USER MOD reduce.3.24.130724 H: found=0, std=0, add=649, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 643 hydrogens (11 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 128 ZNZN :(H bumps) USER MOD NoAdj-H: A 44 HIS HE2 : A 44 HIS NE2 : A 149 ZNZN :(H bumps) USER MOD Set 1.1: B 207 U O2' : rot -8:sc= -0.974 USER MOD Set 1.2: B 209 G O2' : rot 86:sc= -0.37 USER MOD Set 2.1: A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 53 GLN : amide:sc= -9.11! C(o=-9.1!,f=-11!) USER MOD Set 3.1: A 26 LYS NZ :NH3+ -167:sc= -2.17! (180deg=-2.19!) USER MOD Set 3.2: A 27 ASN : amide:sc= -8.23! C(o=-10!,f=-21!) USER MOD Set 4.1: A 1 MET N :NH3+ -163:sc= -0.719 (180deg=0) USER MOD Set 4.2: A 5 ASN : amide:sc= -5.94 K(o=-6.7,f=-12!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= -0.271 K(o=-0.27,f=-2.7!) USER MOD Single : A 3 LYS NZ :NH3+ -145:sc= -0.0283 (180deg=-0.701) USER MOD Single : A 8 ASN : amide:sc= -0.512 X(o=-0.51,f=-0.26) USER MOD Single : A 9 GLN : amide:sc= 0.401 K(o=0.4,f=-0.54!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.783! USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -3.93! C(o=-3.9!,f=-9.3!) 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 180:sc= 0.0338 USER MOD Single : A 55 ASN : amide:sc= -0.016 X(o=-0.016,f=0) USER MOD Single : B 201 CG1 O2' : rot -15:sc= 0.662 USER MOD Single : B 202 G O2' : rot -129:sc= 0.657 USER MOD Single : B 203 C O2' : rot 24:sc= -0.862 USER MOD Single : B 204 G O2' : rot -3:sc= -1.95! USER MOD Single : B 205 A O2' : rot 11:sc= -1.31 USER MOD Single : B 206 C O2' : rot -88:sc= 1.28 USER MOD Single : B 208 G O2' : rot 22:sc= 1.46 USER MOD Single : B 210 U O2' : rot 12:sc= 0.542 USER MOD Single : B 211 G O2' : rot 36:sc= -0.133 USER MOD Single : B 212 A O2' : rot 6:sc= -2.38! USER MOD Single : B 213 G O2' : rot -90:sc= -2.41! USER MOD Single : B 214 U O2' : rot -2:sc= 1.43 USER MOD Single : B 215 A O2' : rot -25:sc= 0.536 USER MOD Single : B 216 C O2' : rot 20:sc= 0.498 USER MOD Single : B 217 G O2' : rot 1:sc= -0.0493 USER MOD Single : B 218 C O2' : rot -108:sc= 0.707 USER MOD Single : B 219 C O2' : rot -28:sc= 0.47 USER MOD Single : B 219 C O3' : rot 180:sc= 0.342 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -32.313 11.932 9.995 1.00 0.00 N ATOM 2 CA MET A 1 -31.728 12.473 8.781 1.00 0.00 C ATOM 3 C MET A 1 -31.620 11.398 7.698 1.00 0.00 C ATOM 4 O MET A 1 -32.130 11.573 6.592 1.00 0.00 O ATOM 5 CB MET A 1 -30.336 13.030 9.089 1.00 0.00 C ATOM 6 CG MET A 1 -30.318 14.555 8.981 1.00 0.00 C ATOM 7 SD MET A 1 -28.713 15.110 8.434 1.00 0.00 S ATOM 8 CE MET A 1 -28.380 16.359 9.665 1.00 0.00 C ATOM 0 H1 MET A 1 -32.640 12.712 10.600 1.00 0.00 H new ATOM 0 H2 MET A 1 -33.119 11.322 9.750 1.00 0.00 H new ATOM 0 H3 MET A 1 -31.599 11.374 10.505 1.00 0.00 H new ATOM 0 HA MET A 1 -32.374 13.270 8.412 1.00 0.00 H new ATOM 0 HB2 MET A 1 -30.034 12.730 10.092 1.00 0.00 H new ATOM 0 HB3 MET A 1 -29.609 12.605 8.397 1.00 0.00 H new ATOM 0 HG2 MET A 1 -31.085 14.887 8.281 1.00 0.00 H new ATOM 0 HG3 MET A 1 -30.555 14.999 9.948 1.00 0.00 H new ATOM 0 HE1 MET A 1 -27.407 16.811 9.471 1.00 0.00 H new ATOM 0 HE2 MET A 1 -29.152 17.127 9.622 1.00 0.00 H new ATOM 0 HE3 MET A 1 -28.377 15.903 10.655 1.00 0.00 H new ATOM 18 N GLN A 2 -30.951 10.311 8.053 1.00 0.00 N ATOM 19 CA GLN A 2 -30.770 9.208 7.124 1.00 0.00 C ATOM 20 C GLN A 2 -32.126 8.621 6.726 1.00 0.00 C ATOM 21 O GLN A 2 -33.089 8.704 7.486 1.00 0.00 O ATOM 22 CB GLN A 2 -29.860 8.133 7.722 1.00 0.00 C ATOM 23 CG GLN A 2 -28.409 8.338 7.285 1.00 0.00 C ATOM 24 CD GLN A 2 -27.598 9.031 8.383 1.00 0.00 C ATOM 25 OE1 GLN A 2 -28.006 9.116 9.530 1.00 0.00 O ATOM 26 NE2 GLN A 2 -26.433 9.518 7.968 1.00 0.00 N ATOM 0 H GLN A 2 -30.528 10.170 8.970 1.00 0.00 H new ATOM 0 HA GLN A 2 -30.285 9.590 6.226 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -29.923 8.162 8.810 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -30.202 7.147 7.409 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -27.957 7.375 7.047 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -28.381 8.936 6.374 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -26.154 9.411 6.993 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -25.818 9.998 8.625 1.00 0.00 H new ATOM 35 N LYS A 3 -32.157 8.039 5.536 1.00 0.00 N ATOM 36 CA LYS A 3 -33.378 7.438 5.029 1.00 0.00 C ATOM 37 C LYS A 3 -33.807 6.301 5.958 1.00 0.00 C ATOM 38 O LYS A 3 -34.998 6.090 6.179 1.00 0.00 O ATOM 39 CB LYS A 3 -33.198 7.006 3.571 1.00 0.00 C ATOM 40 CG LYS A 3 -32.164 5.885 3.456 1.00 0.00 C ATOM 41 CD LYS A 3 -31.694 5.720 2.009 1.00 0.00 C ATOM 42 CE LYS A 3 -30.541 6.675 1.694 1.00 0.00 C ATOM 43 NZ LYS A 3 -31.043 7.880 0.994 1.00 0.00 N ATOM 0 H LYS A 3 -31.356 7.971 4.909 1.00 0.00 H new ATOM 0 HA LYS A 3 -34.187 8.168 5.024 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -34.153 6.668 3.167 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -32.883 7.860 2.971 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -31.310 6.106 4.097 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -32.596 4.949 3.811 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -31.375 4.691 1.842 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -32.525 5.910 1.329 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -30.039 6.966 2.617 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -29.801 6.169 1.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -30.337 8.198 0.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -31.931 7.652 0.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -31.214 8.637 1.686 1.00 0.00 H new ATOM 57 N GLY A 4 -32.810 5.596 6.476 1.00 0.00 N ATOM 58 CA GLY A 4 -33.070 4.486 7.376 1.00 0.00 C ATOM 59 C GLY A 4 -33.851 4.949 8.608 1.00 0.00 C ATOM 60 O GLY A 4 -34.472 4.138 9.294 1.00 0.00 O ATOM 0 H GLY A 4 -31.823 5.772 6.289 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -33.634 3.714 6.853 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -32.127 4.037 7.687 1.00 0.00 H new ATOM 64 N ASN A 5 -33.795 6.250 8.850 1.00 0.00 N ATOM 65 CA ASN A 5 -34.490 6.829 9.987 1.00 0.00 C ATOM 66 C ASN A 5 -35.981 6.506 9.887 1.00 0.00 C ATOM 67 O ASN A 5 -36.637 6.264 10.899 1.00 0.00 O ATOM 68 CB ASN A 5 -34.337 8.352 10.008 1.00 0.00 C ATOM 69 CG ASN A 5 -32.891 8.754 10.310 1.00 0.00 C ATOM 70 OD1 ASN A 5 -31.964 8.429 9.586 1.00 0.00 O ATOM 71 ND2 ASN A 5 -32.752 9.476 11.419 1.00 0.00 N ATOM 0 H ASN A 5 -33.279 6.919 8.279 1.00 0.00 H new ATOM 0 HA ASN A 5 -34.058 6.410 10.895 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -34.640 8.765 9.046 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -35.001 8.777 10.760 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -31.827 9.793 11.709 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -33.571 9.713 11.979 1.00 0.00 H new ATOM 78 N PHE A 6 -36.474 6.512 8.657 1.00 0.00 N ATOM 79 CA PHE A 6 -37.876 6.221 8.412 1.00 0.00 C ATOM 80 C PHE A 6 -38.239 4.816 8.896 1.00 0.00 C ATOM 81 O PHE A 6 -39.416 4.476 9.001 1.00 0.00 O ATOM 82 CB PHE A 6 -38.091 6.298 6.898 1.00 0.00 C ATOM 83 CG PHE A 6 -39.487 5.866 6.445 1.00 0.00 C ATOM 84 CD1 PHE A 6 -40.573 6.166 7.208 1.00 0.00 C ATOM 85 CD2 PHE A 6 -39.642 5.183 5.280 1.00 0.00 C ATOM 86 CE1 PHE A 6 -41.868 5.765 6.787 1.00 0.00 C ATOM 87 CE2 PHE A 6 -40.938 4.782 4.859 1.00 0.00 C ATOM 88 CZ PHE A 6 -42.023 5.081 5.621 1.00 0.00 C ATOM 0 H PHE A 6 -35.927 6.714 7.820 1.00 0.00 H new ATOM 0 HA PHE A 6 -38.502 6.933 8.949 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -37.914 7.322 6.568 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -37.349 5.670 6.404 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -40.450 6.709 8.133 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -38.780 4.945 4.675 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -42.730 6.003 7.392 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -41.061 4.239 3.933 1.00 0.00 H new ATOM 0 HZ PHE A 6 -43.008 4.776 5.301 1.00 0.00 H new ATOM 98 N ARG A 7 -37.204 4.037 9.176 1.00 0.00 N ATOM 99 CA ARG A 7 -37.399 2.676 9.647 1.00 0.00 C ATOM 100 C ARG A 7 -38.167 2.677 10.970 1.00 0.00 C ATOM 101 O ARG A 7 -38.643 1.634 11.415 1.00 0.00 O ATOM 102 CB ARG A 7 -36.059 1.965 9.844 1.00 0.00 C ATOM 103 CG ARG A 7 -36.258 0.459 10.021 1.00 0.00 C ATOM 104 CD ARG A 7 -35.000 -0.313 9.616 1.00 0.00 C ATOM 105 NE ARG A 7 -34.904 -1.568 10.394 1.00 0.00 N ATOM 106 CZ ARG A 7 -35.504 -2.715 10.046 1.00 0.00 C ATOM 107 NH1 ARG A 7 -36.248 -2.772 8.933 1.00 0.00 N ATOM 108 NH2 ARG A 7 -35.362 -3.805 10.812 1.00 0.00 N ATOM 0 H ARG A 7 -36.229 4.322 9.086 1.00 0.00 H new ATOM 0 HA ARG A 7 -37.973 2.142 8.890 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -35.415 2.152 8.985 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -35.552 2.374 10.718 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -36.504 0.241 11.060 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -37.103 0.127 9.417 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -35.029 -0.538 8.550 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -34.116 0.300 9.789 1.00 0.00 H new ATOM 0 HE ARG A 7 -34.347 -1.560 11.248 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -36.358 -1.942 8.350 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -36.704 -3.645 8.669 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -34.797 -3.762 11.660 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -35.819 -4.678 10.547 1.00 0.00 H new ATOM 122 N ASN A 8 -38.264 3.858 11.561 1.00 0.00 N ATOM 123 CA ASN A 8 -38.967 4.008 12.823 1.00 0.00 C ATOM 124 C ASN A 8 -40.419 3.559 12.651 1.00 0.00 C ATOM 125 O ASN A 8 -41.123 3.327 13.633 1.00 0.00 O ATOM 126 CB ASN A 8 -38.974 5.468 13.280 1.00 0.00 C ATOM 127 CG ASN A 8 -39.301 5.575 14.772 1.00 0.00 C ATOM 128 OD1 ASN A 8 -38.429 5.689 15.617 1.00 0.00 O ATOM 129 ND2 ASN A 8 -40.601 5.530 15.045 1.00 0.00 N ATOM 0 H ASN A 8 -37.867 4.721 11.189 1.00 0.00 H new ATOM 0 HA ASN A 8 -38.454 3.400 13.568 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -38.001 5.919 13.084 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -39.708 6.030 12.702 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -40.922 5.592 16.011 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -41.278 5.433 14.288 1.00 0.00 H new ATOM 136 N GLN A 9 -40.826 3.450 11.395 1.00 0.00 N ATOM 137 CA GLN A 9 -42.182 3.034 11.080 1.00 0.00 C ATOM 138 C GLN A 9 -42.489 1.686 11.736 1.00 0.00 C ATOM 139 O GLN A 9 -43.644 1.386 12.037 1.00 0.00 O ATOM 140 CB GLN A 9 -42.399 2.969 9.567 1.00 0.00 C ATOM 141 CG GLN A 9 -43.849 3.299 9.205 1.00 0.00 C ATOM 142 CD GLN A 9 -44.514 2.125 8.483 1.00 0.00 C ATOM 143 OE1 GLN A 9 -43.874 1.329 7.817 1.00 0.00 O ATOM 144 NE2 GLN A 9 -45.832 2.064 8.652 1.00 0.00 N ATOM 0 H GLN A 9 -40.240 3.643 10.583 1.00 0.00 H new ATOM 0 HA GLN A 9 -42.871 3.777 11.481 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -41.728 3.669 9.070 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -42.147 1.973 9.203 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -44.408 3.538 10.110 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -43.877 4.184 8.570 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -46.306 2.764 9.223 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -46.369 