USER MOD reduce.3.24.130724 H: found=0, std=0, add=657, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 643 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 23 HIS HE2 : A 23 HIS NE2 : A 56 ZNZN :(H bumps) USER MOD NoAdj-H: A 44 HIS HE2 : A 44 HIS NE2 : A 57 ZNZN :(H bumps) USER MOD Set 1.1: A 5 ASN : amide:sc= 0.853 K(o=1.5,f=-4.1!) USER MOD Set 1.2: B 212 G O2' : rot -16:sc= 0.689 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 173:sc= 0 (180deg=-0.0526) USER MOD Single : A 2 GLN : amide:sc= -0.485 X(o=-0.48,f=-0.25) USER MOD Single : A 3 LYS NZ :NH3+ -127:sc= 0.533 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= -14! C(o=-14!,f=-20!) USER MOD Single : A 9 GLN : amide:sc= -2.49 K(o=-2.5,f=-11!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 0.723 K(o=0.72,f=-5.8!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -105:sc= 0.0616 (180deg=0) USER MOD Single : A 27 ASN : amide:sc= -1.48 K(o=-1.5,f=-0.087) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -2.37 K(o=-2.4,f=-0.67) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -20:sc= 0.906 USER MOD Single : A 53 GLN : amide:sc= -2.51 X(o=-2.5,f=-2!) USER MOD Single : A 55 ASN : amide:sc= -1 K(o=-1,f=-2.3) USER MOD Single : B 201 G O2' : rot -113:sc= 1.31 USER MOD Single : B 202 G O2' : rot -12:sc= -0.227 USER MOD Single : B 203 A O2' : rot 0:sc= -0.551 USER MOD Single : B 204 C O2' : rot -88:sc= 1.16 USER MOD Single : B 205 U O2' : rot 1:sc= -0.67 USER MOD Single : B 206 A O2' : rot 9:sc= -1.88 USER MOD Single : B 207 G O2' : rot -29:sc= 0.578 USER MOD Single : B 208 C O2' : rot -43:sc= 1.21 USER MOD Single : B 209 G O2' : rot -135:sc= 0.259 USER MOD Single : B 210 G O2' : rot -8:sc= 0.631 USER MOD Single : B 211 A O2' : rot 180:sc= -0.14 USER MOD Single : B 213 G O2' : rot -143:sc= 0.937 USER MOD Single : B 214 C O2' : rot 2:sc= -0.133 USER MOD Single : B 215 U O2' : rot -146:sc= -0.446 USER MOD Single : B 216 A O2' : rot -145:sc= -0.859 USER MOD Single : B 217 G O2' : rot 3:sc= -0.304 USER MOD Single : B 218 U O2' : rot -4:sc= -1.21 USER MOD Single : B 219 C O2' : rot 42:sc= 0.595 USER MOD Single : B 220 C O2' : rot -30:sc= 0.545 USER MOD Single : B 220 C O3' : rot 180:sc= 0.344 USER MOD ----------------------------------------------------------------- ATOM 1 P G B 201 0.156 -20.652 -7.496 1.00 0.00 P ATOM 2 OP1 G B 201 0.533 -19.238 -7.717 1.00 0.00 O ATOM 3 OP2 G B 201 0.748 -21.665 -8.398 1.00 0.00 O ATOM 4 O5' G B 201 0.547 -21.038 -5.994 1.00 0.00 O ATOM 5 C5' G B 201 0.396 -20.080 -4.948 1.00 0.00 C ATOM 6 C4' G B 201 1.174 -20.515 -3.727 1.00 0.00 C ATOM 7 O4' G B 201 1.673 -21.775 -3.644 1.00 0.00 O ATOM 8 C3' G B 201 2.457 -19.726 -3.483 1.00 0.00 C ATOM 9 O3' G B 201 2.133 -18.454 -2.927 1.00 0.00 O ATOM 10 C2' G B 201 3.259 -20.560 -2.523 1.00 0.00 C ATOM 11 O2' G B 201 2.710 -20.208 -1.273 1.00 0.00 O ATOM 12 C1' G B 201 2.921 -21.964 -3.016 1.00 0.00 C ATOM 13 N9 G B 201 3.916 -22.513 -3.961 1.00 0.00 N ATOM 14 C8 G B 201 4.380 -21.936 -5.090 1.00 0.00 C ATOM 15 N7 G B 201 5.274 -22.690 -5.721 1.00 0.00 N ATOM 16 C5 G B 201 5.374 -23.807 -4.936 1.00 0.00 C ATOM 17 C6 G B 201 6.156 -24.975 -5.067 1.00 0.00 C ATOM 18 O6 G B 201 6.944 -25.205 -5.983 1.00 0.00 O ATOM 19 N1 G B 201 6.030 -25.924 -4.101 1.00 0.00 N ATOM 20 C2 G B 201 5.172 -25.698 -3.082 1.00 0.00 C ATOM 21 N2 G B 201 5.162 -26.715 -2.223 1.00 0.00 N ATOM 22 N3 G B 201 4.382 -24.630 -2.858 1.00 0.00 N ATOM 23 C4 G B 201 4.555 -23.720 -3.856 1.00 0.00 C ATOM 0 H5' G B 201 -0.659 -19.969 -4.696 1.00 0.00 H new ATOM 0 H5'' G B 201 0.748 -19.105 -5.284 1.00 0.00 H new ATOM 0 H4' G B 201 0.349 -20.369 -3.030 1.00 0.00 H new ATOM 0 H3' G B 201 3.020 -19.537 -4.397 1.00 0.00 H new ATOM 0 H2' G B 201 4.341 -20.451 -2.452 1.00 0.00 H new ATOM 0 HO2' G B 201 3.377 -19.718 -0.749 1.00 0.00 H new ATOM 0 H1' G B 201 2.911 -22.691 -2.204 1.00 0.00 H new ATOM 0 H8 G B 201 4.059 -20.967 -5.442 1.00 0.00 H new ATOM 0 H1 G B 201 6.571 -26.787 -4.145 1.00 0.00 H new ATOM 0 H21 G B 201 4.559 -26.683 -1.401 1.00 0.00 H new ATOM 0 H22 G B 201 5.758 -27.527 -2.387 1.00 0.00 H new ATOM 35 P G B 202 2.790 -17.125 -3.531 1.00 0.00 P ATOM 36 OP1 G B 202 1.744 -16.096 -3.727 1.00 0.00 O ATOM 37 OP2 G B 202 3.633 -17.473 -4.696 1.00 0.00 O ATOM 38 O5' G B 202 3.753 -16.633 -2.353 1.00 0.00 O ATOM 39 C5' G B 202 3.313 -16.695 -0.998 1.00 0.00 C ATOM 40 C4' G B 202 4.402 -17.277 -0.124 1.00 0.00 C ATOM 41 O4' G B 202 4.626 -18.505 -0.644 1.00 0.00 O ATOM 42 C3' G B 202 5.789 -16.690 -0.371 1.00 0.00 C ATOM 43 O3' G B 202 6.012 -15.604 0.525 1.00 0.00 O ATOM 44 C2' G B 202 6.748 -17.820 -0.119 1.00 0.00 C ATOM 45 O2' G B 202 6.903 -17.786 1.283 1.00 0.00 O ATOM 46 C1' G B 202 5.946 -19.000 -0.661 1.00 0.00 C ATOM 47 N9 G B 202 6.346 -19.408 -2.024 1.00 0.00 N ATOM 48 C8 G B 202 6.089 -18.762 -3.181 1.00 0.00 C ATOM 49 N7 G B 202 6.587 -19.391 -4.240 1.00 0.00 N ATOM 50 C5 G B 202 7.195 -20.498 -3.710 1.00 0.00 C ATOM 51 C6 G B 202 7.902 -21.557 -4.317 1.00 0.00 C ATOM 52 O6 G B 202 8.111 -21.676 -5.524 1.00 0.00 O ATOM 53 N1 G B 202 8.396 -22.529 -3.502 1.00 0.00 N ATOM 54 C2 G B 202 8.183 -22.424 -2.171 1.00 0.00 C ATOM 55 N2 G B 202 8.725 -23.447 -1.513 1.00 0.00 N ATOM 56 N3 G B 202 7.527 -21.466 -1.489 1.00 0.00 N ATOM 57 C4 G B 202 7.060 -20.528 -2.358 1.00 0.00 C ATOM 0 H5' G B 202 2.413 -17.306 -0.927 1.00 0.00 H new ATOM 0 H5'' G B 202 3.049 -15.697 -0.647 1.00 0.00 H new ATOM 0 H4' G B 202 4.076 -17.150 0.908 1.00 0.00 H new ATOM 0 H3' G B 202 5.910 -16.296 -1.380 1.00 0.00 H new ATOM 0 H2' G B 202 7.743 -17.822 -0.564 1.00 0.00 H new ATOM 0 HO2' G B 202 6.520 -16.955 1.634 1.00 0.00 H new ATOM 0 H1' G B 202 6.095 -19.903 -0.070 1.00 0.00 H new ATOM 0 H8 G B 202 5.538 -17.835 -3.239 1.00 0.00 H new ATOM 0 H1 G B 202 8.915 -23.318 -3.887 1.00 0.00 H new ATOM 0 H21 G B 202 8.643 -23.501 -0.498 1.00 0.00 H new ATOM 0 H22 G B 202 9.222 -24.176 -2.024 1.00 0.00 H new ATOM 69 P A B 203 7.301 -14.674 0.350 1.00 0.00 P ATOM 70 OP1 A B 203 7.388 -13.723 1.482 1.00 0.00 O ATOM 71 OP2 A B 203 7.327 -14.110 -1.018 1.00 0.00 O ATOM 72 O5' A B 203 8.513 -15.710 0.480 1.00 0.00 O ATOM 73 C5' A B 203 9.160 -15.895 1.737 1.00 0.00 C ATOM 74 C4' A B 203 10.584 -16.360 1.526 1.00 0.00 C ATOM 75 O4' A B 203 10.353 -17.418 0.722 1.00 0.00 O ATOM 76 C3' A B 203 11.376 -15.525 0.524 1.00 0.00 C ATOM 77 O3' A B 203 12.171 -14.570 1.225 1.00 0.00 O ATOM 78 C2' A B 203 12.229 -16.509 -0.226 1.00 0.00 C ATOM 79 O2' A B 203 13.346 -16.660 0.622 1.00 0.00 O ATOM 80 C1' A B 203 11.289 -17.708 -0.292 1.00 0.00 C ATOM 81 N9 A B 203 10.625 -17.866 -1.603 1.00 0.00 N ATOM 82 C8 A B 203 9.599 -17.139 -2.094 1.00 0.00 C ATOM 83 N7 A B 203 9.229 -17.532 -3.309 1.00 0.00 N ATOM 84 C5 A B 203 10.076 -18.569 -3.592 1.00 0.00 C ATOM 85 C6 A B 203 10.189 -19.401 -4.725 1.00 0.00 C ATOM 86 N6 A B 203 9.404 -19.306 -5.831 1.00 0.00 N ATOM 87 N1 A B 203 11.153 -20.362 -4.704 1.00 0.00 N ATOM 88 C2 A B 203 11.938 -20.463 -3.608 1.00 0.00 C ATOM 89 N3 A B 203 11.919 -19.730 -2.480 1.00 0.00 N ATOM 90 C4 A B 203 10.937 -18.790 -2.564 1.00 0.00 C ATOM 0 H5' A B 203 8.614 -16.628 2.331 1.00 0.00 H new ATOM 0 H5'' A B 203 9.154 -14.961 2.299 1.00 0.00 H new ATOM 0 H4' A B 203 11.096 -16.421 2.486 1.00 0.00 H new ATOM 0 H3' A B 203 10.738 -14.964 -0.159 1.00 0.00 H new ATOM 0 H2' A B 203 12.600 -16.283 -1.226 1.00 0.00 H new ATOM 0 HO2' A B 203 13.231 -16.099 1.417 1.00 0.00 H new ATOM 0 H1' A B 203 11.818 -18.651 -0.159 1.00 0.00 H new ATOM 0 H8 A B 203 9.130 -16.327 -1.558 1.00 0.00 H new ATOM 0 H61 A B 203 9.546 -19.945 -6.613 1.00 0.00 H new ATOM 0 H62 A B 203 8.673 -18.596 -5.878 1.00 0.00 H new ATOM 0 H2 A B 203 12.686 -21.242 -3.643 1.00 0.00 H new ATOM 102 P C B 204 12.667 -13.242 0.484 1.00 0.00 P ATOM 103 OP1 C B 204 13.302 -12.332 1.462 1.00 0.00 O ATOM 104 OP2 C B 204 11.570 -12.695 -0.346 1.00 0.00 O ATOM 105 O5' C B 204 13.807 -13.784 -0.500 1.00 0.00 O ATOM 106 C5' C B 204 15.027 -14.292 0.034 1.00 0.00 C ATOM 107 C4' C B 204 15.796 -15.031 -1.038 1.00 0.00 C ATOM 108 O4' C B 204 14.907 -15.883 -1.557 1.00 0.00 O ATOM 109 C3' C B 204 16.023 -14.230 -2.317 1.00 0.00 C ATOM 110 O3' C B 204 17.245 -13.502 -2.210 1.00 0.00 O ATOM 111 C2' C B 204 16.083 -15.251 -3.419 1.00 0.00 C ATOM 112 O2' C B 204 17.441 -15.633 -3.414 1.00 0.00 O ATOM 113 C1' C B 204 15.106 -16.298 -2.891 1.00 0.00 C ATOM 114 N1 C B 204 13.830 -16.339 -3.633 1.00 0.00 N ATOM 115 C2 C B 204 13.693 -17.300 -4.633 1.00 0.00 C ATOM 116 O2 C B 204 14.637 -18.066 -4.851 1.00 0.00 O ATOM 117 N3 C B 204 12.539 -17.358 -5.324 1.00 0.00 N ATOM 118 C4 C B 204 11.541 -16.532 -5.078 1.00 0.00 C ATOM 119 N4 C B 204 10.412 -16.605 -5.770 1.00 0.00 N ATOM 120 C5 C B 204 11.657 -15.527 -4.047 1.00 0.00 C ATOM 121 C6 C B 204 12.813 -15.483 -3.368 1.00 0.00 C ATOM 0 H5' C B 204 14.817 -14.961 0.868 1.00 0.00 H new ATOM 0 H5'' C B 204 15.630 -13.473 0.426 1.00 0.00 H new ATOM 0 H4' C B 204 16.721 -15.370 -0.571 1.00 0.00 H new ATOM 0 H3' C B 204 15.236 -13.500 -2.507 1.00 0.00 H new ATOM 0 H2' C B 204 15.816 -14.988 -4.443 1.00 0.00 H new ATOM 0 HO2' C B 204 17.951 -15.034 -3.998 1.00 0.00 H new ATOM 0 H1' C B 204 15.494 -17.311 -2.994 1.00 0.00 H new ATOM 0 H41 C B 204 9.648 -15.960 -5.569 1.00 0.00 H new ATOM 0 H42 C B 204 10.308 -17.306 -6.503 1.00 0.00 H new ATOM 0 H5 C B 204 10.850 -14.842 -3.833 1.00 0.00 H new ATOM 0 H6 C B 204 12.937 -14.745 -2.589 1.00 0.00 H new ATOM 133 P U B 205 17.307 -11.971 -2.667 1.00 0.00 P ATOM 134 OP1 U B 205 17.840 -11.141 -1.563 1.00 0.00 O ATOM 135 OP2 U B 205 16.007 -11.573 -3.254 1.00 0.00 O ATOM 136 O5' U B 205 18.393 -11.988 -3.842 1.00 0.00 O ATOM 137 C5' U B 205 19.540 -12.830 -3.738 1.00 0.00 C ATOM 138 C4' U B 205 19.769 -13.560 -5.042 1.00 0.00 C ATOM 139 O4' U B 205 18.484 -14.000 -5.159 1.00 0.00 O ATOM 140 C3' U B 205 19.690 -12.675 -6.282 1.00 0.00 C ATOM 141 O3' U B 205 21.007 -12.291 -6.674 1.00 0.00 O ATOM 142 C2' U B 205 19.027 -13.521 -7.332 1.00 0.00 C ATOM 143 O2' U B 205 20.119 -14.166 -7.947 1.00 0.00 O ATOM 144 C1' U B 205 18.144 -14.412 -6.463 1.00 0.00 C ATOM 145 N1 U B 205 16.699 -14.238 -6.719 1.00 0.00 N ATOM 146 C2 U B 205 16.136 -15.098 -7.612 1.00 0.00 C ATOM 147 O2 U B 205 16.756 -15.976 -8.190 1.00 0.00 O ATOM 148 N3 U B 205 14.790 -14.937 -7.851 1.00 0.00 N ATOM 149 C4 U B 205 14.019 -13.977 -7.244 1.00 0.00 C ATOM 150 O4 U B 205 12.825 -13.926 -7.534 1.00 0.00 O ATOM 151 C5 U B 205 14.657 -13.106 -6.321 1.00 0.00 C ATOM 152 C6 U B 205 15.962 -13.280 -6.104 1.00 0.00 C ATOM 0 H5' U B 205 19.401 -13.548 -2.930 1.00 0.00 H new ATOM 0 H5'' U B 205 20.417 -12.233 -3.487 1.00 0.00 H new ATOM 0 H4' U B 205 20.684 -14.151 -5.013 1.00 0.00 H new ATOM 0 H3' U B 205 19.129 -11.756 -6.113 1.00 0.00 H new ATOM 0 H2' U B 205 18.424 -13.068 -8.119 1.00 0.00 H new ATOM 0 HO2' U B 205 20.951 -13.888 -7.511 1.00 0.00 H new ATOM 0 H1' U B 205 18.312 -15.471 -6.658 