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 K(o=0,f=-1.6) USER MOD Set 1.2: A 121 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 87 ASN : amide:sc= 1.92 K(o=2.3,f=-8.3!) USER MOD Set 2.2: A 90 THR OG1 : rot 167:sc= 0.36 USER MOD Single : A 81 LYS NZ :NH3+ 165:sc= 1.23 (180deg=0.733) USER MOD Single : A 83 LYS NZ :NH3+ -167:sc= 1.22 (180deg=0.814) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.2 USER MOD Single : A 97 LYS NZ :NH3+ 167:sc= 1.2 (180deg=0.995) USER MOD Single : A 100 ASN : amide:sc= 0.0362 K(o=0.036,f=-1.3) USER MOD Single : A 101 HIS : no HE2:sc= 0.791 K(o=0.79,f=-2.4!) USER MOD Single : A 102 LYS NZ :NH3+ -178:sc= 1.32 (180deg=1.27) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -150:sc= 1.18 (180deg=0.49) USER MOD Single : A 108 LYS NZ :NH3+ -146:sc= 2.41 (180deg=0.211) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 92:sc= 1.25 USER MOD Single : A 125 HIS : no HD1:sc= -0.0766 K(o=-0.077,f=-0.63) 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= -0.287 (180deg=-0.287) 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= -0.308 (180deg=-0.308) USER MOD Single : C 21 DT C7 :methyl -30:sc= -1.05 (180deg=-1.75!) USER MOD Single : C 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 79 -0.776 6.677 9.625 1.00 1.00 N ATOM 2 CA ALA A 79 0.363 6.054 8.897 1.00 1.00 C ATOM 3 C ALA A 79 0.603 6.756 7.563 1.00 1.00 C ATOM 4 O ALA A 79 -0.306 7.378 7.030 1.00 1.00 O ATOM 5 CB ALA A 79 0.081 4.557 8.684 1.00 1.00 C ATOM 0 HA ALA A 79 1.268 6.162 9.495 1.00 1.00 H new ATOM 0 HB1 ALA A 79 0.916 4.102 8.151 1.00 1.00 H new ATOM 0 HB2 ALA A 79 -0.042 4.069 9.651 1.00 1.00 H new ATOM 0 HB3 ALA A 79 -0.831 4.438 8.099 1.00 1.00 H new ATOM 11 N ARG A 80 1.815 6.646 7.006 1.00 1.00 N ATOM 12 CA ARG A 80 2.248 7.154 5.681 1.00 1.00 C ATOM 13 C ARG A 80 1.515 6.513 4.478 1.00 1.00 C ATOM 14 O ARG A 80 2.122 5.888 3.609 1.00 1.00 O ATOM 15 CB ARG A 80 3.782 7.046 5.588 1.00 1.00 C ATOM 16 CG ARG A 80 4.449 8.050 6.543 1.00 1.00 C ATOM 17 CD ARG A 80 4.286 9.501 6.070 1.00 1.00 C ATOM 18 NE ARG A 80 3.374 10.282 6.934 1.00 1.00 N ATOM 19 CZ ARG A 80 3.715 10.962 8.015 1.00 1.00 C ATOM 20 NH1 ARG A 80 4.909 10.955 8.515 1.00 1.00 N ATOM 21 NH2 ARG A 80 2.866 11.722 8.631 1.00 1.00 N ATOM 0 H ARG A 80 2.575 6.171 7.493 1.00 1.00 H new ATOM 0 HA ARG A 80 1.956 8.202 5.611 1.00 1.00 H new ATOM 0 HB2 ARG A 80 4.097 6.033 5.837 1.00 1.00 H new ATOM 0 HB3 ARG A 80 4.105 7.238 4.565 1.00 1.00 H new ATOM 0 HG2 ARG A 80 4.017 7.944 7.538 1.00 1.00 H new ATOM 0 HG3 ARG A 80 5.510 7.816 6.630 1.00 1.00 H new ATOM 0 HD2 ARG A 80 5.263 9.984 6.049 1.00 1.00 H new ATOM 0 HD3 ARG A 80 3.906 9.506 5.049 1.00 1.00 H new ATOM 0 HE ARG A 80 2.389 10.297 6.671 1.00 1.00 H new ATOM 0 HH11 ARG A 80 5.644 10.405 8.072 1.00 1.00 H new ATOM 0 HH12 ARG A 80 5.114 11.500 9.352 1.00 1.00 H new ATOM 0 HH21 ARG A 80 1.911 11.805 8.284 1.00 1.00 H new ATOM 0 HH22 ARG A 80 3.153 12.237 9.463 1.00 1.00 H new ATOM 35 N LYS A 81 0.188 6.658 4.451 1.00 1.00 N ATOM 36 CA LYS A 81 -0.753 6.271 3.405 1.00 1.00 C ATOM 37 C LYS A 81 -0.350 6.893 2.070 1.00 1.00 C ATOM 38 O LYS A 81 -0.072 8.086 1.948 1.00 1.00 O ATOM 39 CB LYS A 81 -2.161 6.745 3.815 1.00 1.00 C ATOM 40 CG LYS A 81 -2.767 5.920 4.969 1.00 1.00 C ATOM 41 CD LYS A 81 -3.781 6.741 5.779 1.00 1.00 C ATOM 42 CE LYS A 81 -4.520 5.828 6.772 1.00 1.00 C ATOM 43 NZ LYS A 81 -5.268 6.611 7.795 1.00 1.00 N ATOM 0 H LYS A 81 -0.297 7.091 5.237 1.00 1.00 H new ATOM 0 HA LYS A 81 -0.748 5.188 3.285 1.00 1.00 H new ATOM 0 HB2 LYS A 81 -2.113 7.793 4.112 1.00 1.00 H new ATOM 0 HB3 LYS A 81 -2.822 6.689 2.950 1.00 1.00 H new ATOM 0 HG2 LYS A 81 -3.256 5.033 4.566 1.00 1.00 H new ATOM 0 HG3 LYS A 81 -1.970 5.573 5.627 1.00 1.00 H new ATOM 0 HD2 LYS A 81 -3.269 7.539 6.317 1.00 1.00 H new ATOM 0 HD3 LYS A 81 -4.496 7.217 5.108 1.00 1.00 H new ATOM 0 HE2 LYS A 81 -5.213 5.186 6.228 1.00 1.00 H new ATOM 0 HE3 LYS A 81 -3.802 5.175 7.268 1.00 1.00 