USER MOD reduce.3.24.130724 H: found=0, std=0, add=657, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 643 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 NoAdj-H: A 23 HIS HE2 : A 23 HIS NE2 : A 56 ZNZN :(H bumps) USER MOD NoAdj-H: A 44 HIS HE2 : A 44 HIS NE2 : A 57 ZNZN :(H bumps) USER MOD Set 1.1: A 5 ASN : amide:sc= 1.42 K(o=1.3,f=-3.7!) USER MOD Set 1.2: B 212 G O2' : rot -129:sc= -0.085 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 162:sc= 0.257 (180deg=0.149) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00724) USER MOD Single : A 8 ASN : amide:sc= -12.6! C(o=-13!,f=-16!) USER MOD Single : A 9 GLN : amide:sc= 0.367 X(o=0.37,f=-0.059) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 0.237 K(o=0.24,f=-5.9!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 ASN : amide:sc= -5.93! C(o=-5.9!,f=-5.1!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -1.17 K(o=-1.2,f=-0.41) USER MOD Single : A 46 MET CE :methyl 171:sc= 0 (180deg=-0.0631) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.0106 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 ASN : amide:sc= -0.0278 X(o=-0.028,f=-0.12) USER MOD Single : B 201 G O2' : rot -27:sc= 0.458 USER MOD Single : B 202 G O2' : rot -22:sc= 0.341 USER MOD Single : B 203 A O2' : rot -10:sc= 0.526 USER MOD Single : B 204 C O2' : rot -97:sc= 1.05 USER MOD Single : B 205 U O2' : rot -12:sc= 0.74 USER MOD Single : B 206 A O2' : rot -141:sc= 0.938 USER MOD Single : B 207 G O2' : rot -54:sc= 1.08 USER MOD Single : B 208 C O2' : rot -12:sc= -0.343 USER MOD Single : B 209 G O2' : rot -20:sc= 0.479 USER MOD Single : B 210 G O2' : rot 180:sc= -1.9! USER MOD Single : B 211 A O2' : rot -41:sc= 0.793 USER MOD Single : B 213 G O2' : rot 11:sc= -1.01 USER MOD Single : B 214 C O2' : rot -12:sc= 0.458 USER MOD Single : B 215 U O2' : rot -88:sc= -0.572! USER MOD Single : B 216 A O2' : rot -156:sc= -0.702 USER MOD Single : B 217 G O2' : rot 7:sc= -0.589 USER MOD Single : B 218 U O2' : rot -19:sc= 0.489 USER MOD Single : B 219 C O2' : rot -23:sc= 0.493 USER MOD Single : B 220 C O2' : rot -25:sc= 0.496 USER MOD Single : B 220 C O3' : rot 180:sc= 0.34 USER MOD ----------------------------------------------------------------- ATOM 1 P G B 201 2.375 -17.991 -10.149 1.00 0.00 P ATOM 2 OP1 G B 201 2.076 -16.569 -10.430 1.00 0.00 O ATOM 3 OP2 G B 201 3.760 -18.457 -10.384 1.00 0.00 O ATOM 4 O5' G B 201 2.010 -18.280 -8.618 1.00 0.00 O ATOM 5 C5' G B 201 0.645 -18.347 -8.211 1.00 0.00 C ATOM 6 C4' G B 201 0.504 -19.260 -7.014 1.00 0.00 C ATOM 7 O4' G B 201 0.757 -20.540 -7.497 1.00 0.00 O ATOM 8 C3' G B 201 1.662 -19.183 -6.022 1.00 0.00 C ATOM 9 O3' G B 201 1.358 -18.224 -5.012 1.00 0.00 O ATOM 10 C2' G B 201 1.787 -20.567 -5.450 1.00 0.00 C ATOM 11 O2' G B 201 0.775 -20.589 -4.468 1.00 0.00 O ATOM 12 C1' G B 201 1.516 -21.413 -6.691 1.00 0.00 C ATOM 13 N9 G B 201 2.745 -21.849 -7.387 1.00 0.00 N ATOM 14 C8 G B 201 3.599 -21.083 -8.098 1.00 0.00 C ATOM 15 N7 G B 201 4.613 -21.779 -8.602 1.00 0.00 N ATOM 16 C5 G B 201 4.377 -23.059 -8.178 1.00 0.00 C ATOM 17 C6 G B 201 5.091 -24.259 -8.381 1.00 0.00 C ATOM 18 O6 G B 201 6.133 -24.368 -9.027 1.00 0.00 O ATOM 19 N1 G B 201 4.588 -25.391 -7.817 1.00 0.00 N ATOM 20 C2 G B 201 3.444 -25.301 -7.102 1.00 0.00 C ATOM 21 N2 G B 201 3.084 -26.488 -6.618 1.00 0.00 N ATOM 22 N3 G B 201 2.686 -24.220 -6.845 1.00 0.00 N ATOM 23 C4 G B 201 3.241 -23.125 -7.435 1.00 0.00 C ATOM 0 H5' G B 201 0.030 -18.714 -9.033 1.00 0.00 H new ATOM 0 H5'' G B 201 0.282 -17.350 -7.962 1.00 0.00 H new ATOM 0 H4' G B 201 -0.456 -19.013 -6.560 1.00 0.00 H new ATOM 0 H3' G B 201 2.598 -18.869 -6.485 1.00 0.00 H new ATOM 0 H2' G B 201 2.712 -20.899 -4.979 1.00 0.00 H new ATOM 0 HO2' G B 201 0.613 -19.678 -4.144 1.00 0.00 H new ATOM 0 H1' G B 201 1.014 -22.349 -6.447 1.00 0.00 H new ATOM 0 H8 G B 201 3.472 -20.020 -8.242 1.00 0.00 H new ATOM 0 H1 G B 201 5.063 -26.286 -7.931 1.00 0.00 H new ATOM 0 H21 G B 201 2.237 -26.574 -6.056 1.00 0.00 H new ATOM 0 H22 G B 201 3.655 -27.311 -6.809 1.00 0.00 H new ATOM 35 P G B 202 2.441 -17.121 -4.603 1.00 0.00 P ATOM 36 OP1 G B 202 1.761 -15.949 -4.007 1.00 0.00 O ATOM 37 OP2 G B 202 3.355 -16.873 -5.742 1.00 0.00 O ATOM 38 O5' G B 202 3.278 -17.847 -3.449 1.00 0.00 O ATOM 39 C5' G B 202 2.642 -18.197 -2.221 1.00 0.00 C ATOM 40 C4' G B 202 3.587 -19.002 -1.358 1.00 0.00 C ATOM 41 O4' G B 202 3.746 -20.188 -2.085 1.00 0.00 O ATOM 42 C3' G B 202 5.044 -18.554 -1.428 1.00 0.00 C ATOM 43 O3' G B 202 5.306 -17.628 -0.377 1.00 0.00 O ATOM 44 C2' G B 202 5.854 -19.810 -1.272 1.00 0.00 C ATOM 45 O2' G B 202 5.835 -20.021 0.121 1.00 0.00 O ATOM 46 C1' G B 202 5.022 -20.789 -2.096 1.00 0.00 C ATOM 47 N9 G B 202 5.516 -20.968 -3.477 1.00 0.00 N ATOM 48 C8 G B 202 5.441 -20.085 -4.494 1.00 0.00 C ATOM 49 N7 G B 202 5.981 -20.550 -5.617 1.00 0.00 N ATOM 50 C5 G B 202 6.420 -21.801 -5.277 1.00 0.00 C ATOM 51 C6 G B 202 7.079 -22.797 -6.029 1.00 0.00 C ATOM 52 O6 G B 202 7.395 -22.703 -7.213 1.00 0.00 O ATOM 53 N1 G B 202 7.390 -23.960 -5.392 1.00 0.00 N ATOM 54 C2 G B 202 7.054 -24.091 -4.089 1.00 0.00 C ATOM 55 N2 G B 202 7.424 -25.278 -3.613 1.00 0.00 N ATOM 56 N3 G B 202 6.429 -23.215 -3.281 1.00 0.00 N ATOM 57 C4 G B 202 6.147 -22.077 -3.975 1.00 0.00 C ATOM 0 H5' G B 202 1.739 -18.774 -2.421 1.00 0.00 H new ATOM 0 H5'' G B 202 2.333 -17.295 -1.692 1.00 0.00 H new ATOM 0 H4' G B 202 3.191 -18.983 -0.343 1.00 0.00 H new ATOM 0 H3' G B 202 5.288 -18.049 -2.362 1.00 0.00 H new ATOM 0 H2' G B 202 6.893 -19.852 -1.599 1.00 0.00 H new ATOM 0 HO2' G B 202 5.651 -19.174 0.578 1.00 0.00 H new ATOM 0 H1' G B 202 5.049 -21.798 -1.684 1.00 0.00 H new ATOM 0 H8 G B 202 4.991 -19.107 -4.406 1.00 0.00 H new ATOM 0 H1 G B 202 7.865 -24.715 -5.887 1.00 0.00 H new ATOM 0 H21 G B 202 7.235 -25.519 -2.640 1.00 0.00 H new ATOM 0 H22 G B 202 7.897 -25.947 -4.221 1.00 0.00 H new ATOM 69 P A B 203 6.423 -16.497 -0.565 1.00 0.00 P ATOM 70 OP1 A B 203 6.371 -15.550 0.572 1.00 0.00 O ATOM 71 OP2 A B 203 6.333 -15.931 -1.930 1.00 0.00 O ATOM 72 O5' A B 203 7.790 -17.322 -0.459 1.00 0.00 O ATOM 73 C5' A B 203 8.239 -17.798 0.807 1.00 0.00 C ATOM 74 C4' A B 203 9.638 -18.358 0.686 1.00 0.00 C ATOM 75 O4' A B 203 9.436 -19.174 -0.265 1.00 0.00 O ATOM 76 C3' A B 203 10.633 -17.425 -0.001 1.00 0.00 C ATOM 77 O3' A B 203 11.426 -16.768 0.985 1.00 0.00 O ATOM 78 C2' A B 203 11.470 -18.313 -0.880 1.00 0.00 C ATOM 79 O2' A B 203 12.537 -18.671 -0.032 1.00 0.00 O ATOM 80 C1' A B 203 10.474 -19.428 -1.187 1.00 0.00 C ATOM 81 N9 A B 203 9.971 -19.403 -2.576 1.00 0.00 N ATOM 82 C8 A B 203 9.018 -18.596 -3.089 1.00 0.00 C ATOM 83 N7 A B 203 8.792 -18.823 -4.378 1.00 0.00 N ATOM 84 C5 A B 203 9.658 -19.836 -4.690 1.00 0.00 C ATOM 85 C6 A B 203 9.900 -20.522 -5.900 1.00 0.00 C ATOM 86 N6 A B 203 9.255 -20.269 -7.067 1.00 0.00 N ATOM 87 N1 A B 203 10.846 -21.500 -5.887 1.00 0.00 N ATOM 88 C2 A B 203 11.493 -21.758 -4.728 1.00 0.00 C ATOM 89 N3 A B 203 11.344 -21.172 -3.525 1.00 0.00 N ATOM 90 C4 A B 203 10.387 -20.206 -3.604 1.00 0.00 C ATOM 0 H5' A B 203 7.561 -18.568 1.176 1.00 0.00 H new ATOM 0 H5'' A B 203 8.226 -16.987 1.535 1.00 0.00 H new ATOM 0 H4' A B 203 10.017 -18.654 1.664 1.00 0.00 H new ATOM 0 H3' A B 203 10.147 -16.645 -0.587 1.00 0.00 H new ATOM 0 H2' A B 203 11.897 -17.940 -1.811 1.00 0.00 H new ATOM 0 HO2' A B 203 12.500 -18.132 0.785 1.00 0.00 H new ATOM 0 H1' A B 203 10.925 -20.416 -1.096 1.00 0.00 H new ATOM 0 H8 A B 203 8.496 -17.846 -2.513 1.00 0.00 H new ATOM 0 H61 A B 203 9.484 -20.807 -7.903 1.00 0.00 H new ATOM 0 H62 A B 203 8.542 -19.541 -7.108 1.00 0.00 H new ATOM 0 H2 A B 203 12.232 -22.544 -4.774 1.00 0.00 H new ATOM 102 P C B 204 11.887 -15.252 0.762 1.00 0.00 P ATOM 103 OP1 C B 204 12.459 -14.715 2.016 1.00 0.00 O ATOM 104 OP2 C B 204 10.791 -14.486 0.128 1.00 0.00 O ATOM 105 O5' C B 204 13.074 -15.391 -0.303 1.00 0.00 O ATOM 106 C5' C B 204 14.300 -16.014 0.074 1.00 0.00 C ATOM 107 C4' C B 204 14.927 -16.693 -1.124 1.00 0.00 C ATOM 108 O4' C B 204 14.264 -17.626 -1.847 1.00 0.00 O ATOM 109 C3' C B 204 15.265 -15.752 -2.276 1.00 0.00 C ATOM 110 O3' C B 204 16.380 -14.941 -1.913 1.00 0.00 O ATOM 111 C2' C B 204 15.590 -16.649 -3.438 1.00 0.00 C ATOM 112 O2' C B 204 16.944 -16.972 -3.211 1.00 0.00 O ATOM 113 C1' C B 204 14.598 -17.784 -3.207 1.00 0.00 C ATOM 114 N1 C B 204 13.397 -17.701 -4.065 1.00 0.00 N ATOM 115 C2 C B 204 13.346 -18.524 -5.189 1.00 0.00 C ATOM 116 O2 C B 204 14.299 -19.277 -5.415 1.00 0.00 O ATOM 117 N3 C B 204 12.263 -18.466 -5.985 1.00 0.00 N ATOM 118 C4 C B 204 11.255 -17.656 -5.730 1.00 0.00 C ATOM 119 N4 C B 204 10.195 -17.614 -6.527 1.00 0.00 N ATOM 120 C5 C B 204 11.283 -16.794 -4.570 1.00 0.00 C ATOM 121 C6 C B 204 12.369 -16.863 -3.786 1.00 0.00 C ATOM 0 H5' C B 204 14.119 -16.745 0.862 1.00 0.00 H new ATOM 0 H5'' C B 204 14.985 -15.270 0.480 1.00 0.00 H new ATOM 0 H4' C B 204 15.732 -17.137 -0.538 1.00 0.00 H new ATOM 0 H3' C B 204 14.448 -15.074 -2.525 1.00 0.00 H new ATOM 0 H2' C B 204 15.502 -16.293 -4.464 1.00 0.00 H new ATOM 0 HO2' C B 204 17.515 -16.377 -3.741 1.00 0.00 H new ATOM 0 H1' C B 204 15.023 -18.756 -3.455 1.00 0.00 H new ATOM 0 H41 C B 204 9.423 -16.982 -6.316 1.00 0.00 H new ATOM 0 H42 C B 204 10.152 -18.214 -7.351 1.00 0.00 H new ATOM 0 H5 C B 204 10.466 -16.124 -4.345 1.00 0.00 H new ATOM 0 H6 C B 204 12.426 -16.234 -2.910 1.00 0.00 H new ATOM 133 P U B 205 16.345 -13.365 -2.186 1.00 0.00 P ATOM 134 OP1 U B 205 16.762 -12.638 -0.965 1.00 0.00 O ATOM 135 OP2 U B 205 15.048 -12.993 -2.792 1.00 0.00 O ATOM 136 O5' U B 205 17.485 -13.165 -3.292 1.00 0.00 O ATOM 137 C5' U B 205 18.721 -13.866 -3.177 1.00 0.00 C ATOM 138 C4' U B 205 19.100 -14.472 -4.509 1.00 0.00 C ATOM 139 O4' U B 205 18.125 -15.075 -4.874 1.00 0.00 O ATOM 140 C3' U B 205 19.258 -13.459 -5.640 1.00 0.00 C ATOM 141 O3' U B 205 20.631 -13.089 -5.757 1.00 0.00 O ATOM 142 C2' U B 205 18.770 -14.164 -6.875 1.00 0.00 C ATOM 143 O2' U B 205 19.968 -14.603 -7.475 1.00 0.00 O ATOM 144 C1' U B 205 17.907 -15.260 -6.255 1.00 0.00 C ATOM 145 N1 U B 205 16.473 -15.141 -6.590 1.00 0.00 N ATOM 146 C2 U B 205 16.037 -15.880 -7.647 1.00 0.00 C ATOM 147 O2 U B 205 16.759 -16.611 -8.306 1.00 0.00 O ATOM 148 N3 U B 205 14.701 -15.770 -7.960 1.00 0.00 N ATOM 149 C4 U B 205 13.822 -14.973 -7.271 1.00 0.00 C ATOM 150 O4 U B 205 12.649 -14.953 -7.641 1.00 0.00 O ATOM 151 C5 U B 205 14.328 -14.223 -6.177 1.00 0.00 C ATOM 152 C6 U B 205 15.627 -14.344 -5.891 1.00 0.00 C ATOM 0 H5' U B 205 18.635 -14.649 -2.424 1.00 0.00 H new ATOM 0 H5'' U B 205 19.504 -13.186 -2.842 1.00 0.00 H new ATOM 0 H4' U B 205 20.030 -15.019 -4.351 1.00 0.00 H new ATOM 0 H3' U B 205 18.696 -12.541 -5.469 1.00 0.00 H new ATOM 0 H2' U B 205 18.194 -13.634 -7.634 1.00 0.00 H new ATOM 0 HO2' U B 205 20.730 -14.163 -7.044 1.00 0.00 H new ATOM 0 H1' U B 205 18.174 -16.250 -6.624 1.00 0.00 H new ATOM 0 H3 U B 205 