USER MOD reduce.3.24.130724 H: found=0, std=0, add=657, rem=0, adj=30 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= 1.2 K(o=1.6,f=-5.2!) USER MOD Set 1.2: B 212 G O2' : rot 113:sc= 0.425 USER MOD Set 2.1: A 14 LYS NZ :NH3+ 159:sc= 0 (180deg=0) USER MOD Set 2.2: A 46 MET CE :methyl -140:sc= 0 (180deg=-0.0202) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 150:sc= 0.0125 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= -0.0784 K(o=-0.078,f=-0.71) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= -15.3! C(o=-15!,f=-22!) USER MOD Single : A 9 GLN : amide:sc= -0.576 K(o=-0.58,f=1.4) USER MOD Single : A 11 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00404) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= 0.408 K(o=0.41,f=-5.7!) 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= -5.24 K(o=-5.2,f=-4.3!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ -115:sc= 0 (180deg=-0.139) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ -121:sc= -0.0139 (180deg=-0.879) USER MOD Single : A 45 GLN : amide:sc= -1.48 K(o=-1.5,f=-0.72) USER MOD Single : A 47 LYS NZ :NH3+ 153:sc= 1.19 (180deg=1.04) USER MOD Single : A 50 THR OG1 : rot -38:sc= 0.79 USER MOD Single : A 53 GLN : amide:sc= -1.11 K(o=-1.1,f=-0.55!) USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 201 G O2' : rot -27:sc= 0.466 USER MOD Single : B 202 G O2' : rot -15:sc= -0.513 USER MOD Single : B 203 A O2' : rot -9:sc= 0.375 USER MOD Single : B 204 C O2' : rot -91:sc= 1.16 USER MOD Single : B 205 U O2' : rot 1:sc= 0.159 USER MOD Single : B 206 A O2' : rot -150:sc= -1.37 USER MOD Single : B 207 G O2' : rot -86:sc= 0.622 USER MOD Single : B 208 C O2' : rot -97:sc= -0.539 USER MOD Single : B 209 G O2' : rot -29:sc= -0.806 USER MOD Single : B 210 G O2' : rot 180:sc= -1.74! USER MOD Single : B 211 A O2' : rot -50:sc= 0.899 USER MOD Single : B 213 G O2' : rot 6:sc= -1.32 USER MOD Single : B 214 C O2' : rot -1:sc= -0.357 USER MOD Single : B 215 U O2' : rot -84:sc= 0.776 USER MOD Single : B 216 A O2' : rot -146:sc= -0.293 USER MOD Single : B 217 G O2' : rot -24:sc= 0.548 USER MOD Single : B 218 U O2' : rot 8:sc= -0.793 USER MOD Single : B 219 C O2' : rot -25:sc= 0.552 USER MOD Single : B 220 C O2' : rot -25:sc= 0.461 USER MOD Single : B 220 C O3' : rot 180:sc= 0.435 USER MOD ----------------------------------------------------------------- ATOM 1 P G B 201 1.518 -18.861 -10.209 1.00 0.00 P ATOM 2 OP1 G B 201 0.503 -18.036 -10.902 1.00 0.00 O ATOM 3 OP2 G B 201 2.931 -18.687 -10.613 1.00 0.00 O ATOM 4 O5' G B 201 1.412 -18.561 -8.640 1.00 0.00 O ATOM 5 C5' G B 201 0.303 -17.823 -8.129 1.00 0.00 C ATOM 6 C4' G B 201 0.016 -18.238 -6.704 1.00 0.00 C ATOM 7 O4' G B 201 0.227 -19.601 -6.831 1.00 0.00 O ATOM 8 C3' G B 201 1.142 -17.936 -5.720 1.00 0.00 C ATOM 9 O3' G B 201 0.830 -16.750 -4.992 1.00 0.00 O ATOM 10 C2' G B 201 1.211 -19.135 -4.815 1.00 0.00 C ATOM 11 O2' G B 201 0.174 -18.889 -3.893 1.00 0.00 O ATOM 12 C1' G B 201 0.948 -20.259 -5.813 1.00 0.00 C ATOM 13 N9 G B 201 2.181 -20.875 -6.346 1.00 0.00 N ATOM 14 C8 G B 201 3.234 -20.247 -6.910 1.00 0.00 C ATOM 15 N7 G B 201 4.190 -21.088 -7.288 1.00 0.00 N ATOM 16 C5 G B 201 3.704 -22.319 -6.939 1.00 0.00 C ATOM 17 C6 G B 201 4.247 -23.613 -7.076 1.00 0.00 C ATOM 18 O6 G B 201 5.341 -23.877 -7.575 1.00 0.00 O ATOM 19 N1 G B 201 3.503 -24.658 -6.620 1.00 0.00 N ATOM 20 C2 G B 201 2.297 -24.397 -6.067 1.00 0.00 C ATOM 21 N2 G B 201 1.695 -25.517 -5.672 1.00 0.00 N ATOM 22 N3 G B 201 1.685 -23.212 -5.886 1.00 0.00 N ATOM 23 C4 G B 201 2.478 -22.213 -6.361 1.00 0.00 C ATOM 0 H5' G B 201 -0.576 -17.995 -8.750 1.00 0.00 H new ATOM 0 H5'' G B 201 0.517 -16.755 -8.169 1.00 0.00 H new ATOM 0 H4' G B 201 -0.921 -17.794 -6.366 1.00 0.00 H new ATOM 0 H3' G B 201 2.100 -17.764 -6.211 1.00 0.00 H new ATOM 0 H2' G B 201 2.114 -19.358 -4.246 1.00 0.00 H new ATOM 0 HO2' G B 201 0.028 -17.923 -3.815 1.00 0.00 H new ATOM 0 H1' G B 201 0.420 -21.096 -5.357 1.00 0.00 H new ATOM 0 H8 G B 201 3.293 -19.176 -7.040 1.00 0.00 H new ATOM 0 H1 G B 201 3.847 -25.615 -6.694 1.00 0.00 H new ATOM 0 H21 G B 201 0.774 -25.474 -5.235 1.00 0.00 H new ATOM 0 H22 G B 201 2.155 -26.418 -5.806 1.00 0.00 H new ATOM 35 P G B 202 2.004 -15.872 -4.351 1.00 0.00 P ATOM 36 OP1 G B 202 1.428 -14.862 -3.436 1.00 0.00 O ATOM 37 OP2 G B 202 2.906 -15.390 -5.421 1.00 0.00 O ATOM 38 O5' G B 202 2.809 -16.937 -3.469 1.00 0.00 O ATOM 39 C5' G B 202 2.604 -16.994 -2.059 1.00 0.00 C ATOM 40 C4' G B 202 3.527 -18.022 -1.442 1.00 0.00 C ATOM 41 O4' G B 202 3.601 -19.150 -2.220 1.00 0.00 O ATOM 42 C3' G B 202 5.007 -17.656 -1.501 1.00 0.00 C ATOM 43 O3' G B 202 5.331 -16.811 -0.399 1.00 0.00 O ATOM 44 C2' G B 202 5.742 -18.966 -1.427 1.00 0.00 C ATOM 45 O2' G B 202 5.759 -19.234 -0.043 1.00 0.00 O ATOM 46 C1' G B 202 4.822 -19.855 -2.258 1.00 0.00 C ATOM 47 N9 G B 202 5.284 -20.049 -3.647 1.00 0.00 N ATOM 48 C8 G B 202 5.251 -19.152 -4.655 1.00 0.00 C ATOM 49 N7 G B 202 5.745 -19.637 -5.789 1.00 0.00 N ATOM 50 C5 G B 202 6.110 -20.917 -5.469 1.00 0.00 C ATOM 51 C6 G B 202 6.694 -21.943 -6.240 1.00 0.00 C ATOM 52 O6 G B 202 7.000 -21.855 -7.429 1.00 0.00 O ATOM 53 N1 G B 202 6.942 -23.129 -5.621 1.00 0.00 N ATOM 54 C2 G B 202 6.616 -23.255 -4.315 1.00 0.00 C ATOM 55 N2 G B 202 6.917 -24.467 -3.856 1.00 0.00 N ATOM 56 N3 G B 202 6.059 -22.350 -3.488 1.00 0.00 N ATOM 57 C4 G B 202 5.838 -21.190 -4.166 1.00 0.00 C ATOM 0 H5' G B 202 1.566 -17.250 -1.844 1.00 0.00 H new ATOM 0 H5'' G B 202 2.789 -16.015 -1.617 1.00 0.00 H new ATOM 0 H4' G B 202 3.116 -18.119 -0.437 1.00 0.00 H new ATOM 0 H3' G B 202 5.274 -17.111 -2.406 1.00 0.00 H new ATOM 0 H2' G B 202 6.764 -19.059 -1.794 1.00 0.00 H new ATOM 0 HO2' G B 202 5.521 -18.422 0.450 1.00 0.00 H new ATOM 0 H1' G B 202 4.768 -20.870 -1.864 1.00 0.00 H new ATOM 0 H8 G B 202 4.865 -18.149 -4.551 1.00 0.00 H new ATOM 0 H1 G B 202 7.364 -23.905 -6.131 1.00 0.00 H new ATOM 0 H21 G B 202 6.726 -24.706 -2.883 1.00 0.00 H new ATOM 0 H22 G B 202 7.339 -25.157 -4.477 1.00 0.00 H new ATOM 69 P A B 203 6.787 -16.157 -0.293 1.00 0.00 P ATOM 70 OP1 A B 203 6.935 -15.479 1.013 1.00 0.00 O ATOM 71 OP2 A B 203 7.065 -15.361 -1.510 1.00 0.00 O ATOM 72 O5' A B 203 7.756 -17.430 -0.303 1.00 0.00 O ATOM 73 C5' A B 203 8.227 -17.976 0.927 1.00 0.00 C ATOM 74 C4' A B 203 9.636 -18.498 0.758 1.00 0.00 C ATOM 75 O4' A B 203 9.396 -19.329 -0.237 1.00 0.00 O ATOM 76 C3' A B 203 10.574 -17.550 0.018 1.00 0.00 C ATOM 77 O3' A B 203 11.382 -16.851 0.961 1.00 0.00 O ATOM 78 C2' A B 203 11.405 -18.431 -0.875 1.00 0.00 C ATOM 79 O2' A B 203 12.463 -18.820 -0.027 1.00 0.00 O ATOM 80 C1' A B 203 10.397 -19.527 -1.210 1.00 0.00 C ATOM 81 N9 A B 203 9.843 -19.419 -2.576 1.00 0.00 N ATOM 82 C8 A B 203 8.900 -18.558 -3.012 1.00 0.00 C ATOM 83 N7 A B 203 8.618 -18.716 -4.301 1.00 0.00 N ATOM 84 C5 A B 203 9.437 -19.740 -4.694 1.00 0.00 C ATOM 85 C6 A B 203 9.609 -20.374 -5.943 1.00 0.00 C ATOM 86 N6 A B 203 8.929 -20.046 -7.072 1.00 0.00 N ATOM 87 N1 A B 203 10.520 -21.382 -6.014 1.00 0.00 N ATOM 88 C2 A B 203 11.201 -21.716 -4.894 1.00 0.00 C ATOM 89 N3 A B 203 11.119 -21.185 -3.661 1.00 0.00 N ATOM 90 C4 A B 203 10.194 -20.185 -3.657 1.00 0.00 C ATOM 0 H5' A B 203 7.569 -18.782 1.252 1.00 0.00 H new ATOM 0 H5'' A B 203 8.204 -17.213 1.705 1.00 0.00 H new ATOM 0 H4' A B 203 10.061 -18.785 1.720 1.00 0.00 H new ATOM 0 H3' A B 203 10.044 -16.796 -0.564 1.00 0.00 H new ATOM 0 H2' A B 203 11.842 -18.045 -1.796 1.00 0.00 H new ATOM 0 HO2' A B 203 12.419 -18.308 0.807 1.00 0.00 H new ATOM 0 H1' A B 203 10.849 -20.519 -1.194 1.00 0.00 H new ATOM 0 H8 A B 203 8.426 -17.820 -2.382 1.00 0.00 H new ATOM 0 H61 A B 203 9.108 -20.551 -7.940 1.00 0.00 H new ATOM 0 H62 A B 203 8.239 -19.295 -7.052 1.00 0.00 H new ATOM 0 H2 A B 203 11.910 -22.523 -5.006 1.00 0.00 H new ATOM 102 P C B 204 11.979 -15.413 0.593 1.00 0.00 P ATOM 103 OP1 C B 204 12.638 -14.826 1.781 1.00 0.00 O ATOM 104 OP2 C B 204 10.941 -14.601 -0.083 1.00 0.00 O ATOM 105 O5' C B 204 13.114 -15.758 -0.481 1.00 0.00 O ATOM 106 C5' C B 204 14.340 -16.349 -0.058 1.00 0.00 C ATOM 107 C4' C B 204 15.081 -16.918 -1.247 1.00 0.00 C ATOM 108 O4' C B 204 14.217 -17.714 -1.964 1.00 0.00 O ATOM 109 C3' C B 204 15.330 -15.917 -2.371 1.00 0.00 C ATOM 110 O3' C B 204 16.517 -15.178 -2.093 1.00 0.00 O ATOM 111 C2' C B 204 15.477 -16.747 -3.616 1.00 0.00 C ATOM 112 O2' C B 204 16.825 -17.155 -3.560 1.00 0.00 O ATOM 113 C1' C B 204 14.449 -17.843 -3.349 1.00 0.00 C ATOM 114 N1 C B 204 13.197 -17.678 -4.118 1.00 0.00 N ATOM 115 C2 C B 204 13.046 -18.434 -5.279 1.00 0.00 C ATOM 116 O2 C B 204 13.957 -19.201 -5.609 1.00 0.00 O ATOM 117 N3 C B 204 11.916 -18.301 -5.996 1.00 0.00 N ATOM 118 C4 C B 204 10.953 -17.478 -5.629 1.00 0.00 C ATOM 119 N4 C B 204 9.846 -17.361 -6.350 1.00 0.00 N ATOM 120 C5 C B 204 11.086 -16.683 -4.430 1.00 0.00 C ATOM 121 C6 C B 204 12.218 -16.827 -3.726 1.00 0.00 C ATOM 0 H5' C B 204 14.141 -17.138 0.668 1.00 0.00 H new ATOM 0 H5'' C B 204 14.958 -15.604 0.443 1.00 0.00 H new ATOM 0 H4' C B 204 15.980 -17.346 -0.803 1.00 0.00 H new ATOM 0 H3' C B 204 14.524 -15.192 -2.480 1.00 0.00 H new ATOM 0 H2' C B 204 15.302 -16.316 -4.602 1.00 0.00 H new ATOM 0 HO2' C B 204 17.383 -16.507 -4.038 1.00 0.00 H new ATOM 0 H1' C B 204 14.809 -18.825 -3.655 1.00 0.00 H new ATOM 0 H41 C B 204 9.110 -16.720 -6.054 1.00 0.00 H new ATOM 0 H42 C B 204 9.731 -17.912 -7.201 1.00 0.00 H new ATOM 0 H5 C B 204 10.308 -16.003 -4.115 1.00 0.00 H new ATOM 0 H6 C B 204 12.353 -16.250 -2.823 1.00 0.00 H new ATOM 133 P U B 205 16.532 -13.588 -2.278 1.00 0.00 P ATOM 134 OP1 U B 205 16.943 -12.943 -1.011 1.00 0.00 O ATOM 135 OP2 U B 205 15.258 -13.146 -2.887 1.00 0.00 O ATOM 136 O5' U B 205 17.697 -13.361 -3.350 1.00 0.00 O ATOM 137 C5' U B 205 18.896 -14.132 -3.275 1.00 0.00 C ATOM 138 C4' U B 205 19.321 -14.567 -4.658 1.00 0.00 C ATOM 139 O4' U B 205 18.099 -15.120 -4.933 1.00 0.00 O ATOM 140 C3' U B 205 19.198 -13.484 -5.726 1.00 0.00 C ATOM 141 O3' U B 205 20.481 -12.909 -5.968 1.00 0.00 O ATOM 142 C2' U B 205 18.670 -14.186 -6.946 1.00 0.00 C ATOM 143 O2' U B 205 19.844 -14.675 -7.555 1.00 0.00 O ATOM 144 C1' U B 205 17.777 -15.243 -6.301 1.00 0.00 C ATOM 145 N1 U B 205 16.335 -15.017 -6.532 1.00 0.00 N ATOM 146 C2 U B 205 15.782 -15.679 -7.586 1.00 0.00 C ATOM 147 O2 U B 205 16.409 -16.425 -8.321 1.00 0.00 O ATOM 148 N3 U B 205 14.439 -15.470 -7.803 1.00 0.00 N ATOM 149 C4 U B 205 13.663 -14.648 -7.026 1.00 0.00 C ATOM 150 O4 U B 205 12.472 -14.536 -7.314 1.00 0.00 O ATOM 151 C5 U B 205 14.289 -13.982 -5.939 1.00 0.00 C ATOM 152 C6 U B 205 15.592 -14.198 -5.747 1.00 0.00 C ATOM 0 H5' U B 205 18.737 -15.006 -2.643 1.00 0.00 H new ATOM 0 H5'' U B 205 19.688 -13.544 -2.811 1.00 0.00 H new ATOM 0 H4' U B 205 20.306 -15.033 -4.670 1.00 0.00 H new ATOM 0 H3' U B 205 18.536 -12.670 -5.430 1.00 0.00 H new ATOM 0 H2' U B 205 18.104 -13.645 -7.704 1.00 0.00 H new ATOM 0 HO2' U