USER MOD reduce.3.24.130724 H: found=0, std=0, add=657, rem=0, adj=28 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= 0.828 K(o=0.86,f=-3.7!) USER MOD Set 1.2: B 212 G O2' : rot 180:sc= 0.0371 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -123:sc= 1.1 (180deg=-1.62!) USER MOD Single : A 2 GLN : amide:sc=-0.00627 X(o=-0.0063,f=0) USER MOD Single : A 3 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.012) USER MOD Single : A 8 ASN : amide:sc= -10.8! C(o=-11!,f=-14!) USER MOD Single : A 9 GLN : amide:sc= -1.14 K(o=-1.1,f=-0.12) USER MOD Single : A 11 LYS NZ :NH3+ -121:sc= 1.08 (180deg=-0.67) 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= 0.622 K(o=0.62,f=-5!) 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= -2.31 K(o=-2.3,f=-1.5) 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+ -121:sc= 1.23 (180deg=-0.991) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -5.44! C(o=-5.4!,f=-8.5!) USER MOD Single : A 46 MET CE :methyl -150:sc= -0.11 (180deg=-0.664) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -32:sc= 0.83 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=-0.098) USER MOD Single : A 55 ASN : amide:sc= -0.0107 X(o=-0.011,f=0) USER MOD Single : B 201 G O2' : rot -2:sc= -0.195 USER MOD Single : B 202 G O2' : rot 3:sc= -0.387 USER MOD Single : B 203 A O2' : rot -6:sc= 0.495 USER MOD Single : B 204 C O2' : rot -90:sc= 0.602 USER MOD Single : B 205 U O2' : rot -11:sc= -0.185 USER MOD Single : B 206 A O2' : rot -156:sc= -1.1 USER MOD Single : B 207 G O2' : rot -59:sc= 0.69 USER MOD Single : B 208 C O2' : rot -129:sc= 0.026 USER MOD Single : B 209 G O2' : rot -18:sc= 0.103 USER MOD Single : B 210 G O2' : rot 180:sc= -1.92! USER MOD Single : B 211 A O2' : rot 95:sc= 0.241 USER MOD Single : B 213 G O2' : rot -134:sc= 1.16 USER MOD Single : B 214 C O2' : rot 1:sc= -1.78 USER MOD Single : B 215 U O2' : rot -87:sc= -0.188 USER MOD Single : B 216 A O2' : rot -140:sc= -1.1 USER MOD Single : B 217 G O2' : rot -123:sc= 0.44 USER MOD Single : B 218 U O2' : rot 3:sc= -0.748 USER MOD Single : B 219 C O2' : rot 12:sc= -0.806 USER MOD Single : B 220 C O2' : rot 39:sc= 0.549 USER MOD Single : B 220 C O3' : rot 40:sc= 0.356 USER MOD ----------------------------------------------------------------- ATOM 1 P G B 201 0.457 -18.587 -8.501 1.00 0.00 P ATOM 2 OP1 G B 201 0.223 -17.367 -7.697 1.00 0.00 O ATOM 3 OP2 G B 201 1.636 -18.602 -9.395 1.00 0.00 O ATOM 4 O5' G B 201 0.584 -19.826 -7.494 1.00 0.00 O ATOM 5 C5' G B 201 -0.119 -19.811 -6.254 1.00 0.00 C ATOM 6 C4' G B 201 0.514 -20.785 -5.287 1.00 0.00 C ATOM 7 O4' G B 201 0.793 -22.152 -5.394 1.00 0.00 O ATOM 8 C3' G B 201 1.844 -20.317 -4.701 1.00 0.00 C ATOM 9 O3' G B 201 1.635 -19.127 -3.942 1.00 0.00 O ATOM 10 C2' G B 201 2.316 -21.450 -3.833 1.00 0.00 C ATOM 11 O2' G B 201 1.573 -21.263 -2.649 1.00 0.00 O ATOM 12 C1' G B 201 1.904 -22.649 -4.682 1.00 0.00 C ATOM 13 N9 G B 201 2.965 -23.112 -5.601 1.00 0.00 N ATOM 14 C8 G B 201 3.463 -22.459 -6.672 1.00 0.00 C ATOM 15 N7 G B 201 4.413 -23.147 -7.296 1.00 0.00 N ATOM 16 C5 G B 201 4.514 -24.303 -6.569 1.00 0.00 C ATOM 17 C6 G B 201 5.341 -25.435 -6.721 1.00 0.00 C ATOM 18 O6 G B 201 6.182 -25.589 -7.606 1.00 0.00 O ATOM 19 N1 G B 201 5.199 -26.441 -5.816 1.00 0.00 N ATOM 20 C2 G B 201 4.283 -26.300 -4.832 1.00 0.00 C ATOM 21 N2 G B 201 4.265 -27.363 -4.032 1.00 0.00 N ATOM 22 N3 G B 201 3.448 -25.273 -4.592 1.00 0.00 N ATOM 23 C4 G B 201 3.638 -24.303 -5.529 1.00 0.00 C ATOM 0 H5' G B 201 -1.164 -20.075 -6.416 1.00 0.00 H new ATOM 0 H5'' G B 201 -0.106 -18.806 -5.831 1.00 0.00 H new ATOM 0 H4' G B 201 -0.456 -20.746 -4.792 1.00 0.00 H new ATOM 0 H3' G B 201 2.584 -20.079 -5.465 1.00 0.00 H new ATOM 0 H2' G B 201 3.366 -21.545 -3.555 1.00 0.00 H new ATOM 0 HO2' G B 201 1.022 -20.457 -2.732 1.00 0.00 H new ATOM 0 H1' G B 201 1.691 -23.528 -4.074 1.00 0.00 H new ATOM 0 H8 G B 201 3.126 -21.483 -6.988 1.00 0.00 H new ATOM 0 H1 G B 201 5.771 -27.283 -5.879 1.00 0.00 H new ATOM 0 H21 G B 201 3.620 -27.396 -3.242 1.00 0.00 H new ATOM 0 H22 G B 201 4.896 -28.145 -4.208 1.00 0.00 H new ATOM 35 P G B 202 2.597 -17.866 -4.154 1.00 0.00 P ATOM 36 OP1 G B 202 1.853 -16.619 -3.865 1.00 0.00 O ATOM 37 OP2 G B 202 3.274 -17.969 -5.465 1.00 0.00 O ATOM 38 O5' G B 202 3.700 -18.059 -3.011 1.00 0.00 O ATOM 39 C5' G B 202 3.331 -18.605 -1.748 1.00 0.00 C ATOM 40 C4' G B 202 4.479 -19.399 -1.167 1.00 0.00 C ATOM 41 O4' G B 202 4.717 -20.545 -1.893 1.00 0.00 O ATOM 42 C3' G B 202 5.851 -18.761 -1.370 1.00 0.00 C ATOM 43 O3' G B 202 6.085 -17.801 -0.342 1.00 0.00 O ATOM 44 C2' G B 202 6.832 -19.898 -1.297 1.00 0.00 C ATOM 45 O2' G B 202 6.998 -20.074 0.093 1.00 0.00 O ATOM 46 C1' G B 202 6.048 -20.997 -2.008 1.00 0.00 C ATOM 47 N9 G B 202 6.432 -21.172 -3.424 1.00 0.00 N ATOM 48 C8 G B 202 6.144 -20.353 -4.458 1.00 0.00 C ATOM 49 N7 G B 202 6.636 -20.794 -5.613 1.00 0.00 N ATOM 50 C5 G B 202 7.267 -21.961 -5.277 1.00 0.00 C ATOM 51 C6 G B 202 7.981 -22.896 -6.057 1.00 0.00 C ATOM 52 O6 G B 202 8.170 -22.814 -7.270 1.00 0.00 O ATOM 53 N1 G B 202 8.502 -23.977 -5.417 1.00 0.00 N ATOM 54 C2 G B 202 8.309 -24.093 -4.084 1.00 0.00 C ATOM 55 N2 G B 202 8.878 -25.198 -3.607 1.00 0.00 N ATOM 56 N3 G B 202 7.652 -23.269 -3.246 1.00 0.00 N ATOM 57 C4 G B 202 7.156 -22.211 -3.946 1.00 0.00 C ATOM 0 H5' G B 202 2.457 -19.246 -1.862 1.00 0.00 H new ATOM 0 H5'' G B 202 3.051 -17.803 -1.065 1.00 0.00 H new ATOM 0 H4' G B 202 4.168 -19.509 -0.128 1.00 0.00 H new ATOM 0 H3' G B 202 5.937 -18.234 -2.320 1.00 0.00 H new ATOM 0 H2' G B 202 7.823 -19.814 -1.742 1.00 0.00 H new ATOM 0 HO2' G B 202 6.406 -19.459 0.574 1.00 0.00 H new ATOM 0 H1' G B 202 6.229 -21.979 -1.571 1.00 0.00 H new ATOM 0 H8 G B 202 5.576 -19.440 -4.359 1.00 0.00 H new ATOM 0 H1 G B 202 9.027 -24.685 -5.931 1.00 0.00 H new ATOM 0 H21 G B 202 8.813 -25.417 -2.613 1.00 0.00 H new ATOM 0 H22 G B 202 9.379 -25.826 -4.236 1.00 0.00 H new ATOM 69 P A B 203 6.767 -16.398 -0.697 1.00 0.00 P ATOM 70 OP1 A B 203 6.315 -15.367 0.264 1.00 0.00 O ATOM 71 OP2 A B 203 6.593 -16.110 -2.139 1.00 0.00 O ATOM 72 O5' A B 203 8.319 -16.675 -0.432 1.00 0.00 O ATOM 73 C5' A B 203 8.725 -17.423 0.713 1.00 0.00 C ATOM 74 C4' A B 203 10.069 -18.069 0.462 1.00 0.00 C ATOM 75 O4' A B 203 10.125 -19.130 -0.221 1.00 0.00 O ATOM 76 C3' A B 203 11.087 -17.160 -0.220 1.00 0.00 C ATOM 77 O3' A B 203 11.750 -16.369 0.764 1.00 0.00 O ATOM 78 C2' A B 203 12.043 -18.088 -0.917 1.00 0.00 C ATOM 79 O2' A B 203 13.034 -18.305 0.064 1.00 0.00 O ATOM 80 C1' A B 203 11.130 -19.278 -1.199 1.00 0.00 C ATOM 81 N9 A B 203 10.555 -19.269 -2.560 1.00 0.00 N ATOM 82 C8 A B 203 9.597 -18.449 -3.040 1.00 0.00 C ATOM 83 N7 A B 203 9.298 -18.697 -4.312 1.00 0.00 N ATOM 84 C5 A B 203 10.122 -19.738 -4.645 1.00 0.00 C ATOM 85 C6 A B 203 10.282 -20.454 -5.850 1.00 0.00 C ATOM 86 N6 A B 203 9.583 -20.210 -6.988 1.00 0.00 N ATOM 87 N1 A B 203 11.203 -21.458 -5.865 1.00 0.00 N ATOM 88 C2 A B 203 11.904 -21.707 -4.737 1.00 0.00 C ATOM 89 N3 A B 203 11.833 -21.093 -3.540 1.00 0.00 N ATOM 90 C4 A B 203 10.898 -20.104 -3.592 1.00 0.00 C ATOM 0 H5' A B 203 7.982 -18.188 0.940 1.00 0.00 H new ATOM 0 H5'' A B 203 8.784 -16.768 1.582 1.00 0.00 H new ATOM 0 H4' A B 203 10.294 -18.301 1.503 1.00 0.00 H new ATOM 0 H3' A B 203 10.631 -16.468 -0.928 1.00 0.00 H new ATOM 0 H2' A B 203 12.545 -17.789 -1.837 1.00 0.00 H new ATOM 0 HO2' A B 203 12.856 -17.734 0.840 1.00 0.00 H new ATOM 0 H1' A B 203 11.666 -20.226 -1.153 1.00 0.00 H new ATOM 0 H8 A B 203 9.124 -17.675 -2.454 1.00 0.00 H new ATOM 0 H61 A B 203 9.755 -20.771 -7.822 1.00 0.00 H new ATOM 0 H62 A B 203 8.886 -19.465 -7.009 1.00 0.00 H new ATOM 0 H2 A B 203 12.622 -22.511 -4.804 1.00 0.00 H new ATOM 102 P C B 204 12.657 -15.129 0.315 1.00 0.00 P ATOM 103 OP1 C B 204 13.456 -14.654 1.466 1.00 0.00 O ATOM 104 OP2 C B 204 11.824 -14.134 -0.396 1.00 0.00 O ATOM 105 O5' C B 204 13.660 -15.784 -0.746 1.00 0.00 O ATOM 106 C5' C B 204 15.018 -16.029 -0.386 1.00 0.00 C ATOM 107 C4' C B 204 15.755 -16.664 -1.544 1.00 0.00 C ATOM 108 O4' C B 204 14.968 -17.544 -2.189 1.00 0.00 O ATOM 109 C3' C B 204 16.002 -15.728 -2.723 1.00 0.00 C ATOM 110 O3' C B 204 17.183 -14.965 -2.484 1.00 0.00 O ATOM 111 C2' C B 204 16.160 -16.628 -3.918 1.00 0.00 C ATOM 112 O2' C B 204 17.521 -16.992 -3.854 1.00 0.00 O ATOM 113 C1' C B 204 15.168 -17.735 -3.572 1.00 0.00 C ATOM 114 N1 C B 204 13.894 -17.638 -4.314 1.00 0.00 N ATOM 115 C2 C B 204 13.727 -18.463 -5.426 1.00 0.00 C ATOM 116 O2 C B 204 14.645 -19.231 -5.736 1.00 0.00 O ATOM 117 N3 C B 204 12.576 -18.393 -6.118 1.00 0.00 N ATOM 118 C4 C B 204 11.608 -17.568 -5.773 1.00 0.00 C ATOM 119 N4 C B 204 10.479 -17.513 -6.469 1.00 0.00 N ATOM 120 C5 C B 204 11.755 -16.703 -4.626 1.00 0.00 C ATOM 121 C6 C B 204 12.908 -16.784 -3.946 1.00 0.00 C ATOM 0 H5' C B 204 15.059 -16.684 0.485 1.00 0.00 H new ATOM 0 H5'' C B 204 15.502 -15.094 -0.105 1.00 0.00 H new ATOM 0 H4' C B 204 16.657 -17.040 -1.062 1.00 0.00 H new ATOM 0 H3' C B 204 15.191 -15.016 -2.877 1.00 0.00 H new ATOM 0 H2' C B 204 15.961 -16.264 -4.926 1.00 0.00 H new ATOM 0 HO2' C B 204 18.056 -16.349 -4.365 1.00 0.00 H new ATOM 0 H1' C B 204 15.545 -18.722 -3.840 1.00 0.00 H new ATOM 0 H41 C B 204 9.739 -16.869 -6.190 1.00 0.00 H new ATOM 0 H42 C B 204 10.352 -18.114 -7.283 1.00 0.00 H new ATOM 0 H5 C B 204 10.972 -16.021 -4.329 1.00 0.00 H new ATOM 0 H6 C B 204 13.055 -16.152 -3.082 1.00 0.00 H new ATOM 133 P U B 205 17.132 -13.368 -2.564 1.00 0.00 P ATOM 134 OP1 U B 205 17.712 -12.788 -1.331 1.00 0.00 O ATOM 135 OP2 U B 205 15.772 -12.930 -2.950 1.00 0.00 O ATOM 136 O5' U B 205 18.122 -13.037 -3.777 1.00 0.00 O ATOM 137 C5' U B 205 19.454 -13.547 -3.771 1.00 0.00 C ATOM 138 C4' U B 205 19.851 -13.982 -5.163 1.00 0.00 C ATOM 139 O4' U B 205 18.781 -14.849 -5.423 1.00 0.00 O ATOM 140 C3' U B 205 19.474 -12.996 -6.265 1.00 0.00 C ATOM 141 O3' U B 205 20.585 -12.145 -6.539 1.00 0.00 O ATOM 142 C2' U B 205 19.121 -13.844 -7.455 1.00 0.00 C ATOM 143 O2' U B 205 20.384 -14.151 -8.002 1.00 0.00 O ATOM 144 C1' U B 205 18.402 -15.005 -6.772 1.00 0.00 C ATOM 145 N1 U B 205 16.933 -14.958 -6.924 1.00 0.00 N ATOM 146 C2 U B 205 16.399 -15.760 -7.887 1.00 0.00 C ATOM 147 O2 U B 205 17.064 -16.489 -8.606 1.00 0.00 O ATOM 148 N3 U B 205 15.031 -15.718 -8.029 1.00 0.00 N ATOM 149 C4 U B 205 14.211 -14.928 -7.263 1.00 0.00 C ATOM 150 O4 U B 205 13.002 -14.971 -7.478 1.00 0.00 O ATOM 151 C5 U B 205 14.820 -14.111 -6.272 1.00 0.00 C ATOM 152 C6 U B 205 16.147 -14.167 -6.152 1.00 0.00 C ATOM 0 H5' U B 205 19.526 -14.390 -3.084 1.00 0.00 H new ATOM 0 H5'' U B 205 20.142 -12.783 -3.410 1.00 0.00 H new ATOM 0 H4' U B 205 20.909 -14.244 -5.174 1.00 0.00 H new ATOM 0 H3' U B 205 18.641 -12.350 -5.989 1.00 0.00 H new ATOM 0 H2' U B 205 18.498 -13.453 -8.259 1.00 0.00 H new ATOM 0 HO2' U B 205 21.070 -13.598 -7.573 1.00 0.00 H new ATOM 0 H1' U B 205 18.673 -15.968 -7.206 1.00 