14.345 -16.311 -8.748 1.00 0.00 H new ATOM 0 H5 U B 205 13.685 -13.578 -5.597 1.00 0.00 H new ATOM 0 H6 U B 205 16.024 -13.778 -5.061 1.00 0.00 H new ATOM 163 P A B 206 21.053 -11.549 -5.681 1.00 0.00 P ATOM 164 OP1 A B 206 22.522 -11.427 -5.808 1.00 0.00 O ATOM 165 OP2 A B 206 20.414 -10.914 -4.506 1.00 0.00 O ATOM 166 O5' A B 206 20.390 -10.928 -6.998 1.00 0.00 O ATOM 167 C5' A B 206 20.891 -11.285 -8.285 1.00 0.00 C ATOM 168 C4' A B 206 19.773 -11.258 -9.303 1.00 0.00 C ATOM 169 O4' A B 206 18.696 -11.825 -9.262 1.00 0.00 O ATOM 170 C3' A B 206 19.328 -9.858 -9.715 1.00 0.00 C ATOM 171 O3' A B 206 20.400 -9.197 -10.385 1.00 0.00 O ATOM 172 C2' A B 206 18.152 -10.067 -10.626 1.00 0.00 C ATOM 173 O2' A B 206 18.732 -9.967 -11.908 1.00 0.00 O ATOM 174 C1' A B 206 17.717 -11.470 -10.212 1.00 0.00 C ATOM 175 N9 A B 206 16.361 -11.518 -9.626 1.00 0.00 N ATOM 176 C8 A B 206 16.014 -11.279 -8.343 1.00 0.00 C ATOM 177 N7 A B 206 14.708 -11.404 -8.134 1.00 0.00 N ATOM 178 C5 A B 206 14.208 -11.741 -9.364 1.00 0.00 C ATOM 179 C6 A B 206 12.893 -12.010 -9.796 1.00 0.00 C ATOM 180 N6 A B 206 11.797 -11.976 -8.996 1.00 0.00 N ATOM 181 N1 A B 206 12.718 -12.325 -11.109 1.00 0.00 N ATOM 182 C2 A B 206 13.803 -12.361 -11.914 1.00 0.00 C ATOM 183 N3 A B 206 15.093 -12.125 -11.612 1.00 0.00 N ATOM 184 C4 A B 206 15.200 -11.817 -10.289 1.00 0.00 C ATOM 0 H5' A B 206 21.336 -12.279 -8.248 1.00 0.00 H new ATOM 0 H5'' A B 206 21.680 -10.594 -8.581 1.00 0.00 H new ATOM 0 H4' A B 206 20.404 -11.885 -9.934 1.00 0.00 H new ATOM 0 H3' A B 206 19.054 -9.233 -8.865 1.00 0.00 H new ATOM 0 H2' A B 206 17.293 -9.397 -10.597 1.00 0.00 H new ATOM 0 HO2' A B 206 18.124 -9.484 -12.505 1.00 0.00 H new ATOM 0 H1' A B 206 17.651 -12.147 -11.064 1.00 0.00 H new ATOM 0 H8 A B 206 16.721 -11.015 -7.571 1.00 0.00 H new ATOM 0 H61 A B 206 10.876 -12.183 -9.383 1.00 0.00 H new ATOM 0 H62 A B 206 11.894 -11.743 -8.008 1.00 0.00 H new ATOM 0 H2 A B 206 13.607 -12.615 -12.945 1.00 0.00 H new ATOM 196 P G B 207 20.851 -7.734 -9.924 1.00 0.00 P ATOM 197 OP1 G B 207 22.221 -7.456 -10.414 1.00 0.00 O ATOM 198 OP2 G B 207 20.599 -7.568 -8.475 1.00 0.00 O ATOM 199 O5' G B 207 19.840 -6.779 -10.714 1.00 0.00 O ATOM 200 C5' G B 207 19.795 -6.812 -12.139 1.00 0.00 C ATOM 201 C4' G B 207 18.369 -6.989 -12.610 1.00 0.00 C ATOM 202 O4' G B 207 17.510 -7.844 -12.200 1.00 0.00 O ATOM 203 C3' G B 207 17.502 -5.740 -12.478 1.00 0.00 C ATOM 204 O3' G B 207 18.025 -4.710 -13.313 1.00 0.00 O ATOM 205 C2' G B 207 16.128 -6.163 -12.919 1.00 0.00 C ATOM 206 O2' G B 207 16.137 -5.861 -14.296 1.00 0.00 O ATOM 207 C1' G B 207 16.164 -7.650 -12.575 1.00 0.00 C ATOM 208 N9 G B 207 15.246 -8.022 -11.477 1.00 0.00 N ATOM 209 C8 G B 207 15.471 -7.923 -10.151 1.00 0.00 C ATOM 210 N7 G B 207 14.442 -8.343 -9.422 1.00 0.00 N ATOM 211 C5 G B 207 13.516 -8.730 -10.354 1.00 0.00 C ATOM 212 C6 G B 207 12.218 -9.264 -10.217 1.00 0.00 C ATOM 213 O6 G B 207 11.651 -9.493 -9.149 1.00 0.00 O ATOM 214 N1 G B 207 11.535 -9.552 -11.358 1.00 0.00 N ATOM 215 C2 G B 207 12.133 -9.312 -12.546 1.00 0.00 C ATOM 216 N2 G B 207 11.340 -9.643 -13.563 1.00 0.00 N ATOM 217 N3 G B 207 13.356 -8.808 -12.794 1.00 0.00 N ATOM 218 C4 G B 207 13.986 -8.542 -11.616 1.00 0.00 C ATOM 0 H5' G B 207 20.413 -7.629 -12.511 1.00 0.00 H new ATOM 0 H5'' G B 207 20.208 -5.889 -12.545 1.00 0.00 H new ATOM 0 H4' G B 207 18.762 -7.343 -13.563 1.00 0.00 H new ATOM 0 H3' G B 207 17.480 -5.344 -11.463 1.00 0.00 H new ATOM 0 H2' G B 207 15.236 -5.711 -12.486 1.00 0.00 H new ATOM 0 HO2' G B 207 16.390 -4.923 -14.424 1.00 0.00 H new ATOM 0 H1' G B 207 15.835 -8.272 -13.407 1.00 0.00 H new ATOM 0 H8 G B 207 16.389 -7.543 -9.727 1.00 0.00 H new ATOM 0 H1 G B 207 10.593 -9.940 -11.318 1.00 0.00 H new ATOM 0 H21 G B 207 11.661 -9.516 -14.523 1.00 0.00 H new ATOM 0 H22 G B 207 10.411 -10.024 -13.382 1.00 0.00 H new ATOM 230 P C B 208 18.529 -3.336 -12.668 1.00 0.00 P ATOM 231 OP1 C B 208 19.788 -2.911 -13.321 1.00 0.00 O ATOM 232 OP2 C B 208 18.530 -3.449 -11.193 1.00 0.00 O ATOM 233 O5' C B 208 17.382 -2.301 -13.084 1.00 0.00 O ATOM 234 C5' C B 208 17.373 -1.734 -14.392 1.00 0.00 C ATOM 235 C4' C B 208 16.041 -1.986 -15.059 1.00 0.00 C ATOM 236 O4' C B 208 15.667 -3.169 -14.491 1.00 0.00 O ATOM 237 C3' C B 208 14.888 -1.159 -14.497 1.00 0.00 C ATOM 238 O3' C B 208 14.739 0.032 -15.266 1.00 0.00 O ATOM 239 C2' C B 208 13.676 -2.042 -14.606 1.00 0.00 C ATOM 240 O2' C B 208 13.268 -1.844 -15.941 1.00 0.00 O ATOM 241 C1' C B 208 14.290 -3.406 -14.304 1.00 0.00 C ATOM 242 N1 C B 208 14.011 -3.887 -12.935 1.00 0.00 N ATOM 243 C2 C B 208 12.979 -4.809 -12.769 1.00 0.00 C ATOM 244 O2 C B 208 12.349 -5.177 -13.767 1.00 0.00 O ATOM 245 N3 C B 208 12.706 -5.261 -11.532 1.00 0.00 N ATOM 246 C4 C B 208 13.389 -4.858 -10.479 1.00 0.00 C ATOM 247 N4 C B 208 13.104 -5.317 -9.266 1.00 0.00 N ATOM 248 C5 C B 208 14.464 -3.904 -10.624 1.00 0.00 C ATOM 249 C6 C B 208 14.724 -3.462 -11.862 1.00 0.00 C ATOM 0 H5' C B 208 18.175 -2.167 -14.990 1.00 0.00 H new ATOM 0 H5'' C B 208 17.562 -0.662 -14.333 1.00 0.00 H new ATOM 0 H4' C B 208 16.171 -1.847 -16.132 1.00 0.00 H new ATOM 0 H3' C B 208 15.051 -0.850 -13.465 1.00 0.00 H new ATOM 0 H2' C B 208 12.807 -1.885 -13.967 1.00 0.00 H new ATOM 0 HO2' C B 208 13.747 -1.077 -16.319 1.00 0.00 H new ATOM 0 H1' C B 208 13.879 -4.191 -14.939 1.00 0.00 H new ATOM 0 H41 C B 208 13.641 -4.996 -8.460 1.00 0.00 H new ATOM 0 H42 C B 208 12.348 -5.990 -9.140 1.00 0.00 H new ATOM 0 H5 C B 208 15.033 -3.562 -9.772 1.00 0.00 H new ATOM 0 H6 C B 208 15.522 -2.749 -12.009 1.00 0.00 H new ATOM 261 P G B 209 14.544 1.440 -14.532 1.00 0.00 P ATOM 262 OP1 G B 209 15.471 2.437 -15.112 1.00 0.00 O ATOM 263 OP2 G B 209 14.581 1.246 -13.065 1.00 0.00 O ATOM 264 O5' G B 209 13.054 1.855 -14.939 1.00 0.00 O ATOM 265 C5' G B 209 12.137 0.863 -15.397 1.00 0.00 C ATOM 266 C4' G B 209 10.723 1.255 -15.032 1.00 0.00 C ATOM 267 O4' G B 209 10.247 0.137 -14.405 1.00 0.00 O ATOM 268 C3' G B 209 10.623 2.287 -13.912 1.00 0.00 C ATOM 269 O3' G B 209 10.348 3.569 -14.472 1.00 0.00 O ATOM 270 C2' G B 209 9.497 1.814 -13.036 1.00 0.00 C ATOM 271 O2' G B 209 8.358 2.319 -13.695 1.00 0.00 O ATOM 272 C1' G B 209 9.686 0.302 -13.122 1.00 0.00 C ATOM 273 N9 G B 209 10.577 -0.241 -12.075 1.00 0.00 N ATOM 274 C8 G B 209 11.874 0.066 -11.863 1.00 0.00 C ATOM 275 N7 G B 209 12.396 -0.597 -10.837 1.00 0.00 N ATOM 276 C5 G B 209 11.361 -1.367 -10.381 1.00 0.00 C ATOM 277 C6 G B 209 11.279 -2.289 -9.316 1.00 0.00 C ATOM 278 O6 G B 209 12.200 -2.581 -8.555 1.00 0.00 O ATOM 279 N1 G B 209 10.083 -2.906 -9.111 1.00 0.00 N ATOM 280 C2 G B 209 9.053 -2.604 -9.933 1.00 0.00 C ATOM 281 N2 G B 209 7.958 -3.286 -9.606 1.00 0.00 N ATOM 282 N3 G B 209 9.018 -1.748 -10.971 1.00 0.00 N ATOM 283 C4 G B 209 10.240 -1.165 -11.121 1.00 0.00 C ATOM 0 H5' G B 209 12.381 -0.102 -14.953 1.00 0.00 H new ATOM 0 H5'' G B 209 12.223 0.748 -16.477 1.00 0.00 H new ATOM 0 H4' G B 209 10.231 1.633 -15.928 1.00 0.00 H new ATOM 0 H3' G B 209 11.546 2.384 -13.340 1.00 0.00 H new ATOM 0 H2' G B 209 9.436 2.114 -11.990 1.00 0.00 H new ATOM 0 HO2' G B 209 8.622 3.053 -14.289 1.00 0.00 H new ATOM 0 H1' G B 209 8.752 -0.238 -12.967 1.00 0.00 H new ATOM 0 H8 G B 209 12.427 0.774 -12.462 1.00 0.00 H new ATOM 0 H1 G B 209 9.967 -3.581 -8.355 1.00 0.00 H new ATOM 0 H21 G B 209 7.099 -3.159 -10.142 1.00 0.00 H new ATOM 0 H22 G B 209 7.978 -3.935 -8.820 1.00 0.00 H new ATOM 295 P G B 210 11.140 4.857 -13.947 1.00 0.00 P ATOM 296 OP1 G B 210 10.762 6.037 -14.756 1.00 0.00 O ATOM 297 OP2 G B 210 12.581 4.542 -13.832 1.00 0.00 O ATOM 298 O5' G B 210 10.558 5.062 -12.472 1.00 0.00 O ATOM 299 C5' G B 210 10.019 6.324 -12.085 1.00 0.00 C ATOM 300 C4' G B 210 8.583 6.163 -11.641 1.00 0.00 C ATOM 301 O4' G B 210 8.351 6.682 -10.721 1.00 0.00 O ATOM 302 C3' G B 210 7.550 6.600 -12.676 1.00 0.00 C ATOM 303 O3' G B 210 6.663 5.517 -12.946 1.00 0.00 O ATOM 304 C2' G B 210 6.828 7.761 -12.049 1.00 0.00 C ATOM 305 O2' G B 210 5.481 7.348 -12.091 1.00 0.00 O ATOM 306 C1' G B 210 7.466 7.777 -10.663 1.00 0.00 C ATOM 307 N9 G B 210 8.187 9.032 -10.361 1.00 0.00 N ATOM 308 C8 G B 210 9.323 9.482 -10.936 1.00 0.00 C ATOM 309 N7 G B 210 9.720 10.650 -10.440 1.00 0.00 N ATOM 310 C5 G B 210 8.772 10.946 -9.498 1.00 0.00 C ATOM 311 C6 G B 210 8.630 12.049 -8.628 1.00 0.00 C ATOM 312 O6 G B 210 9.397 13.009 -8.565 1.00 0.00 O ATOM 313 N1 G B 210 7.558 12.053 -7.791 1.00 0.00 N ATOM 314 C2 G B 210 6.698 11.010 -7.839 1.00 0.00 C ATOM 315 N2 G B 210 5.707 11.160 -6.963 1.00 0.00 N ATOM 316 N3 G B 210 6.734 9.915 -8.622 1.00 0.00 N ATOM 317 C4 G B 210 7.827 9.972 -9.432 1.00 0.00 C ATOM 0 H5' G B 210 10.073 7.023 -12.920 1.00 0.00 H new ATOM 0 H5'' G B 210 10.612 6.749 -11.275 1.00 0.00 H new ATOM 0 H4' G B 210 8.511 5.086 -11.491 1.00 0.00 H new ATOM 0 H3' G B 210 7.997 6.888 -13.628 1.00 0.00 H new ATOM 0 H2' G B 210 6.882 8.758 -12.486 1.00 0.00 H new ATOM 0 HO2' G B 210 4.913 8.044 -11.699 1.00 0.00 H new ATOM 0 H1' G B 210 6.722 7.712 -9.869 1.00 0.00 H new ATOM 0 H8 G B 210 9.851 8.951 -11.714 1.00 0.00 H new ATOM 0 H1 G B 210 7.406 12.825 -7.142 1.00 0.00 H new ATOM 0 H21 G B 210 4.981 10.448 -6.888 1.00 0.00 H new ATOM 0 H22 G B 210 5.674 11.987 -6.367 1.00 0.00 H new ATOM 329 P A B 211 5.958 4.738 -11.739 1.00 0.00 P ATOM 330 OP1 A B 211 4.494 4.703 -11.955 1.00 0.00 O ATOM 331 OP2 A B 211 6.445 5.276 -10.449 1.00 0.00 O ATOM 332 O5' A B 211 6.517 3.248 -11.897 1.00 0.00 O ATOM 333 C5' A B 211 7.195 2.621 -10.809 1.00 0.00 C ATOM 334 C4' A B 211 6.219 2.327 -9.691 1.00 0.00 C ATOM 335 O4' A B 211 5.933 2.579 -8.354 1.00 0.00 O ATOM 336 C3' A B 211 4.872 1.781 -10.156 1.00 0.00 C ATOM 337 O3' A B 211 4.846 0.367 -9.975 1.00 0.00 O ATOM 338 C2' A B 211 3.848 2.466 -9.295 1.00 0.00 C ATOM 339 O2' A B 211 2.751 1.582 -9.357 1.00 0.00 O ATOM 340 C1' A B 211 4.582 2.508 -7.958 1.00 0.00 C ATOM 341 N9 A B 211 4.211 3.666 -7.118 1.00 0.00 N ATOM 342 C8 A B 211 4.473 4.968 -7.355 1.00 0.00 C ATOM 343 N7 A B 211 4.003 5.767 -6.403 1.00 0.00 N ATOM 344 C5 A B 211 3.410 4.909 -5.517 1.00 0.00 C ATOM 345 C6 A B 211 2.732 5.142 -4.302 1.00 0.00 C ATOM 346 N6 A B 211 2.535 6.369 -3.753 1.00 0.00 N ATOM 347 N1 A B 211 2.244 4.058 -3.638 1.00 0.00 N ATOM 348 C2 A B 211 2.436 2.833 -4.176 1.00 0.00 C ATOM 349 N3 A B 211 3.061 2.497 -5.320 1.00 0.00 N ATOM 350 C4 A B 211 3.524 3.621 -5.933 1.00 0.00 C ATOM 0 H5' A B 211 7.993 3.269 -10.445 1.00 0.00 H new ATOM 0 H5'' A B 211 7.664 1.696 -11.146 1.00 0.00 H new ATOM 0 H4' A B 211 7.290 2.284 -9.493 1.00 0.00 H new ATOM 0 H3' A B 211 4.679 1.968 -11.212 1.00 0.00 H new ATOM 0 H2' A B 211 3.484 3.464 -9.540 1.00 0.00 H new ATOM 0 HO2' A B 211 2.650 1.250 -10.273 1.00 0.00 H new ATOM 0 H1' A B 211 4.341 1.649 -7.331 1.00 0.00 H new ATOM 0 H8 A B 211 5.007 5.322 -8.224 1.00 0.00 H new ATOM 0 H61 A B 211 2.034 6.458 -2.869 1.00 0.00 H new