B 205 20.621 -14.432 -7.009 1.00 0.00 H new ATOM 0 H1' U B 205 17.950 -16.235 -6.717 1.00 0.00 H new ATOM 0 H3 U B 205 13.996 -15.953 -8.585 1.00 0.00 H new ATOM 0 H5 U B 205 13.730 -13.324 -5.290 1.00 0.00 H new ATOM 0 H6 U B 205 16.079 -13.695 -4.925 1.00 0.00 H new ATOM 163 P A B 206 20.696 -11.333 -5.793 1.00 0.00 P ATOM 164 OP1 A B 206 22.095 -11.063 -5.387 1.00 0.00 O ATOM 165 OP2 A B 206 19.620 -10.774 -4.944 1.00 0.00 O ATOM 166 O5' A B 206 20.495 -10.775 -7.278 1.00 0.00 O ATOM 167 C5' A B 206 20.850 -11.584 -8.398 1.00 0.00 C ATOM 168 C4' A B 206 19.763 -11.524 -9.446 1.00 0.00 C ATOM 169 O4' A B 206 18.743 -12.106 -9.560 1.00 0.00 O ATOM 170 C3' A B 206 19.410 -10.115 -9.910 1.00 0.00 C ATOM 171 O3' A B 206 20.541 -9.531 -10.553 1.00 0.00 O ATOM 172 C2' A B 206 18.260 -10.287 -10.865 1.00 0.00 C ATOM 173 O2' A B 206 18.895 -10.253 -12.123 1.00 0.00 O ATOM 174 C1' A B 206 17.734 -11.651 -10.431 1.00 0.00 C ATOM 175 N9 A B 206 16.424 -11.587 -9.746 1.00 0.00 N ATOM 176 C8 A B 206 16.189 -11.263 -8.458 1.00 0.00 C ATOM 177 N7 A B 206 14.898 -11.298 -8.148 1.00 0.00 N ATOM 178 C5 A B 206 14.290 -11.668 -9.317 1.00 0.00 C ATOM 179 C6 A B 206 12.932 -11.879 -9.638 1.00 0.00 C ATOM 180 N6 A B 206 11.903 -11.738 -8.762 1.00 0.00 N ATOM 181 N1 A B 206 12.640 -12.248 -10.915 1.00 0.00 N ATOM 182 C2 A B 206 13.657 -12.390 -11.794 1.00 0.00 C ATOM 183 N3 A B 206 14.978 -12.217 -11.598 1.00 0.00 N ATOM 184 C4 A B 206 15.203 -11.850 -10.306 1.00 0.00 C ATOM 0 H5' A B 206 21.002 -12.615 -8.078 1.00 0.00 H new ATOM 0 H5'' A B 206 21.794 -11.239 -8.821 1.00 0.00 H new ATOM 0 H4' A B 206 20.429 -12.215 -9.963 1.00 0.00 H new ATOM 0 H3' A B 206 19.136 -9.453 -9.088 1.00 0.00 H new ATOM 0 H2' A B 206 17.438 -9.572 -10.890 1.00 0.00 H new ATOM 0 HO2' A B 206 18.277 -9.892 -12.792 1.00 0.00 H new ATOM 0 H1' A B 206 17.546 -12.307 -11.281 1.00 0.00 H new ATOM 0 H8 A B 206 16.966 -11.003 -7.755 1.00 0.00 H new ATOM 0 H61 A B 206 10.945 -11.908 -9.069 1.00 0.00 H new ATOM 0 H62 A B 206 12.088 -11.462 -7.798 1.00 0.00 H new ATOM 0 H2 A B 206 13.370 -12.683 -12.793 1.00 0.00 H new ATOM 196 P G B 207 20.953 -8.018 -10.229 1.00 0.00 P ATOM 197 OP1 G B 207 22.360 -7.790 -10.625 1.00 0.00 O ATOM 198 OP2 G B 207 20.572 -7.686 -8.839 1.00 0.00 O ATOM 199 O5' G B 207 20.018 -7.172 -11.213 1.00 0.00 O ATOM 200 C5' G B 207 19.843 -7.590 -12.566 1.00 0.00 C ATOM 201 C4' G B 207 18.376 -7.568 -12.931 1.00 0.00 C ATOM 202 O4' G B 207 17.398 -8.328 -12.566 1.00 0.00 O ATOM 203 C3' G B 207 17.690 -6.224 -12.701 1.00 0.00 C ATOM 204 O3' G B 207 18.346 -5.218 -13.470 1.00 0.00 O ATOM 205 C2' G B 207 16.269 -6.422 -13.150 1.00 0.00 C ATOM 206 O2' G B 207 16.322 -6.069 -14.513 1.00 0.00 O ATOM 207 C1' G B 207 16.085 -7.909 -12.864 1.00 0.00 C ATOM 208 N9 G B 207 15.168 -8.186 -11.738 1.00 0.00 N ATOM 209 C8 G B 207 15.450 -8.133 -10.420 1.00 0.00 C ATOM 210 N7 G B 207 14.404 -8.437 -9.658 1.00 0.00 N ATOM 211 C5 G B 207 13.406 -8.695 -10.560 1.00 0.00 C ATOM 212 C6 G B 207 12.059 -9.070 -10.379 1.00 0.00 C ATOM 213 O6 G B 207 11.506 -9.244 -9.294 1.00 0.00 O ATOM 214 N1 G B 207 11.305 -9.256 -11.497 1.00 0.00 N ATOM 215 C2 G B 207 11.885 -9.072 -12.704 1.00 0.00 C ATOM 216 N2 G B 207 11.023 -9.290 -13.694 1.00 0.00 N ATOM 217 N3 G B 207 13.152 -8.717 -12.992 1.00 0.00 N ATOM 218 C4 G B 207 13.850 -8.547 -11.835 1.00 0.00 C ATOM 0 H5' G B 207 20.244 -8.595 -12.699 1.00 0.00 H new ATOM 0 H5'' G B 207 20.402 -6.933 -13.233 1.00 0.00 H new ATOM 0 H4' G B 207 18.712 -7.962 -13.890 1.00 0.00 H new ATOM 0 H3' G B 207 17.728 -5.901 -11.661 1.00 0.00 H new ATOM 0 H2' G B 207 15.453 -5.861 -12.695 1.00 0.00 H new ATOM 0 HO2' G B 207 16.211 -5.100 -14.604 1.00 0.00 H new ATOM 0 H1' G B 207 15.625 -8.432 -13.702 1.00 0.00 H new ATOM 0 H8 G B 207 16.421 -7.872 -10.026 1.00 0.00 H new ATOM 0 H1 G B 207 10.325 -9.528 -11.426 1.00 0.00 H new ATOM 0 H21 G B 207 11.323 -9.188 -14.663 1.00 0.00 H new ATOM 0 H22 G B 207 10.062 -9.559 -13.483 1.00 0.00 H new ATOM 230 P C B 208 19.016 -3.963 -12.739 1.00 0.00 P ATOM 231 OP1 C B 208 20.245 -3.564 -13.461 1.00 0.00 O ATOM 232 OP2 C B 208 19.134 -4.234 -11.289 1.00 0.00 O ATOM 233 O5' C B 208 17.929 -2.807 -12.939 1.00 0.00 O ATOM 234 C5' C B 208 17.825 -2.133 -14.191 1.00 0.00 C ATOM 235 C4' C B 208 16.410 -2.222 -14.714 1.00 0.00 C ATOM 236 O4' C B 208 15.858 -3.199 -14.247 1.00 0.00 O ATOM 237 C3' C B 208 15.486 -1.111 -14.227 1.00 0.00 C ATOM 238 O3' C B 208 15.557 -0.006 -15.125 1.00 0.00 O ATOM 239 C2' C B 208 14.111 -1.719 -14.206 1.00 0.00 C ATOM 240 O2' C B 208 13.574 -1.311 -15.445 1.00 0.00 O ATOM 241 C1' C B 208 14.456 -3.201 -14.098 1.00 0.00 C ATOM 242 N1 C B 208 14.057 -3.806 -12.810 1.00 0.00 N ATOM 243 C2 C B 208 12.820 -4.447 -12.751 1.00 0.00 C ATOM 244 O2 C B 208 12.121 -4.478 -13.770 1.00 0.00 O ATOM 245 N3 C B 208 12.434 -5.005 -11.591 1.00 0.00 N ATOM 246 C4 C B 208 13.193 -4.963 -10.513 1.00 0.00 C ATOM 247 N4 C B 208 12.794 -5.520 -9.377 1.00 0.00 N ATOM 248 C5 C B 208 14.479 -4.305 -10.548 1.00 0.00 C ATOM 249 C6 C B 208 14.849 -3.753 -11.712 1.00 0.00 C ATOM 0 H5' C B 208 18.515 -2.576 -14.909 1.00 0.00 H new ATOM 0 H5'' C B 208 18.113 -1.088 -14.075 1.00 0.00 H new ATOM 0 H4' C B 208 16.538 -2.205 -15.796 1.00 0.00 H new ATOM 0 H3' C B 208 15.759 -0.734 -13.241 1.00 0.00 H new ATOM 0 H2' C B 208 13.393 -1.456 -13.429 1.00 0.00 H new ATOM 0 HO2' C B 208 13.028 -0.507 -15.316 1.00 0.00 H new ATOM 0 H1' C B 208 13.926 -3.801 -14.838 1.00 0.00 H new ATOM 0 H41 C B 208 13.392 -5.479 -8.552 1.00 0.00 H new ATOM 0 H42 C B 208 11.889 -5.989 -9.329 1.00 0.00 H new ATOM 0 H5 C B 208 15.114 -4.260 -9.675 1.00 0.00 H new ATOM 0 H6 C B 208 15.804 -3.253 -11.776 1.00 0.00 H new ATOM 261 P G B 209 14.668 1.298 -14.860 1.00 0.00 P ATOM 262 OP1 G B 209 15.437 2.508 -15.228 1.00 0.00 O ATOM 263 OP2 G B 209 14.094 1.242 -13.498 1.00 0.00 O ATOM 264 O5' G B 209 13.471 1.136 -15.908 1.00 0.00 O ATOM 265 C5' G B 209 12.246 1.838 -15.706 1.00 0.00 C ATOM 266 C4' G B 209 11.504 1.259 -14.523 1.00 0.00 C ATOM 267 O4' G B 209 11.562 0.137 -13.687 1.00 0.00 O ATOM 268 C3' G B 209 11.279 2.243 -13.378 1.00 0.00 C ATOM 269 O3' G B 209 10.803 3.480 -13.903 1.00 0.00 O ATOM 270 C2' G B 209 10.256 1.590 -12.490 1.00 0.00 C ATOM 271 O2' G B 209 9.042 1.895 -13.139 1.00 0.00 O ATOM 272 C1' G B 209 10.697 0.131 -12.574 1.00 0.00 C ATOM 273 N9 G B 209 11.392 -0.346 -11.359 1.00 0.00 N ATOM 274 C8 G B 209 12.649 -0.054 -10.967 1.00 0.00 C ATOM 275 N7 G B 209 12.979 -0.643 -9.822 1.00 0.00 N ATOM 276 C5 G B 209 11.856 -1.347 -9.479 1.00 0.00 C ATOM 277 C6 G B 209 11.574 -2.176 -8.373 1.00 0.00 C ATOM 278 O6 G B 209 12.352 -2.427 -7.454 1.00 0.00 O ATOM 279 N1 G B 209 10.338 -2.745 -8.315 1.00 0.00 N ATOM 280 C2 G B 209 9.462 -2.485 -9.312 1.00 0.00 C ATOM 281 N2 G B 209 8.304 -3.111 -9.112 1.00 0.00 N ATOM 282 N3 G B 209 9.623 -1.717 -10.406 1.00 0.00 N ATOM 283 C4 G B 209 10.874 -1.180 -10.403 1.00 0.00 C ATOM 0 H5' G B 209 11.628 1.771 -16.601 1.00 0.00 H new ATOM 0 H5'' G B 209 12.448 2.896 -15.536 1.00 0.00 H new ATOM 0 H4' G B 209 10.921 0.916 -15.378 1.00 0.00 H new ATOM 0 H3' G B 209 12.190 2.465 -12.823 1.00 0.00 H new ATOM 0 H2' G B 209 10.154 1.879 -11.444 1.00 0.00 H new ATOM 0 HO2' G B 209 9.135 2.741 -13.625 1.00 0.00 H new ATOM 0 H1' G B 209 9.850 -0.549 -12.667 1.00 0.00 H new ATOM 0 H8 G B 209 13.315 0.589 -11.523 1.00 0.00 H new ATOM 0 H1 G B 209 10.079 -3.353 -7.538 1.00 0.00 H new ATOM 0 H21 G B 209 7.545 -3.007 -9.786 1.00 0.00 H new ATOM 0 H22 G B 209 8.176 -3.694 -8.285 1.00 0.00 H new ATOM 295 P G B 210 11.741 4.776 -13.870 1.00 0.00 P ATOM 296 OP1 G B 210 12.136 5.139 -15.250 1.00 0.00 O ATOM 297 OP2 G B 210 12.823 4.584 -12.878 1.00 0.00 O ATOM 298 O5' G B 210 10.762 5.916 -13.321 1.00 0.00 O ATOM 299 C5' G B 210 10.569 6.073 -11.916 1.00 0.00 C ATOM 300 C4' G B 210 9.099 5.971 -11.579 1.00 0.00 C ATOM 301 O4' G B 210 8.771 6.523 -10.709 1.00 0.00 O ATOM 302 C3' G B 210 8.162 6.345 -12.725 1.00 0.00 C ATOM 303 O3' G B 210 7.319 5.235 -13.029 1.00 0.00 O ATOM 304 C2' G B 210 7.370 7.519 -12.223 1.00 0.00 C ATOM 305 O2' G B 210 6.037 7.092 -12.397 1.00 0.00 O ATOM 306 C1' G B 210 7.851 7.590 -10.777 1.00 0.00 C ATOM 307 N9 G B 210 8.496 8.874 -10.432 1.00 0.00 N ATOM 308 C8 G B 210 9.627 9.390 -10.958 1.00 0.00 C ATOM 309 N7 G B 210 9.945 10.569 -10.433 1.00 0.00 N ATOM 310 C5 G B 210 8.949 10.802 -9.523 1.00 0.00 C ATOM 311 C6 G B 210 8.721 11.884 -8.645 1.00 0.00 C ATOM 312 O6 G B 210 9.433 12.880 -8.540 1.00 0.00 O ATOM 313 N1 G B 210 7.619 11.820 -7.848 1.00 0.00 N ATOM 314 C2 G B 210 6.816 10.736 -7.941 1.00 0.00 C ATOM 315 N2 G B 210 5.787 10.823 -7.102 1.00 0.00 N ATOM 316 N3 G B 210 6.937 9.656 -8.736 1.00 0.00 N ATOM 317 C4 G B 210 8.054 9.781 -9.505 1.00 0.00 C ATOM 0 H5' G B 210 10.958 7.039 -11.593 1.00 0.00 H new ATOM 0 H5'' G B 210 11.128 5.308 -11.377 1.00 0.00 H new ATOM 0 H4' G B 210 9.027 4.906 -11.360 1.00 0.00 H new ATOM 0 H3' G B 210 8.693 6.599 -13.642 1.00 0.00 H new ATOM 0 H2' G B 210 7.467 8.501 -12.687 1.00 0.00 H new ATOM 0 HO2' G B 210 5.426 7.796 -12.094 1.00 0.00 H new ATOM 0 H1' G B 210 7.027 7.520 -10.067 1.00 0.00 H new ATOM 0 H8 G B 210 10.210 8.898 -11.722 1.00 0.00 H new ATOM 0 H1 G B 210 7.404 12.573 -7.195 1.00 0.00 H new ATOM 0 H21 G B 210 5.096 10.074 -7.063 1.00 0.00 H new ATOM 0 H22 G B 210 5.689 11.639 -6.498 1.00 0.00 H new ATOM 329 P A B 211 6.525 4.489 -11.856 1.00 0.00 P ATOM 330 OP1 A B 211 5.106 4.325 -12.243 1.00 0.00 O ATOM 331 OP2 A B 211 6.808 5.151 -10.562 1.00 0.00 O ATOM 332 O5' A B 211 7.201 3.040 -11.828 1.00 0.00 O ATOM 333 C5' A B 211 7.823 2.565 -10.637 1.00 0.00 C ATOM 334 C4' A B 211 6.772 2.148 -9.633 1.00 0.00 C ATOM 335 O4' A B 211 6.355 2.567 -8.439 1.00 0.00 O ATOM 336 C3' A B 211 5.506 1.564 -10.252 1.00 0.00 C ATOM 337 O3' A B 211 5.496 0.150 -10.067 1.00 0.00 O ATOM 338 C2' A B 211 4.367 2.224 -9.524 1.00 0.00 C ATOM 339 O2' A B 211 3.346 1.254 -9.602 1.00 0.00 O ATOM 340 C1' A B 211 4.986 2.413 -8.142 1.00 0.00 C ATOM 341 N9 A B 211 4.461 3.590 -7.418 1.00 0.00 N ATOM 342 C8 A B 211 4.550 4.886 -7.786 1.00 0.00 C ATOM 343 N7 A B 211 3.974 5.707 -6.915 1.00 0.00 N ATOM 344 C5 A B 211 3.496 4.871 -5.942 1.00 0.00 C ATOM 345 C6 A B 211 2.789 5.134 -4.749 1.00 0.00 C ATOM 346 N6 A B 211 2.429 6.373 -4.325 1.00 0.00 N ATOM 347 N1 A B 211 2.445 4.067 -3.977 1.00 0.00 N ATOM 348 C2 A B 211 2.800 2.830 -4.392 1.00 0.00 C ATOM 349 N3 A B 211 3.469 2.466 -5.502 1.00 0.00 N ATOM 350 C4 A B 211 3.781 3.574 -6.229 1.00 0.00 C ATOM 0 H5' A B 211 8.455 3.345 -10.211 1.00 0.00 H new ATOM 0 H5'' A B 211 8.472 1.720 -10.868 1.00 0.00 H new ATOM 0 H4' A B 211 7.705 1.716 -9.271 1.00 0.00 H new ATOM 0 H3' A B 211 5.437 1.743 -11.325 1.00 0.00 H new ATOM 0 H2' A B 211 3.952 3.171 -9.870 1.00 0.00 H new ATOM 0 HO2' A B 211 3.248 0.956 -10.531 1.00 0.00 H new ATOM 0 H1' A B 211 4.762 1.581 -7.475 1.00 0.00 H new ATOM 