0.00 H new ATOM 0 H3 U B 205 14.603 -16.307 -8.743 1.00 0.00 H new ATOM 0 H5 U B 205 14.228 -13.467 -5.638 1.00 0.00 H new ATOM 0 H6 U B 205 16.620 -13.551 -5.402 1.00 0.00 H new ATOM 163 P A B 206 20.410 -10.556 -6.479 1.00 0.00 P ATOM 164 OP1 A B 206 21.676 -9.931 -6.039 1.00 0.00 O ATOM 165 OP2 A B 206 19.183 -10.218 -5.724 1.00 0.00 O ATOM 166 O5' A B 206 20.170 -10.162 -8.012 1.00 0.00 O ATOM 167 C5' A B 206 20.749 -10.951 -9.050 1.00 0.00 C ATOM 168 C4' A B 206 19.875 -10.909 -10.283 1.00 0.00 C ATOM 169 O4' A B 206 18.891 -11.603 -10.324 1.00 0.00 O ATOM 170 C3' A B 206 19.303 -9.531 -10.604 1.00 0.00 C ATOM 171 O3' A B 206 20.294 -8.751 -11.269 1.00 0.00 O ATOM 172 C2' A B 206 18.118 -9.791 -11.492 1.00 0.00 C ATOM 173 O2' A B 206 18.659 -9.634 -12.785 1.00 0.00 O ATOM 174 C1' A B 206 17.773 -11.224 -11.095 1.00 0.00 C ATOM 175 N9 A B 206 16.523 -11.334 -10.314 1.00 0.00 N ATOM 176 C8 A B 206 16.352 -11.080 -9.000 1.00 0.00 C ATOM 177 N7 A B 206 15.101 -11.275 -8.599 1.00 0.00 N ATOM 178 C5 A B 206 14.450 -11.677 -9.734 1.00 0.00 C ATOM 179 C6 A B 206 13.104 -12.034 -9.964 1.00 0.00 C ATOM 180 N6 A B 206 12.137 -12.042 -9.011 1.00 0.00 N ATOM 181 N1 A B 206 12.760 -12.395 -11.230 1.00 0.00 N ATOM 182 C2 A B 206 13.717 -12.391 -12.185 1.00 0.00 C ATOM 183 N3 A B 206 15.019 -12.071 -12.080 1.00 0.00 N ATOM 184 C4 A B 206 15.299 -11.720 -10.794 1.00 0.00 C ATOM 0 H5' A B 206 20.866 -11.981 -8.713 1.00 0.00 H new ATOM 0 H5'' A B 206 21.745 -10.578 -9.288 1.00 0.00 H new ATOM 0 H4' A B 206 20.626 -11.275 -10.983 1.00 0.00 H new ATOM 0 H3' A B 206 19.007 -8.975 -9.714 1.00 0.00 H new ATOM 0 H2' A B 206 17.223 -9.172 -11.430 1.00 0.00 H new ATOM 0 HO2' A B 206 17.944 -9.397 -13.412 1.00 0.00 H new ATOM 0 H1' A B 206 17.589 -11.858 -11.962 1.00 0.00 H new ATOM 0 H8 A B 206 17.146 -10.753 -8.345 1.00 0.00 H new ATOM 0 H61 A B 206 11.184 -12.313 -9.254 1.00 0.00 H new ATOM 0 H62 A B 206 12.364 -11.777 -8.052 1.00 0.00 H new ATOM 0 H2 A B 206 13.390 -12.686 -13.171 1.00 0.00 H new ATOM 196 P G B 207 20.501 -7.214 -10.872 1.00 0.00 P ATOM 197 OP1 G B 207 21.865 -6.782 -11.248 1.00 0.00 O ATOM 198 OP2 G B 207 20.079 -7.002 -9.469 1.00 0.00 O ATOM 199 O5' G B 207 19.461 -6.454 -11.821 1.00 0.00 O ATOM 200 C5' G B 207 19.312 -6.857 -13.181 1.00 0.00 C ATOM 201 C4' G B 207 17.845 -6.966 -13.532 1.00 0.00 C ATOM 202 O4' G B 207 16.945 -7.934 -13.077 1.00 0.00 O ATOM 203 C3' G B 207 16.994 -5.793 -13.057 1.00 0.00 C ATOM 204 O3' G B 207 17.448 -4.593 -13.681 1.00 0.00 O ATOM 205 C2' G B 207 15.587 -6.130 -13.468 1.00 0.00 C ATOM 206 O2' G B 207 15.557 -5.735 -14.821 1.00 0.00 O ATOM 207 C1' G B 207 15.575 -7.637 -13.224 1.00 0.00 C ATOM 208 N9 G B 207 14.809 -8.033 -12.023 1.00 0.00 N ATOM 209 C8 G B 207 15.202 -7.941 -10.735 1.00 0.00 C ATOM 210 N7 G B 207 14.280 -8.383 -9.886 1.00 0.00 N ATOM 211 C5 G B 207 13.248 -8.774 -10.695 1.00 0.00 C ATOM 212 C6 G B 207 11.984 -9.327 -10.397 1.00 0.00 C ATOM 213 O6 G B 207 11.562 -9.574 -9.269 1.00 0.00 O ATOM 214 N1 G B 207 11.163 -9.614 -11.445 1.00 0.00 N ATOM 215 C2 G B 207 11.601 -9.354 -12.698 1.00 0.00 C ATOM 216 N2 G B 207 10.689 -9.687 -13.607 1.00 0.00 N ATOM 217 N3 G B 207 12.777 -8.832 -13.094 1.00 0.00 N ATOM 218 C4 G B 207 13.548 -8.568 -12.004 1.00 0.00 C ATOM 0 H5' G B 207 19.804 -7.816 -13.340 1.00 0.00 H new ATOM 0 H5'' G B 207 19.799 -6.136 -13.838 1.00 0.00 H new ATOM 0 H4' G B 207 18.122 -7.144 -14.571 1.00 0.00 H new ATOM 0 H3' G B 207 17.056 -5.633 -11.981 1.00 0.00 H new ATOM 0 H2' G B 207 14.731 -5.674 -12.971 1.00 0.00 H new ATOM 0 HO2' G B 207 15.772 -4.781 -14.888 1.00 0.00 H new ATOM 0 H1' G B 207 15.083 -8.179 -14.031 1.00 0.00 H new ATOM 0 H8 G B 207 16.161 -7.551 -10.428 1.00 0.00 H new ATOM 0 H1 G B 207 10.239 -10.016 -11.289 1.00 0.00 H new ATOM 0 H21 G B 207 10.882 -9.546 -14.599 1.00 0.00 H new ATOM 0 H22 G B 207 9.796 -10.083 -13.312 1.00 0.00 H new ATOM 230 P C B 208 17.995 -3.384 -12.788 1.00 0.00 P ATOM 231 OP1 C B 208 19.408 -3.111 -13.129 1.00 0.00 O ATOM 232 OP2 C B 208 17.671 -3.629 -11.364 1.00 0.00 O ATOM 233 O5' C B 208 17.117 -2.143 -13.287 1.00 0.00 O ATOM 234 C5' C B 208 17.091 -1.798 -14.670 1.00 0.00 C ATOM 235 C4' C B 208 15.665 -1.761 -15.170 1.00 0.00 C ATOM 236 O4' C B 208 15.254 -2.839 -14.618 1.00 0.00 O ATOM 237 C3' C B 208 14.762 -0.782 -14.428 1.00 0.00 C ATOM 238 O3' C B 208 14.649 0.424 -15.182 1.00 0.00 O ATOM 239 C2' C B 208 13.436 -1.481 -14.302 1.00 0.00 C ATOM 240 O2' C B 208 12.751 -1.056 -15.460 1.00 0.00 O ATOM 241 C1' C B 208 13.883 -2.939 -14.303 1.00 0.00 C ATOM 242 N1 C B 208 13.682 -3.617 -13.005 1.00 0.00 N ATOM 243 C2 C B 208 12.568 -4.445 -12.872 1.00 0.00 C ATOM 244 O2 C B 208 11.807 -4.572 -13.839 1.00 0.00 O ATOM 245 N3 C B 208 12.363 -5.073 -11.701 1.00 0.00 N ATOM 246 C4 C B 208 13.185 -4.926 -10.682 1.00 0.00 C ATOM 247 N4 C B 208 12.966 -5.555 -9.533 1.00 0.00 N ATOM 248 C5 C B 208 14.347 -4.075 -10.792 1.00 0.00 C ATOM 249 C6 C B 208 14.538 -3.455 -11.966 1.00 0.00 C ATOM 0 H5' C B 208 17.667 -2.523 -15.244 1.00 0.00 H new ATOM 0 H5'' C B 208 17.562 -0.826 -14.819 1.00 0.00 H new ATOM 0 H4' C B 208 15.639 -1.568 -16.242 1.00 0.00 H new ATOM 0 H3' C B 208 15.150 -0.507 -13.447 1.00 0.00 H new ATOM 0 H2' C B 208 12.785 -1.301 -13.447 1.00 0.00 H new ATOM 0 HO2' C B 208 11.868 -0.711 -15.210 1.00 0.00 H new ATOM 0 H1' C B 208 13.305 -3.544 -15.001 1.00 0.00 H new ATOM 0 H41 C B 208 13.611 -5.431 -8.753 1.00 0.00 H new ATOM 0 H42 C B 208 12.152 -6.162 -9.431 1.00 0.00 H new ATOM 0 H5 C B 208 15.031 -3.944 -9.966 1.00 0.00 H new ATOM 0 H6 C B 208 15.396 -2.810 -12.087 1.00 0.00 H new ATOM 261 P G B 209 14.930 1.835 -14.483 1.00 0.00 P ATOM 262 OP1 G B 209 16.127 2.461 -15.088 1.00 0.00 O ATOM 263 OP2 G B 209 14.913 1.674 -13.012 1.00 0.00 O ATOM 264 O5' G B 209 13.653 2.704 -14.900 1.00 0.00 O ATOM 265 C5' G B 209 12.547 2.081 -15.549 1.00 0.00 C ATOM 266 C4' G B 209 11.572 1.554 -14.521 1.00 0.00 C ATOM 267 O4' G B 209 11.436 0.458 -13.817 1.00 0.00 O ATOM 268 C3' G B 209 11.120 2.587 -13.492 1.00 0.00 C ATOM 269 O3' G B 209 10.590 3.727 -14.167 1.00 0.00 O ATOM 270 C2' G B 209 10.069 1.895 -12.670 1.00 0.00 C ATOM 271 O2' G B 209 8.893 2.119 -13.415 1.00 0.00 O ATOM 272 C1' G B 209 10.592 0.462 -12.687 1.00 0.00 C ATOM 273 N9 G B 209 11.336 0.091 -11.465 1.00 0.00 N ATOM 274 C8 G B 209 12.542 0.548 -11.069 1.00 0.00 C ATOM 275 N7 G B 209 12.940 0.018 -9.917 1.00 0.00 N ATOM 276 C5 G B 209 11.915 -0.823 -9.572 1.00 0.00 C ATOM 277 C6 G B 209 11.736 -1.672 -8.459 1.00 0.00 C ATOM 278 O6 G B 209 12.535 -1.811 -7.534 1.00 0.00 O ATOM 279 N1 G B 209 10.586 -2.396 -8.402 1.00 0.00 N ATOM 280 C2 G B 209 9.689 -2.263 -9.405 1.00 0.00 C ATOM 281 N2 G B 209 8.622 -3.033 -9.205 1.00 0.00 N ATOM 282 N3 G B 209 9.755 -1.490 -10.506 1.00 0.00 N ATOM 283 C4 G B 209 10.926 -0.794 -10.503 1.00 0.00 C ATOM 0 H5' G B 209 12.898 1.265 -16.180 1.00 0.00 H new ATOM 0 H5'' G B 209 12.048 2.797 -16.202 1.00 0.00 H new ATOM 0 H4' G B 209 11.138 1.220 -15.463 1.00 0.00 H new ATOM 0 H3' G B 209 11.934 2.943 -12.861 1.00 0.00 H new ATOM 0 H2' G B 209 9.872 2.198 -11.642 1.00 0.00 H new ATOM 0 HO2' G B 209 9.040 2.856 -14.044 1.00 0.00 H new ATOM 0 H1' G B 209 9.784 -0.268 -12.726 1.00 0.00 H new ATOM 0 H8 G B 209 13.122 1.267 -11.628 1.00 0.00 H new ATOM 0 H1 G B 209 10.404 -3.025 -7.620 1.00 0.00 H new ATOM 0 H21 G B 209 7.860 -3.035 -9.883 1.00 0.00 H new ATOM 0 H22 G B 209 8.566 -3.621 -8.373 1.00 0.00 H new ATOM 295 P G B 210 11.387 5.114 -14.140 1.00 0.00 P ATOM 296 OP1 G B 210 11.680 5.547 -15.524 1.00 0.00 O ATOM 297 OP2 G B 210 12.526 5.017 -13.199 1.00 0.00 O ATOM 298 O5' G B 210 10.319 6.131 -13.519 1.00 0.00 O ATOM 299 C5' G B 210 10.184 6.246 -12.104 1.00 0.00 C ATOM 300 C4' G B 210 8.722 6.221 -11.717 1.00 0.00 C ATOM 301 O4' G B 210 8.553 6.827 -10.849 1.00 0.00 O ATOM 302 C3' G B 210 7.773 6.707 -12.809 1.00 0.00 C ATOM 303 O3' G B 210 6.823 5.685 -13.101 1.00 0.00 O ATOM 304 C2' G B 210 7.110 7.932 -12.242 1.00 0.00 C ATOM 305 O2' G B 210 5.740 7.606 -12.321 1.00 0.00 O ATOM 306 C1' G B 210 7.699 7.948 -10.834 1.00 0.00 C ATOM 307 N9 G B 210 8.445 9.184 -10.522 1.00 0.00 N ATOM 308 C8 G B 210 9.585 9.622 -11.098 1.00 0.00 C ATOM 309 N7 G B 210 10.005 10.775 -10.590 1.00 0.00 N ATOM 310 C5 G B 210 9.069 11.077 -9.638 1.00 0.00 C ATOM 311 C6 G B 210 8.953 12.171 -8.754 1.00 0.00 C ATOM 312 O6 G B 210 9.738 13.116 -8.682 1.00 0.00 O ATOM 313 N1 G B 210 7.886 12.182 -7.909 1.00 0.00 N ATOM 314 C2 G B 210 7.008 11.156 -7.965 1.00 0.00 C ATOM 315 N2 G B 210 6.025 11.313 -7.081 1.00 0.00 N ATOM 316 N3 G B 210 7.019 10.072 -8.761 1.00 0.00 N ATOM 317 C4 G B 210 8.107 10.119 -9.579 1.00 0.00 C ATOM 0 H5' G B 210 10.643 7.173 -11.761 1.00 0.00 H new ATOM 0 H5'' G B 210 10.712 5.429 -11.613 1.00 0.00 H new ATOM 0 H4' G B 210 8.504 5.170 -11.528 1.00 0.00 H new ATOM 0 H3' G B 210 8.284 6.939 -13.743 1.00 0.00 H new ATOM 0 H2' G B 210 7.247 8.910 -12.704 1.00 0.00 H new ATOM 0 HO2' G B 210 5.206 8.349 -11.970 1.00 0.00 H new ATOM 0 H1' G B 210 6.927 7.915 -10.065 1.00 0.00 H new ATOM 0 H8 G B 210 10.099 9.092 -11.886 1.00 0.00 H new ATOM 0 H1 G B 210 7.752 12.947 -7.248 1.00 0.00 H new ATOM 0 H21 G B 210 5.286 10.613 -7.010 1.00 0.00 H new ATOM 0 H22 G B 210 6.010 12.133 -6.475 1.00 0.00 H new ATOM 329 P A B 211 6.025 4.971 -11.912 1.00 0.00 P ATOM 330 OP1 A B 211 4.573 5.004 -12.197 1.00 0.00 O ATOM 331 OP2 A B 211 6.479 5.512 -10.612 1.00 0.00 O ATOM 332 O5' A B 211 6.514 3.451 -12.013 1.00 0.00 O ATOM 333 C5' A B 211 7.195 2.847 -10.915 1.00 0.00 C ATOM 334 C4' A B 211 6.255 1.939 -10.155 1.00 0.00 C ATOM 335 O4' A B 211 5.944 2.792 -9.103 1.00 0.00 O ATOM 336 C3' A B 211 4.929 1.673 -10.861 1.00 0.00 C ATOM 337 O3' A B 211 4.627 0.281 -10.794 1.00 0.00 O ATOM 338 C2' A B 211 3.911 2.494 -10.118 1.00 0.00 C ATOM 339 O2' A B 211 2.765 1.674 -10.151 1.00 0.00 O ATOM 340 C1' A B 211 4.588 2.619 -8.755 1.00 0.00 C ATOM 341 N9 A B 211 4.094 3.758 -7.954 1.00 0.00 N ATOM 342 C8 A B 211 4.263 5.073 -8.208 1.00 0.00 C ATOM 343 N7 A B 211 3.694 5.850 -7.292 1.00 0.00 N ATOM 344 C5 A B 211 3.134 4.963 -6.411 1.00 0.00 C ATOM 345 C6 A B 211 2.392 5.163 -5.227 1.00 0.00 C ATOM 346 N6 A B 211 2.078 6.379 -4.713 1.00 0.00 N ATOM 347 N1 A B 211 1.966 4.055 -4.562 1.00 0.00 N ATOM 348 C2 A B 211 2.274 2.840 -5.067 1.00 0.00 C ATOM 349 N3 A B 211 2.969 2.535 -6.178 1.00 0.00 N ATOM 350 C4 A B 211 3.365 3.681 -6.796 1.00 0.00 C ATOM 0 H5' A B 211 7.585 3.618 -10.250 1.00 0.00 H new ATOM 0 H5'' A B 211 8.050 2.277 -11.277 1.00 0.00 H new ATOM 0 H4' A B 211 6.698 0.962 -9.959 1.00 0.00 H new ATOM 0 H3' A B 211 4.949 1.942 -11.917 1.00 0.00 H new ATOM 0 H2' A B 211 3.621 3.483 -10.473 1.00 0.00 H new ATOM 0 HO2' A B 211 2.715 1.149 -9.325 1.00 0.00 H new ATOM 0 H1' A B 211 4.393 1.755 -8.120 1.00 0.00 H new ATOM 0 H8 A B 211 4.802 5.453 -9.063 1.00 0.00 H new ATOM 0 H61 A B 211 1.537 6.444 -3.851 1.00 0.00 H new ATOM 0 H62 A B 211 2.383 7.228 -5.189 1.00 0.00 H new ATOM 0 H2 A B 211 1.912 1.996 -4.499 1.00 0.00 H new ATOM 362 P G B 212 4.524 -0.448 -9.373 1.00 0.00 P ATOM 363 OP1 G B 212 3.259 -0.065 -8.707 1.00 0.00 O ATOM 364 OP2 G B 212 5.781 -0.248 -8.618 1.00 0.00 O ATOM 365 O5' G B 212 4.425 -1.995 -9.769 1.00 0.00 O ATOM 366 C5' G B 212 4.005 -2.954 -8.800 1.00 0.00 C ATOM 367 C4' G B 212 5.209 -3.560 -8.113 1.00 0.00 C ATOM 368 O4' G B 212 5.754 -2.598 -7.896 1.00 0.00 O ATOM 369 C3' G B 212 4.912 -4.173 -6.748 1.00 0.00 C ATOM 370 O3' G B 212 5.121 -5.581 -6.805 1.00 0.00 O ATOM 371 C2' G B 212 5.872 -3.510 -5.798 1.00 0.00 C ATOM 372 O2' G B 212 6.692 -4.581 -5.389 1.00 0.00 O ATOM 373 C1' G B 212 6.533 -2.494 -6.726 1.00 0.00 C ATOM 374 N9 G B 212 6.521 -1.115 -6.195 1.00 0.00 N ATOM 375 C8 G B 212 5.441 -0.375 -5.864 1.00 0.00 C ATOM 376 N7 G B 212 5.767 0.833 -5.414 1.00 0.00 N ATOM 377 C5 G B 212 7.135 0.846 -5.466 1.00 0.00 C ATOM 378 C6 G B 212 8.075 1.840 -5.123 1.00 0.00 C ATOM 379 O6 G B 212 7.803 2.956 -4.682 1.00 0.00 O ATOM 380 N1 G B 212 9.392 1.543 -5.292 1.00 0.00 N ATOM 381 C2 G B 212 9.721 0.324 -5.774 1.00 0.00 C ATOM 382 N2 G B 212 11.041 0.187 -5.882 1.00 0.00 N ATOM 383 N3 G B 212 8.916 -0.694 -6.132 1.00 0.00 N ATOM 384 C4 G B 212 7.616 -0.334 -5.940 1.00 0.00 C ATOM 0 H5' G B 212 3.419 -3.737 -9.282 1.00 0.00 H new ATOM 0 H5'' G B 212 3.357 -2.479 -8.063 1.00 0.00 H new ATOM 0 H4' G B 212 5.678 -4.350 -8.700 1.00 0.00 H new ATOM 0 H3' G B 212 3.881 -4.019 -6.429 1.00 0.00 H new ATOM 0 H2' G B 212 5.516 -3.004 -4.901 1.00 0.00 H new ATOM 0 HO2' G B 212 7.366 -4.254 -4.757 1.00 0.00 H new ATOM 0 H1' G B 212 7.593 -2.701 -6.872 1.00 0.00 H new ATOM 0 H8 G B 212 4.424 -0.726 -5.955 1.00 0.00 H new ATOM 0 H1 G B 212 10.114 2.225 -5.060 1.00 0.00 H new ATOM 0 H21 G B 212 11.436 -0.685 -6.234 1.00 0.00 H new ATOM 0 H22 G B 212 11.657 0.954 -5.613 1.00 0.00 H new ATOM 396 P G B 213 4.020 -6.578 -6.209 1.00 0.00 P ATOM 397 OP1 G B 213 3.025 -5.812 -5.427 1.00 0.00 O ATOM 398 OP2 G B 213 4.689 -7.714 -5.535 1.00 0.00 O ATOM 399 O5' G B 213 3.295 -7.139 -7.520 1.00 0.00 O ATOM 400 C5' G B 213 2.490 -6.272 -8.315 1.00 0.00 C ATOM 401 C4' G B 213 2.850 -6.422 -9.775 1.00 0.00 C ATOM 402 O4' G B 213 3.664 -5.659 -10.335 1.00 0.00 O ATOM 403 C3' G B 213 3.279 -7.829 -10.179 1.00 0.00 C ATOM 404 O3' G B 213 2.129 -8.587 -10.552 1.00 0.00 O ATOM 405 C2' G B 213 4.218 -7.643 -11.337 1.00 0.00 C ATOM 406 O2' G B 213 3.366 -7.778 -12.452 1.00 0.00 O ATOM 407 C1' G B 213 4.725 -6.229 -11.067 1.00 0.00 C ATOM 408 N9 G B 213 5.985 -6.193 -10.296 1.00 0.00 N ATOM 409 C8 G B 213 6.183 -6.608 -9.027 1.00 0.00 C ATOM 410 N7 G B 213 7.436 -6.439 -8.621 1.00 0.00 N ATOM 411 C5 G B 213 8.061 -5.883 -9.705 1.00 0.00 C ATOM 412 C6 G B 213 9.395 -5.471 -9.906 1.00 0.00 C ATOM 413 O6 G B 213 10.297 -5.547 -9.073 1.00 0.00 O ATOM 414 N1 G B 213 9.712 -4.944 -11.120 1.00 0.00 N ATOM 415 C2 G B 213 8.740 -4.848 -12.055 1.00 0.00 C ATOM 416 N2 G B 213 9.205 -4.315 -13.183 1.00 0.00 N ATOM 417 N3 G B 213 7.446 -5.206 -11.974 1.00 0.00 N ATOM 418 C4 G B 213 7.194 -5.723 -10.739 1.00 0.00 C ATOM 0 H5' G B 213 2.636 -5.238 -8.001 1.00 0.00 H new ATOM 0 H5'' G B 213 1.435 -6.505 -8.167 1.00 0.00 H new ATOM 0 H4' G B 213 1.865 -6.122 -10.133 1.00 0.00 H new ATOM 0 H3' G B 213 3.767 -8.372 -9.370 1.00 0.00 H new ATOM 0 H2' G B 213 5.066 -8.311 -11.485 1.00 0.00 H new ATOM 0 HO2' G B 213 3.782 -8.371 -13.112 1.00 0.00 H new ATOM 0 H1' G B 213 4.972 -5.699 -11.987 1.00 0.00 H new ATOM 0 H8 G B 213 5.406 -7.032 -8.408 1.00 0.00 H new ATOM 0 H1 G B 213 10.661 -4.629 -11.320 1.00 0.00 H new ATOM 0 H21 G B 213 8.581 -4.181 -13.979 1.00 0.00 H new ATOM 0 H22 G B 213 10.185 -4.040 -13.251 1.00 0.00 H new ATOM 430 P C B 214 1.920 -10.064 -9.974 1.00 0.00 P ATOM 431 OP1 C B 214 0.479 -10.402 -9.979 1.00 0.00 O ATOM 432 OP2 C B 214 2.651 -10.206 -8.695 1.00 0.00 O ATOM 433 O5' C B 214 2.648 -10.983 -11.064 1.00 0.00 O ATOM 434 C5' C B 214 2.139 -11.048 -12.394 1.00 0.00 C ATOM 435 C4' C B 214 3.277 -11.002 -13.388 1.00 0.00 C ATOM 436 O4' C B 214 4.222 -9.966 -13.406 1.00 0.00 O ATOM 437 C3' C B 214 4.224 -12.196 -13.320 1.00 0.00 C ATOM 438 O3' C B 214 3.598 -13.332 -13.914 1.00 0.00 O ATOM 439 C2' C B 214 5.449 -11.778 -14.085 1.00 0.00 C ATOM 440 O2' C B 214 5.064 -11.989 -15.425 1.00 0.00 O ATOM 441 C1' C B 214 5.564 -10.317 -13.659 1.00 0.00 C ATOM 442 N1 C B 214 6.403 -10.118 -12.460 1.00 0.00 N ATOM 443 C2 C B 214 7.670 -9.562 -12.639 1.00 0.00 C ATOM 444 O2 C B 214 8.027 -9.265 -13.784 1.00 0.00 O ATOM 445 N3 C B 214 8.452 -9.371 -11.562 1.00 0.00 N ATOM 446 C4 C B 214 8.054 -9.695 -10.348 1.00 0.00 C ATOM 447 N4 C B 214 8.841 -9.498 -9.298 1.00 0.00 N ATOM 448 C5 C B 214 6.747 -10.272 -10.135 1.00 0.00 C ATOM 449 C6 C B 214 5.979 -10.456 -11.218 1.00 0.00 C ATOM 0 H5' C B 214 1.457 -10.217 -12.572 1.00 0.00 H new ATOM 0 H5'' C B 214 1.566 -11.965 -12.528 1.00 0.00 H new ATOM 0 H4' C B 214 2.606 -10.910 -14.242 1.00 0.00 H new ATOM 0 H3' C B 214 4.482 -12.475 -12.298 1.00 0.00 H new ATOM 0 H2' C B 214 6.405 -12.278 -13.932 1.00 0.00 H new ATOM 0 HO2' C B 214 4.143 -12.323 -15.452 1.00 0.00 H new ATOM 0 H1' C B 214 6.053 -9.706 -14.418 1.00 0.00 H new ATOM 0 H41 C B 214 8.519 -9.754 -8.364 1.00 0.00 H new ATOM 0 H42 C B 214 9.768 -9.091 -9.424 1.00 0.00 H new ATOM 0 H5 C B 214 6.404 -10.543 -9.147 1.00 0.00 H new ATOM 0 H6 C B 214 4.995 -10.885 -11.098 1.00 0.00 H new ATOM 461 P U B 215 3.795 -14.783 -13.270 1.00 0.00 P ATOM 462 OP1 U B 215 2.678 -15.664 -13.677 1.00 0.00 O ATOM 463 OP2 U B 215 4.067 -14.652 -11.821 1.00 0.00 O ATOM 464 O5' U B 215 5.128 -15.313 -13.979 1.00 0.00 O ATOM 465 C5' U B 215 5.369 -15.021 -15.353 1.00 0.00 C ATOM 466 C4' U B 215 6.836 -14.726 -15.572 1.00 0.00 C ATOM 467 O4' U B 215 7.569 -13.857 -15.603 1.00 0.00 O ATOM 468 C3' U B 215 7.723 -15.964 -15.656 1.00 0.00 C ATOM 469 O3' U B 215 7.804 -16.399 -17.012 1.00 0.00 O ATOM 470 C2' U B 215 9.064 -15.528 -15.136 1.00 0.00 C ATOM 471 O2' U B 215 9.950 -16.006 -16.123 1.00 0.00 O ATOM 472 C1' U B 215 8.877 -14.014 -15.099 1.00 0.00 C ATOM 473 N1 U B 215 9.001 -13.436 -13.745 1.00 0.00 N ATOM 474 C2 U B 215 10.144 -12.742 -13.488 1.00 0.00 C ATOM 475 O2 U B 215 11.038 -12.584 -14.304 1.00 0.00 O ATOM 476 N3 U B 215 10.262 -12.203 -12.227 1.00 0.00 N ATOM 477 C4 U B 215 9.305 -12.334 -11.252 1.00 0.00 C ATOM 478 O4 U B 215 9.518 -11.810 -10.160 1.00 0.00 O ATOM 479 C5 U B 215 8.133 -13.069 -11.573 1.00 0.00 C ATOM 480 C6 U B 215 8.039 -13.583 -12.802 1.00 0.00 C ATOM 0 H5' U B 215 4.768 -14.166 -15.662 1.00 0.00 H new ATOM 0 H5'' U B 215 5.064 -15.865 -15.971 1.00 0.00 H new ATOM 0 H4' U B 215 6.057 -13.988 -15.762 1.00 0.00 H new ATOM 0 H3' U B 215 7.336 -16.803 -15.077 1.00 0.00 H new ATOM 0 H2' U B 215 9.430 -15.872 -14.168 1.00 0.00 H new ATOM 0 HO2' U B 215 10.195 -16.933 -15.921 1.00 0.00 H new ATOM 0 H1' U B 215 9.645 -13.492 -15.669 1.00 0.00 H new ATOM 0 H3 U B 215 11.107 -11.677 -12.005 1.00 0.00 H new ATOM 0 H5 U B 215 7.345 -13.208 -10.848 1.00 0.00 H new ATOM 0 H6 U B 215 7.152 -14.144 -13.057 1.00 0.00 H new ATOM 491 P A B 216 7.950 -17.957 -17.345 1.00 0.00 P ATOM 492 OP1 A B 216 7.788 -18.172 -18.799 1.00 0.00 O ATOM 493 OP2 A B 216 7.087 -18.744 -16.437 1.00 0.00 O ATOM 494 O5' A B 216 9.474 -18.263 -16.967 1.00 0.00 O ATOM 495 C5' A B 216 10.501 -18.079 -17.939 1.00 0.00 C ATOM 496 C4' A B 216 11.860 -18.231 -17.295 1.00 0.00 C ATOM 497 O4' A B 216 11.854 -17.454 -16.238 1.00 0.00 O ATOM 498 C3' A B 216 12.058 -19.544 -16.542 1.00 0.00 C ATOM 499 O3' A B 216 12.539 -20.539 -17.443 1.00 0.00 O ATOM 500 C2' A B 216 13.066 -19.238 -15.470 1.00 0.00 C ATOM 501 O2' A B 216 14.293 -19.507 -16.112 1.00 0.00 O ATOM 502 C1' A B 216 12.770 -17.765 -15.212 1.00 0.00 C ATOM 503 N9 A B 216 12.188 -17.504 -13.879 1.00 0.00 N ATOM 504 C8 A B 216 10.900 -17.653 -13.504 1.00 0.00 C ATOM 505 N7 A B 216 10.697 -17.334 -12.230 1.00 0.00 N ATOM 506 C5 A B 216 11.936 -16.962 -11.783 1.00 0.00 C ATOM 507 C6 A B 216 12.380 -16.519 -10.518 1.00 0.00 C ATOM 508 N6 A B 216 11.580 -16.371 -9.431 1.00 0.00 N ATOM 509 N1 A B 216 13.701 -16.220 -10.387 1.00 0.00 N ATOM 510 C2 A B 216 14.505 -16.364 -11.466 1.00 0.00 C ATOM 511 N3 A B 216 14.192 -16.777 -12.708 1.00 0.00 N ATOM 512 C4 A B 216 12.862 -17.058 -12.773 1.00 0.00 C ATOM 0 H5' A B 216 10.412 -17.091 -18.390 1.00 0.00 H new ATOM 0 H5'' A B 216 10.387 -18.807 -18.742 1.00 0.00 H new ATOM 0 H4' A B 216 12.576 -18.076 -18.102 1.00 0.00 H new ATOM 0 H3' A B 216 11.135 -19.929 -16.109 1.00 0.00 H new ATOM 0 H2' A B 216 13.061 -19.780 -14.524 1.00 0.00 H new ATOM 0 HO2' A B 216 14.902 -19.947 -15.483 1.00 0.00 H new ATOM 0 H1' A B 216 13.675 -17.158 -15.218 1.00 0.00 H new ATOM 0 H8 A B 216 10.119 -17.994 -14.167 1.00 0.00 H new ATOM 0 H61 A B 216 11.974 -16.045 -8.548 1.00 0.00 H new ATOM 0 H62 A B 216 10.585 -16.585 -9.497 1.00 0.00 H new ATOM 0 H2 A B 216 15.543 -16.112 -11.308 1.00 0.00 H new ATOM 524 P G B 217 11.940 -22.022 -17.390 1.00 0.00 P ATOM 525 OP1 G B 217 11.939 -22.609 -18.749 1.00 0.00 O ATOM 526 OP2 G B 217 10.660 -22.017 -16.646 1.00 0.00 O ATOM 527 O5' G B 217 13.019 -22.813 -16.512 1.00 0.00 O ATOM 528 C5' G B 217 14.388 -22.413 -16.533 1.00 0.00 C ATOM 529 C4' G B 217 14.896 -22.228 -15.122 1.00 0.00 C ATOM 530 O4' G B 217 14.568 -21.243 -14.322 1.00 0.00 O ATOM 531 C3' G B 217 14.551 -23.370 -14.171 1.00 0.00 C ATOM 532 O3' G B 217 15.235 -24.553 -14.582 1.00 0.00 O ATOM 533 C2' G B 217 15.009 -22.911 -12.816 1.00 0.00 C ATOM 534 O2' G B 217 16.351 -23.340 -12.780 1.00 0.00 O ATOM 535 C1' G B 217 14.806 -21.404 -12.942 1.00 0.00 C ATOM 536 N9 G B 217 13.673 -20.892 -12.142 1.00 0.00 N ATOM 537 C8 G B 217 12.359 -20.965 -12.443 1.00 0.00 C ATOM 538 N7 G B 217 11.589 -20.408 -11.513 1.00 0.00 N ATOM 539 C5 G B 217 12.479 -19.961 -10.574 1.00 0.00 C ATOM 540 C6 G B 217 12.286 -19.284 -9.350 1.00 0.00 C ATOM 541 O6 G B 217 11.197 -18.956 -8.882 1.00 0.00 O ATOM 542 N1 G B 217 13.395 -18.970 -8.628 1.00 0.00 N ATOM 543 C2 G B 217 14.606 -19.318 -9.118 1.00 0.00 C ATOM 544 N2 G B 217 15.586 -18.943 -8.300 1.00 0.00 N ATOM 545 N3 G B 217 14.905 -19.960 -10.264 1.00 0.00 N ATOM 546 C4 G B 217 13.757 -20.245 -10.938 1.00 0.00 C ATOM 0 H5' G B 217 14.495 -21.483 -17.091 1.00 0.00 H new ATOM 0 H5'' G B 217 14.987 -23.164 -17.048 1.00 0.00 H new ATOM 0 H4' G B 217 15.909 -22.079 -15.496 1.00 0.00 H new ATOM 0 H3' G B 217 13.487 -23.607 -14.161 1.00 0.00 H new ATOM 0 H2' G B 217 14.522 -23.268 -11.908 1.00 0.00 H new ATOM 0 HO2' G B 217 16.489 -23.917 -12.000 1.00 0.00 H new ATOM 0 H1' G B 217 15.660 -20.843 -12.564 1.00 0.00 H new ATOM 0 H8 G B 217 11.975 -21.426 -13.341 1.00 0.00 H new ATOM 0 H1 G B 217 13.315 -18.482 -7.736 1.00 0.00 H new ATOM 0 H21 G B 217 16.557 -19.141 -8.543 1.00 0.00 H new ATOM 0 H22 G B 217 15.367 -18.458 -7.430 1.00 0.00 H new ATOM 558 P U B 218 14.466 -25.955 -14.605 1.00 0.00 P ATOM 559 OP1 U B 218 15.116 -26.865 -15.573 1.00 0.00 O ATOM 560 OP2 U B 218 13.012 -25.724 -14.756 1.00 0.00 O ATOM 561 O5' U B 218 14.724 -26.530 -13.134 1.00 0.00 O ATOM 562 C5' U B 218 16.046 -26.548 -12.597 1.00 0.00 C ATOM 563 C4' U B 218 16.005 -26.292 -11.108 1.00 0.00 C ATOM 564 O4' U B 218 15.711 -25.048 -10.564 1.00 0.00 O ATOM 565 C3' U B 218 14.919 -27.066 -10.365 1.00 0.00 C ATOM 566 O3' U B 218 15.252 -28.453 -10.348 1.00 0.00 O ATOM 567 C2' U B 218 14.897 -26.486 -8.978 1.00 0.00 C ATOM 568 O2' U B 218 15.974 -27.144 -8.351 1.00 0.00 O ATOM 569 C1' U B 218 15.119 -25.008 -9.285 1.00 0.00 C ATOM 570 N1 U B 218 13.873 -24.214 -9.297 1.00 0.00 N ATOM 571 C2 U B 218 13.638 -23.442 -8.200 1.00 0.00 C ATOM 572 O2 U B 218 14.391 -23.383 -7.242 1.00 0.00 O ATOM 573 N3 U B 218 12.477 -22.702 -8.210 1.00 0.00 N ATOM 574 C4 U B 218 11.579 -22.712 -9.246 1.00 0.00 C ATOM 575 O4 U B 218 10.573 -22.010 -9.147 1.00 0.00 O ATOM 576 C5 U B 218 11.872 -23.535 -10.366 1.00 0.00 C ATOM 577 C6 U B 218 13.002 -24.245 -10.336 1.00 0.00 C ATOM 0 H5' U B 218 16.657 -25.790 -13.088 1.00 0.00 H new ATOM 0 H5'' U B 218 16.514 -27.512 -12.795 1.00 0.00 H new ATOM 0 H4' U B 218 17.057 -26.549 -10.983 1.00 0.00 H new ATOM 0 H3' U B 218 13.940 -26.982 -10.836 1.00 0.00 H new ATOM 0 H2' U B 218 14.023 -26.596 -8.336 1.00 0.00 H new ATOM 0 HO2' U B 218 16.424 -27.726 -8.999 1.00 0.00 H new ATOM 0 H1' U B 218 15.726 -24.518 -8.524 1.00 0.00 H new ATOM 0 H3 U B 218 12.274 -22.114 -7.402 1.00 0.00 H new ATOM 0 H5 U B 218 11.203 -23.585 -11.213 1.00 0.00 H new ATOM 0 H6 U B 218 13.234 -24.876 -11.181 1.00 0.00 H new ATOM 588 P C B 219 14.119 -29.551 -10.612 1.00 0.00 P ATOM 589 OP1 C B 219 14.713 -30.730 -11.280 1.00 0.00 O ATOM 590 OP2 C B 219 12.951 -28.915 -11.262 1.00 0.00 O ATOM 591 O5' C B 219 13.686 -29.984 -9.134 1.00 0.00 O ATOM 592 C5' C B 219 14.650 -29.997 -8.084 1.00 0.00 C ATOM 593 C4' C B 219 14.004 -29.587 -6.780 1.00 0.00 C ATOM 594 O4' C B 219 13.875 -28.366 -6.315 1.00 0.00 O ATOM 595 C3' C B 219 12.631 -30.205 -6.535 1.00 0.00 C ATOM 596 O3' C B 219 12.788 -31.565 -6.130 1.00 0.00 O ATOM 597 C2' C B 219 12.010 -29.376 -5.447 1.00 0.00 C ATOM 598 O2' C B 219 12.459 -30.015 -4.273 1.00 0.00 O ATOM 599 C1' C B 219 12.639 -28.015 -5.733 1.00 0.00 C ATOM 600 N1 C B 219 11.838 -27.176 -6.648 1.00 0.00 N ATOM 601 C2 C B 219 11.150 -26.094 -6.100 1.00 0.00 C ATOM 602 O2 C B 219 11.241 -25.889 -4.885 1.00 0.00 O ATOM 603 N3 C B 219 10.414 -25.315 -6.913 1.00 0.00 N ATOM 604 C4 C B 219 10.327 -25.548 -8.208 1.00 0.00 C ATOM 605 N4 C B 219 9.595 -24.768 -8.993 1.00 0.00 N ATOM 606 C5 C B 219 11.030 -26.662 -8.801 1.00 0.00 C ATOM 607 C6 C B 219 11.760 -27.430 -7.978 1.00 0.00 C ATOM 0 H5' C B 219 15.468 -29.318 -8.323 1.00 0.00 H new ATOM 0 H5'' C B 219 15.081 -30.994 -7.988 1.00 0.00 H new ATOM 0 H4' C B 219 14.874 -29.974 -6.250 1.00 0.00 H new ATOM 0 H3' C B 219 12.003 -30.210 -7.426 1.00 0.00 H new ATOM 0 H2' C B 219 10.928 -29.269 -5.372 1.00 0.00 H new ATOM 0 HO2' C B 219 13.169 -30.652 -4.498 1.00 0.00 H new ATOM 0 H1' C B 219 12.722 -27.405 -4.833 1.00 0.00 H new ATOM 0 H41 C B 219 9.537 -24.961 -9.993 1.00 0.00 H new ATOM 0 H42 C B 219 9.090 -23.976 -8.596 1.00 0.00 H new ATOM 0 H5 C B 219 10.971 -26.867 -9.860 1.00 0.00 H new ATOM 0 H6 C B 219 12.300 -28.272 -8.385 1.00 0.00 H new ATOM 619 P C B 220 11.911 -32.711 -6.820 1.00 0.00 P ATOM 620 OP1 C B 220 12.725 -33.938 -6.972 1.00 0.00 O ATOM 621 OP2 C B 220 11.252 -32.174 -8.031 1.00 0.00 O ATOM 622 O5' C B 220 10.778 -33.002 -5.728 1.00 0.00 O ATOM 623 C5' C B 220 11.068 -32.845 -4.340 1.00 0.00 C ATOM 624 C4' C B 220 9.865 -32.283 -3.619 1.00 0.00 C ATOM 625 O4' C B 220 9.207 -31.248 -3.047 1.00 0.00 O ATOM 626 C3' C B 220 8.665 -33.225 -3.563 1.00 0.00 C ATOM 627 O3' C B 220 8.481 -33.679 -2.213 1.00 0.00 O ATOM 628 C2' C B 220 7.496 -32.407 -4.036 1.00 0.00 C ATOM 629 O2' C B 220 6.427 -32.928 -3.278 1.00 0.00 O ATOM 630 C1' C B 220 7.954 -31.005 -3.646 1.00 0.00 C ATOM 631 N1 C B 220 8.081 -30.085 -4.796 1.00 0.00 N ATOM 632 C2 C B 220 7.397 -28.873 -4.736 1.00 0.00 C ATOM 633 O2 C B 220 6.721 -28.624 -3.731 1.00 0.00 O ATOM 634 N3 C B 220 7.497 -28.020 -5.771 1.00 0.00 N ATOM 635 C4 C B 220 8.223 -28.300 -6.834 1.00 0.00 C ATOM 636 N4 C B 220 8.309 -27.446 -7.845 1.00 0.00 N ATOM 637 C5 C B 220 8.942 -29.550 -6.922 1.00 0.00 C ATOM 638 C6 C B 220 8.832 -30.390 -5.883 1.00 0.00 C ATOM 0 H5' C B 220 11.922 -32.180 -4.212 1.00 0.00 H new ATOM 0 H5'' C B 220 11.345 -33.806 -3.907 1.00 0.00 H new ATOM 0 H4' C B 220 10.851 -31.819 -3.582 1.00 0.00 H new ATOM 0 H3' C B 220 8.791 -34.113 -4.182 1.00 0.00 H new ATOM 0 H2' C B 220 7.194 -32.412 -5.083 1.00 0.00 H new ATOM 0 HO2' C B 220 6.736 -33.124 -2.369 1.00 0.00 H new ATOM 0 HO3' C B 220 8.636 -32.935 -1.594 1.00 0.00 H new ATOM 0 H1' C B 220 7.235 -30.505 -2.997 1.00 0.00 H new ATOM 0 H41 C B 220 8.875 -27.677 -8.661 1.00 0.00 H new ATOM 0 H42 C B 220 7.809 -26.558 -7.806 1.00 0.00 H new ATOM 0 H5 C B 220 9.541 -29.797 -7.786 1.00 0.00 H new ATOM 0 H6 C B 220 9.355 -31.334 -5.913 1.00 0.00 H new TER 650 C B 220 ATOM 651 N MET A 1 5.473 -15.312 2.644 1.00 0.00 N ATOM 652 CA MET A 1 4.271 -14.606 2.235 1.00 0.00 C ATOM 653 C MET A 1 4.220 -13.206 2.851 1.00 0.00 C ATOM 654 O MET A 1 5.154 -12.792 3.537 1.00 0.00 O ATOM 655 CB MET A 1 3.038 -15.400 2.672 1.00 0.00 C ATOM 656 CG MET A 1 2.729 -16.523 1.680 1.00 0.00 C ATOM 657 SD MET A 1 0.963 -16.689 1.477 1.00 0.00 S ATOM 658 CE MET A 1 0.616 -17.886 2.757 1.00 0.00 C ATOM 0 H1 MET A 1 6.009 -15.603 1.801 1.00 0.00 H new ATOM 0 H2 MET A 1 6.062 -14.685 3.229 1.00 0.00 H new ATOM 0 H3 MET A 1 5.210 -16.154 3.195 1.00 0.00 H new ATOM 0 HA MET A 1 4.284 -14.505 1.150 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.205 -15.821 3.663 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.180 -14.732 2.750 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.195 -16.309 0.718 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.152 -17.462 2.037 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.452 -18.106 2.770 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.173 -18.802 2.559 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.915 -17.481 3.724 1.00 0.00 H new ATOM 668 N GLN A 2 3.121 -12.516 2.583 1.00 0.00 N ATOM 669 CA GLN A 2 2.937 -11.172 3.102 1.00 0.00 C ATOM 670 C GLN A 2 3.713 -10.164 2.252 1.00 0.00 C ATOM 671 O GLN A 2 4.477 -9.358 2.782 1.00 0.00 O ATOM 672 CB GLN A 2 3.356 -11.088 4.571 1.00 0.00 C ATOM 673 CG GLN A 2 2.353 -10.265 5.382 1.00 0.00 C ATOM 674 CD GLN A 2 2.890 -9.976 6.785 1.00 0.00 C ATOM 675 OE1 GLN A 2 2.952 -10.839 7.644 1.00 0.00 O ATOM 676 NE2 GLN A 2 3.271 -8.715 6.970 1.00 0.00 N ATOM 0 H GLN A 2 2.349 -12.863 2.013 1.00 0.00 H new ATOM 0 HA GLN A 2 1.877 -10.925 3.047 1.00 0.00 H new ATOM 0 HB2 GLN A 2 3.431 -12.092 4.989 1.00 0.00 H new ATOM 0 HB3 GLN A 2 4.346 -10.637 4.645 1.00 0.00 H new ATOM 0 HG2 GLN A 2 2.146 -9.327 4.867 1.00 0.00 H new ATOM 0 HG3 GLN A 2 1.408 -10.804 5.454 1.00 0.00 H new ATOM 0 HE21 GLN A 2 3.193 -8.042 6.208 1.00 0.00 H new ATOM 0 HE22 GLN A 2 3.642 -8.422 7.874 1.00 0.00 H new ATOM 685 N LYS A 3 3.492 -10.242 0.948 1.00 0.00 N ATOM 686 CA LYS A 3 4.161 -9.347 0.020 1.00 0.00 C ATOM 687 C LYS A 3 5.639 -9.731 -0.077 1.00 0.00 C ATOM 688 O LYS A 3 6.516 -8.924 0.225 1.00 0.00 O ATOM 689 CB LYS A 3 3.931 -7.889 0.421 1.00 0.00 C ATOM 690 CG LYS A 3 2.436 -7.583 0.544 1.00 0.00 C ATOM 691 CD LYS A 3 1.799 -7.404 -0.836 1.00 0.00 C ATOM 692 CE LYS A 3 0.498 -8.203 -0.947 1.00 0.00 C ATOM 693 NZ LYS A 3 0.790 -9.637 -1.167 1.00 0.00 N ATOM 0 H LYS A 3 2.858 -10.912 0.512 1.00 0.00 H new ATOM 0 HA LYS A 3 3.738 -9.450 -0.979 1.00 0.00 H new ATOM 0 HB2 LYS A 3 4.427 -7.687 1.371 1.00 0.00 H new ATOM 0 HB3 LYS A 3 4.381 -7.229 -0.320 1.00 0.00 H new ATOM 0 HG2 LYS A 3 1.938 -8.393 1.076 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.293 -6.678 1.135 1.00 0.00 H new ATOM 0 HD2 LYS A 3 1.597 -6.348 -1.013 1.00 0.00 H new ATOM 0 HD3 LYS A 3 2.497 -7.729 -1.608 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -0.090 -8.081 -0.037 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -0.104 -7.818 -1.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.101 -10.155 -1.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 1.390 -9.744 -2.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 1.287 -10.021 -0.338 1.00 0.00 H new ATOM 706 N GLY A 4 5.869 -10.966 -0.500 1.00 0.00 N ATOM 707 CA GLY A 4 7.225 -11.468 -0.641 1.00 0.00 C ATOM 708 C GLY A 4 8.032 -10.604 -1.612 1.00 0.00 C ATOM 709 O GLY A 4 9.253 -10.514 -1.501 1.00 0.00 O ATOM 0 H GLY A 4 5.139 -11.633 -0.749 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.715 -11.481 0.333 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.200 -12.497 -0.999 1.00 0.00 H new ATOM 713 N ASN A 5 7.315 -9.990 -2.543 1.00 0.00 N ATOM 714 CA ASN A 5 7.949 -9.136 -3.533 1.00 0.00 C ATOM 715 C ASN A 5 8.680 -7.994 -2.823 1.00 0.00 C ATOM 716 O ASN A 5 9.525 -7.328 -3.419 1.00 0.00 O ATOM 717 CB ASN A 5 6.912 -8.520 -4.473 1.00 0.00 C ATOM 718 CG ASN A 5 7.531 -8.194 -5.834 1.00 0.00 C ATOM 719 OD1 ASN A 5 7.671 -9.043 -6.701 1.00 0.00 O ATOM 720 ND2 ASN A 5 7.892 -6.922 -5.974 1.00 0.00 N ATOM 0 H ASN A 5 6.302 -10.067 -2.632 1.00 0.00 H new ATOM 0 HA ASN A 5 8.642 -9.747 -4.111 1.00 0.00 H new ATOM 0 HB2 ASN A 5 6.079 -9.211 -4.604 1.00 0.00 H new ATOM 0 HB3 ASN A 5 6.506 -7.612 -4.027 1.00 0.00 H new ATOM 0 HD21 ASN A 5 8.314 -6.605 -6.847 1.00 0.00 H new ATOM 0 HD22 ASN A 5 7.747 -6.263 -5.209 1.00 0.00 H new ATOM 727 N PHE A 6 8.328 -7.805 -1.560 1.00 0.00 N ATOM 728 CA PHE A 6 8.940 -6.755 -0.763 1.00 0.00 C ATOM 729 C PHE A 6 10.452 -6.960 -0.655 1.00 0.00 C ATOM 730 O PHE A 6 11.177 -6.053 -0.247 1.00 0.00 O ATOM 731 CB PHE A 6 8.325 -6.840 0.636 1.00 0.00 C ATOM 732 CG PHE A 6 9.060 -6.009 1.690 1.00 0.00 C ATOM 733 CD1 PHE A 6 10.099 -6.551 2.380 1.00 0.00 C ATOM 734 CD2 PHE A 6 8.673 -4.729 1.938 1.00 0.00 C ATOM 735 CE1 PHE A 6 10.781 -5.780 3.357 1.00 0.00 C ATOM 736 CE2 PHE A 6 9.354 -3.958 2.917 1.00 0.00 C ATOM 737 CZ PHE A 6 10.395 -4.500 3.606 1.00 0.00 C ATOM 0 H PHE A 6 7.627 -8.360 -1.069 1.00 0.00 H new ATOM 0 HA PHE A 6 8.764 -5.785 -1.227 1.00 0.00 H new ATOM 0 HB2 PHE A 6 7.287 -6.510 0.586 1.00 0.00 H new ATOM 0 HB3 PHE A 6 8.313 -7.883 0.954 1.00 0.00 H new ATOM 0 HD1 PHE A 6 10.405 -7.568 2.184 1.00 0.00 H new ATOM 0 HD2 PHE A 6 7.848 -4.299 1.390 1.00 0.00 H new ATOM 0 HE1 PHE A 6 11.607 -6.210 3.903 1.00 0.00 H new ATOM 0 HE2 PHE A 6 9.046 -2.942 3.115 1.00 0.00 H new ATOM 0 HZ PHE A 6 10.914 -3.914 4.350 1.00 0.00 H new ATOM 747 N ARG A 7 10.883 -8.155 -1.027 1.00 0.00 N ATOM 748 CA ARG A 7 12.297 -8.491 -0.978 1.00 0.00 C ATOM 749 C ARG A 7 13.096 -7.554 -1.887 1.00 0.00 C ATOM 750 O ARG A 7 