H new ATOM 0 HZ1 LYS A 81 -5.946 5.989 8.281 1.00 1.00 H new ATOM 0 HZ2 LYS A 81 -4.600 7.003 8.489 1.00 1.00 H new ATOM 0 HZ3 LYS A 81 -5.781 7.387 7.331 1.00 1.00 H new ATOM 57 N VAL A 82 -0.326 6.028 1.074 1.00 1.00 N ATOM 58 CA VAL A 82 -0.107 6.372 -0.333 1.00 1.00 C ATOM 59 C VAL A 82 -1.341 7.034 -0.941 1.00 1.00 C ATOM 60 O VAL A 82 -2.459 6.532 -0.810 1.00 1.00 O ATOM 61 CB VAL A 82 0.211 5.102 -1.147 1.00 1.00 C ATOM 62 CG1 VAL A 82 0.330 5.371 -2.654 1.00 1.00 C ATOM 63 CG2 VAL A 82 1.503 4.451 -0.645 1.00 1.00 C ATOM 0 H VAL A 82 -0.463 5.028 1.220 1.00 1.00 H new ATOM 0 HA VAL A 82 0.731 7.069 -0.371 1.00 1.00 H new ATOM 0 HB VAL A 82 -0.631 4.426 -0.999 1.00 1.00 H new ATOM 0 HG11 VAL A 82 0.555 4.439 -3.173 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -0.611 5.776 -3.027 1.00 1.00 H new ATOM 0 HG13 VAL A 82 1.131 6.089 -2.833 1.00 1.00 H new ATOM 0 HG21 VAL A 82 1.711 3.556 -1.231 1.00 1.00 H new ATOM 0 HG22 VAL A 82 2.329 5.154 -0.750 1.00 1.00 H new ATOM 0 HG23 VAL A 82 1.389 4.179 0.404 1.00 1.00 H new ATOM 73 N LYS A 83 -1.131 8.130 -1.665 1.00 1.00 N ATOM 74 CA LYS A 83 -2.130 8.746 -2.527 1.00 1.00 C ATOM 75 C LYS A 83 -1.701 8.460 -3.959 1.00 1.00 C ATOM 76 O LYS A 83 -0.573 8.753 -4.359 1.00 1.00 O ATOM 77 CB LYS A 83 -2.279 10.263 -2.314 1.00 1.00 C ATOM 78 CG LYS A 83 -3.441 10.588 -1.368 1.00 1.00 C ATOM 79 CD LYS A 83 -3.555 12.111 -1.181 1.00 1.00 C ATOM 80 CE LYS A 83 -4.917 12.556 -0.625 1.00 1.00 C ATOM 81 NZ LYS A 83 -5.153 12.098 0.773 1.00 1.00 N ATOM 0 H LYS A 83 -0.239 8.625 -1.667 1.00 1.00 H new ATOM 0 HA LYS A 83 -3.107 8.326 -2.291 1.00 1.00 H new ATOM 0 HB2 LYS A 83 -1.353 10.666 -1.905 1.00 1.00 H new ATOM 0 HB3 LYS A 83 -2.443 10.752 -3.274 1.00 1.00 H new ATOM 0 HG2 LYS A 83 -4.372 10.192 -1.773 1.00 1.00 H new ATOM 0 HG3 LYS A 83 -3.282 10.105 -0.404 1.00 1.00 H new ATOM 0 HD2 LYS A 83 -2.768 12.447 -0.506 1.00 1.00 H new ATOM 0 HD3 LYS A 83 -3.384 12.601 -2.139 1.00 1.00 H new ATOM 0 HE2 LYS A 83 -4.980 13.644 -0.661 1.00 1.00 H new ATOM 0 HE3 LYS A 83 -5.709 12.170 -1.267 1.00 1.00 H new ATOM 0 HZ1 LYS A 83 -6.155 12.231 1.017 1.00 1.00 H new ATOM 0 HZ2 LYS A 83 -4.907 11.091 0.854 1.00 1.00 H new ATOM 0 HZ3 LYS A 83 -4.561 12.652 1.424 1.00 1.00 H new ATOM 95 N GLN A 84 -2.581 7.811 -4.710 1.00 1.00 N ATOM 96 CA GLN A 84 -2.423 7.693 -6.141 1.00 1.00 C ATOM 97 C GLN A 84 -3.011 8.989 -6.694 1.00 1.00 C ATOM 98 O GLN A 84 -4.014 9.494 -6.189 1.00 1.00 O ATOM 99 CB GLN A 84 -3.118 6.429 -6.687 1.00 1.00 C ATOM 100 CG GLN A 84 -3.836 6.594 -8.032 1.00 1.00 C ATOM 101 CD GLN A 84 -4.467 5.284 -8.498 1.00 1.00 C ATOM 102 OE1 GLN A 84 -5.670 5.082 -8.407 1.00 1.00 O ATOM 103 NE2 GLN A 84 -3.692 4.342 -8.994 1.00 1.00 N ATOM 0 H GLN A 84 -3.417 7.357 -4.341 1.00 1.00 H new ATOM 0 HA GLN A 84 -1.383 7.571 -6.443 1.00 1.00 H new ATOM 0 HB2 GLN A 84 -2.371 5.641 -6.789 1.00 1.00 H new ATOM 0 HB3 GLN A 84 -3.843 6.087 -5.948 1.00 1.00 H new ATOM 0 HG2 GLN A 84 -4.608 7.358 -7.941 1.00 1.00 H new ATOM 0 HG3 GLN A 84 -3.127 6.944 -8.783 1.00 1.00 H new ATOM 0 HE21 GLN A 84 -2.687 4.498 -9.075 1.00 1.00 H new ATOM 0 HE22 GLN A 84 -4.096 3.456 -9.297 1.00 1.00 H new ATOM 112 N TYR A 85 -2.415 9.477 -7.767 1.00 1.00 N ATOM 113 CA TYR A 85 -2.921 10.613 -8.527 1.00 1.00 C ATOM 114 C TYR A 85 -2.999 10.205 -9.999 1.00 1.00 C ATOM 115 O TYR A 85 -2.122 9.490 -10.479 1.00 1.00 O ATOM 116 CB TYR A 85 -1.993 11.823 -8.319 1.00 1.00 C ATOM 117 CG TYR A 85 -1.757 12.245 -6.881 1.00 1.00 C ATOM 118 CD1 TYR A 85 -2.648 13.148 -6.276 1.00 1.00 C ATOM 119 CD2 TYR A 85 -0.629 11.786 -6.173 1.00 1.00 C ATOM 120 CE1 TYR A 85 -2.409 13.621 -4.974 1.00 1.00 C ATOM 121 CE2 TYR A 85 -0.380 12.252 -4.869 1.00 1.00 C ATOM 122 CZ TYR A 85 -1.269 13.177 -4.270 1.00 1.00 C ATOM 123 OH TYR A 85 -1.057 13.641 -3.012 1.00 1.00 O ATOM 0 H TYR A 85 -1.550 9.090 -8.144 1.00 1.00 H new ATOM 0 HA TYR A 85 -3.916 10.901 -8.188 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -1.028 