0 H8 A B 211 5.037 5.219 -8.691 1.00 0.00 H new ATOM 0 H61 A B 211 1.918 6.484 -3.449 1.00 0.00 H new ATOM 0 H62 A B 211 2.670 7.193 -4.882 1.00 0.00 H new ATOM 0 H2 A B 211 2.505 2.020 -3.741 1.00 0.00 H new ATOM 362 P G B 212 4.858 -0.799 -11.186 1.00 0.00 P ATOM 363 OP1 G B 212 5.858 -1.066 -12.243 1.00 0.00 O ATOM 364 OP2 G B 212 3.546 -0.259 -11.608 1.00 0.00 O ATOM 365 O5' G B 212 4.598 -2.165 -10.393 1.00 0.00 O ATOM 366 C5' G B 212 4.338 -2.137 -8.992 1.00 0.00 C ATOM 367 C4' G B 212 5.430 -2.870 -8.247 1.00 0.00 C ATOM 368 O4' G B 212 6.128 -2.094 -7.891 1.00 0.00 O ATOM 369 C3' G B 212 4.950 -3.638 -7.019 1.00 0.00 C ATOM 370 O3' G B 212 5.107 -5.037 -7.243 1.00 0.00 O ATOM 371 C2' G B 212 5.817 -3.160 -5.887 1.00 0.00 C ATOM 372 O2' G B 212 6.423 -4.351 -5.436 1.00 0.00 O ATOM 373 C1' G B 212 6.739 -2.193 -6.624 1.00 0.00 C ATOM 374 N9 G B 212 6.844 -0.868 -5.976 1.00 0.00 N ATOM 375 C8 G B 212 5.852 -0.157 -5.402 1.00 0.00 C ATOM 376 N7 G B 212 6.273 1.002 -4.907 1.00 0.00 N ATOM 377 C5 G B 212 7.613 1.013 -5.190 1.00 0.00 C ATOM 378 C6 G B 212 8.617 1.968 -4.922 1.00 0.00 C ATOM 379 O6 G B 212 8.446 3.039 -4.343 1.00 0.00 O ATOM 380 N1 G B 212 9.880 1.681 -5.339 1.00 0.00 N ATOM 381 C2 G B 212 10.099 0.511 -5.979 1.00 0.00 C ATOM 382 N2 G B 212 11.377 0.377 -6.321 1.00 0.00 N ATOM 383 N3 G B 212 9.224 -0.467 -6.285 1.00 0.00 N ATOM 384 C4 G B 212 7.983 -0.119 -5.842 1.00 0.00 C ATOM 0 H5' G B 212 3.372 -2.598 -8.784 1.00 0.00 H new ATOM 0 H5'' G B 212 4.280 -1.105 -8.645 1.00 0.00 H new ATOM 0 H4' G B 212 5.863 -3.604 -8.927 1.00 0.00 H new ATOM 0 H3' G B 212 3.896 -3.469 -6.799 1.00 0.00 H new ATOM 0 H2' G B 212 5.384 -2.660 -5.021 1.00 0.00 H new ATOM 0 HO2' G B 212 7.384 -4.320 -5.624 1.00 0.00 H new ATOM 0 H1' G B 212 7.769 -2.548 -6.648 1.00 0.00 H new ATOM 0 H8 G B 212 4.827 -0.493 -5.350 1.00 0.00 H new ATOM 0 H1 G B 212 10.645 2.335 -5.172 1.00 0.00 H new ATOM 0 H21 G B 212 11.688 -0.461 -6.812 1.00 0.00 H new ATOM 0 H22 G B 212 12.046 1.112 -6.092 1.00 0.00 H new ATOM 396 P G B 213 3.936 -6.049 -6.835 1.00 0.00 P ATOM 397 OP1 G B 213 3.077 -5.427 -5.803 1.00 0.00 O ATOM 398 OP2 G B 213 4.511 -7.380 -6.533 1.00 0.00 O ATOM 399 O5' G B 213 3.082 -6.173 -8.182 1.00 0.00 O ATOM 400 C5' G B 213 2.997 -5.067 -9.077 1.00 0.00 C ATOM 401 C4' G B 213 2.699 -5.552 -10.477 1.00 0.00 C ATOM 402 O4' G B 213 3.546 -4.849 -11.218 1.00 0.00 O ATOM 403 C3' G B 213 3.088 -7.005 -10.736 1.00 0.00 C ATOM 404 O3' G B 213 1.909 -7.786 -10.923 1.00 0.00 O ATOM 405 C2' G B 213 3.932 -6.975 -11.980 1.00 0.00 C ATOM 406 O2' G B 213 2.977 -7.123 -13.007 1.00 0.00 O ATOM 407 C1' G B 213 4.558 -5.588 -11.865 1.00 0.00 C ATOM 408 N9 G B 213 5.813 -5.570 -11.085 1.00 0.00 N ATOM 409 C8 G B 213 5.967 -5.853 -9.774 1.00 0.00 C ATOM 410 N7 G B 213 7.229 -5.747 -9.371 1.00 0.00 N ATOM 411 C5 G B 213 7.905 -5.375 -10.502 1.00 0.00 C ATOM 412 C6 G B 213 9.270 -5.104 -10.728 1.00 0.00 C ATOM 413 O6 G B 213 10.158 -5.161 -9.879 1.00 0.00 O ATOM 414 N1 G B 213 9.639 -4.750 -11.990 1.00 0.00 N ATOM 415 C2 G B 213 8.684 -4.678 -12.944 1.00 0.00 C ATOM 416 N2 G B 213 9.199 -4.322 -14.118 1.00 0.00 N ATOM 417 N3 G B 213 7.362 -4.912 -12.842 1.00 0.00 N ATOM 418 C4 G B 213 7.060 -5.261 -11.560 1.00 0.00 C ATOM 0 H5' G B 213 3.934 -4.510 -9.069 1.00 0.00 H new ATOM 0 H5'' G B 213 2.216 -4.382 -8.747 1.00 0.00 H new ATOM 0 H4' G B 213 1.631 -5.453 -10.671 1.00 0.00 H new ATOM 0 H3' G B 213 3.635 -7.452 -9.906 1.00 0.00 H new ATOM 0 H2' G B 213 4.715 -7.716 -12.145 1.00 0.00 H new ATOM 0 HO2' G B 213 2.076 -7.104 -12.621 1.00 0.00 H new ATOM 0 H1' G B 213 4.855 -5.191 -12.836 1.00 0.00 H new ATOM 0 H8 G B 213 5.153 -6.135 -9.123 1.00 0.00 H new ATOM 0 H1 G B 213 10.613 -4.544 -12.210 1.00 0.00 H new ATOM 0 H21 G B 213 8.593 -4.227 -14.933 1.00 0.00 H new ATOM 0 H22 G B 213 10.200 -4.144 -14.203 1.00 0.00 H new ATOM 430 P C B 214 1.931 -9.354 -10.611 1.00 0.00 P ATOM 431 OP1 C B 214 0.576 -9.918 -10.796 1.00 0.00 O ATOM 432 OP2 C B 214 2.600 -9.596 -9.313 1.00 0.00 O ATOM 433 O5' C B 214 2.871 -9.937 -11.767 1.00 0.00 O ATOM 434 C5' C B 214 2.436 -9.901 -13.126 1.00 0.00 C ATOM 435 C4' C B 214 3.629 -9.934 -14.053 1.00 0.00 C ATOM 436 O4' C B 214 4.571 -9.013 -14.045 1.00 0.00 O ATOM 437 C3' C B 214 4.447 -11.221 -13.983 1.00 0.00 C ATOM 438 O3' C B 214 3.781 -12.247 -14.716 1.00 0.00 O ATOM 439 C2' C B 214 5.777 -10.881 -14.595 1.00 0.00 C ATOM 440 O2' C B 214 5.551 -11.102 -15.969 1.00 0.00 O ATOM 441 C1' C B 214 5.915 -9.419 -14.181 1.00 0.00 C ATOM 442 N1 C B 214 6.660 -9.231 -12.919 1.00 0.00 N ATOM 443 C2 C B 214 7.973 -8.769 -13.004 1.00 0.00 C ATOM 444 O2 C B 214 8.448 -8.541 -14.122 1.00 0.00 O ATOM 445 N3 C B 214 8.672 -8.590 -11.869 1.00 0.00 N ATOM 446 C4 C B 214 8.149 -8.840 -10.685 1.00 0.00 C ATOM 447 N4 C B 214 8.855 -8.658 -9.577 1.00 0.00 N ATOM 448 C5 C B 214 6.791 -9.320 -10.569 1.00 0.00 C ATOM 449 C6 C B 214 6.107 -9.493 -11.710 1.00 0.00 C ATOM 0 H5' C B 214 1.851 -8.999 -13.305 1.00 0.00 H new ATOM 0 H5'' C B 214 1.783 -10.750 -13.330 1.00 0.00 H new ATOM 0 H4' C B 214 3.015 -9.771 -14.939 1.00 0.00 H new ATOM 0 H3' C B 214 4.571 -11.589 -12.965 1.00 0.00 H new ATOM 0 H2' C B 214 6.679 -11.425 -14.315 1.00 0.00 H new ATOM 0 HO2' C B 214 4.630 -11.410 -16.104 1.00 0.00 H new ATOM 0 H1' C B 214 6.489 -8.840 -14.905 1.00 0.00 H new ATOM 0 H41 C B 214 8.437 -8.856 -8.668 1.00 0.00 H new ATOM 0 H42 C B 214 9.816 -8.320 -9.634 1.00 0.00 H new ATOM 0 H5 C B 214 6.347 -9.530 -9.607 1.00 0.00 H new ATOM 0 H6 C B 214 5.089 -9.850 -11.664 1.00 0.00 H new ATOM 461 P U B 215 3.898 -13.772 -14.243 1.00 0.00 P ATOM 462 OP1 U B 215 2.920 -14.599 -14.985 1.00 0.00 O ATOM 463 OP2 U B 215 3.868 -13.840 -12.765 1.00 0.00 O ATOM 464 O5' U B 215 5.364 -14.187 -14.728 1.00 0.00 O ATOM 465 C5' U B 215 5.697 -14.143 -16.114 1.00 0.00 C ATOM 466 C4' U B 215 7.197 -14.056 -16.287 1.00 0.00 C ATOM 467 O4' U B 215 7.617 -13.238 -15.646 1.00 0.00 O ATOM 468 C3' U B 215 7.953 -15.315 -15.870 1.00 0.00 C ATOM 469 O3' U B 215 8.224 -16.109 -17.023 1.00 0.00 O ATOM 470 C2' U B 215 9.221 -14.821 -15.230 1.00 0.00 C ATOM 471 O2' U B 215 10.206 -15.191 -16.167 1.00 0.00 O ATOM 472 C1' U B 215 8.930 -13.326 -15.139 1.00 0.00 C ATOM 473 N1 U B 215 9.008 -12.793 -13.762 1.00 0.00 N ATOM 474 C2 U B 215 10.206 -12.268 -13.386 1.00 0.00 C ATOM 475 O2 U B 215 11.184 -12.222 -14.115 1.00 0.00 O ATOM 476 N3 U B 215 10.280 -11.771 -12.104 1.00 0.00 N ATOM 477 C4 U B 215 9.230 -11.783 -11.222 1.00 0.00 C ATOM 478 O4 U B 215 9.410 -11.311 -10.101 1.00 0.00 O ATOM 479 C5 U B 215 8.002 -12.343 -11.667 1.00 0.00 C ATOM 480 C6 U B 215 7.952 -12.818 -12.913 1.00 0.00 C ATOM 0 H5' U B 215 5.219 -13.283 -16.583 1.00 0.00 H new ATOM 0 H5'' U B 215 5.317 -15.033 -16.616 1.00 0.00 H new ATOM 0 H4' U B 215 7.333 -13.886 -17.355 1.00 0.00 H new ATOM 0 H3' U B 215 7.388 -15.942 -15.180 1.00 0.00 H new ATOM 0 H2' U B 215 9.538 -15.189 -14.254 1.00 0.00 H new ATOM 0 HO2' U B 215 10.468 -16.123 -16.015 1.00 0.00 H new ATOM 0 H1' U B 215 9.663 -12.732 -15.685 1.00 0.00 H new ATOM 0 H3 U B 215 11.165 -11.372 -11.793 1.00 0.00 H new ATOM 0 H5 U B 215 7.139 -12.383 -11.019 1.00 0.00 H new ATOM 0 H6 U B 215 7.023 -13.244 -13.262 1.00 0.00 H new ATOM 491 P A B 216 7.733 -17.630 -17.080 1.00 0.00 P ATOM 492 OP1 A B 216 6.895 -17.839 -18.282 1.00 0.00 O ATOM 493 OP2 A B 216 7.159 -18.017 -15.772 1.00 0.00 O ATOM 494 O5' A B 216 9.097 -18.440 -17.281 1.00 0.00 O ATOM 495 C5' A B 216 10.203 -17.825 -17.938 1.00 0.00 C ATOM 496 C4' A B 216 11.460 -18.000 -17.115 1.00 0.00 C ATOM 497 O4' A B 216 11.444 -17.238 -16.097 1.00 0.00 O ATOM 498 C3' A B 216 11.548 -19.333 -16.376 1.00 0.00 C ATOM 499 O3' A B 216 12.061 -20.330 -17.256 1.00 0.00 O ATOM 500 C2' A B 216 12.479 -19.085 -15.221 1.00 0.00 C ATOM 501 O2' A B 216 13.726 -19.494 -15.736 1.00 0.00 O ATOM 502 C1' A B 216 12.308 -17.579 -15.036 1.00 0.00 C ATOM 503 N9 A B 216 11.724 -17.209 -13.730 1.00 0.00 N ATOM 504 C8 A B 216 10.416 -17.185 -13.395 1.00 0.00 C ATOM 505 N7 A B 216 10.217 -16.806 -12.137 1.00 0.00 N ATOM 506 C5 A B 216 11.478 -16.579 -11.658 1.00 0.00 C ATOM 507 C6 A B 216 11.936 -16.156 -10.391 1.00 0.00 C ATOM 508 N6 A B 216 11.129 -15.877 -9.336 1.00 0.00 N ATOM 509 N1 A B 216 13.280 -16.022 -10.224 1.00 0.00 N ATOM 510 C2 A B 216 14.091 -16.298 -11.269 1.00 0.00 C ATOM 511 N3 A B 216 13.767 -16.704 -12.512 1.00 0.00 N ATOM 512 C4 A B 216 12.414 -16.819 -12.613 1.00 0.00 C ATOM 0 H5' A B 216 10.002 -16.764 -18.089 1.00 0.00 H new ATOM 0 H5'' A B 216 10.341 -18.267 -18.925 1.00 0.00 H new ATOM 0 H4' A B 216 12.245 -17.842 -17.855 1.00 0.00 H new ATOM 0 H3' A B 216 10.579 -19.689 -16.025 1.00 0.00 H new ATOM 0 H2' A B 216 12.334 -19.587 -14.264 1.00 0.00 H new ATOM 0 HO2' A B 216 14.265 -19.884 -15.016 1.00 0.00 H new ATOM 0 H1' A B 216 13.262 -17.053 -15.047 1.00 0.00 H new ATOM 0 H8 A B 216 9.619 -17.445 -14.075 1.00 0.00 H new ATOM 0 H61 A B 216 11.534 -15.576 -8.450 1.00 0.00 H new ATOM 0 H62 A B 216 10.117 -15.968 -9.430 1.00 0.00 H new ATOM 0 H2 A B 216 15.148 -16.176 -11.081 1.00 0.00 H new ATOM 524 P G B 217 11.450 -21.808 -17.233 1.00 0.00 P ATOM 525 OP1 G B 217 11.593 -22.429 -18.568 1.00 0.00 O ATOM 526 OP2 G B 217 10.096 -21.778 -16.635 1.00 0.00 O ATOM 527 O5' G B 217 12.419 -22.582 -16.221 1.00 0.00 O ATOM 528 C5' G B 217 13.828 -22.375 -16.285 1.00 0.00 C ATOM 529 C4' G B 217 14.411 -22.336 -14.890 1.00 0.00 C ATOM 530 O4' G B 217 13.972 -21.254 -14.116 1.00 0.00 O ATOM 531 C3' G B 217 13.824 -23.368 -13.933 1.00 0.00 C ATOM 532 O3' G B 217 14.355 -24.656 -14.239 1.00 0.00 O ATOM 533 C2' G B 217 14.234 -22.915 -12.559 1.00 0.00 C ATOM 534 O2' G B 217 15.535 -23.445 -12.434 1.00 0.00 O ATOM 535 C1' G B 217 14.158 -21.400 -12.725 1.00 0.00 C ATOM 536 N9 G B 217 13.049 -20.779 -11.971 1.00 0.00 N ATOM 537 C8 G B 217 11.745 -20.737 -12.317 1.00 0.00 C ATOM 538 N7 G B 217 10.997 -20.102 -11.420 1.00 0.00 N ATOM 539 C5 G B 217 11.892 -19.724 -10.455 1.00 0.00 C ATOM 540 C6 G B 217 11.720 -19.017 -9.245 1.00 0.00 C ATOM 541 O6 G B 217 10.650 -18.587 -8.818 1.00 0.00 O ATOM 542 N1 G B 217 12.828 -18.794 -8.488 1.00 0.00 N ATOM 543 C2 G B 217 14.017 -19.256 -8.932 1.00 0.00 C ATOM 544 N2 G B 217 14.999 -18.959 -8.084 1.00 0.00 N ATOM 545 N3 G B 217 14.297 -19.936 -10.060 1.00 0.00 N ATOM 546 C4 G B 217 13.150 -20.126 -10.771 1.00 0.00 C ATOM 0 H5' G B 217 14.043 -21.441 -16.804 1.00 0.00 H new ATOM 0 H5'' G B 217 14.295 -23.174 -16.861 1.00 0.00 H new ATOM 0 H4' G B 217 15.469 -22.404 -15.142 1.00 0.00 H new ATOM 0 H3' G B 217 12.739 -23.447 -14.008 1.00 0.00 H new ATOM 0 H2' G B 217 13.667 -23.213 -11.677 1.00 0.00 H new ATOM 0 HO2' G B 217 15.633 -24.215 -13.032 1.00 0.00 H new ATOM 0 H1' G B 217 15.044 -20.900 -12.334 1.00 0.00 H new ATOM 0 H8 G B 217 11.352 -21.172 -13.224 1.00 0.00 H new ATOM 0 H1 G B 217 12.762 -18.289 -7.604 1.00 0.00 H new ATOM 0 H21 G B 217 15.956 -19.247 -8.291 1.00 0.00 H new ATOM 0 H22 G B 217 14.795 -18.444 -7.228 1.00 0.00 H new ATOM 558 P U B 218 13.388 -25.930 -14.287 1.00 0.00 P ATOM 559 OP1 U B 218 13.958 -26.955 -15.188 1.00 0.00 O ATOM 560 OP2 U B 218 11.998 -25.491 -14.544 1.00 0.00 O ATOM 561 O5' U B 218 13.459 -26.491 -12.790 1.00 0.00 O ATOM 562 C5' U B 218 14.682 -27.026 -12.287 1.00 0.00 C ATOM 563 C4' U B 218 14.631 -27.108 -10.778 1.00 0.00 C ATOM 564 O4' U B 218 14.274 -25.780 -10.512 1.00 0.00 O ATOM 565 C3' U B 218 13.322 -27.660 -10.221 1.00 0.00 C ATOM 566 O3' U B 218 13.444 -29.068 -10.030 1.00 0.00 O ATOM 567 C2' U B 218 13.112 -26.942 -8.916 1.00 0.00 C ATOM 568 O2' U B 218 13.888 -27.700 -8.016 1.00 0.00 O ATOM 569 C1' U B 218 13.665 -25.562 -9.259 1.00 0.00 C ATOM 570 N1 U B 218 12.626 -24.515 -9.345 1.00 0.00 N ATOM 571 C2 U B 218 12.436 -23.761 -8.228 1.00 0.00 C ATOM 572 O2 U B 218 13.068 -23.911 -7.194 1.00 0.00 O ATOM 573 N3 U B 218 11.469 -22.785 -8.306 1.00 0.00 N ATOM 574 C4 U B 218 10.714 -22.550 -9.428 1.00 0.00 C ATOM 575 O4 U B 218 9.878 -21.649 -9.384 1.00 0.00 O ATOM 576 C5 U B 218 10.954 -23.366 -10.565 1.00 0.00 C ATOM 577 C6 U B 218 11.896 -24.306 -10.468 1.00 0.00 C ATOM 0 H5' U B 218 15.517 -26.398 -12.597 1.00 0.00 H new ATOM 0 H5'' U B 218 14.855 -28.017 -12.707 1.00 0.00 H new ATOM 0 H4' U B 218 15.515 -27.633 -10.415 1.00 0.00 H new ATOM 0 H3' U B 218 12.476 -27.504 -10.891 1.00 0.00 H new ATOM 0 H2' U B 218 12.116 -26.837 -8.486 1.00 0.00 H new ATOM 0 HO2' U B 218 14.415 -28.359 -8.514 1.00 0.00 H new ATOM 0 H1' U B 218 14.341 -25.188 -8.489 1.00 0.00 H new ATOM 0 H3 U B 218 11.304 -22.204 -7.484 1.00 0.00 H new ATOM 0 H5 U B 218 10.393 -23.230 -11.478 1.00 0.00 H new ATOM 0 H6 U B 218 12.086 -24.932 -11.327 1.00 0.00 H new ATOM 588 P C B 219 12.244 -30.040 -10.448 1.00 0.00 P ATOM 589 OP1 C B 219 12.789 -31.341 -10.895 1.00 0.00 O ATOM 590 OP2 C B 219 11.328 -29.331 -11.369 1.00 0.00 O ATOM 591 O5' C B 219 11.472 -30.274 -9.066 1.00 0.00 O ATOM 592 C5' C B 219 12.200 -30.306 -7.840 1.00 0.00 C ATOM 593 C4' C B 219 11.410 -29.618 -6.749 1.00 0.00 C ATOM 594 O4' C B 219 11.389 -28.346 -6.562 1.00 0.00 O ATOM 595 C3' C B 219 9.916 -29.927 -6.763 1.00 0.00 C ATOM 596 O3' C B 219 9.704 -31.262 -6.308 1.00 0.00 O ATOM 597 C2' C B 219 9.295 -28.921 -5.834 1.00 0.00 C ATOM 598 O2' C B 219 9.378 -29.564 -4.582 1.00 0.00 O ATOM 599 C1' C B 219 10.236 -27.736 -6.027 1.00 0.00 C ATOM 600 N1 C B 219 9.705 -26.704 -6.942 1.00 0.00 N ATOM 601 C2 C B 219 9.169 -25.549 -6.375 1.00 0.00 C ATOM 602 O2 C B 219 9.162 -25.443 -5.144 1.00 0.00 O ATOM 603 N3 C B 219 8.680 -24.596 -7.189 1.00 0.00 N ATOM 604 C4 C B 219 8.694 -24.726 -8.500 1.00 0.00 C ATOM 605 N4 C B 219 8.207 -23.774 -9.284 1.00 0.00 N ATOM 606 C5 C B 219 9.245 -25.914 -9.113 1.00 0.00 C ATOM 607 C6 C B 219 9.729 -26.854 -8.289 1.00 0.00 C ATOM 0 H5' C B 219 13.164 -29.814 -7.967 1.00 0.00 H new ATOM 0 H5'' C B 219 12.404 -31.338 -7.556 1.00 0.00 H new ATOM 0 H4' C B 219 12.037 -30.058 -5.974 1.00 0.00 H new ATOM 0 H3' C B 219 9.477 -29.859 -7.758 1.00 0.00 H new ATOM 0 H2' C B 219 8.265 -28.591 -5.970 1.00 0.00 H new ATOM 0 HO2' C B 219 9.415 -30.534 -4.714 1.00 0.00 H new ATOM 0 H1' C B 219 10.405 -27.191 -5.098 1.00 0.00 H new ATOM 0 H41 C B 219 8.225 -23.889 -10.297 1.00 0.00 H new ATOM 0 H42 C B 219 7.815 -22.927 -8.874 1.00 0.00 H new ATOM 0 H5 C B 219 9.266 -26.038 -10.186 1.00 0.00 H new ATOM 0 H6 C B 219 10.150 -27.755 -8.710 1.00 0.00 H new ATOM 619 P C B 220 8.966 -32.321 -7.254 1.00 0.00 P ATOM 620 OP1 C B 220 9.263 -33.695 -6.789 1.00 0.00 O ATOM 621 OP2 C B 220 9.248 -32.004 -8.671 1.00 0.00 O ATOM 622 O5' C B 220 7.416 -32.031 -6.981 1.00 0.00 O ATOM 623 C5' C B 220 6.700 -32.822 -6.035 1.00 0.00 C ATOM 624 C4' C B 220 5.226 -32.484 -6.086 1.00 0.00 C ATOM 625 O4' C B 220 5.254 -31.113 -5.914 1.00 0.00 O ATOM 626 C3' C B 220 4.637 -32.446 -7.493 1.00 0.00 C ATOM 627 O3' C B 220 4.082 -33.731 -7.811 1.00 0.00 O ATOM 628 C2' C B 220 3.576 -31.380 -7.451 1.00 0.00 C ATOM 629 O2' C B 220 2.474 -32.062 -6.898 1.00 0.00 O ATOM 630 C1' C B 220 4.240 -30.355 -6.535 1.00 0.00 C ATOM 631 N1 C B 220 4.806 -29.197 -7.259 1.00 0.00 N ATOM 632 C2 C B 220 4.154 -27.972 -7.130 1.00 0.00 C ATOM 633 O2 C B 220 3.141 -27.911 -6.423 1.00 0.00 O ATOM 634 N3 C B 220 4.649 -26.903 -7.779 1.00 0.00 N ATOM 635 C4 C B 220 5.730 -26.985 -8.530 1.00 0.00 C ATOM 636 N4 C B 220 6.203 -25.920 -9.162 1.00 0.00 N ATOM 637 C5 C B 220 6.424 -28.244 -8.680 1.00 0.00 C ATOM 638 C6 C B 220 5.918 -29.300 -8.026 1.00 0.00 C ATOM 0 H5' C B 220 7.088 -32.643 -5.032 1.00 0.00 H new ATOM 0 H5'' C B 220 6.846 -33.881 -6.249 1.00 0.00 H new ATOM 0 H4' C B 220 4.699 -33.171 -5.424 1.00 0.00 H new ATOM 0 H3' C B 220 5.379 -32.223 -8.259 1.00 0.00 H new ATOM 0 H2' C B 220 3.238 -30.888 -8.363 1.00 0.00 H new ATOM 0 HO2' C B 220 2.561 -33.022 -7.074 1.00 0.00 H new ATOM 0 HO3' C B 220 3.701 -33.709 -8.714 1.00 0.00 H new ATOM 0 H1' C B 220 3.530 -29.902 -5.844 1.00 0.00 H new ATOM 0 H41 C B 220 7.040 -26.000 -9.739 1.00 0.00 H new ATOM 0 H42 C B 220 5.730 -25.021 -9.071 1.00 0.00 H new ATOM 0 H5 C B 220 7.310 -28.331 -9.291 1.00 0.00 H new ATOM 0 H6 C B 220 6.410 -30.258 -8.113 1.00 0.00 H new TER 650 C B 220 ATOM 651 N MET A 1 5.859 -11.215 7.182 1.00 0.00 N ATOM 652 CA MET A 1 6.402 -10.244 6.248 1.00 0.00 C ATOM 653 C MET A 1 5.549 -10.165 4.980 1.00 0.00 C ATOM 654 O MET A 1 4.921 -9.143 4.712 1.00 0.00 O ATOM 655 CB MET A 1 7.834 -10.637 5.875 1.00 0.00 C ATOM 656 CG MET A 1 8.841 -10.025 6.851 1.00 0.00 C ATOM 657 SD MET A 1 9.334 -11.238 8.063 1.00 0.00 S ATOM 658 CE MET A 1 9.953 -10.161 9.345 1.00 0.00 C ATOM 0 H1 MET A 1 6.632 -11.627 7.743 1.00 0.00 H new ATOM 0 H2 MET A 1 5.182 -10.745 7.817 1.00 0.00 H new ATOM 0 H3 MET A 1 5.374 -11.969 6.656 1.00 0.00 H new ATOM 0 HA MET A 1 6.397 -9.266 6.729 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.930 -11.723 5.880 1.00 0.00 H new ATOM 0 HB3 MET A 1 8.055 -10.302 4.861 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.715 -9.667 6.307 1.00 0.00 H new ATOM 0 HG3 MET A 1 8.399 -9.162 7.348 1.00 0.00 H new ATOM 0 HE1 MET A 1 10.305 -10.760 10.185 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.778 -9.566 8.953 1.00 0.00 H new ATOM 0 HE3 MET A 1 9.155 -9.499 9.681 1.00 0.00 H new ATOM 668 N GLN A 2 5.554 -11.260 4.233 1.00 0.00 N ATOM 669 CA GLN A 2 4.788 -11.329 3.001 1.00 0.00 C ATOM 670 C GLN A 2 5.259 -10.250 2.022 1.00 0.00 C ATOM 671 O GLN A 2 5.744 -9.199 2.437 1.00 0.00 O ATOM 672 CB GLN A 2 3.289 -11.198 3.279 1.00 0.00 C ATOM 673 CG GLN A 2 2.770 -12.406 4.063 1.00 0.00 C ATOM 674 CD GLN A 2 2.388 -13.550 3.121 1.00 0.00 C ATOM 675 OE1 GLN A 2 1.820 -13.350 2.059 1.00 0.00 O ATOM 676 NE2 GLN A 2 2.729 -14.755 3.567 1.00 0.00 N ATOM 0 H GLN A 2 6.077 -12.106 4.458 1.00 0.00 H new ATOM 0 HA GLN A 2 4.956 -12.305 2.546 1.00 0.00 H new ATOM 0 HB2 GLN A 2 3.098 -10.285 3.843 1.00 0.00 H new ATOM 0 HB3 GLN A 2 2.747 -11.111 2.337 1.00 0.00 H new ATOM 0 HG2 GLN A 2 3.534 -12.746 4.762 1.00 0.00 H new ATOM 0 HG3 GLN A 2 1.903 -12.114 4.656 1.00 0.00 H new ATOM 0 HE21 GLN A 2 3.203 -14.851 4.465 1.00 0.00 H new ATOM 0 HE22 GLN A 2 2.517 -15.583 3.011 1.00 0.00 H new ATOM 685 N LYS A 3 5.101 -10.550 0.741 1.00 0.00 N ATOM 686 CA LYS A 3 5.504 -9.619 -0.300 1.00 0.00 C ATOM 687 C LYS A 3 7.011 -9.746 -0.534 1.00 0.00 C ATOM 688 O LYS A 3 7.768 -8.824 -0.235 1.00 0.00 O ATOM 689 CB LYS A 3 5.052 -8.199 0.047 1.00 0.00 C ATOM 690 CG LYS A 3 4.658 -7.427 -1.214 1.00 0.00 C ATOM 691 CD LYS A 3 3.272 -6.796 -1.060 1.00 0.00 C ATOM 692 CE LYS A 3 2.179 -7.755 -1.532 1.00 0.00 C ATOM 693 NZ LYS A 3 1.273 -8.101 -0.414 1.00 0.00 N ATOM 0 H LYS A 3 4.700 -11.424 0.400 1.00 0.00 H new ATOM 0 HA LYS A 3 5.013 -9.863 -1.242 1.00 0.00 H new ATOM 0 HB2 LYS A 3 4.205 -8.240 0.732 1.00 0.00 H new ATOM 0 HB3 LYS A 3 5.855 -7.674 0.564 1.00 0.00 H new ATOM 0 HG2 LYS A 3 5.395 -6.650 -1.414 1.00 0.00 H new ATOM 0 HG3 LYS A 3 4.662 -8.099 -2.072 1.00 0.00 H new ATOM 0 HD2 LYS A 3 3.103 -6.531 -0.016 1.00 0.00 H new ATOM 0 HD3 LYS A 3 3.223 -5.872 -1.635 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.610 -7.297 -2.341 1.00 0.00 H new ATOM 0 HE3 LYS A 3 2.631 -8.661 -1.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 0.537 -8.753 -0.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 1.817 -8.558 0.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.827 -7.236 -0.048 1.00 0.00 H new ATOM 706 N GLY A 4 7.400 -10.895 -1.067 1.00 0.00 N ATOM 707 CA GLY A 4 8.802 -11.153 -1.347 1.00 0.00 C ATOM 708 C GLY A 4 9.371 -10.112 -2.313 1.00 0.00 C ATOM 709 O GLY A 4 10.581 -9.893 -2.353 1.00 0.00 O ATOM 0 H GLY A 4 6.769 -11.658 -1.312 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.370 -11.140 -0.417 1.00 0.00 H new ATOM 0 HA3 GLY A 4 8.913 -12.150 -1.774 1.00 0.00 H new ATOM 713 N ASN A 5 8.471 -9.499 -3.068 1.00 0.00 N ATOM 714 CA ASN A 5 8.867 -8.487 -4.032 1.00 0.00 C ATOM 715 C ASN A 5 9.581 -7.347 -3.303 1.00 0.00 C ATOM 716 O ASN A 5 10.430 -6.671 -3.882 1.00 0.00 O ATOM 717 CB ASN A 5 7.649 -7.900 -4.747 1.00 0.00 C ATOM 718 CG ASN A 5 7.970 -7.589 -6.210 1.00 0.00 C ATOM 719 OD1 ASN A 5 8.836 -8.189 -6.824 1.00 0.00 O ATOM 720 ND2 ASN A 5 7.223 -6.620 -6.733 1.00 0.00 N ATOM 0 H ASN A 5 7.469 -9.684 -3.031 1.00 0.00 H new ATOM 0 HA ASN A 5 9.523 -8.958 -4.764 1.00 0.00 H new ATOM 0 HB2 ASN A 5 6.818 -8.604 -4.695 1.00 0.00 H new ATOM 0 HB3 ASN A 5 7.329 -6.990 -4.240 1.00 0.00 H new ATOM 0 HD21 ASN A 5 7.359 -6.339 -7.704 1.00 0.00 H new ATOM 0 HD22 ASN A 5 6.514 -6.158 -6.163 1.00 0.00 H new ATOM 727 N PHE A 6 9.212 -7.169 -2.043 1.00 0.00 N ATOM 728 CA PHE A 6 9.806 -6.123 -1.229 1.00 0.00 C ATOM 729 C PHE A 6 11.318 -6.322 -1.099 1.00 0.00 C ATOM 730 O PHE A 6 12.036 -5.407 -0.699 1.00 0.00 O ATOM 731 CB PHE A 6 9.170 -6.220 0.159 1.00 0.00 C ATOM 732 CG PHE A 6 9.891 -5.402 1.233 1.00 0.00 C ATOM 733 CD1 PHE A 6 9.694 -4.058 1.311 1.00 0.00 C ATOM 734 CD2 PHE A 6 10.731 -6.018 2.108 1.00 0.00 C ATOM 735 CE1 PHE A 6 10.362 -3.300 2.308 1.00 0.00 C ATOM 736 CE2 PHE A 6 11.400 -5.259 3.103 1.00 0.00 C ATOM 737 CZ PHE A 6 11.202 -3.915 3.183 1.00 0.00 C ATOM 0 H PHE A 6 8.508 -7.732 -1.566 1.00 0.00 H new ATOM 0 HA PHE A 6 9.632 -5.150 -1.689 1.00 0.00 H new ATOM 0 HB2 PHE A 6 8.134 -5.886 0.097 1.00 0.00 H new ATOM 0 HB3 PHE A 6 9.150 -7.266 0.466 1.00 0.00 H new ATOM 0 HD1 PHE A 6 9.030 -3.568 0.615 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.889 -7.085 2.045 1.00 0.00 H new ATOM 0 HE1 PHE A 6 10.203 -2.234 2.372 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.067 -5.748 3.797 1.00 0.00 H new ATOM 0 HZ PHE A 6 11.711 -3.338 3.940 1.00 0.00 H new ATOM 747 N ARG A 7 11.756 -7.524 -1.444 1.00 0.00 N ATOM 748 CA ARG A 7 13.169 -7.855 -1.371 1.00 0.00 C ATOM 749 C ARG A 7 13.980 -6.927 -2.279 1.00 0.00 C ATOM 750 O ARG A 7 15.205 -6.876 -2.185 1.00 0.00 O ATOM 751 CB ARG A 7 