USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 758 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 14:sc= 1.15 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 154:sc= -0.229 (180deg=-0.931) USER MOD Single : A 14 MET CE :methyl 174:sc= -0.729 (180deg=-0.86) USER MOD Single : A 15 LYS NZ :NH3+ -154:sc= 0.632 (180deg=0.35) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot -100:sc= 0.0194 USER MOD Single : A 20 THR OG1 : rot -21:sc= 0.148 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -3! C(o=-3!,f=-3.1!) USER MOD Single : A 31 LYS NZ :NH3+ -129:sc= -0.133 (180deg=-1.59) USER MOD Single : A 33 THR OG1 : rot 154:sc= 0.52 USER MOD Single : A 35 GLN : amide:sc= -2.09! C(o=-2.1!,f=-9!) USER MOD Single : A 38 TYR OH : rot 120:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 110:sc= -0.0467 USER MOD Single : A 42 ASN :FLIP amide:sc= 0.0487 F(o=-0.6,f=0.049) USER MOD Single : A 43 ASN : amide:sc= -2.25! C(o=-2.3!,f=-2.4!) USER MOD Single : A 44 SER OG : rot 55:sc= 0.794 USER MOD Single : A 45 HIS :FLIP no HD1:sc= -1.16 F(o=-2.4,f=-1.2) USER MOD Single : A 47 ASN : amide:sc= -0.419 K(o=-0.42,f=-3.3!) USER MOD Single : A 60 CYS SG : rot -20:sc= 0.00417 USER MOD Single : A 61 THR OG1 : rot 69:sc= 0.707 USER MOD Single : A 63 ASN : amide:sc= -2.65! X(o=-2.7!,f=-2.9) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -5.05 X(o=-5.1,f=-4.6!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.138 K(o=-0.14,f=-2.3!) USER MOD Single : A 74 GLN : amide:sc= -0.916 K(o=-0.92,f=-1.6!) USER MOD Single : A 75 TYR OH : rot 180:sc= -0.0952 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -137:sc= -0.0872 (180deg=-1.47!) USER MOD Single : A 86 CYS SG : rot 130:sc= 0 USER MOD Single : A 87 CYS SG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.048 -21.141 4.907 1.00 0.00 N ATOM 2 CA GLY A 1 -6.857 -19.797 4.394 1.00 0.00 C ATOM 3 C GLY A 1 -5.394 -19.404 4.328 1.00 0.00 C ATOM 4 O GLY A 1 -4.615 -20.008 3.591 1.00 0.00 O ATOM 0 H1 GLY A 1 -8.064 -21.362 4.932 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.561 -21.821 4.289 1.00 0.00 H new ATOM 0 H3 GLY A 1 -6.656 -21.205 5.868 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -7.294 -19.726 3.398 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -7.392 -19.090 5.028 1.00 0.00 H new ATOM 8 N SER A 2 -5.021 -18.387 5.098 1.00 0.00 N ATOM 9 CA SER A 2 -3.643 -17.911 5.119 1.00 0.00 C ATOM 10 C SER A 2 -3.207 -17.573 6.542 1.00 0.00 C ATOM 11 O SER A 2 -3.925 -16.898 7.280 1.00 0.00 O ATOM 12 CB SER A 2 -3.492 -16.681 4.222 1.00 0.00 C ATOM 13 OG SER A 2 -4.233 -15.585 4.731 1.00 0.00 O ATOM 0 H SER A 2 -5.653 -17.877 5.715 1.00 0.00 H new ATOM 0 HA SER A 2 -3.003 -18.708 4.741 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.439 -16.409 4.147 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.833 -16.918 3.214 1.00 0.00 H new ATOM 0 HG SER A 2 -4.119 -14.811 4.141 1.00 0.00 H new ATOM 19 N SER A 3 -2.024 -18.048 6.920 1.00 0.00 N ATOM 20 CA SER A 3 -1.492 -17.800 8.255 1.00 0.00 C ATOM 21 C SER A 3 -1.047 -16.349 8.402 1.00 0.00 C ATOM 22 O SER A 3 -1.332 -15.698 9.406 1.00 0.00 O ATOM 23 CB SER A 3 -0.318 -18.738 8.541 1.00 0.00 C ATOM 24 OG SER A 3 0.330 -18.388 9.752 1.00 0.00 O ATOM 0 H SER A 3 -1.416 -18.606 6.321 1.00 0.00 H new ATOM 0 HA SER A 3 -2.286 -17.992 8.977 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.676 -19.766 8.600 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.395 -18.695 7.718 1.00 0.00 H new ATOM 0 HG SER A 3 1.076 -19.003 9.914 1.00 0.00 H new ATOM 30 N GLY A 4 -0.344 -15.847 7.391 1.00 0.00 N ATOM 31 CA GLY A 4 0.131 -14.476 7.426 1.00 0.00 C ATOM 32 C GLY A 4 1.630 -14.376 7.222 1.00 0.00 C ATOM 33 O GLY A 4 2.092 -13.954 6.162 1.00 0.00 O ATOM 0 H GLY A 4 -0.095 -16.365 6.549 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -0.377 -13.899 6.653 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -0.133 -14.028 8.384 1.00 0.00 H new ATOM 37 N SER A 5 2.392 -14.763 8.240 1.00 0.00 N ATOM 38 CA SER A 5 3.847 -14.710 8.170 1.00 0.00 C ATOM 39 C SER A 5 4.389 -15.824 7.279 1.00 0.00 C ATOM 40 O SER A 5 5.008 -15.563 6.248 1.00 0.00 O ATOM 41 CB SER A 5 4.451 -14.822 9.571 1.00 0.00 C ATOM 42 OG SER A 5 5.842 -14.552 9.550 1.00 0.00 O ATOM 0 H SER A 5 2.025 -15.117 9.124 1.00 0.00 H new ATOM 0 HA SER A 5 4.130 -13.751 7.736 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.952 -14.123 10.242 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.278 -15.823 9.966 1.00 0.00 H new ATOM 0 HG SER A 5 6.082 -14.136 8.696 1.00 0.00 H new ATOM 48 N SER A 6 4.151 -17.067 7.687 1.00 0.00 N ATOM 49 CA SER A 6 4.618 -18.222 6.929 1.00 0.00 C ATOM 50 C SER A 6 3.632 -18.579 5.820 1.00 0.00 C ATOM 51 O SER A 6 3.329 -19.750 5.598 1.00 0.00 O ATOM 52 CB SER A 6 4.816 -19.422 7.857 1.00 0.00 C ATOM 53 OG SER A 6 3.641 -19.689 8.602 1.00 0.00 O ATOM 0 H SER A 6 3.638 -17.300 8.537 1.00 0.00 H new ATOM 0 HA SER A 6 5.573 -17.964 6.473 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.085 -20.300 7.269 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.645 -19.227 8.537 1.00 0.00 H new ATOM 0 HG SER A 6 3.792 -20.461 9.186 1.00 0.00 H new ATOM 59 N GLY A 7 3.134 -17.559 5.128 1.00 0.00 N ATOM 60 CA GLY A 7 2.188 -17.785 4.051 1.00 0.00 C ATOM 61 C GLY A 7 2.817 -17.620 2.682 1.00 0.00 C ATOM 62 O GLY A 7 3.502 -18.519 2.193 1.00 0.00 O ATOM 0 H GLY A 7 3.369 -16.580 5.294 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.775 -18.790 4.139 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.355 -17.089 4.151 1.00 0.00 H new ATOM 66 N LYS A 8 2.584 -16.470 2.060 1.00 0.00 N ATOM 67 CA LYS A 8 3.132 -16.189 0.738 1.00 0.00 C ATOM 68 C LYS A 8 4.275 -15.182 0.825 1.00 0.00 C ATOM 69 O LYS A 8 4.048 -13.973 0.848 1.00 0.00 O ATOM 70 CB LYS A 8 2.037 -15.655 -0.188 1.00 0.00 C ATOM 71 CG LYS A 8 1.154 -16.742 -0.776 1.00 0.00 C ATOM 72 CD LYS A 8 0.099 -17.201 0.216 1.00 0.00 C ATOM 73 CE LYS A 8 -0.446 -18.574 -0.146 1.00 0.00 C ATOM 74 NZ LYS A 8 0.627 -19.606 -0.183 1.00 0.00 N ATOM 0 H LYS A 8 2.019 -15.716 2.450 1.00 0.00 H new ATOM 0 HA LYS A 8 3.523 -17.121 0.329 1.00 0.00 H new ATOM 0 HB2 LYS A 8 1.414 -14.953 0.367 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.501 -15.096 -1.001 1.00 0.00 H new ATOM 0 HG2 LYS A 8 0.669 -16.369 -1.678 1.00 0.00 H new ATOM 0 HG3 LYS A 8 1.770 -17.591 -1.073 1.00 0.00 H new ATOM 0 HD2 LYS A 8 0.528 -17.231 1.217 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -0.717 -16.479 0.241 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -1.205 -18.866 0.579 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -0.936 -18.525 -1.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 0.215 -20.542 0.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 1.074 -19.609 -1.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 1.342 -19.389 0.540 1.00 0.00 H new ATOM 88 N ALA A 9 5.502 -15.690 0.872 1.00 0.00 N ATOM 89 CA ALA A 9 6.680 -14.834 0.953 1.00 0.00 C ATOM 90 C ALA A 9 6.514 -13.589 0.088 1.00 0.00 C ATOM 91 O ALA A 9 6.772 -12.472 0.536 1.00 0.00 O ATOM 92 CB ALA A 9 7.923 -15.607 0.538 1.00 0.00 C ATOM 0 H ALA A 9 5.707 -16.689 0.855 1.00 0.00 H new ATOM 0 HA ALA A 9 6.795 -14.512 1.988 1.00 0.00 H new ATOM 0 HB1 ALA A 9 8.795 -14.956 0.603 1.00 0.00 H new ATOM 0 HB2 ALA A 9 8.058 -16.462 1.201 1.00 0.00 H new ATOM 0 HB3 ALA A 9 7.808 -15.958 -0.488 1.00 0.00 H new ATOM 98 N PHE A 10 6.084 -13.790 -1.153 1.00 0.00 N ATOM 99 CA PHE A 10 5.886 -12.683 -2.082 1.00 0.00 C ATOM 100 C PHE A 10 5.320 -11.463 -1.361 1.00 0.00 C ATOM 101 O PHE A 10 5.755 -10.334 -1.592 1.00 0.00 O ATOM 102 CB PHE A 10 4.947 -13.102 -3.215 1.00 0.00 C ATOM 103 CG PHE A 10 4.860 -12.094 -4.325 1.00 0.00 C ATOM 104 CD1 PHE A 10 4.187 -10.897 -4.141 1.00 0.00 C ATOM 105 CD2 PHE A 10 5.452 -12.344 -5.553 1.00 0.00 C ATOM 106 CE1 PHE A 10 4.106 -9.968 -5.161 1.00 0.00 C ATOM 107 CE2 PHE A 10 5.374 -11.419 -6.576 1.00 0.00 C ATOM 108 CZ PHE A 10 4.699 -10.229 -6.380 1.00 0.00 C ATOM 0 H PHE A 10 5.866 -14.709 -1.539 1.00 0.00 H new ATOM 0 HA PHE A 10 6.855 -12.417 -2.503 1.00 0.00 H new ATOM 0 HB2 PHE A 10 5.287 -14.053 -3.625 1.00 0.00 H new ATOM 0 HB3 PHE A 10 3.950 -13.268 -2.807 1.00 0.00 H new ATOM 0 HD1 PHE A 10 3.720 -10.688 -3.190 1.00 0.00 H new ATOM 0 HD2 PHE A 10 5.980 -13.272 -5.712 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.579 -9.038 -5.005 1.00 0.00 H new ATOM 0 HE2 PHE A 10 5.840 -11.626 -7.528 1.00 0.00 H new ATOM 0 HZ PHE A 10 4.636 -9.505 -7.179 1.00 0.00 H new ATOM 118 N LEU A 11 4.347 -11.698 -0.488 1.00 0.00 N ATOM 119 CA LEU A 11 3.719 -10.619 0.267 1.00 0.00 C ATOM 120 C LEU A 11 4.596 -10.194 1.440 1.00 0.00 C ATOM 121 O LEU A 11 4.916 -9.016 1.592 1.00 0.00 O ATOM 122 CB LEU A 11 2.345 -11.058 0.775 1.00 0.00 C ATOM 123 CG LEU A 11 1.232 -11.127 -0.271 1.00 0.00 C ATOM 124 CD1 LEU A 11 0.042 -11.908 0.265 1.00 0.00 C ATOM 125 CD2 LEU A 11 0.808 -9.728 -0.692 1.00 0.00 C ATOM 0 H LEU A 11 3.976 -12.626 -0.285 1.00 0.00 H new ATOM 0 HA LEU A 11 3.597 -9.765 -0.400 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.447 -12.042 1.233 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.034 -10.371 1.562 1.00 0.00 H new ATOM 0 HG LEU A 11 1.617 -11.648 -1.148 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -0.740 -11.946 -0.494 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.355 -12.922 0.515 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -0.343 -11.417 1.158 1.00 0.00 H new ATOM 0 HD21 LEU A 11 0.015 -9.797 -1.437 1.00 0.00 H new ATOM 0 HD22 LEU A 11 0.443 -9.181 0.177 1.00 0.00 H new ATOM 0 HD23 LEU A 11 1.662 -9.202 -1.119 1.00 0.00 H new ATOM 137 N GLU A 12 4.982 -11.162 2.265 1.00 0.00 N ATOM 138 CA GLU A 12 5.824 -10.887 3.424 1.00 0.00 C ATOM 139 C GLU A 12 6.816 -9.767 3.122 1.00 0.00 C ATOM 140 O GLU A 12 6.760 -8.694 3.723 1.00 0.00 O ATOM 141 CB GLU A 12 6.576 -12.150 3.847 1.00 0.00 C ATOM 142 CG GLU A 12 5.762 -13.074 4.737 1.00 0.00 C ATOM 143 CD GLU A 12 5.743 -12.622 6.184 1.00 0.00 C ATOM 144 OE1 GLU A 12 5.279 -11.493 6.446 1.00 0.00 O ATOM 145 OE2 GLU A 12 6.192 -13.397 7.054 1.00 0.00 O ATOM 0 H GLU A 12 4.726 -12.143 2.153 1.00 0.00 H new ATOM 0 HA GLU A 12 5.179 -10.566 4.242 1.00 0.00 H new ATOM 0 HB2 GLU A 12 6.883 -12.696 2.955 1.00 0.00 H new ATOM 0 HB3 GLU A 12 7.486 -11.862 4.373 1.00 0.00 H new ATOM 0 HG2 GLU A 12 4.740 -13.125 4.363 1.00 0.00 H new ATOM 0 HG3 GLU A 12 6.173 -14.082 4.680 1.00 0.00 H new ATOM 152 N ASP A 13 7.724 -10.026 2.187 1.00 0.00 N ATOM 153 CA ASP A 13 8.729 -9.041 1.804 1.00 0.00 C ATOM 154 C ASP A 13 8.094 -7.670 1.595 1.00 0.00 C ATOM 155 O ASP A 13 8.575 -6.666 2.119 1.00 0.00 O ATOM 156 CB ASP A 13 9.448 -9.484 0.529 1.00 0.00 C ATOM 157 CG ASP A 13 8.516 -9.566 -0.663 1.00 0.00 C ATOM 158 OD1 ASP A 13 8.258 -8.515 -1.288 1.00 0.00 O ATOM 159 OD2 ASP A 13 8.044 -10.680 -0.972 1.00 0.00 O ATOM 0 H ASP A 13 7.785 -10.909 1.681 1.00 0.00 H new ATOM 0 HA ASP A 13 9.455 -8.965 2.613 1.00 0.00 H new ATOM 0 HB2 ASP A 13 10.254 -8.784 0.308 1.00 0.00 H new ATOM 0 HB3 ASP A 13 9.908 -10.458 0.695 1.00 0.00 H new ATOM 164 N MET A 14 7.012 -7.636 0.823 1.00 0.00 