14.322 -7.503 -1.806 1.00 0.00 O ATOM 751 CB ARG A 7 12.534 -9.938 -1.412 1.00 0.00 C ATOM 752 CG ARG A 7 12.041 -10.170 -2.843 1.00 0.00 C ATOM 753 CD ARG A 7 12.577 -11.489 -3.400 1.00 0.00 C ATOM 754 NE ARG A 7 12.189 -11.633 -4.821 1.00 0.00 N ATOM 755 CZ ARG A 7 10.935 -11.907 -5.239 1.00 0.00 C ATOM 756 NH1 ARG A 7 9.935 -12.069 -4.347 1.00 0.00 N ATOM 757 NH2 ARG A 7 10.701 -12.013 -6.534 1.00 0.00 N ATOM 0 H ARG A 7 10.278 -8.904 -1.364 1.00 0.00 H new ATOM 0 HA ARG A 7 12.631 -8.374 0.053 1.00 0.00 H new ATOM 0 HB2 ARG A 7 13.597 -10.171 -1.348 1.00 0.00 H new ATOM 0 HB3 ARG A 7 12.017 -10.615 -0.731 1.00 0.00 H new ATOM 0 HG2 ARG A 7 10.951 -10.181 -2.859 1.00 0.00 H new ATOM 0 HG3 ARG A 7 12.361 -9.345 -3.480 1.00 0.00 H new ATOM 0 HD2 ARG A 7 13.663 -11.519 -3.306 1.00 0.00 H new ATOM 0 HD3 ARG A 7 12.184 -12.324 -2.821 1.00 0.00 H new ATOM 0 HE ARG A 7 12.914 -11.518 -5.529 1.00 0.00 H new ATOM 0 HH11 ARG A 7 10.124 -11.985 -3.348 1.00 0.00 H new ATOM 0 HH12 ARG A 7 8.990 -12.276 -4.672 1.00 0.00 H new ATOM 0 HH21 ARG A 7 11.462 -11.888 -7.202 1.00 0.00 H new ATOM 0 HH22 ARG A 7 9.759 -12.220 -6.867 1.00 0.00 H new ATOM 770 N ASN A 8 12.369 -6.837 -2.730 1.00 0.00 N ATOM 771 CA ASN A 8 12.995 -5.904 -3.652 1.00 0.00 C ATOM 772 C ASN A 8 13.845 -4.906 -2.864 1.00 0.00 C ATOM 773 O ASN A 8 14.724 -4.255 -3.426 1.00 0.00 O ATOM 774 CB ASN A 8 11.945 -5.116 -4.437 1.00 0.00 C ATOM 775 CG ASN A 8 11.048 -4.311 -3.494 1.00 0.00 C ATOM 776 OD1 ASN A 8 10.608 -4.784 -2.459 1.00 0.00 O ATOM 777 ND2 ASN A 8 10.802 -3.072 -3.910 1.00 0.00 N ATOM 0 H ASN A 8 11.352 -6.883 -2.794 1.00 0.00 H new ATOM 0 HA ASN A 8 13.608 -6.478 -4.347 1.00 0.00 H new ATOM 0 HB2 ASN A 8 12.439 -4.443 -5.138 1.00 0.00 H new ATOM 0 HB3 ASN A 8 11.337 -5.801 -5.027 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.213 -2.454 -3.352 1.00 0.00 H new ATOM 0 HD22 ASN A 8 11.203 -2.740 -4.787 1.00 0.00 H new ATOM 784 N GLN A 9 13.553 -4.819 -1.574 1.00 0.00 N ATOM 785 CA GLN A 9 14.279 -3.911 -0.703 1.00 0.00 C ATOM 786 C GLN A 9 15.770 -4.259 -0.698 1.00 0.00 C ATOM 787 O GLN A 9 16.595 -3.464 -0.251 1.00 0.00 O ATOM 788 CB GLN A 9 13.706 -3.935 0.715 1.00 0.00 C ATOM 789 CG GLN A 9 12.565 -2.926 0.863 1.00 0.00 C ATOM 790 CD GLN A 9 12.894 -1.880 1.929 1.00 0.00 C ATOM 791 OE1 GLN A 9 12.141 -1.648 2.860 1.00 0.00 O ATOM 792 NE2 GLN A 9 14.057 -1.263 1.741 1.00 0.00 N ATOM 0 H GLN A 9 12.824 -5.362 -1.112 1.00 0.00 H new ATOM 0 HA GLN A 9 14.163 -2.898 -1.089 1.00 0.00 H new ATOM 0 HB2 GLN A 9 13.343 -4.936 0.947 1.00 0.00 H new ATOM 0 HB3 GLN A 9 14.494 -3.707 1.433 1.00 0.00 H new ATOM 0 HG2 GLN A 9 12.385 -2.433 -0.092 1.00 0.00 H new ATOM 0 HG3 GLN A 9 11.646 -3.447 1.131 1.00 0.00 H new ATOM 0 HE21 GLN A 9 14.639 -1.506 0.940 1.00 0.00 H new ATOM 0 HE22 GLN A 9 14.367 -0.547 2.398 1.00 0.00 H new ATOM 801 N ARG A 10 16.069 -5.448 -1.200 1.00 0.00 N ATOM 802 CA ARG A 10 17.445 -5.910 -1.259 1.00 0.00 C ATOM 803 C ARG A 10 18.290 -4.958 -2.108 1.00 0.00 C ATOM 804 O ARG A 10 19.518 -5.008 -2.069 1.00 0.00 O ATOM 805 CB ARG A 10 17.528 -7.319 -1.850 1.00 0.00 C ATOM 806 CG ARG A 10 17.026 -7.338 -3.295 1.00 0.00 C ATOM 807 CD ARG A 10 16.997 -8.765 -3.846 1.00 0.00 C ATOM 808 NE ARG A 10 16.140 -9.619 -2.995 1.00 0.00 N ATOM 809 CZ ARG A 10 16.584 -10.300 -1.917 1.00 0.00 C ATOM 810 NH1 ARG A 10 17.881 -10.233 -1.549 1.00 0.00 N ATOM 811 NH2 ARG A 10 15.729 -11.034 -1.227 1.00 0.00 N ATOM 0 H ARG A 10 15.382 -6.105 -1.570 1.00 0.00 H new ATOM 0 HA ARG A 10 17.831 -5.932 -0.240 1.00 0.00 H new ATOM 0 HB2 ARG A 10 18.559 -7.672 -1.815 1.00 0.00 H new ATOM 0 HB3 ARG A 10 16.935 -8.006 -1.246 1.00 0.00 H new ATOM 0 HG2 ARG A 10 16.027 -6.906 -3.342 1.00 0.00 H new ATOM 0 HG3 ARG A 10 17.672 -6.717 -3.916 1.00 0.00 H new ATOM 0 HD2 ARG A 10 16.619 -8.761 -4.869 1.00 0.00 H new ATOM 0 HD3 ARG A 10 18.008 -9.171 -3.881 1.00 0.00 H new ATOM 0 HE ARG A 10 15.152 -9.698 -3.238 1.00 0.00 H new ATOM 0 HH11 ARG A 10 18.535 -9.664 -2.087 1.00 0.00 H new ATOM 0 HH12 ARG A 10 18.207 -10.751 -0.733 1.00 0.00 H new ATOM 0 HH21 ARG A 10 14.751 -11.080 -1.511 1.00 0.00 H new ATOM 0 HH22 ARG A 10 16.047 -11.555 -0.410 1.00 0.00 H new ATOM 824 N LYS A 11 17.597 -4.113 -2.858 1.00 0.00 N ATOM 825 CA LYS A 11 18.267 -3.150 -3.715 1.00 0.00 C ATOM 826 C LYS A 11 17.915 -1.733 -3.258 1.00 0.00 C ATOM 827 O LYS A 11 17.774 -0.829 -4.078 1.00 0.00 O ATOM 828 CB LYS A 11 17.937 -3.421 -5.184 1.00 0.00 C ATOM 829 CG LYS A 11 18.540 -2.344 -6.090 1.00 0.00 C ATOM 830 CD LYS A 11 18.836 -2.902 -7.483 1.00 0.00 C ATOM 831 CE LYS A 11 17.696 -2.588 -8.453 1.00 0.00 C ATOM 832 NZ LYS A 11 18.172 -1.708 -9.543 1.00 0.00 N ATOM 0 H LYS A 11 16.578 -4.076 -2.890 1.00 0.00 H new ATOM 0 HA LYS A 11 19.349 -3.253 -3.630 1.00 0.00 H new ATOM 0 HB2 LYS A 11 18.321 -4.400 -5.472 1.00 0.00 H new ATOM 0 HB3 LYS A 11 16.856 -3.450 -5.318 1.00 0.00 H new ATOM 0 HG2 LYS A 11 17.851 -1.503 -6.170 1.00 0.00 H new ATOM 0 HG3 LYS A 11 19.459 -1.962 -5.645 1.00 0.00 H new ATOM 0 HD2 LYS A 11 19.766 -2.476 -7.859 1.00 0.00 H new ATOM 0 HD3 LYS A 11 18.981 -3.981 -7.423 1.00 0.00 H new ATOM 0 HE2 LYS A 11 17.301 -3.514 -8.871 1.00 0.00 H new ATOM 0 HE3 LYS A 11 16.878 -2.105 -7.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 17.619 -0.827 -9.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 19.177 -1.485 -9.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 18.055 -2.192 -10.456 1.00 0.00 H new ATOM 845 N THR A 12 17.785 -1.584 -1.947 1.00 0.00 N ATOM 846 CA THR A 12 17.453 -0.293 -1.370 1.00 0.00 C ATOM 847 C THR A 12 16.472 0.458 -2.272 1.00 0.00 C ATOM 848 O THR A 12 16.678 1.632 -2.578 1.00 0.00 O ATOM 849 CB THR A 12 18.759 0.466 -1.127 1.00 0.00 C ATOM 850 OG1 THR A 12 18.409 1.461 -0.170 1.00 0.00 O ATOM 851 CG2 THR A 12 19.206 1.268 -2.351 1.00 0.00 C ATOM 0 H THR A 12 17.904 -2.336 -1.269 1.00 0.00 H new ATOM 0 HA THR A 12 16.944 -0.407 -0.413 1.00 0.00 H new ATOM 0 HB THR A 12 19.542 -0.239 -0.849 1.00 0.00 H new ATOM 0 HG1 THR A 12 19.199 1.999 0.046 1.00 0.00 H new ATOM 0 HG21 THR A 12 20.137 1.788 -2.125 1.00 0.00 H new ATOM 0 HG22 THR A 12 19.362 0.592 -3.192 1.00 0.00 H new ATOM 0 HG23 THR A 12 18.437 1.997 -2.609 1.00 0.00 H new ATOM 859 N VAL A 13 15.427 -0.250 -2.675 1.00 0.00 N ATOM 860 CA VAL A 13 14.414 0.336 -3.536 1.00 0.00 C ATOM 861 C VAL A 13 14.164 1.784 -3.112 1.00 0.00 C ATOM 862 O VAL A 13 14.400 2.146 -1.961 1.00 0.00 O ATOM 863 CB VAL A 13 13.147 -0.522 -3.511 1.00 0.00 C ATOM 864 CG1 VAL A 13 13.355 -1.830 -4.276 1.00 0.00 C ATOM 865 CG2 VAL A 13 12.697 -0.793 -2.075 1.00 0.00 C ATOM 0 H VAL A 13 15.260 -1.224 -2.421 1.00 0.00 H new ATOM 0 HA VAL A 13 14.757 0.356 -4.570 1.00 0.00 H new ATOM 0 HB VAL A 13 12.355 0.036 -4.011 1.00 0.00 H new ATOM 0 HG11 VAL A 13 12.440 -2.421 -4.242 1.00 0.00 H new ATOM 0 HG12 VAL A 13 13.606 -1.609 -5.313 1.00 0.00 H new ATOM 0 HG13 VAL A 13 14.168 -2.394 -3.818 1.00 0.00 H new ATOM 0 HG21 VAL A 13 11.795 -1.405 -2.086 1.00 0.00 H new ATOM 0 HG22 VAL A 13 13.487 -1.320 -1.540 1.00 0.00 H new ATOM 0 HG23 VAL A 13 12.488 0.153 -1.575 1.00 0.00 H new ATOM 875 N LYS A 14 13.689 2.573 -4.064 1.00 0.00 N ATOM 876 CA LYS A 14 13.404 3.973 -3.803 1.00 0.00 C ATOM 877 C LYS A 14 11.890 4.174 -3.714 1.00 0.00 C ATOM 878 O LYS A 14 11.131 3.529 -4.436 1.00 0.00 O ATOM 879 CB LYS A 14 14.081 4.862 -4.849 1.00 0.00 C ATOM 880 CG LYS A 14 13.207 5.005 -6.096 1.00 0.00 C ATOM 881 CD LYS A 14 14.053 5.354 -7.322 1.00 0.00 C ATOM 882 CE LYS A 14 14.009 6.857 -7.607 1.00 0.00 C ATOM 883 NZ LYS A 14 14.919 7.198 -8.723 1.00 0.00 N ATOM 0 H LYS A 14 13.494 2.269 -5.018 1.00 0.00 H new ATOM 0 HA LYS A 14 13.823 4.273 -2.843 1.00 0.00 H new ATOM 0 HB2 LYS A 14 14.277 5.846 -4.423 1.00 0.00 H new ATOM 0 HB3 LYS A 14 15.046 4.436 -5.124 1.00 0.00 H new ATOM 0 HG2 LYS A 14 12.668 4.075 -6.275 1.00 0.00 H new ATOM 0 HG3 LYS A 14 12.459 5.781 -5.933 1.00 0.00 H new ATOM 0 HD2 LYS A 14 15.084 5.041 -7.158 1.00 0.00 H new ATOM 0 HD3 LYS A 14 13.687 4.805 -8.189 1.00 0.00 H new ATOM 0 HE2 LYS A 14 12.991 7.157 -7.855 1.00 0.00 H new ATOM 0 HE3 LYS A 14 14.296 7.411 -6.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 14.878 8.221 -8.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 15.892 6.930 -8.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 14.628 6.683 -9.578 1.00 0.00 H new ATOM 896 N CYS A 15 11.494 5.069 -2.820 1.00 0.00 N ATOM 897 CA CYS A 15 10.085 5.362 -2.627 1.00 0.00 C ATOM 898 C CYS A 15 9.636 6.316 -3.736 1.00 0.00 C ATOM 899 O CYS A 15 10.053 7.473 -3.770 1.00 0.00 O ATOM 900 CB CYS A 15 9.812 5.936 -1.235 1.00 0.00 C ATOM 901 SG CYS A 15 8.016 6.204 -1.010 1.00 0.00 S ATOM 0 H CYS A 15 12.126 5.601 -2.221 1.00 0.00 H new ATOM 0 HA CYS A 15 9.508 4.439 -2.687 1.00 0.00 H new ATOM 0 HB2 CYS A 15 10.185 5.253 -0.472 1.00 0.00 H new ATOM 0 HB3 CYS A 15 10.347 6.877 -1.109 1.00 0.00 H new ATOM 906 N PHE A 16 8.793 5.795 -4.615 1.00 0.00 N ATOM 907 CA PHE A 16 8.283 6.586 -5.722 1.00 0.00 C ATOM 908 C PHE A 16 7.274 7.627 -5.233 1.00 0.00 C ATOM 909 O PHE A 16 6.736 8.397 -6.028 1.00 0.00 O ATOM 910 CB PHE A 16 7.578 5.619 -6.676 1.00 0.00 C ATOM 911 CG PHE A 16 8.529 4.825 -7.572 1.00 0.00 C ATOM 912 CD1 PHE A 16 9.506 5.467 -8.267 1.00 0.00 C ATOM 913 CD2 PHE A 16 8.400 3.474 -7.673 1.00 0.00 C ATOM 914 CE1 PHE A 16 10.389 4.730 -9.099 1.00 0.00 C ATOM 915 CE2 PHE A 16 9.283 2.737 -8.505 1.00 0.00 C ATOM 916 CZ PHE A 16 10.259 3.380 -9.200 1.00 0.00 C ATOM 0 H PHE A 16 8.450 4.835 -4.583 1.00 0.00 H new ATOM 0 HA PHE A 16 9.102 7.114 -6.210 1.00 0.00 H new ATOM 0 HB2 PHE A 16 6.978 4.921 -6.092 1.00 0.00 H new ATOM 0 HB3 PHE A 16 6.889 6.183 -7.305 1.00 0.00 H new ATOM 0 HD1 PHE A 16 9.610 6.539 -8.186 1.00 0.00 H new ATOM 0 HD2 PHE A 16 7.626 2.963 -7.120 1.00 0.00 H new ATOM 0 HE1 PHE A 16 11.164 5.241 -9.651 1.00 0.00 H new ATOM 0 HE2 PHE A 16 9.180 1.665 -8.586 1.00 0.00 H new ATOM 0 HZ PHE A 16 10.931 2.819 -9.832 1.00 0.00 H new ATOM 926 N ASN A 17 7.050 7.620 -3.927 1.00 0.00 N ATOM 927 CA ASN A 17 6.116 8.555 -3.323 1.00 0.00 C ATOM 928 C ASN A 17 6.873 9.802 -2.864 1.00 0.00 C ATOM 929 O ASN A 17 6.694 10.882 -3.425 1.00 0.00 O ATOM 930 CB ASN A 17 5.435 7.939 -2.099 1.00 0.00 C ATOM 931 CG ASN A 17 4.110 8.641 -1.797 1.00 0.00 C ATOM 932 OD1 ASN A 17 3.368 9.032 -2.684 1.00 0.00 O ATOM 933 ND2 ASN A 17 3.854 8.779 -0.499 1.00 0.00 N ATOM 0 H ASN A 17 7.499 6.982 -3.270 1.00 0.00 H new ATOM 0 HA ASN A 17 5.361 8.806 -4.068 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.257 6.878 -2.273 1.00 0.00 H new ATOM 0 HB3 ASN A 17 6.095 8.014 -1.235 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.994 9.235 -0.194 1.00 0.00 H new ATOM 0 HD22 ASN A 17 4.518 8.429 0.192 1.00 0.00 H new ATOM 940 N CYS A 18 7.705 9.611 -1.851 1.00 0.00 N ATOM 941 CA CYS A 18 8.490 10.708 -1.311 1.00 0.00 C ATOM 942 C CYS A 18 9.731 10.887 -2.188 1.00 0.00 C ATOM 943 O CYS