13.417 -9.307 -1.786 1.00 0.00 C ATOM 752 CG ARG A 7 13.079 -10.268 -0.645 1.00 0.00 C ATOM 753 CD ARG A 7 13.229 -11.724 -1.092 1.00 0.00 C ATOM 754 NE ARG A 7 14.061 -12.468 -0.120 1.00 0.00 N ATOM 755 CZ ARG A 7 13.778 -12.572 1.196 1.00 0.00 C ATOM 756 NH1 ARG A 7 12.680 -11.977 1.709 1.00 0.00 N ATOM 757 NH2 ARG A 7 14.591 -13.262 1.973 1.00 0.00 N ATOM 0 H ARG A 7 11.157 -8.281 -1.775 1.00 0.00 H new ATOM 0 HA ARG A 7 13.486 -7.725 -0.336 1.00 0.00 H new ATOM 0 HB2 ARG A 7 12.812 -9.548 -2.660 1.00 0.00 H new ATOM 0 HB3 ARG A 7 14.460 -9.433 -2.076 1.00 0.00 H new ATOM 0 HG2 ARG A 7 13.735 -10.075 0.204 1.00 0.00 H new ATOM 0 HG3 ARG A 7 12.058 -10.091 -0.306 1.00 0.00 H new ATOM 0 HD2 ARG A 7 12.247 -12.191 -1.175 1.00 0.00 H new ATOM 0 HD3 ARG A 7 13.686 -11.764 -2.081 1.00 0.00 H new ATOM 0 HE ARG A 7 14.901 -12.931 -0.466 1.00 0.00 H new ATOM 0 HH11 ARG A 7 12.058 -11.444 1.101 1.00 0.00 H new ATOM 0 HH12 ARG A 7 12.473 -12.060 2.704 1.00 0.00 H new ATOM 0 HH21 ARG A 7 15.419 -13.707 1.577 1.00 0.00 H new ATOM 0 HH22 ARG A 7 14.392 -13.350 2.969 1.00 0.00 H new ATOM 770 N ASN A 8 13.262 -6.216 -3.136 1.00 0.00 N ATOM 771 CA ASN A 8 13.899 -5.293 -4.060 1.00 0.00 C ATOM 772 C ASN A 8 14.743 -4.290 -3.270 1.00 0.00 C ATOM 773 O ASN A 8 15.614 -3.627 -3.833 1.00 0.00 O ATOM 774 CB ASN A 8 12.858 -4.508 -4.860 1.00 0.00 C ATOM 775 CG ASN A 8 11.808 -3.888 -3.935 1.00 0.00 C ATOM 776 OD1 ASN A 8 11.336 -4.500 -2.992 1.00 0.00 O ATOM 777 ND2 ASN A 8 11.472 -2.642 -4.257 1.00 0.00 N ATOM 0 H ASN A 8 12.246 -6.260 -3.210 1.00 0.00 H new ATOM 0 HA ASN A 8 14.517 -5.874 -4.745 1.00 0.00 H new ATOM 0 HB2 ASN A 8 13.351 -3.723 -5.434 1.00 0.00 H new ATOM 0 HB3 ASN A 8 12.371 -5.169 -5.577 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.780 -2.140 -3.700 1.00 0.00 H new ATOM 0 HD22 ASN A 8 11.907 -2.188 -5.060 1.00 0.00 H new ATOM 784 N GLN A 9 14.455 -4.209 -1.980 1.00 0.00 N ATOM 785 CA GLN A 9 15.177 -3.298 -1.108 1.00 0.00 C ATOM 786 C GLN A 9 16.675 -3.605 -1.142 1.00 0.00 C ATOM 787 O GLN A 9 17.490 -2.793 -0.707 1.00 0.00 O ATOM 788 CB GLN A 9 14.636 -3.364 0.323 1.00 0.00 C ATOM 789 CG GLN A 9 13.465 -2.399 0.510 1.00 0.00 C ATOM 790 CD GLN A 9 13.694 -1.489 1.720 1.00 0.00 C ATOM 791 OE1 GLN A 9 12.858 -1.361 2.600 1.00 0.00 O ATOM 792 NE2 GLN A 9 14.869 -0.867 1.714 1.00 0.00 N ATOM 0 H GLN A 9 13.732 -4.759 -1.517 1.00 0.00 H new ATOM 0 HA GLN A 9 15.026 -2.282 -1.472 1.00 0.00 H new ATOM 0 HB2 GLN A 9 14.314 -4.381 0.547 1.00 0.00 H new ATOM 0 HB3 GLN A 9 15.430 -3.119 1.028 1.00 0.00 H new ATOM 0 HG2 GLN A 9 13.341 -1.793 -0.387 1.00 0.00 H new ATOM 0 HG3 GLN A 9 12.542 -2.963 0.644 1.00 0.00 H new ATOM 0 HE21 GLN A 9 15.523 -1.019 0.946 1.00 0.00 H new ATOM 0 HE22 GLN A 9 15.117 -0.238 2.477 1.00 0.00 H new ATOM 801 N ARG A 10 16.994 -4.781 -1.664 1.00 0.00 N ATOM 802 CA ARG A 10 18.380 -5.205 -1.761 1.00 0.00 C ATOM 803 C ARG A 10 19.172 -4.236 -2.641 1.00 0.00 C ATOM 804 O ARG A 10 20.401 -4.275 -2.662 1.00 0.00 O ATOM 805 CB ARG A 10 18.485 -6.616 -2.345 1.00 0.00 C ATOM 806 CG ARG A 10 18.086 -6.628 -3.822 1.00 0.00 C ATOM 807 CD ARG A 10 17.901 -8.060 -4.328 1.00 0.00 C ATOM 808 NE ARG A 10 16.460 -8.398 -4.372 1.00 0.00 N ATOM 809 CZ ARG A 10 15.981 -9.659 -4.417 1.00 0.00 C ATOM 810 NH1 ARG A 10 16.824 -10.714 -4.423 1.00 0.00 N ATOM 811 NH2 ARG A 10 14.674 -9.847 -4.454 1.00 0.00 N ATOM 0 H ARG A 10 16.316 -5.453 -2.024 1.00 0.00 H new ATOM 0 HA ARG A 10 18.796 -5.209 -0.754 1.00 0.00 H new ATOM 0 HB2 ARG A 10 19.506 -6.983 -2.237 1.00 0.00 H new ATOM 0 HB3 ARG A 10 17.841 -7.294 -1.785 1.00 0.00 H new ATOM 0 HG2 ARG A 10 17.160 -6.068 -3.957 1.00 0.00 H new ATOM 0 HG3 ARG A 10 18.851 -6.126 -4.413 1.00 0.00 H new ATOM 0 HD2 ARG A 10 18.338 -8.163 -5.321 1.00 0.00 H new ATOM 0 HD3 ARG A 10 18.427 -8.756 -3.675 1.00 0.00 H new ATOM 0 HE ARG A 10 15.788 -7.631 -4.368 1.00 0.00 H new ATOM 0 HH11 ARG A 10 17.832 -10.561 -4.393 1.00 0.00 H new ATOM 0 HH12 ARG A 10 16.453 -11.663 -4.457 1.00 0.00 H new ATOM 0 HH21 ARG A 10 14.043 -9.046 -4.448 1.00 0.00 H new ATOM 0 HH22 ARG A 10 14.296 -10.794 -4.488 1.00 0.00 H new ATOM 824 N LYS A 11 18.435 -3.389 -3.345 1.00 0.00 N ATOM 825 CA LYS A 11 19.053 -2.412 -4.224 1.00 0.00 C ATOM 826 C LYS A 11 18.646 -1.005 -3.782 1.00 0.00 C ATOM 827 O LYS A 11 18.417 -0.131 -4.616 1.00 0.00 O ATOM 828 CB LYS A 11 18.717 -2.719 -5.685 1.00 0.00 C ATOM 829 CG LYS A 11 19.401 -1.723 -6.625 1.00 0.00 C ATOM 830 CD LYS A 11 19.520 -2.297 -8.039 1.00 0.00 C ATOM 831 CE LYS A 11 18.910 -1.346 -9.070 1.00 0.00 C ATOM 832 NZ LYS A 11 19.721 -0.113 -9.183 1.00 0.00 N ATOM 0 H LYS A 11 17.416 -3.360 -3.324 1.00 0.00 H new ATOM 0 HA LYS A 11 20.139 -2.467 -4.152 1.00 0.00 H new ATOM 0 HB2 LYS A 11 19.034 -3.733 -5.930 1.00 0.00 H new ATOM 0 HB3 LYS A 11 17.637 -2.679 -5.830 1.00 0.00 H new ATOM 0 HG2 LYS A 11 18.832 -0.794 -6.653 1.00 0.00 H new ATOM 0 HG3 LYS A 11 20.392 -1.479 -6.243 1.00 0.00 H new ATOM 0 HD2 LYS A 11 20.569 -2.473 -8.277 1.00 0.00 H new ATOM 0 HD3 LYS A 11 19.016 -3.263 -8.087 1.00 0.00 H new ATOM 0 HE2 LYS A 11 18.852 -1.840 -10.040 1.00 0.00 H new ATOM 0 HE3 LYS A 11 17.890 -1.092 -8.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 19.312 0.506 -9.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 19.727 0.384 -8.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 20.696 -0.362 -9.448 1.00 0.00 H new ATOM 845 N THR A 12 18.569 -0.831 -2.471 1.00 0.00 N ATOM 846 CA THR A 12 18.194 0.454 -1.907 1.00 0.00 C ATOM 847 C THR A 12 17.112 1.117 -2.763 1.00 0.00 C ATOM 848 O THR A 12 17.218 2.295 -3.103 1.00 0.00 O ATOM 849 CB THR A 12 19.462 1.299 -1.770 1.00 0.00 C ATOM 850 OG1 THR A 12 19.112 2.301 -0.821 1.00 0.00 O ATOM 851 CG2 THR A 12 19.780 2.087 -3.043 1.00 0.00 C ATOM 0 H THR A 12 18.760 -1.559 -1.783 1.00 0.00 H new ATOM 0 HA THR A 12 17.755 0.338 -0.916 1.00 0.00 H new ATOM 0 HB THR A 12 20.304 0.652 -1.523 1.00 0.00 H new ATOM 0 HG1 THR A 12 19.879 2.892 -0.672 1.00 0.00 H new ATOM 0 HG21 THR A 12 20.689 2.670 -2.893 1.00 0.00 H new ATOM 0 HG22 THR A 12 19.926 1.395 -3.872 1.00 0.00 H new ATOM 0 HG23 THR A 12 18.952 2.758 -3.272 1.00 0.00 H new ATOM 859 N VAL A 13 16.095 0.331 -3.087 1.00 0.00 N ATOM 860 CA VAL A 13 14.995 0.827 -3.897 1.00 0.00 C ATOM 861 C VAL A 13 14.672 2.264 -3.486 1.00 0.00 C ATOM 862 O VAL A 13 14.971 2.675 -2.365 1.00 0.00 O ATOM 863 CB VAL A 13 13.794 -0.113 -3.779 1.00 0.00 C ATOM 864 CG1 VAL A 13 14.061 -1.437 -4.498 1.00 0.00 C ATOM 865 CG2 VAL A 13 13.426 -0.351 -2.313 1.00 0.00 C ATOM 0 H VAL A 13 16.010 -0.645 -2.803 1.00 0.00 H new ATOM 0 HA VAL A 13 15.274 0.846 -4.950 1.00 0.00 H new ATOM 0 HB VAL A 13 12.944 0.367 -4.265 1.00 0.00 H new ATOM 0 HG11 VAL A 13 13.192 -2.087 -4.399 1.00 0.00 H new ATOM 0 HG12 VAL A 13 14.252 -1.246 -5.554 1.00 0.00 H new ATOM 0 HG13 VAL A 13 14.930 -1.923 -4.054 1.00 0.00 H new ATOM 0 HG21 VAL A 13 12.569 -1.023 -2.257 1.00 0.00 H new ATOM 0 HG22 VAL A 13 14.273 -0.799 -1.793 1.00 0.00 H new ATOM 0 HG23 VAL A 13 13.173 0.599 -1.842 1.00 0.00 H new ATOM 875 N LYS A 14 14.068 2.990 -4.415 1.00 0.00 N ATOM 876 CA LYS A 14 13.701 4.373 -4.163 1.00 0.00 C ATOM 877 C LYS A 14 12.183 4.471 -3.997 1.00 0.00 C ATOM 878 O LYS A 14 11.430 3.878 -4.768 1.00 0.00 O ATOM 879 CB LYS A 14 14.260 5.284 -5.258 1.00 0.00 C ATOM 880 CG LYS A 14 13.283 5.394 -6.431 1.00 0.00 C ATOM 881 CD LYS A 14 14.029 5.629 -7.745 1.00 0.00 C ATOM 882 CE LYS A 14 13.595 6.945 -8.394 1.00 0.00 C ATOM 883 NZ LYS A 14 14.779 7.741 -8.792 1.00 0.00 N ATOM 0 H LYS A 14 13.823 2.646 -5.344 1.00 0.00 H new ATOM 0 HA LYS A 14 14.147 4.722 -3.232 1.00 0.00 H new ATOM 0 HB2 LYS A 14 14.454 6.275 -4.848 1.00 0.00 H new ATOM 0 HB3 LYS A 14 15.214 4.892 -5.610 1.00 0.00 H new ATOM 0 HG2 LYS A 14 12.691 4.481 -6.503 1.00 0.00 H new ATOM 0 HG3 LYS A 14 12.586 6.213 -6.253 1.00 0.00 H new ATOM 0 HD2 LYS A 14 15.103 5.648 -7.559 1.00 0.00 H new ATOM 0 HD3 LYS A 14 13.838 4.802 -8.429 1.00 0.00 H new ATOM 0 HE2 LYS A 14 12.977 6.740 -9.268 1.00 0.00 H new ATOM 0 HE3 LYS A 14 12.982 7.517 -7.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 14.505 8.429 -9.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 15.152 8.247 -7.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 15.512 7.108 -9.170 1.00 0.00 H new ATOM 896 N CYS A 15 11.778 5.226 -2.987 1.00 0.00 N ATOM 897 CA CYS A 15 10.363 5.410 -2.709 1.00 0.00 C ATOM 898 C CYS A 15 9.793 6.379 -3.746 1.00 0.00 C ATOM 899 O CYS A 15 10.133 7.561 -3.749 1.00 0.00 O ATOM 900 CB CYS A 15 10.126 5.899 -1.279 1.00 0.00 C ATOM 901 SG CYS A 15 8.330 6.014 -0.947 1.00 0.00 S ATOM 0 H CYS A 15 12.405 5.718 -2.350 1.00 0.00 H new ATOM 0 HA CYS A 15 9.847 4.453 -2.785 1.00 0.00 H new ATOM 0 HB2 CYS A 15 10.592 5.215 -0.570 1.00 0.00 H new ATOM 0 HB3 CYS A 15 10.594 6.873 -1.137 1.00 0.00 H new ATOM 906 N PHE A 16 8.935 5.843 -4.602 1.00 0.00 N ATOM 907 CA PHE A 16 8.314 6.645 -5.641 1.00 0.00 C ATOM 908 C PHE A 16 7.191 7.512 -5.068 1.00 0.00 C ATOM 909 O PHE A 16 6.468 8.171 -5.814 1.00 0.00 O ATOM 910 CB PHE A 16 7.720 5.673 -6.663 1.00 0.00 C ATOM 911 CG PHE A 16 8.767 4.894 -7.462 1.00 0.00 C ATOM 912 CD1 PHE A 16 9.747 5.560 -8.129 1.00 0.00 C ATOM 913 CD2 PHE A 16 8.716 3.536 -7.506 1.00 0.00 C ATOM 914 CE1 PHE A 16 10.719 4.838 -8.871 1.00 0.00 C ATOM 915 CE2 PHE A 16 9.688 2.813 -8.249 1.00 0.00 C ATOM 916 CZ PHE A 16 10.669 3.480 -8.915 1.00 0.00 C ATOM 0 H PHE A 16 8.656 4.862 -4.597 1.00 0.00 H new ATOM 0 HA PHE A 16 9.054 7.307 -6.091 1.00 0.00 H new ATOM 0 HB2 PHE A 16 7.074 4.965 -6.143 1.00 0.00 H new ATOM 0 HB3 PHE A 16 7.090 6.231 -7.356 1.00 0.00 H new ATOM 0 HD1 PHE A 16 9.786 6.639 -8.094 1.00 0.00 H new ATOM 0 HD2 PHE A 16 7.937 3.007 -6.977 1.00 0.00 H new ATOM 0 HE1 PHE A 16 11.498 5.367 -9.400 1.00 0.00 H new ATOM 0 HE2 PHE A 16 9.648 1.734 -8.285 1.00 0.00 H new ATOM 0 HZ PHE A 16 11.408 2.931 -9.479 1.00 0.00 H new ATOM 926 N ASN A 17 7.082 7.485 -3.748 1.00 0.00 N ATOM 927 CA ASN A 17 6.059 8.260 -3.066 1.00 0.00 C ATOM 928 C ASN A 17 6.672 9.564 -2.553 1.00 0.00 C ATOM 929 O ASN A 17 6.218 10.651 -2.910 1.00 0.00 O ATOM 930 CB ASN A 17 5.499 7.496 -1.864 1.00 0.00 C ATOM 931 CG ASN A 17 4.091 7.982 -1.514 1.00 0.00 C ATOM 932 OD1 ASN A 17 3.336 8.437 -2.358 1.00 0.00 O ATOM 933 ND2 ASN A 17 3.782 7.859 -0.227 1.00 0.00 N ATOM 0 H ASN A 17 7.685 6.939 -3.133 1.00 0.00 H new ATOM 0 HA ASN A 17 5.255 8.456 -3.775 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.475 6.429 -2.086 1.00 0.00 H new ATOM 0 HB3 ASN A 17 6.157 7.628 -1.005 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.865 8.154 0.108 1.00 0.00 H new ATOM 0 HD22 ASN A 17 4.462 7.469 0.426 1.00 0.00 H new ATOM 940 N CYS A 18 7.695 9.415 -1.723 1.00 0.00 N ATOM 941 CA CYS A 18 8.374 10.568 -1.158 1.00 0.00 C ATOM 942 C CYS A 18 9.602 10.871 -2.018 1.00 0.00 C ATOM 943 O CYS A 18 9.891 12.031 -2.307 1.00 0.00 O ATOM 944 CB CYS A 18 8.746 10.341 