11.597 -8.773 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -2.409 12.672 -8.861 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -3.523 13.481 -6.815 1.00 1.00 H new ATOM 0 HD2 TYR A 85 0.044 11.077 -6.631 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -3.093 14.320 -4.515 1.00 1.00 H new ATOM 0 HE2 TYR A 85 0.487 11.905 -4.326 1.00 1.00 H new ATOM 0 HH TYR A 85 -0.235 13.247 -2.652 1.00 1.00 H new ATOM 133 N LYS A 86 -4.022 10.657 -10.726 1.00 1.00 N ATOM 134 CA LYS A 86 -4.219 10.397 -12.162 1.00 1.00 C ATOM 135 C LYS A 86 -4.558 11.702 -12.876 1.00 1.00 C ATOM 136 O LYS A 86 -5.285 12.519 -12.325 1.00 1.00 O ATOM 137 CB LYS A 86 -5.323 9.334 -12.316 1.00 1.00 C ATOM 138 CG LYS A 86 -5.707 9.066 -13.781 1.00 1.00 C ATOM 139 CD LYS A 86 -6.565 7.799 -13.891 1.00 1.00 C ATOM 140 CE LYS A 86 -6.883 7.500 -15.364 1.00 1.00 C ATOM 141 NZ LYS A 86 -7.748 6.293 -15.509 1.00 1.00 N ATOM 0 H LYS A 86 -4.762 11.232 -10.324 1.00 1.00 H new ATOM 0 HA LYS A 86 -3.309 10.011 -12.622 1.00 1.00 H new ATOM 0 HB2 LYS A 86 -4.988 8.403 -11.859 1.00 1.00 H new ATOM 0 HB3 LYS A 86 -6.208 9.657 -11.769 1.00 1.00 H new ATOM 0 HG2 LYS A 86 -6.255 9.919 -14.181 1.00 1.00 H new ATOM 0 HG3 LYS A 86 -4.806 8.955 -14.384 1.00 1.00 H new ATOM 0 HD2 LYS A 86 -6.038 6.955 -13.446 1.00 1.00 H new ATOM 0 HD3 LYS A 86 -7.491 7.928 -13.330 1.00 1.00 H new ATOM 0 HE2 LYS A 86 -7.382 8.360 -15.810 1.00 1.00 H new ATOM 0 HE3 LYS A 86 -5.954 7.350 -15.913 1.00 1.00 H new ATOM 0 HZ1 LYS A 86 -7.941 6.123 -16.517 1.00 1.00 H new ATOM 0 HZ2 LYS A 86 -7.262 5.467 -15.106 1.00 1.00 H new ATOM 0 HZ3 LYS A 86 -8.645 6.446 -15.006 1.00 1.00 H new ATOM 155 N ASN A 87 -4.034 11.901 -14.080 1.00 1.00 N ATOM 156 CA ASN A 87 -4.168 13.163 -14.813 1.00 1.00 C ATOM 157 C ASN A 87 -5.130 13.048 -16.018 1.00 1.00 C ATOM 158 O ASN A 87 -4.766 12.435 -17.028 1.00 1.00 O ATOM 159 CB ASN A 87 -2.761 13.611 -15.216 1.00 1.00 C ATOM 160 CG ASN A 87 -2.724 14.991 -15.849 1.00 1.00 C ATOM 161 OD1 ASN A 87 -3.683 15.479 -16.430 1.00 1.00 O ATOM 162 ND2 ASN A 87 -1.622 15.679 -15.713 1.00 1.00 N ATOM 0 H ASN A 87 -3.501 11.190 -14.581 1.00 1.00 H new ATOM 0 HA ASN A 87 -4.625 13.919 -14.175 1.00 1.00 H new ATOM 0 HB2 ASN A 87 -2.120 13.607 -14.334 1.00 1.00 H new ATOM 0 HB3 ASN A 87 -2.344 12.887 -15.916 1.00 1.00 H new ATOM 0 HD21 ASN A 87 -1.561 16.624 -16.092 1.00 1.00 H new ATOM 0 HD22 ASN A 87 -0.823 15.271 -15.228 1.00 1.00 H new ATOM 169 N PRO A 88 -6.331 13.662 -15.956 1.00 1.00 N ATOM 170 CA PRO A 88 -7.304 13.692 -17.055 1.00 1.00 C ATOM 171 C PRO A 88 -6.766 14.199 -18.407 1.00 1.00 C ATOM 172 O PRO A 88 -7.298 13.827 -19.455 1.00 1.00 O ATOM 173 CB PRO A 88 -8.445 14.597 -16.571 1.00 1.00 C ATOM 174 CG PRO A 88 -8.377 14.498 -15.051 1.00 1.00 C ATOM 175 CD PRO A 88 -6.882 14.354 -14.795 1.00 1.00 C ATOM 0 HA PRO A 88 -7.610 12.668 -17.268 1.00 1.00 H new ATOM 0 HB2 PRO A 88 -8.311 15.624 -16.910 1.00 1.00 H new ATOM 0 HB3 PRO A 88 -9.410 14.260 -16.950 1.00 1.00 H new ATOM 0 HG2 PRO A 88 -8.788 15.385 -14.568 1.00 1.00 H new ATOM 0 HG3 PRO A 88 -8.937 13.642 -14.675 1.00 1.00 H new ATOM 0 HD2 PRO A 88 -6.414 15.330 -14.666 1.00 1.00 H new ATOM 0 HD3 PRO A 88 -6.697 13.789 -13.882 1.00 1.00 H new ATOM 183 N HIS A 89 -5.728 15.048 -18.401 1.00 1.00 N ATOM 184 CA HIS A 89 -5.183 15.708 -19.601 1.00 1.00 C ATOM 185 C HIS A 89 -4.106 14.883 -20.326 1.00 1.00 C ATOM 186 O HIS A 89 -3.848 15.135 -21.504 1.00 1.00 O ATOM 187 CB HIS A 89 -4.627 17.089 -19.208 1.00 1.00 C ATOM 188 CG HIS A 89 -5.641 17.951 -18.498 1.00 1.00 C ATOM 189 ND1 HIS A 89 -6.678 18.651 -19.094 1.00 1.00 N ATOM 190 CD2 HIS A 89 -5.704 18.179 -17.148 1.00 1.00 C ATOM 191 CE1 HIS A 89 -7.354 19.297 -18.123 1.00 1.00 C ATOM 192 NE2 HIS A 89 -6.779 19.024 -16.932 1.00 1.00 N ATOM 0 H HIS A 89 -5.233 15.301 -17.546 1.00 1.00 H new ATOM 0 HA HIS A 89 -6.004 15.811 -20.311 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -3.758 16.955 -18.564 