1.00 0.00 H new ATOM 0 H3 U B 205 14.340 -15.566 -8.516 1.00 0.00 H new ATOM 0 H5 U B 205 14.105 -12.330 -5.812 1.00 0.00 H new ATOM 0 H6 U B 205 16.457 -12.624 -5.403 1.00 0.00 H new ATOM 163 P A B 206 21.385 -10.742 -6.794 1.00 0.00 P ATOM 164 OP1 A B 206 22.845 -10.570 -6.618 1.00 0.00 O ATOM 165 OP2 A B 206 20.493 -9.942 -5.925 1.00 0.00 O ATOM 166 O5' A B 206 21.029 -10.400 -8.316 1.00 0.00 O ATOM 167 C5' A B 206 21.125 -11.414 -9.315 1.00 0.00 C ATOM 168 C4' A B 206 19.987 -11.280 -10.302 1.00 0.00 C ATOM 169 O4' A B 206 18.962 -11.900 -10.496 1.00 0.00 O ATOM 170 C3' A B 206 19.535 -9.844 -10.552 1.00 0.00 C ATOM 171 O3' A B 206 20.632 -9.081 -11.051 1.00 0.00 O ATOM 172 C2' A B 206 18.428 -9.946 -11.564 1.00 0.00 C ATOM 173 O2' A B 206 19.104 -9.747 -12.785 1.00 0.00 O ATOM 174 C1' A B 206 17.941 -11.369 -11.308 1.00 0.00 C ATOM 175 N9 A B 206 16.630 -11.430 -10.629 1.00 0.00 N ATOM 176 C8 A B 206 16.380 -11.247 -9.315 1.00 0.00 C ATOM 177 N7 A B 206 15.090 -11.369 -9.018 1.00 0.00 N ATOM 178 C5 A B 206 14.499 -11.645 -10.222 1.00 0.00 C ATOM 179 C6 A B 206 13.153 -11.881 -10.570 1.00 0.00 C ATOM 180 N6 A B 206 12.118 -11.873 -9.690 1.00 0.00 N ATOM 181 N1 A B 206 12.879 -12.133 -11.879 1.00 0.00 N ATOM 182 C2 A B 206 13.903 -12.143 -12.762 1.00 0.00 C ATOM 183 N3 A B 206 15.215 -11.933 -12.543 1.00 0.00 N ATOM 184 C4 A B 206 15.421 -11.688 -11.219 1.00 0.00 C ATOM 0 H5' A B 206 21.098 -12.399 -8.849 1.00 0.00 H new ATOM 0 H5'' A B 206 22.079 -11.334 -9.835 1.00 0.00 H new ATOM 0 H4' A B 206 20.678 -11.887 -10.887 1.00 0.00 H new ATOM 0 H3' A B 206 19.189 -9.345 -9.647 1.00 0.00 H new ATOM 0 H2' A B 206 17.580 -9.262 -11.540 1.00 0.00 H new ATOM 0 HO2' A B 206 20.071 -9.757 -12.629 1.00 0.00 H new ATOM 0 H1' A B 206 17.774 -11.918 -12.235 1.00 0.00 H new ATOM 0 H8 A B 206 17.144 -11.026 -8.585 1.00 0.00 H new ATOM 0 H61 A B 206 11.169 -12.053 -10.017 1.00 0.00 H new ATOM 0 H62 A B 206 12.290 -11.687 -8.702 1.00 0.00 H new ATOM 0 H2 A B 206 13.630 -12.348 -13.787 1.00 0.00 H new ATOM 196 P G B 207 20.915 -7.615 -10.474 1.00 0.00 P ATOM 197 OP1 G B 207 22.326 -7.246 -10.720 1.00 0.00 O ATOM 198 OP2 G B 207 20.416 -7.521 -9.084 1.00 0.00 O ATOM 199 O5' G B 207 19.993 -6.684 -11.393 1.00 0.00 O ATOM 200 C5' G B 207 19.865 -6.959 -12.786 1.00 0.00 C ATOM 201 C4' G B 207 18.406 -6.983 -13.179 1.00 0.00 C ATOM 202 O4' G B 207 17.441 -7.854 -13.062 1.00 0.00 O ATOM 203 C3' G B 207 17.630 -5.724 -12.801 1.00 0.00 C ATOM 204 O3' G B 207 18.273 -4.583 -13.365 1.00 0.00 O ATOM 205 C2' G B 207 16.253 -5.920 -13.372 1.00 0.00 C ATOM 206 O2' G B 207 16.389 -5.424 -14.685 1.00 0.00 O ATOM 207 C1' G B 207 16.109 -7.434 -13.256 1.00 0.00 C ATOM 208 N9 G B 207 15.247 -7.859 -12.133 1.00 0.00 N ATOM 209 C8 G B 207 15.566 -7.896 -10.822 1.00 0.00 C ATOM 210 N7 G B 207 14.567 -8.327 -10.061 1.00 0.00 N ATOM 211 C5 G B 207 13.559 -8.577 -10.954 1.00 0.00 C ATOM 212 C6 G B 207 12.244 -9.053 -10.771 1.00 0.00 C ATOM 213 O6 G B 207 11.738 -9.350 -9.689 1.00 0.00 O ATOM 214 N1 G B 207 11.469 -9.198 -11.880 1.00 0.00 N ATOM 215 C2 G B 207 11.999 -8.880 -13.082 1.00 0.00 C ATOM 216 N2 G B 207 11.121 -9.074 -14.065 1.00 0.00 N ATOM 217 N3 G B 207 13.230 -8.420 -13.372 1.00 0.00 N ATOM 218 C4 G B 207 13.952 -8.298 -12.224 1.00 0.00 C ATOM 0 H5' G B 207 20.328 -7.918 -13.019 1.00 0.00 H new ATOM 0 H5'' G B 207 20.393 -6.201 -13.364 1.00 0.00 H new ATOM 0 H4' G B 207 18.856 -7.260 -14.132 1.00 0.00 H new ATOM 0 H3' G B 207 17.584 -5.561 -11.724 1.00 0.00 H new ATOM 0 H2' G B 207 15.385 -5.437 -12.923 1.00 0.00 H new ATOM 0 HO2' G B 207 17.076 -4.725 -14.701 1.00 0.00 H new ATOM 0 H1' G B 207 15.624 -7.868 -14.130 1.00 0.00 H new ATOM 0 H8 G B 207 16.531 -7.606 -10.433 1.00 0.00 H new ATOM 0 H1 G B 207 10.510 -9.539 -11.806 1.00 0.00 H new ATOM 0 H21 G B 207 11.384 -8.875 -15.030 1.00 0.00 H new ATOM 0 H22 G B 207 10.186 -9.422 -13.852 1.00 0.00 H new ATOM 230 P C B 208 18.835 -3.429 -12.411 1.00 0.00 P ATOM 231 OP1 C B 208 19.925 -2.700 -13.098 1.00 0.00 O ATOM 232 OP2 C B 208 19.126 -3.987 -11.072 1.00 0.00 O ATOM 233 O5' C B 208 17.587 -2.437 -12.273 1.00 0.00 O ATOM 234 C5' C B 208 17.350 -1.446 -13.271 1.00 0.00 C ATOM 235 C4' C B 208 15.951 -1.593 -13.826 1.00 0.00 C ATOM 236 O4' C B 208 15.345 -2.480 -14.077 1.00 0.00 O ATOM 237 C3' C B 208 14.990 -0.480 -13.415 1.00 0.00 C ATOM 238 O3' C B 208 15.128 0.620 -14.311 1.00 0.00 O ATOM 239 C2' C B 208 13.619 -1.090 -13.496 1.00 0.00 C ATOM 240 O2' C B 208 13.037 -0.401 -14.580 1.00 0.00 O ATOM 241 C1' C B 208 13.972 -2.551 -13.762 1.00 0.00 C ATOM 242 N1 C B 208 13.735 -3.434 -12.602 1.00 0.00 N ATOM 243 C2 C B 208 12.540 -4.152 -12.567 1.00 0.00 C ATOM 244 O2 C B 208 11.742 -4.017 -13.501 1.00 0.00 O ATOM 245 N3 C B 208 12.302 -4.964 -11.521 1.00 0.00 N ATOM 246 C4 C B 208 13.165 -5.096 -10.534 1.00 0.00 C ATOM 247 N4 C B 208 12.912 -5.902 -9.511 1.00 0.00 N ATOM 248 C5 C B 208 14.411 -4.364 -10.546 1.00 0.00 C ATOM 249 C6 C B 208 14.634 -3.559 -11.595 1.00 0.00 C ATOM 0 H5' C B 208 18.081 -1.545 -14.074 1.00 0.00 H new ATOM 0 H5'' C B 208 17.478 -0.451 -12.845 1.00 0.00 H new ATOM 0 H4' C B 208 16.525 -1.643 -14.751 1.00 0.00 H new ATOM 0 H3' C B 208 15.186 -0.098 -12.413 1.00 0.00 H new ATOM 0 H2' C B 208 12.928 -1.031 -12.655 1.00 0.00 H new ATOM 0 HO2' C B 208 13.253 0.553 -14.516 1.00 0.00 H new ATOM 0 H1' C B 208 13.353 -2.987 -14.546 1.00 0.00 H new ATOM 0 H41 C B 208 13.590 -5.994 -8.754 1.00 0.00 H new ATOM 0 H42 C B 208 12.040 -6.430 -9.481 1.00 0.00 H new ATOM 0 H5 C B 208 15.130 -4.461 -9.746 1.00 0.00 H new ATOM 0 H6 C B 208 15.554 -2.995 -11.639 1.00 0.00 H new ATOM 261 P G B 209 15.495 2.072 -13.746 1.00 0.00 P ATOM 262 OP1 G B 209 16.965 2.232 -13.703 1.00 0.00 O ATOM 263 OP2 G B 209 14.743 2.324 -12.497 1.00 0.00 O ATOM 264 O5' G B 209 14.922 3.052 -14.874 1.00 0.00 O ATOM 265 C5' G B 209 13.791 3.873 -14.597 1.00 0.00 C ATOM 266 C4' G B 209 12.617 3.016 -14.179 1.00 0.00 C ATOM 267 O4' G B 209 12.531 1.918 -13.693 1.00 0.00 O ATOM 268 C3' G B 209 11.519 3.771 -13.435 1.00 0.00 C ATOM 269 O3' G B 209 11.004 4.805 -14.270 1.00 0.00 O ATOM 270 C2' G B 209 10.470 2.739 -13.123 1.00 0.00 C ATOM 271 O2' G B 209 9.553 2.901 -14.181 1.00 0.00 O ATOM 272 C1' G B 209 11.304 1.462 -13.168 1.00 0.00 C ATOM 273 N9 G B 209 11.491 0.833 -11.843 1.00 0.00 N ATOM 274 C8 G B 209 12.377 1.182 -10.887 1.00 0.00 C ATOM 275 N7 G B 209 12.293 0.415 -9.806 1.00 0.00 N ATOM 276 C5 G B 209 11.290 -0.467 -10.105 1.00 0.00 C ATOM 277 C6 G B 209 10.728 -1.529 -9.365 1.00 0.00 C ATOM 278 O6 G B 209 11.071 -1.870 -8.234 1.00 0.00 O ATOM 279 N1 G B 209 9.722 -2.236 -9.950 1.00 0.00 N ATOM 280 C2 G B 209 9.324 -1.883 -11.194 1.00 0.00 C ATOM 281 N2 G B 209 8.337 -2.665 -11.626 1.00 0.00 N ATOM 282 N3 G B 209 9.786 -0.897 -11.985 1.00 0.00 N ATOM 283 C4 G B 209 10.786 -0.230 -11.344 1.00 0.00 C ATOM 0 H5' G B 209 13.530 4.456 -15.480 1.00 0.00 H new ATOM 0 H5'' G B 209 14.032 4.583 -13.806 1.00 0.00 H new ATOM 0 H4' G B 209 12.642 2.759 -15.238 1.00 0.00 H new ATOM 0 H3' G B 209 11.876 4.250 -12.523 1.00 0.00 H new ATOM 0 H2' G B 209 9.909 2.773 -12.189 1.00 0.00 H new ATOM 0 HO2' G B 209 8.640 2.910 -13.824 1.00 0.00 H new ATOM 0 H1' G B 209 10.825 0.680 -13.757 1.00 0.00 H new ATOM 0 H8 G B 209 13.078 1.997 -10.990 1.00 0.00 H new ATOM 0 H1 G B 209 9.279 -3.014 -9.462 1.00 0.00 H new ATOM 0 H21 G B 209 7.935 -2.515 -12.551 1.00 0.00 H new ATOM 0 H22 G B 209 7.983 -3.414 -11.031 1.00 0.00 H new ATOM 295 P G B 210 11.175 6.338 -13.841 1.00 0.00 P ATOM 296 OP1 G B 210 10.876 7.214 -14.996 1.00 0.00 O ATOM 297 OP2 G B 210 12.477 6.523 -13.162 1.00 0.00 O ATOM 298 O5' G B 210 10.018 6.539 -12.756 1.00 0.00 O ATOM 299 C5' G B 210 9.387 5.405 -12.166 1.00 0.00 C ATOM 300 C4' G B 210 8.154 5.833 -11.403 1.00 0.00 C ATOM 301 O4' G B 210 7.787 6.271 -10.343 1.00 0.00 O ATOM 302 C3' G B 210 6.950 6.160 -12.282 1.00 0.00 C ATOM 303 O3' G B 210 5.998 5.102 -12.196 1.00 0.00 O ATOM 304 C2' G B 210 6.397 7.446 -11.735 1.00 0.00 C ATOM 305 O2' G B 210 5.008 7.207 -11.725 1.00 0.00 O ATOM 306 C1' G B 210 7.065 7.482 -10.363 1.00 0.00 C ATOM 307 N9 G B 210 7.963 8.642 -10.175 1.00 0.00 N ATOM 308 C8 G B 210 9.059 8.955 -10.897 1.00 0.00 C ATOM 309 N7 G B 210 9.651 10.066 -10.473 1.00 0.00 N ATOM 310 C5 G B 210 8.875 10.471 -9.420 1.00 0.00 C ATOM 311 C6 G B 210 8.978 11.582 -8.555 1.00 0.00 C ATOM 312 O6 G B 210 9.855 12.443 -8.604 1.00 0.00 O ATOM 313 N1 G B 210 8.032 11.711 -7.586 1.00 0.00 N ATOM 314 C2 G B 210 7.056 10.778 -7.509 1.00 0.00 C ATOM 315 N2 G B 210 6.211 11.042 -6.515 1.00 0.00 N ATOM 316 N3 G B 210 6.862 9.688 -8.274 1.00 0.00 N ATOM 317 C4 G B 210 7.839 9.616 -9.220 1.00 0.00 C ATOM 0 H5' G B 210 10.082 4.901 -11.495 1.00 0.00 H new ATOM 0 H5'' G B 210 9.114 4.688 -12.940 1.00 0.00 H new ATOM 0 H4' G B 210 8.824 5.122 -10.920 1.00 0.00 H new ATOM 0 H3' G B 210 7.210 6.266 -13.335 1.00 0.00 H new ATOM 0 H2' G B 210 6.567 8.393 -12.247 1.00 0.00 H new ATOM 0 HO2' G B 210 4.818 6.361 -12.182 1.00 0.00 H new ATOM 0 H1' G B 210 6.339 7.586 -9.556 1.00 0.00 H new ATOM 0 H8 G B 210 9.416 8.366 -11.729 1.00 0.00 H new ATOM 0 H1 G B 210 8.058 12.494 -6.932 1.00 0.00 H new ATOM 0 H21 G B 210 5.422 10.420 -6.338 1.00 0.00 H new ATOM 0 H22 G B 210 6.353 11.866 -5.931 1.00 0.00 H new ATOM 329 P A B 211 6.007 3.927 -13.282 1.00 0.00 P ATOM 330 OP1 A B 211 7.358 3.806 -13.875 1.00 0.00 O ATOM 331 OP2 A B 211 4.867 4.097 -14.209 1.00 0.00 O ATOM 332 O5' A B 211 5.736 2.619 -12.400 1.00 0.00 O ATOM 333 C5' A B 211 6.581 2.320 -11.291 1.00 0.00 C ATOM 334 C4' A B 211 5.745 2.024 -10.066 1.00 0.00 C ATOM 335 O4' A B 211 5.611 2.151 -8.672 1.00 0.00 O ATOM 336 C3' A B 211 4.381 1.409 -10.367 1.00 0.00 C ATOM 337 O3' A B 211 4.450 -0.005 -10.195 1.00 0.00 O ATOM 338 C2' A B 211 3.435 2.040 -9.383 1.00 0.00 C ATOM 339 O2' A B 211 2.366 1.121 -9.348 1.00 0.00 O ATOM 340 C1' A B 211 4.310 2.076 -8.133 1.00 0.00 C ATOM 341 N9 A B 211 4.030 3.230 -7.252 1.00 0.00 N ATOM 342 C8 A B 211 4.284 4.532 -7.501 1.00 0.00 C ATOM 343 N7 A B 211 3.913 5.327 -6.503 1.00 0.00 N ATOM 344 C5 A B 211 3.394 4.466 -5.573 1.00 0.00 C ATOM 345 C6 A B 211 2.835 4.694 -4.298 1.00 0.00 C ATOM 346 N6 A B 211 2.703 5.918 -3.722 1.00 0.00 N ATOM 347 N1 A B 211 2.399 3.609 -3.602 1.00 0.00 N ATOM 348 C2 A B 211 2.526 2.386 -4.166 1.00 0.00 C ATOM 349 N3 A B 211 3.039 2.055 -5.365 1.00 0.00 N ATOM 350 C4 A B 211 3.456 3.180 -6.009 1.00 0.00 C ATOM 0 H5' A B 211 7.245 3.161 -11.093 1.00 0.00 H new ATOM 0 H5'' A B 211 7.213 1.463 -11.526 1.00 0.00 H new ATOM 0 H4' A B 211 6.797 2.306 -10.028 1.00 0.00 H new ATOM 0 H3' A B 211 4.051 1.587 -11.391 1.00 0.00 H new ATOM 0 H2' A B 211 3.015 3.030 -9.562 1.00 0.00 H new ATOM 0 HO2' A B 211 1.681 1.440 -8.724 1.00 0.00 H new ATOM 0 H1' A B 211 4.140 1.214 -7.488 1.00 0.00 H new ATOM 0 H8 A B 211 4.740 4.889 -8.413 1.00 0.00 H new ATOM 0 H61 A B 211 2.288 