0.309 1.00 0.00 C ATOM 945 SG CYS A 18 9.882 8.913 0.454 1.00 0.00 S ATOM 0 H CYS A 18 8.069 8.513 -1.429 1.00 0.00 H new ATOM 0 HA CYS A 18 7.705 11.428 -1.166 1.00 0.00 H new ATOM 0 HB2 CYS A 18 9.219 11.235 0.715 1.00 0.00 H new ATOM 0 HB3 CYS A 18 7.846 10.161 0.897 1.00 0.00 H new ATOM 950 N GLY A 19 10.293 9.808 -2.402 1.00 0.00 N ATOM 951 CA GLY A 19 11.483 9.945 -3.224 1.00 0.00 C ATOM 952 C GLY A 19 12.749 9.691 -2.402 1.00 0.00 C ATOM 953 O GLY A 19 13.805 10.249 -2.694 1.00 0.00 O ATOM 0 H GLY A 19 10.051 8.847 -2.159 1.00 0.00 H new ATOM 0 HA2 GLY A 19 11.438 9.242 -4.056 1.00 0.00 H new ATOM 0 HA3 GLY A 19 11.519 10.946 -3.654 1.00 0.00 H new ATOM 957 N LYS A 20 12.600 8.847 -1.392 1.00 0.00 N ATOM 958 CA LYS A 20 13.718 8.512 -0.526 1.00 0.00 C ATOM 959 C LYS A 20 14.089 7.042 -0.726 1.00 0.00 C ATOM 960 O LYS A 20 13.212 6.188 -0.849 1.00 0.00 O ATOM 961 CB LYS A 20 13.398 8.875 0.926 1.00 0.00 C ATOM 962 CG LYS A 20 14.436 9.847 1.489 1.00 0.00 C ATOM 963 CD LYS A 20 14.160 10.150 2.963 1.00 0.00 C ATOM 964 CE LYS A 20 14.167 11.658 3.224 1.00 0.00 C ATOM 965 NZ LYS A 20 15.071 11.985 4.350 1.00 0.00 N ATOM 0 H LYS A 20 11.722 8.385 -1.154 1.00 0.00 H new ATOM 0 HA LYS A 20 14.596 9.101 -0.791 1.00 0.00 H new ATOM 0 HB2 LYS A 20 12.406 9.324 0.982 1.00 0.00 H new ATOM 0 HB3 LYS A 20 13.374 7.971 1.534 1.00 0.00 H new ATOM 0 HG2 LYS A 20 15.434 9.421 1.382 1.00 0.00 H new ATOM 0 HG3 LYS A 20 14.421 10.773 0.915 1.00 0.00 H new ATOM 0 HD2 LYS A 20 13.195 9.732 3.249 1.00 0.00 H new ATOM 0 HD3 LYS A 20 14.913 9.666 3.585 1.00 0.00 H new ATOM 0 HE2 LYS A 20 14.488 12.187 2.327 1.00 0.00 H new ATOM 0 HE3 LYS A 20 13.157 11.999 3.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 15.064 13.012 4.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 14.747 11.495 5.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 16.038 11.678 4.120 1.00 0.00 H new ATOM 978 N GLU A 21 15.390 6.790 -0.750 1.00 0.00 N ATOM 979 CA GLU A 21 15.887 5.438 -0.932 1.00 0.00 C ATOM 980 C GLU A 21 15.971 4.717 0.414 1.00 0.00 C ATOM 981 O GLU A 21 16.370 5.309 1.416 1.00 0.00 O ATOM 982 CB GLU A 21 17.245 5.443 -1.637 1.00 0.00 C ATOM 983 CG GLU A 21 17.076 5.369 -3.155 1.00 0.00 C ATOM 984 CD GLU A 21 17.813 6.519 -3.847 1.00 0.00 C ATOM 985 OE1 GLU A 21 18.836 6.290 -4.507 1.00 0.00 O ATOM 986 OE2 GLU A 21 17.285 7.683 -3.679 1.00 0.00 O ATOM 0 H GLU A 21 16.115 7.500 -0.646 1.00 0.00 H new ATOM 0 HA GLU A 21 15.186 4.897 -1.568 1.00 0.00 H new ATOM 0 HB2 GLU A 21 17.793 6.348 -1.372 1.00 0.00 H new ATOM 0 HB3 GLU A 21 17.841 4.598 -1.292 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.458 4.416 -3.521 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.017 5.407 -3.409 1.00 0.00 H new ATOM 994 N GLY A 22 15.590 3.448 0.396 1.00 0.00 N ATOM 995 CA GLY A 22 15.617 2.641 1.603 1.00 0.00 C ATOM 996 C GLY A 22 14.218 2.126 1.950 1.00 0.00 C ATOM 997 O GLY A 22 14.008 1.568 3.026 1.00 0.00 O ATOM 0 H GLY A 22 15.261 2.959 -0.436 1.00 0.00 H new ATOM 0 HA2 GLY A 22 16.295 1.799 1.466 1.00 0.00 H new ATOM 0 HA3 GLY A 22 16.007 3.232 2.432 1.00 0.00 H new ATOM 1001 N HIS A 23 13.299 2.331 1.018 1.00 0.00 N ATOM 1002 CA HIS A 23 11.927 1.895 1.212 1.00 0.00 C ATOM 1003 C HIS A 23 11.115 2.178 -0.054 1.00 0.00 C ATOM 1004 O HIS A 23 11.502 3.011 -0.871 1.00 0.00 O ATOM 1005 CB HIS A 23 11.323 2.541 2.460 1.00 0.00 C ATOM 1006 CG HIS A 23 10.819 3.947 2.242 1.00 0.00 C ATOM 1007 ND1 HIS A 23 11.624 5.063 2.385 1.00 0.00 N ATOM 1008 CD2 HIS A 23 9.584 4.406 1.887 1.00 0.00 C ATOM 1009 CE1 HIS A 23 10.897 6.140 2.128 1.00 0.00 C ATOM 1010 NE2 HIS A 23 9.633 5.731 1.820 1.00 0.00 N ATOM 0 H HIS A 23 13.478 2.793 0.127 1.00 0.00 H new ATOM 0 HA HIS A 23 11.904 0.819 1.384 1.00 0.00 H new ATOM 0 HB2 HIS A 23 10.499 1.922 2.814 1.00 0.00 H new ATOM 0 HB3 HIS A 23 12.074 2.554 3.250 1.00 0.00 H new ATOM 0 HD1 HIS A 23 12.610 5.057 2.644 1.00 0.00 H new ATOM 0 HD2 HIS A 23 8.715 3.795 1.693 1.00 0.00 H new ATOM 0 HE1 HIS A 23 11.244 7.162 2.157 1.00 0.00 H new ATOM 1018 N ILE A 24 10.003 1.467 -0.177 1.00 0.00 N ATOM 1019 CA ILE A 24 9.134 1.631 -1.329 1.00 0.00 C ATOM 1020 C ILE A 24 7.811 2.257 -0.879 1.00 0.00 C ATOM 1021 O ILE A 24 7.445 2.167 0.291 1.00 0.00 O ATOM 1022 CB ILE A 24 8.965 0.301 -2.066 1.00 0.00 C ATOM 1023 CG1 ILE A 24 7.921 -0.580 -1.379 1.00 0.00 C ATOM 1024 CG2 ILE A 24 10.309 -0.415 -2.219 1.00 0.00 C ATOM 1025 CD1 ILE A 24 7.555 -1.782 -2.252 1.00 0.00 C ATOM 0 H ILE A 24 9.685 0.776 0.503 1.00 0.00 H new ATOM 0 HA ILE A 24 9.582 2.314 -2.050 1.00 0.00 H new ATOM 0 HB ILE A 24 8.596 0.512 -3.070 1.00 0.00 H new ATOM 0 HG12 ILE A 24 8.307 -0.927 -0.420 1.00 0.00 H new ATOM 0 HG13 ILE A 24 7.027 0.007 -1.169 1.00 0.00 H new ATOM 0 HG21 ILE A 24 10.161 -1.358 -2.746 1.00 0.00 H new ATOM 0 HG22 ILE A 24 10.994 0.215 -2.787 1.00 0.00 H new ATOM 0 HG23 ILE A 24 10.730 -0.613 -1.233 1.00 0.00 H new ATOM 0 HD11 ILE A 24 6.811 -2.391 -1.739 1.00 0.00 H new ATOM 0 HD12 ILE A 24 7.146 -1.432 -3.200 1.00 0.00 H new ATOM 0 HD13 ILE A 24 8.447 -2.380 -2.440 1.00 0.00 H new ATOM 1037 N ALA A 25 7.132 2.876 -1.833 1.00 0.00 N ATOM 1038 CA ALA A 25 5.859 3.516 -1.550 1.00 0.00 C ATOM 1039 C ALA A 25 4.958 2.537 -0.795 1.00 0.00 C ATOM 1040 O ALA A 25 4.222 2.934 0.107 1.00 0.00 O ATOM 1041 CB ALA A 25 5.228 3.999 -2.858 1.00 0.00 C ATOM 0 H ALA A 25 7.439 2.948 -2.803 1.00 0.00 H new ATOM 0 HA ALA A 25 6.002 4.390 -0.915 1.00 0.00 H new ATOM 0 HB1 ALA A 25 4.273 4.479 -2.646 1.00 0.00 H new ATOM 0 HB2 ALA A 25 5.894 4.714 -3.341 1.00 0.00 H new ATOM 0 HB3 ALA A 25 5.067 3.148 -3.520 1.00 0.00 H new ATOM 1047 N LYS A 26 5.045 1.275 -1.191 1.00 0.00 N ATOM 1048 CA LYS A 26 4.247 0.237 -0.563 1.00 0.00 C ATOM 1049 C LYS A 26 4.563 0.192 0.934 1.00 0.00 C ATOM 1050 O LYS A 26 3.657 0.092 1.760 1.00 0.00 O ATOM 1051 CB LYS A 26 4.451 -1.101 -1.275 1.00 0.00 C ATOM 1052 CG LYS A 26 4.187 -0.969 -2.777 1.00 0.00 C ATOM 1053 CD LYS A 26 2.747 -1.361 -3.116 1.00 0.00 C ATOM 1054 CE LYS A 26 2.588 -2.883 -3.152 1.00 0.00 C ATOM 1055 NZ LYS A 26 1.171 -3.250 -3.376 1.00 0.00 N ATOM 0 H LYS A 26 5.656 0.949 -1.939 1.00 0.00 H new ATOM 0 HA LYS A 26 3.185 0.463 -0.658 1.00 0.00 H new ATOM 0 HB2 LYS A 26 5.469 -1.453 -1.111 1.00 0.00 H new ATOM 0 HB3 LYS A 26 3.783 -1.849 -0.849 1.00 0.00 H new ATOM 0 HG2 LYS A 26 4.373 0.057 -3.094 1.00 0.00 H new ATOM 0 HG3 LYS A 26 4.880 -1.604 -3.329 1.00 0.00 H new ATOM 0 HD2 LYS A 26 2.067 -0.938 -2.376 1.00 0.00 H new ATOM 0 HD3 LYS A 26 2.469 -0.940 -4.082 1.00 0.00 H new ATOM 0 HE2 LYS A 26 3.208 -3.301 -3.945 1.00 0.00 H new ATOM 0 HE3 LYS A 26 2.938 -3.314 -2.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 1.080 -4.286 -3.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.587 -2.867 -2.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 0.849 -2.855 -4.283 1.00 0.00 H new ATOM 1068 N ASN A 27 5.850 0.267 1.236 1.00 0.00 N ATOM 1069 CA ASN A 27 6.297 0.237 2.618 1.00 0.00 C ATOM 1070 C ASN A 27 6.401 1.668 3.149 1.00 0.00 C ATOM 1071 O ASN A 27 6.807 1.883 4.290 1.00 0.00 O ATOM 1072 CB ASN A 27 7.678 -0.412 2.736 1.00 0.00 C ATOM 1073 CG ASN A 27 7.587 -1.931 2.565 1.00 0.00 C ATOM 1074 OD1 ASN A 27 7.914 -2.702 3.452 1.00 0.00 O ATOM 1075 ND2 ASN A 27 7.125 -2.314 1.379 1.00 0.00 N ATOM 0 H ASN A 27 6.598 0.349 0.547 1.00 0.00 H new ATOM 0 HA ASN A 27 5.575 -0.343 3.193 1.00 0.00 H new ATOM 0 HB2 ASN A 27 8.345 0.003 1.980 1.00 0.00 H new ATOM 0 HB3 ASN A 27 8.112 -0.177 3.708 1.00 0.00 H new ATOM 0 HD21 ASN A 27 7.026 -3.307 1.167 1.00 0.00 H new ATOM 0 HD22 ASN A 27 6.869 -1.615 0.681 1.00 0.00 H new ATOM 1082 N CYS A 28 6.026 2.609 2.295 1.00 0.00 N ATOM 1083 CA CYS A 28 6.072 4.014 2.664 1.00 0.00 C ATOM 1084 C CYS A 28 4.875 4.313 3.568 1.00 0.00 C ATOM 1085 O CYS A 28 3.745 3.945 3.249 1.00 0.00 O ATOM 1086 CB CYS A 28 6.098 4.922 1.432 1.00 0.00 C ATOM 1087 SG CYS A 28 6.339 6.663 1.942 1.00 0.00 S ATOM 0 H CYS A 28 5.689 2.427 1.350 1.00 0.00 H new ATOM 0 HA CYS A 28 6.995 4.220 3.206 1.00 0.00 H new ATOM 0 HB2 CYS A 28 6.901 4.616 0.762 1.00 0.00 H new ATOM 0 HB3 CYS A 28 5.165 4.823 0.877 1.00 0.00 H new ATOM 1092 N ARG A 29 5.163 4.976 4.678 1.00 0.00 N ATOM 1093 CA ARG A 29 4.123 5.328 5.630 1.00 0.00 C ATOM 1094 C ARG A 29 3.278 6.483 5.090 1.00 0.00 C ATOM 1095 O ARG A 29 2.106 6.615 5.439 1.00 0.00 O ATOM 1096 CB ARG A 29 4.725 5.733 6.978 1.00 0.00 C ATOM 1097 CG ARG A 29 5.566 7.004 6.843 1.00 0.00 C ATOM 1098 CD ARG A 29 6.627 7.078 7.943 1.00 0.00 C ATOM 1099 NE ARG A 29 6.243 8.093 8.949 1.00 0.00 N ATOM 1100 CZ ARG A 29 6.730 8.133 10.208 1.00 0.00 C ATOM 1101 NH1 ARG A 29 7.625 7.213 10.626 1.00 0.00 N ATOM 1102 NH2 ARG A 29 6.317 9.085 11.024 1.00 0.00 N ATOM 0 H ARG A 29 6.101 5.279 4.940 1.00 0.00 H new ATOM 0 HA ARG A 29 3.494 4.449 5.774 1.00 0.00 H new ATOM 0 HB2 ARG A 29 3.927 5.896 7.702 1.00 0.00 H new ATOM 0 HB3 ARG A 29 5.344 4.922 7.362 1.00 0.00 H new ATOM 0 HG2 ARG A 29 6.048 7.023 5.866 1.00 0.00 H new ATOM 0 HG3 ARG A 29 4.919 7.880 6.897 1.00 0.00 H new ATOM 0 HD2 ARG A 29 6.736 6.104 8.420 1.00 0.00 H new ATOM 0 HD3 ARG A 29 7.595 7.331 7.510 1.00 0.00 H new ATOM 0 HE ARG A 29 5.568 8.807 8.674 1.00 0.00 H new ATOM 0 HH11 ARG A 29 7.938 6.480 9.989 1.00 0.00 H new ATOM 0 HH12 ARG A 29 7.988 7.250 11.579 1.00 0.00 H new ATOM 0 HH21 ARG A 29 5.640 9.776 10.700 1.00 0.00 H new ATOM 0 HH22 ARG A 29 6.675 9.130 11.978 1.00 0.00 H new ATOM 1115 N ALA A 30 3.905 7.289 4.246 1.00 0.00 N ATOM 1116 CA ALA A 30 3.224 8.429 3.655 1.00 0.00 C ATOM 1117 C ALA A 30 2.023 7.936 2.843 1.00 0.00 C ATOM 1118 O ALA A 30 1.994 6.785 2.409 1.00 0.00 O ATOM 1119 CB ALA A 30 4.213 9.229 2.804 1.00 0.00 C ATOM 0 H ALA A 30 4.877 7.176 3.957 1.00 0.00 H new ATOM 0 HA ALA A 30 2.847 9.095 4.431 1.00 0.00 H new ATOM 0 HB1 ALA A 30 3.703 10.084 2.361 1.00 0.00 H new ATOM 0 HB2 ALA A 30 5.032 9.581 3.432 1.00 0.00 H new ATOM 0 HB3 ALA A 30 4.610 8.593 2.013 1.00 0.00 H new ATOM 1125 N PRO A 31 1.039 8.854 2.659 1.00 0.00 N ATOM 1126 CA PRO A 31 -0.161 8.525 1.908 1.00 0.00 C ATOM 1127 C PRO A 31 0.127 8.480 0.405 1.00 0.00 C ATOM 1128 O PRO A 31 1.087 9.089 -0.064 1.00 0.00 O ATOM 1129 CB PRO A 31 -1.170 9.595 2.288 1.00 0.00 C ATOM 1130 CG PRO A 31 -0.361 10.742 2.872 1.00 0.00 C ATOM 1131 CD PRO A 31 1.039 10.226 3.158 1.00 0.00 C ATOM 0 HA PRO A 31 -0.546 7.533 2.144 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -1.739 9.922 1.418 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -1.888 9.214 3.014 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -0.324 11.578 2.173 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -0.826 11.111 3.786 1.00 0.00 H new ATOM 0 HD2 PRO A 31 1.794 10.830 2.655 1.00 0.00 H new ATOM 0 HD3 PRO A 31 1.263 10.259 4.224 1.00 0.00 H new ATOM 1139 N ARG A 32 -0.722 7.755 -0.306 1.00 0.00 N ATOM 1140 CA ARG A 32 -0.571 7.624 -1.745 1.00 0.00 C ATOM 1141 C ARG A 32 -0.627 8.999 -2.412 1.00 0.00 