1.317 8.210 1.00 0.00 H new ATOM 153 N ARG A 10 -41.435 0.909 11.940 1.00 0.00 N ATOM 154 CA ARG A 10 -41.578 -0.399 12.555 1.00 0.00 C ATOM 155 C ARG A 10 -42.276 -0.275 13.911 1.00 0.00 C ATOM 156 O ARG A 10 -42.866 -1.237 14.400 1.00 0.00 O ATOM 157 CB ARG A 10 -40.215 -1.067 12.750 1.00 0.00 C ATOM 158 CG ARG A 10 -40.344 -2.591 12.728 1.00 0.00 C ATOM 159 CD ARG A 10 -38.967 -3.258 12.696 1.00 0.00 C ATOM 160 NE ARG A 10 -38.706 -3.942 13.982 1.00 0.00 N ATOM 161 CZ ARG A 10 -38.189 -3.340 15.062 1.00 0.00 C ATOM 162 NH1 ARG A 10 -37.875 -2.038 15.018 1.00 0.00 N ATOM 163 NH2 ARG A 10 -37.987 -4.041 16.186 1.00 0.00 N ATOM 0 H ARG A 10 -40.479 1.161 11.690 1.00 0.00 H new ATOM 0 HA ARG A 10 -42.181 -1.015 11.888 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -39.532 -0.745 11.964 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -39.782 -0.749 13.698 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -40.894 -2.926 13.608 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -40.921 -2.898 11.856 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -38.920 -3.976 11.877 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -38.196 -2.511 12.509 1.00 0.00 H new ATOM 0 HE ARG A 10 -38.934 -4.934 14.051 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -38.029 -1.505 14.162 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -37.482 -1.580 15.840 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -38.227 -5.032 16.219 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -37.594 -3.584 17.008 1.00 0.00 H new ATOM 177 N LYS A 11 -42.185 0.918 14.481 1.00 0.00 N ATOM 178 CA LYS A 11 -42.801 1.181 15.770 1.00 0.00 C ATOM 179 C LYS A 11 -43.601 2.482 15.693 1.00 0.00 C ATOM 180 O LYS A 11 -43.573 3.288 16.622 1.00 0.00 O ATOM 181 CB LYS A 11 -41.747 1.172 16.878 1.00 0.00 C ATOM 182 CG LYS A 11 -41.753 -0.161 17.630 1.00 0.00 C ATOM 183 CD LYS A 11 -43.011 -0.299 18.491 1.00 0.00 C ATOM 184 CE LYS A 11 -43.487 -1.752 18.537 1.00 0.00 C ATOM 185 NZ LYS A 11 -44.376 -1.970 19.699 1.00 0.00 N ATOM 0 H LYS A 11 -41.694 1.713 14.073 1.00 0.00 H new ATOM 0 HA LYS A 11 -43.505 0.389 16.024 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -40.761 1.347 16.448 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -41.940 1.988 17.575 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -41.703 -0.985 16.918 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -40.867 -0.231 18.261 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -42.804 0.052 19.502 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -43.802 0.334 18.089 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -44.016 -1.997 17.616 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -42.628 -2.420 18.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -44.690 -2.961 19.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -43.860 -1.756 20.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -45.205 -1.346 19.624 1.00 0.00 H new ATOM 199 N THR A 12 -44.296 2.646 14.577 1.00 0.00 N ATOM 200 CA THR A 12 -45.103 3.837 14.367 1.00 0.00 C ATOM 201 C THR A 12 -44.233 4.988 13.857 1.00 0.00 C ATOM 202 O THR A 12 -43.249 5.357 14.496 1.00 0.00 O ATOM 203 CB THR A 12 -45.826 4.156 15.677 1.00 0.00 C ATOM 204 OG1 THR A 12 -46.184 2.878 16.196 1.00 0.00 O ATOM 205 CG2 THR A 12 -47.168 4.855 15.450 1.00 0.00 C ATOM 0 H THR A 12 -44.317 1.975 13.809 1.00 0.00 H new ATOM 0 HA THR A 12 -45.855 3.673 13.596 1.00 0.00 H new ATOM 0 HB THR A 12 -45.189 4.786 16.299 1.00 0.00 H new ATOM 0 HG1 THR A 12 -46.656 2.991 17.047 1.00 0.00 H new ATOM 0 HG21 THR A 12 -47.639 5.059 16.411 1.00 0.00 H new ATOM 0 HG22 THR A 12 -47.004 5.793 14.920 1.00 0.00 H new ATOM 0 HG23 THR A 12 -47.818 4.212 14.857 1.00 0.00 H new ATOM 213 N VAL A 13 -44.627 5.523 12.710 1.00 0.00 N ATOM 214 CA VAL A 13 -43.896 6.624 12.108 1.00 0.00 C ATOM 215 C VAL A 13 -44.578 7.944 12.474 1.00 0.00 C ATOM 216 O VAL A 13 -45.533 7.959 13.248 1.00 0.00 O ATOM 217 CB VAL A 13 -43.779 6.410 10.597 1.00 0.00 C ATOM 218 CG1 VAL A 13 -45.064 6.835 9.883 1.00 0.00 C ATOM 219 CG2 VAL A 13 -42.565 7.150 10.031 1.00 0.00 C ATOM 0 H VAL A 13 -45.443 5.214 12.182 1.00 0.00 H new ATOM 0 HA VAL A 13 -42.879 6.665 12.497 1.00 0.00 H new ATOM 0 HB VAL A 13 -43.634 5.345 10.419 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -44.955 6.673 8.811 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -45.900 6.244 10.256 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -45.253 7.891 10.073 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -42.505 6.981 8.956 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -42.666 8.218 10.226 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -41.658 6.779 10.508 1.00 0.00 H new ATOM 229 N LYS A 14 -44.059 9.020 11.900 1.00 0.00 N ATOM 230 CA LYS A 14 -44.606 10.341 12.156 1.00 0.00 C ATOM 231 C LYS A 14 -44.954 11.012 10.825 1.00 0.00 C ATOM 232 O LYS A 14 -44.064 11.401 10.071 1.00 0.00 O ATOM 233 CB LYS A 14 -43.647 11.159 13.024 1.00 0.00 C ATOM 234 CG LYS A 14 -44.405 12.207 13.841 1.00 0.00 C ATOM 235 CD LYS A 14 -43.613 12.611 15.086 1.00 0.00 C ATOM 236 CE LYS A 14 -44.504 12.601 16.329 1.00 0.00 C ATOM 237 NZ LYS A 14 -43.930 13.464 17.385 1.00 0.00 N ATOM 0 H LYS A 14 -43.266 9.003 11.259 1.00 0.00 H new ATOM 0 HA LYS A 14 -45.531 10.265 12.727 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -43.101 10.495 13.694 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -42.908 11.651 12.391 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -44.594 13.086 13.225 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -45.376 11.810 14.137 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -42.777 11.926 15.228 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -43.190 13.606 14.945 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -45.504 12.950 16.070 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -44.608 11.582 16.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -44.547 13.446 18.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -42.985 13.114 17.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -43.853 14.439 17.033 1.00 0.00 H new ATOM 251 N CYS A 15 -46.250 11.124 10.576 1.00 0.00 N ATOM 252 CA CYS A 15 -46.726 11.740 9.350 1.00 0.00 C ATOM 253 C CYS A 15 -46.437 13.241 9.421 1.00 0.00 C ATOM 254 O CYS A 15 -46.988 13.943 10.268 1.00 0.00 O ATOM 255 CB CYS A 15 -48.211 11.456 9.114 1.00 0.00 C ATOM 256 SG CYS A 15 -48.692 11.997 7.433 1.00 0.00 S ATOM 0 H CYS A 15 -46.986 10.798 11.203 1.00 0.00 H new ATOM 0 HA CYS A 15 -46.200 11.310 8.497 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -48.409 10.391 9.233 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -48.812 11.977 9.859 1.00 0.00 H new ATOM 261 N PHE A 16 -45.572 13.687 8.523 1.00 0.00 N ATOM 262 CA PHE A 16 -45.202 15.091 8.473 1.00 0.00 C ATOM 263 C PHE A 16 -46.236 15.905 7.692 1.00 0.00 C ATOM 264 O PHE A 16 -45.974 17.042 7.306 1.00 0.00 O ATOM 265 CB PHE A 16 -43.855 15.174 7.752 1.00 0.00 C ATOM 266 CG PHE A 16 -43.964 15.537 6.270 1.00 0.00 C ATOM 267 CD1 PHE A 16 -44.250 14.572 5.354 1.00 0.00 C ATOM 268 CD2 PHE A 16 -43.776 16.822 5.868 1.00 0.00 C ATOM 269 CE1 PHE A 16 -44.352 14.908 3.977 1.00 0.00 C ATOM 270 CE2 PHE A 16 -43.877 17.158 4.492 1.00 0.00 C ATOM 271 CZ PHE A 16 -44.163 16.193 3.575 1.00 0.00 C ATOM 0 H PHE A 16 -45.116 13.101 7.824 1.00 0.00 H new ATOM 0 HA PHE A 16 -45.149 15.497 9.483 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -43.232 15.915 8.252 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -43.345 14.215 7.844 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -44.399 13.551 5.673 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -43.550 17.588 6.595 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -44.580 14.143 3.250 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -43.727 18.179 4.173 1.00 0.00 H new ATOM 0 HZ PHE A 16 -44.240 16.448 2.528 1.00 0.00 H new ATOM 281 N ASN A 17 -47.390 15.287 7.482 1.00 0.00 N ATOM 282 CA ASN A 17 -48.466 15.939 6.753 1.00 0.00 C ATOM 283 C ASN A 17 -49.649 16.168 7.696 1.00 0.00 C ATOM 284 O ASN A 17 -50.082 17.303 7.889 1.00 0.00 O ATOM 285 CB ASN A 17 -48.948 15.071 5.590 1.00 0.00 C ATOM 286 CG ASN A 17 -50.325 15.525 5.101 1.00 0.00 C ATOM 287 OD1 ASN A 17 -50.586 16.700 4.906 1.00 0.00 O ATOM 288 ND2 ASN A 17 -51.188 14.530 4.917 1.00 0.00 N ATOM 0 H ASN A 17 -47.603 14.343 7.804 1.00 0.00 H new ATOM 0 HA ASN A 17 -48.086 16.884 6.364 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -48.231 15.124 4.770 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -48.995 14.029 5.905 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -52.135 14.729 4.593 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -50.903 13.568 5.100 1.00 0.00 H new ATOM 295 N CYS A 18 -50.138 15.072 8.257 1.00 0.00 N ATOM 296 CA CYS A 18 -51.262 15.138 9.174 1.00 0.00 C ATOM 297 C CYS A 18 -50.715 15.257 10.597 1.00 0.00 C ATOM 298 O CYS A 18 -51.361 15.838 11.469 1.00 0.00 O ATOM 299 CB CYS A 18 -52.192 13.932 9.019 1.00 0.00 C ATOM 300 SG CYS A 18 -51.339 12.410 9.570 1.00 0.00 S ATOM 0 H CYS A 18 -49.776 14.133 8.094 1.00 0.00 H new ATOM 0 HA CYS A 18 -51.870 16.013 8.945 1.00 0.00 H new ATOM 0 HB2 CYS A 18 -53.098 14.083 9.605 1.00 0.00 H new ATOM 0 HB3 CYS A 18 -52.499 13.830 7.978 1.00 0.00 H new ATOM 305 N GLY A 19 -49.530 14.697 10.791 1.00 0.00 N ATOM 306 CA GLY A 19 -48.888 14.732 12.093 1.00 0.00 C ATOM 307 C GLY A 19 -49.064 13.402 12.827 1.00 0.00 C ATOM 308 O GLY A 19 -48.183 12.981 13.576 1.00 0.00 O ATOM 0 H GLY A 19 -48.997 14.216 10.066 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -47.826 14.948 11.973 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -49.312 15.540 12.690 1.00 0.00 H new ATOM 312 N LYS A 20 -50.207 12.777 12.587 1.00 0.00 N ATOM 313 CA LYS A 20 -50.509 11.502 13.216 1.00 0.00 C ATOM 314 C LYS A 20 -49.294 10.579 13.099 1.00 0.00 C ATOM 315 O LYS A 20 -48.331 10.900 12.404 1.00 0.00 O ATOM 316 CB LYS A 20 -51.791 10.906 12.632 1.00 0.00 C ATOM 317 CG LYS A 20 -52.682 10.334 13.736 1.00 0.00 C ATOM 318 CD LYS A 20 -53.746 11.346 14.164 1.00 0.00 C ATOM 319 CE LYS A 20 -55.148 10.861 13.789 1.00 0.00 C ATOM 320 NZ LYS A 20 -56.038 12.011 13.512 1.00 0.00 N ATOM 0 H LYS A 20 -50.935 13.129 11.966 1.00 0.00 H new ATOM 0 HA LYS A 20 -50.704 11.640 14.279 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -52.335 11.673 12.082 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -51.539 10.121 11.919 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -53.164 9.422 13.383 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -52.070 10.059 14.595 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -53.689 11.506 15.241 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -53.551 12.307 13.688 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -55.094 10.216 12.912 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -55.561 10.261 14.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -56.985 11.664 13.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -56.104 12.611 14.