USER MOD reduce.3.24.130724 H: found=0, std=0, add=656, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 657 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 Set 1.1: A 84 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Set 1.2: A 121 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 87 ASN : amide:sc= 1.65 K(o=1.7,f=-8.8!) USER MOD Set 2.2: A 89 HIS : no HD1:sc= 0 X(o=1.7,f=1.7) USER MOD Single : A 81 LYS NZ :NH3+ -162:sc= 1.25 (180deg=0.961) USER MOD Single : A 83 LYS NZ :NH3+ 148:sc= 1.49 (180deg=-0.241!) USER MOD Single : A 85 TYR OH : rot 4:sc= 0.128 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -179:sc= 0.0713 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.221 USER MOD Single : A 97 LYS NZ :NH3+ 168:sc= 1.2 (180deg=1) USER MOD Single : A 100 ASN : amide:sc= 0.1 K(o=0.1,f=-1.2) USER MOD Single : A 101 HIS : no HE2:sc= 0.81 K(o=0.81,f=-2.5!) USER MOD Single : A 102 LYS NZ :NH3+ -177:sc= 1.24 (180deg=1.21) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -159:sc= 1.14 (180deg=0.561) USER MOD Single : A 108 LYS NZ :NH3+ -143:sc= 2.34 (180deg=-0.485) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 88:sc= 1.28 USER MOD Single : A 125 HIS : no HD1:sc= -0.053 X(o=-0.053,f=-0.5) USER MOD Single : B 1 DC O5' : rot 180:sc= 0 USER MOD Single : B 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 9 DT C7 :methyl 150:sc= -0.312 (180deg=-0.312) USER MOD Single : B 12 DG O3' : rot 180:sc= 0 USER MOD Single : C 13 DC O5' : rot 180:sc= 0 USER MOD Single : C 17 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : C 19 DT C7 :methyl 150:sc= -0.221 (180deg=-0.221) USER MOD Single : C 21 DT C7 :methyl -30:sc= -1.13 (180deg=-1.46!) USER MOD Single : C 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 79 -0.773 7.006 9.586 1.00 1.00 N ATOM 2 CA ALA A 79 0.231 6.255 8.785 1.00 1.00 C ATOM 3 C ALA A 79 0.560 6.972 7.476 1.00 1.00 C ATOM 4 O ALA A 79 -0.258 7.715 6.950 1.00 1.00 O ATOM 5 CB ALA A 79 -0.306 4.845 8.488 1.00 1.00 C ATOM 0 HA ALA A 79 1.151 6.190 9.366 1.00 1.00 H new ATOM 0 HB1 ALA A 79 0.428 4.292 7.901 1.00 1.00 H new ATOM 0 HB2 ALA A 79 -0.490 4.321 9.426 1.00 1.00 H new ATOM 0 HB3 ALA A 79 -1.237 4.921 7.926 1.00 1.00 H new ATOM 11 N ARG A 80 1.742 6.716 6.910 1.00 1.00 N ATOM 12 CA ARG A 80 2.216 7.199 5.596 1.00 1.00 C ATOM 13 C ARG A 80 1.470 6.566 4.401 1.00 1.00 C ATOM 14 O ARG A 80 2.062 5.918 3.539 1.00 1.00 O ATOM 15 CB ARG A 80 3.747 7.033 5.531 1.00 1.00 C ATOM 16 CG ARG A 80 4.421 8.017 6.501 1.00 1.00 C ATOM 17 CD ARG A 80 4.278 9.474 6.038 1.00 1.00 C ATOM 18 NE ARG A 80 3.356 10.257 6.892 1.00 1.00 N ATOM 19 CZ ARG A 80 3.685 10.963 7.960 1.00 1.00 C ATOM 20 NH1 ARG A 80 4.880 10.982 8.457 1.00 1.00 N ATOM 21 NH2 ARG A 80 2.822 11.721 8.562 1.00 1.00 N ATOM 0 H ARG A 80 2.438 6.134 7.376 1.00 1.00 H new ATOM 0 HA ARG A 80 1.978 8.259 5.504 1.00 1.00 H new ATOM 0 HB2 ARG A 80 4.022 6.010 5.788 1.00 1.00 H new ATOM 0 HB3 ARG A 80 4.098 7.212 4.515 1.00 1.00 H new ATOM 0 HG2 ARG A 80 3.981 7.907 7.492 1.00 1.00 H new ATOM 0 HG3 ARG A 80 5.478 7.768 6.593 1.00 1.00 H new ATOM 0 HD2 ARG A 80 5.259 9.949 6.039 1.00 1.00 H new ATOM 0 HD3 ARG A 80 3.917 9.490 5.010 1.00 1.00 H new ATOM 0 HE ARG A 80 2.370 10.251 6.630 1.00 1.00 H new ATOM 0 HH11 ARG A 80 5.622 10.434 8.022 1.00 1.00 H new ATOM 0 HH12 ARG A 80 5.080 11.545 9.284 1.00 1.00 H new ATOM 0 HH21 ARG A 80 1.866 11.782 8.213 1.00 1.00 H new ATOM 0 HH22 ARG A 80 3.100 12.256 9.385 1.00 1.00 H new ATOM 35 N LYS A 81 0.145 6.742 4.373 1.00 1.00 N ATOM 36 CA LYS A 81 -0.797 6.359 3.321 1.00 1.00 C ATOM 37 C LYS A 81 -0.346 6.925 1.980 1.00 1.00 C ATOM 38 O LYS A 81 -0.085 8.118 1.825 1.00 1.00 O ATOM 39 CB LYS A 81 -2.194 6.901 3.669 1.00 1.00 C ATOM 40 CG LYS A 81 -2.855 6.226 4.885 1.00 1.00 C ATOM 41 CD LYS A 81 -3.954 7.130 5.462 1.00 1.00 C ATOM 42 CE LYS A 81 -4.756 6.397 6.546 1.00 1.00 C ATOM 43 NZ LYS A 81 -5.825 7.267 7.111 1.00 1.00 N ATOM 0 H LYS A 81 -0.334 7.194 5.152 1.00 1.00 H new ATOM 0 HA LYS A 81 -0.832 5.272 3.249 1.00 1.00 H new ATOM 0 HB2 LYS A 81 -2.117 7.971 3.860 1.00 1.00 H new ATOM 0 HB3 LYS A 81 -2.844 6.778 2.803 1.00 1.00 H new ATOM 0 HG2 LYS A 81 -3.281 5.267 4.591 1.00 1.00 H new ATOM 0 HG3 LYS A 81 -2.105 6.021 5.649 1.00 1.00 H new ATOM 0 HD2 LYS A 81 -3.506 8.030 5.882 1.00 1.00 H new ATOM 0 HD3 LYS A 81 -4.623 7.450 4.663 1.00 1.00 H new ATOM 0 HE2 LYS A 81 -5.202 5.496 6.124 1.00 1.00 H new ATOM 0 HE3 LYS A 81 -4.085 6.077 7.344 1.00 1.00 H new ATOM 0 HZ1 LYS A 81 -6.143 6.879 8.022 1.00 1.00 H new ATOM 0 HZ2 LYS A 81 -5.452 8.227 7.254 1.00 1.00 H new ATOM 0 HZ3 LYS A 81 -6.628 7.303 6.451 1.00 1.00 H new ATOM 57 N VAL A 82 -0.280 6.023 1.021 1.00 1.00 N ATOM 58 CA VAL A 82 -0.042 6.331 -0.388 1.00 1.00 C ATOM 59 C VAL A 82 -1.273 6.982 -1.008 1.00 1.00 C ATOM 60 O VAL A 82 -2.393 6.496 -0.856 1.00 1.00 O ATOM 61 CB VAL A 82 0.296 5.052 -1.172 1.00 1.00 C ATOM 62 CG1 VAL A 82 0.455 5.310 -2.680 1.00 1.00 C ATOM 63 CG2 VAL A 82 1.561 4.399 -0.616 1.00 1.00 C ATOM 0 H VAL A 82 -0.393 5.025 1.199 1.00 1.00 H new ATOM 0 HA VAL A 82 0.800 7.021 -0.441 1.00 1.00 H new ATOM 0 HB VAL A 82 -0.548 4.373 -1.045 1.00 1.00 H new ATOM 0 HG11 VAL A 82 0.693 4.374 -3.186 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -0.475 5.713 -3.080 1.00 1.00 H new ATOM 0 HG13 VAL A 82 1.260 6.026 -2.844 1.00 1.00 H new ATOM 0 HG21 VAL A 82 1.784 3.496 -1.184 1.00 1.00 H new ATOM 0 HG22 VAL A 82 2.396 5.095 -0.699 1.00 1.00 H new ATOM 0 HG23 VAL A 82 1.407 4.140 0.432 1.00 1.00 H new ATOM 73 N LYS A 83 -1.058 8.056 -1.761 1.00 1.00 N ATOM 74 CA LYS A 83 -2.047 8.666 -2.632 1.00 1.00 C ATOM 75 C LYS A 83 -1.621 8.353 -4.054 1.00 1.00 C ATOM 76 O LYS A 83 -0.493 8.647 -4.456 1.00 1.00 O ATOM 77 CB LYS A 83 -2.161 10.186 -2.454 1.00 1.00 C ATOM 78 CG LYS A 83 -3.320 10.569 -1.528 1.00 1.00 C ATOM 79 CD LYS A 83 -3.332 12.090 -1.346 1.00 1.00 C ATOM 80 CE LYS A 83 -4.621 12.593 -0.698 1.00 1.00 C ATOM 81 NZ LYS A 83 -4.413 13.911 -0.064 1.00 1.00 N ATOM 0 H LYS A 83 -0.160 8.539 -1.780 1.00 1.00 H new ATOM 0 HA LYS A 83 -3.030 8.263 -2.387 1.00 1.00 H new ATOM 0 HB2 LYS A 83 -1.228 10.575 -2.047 1.00 1.00 H new ATOM 0 HB3 LYS A 83 -2.304 10.656 -3.427 1.00 1.00 H new ATOM 0 HG2 LYS A 83 -4.267 10.233 -1.951 1.00 1.00 H new ATOM 0 HG3 LYS A 83 -3.209 10.075 -0.563 1.00 1.00 H new ATOM 0 HD2 LYS A 83 -2.481 12.386 -0.732 1.00 1.00 H new ATOM 0 HD3 LYS A 83 -3.206 12.570 -2.317 1.00 1.00 H new ATOM 0 HE2 LYS A 83 -5.406 12.667 -1.450 1.00 1.00 H new ATOM 0 HE3 LYS A 83 -4.961 11.876 0.049 1.00 1.00 H new ATOM 0 HZ1 LYS A 83 -5.292 14.465 -0.118 1.00 1.00 H new ATOM 0 HZ2 LYS A 83 -4.148 13.779 0.933 1.00 1.00 H new ATOM 0 HZ3 LYS A 83 -3.653 14.419 -0.560 1.00 1.00 H new ATOM 95 N GLN A 84 -2.501 7.690 -4.792 1.00 1.00 N ATOM 96 CA GLN A 84 -2.331 7.560 -6.218 1.00 1.00 C ATOM 97 C GLN A 84 -2.940 8.842 -6.778 1.00 1.00 C ATOM 98 O GLN A 84 -3.957 9.330 -6.285 1.00 1.00 O ATOM 99 CB GLN A 84 -2.998 6.279 -6.764 1.00 1.00 C ATOM 100 CG GLN A 84 -3.698 6.428 -8.118 1.00 1.00 C ATOM 101 CD GLN A 84 -4.220 5.083 -8.620 1.00 1.00 C ATOM 102 OE1 GLN A 84 -5.403 4.781 -8.552 1.00 1.00 O ATOM 103 NE2 GLN A 84 -3.364 4.211 -9.119 1.00 1.00 N ATOM 0 H GLN A 84 -3.336 7.237 -4.420 1.00 1.00 H new ATOM 0 HA GLN A 84 -1.288 7.449 -6.513 1.00 1.00 H new ATOM 0 HB2 GLN A 84 -2.238 5.503 -6.851 1.00 1.00 H new ATOM 0 HB3 GLN A 84 -3.728 5.930 -6.033 1.00 1.00 H new ATOM 0 HG2 GLN A 84 -4.526 7.131 -8.027 1.00 1.00 H new ATOM 0 HG3 GLN A 84 -3.003 6.846 -8.846 1.00 1.00 H new ATOM 0 HE21 GLN A 84 -2.374 4.447 -9.183 1.00 1.00 H new ATOM 0 HE22 GLN A 84 -3.693 3.301 -9.441 1.00 1.00 H new ATOM 112 N TYR A 85 -2.338 9.357 -7.833 1.00 1.00 N ATOM 113 CA TYR A 85 -2.831 10.514 -8.567 1.00 1.00 C ATOM 114 C TYR A 85 -2.906 10.132 -10.042 1.00 1.00 C ATOM 115 O TYR A 85 -2.005 9.466 -10.541 1.00 1.00 O ATOM 116 CB TYR A 85 -1.883 11.703 -8.346 1.00 1.00 C ATOM 117 CG TYR A 85 -1.661 12.120 -6.904 1.00 1.00 C ATOM 118 CD1 TYR A 85 -2.562 13.015 -6.303 1.00 1.00 C ATOM 119 CD2 TYR A 85 -0.531 11.672 -6.192 1.00 1.00 C ATOM 120 CE1 TYR A 85 -2.325 13.500 -5.003 1.00 1.00 C ATOM 121 CE2 TYR A 85 -0.287 12.151 -4.891 1.00 1.00 C ATOM 122 CZ TYR A 85 -1.173 13.083 -4.302 1.00 1.00 C ATOM 123 OH TYR A 85 -0.925 13.567 -3.056 1.00 1.00 O ATOM 0 H TYR A 85 -1.472 8.976 -8.215 1.00 1.00 H new ATOM 0 HA TYR A 85 -3.821 10.810 -8.219 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -0.916 11.457 -8.785 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -2.274 12.560 -8.895 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -3.442 13.333 -6.842 1.00 1.00 H new ATOM 0 HD2 TYR A 85 0.147 10.963 -6.643 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -3.021 14.187 -4.545 1.00 1.00 H new ATOM 0 HE2 TYR A 85 0.577 11.807 -4.342 1.00 1.00 H new ATOM 0 HH TYR A 85 -1.669 14.138 -2.773 1.00 1.00 H new ATOM 133 N LYS A 86 -3.955 10.559 -10.748 1.00 1.00 N ATOM 134 CA LYS A 86 -4.144 10.322 -12.188 1.00 1.00 C ATOM 135 C LYS A 86 -4.512 11.638 -12.863 1.00 1.00 C ATOM 136 O LYS A 86 -5.278 12.412 -12.303 1.00 1.00 O ATOM 137 CB LYS A 86 -5.231 9.246 -12.373 1.00 1.00 C ATOM 138 CG LYS A 86 -5.611 9.025 -13.847 1.00 1.00 C ATOM 139 CD LYS A 86 -6.454 7.753 -14.008 1.00 1.00 C ATOM 140 CE LYS A 86 -6.736 7.480 -15.494 1.00 1.00 C ATOM 141 NZ LYS A 86 -7.598 6.277 -15.682 1.00 1.00 N ATOM 0 H LYS A 86 -4.717 11.092 -10.328 1.00 1.00 H new ATOM 0 HA LYS A 86 -3.228 9.957 -12.653 1.00 1.00 H new ATOM 0 HB2 LYS A 86 -4.880 8.305 -11.949 1.00 1.00 H new ATOM 0 HB3 LYS A 86 -6.120 9.536 -11.813 1.00 1.00 H new ATOM 0 HG2 LYS A 86 -6.169 9.885 -14.216 1.00 1.00 H new ATOM 0 HG3 LYS A 86 -4.708 8.947 -14.452 1.00 1.00 H new ATOM 0 HD2 LYS A 86 -5.930 6.904 -13.569 1.00 1.00 H new ATOM 0 HD3 LYS A 86 -7.394 7.862 -13.467 1.00 1.00 H new ATOM 0 HE2 LYS A 86 -7.223 8.349 -15.937 1.00 1.00 H new ATOM 0 HE3 LYS A 86 -5.793 7.338 -16.023 1.00 1.00 H new ATOM 0 HZ1 LYS A 86 -7.766 6.125 -16.697 1.00 1.00 H new ATOM 0 HZ2 LYS A 86 -7.123 5.443 -15.281 1.00 1.00 H new ATOM 0 HZ3 LYS A 86 -8.507 6.423 -15.199 1.00 1.00 H new ATOM 155 N ASN A 87 -3.973 11.888 -14.051 1.00 1.00 N ATOM 156 CA ASN A 87 -4.150 13.160 -14.753 1.00 1.00 C ATOM 157 C ASN A 87 -5.134 13.049 -15.944 1.00 1.00 C ATOM 158 O ASN A 87 -4.772 12.461 -16.967 1.00 1.00 O ATOM 159 CB ASN A 87 -2.759 13.642 -15.171 1.00 1.00 C ATOM 160 CG ASN A 87 -2.761 15.033 -15.768 1.00 1.00 C ATOM 161 OD1 ASN A 87 -3.723 15.496 -16.362 1.00 1.00 O ATOM 162 ND2 ASN A 87 -1.690 15.763 -15.601 1.00 1.00 N ATOM 0 H ASN A 87 -3.399 11.214 -14.558 1.00 1.00 H new ATOM 0 HA