6.003 -2.794 1.00 0.00 H new ATOM 0 H62 A B 211 3.019 6.752 -4.217 1.00 0.00 H new ATOM 0 H2 A B 211 2.165 1.560 -3.571 1.00 0.00 H new ATOM 362 P G B 212 3.725 -0.974 -11.241 1.00 0.00 P ATOM 363 OP1 G B 212 4.632 -1.248 -12.378 1.00 0.00 O ATOM 364 OP2 G B 212 2.376 -0.451 -11.554 1.00 0.00 O ATOM 365 O5' G B 212 3.548 -2.332 -10.412 1.00 0.00 O ATOM 366 C5' G B 212 3.247 -2.282 -9.019 1.00 0.00 C ATOM 367 C4' G B 212 4.423 -2.786 -8.214 1.00 0.00 C ATOM 368 O4' G B 212 5.220 -1.760 -7.853 1.00 0.00 O ATOM 369 C3' G B 212 4.081 -3.188 -6.782 1.00 0.00 C ATOM 370 O3' G B 212 3.520 -4.499 -6.780 1.00 0.00 O ATOM 371 C2' G B 212 5.385 -3.145 -6.035 1.00 0.00 C ATOM 372 O2' G B 212 5.890 -4.449 -6.217 1.00 0.00 O ATOM 373 C1' G B 212 6.115 -2.046 -6.802 1.00 0.00 C ATOM 374 N9 G B 212 6.387 -0.841 -5.989 1.00 0.00 N ATOM 375 C8 G B 212 5.490 -0.081 -5.326 1.00 0.00 C ATOM 376 N7 G B 212 6.057 0.938 -4.686 1.00 0.00 N ATOM 377 C5 G B 212 7.389 0.803 -4.968 1.00 0.00 C ATOM 378 C6 G B 212 8.508 1.571 -4.582 1.00 0.00 C ATOM 379 O6 G B 212 8.474 2.572 -3.869 1.00 0.00 O ATOM 380 N1 G B 212 9.728 1.171 -5.034 1.00 0.00 N ATOM 381 C2 G B 212 9.797 0.073 -5.820 1.00 0.00 C ATOM 382 N2 G B 212 11.052 -0.187 -6.178 1.00 0.00 N ATOM 383 N3 G B 212 8.804 -0.729 -6.247 1.00 0.00 N ATOM 384 C4 G B 212 7.615 -0.276 -5.762 1.00 0.00 C ATOM 0 H5' G B 212 2.366 -2.888 -8.808 1.00 0.00 H new ATOM 0 H5'' G B 212 3.008 -1.259 -8.727 1.00 0.00 H new ATOM 0 H4' G B 212 4.814 -3.576 -8.855 1.00 0.00 H new ATOM 0 H3' G B 212 3.347 -2.528 -6.319 1.00 0.00 H new ATOM 0 H2' G B 212 5.414 -2.925 -4.968 1.00 0.00 H new ATOM 0 HO2' G B 212 5.169 -5.040 -6.519 1.00 0.00 H new ATOM 0 H1' G B 212 7.105 -2.363 -7.129 1.00 0.00 H new ATOM 0 H8 G B 212 4.428 -0.279 -5.316 1.00 0.00 H new ATOM 0 H1 G B 212 10.571 1.688 -4.785 1.00 0.00 H new ATOM 0 H21 G B 212 11.257 -0.989 -6.774 1.00 0.00 H new ATOM 0 H22 G B 212 11.809 0.416 -5.857 1.00 0.00 H new ATOM 396 P G B 213 1.949 -4.698 -7.012 1.00 0.00 P ATOM 397 OP1 G B 213 1.268 -3.385 -6.962 1.00 0.00 O ATOM 398 OP2 G B 213 1.444 -5.763 -6.117 1.00 0.00 O ATOM 399 O5' G B 213 1.873 -5.238 -8.515 1.00 0.00 O ATOM 400 C5' G B 213 3.025 -5.818 -9.125 1.00 0.00 C ATOM 401 C4' G B 213 2.723 -6.188 -10.559 1.00 0.00 C ATOM 402 O4' G B 213 3.569 -5.482 -11.180 1.00 0.00 O ATOM 403 C3' G B 213 3.069 -7.629 -10.923 1.00 0.00 C ATOM 404 O3' G B 213 1.872 -8.345 -11.220 1.00 0.00 O ATOM 405 C2' G B 213 3.966 -7.530 -12.127 1.00 0.00 C ATOM 406 O2' G B 213 3.056 -7.635 -13.199 1.00 0.00 O ATOM 407 C1' G B 213 4.572 -6.146 -11.916 1.00 0.00 C ATOM 408 N9 G B 213 5.851 -6.170 -11.175 1.00 0.00 N ATOM 409 C8 G B 213 6.036 -6.450 -9.867 1.00 0.00 C ATOM 410 N7 G B 213 7.312 -6.388 -9.505 1.00 0.00 N ATOM 411 C5 G B 213 7.966 -6.047 -10.658 1.00 0.00 C ATOM 412 C6 G B 213 9.333 -5.828 -10.929 1.00 0.00 C ATOM 413 O6 G B 213 10.245 -5.913 -10.108 1.00 0.00 O ATOM 414 N1 G B 213 9.674 -5.495 -12.204 1.00 0.00 N ATOM 415 C2 G B 213 8.693 -5.395 -13.129 1.00 0.00 C ATOM 416 N2 G B 213 9.183 -5.064 -14.321 1.00 0.00 N ATOM 417 N3 G B 213 7.367 -5.580 -12.984 1.00 0.00 N ATOM 418 C4 G B 213 7.093 -5.909 -11.691 1.00 0.00 C ATOM 0 H5' G B 213 3.333 -6.704 -8.570 1.00 0.00 H new ATOM 0 H5'' G B 213 3.857 -5.115 -9.090 1.00 0.00 H new ATOM 0 H4' G B 213 1.663 -6.051 -10.771 1.00 0.00 H new ATOM 0 H3' G B 213 3.564 -8.164 -10.112 1.00 0.00 H new ATOM 0 H2' G B 213 4.763 -8.254 -12.295 1.00 0.00 H new ATOM 0 HO2' G B 213 3.462 -8.155 -13.923 1.00 0.00 H new ATOM 0 H1' G B 213 4.831 -5.664 -12.859 1.00 0.00 H new ATOM 0 H8 G B 213 5.233 -6.698 -9.189 1.00 0.00 H new ATOM 0 H1 G B 213 10.648 -5.325 -12.456 1.00 0.00 H new ATOM 0 H21 G B 213 8.555 -4.953 -15.117 1.00 0.00 H new ATOM 0 H22 G B 213 10.186 -4.921 -14.438 1.00 0.00 H new ATOM 430 P C B 214 1.734 -9.883 -10.803 1.00 0.00 P ATOM 431 OP1 C B 214 0.349 -10.344 -11.051 1.00 0.00 O ATOM 432 OP2 C B 214 2.289 -10.083 -9.445 1.00 0.00 O ATOM 433 O5' C B 214 2.696 -10.625 -11.844 1.00 0.00 O ATOM 434 C5' C B 214 2.325 -10.715 -13.219 1.00 0.00 C ATOM 435 C4' C B 214 3.558 -10.660 -14.093 1.00 0.00 C ATOM 436 O4' C B 214 4.511 -9.638 -14.223 1.00 0.00 O ATOM 437 C3' C B 214 4.479 -11.869 -13.961 1.00 0.00 C ATOM 438 O3' C B 214 3.828 -13.021 -14.493 1.00 0.00 O ATOM 439 C2' C B 214 5.710 -11.517 -14.749 1.00 0.00 C ATOM 440 O2' C B 214 5.322 -11.802 -16.075 1.00 0.00 O ATOM 441 C1' C B 214 5.850 -10.036 -14.411 1.00 0.00 C ATOM 442 N1 C B 214 6.658 -9.782 -13.200 1.00 0.00 N ATOM 443 C2 C B 214 7.938 -9.257 -13.372 1.00 0.00 C ATOM 444 O2 C B 214 8.334 -9.030 -14.520 1.00 0.00 O ATOM 445 N3 C B 214 8.692 -9.017 -12.285 1.00 0.00 N ATOM 446 C4 C B 214 8.252 -9.265 -11.066 1.00 0.00 C ATOM 447 N4 C B 214 9.012 -9.021 -10.006 1.00 0.00 N ATOM 448 C5 C B 214 6.930 -9.809 -10.860 1.00 0.00 C ATOM 449 C6 C B 214 6.191 -10.043 -11.954 1.00 0.00 C ATOM 0 H5' C B 214 1.650 -9.898 -13.476 1.00 0.00 H new ATOM 0 H5'' C B 214 1.784 -11.644 -13.398 1.00 0.00 H new ATOM 0 H4' C B 214 2.874 -10.513 -14.929 1.00 0.00 H new ATOM 0 H3' C B 214 4.733 -12.099 -12.926 1.00 0.00 H new ATOM 0 H2' C B 214 6.658 -12.023 -14.565 1.00 0.00 H new ATOM 0 HO2' C B 214 4.389 -12.103 -16.085 1.00 0.00 H new ATOM 0 H1' C B 214 6.377 -9.486 -15.190 1.00 0.00 H new ATOM 0 H41 C B 214 8.659 -9.217 -9.069 1.00 0.00 H new ATOM 0 H42 C B 214 9.949 -8.637 -10.128 1.00 0.00 H new ATOM 0 H5 C B 214 6.554 -10.018 -9.869 1.00 0.00 H new ATOM 0 H6 C B 214 5.197 -10.450 -11.840 1.00 0.00 H new ATOM 461 P U B 215 3.879 -14.408 -13.696 1.00 0.00 P ATOM 462 OP1 U B 215 2.677 -15.211 -14.017 1.00 0.00 O ATOM 463 OP2 U B 215 4.167 -14.151 -12.267 1.00 0.00 O ATOM 464 O5' U B 215 5.149 -15.143 -14.333 1.00 0.00 O ATOM 465 C5' U B 215 5.416 -15.024 -15.728 1.00 0.00 C ATOM 466 C4' U B 215 6.890 -14.770 -15.955 1.00 0.00 C ATOM 467 O4' U B 215 7.624 -13.918 -16.055 1.00 0.00 O ATOM 468 C3' U B 215 7.759 -16.023 -15.919 1.00 0.00 C ATOM 469 O3' U B 215 7.819 -16.597 -17.223 1.00 0.00 O ATOM 470 C2' U B 215 9.111 -15.556 -15.459 1.00 0.00 C ATOM 471 O2' U B 215 9.978 -16.132 -16.410 1.00 0.00 O ATOM 472 C1' U B 215 8.938 -14.043 -15.560 1.00 0.00 C ATOM 473 N1 U B 215 9.091 -13.345 -14.266 1.00 0.00 N ATOM 474 C2 U B 215 10.246 -12.647 -14.090 1.00 0.00 C ATOM 475 O2 U B 215 11.130 -12.579 -14.929 1.00 0.00 O ATOM 476 N3 U B 215 10.389 -11.995 -12.886 1.00 0.00 N ATOM 477 C4 U B 215 9.446 -12.021 -11.891 1.00 0.00 C ATOM 478 O4 U B 215 9.680 -11.401 -10.855 1.00 0.00 O ATOM 479 C5 U B 215 8.259 -12.764 -12.127 1.00 0.00 C ATOM 480 C6 U B 215 8.140 -13.388 -13.301 1.00 0.00 C ATOM 0 H5' U B 215 4.829 -14.208 -16.150 1.00 0.00 H new ATOM 0 H5'' U B 215 5.112 -15.935 -16.243 1.00 0.00 H new ATOM 0 H4' U B 215 6.126 -14.039 -16.220 1.00 0.00 H new ATOM 0 H3' U B 215 7.367 -16.792 -15.253 1.00 0.00 H new ATOM 0 H2' U B 215 9.488 -15.813 -14.469 1.00 0.00 H new ATOM 0 HO2' U B 215 10.824 -16.373 -15.978 1.00 0.00 H new ATOM 0 H1' U B 215 9.700 -13.584 -16.189 1.00 0.00 H new ATOM 0 H3 U B 215 11.244 -11.463 -12.725 1.00 0.00 H new ATOM 0 H5 U B 215 7.479 -12.822 -11.382 1.00 0.00 H new ATOM 0 H6 U B 215 7.241 -13.955 -13.492 1.00 0.00 H new ATOM 491 P A B 216 7.895 -18.186 -17.397 1.00 0.00 P ATOM 492 OP1 A B 216 8.013 -18.526 -18.832 1.00 0.00 O ATOM 493 OP2 A B 216 6.800 -18.824 -16.631 1.00 0.00 O ATOM 494 O5' A B 216 9.279 -18.559 -16.686 1.00 0.00 O ATOM 495 C5' A B 216 10.464 -18.709 -17.464 1.00 0.00 C ATOM 496 C4' A B 216 11.685 -18.594 -16.581 1.00 0.00 C ATOM 497 O4' A B 216 11.742 -17.665 -15.694 1.00 0.00 O ATOM 498 C3' A B 216 11.909 -19.789 -15.658 1.00 0.00 C ATOM 499 O3' A B 216 12.396 -20.891 -16.421 1.00 0.00 O ATOM 500 C2' A B 216 12.922 -19.327 -14.649 1.00 0.00 C ATOM 501 O2' A B 216 14.147 -19.670 -15.257 1.00 0.00 O ATOM 502 C1' A B 216 12.612 -17.833 -14.598 1.00 0.00 C ATOM 503 N9 A B 216 11.970 -17.407 -13.336 1.00 0.00 N ATOM 504 C8 A B 216 10.672 -17.538 -12.992 1.00 0.00 C ATOM 505 N7 A B 216 10.411 -17.051 -11.784 1.00 0.00 N ATOM 506 C5 A B 216 11.623 -16.587 -11.346 1.00 0.00 C ATOM 507 C6 A B 216 12.005 -15.961 -10.142 1.00 0.00 C ATOM 508 N6 A B 216 11.158 -15.685 -9.116 1.00 0.00 N ATOM 509 N1 A B 216 13.313 -15.611 -10.005 1.00 0.00 N ATOM 510 C2 A B 216 14.163 -15.881 -11.021 1.00 0.00 C ATOM 511 N3 A B 216 13.910 -16.470 -12.205 1.00 0.00 N ATOM 512 C4 A B 216 12.589 -16.794 -12.279 1.00 0.00 C ATOM 0 H5' A B 216 10.496 -17.947 -18.242 1.00 0.00 H new ATOM 0 H5'' A B 216 10.459 -19.677 -17.966 1.00 0.00 H new ATOM 0 H4' A B 216 12.392 -18.438 -17.395 1.00 0.00 H new ATOM 0 H3' A B 216 10.996 -20.123 -15.166 1.00 0.00 H new ATOM 0 H2' A B 216 12.930 -19.732 -13.637 1.00 0.00 H new ATOM 0 HO2' A B 216 14.791 -19.937 -14.568 1.00 0.00 H new ATOM 0 H1' A B 216 13.515 -17.225 -14.643 1.00 0.00 H new ATOM 0 H8 A B 216 9.926 -17.990 -13.629 1.00 0.00 H new ATOM 0 H61 A B 216 11.509 -15.229 -8.274 1.00 0.00 H new ATOM 0 H62 A B 216 10.171 -15.934 -9.188 1.00 0.00 H new ATOM 0 H2 A B 216 15.188 -15.582 -10.860 1.00 0.00 H new ATOM 524 P G B 217 11.810 -22.359 -16.169 1.00 0.00 P ATOM 525 OP1 G B 217 11.821 -23.124 -17.436 1.00 0.00 O ATOM 526 OP2 G B 217 10.525 -22.264 -15.440 1.00 0.00 O ATOM 527 O5' G B 217 12.890 -23.014 -15.186 1.00 0.00 O ATOM 528 C5' G B 217 14.253 -22.602 -15.248 1.00 0.00 C ATOM 529 C4' G B 217 14.736 -22.196 -13.874 1.00 0.00 C ATOM 530 O4' G B 217 14.491 -21.033 -13.172 1.00 0.00 O ATOM 531 C3' G B 217 14.328 -23.150 -12.756 1.00 0.00 C ATOM 532 O3' G B 217 14.885 -24.440 -13.005 1.00 0.00 O ATOM 533 C2' G B 217 14.883 -22.545 -11.495 1.00 0.00 C ATOM 534 O2' G B 217 16.227 -22.969 -11.512 1.00 0.00 O ATOM 535 C1' G B 217 14.660 -21.060 -11.772 1.00 0.00 C ATOM 536 N9 G B 217 13.479 -20.502 -11.081 1.00 0.00 N ATOM 537 C8 G B 217 12.180 -20.680 -11.403 1.00 0.00 C ATOM 538 N7 G B 217 11.355 -20.042 -10.579 1.00 0.00 N ATOM 539 C5 G B 217 12.193 -19.426 -9.687 1.00 0.00 C ATOM 540 C6 G B 217 11.929 -18.601 -8.575 1.00 0.00 C ATOM 541 O6 G B 217 10.812 -18.266 -8.185 1.00 0.00 O ATOM 542 N1 G B 217 12.998 -18.134 -7.873 1.00 0.00 N ATOM 543 C2 G B 217 14.239 -18.486 -8.279 1.00 0.00 C ATOM 544 N2 G B 217 15.173 -17.953 -7.495 1.00 0.00 N ATOM 545 N3 G B 217 14.605 -19.261 -9.317 1.00 0.00 N ATOM 546 C4 G B 217 13.493 -19.693 -9.975 1.00 0.00 C ATOM 0 H5' G B 217 14.357 -21.767 -15.940 1.00 0.00 H new ATOM 0 H5'' G B 217 14.869 -23.414 -15.633 1.00 0.00 H new ATOM 0 H4' G B 217 15.734 -22.129 -14.308 1.00 0.00 H new ATOM 0 H3' G B 217 13.248 -23.280 -12.683 1.00 0.00 H new ATOM 0 H2' G B 217 14.468 -22.800 -10.520 1.00 0.00 H new ATOM 0 HO2' G B 217 16.402 -23.468 -12.337 1.00 0.00 H new ATOM 0 H1' G B 217 15.483 -20.447 -11.406 1.00 0.00 H new ATOM 0 H8 G B 217 11.847 -21.276 -12.240 1.00 0.00 H new ATOM 0 H1 G B 217 12.866 -17.533 -7.060 1.00 0.00 H new ATOM 0 H21 G B 217 16.159 -18.133 -7.682 1.00 0.00 H new ATOM 0 H22 G B 217 14.902 -17.364 -6.707 1.00 0.00 H new ATOM 558 P U B 218 14.013 -25.753 -12.740 1.00 0.00 P ATOM 559 OP1 U B 218 14.490 -26.854 -13.607 1.00 0.00 O ATOM 560 OP2 U B 218 12.573 -25.415 -12.798 1.00 0.00 O ATOM 561 O5' U B 218 14.372 -26.124 -11.226 1.00 0.00 O ATOM 562 C5' U B 218 15.707 -25.970 -10.752 1.00 0.00 C ATOM 563 C4' U B 218 15.699 -25.433 -9.339 1.00 0.00 C ATOM 564 O4' U B 218 15.637 -24.145 -8.863 1.00 0.00 O ATOM 565 C3' U B 218 14.676 -26.094 -8.419 1.00 0.00 C ATOM 566 O3' U B 218 15.006 -27.473 -8.258 1.00 0.00 O ATOM 567 C2' U B 218 14.773 -25.349 -7.116 1.00 0.00 C ATOM 568 O2' U B 218 15.877 -25.961 -6.490 1.00 0.00 O ATOM 569 C1' U B 218 15.009 -23.928 -7.620 1.00 0.00 C ATOM 570 N1 U B 218 13.766 -23.144 -7.779 1.00 0.00 N ATOM 571 C2 U B 218 13.520 -22.203 -6.827 1.00 0.00 C ATOM 572 O2 U B 218 14.261 -21.988 -5.881 1.00 0.00 O ATOM 573 N3 U B 218 12.364 -21.472 -6.973 1.00 0.00 N ATOM 574 C4 U B 218 11.478 -21.649 -8.007 1.00 0.00 C ATOM 575 O4 U B 218 10.475 -20.938 -8.037 1.00 0.00 O ATOM 576 C5 U B 218 11.783 -22.645 -8.972 1.00 0.00 C ATOM 577 C6 U B 218 12.910 -23.342 -8.811 1.00 0.00 C ATOM 0 H5' U B 218 16.256 -25.291 -11.404 1.00 0.00 H new ATOM 0 H5'' U B 218 16.224 -26.929 -10.782 1.00 0.00 H new ATOM 0 H4' U B 218 16.766 -25.656 -9.360 1.00 0.00 H new ATOM 0 H3' U B 218 13.661 -26.054 -8.814 1.00 0.00 H new ATOM 0 H2' U B 218 13.947 -25.350 -6.405 1.00 0.00 H new ATOM 0 HO2' U B 218 16.200 -26.701 -7.046 1.00 0.00 H new ATOM 0 H1' U B 218 15.595 -23.336 -6.917 1.00 0.00 H new ATOM 0 H3 U B 218 12.153 -20.759 -6.275 1.00 0.00 H new ATOM 0 H5 U B 218 11.125 -22.832 -9.808 1.00 0.00 H new ATOM 0 H6 U B 218 13.152 -24.102 -9.540 1.00 0.00 H new ATOM 588 P C B 219 13.859 -28.585 -8.341 1.00 0.00 P ATOM 589 OP1 C B 219 14.430 -29.854 -8.847 1.00 0.00 O ATOM 590 OP2 C B 219 12.682 -28.035 -9.052 1.00 0.00 O ATOM 591 O5' C B 219 13.454 -28.800 -6.809 1.00 0.00 O ATOM 592 C5' C B 219 14.434 -28.645 -5.785 1.00 0.00 C ATOM 593 C4' C B 219 13.826 -27.955 -4.584 1.00 0.00 C ATOM 594 O4' C B 219 13.698 -26.882 -3.874 1.00 0.00 O ATOM 595 C3' C B 219 12.979 -28.863 -3.696 1.00 0.00 C ATOM 596 O3' C B 219 13.752 -29.283 -2.574 1.00 0.00 O ATOM 597 C2' C B 219 11.805 -28.024 -3.276 1.00 0.00 C ATOM 598 O2' C B 219 11.613 -28.410 -1.934 1.00 0.00 O ATOM 599 C1' C B 219 12.371 -26.621 -3.478 1.00 0.00 C ATOM 600 N1 C B 219 11.651 -25.838 -4.505 1.00 0.00 N ATOM 601 C2 C B 219 10.968 -24.697 -4.087 1.00 0.00 C ATOM 602 O2 C B 219 10.996 -24.395 -2.888 1.00 0.00 O ATOM 603 N3 C B 219 10.306 -23.967 -5.002 1.00 0.00 N ATOM 604 C4 C B 219 10.286 -24.302 -6.276 1.00 0.00 C ATOM 605 N4 C B 219 9.626 -23.570 -7.164 1.00 0.00 N ATOM 606 C5 C B 219 10.986 -25.481 -6.735 1.00 0.00 C ATOM 607 C6 C B 219 11.641 -26.198 -5.811 1.00 0.00 C ATOM 0 H5' C B 219 15.275 -28.063 -6.161 1.00 0.00 H new ATOM 0 H5'' C B 219 14.825 -29.620 -5.495 1.00 0.00 H new ATOM 0 H4' C B 219 14.404 -27.448 -5.357 1.00 0.00 H new ATOM 0 H3' C B 219 12.646 -29.767 -4.206 1.00 0.00 H new ATOM 0 H2' C B 219 10.845 -28.106 -3.786 1.00 0.00 H new ATOM 0 HO2' C B 219 12.483 -28.491 -1.489 1.00 0.00 H new ATOM 0 H1' C B 219 12.282 -26.009 -2.580 1.00 0.00 H new ATOM 0 H41 C B 219 9.620 -23.843 -8.147 1.00 0.00 H new ATOM 0 H42 C B 219 9.124 -22.734 -6.864 1.00 0.00 H new ATOM 0 H5 C B 219 10.981 -25.771 -7.775 1.00 0.00 H new ATOM 0 H6 C B 219 12.175 -27.086 -6.116 1.00 0.00 H new ATOM 619 P C B 220 14.025 -30.840 -2.328 1.00 0.00 P ATOM 620 OP1 C B 220 14.668 -31.031 -1.009 1.00 0.00 O ATOM 621 OP2 C B 220 14.703 -31.419 -3.508 1.00 0.00 O ATOM 622 O5' C B 220 12.551 -31.456 -2.253 1.00 0.00 O ATOM 623 C5' C B 220 12.022 -31.891 -1.002 1.00 0.00 C ATOM 624 C4' C B 220 10.520 -32.034 -1.093 1.00 0.00 C ATOM 625 O4' C B 220 9.932 -30.905 -1.588 1.00 0.00 O ATOM 626 C3' C B 220 10.040 -32.935 -2.228 1.00 0.00 C ATOM 627 O3' C B 220 10.169 -34.309 -1.828 1.00 0.00 O ATOM 628 C2' C B 220 8.603 -32.558 -2.456 1.00 0.00 C ATOM 629 O2' C B 220 7.922 -33.341 -1.501 1.00 0.00 O ATOM 630 C1' C B 220 8.652 -31.061 -2.159 1.00 0.00 C ATOM 631 N1 C B 220 8.498 -30.218 -3.363 1.00 0.00 N ATOM 632 C2 C B 220 7.506 -29.237 -3.345 1.00 0.00 C ATOM 633 O2 C B 220 6.809 -29.122 -2.331 1.00 0.00 O ATOM 634 N3 C B 220 7.346 -28.458 -4.428 1.00 0.00 N ATOM 635 C4 C B 220 8.100 -28.595 -5.500 1.00 0.00 C ATOM 636 N4 C B 220 7.927 -27.816 -6.560 1.00 0.00 N ATOM 637 C5 C B 220 9.134 -29.604 -5.546 1.00 0.00 C ATOM 638 C6 C B 220 9.282 -30.373 -4.458 1.00 0.00 C ATOM 0 H5' C B 220 12.280 -31.176 -0.221 1.00 0.00 H new ATOM 0 H5'' C B 220 12.469 -32.845 -0.721 1.00 0.00 H new ATOM 0 H4' C B 220 10.279 -32.355 -0.080 1.00 0.00 H new ATOM 0 H3' C B 220 10.620 -32.814 -3.143 1.00 0.00 H new ATOM 0 H2' C B 220 8.126 -32.723 -3.422 1.00 0.00 H new ATOM 0 HO2' C B 220 8.418 -34.172 -1.346 1.00 0.00 H new ATOM 0 HO3' C B 220 9.860 -34.891 -2.553 1.00 0.00 H new ATOM 0 H1' C B 220 7.831 -30.743 -1.516 1.00 0.00 H new ATOM 0 H41 C B 220 8.519 -27.935 -7.382 1.00 0.00 H new ATOM 0 H42 C B 220 7.202 -27.099 -6.553 1.00 0.00 H new ATOM 0 H5 C B 220 9.759 -29.733 -6.417 1.00 0.00 H new ATOM 0 H6 C B 220 10.046 -31.136 -4.454 1.00 0.00 H new TER 650 C B 220 ATOM 651 N MET A 1 -1.407 -11.730 1.325 1.00 0.00 N ATOM 652 CA MET A 1 -1.278 -10.569 2.188 1.00 0.00 C ATOM 653 C MET A 1 0.120 -10.497 2.807 1.00 0.00 C ATOM 654 O MET A 1 0.260 -10.273 4.008 1.00 0.00 O ATOM 655 CB MET A 1 -2.326 -10.641 3.301 1.00 0.00 C ATOM 656 CG MET A 1 -2.430 -9.307 4.043 1.00 0.00 C ATOM 657 SD MET A 1 -4.145 -8.872 4.281 1.00 0.00 S ATOM 658 CE MET A 1 -4.426 -7.902 2.810 1.00 0.00 C ATOM 0 H1 MET A 1 -2.395 -11.822 1.012 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.790 -11.616 0.495 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.128 -12.584 1.849 1.00 0.00 H new ATOM 0 HA MET A 1 -1.435 -9.674 1.586 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.295 -10.902 2.876 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.062 -11.432 4.003 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.927 -9.378 5.007 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.924 -8.526 3.476 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.457 -7.549 2.799 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.749 -7.047 2.803 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.243 -8.517 1.929 1.00 0.00 H new ATOM 668 N GLN A 2 1.118 -10.692 1.959 1.00 0.00 N ATOM 669 CA GLN A 2 2.499 -10.653 2.406 1.00 0.00 C ATOM 670 C GLN A 2 3.322 -9.721 1.513 1.00 0.00 C ATOM 671 O GLN A 2 4.075 -8.886 2.009 1.00 0.00 O ATOM 672 CB GLN A 2 3.106 -12.057 2.438 1.00 0.00 C ATOM 673 CG GLN A 2 3.534 -12.437 3.858 1.00 0.00 C ATOM 674 CD GLN A 2 4.537 -11.425 4.416 1.00 0.00 C ATOM 675 OE1 GLN A 2 5.695 -11.383 4.033 1.00 0.00 O ATOM 676 NE2 GLN A 2 4.030 -10.617 5.342 1.00 0.00 N ATOM 0 H GLN A 2 0.997 -10.878 0.963 1.00 0.00 H new ATOM 0 HA GLN A 2 2.518 -10.261 3.423 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.379 -12.780 2.068 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.967 -12.100 1.771 1.00 0.00 H new ATOM 0 HG2 GLN A 2 2.659 -12.482 4.506 1.00 0.00 H new ATOM 0 HG3 GLN A 2 3.979 -13.432 3.854 1.00 0.00 H new ATOM 0 HE21 GLN A 2 3.052 -10.706 5.616 1.00 0.00 H new ATOM 0 HE22 GLN A 2 4.619 -9.908 5.778 1.00 0.00 H new ATOM 685 N LYS A 3 3.147 -9.896 0.211 1.00 0.00 N ATOM 686 CA LYS A 3 3.863 -9.081 -0.756 1.00 0.00 C ATOM 687 C LYS A 3 5.277 -9.637 -0.936 1.00 0.00 C ATOM 688 O LYS A 3 6.255 -8.993 -0.558 1.00 0.00 O ATOM 689 CB LYS A 3 3.829 -7.608 -0.345 1.00 0.00 C ATOM 690 CG LYS A 3 3.582 -6.707 -1.556 1.00 0.00 C ATOM 691 CD LYS A 3 2.095 -6.667 -1.916 1.00 0.00 C ATOM 692 CE LYS A 3 1.822 -7.446 -3.203 1.00 0.00 C ATOM 693 NZ LYS A 3 0.454 -7.168 -3.696 1.00 0.00 N ATOM 0 H LYS A 3 2.520 -10.590 -0.197 1.00 0.00 H new ATOM 0 HA LYS A 3 3.375 -9.127 -1.730 1.00 0.00 H new ATOM 0 HB2 LYS A 3 3.045 -7.451 0.395 1.00 0.00 H new ATOM 0 HB3 LYS A 3 4.773 -7.337 0.128 1.00 0.00 H new ATOM 0 HG2 LYS A 3 3.935 -5.698 -1.341 1.00 0.00 H new ATOM 0 HG3 LYS A 3 4.156 -7.071 -2.408 1.00 0.00 H new ATOM 0 HD2 LYS A 3 1.508 -7.089 -1.100 1.00 0.00 H new ATOM 0 HD3 LYS A 3 1.774 -5.632 -2.038 1.00 0.00 H new ATOM 0 HE2 LYS A 3 2.552 -7.171 -3.964 1.00 0.00 H new ATOM 0 HE3 LYS A 3 1.939 -8.514 -3.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.050 -8.065 -3.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.059 -6.597 -2.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.508 -6.646 -4.594 1.00 0.00 H new ATOM 706 N GLY A 4 5.341 -10.827 -1.515 1.00 0.00 N ATOM 707 CA GLY A 4 6.620 -11.477 -1.751 1.00 0.00 C ATOM 708 C GLY A 4 7.513 -10.619 -2.648 1.00 0.00 C ATOM 709 O GLY A 4 8.737 -10.647 -2.520 1.00 0.00 O ATOM 0 H GLY A 4 4.528 -11.358 -1.828 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.121 -11.659 -0.800 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.458 -12.449 -2.216 1.00 0.00 H new ATOM 713 N ASN A 5 6.868 -9.875 -3.536 1.00 0.00 N ATOM 714 CA ASN A 5 7.589 -9.011 -4.454 1.00 0.00 C ATOM 715 C ASN A 5 8.442 -8.024 -3.654 1.00 0.00 C ATOM 716 O ASN A 5 9.343 -7.390 -4.202 1.00 0.00 O ATOM 717 CB ASN A 5 6.624 -8.204 -5.324 1.00 0.00 C ATOM 718 CG ASN A 5 7.275 -7.820 -6.655 1.00 0.00 C ATOM 719 OD1 ASN A 5 7.533 -8.650 -7.511 1.00 0.00 O ATOM 720 ND2 ASN A 5 7.525 -6.521 -6.779 1.00 0.00 N ATOM 0 H ASN A 5 5.853 -9.853 -3.638 1.00 0.00 H new ATOM 0 HA ASN A 5 8.210 -9.640 -5.092 1.00 0.00 H new ATOM 0 HB2 ASN A 5 5.723 -8.788 -5.511 1.00 0.00 H new ATOM 0 HB3 ASN A 5 6.316 -7.304 -4.793 1.00 0.00 H new ATOM 0 HD21 ASN A 5 7.959 -6.164 -7.630 1.00 0.00 H new ATOM 0 HD22 ASN A 5 7.283 -5.881 -6.023 1.00 0.00 H new ATOM 727 N PHE A 6 8.127 -7.924 -2.371 1.00 0.00 N ATOM 728 CA PHE A 6 8.854 -7.024 -1.490 1.00 0.00 C ATOM 729 C PHE A 6 10.346 -7.363 -1.470 1.00 0.00 C ATOM 730 O PHE A 6 11.159 -6.571 -0.996 1.00 0.00 O ATOM 731 CB PHE A 6 8.281 -7.216 -0.085 1.00 0.00 C ATOM 732 CG PHE A 6 9.100 -6.541 1.018 1.00 0.00 C ATOM 733 CD1 PHE A 6 10.133 -7.206 1.601 1.00 0.00 C ATOM 734 CD2 PHE A 6 8.794 -5.277 1.416 1.00 0.00 C ATOM 735 CE1 PHE A 6 10.893 -6.580 2.624 1.00 0.00 C ATOM 736 CE2 PHE A 6 9.554 -4.651 2.440 1.00 0.00 C ATOM 737 CZ PHE A 6 10.588 -5.316 3.021 1.00 0.00 C ATOM 0 H PHE A 6 7.379 -8.451 -1.920 1.00 0.00 H new ATOM 0 HA PHE A 6 8.747 -5.996 -1.837 1.00 0.00 H new ATOM 0 HB2 PHE A 6 7.265 -6.823 -0.061 1.00 0.00 H new ATOM 0 HB3 PHE A 6 8.215 -8.283 0.127 1.00 0.00 H new ATOM 0 HD1 PHE A 6 10.375 -8.210 1.286 1.00 0.00 H new ATOM 0 HD2 PHE A 6 7.973 -4.749 0.953 1.00 0.00 H new ATOM 0 HE1 PHE A 6 11.714 -7.108 3.087 1.00 0.00 H new ATOM 0 HE2 PHE A 6 9.311 -3.648 2.757 1.00 0.00 H new ATOM 0 HZ PHE A 6 11.167 -4.840 3.798 1.00 0.00 H new ATOM 747 N ARG A 7 10.660 -8.540 -1.990 1.00 0.00 N ATOM 748 CA ARG A 7 12.040 -8.993 -2.038 1.00 0.00 C ATOM 749 C ARG A 7 12.909 -7.971 -2.774 1.00 0.00 