ATOM 0 H62 A B 211 2.888 7.201 -4.225 1.00 0.00 H new ATOM 0 H2 A B 211 2.031 2.008 -3.609 1.00 0.00 H new ATOM 362 P G B 212 4.178 -0.570 -11.088 1.00 0.00 P ATOM 363 OP1 G B 212 5.045 -0.617 -12.286 1.00 0.00 O ATOM 364 OP2 G B 212 2.763 -0.178 -11.283 1.00 0.00 O ATOM 365 O5' G B 212 4.200 -2.015 -10.402 1.00 0.00 O ATOM 366 C5' G B 212 4.065 -2.135 -8.988 1.00 0.00 C ATOM 367 C4' G B 212 5.217 -2.934 -8.422 1.00 0.00 C ATOM 368 O4' G B 212 5.965 -2.184 -8.199 1.00 0.00 O ATOM 369 C3' G B 212 4.902 -3.654 -7.112 1.00 0.00 C ATOM 370 O3' G B 212 4.951 -5.063 -7.323 1.00 0.00 O ATOM 371 C2' G B 212 5.963 -3.202 -6.148 1.00 0.00 C ATOM 372 O2' G B 212 6.679 -4.390 -5.895 1.00 0.00 O ATOM 373 C1' G B 212 6.694 -2.163 -6.993 1.00 0.00 C ATOM 374 N9 G B 212 6.697 -0.812 -6.394 1.00 0.00 N ATOM 375 C8 G B 212 5.626 -0.055 -6.073 1.00 0.00 C ATOM 376 N7 G B 212 5.966 1.118 -5.548 1.00 0.00 N ATOM 377 C5 G B 212 7.334 1.091 -5.541 1.00 0.00 C ATOM 378 C6 G B 212 8.286 2.038 -5.108 1.00 0.00 C ATOM 379 O6 G B 212 8.026 3.139 -4.624 1.00 0.00 O ATOM 380 N1 G B 212 9.600 1.709 -5.236 1.00 0.00 N ATOM 381 C2 G B 212 9.916 0.506 -5.765 1.00 0.00 C ATOM 382 N2 G B 212 11.234 0.333 -5.823 1.00 0.00 N ATOM 383 N3 G B 212 9.098 -0.467 -6.208 1.00 0.00 N ATOM 384 C4 G B 212 7.802 -0.079 -6.053 1.00 0.00 C ATOM 0 H5' G B 212 3.121 -2.622 -8.745 1.00 0.00 H new ATOM 0 H5'' G B 212 4.040 -1.145 -8.532 1.00 0.00 H new ATOM 0 H4' G B 212 5.503 -3.708 -9.134 1.00 0.00 H new ATOM 0 H3' G B 212 3.907 -3.427 -6.729 1.00 0.00 H new ATOM 0 H2' G B 212 5.697 -2.764 -5.186 1.00 0.00 H new ATOM 0 HO2' G B 212 6.763 -4.522 -4.928 1.00 0.00 H new ATOM 0 H1' G B 212 7.753 -2.396 -7.103 1.00 0.00 H new ATOM 0 H8 G B 212 4.604 -0.369 -6.226 1.00 0.00 H new ATOM 0 H1 G B 212 10.331 2.356 -4.939 1.00 0.00 H new ATOM 0 H21 G B 212 11.619 -0.533 -6.201 1.00 0.00 H new ATOM 0 H22 G B 212 11.860 1.066 -5.489 1.00 0.00 H new ATOM 396 P G B 213 3.857 -6.012 -6.643 1.00 0.00 P ATOM 397 OP1 G B 213 2.875 -5.188 -5.902 1.00 0.00 O ATOM 398 OP2 G B 213 4.532 -7.100 -5.902 1.00 0.00 O ATOM 399 O5' G B 213 3.110 -6.659 -7.901 1.00 0.00 O ATOM 400 C5' G B 213 2.465 -5.820 -8.857 1.00 0.00 C ATOM 401 C4' G B 213 3.159 -5.930 -10.196 1.00 0.00 C ATOM 402 O4' G B 213 3.806 -5.224 -10.968 1.00 0.00 O ATOM 403 C3' G B 213 3.214 -7.345 -10.762 1.00 0.00 C ATOM 404 O3' G B 213 1.917 -7.725 -11.216 1.00 0.00 O ATOM 405 C2' G B 213 4.198 -7.281 -11.898 1.00 0.00 C ATOM 406 O2' G B 213 3.367 -7.365 -13.034 1.00 0.00 O ATOM 407 C1' G B 213 4.831 -5.915 -11.647 1.00 0.00 C ATOM 408 N9 G B 213 6.063 -5.977 -10.833 1.00 0.00 N ATOM 409 C8 G B 213 6.165 -6.274 -9.520 1.00 0.00 C ATOM 410 N7 G B 213 7.419 -6.244 -9.084 1.00 0.00 N ATOM 411 C5 G B 213 8.146 -5.909 -10.194 1.00 0.00 C ATOM 412 C6 G B 213 9.532 -5.719 -10.382 1.00 0.00 C ATOM 413 O6 G B 213 10.391 -5.834 -9.510 1.00 0.00 O ATOM 414 N1 G B 213 9.954 -5.383 -11.632 1.00 0.00 N ATOM 415 C2 G B 213 9.031 -5.250 -12.611 1.00 0.00 C ATOM 416 N2 G B 213 9.598 -4.920 -13.769 1.00 0.00 N ATOM 417 N3 G B 213 7.695 -5.405 -12.544 1.00 0.00 N ATOM 418 C4 G B 213 7.339 -5.741 -11.274 1.00 0.00 C ATOM 0 H5' G B 213 2.481 -4.785 -8.514 1.00 0.00 H new ATOM 0 H5'' G B 213 1.418 -6.107 -8.956 1.00 0.00 H new ATOM 0 H4' G B 213 2.808 -4.973 -9.810 1.00 0.00 H new ATOM 0 H3' G B 213 3.521 -8.085 -10.023 1.00 0.00 H new ATOM 0 H2' G B 213 4.982 -8.031 -12.006 1.00 0.00 H new ATOM 0 HO2' G B 213 2.431 -7.257 -12.764 1.00 0.00 H new ATOM 0 H1' G B 213 5.159 -5.439 -12.571 1.00 0.00 H new ATOM 0 H8 G B 213 5.319 -6.510 -8.892 1.00 0.00 H new ATOM 0 H1 G B 213 10.944 -5.235 -11.826 1.00 0.00 H new ATOM 0 H21 G B 213 9.021 -4.786 -14.599 1.00 0.00 H new ATOM 0 H22 G B 213 10.609 -4.801 -13.826 1.00 0.00 H new ATOM 430 P C B 214 1.433 -9.244 -11.076 1.00 0.00 P ATOM 431 OP1 C B 214 0.131 -9.418 -11.759 1.00 0.00 O ATOM 432 OP2 C B 214 1.522 -9.667 -9.660 1.00 0.00 O ATOM 433 O5' C B 214 2.538 -10.052 -11.903 1.00 0.00 O ATOM 434 C5' C B 214 2.478 -10.088 -13.327 1.00 0.00 C ATOM 435 C4' C B 214 3.873 -10.056 -13.908 1.00 0.00 C ATOM 436 O4' C B 214 4.897 -9.163 -14.173 1.00 0.00 O ATOM 437 C3' C B 214 4.558 -11.419 -13.978 1.00 0.00 C ATOM 438 O3' C B 214 3.721 -12.334 -14.684 1.00 0.00 O ATOM 439 C2' C B 214 5.850 -11.176 -14.709 1.00 0.00 C ATOM 440 O2' C B 214 5.471 -11.303 -16.061 1.00 0.00 O ATOM 441 C1' C B 214 6.174 -9.757 -14.249 1.00 0.00 C ATOM 442 N1 C B 214 6.867 -9.704 -12.945 1.00 0.00 N ATOM 443 C2 C B 214 8.210 -9.332 -12.940 1.00 0.00 C ATOM 444 O2 C B 214 8.754 -9.066 -14.017 1.00 0.00 O ATOM 445 N3 C B 214 8.863 -9.276 -11.765 1.00 0.00 N ATOM 446 C4 C B 214 8.266 -9.562 -10.625 1.00 0.00 C ATOM 447 N4 C B 214 8.928 -9.501 -9.476 1.00 0.00 N ATOM 448 C5 C B 214 6.875 -9.950 -10.602 1.00 0.00 C ATOM 449 C6 C B 214 6.238 -10.002 -11.781 1.00 0.00 C ATOM 0 H5' C B 214 1.903 -9.239 -13.696 1.00 0.00 H new ATOM 0 H5'' C B 214 1.960 -10.990 -13.654 1.00 0.00 H new ATOM 0 H4' C B 214 3.159 -9.333 -14.304 1.00 0.00 H new ATOM 0 H3' C B 214 4.743 -11.853 -12.995 1.00 0.00 H new ATOM 0 H2' C B 214 6.716 -11.817 -14.547 1.00 0.00 H new ATOM 0 HO2' C B 214 4.575 -11.696 -16.114 1.00 0.00 H new ATOM 0 H1' C B 214 6.865 -9.254 -14.925 1.00 0.00 H new ATOM 0 H41 C B 214 8.453 -9.725 -8.601 1.00 0.00 H new ATOM 0 H42 C B 214 9.911 -9.230 -9.468 1.00 0.00 H new ATOM 0 H5 C B 214 6.371 -10.188 -9.677 1.00 0.00 H new ATOM 0 H6 C B 214 5.197 -10.289 -11.804 1.00 0.00 H new ATOM 461 P U B 215 3.662 -13.869 -14.240 1.00 0.00 P ATOM 462 OP1 U B 215 2.721 -14.605 -15.115 1.00 0.00 O ATOM 463 OP2 U B 215 3.445 -13.956 -12.778 1.00 0.00 O ATOM 464 O5' U B 215 5.141 -14.392 -14.553 1.00 0.00 O ATOM 465 C5' U B 215 5.557 -14.592 -15.902 1.00 0.00 C ATOM 466 C4' U B 215 7.044 -14.354 -16.030 1.00 0.00 C ATOM 467 O4' U B 215 7.788 -13.513 -15.982 1.00 0.00 O ATOM 468 C3' U B 215 7.885 -15.626 -16.069 1.00 0.00 C ATOM 469 O3' U B 215 7.994 -16.082 -17.415 1.00 0.00 O ATOM 470 C2' U B 215 9.225 -15.234 -15.509 1.00 0.00 C ATOM 471 O2' U B 215 10.118 -15.671 -16.509 1.00 0.00 O ATOM 472 C1' U B 215 9.054 -13.721 -15.398 1.00 0.00 C ATOM 473 N1 U B 215 9.088 -13.225 -14.005 1.00 0.00 N ATOM 474 C2 U B 215 10.266 -12.689 -13.586 1.00 0.00 C ATOM 475 O2 U B 215 11.260 -12.604 -14.287 1.00 0.00 O ATOM 476 N3 U B 215 10.299 -12.226 -12.289 1.00 0.00 N ATOM 477 C4 U B 215 9.228 -12.283 -11.434 1.00 0.00 C ATOM 478 O4 U B 215 9.371 -11.839 -10.297 1.00 0.00 O ATOM 479 C5 U B 215 8.022 -12.853 -11.924 1.00 0.00 C ATOM 480 C6 U B 215 8.012 -13.295 -13.184 1.00 0.00 C ATOM 0 H5' U B 215 5.015 -13.915 -16.562 1.00 0.00 H new ATOM 0 H5'' U B 215 5.315 -15.607 -16.218 1.00 0.00 H new ATOM 0 H4' U B 215 6.328 -13.596 -16.348 1.00 0.00 H new ATOM 0 H3' U B 215 7.447 -16.442 -15.494 1.00 0.00 H new ATOM 0 H2' U B 215 9.574 -15.631 -14.556 1.00 0.00 H new ATOM 0 HO2' U B 215 10.370 -16.602 -16.338 1.00 0.00 H new ATOM 0 H1' U B 215 9.867 -13.180 -15.882 1.00 0.00 H new ATOM 0 H3 U B 215 11.168 -11.818 -11.945 1.00 0.00 H new ATOM 0 H5 U B 215 7.144 -12.926 -11.299 1.00 0.00 H new ATOM 0 H6 U B 215 7.101 -13.730 -13.568 1.00 0.00 H new ATOM 491 P A B 216 8.098 -17.649 -17.724 1.00 0.00 P ATOM 492 OP1 A B 216 8.043 -17.874 -19.185 1.00 0.00 O ATOM 493 OP2 A B 216 7.130 -18.388 -16.883 1.00 0.00 O ATOM 494 O5' A B 216 9.572 -18.016 -17.221 1.00 0.00 O ATOM 495 C5' A B 216 10.681 -17.884 -18.108 1.00 0.00 C ATOM 496 C4' A B 216 11.977 -18.055 -17.347 1.00 0.00 C ATOM 497 O4' A B 216 11.853 -17.306 -16.296 1.00 0.00 O ATOM 498 C3' A B 216 12.104 -19.384 -16.609 1.00 0.00 C ATOM 499 O3' A B 216 12.696 -20.352 -17.475 1.00 0.00 O ATOM 500 C2' A B 216 12.982 -19.097 -15.423 1.00 0.00 C ATOM 501 O2' A B 216 14.272 -19.390 -15.912 1.00 0.00 O ATOM 502 C1' A B 216 12.686 -17.616 -15.202 1.00 0.00 C ATOM 503 N9 A B 216 12.007 -17.336 -13.919 1.00 0.00 N ATOM 504 C8 A B 216 10.690 -17.443 -13.647 1.00 0.00 C ATOM 505 N7 A B 216 10.396 -17.117 -12.393 1.00 0.00 N ATOM 506 C5 A B 216 11.607 -16.786 -11.847 1.00 0.00 C ATOM 507 C6 A B 216 11.962 -16.356 -10.551 1.00 0.00 C ATOM 508 N6 A B 216 11.084 -16.181 -9.531 1.00 0.00 N ATOM 509 N1 A B 216 13.278 -16.100 -10.316 1.00 0.00 N ATOM 510 C2 A B 216 14.160 -16.271 -11.325 1.00 0.00 C ATOM 511 N3 A B 216 13.935 -16.675 -12.590 1.00 0.00 N ATOM 512 C4 A B 216 12.605 -16.912 -12.761 1.00 0.00 C ATOM 0 H5' A B 216 10.658 -16.906 -18.588 1.00 0.00 H new ATOM 0 H5'' A B 216 10.614 -18.630 -18.900 1.00 0.00 H new ATOM 0 H4' A B 216 12.774 -17.890 -18.072 1.00 0.00 H new ATOM 0 H3' A B 216 11.142 -19.787 -16.292 1.00 0.00 H new ATOM 0 H2' A B 216 12.853 -19.638 -14.486 1.00 0.00 H new ATOM 0 HO2' A B 216 14.863 -19.613 -15.163 1.00 0.00 H new ATOM 0 H1' A B 216 13.597 -17.020 -15.146 1.00 0.00 H new ATOM 0 H8 A B 216 9.954 -17.760 -14.371 1.00 0.00 H new ATOM 0 H61 A B 216 11.417 -15.867 -8.620 1.00 0.00 H new ATOM 0 H62 A B 216 10.091 -16.364 -9.676 1.00 0.00 H new ATOM 0 H2 A B 216 15.190 -16.053 -11.083 1.00 0.00 H new ATOM 524 P G B 217 12.114 -21.841 -17.526 1.00 0.00 P ATOM 525 OP1 G B 217 12.243 -22.380 -18.898 1.00 0.00 O ATOM 526 OP2 G B 217 10.771 -21.873 -16.903 1.00 0.00 O ATOM 527 O5' G B 217 13.117 -22.651 -16.579 1.00 0.00 O ATOM 528 C5' G B 217 14.480 -22.247 -16.472 1.00 0.00 C ATOM 529 C4' G B 217 14.869 -22.107 -15.018 1.00 0.00 C ATOM 530 O4' G B 217 14.567 -21.078 -14.178 1.00 0.00 O ATOM 531 C3' G B 217 14.350 -23.222 -14.116 1.00 0.00 C ATOM 532 O3' G B 217 14.933 -24.462 -14.513 1.00 0.00 O ATOM 533 C2' G B 217 14.769 -22.837 -12.724 1.00 0.00 C ATOM 534 O2' G B 217 16.098 -23.301 -12.660 1.00 0.00 O ATOM 535 C1' G B 217 14.607 -21.320 -12.790 1.00 0.00 C ATOM 536 N9 G B 217 13.383 -20.828 -12.126 1.00 0.00 N ATOM 537 C8 G B 217 12.115 -20.905 -12.584 1.00 0.00 C ATOM 538 N7 G B 217 11.234 -20.367 -11.745 1.00 0.00 N ATOM 539 C5 G B 217 12.001 -19.929 -10.700 1.00 0.00 C ATOM 540 C6 G B 217 11.656 -19.272 -9.499 1.00 0.00 C ATOM 541 O6 G B 217 10.516 -18.957 -9.161 1.00 0.00 O ATOM 542 N1 G B 217 12.667 -18.960 -8.643 1.00 0.00 N ATOM 543 C2 G B 217 13.931 -19.294 -8.989 1.00 0.00 C ATOM 544 N2 G B 217 14.802 -18.924 -8.054 1.00 0.00 N ATOM 545 N3 G B 217 14.372 -19.915 -10.099 1.00 0.00 N ATOM 546 C4 G B 217 13.315 -20.199 -10.911 1.00 0.00 C ATOM 0 H5' G B 217 14.628 -21.299 -16.989 1.00 0.00 H new ATOM 0 H5'' G B 217 15.124 -22.979 -16.960 1.00 0.00 H new ATOM 0 H4' G B 217 15.910 -22.020 -15.331 1.00 0.00 H new ATOM 0 H3' G B 217 13.269 -23.346 -14.175 1.00 0.00 H new ATOM 0 H2' G B 217 14.241 -23.223 -11.852 1.00 0.00 H new ATOM 0 HO2' G B 217 16.376 -23.621 -13.544 1.00 0.00 H new ATOM 0 H1' G B 217 15.408 -20.799 -12.265 1.00 0.00 H new ATOM 0 H8 G B 217 11.846 -21.354 -13.528 1.00 0.00 H new ATOM 0 H1 G B 217 12.476 -18.485 -7.761 1.00 0.00 H new ATOM 0 H21 G B 217 15.796 -19.112 -8.180 1.00 0.00 H new ATOM 0 H22 G B 217 14.475 -18.452 -7.211 