ASN A 87 -4.613 13.894 -14.093 1.00 1.00 H new ATOM 0 HB2 ASN A 87 -2.101 13.628 -14.302 1.00 1.00 H new ATOM 0 HB3 ASN A 87 -2.343 12.943 -15.897 1.00 1.00 H new ATOM 0 HD21 ASN A 87 -1.660 16.715 -15.966 1.00 1.00 H new ATOM 0 HD22 ASN A 87 -0.884 15.381 -15.106 1.00 1.00 H new ATOM 169 N PRO A 88 -6.344 13.643 -15.864 1.00 1.00 N ATOM 170 CA PRO A 88 -7.325 13.670 -16.959 1.00 1.00 C ATOM 171 C PRO A 88 -6.808 14.194 -18.312 1.00 1.00 C ATOM 172 O PRO A 88 -7.337 13.820 -19.363 1.00 1.00 O ATOM 173 CB PRO A 88 -8.465 14.568 -16.454 1.00 1.00 C ATOM 174 CG PRO A 88 -8.388 14.449 -14.933 1.00 1.00 C ATOM 175 CD PRO A 88 -6.893 14.308 -14.687 1.00 1.00 C ATOM 0 HA PRO A 88 -7.620 12.644 -17.180 1.00 1.00 H new ATOM 0 HB2 PRO A 88 -8.334 15.600 -16.780 1.00 1.00 H new ATOM 0 HB3 PRO A 88 -9.432 14.235 -16.831 1.00 1.00 H new ATOM 0 HG2 PRO A 88 -8.800 15.328 -14.436 1.00 1.00 H new ATOM 0 HG3 PRO A 88 -8.943 13.586 -14.565 1.00 1.00 H new ATOM 0 HD2 PRO A 88 -6.430 15.284 -14.540 1.00 1.00 H new ATOM 0 HD3 PRO A 88 -6.701 13.725 -13.786 1.00 1.00 H new ATOM 183 N HIS A 89 -5.781 15.057 -18.306 1.00 1.00 N ATOM 184 CA HIS A 89 -5.244 15.737 -19.499 1.00 1.00 C ATOM 185 C HIS A 89 -4.161 14.941 -20.245 1.00 1.00 C ATOM 186 O HIS A 89 -3.884 15.241 -21.409 1.00 1.00 O ATOM 187 CB HIS A 89 -4.715 17.123 -19.090 1.00 1.00 C ATOM 188 CG HIS A 89 -5.741 17.956 -18.360 1.00 1.00 C ATOM 189 ND1 HIS A 89 -6.793 18.643 -18.940 1.00 1.00 N ATOM 190 CD2 HIS A 89 -5.814 18.134 -17.005 1.00 1.00 C ATOM 191 CE1 HIS A 89 -7.489 19.243 -17.955 1.00 1.00 C ATOM 192 NE2 HIS A 89 -6.915 18.946 -16.772 1.00 1.00 N ATOM 0 H HIS A 89 -5.287 15.309 -17.450 1.00 1.00 H new ATOM 0 HA HIS A 89 -6.067 15.831 -20.208 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -3.838 16.998 -18.454 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -4.389 17.658 -19.982 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -5.146 17.723 -16.263 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -8.364 19.861 -18.091 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -7.236 19.265 -15.858 1.00 1.00 H new ATOM 201 N THR A 90 -3.555 13.932 -19.603 1.00 1.00 N ATOM 202 CA THR A 90 -2.416 13.160 -20.152 1.00 1.00 C ATOM 203 C THR A 90 -2.602 11.641 -20.085 1.00 1.00 C ATOM 204 O THR A 90 -1.974 10.917 -20.860 1.00 1.00 O ATOM 205 CB THR A 90 -1.115 13.505 -19.414 1.00 1.00 C ATOM 206 OG1 THR A 90 -1.207 13.038 -18.090 1.00 1.00 O ATOM 207 CG2 THR A 90 -0.845 15.005 -19.319 1.00 1.00 C ATOM 0 H THR A 90 -3.841 13.620 -18.675 1.00 1.00 H new ATOM 0 HA THR A 90 -2.366 13.448 -21.202 1.00 1.00 H new ATOM 0 HB THR A 90 -0.311 13.040 -19.985 1.00 1.00 H new ATOM 0 HG1 THR A 90 -0.386 13.266 -17.605 1.00 1.00 H new ATOM 0 HG21 THR A 90 0.090 15.173 -18.785 1.00 1.00 H new ATOM 0 HG22 THR A 90 -0.771 15.426 -20.322 1.00 1.00 H new ATOM 0 HG23 THR A 90 -1.661 15.488 -18.782 1.00 1.00 H new ATOM 215 N GLY A 91 -3.460 11.143 -19.186 1.00 1.00 N ATOM 216 CA GLY A 91 -3.617 9.713 -18.906 1.00 1.00 C ATOM 217 C GLY A 91 -2.469 9.097 -18.087 1.00 1.00 C ATOM 218 O GLY A 91 -2.422 7.873 -17.939 1.00 1.00 O ATOM 0 H GLY A 91 -4.074 11.733 -18.624 1.00 1.00 H new ATOM 0 HA2 GLY A 91 -4.553 9.561 -18.369 1.00 1.00 H new ATOM 0 HA3 GLY A 91 -3.701 9.177 -19.851 1.00 1.00 H new ATOM 222 N GLU A 92 -1.543 9.906 -17.553 1.00 1.00 N ATOM 223 CA GLU A 92 -0.508 9.462 -16.637 1.00 1.00 C ATOM 224 C GLU A 92 -1.076 9.285 -15.236 1.00 1.00 C ATOM 225 O GLU A 92 -2.054 9.911 -14.824 1.00 1.00 O ATOM 226 CB GLU A 92 0.665 10.454 -16.574 1.00 1.00 C ATOM 227 CG GLU A 92 1.621 10.296 -17.752 1.00 1.00 C ATOM 228 CD GLU A 92 2.627 9.145 -17.531 1.00 1.00 C ATOM 229 OE1 GLU A 92 2.231 7.955 -17.606 1.00 1.00 O ATOM 230 OE2 GLU A 92 3.826 9.423 -17.281 1.00 1.00 O ATOM 0 H GLU A 92 -1.500 10.905 -17.756 1.00 1.00 H new ATOM 0 HA GLU A 92 -0.139 8.508 -17.014 1.00 1.00 H new ATOM 0 HB2 GLU A 92 0.276 11.472 -16.559 1.00 1.00 H new ATOM 0 HB3 GLU A 92 1.212 10.307 -15.643 1.00 1.00 H new ATOM 0 HG2 GLU A 92 1.049 10.108 -18.660 1.00 1.00 H new ATOM 0 HG3 GLU A 92 2.165 11.228 -17.905 1.00 1.00 H new ATOM 237 N VAL A 93 -0.387 8.441 -14.486 1.00 1.00 N ATOM 238 CA VAL A 93 -0.658 8.079 -13.099 1.00 1.00 C ATOM 239 C VAL A 93 0.655 8.074 -12.303 1.00 1.00 C ATOM 240 O VAL A 93 1.746 7.876 -12.845 1.00 1.00 O ATOM 241 CB VAL A 93 -1.326 6.691 -13.044 1.00 1.00 C ATOM 242 CG1 VAL A 93 -1.842 6.288 -11.646 1.00 1.00 C ATOM 243 CG2 VAL A 93 -2.523 6.610 -14.006 1.00 1.00 C ATOM 0 H VAL A 93 0.432 7.956 -14.852 1.00 1.00 H new ATOM 0 HA VAL A 93 -1.335 8.810 -12.657 1.00 1.00 H new ATOM 0 HB VAL A 93 -0.530 6.003 -13.330 1.00 1.00 H new ATOM 0 HG11 VAL A 93 -2.297 5.299 -11.697 1.00 1.00 H new ATOM 0 HG12 VAL A 93 -1.010 6.268 -10.943 1.00 1.00 H new ATOM 0 HG13 VAL A 93 -2.584 7.012 -11.310 1.00 1.00 H new ATOM 0 HG21 VAL A 93 -2.973 5.619 -13.944 1.00 1.00 H new ATOM 0 HG22 VAL A 93 -3.262 7.362 -13.731 1.00 1.00 H new ATOM 0 HG23 VAL A 93 -2.183 6.791 -15.026 1.00 1.00 H new ATOM 253 N ILE A 94 0.521 8.266 -10.997 1.00 1.00 N ATOM 254 CA ILE A 94 1.576 8.268 -9.978 1.00 1.00 C ATOM 255 C ILE A 94 1.029 7.662 -8.684 1.00 1.00 C ATOM 256 O ILE A 94 -0.179 7.550 -8.495 1.00 1.00 O ATOM 257 CB ILE A 94 2.113 9.689 -9.644 1.00 1.00 C ATOM 258 CG1 ILE A 94 1.522 10.848 -10.477 1.00 1.00 C ATOM 259 CG2 ILE A 94 3.649 9.702 -9.716 1.00 1.00 C ATOM 260 CD1 ILE A 94 1.883 12.216 -9.891 1.00 1.00 C ATOM 0 H ILE A 94 -0.396 8.438 -10.586 1.00 1.00 H new ATOM 0 HA ILE A 94 2.400 7.686 -10.390 1.00 1.00 H new ATOM 0 HB ILE A 94 1.769 9.885 -8.628 1.00 1.00 H new ATOM 0 HG12 ILE A 94 1.890 10.783 -11.501 1.00 1.00 H new ATOM 0 HG13 ILE A 94 0.438 10.747 -10.521 1.00 1.00 H new ATOM 0 HG21 ILE A 94 4.016 10.701 -9.481 1.00 1.00 H new ATOM 0 HG22 ILE A 94 4.053 8.989 -8.998 1.00 1.00 H new ATOM 0 HG23 ILE A 94 3.968 9.426 -10.721 1.00 1.00 H new ATOM 0 HD11 ILE A 94 1.447 13.002 -10.507 1.00 1.00 H new ATOM 0 HD12 ILE A 94 1.492 12.292 -8.876 1.00 1.00 H new ATOM 0 HD13 ILE A 94 2.967 12.329 -9.871 1.00 1.00 H new ATOM 272 N GLU A 95 1.940 7.377 -7.762 1.00 1.00 N ATOM 273 CA GLU A 95 1.714 6.930 -6.385 1.00 1.00 C ATOM 274 C GLU A 95 2.825 7.485 -5.483 1.00 1.00 C ATOM 275 O GLU A 95 4.008 7.230 -5.726 1.00 1.00 O ATOM 276 CB GLU A 95 1.776 5.402 -6.322 1.00 1.00 C ATOM 277 CG GLU A 95 0.465 4.743 -6.743 1.00 1.00 C ATOM 278 CD GLU A 95 0.621 3.216 -6.863 1.00 1.00 C ATOM 279 OE1 GLU A 95 0.932 2.549 -5.847 1.00 1.00 O ATOM 280 OE2 GLU A 95 0.436 2.669 -7.977 1.00 1.00 O ATOM 0 H GLU A 95 2.935 7.457 -7.970 1.00 1.00 H new ATOM 0 HA GLU A 95 0.737 7.283 -6.054 1.00 1.00 H new ATOM 0 HB2 GLU A 95 2.580 5.048 -6.967 1.00 1.00 H new ATOM 0 HB3 GLU A 95 2.023 5.094 -5.306 1.00 1.00 H new ATOM 0 HG2 GLU A 95 -0.312 4.975 -6.015 1.00 1.00 H new ATOM 0 HG3 GLU A 95 0.139 5.154 -7.699 1.00 1.00 H new ATOM 287 N THR A 96 2.453 8.244 -4.452 1.00 1.00 N ATOM 288 CA THR A 96 3.402 8.879 -3.508 1.00 1.00 C ATOM 289 C THR A 96 2.778 8.948 -2.110 1.00 1.00 C ATOM 290 O THR A 96 1.554 8.933 -1.979 1.00 1.00 O ATOM 291 CB THR A 96 3.872 10.283 -3.975 1.00 1.00 C ATOM 292 OG1 THR A 96 3.220 11.317 -3.267 1.00 1.00 O ATOM 293 CG2 THR A 96 3.644 10.602 -5.464 1.00 1.00 C ATOM 0 H THR A 96 1.476 8.444 -4.238 1.00 1.00 H new ATOM 0 HA THR A 96 4.295 8.255 -3.477 1.00 1.00 H new ATOM 0 HB THR A 96 4.944 10.242 -3.781 1.00 1.00 H new ATOM 0 HG1 THR A 96 3.542 12.186 -3.587 1.00 1.00 H new ATOM 0 HG21 THR A 96 4.008 11.606 -5.681 1.00 1.00 H new ATOM 0 HG22 THR A 96 4.183 9.880 -6.077 1.00 1.00 H new ATOM 0 HG23 THR A 96 2.579 10.546 -5.689 1.00 1.00 H new ATOM 301 N LYS A 97 3.583 9.028 -1.048 1.00 1.00 N ATOM 302 CA LYS A 97 3.100 9.189 0.344 1.00 1.00 C ATOM 303 C LYS A 97 3.131 10.665 0.800 1.00 1.00 C ATOM 304 O LYS A 97 2.988 10.954 1.992 1.00 1.00 O ATOM 305 CB LYS A 97 3.928 8.288 1.275 1.00 1.00 C ATOM 306 CG LYS A 97 3.979 6.808 0.844 1.00 1.00 C ATOM 307 CD LYS A 97 5.039 6.005 1.619 1.00 1.00 C ATOM 308 CE LYS A 97 5.381 4.663 0.955 1.00 1.00 C ATOM 309 NZ LYS A 97 6.142 4.834 -0.320 1.00 1.00 N ATOM 0 H LYS A 97 4.599 8.983 -1.121 1.00 1.00 H new ATOM 0 HA LYS A 97 2.055 8.881 0.390 1.00 1.00 H new ATOM 0 HB2 LYS A 97 4.946 8.675 1.326 1.00 1.00 H new ATOM 0 HB3 LYS A 97 3.514 8.347 2.282 1.00 1.00 H new ATOM 0 HG2 LYS A 97 3.000 6.354 0.998 1.00 1.00 H new ATOM 0 HG3 LYS A 97 4.193 6.751 -0.223 1.00 1.00 H new ATOM 0 HD2 LYS A 97 5.947 6.602 1.707 1.00 1.00 H new ATOM 0 HD3 LYS A 97 4.679 5.822 2.631 1.00 1.00 H new ATOM 0 HE2 LYS A 97 5.968 4.058 1.646 1.00 1.00 H new ATOM 0 HE3 LYS A 97 4.460 4.115 0.754 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 6.523 3.915 -0.623 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 5.508 5.205 -1.056 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 6.925 5.501 -0.170 1.00 1.00 H new ATOM 323 N GLY A 98 3.365 11.578 -0.144 1.00 1.00 N ATOM 324 CA GLY A 98 3.616 13.004 0.048 1.00 1.00 C ATOM 325 C GLY A 98 4.929 13.471 -0.598 1.00 1.00 C ATOM 326 O GLY A 98 5.550 12.757 -1.393 1.00 1.00 O ATOM 0 H GLY A 98 3.385 11.321 -1.131 1.00 1.00 H new ATOM 0 HA2 GLY A 98 2.787 13.574 -0.372 1.00 1.00 H new ATOM 0 HA3 GLY A 98 3.644 13.223 1.115 1.00 1.00 H new ATOM 330 N GLY A 99 5.347 14.681 -0.225 1.00 1.00 N ATOM 331 CA GLY A 99 6.656 15.249 -0.533 1.00 1.00 C ATOM 332 C GLY A 99 6.882 15.772 -1.960 1.00 1.00 C ATOM 333 O GLY A 99 6.100 15.560 -2.889 1.00 1.00 O ATOM 0 H GLY A 99 4.761 15.314 0.319 1.00 1.00 H new ATOM 0 HA2 GLY A 99 6.838 16.071 0.160 1.00 1.00 H new ATOM 0 HA3 GLY A 99 7.410 14.488 -0.330 1.00 1.00 H new ATOM 337 N ASN A 100 8.009 16.471 -2.110 1.00 1.00 N ATOM 338 CA ASN A 100 8.622 16.917 -3.359 1.00 1.00 C ATOM 339 C ASN A 100 8.902 15.688 -4.258 1.00 1.00 C ATOM 340 O ASN A 100 9.855 14.939 -4.031 1.00 1.00 O ATOM 341 CB ASN A 100 9.877 17.726 -2.948 1.00 1.00 C ATOM 342 CG ASN A 100 10.961 17.929 -3.995 1.00 1.00 C ATOM 343 OD1 ASN A 100 10.781 17.747 -5.193 1.00 1.00 O ATOM 344 ND2 ASN A 100 12.128 18.334 -3.541 1.00 1.00 N ATOM 0 H ASN A 100 8.556 16.761 -1.300 1.00 1.00 H new ATOM 0 HA ASN A 100 7.983 17.562 -3.962 1.00 1.00 H new ATOM 0 HB2 ASN A 100 9.547 18.709 -2.612 1.00 1.00 H new ATOM 0 HB3 ASN A 100 10.329 17.230 -2.089 1.00 1.00 H new ATOM 0 HD21 ASN A 100 12.898 18.501 -4.189 1.00 1.00 H new ATOM 0 HD22 ASN A 100 12.263 18.481 -2.541 1.00 1.00 H new ATOM 351 N HIS A 101 8.023 15.450 -5.246 1.00 1.00 N ATOM 352 CA HIS A 101 8.124 14.364 -6.236 1.00 1.00 C ATOM 353 C HIS A 101 7.932 14.933 -7.654 1.00 1.00 C ATOM 354 O HIS A 101 6.959 15.645 -7.882 1.00 1.00 O ATOM 355 CB HIS A 101 7.116 13.262 -5.859 1.00 1.00 