C ATOM 750 O ARG A 7 14.133 -7.988 -2.650 1.00 0.00 O ATOM 751 CB ARG A 7 12.151 -10.347 -2.742 1.00 0.00 C ATOM 752 CG ARG A 7 12.012 -10.190 -4.258 1.00 0.00 C ATOM 753 CD ARG A 7 10.918 -11.108 -4.806 1.00 0.00 C ATOM 754 NE ARG A 7 10.742 -10.875 -6.257 1.00 0.00 N ATOM 755 CZ ARG A 7 10.034 -11.685 -7.073 1.00 0.00 C ATOM 756 NH1 ARG A 7 9.428 -12.789 -6.586 1.00 0.00 N ATOM 757 NH2 ARG A 7 9.942 -11.380 -8.354 1.00 0.00 N ATOM 0 H ARG A 7 9.983 -9.194 -2.382 1.00 0.00 H new ATOM 0 HA ARG A 7 12.390 -9.100 -1.011 1.00 0.00 H new ATOM 0 HB2 ARG A 7 13.112 -10.805 -2.507 1.00 0.00 H new ATOM 0 HB3 ARG A 7 11.378 -11.019 -2.370 1.00 0.00 H new ATOM 0 HG2 ARG A 7 11.777 -9.154 -4.500 1.00 0.00 H new ATOM 0 HG3 ARG A 7 12.962 -10.422 -4.740 1.00 0.00 H new ATOM 0 HD2 ARG A 7 11.182 -12.150 -4.626 1.00 0.00 H new ATOM 0 HD3 ARG A 7 9.980 -10.922 -4.283 1.00 0.00 H new ATOM 0 HE ARG A 7 11.183 -10.051 -6.666 1.00 0.00 H new ATOM 0 HH11 ARG A 7 9.503 -13.017 -5.595 1.00 0.00 H new ATOM 0 HH12 ARG A 7 8.895 -13.395 -7.210 1.00 0.00 H new ATOM 0 HH21 ARG A 7 10.402 -10.543 -8.713 1.00 0.00 H new ATOM 0 HH22 ARG A 7 9.411 -11.981 -8.984 1.00 0.00 H new ATOM 770 N ASN A 8 12.242 -7.104 -3.522 1.00 0.00 N ATOM 771 CA ASN A 8 12.938 -6.076 -4.276 1.00 0.00 C ATOM 772 C ASN A 8 13.808 -5.252 -3.326 1.00 0.00 C ATOM 773 O ASN A 8 14.730 -4.564 -3.761 1.00 0.00 O ATOM 774 CB ASN A 8 11.949 -5.127 -4.957 1.00 0.00 C ATOM 775 CG ASN A 8 10.964 -4.543 -3.943 1.00 0.00 C ATOM 776 OD1 ASN A 8 10.509 -5.209 -3.026 1.00 0.00 O ATOM 777 ND2 ASN A 8 10.661 -3.266 -4.156 1.00 0.00 N ATOM 0 H ASN A 8 11.227 -7.093 -3.622 1.00 0.00 H new ATOM 0 HA ASN A 8 13.545 -6.569 -5.035 1.00 0.00 H new ATOM 0 HB2 ASN A 8 12.493 -4.320 -5.448 1.00 0.00 H new ATOM 0 HB3 ASN A 8 11.403 -5.662 -5.734 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.012 -2.785 -3.533 1.00 0.00 H new ATOM 0 HD22 ASN A 8 11.078 -2.767 -4.942 1.00 0.00 H new ATOM 784 N GLN A 9 13.482 -5.347 -2.045 1.00 0.00 N ATOM 785 CA GLN A 9 14.222 -4.619 -1.029 1.00 0.00 C ATOM 786 C GLN A 9 15.691 -5.047 -1.031 1.00 0.00 C ATOM 787 O GLN A 9 16.532 -4.396 -0.413 1.00 0.00 O ATOM 788 CB GLN A 9 13.596 -4.817 0.353 1.00 0.00 C ATOM 789 CG GLN A 9 12.155 -4.303 0.381 1.00 0.00 C ATOM 790 CD GLN A 9 12.062 -2.972 1.130 1.00 0.00 C ATOM 791 OE1 GLN A 9 11.714 -1.942 0.577 1.00 0.00 O ATOM 792 NE2 GLN A 9 12.394 -3.050 2.416 1.00 0.00 N ATOM 0 H GLN A 9 12.715 -5.917 -1.688 1.00 0.00 H new ATOM 0 HA GLN A 9 14.174 -3.556 -1.265 1.00 0.00 H new ATOM 0 HB2 GLN A 9 13.614 -5.875 0.616 1.00 0.00 H new ATOM 0 HB3 GLN A 9 14.188 -4.292 1.103 1.00 0.00 H new ATOM 0 HG2 GLN A 9 11.790 -4.177 -0.638 1.00 0.00 H new ATOM 0 HG3 GLN A 9 11.511 -5.040 0.861 1.00 0.00 H new ATOM 0 HE21 GLN A 9 12.677 -3.945 2.816 1.00 0.00 H new ATOM 0 HE22 GLN A 9 12.366 -2.215 3.002 1.00 0.00 H new ATOM 801 N ARG A 10 15.954 -6.139 -1.734 1.00 0.00 N ATOM 802 CA ARG A 10 17.307 -6.662 -1.826 1.00 0.00 C ATOM 803 C ARG A 10 18.188 -5.715 -2.644 1.00 0.00 C ATOM 804 O ARG A 10 19.400 -5.908 -2.730 1.00 0.00 O ATOM 805 CB ARG A 10 17.320 -8.047 -2.475 1.00 0.00 C ATOM 806 CG ARG A 10 16.866 -7.974 -3.934 1.00 0.00 C ATOM 807 CD ARG A 10 17.741 -8.857 -4.826 1.00 0.00 C ATOM 808 NE ARG A 10 18.518 -8.017 -5.763 1.00 0.00 N ATOM 809 CZ ARG A 10 19.736 -7.503 -5.488 1.00 0.00 C ATOM 810 NH1 ARG A 10 20.326 -7.740 -4.297 1.00 0.00 N ATOM 811 NH2 ARG A 10 20.342 -6.766 -6.400 1.00 0.00 N ATOM 0 H ARG A 10 15.253 -6.676 -2.245 1.00 0.00 H new ATOM 0 HA ARG A 10 17.699 -6.745 -0.812 1.00 0.00 H new ATOM 0 HB2 ARG A 10 18.325 -8.467 -2.424 1.00 0.00 H new ATOM 0 HB3 ARG A 10 16.665 -8.719 -1.920 1.00 0.00 H new ATOM 0 HG2 ARG A 10 15.826 -8.291 -4.011 1.00 0.00 H new ATOM 0 HG3 ARG A 10 16.911 -6.942 -4.281 1.00 0.00 H new ATOM 0 HD2 ARG A 10 18.417 -9.452 -4.212 1.00 0.00 H new ATOM 0 HD3 ARG A 10 17.118 -9.556 -5.383 1.00 0.00 H new ATOM 0 HE ARG A 10 18.108 -7.813 -6.674 1.00 0.00 H new ATOM 0 HH11 ARG A 10 19.852 -8.311 -3.597 1.00 0.00 H new ATOM 0 HH12 ARG A 10 21.246 -7.348 -4.097 1.00 0.00 H new ATOM 0 HH21 ARG A 10 19.890 -6.592 -7.298 1.00 0.00 H new ATOM 0 HH22 ARG A 10 21.262 -6.371 -6.207 1.00 0.00 H new ATOM 824 N LYS A 11 17.544 -4.712 -3.224 1.00 0.00 N ATOM 825 CA LYS A 11 18.254 -3.736 -4.033 1.00 0.00 C ATOM 826 C LYS A 11 17.934 -2.329 -3.523 1.00 0.00 C ATOM 827 O LYS A 11 17.760 -1.403 -4.313 1.00 0.00 O ATOM 828 CB LYS A 11 17.939 -3.938 -5.516 1.00 0.00 C ATOM 829 CG LYS A 11 18.704 -2.934 -6.381 1.00 0.00 C ATOM 830 CD LYS A 11 18.814 -3.426 -7.826 1.00 0.00 C ATOM 831 CE LYS A 11 17.804 -2.710 -8.726 1.00 0.00 C ATOM 832 NZ LYS A 11 18.348 -1.412 -9.185 1.00 0.00 N ATOM 0 H LYS A 11 16.539 -4.555 -3.150 1.00 0.00 H new ATOM 0 HA LYS A 11 19.331 -3.874 -3.938 1.00 0.00 H new ATOM 0 HB2 LYS A 11 18.202 -4.953 -5.812 1.00 0.00 H new ATOM 0 HB3 LYS A 11 16.868 -3.825 -5.683 1.00 0.00 H new ATOM 0 HG2 LYS A 11 18.197 -1.969 -6.359 1.00 0.00 H new ATOM 0 HG3 LYS A 11 19.701 -2.779 -5.969 1.00 0.00 H new ATOM 0 HD2 LYS A 11 19.824 -3.253 -8.197 1.00 0.00 H new ATOM 0 HD3 LYS A 11 18.641 -4.502 -7.862 1.00 0.00 H new ATOM 0 HE2 LYS A 11 17.566 -3.336 -9.586 1.00 0.00 H new ATOM 0 HE3 LYS A 11 16.873 -2.549 -8.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 17.650 -0.939 -9.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 18.552 -0.811 -8.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 19.224 -1.573 -9.722 1.00 0.00 H new ATOM 845 N THR A 12 17.866 -2.214 -2.205 1.00 0.00 N ATOM 846 CA THR A 12 17.570 -0.935 -1.580 1.00 0.00 C ATOM 847 C THR A 12 16.581 -0.140 -2.435 1.00 0.00 C ATOM 848 O THR A 12 16.801 1.037 -2.712 1.00 0.00 O ATOM 849 CB THR A 12 18.894 -0.205 -1.346 1.00 0.00 C ATOM 850 OG1 THR A 12 18.585 0.764 -0.349 1.00 0.00 O ATOM 851 CG2 THR A 12 19.325 0.627 -2.555 1.00 0.00 C ATOM 0 H THR A 12 18.011 -2.985 -1.553 1.00 0.00 H new ATOM 0 HA THR A 12 17.082 -1.070 -0.615 1.00 0.00 H new ATOM 0 HB THR A 12 19.672 -0.931 -1.110 1.00 0.00 H new ATOM 0 HG1 THR A 12 19.389 1.282 -0.136 1.00 0.00 H new ATOM 0 HG21 THR A 12 20.270 1.124 -2.336 1.00 0.00 H new ATOM 0 HG22 THR A 12 19.450 -0.025 -3.420 1.00 0.00 H new ATOM 0 HG23 THR A 12 18.563 1.376 -2.772 1.00 0.00 H new ATOM 859 N VAL A 13 15.511 -0.816 -2.827 1.00 0.00 N ATOM 860 CA VAL A 13 14.487 -0.188 -3.645 1.00 0.00 C ATOM 861 C VAL A 13 14.304 1.264 -3.197 1.00 0.00 C ATOM 862 O VAL A 13 14.583 1.603 -2.048 1.00 0.00 O ATOM 863 CB VAL A 13 13.193 -1.002 -3.579 1.00 0.00 C ATOM 864 CG1 VAL A 13 13.331 -2.314 -4.354 1.00 0.00 C ATOM 865 CG2 VAL A 13 12.782 -1.263 -2.129 1.00 0.00 C ATOM 0 H VAL A 13 15.331 -1.792 -2.593 1.00 0.00 H new ATOM 0 HA VAL A 13 14.791 -0.170 -4.692 1.00 0.00 H new ATOM 0 HB VAL A 13 12.404 -0.415 -4.050 1.00 0.00 H new ATOM 0 HG11 VAL A 13 12.398 -2.874 -4.291 1.00 0.00 H new ATOM 0 HG12 VAL A 13 13.555 -2.098 -5.399 1.00 0.00 H new ATOM 0 HG13 VAL A 13 14.139 -2.907 -3.925 1.00 0.00 H new ATOM 0 HG21 VAL A 13 11.859 -1.843 -2.111 1.00 0.00 H new ATOM 0 HG22 VAL A 13 13.570 -1.819 -1.622 1.00 0.00 H new ATOM 0 HG23 VAL A 13 12.623 -0.313 -1.619 1.00 0.00 H new ATOM 875 N LYS A 14 13.836 2.081 -4.128 1.00 0.00 N ATOM 876 CA LYS A 14 13.611 3.488 -3.844 1.00 0.00 C ATOM 877 C LYS A 14 12.110 3.743 -3.700 1.00 0.00 C ATOM 878 O LYS A 14 11.317 3.286 -4.523 1.00 0.00 O ATOM 879 CB LYS A 14 14.285 4.363 -4.904 1.00 0.00 C ATOM 880 CG LYS A 14 13.413 4.473 -6.158 1.00 0.00 C ATOM 881 CD LYS A 14 14.272 4.474 -7.424 1.00 0.00 C ATOM 882 CE LYS A 14 14.231 5.839 -8.113 1.00 0.00 C ATOM 883 NZ LYS A 14 15.353 6.686 -7.651 1.00 0.00 N ATOM 0 H LYS A 14 13.606 1.796 -5.080 1.00 0.00 H new ATOM 0 HA LYS A 14 14.073 3.763 -2.896 1.00 0.00 H new ATOM 0 HB2 LYS A 14 14.470 5.357 -4.497 1.00 0.00 H new ATOM 0 HB3 LYS A 14 15.255 3.941 -5.167 1.00 0.00 H new ATOM 0 HG2 LYS A 14 12.711 3.640 -6.191 1.00 0.00 H new ATOM 0 HG3 LYS A 14 12.821 5.387 -6.115 1.00 0.00 H new ATOM 0 HD2 LYS A 14 15.301 4.222 -7.169 1.00 0.00 H new ATOM 0 HD3 LYS A 14 13.916 3.705 -8.110 1.00 0.00 H new ATOM 0 HE2 LYS A 14 14.286 5.709 -9.194 1.00 0.00 H new ATOM 0 HE3 LYS A 14 13.283 6.333 -7.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 15.311 7.609 -8.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 15.283 6.824 -6.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 16.255 6.221 -7.877 1.00 0.00 H new ATOM 896 N CYS A 15 11.763 4.470 -2.649 1.00 0.00 N ATOM 897 CA CYS A 15 10.370 4.790 -2.386 1.00 0.00 C ATOM 898 C CYS A 15 9.879 5.735 -3.485 1.00 0.00 C ATOM 899 O CYS A 15 10.320 6.882 -3.565 1.00 0.00 O ATOM 900 CB CYS A 15 10.180 5.389 -0.991 1.00 0.00 C ATOM 901 SG CYS A 15 8.400 5.665 -0.666 1.00 0.00 S ATOM 0 H CYS A 15 12.423 4.847 -1.969 1.00 0.00 H new ATOM 0 HA CYS A 15 9.775 3.877 -2.401 1.00 0.00 H new ATOM 0 HB2 CYS A 15 10.596 4.719 -0.239 1.00 0.00 H new ATOM 0 HB3 CYS A 15 10.723 6.331 -0.914 1.00 0.00 H new ATOM 906 N PHE A 16 8.974 5.221 -4.303 1.00 0.00 N ATOM 907 CA PHE A 16 8.418 6.005 -5.394 1.00 0.00 C ATOM 908 C PHE A 16 7.405 7.027 -4.873 1.00 0.00 C ATOM 909 O PHE A 16 6.772 7.733 -5.657 1.00 0.00 O ATOM 910 CB PHE A 16 7.704 5.027 -6.328 1.00 0.00 C ATOM 911 CG PHE A 16 8.582 4.497 -7.463 1.00 0.00 C ATOM 912 CD1 PHE A 16 9.428 5.337 -8.119 1.00 0.00 C ATOM 913 CD2 PHE A 16 8.518 3.186 -7.817 1.00 0.00 C ATOM 914 CE1 PHE A 16 10.243 4.845 -9.172 1.00 0.00 C ATOM 915 CE2 PHE A 16 9.333 2.694 -8.871 1.00 0.00 C ATOM 916 CZ PHE A 16 10.178 3.533 -9.526 1.00 0.00 C ATOM 0 H PHE A 16 8.611 4.270 -4.233 1.00 0.00 H new ATOM 0 HA PHE A 16 9.213 6.549 -5.905 1.00 0.00 H new ATOM 0 HB2 PHE A 16 7.337 4.184 -5.743 1.00 0.00 H new ATOM 0 HB3 PHE A 16 6.832 5.521 -6.757 1.00 0.00 H new ATOM 0 HD1 PHE A 16 9.479 6.379 -7.838 1.00 0.00 H new ATOM 0 HD2 PHE A 16 7.847 2.518 -7.297 1.00 0.00 H new ATOM 0 HE1 PHE A 16 10.915 5.512 -9.692 1.00 0.00 H new ATOM 0 HE2 PHE A 16 9.281 1.653 -9.152 1.00 0.00 H new ATOM 0 HZ PHE A 16 10.798 3.158 -10.327 1.00 0.00 H new ATOM 926 N ASN A 17 7.284 7.074 -3.554 1.00 0.00 N ATOM 927 CA ASN A 17 6.360 7.998 -2.921 1.00 0.00 C ATOM 928 C ASN A 17 7.118 9.253 -2.483 1.00 0.00 C ATOM 929 O ASN A 17 6.878 10.340 -3.005 1.00 0.00 O ATOM 930 CB ASN A 17 5.722 7.373 -1.678 1.00 0.00 C ATOM 931 CG ASN A 17 4.370 8.022 -1.370 1.00 0.00 C ATOM 932 OD1 ASN A 17 3.715 8.587 -2.228 1.00 0.00 O ATOM 933 ND2 ASN A 17 3.993 7.907 -0.099 1.00 0.00 N ATOM 0 H ASN A 17 7.811 6.487 -2.907 1.00 0.00 H new ATOM 0 HA ASN A 17 5.581 8.243 -3.643 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.589 6.302 -1.833 1.00 0.00 H new ATOM 0 HB3 ASN A 17 6.389 7.491 -0.824 1.00 0.00 H new ATOM 0 HD21 ASN A 17 3.106 8.306 0.208 1.00 0.00 H new ATOM 0 HD22 ASN A 17 4.591 7.420 0.568 1.00 0.00 H new ATOM 940 N CYS A 18 8.018 9.059 -1.532 1.00 0.00 N ATOM 941 CA CYS A 18 8.814 10.162 -1.019 1.00 0.00 C ATOM 942 C CYS A 18 10.017 10.357 -1.943 1.00 0.00 C