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -55.651 12.567 12.723 1.00 0.00 H new ATOM 334 N GLU A 21 -49.378 9.453 13.790 1.00 0.00 N ATOM 335 CA GLU A 21 -48.297 8.481 13.773 1.00 0.00 C ATOM 336 C GLU A 21 -48.799 7.138 13.238 1.00 0.00 C ATOM 337 O GLU A 21 -49.999 6.871 13.250 1.00 0.00 O ATOM 338 CB GLU A 21 -47.680 8.321 15.164 1.00 0.00 C ATOM 339 CG GLU A 21 -48.663 7.646 16.124 1.00 0.00 C ATOM 340 CD GLU A 21 -48.127 7.663 17.557 1.00 0.00 C ATOM 341 OE1 GLU A 21 -47.991 8.781 18.099 1.00 0.00 O ATOM 342 OE2 GLU A 21 -47.864 6.557 18.079 1.00 0.00 O ATOM 0 H GLU A 21 -50.178 9.191 14.366 1.00 0.00 H new ATOM 0 HA GLU A 21 -47.517 8.847 13.106 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -46.768 7.728 15.095 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -47.397 9.298 15.555 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -49.625 8.158 16.085 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -48.837 6.617 15.809 1.00 0.00 H new ATOM 349 N GLY A 22 -47.854 6.330 12.782 1.00 0.00 N ATOM 350 CA GLY A 22 -48.185 5.021 12.243 1.00 0.00 C ATOM 351 C GLY A 22 -47.944 4.972 10.733 1.00 0.00 C ATOM 352 O GLY A 22 -47.613 3.921 10.187 1.00 0.00 O ATOM 0 H GLY A 22 -46.859 6.556 12.774 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -47.582 4.258 12.736 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -49.229 4.790 12.456 1.00 0.00 H new ATOM 356 N HIS A 23 -48.119 6.123 10.101 1.00 0.00 N ATOM 357 CA HIS A 23 -47.926 6.225 8.664 1.00 0.00 C ATOM 358 C HIS A 23 -47.266 7.564 8.329 1.00 0.00 C ATOM 359 O HIS A 23 -47.072 8.402 9.209 1.00 0.00 O ATOM 360 CB HIS A 23 -49.246 6.012 7.921 1.00 0.00 C ATOM 361 CG HIS A 23 -50.172 7.204 7.960 1.00 0.00 C ATOM 362 ND1 HIS A 23 -51.240 7.296 8.836 1.00 0.00 N ATOM 363 CD2 HIS A 23 -50.178 8.353 7.223 1.00 0.00 C ATOM 364 CE1 HIS A 23 -51.854 8.451 8.626 1.00 0.00 C ATOM 365 NE2 HIS A 23 -51.195 9.104 7.625 1.00 0.00 N ATOM 0 H HIS A 23 -48.392 6.993 10.557 1.00 0.00 H new ATOM 0 HA HIS A 23 -47.256 5.434 8.327 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -49.030 5.766 6.881 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -49.759 5.152 8.352 1.00 0.00 H new ATOM 0 HD1 HIS A 23 -51.508 6.594 9.526 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -49.474 8.608 6.445 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -52.724 8.813 9.154 1.00 0.00 H new ATOM 373 N ILE A 24 -46.940 7.725 7.055 1.00 0.00 N ATOM 374 CA ILE A 24 -46.306 8.948 6.593 1.00 0.00 C ATOM 375 C ILE A 24 -47.167 9.581 5.497 1.00 0.00 C ATOM 376 O ILE A 24 -47.982 8.902 4.875 1.00 0.00 O ATOM 377 CB ILE A 24 -44.864 8.674 6.162 1.00 0.00 C ATOM 378 CG1 ILE A 24 -44.805 7.543 5.134 1.00 0.00 C ATOM 379 CG2 ILE A 24 -43.973 8.395 7.373 1.00 0.00 C ATOM 380 CD1 ILE A 24 -43.392 7.388 4.568 1.00 0.00 C ATOM 0 H ILE A 24 -47.103 7.028 6.328 1.00 0.00 H new ATOM 0 HA ILE A 24 -46.239 9.673 7.404 1.00 0.00 H new ATOM 0 HB ILE A 24 -44.476 9.570 5.678 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -45.119 6.608 5.598 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -45.505 7.747 4.323 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -42.954 8.203 7.038 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -43.981 9.259 8.037 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -44.349 7.523 7.908 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -43.379 6.577 3.840 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -43.091 8.316 4.083 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -42.699 7.160 5.378 1.00 0.00 H new ATOM 392 N ALA A 25 -46.955 10.873 5.295 1.00 0.00 N ATOM 393 CA ALA A 25 -47.701 11.604 4.286 1.00 0.00 C ATOM 394 C ALA A 25 -47.595 10.871 2.948 1.00 0.00 C ATOM 395 O ALA A 25 -48.570 10.788 2.202 1.00 0.00 O ATOM 396 CB ALA A 25 -47.180 13.041 4.206 1.00 0.00 C ATOM 0 H ALA A 25 -46.277 11.432 5.813 1.00 0.00 H new ATOM 0 HA ALA A 25 -48.757 11.654 4.552 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -47.740 13.589 3.449 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -47.305 13.528 5.173 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -46.123 13.031 3.939 1.00 0.00 H new ATOM 402 N LYS A 26 -46.403 10.357 2.685 1.00 0.00 N ATOM 403 CA LYS A 26 -46.156 9.633 1.449 1.00 0.00 C ATOM 404 C LYS A 26 -47.366 8.752 1.128 1.00 0.00 C ATOM 405 O LYS A 26 -47.636 8.462 -0.035 1.00 0.00 O ATOM 406 CB LYS A 26 -44.838 8.859 1.534 1.00 0.00 C ATOM 407 CG LYS A 26 -45.088 7.350 1.538 1.00 0.00 C ATOM 408 CD LYS A 26 -43.772 6.577 1.433 1.00 0.00 C ATOM 409 CE LYS A 26 -44.013 5.069 1.525 1.00 0.00 C ATOM 410 NZ LYS A 26 -44.174 4.654 2.937 1.00 0.00 N ATOM 0 H LYS A 26 -45.597 10.427 3.306 1.00 0.00 H new ATOM 0 HA LYS A 26 -46.037 10.329 0.618 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -44.202 9.124 0.690 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -44.302 9.145 2.439 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -45.609 7.066 2.453 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -45.738 7.083 0.705 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -43.282 6.814 0.489 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -43.097 6.890 2.230 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -44.905 4.802 0.958 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -43.177 4.533 1.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -44.116 3.618 3.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -43.420 5.080 3.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -45.100 4.972 3.289 1.00 0.00 H new ATOM 424 N ASN A 27 -48.062 8.352 2.183 1.00 0.00 N ATOM 425 CA ASN A 27 -49.236 7.511 2.029 1.00 0.00 C ATOM 426 C ASN A 27 -50.204 7.776 3.185 1.00 0.00 C ATOM 427 O ASN A 27 -50.559 6.859 3.924 1.00 0.00 O ATOM 428 CB ASN A 27 -48.860 6.028 2.058 1.00 0.00 C ATOM 429 CG ASN A 27 -47.573 5.805 2.855 1.00 0.00 C ATOM 430 OD1 ASN A 27 -46.657 5.125 2.425 1.00 0.00 O ATOM 431 ND2 ASN A 27 -47.557 6.414 4.038 1.00 0.00 N ATOM 0 H ASN A 27 -47.835 8.595 3.147 1.00 0.00 H new ATOM 0 HA ASN A 27 -49.696 7.748 1.069 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -49.672 5.452 2.502 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -48.730 5.662 1.040 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -46.743 6.326 4.646 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -48.359 6.969 4.337 1.00 0.00 H new ATOM 438 N CYS A 28 -50.602 9.034 3.304 1.00 0.00 N ATOM 439 CA CYS A 28 -51.521 9.431 4.357 1.00 0.00 C ATOM 440 C CYS A 28 -52.909 8.885 4.014 1.00 0.00 C ATOM 441 O CYS A 28 -53.276 8.803 2.844 1.00 0.00 O ATOM 442 CB CYS A 28 -51.537 10.948 4.552 1.00 0.00 C ATOM 443 SG CYS A 28 -52.600 11.385 5.976 1.00 0.00 S ATOM 0 H CYS A 28 -50.305 9.791 2.689 1.00 0.00 H new ATOM 0 HA CYS A 28 -51.191 9.012 5.308 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -50.523 11.312 4.719 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -51.906 11.435 3.649 1.00 0.00 H new ATOM 448 N ARG A 29 -53.642 8.526 5.058 1.00 0.00 N ATOM 449 CA ARG A 29 -54.982 7.991 4.883 1.00 0.00 C ATOM 450 C ARG A 29 -56.016 9.116 4.945 1.00 0.00 C ATOM 451 O ARG A 29 -57.202 8.864 5.153 1.00 0.00 O ATOM 452 CB ARG A 29 -55.304 6.951 5.958 1.00 0.00 C ATOM 453 CG ARG A 29 -55.310 7.586 7.350 1.00 0.00 C ATOM 454 CD ARG A 29 -56.249 6.830 8.293 1.00 0.00 C ATOM 455 NE ARG A 29 -56.494 7.633 9.512 1.00 0.00 N ATOM 456 CZ ARG A 29 -57.569 7.494 10.301 1.00 0.00 C ATOM 457 NH1 ARG A 29 -58.505 6.582 10.002 1.00 0.00 N ATOM 458 NH2 ARG A 29 -57.708 8.265 11.388 1.00 0.00 N ATOM 0 H ARG A 29 -53.333 8.595 6.028 1.00 0.00 H new ATOM 0 HA ARG A 29 -55.022 7.511 3.905 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -56.276 6.502 5.755 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -54.568 6.148 5.924 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -54.300 7.584 7.759 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -55.623 8.628 7.277 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -57.193 6.621 7.789 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -55.811 5.869 8.562 1.00 0.00 H new ATOM 0 HE ARG A 29 -55.801 8.337 9.768 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -58.399 5.995 9.175 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -59.323 6.475 10.602 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -56.996 8.958 11.616 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -58.526 8.158 11.988 1.00 0.00 H new ATOM 472 N ALA A 30 -55.529 10.335 4.760 1.00 0.00 N ATOM 473 CA ALA A 30 -56.396 11.500 4.792 1.00 0.00 C ATOM 474 C ALA A 30 -57.326 11.473 3.578 1.00 0.00 C ATOM 475 O ALA A 30 -56.873 11.606 2.442 1.00 0.00 O ATOM 476 CB ALA A 30 -55.544 12.769 4.845 1.00 0.00 C ATOM 0 H ALA A 30 -54.545 10.540 4.587 1.00 0.00 H new ATOM 0 HA ALA A 30 -57.020 11.489 5.685 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -56.195 13.643 4.869 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -54.924 12.754 5.741 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -54.906 12.816 3.963 1.00 0.00 H new ATOM 482 N PRO A 31 -58.643 11.293 3.865 1.00 0.00 N ATOM 483 CA PRO A 31 -59.640 11.246 2.810 1.00 0.00 C ATOM 484 C PRO A 31 -59.917 12.644 2.255 1.00 0.00 C ATOM 485 O PRO A 31 -61.070 13.061 2.159 1.00 0.00 O ATOM 486 CB PRO A 31 -60.863 10.609 3.452 1.00 0.00 C ATOM 487 CG PRO A 31 -60.666 10.749 4.952 1.00 0.00 C ATOM 488 CD PRO A 31 -59.216 11.131 5.199 1.00 0.00 C ATOM 0 HA PRO A 31 -59.312 10.666 1.947 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -61.777 11.107 3.130 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -60.953 9.561 3.166 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -61.335 11.509 5.355 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -60.905 9.813 5.457 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -59.142 12.053 5.776 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -58.694 10.359 5.763 1.00 0.00 H new ATOM 496 N ARG A 32 -58.839 13.329 1.901 1.00 0.00 N ATOM 497 CA ARG A 32 -58.951 14.672 1.357 1.00 0.00 C ATOM 498 C ARG A 32 -58.634 14.667 -0.140 1.00 0.00 C ATOM 499 O ARG A 32 -57.880 13.819 -0.614 1.00 0.00 O ATOM 500 CB ARG A 32 -58.000 15.636 2.070 1.00 0.00 C ATOM 501 CG ARG A 32 -56.567 15.467 1.561 1.00 0.00 C ATOM 502 CD ARG A 32 -55.561 15.604 2.706 1.00 0.00 C ATOM 503 NE ARG A 32 -54.180 15.511 2.180 1.00 0.00 N ATOM 504 CZ ARG A 32 -53.633 14.385 1.702 1.00 0.00 C ATOM 505 NH1 ARG A 32 -54.345 13.250 1.681 1.00 0.00 N ATOM 506 NH2 ARG A 32 -52.373 14.394 1.245 1.00 0.00 N ATOM 0 H ARG A 32 -57.884 12.979 1.980 1.00 0.00 H new ATOM 0 HA ARG A 32 -59.976 15.009 1.513 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -58.329 16.663 1.909 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -58.032 15.456 3.145 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -56.457 14.490 1.090 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -56.358 16.215 0.796 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -55.702 16.558 3.213 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -55.731 14.822 3.446 1.00 0.00 H new ATOM 0 HE ARG A 32 -53.610 16.357 2.182 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -55.304 13.243 2.029 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -53.928 12.393 1.317 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -51.831 15.258 1.261 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -51.956 13.537 0.881 1.00 0.00 H new ATOM 520 N LYS A 33 -59.225 15.623 -0.840 1.00 0.00 N ATOM 521 CA LYS A 33 -59.015 15.739 -2.274 1.00 0.00 C ATOM 522 C LYS A 33 -57.914 16.767 -2.542 1.00 0.00 C ATOM 523 O LYS A 33 -56.898 16.448 -3.156 1.00 0.00 O ATOM 524 CB LYS A 33 -60.334 16.050 -2.986 1.00 0.00 C ATOM 525 CG LYS A 33 -60.145 16.073 -4.504 1.00 0.00 C ATOM 526 CD LYS A 33 -61.455 16.419 -5.213 1.00 0.00 C ATOM 527 CE LYS A 33 -61.188 17.112 -6.551 1.00 0.00 C ATOM 528 NZ LYS A 33 -60.827 16.120 -7.587 1.00 0.00 N ATOM 0 H LYS A 33 -59.849 16.325 -0.442 1.00 0.00 H new ATOM 0 HA LYS A 33 -58.673 14.790 -2.687 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -61.080 15.301 -2.720 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -60.715 17.014 -2.649 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -59.380 16.803 -4.768 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -59.788 15.101 -4.845 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -62.034 15.510 -5.379 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -62.057 17.068 -4.577 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -62.073 17.666 -6.863 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -60.382 17.837 -6.