A 18 10.097 12.011 -2.531 1.00 0.00 O ATOM 944 CB CYS A 18 8.858 10.472 0.155 1.00 0.00 C ATOM 945 SG CYS A 18 9.816 8.922 0.319 1.00 0.00 S ATOM 0 H CYS A 18 7.853 8.713 -1.390 1.00 0.00 H new ATOM 0 HA CYS A 18 7.899 11.624 -1.327 1.00 0.00 H new ATOM 0 HB2 CYS A 18 9.442 11.312 0.531 1.00 0.00 H new ATOM 0 HB3 CYS A 18 7.954 10.416 0.761 1.00 0.00 H new ATOM 950 N GLY A 19 10.345 9.763 -2.527 1.00 0.00 N ATOM 951 CA GLY A 19 11.536 9.782 -3.358 1.00 0.00 C ATOM 952 C GLY A 19 12.784 9.455 -2.536 1.00 0.00 C ATOM 953 O GLY A 19 13.877 9.930 -2.843 1.00 0.00 O ATOM 0 H GLY A 19 10.040 8.833 -2.241 1.00 0.00 H new ATOM 0 HA2 GLY A 19 11.430 9.060 -4.168 1.00 0.00 H new ATOM 0 HA3 GLY A 19 11.647 10.764 -3.819 1.00 0.00 H new ATOM 957 N LYS A 20 12.579 8.647 -1.506 1.00 0.00 N ATOM 958 CA LYS A 20 13.674 8.249 -0.637 1.00 0.00 C ATOM 959 C LYS A 20 14.167 6.861 -1.046 1.00 0.00 C ATOM 960 O LYS A 20 13.743 6.323 -2.068 1.00 0.00 O ATOM 961 CB LYS A 20 13.255 8.346 0.832 1.00 0.00 C ATOM 962 CG LYS A 20 13.498 9.753 1.380 1.00 0.00 C ATOM 963 CD LYS A 20 13.795 9.714 2.880 1.00 0.00 C ATOM 964 CE LYS A 20 15.249 10.099 3.161 1.00 0.00 C ATOM 965 NZ LYS A 20 15.369 10.729 4.495 1.00 0.00 N ATOM 0 H LYS A 20 11.671 8.257 -1.254 1.00 0.00 H new ATOM 0 HA LYS A 20 14.516 8.931 -0.750 1.00 0.00 H new ATOM 0 HB2 LYS A 20 12.200 8.091 0.930 1.00 0.00 H new ATOM 0 HB3 LYS A 20 13.815 7.620 1.422 1.00 0.00 H new ATOM 0 HG2 LYS A 20 14.333 10.213 0.852 1.00 0.00 H new ATOM 0 HG3 LYS A 20 12.622 10.375 1.195 1.00 0.00 H new ATOM 0 HD2 LYS A 20 13.126 10.397 3.405 1.00 0.00 H new ATOM 0 HD3 LYS A 20 13.598 8.714 3.267 1.00 0.00 H new ATOM 0 HE2 LYS A 20 15.882 9.213 3.112 1.00 0.00 H new ATOM 0 HE3 LYS A 20 15.604 10.787 2.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 16.362 10.984 4.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 14.780 11.586 4.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 15.050 10.060 5.225 1.00 0.00 H new ATOM 978 N GLU A 21 15.056 6.317 -0.227 1.00 0.00 N ATOM 979 CA GLU A 21 15.610 5.000 -0.490 1.00 0.00 C ATOM 980 C GLU A 21 15.610 4.158 0.787 1.00 0.00 C ATOM 981 O GLU A 21 16.120 4.591 1.820 1.00 0.00 O ATOM 982 CB GLU A 21 17.019 5.107 -1.076 1.00 0.00 C ATOM 983 CG GLU A 21 17.008 4.841 -2.583 1.00 0.00 C ATOM 984 CD GLU A 21 18.155 5.577 -3.278 1.00 0.00 C ATOM 985 OE1 GLU A 21 18.516 6.690 -2.869 1.00 0.00 O ATOM 986 OE2 GLU A 21 18.678 4.951 -4.278 1.00 0.00 O ATOM 0 H GLU A 21 15.406 6.765 0.620 1.00 0.00 H new ATOM 0 HA GLU A 21 14.980 4.503 -1.228 1.00 0.00 H new ATOM 0 HB2 GLU A 21 17.423 6.100 -0.881 1.00 0.00 H new ATOM 0 HB3 GLU A 21 17.677 4.393 -0.582 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.094 3.770 -2.767 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.056 5.162 -3.006 1.00 0.00 H new ATOM 994 N GLY A 22 15.030 2.972 0.676 1.00 0.00 N ATOM 995 CA GLY A 22 14.957 2.066 1.810 1.00 0.00 C ATOM 996 C GLY A 22 13.512 1.634 2.072 1.00 0.00 C ATOM 997 O GLY A 22 13.241 0.917 3.034 1.00 0.00 O ATOM 0 H GLY A 22 14.606 2.617 -0.181 1.00 0.00 H new ATOM 0 HA2 GLY A 22 15.574 1.188 1.620 1.00 0.00 H new ATOM 0 HA3 GLY A 22 15.361 2.554 2.697 1.00 0.00 H new ATOM 1001 N HIS A 23 12.625 2.087 1.200 1.00 0.00 N ATOM 1002 CA HIS A 23 11.215 1.755 1.325 1.00 0.00 C ATOM 1003 C HIS A 23 10.488 2.105 0.026 1.00 0.00 C ATOM 1004 O HIS A 23 10.982 2.900 -0.772 1.00 0.00 O ATOM 1005 CB HIS A 23 10.603 2.439 2.549 1.00 0.00 C ATOM 1006 CG HIS A 23 10.188 3.871 2.310 1.00 0.00 C ATOM 1007 ND1 HIS A 23 11.045 4.940 2.496 1.00 0.00 N ATOM 1008 CD2 HIS A 23 8.999 4.397 1.898 1.00 0.00 C ATOM 1009 CE1 HIS A 23 10.391 6.056 2.205 1.00 0.00 C ATOM 1010 NE2 HIS A 23 9.122 5.716 1.836 1.00 0.00 N ATOM 0 H HIS A 23 12.854 2.681 0.403 1.00 0.00 H new ATOM 0 HA HIS A 23 11.103 0.683 1.486 1.00 0.00 H new ATOM 0 HB2 HIS A 23 9.733 1.869 2.874 1.00 0.00 H new ATOM 0 HB3 HIS A 23 11.324 2.412 3.366 1.00 0.00 H new ATOM 0 HD1 HIS A 23 12.015 4.880 2.805 1.00 0.00 H new ATOM 0 HD2 HIS A 23 8.108 3.834 1.662 1.00 0.00 H new ATOM 0 HE1 HIS A 23 10.792 7.058 2.252 1.00 0.00 H new ATOM 1018 N ILE A 24 9.325 1.494 -0.147 1.00 0.00 N ATOM 1019 CA ILE A 24 8.525 1.731 -1.337 1.00 0.00 C ATOM 1020 C ILE A 24 7.244 2.469 -0.945 1.00 0.00 C ATOM 1021 O ILE A 24 6.854 2.466 0.222 1.00 0.00 O ATOM 1022 CB ILE A 24 8.275 0.420 -2.084 1.00 0.00 C ATOM 1023 CG1 ILE A 24 7.133 -0.371 -1.440 1.00 0.00 C ATOM 1024 CG2 ILE A 24 9.559 -0.408 -2.185 1.00 0.00 C ATOM 1025 CD1 ILE A 24 6.685 -1.522 -2.342 1.00 0.00 C ATOM 0 H ILE A 24 8.918 0.835 0.517 1.00 0.00 H new ATOM 0 HA ILE A 24 9.062 2.372 -2.036 1.00 0.00 H new ATOM 0 HB ILE A 24 7.966 0.661 -3.101 1.00 0.00 H new ATOM 0 HG12 ILE A 24 7.457 -0.765 -0.476 1.00 0.00 H new ATOM 0 HG13 ILE A 24 6.290 0.293 -1.246 1.00 0.00 H new ATOM 0 HG21 ILE A 24 9.353 -1.335 -2.721 1.00 0.00 H new ATOM 0 HG22 ILE A 24 10.317 0.161 -2.723 1.00 0.00 H new ATOM 0 HG23 ILE A 24 9.922 -0.640 -1.184 1.00 0.00 H new ATOM 0 HD11 ILE A 24 5.873 -2.067 -1.860 1.00 0.00 H new ATOM 0 HD12 ILE A 24 6.339 -1.123 -3.296 1.00 0.00 H new ATOM 0 HD13 ILE A 24 7.523 -2.197 -2.514 1.00 0.00 H new ATOM 1037 N ALA A 25 6.623 3.082 -1.942 1.00 0.00 N ATOM 1038 CA ALA A 25 5.394 3.823 -1.716 1.00 0.00 C ATOM 1039 C ALA A 25 4.416 2.950 -0.928 1.00 0.00 C ATOM 1040 O ALA A 25 3.726 3.437 -0.032 1.00 0.00 O ATOM 1041 CB ALA A 25 4.818 4.278 -3.058 1.00 0.00 C ATOM 0 H ALA A 25 6.948 3.081 -2.909 1.00 0.00 H new ATOM 0 HA ALA A 25 5.588 4.718 -1.125 1.00 0.00 H new ATOM 0 HB1 ALA A 25 3.896 4.834 -2.888 1.00 0.00 H new ATOM 0 HB2 ALA A 25 5.540 4.918 -3.565 1.00 0.00 H new ATOM 0 HB3 ALA A 25 4.607 3.406 -3.678 1.00 0.00 H new ATOM 1047 N LYS A 26 4.386 1.676 -1.289 1.00 0.00 N ATOM 1048 CA LYS A 26 3.503 0.731 -0.626 1.00 0.00 C ATOM 1049 C LYS A 26 3.830 0.695 0.868 1.00 0.00 C ATOM 1050 O LYS A 26 2.928 0.670 1.704 1.00 0.00 O ATOM 1051 CB LYS A 26 3.578 -0.638 -1.305 1.00 0.00 C ATOM 1052 CG LYS A 26 3.355 -0.515 -2.814 1.00 0.00 C ATOM 1053 CD LYS A 26 1.909 -0.855 -3.183 1.00 0.00 C ATOM 1054 CE LYS A 26 1.853 -2.056 -4.129 1.00 0.00 C ATOM 1055 NZ LYS A 26 0.511 -2.169 -4.743 1.00 0.00 N ATOM 0 H LYS A 26 4.959 1.276 -2.032 1.00 0.00 H new ATOM 0 HA LYS A 26 2.465 1.051 -0.717 1.00 0.00 H new ATOM 0 HB2 LYS A 26 4.551 -1.090 -1.113 1.00 0.00 H new ATOM 0 HB3 LYS A 26 2.828 -1.302 -0.876 1.00 0.00 H new ATOM 0 HG2 LYS A 26 3.588 0.499 -3.138 1.00 0.00 H new ATOM 0 HG3 LYS A 26 4.036 -1.183 -3.342 1.00 0.00 H new ATOM 0 HD2 LYS A 26 1.341 -1.073 -2.279 1.00 0.00 H new ATOM 0 HD3 LYS A 26 1.438 0.007 -3.655 1.00 0.00 H new ATOM 0 HE2 LYS A 26 2.608 -1.949 -4.908 1.00 0.00 H new ATOM 0 HE3 LYS A 26 2.087 -2.969 -3.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 0.490 -2.989 -5.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -0.203 -2.293 -3.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 0.302 -1.304 -5.282 1.00 0.00 H new ATOM 1068 N ASN A 27 5.123 0.695 1.159 1.00 0.00 N ATOM 1069 CA ASN A 27 5.580 0.663 2.537 1.00 0.00 C ATOM 1070 C ASN A 27 5.858 2.091 3.011 1.00 0.00 C ATOM 1071 O ASN A 27 6.462 2.293 4.063 1.00 0.00 O ATOM 1072 CB ASN A 27 6.875 -0.140 2.670 1.00 0.00 C ATOM 1073 CG ASN A 27 6.609 -1.639 2.519 1.00 0.00 C ATOM 1074 OD1 ASN A 27 6.839 -2.431 3.418 1.00 0.00 O ATOM 1075 ND2 ASN A 27 6.113 -1.984 1.334 1.00 0.00 N ATOM 0 H ASN A 27 5.868 0.717 0.463 1.00 0.00 H new ATOM 0 HA ASN A 27 4.802 0.194 3.139 1.00 0.00 H new ATOM 0 HB2 ASN A 27 7.588 0.185 1.912 1.00 0.00 H new ATOM 0 HB3 ASN A 27 7.331 0.056 3.641 1.00 0.00 H new ATOM 0 HD21 ASN A 27 5.902 -2.962 1.135 1.00 0.00 H new ATOM 0 HD22 ASN A 27 5.944 -1.271 0.625 1.00 0.00 H new ATOM 1082 N CYS A 28 5.407 3.045 2.210 1.00 0.00 N ATOM 1083 CA CYS A 28 5.599 4.448 2.535 1.00 0.00 C ATOM 1084 C CYS A 28 4.472 4.884 3.472 1.00 0.00 C ATOM 1085 O CYS A 28 3.305 4.577 3.229 1.00 0.00 O ATOM 1086 CB CYS A 28 5.663 5.315 1.276 1.00 0.00 C ATOM 1087 SG CYS A 28 5.999 7.056 1.732 1.00 0.00 S ATOM 0 H CYS A 28 4.909 2.874 1.336 1.00 0.00 H new ATOM 0 HA CYS A 28 6.557 4.580 3.037 1.00 0.00 H new ATOM 0 HB2 CYS A 28 6.444 4.947 0.611 1.00 0.00 H new ATOM 0 HB3 CYS A 28 4.722 5.248 0.730 1.00 0.00 H new ATOM 1092 N ARG A 29 4.859 5.593 4.521 1.00 0.00 N ATOM 1093 CA ARG A 29 3.894 6.074 5.495 1.00 0.00 C ATOM 1094 C ARG A 29 3.145 7.290 4.946 1.00 0.00 C ATOM 1095 O ARG A 29 1.982 7.510 5.279 1.00 0.00 O ATOM 1096 CB ARG A 29 4.581 6.458 6.808 1.00 0.00 C ATOM 1097 CG ARG A 29 3.694 6.126 8.009 1.00 0.00 C ATOM 1098 CD ARG A 29 4.215 4.893 8.751 1.00 0.00 C ATOM 1099 NE ARG A 29 5.142 5.305 9.828 1.00 0.00 N ATOM 1100 CZ ARG A 29 4.747 5.683 11.062 1.00 0.00 C ATOM 1101 NH1 ARG A 29 3.436 5.705 11.386 1.00 0.00 N ATOM 1102 NH2 ARG A 29 5.661 6.031 11.949 1.00 0.00 N ATOM 0 H ARG A 29 5.827 5.846 4.718 1.00 0.00 H new ATOM 0 HA ARG A 29 3.189 5.266 5.689 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.530 5.928 6.895 1.00 0.00 H new ATOM 0 HB3 ARG A 29 4.810 7.524 6.804 1.00 0.00 H new ATOM 0 HG2 ARG A 29 3.662 6.978 8.689 1.00 0.00 H new ATOM 0 HG3 ARG A 29 2.672 5.948 7.673 1.00 0.00 H new ATOM 0 HD2 ARG A 29 3.381 4.333 9.173 1.00 0.00 H new ATOM 0 HD3 ARG A 29 4.726 4.228 8.055 1.00 0.00 H new ATOM 0 HE ARG A 29 6.142 5.303 9.625 1.00 0.00 H new ATOM 0 HH11 ARG A 29 2.735 5.435 10.696 1.00 0.00 H new ATOM 0 HH12 ARG A 29 3.146 5.992 12.321 1.00 0.00 H new ATOM 0 HH21 ARG A 29 6.649 6.012 11.697 1.00 0.00 H new ATOM 0 HH22 ARG A 29 5.379 6.319 12.886 1.00 0.00 H new ATOM 1115 N ALA A 30 3.844 8.048 4.113 1.00 0.00 N ATOM 1116 CA ALA A 30 3.260 9.236 3.513 1.00 0.00 C ATOM 1117 C ALA A 30 2.033 8.836 2.690 1.00 0.00 C ATOM 1118 O ALA A 30 1.897 7.681 2.291 1.00 0.00 O ATOM 1119 CB ALA A 30 4.316 9.955 2.671 1.00 0.00 C ATOM 0 H ALA A 30 4.809 7.862 3.840 1.00 0.00 H new ATOM 0 HA ALA A 30 2.928 9.931 4.284 1.00 0.00 H new ATOM 0 HB1 ALA A 30 3.878 10.846 2.221 1.00 0.00 H new ATOM 0 HB2 ALA A 30 5.153 10.244 3.306 1.00 0.00 H new ATOM 0 HB3 ALA A 30 4.670 9.288 1.885 1.00 0.00 H new ATOM 1125 N PRO A 31 1.147 9.840 2.455 1.00 0.00 N ATOM 1126 CA PRO A 31 -0.065 9.605 1.688 1.00 0.00 C ATOM 1127 C PRO A 31 0.247 9.484 0.195 1.00 0.00 C ATOM 1128 O PRO A 31 1.188 10.103 -0.298 1.00 0.00 O ATOM 1129 CB PRO A 31 -0.970 10.783 2.013 1.00 0.00 C ATOM 1130 CG PRO A 31 -0.063 11.863 2.578 1.00 0.00 C ATOM 1131 CD PRO A 31 1.273 11.222 2.912 1.00 0.00 C ATOM 0 HA PRO A 31 -0.551 8.664 1.945 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -1.488 11.135 1.121 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -1.736 10.499 2.735 1.00 0.00 H new ATOM 0 HG2 PRO A 31 0.070 12.667 1.854 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -0.507 12.307 3.469 1.00 0.00 H new ATOM 0 HD2 PRO A 31 2.094 11.732 2.408 1.00 0.00 H new ATOM 0 HD3 PRO A 31 1.478 11.268 3.982 1.00 0.00 H new ATOM 1139 N ARG A 32 -0.562 8.682 -0.482 1.00 0.00 N ATOM 1140 CA ARG A 32 -0.385 8.472 -1.908 1.00 0.00 C ATOM 1141 C ARG A 32 -0.477 9.803 -2.658 1.00 0.00 C ATOM 1142 O ARG A 32 -1.550 10.400 -2.741 1.00 0.00 O ATOM 1143 CB ARG A 32 -1.440 7.511 -2.459 1.00 0.00 C ATOM 1144 CG ARG A 32 -1.477 6.215 -1.648 1.00 0.00 C ATOM 1145 CD ARG A 32 -0.144 5.469 -1.746 1.00 0.00 C ATOM 1146 NE ARG A 32 -0.301 4.262 -2.589 1.00 0.00 N ATOM 1147 CZ ARG A 32 -1.196 3.281 -2.347 1.00 0.00 C ATOM 1148 NH1 ARG A 32 -2.025 3.356 -1.284 1.00 0.00 N ATOM 1149 NH2 ARG A 32 -1.249 2.247 -3.166 1.00 0.00 N ATOM 0 H ARG A 32 -1.342 8.170 -0.069 1.00 0.00 H new ATOM 0 HA ARG A 32 0.602 8.035 -2.057 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -2.420 7.988 -2.434 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -1.222 7.285 -3.503 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -1.696 6.441 -0.604 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -2.283 5.577 -2.012 1.00 0.00 H new ATOM 0 HD2 ARG A 32 0.618 6.123 -2.171 1.00 0.00 H new ATOM 0 HD3 ARG A 32 0.198 5.186 -0.751 1.00 0.00 H new ATOM 0 HE ARG A 32 0.305 4.166 -3.404 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -1.978 4.159 -0.656 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -2.698 2.610 -1.109 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -0.619 2.198 -3.967 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -1.919 1.497 -2.998 1.00 0.00 H new ATOM 1162 N LYS A 33 0.662 10.230 -3.183 1.00 0.00 N ATOM 1163 CA LYS A 33 0.723 11.480 -3.922 1.00 0.00 C ATOM 1164 C LYS A 33 1.689 11.325 -5.098 1.00 0.00 C ATOM 1165 O LYS A 33 2.195 10.233 -5.352 1.00 0.00 O ATOM 1166 CB LYS A 33 1.073 12.639 -2.987 1.00 0.00 C ATOM 1167 CG LYS A 33 -0.155 13.508 -2.706 1.00 0.00 C ATOM 1168 CD LYS A 33 0.076 14.409 -1.492 1.00 0.00 C ATOM 1169 CE LYS A 33 1.108 15.494 -1.804 1.00 0.00 C ATOM 1170 NZ LYS A 33 0.836 16.712 -1.008 1.00 0.00 N ATOM 0 H LYS A 33 1.550 9.733 -3.111 1.00 0.00 H new ATOM 0 HA LYS A 33 -0.254 11.723 -4.341 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.468 12.248 -2.049 1.00 0.00 H new ATOM 0 HB3 LYS A 33 1.859 13.248 -3.435 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.379 14.120 -3.580 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -1.023 12.872 -2.531 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -0.865 14.872 -1.194 1.00 0.00 H new ATOM 0 HD3 LYS A 33 0.418 13.809 -0.649 1.00 0.00 H new ATOM 0 HE2 LYS A 33 2.110 15.125 -1.585 1.00 0.00 H new ATOM 0 HE3 LYS A 33 1.082 15.734 -2.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 1.546 17.439 -1.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -0.112 17.072 -1.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 0.883 16.482 0.005 1.00 0.00 H new ATOM 1183 N LYS A 34 1.918 12.435 -5.784 1.00 0.00 N ATOM 1184 CA LYS A 34 2.815 12.437 -6.928 1.00 0.00 C ATOM 1185 C LYS A 34 3.657 13.715 -6.908 1.00 0.00 C ATOM 1186 O LYS A 34 3.750 14.415 -7.915 1.00 0.00 O ATOM 1187 CB LYS A 34 2.030 12.237 -8.225 1.00 0.00 C ATOM 1188 CG LYS A 34 2.618 11.091 -9.051 1.00 0.00 C ATOM 1189 CD LYS A 34 1.881 10.941 -10.384 1.00 0.00 C ATOM 1190 CE LYS A 34 0.564 10.185 -10.201 1.00 0.00 C ATOM 1191 NZ LYS A 34 -0.498 10.783 -11.040 1.00 0.00 N ATOM 0 H LYS A 34 1.498 13.340 -5.570 1.00 0.00 H new ATOM 0 HA LYS A 34 3.508 11.598 -6.870 1.00 0.00 H new ATOM 0 HB2 LYS A 34 0.986 12.025 -7.993 1.00 0.00 H new ATOM 0 HB3 LYS A 34 2.046 13.157 -8.810 1.00 0.00 H new ATOM 0 HG2 LYS A 34 3.676 11.277 -9.235 1.00 0.00 H new ATOM 0 HG3 LYS A 34 2.551 10.160 -8.488 1.00 0.00 H new ATOM 0 HD2 LYS A 34 1.683 11.926 -10.807 1.00 0.00 H new ATOM 0 HD3 LYS A 34 2.513 10.410 -11.095 1.00 0.00 H new ATOM 0 HE2 LYS A 34 0.699 9.137 -10.468 1.00 0.00 H new ATOM 0 HE3 LYS A 34 0.266 10.211 -9.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -1.385 10.258 -10.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -0.638 11.777 -10.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -0.218 10.736 -12.040 1.00 0.00 H new ATOM 1204 N GLY A 35 4.246 13.979 -5.753 1.00 0.00 N ATOM 1205 CA GLY A 35 5.077 15.160 -5.588 1.00 0.00 C ATOM 1206 C GLY A 35 6.506 14.896 -6.068 1.00 0.00 C ATOM 1207 O GLY A 35 7.146 13.944 -5.627 1.00 0.00 O ATOM 0 H GLY A 35 4.165 13.395 -4.920 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.649 15.991 -6.148 1.00 0.00 H new ATOM 0 HA3 GLY A 35 5.091 15.456 -4.539 1.00 0.00 H new ATOM 1211 N CYS A 36 6.964 15.758 -6.964 1.00 0.00 N ATOM 1212 CA CYS A 36 8.305 15.630 -7.507 1.00 0.00 C ATOM 1213 C CYS A 36 9.303 15.715 -6.351 1.00 0.00 C ATOM 1214 O CYS A 36 9.308 16.691 -5.602 1.00 0.00 O ATOM 1215 CB CYS A 36 8.584 16.685 -8.580 1.00 0.00 C ATOM 1216 SG CYS A 36 10.348 16.633 -9.067 1.00 0.00 S ATOM 0 H CYS A 36 6.430 16.548 -7.327 1.00 0.00 H new ATOM 0 HA CYS A 36 8.408 14.665 -8.003 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.953 16.506 -9.450 1.00 0.00 H new ATOM 0 HB3 CYS A 36 8.332 17.676 -8.202 1.00 0.00 H new ATOM 1221 N TRP A 37 10.122 14.681 -6.240 1.00 0.00 N ATOM 1222 CA TRP A 37 11.123 14.627 -5.187 1.00 0.00 C ATOM 1223 C TRP A 37 12.340 15.429 -5.650 1.00 0.00 C ATOM 1224 O TRP A 37 13.477 15.071 -5.344 1.00 0.00 O ATOM 1225 CB TRP A 37 11.462 13.179 -4.828 1.00 0.00 C ATOM 1226 CG TRP A 37 10.458 12.154 -5.359 1.00 0.00 C ATOM 1227 CD1 TRP A 37 9.165 12.020 -5.033 1.00 0.00 C ATOM 1228 CD2 TRP A 37 10.719 11.118 -6.329 1.00 0.00 C ATOM 1229 NE1 TRP A 37 8.577 10.978 -5.719 1.00 0.00 N ATOM 1230 CE2 TRP A 37 9.551 10.411 -6.533 1.00 0.00 C ATOM 1231 CE3 TRP A 37 11.904 10.788 -7.012 1.00 0.00 C ATOM 1232 CZ2 TRP A 37 9.452 9.332 -7.418 1.00 0.00 C ATOM 1233 CZ3 TRP A 37 11.788 9.706 -7.893 1.00 0.00 C ATOM 1234 CH2 TRP A 37 10.620 8.985 -8.110 1.00 0.00 C ATOM 0 H TRP A 37 10.114 13.873 -6.862 1.00 0.00 H new ATOM 0 HA TRP A 37 10.742 15.073 -4.268 1.00 0.00 H new ATOM 0 HB2 TRP A 37 12.451 12.940 -5.220 1.00 0.00 H new ATOM 0 HB3 TRP A 37 11.519 13.088 -3.743 1.00 0.00 H new ATOM 0 HD1 TRP A 37 8.649 12.649 -4.323 1.00 0.00 H new ATOM 0 HE1 TRP A 37 7.605 10.678 -5.643 1.00 0.00 H new ATOM 0 HE3 TRP A 37 12.829 11.326 -6.868 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 8.526 8.796 -7.560 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 12.669 9.411 -8.443 1.00 0.00 H new ATOM 0 HH2 TRP A 37 10.613 8.161 -8.809 1.00 0.00 H new ATOM 1245 N LYS A 38 12.061 16.500 -6.379 1.00 0.00 N ATOM 1246 CA LYS A 38 13.120 17.356 -6.886 1.00 0.00 C ATOM 1247 C LYS A 38 12.758 18.819 -6.621 1.00 0.00 C ATOM 1248 O LYS A 38 13.569 19.576 -6.088 1.00 0.00 O ATOM 1249 CB LYS A 38 13.397 17.049 -8.359 1.00 0.00 C ATOM 1250 CG LYS A 38 14.897 16.872 -8.609 1.00 0.00 C ATOM 1251 CD LYS A 38 15.384 15.518 -8.089 1.00 0.00 C ATOM 1252 CE LYS A 38 16.595 15.687 -7.170 1.00 0.00 C ATOM 1253 NZ LYS A 38 16.189 15.582 -5.751 1.00 0.00 N ATOM 0 H LYS A 38 11.117 16.794 -6.630 1.00 0.00 H new ATOM 0 HA LYS A 38 14.054 17.158 -6.361 1.00 0.00 H new ATOM 0 HB2 LYS A 38 12.866 16.143 -8.651 1.00 0.00 H new ATOM 0 HB3 LYS A 38 13.014 17.858 -8.981 1.00 0.00 H new ATOM 0 HG2 LYS A 38 15.103 16.951 -9.676 1.00 0.00 H new ATOM 0 HG3 LYS A 38 15.448 17.674 -8.118 1.00 0.00 H new ATOM 0 HD2 LYS A 38 14.579 15.021 -7.548 1.00 0.00 H new ATOM 0 HD3 LYS A 38 15.647 14.875 -8.929 1.00 0.00 H new ATOM 0 HE2 LYS A 38 17.341 14.925 -7.398 1.00 0.00 H new ATOM 0 HE3 LYS A 38 17.063 16.655 -7.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 16.439 16.460 -5.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 15.161 15.432 -5.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 16.681 14.780 -5.308 1.00 0.00 H new ATOM 1266 N CYS A 39 11.540 19.173 -7.004 1.00 0.00 N ATOM 1267 CA CYS A 39 11.062 20.531 -6.814 1.00 0.00 C ATOM 1268 C CYS A 39 9.983 20.514 -5.728 1.00 0.00 C ATOM 1269 O CYS A 39 9.834 21.480 -4.981 1.00 0.00 O ATOM 1270 CB CYS A 39 10.544 21.137 -8.120 1.00 0.00 C ATOM 1271 SG CYS A 39 9.321 20.016 -8.889 1.00 0.00 S ATOM 0 H CYS A 39 10.870 18.543 -7.445 1.00 0.00 H new ATOM 0 HA CYS A 39 11.888 21.167 -6.496 1.00 0.00 H new ATOM 0 HB2 CYS A 39 10.087 22.107 -7.924 1.00 0.00 H new ATOM 0 HB3 CYS A 39 11.374 21.308 -8.805 1.00 0.00 H new ATOM 1276 N GLY A 40 9.261 19.405 -5.675 1.00 0.00 N ATOM 1277 CA GLY A 40 8.201 19.248 -4.693 1.00 0.00 C ATOM 1278 C GLY A 40 6.842 19.619 -5.288 1.00 0.00 C ATOM 1279 O GLY A 40 5.905 19.935 -4.558 1.00 0.00 O ATOM 0 H GLY A 40 9.389 18.606 -6.296 1.00 0.00 H new ATOM 0 HA2 GLY A 40 8.178 18.217 -4.340 1.00 0.00 H new ATOM 0 HA3 GLY A 40 8.407 19.877 -3.827 1.00 0.00 H new ATOM 1283 N LYS A 41 6.777 19.567 -6.612 1.00 0.00 N ATOM 1284 CA LYS A 41 5.549 19.894 -7.314 1.00 0.00 C ATOM 1285 C LYS A 41 4.760 18.610 -7.579 1.00 0.00 C ATOM 1286 O LYS A 41 5.277 17.675 -8.189 1.00 0.00 O ATOM 1287 CB LYS A 41 5.853 20.701 -8.579 1.00 0.00 C ATOM 1288 CG LYS A 41 5.018 21.982 -8.625 1.00 0.00 C ATOM 1289 CD LYS A 41 5.472 22.972 -7.551 1.00 0.00 C ATOM 1290 CE LYS A 41 4.384 24.009 -7.265 1.00 0.00 C ATOM 1291 NZ LYS A 41 4.966 25.206 -6.618 1.00 0.00 N ATOM 0 H LYS A 41 7.556 19.303 -7.215 1.00 0.00 H new ATOM 0 HA LYS A 41 4.918 20.535 -6.698 1.00 0.00 H new ATOM 0 HB2 LYS A 41 6.913 20.952 -8.608 1.00 0.00 H new ATOM 0 HB3 LYS A 41 5.645 20.095 -9.461 1.00 0.00 H new ATOM 0 HG2 LYS A 41 5.106 22.442 -9.609 1.00 0.00 H new ATOM 0 HG3 LYS A 41 3.965 21.739 -8.479 1.00 0.00 H new ATOM 0 HD2 LYS A 41 5.716 22.434 -6.635 1.00 0.00 H new ATOM 0 HD3 LYS A 41 6.382 23.475 -7.877 1.00 0.00 H new ATOM 0 HE2 LYS A 41 3.892 24.294 -8.195 1.00 0.00 H new ATOM 0 HE3 LYS A 41 3.620 23.575 -6.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 4.214 25.900 -6.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 5.415 24.932 -5.