C ATOM 1142 O ARG A 32 -1.700 9.587 -2.544 1.00 0.00 O ATOM 1143 CB ARG A 32 -1.667 6.733 -2.336 1.00 0.00 C ATOM 1144 CG ARG A 32 -1.752 5.400 -1.589 1.00 0.00 C ATOM 1145 CD ARG A 32 -0.908 4.329 -2.282 1.00 0.00 C ATOM 1146 NE ARG A 32 0.475 4.355 -1.756 1.00 0.00 N ATOM 1147 CZ ARG A 32 0.798 4.107 -0.468 1.00 0.00 C ATOM 1148 NH1 ARG A 32 -0.161 3.815 0.435 1.00 0.00 N ATOM 1149 NH2 ARG A 32 2.067 4.158 -0.107 1.00 0.00 N ATOM 0 H ARG A 32 -1.517 7.252 0.087 1.00 0.00 H new ATOM 0 HA ARG A 32 0.398 7.163 -1.936 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -2.627 7.246 -2.281 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -1.463 6.550 -3.391 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -1.408 5.531 -0.563 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -2.791 5.073 -1.538 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -1.349 3.346 -2.120 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.900 4.501 -3.358 1.00 0.00 H new ATOM 0 HE ARG A 32 1.230 4.574 -2.406 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -1.139 3.780 0.147 1.00 0.00 H new ATOM 0 HH12 ARG A 32 0.092 3.629 1.405 1.00 0.00 H new ATOM 0 HH21 ARG A 32 2.785 4.382 -0.796 1.00 0.00 H new ATOM 0 HH22 ARG A 32 2.330 3.974 0.861 1.00 0.00 H new ATOM 1162 N LYS A 33 0.542 9.474 -2.815 1.00 0.00 N ATOM 1163 CA LYS A 33 0.640 10.770 -3.466 1.00 0.00 C ATOM 1164 C LYS A 33 1.512 10.643 -4.717 1.00 0.00 C ATOM 1165 O LYS A 33 1.969 9.552 -5.051 1.00 0.00 O ATOM 1166 CB LYS A 33 1.133 11.829 -2.478 1.00 0.00 C ATOM 1167 CG LYS A 33 0.253 13.079 -2.530 1.00 0.00 C ATOM 1168 CD LYS A 33 0.120 13.714 -1.144 1.00 0.00 C ATOM 1169 CE LYS A 33 1.262 14.695 -0.878 1.00 0.00 C ATOM 1170 NZ LYS A 33 0.742 16.075 -0.751 1.00 0.00 N ATOM 0 H LYS A 33 1.430 8.985 -2.703 1.00 0.00 H new ATOM 0 HA LYS A 33 -0.343 11.107 -3.795 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.129 11.419 -1.468 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.164 12.096 -2.710 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.681 13.801 -3.225 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -0.734 12.817 -2.910 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -0.835 14.234 -1.068 1.00 0.00 H new ATOM 0 HD3 LYS A 33 0.120 12.935 -0.382 1.00 0.00 H new ATOM 0 HE2 LYS A 33 1.787 14.412 0.035 1.00 0.00 H new ATOM 0 HE3 LYS A 33 1.987 14.647 -1.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 1.531 16.728 -0.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 0.262 16.347 -1.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 0.067 16.120 0.039 1.00 0.00 H new ATOM 1183 N LYS A 34 1.715 11.775 -5.375 1.00 0.00 N ATOM 1184 CA LYS A 34 2.523 11.805 -6.582 1.00 0.00 C ATOM 1185 C LYS A 34 3.239 13.153 -6.679 1.00 0.00 C ATOM 1186 O LYS A 34 3.136 13.844 -7.691 1.00 0.00 O ATOM 1187 CB LYS A 34 1.668 11.473 -7.808 1.00 0.00 C ATOM 1188 CG LYS A 34 0.504 12.455 -7.946 1.00 0.00 C ATOM 1189 CD LYS A 34 -0.230 12.253 -9.273 1.00 0.00 C ATOM 1190 CE LYS A 34 -1.502 13.101 -9.331 1.00 0.00 C ATOM 1191 NZ LYS A 34 -1.897 13.346 -10.736 1.00 0.00 N ATOM 0 H LYS A 34 1.334 12.679 -5.095 1.00 0.00 H new ATOM 0 HA LYS A 34 3.295 11.036 -6.542 1.00 0.00 H new ATOM 0 HB2 LYS A 34 2.285 11.506 -8.706 1.00 0.00 H new ATOM 0 HB3 LYS A 34 1.283 10.457 -7.723 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -0.191 12.319 -7.118 1.00 0.00 H new ATOM 0 HG3 LYS A 34 0.877 13.477 -7.885 1.00 0.00 H new ATOM 0 HD2 LYS A 34 0.427 12.520 -10.100 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -0.485 11.200 -9.395 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -2.309 12.593 -8.803 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -1.337 14.051 -8.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -1.823 14.362 -10.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -1.268 12.815 -11.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -2.878 13.034 -10.880 1.00 0.00 H new ATOM 1204 N GLY A 35 3.949 13.488 -5.612 1.00 0.00 N ATOM 1205 CA GLY A 35 4.682 14.741 -5.563 1.00 0.00 C ATOM 1206 C GLY A 35 6.115 14.558 -6.068 1.00 0.00 C ATOM 1207 O GLY A 35 6.825 13.659 -5.620 1.00 0.00 O ATOM 0 H GLY A 35 4.032 12.913 -4.774 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.172 15.489 -6.170 1.00 0.00 H new ATOM 0 HA3 GLY A 35 4.698 15.117 -4.540 1.00 0.00 H new ATOM 1211 N CYS A 36 6.497 15.426 -6.993 1.00 0.00 N ATOM 1212 CA CYS A 36 7.833 15.371 -7.564 1.00 0.00 C ATOM 1213 C CYS A 36 8.845 15.602 -6.441 1.00 0.00 C ATOM 1214 O CYS A 36 8.842 16.654 -5.804 1.00 0.00 O ATOM 1215 CB CYS A 36 8.003 16.380 -8.702 1.00 0.00 C ATOM 1216 SG CYS A 36 9.761 16.472 -9.199 1.00 0.00 S ATOM 0 H CYS A 36 5.906 16.171 -7.361 1.00 0.00 H new ATOM 0 HA CYS A 36 8.002 14.390 -8.008 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.390 16.086 -9.554 1.00 0.00 H new ATOM 0 HB3 CYS A 36 7.655 17.362 -8.383 1.00 0.00 H new ATOM 1221 N TRP A 37 9.687 14.600 -6.232 1.00 0.00 N ATOM 1222 CA TRP A 37 10.703 14.681 -5.196 1.00 0.00 C ATOM 1223 C TRP A 37 11.892 15.461 -5.760 1.00 0.00 C ATOM 1224 O TRP A 37 13.043 15.142 -5.469 1.00 0.00 O ATOM 1225 CB TRP A 37 11.086 13.288 -4.695 1.00 0.00 C ATOM 1226 CG TRP A 37 10.204 12.164 -5.244 1.00 0.00 C ATOM 1227 CD1 TRP A 37 8.929 11.892 -4.938 1.00 0.00 C ATOM 1228 CD2 TRP A 37 10.589 11.167 -6.214 1.00 0.00 C ATOM 1229 NE1 TRP A 37 8.464 10.797 -5.636 1.00 0.00 N ATOM 1230 CE2 TRP A 37 9.505 10.341 -6.438 1.00 0.00 C ATOM 1231 CE3 TRP A 37 11.810 10.968 -6.881 1.00 0.00 C ATOM 1232 CZ2 TRP A 37 9.534 9.262 -7.328 1.00 0.00 C ATOM 1233 CZ3 TRP A 37 11.823 9.885 -7.767 1.00 0.00 C ATOM 1234 CH2 TRP A 37 10.742 9.045 -8.003 1.00 0.00 C ATOM 0 H TRP A 37 9.686 13.729 -6.762 1.00 0.00 H new ATOM 0 HA TRP A 37 10.322 15.210 -4.323 1.00 0.00 H new ATOM 0 HB2 TRP A 37 12.123 13.088 -4.966 1.00 0.00 H new ATOM 0 HB3 TRP A 37 11.034 13.278 -3.606 1.00 0.00 H new ATOM 0 HD1 TRP A 37 8.339 12.459 -4.233 1.00 0.00 H new ATOM 0 HE1 TRP A 37 7.528 10.395 -5.575 1.00 0.00 H new ATOM 0 HE3 TRP A 37 12.670 11.601 -6.722 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 8.672 8.631 -7.486 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 12.738 9.688 -8.305 1.00 0.00 H new ATOM 0 HH2 TRP A 37 10.833 8.228 -8.704 1.00 0.00 H new ATOM 1245 N LYS A 38 11.573 16.470 -6.558 1.00 0.00 N ATOM 1246 CA LYS A 38 12.600 17.299 -7.165 1.00 0.00 C ATOM 1247 C LYS A 38 12.241 18.773 -6.972 1.00 0.00 C ATOM 1248 O LYS A 38 13.070 19.565 -6.525 1.00 0.00 O ATOM 1249 CB LYS A 38 12.811 16.904 -8.628 1.00 0.00 C ATOM 1250 CG LYS A 38 14.299 16.723 -8.938 1.00 0.00 C ATOM 1251 CD LYS A 38 14.913 18.025 -9.456 1.00 0.00 C ATOM 1252 CE LYS A 38 15.541 18.827 -8.314 1.00 0.00 C ATOM 1253 NZ LYS A 38 15.504 20.276 -8.616 1.00 0.00 N ATOM 0 H LYS A 38 10.617 16.732 -6.798 1.00 0.00 H new ATOM 0 HA LYS A 38 13.559 17.138 -6.673 1.00 0.00 H new ATOM 0 HB2 LYS A 38 12.277 15.978 -8.839 1.00 0.00 H new ATOM 0 HB3 LYS A 38 12.391 17.670 -9.280 1.00 0.00 H new ATOM 0 HG2 LYS A 38 14.825 16.401 -8.039 1.00 0.00 H new ATOM 0 HG3 LYS A 38 14.426 15.936 -9.681 1.00 0.00 H new ATOM 0 HD2 LYS A 38 15.670 17.801 -10.207 1.00 0.00 H new ATOM 0 HD3 LYS A 38 14.145 18.624 -9.946 1.00 0.00 H new ATOM 0 HE2 LYS A 38 15.005 18.629 -7.386 1.00 0.00 H new ATOM 0 HE3 LYS A 38 16.572 18.508 -8.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 15.934 20.805 -7.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 16.035 20.462 -9.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 14.517 20.580 -8.739 1.00 0.00 H new ATOM 1266 N CYS A 39 11.003 19.098 -7.317 1.00 0.00 N ATOM 1267 CA CYS A 39 10.524 20.463 -7.187 1.00 0.00 C ATOM 1268 C CYS A 39 9.487 20.504 -6.063 1.00 0.00 C ATOM 1269 O CYS A 39 9.365 21.506 -5.360 1.00 0.00 O ATOM 1270 CB CYS A 39 9.957 20.992 -8.506 1.00 0.00 C ATOM 1271 SG CYS A 39 8.709 19.825 -9.162 1.00 0.00 S ATOM 0 H CYS A 39 10.318 18.439 -7.686 1.00 0.00 H new ATOM 0 HA CYS A 39 11.357 21.120 -6.936 1.00 0.00 H new ATOM 0 HB2 CYS A 39 9.505 21.972 -8.350 1.00 0.00 H new ATOM 0 HB3 CYS A 39 10.761 21.123 -9.230 1.00 0.00 H new ATOM 1276 N GLY A 40 8.765 19.402 -5.928 1.00 0.00 N ATOM 1277 CA GLY A 40 7.742 19.298 -4.900 1.00 0.00 C ATOM 1278 C GLY A 40 6.353 19.575 -5.480 1.00 0.00 C ATOM 1279 O GLY A 40 5.425 19.909 -4.745 1.00 0.00 O ATOM 0 H GLY A 40 8.868 18.573 -6.513 1.00 0.00 H new ATOM 0 HA2 GLY A 40 7.764 18.301 -4.459 1.00 0.00 H new ATOM 0 HA3 GLY A 40 7.953 20.006 -4.098 1.00 0.00 H new ATOM 1283 N LYS A 41 6.255 19.427 -6.794 1.00 0.00 N ATOM 1284 CA LYS A 41 4.995 19.657 -7.480 1.00 0.00 C ATOM 1285 C LYS A 41 4.245 18.330 -7.620 1.00 0.00 C ATOM 1286 O LYS A 41 4.788 17.359 -8.144 1.00 0.00 O ATOM 1287 CB LYS A 41 5.234 20.372 -8.811 1.00 0.00 C ATOM 1288 CG LYS A 41 4.321 21.592 -8.950 1.00 0.00 C ATOM 1289 CD LYS A 41 3.045 21.238 -9.718 1.00 0.00 C ATOM 1290 CE LYS A 41 2.225 22.492 -10.024 1.00 0.00 C ATOM 1291 NZ LYS A 41 2.910 23.327 -11.037 1.00 0.00 N ATOM 0 H LYS A 41 7.027 19.151 -7.401 1.00 0.00 H new ATOM 0 HA LYS A 41 4.359 20.322 -6.896 1.00 0.00 H new ATOM 0 HB2 LYS A 41 6.276 20.684 -8.878 1.00 0.00 H new ATOM 0 HB3 LYS A 41 5.054 19.683 -9.636 1.00 0.00 H new ATOM 0 HG2 LYS A 41 4.061 21.971 -7.961 1.00 0.00 H new ATOM 0 HG3 LYS A 41 4.852 22.391 -9.468 1.00 0.00 H new ATOM 0 HD2 LYS A 41 3.304 20.733 -10.648 1.00 0.00 H new ATOM 0 HD3 LYS A 41 2.445 20.541 -9.133 1.00 0.00 H new ATOM 0 HE2 LYS A 41 1.237 22.208 -10.387 1.00 0.00 H new ATOM 0 HE3 LYS A 41 2.076 23.068 -9.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 3.096 24.270 -10.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 3.810 22.880 -11.