1.00 0.00 H new ATOM 558 P U B 218 14.053 -25.799 -14.508 1.00 0.00 P ATOM 559 OP1 U B 218 14.583 -26.748 -15.512 1.00 0.00 O ATOM 560 OP2 U B 218 12.617 -25.450 -14.588 1.00 0.00 O ATOM 561 O5' U B 218 14.334 -26.408 -13.055 1.00 0.00 O ATOM 562 C5' U B 218 15.648 -26.362 -12.504 1.00 0.00 C ATOM 563 C4' U B 218 15.577 -26.170 -11.006 1.00 0.00 C ATOM 564 O4' U B 218 15.269 -25.010 -10.490 1.00 0.00 O ATOM 565 C3' U B 218 14.526 -27.029 -10.310 1.00 0.00 C ATOM 566 O3' U B 218 14.979 -28.380 -10.251 1.00 0.00 O ATOM 567 C2' U B 218 14.375 -26.437 -8.935 1.00 0.00 C ATOM 568 O2' U B 218 15.387 -27.092 -8.204 1.00 0.00 O ATOM 569 C1' U B 218 14.631 -24.963 -9.232 1.00 0.00 C ATOM 570 N1 U B 218 13.398 -24.151 -9.290 1.00 0.00 N ATOM 571 C2 U B 218 13.097 -23.431 -8.174 1.00 0.00 C ATOM 572 O2 U B 218 13.782 -23.431 -7.163 1.00 0.00 O ATOM 573 N3 U B 218 11.948 -22.674 -8.224 1.00 0.00 N ATOM 574 C4 U B 218 11.124 -22.617 -9.320 1.00 0.00 C ATOM 575 O4 U B 218 10.123 -21.906 -9.253 1.00 0.00 O ATOM 576 C5 U B 218 11.484 -23.386 -10.458 1.00 0.00 C ATOM 577 C6 U B 218 12.602 -24.114 -10.387 1.00 0.00 C ATOM 0 H5' U B 218 16.212 -25.547 -12.957 1.00 0.00 H new ATOM 0 H5'' U B 218 16.180 -27.285 -12.735 1.00 0.00 H new ATOM 0 H4' U B 218 16.628 -26.407 -10.839 1.00 0.00 H new ATOM 0 H3' U B 218 13.571 -27.039 -10.836 1.00 0.00 H new ATOM 0 H2' U B 218 13.444 -26.539 -8.378 1.00 0.00 H new ATOM 0 HO2' U B 218 15.663 -27.902 -8.681 1.00 0.00 H new ATOM 0 H1' U B 218 15.217 -24.484 -8.448 1.00 0.00 H new ATOM 0 H3 U B 218 11.695 -22.126 -7.402 1.00 0.00 H new ATOM 0 H5 U B 218 10.875 -23.383 -11.350 1.00 0.00 H new ATOM 0 H6 U B 218 12.886 -24.703 -11.247 1.00 0.00 H new ATOM 588 P C B 219 13.929 -29.568 -10.029 1.00 0.00 P ATOM 589 OP1 C B 219 14.649 -30.855 -9.918 1.00 0.00 O ATOM 590 OP2 C B 219 12.852 -29.474 -11.039 1.00 0.00 O ATOM 591 O5' C B 219 13.298 -29.227 -8.599 1.00 0.00 O ATOM 592 C5' C B 219 13.873 -29.779 -7.417 1.00 0.00 C ATOM 593 C4' C B 219 12.906 -29.655 -6.261 1.00 0.00 C ATOM 594 O4' C B 219 12.601 -28.291 -6.272 1.00 0.00 O ATOM 595 C3' C B 219 11.485 -30.112 -6.578 1.00 0.00 C ATOM 596 O3' C B 219 11.346 -31.492 -6.247 1.00 0.00 O ATOM 597 C2' C B 219 10.592 -29.249 -5.730 1.00 0.00 C ATOM 598 O2' C B 219 10.650 -29.885 -4.473 1.00 0.00 O ATOM 599 C1' C B 219 11.320 -27.911 -5.822 1.00 0.00 C ATOM 600 N1 C B 219 10.685 -26.957 -6.756 1.00 0.00 N ATOM 601 C2 C B 219 9.879 -25.960 -6.214 1.00 0.00 C ATOM 602 O2 C B 219 9.731 -25.918 -4.988 1.00 0.00 O ATOM 603 N3 C B 219 9.289 -25.080 -7.044 1.00 0.00 N ATOM 604 C4 C B 219 9.457 -25.139 -8.350 1.00 0.00 C ATOM 605 N4 C B 219 8.868 -24.262 -9.153 1.00 0.00 N ATOM 606 C5 C B 219 10.290 -26.164 -8.938 1.00 0.00 C ATOM 607 C6 C B 219 10.868 -27.033 -8.097 1.00 0.00 C ATOM 0 H5' C B 219 14.803 -29.262 -7.180 1.00 0.00 H new ATOM 0 H5'' C B 219 14.124 -30.827 -7.581 1.00 0.00 H new ATOM 0 H4' C B 219 13.349 -30.171 -5.409 1.00 0.00 H new ATOM 0 H3' C B 219 11.233 -30.013 -7.634 1.00 0.00 H new ATOM 0 H2' C B 219 9.541 -29.109 -5.983 1.00 0.00 H new ATOM 0 HO2' C B 219 10.903 -30.824 -4.593 1.00 0.00 H new ATOM 0 H1' C B 219 11.318 -27.377 -4.872 1.00 0.00 H new ATOM 0 H41 C B 219 9.007 -24.320 -10.162 1.00 0.00 H new ATOM 0 H42 C B 219 8.276 -23.530 -8.761 1.00 0.00 H new ATOM 0 H5 C B 219 10.440 -26.227 -10.006 1.00 0.00 H new ATOM 0 H6 C B 219 11.496 -27.814 -8.498 1.00 0.00 H new ATOM 619 P C B 220 10.929 -32.548 -7.375 1.00 0.00 P ATOM 620 OP1 C B 220 11.633 -33.829 -7.143 1.00 0.00 O ATOM 621 OP2 C B 220 11.065 -31.927 -8.712 1.00 0.00 O ATOM 622 O5' C B 220 9.372 -32.780 -7.093 1.00 0.00 O ATOM 623 C5' C B 220 8.940 -33.247 -5.817 1.00 0.00 C ATOM 624 C4' C B 220 7.455 -33.018 -5.655 1.00 0.00 C ATOM 625 O4' C B 220 7.291 -31.639 -5.510 1.00 0.00 O ATOM 626 C3' C B 220 6.650 -33.164 -6.942 1.00 0.00 C ATOM 627 O3' C B 220 6.217 -34.527 -7.080 1.00 0.00 O ATOM 628 C2' C B 220 5.484 -32.227 -6.791 1.00 0.00 C ATOM 629 O2' C B 220 4.594 -32.967 -5.988 1.00 0.00 O ATOM 630 C1' C B 220 6.159 -31.044 -6.104 1.00 0.00 C ATOM 631 N1 C B 220 6.551 -29.965 -7.035 1.00 0.00 N ATOM 632 C2 C B 220 5.762 -28.816 -7.064 1.00 0.00 C ATOM 633 O2 C B 220 4.780 -28.753 -6.317 1.00 0.00 O ATOM 634 N3 C B 220 6.099 -27.821 -7.904 1.00 0.00 N ATOM 635 C4 C B 220 7.149 -27.905 -8.696 1.00 0.00 C ATOM 636 N4 C B 220 7.464 -26.912 -9.518 1.00 0.00 N ATOM 637 C5 C B 220 7.983 -29.084 -8.684 1.00 0.00 C ATOM 638 C6 C B 220 7.635 -30.068 -7.843 1.00 0.00 C ATOM 0 H5' C B 220 9.484 -32.728 -5.028 1.00 0.00 H new ATOM 0 H5'' C B 220 9.165 -34.308 -5.714 1.00 0.00 H new ATOM 0 H4' C B 220 7.142 -33.705 -4.869 1.00 0.00 H new ATOM 0 H3' C B 220 7.228 -32.922 -7.834 1.00 0.00 H new ATOM 0 H2' C B 220 4.930 -31.874 -7.661 1.00 0.00 H new ATOM 0 HO2' C B 220 4.765 -33.925 -6.107 1.00 0.00 H new ATOM 0 HO3' C B 220 5.698 -34.623 -7.906 1.00 0.00 H new ATOM 0 H1' C B 220 5.492 -30.545 -5.401 1.00 0.00 H new ATOM 0 H41 C B 220 8.280 -26.992 -10.125 1.00 0.00 H new ATOM 0 H42 C B 220 6.890 -26.069 -9.543 1.00 0.00 H new ATOM 0 H5 C B 220 8.849 -29.169 -9.324 1.00 0.00 H new ATOM 0 H6 C B 220 8.234 -30.966 -7.808 1.00 0.00 H new TER 650 C B 220 ATOM 651 N MET A 1 5.474 -14.322 5.861 1.00 0.00 N ATOM 652 CA MET A 1 6.436 -13.760 4.930 1.00 0.00 C ATOM 653 C MET A 1 5.858 -13.697 3.515 1.00 0.00 C ATOM 654 O MET A 1 6.449 -14.225 2.574 1.00 0.00 O ATOM 655 CB MET A 1 7.704 -14.617 4.925 1.00 0.00 C ATOM 656 CG MET A 1 8.732 -14.082 5.925 1.00 0.00 C ATOM 657 SD MET A 1 8.360 -14.685 7.563 1.00 0.00 S ATOM 658 CE MET A 1 9.714 -15.827 7.785 1.00 0.00 C ATOM 0 H1 MET A 1 5.966 -14.636 6.721 1.00 0.00 H new ATOM 0 H2 MET A 1 4.769 -13.599 6.110 1.00 0.00 H new ATOM 0 H3 MET A 1 4.997 -15.134 5.419 1.00 0.00 H new ATOM 0 HA MET A 1 6.673 -12.746 5.251 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.452 -15.648 5.174 1.00 0.00 H new ATOM 0 HB3 MET A 1 8.136 -14.628 3.924 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.734 -14.395 5.632 1.00 0.00 H new ATOM 0 HG3 MET A 1 8.724 -12.992 5.919 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.636 -16.297 8.765 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.674 -16.593 7.011 1.00 0.00 H new ATOM 0 HE3 MET A 1 10.659 -15.289 7.715 1.00 0.00 H new ATOM 668 N GLN A 2 4.708 -13.047 3.408 1.00 0.00 N ATOM 669 CA GLN A 2 4.042 -12.909 2.124 1.00 0.00 C ATOM 670 C GLN A 2 4.580 -11.687 1.377 1.00 0.00 C ATOM 671 O GLN A 2 5.049 -10.732 1.996 1.00 0.00 O ATOM 672 CB GLN A 2 2.525 -12.820 2.299 1.00 0.00 C ATOM 673 CG GLN A 2 1.924 -14.200 2.575 1.00 0.00 C ATOM 674 CD GLN A 2 0.395 -14.142 2.571 1.00 0.00 C ATOM 675 OE1 GLN A 2 -0.255 -14.275 1.547 1.00 0.00 O ATOM 676 NE2 GLN A 2 -0.142 -13.937 3.771 1.00 0.00 N ATOM 0 H GLN A 2 4.220 -12.610 4.190 1.00 0.00 H new ATOM 0 HA GLN A 2 4.254 -13.798 1.529 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.289 -12.145 3.122 1.00 0.00 H new ATOM 0 HB3 GLN A 2 2.076 -12.397 1.401 1.00 0.00 H new ATOM 0 HG2 GLN A 2 2.267 -14.908 1.820 1.00 0.00 H new ATOM 0 HG3 GLN A 2 2.275 -14.568 3.539 1.00 0.00 H new ATOM 0 HE21 GLN A 2 0.460 -13.834 4.588 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -1.155 -13.883 3.874 1.00 0.00 H new ATOM 685 N LYS A 3 4.495 -11.755 0.056 1.00 0.00 N ATOM 686 CA LYS A 3 4.968 -10.666 -0.782 1.00 0.00 C ATOM 687 C LYS A 3 6.497 -10.632 -0.752 1.00 0.00 C ATOM 688 O LYS A 3 7.091 -9.631 -0.354 1.00 0.00 O ATOM 689 CB LYS A 3 4.314 -9.347 -0.366 1.00 0.00 C ATOM 690 CG LYS A 3 3.205 -8.953 -1.342 1.00 0.00 C ATOM 691 CD LYS A 3 3.788 -8.322 -2.608 1.00 0.00 C ATOM 692 CE LYS A 3 2.733 -7.492 -3.343 1.00 0.00 C ATOM 693 NZ LYS A 3 1.682 -8.370 -3.905 1.00 0.00 N ATOM 0 H LYS A 3 4.106 -12.548 -0.454 1.00 0.00 H new ATOM 0 HA LYS A 3 4.673 -10.827 -1.819 1.00 0.00 H new ATOM 0 HB2 LYS A 3 3.902 -9.442 0.639 1.00 0.00 H new ATOM 0 HB3 LYS A 3 5.067 -8.560 -0.328 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.619 -9.833 -1.607 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.525 -8.250 -0.861 1.00 0.00 H new ATOM 0 HD2 LYS A 3 4.636 -7.689 -2.346 1.00 0.00 H new ATOM 0 HD3 LYS A 3 4.165 -9.103 -3.268 1.00 0.00 H new ATOM 0 HE2 LYS A 3 2.286 -6.772 -2.658 1.00 0.00 H new ATOM 0 HE3 LYS A 3 3.204 -6.920 -4.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 1.002 -7.796 -4.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 2.118 -9.073 -4.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 1.187 -8.858 -3.131 1.00 0.00 H new ATOM 706 N GLY A 4 7.091 -11.737 -1.178 1.00 0.00 N ATOM 707 CA GLY A 4 8.540 -11.845 -1.204 1.00 0.00 C ATOM 708 C GLY A 4 9.153 -10.782 -2.117 1.00 0.00 C ATOM 709 O GLY A 4 10.348 -10.504 -2.038 1.00 0.00 O ATOM 0 H GLY A 4 6.595 -12.565 -1.508 1.00 0.00 H new ATOM 0 HA2 GLY A 4 8.935 -11.733 -0.194 1.00 0.00 H new ATOM 0 HA3 GLY A 4 8.828 -12.837 -1.551 1.00 0.00 H new ATOM 713 N ASN A 5 8.306 -10.215 -2.964 1.00 0.00 N ATOM 714 CA ASN A 5 8.749 -9.188 -3.891 1.00 0.00 C ATOM 715 C ASN A 5 9.390 -8.041 -3.107 1.00 0.00 C ATOM 716 O ASN A 5 10.201 -7.292 -3.649 1.00 0.00 O ATOM 717 CB ASN A 5 7.572 -8.617 -4.685 1.00 0.00 C ATOM 718 CG ASN A 5 8.027 -8.113 -6.056 1.00 0.00 C ATOM 719 OD1 ASN A 5 8.628 -8.828 -6.839 1.00 0.00 O ATOM 720 ND2 ASN A 5 7.708 -6.845 -6.299 1.00 0.00 N ATOM 0 H ASN A 5 7.315 -10.448 -3.027 1.00 0.00 H new ATOM 0 HA ASN A 5 9.463 -9.641 -4.579 1.00 0.00 H new ATOM 0 HB2 ASN A 5 6.808 -9.384 -4.811 1.00 0.00 H new ATOM 0 HB3 ASN A 5 7.115 -7.800 -4.127 1.00 0.00 H new ATOM 0 HD21 ASN A 5 7.968 -6.415 -7.186 1.00 0.00 H new ATOM 0 HD22 ASN A 5 7.203 -6.303 -5.598 1.00 0.00 H new ATOM 727 N PHE A 6 9.004 -7.942 -1.843 1.00 0.00 N ATOM 728 CA PHE A 6 9.532 -6.900 -0.979 1.00 0.00 C ATOM 729 C PHE A 6 11.056 -6.989 -0.879 1.00 0.00 C ATOM 730 O PHE A 6 11.707 -6.059 -0.410 1.00 0.00 O ATOM 731 CB PHE A 6 8.928 -7.121 0.409 1.00 0.00 C ATOM 732 CG PHE A 6 7.884 -6.076 0.808 1.00 0.00 C ATOM 733 CD1 PHE A 6 8.083 -4.766 0.502 1.00 0.00 C ATOM 734 CD2 PHE A 6 6.759 -6.457 1.468 1.00 0.00 C ATOM 735 CE1 PHE A 6 7.114 -3.796 0.872 1.00 0.00 C ATOM 736 CE2 PHE A 6 5.790 -5.487 1.837 1.00 0.00 C ATOM 737 CZ PHE A 6 5.988 -4.176 1.532 1.00 0.00 C ATOM 0 H PHE A 6 8.332 -8.566 -1.397 1.00 0.00 H new ATOM 0 HA PHE A 6 9.278 -5.920 -1.382 1.00 0.00 H new ATOM 0 HB2 PHE A 6 8.468 -8.109 0.441 1.00 0.00 H new ATOM 0 HB3 PHE A 6 9.730 -7.119 1.147 1.00 0.00 H new ATOM 0 HD1 PHE A 6 8.978 -4.463 -0.022 1.00 0.00 H new ATOM 0 HD2 PHE A 6 6.602 -7.497 1.712 1.00 0.00 H new ATOM 0 HE1 PHE A 6 7.272 -2.756 0.629 1.00 0.00 H new ATOM 0 HE2 PHE A 6 4.895 -5.790 2.360 1.00 0.00 H new ATOM 0 HZ PHE A 6 5.251 -3.438 1.814 1.00 0.00 H new ATOM 747 N ARG A 7 11.580 -8.120 -1.330 1.00 0.00 N ATOM 748 CA ARG A 7 13.016 -8.344 -1.297 1.00 0.00 C ATOM 749 C ARG A 7 13.738 -7.280 -2.125 1.00 0.00 C ATOM 750 O ARG A 7 14.963 -7.177 -2.078 1.00 0.00 O ATOM 751 CB