ATOM 943 O CYS A 18 10.396 11.488 -2.245 1.00 0.00 O ATOM 944 CB CYS A 18 9.241 9.924 0.431 1.00 0.00 C ATOM 945 SG CYS A 18 10.211 8.377 0.553 1.00 0.00 S ATOM 0 H CYS A 18 8.215 8.155 -1.102 1.00 0.00 H new ATOM 0 HA CYS A 18 8.215 11.072 -1.008 1.00 0.00 H new ATOM 0 HB2 CYS A 18 9.837 10.765 0.786 1.00 0.00 H new ATOM 0 HB3 CYS A 18 8.362 9.863 1.072 1.00 0.00 H new ATOM 950 N GLY A 19 10.584 9.238 -2.368 1.00 0.00 N ATOM 951 CA GLY A 19 11.736 9.272 -3.253 1.00 0.00 C ATOM 952 C GLY A 19 13.021 8.934 -2.493 1.00 0.00 C ATOM 953 O GLY A 19 14.101 9.394 -2.858 1.00 0.00 O ATOM 0 H GLY A 19 10.267 8.302 -2.116 1.00 0.00 H new ATOM 0 HA2 GLY A 19 11.594 8.563 -4.068 1.00 0.00 H new ATOM 0 HA3 GLY A 19 11.825 10.261 -3.703 1.00 0.00 H new ATOM 957 N LYS A 20 12.860 8.133 -1.450 1.00 0.00 N ATOM 958 CA LYS A 20 13.993 7.728 -0.635 1.00 0.00 C ATOM 959 C LYS A 20 14.458 6.338 -1.070 1.00 0.00 C ATOM 960 O LYS A 20 13.995 5.813 -2.082 1.00 0.00 O ATOM 961 CB LYS A 20 13.647 7.824 0.852 1.00 0.00 C ATOM 962 CG LYS A 20 14.806 8.424 1.649 1.00 0.00 C ATOM 963 CD LYS A 20 14.639 8.156 3.146 1.00 0.00 C ATOM 964 CE LYS A 20 15.989 7.864 3.804 1.00 0.00 C ATOM 965 NZ LYS A 20 16.702 9.125 4.106 1.00 0.00 N ATOM 0 H LYS A 20 11.962 7.753 -1.150 1.00 0.00 H new ATOM 0 HA LYS A 20 14.832 8.407 -0.787 1.00 0.00 H new ATOM 0 HB2 LYS A 20 12.756 8.438 0.982 1.00 0.00 H new ATOM 0 HB3 LYS A 20 13.411 6.833 1.238 1.00 0.00 H new ATOM 0 HG2 LYS A 20 15.748 7.999 1.303 1.00 0.00 H new ATOM 0 HG3 LYS A 20 14.856 9.498 1.472 1.00 0.00 H new ATOM 0 HD2 LYS A 20 14.176 9.019 3.624 1.00 0.00 H new ATOM 0 HD3 LYS A 20 13.967 7.311 3.295 1.00 0.00 H new ATOM 0 HE2 LYS A 20 15.837 7.296 4.722 1.00 0.00 H new ATOM 0 HE3 LYS A 20 16.596 7.245 3.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 17.616 8.909 4.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 16.863 9.652 3.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 16.128 9.702 4.754 1.00 0.00 H new ATOM 978 N GLU A 21 15.368 5.779 -0.285 1.00 0.00 N ATOM 979 CA GLU A 21 15.900 4.459 -0.576 1.00 0.00 C ATOM 980 C GLU A 21 15.950 3.614 0.698 1.00 0.00 C ATOM 981 O GLU A 21 16.496 4.045 1.713 1.00 0.00 O ATOM 982 CB GLU A 21 17.282 4.556 -1.225 1.00 0.00 C ATOM 983 CG GLU A 21 17.208 4.254 -2.723 1.00 0.00 C ATOM 984 CD GLU A 21 18.361 4.923 -3.475 1.00 0.00 C ATOM 985 OE1 GLU A 21 18.871 5.963 -3.030 1.00 0.00 O ATOM 986 OE2 GLU A 21 18.725 4.324 -4.557 1.00 0.00 O ATOM 0 H GLU A 21 15.750 6.217 0.553 1.00 0.00 H new ATOM 0 HA GLU A 21 15.235 3.969 -1.287 1.00 0.00 H new ATOM 0 HB2 GLU A 21 17.690 5.555 -1.072 1.00 0.00 H new ATOM 0 HB3 GLU A 21 17.964 3.856 -0.743 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.242 3.176 -2.882 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.256 4.605 -3.122 1.00 0.00 H new ATOM 994 N GLY A 22 15.373 2.426 0.604 1.00 0.00 N ATOM 995 CA GLY A 22 15.344 1.515 1.737 1.00 0.00 C ATOM 996 C GLY A 22 13.906 1.132 2.096 1.00 0.00 C ATOM 997 O GLY A 22 13.663 0.545 3.149 1.00 0.00 O ATOM 0 H GLY A 22 14.921 2.072 -0.239 1.00 0.00 H new ATOM 0 HA2 GLY A 22 15.915 0.617 1.501 1.00 0.00 H new ATOM 0 HA3 GLY A 22 15.825 1.982 2.596 1.00 0.00 H new ATOM 1001 N HIS A 23 12.994 1.479 1.200 1.00 0.00 N ATOM 1002 CA HIS A 23 11.588 1.179 1.410 1.00 0.00 C ATOM 1003 C HIS A 23 10.792 1.551 0.158 1.00 0.00 C ATOM 1004 O HIS A 23 11.236 2.371 -0.644 1.00 0.00 O ATOM 1005 CB HIS A 23 11.067 1.870 2.671 1.00 0.00 C ATOM 1006 CG HIS A 23 10.693 3.318 2.468 1.00 0.00 C ATOM 1007 ND1 HIS A 23 11.602 4.353 2.603 1.00 0.00 N ATOM 1008 CD2 HIS A 23 9.501 3.894 2.137 1.00 0.00 C ATOM 1009 CE1 HIS A 23 10.974 5.496 2.363 1.00 0.00 C ATOM 1010 NE2 HIS A 23 9.672 5.208 2.074 1.00 0.00 N ATOM 0 H HIS A 23 13.201 1.965 0.327 1.00 0.00 H new ATOM 0 HA HIS A 23 11.461 0.109 1.574 1.00 0.00 H new ATOM 0 HB2 HIS A 23 10.195 1.328 3.036 1.00 0.00 H new ATOM 0 HB3 HIS A 23 11.829 1.808 3.448 1.00 0.00 H new ATOM 0 HD1 HIS A 23 12.588 4.253 2.846 1.00 0.00 H new ATOM 0 HD2 HIS A 23 8.575 3.369 1.957 1.00 0.00 H new ATOM 0 HE1 HIS A 23 11.415 6.481 2.391 1.00 0.00 H new ATOM 1018 N ILE A 24 9.629 0.929 0.029 1.00 0.00 N ATOM 1019 CA ILE A 24 8.766 1.185 -1.112 1.00 0.00 C ATOM 1020 C ILE A 24 7.515 1.931 -0.643 1.00 0.00 C ATOM 1021 O ILE A 24 7.172 1.895 0.538 1.00 0.00 O ATOM 1022 CB ILE A 24 8.462 -0.117 -1.856 1.00 0.00 C ATOM 1023 CG1 ILE A 24 7.426 -0.952 -1.101 1.00 0.00 C ATOM 1024 CG2 ILE A 24 9.745 -0.905 -2.128 1.00 0.00 C ATOM 1025 CD1 ILE A 24 6.964 -2.144 -1.940 1.00 0.00 C ATOM 0 H ILE A 24 9.264 0.249 0.696 1.00 0.00 H new ATOM 0 HA ILE A 24 9.270 1.828 -1.834 1.00 0.00 H new ATOM 0 HB ILE A 24 8.028 0.136 -2.823 1.00 0.00 H new ATOM 0 HG12 ILE A 24 7.854 -1.307 -0.163 1.00 0.00 H new ATOM 0 HG13 ILE A 24 6.569 -0.329 -0.845 1.00 0.00 H new ATOM 0 HG21 ILE A 24 9.501 -1.826 -2.658 1.00 0.00 H new ATOM 0 HG22 ILE A 24 10.419 -0.303 -2.738 1.00 0.00 H new ATOM 0 HG23 ILE A 24 10.230 -1.148 -1.183 1.00 0.00 H new ATOM 0 HD11 ILE A 24 6.228 -2.720 -1.379 1.00 0.00 H new ATOM 0 HD12 ILE A 24 6.515 -1.785 -2.866 1.00 0.00 H new ATOM 0 HD13 ILE A 24 7.819 -2.778 -2.174 1.00 0.00 H new ATOM 1037 N ALA A 25 6.868 2.590 -1.592 1.00 0.00 N ATOM 1038 CA ALA A 25 5.662 3.344 -1.292 1.00 0.00 C ATOM 1039 C ALA A 25 4.699 2.461 -0.496 1.00 0.00 C ATOM 1040 O ALA A 25 4.000 2.943 0.393 1.00 0.00 O ATOM 1041 CB ALA A 25 5.042 3.857 -2.593 1.00 0.00 C ATOM 0 H ALA A 25 7.156 2.618 -2.570 1.00 0.00 H new ATOM 0 HA ALA A 25 5.897 4.214 -0.678 1.00 0.00 H new ATOM 0 HB1 ALA A 25 4.138 4.422 -2.367 1.00 0.00 H new ATOM 0 HB2 ALA A 25 5.755 4.503 -3.106 1.00 0.00 H new ATOM 0 HB3 ALA A 25 4.791 3.012 -3.234 1.00 0.00 H new ATOM 1047 N LYS A 26 4.694 1.182 -0.844 1.00 0.00 N ATOM 1048 CA LYS A 26 3.827 0.227 -0.173 1.00 0.00 C ATOM 1049 C LYS A 26 4.156 0.210 1.321 1.00 0.00 C ATOM 1050 O LYS A 26 3.254 0.220 2.157 1.00 0.00 O ATOM 1051 CB LYS A 26 3.926 -1.146 -0.841 1.00 0.00 C ATOM 1052 CG LYS A 26 3.668 -1.044 -2.346 1.00 0.00 C ATOM 1053 CD LYS A 26 2.202 -1.337 -2.672 1.00 0.00 C ATOM 1054 CE LYS A 26 2.073 -2.585 -3.547 1.00 0.00 C ATOM 1055 NZ LYS A 26 0.650 -2.874 -3.831 1.00 0.00 N ATOM 0 H LYS A 26 5.276 0.785 -1.581 1.00 0.00 H new ATOM 0 HA LYS A 26 2.783 0.527 -0.266 1.00 0.00 H new ATOM 0 HB2 LYS A 26 4.915 -1.569 -0.666 1.00 0.00 H new ATOM 0 HB3 LYS A 26 3.204 -1.827 -0.390 1.00 0.00 H new ATOM 0 HG2 LYS A 26 3.930 -0.046 -2.697 1.00 0.00 H new ATOM 0 HG3 LYS A 26 4.310 -1.747 -2.877 1.00 0.00 H new ATOM 0 HD2 LYS A 26 1.641 -1.477 -1.748 1.00 0.00 H new ATOM 0 HD3 LYS A 26 1.762 -0.482 -3.185 1.00 0.00 H new ATOM 0 HE2 LYS A 26 2.614 -2.438 -4.482 1.00 0.00 H new ATOM 0 HE3 LYS A 26 2.530 -3.437 -3.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 0.339 -3.684 -3.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.073 -2.041 -3.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 0.536 -3.100 -4.840 1.00 0.00 H new ATOM 1068 N ASN A 27 5.449 0.184 1.609 1.00 0.00 N ATOM 1069 CA ASN A 27 5.907 0.165 2.988 1.00 0.00 C ATOM 1070 C ASN A 27 6.164 1.599 3.455 1.00 0.00 C ATOM 1071 O ASN A 27 6.660 1.816 4.559 1.00 0.00 O ATOM 1072 CB ASN A 27 7.214 -0.618 3.124 1.00 0.00 C ATOM 1073 CG ASN A 27 6.969 -2.122 2.984 1.00 0.00 C ATOM 1074 OD1 ASN A 27 7.200 -2.902 3.892 1.00 0.00 O ATOM 1075 ND2 ASN A 27 6.491 -2.483 1.796 1.00 0.00 N ATOM 0 H ASN A 27 6.193 0.176 0.912 1.00 0.00 H new ATOM 0 HA ASN A 27 5.136 -0.313 3.593 1.00 0.00 H new ATOM 0 HB2 ASN A 27 7.920 -0.289 2.362 1.00 0.00 H new ATOM 0 HB3 ASN A 27 7.669 -0.408 4.092 1.00 0.00 H new ATOM 0 HD21 ASN A 27 6.295 -3.465 1.602 1.00 0.00 H new ATOM 0 HD22 ASN A 27 6.320 -1.778 1.079 1.00 0.00 H new ATOM 1082 N CYS A 28 5.814 2.540 2.591 1.00 0.00 N ATOM 1083 CA CYS A 28 6.001 3.948 2.901 1.00 0.00 C ATOM 1084 C CYS A 28 4.852 4.397 3.805 1.00 0.00 C ATOM 1085 O CYS A 28 3.694 4.068 3.553 1.00 0.00 O ATOM 1086 CB CYS A 28 6.096 4.799 1.634 1.00 0.00 C ATOM 1087 SG CYS A 28 6.454 6.539 2.074 1.00 0.00 S ATOM 0 H CYS A 28 5.402 2.356 1.676 1.00 0.00 H new ATOM 0 HA CYS A 28 6.948 4.085 3.423 1.00 0.00 H new ATOM 0 HB2 CYS A 28 6.880 4.411 0.983 1.00 0.00 H new ATOM 0 HB3 CYS A 28 5.161 4.741 1.076 1.00 0.00 H new ATOM 1092 N ARG A 29 5.212 5.143 4.841 1.00 0.00 N ATOM 1093 CA ARG A 29 4.225 5.640 5.783 1.00 0.00 C ATOM 1094 C ARG A 29 3.429 6.789 5.161 1.00 0.00 C ATOM 1095 O ARG A 29 2.258 6.985 5.486 1.00 0.00 O ATOM 1096 CB ARG A 29 4.891 6.129 7.072 1.00 0.00 C ATOM 1097 CG ARG A 29 5.908 7.234 6.776 1.00 0.00 C ATOM 1098 CD ARG A 29 5.474 8.560 7.403 1.00 0.00 C ATOM 1099 NE ARG A 29 6.665 9.344 7.803 1.00 0.00 N ATOM 1100 CZ ARG A 29 7.305 9.199 8.982 1.00 0.00 C ATOM 1101 NH1 ARG A 29 6.876 8.297 9.889 1.00 0.00 N ATOM 1102 NH2 ARG A 29 8.359 9.953 9.235 1.00 0.00 N ATOM 0 H ARG A 29 6.173 5.414 5.047 1.00 0.00 H new ATOM 0 HA ARG A 29 3.553 4.817 6.024 1.00 0.00 H new ATOM 0 HB2 ARG A 29 4.132 6.502 7.759 1.00 0.00 H new ATOM 0 HB3 ARG A 29 5.388 5.295 7.568 1.00 0.00 H new ATOM 0 HG2 ARG A 29 6.885 6.947 7.164 1.00 0.00 H new ATOM 0 HG3 ARG A 29 6.016 7.355 5.698 1.00 0.00 H new ATOM 0 HD2 ARG A 29 4.875 9.129 6.692 1.00 0.00 H new ATOM 0 HD3 ARG A 29 4.843 8.372 8.272 1.00 0.00 H new ATOM 0 HE ARG A 29 7.024 10.037 7.146 1.00 0.00 H new ATOM 0 HH11 ARG A 29 6.061 7.718 9.686 1.00 0.00 H new ATOM 0 HH12 ARG A 29 7.366 8.194 10.778 1.00 0.00 H new ATOM 0 HH21 ARG A 29 8.678 10.632 8.544 1.00 0.00 H new ATOM 0 HH22 ARG A 29 8.854 9.856 10.121 1.00 0.00 H new ATOM 1115 N ALA A 30 4.094 7.518 4.279 1.00 0.00 N ATOM 1116 CA ALA A 30 3.463 8.642 3.607 1.00 0.00 C ATOM 1117 C ALA A 30 2.325 8.128 2.723 1.00 0.00 C ATOM 1118 O ALA A 30 2.381 7.006 2.222 1.00 0.00 O ATOM 1119 CB ALA A 30 4.515 9.419 2.813 1.00 0.00 C ATOM 0 H ALA A 30 5.065 7.353 4.013 1.00 0.00 H new ATOM 0 HA ALA A 30 3.031 9.330 4.333 1.00 0.00 H new ATOM 0 HB1 ALA A 30 4.042 10.262 2.309 1.00 0.00 H new ATOM 0 HB2 ALA A 30 5.284 9.788 3.492 1.00 0.00 H new ATOM 0 HB3 ALA A 30 4.970 8.762 2.072 1.00 0.00 H new ATOM 1125 N PRO A 31 1.294 8.997 2.551 1.00 0.00 N ATOM 1126 CA PRO A 31 0.144 8.644 1.735 1.00 0.00 C ATOM 1127 C PRO A 31 0.490 8.706 0.246 1.00 0.00 C ATOM 1128 O PRO A 31 1.435 9.387 -0.148 1.00 0.00 O ATOM 1129 CB PRO A 31 -0.941 9.630 2.135 1.00 0.00 C ATOM 1130 CG PRO A 31 -0.224 10.785 2.815 1.00 0.00 C ATOM 1131 CD PRO A 31 1.193 10.335 3.128 1.00 0.00 C ATOM 0 HA PRO A 31 -0.189 7.619 1.898 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -1.497 9.974 1.263 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -1.661 9.166 2.809 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -0.212 11.661 2.167 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -0.744 11.072 3.729 1.00 0.00 H new ATOM 0 HD2 PRO A 31 1.928 11.011 2.692 1.00 0.00 H new ATOM 0 HD3 PRO A 31 1.374 10.317 4.203 1.00 0.00 H new ATOM 1139 N ARG A 32 -0.295 7.985 -0.542 1.00 0.00 N ATOM 1140 CA ARG A 32 -0.085 7.950 -1.979 1.00 0.00 C ATOM 1141 C ARG A 32 -0.115 9.368 -2.554 1.00 0.00 C ATOM 1142 O ARG A 32 -1.186 9.945 -2.734 1.00 0.00 O ATOM 1143 CB ARG A 32 -1.154 7.103 -2.672 1.00 0.00 C ATOM 1144 CG ARG A 32 -0.653 5.677 -2.913 1.00 0.00 C ATOM 1145 CD ARG A 32 -0.882 4.799 -1.681 1.00 0.00 C ATOM 1146 NE ARG A 32 0.310 3.959 -1.430 1.00 0.00 N ATOM 1147 CZ ARG A 32 0.512 3.250 -0.300 1.00 0.00 C ATOM 1148 NH1 ARG A 32 -0.400 3.274 0.696 1.00 0.00 N ATOM 1149 NH2 ARG A 32 1.613 2.533 -0.182 1.00 0.00 N ATOM 0 H ARG A 32 -1.078 7.420 -0.212 1.00 0.00 H new ATOM 0 HA ARG A 32 0.891 7.501 -2.161 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -2.056 7.077 -2.060 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -1.427 7.562 -3.622 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -1.169 5.247 -3.771 1.00 0.00 H new ATOM 0 HG3 ARG A 32 0.409 5.697 -3.157 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -1.086 5.424 -0.812 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -1.757 4.167 -1.832 1.00 0.00 H new ATOM 0 HE ARG A 32 1.024 3.913 -2.157 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -1.249 3.831 0.597 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -0.240 2.735 1.547 1.00 0.00 H new ATOM 0 HH21 ARG A 32 2.297 2.520 -0.939 1.00 0.00 H new ATOM 0 HH22 ARG A 32 1.781 1.991 0.666 1.00 0.00 H new ATOM 1162 N LYS A 33 1.074 9.886 -2.827 1.00 0.00 N ATOM 1163 CA LYS A 33 1.196 11.224 -3.379 1.00 0.00 C ATOM 1164 C LYS A 33 1.944 11.155 -4.712 1.00 0.00 C ATOM 1165 O LYS A 33 2.298 10.071 -5.173 1.00 0.00 O ATOM 1166 CB LYS A 33 1.842 12.167 -2.360 1.00 0.00 C ATOM 1167 CG LYS A 33 0.779 12.943 -1.580 1.00 0.00 C ATOM 1168 CD LYS A 33 0.485 14.289 -2.245 1.00 0.00 C ATOM 1169 CE LYS A 33 -0.949 14.739 -1.963 1.00 0.00 C ATOM 1170 NZ LYS A 33 -1.197 16.078 -2.543 1.00 0.00 N ATOM 0 H LYS A 33 1.960 9.404 -2.676 1.00 0.00 H new ATOM 0 HA LYS A 33 0.211 11.642 -3.587 1.00 0.00 H new ATOM 0 HB2 LYS A 33 2.459 11.593 -1.668 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.503 12.865 -2.873 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.137 12.354 -1.522 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.119 13.105 -0.557 1.00 0.00 H new ATOM 0 HD2 LYS A 33 1.184 15.040 -1.878 1.00 0.00 H new ATOM 0 HD3 LYS A 33 0.640 14.208 -3.321 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -1.651 14.019 -2.383 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.123 14.764 -0.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.175 16.368 -2.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -0.539 16.765 -2.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -1.051 16.043 -3.572 1.00 0.00 H new ATOM 1183 N LYS A 34 2.162 12.327 -5.293 1.00 0.00 N ATOM 1184 CA LYS A 34 2.861 12.412 -6.564 1.00 0.00 C ATOM 1185 C LYS A 34 3.778 13.637 -6.555 1.00 0.00 C ATOM 1186 O LYS A 34 3.756 14.439 -7.488 1.00 0.00 O ATOM 1187 CB LYS A 34 1.864 12.398 -7.725 1.00 0.00 C ATOM 1188 CG LYS A 34 0.981 13.647 -7.706 1.00 0.00 C ATOM 1189 CD LYS A 34 -0.261 13.455 -8.577 1.00 0.00 C ATOM 1190 CE LYS A 34 -1.540 13.627 -7.756 1.00 0.00 C ATOM 1191 NZ LYS A 34 -2.219 14.891 -8.114 1.00 0.00 N ATOM 0 H LYS A 34 1.867 13.224 -4.907 1.00 0.00 H new ATOM 0 HA LYS A 34 3.497 11.539 -6.709 1.00 0.00 H new ATOM 0 HB2 LYS A 34 2.403 12.344 -8.671 1.00 0.00 H new ATOM 0 HB3 LYS A 34 1.240 11.506 -7.662 1.00 0.00 H new ATOM 0 HG2 LYS A 34 0.680 13.868 -6.682 1.00 0.00 H new ATOM 0 HG3 LYS A 34 1.551 14.505 -8.063 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -0.250 14.175 -9.395 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -0.244 12.462 -9.026 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -2.209 12.785 -7.933 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -1.300 13.625 -6.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -3.085 14.992 -7.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -1.584 15.692 -7.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -2.465 14.879 -9.124 1.00 0.00 H new ATOM 1204 N GLY A 35 4.561 13.743 -5.492 1.00 0.00 N ATOM 1205 CA GLY A 35 5.483 14.856 -5.350 1.00 0.00 C ATOM 1206 C GLY A 35 6.861 14.503 -5.915 1.00 0.00 C ATOM 1207 O GLY A 35 7.498 13.555 -5.458 1.00 0.00 O ATOM 0 H GLY A 35 4.576 13.076 -4.721 1.00 0.00 H new ATOM 0 HA2 GLY A 35 5.087 15.729 -5.868 1.00 0.00 H new ATOM 0 HA3 GLY A 35 5.575 15.124 -4.298 1.00 0.00 H new ATOM 1211 N CYS A 36 7.278 15.284 -6.901 1.00 0.00 N ATOM 1212 CA CYS A 36 8.569 15.065 -7.533 1.00 0.00 C ATOM 1213 C CYS A 36 9.656 15.200 -6.465 1.00 0.00 C ATOM 1214 O CYS A 36 9.832 16.270 -5.885 1.00 0.00 O ATOM 1215 CB CYS A 36 8.795 16.025 -8.703 1.00 0.00 C ATOM 1216 SG CYS A 36 10.540 15.947 -9.247 1.00 0.00 S ATOM 0 H CYS A 36 6.746 16.068 -7.278 1.00 0.00 H new ATOM 0 HA CYS A 36 8.603 14.062 -7.959 1.00 0.00 H new ATOM 0 HB2 CYS A 36 8.135 15.765 -9.531 1.00 0.00 H new ATOM 0 HB3 CYS A 36 8.544 17.042 -8.403 1.00 0.00 H new ATOM 1221 N TRP A 37 10.358 14.098 -6.238 1.00 0.00 N ATOM 1222 CA TRP A 37 11.423 14.081 -5.250 1.00 0.00 C ATOM 1223 C TRP A 37 12.687 14.634 -5.909 1.00 0.00 C ATOM 1224 O TRP A 37 13.785 14.132 -5.673 1.00 0.00 O ATOM 1225 CB TRP A 37 11.614 12.675 -4.676 1.00 0.00 C ATOM 1226 CG TRP A 37 10.594 11.653 -5.180 1.00 0.00 C ATOM 1227 CD1 TRP A 37 9.320 11.498 -4.793 1.00 0.00 C ATOM 1228 CD2 TRP A 37 10.815 10.642 -6.187 1.00 0.00 C ATOM 1229 NE1 TRP A 37 8.707 10.466 -5.474 1.00 0.00 N ATOM 1230 CE2 TRP A 37 9.644 9.929 -6.348 1.00 0.00 C ATOM 1231 CE3 TRP A 37 11.966 10.341 -6.935 1.00 0.00 C ATOM 1232 CZ2 TRP A 37 9.512 8.869 -7.252 1.00 0.00 C ATOM 1233 CZ3 TRP A 37 11.817 9.279 -7.836 1.00 0.00 C ATOM 1234 CH2 TRP A 37 10.646 8.551 -8.010 1.00 0.00 C ATOM 0 H TRP A 37 10.210 13.212 -6.721 1.00 0.00 H new ATOM 0 HA TRP A 37 11.170 14.712 -4.398 1.00 0.00 H new ATOM 0 HB2 TRP A 37 12.616 12.325 -4.924 1.00 0.00 H new ATOM 0 HB3 TRP A 37 11.555 12.726 -3.589 1.00 0.00 H new ATOM 0 HD1 TRP A 37 8.834 12.104 -4.043 1.00 0.00 H new ATOM 0 HE1 TRP A 37 7.743 10.155 -5.357 1.00 0.00 H new ATOM 0 HE3 TRP A 37 12.892 10.885 -6.824 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 8.585 8.325 -7.359 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 12.672 9.007 -8.437 1.00 0.00 H new ATOM 0 HH2 TRP A 37 10.611 7.744 -8.727 1.00 0.00 H new ATOM 1245 N LYS A 38 12.491 15.662 -6.721 1.00 0.00 N ATOM 1246 CA LYS A 38 13.603 16.290 -7.416 1.00 0.00 C ATOM 1247 C LYS A 38 13.512 17.808 -7.247 1.00 0.00 C ATOM 1248 O LYS A 38 14.495 18.457 -6.895 1.00 0.00 O ATOM 1249 CB LYS A 38 13.648 15.835 -8.875 1.00 0.00 C ATOM 1250 CG LYS A 38 15.063 15.410 -9.273 1.00 0.00 C ATOM 1251 CD LYS A 38 16.062 16.548 -9.048 1.00 0.00 C ATOM 1252 CE LYS A 38 17.361 16.023 -8.434 1.00 0.00 C ATOM 1253 NZ LYS A 38 18.394 15.848 -9.480 1.00 0.00 N ATOM 0 H LYS A 38 11.579 16.076 -6.914 1.00 0.00 H new ATOM 0 HA LYS A 38 14.551 15.977 -6.980 1.00 0.00 H new ATOM 0 HB2 LYS A 38 12.960 15.003 -9.022 1.00 0.00 H new ATOM 0 HB3 LYS A 38 13.312 16.645 -9.523 1.00 0.00 H new ATOM 0 HG2 LYS A 38 15.362 14.539 -8.691 1.00 0.00 H new ATOM 0 HG3 LYS A 38 15.076 15.112 -10.321 1.00 0.00 H new ATOM 0 HD2 LYS A 38 16.277 17.041 -9.996 1.00 0.00 H new ATOM 0 HD3 LYS A 38 15.622 17.298 -8.391 1.00 0.00 H new ATOM 0 HE2 LYS A 38 17.718 16.718 -7.674 1.00 0.00 H new ATOM 0 HE3 LYS A 38 17.176 15.072 -7.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 19.270 15.491 -9.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 18.057 15.168 -10.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 18.582 16.762 -9.938 1.00 0.00 H new ATOM 1266 N CYS A 39 12.322 18.330 -7.507 1.00 0.00 N ATOM 1267 CA CYS A 39 12.090 19.760 -7.389 1.00 0.00 C ATOM 1268 C CYS A 39 11.207 20.003 -6.163 1.00 0.00 C ATOM 1269 O CYS A 39 11.339 21.026 -5.493 1.00 0.00 O ATOM 1270 CB CYS A 39 11.472 20.339 -8.663 1.00 0.00 C ATOM 1271 SG CYS A 39 9.956 19.413 -9.100 1.00 0.00 S ATOM 0 H CYS A 39 11.508 17.789 -7.799 1.00 0.00 H new ATOM 0 HA CYS A 39 13.041 20.277 -7.258 1.00 0.00 H new ATOM 0 HB2 CYS A 39 11.235 21.393 -8.516 1.00 0.00 H new ATOM 0 HB3 CYS A 39 12.189 20.285 -9.482 1.00 0.00 H new ATOM 1276 N GLY A 40 10.327 19.046 -5.908 1.00 0.00 N ATOM 1277 CA GLY A 40 9.423 19.144 -4.776 1.00 0.00 C ATOM 1278 C GLY A 40 8.057 19.682 -5.208 1.00 0.00 C ATOM 1279 O GLY A 40 7.333 20.266 -4.404 1.00 0.00 O ATOM 0 H GLY A 40 10.221 18.199 -6.466 1.00 0.00 H new ATOM 0 HA2 GLY A 40 9.302 18.163 -4.317 1.00 0.00 H new ATOM 0 HA3 GLY A 40 9.853 19.800 -4.019 1.00 0.00 H new ATOM 1283 N LYS A 41 7.749 19.469 -6.479 1.00 0.00 N ATOM 1284 CA LYS A 41 6.484 19.926 -7.028 1.00 0.00 C ATOM 1285 C LYS A 41 5.487 18.765 -7.038 1.00 0.00 C ATOM 1286 O LYS A 41 5.792 17.684 -7.541 1.00 0.00 O ATOM 1287 CB LYS A 41 6.696 20.564 -8.402 1.00 0.00 C ATOM 1288 CG LYS A 41 5.991 21.920 -8.492 1.00 0.00 C ATOM 1289 CD LYS A 41 6.895 23.043 -7.977 1.00 0.00 C ATOM 1290 CE LYS A 41 6.178 24.393 -8.034 1.00 0.00 C ATOM 1291 NZ LYS A 41 5.937 24.908 -6.668 1.00 0.00 N ATOM 0 H LYS A 41 8.353 18.986 -7.144 1.00 0.00 H new ATOM 0 HA LYS A 41 6.057 20.708 -6.400 1.00 0.00 H new ATOM 0 HB2 LYS A 41 7.763 20.692 -8.587 1.00 0.00 H new ATOM 0 HB3 LYS A 41 6.315 19.900 -9.178 1.00 0.00 H new ATOM 0 HG2 LYS A 41 5.710 22.120 -9.526 1.00 0.00 H new ATOM 0 HG3 LYS A 41 5.070 21.894 -7.910 1.00 0.00 H new ATOM 0 HD2 LYS A 41 7.197 22.830 -6.951 1.00 0.00 H new ATOM 0 HD3 LYS A 41 7.805 23.085 -8.575 1.00 0.00 H new ATOM 0 HE2 LYS A 41 6.778 25.107 -8.598 1.00 0.00 H new ATOM 0 HE3 LYS A 41 5.230 24.286 -8.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 5.450 25.825 -6.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 5.346 24.233 -6.