C ATOM 356 CG HIS A 101 7.318 11.972 -6.618 1.00 1.00 C ATOM 357 ND1 HIS A 101 8.303 11.024 -6.380 1.00 1.00 N ATOM 358 CD2 HIS A 101 6.558 11.527 -7.665 1.00 1.00 C ATOM 359 CE1 HIS A 101 8.146 10.029 -7.276 1.00 1.00 C ATOM 360 NE2 HIS A 101 7.094 10.314 -8.070 1.00 1.00 N ATOM 0 H HIS A 101 7.194 16.028 -5.382 1.00 1.00 H new ATOM 0 HA HIS A 101 9.114 13.907 -6.231 1.00 1.00 H new ATOM 0 HB2 HIS A 101 7.193 13.061 -4.790 1.00 1.00 H new ATOM 0 HB3 HIS A 101 6.106 13.627 -6.043 1.00 1.00 H new ATOM 0 HD1 HIS A 101 9.019 11.072 -5.655 1.00 1.00 H new ATOM 0 HD2 HIS A 101 5.702 12.026 -8.095 1.00 1.00 H new ATOM 0 HE1 HIS A 101 8.763 9.146 -7.347 1.00 1.00 H new ATOM 369 N LYS A 102 8.816 14.606 -8.611 1.00 1.00 N ATOM 370 CA LYS A 102 8.897 15.256 -9.945 1.00 1.00 C ATOM 371 C LYS A 102 7.560 15.427 -10.679 1.00 1.00 C ATOM 372 O LYS A 102 7.092 16.553 -10.800 1.00 1.00 O ATOM 373 CB LYS A 102 9.973 14.554 -10.802 1.00 1.00 C ATOM 374 CG LYS A 102 10.389 15.405 -12.017 1.00 1.00 C ATOM 375 CD LYS A 102 11.277 16.625 -11.700 1.00 1.00 C ATOM 376 CE LYS A 102 12.633 16.296 -11.051 1.00 1.00 C ATOM 377 NZ LYS A 102 13.536 15.543 -11.965 1.00 1.00 N ATOM 0 H LYS A 102 9.511 13.870 -8.484 1.00 1.00 H new ATOM 0 HA LYS A 102 9.200 16.288 -9.766 1.00 1.00 H new ATOM 0 HB2 LYS A 102 10.849 14.348 -10.187 1.00 1.00 H new ATOM 0 HB3 LYS A 102 9.592 13.593 -11.146 1.00 1.00 H new ATOM 0 HG2 LYS A 102 10.919 14.765 -12.722 1.00 1.00 H new ATOM 0 HG3 LYS A 102 9.487 15.755 -12.520 1.00 1.00 H new ATOM 0 HD2 LYS A 102 11.458 17.173 -12.625 1.00 1.00 H new ATOM 0 HD3 LYS A 102 10.727 17.292 -11.037 1.00 1.00 H new ATOM 0 HE2 LYS A 102 13.120 17.222 -10.746 1.00 1.00 H new ATOM 0 HE3 LYS A 102 12.467 15.711 -10.147 1.00 1.00 H new ATOM 0 HZ1 LYS A 102 14.415 15.302 -11.464 1.00 1.00 H new ATOM 0 HZ2 LYS A 102 13.065 14.670 -12.277 1.00 1.00 H new ATOM 0 HZ3 LYS A 102 13.760 16.130 -12.793 1.00 1.00 H new ATOM 391 N THR A 103 6.905 14.344 -11.104 1.00 1.00 N ATOM 392 CA THR A 103 5.663 14.423 -11.916 1.00 1.00 C ATOM 393 C THR A 103 4.542 15.161 -11.182 1.00 1.00 C ATOM 394 O THR A 103 3.865 16.012 -11.759 1.00 1.00 O ATOM 395 CB THR A 103 5.178 13.028 -12.348 1.00 1.00 C ATOM 396 OG1 THR A 103 6.241 12.346 -12.981 1.00 1.00 O ATOM 397 CG2 THR A 103 4.006 13.139 -13.321 1.00 1.00 C ATOM 0 H THR A 103 7.207 13.391 -10.904 1.00 1.00 H new ATOM 0 HA THR A 103 5.917 14.995 -12.809 1.00 1.00 H new ATOM 0 HB THR A 103 4.848 12.482 -11.464 1.00 1.00 H new ATOM 0 HG1 THR A 103 5.940 11.455 -13.258 1.00 1.00 H new ATOM 0 HG21 THR A 103 3.680 12.141 -13.613 1.00 1.00 H new ATOM 0 HG22 THR A 103 3.181 13.664 -12.839 1.00 1.00 H new ATOM 0 HG23 THR A 103 4.319 13.692 -14.207 1.00 1.00 H new ATOM 405 N LEU A 104 4.404 14.896 -9.879 1.00 1.00 N ATOM 406 CA LEU A 104 3.424 15.544 -9.006 1.00 1.00 C ATOM 407 C LEU A 104 3.623 17.074 -8.969 1.00 1.00 C ATOM 408 O LEU A 104 2.652 17.826 -9.038 1.00 1.00 O ATOM 409 CB LEU A 104 3.537 14.874 -7.615 1.00 1.00 C ATOM 410 CG LEU A 104 2.523 15.324 -6.550 1.00 1.00 C ATOM 411 CD1 LEU A 104 1.086 15.057 -6.993 1.00 1.00 C ATOM 412 CD2 LEU A 104 2.770 14.570 -5.245 1.00 1.00 C ATOM 0 H LEU A 104 4.983 14.211 -9.393 1.00 1.00 H new ATOM 0 HA LEU A 104 2.411 15.409 -9.385 1.00 1.00 H new ATOM 0 HB2 LEU A 104 3.437 13.797 -7.747 1.00 1.00 H new ATOM 0 HB3 LEU A 104 4.540 15.057 -7.229 1.00 1.00 H new ATOM 0 HG LEU A 104 2.657 16.396 -6.407 1.00 1.00 H new ATOM 0 HD11 LEU A 104 0.398 15.388 -6.215 1.00 1.00 H new ATOM 0 HD12 LEU A 104 0.882 15.603 -7.914 1.00 1.00 H new ATOM 0 HD13 LEU A 104 0.951 13.989 -7.166 1.00 1.00 H new ATOM 0 HD21 LEU A 104 2.048 14.894 -4.495 1.00 1.00 H new ATOM 0 HD22 LEU A 104 2.659 13.499 -5.417 1.00 1.00 H new ATOM 0 HD23 LEU A 104 3.779 14.778 -4.890 1.00 1.00 H new ATOM 424 N LYS A 105 4.881 17.544 -8.947 1.00 1.00 N ATOM 425 CA LYS A 105 5.220 18.977 -9.016 1.00 1.00 C ATOM 426 C LYS A 105 4.916 19.603 -10.378 1.00 1.00 C ATOM 427 O LYS A 105 4.506 20.762 -10.420 1.00 1.00 O ATOM 428 CB LYS A 105 6.698 19.197 -8.629 1.00 1.00 C ATOM 429 CG LYS A 105 6.996 19.048 -7.122 1.00 1.00 C ATOM 430 CD LYS A 105 6.301 20.070 -6.199 1.00 1.00 C ATOM 431 CE LYS A 105 6.524 21.527 -6.648 1.00 1.00 C ATOM 432 NZ LYS A 105 5.977 22.498 -5.660 1.00 1.00 N ATOM 0 H LYS A 105 5.698 16.937 -8.880 1.00 1.00 H new ATOM 0 HA LYS A 105 4.579 19.487 -8.297 1.00 1.00 H new ATOM 0 HB2 LYS A 105 7.314 18.486 -9.180 1.00 1.00 H new ATOM 0 HB3 LYS A 105 6.999 20.195 -8.949 1.00 1.00 H new ATOM 0 HG2 LYS A 105 6.703 18.046 -6.810 1.00 1.00 H new ATOM 0 HG3 LYS A 105 8.073 19.126 -6.974 1.00 1.00 H new ATOM 0 HD2 LYS A 105 5.231 19.862 -6.174 1.00 1.00 H new ATOM 0 HD3 LYS A 105 6.674 19.947 -5.182 1.00 1.00 H new ATOM 0 HE2 LYS A 105 7.591 21.707 -6.783 1.00 1.00 H new ATOM 0 HE3 LYS A 105 6.049 21.686 -7.616 1.00 1.00 H new ATOM 0 HZ1 LYS A 105 5.817 23.414 -6.126 1.00 1.00 H new ATOM 0 HZ2 LYS A 105 5.077 22.139 -5.283 1.00 1.00 H new ATOM 0 HZ3 LYS A 105 6.655 22.620 -4.881 1.00 1.00 H new ATOM 446 N GLU A 106 5.031 18.860 -11.482 1.00 1.00 N ATOM 447 CA GLU A 106 4.688 19.389 -12.805 1.00 1.00 C ATOM 448 C GLU A 106 3.190 19.600 -12.931 1.00 1.00 C ATOM 449 O GLU A 106 2.729 20.629 -13.408 1.00 1.00 O ATOM 450 CB GLU A 106 5.109 18.458 -13.946 1.00 1.00 C ATOM 451 CG GLU A 106 6.532 17.949 -13.805 1.00 1.00 C ATOM 452 CD GLU A 106 7.046 17.344 -15.124 1.00 1.00 C ATOM 453 OE1 GLU A 106 6.833 16.133 -15.372 1.00 1.00 O ATOM 454 OE2 GLU A 106 7.675 18.079 -15.924 1.00 1.00 O ATOM 0 H GLU A 106 5.358 17.894 -11.486 1.00 1.00 H new ATOM 0 HA GLU A 106 5.230 20.331 -12.890 1.00 1.00 H new ATOM 0 HB2 GLU A 106 4.428 17.608 -13.984 1.00 1.00 H new ATOM 0 HB3 GLU A 106 5.011 18.987 -14.894 1.00 1.00 H new ATOM 0 HG2 GLU A 106 7.184 18.767 -13.500 1.00 1.00 H new ATOM 0 HG3 GLU A 106 6.575 17.197 -13.017 1.00 1.00 H new ATOM 461 N TRP A 107 2.416 18.634 -12.447 1.00 1.00 N ATOM 462 CA TRP A 107 0.953 18.737 -12.466 1.00 1.00 C ATOM 463 C TRP A 107 0.430 19.928 -11.647 1.00 1.00 C ATOM 464 O TRP A 107 -0.511 20.609 -12.066 1.00 1.00 O ATOM 465 CB TRP A 107 0.316 17.427 -11.999 1.00 1.00 C ATOM 466 CG TRP A 107 0.555 16.195 -12.816 1.00 1.00 C ATOM 467 CD1 TRP A 107 1.371 16.056 -13.889 1.00 1.00 C ATOM 468 CD2 TRP A 107 -0.034 14.879 -12.599 1.00 1.00 C ATOM 469 NE1 TRP A 107 1.332 14.750 -14.335 1.00 1.00 N ATOM 470 CE2 TRP A 107 0.534 13.971 -13.538 1.00 1.00 C ATOM 471 CE3 TRP A 107 -0.983 14.354 -11.694 1.00 1.00 C ATOM 472 CZ2 TRP A 107 0.246 12.605 -13.536 1.00 1.00 C ATOM 473 CZ3 TRP A 107 -1.333 12.991 -11.733 1.00 1.00 C ATOM 474 CH2 TRP A 107 -0.708 12.113 -12.635 1.00 1.00 C ATOM 0 H TRP A 107 2.772 17.771 -12.037 1.00 1.00 H new ATOM 0 HA TRP A 107 0.661 18.921 -13.500 1.00 1.00 H new ATOM 0 HB2 TRP A 107 0.667 17.228 -10.986 1.00 1.00 H new ATOM 0 HB3 TRP A 107 -0.761 17.583 -11.939 1.00 1.00 H new ATOM 0 HD1 TRP A 107 1.962 16.846 -14.328 1.00 1.00 H new ATOM 0 HE1 TRP A 107 1.834 14.408 -15.154 1.00 1.00 H new ATOM 0 HE3 TRP A 107 -1.444 15.004 -10.965 1.00 1.00 H new ATOM 0 HZ2 TRP A 107 0.751 11.937 -14.219 1.00 1.00 H new ATOM 0 HZ3 TRP A 107 -2.091 12.615 -11.062 1.00 1.00 H new ATOM 0 HH2 TRP A 107 -0.962 11.063 -12.634 1.00 1.00 H new ATOM 485 N LYS A 108 1.082 20.255 -10.523 1.00 1.00 N ATOM 486 CA LYS A 108 0.790 21.485 -9.761 1.00 1.00 C ATOM 487 C LYS A 108 1.127 22.759 -10.543 1.00 1.00 C ATOM 488 O LYS A 108 0.397 23.742 -10.446 1.00 1.00 O ATOM 489 CB LYS A 108 1.568 21.508 -8.443 1.00 1.00 C ATOM 490 CG LYS A 108 1.028 20.459 -7.480 1.00 1.00 C ATOM 491 CD LYS A 108 1.702 20.642 -6.125 1.00 1.00 C ATOM 492 CE LYS A 108 1.228 19.539 -5.187 1.00 1.00 C ATOM 493 NZ LYS A 108 1.711 19.794 -3.813 1.00 1.00 N ATOM 0 H LYS A 108 1.821 19.682 -10.116 1.00 1.00 H new ATOM 0 HA LYS A 108 -0.283 21.470 -9.569 1.00 1.00 H new ATOM 0 HB2 LYS A 108 2.625 21.322 -8.636 1.00 1.00 H new ATOM 0 HB3 LYS A 108 1.496 22.497 -7.990 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -0.053 20.559 -7.380 1.00 1.00 H new ATOM 0 HG3 LYS A 108 1.221 19.458 -7.865 1.00 1.00 H new ATOM 0 HD2 LYS A 108 2.786 20.604 -6.235 1.00 1.00 H new ATOM 0 HD3 LYS A 108 1.457 21.620 -5.711 1.00 1.00 H new ATOM 0 HE2 LYS A 108 0.139 19.489 -5.194 1.00 1.00 H new ATOM 0 HE3 LYS A 108 1.594 18.573 -5.535 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 1.960 18.892 -3.360 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 2.550 20.407 -3.848 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 0.963 20.262 -3.263 1.00 1.00 H new ATOM 507 N ALA A 109 2.210 22.749 -11.326 1.00 1.00 N ATOM 508 CA ALA A 109 2.598 23.873 -12.169 1.00 1.00 C ATOM 509 C ALA A 109 1.575 24.091 -13.296 1.00 1.00 C ATOM 510 O ALA A 109 1.115 25.208 -13.547 1.00 1.00 O ATOM 511 CB ALA A 109 3.976 23.581 -12.780 1.00 1.00 C ATOM 0 H ALA A 109 2.844 21.952 -11.390 1.00 1.00 H new ATOM 0 HA ALA A 109 2.636 24.776 -11.560 1.00 1.00 H new ATOM 0 HB1 ALA A 109 4.277 24.415 -13.413 1.00 1.00 H new ATOM 0 HB2 ALA A 109 4.707 23.448 -11.982 1.00 1.00 H new ATOM 0 HB3 ALA A 109 3.923 22.672 -13.379 1.00 1.00 H new ATOM 517 N LYS A 110 1.234 22.985 -13.968 1.00 1.00 N ATOM 518 CA LYS A 110 0.464 22.948 -15.196 1.00 1.00 C ATOM 519 C LYS A 110 -1.044 23.183 -15.008 1.00 1.00 C ATOM 520 O LYS A 110 -1.667 23.795 -15.878 1.00 1.00 O ATOM 521 CB LYS A 110 0.739 21.618 -15.912 1.00 1.00 C ATOM 522 CG LYS A 110 2.131 21.599 -16.571 1.00 1.00 C ATOM 523 CD LYS A 110 2.454 20.259 -17.249 1.00 1.00 C ATOM 524 CE LYS A 110 1.677 20.048 -18.561 1.00 1.00 C ATOM 525 NZ LYS A 110 2.248 20.832 -19.696 1.00 1.00 N ATOM 0 H LYS A 110 1.504 22.055 -13.648 1.00 1.00 H new ATOM 0 HA LYS A 110 0.794 23.787 -15.809 1.00 1.00 H new ATOM 0 HB2 LYS A 110 0.664 20.798 -15.197 1.00 1.00 H new ATOM 0 HB3 LYS A 110 -0.025 21.449 -16.671 1.00 1.00 H new ATOM 0 HG2 LYS A 110 2.188 22.398 -17.311 1.00 1.00 H new ATOM 0 HG3 LYS A 110 2.888 21.810 -15.815 1.00 1.00 H new ATOM 0 HD2 LYS A 110 3.523 20.210 -17.454 1.00 1.00 H new ATOM 0 HD3 LYS A 110 2.224 19.445 -16.562 1.00 1.00 H new ATOM 0 HE2 LYS A 110 1.683 18.988 -18.816 1.00 1.00 H new ATOM 0 HE3 LYS A 110 0.636 20.335 -18.413 1.00 1.00 H new ATOM 0 HZ1 LYS A 110 1.690 20.655 -20.555 1.00 1.00 H new ATOM 0 HZ2 LYS A 110 2.219 21.846 -19.467 1.00 1.00 H new ATOM 0 HZ3 LYS A 110 3.233 20.541 -19.858 1.00 1.00 H new ATOM 539 N TRP A 111 -1.615 22.744 -13.876 1.00 1.00 N ATOM 540 CA TRP A 111 -3.062 22.830 -13.587 1.00 1.00 C ATOM 541 C TRP A 111 -3.389 23.327 -12.167 1.00 1.00 C ATOM 542 O TRP A 111 -4.179 24.266 -12.035 1.00 1.00 O ATOM 543 CB TRP A 111 -3.737 21.478 -13.868 1.00 1.00 C ATOM 544 CG