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -4.283 17.605 -20.105 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -5.041 17.776 -16.396 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -8.216 19.930 -18.273 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -7.085 19.380 -16.027 1.00 1.00 H new ATOM 201 N THR A 90 -3.484 13.906 -19.652 1.00 1.00 N ATOM 202 CA THR A 90 -2.318 13.156 -20.169 1.00 1.00 C ATOM 203 C THR A 90 -2.448 11.630 -20.074 1.00 1.00 C ATOM 204 O THR A 90 -1.743 10.914 -20.790 1.00 1.00 O ATOM 205 CB THR A 90 -1.036 13.559 -19.424 1.00 1.00 C ATOM 206 OG1 THR A 90 -1.120 13.149 -18.080 1.00 1.00 O ATOM 207 CG2 THR A 90 -0.802 15.068 -19.396 1.00 1.00 C ATOM 0 H THR A 90 -3.775 13.607 -18.721 1.00 1.00 H new ATOM 0 HA THR A 90 -2.273 13.422 -21.225 1.00 1.00 H new ATOM 0 HB THR A 90 -0.219 13.080 -19.963 1.00 1.00 H new ATOM 0 HG1 THR A 90 -0.237 13.219 -17.661 1.00 1.00 H new ATOM 0 HG21 THR A 90 0.119 15.283 -18.855 1.00 1.00 H new ATOM 0 HG22 THR A 90 -0.720 15.442 -20.416 1.00 1.00 H new ATOM 0 HG23 THR A 90 -1.639 15.557 -18.897 1.00 1.00 H new ATOM 215 N GLY A 91 -3.343 11.115 -19.221 1.00 1.00 N ATOM 216 CA GLY A 91 -3.473 9.681 -18.934 1.00 1.00 C ATOM 217 C GLY A 91 -2.326 9.100 -18.088 1.00 1.00 C ATOM 218 O GLY A 91 -2.208 7.878 -17.971 1.00 1.00 O ATOM 0 H GLY A 91 -4.007 11.691 -18.704 1.00 1.00 H new ATOM 0 HA2 GLY A 91 -4.416 9.510 -18.414 1.00 1.00 H new ATOM 0 HA3 GLY A 91 -3.526 9.137 -19.877 1.00 1.00 H new ATOM 222 N GLU A 92 -1.473 9.945 -17.500 1.00 1.00 N ATOM 223 CA GLU A 92 -0.450 9.575 -16.540 1.00 1.00 C ATOM 224 C GLU A 92 -1.102 9.301 -15.182 1.00 1.00 C ATOM 225 O GLU A 92 -2.099 9.913 -14.788 1.00 1.00 O ATOM 226 CB GLU A 92 0.541 10.730 -16.349 1.00 1.00 C ATOM 227 CG GLU A 92 1.430 11.053 -17.552 1.00 1.00 C ATOM 228 CD GLU A 92 2.268 12.326 -17.298 1.00 1.00 C ATOM 229 OE1 GLU A 92 1.695 13.374 -16.912 1.00 1.00 O ATOM 230 OE2 GLU A 92 3.505 12.283 -17.509 1.00 1.00 O ATOM 0 H GLU A 92 -1.484 10.946 -17.694 1.00 1.00 H new ATOM 0 HA GLU A 92 0.067 8.691 -16.913 1.00 1.00 H new ATOM 0 HB2 GLU A 92 -0.021 11.626 -16.086 1.00 1.00 H new ATOM 0 HB3 GLU A 92 1.183 10.496 -15.500 1.00 1.00 H new ATOM 0 HG2 GLU A 92 2.093 10.212 -17.755 1.00 1.00 H new ATOM 0 HG3 GLU A 92 0.811 11.192 -18.439 1.00 1.00 H new ATOM 237 N VAL A 93 -0.460 8.420 -14.435 1.00 1.00 N ATOM 238 CA VAL A 93 -0.760 8.074 -13.045 1.00 1.00 C ATOM 239 C VAL A 93 0.548 8.069 -12.239 1.00 1.00 C ATOM 240 O VAL A 93 1.639 7.851 -12.773 1.00 1.00 O ATOM 241 CB VAL A 93 -1.450 6.698 -12.977 1.00 1.00 C ATOM 242 CG1 VAL A 93 -1.982 6.325 -11.578 1.00 1.00 C ATOM 243 CG2 VAL A 93 -2.633 6.618 -13.952 1.00 1.00 C ATOM 0 H VAL A 93 0.333 7.892 -14.799 1.00 1.00 H new ATOM 0 HA VAL A 93 -1.440 8.812 -12.619 1.00 1.00 H new ATOM 0 HB VAL A 93 -0.664 5.992 -13.245 1.00 1.00 H new ATOM 0 HG11 VAL A 93 -2.453 5.343 -11.618 1.00 1.00 H new ATOM 0 HG12 VAL A 93 -1.155 6.303 -10.868 1.00 1.00 H new ATOM 0 HG13 VAL A 93 -2.715 7.066 -11.258 1.00 1.00 H new ATOM 0 HG21 VAL A 93 -3.098 5.635 -13.880 1.00 1.00 H new ATOM 0 HG22 VAL A 93 -3.365 7.385 -13.700 1.00 1.00 H new ATOM 0 HG23 VAL A 93 -2.277 6.777 -14.970 1.00 1.00 H new ATOM 253 N ILE A 94 0.417 8.285 -10.939 1.00 1.00 N ATOM 254 CA ILE A 94 1.472 8.278 -9.922 1.00 1.00 C ATOM 255 C ILE A 94 0.920 7.684 -8.627 1.00 1.00 C ATOM 256 O ILE A 94 -0.288 7.603 -8.426 1.00 1.00 O ATOM 257 CB ILE A 94 2.032 9.695 -9.596 1.00 1.00 C ATOM 258 CG1 ILE A 94 1.431 10.856 -10.414 1.00 1.00 C ATOM 259 CG2 ILE A 94 3.566 9.691 -9.687 1.00 1.00 C ATOM 260 CD1 ILE A 94 1.822 12.219 -9.838 1.00 1.00 C ATOM 0 H ILE A 94 -0.496 8.485 -10.531 1.00 1.00 H new ATOM 0 HA ILE A 94 2.288 7.684 -10.332 1.00 1.00 H new ATOM 0 HB ILE A 94 1.713 9.899 -8.574 1.00 1.00 H new ATOM 0 HG12 ILE A 94 1.771 10.787 -11.447 1.00 1.00 H new ATOM 0 HG13 ILE A 94 0.345 10.766 -10.429 1.00 1.00 H new ATOM 0 HG21 ILE A 94 3.947 10.686 -9.457 1.00 1.00 H