N ATOM 165 CA MET A 14 6.312 -6.388 0.545 1.00 0.00 C ATOM 166 C MET A 14 5.845 -5.726 1.837 1.00 0.00 C ATOM 167 O MET A 14 6.117 -4.550 2.078 1.00 0.00 O ATOM 168 CB MET A 14 5.114 -6.644 -0.373 1.00 0.00 C ATOM 169 CG MET A 14 4.272 -5.406 -0.632 1.00 0.00 C ATOM 170 SD MET A 14 3.195 -4.995 0.755 1.00 0.00 S ATOM 171 CE MET A 14 1.783 -6.040 0.408 1.00 0.00 C ATOM 0 H MET A 14 6.602 -8.458 0.380 1.00 0.00 H new ATOM 0 HA MET A 14 7.008 -5.715 0.044 1.00 0.00 H new ATOM 0 HB2 MET A 14 5.473 -7.035 -1.325 1.00 0.00 H new ATOM 0 HB3 MET A 14 4.485 -7.415 0.071 1.00 0.00 H new ATOM 0 HG2 MET A 14 4.929 -4.561 -0.839 1.00 0.00 H new ATOM 0 HG3 MET A 14 3.665 -5.564 -1.524 1.00 0.00 H new ATOM 0 HE1 MET A 14 1.074 -5.979 1.234 1.00 0.00 H new ATOM 0 HE2 MET A 14 1.300 -5.706 -0.510 1.00 0.00 H new ATOM 0 HE3 MET A 14 2.114 -7.072 0.289 1.00 0.00 H new ATOM 181 N LYS A 15 5.140 -6.489 2.666 1.00 0.00 N ATOM 182 CA LYS A 15 4.635 -5.978 3.935 1.00 0.00 C ATOM 183 C LYS A 15 5.759 -5.353 4.755 1.00 0.00 C ATOM 184 O LYS A 15 5.636 -4.230 5.243 1.00 0.00 O ATOM 185 CB LYS A 15 3.971 -7.102 4.733 1.00 0.00 C ATOM 186 CG LYS A 15 2.911 -7.859 3.951 1.00 0.00 C ATOM 187 CD LYS A 15 2.186 -8.867 4.827 1.00 0.00 C ATOM 188 CE LYS A 15 2.862 -10.229 4.784 1.00 0.00 C ATOM 189 NZ LYS A 15 1.916 -11.329 5.119 1.00 0.00 N ATOM 0 H LYS A 15 4.905 -7.464 2.481 1.00 0.00 H new ATOM 0 HA LYS A 15 3.894 -5.208 3.719 1.00 0.00 H new ATOM 0 HB2 LYS A 15 4.737 -7.803 5.063 1.00 0.00 H new ATOM 0 HB3 LYS A 15 3.517 -6.680 5.630 1.00 0.00 H new ATOM 0 HG2 LYS A 15 2.192 -7.154 3.534 1.00 0.00 H new ATOM 0 HG3 LYS A 15 3.376 -8.374 3.110 1.00 0.00 H new ATOM 0 HD2 LYS A 15 2.159 -8.505 5.855 1.00 0.00 H new ATOM 0 HD3 LYS A 15 1.152 -8.962 4.495 1.00 0.00 H new ATOM 0 HE2 LYS A 15 3.277 -10.397 3.790 1.00 0.00 H new ATOM 0 HE3 LYS A 15 3.697 -10.242 5.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 2.445 -12.136 5.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 1.230 -10.994 5.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 1.411 -11.626 4.260 1.00 0.00 H new ATOM 203 N LYS A 16 6.856 -6.088 4.903 1.00 0.00 N ATOM 204 CA LYS A 16 8.004 -5.606 5.662 1.00 0.00 C ATOM 205 C LYS A 16 8.501 -4.273 5.110 1.00 0.00 C ATOM 206 O LYS A 16 8.750 -3.333 5.864 1.00 0.00 O ATOM 207 CB LYS A 16 9.135 -6.637 5.627 1.00 0.00 C ATOM 208 CG LYS A 16 10.124 -6.495 6.771 1.00 0.00 C ATOM 209 CD LYS A 16 11.266 -5.562 6.407 1.00 0.00 C ATOM 210 CE LYS A 16 11.850 -4.888 7.639 1.00 0.00 C ATOM 211 NZ LYS A 16 13.140 -4.206 7.340 1.00 0.00 N ATOM 0 H LYS A 16 6.974 -7.021 4.507 1.00 0.00 H new ATOM 0 HA LYS A 16 7.688 -5.457 6.694 1.00 0.00 H new ATOM 0 HB2 LYS A 16 8.704 -7.638 5.653 1.00 0.00 H new ATOM 0 HB3 LYS A 16 9.670 -6.545 4.682 1.00 0.00 H new ATOM 0 HG2 LYS A 16 9.609 -6.115 7.653 1.00 0.00 H new ATOM 0 HG3 LYS A 16 10.523 -7.475 7.032 1.00 0.00 H new ATOM 0 HD2 LYS A 16 12.047 -6.124 5.894 1.00 0.00 H new ATOM 0 HD3 LYS A 16 10.909 -4.803 5.711 1.00 0.00 H new ATOM 0 HE2 LYS A 16 11.137 -4.161 8.028 1.00 0.00 H new ATOM 0 HE3 LYS A 16 12.005 -5.632 8.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 13.505 -3.759 8.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 13.829 -4.903 6.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 12.988 -3.479 6.613 1.00 0.00 H new ATOM 225 N TYR A 17 8.640 -4.200 3.792 1.00 0.00 N ATOM 226 CA TYR A 17 9.107 -2.982 3.139 1.00 0.00 C ATOM 227 C TYR A 17 8.038 -1.895 3.185 1.00 0.00 C ATOM 228 O TYR A 17 8.190 -0.888 3.875 1.00 0.00 O ATOM 229 CB TYR A 17 9.494 -3.272 1.688 1.00 0.00 C ATOM 230 CG TYR A 17 9.697 -2.027 0.855 1.00 0.00 C ATOM 231 CD1 TYR A 17 10.912 -1.354 0.862 1.00 0.00 C ATOM 232 CD2 TYR A 17 8.673 -1.523 0.062 1.00 0.00 C ATOM 233 CE1 TYR A 17 11.102 -0.215 0.103 1.00 0.00 C ATOM 234 CE2 TYR A 17 8.855 -0.386 -0.701 1.00 0.00 C ATOM 235 CZ TYR A 17 10.071 0.264 -0.677 1.00 0.00 C ATOM 236 OH TYR A 17 10.255 1.398 -1.435 1.00 0.00 O ATOM 0 H TYR A 17 8.436 -4.969 3.154 1.00 0.00 H new ATOM 0 HA TYR A 17 9.985 -2.625 3.677 1.00 0.00 H new ATOM 0 HB2 TYR A 17 10.411 -3.860 1.676 1.00 0.00 H new ATOM 0 HB3 TYR A 17 8.717 -3.883 1.229 1.00 0.00 H new ATOM 0 HD1 TYR A 17 11.722 -1.727 1.471 1.00 0.00 H new ATOM 0 HD2 TYR A 17 7.719 -2.029 0.042 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.053 0.297 0.121 1.00 0.00 H new ATOM 0 HE2 TYR A 17 8.049 -0.008 -1.313 1.00 0.00 H new ATOM 0 HH TYR A 17 9.860 2.167 -0.974 1.00 0.00 H new ATOM 246 N ALA A 18 6.955 -2.108 2.445 1.00 0.00 N ATOM 247 CA ALA A 18 5.858 -1.149 2.402 1.00 0.00 C ATOM 248 C ALA A 18 5.675 -0.463 3.751 1.00 0.00 C ATOM 249 O ALA A 18 5.334 0.717 3.816 1.00 0.00 O ATOM 250 CB ALA A 18 4.570 -1.839 1.979 1.00 0.00 C ATOM 0 H ALA A 18 6.814 -2.936 1.867 1.00 0.00 H new ATOM 0 HA ALA A 18 6.106 -0.384 1.666 1.00 0.00 H new ATOM 0 HB1 ALA A 18 3.759 -1.111 1.951 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.699 -2.276 0.989 1.00 0.00 H new ATOM 0 HB3 ALA A 18 4.327 -2.625 2.693 1.00 0.00 H new ATOM 256 N GLU A 19 5.904 -1.211 4.826 1.00 0.00 N ATOM 257 CA GLU A 19 5.763 -0.674 6.174 1.00 0.00 C ATOM 258 C GLU A 19 6.884 0.313 6.487 1.00 0.00 C ATOM 259 O GLU A 19 6.658 1.520 6.576 1.00 0.00 O ATOM 260 CB GLU A 19 5.765 -1.808 7.202 1.00 0.00 C ATOM 261 CG GLU A 19 5.241 -1.394 8.566 1.00 0.00 C ATOM 262 CD GLU A 19 5.815 -2.233 9.691 1.00 0.00 C ATOM 263 OE1 GLU A 19 7.030 -2.520 9.656 1.00 0.00 O ATOM 264 OE2 GLU A 19 5.050 -2.604 10.606 1.00 0.00 O ATOM 0 H GLU A 19 6.188 -2.190 4.789 1.00 0.00 H new ATOM 0 HA GLU A 19 4.811 -0.145 6.229 1.00 0.00 H new ATOM 0 HB2 GLU A 19 5.159 -2.631 6.824 1.00 0.00 H new ATOM 0 HB3 GLU A 19 6.782 -2.185 7.312 1.00 0.00 H new ATOM 0 HG2 GLU A 19 5.482 -0.345 8.741 1.00 0.00 H new ATOM 0 HG3 GLU A 19 4.154 -1.477 8.574 1.00 0.00 H new ATOM 271 N THR A 20 8.095 -0.210 6.654 1.00 0.00 N ATOM 272 CA THR A 20 9.252 0.623 6.958 1.00 0.00 C ATOM 273 C THR A 20 9.462 1.686 5.886 1.00 0.00 C ATOM 274 O THR A 20 10.246 2.617 6.066 1.00 0.00 O ATOM 275 CB THR A 20 10.534 -0.221 7.087 1.00 0.00 C ATOM 276 OG1 THR A 20 11.622 0.604 7.518 1.00 0.00 O ATOM 277 CG2 THR A 20 10.884 -0.879 5.761 1.00 0.00 C ATOM 0 H THR A 20 8.300 -1.207 6.584 1.00 0.00 H new ATOM 0 HA THR A 20 9.049 1.109 7.912 1.00 0.00 H new ATOM 0 HB THR A 20 10.356 -1.002 7.826 1.00 0.00 H new ATOM 0 HG1 THR A 20 11.424 1.541 7.310 1.00 0.00 H new ATOM 0 HG21 THR A 20 11.793 -1.470 5.877 1.00 0.00 H new ATOM 0 HG22 THR A 20 10.066 -1.529 5.450 1.00 0.00 H new ATOM 0 HG23 THR A 20 11.044 -0.111 5.005 1.00 0.00 H new ATOM 285 N PHE A 21 8.756 1.540 4.769 1.00 0.00 N ATOM 286 CA PHE A 21 8.866 2.488 3.667 1.00 0.00 C ATOM 287 C PHE A 21 7.796 3.571 3.771 1.00 0.00 C ATOM 288 O PHE A 21 8.074 4.755 3.580 1.00 0.00 O ATOM 289 CB PHE A 21 8.741 1.761 2.326 1.00 0.00 C ATOM 290 CG PHE A 21 8.337 2.658 1.192 1.00 0.00 C ATOM 291 CD1 PHE A 21 8.998 3.855 0.969 1.00 0.00 C ATOM 292 CD2 PHE A 21 7.296 2.305 0.349 1.00 0.00 C ATOM 293 CE1 PHE A 21 8.627 4.683 -0.073 1.00 0.00 C ATOM 294 CE2 PHE A 21 6.921 3.129 -0.696 1.00 0.00 C ATOM 295 CZ PHE A 21 7.588 4.319 -0.908 1.00 0.00 C ATOM 0 H PHE A 21 8.102 0.775 4.604 1.00 0.00 H new ATOM 0 HA PHE A 21 9.846 2.962 3.726 1.00 0.00 H new ATOM 0 HB2 PHE A 21 9.695 1.293 2.086 1.00 0.00 H new ATOM 0 HB3 PHE A 21 8.008 0.960 2.423 1.00 0.00 H new ATOM 0 HD1 PHE A 21 9.812 4.144 1.617 1.00 0.00 H new ATOM 0 HD2 PHE A 21 6.771 1.375 0.510 1.00 0.00 H new ATOM 0 HE1 PHE A 21 9.149 5.615 -0.235 1.00 0.00 H new ATOM 0 HE2 PHE A 21 6.107 2.842 -1.346 1.00 0.00 H new ATOM 0 HZ PHE A 21 7.298 4.964 -1.725 1.00 0.00 H new ATOM 305 N LEU A 22 6.571 3.156 4.076 1.00 0.00 N ATOM 306 CA LEU A 22 5.457 4.089 4.206 1.00 0.00 C ATOM 307 C LEU A 22 5.362 4.629 5.630 1.00 0.00 C ATOM 308 O LEU A 22 4.509 5.461 5.932 1.00 0.00 O ATOM 309 CB LEU A 22 4.145 3.405 3.819 1.00 0.00 C ATOM 310 CG LEU A 22 3.997 3.021 2.347 1.00 0.00 C ATOM 311 CD1 LEU A 22 2.873 2.012 2.169 1.00 0.00 C ATOM 312 CD2 LEU A 22 3.746 4.257 1.495 1.00 0.00 C ATOM 0 H LEU A 22 6.324 2.180 4.238 1.00 0.00 H new ATOM 0 HA LEU A 22 5.636 4.926 3.531 1.00 0.00 H new ATOM 0 HB2 LEU A 22 4.037 2.503 4.422 1.00 0.00 H new ATOM 0 HB3 LEU A 22 3.321 4.067 4.086 1.00 0.00 H new ATOM 0 HG LEU A 22 4.928 2.560 2.017 1.00 0.00 H new ATOM 0 HD11 LEU A 22 2.782 1.750 1.115 1.00 0.00 H new ATOM 0 HD12 LEU A 22 3.094 1.115 2.748 1.00 0.00 H new ATOM 0 HD13 LEU A 22 1.936 2.446 2.517 1.00 0.00 H new ATOM 0 HD21 LEU A 22 3.643 3.964 0.450 1.00 0.00 H new ATOM 0 HD22 LEU A 22 2.831 4.747 1.826 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.584 4.946 1.598 1.00 0.00 H new ATOM 324 N GLU A 23 6.247 4.149 6.499 1.00 0.00 N ATOM 325 CA GLU A 23 6.263 4.585 7.890 1.00 0.00 C ATOM 326 C GLU A 23 6.132 6.102 7.987 1.00 0.00 C ATOM 327 O GLU A 23 5.225 6.633 8.629 1.00 0.00 O ATOM 328 CB GLU A 23 7.552 4.128 8.576 1.00 0.00 C ATOM 329 CG GLU A 23 7.417 2.802 9.305 1.00 0.00 C ATOM 330 CD GLU A 23 8.539 2.564 10.296 1.00 0.00 C ATOM 331 OE1 GLU A 23 9.713 2.778 9.927 1.00 0.00 O ATOM 332 OE2 GLU A 23 8.243 2.164 11.442 1.00 0.00 O ATOM 0 H GLU A 23 6.961 3.459 6.264 1.00 0.00 H new ATOM 0 HA GLU A 23 5.410 4.132 8.396 1.00 0.00 H new ATOM 0 HB2 GLU A 23 8.341 4.043 7.829 1.00 0.00 H new ATOM 0 HB3 GLU A 23 7.866 4.893 9.286 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.462 2.776 9.830 1.00 0.00 H new ATOM 0 HG3 GLU A 23 7.403 1.991 8.577 1.00 0.00 H new ATOM 339 N PRO A 24 7.060 6.818 7.334 1.00 0.00 N ATOM 340 CA PRO A 24 7.070 8.284 7.331 1.00 0.00 C ATOM 341 C PRO A 24 5.913 8.870 6.530 1.00 0.00 C ATOM 342 O PRO A 24 5.700 10.083 6.526 1.00 0.00 O ATOM 343 CB PRO A 24 8.407 8.627 6.669 1.00 0.00 C ATOM 344 CG PRO A 24 8.725 7.444 5.821 1.00 0.00 C ATOM 345 CD PRO A 24 8.169 6.252 6.549 1.00 0.00 C ATOM 0 HA PRO A 24 6.957 8.695 8.334 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.331 9.534 6.070 1.00 0.00 H new ATOM 0 HB3 PRO A 24 9.184 8.801 7.413 1.00 0.00 H new ATOM 0 HG2 PRO A 24 8.277 7.541 4.832 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.801 7.346 5.676 1.00 0.00 H new ATOM 0 HD2 PRO A 24 7.821 5.485 5.857 1.00 0.00 H new ATOM 0 HD3 PRO A 24 8.918 5.787 7.190 1.00 0.00 H new ATOM 353 N TRP A 25 5.169 8.003 5.853 1.00 0.00 N ATOM 354 CA TRP A 25 4.032 8.436 5.048 1.00 0.00 C ATOM 355 C TRP A 25 2.716 8.115 5.748 1.00 0.00 C ATOM 356 O TRP A 25 1.688 8.733 5.472 1.00 0.00 O ATOM 357 CB TRP A 25 4.070 7.767 3.673 1.00 0.00 C ATOM 358 CG TRP A 25 4.834 8.553 2.651 1.00 0.00 C ATOM 359 CD1 TRP A 25 4.359 9.575 1.880 1.00 0.00 C ATOM 360 CD2 TRP A 25 6.208 8.380 2.288 1.00 0.00 C ATOM 361 NE1 TRP A 25 5.354 10.047 1.059 1.00 0.00 N ATOM 362 CE2 TRP A 25 6.499 9.331 1.291 1.00 0.00 C ATOM 363 CE3 TRP A 25 7.222 7.515 2.709 1.00 0.00 C ATOM 364 CZ2 TRP A 25 7.760 9.439 0.710 1.00 0.00 C ATOM 365 CZ3 TRP A 25 8.472 7.623 2.132 1.00 0.00 C ATOM 366 CH2 TRP A 25 8.733 8.579 1.142 1.00 0.00 C ATOM 0 H TRP A 25 5.332 6.996 5.845 1.00 0.00 H new ATOM 0 HA TRP A 25 4.099 9.516 4.920 1.00 0.00 H new ATOM 0 HB2 TRP A 25 4.519 6.778 3.770 1.00 0.00 H new ATOM 0 HB3 TRP A 25 3.049 7.621 3.320 1.00 0.00 H new ATOM 