TRP A 111 -3.574 20.965 -15.272 1.00 1.00 C ATOM 545 CD1 TRP A 111 -4.300 21.347 -16.345 1.00 1.00 C ATOM 546 CD2 TRP A 111 -2.583 20.024 -15.785 1.00 1.00 C ATOM 547 NE1 TRP A 111 -3.823 20.716 -17.481 1.00 1.00 N ATOM 548 CE2 TRP A 111 -2.750 19.898 -17.195 1.00 1.00 C ATOM 549 CE3 TRP A 111 -1.542 19.283 -15.196 1.00 1.00 C ATOM 550 CZ2 TRP A 111 -1.927 19.073 -17.978 1.00 1.00 C ATOM 551 CZ3 TRP A 111 -0.674 18.494 -15.978 1.00 1.00 C ATOM 552 CH2 TRP A 111 -0.881 18.363 -17.362 1.00 1.00 C ATOM 0 H TRP A 111 -1.080 22.312 -13.122 1.00 1.00 H new ATOM 0 HA TRP A 111 -3.466 23.588 -14.258 1.00 1.00 H new ATOM 0 HB2 TRP A 111 -3.334 20.737 -13.178 1.00 1.00 H new ATOM 0 HB3 TRP A 111 -4.801 21.569 -13.652 1.00 1.00 H new ATOM 0 HD1 TRP A 111 -5.128 22.040 -16.320 1.00 1.00 H new ATOM 0 HE1 TRP A 111 -4.216 20.841 -18.414 1.00 1.00 H new ATOM 0 HE3 TRP A 111 -1.405 19.319 -14.125 1.00 1.00 H new ATOM 0 HZ2 TRP A 111 -2.095 18.985 -19.041 1.00 1.00 H new ATOM 0 HZ3 TRP A 111 0.156 17.986 -15.510 1.00 1.00 H new ATOM 0 HH2 TRP A 111 -0.241 17.721 -17.949 1.00 1.00 H new ATOM 563 N GLY A 112 -2.782 22.759 -11.114 1.00 1.00 N ATOM 564 CA GLY A 112 -2.856 23.298 -9.738 1.00 1.00 C ATOM 565 C GLY A 112 -2.945 22.246 -8.624 1.00 1.00 C ATOM 566 O GLY A 112 -3.471 21.160 -8.856 1.00 1.00 O ATOM 0 H GLY A 112 -2.223 21.909 -11.188 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -1.977 23.917 -9.561 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -3.726 23.951 -9.668 1.00 1.00 H new ATOM 570 N PRO A 113 -2.493 22.544 -7.389 1.00 1.00 N ATOM 571 CA PRO A 113 -2.531 21.596 -6.266 1.00 1.00 C ATOM 572 C PRO A 113 -3.943 21.152 -5.861 1.00 1.00 C ATOM 573 O PRO A 113 -4.138 19.997 -5.495 1.00 1.00 O ATOM 574 CB PRO A 113 -1.798 22.282 -5.110 1.00 1.00 C ATOM 575 CG PRO A 113 -1.842 23.767 -5.459 1.00 1.00 C ATOM 576 CD PRO A 113 -1.853 23.790 -6.983 1.00 1.00 C ATOM 0 HA PRO A 113 -2.049 20.664 -6.562 1.00 1.00 H new ATOM 0 HB2 PRO A 113 -2.287 22.084 -4.156 1.00 1.00 H new ATOM 0 HB3 PRO A 113 -0.772 21.925 -5.023 1.00 1.00 H new ATOM 0 HG2 PRO A 113 -2.729 24.247 -5.047 1.00 1.00 H new ATOM 0 HG3 PRO A 113 -0.978 24.297 -5.058 1.00 1.00 H new ATOM 0 HD2 PRO A 113 -2.403 24.653 -7.358 1.00 1.00 H new ATOM 0 HD3 PRO A 113 -0.841 23.859 -7.381 1.00 1.00 H new ATOM 584 N GLU A 114 -4.940 22.031 -5.988 1.00 1.00 N ATOM 585 CA GLU A 114 -6.347 21.718 -5.692 1.00 1.00 C ATOM 586 C GLU A 114 -6.874 20.630 -6.628 1.00 1.00 C ATOM 587 O GLU A 114 -7.484 19.648 -6.208 1.00 1.00 O ATOM 588 CB GLU A 114 -7.217 22.963 -5.886 1.00 1.00 C ATOM 589 CG GLU A 114 -6.647 24.225 -5.238 1.00 1.00 C ATOM 590 CD GLU A 114 -7.670 25.379 -5.265 1.00 1.00 C ATOM 591 OE1 GLU A 114 -7.715 26.137 -6.267 1.00 1.00 O ATOM 592 OE2 GLU A 114 -8.440 25.537 -4.285 1.00 1.00 O ATOM 0 H GLU A 114 -4.796 22.991 -6.302 1.00 1.00 H new ATOM 0 HA GLU A 114 -6.395 21.373 -4.659 1.00 1.00 H new ATOM 0 HB2 GLU A 114 -7.346 23.141 -6.954 1.00 1.00 H new ATOM 0 HB3 GLU A 114 -8.207 22.770 -5.473 1.00 1.00 H new ATOM 0 HG2 GLU A 114 -6.364 24.011 -4.207 1.00 1.00 H new ATOM 0 HG3 GLU A 114 -5.740 24.528 -5.762 1.00 1.00 H new ATOM 599 N ALA A 115 -6.580 20.822 -7.916 1.00 1.00 N ATOM 600 CA ALA A 115 -6.906 19.900 -8.995 1.00 1.00 C ATOM 601 C ALA A 115 -6.267 18.537 -8.730 1.00 1.00 C ATOM 602 O ALA A 115 -6.932 17.507 -8.659 1.00 1.00 O ATOM 603 CB ALA A 115 -6.382 20.485 -10.311 1.00 1.00 C ATOM 0 H ALA A 115 -6.091 21.655 -8.243 1.00 1.00 H new ATOM 0 HA ALA A 115 -7.986 19.765 -9.056 1.00 1.00 H new ATOM 0 HB1 ALA A 115 -6.618 19.806 -11.130 1.00 1.00 H new ATOM 0 HB2 ALA A 115 -6.853 21.451 -10.493 1.00 1.00 H new ATOM 0 HB3 ALA A 115 -5.302 20.615 -10.247 1.00 1.00 H new ATOM 609 N VAL A 116 -4.954 18.581 -8.503 1.00 1.00 N ATOM 610 CA VAL A 116 -4.085 17.437 -8.300 1.00 1.00 C ATOM 611 C VAL A 116 -4.552 16.569 -7.130 1.00 1.00 C ATOM 612 O VAL A 116 -4.716 15.361 -7.286 1.00 1.00 O ATOM 613 CB VAL A 116 -2.648 17.957 -8.147 1.00 1.00 C ATOM 614 CG1 VAL A 116 -1.653 16.953 -7.568 1.00 1.00 C ATOM 615 CG2 VAL A 116 -2.147 18.400 -9.526 1.00 1.00 C ATOM 0 H VAL A 116 -4.448 19.465 -8.455 1.00 1.00 H new ATOM 0 HA VAL A 116 -4.122 16.771 -9.162 1.00 1.00 H new ATOM 0 HB VAL A 116 -2.697 18.775 -7.429 1.00 1.00 H new ATOM 0 HG11 VAL A 116 -0.668 17.415 -7.500 1.00 1.00 H new ATOM 0 HG12 VAL A 116 -1.980 16.648 -6.574 1.00 1.00 H new ATOM 0 HG13 VAL A 116 -1.599 16.079 -8.216 1.00 1.00 H new ATOM 0 HG21 VAL A 116 -1.127 18.773 -9.440 1.00 1.00 H new ATOM 0 HG22 VAL A 116 -2.166 17.552 -10.210 1.00 1.00 H new ATOM 0 HG23 VAL A 116 -2.791 19.191 -9.910 1.00 1.00 H new ATOM 625 N GLU A 117 -4.849 17.179 -5.980 1.00 1.00 N ATOM 626 CA GLU A 117 -5.418 16.476 -4.824 1.00 1.00 C ATOM 627 C GLU A 117 -6.838 15.950 -5.097 1.00 1.00 C ATOM 628 O GLU A 117 -7.193 14.862 -4.636 1.00 1.00 O ATOM 629 CB GLU A 117 -5.475 17.428 -3.620 1.00 1.00 C ATOM 630 CG GLU A 117 -4.111 17.632 -2.951 1.00 1.00 C ATOM 631 CD GLU A 117 -3.854 16.506 -1.917 1.00 1.00 C ATOM 632 OE1 GLU A 117 -3.422 15.387 -2.286 1.00 1.00 O ATOM 633 OE2 GLU A 117 -4.183 16.683 -0.719 1.00 1.00 O ATOM 0 H GLU A 117 -4.702 18.176 -5.822 1.00 1.00 H new ATOM 0 HA GLU A 117 -4.772 15.622 -4.620 1.00 1.00 H new ATOM 0 HB2 GLU A 117 -5.862 18.394 -3.946 1.00 1.00 H new ATOM 0 HB3 GLU A 117 -6.178 17.034 -2.886 1.00 1.00 H new ATOM 0 HG2 GLU A 117 -3.323 17.632 -3.705 1.00 1.00 H new ATOM 0 HG3 GLU A 117 -4.080 18.604 -2.458 1.00 1.00 H new ATOM 640 N SER A 118 -7.649 16.690 -5.859 1.00 1.00 N ATOM 641 CA SER A 118 -9.022 16.281 -6.203 1.00 1.00 C ATOM 642 C SER A 118 -9.060 15.048 -7.115 1.00 1.00 C ATOM 643 O SER A 118 -9.987 14.237 -7.020 1.00 1.00 O ATOM 644 CB SER A 118 -9.816 17.415 -6.868 1.00 1.00 C ATOM 645 OG SER A 118 -9.929 18.536 -6.007 1.00 1.00 O ATOM 0 H SER A 118 -7.376 17.589 -6.256 1.00 1.00 H new ATOM 0 HA SER A 118 -9.489 16.027 -5.252 1.00 1.00 H new ATOM 0 HB2 SER A 118 -9.324 17.713 -7.794 1.00 1.00 H new ATOM 0 HB3 SER A 118 -10.810 17.058 -7.136 1.00 1.00 H new ATOM 0 HG SER A 118 -9.153 19.122 -6.129 1.00 1.00 H new ATOM 651 N TRP A 119 -8.043 14.871 -7.963 1.00 1.00 N ATOM 652 CA TRP A 119 -7.863 13.678 -8.795 1.00 1.00 C ATOM 653 C TRP A 119 -7.363 12.443 -8.014 1.00 1.00 C ATOM 654 O TRP A 119 -7.305 11.353 -8.589 1.00 1.00 O ATOM 655 CB TRP A 119 -6.862 13.961 -9.923 1.00 1.00 C ATOM 656 CG TRP A 119 -7.043 15.170 -10.802 1.00 1.00 C ATOM 657 CD1 TRP A 119 -8.204 15.810 -11.076 1.00 1.00 C ATOM 658 CD2 TRP A 119 -6.011 15.879 -11.560 1.00 1.00 C ATOM 659 NE1 TRP A 119 -7.955 16.887 -11.909 1.00 1.00 N ATOM 660 CE2 TRP A 119 -6.618 16.977 -12.240 1.00 1.00 C ATOM 661 CE3 TRP A 119 -4.623 15.693 -11.755 1.00 1.00 C ATOM 662 CZ2 TRP A 119 -5.885 17.861 -13.046 1.00 1.00 C ATOM 663 CZ3 TRP A 119 -3.881 16.565 -12.578 1.00 1.00 C ATOM 664 CH2 TRP A 119 -4.507 17.649 -13.216 1.00 1.00 C ATOM 0 H TRP A 119 -7.308 15.566 -8.093 1.00 1.00 H new ATOM 0 HA TRP A 119 -8.853 13.447 -9.188 1.00 1.00 H new ATOM 0 HB2 TRP A 119 -5.874 14.035 -9.469 1.00 1.00 H new ATOM 0 HB3 TRP A 119 -6.850 13.086 -10.573 1.00 1.00 H new ATOM 0 HD1 TRP A 119 -9.176 15.524 -10.702 1.00 1.00 H new ATOM 0 HE1 TRP A 119 -8.671 17.534 -12.238 1.00 1.00 H new ATOM 0 HE3 TRP A 119 -4.123 14.870 -11.266 1.00 1.00 H new ATOM 0 HZ2 TRP A 119 -6.374 18.694 -13.529 1.00 1.00 H new ATOM 0 HZ3 TRP A 119 -2.823 16.398 -12.719 1.00 1.00 H new ATOM 0 HH2 TRP A 119 -3.929 18.318 -13.836 1.00 1.00 H new ATOM 675 N ALA A 120 -6.945 12.579 -6.746 1.00 1.00 N ATOM 676 CA ALA A 120 -6.310 11.506 -6.005 1.00 1.00 C ATOM 677 C ALA A 120 -7.251 10.356 -5.606 1.00 1.00 C ATOM 678 O ALA A 120 -8.483 10.419 -5.643 1.00 1.00 O ATOM 679 CB ALA A 120 -5.573 12.051 -4.773 1.00 1.00 C ATOM 0 H ALA A 120 -7.044 13.444 -6.214 1.00 1.00 H new ATOM 0 HA ALA A 120 -5.592 11.068 -6.699 1.00 1.00 H new ATOM 0 HB1 ALA A 120 -5.105 11.227 -4.235 1.00 1.00 H new ATOM 0 HB2 ALA A 120 -4.807 12.758 -5.091 1.00 1.00 H new ATOM 0 HB3 ALA A 120 -6.283 12.556 -4.118 1.00 1.00 H new ATOM 685 N THR A 121 -6.574 9.316 -5.152 1.00 1.00 N ATOM 686 CA THR A 121 -7.046 7.999 -4.713 1.00 1.00 C ATOM 687 C THR A 121 -6.204 7.580 -3.515 1.00 1.00 C ATOM 688 O THR A 121 -4.999 7.796 -3.517 1.00 1.00 O ATOM 689 CB THR A 121 -6.825 6.993 -5.845 1.00 1.00 C ATOM 690 OG1 THR A 121 -7.487 7.387 -7.033 1.00 1.00 O ATOM 691 CG2 THR A 121 -7.348 5.615 -5.449 1.00 1.00 C ATOM 0 H THR A 121 -5.559 9.374 -5.070 1.00 1.00 H new ATOM 0 HA THR A 121 -8.103 8.035 -4.451 1.00 1.00 H new ATOM 0 HB THR A 121 -5.751 6.956 -6.025 1.00 1.00 H new ATOM 0 HG1 THR A 121 -7.323 6.723 -7.735 1.00 1.00 H new ATOM 0 HG21 THR A 121 -7.182 4.914 -6.267 1.00 1.00 H new ATOM 0 HG22 THR A 121 -6.821 5.267 -4.560 1.00 1.00 H new ATOM 0 HG23 THR A 121 -8.415 5.678 -5.237 1.00 1.00 H new ATOM 699 N LEU A 122 -6.805 6.952 -2.511 1.00 1.00 N ATOM 700 CA LEU A 122 -6.137 6.584 -1.259 1.00 1.00 C ATOM 701 C LEU A 122 -5.859 5.079 -1.243 1.00 1.00 C ATOM 702 O LEU A 122 -6.771 4.260 -1.370 1.00 1.00 O ATOM 703 CB LEU A 122 -7.005 7.070 -0.084 1.00 1.00 C ATOM 704 CG LEU A 122 -6.225 7.296 1.224 1.00 1.00 C ATOM 705 CD1 LEU A 122 -7.163 7.892 2.276 1.00 1.00 C ATOM 706 CD2 LEU A 122 -5.602 6.022 1.794 1.00 1.00 C ATOM 0 H LEU A 122 -7.787 6.678 -2.540 1.00 1.00 H new ATOM 0 HA LEU A 122 -5.165 7.068 -1.166 1.00 1.00 H new ATOM 0 HB2 LEU A 122 -7.493 8.002 -0.369 1.00 1.00 H new ATOM 0 HB3 LEU A 122 -7.793 6.339 0.098 1.00 1.00 H new ATOM 0 HG LEU A 122 -5.407 7.975 0.982 1.00 1.00 H new ATOM 0 HD11 LEU A 122 -6.614 8.053 3.204 1.00 1.00 H new ATOM 0 HD12 LEU A 122 -7.555 8.843 1.916 1.00 1.00 H new ATOM 0 HD13 LEU A 122 -7.989 7.205 2.458 1.00 1.00 H new ATOM 0 HD21 LEU A 122 -5.069 6.258 2.715 1.00 1.00 H new ATOM 0 HD22 LEU A 122 -6.387 5.296 2.005 1.00 1.00 H new ATOM 0 HD23 LEU A 122 -4.905 5.602 1.069 1.00 1.00 H new ATOM 718 N LEU A 123 -4.579 4.737 -1.103 1.00 1.00 N ATOM 719 CA LEU A 123 -4.031 3.385 -1.170 1.00 1.00 C ATOM 720 C LEU A 123 -3.335 3.009 0.148 1.00 1.00 C ATOM 721 O LEU A 123 -2.420 3.685 0.618 1.00 1.00 O ATOM 722 CB LEU A 123 -3.068 3.310 -2.373 1.00 1.00 C ATOM 723 CG LEU A 123 -3.719 3.614 -3.730 1.00 1.00 C ATOM 724 CD1 LEU A 123 -2.656 3.456 -4.813 1.00 1.00 C ATOM 725 CD2 LEU A 123 -4.873 2.667 -4.066 1.00 1.00 C ATOM 0 H LEU A 123 -3.857 5.436 -0.930 1.00 1.00 H new ATOM 0 HA LEU A 123 -4.834 2.661 -1.311 1.00 1.00 H new ATOM 0 HB2 LEU A 123 -2.250 4.012 -2.212 1.00 1.00 H new ATOM 0 HB3 LEU A 123 -2.630 2.313 -2.410 1.00 1.00 H new ATOM 0 HG LEU A 123 -4.122 4.626 -3.680 1.00 1.00 H new ATOM 0 HD11 LEU A 123 -3.096 3.667 -5.788 1.00 1.00 H new ATOM 0 