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -60.649 16.608 -8.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -59.969 15.609 -7.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -61.608 15.444 -7.708 1.00 0.00 H new ATOM 542 N LYS A 34 -58.154 17.981 -2.069 1.00 0.00 N ATOM 543 CA LYS A 34 -57.196 19.058 -2.249 1.00 0.00 C ATOM 544 C LYS A 34 -57.581 20.234 -1.350 1.00 0.00 C ATOM 545 O LYS A 34 -58.656 20.813 -1.504 1.00 0.00 O ATOM 546 CB LYS A 34 -57.080 19.429 -3.729 1.00 0.00 C ATOM 547 CG LYS A 34 -57.826 20.729 -4.029 1.00 0.00 C ATOM 548 CD LYS A 34 -57.813 21.037 -5.527 1.00 0.00 C ATOM 549 CE LYS A 34 -56.412 21.442 -5.991 1.00 0.00 C ATOM 550 NZ LYS A 34 -56.465 22.707 -6.759 1.00 0.00 N ATOM 0 H LYS A 34 -58.999 18.243 -1.561 1.00 0.00 H new ATOM 0 HA LYS A 34 -56.200 18.736 -1.944 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -56.030 19.538 -3.999 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -57.485 18.624 -4.342 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -58.855 20.650 -3.680 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -57.365 21.551 -3.481 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -58.146 20.162 -6.085 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -58.518 21.840 -5.743 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -55.757 21.561 -5.128 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -55.985 20.652 -6.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -55.506 22.967 -7.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -57.074 22.582 -7.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -56.853 23.462 -6.158 1.00 0.00 H new ATOM 564 N GLY A 35 -56.683 20.552 -0.428 1.00 0.00 N ATOM 565 CA GLY A 35 -56.915 21.649 0.495 1.00 0.00 C ATOM 566 C GLY A 35 -55.598 22.155 1.088 1.00 0.00 C ATOM 567 O GLY A 35 -54.614 21.419 1.141 1.00 0.00 O ATOM 0 H GLY A 35 -55.794 20.069 -0.301 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -57.421 22.464 -0.023 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -57.577 21.321 1.297 1.00 0.00 H new ATOM 571 N CYS A 36 -55.622 23.409 1.517 1.00 0.00 N ATOM 572 CA CYS A 36 -54.443 24.022 2.103 1.00 0.00 C ATOM 573 C CYS A 36 -54.249 23.446 3.507 1.00 0.00 C ATOM 574 O CYS A 36 -55.006 23.765 4.422 1.00 0.00 O ATOM 575 CB CYS A 36 -54.549 25.548 2.122 1.00 0.00 C ATOM 576 SG CYS A 36 -52.981 26.277 2.723 1.00 0.00 S ATOM 0 H CYS A 36 -56.440 24.017 1.470 1.00 0.00 H new ATOM 0 HA CYS A 36 -53.569 23.792 1.493 1.00 0.00 H new ATOM 0 HB2 CYS A 36 -54.771 25.918 1.121 1.00 0.00 H new ATOM 0 HB3 CYS A 36 -55.373 25.856 2.766 1.00 0.00 H new ATOM 581 N TRP A 37 -53.231 22.607 3.633 1.00 0.00 N ATOM 582 CA TRP A 37 -52.928 21.984 4.910 1.00 0.00 C ATOM 583 C TRP A 37 -51.986 22.913 5.678 1.00 0.00 C ATOM 584 O TRP A 37 -51.409 22.519 6.690 1.00 0.00 O ATOM 585 CB TRP A 37 -52.353 20.580 4.712 1.00 0.00 C ATOM 586 CG TRP A 37 -50.913 20.423 5.203 1.00 0.00 C ATOM 587 CD1 TRP A 37 -50.468 19.695 6.237 1.00 0.00 C ATOM 588 CD2 TRP A 37 -49.738 21.038 4.633 1.00 0.00 C ATOM 589 NE1 TRP A 37 -49.099 19.798 6.375 1.00 0.00 N ATOM 590 CE2 TRP A 37 -48.640 20.641 5.369 1.00 0.00 C ATOM 591 CE3 TRP A 37 -49.608 21.904 3.533 1.00 0.00 C ATOM 592 CZ2 TRP A 37 -47.335 21.058 5.084 1.00 0.00 C ATOM 593 CZ3 TRP A 37 -48.296 22.312 3.262 1.00 0.00 C ATOM 594 CH2 TRP A 37 -47.181 21.920 3.993 1.00 0.00 C ATOM 0 H TRP A 37 -52.606 22.344 2.871 1.00 0.00 H new ATOM 0 HA TRP A 37 -53.836 21.847 5.497 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -52.985 19.863 5.236 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -52.394 20.328 3.652 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -51.101 19.103 6.881 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -48.528 19.340 7.085 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -50.453 22.229 2.944 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -46.492 20.732 5.675 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -48.140 22.978 2.426 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -46.200 22.279 3.720 1.00 0.00 H new ATOM 605 N LYS A 38 -51.860 24.129 5.168 1.00 0.00 N ATOM 606 CA LYS A 38 -50.998 25.118 5.793 1.00 0.00 C ATOM 607 C LYS A 38 -51.847 26.059 6.650 1.00 0.00 C ATOM 608 O LYS A 38 -51.433 26.457 7.737 1.00 0.00 O ATOM 609 CB LYS A 38 -50.156 25.837 4.739 1.00 0.00 C ATOM 610 CG LYS A 38 -49.082 26.708 5.395 1.00 0.00 C ATOM 611 CD LYS A 38 -48.927 28.038 4.655 1.00 0.00 C ATOM 612 CE LYS A 38 -47.453 28.355 4.400 1.00 0.00 C ATOM 613 NZ LYS A 38 -46.946 29.314 5.407 1.00 0.00 N ATOM 0 H LYS A 38 -52.341 24.452 4.328 1.00 0.00 H new ATOM 0 HA LYS A 38 -50.285 24.635 6.461 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -49.685 25.105 4.083 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -50.800 26.456 4.115 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -49.346 26.896 6.436 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -48.130 26.177 5.399 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -49.463 27.995 3.707 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -49.379 28.839 5.240 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -46.866 27.437 4.436 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -47.332 28.771 3.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -45.944 29.518 5.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -47.495 30.196 5.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -47.043 28.903 6.357 1.00 0.00 H new ATOM 627 N CYS A 39 -53.019 26.389 6.126 1.00 0.00 N ATOM 628 CA CYS A 39 -53.929 27.277 6.829 1.00 0.00 C ATOM 629 C CYS A 39 -55.113 26.448 7.335 1.00 0.00 C ATOM 630 O CYS A 39 -55.553 26.618 8.471 1.00 0.00 O ATOM 631 CB CYS A 39 -54.382 28.439 5.945 1.00 0.00 C ATOM 632 SG CYS A 39 -55.204 27.797 4.441 1.00 0.00 S ATOM 0 H CYS A 39 -53.359 26.057 5.223 1.00 0.00 H new ATOM 0 HA CYS A 39 -53.416 27.731 7.676 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -55.067 29.082 6.498 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -53.524 29.052 5.667 1.00 0.00 H new ATOM 637 N GLY A 40 -55.594 25.572 6.466 1.00 0.00 N ATOM 638 CA GLY A 40 -56.718 24.718 6.810 1.00 0.00 C ATOM 639 C GLY A 40 -57.949 25.067 5.972 1.00 0.00 C ATOM 640 O GLY A 40 -59.080 24.857 6.406 1.00 0.00 O ATOM 0 H GLY A 40 -55.226 25.435 5.525 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -56.449 23.674 6.649 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -56.952 24.828 7.869 1.00 0.00 H new ATOM 644 N LYS A 41 -57.688 25.597 4.786 1.00 0.00 N ATOM 645 CA LYS A 41 -58.760 25.979 3.883 1.00 0.00 C ATOM 646 C LYS A 41 -58.709 25.096 2.636 1.00 0.00 C ATOM 647 O LYS A 41 -57.758 25.166 1.859 1.00 0.00 O ATOM 648 CB LYS A 41 -58.697 27.477 3.580 1.00 0.00 C ATOM 649 CG LYS A 41 -59.796 28.235 4.328 1.00 0.00 C ATOM 650 CD LYS A 41 -59.263 29.549 4.902 1.00 0.00 C ATOM 651 CE LYS A 41 -59.242 29.512 6.431 1.00 0.00 C ATOM 652 NZ LYS A 41 -59.062 30.875 6.981 1.00 0.00 N ATOM 0 H LYS A 41 -56.748 25.771 4.429 1.00 0.00 H new ATOM 0 HA LYS A 41 -59.730 25.813 4.351 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -57.721 27.869 3.866 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -58.804 27.639 2.507 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -60.626 28.440 3.652 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -60.187 27.614 5.134 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -58.257 29.733 4.525 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -59.886 30.377 4.563 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -60.173 29.084 6.803 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -58.434 28.866 6.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -59.050 30.831 8.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -58.162 31.271 6.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -59.847 31.482 6.669 1.00 0.00 H new ATOM 666 N GLU A 42 -59.746 24.284 2.481 1.00 0.00 N ATOM 667 CA GLU A 42 -59.831 23.389 1.340 1.00 0.00 C ATOM 668 C GLU A 42 -60.106 24.182 0.062 1.00 0.00 C ATOM 669 O GLU A 42 -60.647 25.285 0.115 1.00 0.00 O ATOM 670 CB GLU A 42 -60.901 22.318 1.562 1.00 0.00 C ATOM 671 CG GLU A 42 -62.299 22.939 1.593 1.00 0.00 C ATOM 672 CD GLU A 42 -62.964 22.726 2.955 1.00 0.00 C ATOM 673 OE1 GLU A 42 -63.553 21.638 3.133 1.00 0.00 O ATOM 674 OE2 GLU A 42 -62.867 23.655 3.785 1.00 0.00 O ATOM 0 H GLU A 42 -60.534 24.228 3.127 1.00 0.00 H new ATOM 0 HA GLU A 42 -58.873 22.881 1.229 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -60.847 21.574 0.767 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -60.710 21.796 2.500 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -62.232 24.006 1.380 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -62.915 22.496 0.810 1.00 0.00 H new ATOM 681 N GLY A 43 -59.719 23.589 -1.059 1.00 0.00 N ATOM 682 CA GLY A 43 -59.918 24.227 -2.350 1.00 0.00 C ATOM 683 C GLY A 43 -58.583 24.660 -2.958 1.00 0.00 C ATOM 684 O GLY A 43 -58.434 24.695 -4.179 1.00 0.00 O ATOM 0 H GLY A 43 -59.269 22.674 -1.100 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -60.423 23.538 -3.026 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -60.568 25.094 -2.235 1.00 0.00 H new ATOM 688 N HIS A 44 -57.643 24.978 -2.080 1.00 0.00 N ATOM 689 CA HIS A 44 -56.325 25.407 -2.515 1.00 0.00 C ATOM 690 C HIS A 44 -55.254 24.643 -1.736 1.00 0.00 C ATOM 691 O HIS A 44 -55.570 23.759 -0.940 1.00 0.00 O ATOM 692 CB HIS A 44 -56.178 26.925 -2.391 1.00 0.00 C ATOM 693 CG HIS A 44 -55.927 27.405 -0.982 1.00 0.00 C ATOM 694 ND1 HIS A 44 -56.916 27.441 -0.015 1.00 0.00 N ATOM 695 CD2 HIS A 44 -54.789 27.865 -0.387 1.00 0.00 C ATOM 696 CE1 HIS A 44 -56.386 27.906 1.108 1.00 0.00 C ATOM 697 NE2 HIS A 44 -55.068 28.169 0.874 1.00 0.00 N ATOM 0 H HIS A 44 -57.768 24.947 -1.068 1.00 0.00 H new ATOM 0 HA HIS A 44 -56.194 25.173 -3.571 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -55.356 27.253 -3.027 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -57.083 27.399 -2.770 1.00 0.00 H new ATOM 0 HD1 HIS A 44 -57.887 27.158 -0.144 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -53.824 27.965 -0.862 