 -5.346 2.978 1.00 0.00 C ATOM 1088 C ALA A 76 -7.662 -4.023 3.162 1.00 0.00 C ATOM 1089 O ALA A 76 -8.112 -3.140 3.869 1.00 0.00 O ATOM 1090 CB ALA A 76 -7.531 -6.498 3.461 1.00 0.00 C ATOM 0 H ALA A 76 -8.286 -6.336 1.089 1.00 0.00 H new ATOM 0 HA ALA A 76 -9.336 -5.329 3.556 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -7.297 -6.359 4.516 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -8.060 -7.441 3.328 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -6.607 -6.516 2.884 1.00 0.00 H new ATOM 1096 N LEU A 77 -6.523 -3.883 2.531 1.00 0.00 N ATOM 1097 CA LEU A 77 -5.735 -2.623 2.666 1.00 0.00 C ATOM 1098 C LEU A 77 -6.513 -1.452 2.063 1.00 0.00 C ATOM 1099 O LEU A 77 -6.359 -0.322 2.481 1.00 0.00 O ATOM 1100 CB LEU A 77 -4.400 -2.779 1.933 1.00 0.00 C ATOM 1101 CG LEU A 77 -3.687 -4.054 2.421 1.00 0.00 C ATOM 1102 CD1 LEU A 77 -3.426 -4.984 1.235 1.00 0.00 C ATOM 1103 CD2 LEU A 77 -2.353 -3.682 3.075 1.00 0.00 C ATOM 0 H LEU A 77 -6.105 -4.590 1.927 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.554 -2.425 3.723 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.569 -2.834 0.858 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.771 -1.907 2.113 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.320 -4.561 3.149 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.921 -5.885 1.583 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.374 -5.255 0.770 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.797 -4.475 0.505 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.852 -4.587 3.419 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.721 -3.171 2.348 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.535 -3.023 3.924 1.00 0.00 H new ATOM 1115 N GLU A 78 -7.344 -1.711 1.082 1.00 0.00 N ATOM 1116 CA GLU A 78 -8.132 -0.607 0.449 1.00 0.00 C ATOM 1117 C GLU A 78 -9.005 0.082 1.506 1.00 0.00 C ATOM 1118 O GLU A 78 -8.967 1.289 1.658 1.00 0.00 O ATOM 1119 CB GLU A 78 -9.018 -1.192 -0.659 1.00 0.00 C ATOM 1120 CG GLU A 78 -9.792 -0.069 -1.362 1.00 0.00 C ATOM 1121 CD GLU A 78 -11.248 -0.067 -0.888 1.00 0.00 C ATOM 1122 OE1 GLU A 78 -11.821 -1.140 -0.794 1.00 0.00 O ATOM 1123 OE2 GLU A 78 -11.764 1.007 -0.626 1.00 0.00 O ATOM 0 H GLU A 78 -7.510 -2.639 0.693 1.00 0.00 H new ATOM 0 HA GLU A 78 -7.451 0.129 0.021 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -8.403 -1.729 -1.382 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -9.715 -1.915 -0.235 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -9.329 0.894 -1.147 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -9.752 -0.208 -2.442 1.00 0.00 H new ATOM 1130 N GLU A 79 -9.787 -0.674 2.238 1.00 0.00 N ATOM 1131 CA GLU A 79 -10.658 -0.066 3.284 1.00 0.00 C ATOM 1132 C GLU A 79 -9.788 0.593 4.357 1.00 0.00 C ATOM 1133 O GLU A 79 -10.199 1.541 4.999 1.00 0.00 O ATOM 1134 CB GLU A 79 -11.534 -1.152 3.916 1.00 0.00 C ATOM 1135 CG GLU A 79 -10.655 -2.286 4.451 1.00 0.00 C ATOM 1136 CD GLU A 79 -11.426 -3.068 5.516 1.00 0.00 C ATOM 1137 OE1 GLU A 79 -12.593 -3.346 5.291 1.00 0.00 O ATOM 1138 OE2 GLU A 79 -10.837 -3.377 6.538 1.00 0.00 O ATOM 0 H GLU A 79 -9.857 -1.688 2.154 1.00 0.00 H new ATOM 0 HA GLU A 79 -11.298 0.690 2.830 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -12.127 -0.727 4.726 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -12.235 -1.541 3.178 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -10.363 -2.950 3.637 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -9.737 -1.880 4.876 1.00 0.00 H new ATOM 1145 N THR A 80 -8.585 0.106 4.549 1.00 0.00 N ATOM 1146 CA THR A 80 -7.683 0.712 5.570 1.00 0.00 C ATOM 1147 C THR A 80 -7.264 2.104 5.093 1.00 0.00 C ATOM 