ARG A 7 13.369 -9.730 -1.840 1.00 0.00 C ATOM 752 CG ARG A 7 12.976 -9.858 -3.313 1.00 0.00 C ATOM 753 CD ARG A 7 12.655 -11.311 -3.670 1.00 0.00 C ATOM 754 NE ARG A 7 11.693 -11.356 -4.794 1.00 0.00 N ATOM 755 CZ ARG A 7 10.841 -12.378 -5.020 1.00 0.00 C ATOM 756 NH1 ARG A 7 10.824 -13.450 -4.201 1.00 0.00 N ATOM 757 NH2 ARG A 7 10.024 -12.312 -6.055 1.00 0.00 N ATOM 0 H ARG A 7 11.037 -8.890 -1.720 1.00 0.00 H new ATOM 0 HA ARG A 7 13.338 -8.280 -0.258 1.00 0.00 H new ATOM 0 HB2 ARG A 7 14.439 -9.906 -1.729 1.00 0.00 H new ATOM 0 HB3 ARG A 7 12.857 -10.495 -1.256 1.00 0.00 H new ATOM 0 HG2 ARG A 7 12.109 -9.229 -3.518 1.00 0.00 H new ATOM 0 HG3 ARG A 7 13.789 -9.496 -3.943 1.00 0.00 H new ATOM 0 HD2 ARG A 7 13.570 -11.838 -3.942 1.00 0.00 H new ATOM 0 HD3 ARG A 7 12.238 -11.823 -2.803 1.00 0.00 H new ATOM 0 HE ARG A 7 11.673 -10.565 -5.438 1.00 0.00 H new ATOM 0 HH11 ARG A 7 11.458 -13.493 -3.403 1.00 0.00 H new ATOM 0 HH12 ARG A 7 10.177 -14.218 -4.379 1.00 0.00 H new ATOM 0 HH21 ARG A 7 10.043 -11.498 -6.669 1.00 0.00 H new ATOM 0 HH22 ARG A 7 9.374 -13.075 -6.241 1.00 0.00 H new ATOM 770 N ASN A 8 12.948 -6.515 -2.865 1.00 0.00 N ATOM 771 CA ASN A 8 13.498 -5.462 -3.702 1.00 0.00 C ATOM 772 C ASN A 8 14.333 -4.513 -2.840 1.00 0.00 C ATOM 773 O ASN A 8 15.232 -3.841 -3.343 1.00 0.00 O ATOM 774 CB ASN A 8 12.384 -4.645 -4.361 1.00 0.00 C ATOM 775 CG ASN A 8 11.492 -3.984 -3.308 1.00 0.00 C ATOM 776 OD1 ASN A 8 11.183 -4.553 -2.273 1.00 0.00 O ATOM 777 ND2 ASN A 8 11.098 -2.755 -3.626 1.00 0.00 N ATOM 0 H ASN A 8 11.933 -6.603 -2.902 1.00 0.00 H new ATOM 0 HA ASN A 8 14.109 -5.930 -4.474 1.00 0.00 H new ATOM 0 HB2 ASN A 8 12.820 -3.881 -5.004 1.00 0.00 H new ATOM 0 HB3 ASN A 8 11.782 -5.292 -4.998 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.501 -2.230 -2.987 1.00 0.00 H new ATOM 0 HD22 ASN A 8 11.393 -2.337 -4.509 1.00 0.00 H new ATOM 784 N GLN A 9 14.007 -4.490 -1.556 1.00 0.00 N ATOM 785 CA GLN A 9 14.715 -3.636 -0.620 1.00 0.00 C ATOM 786 C GLN A 9 16.205 -3.987 -0.602 1.00 0.00 C ATOM 787 O GLN A 9 17.019 -3.229 -0.078 1.00 0.00 O ATOM 788 CB GLN A 9 14.112 -3.740 0.783 1.00 0.00 C ATOM 789 CG GLN A 9 12.704 -3.142 0.819 1.00 0.00 C ATOM 790 CD GLN A 9 11.995 -3.491 2.130 1.00 0.00 C ATOM 791 OE1 GLN A 9 11.716 -2.641 2.959 1.00 0.00 O ATOM 792 NE2 GLN A 9 11.720 -4.785 2.269 1.00 0.00 N ATOM 0 H GLN A 9 13.261 -5.050 -1.142 1.00 0.00 H new ATOM 0 HA GLN A 9 14.608 -2.603 -0.951 1.00 0.00 H new ATOM 0 HB2 GLN A 9 14.075 -4.785 1.091 1.00 0.00 H new ATOM 0 HB3 GLN A 9 14.751 -3.220 1.497 1.00 0.00 H new ATOM 0 HG2 GLN A 9 12.762 -2.059 0.709 1.00 0.00 H new ATOM 0 HG3 GLN A 9 12.124 -3.517 -0.024 1.00 0.00 H new ATOM 0 HE21 GLN A 9 11.982 -5.444 1.535 1.00 0.00 H new ATOM 0 HE22 GLN A 9 11.247 -5.119 3.109 1.00 0.00 H new ATOM 801 N ARG A 10 16.515 -5.135 -1.184 1.00 0.00 N ATOM 802 CA ARG A 10 17.893 -5.596 -1.243 1.00 0.00 C ATOM 803 C ARG A 10 18.719 -4.684 -2.153 1.00 0.00 C ATOM 804 O ARG A 10 19.942 -4.806 -2.213 1.00 0.00 O ATOM 805 CB ARG A 10 17.971 -7.033 -1.764 1.00 0.00 C ATOM 806 CG ARG A 10 17.565 -7.104 -3.238 1.00 0.00 C ATOM 807 CD ARG A 10 17.331 -8.552 -3.673 1.00 0.00 C ATOM 808 NE ARG A 10 18.499 -9.385 -3.309 1.00 0.00 N ATOM 809 CZ ARG A 10 18.602 -10.084 -2.159 1.00 0.00 C ATOM 810 NH1 ARG A 10 17.604 -10.057 -1.249 1.00 0.00 N ATOM 811 NH2 ARG A 10 19.691 -10.795 -1.938 1.00 0.00 N ATOM 0 H ARG A 10 15.837 -5.760 -1.619 1.00 0.00 H new ATOM 0 HA ARG A 10 18.297 -5.567 -0.231 1.00 0.00 H new ATOM 0 HB2 ARG A 10 18.986 -7.413 -1.644 1.00 0.00 H new ATOM 0 HB3 ARG A 10 17.318 -7.674 -1.172 1.00 0.00 H new ATOM 0 HG2 ARG A 10 16.658 -6.521 -3.397 1.00 0.00 H new ATOM 0 HG3 ARG A 10 18.344 -6.656 -3.855 1.00 0.00 H new ATOM 0 HD2 ARG A 10 16.432 -8.943 -3.196 1.00 0.00 H new ATOM 0 HD3 ARG A 10 17.165 -8.595 -4.749 1.00 0.00 H new ATOM 0 HE ARG A 10 19.275 -9.434 -3.969 1.00 0.00 H new ATOM 0 HH11 ARG A 10 16.765 -9.506 -1.429 1.00 0.00 H new ATOM 0 HH12 ARG A 10 17.690 -10.588 -0.382 1.00 0.00 H new ATOM 0 HH21 ARG A 10 20.439 -10.811 -2.631 1.00 0.00 H new ATOM 0 HH22 ARG A 10 19.785 -11.329 -1.074 1.00 0.00 H new ATOM 824 N LYS A 11 18.018 -3.793 -2.838 1.00 0.00 N ATOM 825 CA LYS A 11 18.672 -2.862 -3.741 1.00 0.00 C ATOM 826 C LYS A 11 18.311 -1.429 -3.339 1.00 0.00 C ATOM 827 O LYS A 11 18.099 -0.575 -4.198 1.00 0.00 O ATOM 828 CB LYS A 11 18.330 -3.196 -5.195 1.00 0.00 C ATOM 829 CG LYS A 11 18.941 -2.171 -6.152 1.00 0.00 C ATOM 830 CD LYS A 11 19.287 -2.813 -7.497 1.00 0.00 C ATOM 831 CE LYS A 11 19.954 -1.802 -8.431 1.00 0.00 C ATOM 832 NZ LYS A 11 21.402 -2.086 -8.551 1.00 0.00 N ATOM 0 H LYS A 11 17.004 -3.696 -2.786 1.00 0.00 H new ATOM 0 HA LYS A 11 19.755 -2.953 -3.663 1.00 0.00 H new ATOM 0 HB2 LYS A 11 18.699 -4.192 -5.439 1.00 0.00 H new ATOM 0 HB3 LYS A 11 17.248 -3.217 -5.322 1.00 0.00 H new ATOM 0 HG2 LYS A 11 18.241 -1.350 -6.307 1.00 0.00 H new ATOM 0 HG3 LYS A 11 19.840 -1.744 -5.707 1.00 0.00 H new ATOM 0 HD2 LYS A 11 19.953 -3.661 -7.339 1.00 0.00 H new ATOM 0 HD3 LYS A 11 18.381 -3.201 -7.963 1.00 0.00 H new ATOM 0 HE2 LYS A 11 19.486 -1.843 -9.415 1.00 0.00 H new ATOM 0 HE3 LYS A 11 19.806 -0.792 -8.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 21.840 -1.391 -9.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 21.847 -2.024 -7.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 21.537 -3.043 -8.936 1.00 0.00 H new ATOM 845 N THR A 12 18.252 -1.213 -2.033 1.00 0.00 N ATOM 846 CA THR A 12 17.921 0.100 -1.507 1.00 0.00 C ATOM 847 C THR A 12 16.877 0.782 -2.394 1.00 0.00 C ATOM 848 O THR A 12 17.038 1.943 -2.769 1.00 0.00 O ATOM 849 CB THR A 12 19.220 0.898 -1.376 1.00 0.00 C ATOM 850 OG1 THR A 12 18.910 1.910 -0.421 1.00 0.00 O ATOM 851 CG2 THR A 12 19.562 1.677 -2.647 1.00 0.00 C ATOM 0 H THR A 12 18.428 -1.925 -1.324 1.00 0.00 H new ATOM 0 HA THR A 12 17.466 0.027 -0.519 1.00 0.00 H new ATOM 0 HB THR A 12 20.039 0.220 -1.136 1.00 0.00 H new ATOM 0 HG1 THR A 12 19.698 2.474 -0.274 1.00 0.00 H new ATOM 0 HG21 THR A 12 20.493 2.225 -2.499 1.00 0.00 H new ATOM 0 HG22 THR A 12 19.678 0.983 -3.479 1.00 0.00 H new ATOM 0 HG23 THR A 12 18.759 2.379 -2.870 1.00 0.00 H new ATOM 859 N VAL A 13 15.830 0.033 -2.704 1.00 0.00 N ATOM 860 CA VAL A 13 14.760 0.550 -3.539 1.00 0.00 C ATOM 861 C VAL A 13 14.515 2.020 -3.195 1.00 0.00 C ATOM 862 O VAL A 13 14.802 2.457 -2.081 1.00 0.00 O ATOM 863 CB VAL A 13 13.508 -0.316 -3.382 1.00 0.00 C ATOM 864 CG1 VAL A 13 13.674 -1.654 -4.106 1.00 0.00 C ATOM 865 CG2 VAL A 13 13.170 -0.530 -1.905 1.00 0.00 C ATOM 0 H VAL A 13 15.700 -0.929 -2.391 1.00 0.00 H new ATOM 0 HA VAL A 13 15.042 0.504 -4.591 1.00 0.00 H new ATOM 0 HB VAL A 13 12.674 0.214 -3.842 1.00 0.00 H new ATOM 0 HG11 VAL A 13 12.771 -2.251 -3.979 1.00 0.00 H new ATOM 0 HG12 VAL A 13 13.844 -1.475 -5.168 1.00 0.00 H new ATOM 0 HG13 VAL A 13 14.525 -2.191 -3.688 1.00 0.00 H new ATOM 0 HG21 VAL A 13 12.276 -1.149 -1.822 1.00 0.00 H new ATOM 0 HG22 VAL A 13 14.003 -1.028 -1.410 1.00 0.00 H new ATOM 0 HG23 VAL A 13 12.989 0.434 -1.430 1.00 0.00 H new ATOM 875 N LYS A 14 13.988 2.744 -4.171 1.00 0.00 N ATOM 876 CA LYS A 14 13.701 4.156 -3.986 1.00 0.00 C ATOM 877 C LYS A 14 12.199 4.342 -3.759 1.00 0.00 C ATOM 878 O LYS A 14 11.385 3.684 -4.403 1.00 0.00 O ATOM 879 CB LYS A 14 14.253 4.974 -5.156 1.00 0.00 C ATOM 880 CG LYS A 14 13.508 6.302 -5.297 1.00 0.00 C ATOM 881 CD LYS A 14 14.331 7.310 -6.101 1.00 0.00 C ATOM 882 CE LYS A 14 14.346 6.942 -7.586 1.00 0.00 C ATOM 883 NZ LYS A 14 15.699 7.143 -8.156 1.00 0.00 N ATOM 0 H LYS A 14 13.752 2.379 -5.094 1.00 0.00 H new ATOM 0 HA LYS A 14 14.207 4.534 -3.097 1.00 0.00 H new ATOM 0 HB2 LYS A 14 15.315 5.164 -5.002 1.00 0.00 H new ATOM 0 HB3 LYS A 14 14.162 4.402 -6.079 1.00 0.00 H new ATOM 0 HG2 LYS A 14 12.550 6.135 -5.789 1.00 0.00 H new ATOM 0 HG3 LYS A 14 13.293 6.709 -4.309 1.00 0.00 H new ATOM 0 HD2 LYS A 14 13.914 8.309 -5.974 1.00 0.00 H new ATOM 0 HD3 LYS A 14 15.352 7.339 -5.719 1.00 0.00 H new ATOM 0 HE2 LYS A 14 14.042 5.903 -7.712 1.00 0.00 H new ATOM 0 HE3 LYS A 14 13.623 7.553 -8.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 15.692 6.889 -9.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 15.975 8.140 -8.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 16.381 6.541 -7.652 1.00 0.00 H new ATOM 896 N CYS A 15 11.880 5.244 -2.842 1.00 0.00 N ATOM 897 CA CYS A 15 10.490 5.525 -2.523 1.00 0.00 C ATOM 898 C CYS A 15 9.937 6.478 -3.584 1.00 0.00 C ATOM 899 O CYS A 15 10.312 7.648 -3.630 1.00 0.00 O ATOM 900 CB CYS A 15 10.339 6.095 -1.111 1.00 0.00 C ATOM 901 SG CYS A 15 8.566 6.314 -0.711 1.00 0.00 S ATOM 0 H CYS A 15 12.559 5.789 -2.311 1.00 0.00 H new ATOM 0 HA CYS A 15 9.917 4.598 -2.534 1.00 0.00 H new ATOM 0 HB2 CYS A 15 10.803 5.425 -0.388 1.00 0.00 H new ATOM 0 HB3 CYS A 15 10.858 7.051 -1.038 1.00 0.00 H new ATOM 906 N PHE A 16 9.053 5.941 -4.412 1.00 0.00 N ATOM 907 CA PHE A 16 8.444 6.729 -5.471 1.00 0.00 C ATOM 908 C PHE A 16 7.412 7.706 -4.902 1.00 0.00 C ATOM 909 O PHE A 16 6.797 8.468 -5.647 1.00 0.00 O ATOM 910 CB PHE A 16 7.738 5.748 -6.408 1.00 0.00 C ATOM 911 CG PHE A 16 8.672 5.048 -7.395 1.00 0.00 C ATOM 912 CD1 PHE A 16 9.642 5.756 -8.034 1.00 0.00 C ATOM 913 CD2 PHE A 16 8.534 3.716 -7.635 1.00 0.00 C ATOM 914 CE1 PHE A 16 10.509 5.107 -8.950 1.00 0.00 C ATOM 915 CE2 PHE A 16 9.402 3.066 -8.553 1.00 0.00 C ATOM 916 CZ PHE A 16 10.371 3.775 -9.191 1.00 0.00 C ATOM 0 H PHE A 16 8.744 4.970 -4.371 1.00 0.00 H new ATOM 0 HA PHE A 16 9.207 7.309 -5.990 1.00 0.00 H new ATOM 0 HB2 PHE A 16 7.227 4.994 -5.809 1.00 0.00 H new ATOM 0 HB3 PHE A 16 6.971 6.284 -6.967 1.00 0.00 H new ATOM 0 HD1 PHE A 16 9.752 6.813 -7.844 1.00 0.00 H new ATOM 0 HD2 PHE A 16 7.765 3.153 -7.128 1.00 0.00 H new ATOM 0 HE1 PHE A 16 11.279 5.670 -9.456 1.00 0.00 H new ATOM 0 HE2 PHE A 16 9.292 2.009 -8.744 1.00 0.00 H new ATOM 0 HZ PHE A 16 11.031 3.281 -9.889 1.00 0.00 H new ATOM 926 N ASN A 17 7.254 7.652 -3.588 1.00 0.00 N ATOM 927 CA ASN A 17 6.309 8.523 -2.912 1.00 0.00 C ATOM 928 C ASN A 17 7.019 9.809 -2.487 1.00 0.00 C ATOM 929 O ASN A 17 6.730 10.885 -3.010 1.00 0.00 O ATOM 930 CB ASN A 17 5.748 7.856 -1.654 1.00 0.00 C ATOM 931 CG ASN A 17 4.355 8.395 -1.321 1.00 0.00 C ATOM 932 OD1 ASN A 17 3.624 8.866 -2.177 1.00 0.00 O ATOM 933 ND2 ASN A 17 4.031 8.301 -0.036 1.00 0.00 N ATOM 0 H ASN A 17 7.765 7.018 -2.973 1.00 0.00 H new ATOM 0 HA ASN A 17 5.493 8.735 -3.603 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.698 6.777 -1.802 1.00 0.00 H new ATOM 0 HB3 ASN A 17 6.420 8.032 -0.814 1.00 0.00 H new ATOM 0 HD21 ASN A 17 3.123 8.634 0.287 1.00 0.00 H new ATOM 0 HD22 ASN A 17 4.691 7.896 0.628 1.00 0.00 H new ATOM 940 N CYS A 18 7.936 9.658 -1.542 1.00 0.00 N ATOM 941 CA CYS A 18 8.691 10.794 -1.042 1.00 0.00 C ATOM 942 C CYS A 18 9.837 11.074 -2.014 1.00 0.00 C ATOM 943 O CYS A 18 10.096 12.227 -2.358 1.00 0.00 O ATOM 