0 HD1 TRP A 25 3.349 9.956 1.911 1.00 0.00 H new ATOM 0 HE1 TRP A 25 5.256 10.807 0.386 1.00 0.00 H new ATOM 0 HE3 TRP A 25 7.031 6.775 3.472 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 7.963 10.175 -0.054 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 9.262 6.959 2.450 1.00 0.00 H new ATOM 0 HH2 TRP A 25 9.722 8.639 0.711 1.00 0.00 H new ATOM 377 N PHE A 26 2.755 7.144 6.654 1.00 0.00 N ATOM 378 CA PHE A 26 1.564 6.740 7.393 1.00 0.00 C ATOM 379 C PHE A 26 1.835 6.721 8.894 1.00 0.00 C ATOM 380 O PHE A 26 1.011 7.167 9.692 1.00 0.00 O ATOM 381 CB PHE A 26 1.095 5.359 6.930 1.00 0.00 C ATOM 382 CG PHE A 26 0.416 5.374 5.590 1.00 0.00 C ATOM 383 CD1 PHE A 26 -0.567 6.309 5.307 1.00 0.00 C ATOM 384 CD2 PHE A 26 0.761 4.454 4.614 1.00 0.00 C ATOM 385 CE1 PHE A 26 -1.193 6.326 4.075 1.00 0.00 C ATOM 386 CE2 PHE A 26 0.139 4.466 3.380 1.00 0.00 C ATOM 387 CZ PHE A 26 -0.840 5.403 3.111 1.00 0.00 C ATOM 0 H PHE A 26 3.598 6.622 6.894 1.00 0.00 H new ATOM 0 HA PHE A 26 0.778 7.469 7.193 1.00 0.00 H new ATOM 0 HB2 PHE A 26 1.953 4.689 6.886 1.00 0.00 H new ATOM 0 HB3 PHE A 26 0.409 4.950 7.671 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -0.847 7.033 6.058 1.00 0.00 H new ATOM 0 HD2 PHE A 26 1.525 3.719 4.820 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -1.957 7.060 3.867 1.00 0.00 H new ATOM 0 HE2 PHE A 26 0.418 3.744 2.627 1.00 0.00 H new ATOM 0 HZ PHE A 26 -1.328 5.413 2.148 1.00 0.00 H new ATOM 397 N LYS A 27 2.998 6.200 9.272 1.00 0.00 N ATOM 398 CA LYS A 27 3.381 6.122 10.677 1.00 0.00 C ATOM 399 C LYS A 27 3.822 7.486 11.197 1.00 0.00 C ATOM 400 O LYS A 27 4.584 8.195 10.540 1.00 0.00 O ATOM 401 CB LYS A 27 4.509 5.104 10.863 1.00 0.00 C ATOM 402 CG LYS A 27 4.667 4.627 12.296 1.00 0.00 C ATOM 403 CD LYS A 27 6.063 4.084 12.553 1.00 0.00 C ATOM 404 CE LYS A 27 7.013 5.183 13.005 1.00 0.00 C ATOM 405 NZ LYS A 27 6.821 5.525 14.442 1.00 0.00 N ATOM 0 H LYS A 27 3.692 5.825 8.625 1.00 0.00 H new ATOM 0 HA LYS A 27 2.510 5.799 11.248 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.320 4.243 10.221 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.447 5.549 10.531 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.465 5.452 12.979 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.930 3.852 12.506 1.00 0.00 H new ATOM 0 HD2 LYS A 27 6.017 3.305 13.314 1.00 0.00 H new ATOM 0 HD3 LYS A 27 6.447 3.620 11.645 1.00 0.00 H new ATOM 0 HE2 LYS A 27 8.042 4.863 12.842 1.00 0.00 H new ATOM 0 HE3 LYS A 27 6.855 6.073 12.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 7.486 6.277 14.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 5.846 5.854 14.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 6.996 4.682 15.026 1.00 0.00 H new ATOM 419 N ALA A 28 3.339 7.847 12.382 1.00 0.00 N ATOM 420 CA ALA A 28 3.687 9.125 12.991 1.00 0.00 C ATOM 421 C ALA A 28 5.170 9.432 12.815 1.00 0.00 C ATOM 422 O ALA A 28 5.991 8.541 12.598 1.00 0.00 O ATOM 423 CB ALA A 28 3.318 9.122 14.468 1.00 0.00 C ATOM 0 H ALA A 28 2.706 7.273 12.939 1.00 0.00 H new ATOM 0 HA ALA A 28 3.119 9.907 12.486 1.00 0.00 H new ATOM 0 HB1 ALA A 28 3.583 10.082 14.911 1.00 0.00 H new ATOM 0 HB2 ALA A 28 2.246 8.957 14.575 1.00 0.00 H new ATOM 0 HB3 ALA A 28 3.861 8.325 14.977 1.00 0.00 H new ATOM 429 N PRO A 29 5.523 10.723 12.908 1.00 0.00 N ATOM 430 CA PRO A 29 4.553 11.792 13.165 1.00 0.00 C ATOM 431 C PRO A 29 3.625 12.030 11.979 1.00 0.00 C ATOM 432 O PRO A 29 2.723 12.863 12.043 1.00 0.00 O ATOM 433 CB PRO A 29 5.435 13.019 13.409 1.00 0.00 C ATOM 434 CG PRO A 29 6.701 12.726 12.681 1.00 0.00 C ATOM 435 CD PRO A 29 6.895 11.238 12.769 1.00 0.00 C ATOM 0 HA PRO A 29 3.893 11.552 13.998 1.00 0.00 H new ATOM 0 HB2 PRO A 29 4.963 13.927 13.033 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.616 13.171 14.473 1.00 0.00 H new ATOM 0 HG2 PRO A 29 6.638 13.050 11.642 1.00 0.00 H new ATOM 0 HG3 PRO A 29 7.541 13.256 13.130 1.00 0.00 H new ATOM 0 HD2 PRO A 29 7.384 10.843 11.879 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.516 10.963 13.622 1.00 0.00 H new ATOM 443 N ASN A 30 3.853 11.292 10.897 1.00 0.00 N ATOM 444 CA ASN A 30 3.036 11.423 9.696 1.00 0.00 C ATOM 445 C ASN A 30 1.739 10.632 9.831 1.00 0.00 C ATOM 446 O ASN A 30 1.687 9.616 10.524 1.00 0.00 O ATOM 447 CB ASN A 30 3.815 10.942 8.470 1.00 0.00 C ATOM 448 CG ASN A 30 4.785 11.987 7.954 1.00 0.00 C ATOM 449 OD1 ASN A 30 4.584 12.562 6.884 1.00 0.00 O ATOM 450 ND2 ASN A 30 5.844 12.238 8.715 1.00 0.00 N ATOM 0 H ASN A 30 4.597 10.597 10.827 1.00 0.00 H new ATOM 0 HA ASN A 30 2.786 12.476 9.570 1.00 0.00 H new ATOM 0 HB2 ASN A 30 4.364 10.035 8.725 1.00 0.00 H new ATOM 0 HB3 ASN A 30 3.114 10.679 7.678 1.00 0.00 H new ATOM 0 HD21 ASN A 30 6.531 12.932 8.420 1.00 0.00 H new ATOM 0 HD22 ASN A 30 5.970 11.737 9.595 1.00 0.00 H new ATOM 457 N LYS A 31 0.692 11.105 9.164 1.00 0.00 N ATOM 458 CA LYS A 31 -0.606 10.443 9.206 1.00 0.00 C ATOM 459 C LYS A 31 -1.572 11.074 8.209 1.00 0.00 C ATOM 460 O LYS A 31 -1.273 12.106 7.608 1.00 0.00 O ATOM 461 CB LYS A 31 -1.193 10.517 10.618 1.00 0.00 C ATOM 462 CG LYS A 31 -1.070 11.889 11.257 1.00 0.00 C ATOM 463 CD LYS A 31 -2.153 12.119 12.297 1.00 0.00 C ATOM 464 CE LYS A 31 -3.476 12.501 11.650 1.00 0.00 C ATOM 465 NZ LYS A 31 -4.491 12.908 12.660 1.00 0.00 N ATOM 0 H LYS A 31 0.717 11.946 8.587 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.462 9.398 8.933 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -2.246 10.236 10.580 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.691 9.785 11.250 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.090 11.988 11.723 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.135 12.657 10.487 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.285 11.215 12.892 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -1.840 12.908 12.981 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.314 13.319 10.948 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -3.855 11.657 11.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -5.372 12.379 12.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -4.133 12.702 13.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -4.678 13.927 12.573 1.00 0.00 H new ATOM 479 N GLY A 32 -2.733 10.449 8.038 1.00 0.00 N ATOM 480 CA GLY A 32 -3.726 10.965 7.114 1.00 0.00 C ATOM 481 C GLY A 32 -4.441 9.864 6.357 1.00 0.00 C ATOM 482 O GLY A 32 -4.460 8.711 6.792 1.00 0.00 O ATOM 0 H GLY A 32 -3.004 9.594 8.523 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -4.457 11.557 7.665 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -3.243 11.636 6.403 1.00 0.00 H new ATOM 486 N THR A 33 -5.034 10.217 5.221 1.00 0.00 N ATOM 487 CA THR A 33 -5.757 9.251 4.403 1.00 0.00 C ATOM 488 C THR A 33 -4.948 8.857 3.173 1.00 0.00 C ATOM 489 O THR A 33 -3.913 9.457 2.880 1.00 0.00 O ATOM 490 CB THR A 33 -7.120 9.807 3.950 1.00 0.00 C ATOM 491 OG1 THR A 33 -6.953 11.111 3.383 1.00 0.00 O ATOM 492 CG2 THR A 33 -8.091 9.878 5.119 1.00 0.00 C ATOM 0 H THR A 33 -5.028 11.166 4.846 1.00 0.00 H new ATOM 0 HA THR A 33 -5.920 8.371 5.024 1.00 0.00 H new ATOM 0 HB THR A 33 -7.530 9.134 3.197 1.00 0.00 H new ATOM 0 HG1 THR A 33 -7.674 11.284 2.742 1.00 0.00 H new ATOM 0 HG21 THR A 33 -9.047 10.274 4.775 1.00 0.00 H new ATOM 0 HG22 THR A 33 -8.239 8.880 5.530 1.00 0.00 H new ATOM 0 HG23 THR A 33 -7.684 10.532 5.891 1.00 0.00 H new ATOM 500 N PHE A 34 -5.425 7.846 2.455 1.00 0.00 N ATOM 501 CA PHE A 34 -4.745 7.372 1.256 1.00 0.00 C ATOM 502 C PHE A 34 -5.655 6.458 0.440 1.00 0.00 C ATOM 503 O PHE A 34 -6.742 6.090 0.885 1.00 0.00 O ATOM 504 CB PHE A 34 -3.462 6.628 1.632 1.00 0.00 C ATOM 505 CG PHE A 34 -3.672 5.548 2.654 1.00 0.00 C ATOM 506 CD1 PHE A 34 -3.979 5.868 3.967 1.00 0.00 C ATOM 507 CD2 PHE A 34 -3.563 4.212 2.302 1.00 0.00 C ATOM 508 CE1 PHE A 34 -4.174 4.877 4.910 1.00 0.00 C ATOM 509 CE2 PHE A 34 -3.757 3.216 3.241 1.00 0.00 C ATOM 510 CZ PHE A 34 -4.062 3.549 4.546 1.00 0.00 C ATOM 0 H PHE A 34 -6.280 7.339 2.683 1.00 0.00 H new ATOM 0 HA PHE A 34 -4.489 8.239 0.647 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -3.031 6.187 0.733 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -2.736 7.344 2.016 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -4.067 6.905 4.257 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -3.324 3.946 1.283 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -4.414 5.140 5.930 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -3.670 2.178 2.954 1.00 0.00 H new ATOM 0 HZ PHE A 34 -4.213 2.772 5.281 1.00 0.00 H new ATOM 520 N GLN A 35 -5.202 6.097 -0.757 1.00 0.00 N ATOM 521 CA GLN A 35 -5.976 5.228 -1.635 1.00 0.00 C ATOM 522 C GLN A 35 -5.076 4.203 -2.317 1.00 0.00 C ATOM 523 O GLN A 35 -4.208 4.559 -3.115 1.00 0.00 O ATOM 524 CB GLN A 35 -6.713 6.058 -2.688 1.00 0.00 C ATOM 525 CG GLN A 35 -5.820 7.050 -3.416 1.00 0.00 C ATOM 526 CD GLN A 35 -6.431 7.543 -4.712 1.00 0.00 C ATOM 527 OE1 GLN A 35 -7.074 8.593 -4.750 1.00 0.00 O ATOM 528 NE2 GLN A 35 -6.232 6.787 -5.786 1.00 0.00 N ATOM 0 H GLN A 35 -4.304 6.393 -1.140 1.00 0.00 H new ATOM 0 HA GLN A 35 -6.706 4.695 -1.026 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -7.165 5.386 -3.417 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -7.527 6.600 -2.207 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -5.623 7.901 -2.765 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -4.859 6.581 -3.627 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -5.693 5.924 -5.710 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -6.618 7.069 -6.687 1.00 0.00 H new ATOM 537 N ILE A 36 -5.288 2.931 -1.998 1.00 0.00 N ATOM 538 CA ILE A 36 -4.497 1.855 -2.580 1.00 0.00 C ATOM 539 C ILE A 36 -5.090 1.392 -3.907 1.00 0.00 C ATOM 540 O ILE A 36 -6.309 1.333 -4.067 1.00 0.00 O ATOM 541 CB ILE A 36 -4.397 0.650 -1.627 1.00 0.00 C ATOM 542 CG1 ILE A 36 -3.701 1.056 -0.327 1.00 0.00 C ATOM 543 CG2 ILE A 36 -3.653 -0.496 -2.297 1.00 0.00 C ATOM 544 CD1 ILE A 36 -3.949 0.098 0.817 1.00 0.00 C ATOM 0 H ILE A 36 -6.002 2.620 -1.339 1.00 0.00 H new ATOM 0 HA ILE A 36 -3.498 2.256 -2.751 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.405 0.312 -1.387 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.628 1.126 -0.506 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.041 2.050 -0.038 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.591 -1.340 -1.610 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.187 -0.799 -3.198 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -2.648 -0.170 -2.564 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.425 0.449 1.706 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.018 0.046 1.023 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.583 -0.893 0.548 1.00 0.00 H new ATOM 556 N VAL A 37 -4.219 1.064 -4.856 1.00 0.00 N ATOM 557 CA VAL A 37 -4.656 0.603 -6.168 1.00 0.00 C ATOM 558 C VAL A 37 -3.713 -0.461 -6.719 1.00 0.00 C ATOM 559 O VAL A 37 -2.496 -0.275 -6.742 1.00 0.00 O ATOM 560 CB VAL A 37 -4.741 1.768 -7.172 1.00 0.00 C ATOM 561 CG1 VAL A 37 -5.118 1.256 -8.554 1.00 0.00 C ATOM 562 CG2 VAL A 37 -5.736 2.813 -6.692 1.00 0.00 C ATOM 0 H VAL A 37 -3.207 1.109 -4.740 1.00 0.00 H new ATOM 0 HA VAL A 37 -5.649 0.172 -6.038 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.760 2.238 -7.240 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -5.173 2.093 -9.250 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -4.364 0.548 -8.898 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.087 0.760 -8.506 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -5.783 3.629 -7.413 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -6.722 2.358 -6.593 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -5.417 3.202 -5.725 1.00 0.00 H new ATOM 572 N TYR A 38 -4.282 -1.576 -7.162 1.00 0.00 N ATOM 573 CA TYR A 38 -3.492 -2.671 -7.712 1.00 0.00 C ATOM 574 C TYR A 38 -3.370 -2.548 -9.228 1.00 0.00 C ATOM 575 O TYR A 38 -4.352 -2.691 -9.956 1.00 0.00 O ATOM 576 CB TYR A 38 -4.124 -4.016 -7.348 1.00 0.00 C ATOM 577 CG TYR A 38 -3.411 -5.204 -7.954 1.00 0.00 C ATOM 578 CD1 TYR A 38 -2.257 -5.716 -7.375 1.00 0.00 C ATOM 579 CD2 TYR A 38 -3.893 -5.814 -9.106 1.00 0.00 C ATOM 580 CE1 TYR A 38 -1.603 -6.801 -7.926 1.00 0.00 C ATOM 581 CE2 TYR A 38 -3.246 -6.900 -9.663 1.00 0.00 C ATOM 582 CZ TYR A 38 -2.101 -7.389 -9.070 1.00 0.00 C ATOM 583 OH TYR A 38 -1.453 -8.470 -9.621 1.00 0.00 O ATOM 0 H TYR A 38 -5.288 -1.746 -7.151 1.00 0.00 H new ATOM 0 HA TYR A 38 -2.493 -2.617 -7.280 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -4.132 -4.122 -6.263 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -5.163 -4.020 -7.676 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -1.864 -5.258 -6.479 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -4.789 -5.432 -9.574 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -0.707 -7.187 -7.463 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -3.635 -7.363 -10.558 1.00 0.00 H new ATOM 0 HH TYR A 38 -2.059 -9.240 -9.640 1.00 0.00 H new ATOM 593 N LYS A 39 -2.156 -2.281 -9.697 1.00 0.00 N ATOM 594 CA LYS A 39 -1.901 -2.140 -11.125 1.00 0.00 C ATOM 595 C LYS A 39 -0.994 -3.258 -11.630 1.00 0.00 C ATOM 596 O LYS A 39 0.142 -3.399 -11.178 1.00 0.00 O ATOM 597 CB LYS A 39 -1.264 -0.780 -11.418 1.00 0.00 C ATOM 598 CG LYS A 39 -2.182 0.396 -11.135 1.00 0.00 C ATOM 599 CD LYS A 39 -1.564 1.708 -11.590 1.00 0.00 C ATOM 600 CE LYS A 39 -1.872 1.992 -13.052 1.00 0.00 C ATOM 601 NZ LYS A 39 -1.036 3.101 -13.590 1.00 0.00 N ATOM 0 H LYS A 39 -1.332 -2.158 -9.108 1.00 0.00 H new ATOM 0 HA LYS A 39 -2.855 -2.208 -11.647 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -0.359 -0.676 -10.819 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -0.960 -0.749 -12.464 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -3.134 0.246 -11.643 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -2.395 0.444 -10.067 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -1.942 2.523 -10.973 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -0.484 1.672 -11.445 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -1.702 1.091 -13.641 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -2.926 2.248 -13.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -1.276 3.264 -14.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -1.217 3.968 -13.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -0.031 2.847 -13.513 1.00 0.00 H new ATOM 615 N SER A 40 -1.503 -4.048 -12.569 1.00 0.00 N ATOM 616 CA SER A 40 -0.740 -5.155 -13.133 1.00 0.00 C ATOM 617 C SER A 40 -0.590 -4.998 -14.644 1.00 0.00 C ATOM 618 O SER A 40 -1.555 -4.693 -15.345 1.00 0.00 O ATOM 619 CB SER A 40 -1.419 -6.487 -12.812 1.00 0.00 C ATOM 620 OG SER A 40 -2.754 -6.507 -13.289 1.00 0.00 O ATOM 0 H SER A 40 -2.441 -3.942 -12.956 1.00 0.00 H new ATOM 0 HA SER A 40 0.253 -5.145 -12.684 1.00 0.00 H new ATOM 0 HB2 SER A 40 -0.856 -7.304 -13.263 1.00 0.00 H new ATOM 0 HB3 SER A 40 -1.412 -6.652 -11.735 1.00 0.00 H new ATOM 0 HG SER A 40 -2.822 -7.127 -14.045 1.00 0.00 H new ATOM 626 N ARG A 41 0.626 -5.208 -15.137 1.00 0.00 N ATOM 627 CA ARG A 41 0.903 -5.089 -16.563 1.00 0.00 C ATOM 628 C ARG A 41 1.282 -6.443 -17.158 1.00 0.00 C ATOM 629 O ARG A 41 0.804 -6.817 -18.228 1.00 0.00 O ATOM 630 CB ARG A 41 2.029 -4.082 -16.803 1.00 0.00 C ATOM 631 CG ARG A 41 2.040 -3.504 -18.209 1.00 0.00 C ATOM 632 CD ARG A 41 2.743 -4.432 -19.187 1.00 0.00 C ATOM 633 NE ARG A 41 4.174 -4.154 -19.273 1.00 0.00 N ATOM 634 CZ ARG A 41 5.058 -5.001 -19.790 1.00 0.00 C ATOM 635 NH1 ARG A 41 4.659 -6.173 -20.263 1.00 0.00 N ATOM 636 NH2 ARG A 41 6.343 -4.675 -19.833 1.00 0.00 N ATOM 0 H ARG A 41 1.435 -5.461 -14.570 1.00 0.00 H new ATOM 0 HA ARG A 41 -0.003 -4.735 -17.055 1.00 0.00 H new ATOM 0 HB2 ARG A 41 1.935 -3.267 -16.085 1.00 0.00 H new ATOM 0 HB3 ARG A 41 2.986 -4.567 -16.611 1.00 0.00 H new ATOM 0 HG2 ARG A 41 1.016 -3.332 -18.541 1.00 0.00 H new ATOM 0 HG3 ARG A 41 2.540 -2.535 -18.202 1.00 0.00 H new ATOM 0 HD2 ARG A 41 2.593 -5.466 -18.877 1.00 0.00 H new ATOM 0 HD3 ARG A 41 2.293 -4.326 -20.174 1.00 0.00 H new ATOM 0 HE ARG A 41 4.514 -3.261 -18.917 1.00 0.00 H new ATOM 0 HH11 ARG A 41 3.672 -6.427 -20.231 1.00 0.00 H new ATOM 0 HH12 ARG A 41 5.339 -6.821 -20.659 1.00 0.00 H new ATOM 0 HH21 ARG A 41 6.653 -3.774 -19.469 1.00 0.00 H new ATOM 0 HH22 ARG A 41 7.021 -5.325 -20.230 1.00 0.00 H new ATOM 650 N ASN A 42 2.144 -7.171 -16.456 1.00 0.00 N ATOM 651 CA ASN A 42 2.588 -8.482 -16.916 1.00 0.00 C ATOM 652 C ASN A 42 1.471 -9.513 -16.781 1.00 0.00 C ATOM 653 O ASN A 42 1.024 -10.091 -17.771 1.00 0.00 O ATOM 654 CB ASN A 42 3.814 -8.936 -16.121 1.00 0.00 C ATOM 655 CG ASN A 42 5.055 -8.133 -16.463 1.00 0.00 C ATOM 656 OD1 ASN A 42 5.130 -6.912 -15.945 1.00 0.00 O flip ATOM 657 ND2 ASN A 42 5.934 -8.605 -17.183 1.00 0.00 N flip ATOM 0 H ASN A 42 2.549 -6.876 -15.567 1.00 0.00 H new ATOM 0 HA ASN A 42 2.856 -8.398 -17.969 1.00 0.00 H new ATOM 0 HB2 ASN A 42 3.607 -8.843 -15.055 1.00 0.00 H new ATOM 0 HB3 ASN A 42 4.002 -9.991 -16.319 1.00 0.00 H new ATOM 0 HD21 ASN A 42 5.834 -9.548 -17.559 1.00 0.00 H new ATOM 0 HD22 ASN A 42 6.763 -8.053 -17.404 1.00 0.00 H new ATOM 664 N ASN A 43 1.026 -9.737 -15.549 1.00 0.00 N ATOM 665 CA ASN A 43 -0.039 -10.697 -15.285 1.00 0.00 C ATOM 666 C ASN A 43 -0.518 -10.594 -13.840 1.00 0.00 C ATOM 667 O ASN A 43 0.280 -10.408 -12.922 1.00 0.00 O ATOM 668 CB ASN A 43 0.445 -12.120 -15.573 1.00 0.00 C ATOM 669 CG ASN A 43 0.267 -12.508 -17.028 1.00 0.00 C ATOM 670 OD1 ASN A 43 -0.816 -12.357 -17.594 1.00 0.00 O ATOM 671 ND2 ASN A 43 1.333 -13.011 -17.640 1.00 0.00 N ATOM 0 H ASN A 43 1.386 -9.267 -14.718 1.00 0.00 H new ATOM 0 HA ASN A 43 -0.875 -10.464 -15.944 1.00 0.00 H new ATOM 0 HB2 ASN A 43 1.498 -12.204 -15.304 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -0.102 -12.821 -14.943 1.00 0.00 H new ATOM 0 HD21 ASN A 43 1.274 -13.290 -18.619 1.00 0.00 H new ATOM 0 HD22 ASN A 43 2.210 -13.118 -17.131 1.00 0.00 H new ATOM 678 N SER A 44 -1.828 -10.717 -13.646 1.00 0.00 N ATOM 679 CA SER A 44 -2.414 -10.634 -12.314 1.00 0.00 C ATOM 680 C SER A 44 -2.686 -12.027 -11.752 1.00 0.00 C ATOM 681 O SER A 44 -3.811 -12.523 -11.810 1.00 0.00 O ATOM 682 CB SER A 44 -3.713 -9.826 -12.354 1.00 0.00 C ATOM 683 OG SER A 44 -4.666 -10.434 -13.209 1.00 0.00 O ATOM 0 H SER A 44 -2.503 -10.874 -14.395 1.00 0.00 H new ATOM 0 HA SER A 44 -1.701 -10.130 -11.662 1.00 0.00 H new ATOM 0 HB2 SER A 44 -4.124 -9.742 -11.348 1.00 0.00 H new ATOM 0 HB3 SER A 44 -3.504 -8.813 -12.699 1.00 0.00 H new ATOM 0 HG SER A 44 -4.811 -11.362 -12.929 1.00 0.00 H new ATOM 689 N HIS A 45 -1.646 -12.652 -11.209 1.00 0.00 N ATOM 690 CA HIS A 45 -1.771 -13.987 -10.636 1.00 0.00 C ATOM 691 C HIS A 45 -2.226 -13.914 -9.182 1.00 0.00 C ATOM 692 O HIS A 45 -3.206 -14.550 -8.794 1.00 0.00 O ATOM 693 CB HIS A 45 -0.440 -14.732 -10.730 1.00 0.00 C ATOM 694 CG HIS A 45 0.693 -14.021 -10.055 1.00 0.00 C ATOM 695 ND1 HIS A 45 1.371 -12.903 -10.406 1.00 0.00 N flip ATOM 696 CD2 HIS A 45 1.254 -14.453 -8.872 1.00 0.00 C flip ATOM 697 CE1 HIS A 45 2.318 -12.681 -9.437 1.00 0.00 C flip ATOM 698 NE2 HIS A 45 2.227 -13.630 -8.523 1.00 0.00 N flip ATOM 0 H HIS A 45 -0.708 -12.255 -11.154 1.00 0.00 H new ATOM 0 HA HIS A 45 -2.524 -14.531 -11.206 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -0.554 -15.721 -10.285 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -0.190 -14.882 -11.780 1.00 0.00 H new ATOM 0 HD2 HIS A 45 0.946 -15.327 -8.317 1.00 0.00 H new ATOM 0 HE1 HIS A 45 3.023 -11.863 -9.424 1.00 0.00 H new ATOM 0 HE2 HIS A 45 2.809 -13.713 -7.689 1.00 0.00 H new ATOM 706 N VAL A 46 -1.506 -13.135 -8.380 1.00 0.00 N ATOM 707 CA VAL A 46 -1.835 -12.979 -6.969 1.00 0.00 C ATOM 708 C VAL A 46 -3.113 -12.167 -6.789 1.00 0.00 C ATOM 709 O VAL A 46 -3.274 -11.104 -7.388 1.00 0.00 O ATOM 710 CB VAL A 46 -0.691 -12.293 -6.198 1.00 0.00 C ATOM 711 CG1 VAL A 46 -0.287 -10.997 -6.885 1.00 0.00 C ATOM 712 CG2 VAL A 46 -1.100 -12.036 -4.756 1.00 0.00 C ATOM 0 H VAL A 46 -0.691 -12.602 -8.684 1.00 0.00 H new ATOM 0 HA VAL A 46 -1.985 -13.981 -6.567 1.00 0.00 H new ATOM 0 HB VAL A 46 0.172 -12.959 -6.194 1.00 0.00 H new ATOM 0 HG11 VAL A 46 0.522 -10.526 -6.327 1.00 0.00 H new ATOM 0 HG12 VAL A 46 0.049 -11.212 -7.899 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -1.143 -10.323 -6.922 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -0.280 -11.551 -4.226 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -1.977 -11.390 -4.736 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -1.336 -12.983 -4.270 1.00 0.00 H new ATOM 722 N ASN A 47 -4.019 -12.675 -5.960 1.00 0.00 N ATOM 723 CA ASN A 47 -5.284 -11.996 -5.701 1.00 0.00 C ATOM 724 C ASN A 47 -5.046 -10.566 -5.225 1.00 0.00 C ATOM 725 O ASN A 47 -4.670 -10.337 -4.076 1.00 0.00 O ATOM 726 CB ASN A 47 -6.094 -12.765 -4.655 1.00 0.00 C ATOM 727 CG ASN A 47 -7.588 -12.563 -4.818 1.00 0.00 C ATOM 728 OD1 ASN A 47 -8.044 -12.001 -5.814 1.00 0.00 O ATOM 729 ND2 ASN A 47 -8.357 -13.021 -3.838 1.00 0.00 N ATOM 0 H ASN A 47 -3.901 -13.554 -5.456 1.00 0.00 H new ATOM 0 HA ASN A 47 -5.847 -11.961 -6.634 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -5.863 -13.828 -4.730 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -5.793 -12.443 -3.658 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -9.370 -12.914 -3.892 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -7.935 -13.480 -3.031 1.00 0.00 H new ATOM 736 N ARG A 48 -5.269 -9.607 -6.118 1.00 0.00 N ATOM 737 CA ARG A 48 -5.079 -8.199 -5.791 1.00 0.00 C ATOM 738 C ARG A 48 -5.657 -7.878 -4.415 1.00 0.00 C ATOM 739 O ARG A 48 -5.022 -7.199 -3.609 1.00 0.00 O ATOM 740 CB ARG A 48 -5.737 -7.314 -6.851 1.00 0.00 C ATOM 741 CG ARG A 48 -7.221 -7.585 -7.036 1.00 0.00 C ATOM 742 CD ARG A 48 -7.727 -7.032 -8.359 1.00 0.00 C ATOM 743 NE ARG A 48 -7.562 -7.987 -9.451 1.00 0.00 N ATOM 744 CZ ARG A 48 -8.206 -9.147 -9.518 1.00 0.00 C ATOM 745 NH1 ARG A 48 -9.056 -9.492 -8.560 1.00 0.00 N ATOM 746 NH2 ARG A 48 -8.002 -9.963 -10.544 1.00 0.00 N ATOM 0 H ARG A 48 -5.581 -9.780 -7.074 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.008 -7.997 -5.773 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -5.599 -6.268 -6.576 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -5.228 -7.463 -7.803 