new ATOM 0 HG22 ILE A 94 3.971 8.974 -8.973 1.00 1.00 H new ATOM 0 HG23 ILE A 94 3.870 9.410 -10.695 1.00 1.00 H new ATOM 0 HD11 ILE A 94 1.379 13.010 -10.443 1.00 1.00 H new ATOM 0 HD12 ILE A 94 1.459 12.299 -8.813 1.00 1.00 H new ATOM 0 HD13 ILE A 94 2.907 12.320 -9.847 1.00 1.00 H new ATOM 272 N GLU A 95 1.831 7.389 -7.709 1.00 1.00 N ATOM 273 CA GLU A 95 1.603 6.942 -6.336 1.00 1.00 C ATOM 274 C GLU A 95 2.725 7.488 -5.442 1.00 1.00 C ATOM 275 O GLU A 95 3.903 7.217 -5.686 1.00 1.00 O ATOM 276 CB GLU A 95 1.649 5.412 -6.289 1.00 1.00 C ATOM 277 CG GLU A 95 0.334 4.765 -6.727 1.00 1.00 C ATOM 278 CD GLU A 95 0.476 3.234 -6.847 1.00 1.00 C ATOM 279 OE1 GLU A 95 0.752 2.557 -5.828 1.00 1.00 O ATOM 280 OE2 GLU A 95 0.304 2.694 -7.968 1.00 1.00 O ATOM 0 H GLU A 95 2.827 7.461 -7.919 1.00 1.00 H new ATOM 0 HA GLU A 95 0.633 7.299 -5.991 1.00 1.00 H new ATOM 0 HB2 GLU A 95 2.455 5.058 -6.932 1.00 1.00 H new ATOM 0 HB3 GLU A 95 1.886 5.091 -5.275 1.00 1.00 H new ATOM 0 HG2 GLU A 95 -0.449 5.005 -6.008 1.00 1.00 H new ATOM 0 HG3 GLU A 95 0.024 5.180 -7.686 1.00 1.00 H new ATOM 287 N THR A 96 2.366 8.266 -4.420 1.00 1.00 N ATOM 288 CA THR A 96 3.325 8.894 -3.488 1.00 1.00 C ATOM 289 C THR A 96 2.726 8.945 -2.077 1.00 1.00 C ATOM 290 O THR A 96 1.504 8.949 -1.922 1.00 1.00 O ATOM 291 CB THR A 96 3.783 10.305 -3.955 1.00 1.00 C ATOM 292 OG1 THR A 96 3.118 11.329 -3.240 1.00 1.00 O ATOM 293 CG2 THR A 96 3.546 10.623 -5.443 1.00 1.00 C ATOM 0 H THR A 96 1.393 8.485 -4.207 1.00 1.00 H new ATOM 0 HA THR A 96 4.221 8.274 -3.475 1.00 1.00 H new ATOM 0 HB THR A 96 4.856 10.278 -3.767 1.00 1.00 H new ATOM 0 HG1 THR A 96 3.429 12.203 -3.556 1.00 1.00 H new ATOM 0 HG21 THR A 96 3.901 11.630 -5.661 1.00 1.00 H new ATOM 0 HG22 THR A 96 4.088 9.906 -6.059 1.00 1.00 H new ATOM 0 HG23 THR A 96 2.481 10.559 -5.664 1.00 1.00 H new ATOM 301 N LYS A 97 3.554 8.980 -1.031 1.00 1.00 N ATOM 302 CA LYS A 97 3.101 9.143 0.371 1.00 1.00 C ATOM 303 C LYS A 97 3.165 10.616 0.828 1.00 1.00 C ATOM 304 O LYS A 97 3.041 10.908 2.020 1.00 1.00 O ATOM 305 CB LYS A 97 3.945 8.241 1.284 1.00 1.00 C ATOM 306 CG LYS A 97 4.006 6.764 0.850 1.00 1.00 C ATOM 307 CD LYS A 97 5.084 5.974 1.612 1.00 1.00 C ATOM 308 CE LYS A 97 5.437 4.635 0.941 1.00 1.00 C ATOM 309 NZ LYS A 97 6.184 4.822 -0.338 1.00 1.00 N ATOM 0 H LYS A 97 4.566 8.896 -1.123 1.00 1.00 H new ATOM 0 HA LYS A 97 2.055 8.843 0.436 1.00 1.00 H new ATOM 0 HB2 LYS A 97 4.960 8.636 1.325 1.00 1.00 H new ATOM 0 HB3 LYS A 97 3.542 8.292 2.296 1.00 1.00 H new ATOM 0 HG2 LYS A 97 3.034 6.299 1.015 1.00 1.00 H new ATOM 0 HG3 LYS A 97 4.208 6.710 -0.220 1.00 1.00 H new ATOM 0 HD2 LYS A 97 5.985 6.583 1.691 1.00 1.00 H new ATOM 0 HD3 LYS A 97 4.737 5.784 2.628 1.00 1.00 H new ATOM 0 HE2 LYS A 97 6.037 4.035 1.625 1.00 1.00 H new ATOM 0 HE3 LYS A 97 4.522 4.076 0.746 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 6.589 3.913 -0.639 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 5.535 5.172 -1.071 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 6.949 5.512 -0.195 1.00 1.00 H new ATOM 323 N GLY A 98 3.406 11.524 -0.122 1.00 1.00 N ATOM 324 CA GLY A 98 3.665 12.949 0.067 1.00 1.00 C ATOM 325 C GLY A 98 4.961 13.424 -0.594 1.00 1.00 C ATOM 326 O GLY A 98 5.577 12.722 -1.404 1.00 1.00 O ATOM 0 H GLY A 98 3.426 11.263 -1.108 1.00 1.00 H new ATOM 0 HA2 GLY A 98 2.829 13.519 -0.338 1.00 1.00 H new ATOM 0 HA3 GLY A 98 3.710 13.164 1.135 1.00 1.00 H new ATOM 330 N GLY A 99 5.375 14.632 -0.211 1.00 1.00 N ATOM 331 CA GLY A 99 6.673 15.219 -0.527 1.00 1.00 C ATOM 332 C GLY A 99 6.880 15.756 -1.950 1.00 1.00 C ATOM 333 O GLY A 99 6.094 15.542 -2.878 1.00 1.00 O ATOM 0 H GLY A 99 4.790 15.251 0.350 1.00 1.00 H new ATOM 0 HA2 GLY A 99 6.851 16.037 0.171 1.00 1.00 H new ATOM 0 HA3 GLY A 99 7.438 14.466 -0.337 1.00 1.00 H new ATOM 337 N ASN A 100 8.003 16.458 -2.102 1.00 1.00 N ATOM 338 CA ASN A 100 8.613 16.924 -3.343 1.00 1.00 C ATOM 339 C ASN A 100 8.887 15.706 -4.264 1.00 