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -56.906 28.051 2.043 1.00 0.00 H new ATOM 705 N GLN A 45 -54.006 25.009 -1.992 1.00 0.00 N ATOM 706 CA GLN A 45 -52.886 24.369 -1.325 1.00 0.00 C ATOM 707 C GLN A 45 -51.947 25.423 -0.735 1.00 0.00 C ATOM 708 O GLN A 45 -52.092 26.614 -1.010 1.00 0.00 O ATOM 709 CB GLN A 45 -52.135 23.441 -2.282 1.00 0.00 C ATOM 710 CG GLN A 45 -51.329 24.244 -3.305 1.00 0.00 C ATOM 711 CD GLN A 45 -49.879 23.756 -3.365 1.00 0.00 C ATOM 712 OE1 GLN A 45 -49.245 23.492 -2.358 1.00 0.00 O ATOM 713 NE2 GLN A 45 -49.394 23.654 -4.599 1.00 0.00 N ATOM 0 H GLN A 45 -53.747 25.741 -2.653 1.00 0.00 H new ATOM 0 HA GLN A 45 -53.275 23.759 -0.510 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -51.467 22.792 -1.716 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -52.844 22.795 -2.799 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -51.789 24.152 -4.289 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -51.350 25.301 -3.041 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -49.981 23.892 -5.399 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -48.435 23.338 -4.746 1.00 0.00 H new ATOM 722 N MET A 46 -51.004 24.948 0.067 1.00 0.00 N ATOM 723 CA MET A 46 -50.042 25.835 0.698 1.00 0.00 C ATOM 724 C MET A 46 -49.322 26.694 -0.343 1.00 0.00 C ATOM 725 O MET A 46 -49.211 27.908 -0.182 1.00 0.00 O ATOM 726 CB MET A 46 -49.016 25.006 1.474 1.00 0.00 C ATOM 727 CG MET A 46 -47.981 25.907 2.150 1.00 0.00 C ATOM 728 SD MET A 46 -46.546 26.081 1.102 1.00 0.00 S ATOM 729 CE MET A 46 -45.635 24.623 1.580 1.00 0.00 C ATOM 0 H MET A 46 -50.886 23.961 0.294 1.00 0.00 H new ATOM 0 HA MET A 46 -50.578 26.496 1.379 1.00 0.00 H new ATOM 0 HB2 MET A 46 -49.525 24.403 2.226 1.00 0.00 H new ATOM 0 HB3 MET A 46 -48.515 24.315 0.797 1.00 0.00 H new ATOM 0 HG2 MET A 46 -48.415 26.886 2.351 1.00 0.00 H new ATOM 0 HG3 MET A 46 -47.690 25.483 3.111 1.00 0.00 H new ATOM 0 HE1 MET A 46 -44.703 24.575 1.017 1.00 0.00 H new ATOM 0 HE2 MET A 46 -45.413 24.666 2.646 1.00 0.00 H new ATOM 0 HE3 MET A 46 -46.232 23.736 1.370 1.00 0.00 H new ATOM 739 N LYS A 47 -48.851 26.029 -1.388 1.00 0.00 N ATOM 740 CA LYS A 47 -48.144 26.716 -2.455 1.00 0.00 C ATOM 741 C LYS A 47 -49.062 27.775 -3.069 1.00 0.00 C ATOM 742 O LYS A 47 -48.599 28.667 -3.779 1.00 0.00 O ATOM 743 CB LYS A 47 -47.600 25.711 -3.472 1.00 0.00 C ATOM 744 CG LYS A 47 -46.211 26.124 -3.963 1.00 0.00 C ATOM 745 CD LYS A 47 -45.264 24.923 -4.003 1.00 0.00 C ATOM 746 CE LYS A 47 -45.467 24.107 -5.281 1.00 0.00 C ATOM 747 NZ LYS A 47 -44.167 23.841 -5.938 1.00 0.00 N ATOM 0 H LYS A 47 -48.945 25.022 -1.518 1.00 0.00 H new ATOM 0 HA LYS A 47 -47.273 27.238 -2.060 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -47.550 24.721 -3.019 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -48.283 25.640 -4.319 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -46.289 26.564 -4.957 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -45.803 26.892 -3.306 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -44.231 25.268 -3.948 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -45.436 24.290 -3.132 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -45.961 23.165 -5.043 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -46.123 24.647 -5.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -44.323 23.286 -6.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -43.710 24.743 -6.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -43.554 23.307 -5.290 1.00 0.00 H new ATOM 761 N ASP A 48 -50.347 27.643 -2.773 1.00 0.00 N ATOM 762 CA ASP A 48 -51.334 28.577 -3.287 1.00 0.00 C ATOM 763 C ASP A 48 -52.104 29.193 -2.117 1.00 0.00 C ATOM 764 O ASP A 48 -53.269 29.563 -2.263 1.00 0.00 O ATOM 765 CB ASP A 48 -52.340 27.871 -4.197 1.00 0.00 C ATOM 766 CG ASP A 48 -52.967 28.756 -5.276 1.00 0.00 C ATOM 767 OD1 ASP A 48 -53.320 29.905 -4.935 1.00 0.00 O ATOM 768 OD2 ASP A 48 -53.080 28.262 -6.419 1.00 0.00 O ATOM 0 H ASP A 48 -50.727 26.903 -2.183 1.00 0.00 H new ATOM 0 HA ASP A 48 -50.809 29.343 -3.858 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -51.842 27.031 -4.681 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -53.137 27.456 -3.580 1.00 0.00 H new ATOM 773 N CYS A 49 -51.424 29.282 -0.984 1.00 0.00 N ATOM 774 CA CYS A 49 -52.031 29.846 0.210 1.00 0.00 C ATOM 775 C CYS A 49 -52.147 31.359 0.021 1.00 0.00 C ATOM 776 O CYS A 49 -51.338 31.966 -0.679 1.00 0.00 O ATOM 777 CB CYS A 49 -51.240 29.488 1.470 1.00 0.00 C ATOM 778 SG CYS A 49 -52.212 29.911 2.962 1.00 0.00 S ATOM 0 H CYS A 49 -50.459 28.973 -0.867 1.00 0.00 H new ATOM 0 HA CYS A 49 -53.025 29.421 0.351 1.00 0.00 H new ATOM 0 HB2 CYS A 49 -51.003 28.424 1.470 1.00 0.00 H new ATOM 0 HB3 CYS A 49 -50.292 30.026 1.479 1.00 0.00 H new ATOM 783 N THR A 50 -53.161 31.927 0.658 1.00 0.00 N ATOM 784 CA THR A 50 -53.394 33.359 0.569 1.00 0.00 C ATOM 785 C THR A 50 -52.610 34.096 1.658 1.00 0.00 C ATOM 786 O THR A 50 -52.270 35.267 1.497 1.00 0.00 O ATOM 787 CB THR A 50 -54.903 33.598 0.640 1.00 0.00 C ATOM 788 OG1 THR A 50 -55.291 33.002 1.874 1.00 0.00 O ATOM 789 CG2 THR A 50 -55.672 32.802 -0.417 1.00 0.00 C ATOM 0 H THR A 50 -53.831 31.421 1.238 1.00 0.00 H new ATOM 0 HA THR A 50 -53.031 33.760 -0.377 1.00 0.00 H new ATOM 0 HB THR A 50 -55.109 34.661 0.514 1.00 0.00 H new ATOM 0 HG1 THR A 50 -56.256 33.113 2.001 1.00 0.00 H new ATOM 0 HG21 THR A 50 -56.738 33.008 -0.323 1.00 0.00 H new ATOM 0 HG22 THR A 50 -55.332 33.094 -1.411 1.00 0.00 H new ATOM 0 HG23 THR A 50 -55.494 31.737 -0.271 1.00 0.00 H new ATOM 797 N GLU A 51 -52.347 33.379 2.740 1.00 0.00 N ATOM 798 CA GLU A 51 -51.610 33.950 3.855 1.00 0.00 C ATOM 799 C GLU A 51 -50.217 33.323 3.946 1.00 0.00 C ATOM 800 O GLU A 51 -49.848 32.772 4.982 1.00 0.00 O ATOM 801 CB GLU A 51 -52.377 33.773 5.167 1.00 0.00 C ATOM 802 CG GLU A 51 -52.293 35.037 6.025 1.00 0.00 C ATOM 803 CD GLU A 51 -51.969 34.691 7.480 1.00 0.00 C ATOM 804 OE1 GLU A 51 -50.800 34.326 7.730 1.00 0.00 O ATOM 805 OE2 GLU A 51 -52.898 34.800 8.310 1.00 0.00 O ATOM 0 H GLU A 51 -52.631 32.408 2.869 1.00 0.00 H new ATOM 0 HA GLU A 51 -51.496 35.020 3.680 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -53.421 33.542 4.954 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -51.970 32.926 5.719 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -51.527 35.701 5.626 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -53.239 35.577 5.978 1.00 0.00 H new ATOM 812 N ARG A 52 -49.482 33.430 2.849 1.00 0.00 N ATOM 813 CA ARG A 52 -48.138 32.882 2.792 1.00 0.00 C ATOM 814 C ARG A 52 -47.106 33.975 3.080 1.00 0.00 C ATOM 815 O ARG A 52 -46.493 34.513 2.159 1.00 0.00 O ATOM 816 CB ARG A 52 -47.852 32.268 1.421 1.00 0.00 C ATOM 817 CG ARG A 52 -47.040 30.977 1.557 1.00 0.00 C ATOM 818 CD ARG A 52 -46.550 30.491 0.191 1.00 0.00 C ATOM 819 NE ARG A 52 -45.265 31.144 -0.146 1.00 0.00 N ATOM 820 CZ ARG A 52 -44.431 30.712 -1.100 1.00 0.00 C ATOM 821 NH1 ARG A 52 -44.739 29.622 -1.818 1.00 0.00 N ATOM 822 NH2 ARG A 52 -43.287 31.367 -1.338 1.00 0.00 N ATOM 0 H ARG A 52 -49.792 33.888 1.992 1.00 0.00 H new ATOM 0 HA ARG A 52 -48.066 32.101 3.549 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -48.791 32.059 0.909 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -47.306 32.982 0.805 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -46.187 31.147 2.214 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -47.652 30.205 2.023 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -46.425 29.408 0.204 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -47.294 30.717 -0.573 1.00 0.00 H new ATOM 0 HE ARG A 52 -44.998 31.975 0.382 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -45.609 29.121 -1.637 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -44.103 29.294 -2.545 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -43.051 32.196 -0.792 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -42.652 31.037 -2.065 1.00 0.00 H new ATOM 836 N GLN A 53 -46.945 34.270 4.361 1.00 0.00 N ATOM 837 CA GLN A 53 -45.998 35.288 4.781 1.00 0.00 C ATOM 838 C GLN A 53 -46.008 36.460 3.797 1.00 0.00 C ATOM 839 O GLN A 53 -44.954 36.904 3.344 1.00 0.00 O ATOM 840 CB GLN A 53 -44.592 34.704 4.924 1.00 0.00 C ATOM 841 CG GLN A 53 -44.072 34.193 3.579 1.00 0.00 C ATOM 842 CD GLN A 53 -44.549 32.764 3.314 1.00 0.00 C ATOM 843 OE1 GLN A 53 -45.355 32.207 4.039 1.00 0.00 O ATOM 844 NE2 GLN A 53 -44.008 32.205 2.235 1.00 0.00 N ATOM 0 H GLN A 53 -47.455 33.822 5.122 1.00 0.00 H new ATOM 0 HA GLN A 53 -46.303 35.658 5.760 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -43.916 35.465 5.314 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -44.605 33.888 5.647 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -44.416 34.849 2.779 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -42.982 34.224 3.571 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -43.338 32.728 1.671 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -44.263 31.253 1.972 1.00 0.00 H new ATOM 853 N ALA A 54 -47.211 36.928 3.496 1.00 0.00 N ATOM 854 CA ALA A 54 -47.371 38.040 2.574 1.00 0.00 C ATOM 855 C ALA A 54 -48.093 39.186 3.285 1.00 0.00 C ATOM 856 O ALA A 54 -49.225 39.026 3.738 1.00 0.00 O ATOM 857 CB ALA A 54 -48.119 37.565 1.327 1.00 0.00 C ATOM 0 H ALA A 54 -48.083 36.558 3.874 1.00 0.00 H new ATOM 0 HA ALA A 54 -46.399 38.413 2.250 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -48.239 38.399 0.635 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -47.551 36.771 0.843 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -49.100 37.187 1.613 1.00 0.00 H new ATOM 863 N ASN A 55 -47.408 40.317 3.362 1.00 0.00 N ATOM 864 CA ASN A 55 -47.969 41.491 4.010 1.00 0.00 C ATOM 865 C ASN A 55 -48.632 42.381 2.958 1.00 0.00 C ATOM 866 O ASN A 55 -49.019 41.906 1.892 1.00 0.00 O ATOM 867 CB ASN A 55 -46.880 42.310 4.705 1.00 0.00 C ATOM 868 CG ASN A 55 -47.351 42.798 6.077 1.00 0.00 C ATOM 869 OD1 ASN A 55 -47.446 42.045 7.032 1.00 0.00 O ATOM 870 ND2 ASN A 55 -47.640 44.094 6.121 1.00 0.00 N ATOM 0 H ASN A 55 -46.469 40.446 2.986 1.00 0.00 H new ATOM 0 HA ASN A 55 -48.694 41.153 4.751 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -45.982 41.704 4.820 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -46.611 43.164 4.084 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -47.964 44.515 6.992 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -47.538 44.668 5.284 1.00 0.00 H new HETATM 877 N NH2 A 56 -48.742 43.658 3.294 1.00 0.00 N TER 878 NH2 A 56 HETATM 879 OP3 CG1 B 201 -42.627 -6.410 3.043 1.00 0.00 O HETATM 880 P CG1 B 201 -41.555 -6.296 1.861 1.00 0.00 P HETATM 881 OP1 CG1 B 201 -40.306 -6.988 2.251 1.00 0.00 O HETATM 882 OP2 CG1 B 201 -41.446 -4.886 1.422 1.00 0.00 O HETATM 883 O5' CG1 B 201 -42.234 -7.131 0.677 1.00 0.00 O HETATM 884 C5' CG1 B 201 -41.913 -8.509 0.502 1.00 0.00 C HETATM 885 C4' CG1 B 201 -43.001 -9.199 -0.291 1.00 0.00 C HETATM 886 O4' CG1 B 201 -43.986 -9.352 0.287 1.00 0.00 O HETATM 887 C3' CG1 B 201 -43.439 -8.448 -1.545 1.00 0.00 C HETATM 888 O3' CG1 B 201 -42.616 -8.836 -2.642 1.00 0.00 O HETATM 889 C2' CG1 B 201 -44.873 -8.845 -1.764 1.00 0.00 C HETATM 890 O2' CG1 B 201 -44.783 -9.760 -2.833 1.00 0.00 O HETATM 891 C1' CG1 B 201 -45.209 -9.456 -0.407 1.00 0.00 C HETATM 892 N9 CG1 B 201 -46.291 -8.746 