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -7.404 -8.659 -6.995 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -7.779 -7.135 -6.215 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -8.781 -6.770 -8.263 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.190 -6.113 -8.597 1.00 0.00 H new ATOM 0 HE ARG A 48 -6.916 -7.750 -10.204 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -9.216 -8.866 -7.770 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -9.550 -10.383 -8.613 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -7.350 -9.700 -11.283 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -8.497 -10.853 -10.594 1.00 0.00 H new ATOM 760 N GLU A 49 -6.864 -8.371 -4.156 1.00 0.00 N ATOM 761 CA GLU A 49 -7.527 -8.135 -2.879 1.00 0.00 C ATOM 762 C GLU A 49 -6.552 -8.314 -1.719 1.00 0.00 C ATOM 763 O GLU A 49 -6.401 -7.427 -0.880 1.00 0.00 O ATOM 764 CB GLU A 49 -8.715 -9.084 -2.713 1.00 0.00 C ATOM 765 CG GLU A 49 -9.985 -8.595 -3.389 1.00 0.00 C ATOM 766 CD GLU A 49 -10.064 -9.003 -4.847 1.00 0.00 C ATOM 767 OE1 GLU A 49 -9.597 -10.112 -5.180 1.00 0.00 O ATOM 768 OE2 GLU A 49 -10.593 -8.212 -5.656 1.00 0.00 O ATOM 0 H GLU A 49 -7.402 -8.936 -4.813 1.00 0.00 H new ATOM 0 HA GLU A 49 -7.889 -7.107 -2.871 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -8.449 -10.060 -3.120 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -8.911 -9.225 -1.650 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -10.850 -8.991 -2.857 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -10.036 -7.509 -3.316 1.00 0.00 H new ATOM 775 N GLU A 50 -5.895 -9.469 -1.679 1.00 0.00 N ATOM 776 CA GLU A 50 -4.936 -9.765 -0.621 1.00 0.00 C ATOM 777 C GLU A 50 -3.904 -8.648 -0.493 1.00 0.00 C ATOM 778 O GLU A 50 -3.569 -8.222 0.612 1.00 0.00 O ATOM 779 CB GLU A 50 -4.232 -11.095 -0.899 1.00 0.00 C ATOM 780 CG GLU A 50 -4.949 -12.298 -0.310 1.00 0.00 C ATOM 781 CD GLU A 50 -6.444 -12.265 -0.558 1.00 0.00 C ATOM 782 OE1 GLU A 50 -6.876 -12.700 -1.646 1.00 0.00 O ATOM 783 OE2 GLU A 50 -7.183 -11.803 0.337 1.00 0.00 O ATOM 0 H GLU A 50 -6.009 -10.214 -2.366 1.00 0.00 H new ATOM 0 HA GLU A 50 -5.483 -9.840 0.319 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -4.140 -11.229 -1.977 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -3.220 -11.052 -0.496 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -4.533 -13.210 -0.739 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -4.763 -12.337 0.763 1.00 0.00 H new ATOM 790 N VAL A 51 -3.405 -8.178 -1.632 1.00 0.00 N ATOM 791 CA VAL A 51 -2.412 -7.110 -1.649 1.00 0.00 C ATOM 792 C VAL A 51 -3.008 -5.799 -1.149 1.00 0.00 C ATOM 793 O VAL A 51 -2.568 -5.252 -0.137 1.00 0.00 O ATOM 794 CB VAL A 51 -1.842 -6.896 -3.063 1.00 0.00 C ATOM 795 CG1 VAL A 51 -0.710 -5.880 -3.034 1.00 0.00 C ATOM 796 CG2 VAL A 51 -1.369 -8.217 -3.652 1.00 0.00 C ATOM 0 H VAL A 51 -3.672 -8.520 -2.555 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.605 -7.417 -0.983 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.634 -6.503 -3.700 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -0.319 -5.742 -4.042 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -1.085 -4.929 -2.656 1.00 0.00 H new ATOM 0 HG13 VAL A 51 0.086 -6.241 -2.383 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -0.969 -8.047 -4.652 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -0.591 -8.641 -3.017 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.208 -8.911 -3.710 1.00 0.00 H new ATOM 806 N ILE A 52 -4.010 -5.300 -1.864 1.00 0.00 N ATOM 807 CA ILE A 52 -4.667 -4.053 -1.492 1.00 0.00 C ATOM 808 C ILE A 52 -5.175 -4.107 -0.055 1.00 0.00 C ATOM 809 O ILE A 52 -4.749 -3.324 0.794 1.00 0.00 O ATOM 810 CB ILE A 52 -5.847 -3.737 -2.430 1.00 0.00 C ATOM 811 CG1 ILE A 52 -5.352 -3.564 -3.867 1.00 0.00 C ATOM 812 CG2 ILE A 52 -6.577 -2.487 -1.960 1.00 0.00 C ATOM 813 CD1 ILE A 52 -6.447 -3.697 -4.903 1.00 0.00 C ATOM 0 H ILE A 52 -4.385 -5.740 -2.704 1.00 0.00 H new ATOM 0 HA ILE A 52 -3.921 -3.264 -1.582 1.00 0.00 H new ATOM 0 HB ILE A 52 -6.546 -4.573 -2.405 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -4.886 -2.584 -3.967 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -4.580 -4.306 -4.069 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -7.408 -2.276 -2.633 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.958 -2.646 -0.951 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -5.888 -1.642 -1.959 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -6.024 -3.563 -5.899 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -6.898 -4.687 -4.831 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -7.209 -2.937 -4.727 1.00 0.00 H new ATOM 825 N ARG A 53 -6.086 -5.038 0.211 1.00 0.00 N ATOM 826 CA ARG A 53 -6.651 -5.194 1.545 1.00 0.00 C ATOM 827 C ARG A 53 -5.554 -5.177 2.606 1.00 0.00 C ATOM 828 O ARG A 53 -5.564 -4.340 3.509 1.00 0.00 O ATOM 829 CB ARG A 53 -7.443 -6.500 1.637 1.00 0.00 C ATOM 830 CG ARG A 53 -8.585 -6.591 0.639 1.00 0.00 C ATOM 831 CD ARG A 53 -9.864 -5.988 1.200 1.00 0.00 C ATOM 832 NE ARG A 53 -10.332 -6.704 2.384 1.00 0.00 N ATOM 833 CZ ARG A 53 -11.522 -6.504 2.941 1.00 0.00 C ATOM 834 NH1 ARG A 53 -12.359 -5.616 2.423 1.00 0.00 N ATOM 835 NH2 ARG A 53 -11.876 -7.194 4.017 1.00 0.00 N ATOM 0 H ARG A 53 -6.448 -5.695 -0.480 1.00 0.00 H new ATOM 0 HA ARG A 53 -7.323 -4.355 1.728 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -6.765 -7.338 1.478 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -7.844 -6.602 2.645 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -8.309 -6.073 -0.279 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -8.758 -7.635 0.376 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -9.691 -4.942 1.453 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -10.640 -6.007 0.435 1.00 0.00 H new ATOM 0 HE ARG A 53 -9.712 -7.395 2.806 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -12.090 -5.084 1.595 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -13.272 -5.464 2.852 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -11.235 -7.879 4.418 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -12.789 -7.040 4.444 1.00 0.00 H new ATOM 849 N GLU A 54 -4.610 -6.105 2.489 1.00 0.00 N ATOM 850 CA GLU A 54 -3.507 -6.196 3.439 1.00 0.00 C ATOM 851 C GLU A 54 -2.790 -4.856 3.570 1.00 0.00 C ATOM 852 O GLU A 54 -2.791 -4.240 4.637 1.00 0.00 O ATOM 853 CB GLU A 54 -2.516 -7.277 3.002 1.00 0.00 C ATOM 854 CG GLU A 54 -1.241 -7.304 3.828 1.00 0.00 C ATOM 855 CD GLU A 54 -1.393 -8.100 5.110 1.00 0.00 C ATOM 856 OE1 GLU A 54 -1.410 -9.346 5.035 1.00 0.00 O ATOM 857 OE2 GLU A 54 -1.495 -7.476 6.187 1.00 0.00 O ATOM 0 H GLU A 54 -4.586 -6.804 1.747 1.00 0.00 H new ATOM 0 HA GLU A 54 -3.920 -6.464 4.412 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -3.002 -8.251 3.067 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -2.257 -7.119 1.955 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -0.435 -7.733 3.232 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -0.949 -6.283 4.071 1.00 0.00 H new ATOM 864 N LEU A 55 -2.177 -4.411 2.478 1.00 0.00 N ATOM 865 CA LEU A 55 -1.455 -3.143 2.470 1.00 0.00 C ATOM 866 C LEU A 55 -2.134 -2.123 3.378 1.00 0.00 C ATOM 867 O LEU A 55 -1.468 -1.367 4.085 1.00 0.00 O ATOM 868 CB LEU A 55 -1.365 -2.595 1.045 1.00 0.00 C ATOM 869 CG LEU A 55 -0.147 -3.034 0.232 1.00 0.00 C ATOM 870 CD1 LEU A 55 -0.470 -3.038 -1.254 1.00 0.00 C ATOM 871 CD2 LEU A 55 1.041 -2.127 0.519 1.00 0.00 C ATOM 0 H LEU A 55 -2.165 -4.909 1.588 1.00 0.00 H new ATOM 0 HA LEU A 55 -0.449 -3.324 2.848 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -2.264 -2.893 0.505 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -1.370 -1.506 1.095 1.00 0.00 H new ATOM 0 HG LEU A 55 0.117 -4.049 0.528 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.409 -3.353 -1.817 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -1.291 -3.729 -1.446 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -0.760 -2.035 -1.566 1.00 0.00 H new ATOM 0 HD21 LEU A 55 1.899 -2.454 -0.068 1.00 0.00 H new ATOM 0 HD22 LEU A 55 0.788 -1.101 0.252 1.00 0.00 H new ATOM 0 HD23 LEU A 55 1.288 -2.175 1.580 1.00 0.00 H new ATOM 883 N ALA A 56 -3.463 -2.109 3.354 1.00 0.00 N ATOM 884 CA ALA A 56 -4.232 -1.185 4.178 1.00 0.00 C ATOM 885 C ALA A 56 -4.166 -1.577 5.650 1.00 0.00 C ATOM 886 O ALA A 56 -3.861 -0.752 6.510 1.00 0.00 O ATOM 887 CB ALA A 56 -5.678 -1.136 3.707 1.00 0.00 C ATOM 0 H ALA A 56 -4.029 -2.727 2.773 1.00 0.00 H new ATOM 0 HA ALA A 56 -3.794 -0.193 4.073 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.241 -0.442 4.331 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -5.712 -0.801 2.670 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.119 -2.130 3.781 1.00 0.00 H new ATOM 893 N GLY A 57 -4.455 -2.844 5.934 1.00 0.00 N ATOM 894 CA GLY A 57 -4.424 -3.323 7.304 1.00 0.00 C ATOM 895 C GLY A 57 -3.145 -2.940 8.023 1.00 0.00 C ATOM 896 O GLY A 57 -3.142 -2.757 9.241 1.00 0.00 O ATOM 0 H GLY A 57 -4.710 -3.547 5.240 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -5.278 -2.918 7.847 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -4.529 -4.408 7.309 1.00 0.00 H new ATOM 900 N ILE A 58 -2.058 -2.819 7.269 1.00 0.00 N ATOM 901 CA ILE A 58 -0.768 -2.456 7.843 1.00 0.00 C ATOM 902 C ILE A 58 -0.707 -0.965 8.158 1.00 0.00 C ATOM 903 O ILE A 58 -0.332 -0.567 9.261 1.00 0.00 O ATOM 904 CB ILE A 58 0.391 -2.816 6.895 1.00 0.00 C ATOM 905 CG1 ILE A 58 0.369 -4.312 6.574 1.00 0.00 C ATOM 906 CG2 ILE A 58 1.724 -2.422 7.514 1.00 0.00 C ATOM 907 CD1 ILE A 58 1.043 -4.658 5.264 1.00 0.00 C ATOM 0 H ILE A 58 -2.045 -2.967 6.260 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.662 -3.025 8.766 1.00 0.00 H new ATOM 0 HB ILE A 58 0.266 -2.261 5.965 1.00 0.00 H new ATOM 0 HG12 ILE A 58 0.860 -4.856 7.381 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -0.666 -4.654 6.543 1.00 0.00 H new ATOM 0 HG21 ILE A 58 2.533 -2.683 6.832 1.00 0.00 H new ATOM 0 HG22 ILE A 58 1.736 -1.348 7.698 1.00 0.00 H new ATOM 0 HG23 ILE A 58 1.859 -2.953 8.456 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.990 -5.734 5.101 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.538 -4.142 4.448 1.00 0.00 H new ATOM 0 HD13 ILE A 58 2.087 -4.347 5.299 1.00 0.00 H new ATOM 919 N VAL A 59 -1.080 -0.143 7.182 1.00 0.00 N ATOM 920 CA VAL A 59 -1.070 1.304 7.356 1.00 0.00 C ATOM 921 C VAL A 59 -1.675 1.701 8.698 1.00 0.00 C ATOM 922 O VAL A 59 -1.075 2.459 9.461 1.00 0.00 O ATOM 923 CB VAL A 59 -1.846 2.010 6.227 1.00 0.00 C ATOM 924 CG1 VAL A 59 -1.900 3.510 6.474 1.00 0.00 C ATOM 925 CG2 VAL A 59 -1.215 1.706 4.877 1.00 0.00 C ATOM 0 H VAL A 59 -1.393 -0.455 6.263 1.00 0.00 H new ATOM 0 HA VAL A 59 -0.027 1.619 7.324 1.00 0.00 H new ATOM 0 HB VAL A 59 -2.868 1.630 6.219 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -2.452 3.992 5.667 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -2.401 3.705 7.422 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -0.887 3.910 6.510 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -1.775 2.212 4.091 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -0.183 2.057 4.870 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -1.234 