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 6.846 25.028 -6.177 1.00 0.00 H new ATOM 1304 N GLU A 42 4.316 19.026 -6.476 1.00 0.00 N ATOM 1305 CA GLU A 42 3.273 18.017 -6.414 1.00 0.00 C ATOM 1306 C GLU A 42 2.410 18.066 -7.676 1.00 0.00 C ATOM 1307 O GLU A 42 1.733 19.061 -7.931 1.00 0.00 O ATOM 1308 CB GLU A 42 2.417 18.190 -5.157 1.00 0.00 C ATOM 1309 CG GLU A 42 1.642 19.509 -5.200 1.00 0.00 C ATOM 1310 CD GLU A 42 1.791 20.276 -3.884 1.00 0.00 C ATOM 1311 OE1 GLU A 42 2.741 20.029 -3.127 1.00 0.00 O ATOM 1312 OE2 GLU A 42 0.875 21.155 -3.659 1.00 0.00 O ATOM 0 H GLU A 42 4.067 19.923 -6.059 1.00 0.00 H new ATOM 0 HA GLU A 42 3.746 17.037 -6.360 1.00 0.00 H new ATOM 0 HB2 GLU A 42 1.720 17.357 -5.070 1.00 0.00 H new ATOM 0 HB3 GLU A 42 3.054 18.167 -4.273 1.00 0.00 H new ATOM 0 HG2 GLU A 42 2.005 20.122 -6.025 1.00 0.00 H new ATOM 0 HG3 GLU A 42 0.588 19.309 -5.391 1.00 0.00 H new ATOM 1320 N GLY A 43 2.464 16.980 -8.433 1.00 0.00 N ATOM 1321 CA GLY A 43 1.695 16.886 -9.663 1.00 0.00 C ATOM 1322 C GLY A 43 2.460 16.099 -10.729 1.00 0.00 C ATOM 1323 O GLY A 43 1.919 15.170 -11.328 1.00 0.00 O ATOM 0 H GLY A 43 3.028 16.158 -8.219 1.00 0.00 H new ATOM 0 HA2 GLY A 43 0.740 16.400 -9.463 1.00 0.00 H new ATOM 0 HA3 GLY A 43 1.472 17.886 -10.034 1.00 0.00 H new ATOM 1327 N HIS A 44 3.707 16.497 -10.932 1.00 0.00 N ATOM 1328 CA HIS A 44 4.552 15.839 -11.914 1.00 0.00 C ATOM 1329 C HIS A 44 5.505 14.873 -11.208 1.00 0.00 C ATOM 1330 O HIS A 44 5.493 14.768 -9.982 1.00 0.00 O ATOM 1331 CB HIS A 44 5.284 16.869 -12.777 1.00 0.00 C ATOM 1332 CG HIS A 44 6.474 17.504 -12.098 1.00 0.00 C ATOM 1333 ND1 HIS A 44 6.399 18.718 -11.437 1.00 0.00 N ATOM 1334 CD2 HIS A 44 7.766 17.082 -11.985 1.00 0.00 C ATOM 1335 CE1 HIS A 44 7.599 19.005 -10.952 1.00 0.00 C ATOM 1336 NE2 HIS A 44 8.444 17.989 -11.293 1.00 0.00 N ATOM 0 H HIS A 44 4.153 17.267 -10.433 1.00 0.00 H new ATOM 0 HA HIS A 44 3.935 15.252 -12.595 1.00 0.00 H new ATOM 0 HB2 HIS A 44 5.617 16.387 -13.696 1.00 0.00 H new ATOM 0 HB3 HIS A 44 4.582 17.652 -13.064 1.00 0.00 H new ATOM 0 HD1 HIS A 44 5.563 19.294 -11.340 1.00 0.00 H new ATOM 0 HD2 HIS A 44 8.169 16.165 -12.390 1.00 0.00 H new ATOM 0 HE1 HIS A 44 7.862 19.887 -10.387 1.00 0.00 H new ATOM 1344 N GLN A 45 6.307 14.190 -12.011 1.00 0.00 N ATOM 1345 CA GLN A 45 7.265 13.236 -11.478 1.00 0.00 C ATOM 1346 C GLN A 45 8.649 13.477 -12.084 1.00 0.00 C ATOM 1347 O GLN A 45 8.775 14.162 -13.100 1.00 0.00 O ATOM 1348 CB GLN A 45 6.801 11.799 -11.724 1.00 0.00 C ATOM 1349 CG GLN A 45 6.999 11.402 -13.189 1.00 0.00 C ATOM 1350 CD GLN A 45 5.786 10.633 -13.717 1.00 0.00 C ATOM 1351 OE1 GLN A 45 4.652 11.072 -13.626 1.00 0.00 O ATOM 1352 NE2 GLN A 45 6.088 9.463 -14.274 1.00 0.00 N ATOM 0 H GLN A 45 6.313 14.278 -13.027 1.00 0.00 H new ATOM 0 HA GLN A 45 7.333 13.382 -10.400 1.00 0.00 H new ATOM 0 HB2 GLN A 45 7.358 11.118 -11.080 1.00 0.00 H new ATOM 0 HB3 GLN A 45 5.749 11.702 -11.456 1.00 0.00 H new ATOM 0 HG2 GLN A 45 7.159 12.295 -13.793 1.00 0.00 H new ATOM 0 HG3 GLN A 45 7.894 10.787 -13.285 1.00 0.00 H new ATOM 0 HE21 GLN A 45 7.059 9.155 -14.318 1.00 0.00 H new ATOM 0 HE22 GLN A 45 5.348 8.875 -14.657 1.00 0.00 H new ATOM 1361 N MET A 46 9.652 12.902 -11.438 1.00 0.00 N ATOM 1362 CA MET A 46 11.021 13.046 -11.901 1.00 0.00 C ATOM 1363 C MET A 46 11.142 12.672 -13.379 1.00 0.00 C ATOM 1364 O MET A 46 11.857 13.330 -14.134 1.00 0.00 O ATOM 1365 CB MET A 46 11.939 12.145 -11.070 1.00 0.00 C ATOM 1366 CG MET A 46 13.377 12.668 -11.082 1.00 0.00 C ATOM 1367 SD MET A 46 14.342 11.825 -9.840 1.00 0.00 S ATOM 1368 CE MET A 46 15.433 10.876 -10.886 1.00 0.00 C ATOM 0 H MET A 46 9.544 12.335 -10.597 1.00 0.00 H new ATOM 0 HA MET A 46 11.316 14.089 -11.784 1.00 0.00 H new ATOM 0 HB2 MET A 46 11.575 12.096 -10.044 1.00 0.00 H new ATOM 0 HB3 MET A 46 11.914 11.130 -11.466 1.00 0.00 H new ATOM 0 HG2 MET A 46 13.821 12.514 -12.066 1.00 0.00 H new ATOM 0 HG3 MET A 46 13.384 13.742 -10.893 1.00 0.00 H new ATOM 0 HE1 MET A 46 16.109 10.286 -10.267 1.00 0.00 H new ATOM 0 HE2 MET A 46 14.844 10.210 -11.517 1.00 0.00 H new ATOM 0 HE3 MET A 46 16.013 11.552 -11.514 1.00 0.00 H new ATOM 1378 N LYS A 47 10.432 11.617 -13.751 1.00 0.00 N ATOM 1379 CA LYS A 47 10.451 11.148 -15.126 1.00 0.00 C ATOM 1380 C LYS A 47 10.065 12.299 -16.058 1.00 0.00 C ATOM 1381 O LYS A 47 10.561 12.386 -17.180 1.00 0.00 O ATOM 1382 CB LYS A 47 9.568 9.909 -15.281 1.00 0.00 C ATOM 1383 CG LYS A 47 9.677 9.331 -16.694 1.00 0.00 C ATOM 1384 CD LYS A 47 8.380 9.548 -17.477 1.00 0.00 C ATOM 1385 CE LYS A 47 7.387 8.414 -17.216 1.00 0.00 C ATOM 1386 NZ LYS A 47 6.095 8.694 -17.883 1.00 0.00 N ATOM 0 H LYS A 47 9.840 11.073 -13.123 1.00 0.00 H new ATOM 0 HA LYS A 47 11.456 10.832 -15.407 1.00 0.00 H new ATOM 0 HB2 LYS A 47 9.863 9.154 -14.552 1.00 0.00 H new ATOM 0 HB3 LYS A 47 8.531 10.169 -15.069 1.00 0.00 H new ATOM 0 HG2 LYS A 47 10.507 9.802 -17.220 1.00 0.00 H new ATOM 0 HG3 LYS A 47 9.899 8.265 -16.639 1.00 0.00 H new ATOM 0 HD2 LYS A 47 7.933 10.500 -17.191 1.00 0.00 H new ATOM 0 HD3 LYS A 47 8.600 9.606 -18.543 1.00 0.00 H new ATOM 0 HE2 LYS A 47 7.796 7.473 -17.583 1.00 0.00 H new ATOM 0 HE3 LYS A 47 7.232 8.298 -16.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 5.432 7.915 -17.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 5.699 9.582 -17.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 6.246 8.782 -18.908 1.00 0.00 H new ATOM 1399 N ASP A 48 9.185 13.152 -15.558 1.00 0.00 N ATOM 1400 CA ASP A 48 8.727 14.294 -16.332 1.00 0.00 C ATOM 1401 C ASP A 48 8.990 15.578 -15.543 1.00 0.00 C ATOM 1402 O ASP A 48 8.164 16.489 -15.540 1.00 0.00 O ATOM 1403 CB ASP A 48 7.224 14.207 -16.606 1.00 0.00 C ATOM 1404 CG ASP A 48 6.793 14.657 -18.004 1.00 0.00 C ATOM 1405 OD1 ASP A 48 7.615 14.740 -18.929 1.00 0.00 O ATOM 1406 OD2 ASP A 48 5.540 14.931 -18.126 1.00 0.00 O ATOM 0 H ASP A 48 8.776 13.076 -14.627 1.00 0.00 H new ATOM 0 HA ASP A 48 9.267 14.297 -17.279 1.00 0.00 H new ATOM 0 HB2 ASP A 48 6.902 13.176 -16.457 1.00 0.00 H new ATOM 0 HB3 ASP A 48 6.700 14.814 -15.868 1.00 0.00 H new ATOM 1412 N CYS A 49 10.144 15.610 -14.893 1.00 0.00 N ATOM 1413 CA CYS A 49 10.527 16.767 -14.102 1.00 0.00 C ATOM 1414 C CYS A 49 10.531 17.993 -15.017 1.00 0.00 C ATOM 1415 O CYS A 49 11.363 18.098 -15.918 1.00 0.00 O ATOM 1416 CB CYS A 49 11.879 16.561 -13.416 1.00 0.00 C ATOM 1417 SG CYS A 49 12.192 17.921 -12.231 1.00 0.00 S ATOM 0 H CYS A 49 10.827 14.852 -14.898 1.00 0.00 H new ATOM 0 HA CYS A 49 9.806 16.917 -13.298 1.00 0.00 H new ATOM 0 HB2 CYS A 49 11.890 15.604 -12.895 1.00 0.00 H new ATOM 0 HB3 CYS A 49 12.673 16.527 -14.162 1.00 0.00 H new ATOM 1422 N THR A 50 9.592 18.891 -14.754 1.00 0.00 N ATOM 1423 CA THR A 50 9.478 20.106 -15.543 1.00 0.00 C ATOM 1424 C THR A 50 10.442 21.174 -15.021 1.00 0.00 C ATOM 1425 O THR A 50 10.438 22.306 -15.500 1.00 0.00 O ATOM 1426 CB THR A 50 8.013 20.548 -15.520 1.00 0.00 C ATOM 1427 OG1 THR A 50 7.987 21.707 -16.349 1.00 0.00 O ATOM 1428 CG2 THR A 50 7.578 21.063 -14.147 1.00 0.00 C ATOM 0 H THR A 50 8.904 18.801 -14.006 1.00 0.00 H new ATOM 0 HA THR A 50 9.765 19.932 -16.580 1.00 0.00 H new ATOM 0 HB THR A 50 7.377 19.712 -15.812 1.00 0.00 H new ATOM 0 HG1 THR A 50 8.893 22.071 -16.431 1.00 0.00 H new ATOM 0 HG21 THR A 50 6.531 21.363 -14.186 1.00 0.00 H new ATOM 0 HG22 THR A 50 7.702 20.273 -13.406 1.00 0.00 H new ATOM 0 HG23 THR A 50 8.191 21.920 -13.869 1.00 0.00 H new ATOM 1436 N GLU A 51 11.246 20.774 -14.046 1.00 0.00 N ATOM 1437 CA GLU A 51 12.213 21.682 -13.453 1.00 0.00 C ATOM 1438 C GLU A 51 13.274 20.896 -12.682 1.00 0.00 C ATOM 1439 O GLU A 51 13.161 20.719 -11.469 1.00 0.00 O ATOM 1440 CB GLU A 51 11.523 22.706 -12.550 1.00 0.00 C ATOM 1441 CG GLU A 51 10.594 22.016 -11.549 1.00 0.00 C ATOM 1442 CD GLU A 51 9.744 23.040 -10.795 1.00 0.00 C ATOM 1443 OE1 GLU A 51 8.507 22.964 -10.828 1.00 0.00 O ATOM 1444 OE2 GLU A 51 10.413 23.940 -10.155 1.00 0.00 O ATOM 0 H GLU A 51 11.247 19.833 -13.652 1.00 0.00 H new ATOM 0 HA GLU A 51 12.707 22.231 -14.255 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.273 23.288 -12.014 1.00 0.00 H new ATOM 0 HB3 GLU A 51 10.952 23.407 -13.159 1.00 0.00 H new ATOM 0 HG2 GLU A 51 9.945 21.315 -12.073 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.184 21.435 -10.840 1.00 0.00 H new ATOM 1452 N ARG A 52 14.282 20.445 -13.414 1.00 0.00 N ATOM 1453 CA ARG A 52 15.363 19.683 -12.813 1.00 0.00 C ATOM 1454 C ARG A 52 16.226 20.589 -11.932 1.00 0.00 C ATOM 1455 O ARG A 52 16.366 21.779 -12.210 1.00 0.00 O ATOM 1456 CB ARG A 52 16.242 19.035 -13.884 1.00 0.00 C ATOM 1457 CG ARG A 52 16.939 20.098 -14.737 1.00 0.00 C ATOM 1458 CD ARG A 52 18.350 19.651 -15.127 1.00 0.00 C ATOM 1459 NE ARG A 52 18.549 19.818 -16.583 1.00 0.00 N ATOM 1460 CZ ARG A 52 19.453 19.126 -17.308 1.00 0.00 C ATOM 1461 NH1 ARG A 52 20.251 18.212 -16.716 1.00 0.00 N ATOM 1462 NH2 ARG A 52 19.547 19.356 -18.605 1.00 0.00 N ATOM 0 H ARG A 52 14.373 20.593 -14.419 1.00 0.00 H new ATOM 0 HA ARG A 52 14.916 18.898 -12.203 1.00 0.00 H new ATOM 0 HB2 ARG A 52 16.988 18.397 -13.410 1.00 0.00 H new ATOM 0 HB3 ARG A 52 15.633 18.394 -14.521 1.00 0.00 H new ATOM 0 HG2 ARG A 52 16.353 20.289 -15.636 1.00 0.00 H new ATOM 0 HG3 ARG A 52 16.991 21.036 -14.184 1.00 0.00 H new ATOM 0 HD2 ARG A 52 19.090 20.236 -14.581 1.00 0.00 H new ATOM 0 HD3 ARG A 52 18.500 18.608 -14.848 1.00 0.00 H new ATOM 0 HE ARG A 52 17.966 20.499 -17.070 1.00 0.00 H new ATOM 0 HH11 ARG A 52 20.173 18.040 -15.714 1.00 0.00 H new ATOM 0 HH12 ARG A 52 20.932 17.693 -17.271 1.00 0.00 H new ATOM 0 HH21 ARG A 52 18.941 20.049 -19.045 1.00 0.00 H new ATOM 0 HH22 ARG A 52 20.225 18.841 -19.166 1.00 0.00 H new ATOM 1475 N GLN A 53 16.781 19.991 -10.888 1.00 0.00 N ATOM 1476 CA GLN A 53 17.626 20.729 -9.965 1.00 0.00 C ATOM 1477 C GLN A 53 18.129 19.808 -8.853 1.00 0.00 C ATOM 1478 O GLN A 53 17.594 18.718 -8.655 1.00 0.00 O ATOM 1479 CB GLN A 53 16.883 21.934 -9.385 1.00 0.00 C ATOM 1480 CG GLN A 53 17.844 23.094 -9.115 1.00 0.00 C ATOM 1481 CD GLN A 53 18.618 23.470 -10.380 1.00 0.00 C ATOM 1482 OE1 GLN A 53 18.258 23.110 -11.489 1.00 0.00 O ATOM 1483 NE2 GLN A 53 19.698 24.212 -10.153 1.00 0.00 N ATOM 0 H GLN A 53 16.662 19.004 -10.661 1.00 0.00 H new ATOM 0 HA GLN A 53 18.488 21.106 -10.515 1.00 0.00 H new ATOM 0 HB2 GLN A 53 16.106 22.255 -10.079 1.00 0.00 H new ATOM 0 HB3 GLN A 53 16.385 21.647 -8.459 1.00 0.00 H new ATOM 0 HG2 GLN A 53 17.285 23.958 -8.756 1.00 0.00 H new ATOM 0 HG3 GLN A 53 18.543 22.816 -8.326 1.00 0.00 H new ATOM 0 HE21 GLN A 53 19.942 24.478 -9.199 1.00 0.00 H new ATOM 0 HE22 GLN A 53 20.282 24.515 -10.933 1.00 0.00 H new ATOM 1492 N ALA A 54 19.154 20.278 -8.156 1.00 0.00 N ATOM 1493 CA ALA A 54 19.735 19.509 -7.069 1.00 0.00 C ATOM 1494 C ALA A 54 19.366 20.162 -5.735 1.00 0.00 C ATOM 1495 O ALA A 54 20.244 20.563 -4.972 1.00 0.00 O ATOM 1496 CB ALA A 54 21.248 19.406 -7.269 1.00 0.00 C ATOM 0 H ALA A 54 19.597 21.182 -8.323 1.00 0.00 H new ATOM 0 HA ALA A 54 19.337 18.494 -7.061 1.00 0.00 H new ATOM 0 HB1 ALA A 54 21.684 18.829 -6.454 1.00 0.00 H new ATOM 0 HB2 ALA A 54 21.457 18.910 -8.217 1.00 0.00 H new ATOM 0 HB3 ALA A 54 21.683 20.406 -7.279 1.00 0.00 H new ATOM 1502 N ASN A 55 18.066 20.247 -5.494 1.00 0.00 N ATOM 1503 CA ASN A 55 17.570 20.845 -4.265 1.00 0.00 C ATOM 1504 C ASN A 55 16.063 21.074 -4.386 1.00 0.00 C ATOM 1505 O ASN A 55 15.524 21.117 -5.491 1.00 0.00 O ATOM 1506 CB ASN A 55 18.235 22.198 -4.003 1.00 0.00 C ATOM 1507 CG ASN A 55 18.220 23.068 -5.261 1.00 0.00 C ATOM 1508 OD1 ASN A 55 19.167 23.110 -6.029 1.00 0.00 O ATOM 1509 ND2 ASN A 55 17.096 23.758 -5.429 1.00 0.00 N ATOM 0 H ASN A 55 17.341 19.912 -6.128 1.00 0.00 H new ATOM 0 HA ASN A 55 17.799 20.166 -3.444 1.00 0.00 H new ATOM 0 HB2 ASN A 55 17.715 22.712 -3.194 1.00 0.00 H new ATOM 0 HB3 ASN A 55 19.263 22.045 -3.675 1.00 0.00 H new ATOM 0 HD21 ASN A 55 16.988 24.368 -6.239 1.00 0.00 H new ATOM 0 HD22 ASN A 55 16.341 23.677 -4.748 1.00 0.00 H new TER 1516 ASN A 55 HETATM 1517 ZN ZN A 56 8.623 6.892 1.392 1.00 0.00 ZN HETATM 1518 ZN ZN A 57 10.439 17.833 -10.746 1.00 0.00 ZN