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 5.678 25.629 -7.247 1.00 0.00 H new ATOM 1304 N GLU A 42 3.523 18.605 -7.106 1.00 0.00 N ATOM 1305 CA GLU A 42 2.659 17.450 -7.284 1.00 0.00 C ATOM 1306 C GLU A 42 1.993 17.493 -8.660 1.00 0.00 C ATOM 1307 O GLU A 42 1.195 18.387 -8.941 1.00 0.00 O ATOM 1308 CB GLU A 42 1.612 17.373 -6.171 1.00 0.00 C ATOM 1309 CG GLU A 42 0.626 18.539 -6.263 1.00 0.00 C ATOM 1310 CD GLU A 42 -0.197 18.665 -4.979 1.00 0.00 C ATOM 1311 OE1 GLU A 42 0.134 18.029 -3.967 1.00 0.00 O ATOM 1312 OE2 GLU A 42 -1.211 19.458 -5.056 1.00 0.00 O ATOM 0 H GLU A 42 3.098 19.382 -6.600 1.00 0.00 H new ATOM 0 HA GLU A 42 3.271 16.550 -7.226 1.00 0.00 H new ATOM 0 HB2 GLU A 42 1.072 16.429 -6.240 1.00 0.00 H new ATOM 0 HB3 GLU A 42 2.107 17.387 -5.200 1.00 0.00 H new ATOM 0 HG2 GLU A 42 1.170 19.466 -6.443 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -0.040 18.390 -7.113 1.00 0.00 H new ATOM 1320 N GLY A 43 2.344 16.516 -9.483 1.00 0.00 N ATOM 1321 CA GLY A 43 1.791 16.431 -10.824 1.00 0.00 C ATOM 1322 C GLY A 43 2.797 15.810 -11.794 1.00 0.00 C ATOM 1323 O GLY A 43 2.481 14.847 -12.492 1.00 0.00 O ATOM 0 H GLY A 43 3.005 15.776 -9.247 1.00 0.00 H new ATOM 0 HA2 GLY A 43 0.880 15.833 -10.808 1.00 0.00 H new ATOM 0 HA3 GLY A 43 1.513 17.427 -11.170 1.00 0.00 H new ATOM 1327 N HIS A 44 3.991 16.386 -11.808 1.00 0.00 N ATOM 1328 CA HIS A 44 5.046 15.900 -12.681 1.00 0.00 C ATOM 1329 C HIS A 44 5.989 14.992 -11.890 1.00 0.00 C ATOM 1330 O HIS A 44 5.851 14.853 -10.676 1.00 0.00 O ATOM 1331 CB HIS A 44 5.772 17.066 -13.356 1.00 0.00 C ATOM 1332 CG HIS A 44 6.697 17.827 -12.436 1.00 0.00 C ATOM 1333 ND1 HIS A 44 6.314 18.982 -11.775 1.00 0.00 N ATOM 1334 CD2 HIS A 44 7.991 17.587 -12.075 1.00 0.00 C ATOM 1335 CE1 HIS A 44 7.339 19.409 -11.052 1.00 0.00 C ATOM 1336 NE2 HIS A 44 8.377 18.544 -11.240 1.00 0.00 N ATOM 0 H HIS A 44 4.251 17.184 -11.229 1.00 0.00 H new ATOM 0 HA HIS A 44 4.613 15.304 -13.484 1.00 0.00 H new ATOM 0 HB2 HIS A 44 6.348 16.683 -14.199 1.00 0.00 H new ATOM 0 HB3 HIS A 44 5.032 17.755 -13.762 1.00 0.00 H new ATOM 0 HD1 HIS A 44 5.399 19.428 -11.835 1.00 0.00 H new ATOM 0 HD2 HIS A 44 8.598 16.759 -12.411 1.00 0.00 H new ATOM 0 HE1 HIS A 44 7.351 20.288 -10.424 1.00 0.00 H new ATOM 1344 N GLN A 45 6.928 14.396 -12.611 1.00 0.00 N ATOM 1345 CA GLN A 45 7.895 13.505 -11.993 1.00 0.00 C ATOM 1346 C GLN A 45 9.318 14.002 -12.251 1.00 0.00 C ATOM 1347 O GLN A 45 9.549 14.778 -13.179 1.00 0.00 O ATOM 1348 CB GLN A 45 7.715 12.069 -12.492 1.00 0.00 C ATOM 1349 CG GLN A 45 8.344 11.888 -13.874 1.00 0.00 C ATOM 1350 CD GLN A 45 8.359 10.413 -14.281 1.00 0.00 C ATOM 1351 OE1 GLN A 45 9.321 9.693 -14.066 1.00 0.00 O ATOM 1352 NE2 GLN A 45 7.242 10.005 -14.877 1.00 0.00 N ATOM 0 H GLN A 45 7.039 14.513 -13.618 1.00 0.00 H new ATOM 0 HA GLN A 45 7.723 13.505 -10.917 1.00 0.00 H new ATOM 0 HB2 GLN A 45 8.172 11.375 -11.787 1.00 0.00 H new ATOM 0 HB3 GLN A 45 6.653 11.826 -12.537 1.00 0.00 H new ATOM 0 HG2 GLN A 45 7.786 12.466 -14.610 1.00 0.00 H new ATOM 0 HG3 GLN A 45 9.362 12.278 -13.868 1.00 0.00 H new ATOM 0 HE21 GLN A 45 6.475 10.660 -15.026 1.00 0.00 H new ATOM 0 HE22 GLN A 45 7.153 9.037 -15.185 1.00 0.00 H new ATOM 1361 N MET A 46 10.235 13.536 -11.418 1.00 0.00 N ATOM 1362 CA MET A 46 11.629 13.923 -11.546 1.00 0.00 C ATOM 1363 C MET A 46 12.133 13.697 -12.973 1.00 0.00 C ATOM 1364 O MET A 46 12.877 14.515 -13.508 1.00 0.00 O ATOM 1365 CB MET A 46 12.478 13.107 -10.568 1.00 0.00 C ATOM 1366 CG MET A 46 13.971 13.326 -10.823 1.00 0.00 C ATOM 1367 SD MET A 46 14.674 11.885 -11.610 1.00 0.00 S ATOM 1368 CE MET A 46 14.577 10.718 -10.263 1.00 0.00 C ATOM 0 H MET A 46 10.040 12.893 -10.651 1.00 0.00 H new ATOM 0 HA MET A 46 11.714 14.985 -11.316 1.00 0.00 H new ATOM 0 HB2 MET A 46 12.235 13.392 -9.544 1.00 0.00 H new ATOM 0 HB3 MET A 46 12.240 12.048 -10.670 1.00 0.00 H new ATOM 0 HG2 MET A 46 14.116 14.202 -11.455 1.00 0.00 H new ATOM 0 HG3 MET A 46 14.484 13.523 -9.882 1.00 0.00 H new ATOM 0 HE1 MET A 46 15.389 9.996 -10.348 1.00 0.00 H new ATOM 0 HE2 MET A 46 14.661 11.249 -9.315 1.00 0.00 H new ATOM 0 HE3 MET A 46 13.621 10.195 -10.303 1.00 0.00 H new ATOM 1378 N LYS A 47 11.707 12.580 -13.546 1.00 0.00 N ATOM 1379 CA LYS A 47 12.105 12.237 -14.900 1.00 0.00 C ATOM 1380 C LYS A 47 11.747 13.388 -15.842 1.00 0.00 C ATOM 1381 O LYS A 47 12.458 13.647 -16.811 1.00 0.00 O ATOM 1382 CB LYS A 47 11.497 10.895 -15.313 1.00 0.00 C ATOM 1383 CG LYS A 47 12.114 10.392 -16.619 1.00 0.00 C ATOM 1384 CD LYS A 47 11.028 10.045 -17.641 1.00 0.00 C ATOM 1385 CE LYS A 47 10.829 8.531 -17.737 1.00 0.00 C ATOM 1386 NZ LYS A 47 11.112 8.057 -19.110 1.00 0.00 N ATOM 0 H LYS A 47 11.091 11.902 -13.097 1.00 0.00 H new ATOM 0 HA LYS A 47 13.185 12.104 -14.956 1.00 0.00 H new ATOM 0 HB2 LYS A 47 11.658 10.161 -14.524 1.00 0.00 H new ATOM 0 HB3 LYS A 47 10.419 11.002 -15.433 1.00 0.00 H new ATOM 0 HG2 LYS A 47 12.775 11.155 -17.030 1.00 0.00 H new ATOM 0 HG3 LYS A 47 12.726 9.512 -16.421 1.00 0.00 H new ATOM 0 HD2 LYS A 47 10.090 10.521 -17.356 1.00 0.00 H new ATOM 0 HD3 LYS A 47 11.303 10.442 -18.618 1.00 0.00 H new ATOM 0 HE2 LYS A 47 11.486 8.026 -17.029 1.00 0.00 H new ATOM 0 HE3 LYS A 47 9.806 8.274 -17.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 10.972 7.028 -19.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 10.468 8.525 -19.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 12.095 8.285 -19.360 1.00 0.00 H new ATOM 1399 N ASP A 48 10.644 14.050 -15.522 1.00 0.00 N ATOM 1400 CA ASP A 48 10.183 15.169 -16.326 1.00 0.00 C ATOM 1401 C ASP A 48 10.144 16.432 -15.463 1.00 0.00 C ATOM 1402 O ASP A 48 9.248 17.260 -15.611 1.00 0.00 O ATOM 1403 CB ASP A 48 8.771 14.918 -16.861 1.00 0.00 C ATOM 1404 CG ASP A 48 8.693 13.974 -18.063 1.00 0.00 C ATOM 1405 OD1 ASP A 48 8.241 12.826 -17.945 1.00 0.00 O ATOM 1406 OD2 ASP A 48 9.128 14.468 -19.172 1.00 0.00 O ATOM 0 H ASP A 48 10.057 13.833 -14.717 1.00 0.00 H new ATOM 0 HA ASP A 48 10.871 15.288 -17.163 1.00 0.00 H new ATOM 0 HB2 ASP A 48 8.161 14.508 -16.056 1.00 0.00 H new ATOM 0 HB3 ASP A 48 8.329 15.875 -17.140 1.00 0.00 H new ATOM 1412 N CYS A 49 11.127 16.537 -14.581 1.00 0.00 N ATOM 1413 CA CYS A 49 11.217 17.683 -13.694 1.00 0.00 C ATOM 1414 C CYS A 49 11.299 18.948 -14.551 1.00 0.00 C ATOM 1415 O CYS A 49 12.299 19.179 -15.228 1.00 0.00 O ATOM 1416 CB CYS A 49 12.403 17.566 -12.734 1.00 0.00 C ATOM 1417 SG CYS A 49 12.325 18.893 -11.477 1.00 0.00 S ATOM 0 H CYS A 49 11.868 15.846 -14.462 1.00 0.00 H new ATOM 0 HA CYS A 49 10.329 17.728 -13.064 1.00 0.00 H new ATOM 0 HB2 CYS A 49 12.392 16.591 -12.247 1.00 0.00 H new ATOM 0 HB3 CYS A 49 13.339 17.634 -13.289 1.00 0.00 H new ATOM 1422 N THR A 50 10.234 19.735 -14.493 1.00 0.00 N ATOM 1423 CA THR A 50 10.174 20.970 -15.255 1.00 0.00 C ATOM 1424 C THR A 50 10.938 22.081 -14.531 1.00 0.00 C ATOM 1425 O THR A 50 10.933 23.230 -14.971 1.00 0.00 O ATOM 1426 CB THR A 50 8.701 21.305 -15.498 1.00 0.00 C ATOM 1427 OG1 THR A 50 8.737 22.550 -16.189 1.00 0.00 O ATOM 1428 CG2 THR A 50 7.949 21.618 -14.203 1.00 0.00 C ATOM 0 H THR A 50 9.406 19.541 -13.930 1.00 0.00 H new ATOM 0 HA THR A 50 10.662 20.861 -16.224 1.00 0.00 H new ATOM 0 HB THR A 50 8.218 20.469 -16.004 1.00 0.00 H new ATOM 0 HG1 THR A 50 9.515 23.066 -15.892 1.00 0.00 H new ATOM 0 HG21 THR A 50 6.909 21.849 -14.433 1.00 0.00 H new ATOM 0 HG22 THR A 50 7.991 20.754 -13.540 1.00 0.00 H new ATOM 0 HG23 THR A 50 8.411 22.475 -13.712 1.00 0.00 H new ATOM 1436 N GLU A 51 11.575 21.700 -13.434 1.00 0.00 N ATOM 1437 CA GLU A 51 12.341 22.649 -12.646 1.00 0.00 C ATOM 1438 C GLU A 51 13.822 22.583 -13.026 1.00 0.00 C ATOM 1439 O GLU A 51 14.405 23.583 -13.441 1.00 0.00 O ATOM 1440 CB GLU A 51 12.148 22.401 -11.149 1.00 0.00 C ATOM 1441 CG GLU A 51 11.157 23.402 -10.549 1.00 0.00 C ATOM 1442 CD GLU A 51 11.865 24.696 -10.141 1.00 0.00 C ATOM 1443 OE1 GLU A 51 12.707 25.207 -10.896 1.00 0.00 O ATOM 1444 OE2 GLU A 51 11.512 25.173 -8.997 1.00 0.00 O ATOM 0 H GLU A 51 11.576 20.746 -13.072 1.00 0.00 H new ATOM 0 HA GLU A 51 11.974 23.652 -12.865 1.00 0.00 H new ATOM 0 HB2 GLU A 51 11.786 21.385 -10.989 1.00 0.00 H new ATOM 0 HB3 GLU A 51 13.107 22.482 -10.637 1.00 0.00 H new ATOM 0 HG2 GLU A 51 10.375 23.624 -11.275 1.00 0.00 H new ATOM 0 HG3 GLU A 51 10.669 22.960 -9.680 1.00 0.00 H new ATOM 1452 N ARG A 52 14.387 21.394 -12.870 1.00 0.00 N ATOM 1453 CA ARG A 52 15.788 21.184 -13.192 1.00 0.00 C ATOM 1454 C ARG A 52 16.679 21.932 -12.198 1.00 0.00 C ATOM 1455 O ARG A 52 17.218 22.991 -12.515 1.00 0.00 O ATOM 1456 CB ARG A 52 16.105 21.662 -14.610 1.00 0.00 C ATOM 1457 CG ARG A 52 16.339 20.478 -15.549 1.00 0.00 C ATOM 1458 CD ARG A 52 15.980 20.841 -16.991 1.00 0.00 C ATOM 1459 NE ARG A 52 16.142 19.659 -17.866 1.00 0.00 N ATOM 1460 CZ ARG A 52 16.368 19.726 -19.196 1.00 0.00 C ATOM 1461 NH1 ARG A 52 16.462 20.923 -19.814 1.00 0.00 N ATOM 1462 NH2 ARG A 52 16.497 18.606 -19.881 1.00 0.00 N ATOM 0 H ARG A 52 13.900 20.567 -12.525 1.00 0.00 H new ATOM 0 HA ARG A 52 15.986 20.114 -13.129 1.00 0.00 H new ATOM 0 HB2 ARG A 52 15.282 22.271 -14.985 1.00 0.00 H new ATOM 0 HB3 ARG A 52 16.990 22.298 -14.594 1.00 0.00 H new ATOM 0 HG2 ARG A 52 17.383 20.169 -15.497 1.00 0.00 H new ATOM 0 HG3 ARG A 52 15.739 19.628 -15.224 1.00 0.00 H new ATOM 0 HD2 ARG A 52 14.952 21.201 -17.039 1.00 0.00 H new ATOM 0 HD3 ARG A 52 16.619 21.652 -17.340 1.00 0.00 H new ATOM 0 HE ARG A 52 16.079 18.735 -17.438 1.00 0.00 H new ATOM 0 HH11 ARG A 52 16.362 21.784 -19.276 1.00 0.00 H new ATOM 0 HH12 ARG A 52 16.633 20.966 -20.819 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.426 17.706 -19.406 1.00 0.00 H new ATOM 0 HH22 ARG A 52 16.668 18.640 -20.886 1.00 0.00 H new ATOM 1475 N GLN A 53 16.806 21.351 -11.014 1.00 0.00 N ATOM 1476 CA GLN A 53 17.622 21.950 -9.971 1.00 0.00 C ATOM 1477 C GLN A 53 17.800 20.971 -8.808 1.00 0.00 C ATOM 1478 O GLN A 53 17.239 19.875 -8.823 1.00 0.00 O ATOM 1479 CB GLN A 53 17.017 23.269 -9.489 1.00 0.00 C ATOM 1480 CG GLN A 53 17.799 24.465 -10.037 1.00 0.00 C ATOM 1481 CD GLN A 53 17.724 25.655 -9.079 1.00 0.00 C ATOM 1482 OE1 GLN A 53 16.708 25.923 -8.459 1.00 0.00 O ATOM 1483 NE2 GLN A 53 18.853 26.352 -8.993 1.00 0.00 N ATOM 0 H GLN A 53 16.358 20.472 -10.754 1.00 0.00 H new ATOM 0 HA GLN A 53 18.604 22.171 -10.389 1.00 0.00 H new ATOM 0 HB2 GLN A 53 15.977 23.334 -9.808 1.00 0.00 H new ATOM 0 HB3 GLN A 53 17.019 23.297 -8.399 1.00 0.00 H new ATOM 0 HG2 GLN A 53 18.841 24.183 -10.191 1.00 0.00 H new ATOM 0 HG3 GLN A 53 17.399 24.751 -11.010 1.00 0.00 H new ATOM 0 HE21 GLN A 53 19.667 26.073 -9.540 1.00 0.00 H new ATOM 0 HE22 GLN A 53 18.905 27.166 -8.380 1.00 0.00 H new ATOM 1492 N ALA A 54 18.581 21.401 -7.828 1.00 0.00 N ATOM 1493 CA ALA A 54 18.839 20.576 -6.660 1.00 0.00 C ATOM 1494 C ALA A 54 19.071 21.477 -5.446 1.00 0.00 C ATOM 1495 O ALA A 54 19.463 22.633 -5.592 1.00 0.00 O ATOM 1496 CB ALA A 54 20.029 19.654 -6.938 1.00 0.00 C ATOM 0 H ALA A 54 19.044 22.310 -7.819 1.00 0.00 H new ATOM 0 HA ALA A 54 17.980 19.942 -6.441 1.00 0.00 H new ATOM 0 HB1 ALA A 54 20.222 19.035 -6.062 1.00 0.00 H new ATOM 0 HB2 ALA A 54 19.802 19.014 -7.791 1.00 0.00 H new ATOM 0 HB3 ALA A 54 20.911 20.255 -7.160 1.00 0.00 H new ATOM 1502 N ASN A 55 18.818 20.914 -4.274 1.00 0.00 N ATOM 1503 CA ASN A 55 18.993 21.652 -3.035 1.00 0.00 C ATOM 1504 C ASN A 55 19.877 20.842 -2.084 1.00 0.00 C ATOM 1505 O ASN A 55 21.096 20.807 -2.241 1.00 0.00 O ATOM 1506 CB ASN A 55 17.651 21.894 -2.343 1.00 0.00 C ATOM 1507 CG ASN A 55 17.831 22.734 -1.076 1.00 0.00 C ATOM 1508 OD1 ASN A 55 18.271 23.871 -1.111 1.00 0.00 O ATOM 1509 ND2 ASN A 55 17.466 22.112 0.042 1.00 0.00 N ATOM 0 H ASN A 55 18.493 19.954 -4.156 1.00 0.00 H new ATOM 0 HA ASN A 55 19.452 22.611 -3.276 1.00 0.00 H new ATOM 0 HB2 ASN A 55 16.971 22.402 -3.027 1.00 0.00 H new ATOM 0 HB3 ASN A 55 17.192 20.939 -2.088 1.00 0.00 H new ATOM 0 HD21 ASN A 55 17.547 22.588 0.940 1.00 0.00 H new ATOM 0 HD22 ASN A 55 17.105 21.159 0.001 1.00 0.00 H new TER 1516 ASN A 55 HETATM 1517 ZN ZN A 56 8.164 7.443 1.061 1.00 0.00 ZN HETATM 1518 ZN ZN A 57 10.290 18.616 -10.441 1.00 0.00 ZN