0.631 4.701 1.00 0.00 H new ATOM 935 N CYS A 60 -2.865 1.182 8.980 1.00 0.00 N ATOM 936 CA CYS A 60 -3.552 1.482 10.232 1.00 0.00 C ATOM 937 C CYS A 60 -2.716 1.043 11.430 1.00 0.00 C ATOM 938 O CYS A 60 -2.728 1.687 12.479 1.00 0.00 O ATOM 939 CB CYS A 60 -4.917 0.793 10.266 1.00 0.00 C ATOM 940 SG CYS A 60 -5.874 1.126 11.763 1.00 0.00 S ATOM 0 H CYS A 60 -3.374 0.552 8.360 1.00 0.00 H new ATOM 0 HA CYS A 60 -3.696 2.561 10.290 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -5.495 1.113 9.399 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -4.771 -0.283 10.173 1.00 0.00 H new ATOM 0 HG CYS A 60 -5.077 1.534 12.706 1.00 0.00 H new ATOM 946 N THR A 61 -1.992 -0.060 11.267 1.00 0.00 N ATOM 947 CA THR A 61 -1.152 -0.587 12.335 1.00 0.00 C ATOM 948 C THR A 61 -0.101 0.431 12.762 1.00 0.00 C ATOM 949 O THR A 61 0.310 0.465 13.922 1.00 0.00 O ATOM 950 CB THR A 61 -0.447 -1.888 11.905 1.00 0.00 C ATOM 951 OG1 THR A 61 -1.415 -2.847 11.467 1.00 0.00 O ATOM 952 CG2 THR A 61 0.365 -2.467 13.053 1.00 0.00 C ATOM 0 H THR A 61 -1.971 -0.606 10.405 1.00 0.00 H new ATOM 0 HA THR A 61 -1.809 -0.800 13.178 1.00 0.00 H new ATOM 0 HB THR A 61 0.230 -1.655 11.083 1.00 0.00 H new ATOM 0 HG1 THR A 61 -1.811 -2.549 10.622 1.00 0.00 H new ATOM 0 HG21 THR A 61 0.854 -3.385 12.726 1.00 0.00 H new ATOM 0 HG22 THR A 61 1.120 -1.745 13.365 1.00 0.00 H new ATOM 0 HG23 THR A 61 -0.296 -2.686 13.892 1.00 0.00 H new ATOM 960 N LEU A 62 0.332 1.258 11.817 1.00 0.00 N ATOM 961 CA LEU A 62 1.336 2.279 12.095 1.00 0.00 C ATOM 962 C LEU A 62 0.766 3.374 12.991 1.00 0.00 C ATOM 963 O LEU A 62 1.166 3.516 14.146 1.00 0.00 O ATOM 964 CB LEU A 62 1.849 2.888 10.789 1.00 0.00 C ATOM 965 CG LEU A 62 2.470 1.911 9.791 1.00 0.00 C ATOM 966 CD1 LEU A 62 2.591 2.554 8.418 1.00 0.00 C ATOM 967 CD2 LEU A 62 3.831 1.439 10.282 1.00 0.00 C ATOM 0 H LEU A 62 0.004 1.242 10.851 1.00 0.00 H new ATOM 0 HA LEU A 62 2.166 1.804 12.617 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.020 3.398 10.299 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.591 3.648 11.033 1.00 0.00 H new ATOM 0 HG LEU A 62 1.815 1.044 9.707 1.00 0.00 H new ATOM 0 HD11 LEU A 62 3.035 1.843 7.721 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.601 2.841 8.062 1.00 0.00 H new ATOM 0 HD13 LEU A 62 3.223 3.439 8.485 1.00 0.00 H new ATOM 0 HD21 LEU A 62 4.258 0.744 9.559 1.00 0.00 H new ATOM 0 HD22 LEU A 62 4.494 2.297 10.396 1.00 0.00 H new ATOM 0 HD23 LEU A 62 3.717 0.938 11.243 1.00 0.00 H new ATOM 979 N ASN A 63 -0.172 4.145 12.451 1.00 0.00 N ATOM 980 CA ASN A 63 -0.798 5.227 13.202 1.00 0.00 C ATOM 981 C ASN A 63 -2.319 5.116 13.149 1.00 0.00 C ATOM 982 O ASN A 63 -2.918 5.152 12.074 1.00 0.00 O ATOM 983 CB ASN A 63 -0.355 6.583 12.649 1.00 0.00 C ATOM 984 CG ASN A 63 -0.344 7.665 13.712 1.00 0.00 C ATOM 985 OD1 ASN A 63 -1.005 7.544 14.743 1.00 0.00 O ATOM 986 ND2 ASN A 63 0.409 8.730 13.464 1.00 0.00 N ATOM 0 H ASN A 63 -0.515 4.041 11.496 1.00 0.00 H new ATOM 0 HA ASN A 63 -0.481 5.145 14.242 1.00 0.00 H new ATOM 0 HB2 ASN A 63 0.642 6.489 12.220 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -1.023 6.879 11.840 1.00 0.00 H new ATOM 0 HD21 ASN A 63 0.456 9.490 14.142 1.00 0.00 H new ATOM 0 HD22 ASN A 63 0.941 8.788 12.595 1.00 0.00 H new ATOM 993 N SER A 64 -2.938 4.980 14.317 1.00 0.00 N ATOM 994 CA SER A 64 -4.389 4.861 14.405 1.00 0.00 C ATOM 995 C SER A 64 -5.073 6.027 13.698 1.00 0.00 C ATOM 996 O SER A 64 -6.228 5.924 13.285 1.00 0.00 O ATOM 997 CB SER A 64 -4.830 4.806 15.869 1.00 0.00 C ATOM 998 OG SER A 64 -4.654 3.507 16.406 1.00 0.00 O ATOM 0 H SER A 64 -2.457 4.949 15.216 1.00 0.00 H new ATOM 0 HA SER A 64 -4.684 3.936 13.910 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.255 5.525 16.452 1.00 0.00 H new ATOM 0 HB3 SER A 64 -5.878 5.097 15.948 1.00 0.00 H new ATOM 0 HG SER A 64 -4.941 3.499 17.343 1.00 0.00 H new ATOM 1004 N GLU A 65 -4.352 7.135 13.565 1.00 0.00 N ATOM 1005 CA GLU A 65 -4.890 8.322 12.909 1.00 0.00 C ATOM 1006 C GLU A 65 -5.064 8.084 11.412 1.00 0.00 C ATOM 1007 O GLU A 65 -5.884 8.731 10.762 1.00 0.00 O ATOM 1008 CB GLU A 65 -3.970 9.522 13.143 1.00 0.00 C ATOM 1009 CG GLU A 65 -3.874 9.941 14.600 1.00 0.00 C ATOM 1010 CD GLU A 65 -5.118 10.662 15.083 1.00 0.00 C ATOM 1011 OE1 GLU A 65 -6.182 10.496 14.451 1.00 0.00 O ATOM 1012 OE2 GLU A 65 -5.027 11.391 16.092 1.00 0.00 O ATOM 0 H GLU A 65 -3.395 7.236 13.902 1.00 0.00 H new ATOM 0 HA GLU A 65 -5.868 8.534 13.342 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -2.972 9.281 12.777 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -4.330 10.366 12.554 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -3.707 9.059 15.218 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -3.008 10.590 14.731 1.00 0.00 H new ATOM 1019 N ASN A 66 -4.286 7.151 10.872 1.00 0.00 N ATOM 1020 CA ASN A 66 -4.353 6.829 9.452 1.00 0.00 C ATOM 1021 C ASN A 66 -5.705 6.218 9.095 1.00 0.00 C ATOM 1022 O ASN A 66 -6.225 5.368 9.819 1.00 0.00 O ATOM 1023 CB ASN A 66 -3.229 5.862 9.073 1.00 0.00 C ATOM 1024 CG ASN A 66 -1.863 6.371 9.494 1.00 0.00 C ATOM 1025 OD1 ASN A 66 -1.569 7.561 9.377 1.00 0.00 O ATOM 1026 ND2 ASN A 66 -1.022 5.469 9.986 1.00 0.00 N ATOM 0 H ASN A 66 -3.602 6.605 11.397 1.00 0.00 H new ATOM 0 HA ASN A 66 -4.233 7.755 8.890 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -3.413 4.894 9.540 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -3.238 5.703 7.995 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -0.089 5.752 10.286 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -1.309 4.493 10.064 1.00 0.00 H new ATOM 1033 N LYS A 67 -6.270 6.656 7.975 1.00 0.00 N ATOM 1034 CA LYS A 67 -7.560 6.153 7.520 1.00 0.00 C ATOM 1035 C LYS A 67 -7.629 6.130 5.997 1.00 0.00 C ATOM 1036 O LYS A 67 -7.747 7.174 5.355 1.00 0.00 O ATOM 1037 CB LYS A 67 -8.693 7.016 8.080 1.00 0.00 C ATOM 1038 CG LYS A 67 -9.028 6.714 9.531 1.00 0.00 C ATOM 1039 CD LYS A 67 -10.494 6.979 9.831 1.00 0.00 C ATOM 1040 CE LYS A 67 -11.369 5.806 9.419 1.00 0.00 C ATOM 1041 NZ LYS A 67 -12.691 5.831 10.104 1.00 0.00 N ATOM 0 H LYS A 67 -5.854 7.360 7.365 1.00 0.00 H new ATOM 0 HA LYS A 67 -7.674 5.133 7.886 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -8.416 8.067 7.991 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -9.585 6.869 7.472 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -8.793 5.672 9.751 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -8.406 7.326 10.184 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -10.619 7.171 10.897 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -10.817 7.877 9.305 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -11.519 5.827 8.340 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -10.857 4.872 9.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -13.257 5.015 9.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -12.550 5.785 11.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -13.191 6.710 9.862 1.00 0.00 H new ATOM 1055 N VAL A 68 -7.556 4.933 5.423 1.00 0.00 N ATOM 1056 CA VAL A 68 -7.612 4.775 3.975 1.00 0.00 C ATOM 1057 C VAL A 68 -8.947 5.261 3.421 1.00 0.00 C ATOM 1058 O VAL A 68 -10.006 4.756 3.792 1.00 0.00 O ATOM 1059 CB VAL A 68 -7.403 3.305 3.563 1.00 0.00 C ATOM 1060 CG1 VAL A 68 -8.333 2.393 4.347 1.00 0.00 C ATOM 1061 CG2 VAL A 68 -7.615 3.137 2.066 1.00 0.00 C ATOM 0 H VAL A 68 -7.458 4.059 5.939 1.00 0.00 H new ATOM 0 HA VAL A 68 -6.807 5.380 3.559 1.00 0.00 H new ATOM 0 HB VAL A 68 -6.376 3.023 3.796 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -8.171 1.359 4.042 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -8.128 2.494 5.413 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -9.368 2.672 4.149 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -7.464 2.093 1.792 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -8.630 3.437 1.806 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -6.903 3.761 1.525 1.00 0.00 H new ATOM 1071 N ASP A 69 -8.887 6.245 2.530 1.00 0.00 N ATOM 1072 CA ASP A 69 -10.091 6.799 1.922 1.00 0.00 C ATOM 1073 C ASP A 69 -9.971 6.823 0.401 1.00 0.00 C ATOM 1074 O ASP A 69 -8.882 7.007 -0.143 1.00 0.00 O ATOM 1075 CB ASP A 69 -10.349 8.212 2.448 1.00 0.00 C ATOM 1076 CG ASP A 69 -11.825 8.559 2.475 1.00 0.00 C ATOM 1077 OD1 ASP A 69 -12.546 8.016 3.337 1.00 0.00 O ATOM 1078 OD2 ASP A 69 -12.259 9.374 1.634 1.00 0.00 O ATOM 0 H ASP A 69 -8.018 6.675 2.213 1.00 0.00 H new ATOM 0 HA ASP A 69 -10.932 6.160 2.192 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -9.939 8.303 3.454 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -9.821 8.932 1.822 1.00 0.00 H new ATOM 1083 N LEU A 70 -11.097 6.635 -0.279 1.00 0.00 N ATOM 1084 CA LEU A 70 -11.118 6.634 -1.737 1.00 0.00 C ATOM 1085 C LEU A 70 -11.813 7.881 -2.273 1.00 0.00 C ATOM 1086 O LEU A 70 -12.008 8.028 -3.480 1.00 0.00 O ATOM 1087 CB LEU A 70 -11.824 5.380 -2.256 1.00 0.00 C ATOM 1088 CG LEU A 70 -11.325 4.048 -1.695 1.00 0.00 C ATOM 1089 CD1 LEU A 70 -12.246 2.913 -2.114 1.00 0.00 C ATOM 1090 CD2 LEU A 70 -9.899 3.777 -2.152 1.00 0.00 C ATOM 0 H LEU A 70 -12.007 6.481 0.156 1.00 0.00 H new ATOM 0 HA LEU A 70 -10.087 6.635 -2.090 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -12.888 5.469 -2.035 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -11.725 5.354 -3.341 1.00 0.00 H new ATOM 0 HG LEU A 70 -11.331 4.110 -0.607 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -11.875 1.973 -1.705 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -13.251 3.101 -1.736 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -12.274 2.850 -3.202 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.561 2.825 -1.743 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -9.867 3.736 -3.241 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -9.246 4.576 -1.800 1.00 0.00 H new ATOM 1102 N THR A 71 -12.185 8.781 -1.367 1.00 0.00 N ATOM 1103 CA THR A 71 -12.858 10.016 -1.748 1.00 0.00 C ATOM 1104 C THR A 71 -11.916 11.210 -1.644 1.00 0.00 C ATOM 1105 O THR A 71 -11.720 11.944 -2.612 1.00 0.00 O ATOM 1106 CB THR A 71 -14.096 10.276 -0.868 1.00 0.00 C ATOM 1107 OG1 THR A 71 -14.943 9.121 -0.861 1.00 0.00 O ATOM 1108 CG2 THR A 71 -14.875 11.480 -1.374 1.00 0.00 C ATOM 0 H THR A 71 -12.031 8.677 -0.364 1.00 0.00 H new ATOM 0 HA THR A 71 -13.176 9.896 -2.784 1.00 0.00 H new ATOM 0 HB THR A 71 -13.757 10.483 0.147 1.00 0.00 H new ATOM 0 HG1 THR A 71 -15.727 9.293 -0.298 1.00 0.00 H new ATOM 0 HG21 THR A 71 -15.744 11.644 -0.738 1.00 0.00 H new ATOM 0 HG22 THR A 71 -14.236 12.363 -1.351 1.00 0.00 H new ATOM 0 HG23 THR A 71 -15.204 11.297 -2.397 1.00 0.00 H new ATOM 1116 N ASN A 72 -11.333 11.398 -0.465 1.00 0.00 N ATOM 1117 CA ASN A 72 -10.410 12.503 -0.235 1.00 0.00 C ATOM 1118 C ASN A 72 -9.078 11.996 0.308 1.00 0.00 C ATOM 1119 O ASN A 72 -8.620 12.402 1.377 1.00 0.00 O ATOM 1120 CB ASN A 72 -11.021 13.511 0.740 1.00 0.00 C ATOM 1121 CG ASN A 72 -11.835 14.579 0.035 1.00 0.00 C ATOM 1122 OD1 ASN A 72 -11.639 14.841 -1.152 1.00 0.00 O ATOM 1123 ND2 ASN A 72 -12.754 15.200 0.764 1.00 0.00 N ATOM 0 H ASN A 72 -11.484 10.799 0.347 1.00 0.00 H new ATOM 0 HA ASN A 72 -10.228 