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 2.305 23.418 -11.878 1.00 0.00 H new ATOM 1304 N GLU A 42 3.010 18.332 -7.141 1.00 0.00 N ATOM 1305 CA GLU A 42 2.180 17.141 -7.205 1.00 0.00 C ATOM 1306 C GLU A 42 1.464 17.066 -8.556 1.00 0.00 C ATOM 1307 O GLU A 42 0.695 17.960 -8.906 1.00 0.00 O ATOM 1308 CB GLU A 42 1.177 17.107 -6.051 1.00 0.00 C ATOM 1309 CG GLU A 42 0.116 18.196 -6.215 1.00 0.00 C ATOM 1310 CD GLU A 42 -0.569 18.500 -4.881 1.00 0.00 C ATOM 1311 OE1 GLU A 42 -1.407 17.711 -4.420 1.00 0.00 O ATOM 1312 OE2 GLU A 42 -0.201 19.602 -4.319 1.00 0.00 O ATOM 0 H GLU A 42 2.564 19.140 -6.707 1.00 0.00 H new ATOM 0 HA GLU A 42 2.825 16.268 -7.107 1.00 0.00 H new ATOM 0 HB2 GLU A 42 0.697 16.129 -6.011 1.00 0.00 H new ATOM 0 HB3 GLU A 42 1.701 17.244 -5.105 1.00 0.00 H new ATOM 0 HG2 GLU A 42 0.578 19.103 -6.606 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -0.628 17.877 -6.945 1.00 0.00 H new ATOM 1320 N GLY A 43 1.742 15.990 -9.278 1.00 0.00 N ATOM 1321 CA GLY A 43 1.134 15.787 -10.582 1.00 0.00 C ATOM 1322 C GLY A 43 2.138 15.185 -11.567 1.00 0.00 C ATOM 1323 O GLY A 43 1.833 14.206 -12.249 1.00 0.00 O ATOM 0 H GLY A 43 2.380 15.250 -8.985 1.00 0.00 H new ATOM 0 HA2 GLY A 43 0.272 15.127 -10.487 1.00 0.00 H new ATOM 0 HA3 GLY A 43 0.766 16.738 -10.968 1.00 0.00 H new ATOM 1327 N HIS A 44 3.314 15.793 -11.611 1.00 0.00 N ATOM 1328 CA HIS A 44 4.363 15.329 -12.502 1.00 0.00 C ATOM 1329 C HIS A 44 5.391 14.520 -11.707 1.00 0.00 C ATOM 1330 O HIS A 44 5.323 14.461 -10.480 1.00 0.00 O ATOM 1331 CB HIS A 44 4.990 16.501 -13.260 1.00 0.00 C ATOM 1332 CG HIS A 44 5.953 17.323 -12.435 1.00 0.00 C ATOM 1333 ND1 HIS A 44 5.606 18.536 -11.868 1.00 0.00 N ATOM 1334 CD2 HIS A 44 7.251 17.092 -12.089 1.00 0.00 C ATOM 1335 CE1 HIS A 44 6.657 19.006 -11.212 1.00 0.00 C ATOM 1336 NE2 HIS A 44 7.675 18.110 -11.350 1.00 0.00 N ATOM 0 H HIS A 44 3.564 16.603 -11.044 1.00 0.00 H new ATOM 0 HA HIS A 44 3.937 14.669 -13.258 1.00 0.00 H new ATOM 0 HB2 HIS A 44 5.514 16.116 -14.135 1.00 0.00 H new ATOM 0 HB3 HIS A 44 4.195 17.151 -13.626 1.00 0.00 H new ATOM 0 HD1 HIS A 44 4.696 18.991 -11.942 1.00 0.00 H new ATOM 0 HD2 HIS A 44 7.835 16.228 -12.369 1.00 0.00 H new ATOM 0 HE1 HIS A 44 6.700 19.936 -10.664 1.00 0.00 H new ATOM 1344 N GLN A 45 6.318 13.920 -12.438 1.00 0.00 N ATOM 1345 CA GLN A 45 7.357 13.117 -11.816 1.00 0.00 C ATOM 1346 C GLN A 45 8.740 13.657 -12.191 1.00 0.00 C ATOM 1347 O GLN A 45 8.885 14.362 -13.188 1.00 0.00 O ATOM 1348 CB GLN A 45 7.220 11.644 -12.205 1.00 0.00 C ATOM 1349 CG GLN A 45 7.614 11.423 -13.667 1.00 0.00 C ATOM 1350 CD GLN A 45 6.656 10.448 -14.352 1.00 0.00 C ATOM 1351 OE1 GLN A 45 5.458 10.666 -14.430 1.00 0.00 O ATOM 1352 NE2 GLN A 45 7.248 9.363 -14.843 1.00 0.00 N ATOM 0 H GLN A 45 6.372 13.974 -13.455 1.00 0.00 H new ATOM 0 HA GLN A 45 7.242 13.184 -10.734 1.00 0.00 H new ATOM 0 HB2 GLN A 45 7.851 11.034 -11.559 1.00 0.00 H new ATOM 0 HB3 GLN A 45 6.192 11.317 -12.048 1.00 0.00 H new ATOM 0 HG2 GLN A 45 7.609 12.376 -14.197 1.00 0.00 H new ATOM 0 HG3 GLN A 45 8.631 11.035 -13.718 1.00 0.00 H new ATOM 0 HE21 GLN A 45 8.256 9.243 -14.743 1.00 0.00 H new ATOM 0 HE22 GLN A 45 6.694 8.651 -15.319 1.00 0.00 H new ATOM 1361 N MET A 46 9.719 13.304 -11.371 1.00 0.00 N ATOM 1362 CA MET A 46 11.085 13.744 -11.604 1.00 0.00 C ATOM 1363 C MET A 46 11.512 13.464 -13.047 1.00 0.00 C ATOM 1364 O MET A 46 12.236 14.256 -13.648 1.00 0.00 O ATOM 1365 CB MET A 46 12.026 13.017 -10.642 1.00 0.00 C ATOM 1366 CG MET A 46 13.395 13.699 -10.594 1.00 0.00 C ATOM 1367 SD MET A 46 14.641 12.619 -11.277 1.00 0.00 S ATOM 1368 CE MET A 46 14.786 11.434 -9.949 1.00 0.00 C ATOM 0 H MET A 46 9.594 12.719 -10.545 1.00 0.00 H new ATOM 0 HA MET A 46 11.136 14.819 -11.432 1.00 0.00 H new ATOM 0 HB2 MET A 46 11.589 13.000 -9.644 1.00 0.00 H new ATOM 0 HB3 MET A 46 12.143 11.980 -10.956 1.00 0.00 H new ATOM 0 HG2 MET A 46 13.365 14.633 -11.155 1.00 0.00 H new ATOM 0 HG3 MET A 46 13.648 13.954 -9.565 1.00 0.00 H new ATOM 0 HE1 MET A 46 15.834 11.170 -9.810 1.00 0.00 H new ATOM 0 HE2 MET A 46 14.396 11.869 -9.029 1.00 0.00 H new ATOM 0 HE3 MET A 46 14.216 10.538 -10.197 1.00 0.00 H new ATOM 1378 N LYS A 47 11.045 12.336 -13.560 1.00 0.00 N ATOM 1379 CA LYS A 47 11.370 11.943 -14.921 1.00 0.00 C ATOM 1380 C LYS A 47 10.940 13.051 -15.884 1.00 0.00 C ATOM 1381 O LYS A 47 11.664 13.378 -16.823 1.00 0.00 O ATOM 1382 CB LYS A 47 10.760 10.577 -15.244 1.00 0.00 C ATOM 1383 CG LYS A 47 11.378 9.987 -16.513 1.00 0.00 C ATOM 1384 CD LYS A 47 10.416 9.006 -17.186 1.00 0.00 C ATOM 1385 CE LYS A 47 10.487 7.628 -16.526 1.00 0.00 C ATOM 1386 NZ LYS A 47 11.519 6.792 -17.181 1.00 0.00 N ATOM 0 H LYS A 47 10.444 11.682 -13.059 1.00 0.00 H new ATOM 0 HA LYS A 47 12.447 11.821 -15.035 1.00 0.00 H new ATOM 0 HB2 LYS A 47 10.919 9.897 -14.407 1.00 0.00 H new ATOM 0 HB3 LYS A 47 9.682 10.677 -15.373 1.00 0.00 H new ATOM 0 HG2 LYS A 47 11.629 10.789 -17.207 1.00 0.00 H new ATOM 0 HG3 LYS A 47 12.309 9.477 -16.265 1.00 0.00 H new ATOM 0 HD2 LYS A 47 9.398 9.390 -17.125 1.00 0.00 H new ATOM 0 HD3 LYS A 47 10.661 8.919 -18.245 1.00 0.00 H new ATOM 0 HE2 LYS A 47 10.718 7.737 -15.466 1.00 0.00 H new ATOM 0 HE3 LYS A 47 9.516 7.136 -16.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 11.882 6.093 -16.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 11.101 6.299 -17.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 12.300 7.396 -17.506 1.00 0.00 H new ATOM 1399 N ASP A 48 9.764 13.600 -15.618 1.00 0.00 N ATOM 1400 CA ASP A 48 9.229 14.666 -16.449 1.00 0.00 C ATOM 1401 C ASP A 48 9.193 15.966 -15.644 1.00 0.00 C ATOM 1402 O ASP A 48 8.339 16.820 -15.875 1.00 0.00 O ATOM 1403 CB ASP A 48 7.802 14.349 -16.900 1.00 0.00 C ATOM 1404 CG ASP A 48 7.416 14.913 -18.269 1.00 0.00 C ATOM 1405 OD1 ASP A 48 7.472 16.131 -18.497 1.00 0.00 O ATOM 1406 OD2 ASP A 48 7.040 14.034 -19.134 1.00 0.00 O ATOM 0 H ASP A 48 9.166 13.327 -14.838 1.00 0.00 H new ATOM 0 HA ASP A 48 9.870 14.765 -17.325 1.00 0.00 H new ATOM 0 HB2 ASP A 48 7.676 13.267 -16.921 1.00 0.00 H new ATOM 0 HB3 ASP A 48 7.107 14.737 -16.155 1.00 0.00 H new ATOM 1412 N CYS A 49 10.132 16.075 -14.714 1.00 0.00 N ATOM 1413 CA CYS A 49 10.218 17.257 -13.874 1.00 0.00 C ATOM 1414 C CYS A 49 9.997 18.489 -14.753 1.00 0.00 C ATOM 1415 O CYS A 49 10.826 18.806 -15.605 1.00 0.00 O ATOM 1416 CB CYS A 49 11.552 17.322 -13.125 1.00 0.00 C ATOM 1417 SG CYS A 49 11.520 18.690 -11.910 1.00 0.00 S ATOM 0 H CYS A 49 10.839 15.364 -14.525 1.00 0.00 H new ATOM 0 HA CYS A 49 9.446 17.217 -13.106 1.00 0.00 H new ATOM 0 HB2 CYS A 49 11.739 16.377 -12.616 1.00 0.00 H new ATOM 0 HB3 CYS A 49 12.369 17.471 -13.832 1.00 0.00 H new ATOM 1422 N THR A 50 8.874 19.152 -14.516 1.00 0.00 N ATOM 1423 CA THR A 50 8.533 20.343 -15.275 1.00 0.00 C ATOM 1424 C THR A 50 9.233 21.569 -14.687 1.00 0.00 C ATOM 1425 O THR A 50 9.053 22.684 -15.173 1.00 0.00 O ATOM 1426 CB THR A 50 7.008 20.467 -15.299 1.00 0.00 C ATOM 1427 OG1 THR A 50 6.764 21.572 -16.165 1.00 0.00 O ATOM 1428 CG2 THR A 50 6.436 20.915 -13.953 1.00 0.00 C ATOM 0 H THR A 50 8.189 18.886 -13.809 1.00 0.00 H new ATOM 0 HA THR A 50 8.884 20.270 -16.304 1.00 0.00 H new ATOM 0 HB THR A 50 6.570 19.509 -15.578 1.00 0.00 H new ATOM 0 HG1 THR A 50 7.448 22.259 -16.020 1.00 0.00 H new ATOM 0 HG21 THR A 50 5.351 20.987 -14.025 1.00 0.00 H new ATOM 0 HG22 THR A 50 6.701 20.189 -13.185 1.00 0.00 H new ATOM 0 HG23 THR A 50 6.848 21.889 -13.689 1.00 0.00 H new ATOM 1436 N GLU A 51 10.019 21.321 -13.648 1.00 0.00 N ATOM 1437 CA GLU A 51 10.747 22.393 -12.989 1.00 0.00 C ATOM 1438 C GLU A 51 9.885 23.654 -12.917 1.00 0.00 C ATOM 1439 O GLU A 51 10.209 24.667 -13.536 1.00 0.00 O ATOM 1440 CB GLU A 51 12.072 22.672 -13.699 1.00 0.00 C ATOM 1441 CG GLU A 51 11.849 22.950 -15.187 1.00 0.00 C ATOM 1442 CD GLU A 51 13.165 23.301 -15.883 1.00 0.00 C ATOM 1443 OE1 GLU A 51 13.948 22.399 -16.220 1.00 0.00 O ATOM 1444 OE2 GLU A 51 13.363 24.561 -16.072 1.00 0.00 O ATOM 0 H GLU A 51 10.167 20.395 -13.247 1.00 0.00 H new ATOM 0 HA GLU A 51 10.978 22.078 -11.972 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.564 23.527 -13.235 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.739 21.818 -13.581 1.00 0.00 H new ATOM 0 HG2 GLU A 51 11.405 22.075 -15.661 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.141 23.770 -15.305 1.00 0.00 H new ATOM 1452 N ARG A 52 8.805 23.554 -12.156 1.00 0.00 N ATOM 1453 CA ARG A 52 7.895 24.675 -11.996 1.00 0.00 C ATOM 1454 C ARG A 52 6.858 24.366 -10.915 1.00 0.00 C ATOM 1455 O ARG A 52 6.410 23.228 -10.786 1.00 0.00 O ATOM 1456 CB ARG A 52 7.175 24.991 -13.309 1.00 0.00 C ATOM 1457 CG ARG A 52 7.396 26.448 -13.718 1.00 0.00 C ATOM 1458 CD ARG A 52 6.528 26.818 -14.922 1.00 0.00 C ATOM 1459 NE ARG A 52 7.298 27.663 -15.862 1.00 0.00 N ATOM 1460 CZ ARG A 52 7.632 28.949 -15.624 1.00 0.00 C ATOM 1461 NH1 ARG A 52 7.265 29.549 -14.471 1.00 0.00 N ATOM 1462 NH2 ARG A 52 8.321 29.611 -16.533 1.00 0.00 N ATOM 0 H ARG A 52 8.540 22.713 -11.643 1.00 0.00 H new ATOM 0 HA ARG A 52 8.485 25.542 -11.701 1.00 0.00 H new ATOM 0 HB2 ARG A 52 7.538 24.330 -14.096 1.00 0.00 H new ATOM 0 HB3 ARG A 52 6.108 24.798 -13.198 1.00 0.00 H new ATOM 0 HG2 ARG A 52 7.160 27.104 -12.880 1.00 0.00 H new ATOM 0 HG3 ARG A 52 8.447 26.606 -13.961 1.00 0.00 H new ATOM 0 HD2 ARG A 52 6.189 25.914 -15.427 1.00 0.00 H new ATOM 0 HD3 ARG A 52 5.637 27.350 -14.588 1.00 0.00 H new ATOM 0 HE ARG A 52 7.595 27.248 -16.745 1.00 0.00 H new ATOM 0 HH11 ARG A 52 6.732 29.030 -13.773 1.00 0.00 H new ATOM 0 HH12 ARG A 52 7.521 30.521 -14.298 1.00 0.00 H new ATOM 0 HH21 ARG A 52 8.594 29.151 -17.401 1.00 0.00 H new ATOM 0 HH22 ARG A 52 8.581 30.583 -16.368 1.00 0.00 H new ATOM 1475 N GLN A 53 6.506 25.400 -10.165 1.00 0.00 N ATOM 1476 CA GLN A 53 5.530 25.253 -9.099 1.00 0.00 C ATOM 1477 C GLN A 53 4.664 26.511 -8.995 1.00 0.00 C ATOM 1478 O GLN A 53 4.682 27.200 -7.977 1.00 0.00 O ATOM 1479 CB GLN A 53 6.216 24.949 -7.766 1.00 0.00 C ATOM 1480 CG GLN A 53 7.111 26.111 -7.332 1.00 0.00 C ATOM 1481 CD GLN A 53 6.679 26.658 -5.970 1.00 0.00 C ATOM 1482 OE1 GLN A 53 5.504 26.805 -5.676 1.00 0.00 O ATOM 1483 NE2 GLN A 53 7.691 26.951 -5.159 1.00 0.00 N ATOM 0 H GLN A 53 6.879 26.343 -10.275 1.00 0.00 H new ATOM 0 HA GLN A 53 4.884 24.409 -9.339 1.00 0.00 H new ATOM 0 HB2 GLN A 53 5.463 24.760 -7.001 1.00 0.00 H new ATOM 0 HB3 GLN A 53 6.812 24.041 -7.859 1.00 0.00 H new ATOM 0 HG2 GLN A 53 8.147 25.777 -7.281 1.00 0.00 H new ATOM 0 HG3 GLN A 53 7.068 26.905 -8.077 1.00 0.00 H new ATOM 0 HE21 GLN A 53 8.652 26.804 -5.468 1.00 0.00 H new ATOM 0 HE22 GLN A 53 7.507 27.323 -4.227 1.00 0.00 H new ATOM 1492 N ALA A 54 3.925 26.772 -10.065 1.00 0.00 N ATOM 1493 CA ALA A 54 3.054 27.934 -10.107 1.00 0.00 C ATOM 1494 C ALA A 54 1.734 27.553 -10.780 1.00 0.00 C ATOM 1495 O ALA A 54 1.606 26.458 -11.326 1.00 0.00 O ATOM 1496 CB ALA A 54 3.767 29.080 -10.828 1.00 0.00 C ATOM 0 H ALA A 54 3.912 26.198 -10.908 1.00 0.00 H new ATOM 0 HA ALA A 54 2.822 28.277 -9.099 1.00 0.00 H new ATOM 0 HB1 ALA A 54 3.114 29.952 -10.860 1.00 0.00 H new ATOM 0 HB2 ALA A 54 4.683 29.332 -10.294 1.00 0.00 H new ATOM 0 HB3 ALA A 54 4.013 28.773 -11.845 1.00 0.00 H new ATOM 1502 N ASN A 55 0.787 28.477 -10.717 1.00 0.00 N ATOM 1503 CA ASN A 55 -0.519 28.250 -11.313 1.00 0.00 C ATOM 1504 C ASN A 55 -0.697 29.186 -12.511 1.00 0.00 C ATOM 1505 O ASN A 55 -0.501 30.395 -12.393 1.00 0.00 O ATOM 1506 CB ASN A 55 -1.640 28.544 -10.313 1.00 0.00 C ATOM 1507 CG ASN A 55 -1.492 27.685 -9.056 1.00 0.00 C ATOM 1508 OD1 ASN A 55 -1.944 26.553 -8.990 1.00 0.00 O ATOM 1509 ND2 ASN A 55 -0.836 28.283 -8.066 1.00 0.00 N ATOM 0 H ASN A 55 0.897 29.384 -10.263 1.00 0.00 H new ATOM 0 HA ASN A 55 -0.573 27.205 -11.619 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -1.622 29.599 -10.041 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -2.607 28.351 -10.778 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -0.685 27.792 -7.185 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -0.484 29.233 -8.188 1.00 0.00 H new TER 1516 ASN A 55 HETATM 1517 ZN ZN A 56 8.401 7.248 1.108 1.00 0.00 ZN HETATM 1518 ZN ZN A 57 9.614 18.345 -10.671 1.00 0.00 ZN