1148 O THR A 80 -7.050 3.005 5.881 1.00 0.00 O ATOM 1149 CB THR A 80 -6.441 -0.167 5.741 1.00 0.00 C ATOM 1150 OG1 THR A 80 -6.842 -1.513 5.957 1.00 0.00 O ATOM 1151 CG2 THR A 80 -5.627 0.324 6.939 1.00 0.00 C ATOM 0 H THR A 80 -8.192 -0.686 4.040 1.00 0.00 H new ATOM 0 HA THR A 80 -8.202 0.788 6.526 1.00 0.00 H new ATOM 0 HB THR A 80 -5.828 -0.110 4.841 1.00 0.00 H new ATOM 0 HG1 THR A 80 -7.125 -1.910 5.107 1.00 0.00 H new ATOM 0 HG21 THR A 80 -4.743 -0.302 7.060 1.00 0.00 H new ATOM 0 HG22 THR A 80 -5.320 1.356 6.772 1.00 0.00 H new ATOM 0 HG23 THR A 80 -6.237 0.269 7.841 1.00 0.00 H new ATOM 1159 N MET A 81 -7.160 2.282 3.800 1.00 0.00 N ATOM 1160 CA MET A 81 -6.770 3.607 3.244 1.00 0.00 C ATOM 1161 C MET A 81 -7.928 4.590 3.429 1.00 0.00 C ATOM 1162 O MET A 81 -7.728 5.779 3.591 1.00 0.00 O ATOM 1163 CB MET A 81 -6.463 3.451 1.750 1.00 0.00 C ATOM 1164 CG MET A 81 -5.015 2.979 1.567 1.00 0.00 C ATOM 1165 SD MET A 81 -3.946 4.394 1.195 1.00 0.00 S ATOM 1166 CE MET A 81 -2.497 3.833 2.123 1.00 0.00 C ATOM 0 H MET A 81 -7.331 1.558 3.102 1.00 0.00 H new ATOM 0 HA MET A 81 -5.888 3.983 3.762 1.00 0.00 H new ATOM 0 HB2 MET A 81 -7.149 2.733 1.301 1.00 0.00 H new ATOM 0 HB3 MET A 81 -6.614 4.401 1.237 1.00 0.00 H new ATOM 0 HG2 MET A 81 -4.669 2.479 2.472 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.961 2.249 0.759 1.00 0.00 H new ATOM 0 HE1 MET A 81 -1.731 4.608 2.105 1.00 0.00 H new ATOM 0 HE2 MET A 81 -2.782 3.629 3.155 1.00 0.00 H new ATOM 0 HE3 MET A 81 -2.104 2.923 1.669 1.00 0.00 H new ATOM 1176 N LYS A 82 -9.140 4.094 3.407 1.00 0.00 N ATOM 1177 CA LYS A 82 -10.327 4.982 3.582 1.00 0.00 C ATOM 1178 C LYS A 82 -10.636 5.171 5.074 1.00 0.00 C ATOM 1179 O LYS A 82 -11.351 6.082 5.451 1.00 0.00 O ATOM 1180 CB LYS A 82 -11.537 4.343 2.892 1.00 0.00 C ATOM 1181 CG LYS A 82 -11.552 4.739 1.414 1.00 0.00 C ATOM 1182 CD LYS A 82 -12.109 3.583 0.581 1.00 0.00 C ATOM 1183 CE LYS A 82 -13.620 3.479 0.794 1.00 0.00 C ATOM 1184 NZ LYS A 82 -14.028 2.046 0.763 1.00 0.00 N ATOM 0 H LYS A 82 -9.358 3.106 3.275 1.00 0.00 H new ATOM 0 HA LYS A 82 -10.113 5.955 3.139 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -11.492 3.258 2.988 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -12.458 4.668 3.376 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -12.162 5.631 1.272 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -10.544 4.987 1.083 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -11.891 3.744 -0.475 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -11.626 2.649 0.868 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -13.895 3.926 1.749 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -14.147 4.035 0.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -14.936 1.954 0.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -13.303 1.489 0.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -14.130 1.693 1.736 1.00 0.00 H new ATOM 1198 N SER A 83 -10.114 4.319 5.925 1.00 0.00 N ATOM 1199 CA SER A 83 -10.387 4.449 7.387 1.00 0.00 C ATOM 1200 C SER A 83 -9.616 5.641 7.960 1.00 0.00 C ATOM 1201 O SER A 83 -10.184 6.503 8.604 1.00 0.00 O ATOM 1202 CB SER A 83 -9.951 3.169 8.101 1.00 0.00 C ATOM 1203 OG SER A 83 -8.569 2.942 7.854 1.00 0.00 O ATOM 0 H SER A 83 -9.510 3.539 5.667 1.00 0.00 H new ATOM 0 HA SER A 83 -11.454 4.609 7.539 1.00 0.00 H new ATOM 0 HB2 SER A 83 -10.131 3.257 9.172 1.00 0.00 H new ATOM 0 HB3 SER A 83 -10.540 2.323 7.747 1.00 0.00 H new ATOM 0 HG SER A 83 -8.351 3.216 6.939 1.00 0.00 H new ATOM 1209 N GLU A 84 -8.326 5.693 7.737 1.00 0.00 N ATOM 1210 CA GLU A 84 -7.514 6.826 8.275 1.00 0.00 C ATOM 1211 C GLU A 84 -7.230 7.859 7.176 1.00 0.00 C ATOM 