12.996 -1.190 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -11.657 12.984 1.451 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -10.225 13.985 1.314 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -13.333 15.927 0.344 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -12.882 14.950 1.745 1.00 0.00 H new ATOM 1130 N PRO A 73 -8.440 11.087 -0.444 1.00 0.00 N ATOM 1131 CA PRO A 73 -7.150 10.506 -0.058 1.00 0.00 C ATOM 1132 C PRO A 73 -6.011 11.516 -0.138 1.00 0.00 C ATOM 1133 O PRO A 73 -5.918 12.284 -1.095 1.00 0.00 O ATOM 1134 CB PRO A 73 -6.945 9.387 -1.083 1.00 0.00 C ATOM 1135 CG PRO A 73 -7.740 9.810 -2.270 1.00 0.00 C ATOM 1136 CD PRO A 73 -8.927 10.558 -1.729 1.00 0.00 C ATOM 0 HA PRO A 73 -7.151 10.162 0.976 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -5.891 9.269 -1.334 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -7.290 8.428 -0.697 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -7.148 10.443 -2.931 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -8.057 8.947 -2.855 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -9.238 11.358 -2.401 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -9.787 9.903 -1.594 1.00 0.00 H new ATOM 1144 N GLN A 74 -5.148 11.509 0.872 1.00 0.00 N ATOM 1145 CA GLN A 74 -4.015 12.426 0.915 1.00 0.00 C ATOM 1146 C GLN A 74 -2.789 11.808 0.253 1.00 0.00 C ATOM 1147 O GLN A 74 -1.901 12.519 -0.219 1.00 0.00 O ATOM 1148 CB GLN A 74 -3.692 12.804 2.362 1.00 0.00 C ATOM 1149 CG GLN A 74 -4.696 13.765 2.979 1.00 0.00 C ATOM 1150 CD GLN A 74 -4.342 15.218 2.729 1.00 0.00 C ATOM 1151 OE1 GLN A 74 -5.101 15.954 2.098 1.00 0.00 O ATOM 1152 NE2 GLN A 74 -3.183 15.639 3.223 1.00 0.00 N ATOM 0 H GLN A 74 -5.211 10.879 1.672 1.00 0.00 H new ATOM 0 HA GLN A 74 -4.288 13.326 0.364 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -3.652 11.897 2.965 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -2.700 13.255 2.398 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.686 13.561 2.572 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -4.750 13.588 4.053 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -2.585 14.995 3.740 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -2.891 16.607 3.085 1.00 0.00 H new ATOM 1161 N TYR A 75 -2.746 10.481 0.220 1.00 0.00 N ATOM 1162 CA TYR A 75 -1.627 9.767 -0.383 1.00 0.00 C ATOM 1163 C TYR A 75 -2.120 8.596 -1.228 1.00 0.00 C ATOM 1164 O TYR A 75 -2.903 7.766 -0.766 1.00 0.00 O ATOM 1165 CB TYR A 75 -0.674 9.261 0.702 1.00 0.00 C ATOM 1166 CG TYR A 75 -0.213 10.341 1.654 1.00 0.00 C ATOM 1167 CD1 TYR A 75 0.830 11.194 1.316 1.00 0.00 C ATOM 1168 CD2 TYR A 75 -0.821 10.509 2.892 1.00 0.00 C ATOM 1169 CE1 TYR A 75 1.255 12.182 2.183 1.00 0.00 C ATOM 1170 CE2 TYR A 75 -0.404 11.494 3.766 1.00 0.00 C ATOM 1171 CZ TYR A 75 0.635 12.328 3.407 1.00 0.00 C ATOM 1172 OH TYR A 75 1.054 13.311 4.273 1.00 0.00 O ATOM 0 H TYR A 75 -3.473 9.878 0.604 1.00 0.00 H new ATOM 0 HA TYR A 75 -1.093 10.461 -1.032 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -1.169 8.474 1.271 1.00 0.00 H new ATOM 0 HB3 TYR A 75 0.198 8.811 0.227 1.00 0.00 H new ATOM 0 HD1 TYR A 75 1.317 11.083 0.359 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -1.634 9.858 3.176 1.00 0.00 H new ATOM 0 HE1 TYR A 75 2.068 12.836 1.904 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -0.888 11.611 4.724 1.00 0.00 H new ATOM 0 HH TYR A 75 0.513 13.280 5.090 1.00 0.00 H new ATOM 1182 N THR A 76 -1.654 8.536 -2.472 1.00 0.00 N ATOM 1183 CA THR A 76 -2.046 7.470 -3.385 1.00 0.00 C ATOM 1184 C THR A 76 -0.964 6.400 -3.477 1.00 0.00 C ATOM 1185 O THR A 76 0.050 6.585 -4.149 1.00 0.00 O ATOM 1186 CB THR A 76 -2.335 8.015 -4.796 1.00 0.00 C ATOM 1187 OG1 THR A 76 -3.301 9.069 -4.726 1.00 0.00 O ATOM 1188 CG2 THR A 76 -2.846 6.911 -5.709 1.00 0.00 C ATOM 0 H THR A 76 -1.004 9.214 -2.870 1.00 0.00 H new ATOM 0 HA THR A 76 -2.957 7.028 -2.982 1.00 0.00 H new ATOM 0 HB THR A 76 -1.404 8.403 -5.209 1.00 0.00 H new ATOM 0 HG1 THR A 76 -3.478 9.411 -5.627 1.00 0.00 H new ATOM 0 HG21 THR A 76 -3.043 7.320 -6.700 1.00 0.00 H new ATOM 0 HG22 THR A 76 -2.095 6.124 -5.784 1.00 0.00 H new ATOM 0 HG23 THR A 76 -3.766 6.496 -5.298 1.00 0.00 H new ATOM 1196 N VAL A 77 -1.187 5.279 -2.797 1.00 0.00 N ATOM 1197 CA VAL A 77 -0.231 4.178 -2.804 1.00 0.00 C ATOM 1198 C VAL A 77 -0.609 3.128 -3.843 1.00 0.00 C ATOM 1199 O VAL A 77 -1.490 2.300 -3.612 1.00 0.00 O ATOM 1200 CB VAL A 77 -0.139 3.506 -1.421 1.00 0.00 C ATOM 1201 CG1 VAL A 77 0.841 4.253 -0.529 1.00 0.00 C ATOM 1202 CG2 VAL A 77 -1.513 3.432 -0.773 1.00 0.00 C ATOM 0 H VAL A 77 -2.021 5.110 -2.235 1.00 0.00 H new ATOM 0 HA VAL A 77 0.740 4.603 -3.058 1.00 0.00 H new ATOM 0 HB VAL A 77 0.230 2.489 -1.554 1.00 0.00 H new ATOM 0 HG11 VAL A 77 0.893 3.764 0.444 1.00 0.00 H new ATOM 0 HG12 VAL A 77 1.829 4.249 -0.990 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.505 5.282 -0.400 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -1.430 2.954 0.203 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -1.913 4.439 -0.652 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -2.183 2.850 -1.406 1.00 0.00 H new ATOM 1212 N VAL A 78 0.063 3.169 -4.989 1.00 0.00 N ATOM 1213 CA VAL A 78 -0.202 2.220 -6.064 1.00 0.00 C ATOM 1214 C VAL A 78 0.871 1.138 -6.118 1.00 0.00 C ATOM 1215 O VAL A 78 2.037 1.388 -5.811 1.00 0.00 O ATOM 1216 CB VAL A 78 -0.273 2.926 -7.431 1.00 0.00 C ATOM 1217 CG1 VAL A 78 -1.346 4.004 -7.420 1.00 0.00 C ATOM 1218 CG2 VAL A 78 1.082 3.514 -7.797 1.00 0.00 C ATOM 0 H VAL A 78 0.795 3.849 -5.197 1.00 0.00 H new ATOM 0 HA VAL A 78 -1.167 1.761 -5.850 1.00 0.00 H new ATOM 0 HB VAL A 78 -0.540 2.189 -8.188 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -1.382 4.492 -8.394 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.314 3.552 -7.205 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -1.112 4.742 -6.653 1.00 0.00 H new ATOM 0 HG21 VAL A 78 1.014 4.009 -8.766 1.00 0.00 H new ATOM 0 HG22 VAL A 78 1.381 4.238 -7.039 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.823 2.716 -7.849 1.00 0.00 H new ATOM 1228 N VAL A 79 0.469 -0.067 -6.510 1.00 0.00 N ATOM 1229 CA VAL A 79 1.396 -1.188 -6.607 1.00 0.00 C ATOM 1230 C VAL A 79 1.472 -1.718 -8.034 1.00 0.00 C ATOM 1231 O VAL A 79 0.587 -2.444 -8.484 1.00 0.00 O ATOM 1232 CB VAL A 79 0.987 -2.337 -5.666 1.00 0.00 C ATOM 1233 CG1 VAL A 79 1.160 -1.924 -4.212 1.00 0.00 C ATOM 1234 CG2 VAL A 79 -0.446 -2.765 -5.940 1.00 0.00 C ATOM 0 H VAL A 79 -0.493 -0.292 -6.766 1.00 0.00 H new ATOM 0 HA VAL A 79 2.376 -0.814 -6.309 1.00 0.00 H new ATOM 0 HB VAL A 79 1.639 -3.189 -5.857 1.00 0.00 H new ATOM 0 HG11 VAL A 79 0.866 -2.748 -3.562 1.00 0.00 H new ATOM 0 HG12 VAL A 79 2.204 -1.671 -4.027 1.00 0.00 H new ATOM 0 HG13 VAL A 79 0.534 -1.057 -4.003 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -0.718 -3.578 -5.266 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -1.115 -1.920 -5.778 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -0.533 -3.105 -6.972 1.00 0.00 H new ATOM 1244 N GLU A 80 2.536 -1.349 -8.741 1.00 0.00 N ATOM 1245 CA GLU A 80 2.727 -1.788 -10.118 1.00 0.00 C ATOM 1246 C GLU A 80 3.580 -3.052 -10.174 1.00 0.00 C ATOM 1247 O GLU A 80 4.516 -3.216 -9.391 1.00 0.00 O ATOM 1248 CB GLU A 80 3.384 -0.679 -10.943 1.00 0.00 C ATOM 1249 CG GLU A 80 3.603 -1.053 -12.400 1.00 0.00 C ATOM 1250 CD GLU A 80 3.957 0.143 -13.262 1.00 0.00 C ATOM 1251 OE1 GLU A 80 4.714 1.015 -12.787 1.00 0.00 O ATOM 1252 OE2 GLU A 80 3.477 0.206 -14.413 1.00 0.00 O ATOM 0 H GLU A 80 3.278 -0.748 -8.383 1.00 0.00 H new ATOM 0 HA GLU A 80 1.747 -2.014 -10.539 1.00 0.00 H new ATOM 0 HB2 GLU A 80 2.762 0.215 -10.896 1.00 0.00 H new ATOM 0 HB3 GLU A 80 4.344 -0.424 -10.494 1.00 0.00 H new ATOM 0 HG2 GLU A 80 4.401 -1.792 -12.465 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.700 -1.523 -12.790 1.00 0.00 H new ATOM 1259 N ILE A 81 3.248 -3.942 -11.103 1.00 0.00 N ATOM 1260 CA ILE A 81 3.984 -5.190 -11.261 1.00 0.00 C ATOM 1261 C ILE A 81 4.830 -5.173 -12.530 1.00 0.00 C ATOM 1262 O ILE A 81 4.302 -5.225 -13.641 1.00 0.00 O ATOM 1263 CB ILE A 81 3.034 -6.401 -11.308 1.00 0.00 C ATOM 1264 CG1 ILE A 81 2.124 -6.411 -10.078 1.00 0.00 C ATOM 1265 CG2 ILE A 81 3.829 -7.695 -11.396 1.00 0.00 C ATOM 1266 CD1 ILE A 81 2.867 -6.637 -8.779 1.00 0.00 C ATOM 0 H ILE A 81 2.475 -3.822 -11.757 1.00 0.00 H new ATOM 0 HA ILE A 81 4.637 -5.283 -10.393 1.00 0.00 H new ATOM 0 HB ILE A 81 2.410 -6.320 -12.198 1.00 0.00 H new ATOM 0 HG12 ILE A 81 1.591 -5.462 -10.022 1.00 0.00 H new ATOM 0 HG13 ILE A 81 1.373 -7.191 -10.198 1.00 0.00 H new ATOM 0 HG21 ILE A 81 3.143 -8.542 -11.428 1.00 0.00 H new ATOM 0 HG22 ILE A 81 4.439 -7.687 -12.300 1.00 0.00 H new ATOM 0 HG23 ILE A 81 4.476 -7.785 -10.523 1.00 0.00 H new ATOM 0 HD11 ILE A 81 2.160 -6.632 -7.950 1.00 0.00 H new ATOM 0 HD12 ILE A 81 3.378 -7.599 -8.815 1.00 0.00 H new ATOM 0 HD13 ILE A 81 3.600 -5.843 -8.636 1.00 0.00 H new ATOM 1278 N ILE A 82 6.145 -5.102 -12.356 1.00 0.00 N ATOM 1279 CA ILE A 82 7.065 -5.081 -13.487 1.00 0.00 C ATOM 1280 C ILE A 82 8.075 -6.220 -13.395 1.00 0.00 C ATOM 1281 O ILE A 82 9.084 -6.115 -12.698 1.00 0.00 O ATOM 1282 CB ILE A 82 7.823 -3.743 -13.572 1.00 0.00 C ATOM 1283 CG1 ILE A 82 6.837 -2.582 -13.714 1.00 0.00 C ATOM 1284 CG2 ILE A 82 8.801 -3.761 -14.737 1.00 0.00 C ATOM 1285 CD1 ILE A 82 7.335 -1.288 -13.109 1.00 0.00 C ATOM 0 H ILE A 82 6.598 -5.058 -11.443 1.00 0.00 H new ATOM 0 HA ILE A 82 6.462 -5.205 -14.387 1.00 0.00 H new ATOM 0 HB ILE A 82 8.389 -3.604 -12.651 1.00 0.00 H new ATOM 0 HG12 ILE A 82 6.627 -2.422 -14.771 1.00 0.00 H new ATOM 0 HG13 ILE A 82 5.895 -2.856 -13.240 1.00 0.00 H new ATOM 0 HG21 ILE A 82 9.329 -2.808 -14.784 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.520 -4.568 -14.596 1.00 0.00 H new ATOM 0 HG23 ILE A 82 8.256 -3.920 -15.667 1.00 0.00 H new ATOM 0 HD11 ILE A 82 6.585 -0.509 -13.247 1.00 0.00 H new ATOM 0 HD12 ILE A 82 7.518 -1.431 -12.044 1.00 0.00 H new ATOM 0 HD13 ILE A 82 8.262 -0.990 -13.600 1.00 0.00 H new ATOM 1297 N LYS A 83 7.798 -7.308 -14.105 1.00 0.00 N ATOM 1298 CA LYS A 83 8.683 -8.467 -14.108 1.00 0.00 C ATOM 1299 C LYS A 83 8.697 -9.143 -12.741 1.00 0.00 C ATOM 1300 O LYS A 83 9.758 -9.466 -12.209 1.00 0.00 O ATOM 1301 CB LYS A 83 10.103 -8.049 -14.496 1.00 0.00 C ATOM 1302 CG LYS A 83 10.171 -7.260 -15.792 1.00 0.00 C ATOM 1303 CD LYS A 83 11.517 -6.574 -15.957 1.00 0.00 C ATOM 1304 CE LYS A 83 12.587 -7.549 -16.425 1.00 0.00 C ATOM 1305 NZ LYS A 83 13.189 -8.299 -15.288 1.00 0.00 N ATOM 0 H LYS A 83 6.966 -7.412 -14.687 1.00 0.00 H new ATOM 0 HA LYS A 83 8.307 -9.179 -14.843 1.00 0.00 H new ATOM 0 HB2 LYS A 83 10.529 -7.449 -13.692 1.00 0.00 H new ATOM 0 HB3 LYS A 83 10.723 -8.941 -14.590 1.00 0.00 H new ATOM 0 HG2 LYS A 83 9.996 -7.928 -16.635 1.00 0.00 H new ATOM 0 HG3 LYS A 83 9.377 -6.514 -15.807 1.00 0.00 H new ATOM 0 HD2 LYS A 83 11.426 -5.760 -16.676 1.00 0.00 H new ATOM 0 HD3 LYS A 83 11.818 -6.129 -15.009 1.00 0.00 H new ATOM 0 HE2 LYS A 83 12.152 -8.253 -17.135 1.00 0.00 H new ATOM 0 HE3 LYS A 83 13.368 -7.004 -16.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 14.220 -8.348 -15.