944 CB CYS A 18 9.196 10.554 0.383 1.00 0.00 C ATOM 945 SG CYS A 18 10.238 9.051 0.433 1.00 0.00 S ATOM 0 H CYS A 18 8.173 8.765 -1.109 1.00 0.00 H new ATOM 0 HA CYS A 18 8.043 11.669 -0.985 1.00 0.00 H new ATOM 0 HB2 CYS A 18 9.770 11.416 0.724 1.00 0.00 H new ATOM 0 HB3 CYS A 18 8.351 10.444 1.063 1.00 0.00 H new ATOM 950 N GLY A 19 10.495 10.002 -2.430 1.00 0.00 N ATOM 951 CA GLY A 19 11.609 10.119 -3.356 1.00 0.00 C ATOM 952 C GLY A 19 12.940 9.861 -2.648 1.00 0.00 C ATOM 953 O GLY A 19 13.968 10.417 -3.030 1.00 0.00 O ATOM 0 H GLY A 19 10.278 9.048 -2.143 1.00 0.00 H new ATOM 0 HA2 GLY A 19 11.484 9.408 -4.173 1.00 0.00 H new ATOM 0 HA3 GLY A 19 11.616 11.115 -3.799 1.00 0.00 H new ATOM 957 N LYS A 20 12.878 9.017 -1.628 1.00 0.00 N ATOM 958 CA LYS A 20 14.066 8.679 -0.862 1.00 0.00 C ATOM 959 C LYS A 20 14.562 7.295 -1.284 1.00 0.00 C ATOM 960 O LYS A 20 14.052 6.713 -2.242 1.00 0.00 O ATOM 961 CB LYS A 20 13.790 8.803 0.637 1.00 0.00 C ATOM 962 CG LYS A 20 14.810 9.726 1.308 1.00 0.00 C ATOM 963 CD LYS A 20 14.360 10.107 2.720 1.00 0.00 C ATOM 964 CE LYS A 20 15.229 9.420 3.776 1.00 0.00 C ATOM 965 NZ LYS A 20 15.556 10.363 4.869 1.00 0.00 N ATOM 0 H LYS A 20 12.023 8.557 -1.314 1.00 0.00 H new ATOM 0 HA LYS A 20 14.870 9.384 -1.074 1.00 0.00 H new ATOM 0 HB2 LYS A 20 12.784 9.192 0.794 1.00 0.00 H new ATOM 0 HB3 LYS A 20 13.827 7.817 1.100 1.00 0.00 H new ATOM 0 HG2 LYS A 20 15.780 9.230 1.353 1.00 0.00 H new ATOM 0 HG3 LYS A 20 14.940 10.627 0.708 1.00 0.00 H new ATOM 0 HD2 LYS A 20 14.417 11.188 2.844 1.00 0.00 H new ATOM 0 HD3 LYS A 20 13.317 9.824 2.862 1.00 0.00 H new ATOM 0 HE2 LYS A 20 14.705 8.553 4.179 1.00 0.00 H new ATOM 0 HE3 LYS A 20 16.147 9.052 3.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 16.146 9.882 5.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 16.075 11.177 4.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 14.677 10.693 5.317 1.00 0.00 H new ATOM 978 N GLU A 21 15.550 6.806 -0.550 1.00 0.00 N ATOM 979 CA GLU A 21 16.120 5.501 -0.836 1.00 0.00 C ATOM 980 C GLU A 21 16.237 4.679 0.449 1.00 0.00 C ATOM 981 O GLU A 21 16.771 5.157 1.449 1.00 0.00 O ATOM 982 CB GLU A 21 17.480 5.635 -1.526 1.00 0.00 C ATOM 983 CG GLU A 21 17.391 5.225 -2.997 1.00 0.00 C ATOM 984 CD GLU A 21 18.557 5.803 -3.799 1.00 0.00 C ATOM 985 OE1 GLU A 21 19.418 6.493 -3.232 1.00 0.00 O ATOM 986 OE2 GLU A 21 18.552 5.514 -5.057 1.00 0.00 O ATOM 0 H GLU A 21 15.971 7.290 0.243 1.00 0.00 H new ATOM 0 HA GLU A 21 15.452 4.977 -1.520 1.00 0.00 H new ATOM 0 HB2 GLU A 21 17.829 6.665 -1.452 1.00 0.00 H new ATOM 0 HB3 GLU A 21 18.214 5.012 -1.015 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.394 4.138 -3.076 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.448 5.572 -3.418 1.00 0.00 H new ATOM 994 N GLY A 22 15.729 3.457 0.381 1.00 0.00 N ATOM 995 CA GLY A 22 15.769 2.565 1.527 1.00 0.00 C ATOM 996 C GLY A 22 14.381 2.002 1.833 1.00 0.00 C ATOM 997 O GLY A 22 14.217 1.214 2.764 1.00 0.00 O ATOM 0 H GLY A 22 15.287 3.064 -0.450 1.00 0.00 H new ATOM 0 HA2 GLY A 22 16.462 1.747 1.331 1.00 0.00 H new ATOM 0 HA3 GLY A 22 16.147 3.102 2.397 1.00 0.00 H new ATOM 1001 N HIS A 23 13.414 2.429 1.034 1.00 0.00 N ATOM 1002 CA HIS A 23 12.044 1.978 1.207 1.00 0.00 C ATOM 1003 C HIS A 23 11.208 2.395 -0.005 1.00 0.00 C ATOM 1004 O HIS A 23 11.554 3.347 -0.702 1.00 0.00 O ATOM 1005 CB HIS A 23 11.468 2.489 2.530 1.00 0.00 C ATOM 1006 CG HIS A 23 11.020 3.931 2.488 1.00 0.00 C ATOM 1007 ND1 HIS A 23 11.858 4.985 2.806 1.00 0.00 N ATOM 1008 CD2 HIS A 23 9.815 4.481 2.162 1.00 0.00 C ATOM 1009 CE1 HIS A 23 11.177 6.115 2.675 1.00 0.00 C ATOM 1010 NE2 HIS A 23 9.911 5.799 2.276 1.00 0.00 N ATOM 0 H HIS A 23 13.553 3.084 0.264 1.00 0.00 H new ATOM 0 HA HIS A 23 12.020 0.890 1.263 1.00 0.00 H new ATOM 0 HB2 HIS A 23 10.621 1.864 2.811 1.00 0.00 H new ATOM 0 HB3 HIS A 23 12.221 2.375 3.310 1.00 0.00 H new ATOM 0 HD1 HIS A 23 12.834 4.906 3.092 1.00 0.00 H new ATOM 0 HD2 HIS A 23 8.932 3.936 1.862 1.00 0.00 H new ATOM 0 HE1 HIS A 23 11.557 7.110 2.853 1.00 0.00 H new ATOM 1018 N ILE A 24 10.125 1.663 -0.216 1.00 0.00 N ATOM 1019 CA ILE A 24 9.238 1.945 -1.332 1.00 0.00 C ATOM 1020 C ILE A 24 7.946 2.573 -0.804 1.00 0.00 C ATOM 1021 O ILE A 24 7.669 2.515 0.393 1.00 0.00 O ATOM 1022 CB ILE A 24 9.012 0.684 -2.169 1.00 0.00 C ATOM 1023 CG1 ILE A 24 8.112 -0.310 -1.431 1.00 0.00 C ATOM 1024 CG2 ILE A 24 10.343 0.055 -2.583 1.00 0.00 C ATOM 1025 CD1 ILE A 24 7.528 -1.342 -2.398 1.00 0.00 C ATOM 0 H ILE A 24 9.841 0.875 0.366 1.00 0.00 H new ATOM 0 HA ILE A 24 9.693 2.670 -2.007 1.00 0.00 H new ATOM 0 HB ILE A 24 8.493 0.970 -3.084 1.00 0.00 H new ATOM 0 HG12 ILE A 24 8.684 -0.817 -0.654 1.00 0.00 H new ATOM 0 HG13 ILE A 24 7.304 0.226 -0.933 1.00 0.00 H new ATOM 0 HG21 ILE A 24 10.154 -0.839 -3.177 1.00 0.00 H new ATOM 0 HG22 ILE A 24 10.914 0.770 -3.175 1.00 0.00 H new ATOM 0 HG23 ILE A 24 10.911 -0.214 -1.692 1.00 0.00 H new ATOM 0 HD11 ILE A 24 6.892 -2.037 -1.849 1.00 0.00 H new ATOM 0 HD12 ILE A 24 6.937 -0.833 -3.159 1.00 0.00 H new ATOM 0 HD13 ILE A 24 8.338 -1.892 -2.876 1.00 0.00 H new ATOM 1037 N ALA A 25 7.191 3.157 -1.723 1.00 0.00 N ATOM 1038 CA ALA A 25 5.936 3.795 -1.365 1.00 0.00 C ATOM 1039 C ALA A 25 5.108 2.836 -0.507 1.00 0.00 C ATOM 1040 O ALA A 25 4.405 3.264 0.408 1.00 0.00 O ATOM 1041 CB ALA A 25 5.199 4.223 -2.636 1.00 0.00 C ATOM 0 H ALA A 25 7.424 3.202 -2.715 1.00 0.00 H new ATOM 0 HA ALA A 25 6.117 4.693 -0.775 1.00 0.00 H new ATOM 0 HB1 ALA A 25 4.257 4.702 -2.367 1.00 0.00 H new ATOM 0 HB2 ALA A 25 5.816 4.926 -3.195 1.00 0.00 H new ATOM 0 HB3 ALA A 25 4.997 3.347 -3.252 1.00 0.00 H new ATOM 1047 N LYS A 26 5.220 1.555 -0.831 1.00 0.00 N ATOM 1048 CA LYS A 26 4.490 0.533 -0.101 1.00 0.00 C ATOM 1049 C LYS A 26 4.911 0.564 1.369 1.00 0.00 C ATOM 1050 O LYS A 26 4.065 0.513 2.262 1.00 0.00 O ATOM 1051 CB LYS A 26 4.676 -0.834 -0.765 1.00 0.00 C ATOM 1052 CG LYS A 26 4.121 -0.831 -2.190 1.00 0.00 C ATOM 1053 CD LYS A 26 2.691 -1.374 -2.223 1.00 0.00 C ATOM 1054 CE LYS A 26 2.546 -2.474 -3.277 1.00 0.00 C ATOM 1055 NZ LYS A 26 1.129 -2.631 -3.672 1.00 0.00 N ATOM 0 H LYS A 26 5.805 1.203 -1.589 1.00 0.00 H new ATOM 0 HA LYS A 26 3.419 0.734 -0.131 1.00 0.00 H new ATOM 0 HB2 LYS A 26 5.735 -1.092 -0.784 1.00 0.00 H new ATOM 0 HB3 LYS A 26 4.172 -1.600 -0.176 1.00 0.00 H new ATOM 0 HG2 LYS A 26 4.138 0.183 -2.588 1.00 0.00 H new ATOM 0 HG3 LYS A 26 4.759 -1.437 -2.834 1.00 0.00 H new ATOM 0 HD2 LYS A 26 2.425 -1.768 -1.242 1.00 0.00 H new ATOM 0 HD3 LYS A 26 1.995 -0.563 -2.440 1.00 0.00 H new ATOM 0 HE2 LYS A 26 3.148 -2.229 -4.152 1.00 0.00 H new ATOM 0 HE3 LYS A 26 2.926 -3.416 -2.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 1.049 -3.381 -4.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.562 -2.886 -2.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 0.778 -1.736 -4.068 1.00 0.00 H new ATOM 1068 N ASN A 27 6.217 0.646 1.577 1.00 0.00 N ATOM 1069 CA ASN A 27 6.760 0.685 2.925 1.00 0.00 C ATOM 1070 C ASN A 27 6.924 2.141 3.362 1.00 0.00 C ATOM 1071 O ASN A 27 7.568 2.421 4.372 1.00 0.00 O ATOM 1072 CB ASN A 27 8.133 0.015 2.984 1.00 0.00 C ATOM 1073 CG ASN A 27 8.052 -1.445 2.533 1.00 0.00 C ATOM 1074 OD1 ASN A 27 7.134 -2.175 2.868 1.00 0.00 O ATOM 1075 ND2 ASN A 27 9.061 -1.828 1.755 1.00 0.00 N ATOM 0 H ASN A 27 6.915 0.687 0.835 1.00 0.00 H new ATOM 0 HA ASN A 27 6.071 0.154 3.582 1.00 0.00 H new ATOM 0 HB2 ASN A 27 8.833 0.557 2.349 1.00 0.00 H new ATOM 0 HB3 ASN A 27 8.522 0.064 4.001 1.00 0.00 H new ATOM 0 HD21 ASN A 27 9.098 -2.784 1.401 1.00 0.00 H new ATOM 0 HD22 ASN A 27 9.798 -1.166 1.512 1.00 0.00 H new ATOM 1082 N CYS A 28 6.333 3.032 2.579 1.00 0.00 N ATOM 1083 CA CYS A 28 6.406 4.452 2.873 1.00 0.00 C ATOM 1084 C CYS A 28 5.265 4.806 3.828 1.00 0.00 C ATOM 1085 O CYS A 28 4.120 4.412 3.607 1.00 0.00 O ATOM 1086 CB CYS A 28 6.364 5.297 1.597 1.00 0.00 C ATOM 1087 SG CYS A 28 6.677 7.054 1.999 1.00 0.00 S ATOM 0 H CYS A 28 5.801 2.797 1.741 1.00 0.00 H new ATOM 0 HA CYS A 28 7.360 4.677 3.350 1.00 0.00 H new ATOM 0 HB2 CYS A 28 7.111 4.939 0.889 1.00 0.00 H new ATOM 0 HB3 CYS A 28 5.392 5.193 1.114 1.00 0.00 H new ATOM 1092 N ARG A 29 5.615 5.543 4.872 1.00 0.00 N ATOM 1093 CA ARG A 29 4.635 5.953 5.863 1.00 0.00 C ATOM 1094 C ARG A 29 3.770 7.089 5.315 1.00 0.00 C ATOM 1095 O ARG A 29 2.629 7.266 5.739 1.00 0.00 O ATOM 1096 CB ARG A 29 5.316 6.416 7.153 1.00 0.00 C ATOM 1097 CG ARG A 29 5.098 5.406 8.281 1.00 0.00 C ATOM 1098 CD ARG A 29 5.144 6.092 9.647 1.00 0.00 C ATOM 1099 NE ARG A 29 3.993 7.011 9.791 1.00 0.00 N ATOM 1100 CZ ARG A 29 2.730 6.610 10.047 1.00 0.00 C ATOM 1101 NH1 ARG A 29 2.444 5.298 10.191 1.00 0.00 N ATOM 1102 NH2 ARG A 29 1.779 7.519 10.156 1.00 0.00 N ATOM 0 H ARG A 29 6.565 5.867 5.053 1.00 0.00 H new ATOM 0 HA ARG A 29 4.008 5.090 6.087 1.00 0.00 H new ATOM 0 HB2 ARG A 29 6.384 6.546 6.978 1.00 0.00 H new ATOM 0 HB3 ARG A 29 4.921 7.388 7.449 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.135 4.912 8.150 1.00 0.00 H new ATOM 0 HG3 ARG A 29 5.863 4.631 8.233 1.00 0.00 H new ATOM 0 HD2 ARG A 29 5.124 5.344 10.440 1.00 0.00 H new ATOM 0 HD3 ARG A 29 6.077 6.645 9.754 1.00 0.00 H new ATOM 0 HE ARG A 29 4.165 8.011 9.690 1.00 0.00 H new ATOM 0 HH11 ARG A 29 3.185 4.602 10.106 1.00 0.00 H new ATOM 0 HH12 ARG A 29 1.487 5.003 10.384 1.00 0.00 H new ATOM 0 HH21 ARG A 29 2.004 8.508 10.047 1.00 0.00 H new ATOM 0 HH22 ARG A 29 0.819 7.232 10.349 1.00 0.00 H new ATOM 1115 N ALA A 30 4.345 7.830 4.379 1.00 0.00 N ATOM 1116 CA ALA A 30 3.641 8.944 3.769 1.00 0.00 C ATOM 1117 C ALA A 30 2.440 8.414 2.982 1.00 0.00 C ATOM 1118 O ALA A 30 2.452 7.275 2.517 1.00 0.00 O ATOM 1119 CB ALA A 30 4.608 9.740 2.889 1.00 0.00 C ATOM 0 H ALA A 30 5.291 7.680 4.028 1.00 0.00 H new ATOM 0 HA ALA A 30 3.262 9.622 4.534 1.00 0.00 H new ATOM 0 HB1 ALA A 30 4.079 10.576 2.431 1.00 0.00 H new ATOM 0 HB2 ALA A 30 5.427 10.119 3.500 1.00 0.00 H new ATOM 0 HB3 ALA A 30 5.007 9.092 2.109 1.00 0.00 H new ATOM 1125 N PRO A 31 1.406 9.288 2.854 1.00 0.00 N ATOM 1126 CA PRO A 31 0.200 8.919 2.131 1.00 0.00 C ATOM 1127 C PRO A 31 0.441 8.929 0.621 1.00 0.00 C ATOM 1128 O PRO A 31 1.356 9.594 0.139 1.00 0.00 O ATOM 1129 CB PRO A 31 -0.847 9.929 2.573 1.00 0.00 C ATOM 1130 CG PRO A 31 -0.075 11.099 3.161 1.00 0.00 C ATOM 1131 CD PRO A 31 1.357 10.644 3.390 1.00 0.00 C ATOM 0 HA PRO A 31 -0.128 7.903 2.350 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -1.460 10.250 1.731 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -1.521 9.495 3.312 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -0.101 11.952 2.483 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -0.527 11.422 4.098 1.00 0.00 H new ATOM 0 HD2 PRO A 31 2.066 11.297 2.881 1.00 0.00 H new ATOM 0 HD3 PRO A 31 1.613 10.660 4.449 1.00 0.00 H new ATOM 1139 N ARG A 32 -0.397 8.182 -0.085 1.00 0.00 N ATOM 1140 CA ARG A 32 -0.286 