HD12 LEU A 123 -1.839 4.152 -4.625 1.00 1.00 H new ATOM 0 HD13 LEU A 123 -2.273 2.435 -4.801 1.00 1.00 H new ATOM 0 HD21 LEU A 123 -5.291 2.933 -5.037 1.00 1.00 H new ATOM 0 HD22 LEU A 123 -4.505 1.642 -4.099 1.00 1.00 H new ATOM 0 HD23 LEU A 123 -5.646 2.751 -3.302 1.00 1.00 H new ATOM 737 N GLY A 124 -3.790 1.902 0.735 1.00 1.00 N ATOM 738 CA GLY A 124 -3.336 1.430 2.052 1.00 1.00 C ATOM 739 C GLY A 124 -1.933 0.800 2.074 1.00 1.00 C ATOM 740 O GLY A 124 -1.321 0.713 3.142 1.00 1.00 O ATOM 0 H GLY A 124 -4.492 1.298 0.308 1.00 1.00 H new ATOM 0 HA2 GLY A 124 -3.350 2.270 2.746 1.00 1.00 H new ATOM 0 HA3 GLY A 124 -4.052 0.697 2.424 1.00 1.00 H new ATOM 744 N HIS A 125 -1.422 0.372 0.911 1.00 1.00 N ATOM 745 CA HIS A 125 -0.093 -0.229 0.718 1.00 1.00 C ATOM 746 C HIS A 125 0.450 0.004 -0.708 1.00 1.00 C ATOM 747 O HIS A 125 1.666 0.270 -0.845 1.00 1.00 O ATOM 748 CB HIS A 125 -0.133 -1.731 1.073 1.00 1.00 C ATOM 749 CG HIS A 125 -1.186 -2.558 0.368 1.00 1.00 C ATOM 750 ND1 HIS A 125 -1.607 -2.411 -0.940 1.00 1.00 N ATOM 751 CD2 HIS A 125 -1.881 -3.606 0.906 1.00 1.00 C ATOM 752 CE1 HIS A 125 -2.545 -3.346 -1.197 1.00 1.00 C ATOM 753 NE2 HIS A 125 -2.727 -4.085 -0.082 1.00 1.00 N ATOM 0 H HIS A 125 -1.947 0.438 0.039 1.00 1.00 H new ATOM 0 HA HIS A 125 0.602 0.268 1.395 1.00 1.00 H new ATOM 0 HB2 HIS A 125 0.844 -2.161 0.853 1.00 1.00 H new ATOM 0 HB3 HIS A 125 -0.287 -1.825 2.148 1.00 1.00 H new ATOM 0 HD2 HIS A 125 -1.788 -3.988 1.912 1.00 1.00 H new ATOM 0 HE1 HIS A 125 -3.062 -3.480 -2.135 1.00 1.00 H new ATOM 0 HE2 HIS A 125 -3.377 -4.864 0.017 1.00 1.00 H new TER 762 HIS A 125 ATOM 763 O5' DC B 1 -3.115 28.335 6.194 1.00 1.00 O ATOM 764 C5' DC B 1 -3.325 29.460 7.054 1.00 1.00 C ATOM 765 C4' DC B 1 -2.654 29.335 8.436 1.00 1.00 C ATOM 766 O4' DC B 1 -3.289 28.328 9.220 1.00 1.00 O ATOM 767 C3' DC B 1 -1.157 29.013 8.326 1.00 1.00 C ATOM 768 O3' DC B 1 -0.396 29.892 9.161 1.00 1.00 O ATOM 769 C2' DC B 1 -1.094 27.548 8.741 1.00 1.00 C ATOM 770 C1' DC B 1 -2.324 27.373 9.631 1.00 1.00 C ATOM 771 N1 DC B 1 -2.919 26.019 9.556 1.00 1.00 N ATOM 772 C2 DC B 1 -3.229 25.305 10.721 1.00 1.00 C ATOM 773 O2 DC B 1 -2.962 25.738 11.845 1.00 1.00 O ATOM 774 N3 DC B 1 -3.840 24.096 10.653 1.00 1.00 N ATOM 775 C4 DC B 1 -4.094 23.594 9.459 1.00 1.00 C ATOM 776 N4 DC B 1 -4.708 22.444 9.449 1.00 1.00 N ATOM 777 C5 DC B 1 -3.788 24.266 8.242 1.00 1.00 C ATOM 778 C6 DC B 1 -3.210 25.481 8.339 1.00 1.00 C ATOM 0 H5' DC B 1 -4.397 29.600 7.195 1.00 1.00 H new ATOM 0 H5'' DC B 1 -2.949 30.356 6.560 1.00 1.00 H new ATOM 0 H4' DC B 1 -2.764 30.305 8.922 1.00 1.00 H new ATOM 0 H3' DC B 1 -0.727 29.160 7.335 1.00 1.00 H new ATOM 0 H2' DC B 1 -1.127 26.885 7.877 1.00 1.00 H new ATOM 0 H2'' DC B 1 -0.174 27.323 9.280 1.00 1.00 H new ATOM 0 HO5' DC B 1 -3.571 28.487 5.340 1.00 1.00 H new ATOM 0 H1' DC B 1 -2.013 27.515 10.666 1.00 1.00 H new ATOM 0 H41 DC B 1 -4.937 21.996 8.562 1.00 1.00 H new ATOM 0 H42 DC B 1 -4.959 21.993 10.328 1.00 1.00 H new ATOM 0 H5 DC B 1 -4.009 23.822 7.282 1.00 1.00 H new ATOM 0 H6 DC B 1 -2.975 26.034 7.441 1.00 1.00 H new ATOM 791 P DG B 2 1.229 29.858 9.230 1.00 1.00 P ATOM 792 OP1 DG B 2 1.687 31.216 9.639 1.00 1.00 O ATOM 793 OP2 DG B 2 1.752 29.294 7.953 1.00 1.00 O ATOM 794 O5' DG B 2 1.566 28.812 10.429 1.00 1.00 O ATOM 795 C5' DG B 2 1.306 29.141 11.795 1.00 1.00 C ATOM 796 C4' DG B 2 1.769 28.075 12.811 1.00 1.00 C ATOM 797 O4' DG B 2 0.868 26.966 12.854 1.00 1.00 O ATOM 798 C3' DG B 2 3.185 27.539 12.525 1.00 1.00 C ATOM 799 O3' DG B 2 3.948 27.506 13.731 1.00 1.00 O ATOM 800 C2' DG B 2 2.864 26.166 11.934 1.00 1.00 C ATOM 801 C1' DG B 2 1.611 25.764 12.709 1.00 1.00 C ATOM 802 N9 DG B 2 0.791 24.755 12.006 1.00 1.00 N ATOM 803 C8 DG B 2 0.430 24.761 10.687 1.00 1.00 C ATOM 804 N7 DG B 2 -0.357 23.781 10.331 1.00 1.00 N ATOM 805 C5 DG B 2 -0.499 23.042 11.514 1.00 1.00 C ATOM 806 C6 DG B 2 -1.230 21.833 11.804 1.00 1.00 C ATOM 807 O6 DG B 2 -1.972 21.175 11.075 1.00 1.00 O ATOM 808 N1 DG B 2 -1.059 21.374 13.092 1.00 1.00 N ATOM 809 C2 DG B 2 -0.312 22.014 14.019 1.00 1.00 C ATOM 810 N2 DG B 2 -0.255 21.460 15.201 1.00 1.00 N ATOM 811 N3 DG B 2 0.355 23.151 13.819 1.00 1.00 N ATOM 812 C4 DG B 2 0.228 23.617 12.538 1.00 1.00 C ATOM 0 H5' DG B 2 0.235 29.302 11.919 1.00 1.00 H new ATOM 0 H5'' DG B 2 1.799 30.085 12.028 1.00 1.00 H new ATOM 0 H4' DG B 2 1.782 28.587 13.773 1.00 1.00 H new ATOM 0 H3' DG B 2 3.804 28.136 11.855 1.00 1.00 H new ATOM 0 H2' DG B 2 2.679 26.218 10.861 1.00 1.00 H new ATOM 0 H2'' DG B 2 3.679 25.458 12.083 1.00 1.00 H new ATOM 0 H1' DG B 2 1.888 25.304 13.658 1.00 1.00 H new ATOM 0 H8 DG B 2 0.769 25.517 9.994 1.00 1.00 H new ATOM 0 H1 DG B 2 -1.521 20.505 13.360 1.00 1.00 H new ATOM 0 H21 DG B 2 0.293 21.896 15.943 1.00 1.00 H new ATOM 0 H22 DG B 2 -0.758 20.592 15.382 1.00 1.00 H new ATOM 824 P DC B 3 5.502 27.031 13.788 1.00 1.00 P ATOM 825 OP1 DC B 3 6.179 27.818 14.859 1.00 1.00 O ATOM 826 OP2 DC B 3 6.077 27.060 12.415 1.00 1.00 O ATOM 827 O5' DC B 3 5.400 25.483 14.267 1.00 1.00 O ATOM 828 C5' DC B 3 4.960 25.162 15.585 1.00 1.00 C ATOM 829 C4' DC B 3 4.819 23.653 15.848 1.00 1.00 C ATOM 830 O4' DC B 3 3.748 23.131 15.074 1.00 1.00 O ATOM 831 C3' DC B 3 6.099 22.849 15.547 1.00 1.00 C ATOM 832 O3' DC B 3 6.629 22.298 16.755 1.00 1.00 O ATOM 833 C2' DC B 3 5.631 21.779 14.554 1.00 1.00 C ATOM 834 C1' DC B 3 4.104 21.850 14.592 1.00 1.00 C ATOM 835 N1 DC B 3 3.489 21.654 13.257 1.00 1.00 N ATOM 836 C2 DC B 3 2.628 20.574 13.035 1.00 1.00 C ATOM 837 O2 DC B 3 2.404 19.722 13.895 1.00 1.00 O ATOM 838 N3 DC B 3 2.005 20.419 11.843 1.00 1.00 N ATOM 839 C4 DC B 3 2.252 21.295 10.895 1.00 1.00 C ATOM 840 N4 DC B 3 1.609 21.097 9.779 1.00 1.00 N ATOM 841 C5 DC B 3 3.136 22.403 11.046 1.00 1.00 C ATOM 842 C6 DC B 3 3.740 22.548 12.253 1.00 1.00 C ATOM 0 H5' DC B 3 3.998 25.643 15.763 1.00 1.00 H new ATOM 0 H5'' DC B 3 5.664 25.581 16.304 1.00 1.00 H new ATOM 0 H4' DC B 3 4.622 23.545 16.915 1.00 1.00 H new ATOM 0 H3' DC B 3 6.911 23.445 15.130 1.00 1.00 H new ATOM 0 H2' DC B 3 6.011 21.977 13.552 1.00 1.00 H new ATOM 0 H2'' DC B 3 5.988 20.790 14.841 1.00 1.00 H new ATOM 0 H1' DC B 3 3.738 21.050 15.235 1.00 1.00 H new ATOM 0 H41 DC B 3 1.745 21.732 8.993 1.00 1.00 H new ATOM 0 H42 DC B 3 0.970 20.307 9.692 1.00 1.00 H new ATOM 0 H5 DC B 3 3.317 23.095 10.237 1.00 1.00 H new ATOM 0 H6 DC B 3 4.420 23.370 12.421 1.00 1.00 H new ATOM 854 P DA B 4 8.073 21.551 16.825 1.00 1.00 P ATOM 855 OP1 DA B 4 8.499 21.534 18.254 1.00 1.00 O ATOM 856 OP2 DA B 4 8.988 22.169 15.823 1.00 1.00 O ATOM 857 O5' DA B 4 7.765 20.026 16.363 1.00 1.00 O ATOM 858 C5' DA B 4 6.922 19.181 17.142 1.00 1.00 C ATOM 859 C4' DA B 4 6.574 17.847 16.459 1.00 1.00 C ATOM 860 O4' DA B 4 5.635 18.022 15.403 1.00 1.00 O ATOM 861 C3' DA B 4 7.799 17.091 15.904 1.00 1.00 C ATOM 862 O3' DA B 4 7.888 15.797 16.500 1.00 1.00 O ATOM 863 C2' DA B 4 7.509 17.085 14.404 1.00 1.00 C ATOM 864 C1' DA B 4 5.985 17.134 14.358 1.00 1.00 C ATOM 865 N9 DA B 4 5.480 17.663 13.079 1.00 1.00 N ATOM 866 C8 DA B 4 5.874 18.816 12.462 1.00 1.00 C ATOM 867 N7 DA B 4 5.214 19.109 11.372 1.00 1.00 N ATOM 868 C5 DA B 4 4.345 18.012 11.243 1.00 1.00 C ATOM 869 C6 DA B 4 3.368 17.616 10.296 1.00 1.00 C ATOM 870 N6 DA B 4 3.022 18.325 9.238 1.00 1.00 N ATOM 871 N1 DA B 4 2.727 16.450 10.399 1.00 1.00 N ATOM 872 C2 DA B 4 3.013 15.679 11.440 1.00 1.00 C ATOM 873 N3 DA B 4 3.880 15.918 12.419 1.00 1.00 N ATOM 874 C4 DA B 4 4.520 17.112 12.261 1.00 1.00 C ATOM 0 H5' DA B 4 5.998 19.714 17.368 1.00 1.00 H new ATOM 0 H5'' DA B 4 7.411 18.974 18.094 1.00 1.00 H new ATOM 0 H4' DA B 4 6.138 17.242 17.254 1.00 1.00 H new ATOM 0 H3' DA B 4 8.771 17.534 16.120 1.00 1.00 H new ATOM 0 H2' DA B 4 7.957 17.942 13.901 1.00 1.00 H new ATOM 0 H2'' DA B 4 7.900 16.191 13.919 1.00 1.00 H new ATOM 0 H1' DA B 4 5.558 16.137 14.462 1.00 1.00 H new ATOM 0 H8 DA B 4 6.670 19.438 12.845 1.00 1.00 H new ATOM 0 H61 DA B 4 2.309 17.973 8.600 1.00 1.00 H new ATOM 0 H62 DA B 4 3.468 19.225 9.059 1.00 1.00 H new ATOM 0 H2 DA B 4 2.476 14.744 11.499 1.00 1.00 H new ATOM 886 P DT B 5 9.187 14.833 16.322 1.00 1.00 P ATOM 887 OP1 DT B 5 9.278 13.959 17.526 1.00 1.00 O ATOM 888 OP2 DT B 5 10.374 15.662 15.968 1.00 1.00 O ATOM 889 O5' DT B 5 8.807 13.914 15.043 1.00 1.00 O ATOM 890 C5' DT B 5 7.786 12.924 15.128 1.00 1.00 C ATOM 891 C4' DT B 5 7.408 12.330 13.762 1.00 1.00 C ATOM 892 O4' DT B 5 6.767 13.321 12.969 1.00 1.00 O ATOM 893 C3' DT B 5 8.603 11.764 12.974 1.00 1.00 C ATOM 894 O3' DT B 5 8.461 10.365 12.752 1.00 1.00 O ATOM 895 C2' DT B 5 8.571 12.578 11.682 1.00 1.00 C ATOM 896 C1' DT B 5 7.126 13.084 11.626 1.00 1.00 C ATOM 897 N1 DT B 5 6.934 14.325 10.823 1.00 1.00 N ATOM 898 C2 DT B 5 5.883 14.356 9.894 1.00 1.00 C ATOM 899 O2 DT B 5 5.091 13.427 9.728 1.00 1.00 O ATOM 900 N3 DT B 5 5.758 15.491 9.128 1.00 1.00 N ATOM 901 C4 DT B 5 6.550 16.613 9.227 1.00 1.00 C ATOM 902 O4 DT B 5 6.294 17.578 8.512 1.00 1.00 O ATOM 903 C5 DT B 5 7.625 16.520 10.211 1.00 1.00 C ATOM 904 C7 DT B 5 8.607 17.663 10.382 1.00 1.00 C ATOM 905 C6 DT B 5 7.777 15.407 10.971 1.00 1.00 C ATOM 0 H5' DT B 5 6.899 13.363 15.585 1.00 1.00 H new ATOM 0 H5'' DT B 5 8.120 12.122 15.787 1.00 1.00 H new ATOM 0 H4' DT B 5 6.741 11.494 13.973 1.00 1.00 H new ATOM 0 H3' DT B 5 9.557 11.851 13.495 1.00 1.00 H new ATOM 0 H2' DT B 5 9.286 13.401 11.706 1.00 1.00 H new ATOM 0 H2'' DT B 5 8.818 11.967 10.814 1.00 1.00 H new ATOM 0 H1' DT B 5 6.505 12.340 11.127 1.00 1.00 H new ATOM 0 H3 DT B 5 5.016 15.503 8.428 1.00 1.00 H new ATOM 0 H71 DT B 5 8.958 17.690 11.414 1.00 1.00 H new ATOM 0 H72 DT B 5 9.456 17.517 9.714 1.00 1.00 H new ATOM 0 H73 DT B 5 8.114 18.605 10.142 1.00 1.00 H new ATOM 0 H6 DT B 5 8.570 15.367 11.703 1.00 1.00 H new ATOM 918 P DA B 6 9.648 9.466 12.091 1.00 1.00 P ATOM 919 OP1 DA B 6 9.619 8.126 12.740 1.00 1.00 O ATOM 920 OP2 DA B 6 10.925 10.232 12.118 1.00 1.00 O ATOM 921 O5' DA B 6 9.194 9.304 10.540 1.00 1.00 O ATOM 922 C5' DA B 6 8.071 8.497 10.193 1.00 1.00 C ATOM 923 C4' DA B 6 7.807 8.397 8.684 1.00 1.00 C ATOM 924 O4' DA B 6 7.327 9.643 8.180 1.00 1.00 O ATOM 925 C3' DA B 6 9.023 7.961 7.854 1.00 1.00 C ATOM 926 O3' DA B 6 8.593 6.956 6.938 1.00 1.00 O ATOM 927 C2' DA B 6 9.466 9.288 7.237 1.00 1.00 C ATOM 928 C1' DA B 6 8.185 10.115 7.152 1.00 1.00 C ATOM 929 N9 DA B 6 8.418 11.566 7.330 1.00 1.00 N ATOM 930 C8 DA B 6 9.331 12.183 8.148 1.00 1.00 C ATOM 931 N7 DA B 6 9.379 13.484 8.035 1.00 1.00 N ATOM 932 C5 DA B 6 8.422 13.739 7.047 1.00 1.00 C ATOM 933 C6 DA B 6 7.964 14.900 6.380 1.00 1.00 C ATOM 934 N6 DA B 6 8.432 16.116 6.594 1.00 1.00 N