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 12.970 -7.812 -14.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 12.798 -9.262 -15.262 1.00 0.00 H new ATOM 1319 N ALA A 84 7.511 -9.357 -12.179 1.00 0.00 N ATOM 1320 CA ALA A 84 7.388 -9.998 -10.876 1.00 0.00 C ATOM 1321 C ALA A 84 8.049 -9.161 -9.787 1.00 0.00 C ATOM 1322 O ALA A 84 8.770 -9.686 -8.938 1.00 0.00 O ATOM 1323 CB ALA A 84 7.996 -11.393 -10.915 1.00 0.00 C ATOM 0 H ALA A 84 6.622 -9.096 -12.606 1.00 0.00 H new ATOM 0 HA ALA A 84 6.327 -10.082 -10.639 1.00 0.00 H new ATOM 0 HB1 ALA A 84 7.897 -11.860 -9.935 1.00 0.00 H new ATOM 0 HB2 ALA A 84 7.475 -11.996 -11.659 1.00 0.00 H new ATOM 0 HB3 ALA A 84 9.051 -11.323 -11.179 1.00 0.00 H new ATOM 1329 N VAL A 85 7.800 -7.856 -9.817 1.00 0.00 N ATOM 1330 CA VAL A 85 8.371 -6.945 -8.832 1.00 0.00 C ATOM 1331 C VAL A 85 7.317 -5.984 -8.296 1.00 0.00 C ATOM 1332 O VAL A 85 6.486 -5.475 -9.049 1.00 0.00 O ATOM 1333 CB VAL A 85 9.536 -6.133 -9.427 1.00 0.00 C ATOM 1334 CG1 VAL A 85 9.017 -4.875 -10.107 1.00 0.00 C ATOM 1335 CG2 VAL A 85 10.550 -5.785 -8.347 1.00 0.00 C ATOM 0 H VAL A 85 7.206 -7.405 -10.513 1.00 0.00 H new ATOM 0 HA VAL A 85 8.747 -7.559 -8.014 1.00 0.00 H new ATOM 0 HB VAL A 85 10.035 -6.744 -10.178 1.00 0.00 H new ATOM 0 HG11 VAL A 85 9.854 -4.314 -10.522 1.00 0.00 H new ATOM 0 HG12 VAL A 85 8.332 -5.151 -10.909 1.00 0.00 H new ATOM 0 HG13 VAL A 85 8.492 -4.258 -9.378 1.00 0.00 H new ATOM 0 HG21 VAL A 85 11.366 -5.211 -8.786 1.00 0.00 H new ATOM 0 HG22 VAL A 85 10.066 -5.192 -7.571 1.00 0.00 H new ATOM 0 HG23 VAL A 85 10.945 -6.702 -7.910 1.00 0.00 H new ATOM 1345 N CYS A 86 7.357 -5.738 -6.991 1.00 0.00 N ATOM 1346 CA CYS A 86 6.404 -4.837 -6.353 1.00 0.00 C ATOM 1347 C CYS A 86 6.909 -3.398 -6.389 1.00 0.00 C ATOM 1348 O CYS A 86 7.899 -3.061 -5.740 1.00 0.00 O ATOM 1349 CB CYS A 86 6.153 -5.266 -4.907 1.00 0.00 C ATOM 1350 SG CYS A 86 4.501 -4.864 -4.293 1.00 0.00 S ATOM 0 H CYS A 86 8.039 -6.150 -6.354 1.00 0.00 H new ATOM 0 HA CYS A 86 5.467 -4.888 -6.907 1.00 0.00 H new ATOM 0 HB2 CYS A 86 6.307 -6.342 -4.827 1.00 0.00 H new ATOM 0 HB3 CYS A 86 6.893 -4.790 -4.264 1.00 0.00 H new ATOM 0 HG CYS A 86 3.970 -5.920 -3.753 1.00 0.00 H new ATOM 1356 N CYS A 87 6.222 -2.555 -7.152 1.00 0.00 N ATOM 1357 CA CYS A 87 6.603 -1.152 -7.275 1.00 0.00 C ATOM 1358 C CYS A 87 5.597 -0.252 -6.566 1.00 0.00 C ATOM 1359 O CYS A 87 4.526 0.043 -7.100 1.00 0.00 O ATOM 1360 CB CYS A 87 6.708 -0.758 -8.749 1.00 0.00 C ATOM 1361 SG CYS A 87 7.924 0.538 -9.082 1.00 0.00 S ATOM 0 H CYS A 87 5.399 -2.818 -7.694 1.00 0.00 H new ATOM 0 HA CYS A 87 7.576 -1.022 -6.802 1.00 0.00 H new ATOM 0 HB2 CYS A 87 6.966 -1.642 -9.333 1.00 0.00 H new ATOM 0 HB3 CYS A 87 5.731 -0.422 -9.095 1.00 0.00 H new ATOM 0 HG CYS A 87 7.941 0.800 -10.355 1.00 0.00 H new ATOM 1367 N LEU A 88 5.945 0.181 -5.359 1.00 0.00 N ATOM 1368 CA LEU A 88 5.072 1.047 -4.574 1.00 0.00 C ATOM 1369 C LEU A 88 5.349 2.516 -4.876 1.00 0.00 C ATOM 1370 O LEU A 88 6.456 3.008 -4.657 1.00 0.00 O ATOM 1371 CB LEU A 88 5.261 0.777 -3.081 1.00 0.00 C ATOM 1372 CG LEU A 88 4.443 -0.376 -2.498 1.00 0.00 C ATOM 1373 CD1 LEU A 88 5.206 -1.687 -2.619 1.00 0.00 C ATOM 1374 CD2 LEU A 88 4.087 -0.097 -1.045 1.00 0.00 C ATOM 0 H LEU A 88 6.826 -0.054 -4.902 1.00 0.00 H new ATOM 0 HA LEU A 88 4.040 0.827 -4.848 1.00 0.00 H new ATOM 0 HB2 LEU A 88 6.317 0.575 -2.900 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.012 1.686 -2.534 1.00 0.00 H new ATOM 0 HG LEU A 88 3.518 -0.463 -3.068 1.00 0.00 H new ATOM 0 HD11 LEU A 88 4.608 -2.496 -2.199 1.00 0.00 H new ATOM 0 HD12 LEU A 88 5.409 -1.894 -3.670 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.148 -1.611 -2.075 1.00 0.00 H new ATOM 0 HD21 LEU A 88 3.505 -0.928 -0.647 1.00 0.00 H new ATOM 0 HD22 LEU A 88 5.001 0.018 -0.462 1.00 0.00 H new ATOM 0 HD23 LEU A 88 3.500 0.819 -0.984 1.00 0.00 H new ATOM 1386 N SER A 89 4.334 3.213 -5.378 1.00 0.00 N ATOM 1387 CA SER A 89 4.468 4.626 -5.711 1.00 0.00 C ATOM 1388 C SER A 89 3.502 5.473 -4.888 1.00 0.00 C ATOM 1389 O SER A 89 2.285 5.309 -4.975 1.00 0.00 O ATOM 1390 CB SER A 89 4.213 4.847 -7.204 1.00 0.00 C ATOM 1391 OG SER A 89 4.671 6.123 -7.616 1.00 0.00 O ATOM 0 H SER A 89 3.410 2.822 -5.563 1.00 0.00 H new ATOM 0 HA SER A 89 5.486 4.934 -5.474 1.00 0.00 H new ATOM 0 HB2 SER A 89 4.718 4.072 -7.781 1.00 0.00 H new ATOM 0 HB3 SER A 89 3.147 4.755 -7.412 1.00 0.00 H new ATOM 0 HG SER A 89 4.498 6.239 -8.574 1.00 0.00 H new ATOM 1397 N VAL A 90 4.054 6.379 -4.087 1.00 0.00 N ATOM 1398 CA VAL A 90 3.242 7.252 -3.248 1.00 0.00 C ATOM 1399 C VAL A 90 3.178 8.663 -3.823 1.00 0.00 C ATOM 1400 O VAL A 90 4.206 9.304 -4.039 1.00 0.00 O ATOM 1401 CB VAL A 90 3.794 7.321 -1.811 1.00 0.00 C ATOM 1402 CG1 VAL A 90 2.834 8.078 -0.906 1.00 0.00 C ATOM 1403 CG2 VAL A 90 4.054 5.922 -1.274 1.00 0.00 C ATOM 0 H VAL A 90 5.060 6.527 -4.002 1.00 0.00 H new ATOM 0 HA VAL A 90 2.239 6.826 -3.225 1.00 0.00 H new ATOM 0 HB VAL A 90 4.741 7.861 -1.829 1.00 0.00 H new ATOM 0 HG11 VAL A 90 3.241 8.116 0.105 1.00 0.00 H new ATOM 0 HG12 VAL A 90 2.702 9.092 -1.283 1.00 0.00 H new ATOM 0 HG13 VAL A 90 1.871 7.568 -0.890 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.444 5.989 -0.258 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.123 5.355 -1.269 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.782 5.418 -1.909 1.00 0.00 H new ATOM 1413 N VAL A 91 1.962 9.140 -4.070 1.00 0.00 N ATOM 1414 CA VAL A 91 1.763 10.476 -4.619 1.00 0.00 C ATOM 1415 C VAL A 91 0.879 11.319 -3.707 1.00 0.00 C ATOM 1416 O VAL A 91 -0.162 10.861 -3.235 1.00 0.00 O ATOM 1417 CB VAL A 91 1.127 10.417 -6.021 1.00 0.00 C ATOM 1418 CG1 VAL A 91 0.942 11.819 -6.583 1.00 0.00 C ATOM 1419 CG2 VAL A 91 1.975 9.567 -6.955 1.00 0.00 C ATOM 0 H VAL A 91 1.101 8.621 -3.899 1.00 0.00 H new ATOM 0 HA VAL A 91 2.748 10.938 -4.693 1.00 0.00 H new ATOM 0 HB VAL A 91 0.144 9.953 -5.936 1.00 0.00 H new ATOM 0 HG11 VAL A 91 0.492 11.757 -7.574 1.00 0.00 H new ATOM 0 HG12 VAL A 91 0.291 12.392 -5.923 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.911 12.313 -6.655 1.00 0.00 H new ATOM 0 HG21 VAL A 91 1.511 9.536 -7.941 1.00 0.00 H new ATOM 0 HG22 VAL A 91 2.972 10.000 -7.037 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.051 8.555 -6.558 1.00 0.00 H new ATOM 1429 N LYS A 92 1.299 12.555 -3.462 1.00 0.00 N ATOM 1430 CA LYS A 92 0.546 13.465 -2.607 1.00 0.00 C ATOM 1431 C LYS A 92 -0.323 14.401 -3.442 1.00 0.00 C ATOM 1432 O LYS A 92 0.184 15.287 -4.129 1.00 0.00 O ATOM 1433 CB LYS A 92 1.499 14.283 -1.732 1.00 0.00 C ATOM 1434 CG LYS A 92 0.886 14.726 -0.415 1.00 0.00 C ATOM 1435 CD LYS A 92 1.853 15.577 0.392 1.00 0.00 C ATOM 1436 CE LYS A 92 1.421 15.683 1.846 1.00 0.00 C ATOM 1437 NZ LYS A 92 2.085 16.822 2.540 1.00 0.00 N ATOM 0 H LYS A 92 2.158 12.950 -3.844 1.00 0.00 H new ATOM 0 HA LYS A 92 -0.103 12.868 -1.966 1.00 0.00 H new ATOM 0 HB2 LYS A 92 2.390 13.690 -1.527 1.00 0.00 H new ATOM 0 HB3 LYS A 92 1.823 15.164 -2.287 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.025 15.293 -0.609 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.598 13.850 0.166 1.00 0.00 H new ATOM 0 HD2 LYS A 92 2.852 15.144 0.339 1.00 0.00 H new ATOM 0 HD3 LYS A 92 1.914 16.574 -0.044 1.00 0.00 H new ATOM 0 HE2 LYS A 92 0.339 15.808 1.895 1.00 0.00 H new ATOM 0 HE3 LYS A 92 1.658 14.754 2.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 1.764 16.861 3.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 3.116 16.690 2.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 1.838 17.712 2.061 1.00 0.00 H new ATOM 1451 N SER A 93 -1.635 14.199 -3.375 1.00 0.00 N ATOM 1452 CA SER A 93 -2.575 15.023 -4.126 1.00 0.00 C ATOM 1453 C SER A 93 -3.563 15.711 -3.190 1.00 0.00 C ATOM 1454 O SER A 93 -4.293 16.615 -3.594 1.00 0.00 O ATOM 1455 CB SER A 93 -3.331 14.170 -5.147 1.00 0.00 C ATOM 1456 OG SER A 93 -4.207 13.261 -4.502 1.00 0.00 O ATOM 0 H SER A 93 -2.071 13.472 -2.808 1.00 0.00 H new ATOM 0 HA SER A 93 -2.007 15.790 -4.653 1.00 0.00 H new ATOM 0 HB2 SER A 93 -3.900 14.816 -5.816 1.00 0.00 H new ATOM 0 HB3 SER A 93 -2.620 13.620 -5.764 1.00 0.00 H new ATOM 0 HG SER A 93 -4.680 12.729 -5.175 1.00 0.00 H new ATOM 1462 N GLY A 94 -3.580 15.276 -1.933 1.00 0.00 N ATOM 1463 CA GLY A 94 -4.482 15.860 -0.958 1.00 0.00 C ATOM 1464 C GLY A 94 -4.290 17.357 -0.815 1.00 0.00 C ATOM 1465 O GLY A 94 -5.206 18.146 -1.049 1.00 0.00 O ATOM 0 H GLY A 94 -2.985 14.530 -1.573 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -5.512 15.655 -1.252 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -4.325 15.383 0.009 1.00 0.00 H new ATOM 1469 N PRO A 95 -3.076 17.767 -0.420 1.00 0.00 N ATOM 1470 CA PRO A 95 -2.740 19.182 -0.236 1.00 0.00 C ATOM 1471 C PRO A 95 -2.673 19.938 -1.558 1.00 0.00 C ATOM 1472 O PRO A 95 -2.351 21.126 -1.589 1.00 0.00 O ATOM 1473 CB PRO A 95 -1.359 19.135 0.424 1.00 0.00 C ATOM 1474 CG PRO A 95 -0.779 17.832 -0.004 1.00 0.00 C ATOM 1475 CD PRO A 95 -1.938 16.881 -0.122 1.00 0.00 C ATOM 0 HA PRO A 95 -3.492 19.707 0.353 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -0.737 19.970 0.101 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -1.437 19.196 1.509 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -0.257 17.931 -0.956 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -0.051 17.472 0.723 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -1.779 16.150 -0.915 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -2.095 16.322 0.800 1.00 0.00 H new ATOM 1483 N SER A 96 -2.979 19.243 -2.649 1.00 0.00 N ATOM 1484 CA SER A 96 -2.950 19.849 -3.975 1.00 0.00 C ATOM 1485 C SER A 96 -3.379 21.312 -3.913 1.00 0.00 C ATOM 1486 O SER A 96 -2.669 22.199 -4.386 1.00 0.00 O ATOM 1487 CB SER A 96 -3.862 19.078 -4.931 1.00 0.00 C ATOM 1488 OG SER A 96 -3.954 19.730 -6.185 1.00 0.00 O ATOM 0 H SER A 96 -3.250 18.260 -2.641 1.00 0.00 H new ATOM 0 HA SER A 96 -1.926 19.804 -4.346 1.00 0.00 H new ATOM 0 HB2 SER A 96 -3.477 18.068 -5.070 1.00 0.00 H new ATOM 0 HB3 SER A 96 -4.856 18.983 -4.493 1.00 0.00 H new ATOM 0 HG SER A 96 -4.541 19.217 -6.778 1.00 0.00 H new ATOM 1494 N SER A 97 -4.546 21.555 -3.326 1.00 0.00 N ATOM 1495 CA SER A 97 -5.073 22.910 -3.205 1.00 0.00 C ATOM 1496 C SER A 97 -6.081 23.000 -2.063 1.00 0.00 C ATOM 1497 O SER A 97 -7.139 22.372 -2.102 1.00 0.00 O ATOM 1498 CB SER A 97 -5.731 23.343 -4.517 1.00 0.00 C ATOM 1499 OG SER A 97 -5.631 24.745 -4.698 1.00 0.00 O ATOM 0 H SER A 97 -5.145 20.832 -2.927 1.00 0.00 H new ATOM 0 HA SER A 97 -4.241 23.579 -2.986 1.00 0.00 H new ATOM 0 HB2 SER A 97 -5.255 22.830 -5.353 1.00 0.00 H new ATOM 0 HB3 SER A 97 -6.780 23.047 -4.517 1.00 0.00 H new ATOM 0 HG SER A 97 -6.057 24.997 -5.544 1.00 0.00 H new ATOM 1505 N GLY A 98 -5.745 23.788 -1.046 1.00 0.00 N ATOM 1506 CA GLY A 98 -6.630 23.947 0.093 1.00 0.00 C ATOM 1507 C GLY A 98 -5.931 23.683 1.412 1.00 0.00 C ATOM 1508 O GLY A 98 -6.163 24.384 2.396 1.00 0.00 O ATOM 0 H GLY A 98 -4.876 24.319 -0.991 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -7.035 24.959 0.096 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -7.475 23.266 -0.010 1.00 0.00 H new TER 1512 GLY A 98