8.098 -1.531 1.00 0.00 C ATOM 1141 C ARG A 32 -0.321 9.496 -2.150 1.00 0.00 C ATOM 1142 O ARG A 32 -1.374 10.128 -2.206 1.00 0.00 O ATOM 1143 CB ARG A 32 -1.421 7.258 -2.121 1.00 0.00 C ATOM 1144 CG ARG A 32 -0.894 5.933 -2.673 1.00 0.00 C ATOM 1145 CD ARG A 32 -0.999 4.822 -1.626 1.00 0.00 C ATOM 1146 NE ARG A 32 0.348 4.293 -1.312 1.00 0.00 N ATOM 1147 CZ ARG A 32 0.684 3.731 -0.132 1.00 0.00 C ATOM 1148 NH1 ARG A 32 -0.226 3.622 0.859 1.00 0.00 N ATOM 1149 NH2 ARG A 32 1.917 3.292 0.040 1.00 0.00 N ATOM 0 H ARG A 32 -1.155 7.630 0.318 1.00 0.00 H new ATOM 0 HA ARG A 32 0.665 7.619 -1.763 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -2.171 7.064 -1.354 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -1.916 7.816 -2.916 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -1.460 5.654 -3.562 1.00 0.00 H new ATOM 0 HG3 ARG A 32 0.145 6.051 -2.981 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -1.467 5.208 -0.720 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -1.636 4.020 -1.998 1.00 0.00 H new ATOM 0 HE ARG A 32 1.067 4.357 -2.033 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -1.176 3.966 0.719 1.00 0.00 H new ATOM 0 HH12 ARG A 32 0.036 3.196 1.748 1.00 0.00 H new ATOM 0 HH21 ARG A 32 2.599 3.380 -0.713 1.00 0.00 H new ATOM 0 HH22 ARG A 32 2.187 2.865 0.926 1.00 0.00 H new ATOM 1162 N LYS A 33 0.845 9.939 -2.598 1.00 0.00 N ATOM 1163 CA LYS A 33 0.962 11.252 -3.210 1.00 0.00 C ATOM 1164 C LYS A 33 1.727 11.128 -4.529 1.00 0.00 C ATOM 1165 O LYS A 33 2.181 10.042 -4.888 1.00 0.00 O ATOM 1166 CB LYS A 33 1.584 12.247 -2.229 1.00 0.00 C ATOM 1167 CG LYS A 33 0.526 13.205 -1.677 1.00 0.00 C ATOM 1168 CD LYS A 33 1.015 13.882 -0.395 1.00 0.00 C ATOM 1169 CE LYS A 33 2.055 14.960 -0.705 1.00 0.00 C ATOM 1170 NZ LYS A 33 1.628 16.266 -0.152 1.00 0.00 N ATOM 0 H LYS A 33 1.717 9.412 -2.549 1.00 0.00 H new ATOM 0 HA LYS A 33 -0.024 11.651 -3.449 1.00 0.00 H new ATOM 0 HB2 LYS A 33 2.055 11.707 -1.408 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.369 12.815 -2.729 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.290 13.962 -2.425 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -0.395 12.658 -1.475 1.00 0.00 H new ATOM 0 HD2 LYS A 33 0.170 14.328 0.130 1.00 0.00 H new ATOM 0 HD3 LYS A 33 1.447 13.136 0.272 1.00 0.00 H new ATOM 0 HE2 LYS A 33 3.019 14.677 -0.282 1.00 0.00 H new ATOM 0 HE3 LYS A 33 2.192 15.042 -1.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.345 16.987 -0.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 0.719 16.542 -0.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 1.520 16.188 0.879 1.00 0.00 H new ATOM 1183 N LYS A 34 1.847 12.255 -5.215 1.00 0.00 N ATOM 1184 CA LYS A 34 2.550 12.287 -6.486 1.00 0.00 C ATOM 1185 C LYS A 34 3.294 13.618 -6.620 1.00 0.00 C ATOM 1186 O LYS A 34 3.151 14.314 -7.623 1.00 0.00 O ATOM 1187 CB LYS A 34 1.585 12.004 -7.639 1.00 0.00 C ATOM 1188 CG LYS A 34 2.169 10.965 -8.599 1.00 0.00 C ATOM 1189 CD LYS A 34 1.349 9.674 -8.575 1.00 0.00 C ATOM 1190 CE LYS A 34 0.608 9.469 -9.899 1.00 0.00 C ATOM 1191 NZ LYS A 34 0.318 8.034 -10.113 1.00 0.00 N ATOM 0 H LYS A 34 1.469 13.153 -4.914 1.00 0.00 H new ATOM 0 HA LYS A 34 3.300 11.497 -6.526 1.00 0.00 H new ATOM 0 HB2 LYS A 34 0.635 11.645 -7.243 1.00 0.00 H new ATOM 0 HB3 LYS A 34 1.377 12.928 -8.179 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.187 11.370 -9.611 1.00 0.00 H new ATOM 0 HG3 LYS A 34 3.201 10.749 -8.323 1.00 0.00 H new ATOM 0 HD2 LYS A 34 2.006 8.825 -8.387 1.00 0.00 H new ATOM 0 HD3 LYS A 34 0.632 9.710 -7.755 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -0.322 10.037 -9.894 1.00 0.00 H new ATOM 0 HE3 LYS A 34 1.211 9.851 -10.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -0.185 7.912 -11.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 1.210 7.500 -10.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -0.275 7.680 -9.336 1.00 0.00 H new ATOM 1204 N GLY A 35 4.072 13.930 -5.594 1.00 0.00 N ATOM 1205 CA GLY A 35 4.838 15.164 -5.584 1.00 0.00 C ATOM 1206 C GLY A 35 6.262 14.930 -6.094 1.00 0.00 C ATOM 1207 O GLY A 35 6.955 14.032 -5.619 1.00 0.00 O ATOM 0 H GLY A 35 4.188 13.349 -4.764 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.343 15.909 -6.207 1.00 0.00 H new ATOM 0 HA3 GLY A 35 4.872 15.567 -4.572 1.00 0.00 H new ATOM 1211 N CYS A 36 6.654 15.753 -7.055 1.00 0.00 N ATOM 1212 CA CYS A 36 7.982 15.647 -7.635 1.00 0.00 C ATOM 1213 C CYS A 36 9.010 15.853 -6.521 1.00 0.00 C ATOM 1214 O CYS A 36 9.033 16.902 -5.878 1.00 0.00 O ATOM 1215 CB CYS A 36 8.178 16.638 -8.784 1.00 0.00 C ATOM 1216 SG CYS A 36 9.933 16.655 -9.303 1.00 0.00 S ATOM 0 H CYS A 36 6.075 16.496 -7.447 1.00 0.00 H new ATOM 0 HA CYS A 36 8.114 14.657 -8.071 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.544 16.361 -9.626 1.00 0.00 H new ATOM 0 HB3 CYS A 36 7.873 17.636 -8.470 1.00 0.00 H new ATOM 1221 N TRP A 37 9.837 14.836 -6.326 1.00 0.00 N ATOM 1222 CA TRP A 37 10.866 14.893 -5.301 1.00 0.00 C ATOM 1223 C TRP A 37 12.068 15.641 -5.880 1.00 0.00 C ATOM 1224 O TRP A 37 13.214 15.294 -5.596 1.00 0.00 O ATOM 1225 CB TRP A 37 11.217 13.492 -4.799 1.00 0.00 C ATOM 1226 CG TRP A 37 10.263 12.399 -5.285 1.00 0.00 C ATOM 1227 CD1 TRP A 37 8.998 12.178 -4.900 1.00 0.00 C ATOM 1228 CD2 TRP A 37 10.549 11.381 -6.267 1.00 0.00 C ATOM 1229 NE1 TRP A 37 8.451 11.096 -5.560 1.00 0.00 N ATOM 1230 CE2 TRP A 37 9.424 10.596 -6.417 1.00 0.00 C ATOM 1231 CE3 TRP A 37 11.721 11.132 -7.004 1.00 0.00 C ATOM 1232 CZ2 TRP A 37 9.359 9.510 -7.298 1.00 0.00 C ATOM 1233 CZ3 TRP A 37 11.640 10.043 -7.880 1.00 0.00 C ATOM 1234 CH2 TRP A 37 10.514 9.243 -8.043 1.00 0.00 C ATOM 0 H TRP A 37 9.815 13.968 -6.861 1.00 0.00 H new ATOM 0 HA TRP A 37 10.509 15.434 -4.425 1.00 0.00 H new ATOM 0 HB2 TRP A 37 12.229 13.245 -5.120 1.00 0.00 H new ATOM 0 HB3 TRP A 37 11.221 13.498 -3.709 1.00 0.00 H new ATOM 0 HD1 TRP A 37 8.473 12.772 -4.166 1.00 0.00 H new ATOM 0 HE1 TRP A 37 7.506 10.731 -5.441 1.00 0.00 H new ATOM 0 HE3 TRP A 37 12.612 11.733 -6.902 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 8.466 8.911 -7.398 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 12.513 9.808 -8.471 1.00 0.00 H new ATOM 0 HH2 TRP A 37 10.531 8.419 -8.741 1.00 0.00 H new ATOM 1245 N LYS A 38 11.768 16.651 -6.681 1.00 0.00 N ATOM 1246 CA LYS A 38 12.811 17.451 -7.302 1.00 0.00 C ATOM 1247 C LYS A 38 12.485 18.935 -7.122 1.00 0.00 C ATOM 1248 O LYS A 38 13.336 19.713 -6.693 1.00 0.00 O ATOM 1249 CB LYS A 38 13.006 17.036 -8.762 1.00 0.00 C ATOM 1250 CG LYS A 38 14.487 16.820 -9.077 1.00 0.00 C ATOM 1251 CD LYS A 38 15.270 18.129 -8.956 1.00 0.00 C ATOM 1252 CE LYS A 38 16.771 17.860 -8.831 1.00 0.00 C ATOM 1253 NZ LYS A 38 17.329 17.419 -10.130 1.00 0.00 N ATOM 0 H LYS A 38 10.817 16.935 -6.915 1.00 0.00 H new ATOM 0 HA LYS A 38 13.769 17.274 -6.814 1.00 0.00 H new ATOM 0 HB2 LYS A 38 12.451 16.119 -8.961 1.00 0.00 H new ATOM 0 HB3 LYS A 38 12.599 17.804 -9.420 1.00 0.00 H new ATOM 0 HG2 LYS A 38 14.903 16.079 -8.395 1.00 0.00 H new ATOM 0 HG3 LYS A 38 14.593 16.420 -10.085 1.00 0.00 H new ATOM 0 HD2 LYS A 38 15.080 18.753 -9.830 1.00 0.00 H new ATOM 0 HD3 LYS A 38 14.923 18.686 -8.085 1.00 0.00 H new ATOM 0 HE2 LYS A 38 17.282 18.763 -8.497 1.00 0.00 H new ATOM 0 HE3 LYS A 38 16.948 17.096 -8.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 18.348 17.241 -10.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 16.854 16.545 -10.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 17.177 18.161 -10.843 1.00 0.00 H new ATOM 1266 N CYS A 39 11.252 19.283 -7.459 1.00 0.00 N ATOM 1267 CA CYS A 39 10.804 20.659 -7.340 1.00 0.00 C ATOM 1268 C CYS A 39 9.785 20.737 -6.202 1.00 0.00 C ATOM 1269 O CYS A 39 9.700 21.749 -5.508 1.00 0.00 O ATOM 1270 CB CYS A 39 10.228 21.183 -8.658 1.00 0.00 C ATOM 1271 SG CYS A 39 8.971 20.017 -9.299 1.00 0.00 S ATOM 0 H CYS A 39 10.549 18.635 -7.815 1.00 0.00 H new ATOM 0 HA CYS A 39 11.654 21.301 -7.110 1.00 0.00 H new ATOM 0 HB2 CYS A 39 9.780 22.165 -8.504 1.00 0.00 H new ATOM 0 HB3 CYS A 39 11.027 21.308 -9.389 1.00 0.00 H new ATOM 1276 N GLY A 40 9.037 19.655 -6.045 1.00 0.00 N ATOM 1277 CA GLY A 40 8.028 19.587 -5.002 1.00 0.00 C ATOM 1278 C GLY A 40 6.639 19.899 -5.563 1.00 0.00 C ATOM 1279 O GLY A 40 5.723 20.232 -4.811 1.00 0.00 O ATOM 0 H GLY A 40 9.110 18.818 -6.623 1.00 0.00 H new ATOM 0 HA2 GLY A 40 8.029 18.593 -4.554 1.00 0.00 H new ATOM 0 HA3 GLY A 40 8.271 20.294 -4.209 1.00 0.00 H new ATOM 1283 N LYS A 41 6.526 19.781 -6.878 1.00 0.00 N ATOM 1284 CA LYS A 41 5.264 20.047 -7.548 1.00 0.00 C ATOM 1285 C LYS A 41 4.469 18.745 -7.664 1.00 0.00 C ATOM 1286 O LYS A 41 4.979 17.745 -8.170 1.00 0.00 O ATOM 1287 CB LYS A 41 5.506 20.742 -8.889 1.00 0.00 C ATOM 1288 CG LYS A 41 4.637 21.996 -9.020 1.00 0.00 C ATOM 1289 CD LYS A 41 5.404 23.243 -8.577 1.00 0.00 C ATOM 1290 CE LYS A 41 4.630 24.515 -8.927 1.00 0.00 C ATOM 1291 NZ LYS A 41 5.246 25.193 -10.089 1.00 0.00 N ATOM 0 H LYS A 41 7.288 19.505 -7.498 1.00 0.00 H new ATOM 0 HA LYS A 41 4.659 20.739 -6.962 1.00 0.00 H new ATOM 0 HB2 LYS A 41 6.558 21.013 -8.978 1.00 0.00 H new ATOM 0 HB3 LYS A 41 5.284 20.054 -9.705 1.00 0.00 H new ATOM 0 HG2 LYS A 41 4.313 22.112 -10.054 1.00 0.00 H new ATOM 0 HG3 LYS A 41 3.737 21.884 -8.415 1.00 0.00 H new ATOM 0 HD2 LYS A 41 5.579 23.204 -7.502 1.00 0.00 H new ATOM 0 HD3 LYS A 41 6.382 23.264 -9.059 1.00 0.00 H new ATOM 0 HE2 LYS A 41 3.593 24.266 -9.151 1.00 0.00 H new ATOM 0 HE3 LYS A 41 4.618 25.188 -8.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 4.708 26.055 -10.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 6.229 25.447 -9.