ATOM 935 N1 DA B 6 7.014 14.837 5.449 1.00 1.00 N ATOM 936 C2 DA B 6 6.503 13.646 5.162 1.00 1.00 C ATOM 937 N3 DA B 6 6.826 12.473 5.697 1.00 1.00 N ATOM 938 C4 DA B 6 7.809 12.584 6.632 1.00 1.00 C ATOM 0 H5' DA B 6 7.183 8.902 10.679 1.00 1.00 H new ATOM 0 H5'' DA B 6 8.223 7.494 10.591 1.00 1.00 H new ATOM 0 H4' DA B 6 7.056 7.614 8.577 1.00 1.00 H new ATOM 0 H3' DA B 6 9.858 7.497 8.379 1.00 1.00 H new ATOM 0 H2' DA B 6 10.217 9.782 7.854 1.00 1.00 H new ATOM 0 H2'' DA B 6 9.909 9.140 6.252 1.00 1.00 H new ATOM 0 H1' DA B 6 7.752 9.998 6.158 1.00 1.00 H new ATOM 0 H8 DA B 6 9.962 11.635 8.833 1.00 1.00 H new ATOM 0 H61 DA B 6 8.052 16.907 6.074 1.00 1.00 H new ATOM 0 H62 DA B 6 9.173 16.264 7.279 1.00 1.00 H new ATOM 0 H2 DA B 6 5.734 13.628 4.404 1.00 1.00 H new ATOM 950 P DT B 7 9.505 6.383 5.723 1.00 1.00 P ATOM 951 OP1 DT B 7 9.026 5.008 5.394 1.00 1.00 O ATOM 952 OP2 DT B 7 10.949 6.580 6.037 1.00 1.00 O ATOM 953 O5' DT B 7 9.079 7.383 4.522 1.00 1.00 O ATOM 954 C5' DT B 7 7.715 7.480 4.132 1.00 1.00 C ATOM 955 C4' DT B 7 7.434 8.617 3.146 1.00 1.00 C ATOM 956 O4' DT B 7 7.741 9.878 3.726 1.00 1.00 O ATOM 957 C3' DT B 7 8.209 8.485 1.828 1.00 1.00 C ATOM 958 O3' DT B 7 7.306 8.667 0.747 1.00 1.00 O ATOM 959 C2' DT B 7 9.207 9.629 1.941 1.00 1.00 C ATOM 960 C1' DT B 7 8.393 10.645 2.733 1.00 1.00 C ATOM 961 N1 DT B 7 9.231 11.697 3.354 1.00 1.00 N ATOM 962 C2 DT B 7 8.999 13.031 3.000 1.00 1.00 C ATOM 963 O2 DT B 7 8.191 13.395 2.147 1.00 1.00 O ATOM 964 N3 DT B 7 9.753 13.975 3.650 1.00 1.00 N ATOM 965 C4 DT B 7 10.757 13.726 4.551 1.00 1.00 C ATOM 966 O4 DT B 7 11.362 14.690 5.019 1.00 1.00 O ATOM 967 C5 DT B 7 10.991 12.310 4.836 1.00 1.00 C ATOM 968 C7 DT B 7 12.095 11.898 5.794 1.00 1.00 C ATOM 969 C6 DT B 7 10.234 11.354 4.234 1.00 1.00 C ATOM 0 H5' DT B 7 7.102 7.623 5.022 1.00 1.00 H new ATOM 0 H5'' DT B 7 7.408 6.536 3.681 1.00 1.00 H new ATOM 0 H4' DT B 7 6.370 8.548 2.919 1.00 1.00 H new ATOM 0 H3' DT B 7 8.692 7.523 1.657 1.00 1.00 H new ATOM 0 H2' DT B 7 10.117 9.333 2.462 1.00 1.00 H new ATOM 0 H2'' DT B 7 9.508 10.012 0.966 1.00 1.00 H new ATOM 0 H1' DT B 7 7.703 11.184 2.083 1.00 1.00 H new ATOM 0 H3 DT B 7 9.548 14.953 3.444 1.00 1.00 H new ATOM 0 H71 DT B 7 11.818 10.968 6.290 1.00 1.00 H new ATOM 0 H72 DT B 7 13.022 11.751 5.239 1.00 1.00 H new ATOM 0 H73 DT B 7 12.239 12.679 6.541 1.00 1.00 H new ATOM 0 H6 DT B 7 10.422 10.312 4.449 1.00 1.00 H new ATOM 982 P DA B 8 7.537 8.024 -0.709 1.00 1.00 P ATOM 983 OP1 DA B 8 6.233 8.070 -1.419 1.00 1.00 O ATOM 984 OP2 DA B 8 8.185 6.698 -0.535 1.00 1.00 O ATOM 985 O5' DA B 8 8.559 9.034 -1.427 1.00 1.00 O ATOM 986 C5' DA B 8 8.071 10.188 -2.098 1.00 1.00 C ATOM 987 C4' DA B 8 9.162 11.158 -2.572 1.00 1.00 C ATOM 988 O4' DA B 8 9.559 12.002 -1.505 1.00 1.00 O ATOM 989 C3' DA B 8 10.427 10.490 -3.152 1.00 1.00 C ATOM 990 O3' DA B 8 10.537 10.760 -4.549 1.00 1.00 O ATOM 991 C2' DA B 8 11.544 11.119 -2.313 1.00 1.00 C ATOM 992 C1' DA B 8 10.902 12.368 -1.729 1.00 1.00 C ATOM 993 N9 DA B 8 11.492 12.807 -0.444 1.00 1.00 N ATOM 994 C8 DA B 8 11.741 12.088 0.704 1.00 1.00 C ATOM 995 N7 DA B 8 12.228 12.793 1.695 1.00 1.00 N ATOM 996 C5 DA B 8 12.308 14.082 1.148 1.00 1.00 C ATOM 997 C6 DA B 8 12.720 15.360 1.611 1.00 1.00 C ATOM 998 N6 DA B 8 13.114 15.662 2.837 1.00 1.00 N ATOM 999 N1 DA B 8 12.681 16.430 0.817 1.00 1.00 N ATOM 1000 C2 DA B 8 12.232 16.272 -0.413 1.00 1.00 C ATOM 1001 N3 DA B 8 11.803 15.163 -0.992 1.00 1.00 N ATOM 1002 C4 DA B 8 11.874 14.092 -0.154 1.00 1.00 C ATOM 0 H5' DA B 8 7.393 10.721 -1.431 1.00 1.00 H new ATOM 0 H5'' DA B 8 7.485 9.871 -2.961 1.00 1.00 H new ATOM 0 H4' DA B 8 8.700 11.715 -3.387 1.00 1.00 H new ATOM 0 H3' DA B 8 10.441 9.402 -3.093 1.00 1.00 H new ATOM 0 H2' DA B 8 11.886 10.442 -1.530 1.00 1.00 H new ATOM 0 H2'' DA B 8 12.413 11.364 -2.924 1.00 1.00 H new ATOM 0 H1' DA B 8 11.043 13.204 -2.414 1.00 1.00 H new ATOM 0 H8 DA B 8 11.550 11.028 0.781 1.00 1.00 H new ATOM 0 H61 DA B 8 13.390 16.618 3.063 1.00 1.00 H new ATOM 0 H62 DA B 8 13.142 14.939 3.556 1.00 1.00 H new ATOM 0 H2 DA B 8 12.212 17.161 -1.025 1.00 1.00 H new ATOM 1014 P DT B 9 11.772 10.204 -5.456 1.00 1.00 P ATOM 1015 OP1 DT B 9 11.194 9.700 -6.730 1.00 1.00 O ATOM 1016 OP2 DT B 9 12.650 9.301 -4.660 1.00 1.00 O ATOM 1017 O5' DT B 9 12.564 11.578 -5.756 1.00 1.00 O ATOM 1018 C5' DT B 9 11.944 12.605 -6.518 1.00 1.00 C ATOM 1019 C4' DT B 9 12.800 13.874 -6.668 1.00 1.00 C ATOM 1020 O4' DT B 9 12.898 14.536 -5.414 1.00 1.00 O ATOM 1021 C3' DT B 9 14.205 13.578 -7.209 1.00 1.00 C ATOM 1022 O3' DT B 9 14.496 14.428 -8.316 1.00 1.00 O ATOM 1023 C2' DT B 9 15.076 13.809 -5.979 1.00 1.00 C ATOM 1024 C1' DT B 9 14.258 14.785 -5.131 1.00 1.00 C ATOM 1025 N1 DT B 9 14.501 14.641 -3.670 1.00 1.00 N ATOM 1026 C2 DT B 9 14.792 15.799 -2.931 1.00 1.00 C ATOM 1027 O2 DT B 9 14.767 16.941 -3.397 1.00 1.00 O ATOM 1028 N3 DT B 9 15.135 15.618 -1.612 1.00 1.00 N ATOM 1029 C4 DT B 9 15.178 14.412 -0.954 1.00 1.00 C ATOM 1030 O4 DT B 9 15.443 14.408 0.245 1.00 1.00 O ATOM 1031 C5 DT B 9 14.859 13.243 -1.773 1.00 1.00 C ATOM 1032 C7 DT B 9 14.927 11.854 -1.169 1.00 1.00 C ATOM 1033 C6 DT B 9 14.506 13.394 -3.075 1.00 1.00 C ATOM 0 H5' DT B 9 10.997 12.871 -6.048 1.00 1.00 H new ATOM 0 H5'' DT B 9 11.710 12.217 -7.509 1.00 1.00 H new ATOM 0 H4' DT B 9 12.303 14.515 -7.396 1.00 1.00 H new ATOM 0 H3' DT B 9 14.354 12.578 -7.616 1.00 1.00 H new ATOM 0 H2' DT B 9 15.268 12.879 -5.445 1.00 1.00 H new ATOM 0 H2'' DT B 9 16.045 14.228 -6.248 1.00 1.00 H new ATOM 0 H1' DT B 9 14.555 15.803 -5.385 1.00 1.00 H new ATOM 0 H3 DT B 9 15.379 16.451 -1.075 1.00 1.00 H new ATOM 0 H71 DT B 9 14.203 11.206 -1.664 1.00 1.00 H new ATOM 0 H72 DT B 9 15.929 11.447 -1.303 1.00 1.00 H new ATOM 0 H73 DT B 9 14.697 11.908 -0.105 1.00 1.00 H new ATOM 0 H6 DT B 9 14.225 12.527 -3.654 1.00 1.00 H new ATOM 1046 P DG B 10 15.942 14.458 -9.051 1.00 1.00 P ATOM 1047 OP1 DG B 10 15.720 14.820 -10.476 1.00 1.00 O ATOM 1048 OP2 DG B 10 16.692 13.210 -8.740 1.00 1.00 O ATOM 1049 O5' DG B 10 16.666 15.706 -8.318 1.00 1.00 O ATOM 1050 C5' DG B 10 16.127 17.023 -8.421 1.00 1.00 C ATOM 1051 C4' DG B 10 16.993 18.109 -7.755 1.00 1.00 C ATOM 1052 O4' DG B 10 16.923 18.010 -6.332 1.00 1.00 O ATOM 1053 C3' DG B 10 18.470 18.039 -8.185 1.00 1.00 C ATOM 1054 O3' DG B 10 18.963 19.351 -8.448 1.00 1.00 O ATOM 1055 C2' DG B 10 19.090 17.353 -6.971 1.00 1.00 C ATOM 1056 C1' DG B 10 18.242 17.890 -5.820 1.00 1.00 C ATOM 1057 N9 DG B 10 18.254 16.999 -4.643 1.00 1.00 N ATOM 1058 C8 DG B 10 18.079 15.645 -4.631 1.00 1.00 C ATOM 1059 N7 DG B 10 18.084 15.101 -3.443 1.00 1.00 N ATOM 1060 C5 DG B 10 18.339 16.194 -2.598 1.00 1.00 C ATOM 1061 C6 DG B 10 18.515 16.271 -1.168 1.00 1.00 C ATOM 1062 O6 DG B 10 18.398 15.383 -0.321 1.00 1.00 O ATOM 1063 N1 DG B 10 18.872 17.526 -0.726 1.00 1.00 N ATOM 1064 C2 DG B 10 18.997 18.597 -1.539 1.00 1.00 C ATOM 1065 N2 DG B 10 19.366 19.712 -0.969 1.00 1.00 N ATOM 1066 N3 DG B 10 18.793 18.598 -2.857 1.00 1.00 N ATOM 1067 C4 DG B 10 18.478 17.356 -3.333 1.00 1.00 C ATOM 0 H5' DG B 10 15.136 17.035 -7.968 1.00 1.00 H new ATOM 0 H5'' DG B 10 15.999 17.271 -9.475 1.00 1.00 H new ATOM 0 H4' DG B 10 16.587 19.065 -8.087 1.00 1.00 H new ATOM 0 H3' DG B 10 18.685 17.503 -9.110 1.00 1.00 H new ATOM 0 H2' DG B 10 19.033 16.267 -7.045 1.00 1.00 H new ATOM 0 H2'' DG B 10 20.143 17.609 -6.854 1.00 1.00 H new ATOM 0 H1' DG B 10 18.642 18.843 -5.473 1.00 1.00 H new ATOM 0 H8 DG B 10 17.947 15.068 -5.534 1.00 1.00 H new ATOM 0 H1 DG B 10 19.052 17.653 0.270 1.00 1.00 H new ATOM 0 H21 DG B 10 19.479 20.558 -1.528 1.00 1.00 H new ATOM 0 H22 DG B 10 19.542 19.737 0.035 1.00 1.00 H new ATOM 1079 P DC B 11 20.468 19.644 -8.992 1.00 1.00 P ATOM 1080 OP1 DC B 11 20.389 20.740 -9.999 1.00 1.00 O ATOM 1081 OP2 DC B 11 21.111 18.361 -9.400 1.00 1.00 O ATOM 1082 O5' DC B 11 21.237 20.206 -7.677 1.00 1.00 O ATOM 1083 C5' DC B 11 20.854 21.448 -7.086 1.00 1.00 C ATOM 1084 C4' DC B 11 21.715 21.878 -5.885 1.00 1.00 C ATOM 1085 O4' DC B 11 21.472 21.027 -4.766 1.00 1.00 O ATOM 1086 C3' DC B 11 23.224 21.883 -6.195 1.00 1.00 C ATOM 1087 O3' DC B 11 23.833 23.074 -5.689 1.00 1.00 O ATOM 1088 C2' DC B 11 23.685 20.597 -5.506 1.00 1.00 C ATOM 1089 C1' DC B 11 22.692 20.440 -4.349 1.00 1.00 C ATOM 1090 N1 DC B 11 22.440 19.044 -3.912 1.00 1.00 N ATOM 1091 C2 DC B 11 22.467 18.721 -2.548 1.00 1.00 C ATOM 1092 O2 DC B 11 22.788 19.536 -1.680 1.00 1.00 O ATOM 1093 N3 DC B 11 22.146 17.474 -2.123 1.00 1.00 N ATOM 1094 C4 DC B 11 21.809 16.578 -3.029 1.00 1.00 C ATOM 1095 N4 DC B 11 21.452 15.415 -2.568 1.00 1.00 N ATOM 1096 C5 DC B 11 21.798 16.830 -4.428 1.00 1.00 C ATOM 1097 C6 DC B 11 22.115 18.086 -4.830 1.00 1.00 C ATOM 0 H5' DC B 11 19.815 21.377 -6.765 1.00 1.00 H new ATOM 0 H5'' DC B 11 20.900 22.227 -7.847 1.00 1.00 H new ATOM 0 H4' DC B 11 21.422 22.902 -5.654 1.00 1.00 H new ATOM 0 H3' DC B 11 23.489 21.895 -7.252 1.00 1.00 H new ATOM 0 H2' DC B 11 23.651 19.744 -6.183 1.00 1.00 H new ATOM 0 H2'' DC B 11 24.711 20.679 -5.147 1.00 1.00 H new ATOM 0 H1' DC B 11 23.133 20.928 -3.480 1.00 1.00 H new ATOM 0 H41 DC B 11 21.178 14.673 -3.212 1.00 1.00 H new ATOM 0 H42 DC B 11 21.446 15.245 -1.562 1.00 1.00 H new ATOM 0 H5 DC B 11 21.548 16.056 -5.139 1.00 1.00 H new ATOM 0 H6 DC B 11 22.110 18.330 -5.882 1.00 1.00 H new ATOM 1109 P DG B 12 25.359 23.505 -6.054 1.00 1.00 P ATOM 1110 OP1 DG B 12 25.500 24.964 -5.774 1.00 1.00 O ATOM 1111 OP2 DG B 12 25.690 23.018 -7.423 1.00 1.00 O ATOM 1112 O5' DG B 12 26.274 22.689 -4.997 1.00 1.00 O ATOM 1113 C5' DG B 12 26.281 23.031 -3.614 1.00 1.00 C ATOM 1114 C4' DG B 12 26.854 21.923 -2.719 1.00 1.00 C ATOM 1115 O4' DG B 12 25.986 20.804 -2.656 1.00 1.00 O ATOM 1116 C3' DG B 12 28.228 21.384 -3.144 1.00 1.00 C ATOM 1117 O3' DG B 12 29.299 22.061 -2.487 1.00 1.00 O ATOM 1118 C2' DG B 12 28.173 19.911 -2.730 1.00 1.00 C ATOM 1119 C1' DG B 12 26.753 19.713 -2.188 1.00 1.00 C ATOM 1120 N9 DG B 12 26.149 18.443 -2.634 1.00 1.00 N ATOM 1121 C8 DG B 12 25.903 18.043 -3.918 1.00 1.00 C ATOM 1122 N7 DG B 12 25.391 16.842 -4.020 1.00 1.00 N ATOM 1123 C5 DG B 12 25.306 16.412 -2.684 1.00 1.00 C ATOM 1124 C6 DG B 12 24.848 15.175 -2.097 1.00 1.00 C ATOM 1125 O6 DG B 12 24.394 14.162 -2.632 1.00 1.00 O ATOM 1126 N1 DG B 12 24.953 15.151 -0.722 1.00 1.00 N ATOM 1127 C2 DG B 12 25.460 16.161 0.018 1.00 1.00 C ATOM 1128 N2 DG B 12 25.554 15.968 1.305 1.00 1.00 N ATOM 1129 N3 DG B 12 25.892 17.319 -0.472 1.00 1.00 N ATOM 1130 C4 DG B 12 25.781 17.388 -1.832 1.00 1.00 C ATOM 0 H5' DG B 12 25.263 23.255 -3.297 1.00 1.00 H new ATOM 0 H5'' DG B 12 26.865 23.940 -3.474 1.00 