1.00 C ATOM 340 O ASN A 100 9.834 14.948 -4.049 1.00 1.00 O ATOM 341 CB ASN A 100 9.870 17.722 -2.911 1.00 1.00 C ATOM 342 CG ASN A 100 10.962 17.943 -3.944 1.00 1.00 C ATOM 343 OD1 ASN A 100 10.807 17.756 -5.146 1.00 1.00 O ATOM 344 ND2 ASN A 100 12.111 18.381 -3.470 1.00 1.00 N ATOM 0 H ASN A 100 8.554 16.738 -1.290 1.00 1.00 H new ATOM 0 HA ASN A 100 7.979 17.580 -3.939 1.00 1.00 H new ATOM 0 HB2 ASN A 100 9.541 18.699 -2.558 1.00 1.00 H new ATOM 0 HB3 ASN A 100 10.315 17.209 -2.059 1.00 1.00 H new ATOM 0 HD21 ASN A 100 12.886 18.569 -4.105 1.00 1.00 H new ATOM 0 HD22 ASN A 100 12.225 18.532 -2.468 1.00 1.00 H new ATOM 351 N HIS A 101 8.000 15.480 -5.251 1.00 1.00 N ATOM 352 CA HIS A 101 8.082 14.386 -6.239 1.00 1.00 C ATOM 353 C HIS A 101 7.901 14.929 -7.668 1.00 1.00 C ATOM 354 O HIS A 101 6.997 15.732 -7.897 1.00 1.00 O ATOM 355 CB HIS A 101 7.065 13.294 -5.857 1.00 1.00 C ATOM 356 CG HIS A 101 7.274 11.999 -6.608 1.00 1.00 C ATOM 357 ND1 HIS A 101 8.273 11.067 -6.365 1.00 1.00 N ATOM 358 CD2 HIS A 101 6.524 11.539 -7.658 1.00 1.00 C ATOM 359 CE1 HIS A 101 8.130 10.064 -7.254 1.00 1.00 C ATOM 360 NE2 HIS A 101 7.075 10.330 -8.051 1.00 1.00 N ATOM 0 H HIS A 101 7.181 16.072 -5.388 1.00 1.00 H new ATOM 0 HA HIS A 101 9.072 13.929 -6.226 1.00 1.00 H new ATOM 0 HB2 HIS A 101 7.133 13.101 -4.786 1.00 1.00 H new ATOM 0 HB3 HIS A 101 6.057 13.661 -6.051 1.00 1.00 H new ATOM 0 HD1 HIS A 101 8.989 11.130 -5.641 1.00 1.00 H new ATOM 0 HD2 HIS A 101 5.666 12.026 -8.096 1.00 1.00 H new ATOM 0 HE1 HIS A 101 8.759 9.188 -7.318 1.00 1.00 H new ATOM 369 N LYS A 102 8.712 14.469 -8.634 1.00 1.00 N ATOM 370 CA LYS A 102 8.829 15.032 -10.003 1.00 1.00 C ATOM 371 C LYS A 102 7.492 15.240 -10.731 1.00 1.00 C ATOM 372 O LYS A 102 7.051 16.377 -10.859 1.00 1.00 O ATOM 373 CB LYS A 102 9.835 14.197 -10.819 1.00 1.00 C ATOM 374 CG LYS A 102 10.259 14.899 -12.124 1.00 1.00 C ATOM 375 CD LYS A 102 11.287 16.033 -11.958 1.00 1.00 C ATOM 376 CE LYS A 102 12.638 15.502 -11.458 1.00 1.00 C ATOM 377 NZ LYS A 102 13.683 16.559 -11.456 1.00 1.00 N ATOM 0 H LYS A 102 9.327 13.669 -8.486 1.00 1.00 H new ATOM 0 HA LYS A 102 9.212 16.047 -9.898 1.00 1.00 H new ATOM 0 HB2 LYS A 102 10.718 14.002 -10.211 1.00 1.00 H new ATOM 0 HB3 LYS A 102 9.392 13.230 -11.057 1.00 1.00 H new ATOM 0 HG2 LYS A 102 10.673 14.152 -12.801 1.00 1.00 H new ATOM 0 HG3 LYS A 102 9.369 15.305 -12.604 1.00 1.00 H new ATOM 0 HD2 LYS A 102 11.426 16.542 -12.912 1.00 1.00 H new ATOM 0 HD3 LYS A 102 10.903 16.773 -11.255 1.00 1.00 H new ATOM 0 HE2 LYS A 102 12.521 15.105 -10.450 1.00 1.00 H new ATOM 0 HE3 LYS A 102 12.960 14.675 -12.091 1.00 1.00 H new ATOM 0 HZ1 LYS A 102 14.588 16.152 -11.144 1.00 1.00 H new ATOM 0 HZ2 LYS A 102 13.789 16.944 -12.416 1.00 1.00 H new ATOM 0 HZ3 LYS A 102 13.404 17.322 -10.806 1.00 1.00 H new ATOM 391 N THR A 103 6.810 14.170 -11.147 1.00 1.00 N ATOM 392 CA THR A 103 5.582 14.273 -11.974 1.00 1.00 C ATOM 393 C THR A 103 4.477 15.048 -11.258 1.00 1.00 C ATOM 394 O THR A 103 3.831 15.914 -11.845 1.00 1.00 O ATOM 395 CB THR A 103 5.076 12.882 -12.387 1.00 1.00 C ATOM 396 OG1 THR A 103 6.127 12.154 -12.994 1.00 1.00 O ATOM 397 CG2 THR A 103 3.921 13.003 -13.377 1.00 1.00 C ATOM 0 H THR A 103 7.081 13.211 -10.928 1.00 1.00 H new ATOM 0 HA THR A 103 5.849 14.828 -12.873 1.00 1.00 H new ATOM 0 HB THR A 103 4.728 12.363 -11.494 1.00 1.00 H new ATOM 0 HG1 THR A 103 5.802 11.267 -13.255 1.00 1.00 H new ATOM 0 HG21 THR A 103 3.576 12.008 -13.658 1.00 1.00 H new ATOM 0 HG22 THR A 103 3.102 13.554 -12.915 1.00 1.00 H new ATOM 0 HG23 THR A 103 4.259 13.534 -14.267 1.00 1.00 H new ATOM 405 N LEU A 104 4.329 14.800 -9.951 1.00 1.00 N ATOM 406 CA LEU A 104 3.369 15.488 -9.084 1.00 1.00 C ATOM 407 C LEU A 104 3.592 17.012 -9.083 1.00 1.00 C ATOM 408 O LEU A 104 2.627 17.774 -9.150 1.00 1.00 O ATOM 409 CB LEU A 104 3.478 14.858 -7.676 1.00 1.00 C ATOM 410 CG LEU A 104 2.465 15.356 -6.629 1.00 1.00 C ATOM 411 CD1 LEU A 104 1.022 