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 5.235 24.554 -10.910 1.00 0.00 H new ATOM 1304 N GLU A 42 3.234 18.798 -7.190 1.00 0.00 N ATOM 1305 CA GLU A 42 2.363 17.635 -7.235 1.00 0.00 C ATOM 1306 C GLU A 42 1.639 17.566 -8.580 1.00 0.00 C ATOM 1307 O GLU A 42 0.926 18.497 -8.952 1.00 0.00 O ATOM 1308 CB GLU A 42 1.366 17.650 -6.074 1.00 0.00 C ATOM 1309 CG GLU A 42 0.381 18.813 -6.214 1.00 0.00 C ATOM 1310 CD GLU A 42 -0.510 18.928 -4.976 1.00 0.00 C ATOM 1311 OE1 GLU A 42 -1.327 18.033 -4.714 1.00 0.00 O ATOM 1312 OE2 GLU A 42 -0.330 19.993 -4.271 1.00 0.00 O ATOM 0 H GLU A 42 2.815 19.629 -6.772 1.00 0.00 H new ATOM 0 HA GLU A 42 2.978 16.741 -7.130 1.00 0.00 H new ATOM 0 HB2 GLU A 42 0.820 16.707 -6.046 1.00 0.00 H new ATOM 0 HB3 GLU A 42 1.903 17.735 -5.129 1.00 0.00 H new ATOM 0 HG2 GLU A 42 0.930 19.744 -6.359 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -0.238 18.666 -7.099 1.00 0.00 H new ATOM 1320 N GLY A 43 1.845 16.456 -9.272 1.00 0.00 N ATOM 1321 CA GLY A 43 1.220 16.254 -10.568 1.00 0.00 C ATOM 1322 C GLY A 43 2.200 15.616 -11.556 1.00 0.00 C ATOM 1323 O GLY A 43 1.858 14.653 -12.240 1.00 0.00 O ATOM 0 H GLY A 43 2.437 15.686 -8.960 1.00 0.00 H new ATOM 0 HA2 GLY A 43 0.343 15.616 -10.457 1.00 0.00 H new ATOM 0 HA3 GLY A 43 0.872 17.209 -10.961 1.00 0.00 H new ATOM 1327 N HIS A 44 3.397 16.179 -11.599 1.00 0.00 N ATOM 1328 CA HIS A 44 4.429 15.678 -12.492 1.00 0.00 C ATOM 1329 C HIS A 44 5.440 14.852 -11.694 1.00 0.00 C ATOM 1330 O HIS A 44 5.430 14.870 -10.464 1.00 0.00 O ATOM 1331 CB HIS A 44 5.080 16.823 -13.269 1.00 0.00 C ATOM 1332 CG HIS A 44 6.076 17.623 -12.464 1.00 0.00 C ATOM 1333 ND1 HIS A 44 5.785 18.866 -11.928 1.00 0.00 N ATOM 1334 CD2 HIS A 44 7.363 17.344 -12.108 1.00 0.00 C ATOM 1335 CE1 HIS A 44 6.855 19.305 -11.283 1.00 0.00 C ATOM 1336 NE2 HIS A 44 7.832 18.361 -11.396 1.00 0.00 N ATOM 0 H HIS A 44 3.677 16.978 -11.030 1.00 0.00 H new ATOM 0 HA HIS A 44 3.982 15.021 -13.238 1.00 0.00 H new ATOM 0 HB2 HIS A 44 5.582 16.414 -14.146 1.00 0.00 H new ATOM 0 HB3 HIS A 44 4.300 17.492 -13.631 1.00 0.00 H new ATOM 0 HD1 HIS A 44 4.897 19.360 -12.015 1.00 0.00 H new ATOM 0 HD2 HIS A 44 7.908 16.447 -12.363 1.00 0.00 H new ATOM 0 HE1 HIS A 44 6.939 20.246 -10.759 1.00 0.00 H new ATOM 1344 N GLN A 45 6.289 14.148 -12.427 1.00 0.00 N ATOM 1345 CA GLN A 45 7.306 13.316 -11.804 1.00 0.00 C ATOM 1346 C GLN A 45 8.703 13.826 -12.166 1.00 0.00 C ATOM 1347 O GLN A 45 8.868 14.555 -13.142 1.00 0.00 O ATOM 1348 CB GLN A 45 7.136 11.849 -12.205 1.00 0.00 C ATOM 1349 CG GLN A 45 7.461 11.645 -13.686 1.00 0.00 C ATOM 1350 CD GLN A 45 6.397 10.782 -14.367 1.00 0.00 C ATOM 1351 OE1 GLN A 45 5.266 11.191 -14.571 1.00 0.00 O ATOM 1352 NE2 GLN A 45 6.820 9.568 -14.705 1.00 0.00 N ATOM 0 H GLN A 45 6.294 14.136 -13.447 1.00 0.00 H new ATOM 0 HA GLN A 45 7.187 13.378 -10.722 1.00 0.00 H new ATOM 0 HB2 GLN A 45 7.789 11.224 -11.596 1.00 0.00 H new ATOM 0 HB3 GLN A 45 6.113 11.530 -12.006 1.00 0.00 H new ATOM 0 HG2 GLN A 45 7.524 12.612 -14.185 1.00 0.00 H new ATOM 0 HG3 GLN A 45 8.437 11.171 -13.786 1.00 0.00 H new ATOM 0 HE21 GLN A 45 7.780 9.289 -14.505 1.00 0.00 H new ATOM 0 HE22 GLN A 45 6.184 8.916 -15.164 1.00 0.00 H new ATOM 1361 N MET A 46 9.673 13.421 -11.358 1.00 0.00 N ATOM 1362 CA MET A 46 11.050 13.828 -11.580 1.00 0.00 C ATOM 1363 C MET A 46 11.480 13.544 -13.021 1.00 0.00 C ATOM 1364 O MET A 46 12.176 14.350 -13.635 1.00 0.00 O ATOM 1365 CB MET A 46 11.967 13.073 -10.615 1.00 0.00 C ATOM 1366 CG MET A 46 13.394 13.621 -10.675 1.00 0.00 C ATOM 1367 SD MET A 46 14.562 12.321 -10.310 1.00 0.00 S ATOM 1368 CE MET A 46 14.976 12.740 -8.625 1.00 0.00 C ATOM 0 H MET A 46 9.532 12.816 -10.549 1.00 0.00 H new ATOM 0 HA MET A 46 11.126 14.901 -11.403 1.00 0.00 H new ATOM 0 HB2 MET A 46 11.582 13.160 -9.599 1.00 0.00 H new ATOM 0 HB3 MET A 46 11.970 12.012 -10.865 1.00 0.00 H new ATOM 0 HG2 MET A 46 13.593 14.033 -11.664 1.00 0.00 H new ATOM 0 HG3 MET A 46 13.510 14.436 -9.961 1.00 0.00 H new ATOM 0 HE1 MET A 46 15.573 11.940 -8.187 1.00 0.00 H new ATOM 0 HE2 MET A 46 15.547 13.668 -8.611 1.00 0.00 H new ATOM 0 HE3 MET A 46 14.061 12.868 -8.047 1.00 0.00 H new ATOM 1378 N LYS A 47 11.045 12.394 -13.518 1.00 0.00 N ATOM 1379 CA LYS A 47 11.376 11.994 -14.875 1.00 0.00 C ATOM 1380 C LYS A 47 10.911 13.077 -15.851 1.00 0.00 C ATOM 1381 O LYS A 47 11.590 13.366 -16.834 1.00 0.00 O ATOM 1382 CB LYS A 47 10.807 10.607 -15.178 1.00 0.00 C ATOM 1383 CG LYS A 47 11.591 9.925 -16.302 1.00 0.00 C ATOM 1384 CD LYS A 47 10.654 9.445 -17.411 1.00 0.00 C ATOM 1385 CE LYS A 47 9.952 8.146 -17.012 1.00 0.00 C ATOM 1386 NZ LYS A 47 9.958 7.187 -18.139 1.00 0.00 N ATOM 0 H LYS A 47 10.467 11.728 -13.005 1.00 0.00 H new ATOM 0 HA LYS A 47 12.456 11.903 -14.992 1.00 0.00 H new ATOM 0 HB2 LYS A 47 10.843 9.991 -14.279 1.00 0.00 H new ATOM 0 HB3 LYS A 47 9.758 10.695 -15.463 1.00 0.00 H new ATOM 0 HG2 LYS A 47 12.322 10.621 -16.714 1.00 0.00 H new ATOM 0 HG3 LYS A 47 12.148 9.079 -15.900 1.00 0.00 H new ATOM 0 HD2 LYS A 47 9.911 10.214 -17.622 1.00 0.00 H new ATOM 0 HD3 LYS A 47 11.221 9.289 -18.329 1.00 0.00 H new ATOM 0 HE2 LYS A 47 10.452 7.706 -16.149 1.00 0.00 H new ATOM 0 HE3 LYS A 47 8.926 8.358 -16.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 9.478 6.311 -17.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 9.461 7.604 -18.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 10.940 6.972 -18.407 1.00 0.00 H new ATOM 1399 N ASP A 48 9.755 13.648 -15.542 1.00 0.00 N ATOM 1400 CA ASP A 48 9.191 14.693 -16.380 1.00 0.00 C ATOM 1401 C ASP A 48 9.227 16.022 -15.623 1.00 0.00 C ATOM 1402 O ASP A 48 8.376 16.885 -15.834 1.00 0.00 O ATOM 1403 CB ASP A 48 7.732 14.389 -16.732 1.00 0.00 C ATOM 1404 CG ASP A 48 7.535 13.548 -17.995 1.00 0.00 C ATOM 1405 OD1 ASP A 48 8.350 13.595 -18.928 1.00 0.00 O ATOM 1406 OD2 ASP A 48 6.476 12.811 -17.997 1.00 0.00 O ATOM 0 H ASP A 48 9.195 13.407 -14.724 1.00 0.00 H new ATOM 0 HA ASP A 48 9.780 14.746 -17.296 1.00 0.00 H new ATOM 0 HB2 ASP A 48 7.272 13.869 -15.892 1.00 0.00 H new ATOM 0 HB3 ASP A 48 7.199 15.332 -16.854 1.00 0.00 H new ATOM 1412 N CYS A 49 10.220 16.145 -14.755 1.00 0.00 N ATOM 1413 CA CYS A 49 10.379 17.354 -13.965 1.00 0.00 C ATOM 1414 C CYS A 49 10.202 18.560 -14.892 1.00 0.00 C ATOM 1415 O CYS A 49 10.995 18.763 -15.810 1.00 0.00 O ATOM 1416 CB CYS A 49 11.727 17.384 -13.241 1.00 0.00 C ATOM 1417 SG CYS A 49 11.755 18.755 -12.029 1.00 0.00 S ATOM 0 H CYS A 49 10.923 15.427 -14.581 1.00 0.00 H new ATOM 0 HA CYS A 49 9.620 17.383 -13.183 1.00 0.00 H new ATOM 0 HB2 CYS A 49 11.898 16.435 -12.733 1.00 0.00 H new ATOM 0 HB3 CYS A 49 12.534 17.509 -13.963 1.00 0.00 H new ATOM 1422 N THR A 50 9.156 19.327 -14.618 1.00 0.00 N ATOM 1423 CA THR A 50 8.865 20.506 -15.415 1.00 0.00 C ATOM 1424 C THR A 50 10.029 21.498 -15.346 1.00 0.00 C ATOM 1425 O THR A 50 10.082 22.451 -16.120 1.00 0.00 O ATOM 1426 CB THR A 50 7.539 21.090 -14.927 1.00 0.00 C ATOM 1427 OG1 THR A 50 7.736 21.279 -13.528 1.00 0.00 O ATOM 1428 CG2 THR A 50 6.390 20.084 -15.007 1.00 0.00 C ATOM 0 H THR A 50 8.501 19.155 -13.856 1.00 0.00 H new ATOM 0 HA THR A 50 8.757 20.254 -16.470 1.00 0.00 H new ATOM 0 HB THR A 50 7.292 21.971 -15.519 1.00 0.00 H new ATOM 0 HG1 THR A 50 6.923 21.657 -13.131 1.00 0.00 H new ATOM 0 HG21 THR A 50 5.472 20.550 -14.649 1.00 0.00 H new ATOM 0 HG22 THR A 50 6.256 19.767 -16.041 1.00 0.00 H new ATOM 0 HG23 THR A 50 6.622 19.217 -14.388 1.00 0.00 H new ATOM 1436 N GLU A 51 10.930 21.238 -14.411 1.00 0.00 N ATOM 1437 CA GLU A 51 12.089 22.095 -14.230 1.00 0.00 C ATOM 1438 C GLU A 51 12.897 21.646 -13.011 1.00 0.00 C ATOM 1439 O GLU A 51 13.774 20.791 -13.124 1.00 0.00 O ATOM 1440 CB GLU A 51 11.672 23.561 -14.102 1.00 0.00 C ATOM 1441 CG GLU A 51 11.878 24.308 -15.421 1.00 0.00 C ATOM 1442 CD GLU A 51 10.731 25.285 -15.683 1.00 0.00 C ATOM 1443 OE1 GLU A 51 9.986 25.632 -14.753 1.00 0.00 O ATOM 1444 OE2 GLU A 51 10.626 25.689 -16.904 1.00 0.00 O ATOM 0 H GLU A 51 10.881 20.446 -13.770 1.00 0.00 H new ATOM 0 HA GLU A 51 12.722 22.007 -15.113 1.00 0.00 H new ATOM 0 HB2 GLU A 51 10.624 23.620 -13.807 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.253 24.040 -13.314 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.823 24.851 -15.392 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.946 23.593 -16.241 1.00 0.00 H new ATOM 1452 N ARG A 52 12.573 22.243 -11.873 1.00 0.00 N ATOM 1453 CA ARG A 52 13.258 21.914 -10.635 1.00 0.00 C ATOM 1454 C ARG A 52 12.900 22.929 -9.546 1.00 0.00 C ATOM 1455 O ARG A 52 12.149 23.872 -9.793 1.00 0.00 O ATOM 1456 CB ARG A 52 14.775 21.902 -10.831 1.00 0.00 C ATOM 1457 CG ARG A 52 15.248 23.175 -11.534 1.00 0.00 C ATOM 1458 CD ARG A 52 16.052 22.840 -12.792 1.00 0.00 C ATOM 1459 NE ARG A 52 16.254 24.061 -13.604 1.00 0.00 N ATOM 1460 CZ ARG A 52 16.935 24.091 -14.769 1.00 0.00 C ATOM 1461 NH1 ARG A 52 17.487 22.965 -15.269 1.00 0.00 N ATOM 1462 NH2 ARG A 52 17.053 25.238 -15.412 1.00 0.00 N ATOM 0 H ARG A 52 11.845 22.952 -11.783 1.00 0.00 H new ATOM 0 HA ARG A 52 12.935 20.918 -10.331 1.00 0.00 H new ATOM 0 HB2 ARG A 52 15.269 21.812 -9.864 1.00 0.00 H new ATOM 0 HB3 ARG A 52 15.062 21.030 -11.418 1.00 0.00 H new ATOM 0 HG2 ARG A 52 14.387 23.789 -11.801 1.00 0.00 H new ATOM 0 HG3 ARG A 52 15.861 23.765 -10.853 1.00 0.00 H new ATOM 0 HD2 ARG A 52 17.016 22.414 -12.515 1.00 0.00 H new ATOM 0 HD3 ARG A 52 15.527 22.086 -13.379 1.00 0.00 H new ATOM 0 HE ARG A 52 15.853 24.934 -13.262 1.00 0.00 H new ATOM 0 HH11 ARG A 52 17.391 22.083 -14.766 1.00 0.00 H new ATOM 0 HH12 ARG A 52 18.000 22.996 -16.150 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.633 26.084 -15.027 1.00 0.00 H new ATOM 0 HH22 ARG A 52 17.564 25.278 -16.294 1.00 0.00 H new ATOM 1475 N GLN A 53 13.454 22.701 -8.364 1.00 0.00 N ATOM 1476 CA GLN A 53 13.203 23.582 -7.237 1.00 0.00 C ATOM 1477 C GLN A 53 13.918 23.064 -5.988 1.00 0.00 C ATOM 1478 O GLN A 53 14.015 21.856 -5.780 1.00 0.00 O ATOM 1479 CB GLN A 53 11.702 23.737 -6.986 1.00 0.00 C ATOM 1480 CG GLN A 53 11.360 25.169 -6.572 1.00 0.00 C ATOM 1481 CD GLN A 53 10.635 25.908 -7.700 1.00 0.00 C ATOM 1482 OE1 GLN A 53 11.204 26.726 -8.406 1.00 0.00 O ATOM 1483 NE2 GLN A 53 9.355 25.574 -7.830 1.00 0.00 N ATOM 0 H GLN A 53 14.076 21.918 -8.163 1.00 0.00 H new ATOM 0 HA GLN A 53 13.601 24.568 -7.476 1.00 0.00 H new ATOM 0 HB2 GLN A 53 11.150 23.474 -7.888 1.00 0.00 H new ATOM 0 HB3 GLN A 53 11.387 23.044 -6.206 1.00 0.00 H new ATOM 0 HG2 GLN A 53 10.733 25.154 -5.681 1.00 0.00 H new ATOM 0 HG3 GLN A 53 12.273 25.704 -6.310 1.00 0.00 H new ATOM 0 HE21 GLN A 53 8.943 24.882 -7.205 1.00 0.00 H new ATOM 0 HE22 GLN A 53 8.785 26.010 -8.555 1.00 0.00 H new ATOM 1492 N ALA A 54 14.401 24.003 -5.188 1.00 0.00 N ATOM 1493 CA ALA A 54 15.104 23.657 -3.965 1.00 0.00 C ATOM 1494 C ALA A 54 14.085 23.385 -2.856 1.00 0.00 C ATOM 1495 O ALA A 54 13.369 24.291 -2.431 1.00 0.00 O ATOM 1496 CB ALA A 54 16.078 24.779 -3.600 1.00 0.00 C ATOM 0 H ALA A 54 14.319 25.004 -5.363 1.00 0.00 H new ATOM 0 HA ALA A 54 15.691 22.749 -4.104 1.00 0.00 H new ATOM 0 HB1 ALA A 54 16.605 24.519 -2.682 1.00 0.00 H new ATOM 0 HB2 ALA A 54 16.798 24.912 -4.407 1.00 0.00 H new ATOM 0 HB3 ALA A 54 15.525 25.706 -3.450 1.00 0.00 H new ATOM 1502 N ASN A 55 14.054 22.136 -2.419 1.00 0.00 N ATOM 1503 CA ASN A 55 13.135 21.734 -1.366 1.00 0.00 C ATOM 1504 C ASN A 55 13.484 20.318 -0.904 1.00 0.00 C ATOM 1505 O ASN A 55 14.627 19.884 -1.030 1.00 0.00 O ATOM 1506 CB ASN A 55 11.690 21.724 -1.871 1.00 0.00 C ATOM 1507 CG ASN A 55 10.717 22.110 -0.755 1.00 0.00 C ATOM 1508 OD1 ASN A 55 10.850 23.135 -0.108 1.00 0.00 O ATOM 1509 ND2 ASN A 55 9.734 21.234 -0.569 1.00 0.00 N ATOM 0 H ASN A 55 14.650 21.388 -2.774 1.00 0.00 H new ATOM 0 HA ASN A 55 13.226 22.448 -0.547 1.00 0.00 H new ATOM 0 HB2 ASN A 55 11.587 22.419 -2.704 1.00 0.00 H new ATOM 0 HB3 ASN A 55 11.440 20.733 -2.250 1.00 0.00 H new ATOM 0 HD21 ASN A 55 9.032 21.401 0.152 1.00 0.00 H new ATOM 0 HD22 ASN A 55 9.682 20.395 -1.147 1.00 0.00 H new TER 1516 ASN A 55 HETATM 1517 ZN ZN A 56 8.871 7.418 1.410 1.00 0.00 ZN HETATM 1518 ZN ZN A 57 9.819 18.514 -10.811 1.00 0.00 ZN