1.00 H new ATOM 0 H4' DG B 12 26.962 22.418 -1.754 1.00 1.00 H new ATOM 0 H3' DG B 12 28.418 21.528 -4.208 1.00 1.00 H new ATOM 0 H2' DG B 12 28.369 19.254 -3.577 1.00 1.00 H new ATOM 0 H2'' DG B 12 28.922 19.685 -1.971 1.00 1.00 H new ATOM 0 HO3' DG B 12 30.154 21.686 -2.784 1.00 1.00 H new ATOM 0 H1' DG B 12 26.781 19.669 -1.099 1.00 1.00 H new ATOM 0 H8 DG B 12 26.113 18.665 -4.776 1.00 1.00 H new ATOM 0 H1 DG B 12 24.627 14.317 -0.233 1.00 1.00 H new ATOM 0 H21 DG B 12 25.931 16.702 1.905 1.00 1.00 H new ATOM 0 H22 DG B 12 25.251 15.083 1.711 1.00 1.00 H new TER 1143 DG B 12 ATOM 1144 O5' DC C 13 22.873 8.016 4.848 1.00 1.00 O ATOM 1145 C5' DC C 13 24.188 8.174 5.393 1.00 1.00 C ATOM 1146 C4' DC C 13 24.659 9.637 5.509 1.00 1.00 C ATOM 1147 O4' DC C 13 24.807 10.228 4.218 1.00 1.00 O ATOM 1148 C3' DC C 13 23.675 10.489 6.326 1.00 1.00 C ATOM 1149 O3' DC C 13 24.373 11.310 7.264 1.00 1.00 O ATOM 1150 C2' DC C 13 22.957 11.285 5.237 1.00 1.00 C ATOM 1151 C1' DC C 13 24.060 11.434 4.184 1.00 1.00 C ATOM 1152 N1 DC C 13 23.603 11.710 2.796 1.00 1.00 N ATOM 1153 C2 DC C 13 24.214 12.720 2.042 1.00 1.00 C ATOM 1154 O2 DC C 13 25.050 13.488 2.525 1.00 1.00 O ATOM 1155 N3 DC C 13 23.910 12.888 0.730 1.00 1.00 N ATOM 1156 C4 DC C 13 22.988 12.111 0.198 1.00 1.00 C ATOM 1157 N4 DC C 13 22.765 12.286 -1.076 1.00 1.00 N ATOM 1158 C5 DC C 13 22.311 11.088 0.920 1.00 1.00 C ATOM 1159 C6 DC C 13 22.653 10.917 2.218 1.00 1.00 C ATOM 0 H5' DC C 13 24.895 7.626 4.769 1.00 1.00 H new ATOM 0 H5'' DC C 13 24.215 7.717 6.382 1.00 1.00 H new ATOM 0 H4' DC C 13 25.621 9.615 6.021 1.00 1.00 H new ATOM 0 H3' DC C 13 22.981 9.919 6.945 1.00 1.00 H new ATOM 0 H2' DC C 13 22.088 10.754 4.848 1.00 1.00 H new ATOM 0 H2'' DC C 13 22.605 12.250 5.600 1.00 1.00 H new ATOM 0 HO5' DC C 13 22.649 7.063 4.805 1.00 1.00 H new ATOM 0 H1' DC C 13 24.642 12.319 4.442 1.00 1.00 H new ATOM 0 H41 DC C 13 22.065 11.719 -1.554 1.00 1.00 H new ATOM 0 H42 DC C 13 23.291 12.990 -1.594 1.00 1.00 H new ATOM 0 H5 DC C 13 21.556 10.474 0.451 1.00 1.00 H new ATOM 0 H6 DC C 13 22.171 10.147 2.802 1.00 1.00 H new ATOM 1172 P DG C 14 23.610 12.211 8.383 1.00 1.00 P ATOM 1173 OP1 DG C 14 24.409 12.144 9.639 1.00 1.00 O ATOM 1174 OP2 DG C 14 22.177 11.803 8.440 1.00 1.00 O ATOM 1175 O5' DG C 14 23.671 13.729 7.798 1.00 1.00 O ATOM 1176 C5' DG C 14 24.885 14.481 7.820 1.00 1.00 C ATOM 1177 C4' DG C 14 24.735 15.975 7.460 1.00 1.00 C ATOM 1178 O4' DG C 14 24.606 16.152 6.048 1.00 1.00 O ATOM 1179 C3' DG C 14 23.535 16.653 8.150 1.00 1.00 C ATOM 1180 O3' DG C 14 23.914 17.955 8.608 1.00 1.00 O ATOM 1181 C2' DG C 14 22.504 16.640 7.020 1.00 1.00 C ATOM 1182 C1' DG C 14 23.358 16.772 5.762 1.00 1.00 C ATOM 1183 N9 DG C 14 22.761 16.125 4.579 1.00 1.00 N ATOM 1184 C8 DG C 14 22.147 14.905 4.517 1.00 1.00 C ATOM 1185 N7 DG C 14 21.771 14.543 3.320 1.00 1.00 N ATOM 1186 C5 DG C 14 22.138 15.643 2.528 1.00 1.00 C ATOM 1187 C6 DG C 14 21.975 15.899 1.119 1.00 1.00 C ATOM 1188 O6 DG C 14 21.517 15.169 0.239 1.00 1.00 O ATOM 1189 N1 DG C 14 22.404 17.148 0.732 1.00 1.00 N ATOM 1190 C2 DG C 14 22.974 18.039 1.573 1.00 1.00 C ATOM 1191 N2 DG C 14 23.345 19.177 1.051 1.00 1.00 N ATOM 1192 N3 DG C 14 23.182 17.843 2.873 1.00 1.00 N ATOM 1193 C4 DG C 14 22.727 16.625 3.299 1.00 1.00 C ATOM 0 H5' DG C 14 25.590 14.025 7.125 1.00 1.00 H new ATOM 0 H5'' DG C 14 25.324 14.405 8.815 1.00 1.00 H new ATOM 0 H4' DG C 14 25.646 16.452 7.823 1.00 1.00 H new ATOM 0 H3' DG C 14 23.151 16.174 9.050 1.00 1.00 H new ATOM 0 H2' DG C 14 21.923 15.718 7.017 1.00 1.00 H new ATOM 0 H2'' DG C 14 21.795 17.463 7.113 1.00 1.00 H new ATOM 0 H1' DG C 14 23.454 17.830 5.517 1.00 1.00 H new ATOM 0 H8 DG C 14 21.986 14.289 5.389 1.00 1.00 H new ATOM 0 H1 DG C 14 22.285 17.416 -0.245 1.00 1.00 H new ATOM 0 H21 DG C 14 23.781 19.889 1.637 1.00 1.00 H new ATOM 0 H22 DG C 14 23.199 19.354 0.057 1.00 1.00 H new ATOM 1205 P DC C 15 22.894 18.951 9.395 1.00 1.00 P ATOM 1206 OP1 DC C 15 23.719 19.945 10.140 1.00 1.00 O ATOM 1207 OP2 DC C 15 21.911 18.133 10.161 1.00 1.00 O ATOM 1208 O5' DC C 15 22.105 19.724 8.207 1.00 1.00 O ATOM 1209 C5' DC C 15 22.798 20.596 7.316 1.00 1.00 C ATOM 1210 C4' DC C 15 22.014 20.914 6.031 1.00 1.00 C ATOM 1211 O4' DC C 15 21.805 19.749 5.248 1.00 1.00 O ATOM 1212 C3' DC C 15 20.640 21.570 6.253 1.00 1.00 C ATOM 1213 O3' DC C 15 20.766 22.990 6.141 1.00 1.00 O ATOM 1214 C2' DC C 15 19.773 20.925 5.166 1.00 1.00 C ATOM 1215 C1' DC C 15 20.722 20.024 4.382 1.00 1.00 C ATOM 1216 N1 DC C 15 20.064 18.773 3.942 1.00 1.00 N ATOM 1217 C2 DC C 15 19.756 18.585 2.588 1.00 1.00 C ATOM 1218 O2 DC C 15 19.967 19.449 1.735 1.00 1.00 O ATOM 1219 N3 DC C 15 19.225 17.418 2.158 1.00 1.00 N ATOM 1220 C4 DC C 15 18.972 16.483 3.047 1.00 1.00 C ATOM 1221 N4 DC C 15 18.485 15.379 2.560 1.00 1.00 N ATOM 1222 C5 DC C 15 19.214 16.632 4.444 1.00 1.00 C ATOM 1223 C6 DC C 15 19.761 17.803 4.854 1.00 1.00 C ATOM 0 H5' DC C 15 23.752 20.143 7.047 1.00 1.00 H new ATOM 0 H5'' DC C 15 23.023 21.528 7.835 1.00 1.00 H new ATOM 0 H4' DC C 15 22.650 21.635 5.518 1.00 1.00 H new ATOM 0 H3' DC C 15 20.201 21.416 7.239 1.00 1.00 H new ATOM 0 H2' DC C 15 18.956 20.351 5.603 1.00 1.00 H new ATOM 0 H2'' DC C 15 19.323 21.680 4.521 1.00 1.00 H new ATOM 0 H1' DC C 15 21.053 20.518 3.469 1.00 1.00 H new ATOM 0 H41 DC C 15 18.261 14.602 3.182 1.00 1.00 H new ATOM 0 H42 DC C 15 18.328 15.290 1.556 1.00 1.00 H new ATOM 0 H5 DC C 15 18.972 15.847 5.145 1.00 1.00 H new ATOM 0 H6 DC C 15 19.957 17.969 5.903 1.00 1.00 H new ATOM 1235 P DA C 16 19.510 24.010 6.295 1.00 1.00 P ATOM 1236 OP1 DA C 16 20.064 25.368 6.562 1.00 1.00 O ATOM 1237 OP2 DA C 16 18.539 23.440 7.273 1.00 1.00 O ATOM 1238 O5' DA C 16 18.812 24.026 4.829 1.00 1.00 O ATOM 1239 C5' DA C 16 19.552 24.395 3.665 1.00 1.00 C ATOM 1240 C4' DA C 16 18.757 24.272 2.350 1.00 1.00 C ATOM 1241 O4' DA C 16 18.580 22.911 1.953 1.00 1.00 O ATOM 1242 C3' DA C 16 17.370 24.938 2.432 1.00 1.00 C ATOM 1243 O3' DA C 16 17.162 25.789 1.304 1.00 1.00 O ATOM 1244 C2' DA C 16 16.463 23.712 2.495 1.00 1.00 C ATOM 1245 C1' DA C 16 17.214 22.713 1.620 1.00 1.00 C ATOM 1246 N9 DA C 16 16.836 21.325 1.929 1.00 1.00 N ATOM 1247 C8 DA C 16 16.858 20.747 3.164 1.00 1.00 C ATOM 1248 N7 DA C 16 16.615 19.464 3.172 1.00 1.00 N ATOM 1249 C5 DA C 16 16.336 19.206 1.820 1.00 1.00 C ATOM 1250 C6 DA C 16 15.956 18.057 1.082 1.00 1.00 C ATOM 1251 N6 DA C 16 15.855 16.847 1.596 1.00 1.00 N ATOM 1252 N1 DA C 16 15.636 18.123 -0.212 1.00 1.00 N ATOM 1253 C2 DA C 16 15.716 19.308 -0.802 1.00 1.00 C ATOM 1254 N3 DA C 16 16.114 20.461 -0.268 1.00 1.00 N ATOM 1255 C4 DA C 16 16.415 20.342 1.059 1.00 1.00 C ATOM 0 H5' DA C 16 20.442 23.769 3.599 1.00 1.00 H new ATOM 0 H5'' DA C 16 19.894 25.424 3.776 1.00 1.00 H new ATOM 0 H4' DA C 16 19.359 24.794 1.606 1.00 1.00 H new ATOM 0 H3' DA C 16 17.202 25.610 3.274 1.00 1.00 H new ATOM 0 H2' DA C 16 16.340 23.348 3.515 1.00 1.00 H new ATOM 0 H2'' DA C 16 15.466 23.923 2.109 1.00 1.00 H new ATOM 0 H1' DA C 16 16.993 22.868 0.564 1.00 1.00 H new ATOM 0 H8 DA C 16 17.061 21.307 4.065 1.00 1.00 H new ATOM 0 H61 DA C 16 15.576 16.064 1.005 1.00 1.00 H new ATOM 0 H62 DA C 16 16.056 16.694 2.584 1.00 1.00 H new ATOM 0 H2 DA C 16 15.423 19.342 -1.841 1.00 1.00 H new ATOM 1267 P DT C 17 15.862 26.755 1.158 1.00 1.00 P ATOM 1268 OP1 DT C 17 16.216 27.852 0.213 1.00 1.00 O ATOM 1269 OP2 DT C 17 15.375 27.127 2.519 1.00 1.00 O ATOM 1270 O5' DT C 17 14.749 25.809 0.455 1.00 1.00 O ATOM 1271 C5' DT C 17 14.919 25.357 -0.888 1.00 1.00 C ATOM 1272 C4' DT C 17 13.869 24.321 -1.323 1.00 1.00 C ATOM 1273 O4' DT C 17 14.068 23.080 -0.654 1.00 1.00 O ATOM 1274 C3' DT C 17 12.410 24.770 -1.097 1.00 1.00 C ATOM 1275 O3' DT C 17 11.724 24.798 -2.346 1.00 1.00 O ATOM 1276 C2' DT C 17 11.903 23.710 -0.112 1.00 1.00 C ATOM 1277 C1' DT C 17 12.796 22.511 -0.428 1.00 1.00 C ATOM 1278 N1 DT C 17 12.872 21.490 0.651 1.00 1.00 N ATOM 1279 C2 DT C 17 12.699 20.141 0.305 1.00 1.00 C ATOM 1280 O2 DT C 17 12.451 19.728 -0.832 1.00 1.00 O ATOM 1281 N3 DT C 17 12.833 19.229 1.326 1.00 1.00 N ATOM 1282 C4 DT C 17 13.103 19.508 2.641 1.00 1.00 C ATOM 1283 O4 DT C 17 13.226 18.567 3.424 1.00 1.00 O ATOM 1284 C5 DT C 17 13.236 20.933 2.945 1.00 1.00 C ATOM 1285 C7 DT C 17 13.496 21.395 4.366 1.00 1.00 C ATOM 1286 C6 DT C 17 13.130 21.861 1.958 1.00 1.00 C ATOM 0 H5' DT C 17 15.913 24.922 -0.994 1.00 1.00 H new ATOM 0 H5'' DT C 17 14.873 26.214 -1.560 1.00 1.00 H new ATOM 0 H4' DT C 17 14.016 24.210 -2.397 1.00 1.00 H new ATOM 0 H3' DT C 17 12.271 25.775 -0.700 1.00 1.00 H new ATOM 0 H2' DT C 17 12.010 24.034 0.923 1.00 1.00 H new ATOM 0 H2'' DT C 17 10.848 23.483 -0.268 1.00 1.00 H new ATOM 0 H1' DT C 17 12.392 21.960 -1.277 1.00 1.00 H new ATOM 0 H3 DT C 17 12.720 18.246 1.080 1.00 1.00 H new ATOM 0 H71 DT C 17 14.069 22.322 4.348 1.00 1.00 H new ATOM 0 H72 DT C 17 12.546 21.565 4.873 1.00 1.00 H new ATOM 0 H73 DT C 17 14.060 20.630 4.900 1.00 1.00 H new ATOM 0 H6 DT C 17 13.249 22.907 2.199 1.00 1.00 H new ATOM 1299 P DA C 18 10.193 25.323 -2.495 1.00 1.00 P ATOM 1300 OP1 DA C 18 9.962 25.674 -3.926 1.00 1.00 O ATOM 1301 OP2 DA C 18 9.932 26.363 -1.459 1.00 1.00 O ATOM 1302 O5' DA C 18 9.325 24.007 -2.136 1.00 1.00 O ATOM 1303 C5' DA C 18 9.430 22.829 -2.930 1.00 1.00 C ATOM 1304 C4' DA C 18 8.560 21.667 -2.438 1.00 1.00 C ATOM 1305 O4' DA C 18 9.190 20.929 -1.399 1.00 1.00 O ATOM 1306 C3' DA C 18 7.159 22.063 -1.945 1.00 1.00 C ATOM 1307 O3' DA C 18 6.254 21.466 -2.869 1.00 1.00 O ATOM 1308 C2' DA C 18 7.148 21.529 -0.509 1.00 1.00 C ATOM 1309 C1' DA C 18 8.185 20.413 -0.546 1.00 1.00 C ATOM 1310 N9 DA C 18 8.812 20.052 0.742 1.00 1.00 N ATOM 1311 C8 DA C 18 9.178 20.866 1.781 1.00 1.00 C ATOM 1312 N7 DA C 18 9.691 20.236 2.810 1.00 1.00 N ATOM 1313 C5 DA C 18 9.640 18.891 2.411 1.00 1.00 C ATOM 1314 C6 DA C 18 9.968 17.644 3.005 1.00 1.00 C ATOM 1315 N6 DA C 18 10.425 17.449 4.226 1.00 1.00 N ATOM 1316 N1 DA C 18 9.829 16.505 2.332 1.00 1.00 N ATOM 1317 C2 DA C 18 9.395 16.566 1.087 1.00 1.00 C ATOM 1318 N3 DA C 18 9.013 17.636 0.406 1.00 1.00 N ATOM 1319 C4 DA C 18 9.152 18.779 1.136 1.00 1.00 C ATOM 0 H5' DA C 18 10.471 22.507 -2.949 1.00 1.00 H new ATOM 0 H5'' DA C 18 9.152 23.069 -3.956 1.00 1.00 H new ATOM 0 H4' DA C 18 8.438 21.058 -3.334 1.00 1.00 H new ATOM 0 H3' DA C 18 6.883 23.117 -1.912 1.00 1.00 H new ATOM 0 H2' DA C 18 7.415 22.303 0.211 1.00 1.00 H new ATOM 0 H2'' DA C 18 6.164 21.155 -0.226 1.00 1.00 H new ATOM 0 H1' DA C 18 7.695 19.492 -0.863 1.00 1.00 H new ATOM 0 H8 DA C 18 9.054 21.939 1.755 1.00 1.00 H new ATOM 0 H61 DA C 18 10.628 16.503 4.550 1.00 1.00 H new