15.119 -7.061 1.00 1.00 C ATOM 412 CD2 LEU A 104 2.689 14.611 -5.313 1.00 1.00 C ATOM 0 H LEU A 104 4.885 14.101 -9.458 1.00 1.00 H new ATOM 0 HA LEU A 104 2.353 15.357 -9.457 1.00 1.00 H new ATOM 0 HB2 LEU A 104 3.367 13.778 -7.774 1.00 1.00 H new ATOM 0 HB3 LEU A 104 4.483 15.042 -7.295 1.00 1.00 H new ATOM 0 HG LEU A 104 2.622 16.429 -6.515 1.00 1.00 H new ATOM 0 HD11 LEU A 104 0.346 15.487 -6.289 1.00 1.00 H new ATOM 0 HD12 LEU A 104 0.830 15.648 -7.994 1.00 1.00 H new ATOM 0 HD13 LEU A 104 0.857 14.052 -7.209 1.00 1.00 H new ATOM 0 HD21 LEU A 104 1.973 14.962 -4.570 1.00 1.00 H new ATOM 0 HD22 LEU A 104 2.552 13.541 -5.472 1.00 1.00 H new ATOM 0 HD23 LEU A 104 3.702 14.798 -4.957 1.00 1.00 H new ATOM 424 N LYS A 105 4.853 17.466 -9.087 1.00 1.00 N ATOM 425 CA LYS A 105 5.202 18.892 -9.178 1.00 1.00 C ATOM 426 C LYS A 105 4.873 19.486 -10.547 1.00 1.00 C ATOM 427 O LYS A 105 4.407 20.622 -10.608 1.00 1.00 O ATOM 428 CB LYS A 105 6.687 19.085 -8.798 1.00 1.00 C ATOM 429 CG LYS A 105 7.193 20.543 -8.875 1.00 1.00 C ATOM 430 CD LYS A 105 6.467 21.545 -7.963 1.00 1.00 C ATOM 431 CE LYS A 105 6.809 21.331 -6.480 1.00 1.00 C ATOM 432 NZ LYS A 105 6.074 22.291 -5.608 1.00 1.00 N ATOM 0 H LYS A 105 5.665 16.851 -9.027 1.00 1.00 H new ATOM 0 HA LYS A 105 4.587 19.443 -8.467 1.00 1.00 H new ATOM 0 HB2 LYS A 105 6.838 18.716 -7.784 1.00 1.00 H new ATOM 0 HB3 LYS A 105 7.299 18.468 -9.456 1.00 1.00 H new ATOM 0 HG2 LYS A 105 8.254 20.554 -8.626 1.00 1.00 H new ATOM 0 HG3 LYS A 105 7.104 20.886 -9.906 1.00 1.00 H new ATOM 0 HD2 LYS A 105 6.737 22.560 -8.254 1.00 1.00 H new ATOM 0 HD3 LYS A 105 5.390 21.448 -8.104 1.00 1.00 H new ATOM 0 HE2 LYS A 105 6.559 20.310 -6.191 1.00 1.00 H new ATOM 0 HE3 LYS A 105 7.882 21.451 -6.332 1.00 1.00 H new ATOM 0 HZ1 LYS A 105 6.640 22.492 -4.759 1.00 1.00 H new ATOM 0 HZ2 LYS A 105 5.906 23.175 -6.130 1.00 1.00 H new ATOM 0 HZ3 LYS A 105 5.163 21.876 -5.326 1.00 1.00 H new ATOM 446 N GLU A 106 5.033 18.737 -11.637 1.00 1.00 N ATOM 447 CA GLU A 106 4.724 19.252 -12.975 1.00 1.00 C ATOM 448 C GLU A 106 3.232 19.490 -13.135 1.00 1.00 C ATOM 449 O GLU A 106 2.802 20.520 -13.638 1.00 1.00 O ATOM 450 CB GLU A 106 5.160 18.300 -14.091 1.00 1.00 C ATOM 451 CG GLU A 106 6.575 17.785 -13.905 1.00 1.00 C ATOM 452 CD GLU A 106 7.120 17.135 -15.190 1.00 1.00 C ATOM 453 OE1 GLU A 106 7.690 17.859 -16.042 1.00 1.00 O ATOM 454 OE2 GLU A 106 6.986 15.899 -15.358 1.00 1.00 O ATOM 0 H GLU A 106 5.373 17.775 -11.623 1.00 1.00 H new ATOM 0 HA GLU A 106 5.280 20.185 -13.064 1.00 1.00 H new ATOM 0 HB2 GLU A 106 4.473 17.455 -14.130 1.00 1.00 H new ATOM 0 HB3 GLU A 106 5.088 18.814 -15.050 1.00 1.00 H new ATOM 0 HG2 GLU A 106 7.226 18.608 -13.610 1.00 1.00 H new ATOM 0 HG3 GLU A 106 6.593 17.057 -13.094 1.00 1.00 H new ATOM 461 N TRP A 107 2.433 18.550 -12.639 1.00 1.00 N ATOM 462 CA TRP A 107 0.976 18.695 -12.654 1.00 1.00 C ATOM 463 C TRP A 107 0.489 19.911 -11.847 1.00 1.00 C ATOM 464 O TRP A 107 -0.415 20.629 -12.289 1.00 1.00 O ATOM 465 CB TRP A 107 0.306 17.421 -12.148 1.00 1.00 C ATOM 466 CG TRP A 107 0.499 16.143 -12.906 1.00 1.00 C ATOM 467 CD1 TRP A 107 1.288 15.913 -13.986 1.00 1.00 C ATOM 468 CD2 TRP A 107 -0.133 14.866 -12.603 1.00 1.00 C ATOM 469 NE1 TRP A 107 1.190 14.585 -14.350 1.00 1.00 N ATOM 470 CE2 TRP A 107 0.411 13.878 -13.467 1.00 1.00 C ATOM 471 CE3 TRP A 107 -1.119 14.443 -11.687 1.00 1.00 C ATOM 472 CZ2 TRP A 107 0.093 12.524 -13.350 1.00 1.00 C ATOM 473 CZ3 TRP A 107 -1.521 13.097 -11.638 1.00 1.00 C ATOM 474 CH2 TRP A 107 -0.899 12.130 -12.445 1.00 1.00 C ATOM 0 H TRP A 107 2.766 17.681 -12.222 1.00 1.00 H new ATOM 0 HA TRP A 107 0.689 18.867 -13.691 1.00 1.00 H new ATOM 0 HB2 TRP A 107 0.650 17.252 -11.128 1.00 1.00 H new ATOM 0 HB3 TRP A 107 -0.766 17.613 -12.095 1.00 1.00 H new ATOM 0 HD1 TRP A 107 1.897 16.653 -14.483 1.00 1.00 H new ATOM 0 HE1 TRP A 107 1.639 14.180 -15.171 1.00 1.00 H new ATOM 0 HE3 TRP A 107 -1.569 15.160 -11.017 1.00 1.00 H new