1212 O GLU A 84 -6.426 8.753 7.361 1.00 0.00 O ATOM 1213 CB GLU A 84 -6.186 6.286 8.812 1.00 0.00 C ATOM 1214 CG GLU A 84 -6.445 5.440 10.060 1.00 0.00 C ATOM 1215 CD GLU A 84 -5.413 4.312 10.135 1.00 0.00 C ATOM 1216 OE1 GLU A 84 -5.135 3.721 9.106 1.00 0.00 O ATOM 1217 OE2 GLU A 84 -4.919 4.061 11.222 1.00 0.00 O ATOM 0 H GLU A 84 -7.801 4.999 7.205 1.00 0.00 H new ATOM 0 HA GLU A 84 -8.075 7.309 9.075 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -5.691 5.685 8.049 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -5.516 7.112 9.052 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -6.385 6.062 10.953 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -7.452 5.024 10.028 1.00 0.00 H new ATOM 1224 N GLY A 85 -7.876 7.752 6.035 1.00 0.00 N ATOM 1225 CA GLY A 85 -7.632 8.737 4.934 1.00 0.00 C ATOM 1226 C GLY A 85 -6.150 8.722 4.548 1.00 0.00 C ATOM 1227 O GLY A 85 -5.324 9.330 5.204 1.00 0.00 O ATOM 0 H GLY A 85 -8.560 7.026 5.821 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -8.246 8.489 4.068 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -7.924 9.737 5.256 1.00 0.00 H new ATOM 1231 N LEU A 86 -5.809 8.027 3.493 1.00 0.00 N ATOM 1232 CA LEU A 86 -4.382 7.964 3.063 1.00 0.00 C ATOM 1233 C LEU A 86 -4.305 8.025 1.536 1.00 0.00 C ATOM 1234 O LEU A 86 -3.570 8.816 0.976 1.00 0.00 O ATOM 1235 CB LEU A 86 -3.763 6.656 3.556 1.00 0.00 C ATOM 1236 CG LEU A 86 -3.471 6.766 5.053 1.00 0.00 C ATOM 1237 CD1 LEU A 86 -3.191 5.375 5.619 1.00 0.00 C ATOM 1238 CD2 LEU A 86 -2.249 7.663 5.271 1.00 0.00 C ATOM 0 H LEU A 86 -6.460 7.500 2.911 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.835 8.807 3.485 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.443 5.825 3.367 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.844 6.447 3.009 1.00 0.00 H new ATOM 0 HG LEU A 86 -4.333 7.199 5.561 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.983 5.452 6.686 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.061 4.737 5.464 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -2.329 4.942 5.111 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.041 7.741 6.338 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -1.386 7.232 4.764 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -2.449 8.655 4.867 1.00 0.00 H new ATOM 1250 N GLY A 87 -5.060 7.195 0.862 1.00 0.00 N ATOM 1251 CA GLY A 87 -5.038 7.198 -0.631 1.00 0.00 C ATOM 1252 C GLY A 87 -6.343 6.603 -1.163 1.00 0.00 C ATOM 1253 O GLY A 87 -6.851 5.631 -0.637 1.00 0.00 O ATOM 0 H GLY A 87 -5.692 6.514 1.283 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -4.913 8.216 -1.001 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.188 6.620 -0.994 1.00 0.00 H new ATOM 1257 N GLU A 88 -6.889 7.182 -2.203 1.00 0.00 N ATOM 1258 CA GLU A 88 -8.162 6.659 -2.777 1.00 0.00 C ATOM 1259 C GLU A 88 -8.147 6.833 -4.297 1.00 0.00 C ATOM 1260 O GLU A 88 -8.436 5.870 -4.987 1.00 0.00 O ATOM 1261 CB GLU A 88 -9.343 7.433 -2.188 1.00 0.00 C ATOM 1262 CG GLU A 88 -9.122 8.936 -2.383 1.00 0.00 C ATOM 1263 CD GLU A 88 -10.095 9.714 -1.496 1.00 0.00 C ATOM 1264 OE1 GLU A 88 -10.275 9.316 -0.357 1.00 0.00 O ATOM 1265 OE2 GLU A 88 -10.643 10.695 -1.971 1.00 0.00 O ATOM 1266 OXT GLU A 88 -7.847 7.928 -4.745 1.00 0.00 O ATOM 0 H GLU A 88 -6.504 7.998 -2.680 1.00 0.00 H new ATOM 0 HA GLU A 88 -8.262 5.601 -2.533 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -10.270 7.126 -2.672 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -9.447 7.205 -1.127 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -8.094 9.199 -2.132 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -9.273 9.204 -3.429 1.00 0.00 H new TER 1273 GLU A 88