ATOM 0 H62 DA C 18 10.576 18.244 4.847 1.00 1.00 H new ATOM 0 H2 DA C 18 9.345 15.626 0.557 1.00 1.00 H new ATOM 1331 P DT C 19 4.672 21.568 -2.740 1.00 1.00 P ATOM 1332 OP1 DT C 19 4.109 21.251 -4.069 1.00 1.00 O ATOM 1333 OP2 DT C 19 4.265 22.808 -2.049 1.00 1.00 O ATOM 1334 O5' DT C 19 4.393 20.317 -1.844 1.00 1.00 O ATOM 1335 C5' DT C 19 4.643 19.001 -2.309 1.00 1.00 C ATOM 1336 C4' DT C 19 4.058 18.006 -1.310 1.00 1.00 C ATOM 1337 O4' DT C 19 5.028 17.818 -0.293 1.00 1.00 O ATOM 1338 C3' DT C 19 2.775 18.535 -0.628 1.00 1.00 C ATOM 1339 O3' DT C 19 1.783 17.555 -0.478 1.00 1.00 O ATOM 1340 C2' DT C 19 3.279 18.938 0.740 1.00 1.00 C ATOM 1341 C1' DT C 19 4.344 17.855 0.934 1.00 1.00 C ATOM 1342 N1 DT C 19 5.304 18.077 2.040 1.00 1.00 N ATOM 1343 C2 DT C 19 5.678 16.968 2.809 1.00 1.00 C ATOM 1344 O2 DT C 19 5.332 15.814 2.564 1.00 1.00 O ATOM 1345 N3 DT C 19 6.456 17.222 3.912 1.00 1.00 N ATOM 1346 C4 DT C 19 6.812 18.468 4.375 1.00 1.00 C ATOM 1347 O4 DT C 19 7.456 18.536 5.419 1.00 1.00 O ATOM 1348 C5 DT C 19 6.367 19.587 3.541 1.00 1.00 C ATOM 1349 C7 DT C 19 6.650 21.025 3.943 1.00 1.00 C ATOM 1350 C6 DT C 19 5.686 19.350 2.390 1.00 1.00 C ATOM 0 H5' DT C 19 5.715 18.838 -2.421 1.00 1.00 H new ATOM 0 H5'' DT C 19 4.195 18.857 -3.292 1.00 1.00 H new ATOM 0 H4' DT C 19 3.806 17.091 -1.845 1.00 1.00 H new ATOM 0 H3' DT C 19 2.308 19.328 -1.212 1.00 1.00 H new ATOM 0 H2' DT C 19 3.696 19.945 0.755 1.00 1.00 H new ATOM 0 H2'' DT C 19 2.500 18.904 1.502 1.00 1.00 H new ATOM 0 H1' DT C 19 3.852 16.925 1.218 1.00 1.00 H new ATOM 0 H3 DT C 19 6.800 16.416 4.434 1.00 1.00 H new ATOM 0 H71 DT C 19 6.747 21.641 3.049 1.00 1.00 H new ATOM 0 H72 DT C 19 5.829 21.400 4.555 1.00 1.00 H new ATOM 0 H73 DT C 19 7.577 21.067 4.515 1.00 1.00 H new ATOM 0 H6 DT C 19 5.441 20.176 1.739 1.00 1.00 H new ATOM 1363 P DA C 20 0.747 17.254 -1.670 1.00 1.00 P ATOM 1364 OP1 DA C 20 1.518 17.195 -2.940 1.00 1.00 O ATOM 1365 OP2 DA C 20 -0.375 18.228 -1.569 1.00 1.00 O ATOM 1366 O5' DA C 20 0.283 15.792 -1.225 1.00 1.00 O ATOM 1367 C5' DA C 20 -0.430 15.625 -0.015 1.00 1.00 C ATOM 1368 C4' DA C 20 -0.111 14.278 0.634 1.00 1.00 C ATOM 1369 O4' DA C 20 1.174 14.359 1.263 1.00 1.00 O ATOM 1370 C3' DA C 20 -1.162 14.054 1.724 1.00 1.00 C ATOM 1371 O3' DA C 20 -1.558 12.695 1.811 1.00 1.00 O ATOM 1372 C2' DA C 20 -0.426 14.601 2.939 1.00 1.00 C ATOM 1373 C1' DA C 20 1.038 14.292 2.672 1.00 1.00 C ATOM 1374 N9 DA C 20 1.875 15.317 3.343 1.00 1.00 N ATOM 1375 C8 DA C 20 1.974 16.646 3.014 1.00 1.00 C ATOM 1376 N7 DA C 20 2.643 17.382 3.861 1.00 1.00 N ATOM 1377 C5 DA C 20 3.026 16.448 4.828 1.00 1.00 C ATOM 1378 C6 DA C 20 3.783 16.521 6.021 1.00 1.00 C ATOM 1379 N6 DA C 20 4.335 17.630 6.470 1.00 1.00 N ATOM 1380 N1 DA C 20 3.999 15.446 6.781 1.00 1.00 N ATOM 1381 C2 DA C 20 3.485 14.301 6.359 1.00 1.00 C ATOM 1382 N3 DA C 20 2.757 14.064 5.272 1.00 1.00 N ATOM 1383 C4 DA C 20 2.567 15.192 4.529 1.00 1.00 C ATOM 0 H5' DA C 20 -1.501 15.694 -0.208 1.00 1.00 H new ATOM 0 H5'' DA C 20 -0.178 16.432 0.673 1.00 1.00 H new ATOM 0 H4' DA C 20 -0.112 13.475 -0.103 1.00 1.00 H new ATOM 0 H3' DA C 20 -2.123 14.542 1.565 1.00 1.00 H new ATOM 0 H2' DA C 20 -0.591 15.672 3.053 1.00 1.00 H new ATOM 0 H2'' DA C 20 -0.770 14.126 3.858 1.00 1.00 H new ATOM 0 H1' DA C 20 1.351 13.319 3.051 1.00 1.00 H new ATOM 0 H8 DA C 20 1.530 17.054 2.118 1.00 1.00 H new ATOM 0 H61 DA C 20 4.870 17.618 7.338 1.00 1.00 H new ATOM 0 H62 DA C 20 4.227 18.500 5.949 1.00 1.00 H new ATOM 0 H2 DA C 20 3.684 13.442 6.983 1.00 1.00 H new ATOM 1395 P DT C 21 -2.866 12.268 2.656 1.00 1.00 P ATOM 1396 OP1 DT C 21 -3.326 10.943 2.168 1.00 1.00 O ATOM 1397 OP2 DT C 21 -3.821 13.407 2.593 1.00 1.00 O ATOM 1398 O5' DT C 21 -2.298 12.116 4.158 1.00 1.00 O ATOM 1399 C5' DT C 21 -1.328 11.120 4.461 1.00 1.00 C ATOM 1400 C4' DT C 21 -1.086 10.928 5.966 1.00 1.00 C ATOM 1401 O4' DT C 21 -0.219 11.936 6.468 1.00 1.00 O ATOM 1402 C3' DT C 21 -2.376 10.954 6.789 1.00 1.00 C ATOM 1403 O3' DT C 21 -2.289 9.937 7.775 1.00 1.00 O ATOM 1404 C2' DT C 21 -2.380 12.365 7.365 1.00 1.00 C ATOM 1405 C1' DT C 21 -0.884 12.644 7.502 1.00 1.00 C ATOM 1406 N1 DT C 21 -0.471 14.073 7.419 1.00 1.00 N ATOM 1407 C2 DT C 21 0.521 14.498 8.312 1.00 1.00 C ATOM 1408 O2 DT C 21 1.010 13.784 9.184 1.00 1.00 O ATOM 1409 N3 DT C 21 0.981 15.781 8.180 1.00 1.00 N ATOM 1410 C4 DT C 21 0.538 16.698 7.260 1.00 1.00 C ATOM 1411 O4 DT C 21 1.073 17.804 7.241 1.00 1.00 O ATOM 1412 C5 DT C 21 -0.526 16.220 6.377 1.00 1.00 C ATOM 1413 C7 DT C 21 -1.124 17.162 5.347 1.00 1.00 C ATOM 1414 C6 DT C 21 -0.983 14.940 6.469 1.00 1.00 C ATOM 0 H5' DT C 21 -0.386 11.386 3.982 1.00 1.00 H new ATOM 0 H5'' DT C 21 -1.648 10.171 4.030 1.00 1.00 H new ATOM 0 H4' DT C 21 -0.634 9.942 6.069 1.00 1.00 H new ATOM 0 H3' DT C 21 -3.298 10.757 6.242 1.00 1.00 H new ATOM 0 H2' DT C 21 -2.871 13.077 6.702 1.00 1.00 H new ATOM 0 H2'' DT C 21 -2.896 12.415 8.324 1.00 1.00 H new ATOM 0 H1' DT C 21 -0.615 12.324 8.509 1.00 1.00 H new ATOM 0 H3 DT C 21 1.716 16.081 8.820 1.00 1.00 H new ATOM 0 H71 DT C 21 -1.074 18.186 5.718 1.00 1.00 H new ATOM 0 H72 DT C 21 -0.563 17.086 4.415 1.00 1.00 H new ATOM 0 H73 DT C 21 -2.165 16.892 5.167 1.00 1.00 H new ATOM 0 H6 DT C 21 -1.753 14.598 5.793 1.00 1.00 H new ATOM 1427 P DG C 22 -3.539 9.464 8.654 1.00 1.00 P ATOM 1428 OP1 DG C 22 -3.264 8.066 9.060 1.00 1.00 O ATOM 1429 OP2 DG C 22 -4.803 9.740 7.929 1.00 1.00 O ATOM 1430 O5' DG C 22 -3.434 10.414 9.942 1.00 1.00 O ATOM 1431 C5' DG C 22 -2.414 10.195 10.904 1.00 1.00 C ATOM 1432 C4' DG C 22 -2.273 11.334 11.915 1.00 1.00 C ATOM 1433 O4' DG C 22 -1.627 12.454 11.321 1.00 1.00 O ATOM 1434 C3' DG C 22 -3.601 11.809 12.542 1.00 1.00 C ATOM 1435 O3' DG C 22 -3.516 11.632 13.953 1.00 1.00 O ATOM 1436 C2' DG C 22 -3.655 13.265 12.074 1.00 1.00 C ATOM 1437 C1' DG C 22 -2.176 13.597 11.940 1.00 1.00 C ATOM 1438 N9 DG C 22 -1.911 14.813 11.153 1.00 1.00 N ATOM 1439 C8 DG C 22 -2.447 15.167 9.945 1.00 1.00 C ATOM 1440 N7 DG C 22 -2.029 16.319 9.488 1.00 1.00 N ATOM 1441 C5 DG C 22 -1.159 16.771 10.493 1.00 1.00 C ATOM 1442 C6 DG C 22 -0.376 17.978 10.619 1.00 1.00 C ATOM 1443 O6 DG C 22 -0.236 18.903 9.820 1.00 1.00 O ATOM 1444 N1 DG C 22 0.300 18.077 11.815 1.00 1.00 N ATOM 1445 C2 DG C 22 0.273 17.118 12.769 1.00 1.00 C ATOM 1446 N2 DG C 22 0.967 17.344 13.849 1.00 1.00 N ATOM 1447 N3 DG C 22 -0.398 15.973 12.691 1.00 1.00 N ATOM 1448 C4 DG C 22 -1.101 15.858 11.525 1.00 1.00 C ATOM 0 H5' DG C 22 -1.463 10.058 10.389 1.00 1.00 H new ATOM 0 H5'' DG C 22 -2.623 9.269 11.439 1.00 1.00 H new ATOM 0 H4' DG C 22 -1.674 10.913 12.723 1.00 1.00 H new ATOM 0 H3' DG C 22 -4.508 11.276 12.257 1.00 1.00 H new ATOM 0 H2' DG C 22 -4.187 13.372 11.128 1.00 1.00 H new ATOM 0 H2'' DG C 22 -4.156 13.909 12.796 1.00 1.00 H new ATOM 0 H1' DG C 22 -1.734 13.819 12.911 1.00 1.00 H new ATOM 0 H8 DG C 22 -3.155 14.548 9.414 1.00 1.00 H new ATOM 0 H1 DG C 22 0.850 18.918 11.991 1.00 1.00 H new ATOM 0 H21 DG C 22 0.981 16.654 14.600 1.00 1.00 H new ATOM 0 H22 DG C 22 1.496 18.211 13.943 1.00 1.00 H new ATOM 1460 P DC C 23 -4.715 11.993 14.986 1.00 1.00 P ATOM 1461 OP1 DC C 23 -4.851 10.865 15.949 1.00 1.00 O ATOM 1462 OP2 DC C 23 -5.926 12.433 14.232 1.00 1.00 O ATOM 1463 O5' DC C 23 -4.103 13.274 15.772 1.00 1.00 O ATOM 1464 C5' DC C 23 -2.914 13.147 16.551 1.00 1.00 C ATOM 1465 C4' DC C 23 -2.485 14.433 17.281 1.00 1.00 C ATOM 1466 O4' DC C 23 -1.990 15.400 16.353 1.00 1.00 O ATOM 1467 C3' DC C 23 -3.627 15.058 18.100 1.00 1.00 C ATOM 1468 O3' DC C 23 -3.161 15.426 19.399 1.00 1.00 O ATOM 1469 C2' DC C 23 -4.041 16.229 17.208 1.00 1.00 C ATOM 1470 C1' DC C 23 -2.750 16.592 16.468 1.00 1.00 C ATOM 1471 N1 DC C 23 -2.971 17.173 15.118 1.00 1.00 N ATOM 1472 C2 DC C 23 -2.364 18.384 14.755 1.00 1.00 C ATOM 1473 O2 DC C 23 -1.652 19.027 15.529 1.00 1.00 O ATOM 1474 N3 DC C 23 -2.549 18.907 13.518 1.00 1.00 N ATOM 1475 C4 DC C 23 -3.315 18.245 12.675 1.00 1.00 C ATOM 1476 N4 DC C 23 -3.431 18.774 11.492 1.00 1.00 N ATOM 1477 C5 DC C 23 -3.956 17.010 12.980 1.00 1.00 C ATOM 1478 C6 DC C 23 -3.753 16.504 14.221 1.00 1.00 C ATOM 0 H5' DC C 23 -2.101 12.826 15.899 1.00 1.00 H new ATOM 0 H5'' DC C 23 -3.061 12.358 17.289 1.00 1.00 H new ATOM 0 H4' DC C 23 -1.695 14.143 17.973 1.00 1.00 H new ATOM 0 H3' DC C 23 -4.472 14.405 18.318 1.00 1.00 H new ATOM 0 H2' DC C 23 -4.834 15.945 16.516 1.00 1.00 H new ATOM 0 H2'' DC C 23 -4.416 17.067 17.795 1.00 1.00 H new ATOM 0 H1' DC C 23 -2.236 17.366 17.039 1.00 1.00 H new ATOM 0 H41 DC C 23 -4.008 18.319 10.784 1.00 1.00 H new ATOM 0 H42 DC C 23 -2.945 19.644 11.272 1.00 1.00 H new ATOM 0 H5 DC C 23 -4.575 16.501 12.256 1.00 1.00 H new ATOM 0 H6 DC C 23 -4.212 15.567 14.501 1.00 1.00 H new ATOM 1490 P DG C 24 -4.167 15.854 20.602 1.00 1.00 P ATOM 1491 OP1 DG C 24 -3.421 15.736 21.887 1.00 1.00 O ATOM 1492 OP2 DG C 24 -5.445 15.100 20.459 1.00 1.00 O ATOM 1493 O5' DG C 24 -4.473 17.420 20.327 1.00 1.00 O ATOM 1494 C5' DG C 24 -3.465 18.405 20.523 1.00 1.00 C ATOM 1495 C4' DG C 24 -3.788 19.744 19.843 1.00 1.00 C ATOM 1496 O4' DG C 24 -3.651 19.660 18.433 1.00 1.00 O ATOM 1497 C3' DG C 24 -5.202 20.297 20.097 1.00 1.00 C ATOM 1498 O3' DG C 24 -5.277 21.154 21.237 1.00 1.00 O ATOM 1499 C2' DG C 24 -5.506 21.077 18.817 1.00 1.00 C ATOM 1500 C1' DG C 24 -4.311 20.791 17.900 1.00 1.00 C ATOM 1501 N9 DG C 24 -4.719 20.563 16.502 1.00 1.00 N ATOM 1502 C8 DG C 24 -5.546 19.590 16.017 1.00 1.00 C ATOM 1503 N7 DG C 24 -5.814 19.695 14.740 1.00 1.00 N ATOM 1504 C5 DG C 24 -5.105 20.846 14.352 1.00 1.00 C ATOM 1505 C6 DG C 24 -4.997 21.540 13.087 1.00 1.00 C ATOM 1506 O6 DG C 24 -5.503 21.278 11.994 1.00 1.00 O ATOM 1507 N1 DG C 24 -4.220 22.678 13.150 1.00 1.00 N ATOM 1508 C2 DG C 24 -3.610 23.114 14.276 1.00 1.00 C ATOM 1509 N2 DG C 24 -2.915 24.214 14.192 1.00 1.00 N ATOM 1510 N3 DG C 24 -3.670 22.513 15.460 1.00 1.00 N ATOM 1511 C4 DG C 24 -4.433 21.379 15.434 1.00 1.00 C ATOM 0 H5' DG C 24 -2.518 18.028 20.137 1.00 1.00 H new ATOM 0 H5'' DG C 24 -3.331 18.571 21.592 1.00 1.00 H new ATOM 0 H4' DG C 24 -3.065 20.420 20.299 1.00 1.00 H new ATOM 0 H3' DG C 24 -5.912 19.499 20.314 1.00 1.00 H new ATOM 0 H2' DG C 24 -6.441 20.748 18.364 1.00 1.00 H new ATOM 0 H2'' DG C 24 -5.607 22.144 19.017 1.00 1.00 H new ATOM 0 HO3' DG C 24 -6.197 21.474 21.346 1.00 1.00 H new ATOM 0 H1' DG C 24 -3.648 21.655 17.870 1.00 1.00 H new ATOM 0 H8 DG C 24 -5.945 18.800 16.636 1.00 1.00 H new ATOM 0 H1 DG C 24 -4.098 23.223 12.297 1.00 1.00 H new ATOM 0 H21 DG C 24 -2.438 24.580 15.016 1.00 1.00 H new ATOM 0 H22 DG C 24 -2.848 24.708 13.302 1.00 1.00 H new TER 1524 DG C 24