0.309 1.00 0.00 N HETATM 893 C8 CG1 B 201 -46.173 -7.657 1.098 1.00 0.00 C HETATM 894 N7 CG1 B 201 -47.339 -7.258 1.596 1.00 0.00 N HETATM 895 C5 CG1 B 201 -48.240 -8.153 1.084 1.00 0.00 C HETATM 896 C6 CG1 B 201 -49.638 -8.266 1.240 1.00 0.00 C HETATM 897 O6 CG1 B 201 -50.343 -7.519 1.917 1.00 0.00 O HETATM 898 N1 CG1 B 201 -50.261 -9.286 0.588 1.00 0.00 N HETATM 899 C2 CG1 B 201 -49.511 -10.123 -0.165 1.00 0.00 C HETATM 900 N2 CG1 B 201 -50.262 -11.062 -0.735 1.00 0.00 N HETATM 901 N3 CG1 B 201 -48.183 -10.110 -0.383 1.00 0.00 N HETATM 902 C4 CG1 B 201 -47.621 -9.071 0.295 1.00 0.00 C HETATM 906 C CG1 B 201 -42.246 -6.103 4.383 1.00 0.00 C HETATM 0 HO2' CG1 B 201 -43.906 -9.677 -3.262 1.00 0.00 H new HETATM 0 HN2A CG1 B 201 -49.831 -11.766 -1.334 1.00 0.00 H new HETATM 0 H5'A CG1 B 201 -40.958 -8.605 -0.015 1.00 0.00 H new HETATM 0 HN2 CG1 B 201 -51.269 -11.078 -0.573 1.00 0.00 H new HETATM 0 HN1 CG1 B 201 -51.270 -9.416 0.665 1.00 0.00 H new HETATM 0 HB CG1 B 201 -41.440 -6.768 4.694 1.00 0.00 H new HETATM 0 HA CG1 B 201 -41.904 -5.069 4.436 1.00 0.00 H new HETATM 0 H8 CG1 B 201 -45.225 -7.159 1.304 1.00 0.00 H new HETATM 0 H5' CG1 B 201 -41.799 -8.990 1.473 1.00 0.00 H new HETATM 0 H4' CG1 B 201 -42.511 -10.144 -0.527 1.00 0.00 H new HETATM 0 H3' CG1 B 201 -43.345 -7.366 -1.447 1.00 0.00 H new HETATM 0 H2' CG1 B 201 -45.627 -8.102 -2.026 1.00 0.00 H new HETATM 0 H1' CG1 B 201 -45.589 -10.474 -0.500 1.00 0.00 H new HETATM 0 H CG1 B 201 -43.102 -6.237 5.044 1.00 0.00 H new ATOM 915 P G B 202 -42.218 -7.764 -3.761 1.00 0.00 P ATOM 916 OP1 G B 202 -41.461 -8.432 -4.844 1.00 0.00 O ATOM 917 OP2 G B 202 -41.597 -6.583 -3.122 1.00 0.00 O ATOM 918 O5' G B 202 -43.636 -7.318 -4.353 1.00 0.00 O ATOM 919 C5' G B 202 -44.166 -7.972 -5.504 1.00 0.00 C ATOM 920 C4' G B 202 -45.678 -7.943 -5.468 1.00 0.00 C ATOM 921 O4' G B 202 -46.238 -7.942 -4.362 1.00 0.00 O ATOM 922 C3' G B 202 -46.297 -6.677 -6.053 1.00 0.00 C ATOM 923 O3' G B 202 -46.242 -6.737 -7.478 1.00 0.00 O ATOM 924 C2' G B 202 -47.715 -6.664 -5.556 1.00 0.00 C ATOM 925 O2' G B 202 -48.435 -7.172 -6.657 1.00 0.00 O ATOM 926 C1' G B 202 -47.605 -7.599 -4.356 1.00 0.00 C ATOM 927 N9 G B 202 -47.992 -6.965 -3.077 1.00 0.00 N ATOM 928 C8 G B 202 -47.208 -6.237 -2.254 1.00 0.00 C ATOM 929 N7 G B 202 -47.857 -5.804 -1.178 1.00 0.00 N ATOM 930 C5 G B 202 -49.126 -6.293 -1.341 1.00 0.00 C ATOM 931 C6 G B 202 -50.282 -6.179 -0.540 1.00 0.00 C ATOM 932 O6 G B 202 -50.351 -5.571 0.527 1.00 0.00 O ATOM 933 N1 G B 202 -51.414 -6.790 -0.983 1.00 0.00 N ATOM 934 C2 G B 202 -51.366 -7.465 -2.154 1.00 0.00 C ATOM 935 N2 G B 202 -52.547 -8.004 -2.449 1.00 0.00 N ATOM 936 N3 G B 202 -50.328 -7.638 -2.993 1.00 0.00 N ATOM 937 C4 G B 202 -49.231 -7.004 -2.494 1.00 0.00 C ATOM 0 H5' G B 202 -43.815 -9.003 -5.540 1.00 0.00 H new ATOM 0 H5'' G B 202 -43.806 -7.481 -6.409 1.00 0.00 H new ATOM 0 H4' G B 202 -45.840 -8.868 -6.021 1.00 0.00 H new ATOM 0 H3' G B 202 -45.772 -5.770 -5.754 1.00 0.00 H new ATOM 0 H2' G B 202 -48.193 -5.734 -5.248 1.00 0.00 H new ATOM 0 HO2' G B 202 -49.180 -6.570 -6.867 1.00 0.00 H new ATOM 0 H1' G B 202 -48.283 -8.449 -4.435 1.00 0.00 H new ATOM 0 H8 G B 202 -46.166 -6.029 -2.449 1.00 0.00 H new ATOM 0 H1 G B 202 -52.279 -6.740 -0.444 1.00 0.00 H new ATOM 0 H21 G B 202 -52.661 -8.544 -3.307 1.00 0.00 H new ATOM 0 H22 G B 202 -53.338 -7.877 -1.817 1.00 0.00 H new ATOM 949 P C B 203 -45.771 -5.456 -8.314 1.00 0.00 P ATOM 950 OP1 C B 203 -45.444 -5.860 -9.700 1.00 0.00 O ATOM 951 OP2 C B 203 -44.735 -4.720 -7.556 1.00 0.00 O ATOM 952 O5' C B 203 -47.089 -4.551 -8.359 1.00 0.00 O ATOM 953 C5' C B 203 -48.178 -4.918 -9.203 1.00 0.00 C ATOM 954 C4' C B 203 -49.484 -4.778 -8.456 1.00 0.00 C ATOM 955 O4' C B 203 -49.244 -4.792 -7.135 1.00 0.00 O ATOM 956 C3' C B 203 -50.071 -3.369 -8.472 1.00 0.00 C ATOM 957 O3' C B 203 -50.788 -3.168 -9.687 1.00 0.00 O ATOM 958 C2' C B 203 -50.981 -3.305 -7.276 1.00 0.00 C ATOM 959 O2' C B 203 -52.248 -3.565 -7.837 1.00 0.00 O ATOM 960 C1' C B 203 -50.401 -4.425 -6.418 1.00 0.00 C ATOM 961 N1 C B 203 -50.065 -3.999 -5.042 1.00 0.00 N ATOM 962 C2 C B 203 -51.063 -4.088 -4.074 1.00 0.00 C ATOM 963 O2 C B 203 -52.175 -4.515 -4.407 1.00 0.00 O ATOM 964 N3 C B 203 -50.782 -3.706 -2.815 1.00 0.00 N ATOM 965 C4 C B 203 -49.591 -3.254 -2.477 1.00 0.00 C ATOM 966 N4 C B 203 -49.333 -2.883 -1.230 1.00 0.00 N ATOM 967 C5 C B 203 -48.539 -3.153 -3.461 1.00 0.00 C ATOM 968 C6 C B 203 -48.834 -3.537 -4.712 1.00 0.00 C ATOM 0 H5' C B 203 -48.054 -5.946 -9.544 1.00 0.00 H new ATOM 0 H5'' C B 203 -48.189 -4.286 -10.091 1.00 0.00 H new ATOM 0 H4' C B 203 -50.105 -5.551 -8.908 1.00 0.00 H new ATOM 0 H3' C B 203 -49.309 -2.591 -8.423 1.00 0.00 H new ATOM 0 H2' C B 203 -51.063 -2.396 -6.680 1.00 0.00 H new ATOM 0 HO2' C B 203 -52.139 -4.064 -8.673 1.00 0.00 H new ATOM 0 H1' C B 203 -51.113 -5.237 -6.268 1.00 0.00 H new ATOM 0 H41 C B 203 -48.407 -2.535 -0.983 1.00 0.00 H new ATOM 0 H42 C B 203 -50.061 -2.946 -0.518 1.00 0.00 H new ATOM 0 H5 C B 203 -47.558 -2.784 -3.201 1.00 0.00 H new ATOM 0 H6 C B 203 -48.072 -3.477 -5.475 1.00 0.00 H new ATOM 980 P G B 204 -50.479 -1.889 -10.596 1.00 0.00 P ATOM 981 OP1 G B 204 -50.485 -2.279 -12.024 1.00 0.00 O ATOM 982 OP2 G B 204 -49.278 -1.192 -10.084 1.00 0.00 O ATOM 983 O5' G B 204 -51.746 -0.947 -10.335 1.00 0.00 O ATOM 984 C5' G B 204 -53.013 -1.525 -10.031 1.00 0.00 C ATOM 985 C4' G B 204 -53.709 -0.717 -8.959 1.00 0.00 C ATOM 986 O4' G B 204 -53.652 -0.959 -7.662 1.00 0.00 O ATOM 987 C3' G B 204 -53.321 0.758 -8.930 1.00 0.00 C ATOM 988 O3' G B 204 -53.819 1.403 -10.100 1.00 0.00 O ATOM 989 C2' G B 204 -53.956 1.312 -7.684 1.00 0.00 C ATOM 990 O2' G B 204 -55.255 1.645 -8.118 1.00 0.00 O ATOM 991 C1' G B 204 -53.864 0.102 -6.758 1.00 0.00 C ATOM 992 N9 G B 204 -52.764 0.194 -5.775 1.00 0.00 N ATOM 993 C8 G B 204 -51.447 -0.001 -5.997 1.00 0.00 C ATOM 994 N7 G B 204 -50.713 0.157 -4.901 1.00 0.00 N ATOM 995 C5 G B 204 -51.630 0.471 -3.933 1.00 0.00 C ATOM 996 C6 G B 204 -51.480 0.754 -2.560 1.00 0.00 C ATOM 997 O6 G B 204 -50.412 0.769 -1.948 1.00 0.00 O ATOM 998 N1 G B 204 -52.607 1.034 -1.851 1.00 0.00 N ATOM 999 C2 G B 204 -53.794 1.026 -2.498 1.00 0.00 C ATOM 1000 N2 G B 204 -54.797 1.318 -1.672 1.00 0.00 N ATOM 1001 N3 G B 204 -54.053 0.771 -3.793 1.00 0.00 N ATOM 1002 C4 G B 204 -52.889 0.499 -4.445 1.00 0.00 C ATOM 0 H5' G B 204 -52.881 -2.553 -9.694 1.00 0.00 H new ATOM 0 H5'' G B 204 -53.630 -1.560 -10.929 1.00 0.00 H new ATOM 0 H4' G B 204 -54.681 -1.037 -9.334 1.00 0.00 H new ATOM 0 H3' G B 204 -52.242 0.912 -8.918 1.00 0.00 H new ATOM 0 H2' G B 204 -53.541 2.186 -7.183 1.00 0.00 H new ATOM 0 HO2' G B 204 -55.335 1.467 -9.078 1.00 0.00 H new ATOM 0 H1' G B 204 -54.753 -0.007 -6.137 1.00 0.00 H new ATOM 0 H8 G B 204 -51.034 -0.258 -6.962 1.00 0.00 H new ATOM 0 H1 G B 204 -52.557 1.245 -0.854 1.00 0.00 H new ATOM 0 H21 G B 204 -55.754 1.349 -2.023 1.00 0.00 H new ATOM 0 H22 G B 204 -54.608 1.511 -0.688 1.00 0.00 H new ATOM 1014 P A B 205 -53.940 2.997 -10.147 1.00 0.00 P ATOM 1015 OP1 A B 205 -53.586 3.486 -11.499 1.00 0.00 O ATOM 1016 OP2 A B 205 -53.215 3.586 -8.998 1.00 0.00 O ATOM 1017 O5' A B 205 -55.504 3.248 -9.924 1.00 0.00 O ATOM 1018 C5' A B 205 -55.965 4.516 -9.462 1.00 0.00 C ATOM 1019 C4' A B 205 -55.405 4.802 -8.088 1.00 0.00 C ATOM 1020 O4' A B 205 -54.672 4.063 -7.147 1.00 0.00 O ATOM 1021 C3' A B 205 -54.418 5.966 -8.039 1.00 0.00 C ATOM 1022 O3' A B 205 -54.989 7.099 -8.690 1.00 0.00 O ATOM 1023 C2' A B 205 -54.186 6.229 -6.576 1.00 0.00 C ATOM 1024 O2' A B 205 -55.239 7.107 -6.249 1.00 0.00 O ATOM 1025 C1' A B 205 -54.311 4.817 -6.012 1.00 0.00 C ATOM 1026 N9 A B 205 -53.059 4.310 -5.410 1.00 0.00 N ATOM 1027 C8 A B 205 -52.009 3.752 -6.050 1.00 0.00 C ATOM 1028 N7 A B 205 -51.032 3.399 -5.221 1.00 0.00 N ATOM 1029 C5 A B 205 -51.503 3.759 -3.987 1.00 0.00 C ATOM 1030 C6 A B 205 -50.933 3.646 -2.701 1.00 0.00 C ATOM 1031 N6 A B 205 -49.711 3.113 -2.444 1.00 0.00 N ATOM 1032 N1 A B 205 -51.665 4.105 -1.649 1.00 0.00 N ATOM 1033 C2 A B 205 -52.884 4.638 -1.895 1.00 0.00 C ATOM 1034 N3 A B 205 -53.520 4.795 -3.071 1.00 0.00 N ATOM 1035 C4 A B 205 -52.738 4.316 -4.078 1.00 0.00 C ATOM 0 H5' A B 205 -57.054 4.526 -9.429 1.00 0.00 H new ATOM 0 H5'' A B 205 -55.660 5.298 -10.158 1.00 0.00 H new ATOM 0 H4' A B 205 -56.459 4.741 -7.815 1.00 0.00 H new ATOM 0 H3' A B 205 -53.479 5.748 -8.548 1.00 0.00 H new ATOM 0 H2' A B 205 -53.257 6.680 -6.226 1.00 0.00 H new ATOM 0 HO2' A B 205 -55.884 7.133 -6.986 1.00 0.00 H new ATOM 0 H1' A B 205 -55.028 4.766 -5.193 1.00 0.00 H new ATOM 0 H8 A B 205 -51.968 3.608 -7.120 1.00 0.00 H new ATOM 0 H61 A B 205 -49.367 3.066 -1.485 1.00 0.00 H new ATOM 0 H62 A B 205 -49.137 2.760 -3.210 1.00 0.00 H new ATOM 0 H2 A B 205 -53.422 4.986 -1.026 1.00 0.00 H new ATOM 1047 P C B 206 -54.093 7.996 -9.666 1.00 0.00 P ATOM 1048 OP1 C B 206 -54.920 8.483 -10.792 1.00 0.00 O ATOM 1049 OP2 C B 206 -52.843 7.276 -9.997 1.00 0.00 O ATOM 1050 O5' C B 206 -53.714 9.253 -8.752 1.00 0.00 O ATOM 1051 C5' C B 206 -54.558 9.624 -7.665 1.00 0.00 C ATOM 1052 C4' C B 206 -53.755 9.702 -6.386 1.00 0.00 C ATOM 1053 O4' C B 206 -53.247 8.742 -5.787 1.00 0.00 O ATOM 1054 C3' C B 206 -52.662 10.767 -6.390 1.00 0.00 C ATOM 1055 O3' C B 206 -53.246 12.046 -6.146 1.00 0.00 O ATOM 1056 C2' C B 206 -51.717 10.373 -5.291 1.00 0.00 C ATOM 1057 O2' C B 206 -52.206 11.099 -4.185 1.00 0.00 O ATOM 1058 C1' C B 206 -51.953 8.865 -5.241 1.00 0.00 C ATOM 1059 N1 C B 206 -50.967 8.089 -6.021 1.00 0.00 N ATOM 1060 C2 C B 206 -49.948 7.446 -5.319 1.00 0.00 C ATOM 1061 O2 C B 206 -49.916 7.556 -4.088 1.00 0.00 O ATOM 1062 N3 C B 206 -49.038 6.733 -6.006 1.00 0.00 N ATOM 1063 C4 C B 206 -49.086 6.626 -7.318 1.00 0.00 C ATOM 1064 N4 C B 206 -48.179 5.918 -7.979 1.00 0.00 N ATOM 1065 C5 C B 206 -50.133 7.282 -8.069 1.00 0.00 C ATOM 1066 C6 C B 206 -51.031 7.990 -7.371 1.00 0.00 C ATOM 0 H5' C B 206 -55.362 8.897 -7.555 1.00 0.00 H new ATOM 0 H5'' C B 206 -55.025 10.587 -7.870 1.00 0.00 H new ATOM 0 H4' C B 206 -54.669 9.898 -5.825 1.00 0.00 H new ATOM 0 H3' C B 206 -52.139 10.834 -7.344 1.00 0.00 H new ATOM 0 H2' C B 206 -50.648 10.572 -5.372 1.00 0.00 H new ATOM 0 HO2' C B 206 -51.796 11.989 -4.171 1.00 0.00 H new ATOM 0 H1' C B 206 -51.851 8.466 -4.232 1.00 0.00 H new ATOM 0 H41 C B 206 -48.230 5.845 -8.995 1.00 0.00 H new ATOM 0 H42 C B 206 -47.431 5.447 -7.471 1.00 0.00 H new ATOM 0 H5 C B 206 -50.189 7.205 -9.145 1.00 0.00 H new ATOM 0 H6 C B 206 -51.827 8.495 -7.898 1.00 0.00 H new ATOM 1078 P U B 207 -53.120 13.206 -7.240 1.00 0.00 P ATOM 1079 OP1 U B 207 -54.360 14.012 -7.259 1.00 0.00 O ATOM 1080 OP2 U B 207 -52.660 12.631 -8.524 1.00 0.00 O ATOM 1081 O5' U B 207 -51.945 14.122 -6.660 1.00 0.00 O ATOM 1082 C5' U B 207 -52.085 14.738 -5.381 1.00 0.00 C ATOM 1083 C4' U B 207 -50.919 14.363 -4.493 1.00 0.00 C ATOM 1084 O4' U B 207 -50.471 13.088 -4.127 1.00 0.00 O ATOM 1085 C3' U B 207 -49.576 14.934 -4.942 1.00 0.00 C ATOM 1086 O3' U B 207 -49.613 16.356 -4.853 1.00 0.00 O ATOM 1087 C2' U B 207 -48.562 14.346 -4.001 1.00 0.00 C ATOM 1088 O2' U B 207 -48.692 15.162 -2.857 1.00 0.00 O ATOM 1089 C1' U B 207 -49.096 12.925 -3.856 1.00 0.00 C ATOM 1090 N1 U B 207 -48.477 11.964 -4.792 1.00 0.00 N ATOM 1091 C2 U B 207 -47.546 11.122 -4.264 1.00 0.00 C ATOM 1092 O2 U B 207 -47.215 11.130 -3.090 1.00 0.00 O ATOM 1093 N3 U B 207 -46.968 10.227 -5.135 1.00 0.00 N ATOM 1094 C4 U B 207 -47.283 10.152 -6.468 1.00 0.00 C ATOM 1095 O4 U B 207 -46.702 9.310 -7.152 1.00 0.00 O ATOM 1096 C5 U B 207 -48.261 11.053 -6.967 1.00 0.00 C ATOM 1097 C6 U B 207 -48.809 11.913 -6.106 1.00 0.00 C ATOM 0 H5' U B 207 -53.020 14.424 -4.918 1.00 0.00 H new ATOM 0 H5'' U B 207 -52.133 15.821 -5.494 1.00 0.00 H new ATOM 0 H4' U B 207 -51.498 14.753 -3.656 1.00 0.00 H new ATOM 0 H3' U B 207 -49.333 14.689 -5.976 1.00 0.00 H new ATOM 0 H2' U B 207 -47.505 14.310 -4.266 1.00 0.00 H new ATOM 0 HO2' U B 207 -49.277 15.921 -3.061 1.00 0.00 H new ATOM 0 H1' U B 207 -48.877 12.502 -2.875 1.00 0.00 H new ATOM 0 H3 U B 207 -46.266 9.584 -4.769 1.00 0.00 H new ATOM 0 H5 U B 207 -48.551 11.043 -8.007 1.00 0.00 H new ATOM 0 H6 U B 207 -49.554 12.603 -6.474 1.00 0.00 H new ATOM 1108 P G B 208 -48.768 17.244 -5.882 1.00 0.00 P ATOM 1109 OP1 G B 208 -48.956 18.679 -5.574 1.00 0.00 O ATOM 1110 OP2 G B 208 -49.047 16.801 -7.267 1.00 0.00 O ATOM 1111 O5' G B 208 -47.255 16.857 -5.535 1.00 0.00 O ATOM 1112 C5' G B 208 -46.730 17.127 -4.237 1.00 0.00 C ATOM 1113 C4' G B 208 -45.475 16.318 -4.005 1.00 0.00 C ATOM 1114 O4' G B 208 -45.466 15.250 -4.242 1.00 0.00 O ATOM 1115 C3' G B 208 -44.215 16.916 -4.625 1.00 0.00 C ATOM 1116 O3' G B 208 -43.562 17.744 -3.666 1.00 0.00 O ATOM 1117 C2' G B 208 -43.363 15.738 -5.008 1.00 0.00 C ATOM 1118 O2' G B 208 -42.310 15.800 -4.072 1.00 0.00 O ATOM 1119 C1' G B 208 -44.353 14.594 -4.806 1.00 0.00 C ATOM 1120 N9 G B 208 -44.719 13.902 -6.060 1.00 0.00 N ATOM 1121 C8 G B 208 -45.642 14.284 -6.967 1.00 0.00 C ATOM 1122 N7 G B 208 -45.734 13.442 -7.990 1.00 0.00 N ATOM 1123 C5 G B 208 -44.809 12.473 -7.704 1.00 0.00 C ATOM 1124 C6 G B 208 -44.430 11.308 -8.401 1.00 0.00 C ATOM 1125 O6 G B 208 -44.903 10.932 -9.473 1.00 0.00 O ATOM 1126 N1 G B 208 -43.459 10.533 -7.845 1.00 0.00 N ATOM 1127 C2 G B 208 -42.920 10.921 -6.667 1.00 0.00 C ATOM 1128 N2 G B 208 -41.990 10.063 -6.255 1.00 0.00 N ATOM 1129 N3 G B 208 -43.203 12.004 -5.920 1.00 0.00 N ATOM 1130 C4 G B 208 -44.178 12.734 -6.529 1.00 0.00 C ATOM 0 H5' G B 208 -47.474 16.884 -3.478 1.00 0.00 H new ATOM 0 H5'' G B 208 -46.510 18.190 -4.139 1.00 0.00 H new ATOM 0 H4' G B 208 -45.480 16.387 -2.917 1.00 0.00 H new ATOM 0 H3' G B 208 -44.425 17.542 -5.493 1.00 0.00 H new ATOM 0 H2' G B 208 -42.920 15.664 -6.001 1.00 0.00 H new ATOM 0 HO2' G B 208 -42.602 16.305 -3.285 1.00 0.00 H new ATOM 0 H1' G B 208 -43.939 13.798 -4.187 1.00 0.00 H new ATOM 0 H8 G B 208 -46.241 15.178 -6.871 1.00 0.00 H new ATOM 0 H1 G B 208 -43.145 9.679 -8.306 1.00 0.00 H new ATOM 0 H21 G B 208 -41.496 10.228 -5.378 1.00 0.00 H new ATOM 0 H22 G B 208 -41.771 9.240 -6.816 1.00 0.00 H new ATOM 1142 P G B 209 -43.338 19.299 -3.971 1.00 0.00 P ATOM 1143 OP1 G B 209 -43.630 19.573 -5.396 1.00 0.00 O ATOM 1144 OP2 G B 209 -42.021 19.725 -3.448 1.00 0.00 O ATOM 1145 O5' G B 209 -44.472 20.005 -3.091 1.00 0.00 O ATOM 1146 C5' G B 209 -44.200 20.372 -1.739 1.00 0.00 C ATOM 1147 C4' G B 209 -45.041 19.541 -0.796 1.00 0.00 C ATOM 1148 O4' G B 209 -45.836 19.460 0.357 1.00 0.00 O ATOM 1149 C3' G B 209 -45.610 18.267 -1.414 1.00 0.00 C ATOM 1150 O3' G B 209 -45.054 17.132 -0.755 1.00 0.00 O ATOM 1151 C2' G B 209 -47.096 18.354 -1.205 1.00 0.00 C ATOM 1152 O2' G B 209 -47.498 17.004 -1.276 1.00 0.00 O ATOM 1153 C1' G B 209 -47.152 18.983 0.184 1.00 0.00 C ATOM 1154 N9 G B 209 -48.137 20.079 0.296 1.00 0.00 N ATOM 1155 C8 G B 209 -47.929 21.393 0.071 1.00 0.00 C ATOM 1156 N7 G B 209 -49.023 22.125 0.258 1.00 0.00 N ATOM 1157 C5 G B 209 -49.972 21.209 0.624 1.00 0.00 C ATOM 1158 C6 G B 209 -51.336 21.358 0.956 1.00 0.00 C ATOM 1159 O6 G B 209 -51.952 22.422 0.977 1.00 0.00 O ATOM 1160 N1 G B 209 -52.028 20.232 1.281 1.00 0.00 N ATOM 1161 C2 G B 209 -51.375 19.047 1.268 1.00 0.00 C ATOM 1162 N2 G B 209 -52.184 18.046 1.606 1.00 0.00 N ATOM 1163 N3 G B 209 -50.088 18.790 0.967 1.00 0.00 N ATOM 1164 C4 G B 209 -49.454 19.953 0.653 1.00 0.00 C ATOM 0 H5' G B 209 -44.413 21.431 -1.592 1.00 0.00 H new ATOM 0 H5'' G B 209 -43.142 20.226 -1.520 1.00 0.00 H new ATOM 0 H4' G B 209 -44.287 20.215 -0.390 1.00 0.00 H new ATOM 0 H3' G B 209 -45.373 18.166 -2.473 1.00 0.00 H new ATOM 0 H2' G B 209 -47.727 18.924 -1.887 1.00 0.00 H new ATOM 0 HO2' G B 209 -47.413 16.590 -0.392 1.00 0.00 H new ATOM 0 H1' G B 209 -47.475 18.271 0.943 1.00 0.00 H new ATOM 0 H8 G B 209 -46.977 21.806 -0.229 1.00 0.00 H new ATOM 0 H1 G B 209 -53.016 20.280 1.529 1.00 0.00 H new ATOM 0 H21 G B 209 -51.827 17.091 1.639 1.00 0.00 H new ATOM 0 H22 G B 209 -53.161 18.234 1.832 1.00 0.00 H new ATOM 1176 P U B 210 -43.475 16.880 -0.790 1.00 0.00 P ATOM 1177 OP1 U B 210 -42.764 18.176 -0.841 1.00 0.00 O ATOM 1178 OP2 U B 210 -43.153 15.883 -1.835 1.00 0.00 O ATOM 1179 O5' U B 210 -43.185 16.212 0.635 1.00 0.00 O ATOM 1180 C5' U B 210 -42.092 15.309 0.790 1.00 0.00 C ATOM 1181 C4' U B 210 -42.576 13.882 0.660 1.00 0.00 C ATOM 1182 O4' U B 210 -43.673 13.370 1.115 1.00 0.00 O ATOM 1183 C3' U B 210 -42.562 13.339 -0.766 1.00 0.00 C ATOM 1184 O3' U B 210 -41.870 12.093 -0.793 1.00 0.00 O ATOM 1185 C2' U B 210 -44.008 13.177 -1.143 1.00 0.00 C ATOM 1186 O2' U B 210 -43.969 12.116 -2.071 1.00 0.00 O ATOM 1187 C1' U B 210 -44.618 12.839 0.214 1.00 0.00 C ATOM 1188 N1 U B 210 -45.953 13.436 0.425 1.00 0.00 N ATOM 1189 C2 U B 210 -47.004 12.782 -0.140 1.00 0.00 C ATOM 1190 O2 U B 210 -46.891 11.755 -0.792 1.00 0.00 O ATOM 1191 N3 U B 210 -48.249 13.337 0.056 1.00 0.00 N ATOM 1192 C4 U B 210 -48.463 14.486 0.775 1.00 0.00 C ATOM 1193 O4 U B 210 -49.619 14.891 0.885 1.00 0.00 O ATOM 1194 C5 U B 210 -47.332 15.129 1.343 1.00 0.00 C ATOM 1195 C6 U B 210 -46.135 14.574 1.140 1.00 0.00 C ATOM 0 H5' U B 210 -41.624 15.455 1.763 1.00 0.00 H new ATOM 0 H5'' U B 210 -41.331 15.514 0.037 1.00 0.00 H new ATOM 0 H4' U B 210 -41.815 13.601 1.388 1.00 0.00 H new ATOM 0 H3' U B 210 -42.050 13.999 -1.467 1.00 0.00 H new ATOM 0 H2' U B 210 -44.565 13.995 -1.599 1.00 0.00 H new ATOM 0 HO2' U B 210 -43.085 11.694 -2.048 1.00 0.00 H new ATOM 0 H1' U B 210 -44.796 11.770 0.329 1.00 0.00 H new ATOM 0 H3 U B 210 -49.056 12.868 -0.356 1.00 0.00 H new ATOM 0 H5 U B 210 -47.436 16.036 1.920 1.00 0.00 H new ATOM 0 H6 U B 210 -45.268 15.056 1.567 1.00 0.00 H new ATOM 1206 P G B 211 -40.371 12.021 -1.349 1.00 0.00 P ATOM 1207 OP1 G B 211 -39.568 13.113 -0.758 1.00 0.00 O ATOM 1208 OP2 G B 211 -40.392 11.910 -2.825 1.00 0.00 O ATOM 1209 O5' G B 211 -39.834 10.635 -0.756 1.00 0.00 O ATOM 1210 C5' G B 211 -40.336 10.150 0.488 1.00 0.00 C ATOM 1211 C4' G B 211 -39.217 10.065 1.502 1.00 0.00 C ATOM 1212 O4' G B 211 -39.405 10.716 2.334 1.00 0.00 O ATOM 1213 C3' G B 211 -38.973 8.664 2.056 1.00 0.00 C ATOM 1214 O3' G B 211 -37.633 8.268 1.771 1.00 0.00 O ATOM 1215 C2' G B 211 -39.213 8.776 3.535 1.00 0.00 C ATOM 1216 O2' G B 211 -37.965 8.409 4.081 1.00 0.00 O ATOM 1217 C1' G B 211 -39.573 10.253 3.655 1.00 0.00 C ATOM 1218 N9 G B 211 -40.952 10.489 4.132 1.00 0.00 N ATOM 1219 C8 G B 211 -42.097 10.330 3.437 1.00 0.00 C ATOM 1220 N7 G B 211 -43.176 10.626 4.154 1.00 0.00 N ATOM 1221 C5 G B 211 -42.672 10.990 5.373 1.00 0.00 C ATOM 1222 C6 G B 211 -43.308 11.411 6.560 1.00 0.00 C ATOM 1223 O6 G B 211 -44.522 11.532 6.714 1.00 0.00 O ATOM 1224 N1 G B 211 -42.514 11.709 7.625 1.00 0.00 N ATOM 1225 C2 G B 211 -41.175 11.585 7.486 1.00 0.00 C ATOM 1226 N2 G B 211 -40.540 11.911 8.608 1.00 0.00 N ATOM 1227 N3 G B 211 -40.466 11.196 6.409 1.00 0.00 N ATOM 1228 C4 G B 211 -41.315 10.914 5.383 1.00 0.00 C ATOM 0 H5' G B 211 -40.787 9.167 0.349 1.00 0.00 H new ATOM 0 H5'' G B 211 -41.121 10.811 0.855 1.00 0.00 H new ATOM 0 H4' G B 211 -38.326 10.366 0.950 1.00 0.00 H new ATOM 0 H3' G B 211 -39.625 7.912 1.612 1.00 0.00 H new ATOM 0 H2' G B 211 -39.979 8.176 4.026 1.00 0.00 H new ATOM 0 HO2' G B 211 -37.246 8.734 3.500 1.00 0.00 H new ATOM 0 H1' G B 211 -38.957 10.765 4.394 1.00 0.00 H new ATOM 0 H8 G B 211 -42.133 9.998 2.410 1.00 0.00 H new ATOM 0 H1 G B 211 -42.920 12.019 8.508 1.00 0.00 H new ATOM 0 H21 G B 211 -39.522 11.864 8.650 1.00 0.00 H new ATOM 0 H22 G B 211 -41.071 12.208 9.427 1.00 0.00 H new ATOM 1240 P A B 212 -37.232 6.720 1.807 1.00 0.00 P ATOM 1241 OP1 A B 212 -38.450 5.886 1.703 1.00 0.00 O ATOM 1242 OP2 A B 212 -36.326 6.466 2.950 1.00 0.00 O ATOM 1243 O5' A B 212 -36.390 6.535 0.459 1.00 0.00 O ATOM 1244 C5' A B 212 -36.693 7.329 -0.686 1.00 0.00 C ATOM 1245 C4' A B 212 -38.151 7.173 -1.055 1.00 0.00 C ATOM 1246 O4' A B 212 -39.137 7.819 -1.821 1.00 0.00 O ATOM 1247 C3' A B 212 -38.518 5.797 -1.603 1.00 0.00 C ATOM 1248 O3' A B 212 -37.903 4.790 -0.803 1.00 0.00 O ATOM 1249 C2' A B 212 -40.018 5.725 -1.523 1.00 0.00 C ATOM 1250 O2' A B 212 -40.239 5.327 -0.189 1.00 0.00 O ATOM 1251 C1' A B 212 -40.389 7.170 -1.846 1.00 0.00 C ATOM 1252 N9 A B 212 -41.047 7.330 -3.159 1.00 0.00 N ATOM 1253 C8 A B 212 -40.564 6.974 -4.367 1.00 0.00 C ATOM 1254 N7 A B 212 -41.404 7.254 -5.358 1.00 0.00 N ATOM 1255 C5 A B 212 -42.479 7.820 -4.729 1.00 0.00 C ATOM 1256 C6 A B 212 -43.696 8.327 -5.230 1.00 0.00 C ATOM 1257 N6 A B 212 -44.041 8.341 -6.544 1.00 0.00 N ATOM 1258 N1 A B 212 -44.582 8.835 -4.330 1.00 0.00 N ATOM 1259 C2 A B 212 -44.248 8.825 -3.020 1.00 0.00 C ATOM 1260 N3 A B 212 -43.124 8.370 -2.434 1.00 0.00 N ATOM 1261 C4 A B 212 -42.283 7.877 -3.385 1.00 0.00 C ATOM 0 H5' A B 212 -36.064 7.028 -1.524 1.00 0.00 H new ATOM 0 H5'' A B 212 -36.472 8.376 -0.481 1.00 0.00 H new ATOM 0 H4' A B 212 -38.184 7.671 -0.086 1.00 0.00 H new ATOM 0 H3' A B 212 -38.176 5.642 -2.626 1.00 0.00 H new ATOM 0 H2' A B 212 -40.583 5.052 -2.167 1.00 0.00 H new ATOM 0 HO2' A B 212 -39.386 5.314 0.294 1.00 0.00 H new ATOM 0 H1' A B 212 -41.119 7.573 -1.144 1.00 0.00 H new ATOM 0 H8 A B 212 -39.599 6.511 -4.513 1.00 0.00 H new ATOM 0 H61 A B 212 -44.941 8.725 -6.831 1.00 0.00 H new ATOM 0 H62 A B 212 -43.400 7.967 -7.244 1.00 0.00 H new ATOM 0 H2 A B 212 -44.986 9.240 -2.349 1.00 0.00 H new ATOM 1273 P G B 213 -37.711 3.312 -1.387 1.00 0.00 P ATOM 1274 OP1 G B 213 -37.028 2.465 -0.383 1.00 0.00 O ATOM 1275 OP2 G B 213 -37.115 3.384 -2.740 1.00 0.00 O ATOM 1276 O5' G B 213 -39.215 2.786 -1.537 1.00 0.00 O ATOM 1277 C5' G B 213 -39.968 2.442 -0.376 1.00 0.00 C ATOM 1278 C4' G B 213 -41.386 2.952 -0.506 1.00 0.00 C ATOM 1279 O4' G B 213 -41.820 3.688 -1.297 1.00 0.00 O ATOM 1280 C3' G B 213 -42.456 1.867 -0.431 1.00 0.00 C ATOM 1281 O3' G B 213 -42.496 1.332 0.891 1.00 0.00 O ATOM 1282 C2' G B 213 -43.745 2.555 -0.787 1.00 0.00 C ATOM 1283 O2' G B 213 -44.362 2.729 0.469 1.00 0.00 O ATOM 1284 C1' G B 213 -43.216 3.829 -1.439 1.00 0.00 C ATOM 1285 N9 G B 213 -43.597 3.966 -2.861 1.00 0.00 N ATOM 1286 C8 G B 213 -42.973 3.431 -3.931 1.00 0.00 C ATOM 1287 N7 G B 213 -43.566 3.741 -5.078 1.00 0.00 N ATOM 1288 C5 G B 213 -44.627 4.519 -4.700 1.00 0.00 C ATOM 1289 C6 G B 213 -45.636 5.156 -5.454 1.00 0.00 C ATOM 1290 O6 G B 213 -45.741 5.118 -6.678 1.00 0.00 O ATOM 1291 N1 G B 213 -46.569 5.872 -4.772 1.00 0.00 N ATOM 1292 C2 G B 213 -46.479 5.932 -3.423 1.00 0.00 C ATOM 1293 N2 G B 213 -47.460 6.667 -2.905 1.00 0.00 N ATOM 1294 N3 G B 213 -45.568 5.369 -2.609 1.00 0.00 N ATOM 1295 C4 G B 213 -44.666 4.669 -3.350 1.00 0.00 C ATOM 0 H5' G B 213 -39.499 2.869 0.511 1.00 0.00 H new ATOM 0 H5'' G B 213 -39.973 1.360 -0.244 1.00 0.00 H new ATOM 0 H4' G B 213 -41.173 3.601 0.343 1.00 0.00 H new ATOM 0 H3' G B 213 -42.263 1.032 -1.105 1.00 0.00 H new ATOM 0 H2' G B 213 -44.470 2.081 -1.449 1.00 0.00 H new ATOM 0 HO2' G B 213 -44.918 1.948 0.671 1.00 0.00 H new ATOM 0 H1' G B 213 -43.627 4.727 -0.977 1.00 0.00 H new ATOM 0 H8 G B 213 -42.087 2.817 -3.862 1.00 0.00 H new ATOM 0 H1 G B 213 -47.320 6.353 -5.266 1.00 0.00 H new ATOM 0 H21 G B 213 -47.519 6.800 -1.895 1.00 0.00 H new ATOM 0 H22 G B 213 -48.153 7.097 -3.518 1.00 0.00 H new ATOM 1307 P U B 214 -42.204 -0.223 1.134 1.00 0.00 P ATOM 1308 OP1 U B 214 -40.823 -0.397 1.636 1.00 0.00 O ATOM 1309 OP2 U B 214 -42.598 -0.997 -0.065 1.00 0.00 O ATOM 1310 O5' U B 214 -43.212 -0.597 2.318 1.00 0.00 O ATOM 1311 C5' U B 214 -43.793 0.434 3.113 1.00 0.00 C ATOM 1312 C4' U B 214 -45.266 0.566 2.796 1.00 0.00 C ATOM 1313 O4' U B 214 -45.872 1.134 2.032 1.00 0.00 O ATOM 1314 C3' U B 214 -46.093 -0.677 3.113 1.00 0.00 C ATOM 1315 O3' U B 214 -46.813 -0.472 4.325 1.00 0.00 O ATOM 1316 C2' U B 214 -47.020 -0.846 1.941 1.00 0.00 C ATOM 1317 O2' U B 214 -48.257 -1.117 2.562 1.00 0.00 O ATOM 1318 C1' U B 214 -46.904 0.527 1.286 1.00 0.00 C ATOM 1319 N1 U B 214 -46.559 0.468 -0.150 1.00 0.00 N ATOM 1320 C2 U B 214 -47.424 1.083 -1.003 1.00 0.00 C ATOM 1321 O2 U B 214 -48.437 1.659 -0.641 1.00 0.00 O ATOM 1322 N3 U B 214 -47.106 1.028 -2.341 1.00 0.00 N ATOM 1323 C4 U B 214 -45.989 0.400 -2.832 1.00 0.00 C ATOM 1324 O4 U B 214 -45.805 0.414 -4.048 1.00 0.00 O ATOM 1325 C5 U B 214 -45.120 -0.225 -1.898 1.00 0.00 C ATOM 1326 C6 U B 214 -45.447 -0.160 -0.606 1.00 0.00 C ATOM 0 H5' U B 214 -43.286 1.380 2.923 1.00 0.00 H new ATOM 0 H5'' U B 214 -43.659 0.207 4.171 1.00 0.00 H new ATOM 0 H4' U B 214 -45.031 1.458 3.377 1.00 0.00 H new ATOM 0 H3' U B 214 -45.482 -1.568 3.257 1.00 0.00 H new ATOM 0 H2' U B 214 -46.846 -1.621 1.194 1.00 0.00 H new ATOM 0 HO2' U B 214 -48.137 -1.140 3.534 1.00 0.00 H new ATOM 0 H1' U B 214 -47.850 1.069 1.300 1.00 0.00 H new ATOM 0 H3 U B 214 -47.736 1.479 -3.005 1.00 0.00 H new ATOM 0 H5 U B 214 -44.225 -0.735 -2.223 1.00 0.00 H new ATOM 0 H6 U B 214 -44.793 -0.631 0.113 1.00 0.00 H new ATOM 1337 P A B 215 -46.236 -1.042 5.706 1.00 0.00 P ATOM 1338 OP1 A B 215 -44.823 -0.634 5.861 1.00 0.00 O ATOM 1339 OP2 A B 215 -46.547 -2.484 5.817 1.00 0.00 O ATOM 1340 O5' A B 215 -47.100 -0.264 6.805 1.00 0.00 O ATOM 1341 C5' A B 215 -48.514 -0.437 6.854 1.00 0.00 C ATOM 1342 C4' A B 215 -49.139 0.633 7.721 1.00 0.00 C ATOM 1343 O4' A B 215 -48.538 1.833 7.315 1.00 0.00 O ATOM 1344 C3' A B 215 -50.618 0.885 7.443 1.00 0.00 C ATOM 1345 O3' A B 215 -51.400 0.328 8.499 1.00 0.00 O ATOM 1346 C2' A B 215 -50.762 2.380 7.380 1.00 0.00 C ATOM 1347 O2' A B 215 -50.912 2.735 8.737 1.00 0.00 O ATOM 1348 C1' A B 215 -49.429 2.766 6.745 1.00 0.00 C ATOM 1349 N9 A B 215 -49.429 2.673 5.271 1.00 0.00 N ATOM 1350 C8 A B 215 -48.563 1.989 4.493 1.00 0.00 C ATOM 1351 N7 A B 215 -48.836 2.107 3.197 1.00 0.00 N ATOM 1352 C5 A B 215 -49.941 2.916 3.166 1.00 0.00 C ATOM 1353 C6 A B 215 -50.707 3.409 2.089 1.00 0.00 C ATOM 1354 N6 A B 215 -50.458 3.143 0.781 1.00 0.00 N ATOM 1355 N1 A B 215 -51.768 4.206 2.390 1.00 0.00 N ATOM 1356 C2 A B 215 -52.025 4.477 3.689 1.00 0.00 C ATOM 1357 N3 A B 215 -51.366 4.064 4.788 1.00 0.00 N ATOM 1358 C4 A B 215 -50.320 3.273 4.420 1.00 0.00 C ATOM 0 H5' A B 215 -48.754 -1.423 7.251 1.00 0.00 H new ATOM 0 H5'' A B 215 -48.929 -0.389 5.847 1.00 0.00 H new ATOM 0 H4' A B 215 -49.013 0.322 8.758 1.00 0.00 H new ATOM 0 H3' A B 215 -50.961 0.423 6.517 1.00 0.00 H new ATOM 0 H2' A B 215 -51.578 2.843 6.824 1.00 0.00 H new ATOM 0 HO2' A B 215 -51.280 1.976 9.235 1.00 0.00 H new ATOM 0 H1' A B 215 -49.171 3.808 6.935 1.00 0.00 H new ATOM 0 H8 A B 215 -47.739 1.409 4.881 1.00 0.00 H new ATOM 0 H61 A B 215 -51.059 3.537 0.057 1.00 0.00 H new ATOM 0 H62 A B 215 -49.670 2.549 0.522 1.00 0.00 H new ATOM 0 H2 A B 215 -52.878 5.114 3.871 1.00 0.00 H new ATOM 1370 P C B 216 -52.505 -0.783 8.176 1.00 0.00 P ATOM 1371 OP1 C B 216 -53.422 -0.922 9.328 1.00 0.00 O ATOM 1372 OP2 C B 216 -51.847 -2.009 7.674 1.00 0.00 O ATOM 1373 O5' C B 216 -53.326 -0.132 6.966 1.00 0.00 O ATOM 1374 C5' C B 216 -54.009 1.106 7.152 1.00 0.00 C ATOM 1375 C4' C B 216 -54.651 1.545 5.856 1.00 0.00 C ATOM 1376 O4' C B 216 -54.394 2.224 5.035 1.00 0.00 O ATOM 1377 C3' C B 216 -55.712 0.588 5.321 1.00 0.00 C ATOM 1378 O3' C B 216 -56.976 0.911 5.897 1.00 0.00 O ATOM 1379 C2' C B 216 -55.715 0.791 3.832 1.00 0.00 C ATOM 1380 O2' C B 216 -57.044 1.188 3.576 1.00 0.00 O ATOM 1381 C1' C B 216 -54.665 1.889 3.692 1.00 0.00 C ATOM 1382 N1 C B 216 -53.440 1.447 2.994 1.00 0.00 N ATOM 1383 C2 C B 216 -53.360 1.673 1.620 1.00 0.00 C ATOM 1384 O2 C B 216 -54.309 2.227 1.055 1.00 0.00 O ATOM 1385 N3 C B 216 -52.254 1.279 0.963 1.00 0.00 N ATOM 1386 C4 C B 216 -51.251 0.690 1.582 1.00 0.00 C ATOM 1387 N4 C B 216 -50.168 0.310 0.915 1.00 0.00 N ATOM 1388 C5 C B 216 -51.308 0.445 3.004 1.00 0.00 C ATOM 1389 C6 C B 216 -52.417 0.843 3.646 1.00 0.00 C ATOM 0 H5' C B 216 -53.310 1.868 7.497 1.00 0.00 H new ATOM 0 H5'' C B 216 -54.770 0.998 7.925 1.00 0.00 H new ATOM 0 H4' C B 216 -54.549 2.387 6.540 1.00 0.00 H new ATOM 0 H3' C B 216 -55.509 -0.454 5.570 1.00 0.00 H new ATOM 0 H2' C B 216 -55.477 -0.028 3.153 1.00 0.00 H new ATOM 0 HO2' C B 216 -57.451 1.522 4.403 1.00 0.00 H new ATOM 0 H1' C B 216 -55.020 2.721 3.083 1.00 0.00 H new ATOM 0 H41 C B 216 -49.399 -0.145 1.407 1.00 0.00 H new ATOM 0 H42 C B 216 -50.105 0.473 -0.090 1.00 0.00 H new ATOM 0 H5 C B 216 -50.495 -0.037 3.527 1.00 0.00 H new ATOM 0 H6 C B 216 -52.496 0.678 4.710 1.00 0.00 H new ATOM 1401 P G B 217 -57.947 -0.255 6.401 1.00 0.00 P ATOM 1402 OP1 G B 217 -59.277 0.308 6.726 1.00 0.00 O ATOM 1403 OP2 G B 217 -57.268 -1.052 7.448 1.00 0.00 O ATOM 1404 O5' G B 217 -58.105 -1.178 5.103 1.00 0.00 O ATOM 1405 C5' G B 217 -59.135 -0.906 4.156 1.00 0.00 C ATOM 1406 C4' G B 217 -58.853 -1.629 2.858 1.00 0.00 C ATOM 1407 O4' G B 217 -58.117 -1.395 2.013 1.00 0.00 O ATOM 1408 C3' G B 217 -58.890 -3.151 2.964 1.00 0.00 C ATOM 1409 O3' G B 217 -60.240 -3.582 3.128 1.00 0.00 O ATOM 1410 C2' G B 217 -58.303 -3.653 1.674 1.00 0.00 C ATOM 1411 O2' G B 217 -59.446 -4.017 0.935 1.00 0.00 O ATOM 1412 C1' G B 217 -57.577 -2.402 1.186 1.00 0.00 C ATOM 1413 N9 G B 217 -56.108 -2.479 1.330 1.00 0.00 N ATOM 1414 C8 G B 217 -55.384 -2.308 2.455 1.00 0.00 C ATOM 1415 N7 G B 217 -54.077 -2.443 2.249 1.00 0.00 N ATOM 1416 C5 G B 217 -53.982 -2.714 0.911 1.00 0.00 C ATOM 1417 C6 G B 217 -52.864 -2.958 0.084 1.00 0.00 C ATOM 1418 O6 G B 217 -51.692 -2.968 0.456 1.00 0.00 O ATOM 1419 N1 G B 217 -53.101 -3.200 -1.233 1.00 0.00 N ATOM 1420 C2 G B 217 -54.382 -3.195 -1.671 1.00 0.00 C ATOM 1421 N2 G B 217 -54.448 -3.448 -2.976 1.00 0.00 N ATOM 1422 N3 G B 217 -55.514 -2.977 -0.977 1.00 0.00 N ATOM 1423 C4 G B 217 -55.209 -2.741 0.329 1.00 0.00 C ATOM 0 H5' G B 217 -59.200 0.167 3.977 1.00 0.00 H new ATOM 0 H5'' G B 217 -60.099 -1.222 4.555 1.00 0.00 H new ATOM 0 H4' G B 217 -59.683 -1.024 2.494 1.00 0.00 H new ATOM 0 H3' G B 217 -58.331 -3.531 3.819 1.00 0.00 H new ATOM 0 H2' G B 217 -57.616 -4.499 1.661 1.00 0.00 H new ATOM 0 HO2' G B 217 -60.250 -3.824 1.460 1.00 0.00 H new ATOM 0 H1' G B 217 -57.721 -2.234 0.119 1.00 0.00 H new ATOM 0 H8 G B 217 -55.818 -2.086 3.418 1.00 0.00 H new ATOM 0 H1 G B 217 -52.331 -3.381 -1.877 1.00 0.00 H new ATOM 0 H21 G B 217 -55.353 -3.476 -3.445 1.00 0.00 H new ATOM 0 H22 G B 217 -53.593 -3.614 -3.507 1.00 0.00 H new ATOM 1435 P C B 218 -60.557 -4.932 3.925 1.00 0.00 P ATOM 1436 OP1 C B 218 -62.017 -5.178 3.930 1.00 0.00 O ATOM 1437 OP2 C B 218 -59.864 -4.914 5.233 1.00 0.00 O ATOM 1438 O5' C B 218 -59.870 -6.057 3.018 1.00 0.00 O ATOM 1439 C5' C B 218 -60.542 -6.548 1.860 1.00 0.00 C ATOM 1440 C4' C B 218 -59.541 -7.121 0.882 1.00 0.00 C ATOM 1441 O4' C B 218 -58.498 -6.476 0.511 1.00 0.00 O ATOM 1442 C3' C B 218 -58.878 -8.414 1.343 1.00 0.00 C ATOM 1443 O3' C B 218 -59.821 -9.482 1.275 1.00 0.00 O ATOM 1444 C2' C B 218 -57.730 -8.632 0.397 1.00 0.00 C ATOM 1445 O2' C B 218 -58.322 -9.377 -0.643 1.00 0.00 O ATOM 1446 C1' C B 218 -57.372 -7.190 0.048 1.00 0.00 C ATOM 1447 N1 C B 218 -56.134 -6.715 0.699 1.00 0.00 N ATOM 1448 C2 C B 218 -54.957 -6.741 -0.048 1.00 0.00 C ATOM 1449 O2 C B 218 -55.006 -7.157 -1.212 1.00 0.00 O ATOM 1450 N3 C B 218 -53.817 -6.315 0.522 1.00 0.00 N ATOM 1451 C4 C B 218 -53.784 -5.875 1.764 1.00 0.00 C ATOM 1452 N4 C B 218 -52.649 -5.458 2.310 1.00 0.00 N ATOM 1453 C5 C B 218 -54.989 -5.837 2.562 1.00 0.00 C ATOM 1454 C6 C B 218 -56.118 -6.266 1.978 1.00 0.00 C ATOM 0 H5' C B 218 -61.104 -5.742 1.387 1.00 0.00 H new ATOM 0 H5'' C B 218 -61.263 -7.314 2.146 1.00 0.00 H new ATOM 0 H4' C B 218 -60.265 -7.163 0.068 1.00 0.00 H new ATOM 0 H3' C B 218 -58.528 -8.366 2.374 1.00 0.00 H new ATOM 0 H2' C B 218 -56.833 -9.163 0.716 1.00 0.00 H new ATOM 0 HO2' C B 218 -58.007 -10.304 -0.602 1.00 0.00 H new ATOM 0 H1' C B 218 -57.165 -7.065 -1.015 1.00 0.00 H new ATOM 0 H41 C B 218 -52.640 -5.120 3.272 1.00 0.00 H new ATOM 0 H42 C B 218 -51.786 -5.475 1.767 1.00 0.00 H new ATOM 0 H5 C B 218 -54.981 -5.480 3.581 1.00 0.00 H new ATOM 0 H6 C B 218 -57.039 -6.253 2.542 1.00 0.00 H new ATOM 1466 P C B 219 -59.908 -10.550 2.463 1.00 0.00 P ATOM 1467 OP1 C B 219 -61.253 -11.167 2.482 1.00 0.00 O ATOM 1468 OP2 C B 219 -59.419 -9.939 3.719 1.00 0.00 O ATOM 1469 O5' C B 219 -58.856 -11.671 2.017 1.00 0.00 O ATOM 1470 C5' C B 219 -59.109 -12.466 0.861 1.00 0.00 C ATOM 1471 C4' C B 219 -57.804 -12.909 0.239 1.00 0.00 C ATOM 1472 O4' C B 219 -56.993 -11.793 0.113 1.00 0.00 O ATOM 1473 C3' C B 219 -56.867 -13.643 1.195 1.00 0.00 C ATOM 1474 O3' C B 219 -57.223 -15.033 1.234 1.00 0.00 O ATOM 1475 C2' C B 219 -55.488 -13.441 0.631 1.00 0.00 C ATOM 1476 O2' C B 219 -55.408 -14.441 -0.360 1.00 0.00 O ATOM 1477 C1' C B 219 -55.600 -12.010 0.111 1.00 0.00 C ATOM 1478 N1 C B 219 -54.904 -11.019 0.958 1.00 0.00 N ATOM 1479 C2 C B 219 -53.640 -10.594 0.553 1.00 0.00 C ATOM 1480 O2 C B 219 -53.163 -11.061 -0.488 1.00 0.00 O ATOM 1481 N3 C B 219 -52.987 -9.692 1.307 1.00 0.00 N ATOM 1482 C4 C B 219 -53.509 -9.203 2.413 1.00 0.00 C ATOM 1483 N4 C B 219 -52.849 -8.314 3.145 1.00 0.00 N ATOM 1484 C5 C B 219 -54.819 -9.626 2.856 1.00 0.00 C ATOM 1485 C6 C B 219 -55.457 -10.526 2.093 1.00 0.00 C ATOM 0 H5' C B 219 -59.690 -11.895 0.137 1.00 0.00 H new ATOM 0 H5'' C B 219 -59.706 -13.337 1.133 1.00 0.00 H new ATOM 0 H4' C B 219 -58.115 -13.480 -0.636 1.00 0.00 H new ATOM 0 H3' C B 219 -56.925 -13.272 2.218 1.00 0.00 H new ATOM 0 H2' C B 219 -54.605 -13.530 1.263 1.00 0.00 H new ATOM 0 HO2' C B 219 -55.980 -15.197 -0.109 1.00 0.00 H new ATOM 0 HO3' C B 219 -56.622 -15.508 1.846 1.00 0.00 H new ATOM 0 H1' C B 219 -55.127 -11.890 -0.864 1.00 0.00 H new ATOM 0 H41 C B 219 -53.267 -7.945 3.999 1.00 0.00 H new ATOM 0 H42 C B 219 -51.923 -8.000 2.854 1.00 0.00 H new ATOM 0 H5 C B 219 -55.263 -9.235 3.760 1.00 0.00 H new ATOM 0 H6 C B 219 -56.437 -10.867 2.391 1.00 0.00 H new TER 1497 C B 219 HETATM 1498 ZN ZN A 128 -50.949 11.206 7.572 1.00 0.00 ZN HETATM 1499 ZN ZN A 149 -53.925 28.422 2.562 1.00 0.00 ZN