ATOM 0 HZ2 TRP A 107 0.607 11.789 -13.951 1.00 1.00 H new ATOM 0 HZ3 TRP A 107 -2.318 12.803 -10.971 1.00 1.00 H new ATOM 0 HH2 TRP A 107 -1.184 11.091 -12.368 1.00 1.00 H new ATOM 485 N LYS A 108 1.118 20.197 -10.695 1.00 1.00 N ATOM 486 CA LYS A 108 0.834 21.420 -9.921 1.00 1.00 C ATOM 487 C LYS A 108 1.224 22.690 -10.684 1.00 1.00 C ATOM 488 O LYS A 108 0.531 23.698 -10.572 1.00 1.00 O ATOM 489 CB LYS A 108 1.567 21.409 -8.575 1.00 1.00 C ATOM 490 CG LYS A 108 0.975 20.384 -7.611 1.00 1.00 C ATOM 491 CD LYS A 108 1.632 20.548 -6.239 1.00 1.00 C ATOM 492 CE LYS A 108 1.176 19.413 -5.320 1.00 1.00 C ATOM 493 NZ LYS A 108 1.684 19.616 -3.942 1.00 1.00 N ATOM 0 H LYS A 108 1.829 19.597 -10.277 1.00 1.00 H new ATOM 0 HA LYS A 108 -0.243 21.429 -9.753 1.00 1.00 H new ATOM 0 HB2 LYS A 108 2.622 21.187 -8.738 1.00 1.00 H new ATOM 0 HB3 LYS A 108 1.516 22.401 -8.126 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -0.103 20.523 -7.530 1.00 1.00 H new ATOM 0 HG3 LYS A 108 1.139 19.375 -7.988 1.00 1.00 H new ATOM 0 HD2 LYS A 108 2.717 20.536 -6.339 1.00 1.00 H new ATOM 0 HD3 LYS A 108 1.362 21.512 -5.807 1.00 1.00 H new ATOM 0 HE2 LYS A 108 0.087 19.364 -5.308 1.00 1.00 H new ATOM 0 HE3 LYS A 108 1.534 18.459 -5.708 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 1.891 18.693 -3.509 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 2.553 20.187 -3.973 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 0.965 20.111 -3.376 1.00 1.00 H new ATOM 507 N ALA A 109 2.303 22.644 -11.471 1.00 1.00 N ATOM 508 CA ALA A 109 2.730 23.766 -12.299 1.00 1.00 C ATOM 509 C ALA A 109 1.729 24.022 -13.438 1.00 1.00 C ATOM 510 O ALA A 109 1.297 25.152 -13.678 1.00 1.00 O ATOM 511 CB ALA A 109 4.109 23.442 -12.895 1.00 1.00 C ATOM 0 H ALA A 109 2.904 21.823 -11.549 1.00 1.00 H new ATOM 0 HA ALA A 109 2.781 24.663 -11.681 1.00 1.00 H new ATOM 0 HB1 ALA A 109 4.441 24.273 -13.517 1.00 1.00 H new ATOM 0 HB2 ALA A 109 4.825 23.283 -12.089 1.00 1.00 H new ATOM 0 HB3 ALA A 109 4.040 22.539 -13.502 1.00 1.00 H new ATOM 517 N LYS A 110 1.375 22.935 -14.134 1.00 1.00 N ATOM 518 CA LYS A 110 0.624 22.933 -15.374 1.00 1.00 C ATOM 519 C LYS A 110 -0.879 23.207 -15.217 1.00 1.00 C ATOM 520 O LYS A 110 -1.455 23.868 -16.084 1.00 1.00 O ATOM 521 CB LYS A 110 0.871 21.605 -16.104 1.00 1.00 C ATOM 522 CG LYS A 110 2.268 21.560 -16.756 1.00 1.00 C ATOM 523 CD LYS A 110 2.552 20.227 -17.467 1.00 1.00 C ATOM 524 CE LYS A 110 1.776 20.072 -18.785 1.00 1.00 C ATOM 525 NZ LYS A 110 2.370 20.870 -19.899 1.00 1.00 N ATOM 0 H LYS A 110 1.621 21.994 -13.825 1.00 1.00 H new ATOM 0 HA LYS A 110 0.991 23.772 -15.965 1.00 1.00 H new ATOM 0 HB2 LYS A 110 0.772 20.779 -15.399 1.00 1.00 H new ATOM 0 HB3 LYS A 110 0.108 21.464 -16.870 1.00 1.00 H new ATOM 0 HG2 LYS A 110 2.355 22.375 -17.474 1.00 1.00 H new ATOM 0 HG3 LYS A 110 3.026 21.727 -15.991 1.00 1.00 H new ATOM 0 HD2 LYS A 110 3.620 20.150 -17.670 1.00 1.00 H new ATOM 0 HD3 LYS A 110 2.294 19.404 -16.801 1.00 1.00 H new ATOM 0 HE2 LYS A 110 1.755 19.020 -19.068 1.00 1.00 H new ATOM 0 HE3 LYS A 110 0.742 20.382 -18.632 1.00 1.00 H new ATOM 0 HZ1 LYS A 110 1.809 20.730 -20.764 1.00 1.00 H new ATOM 0 HZ2 LYS A 110 2.367 21.878 -19.644 1.00 1.00 H new ATOM 0 HZ3 LYS A 110 3.348 20.558 -20.066 1.00 1.00 H new ATOM 539 N TRP A 111 -1.493 22.742 -14.120 1.00 1.00 N ATOM 540 CA TRP A 111 -2.944 22.859 -13.870 1.00 1.00 C ATOM 541 C TRP A 111 -3.293 23.381 -12.464 1.00 1.00 C ATOM 542 O TRP A 111 -4.085 24.319 -12.355 1.00 1.00 O ATOM 543 CB TRP A 111 -3.634 21.514 -14.152 1.00 1.00 C ATOM 544 CG TRP A 111 -3.450 20.988 -15.544 1.00 1.00 C ATOM 545 CD1 TRP A 111 -4.133 21.386 -16.641 1.00 1.00 C ATOM 546 CD2 TRP A 111 -2.479 20.013 -16.022 1.00 1.00 C ATOM 547 NE1 TRP A 111 -3.644 20.733 -17.758 1.00 1.00 N ATOM 548 CE2 TRP A 111 -2.604 19.887 -17.437 1.00 1.00 C ATOM 549 CE3 TRP A 111 -1.476 19.247 -15.395 1.00 1.00 C ATOM 550 CZ2 TRP A 111 -1.773 19.044 -18.191 1.00 1.00 C ATOM 551 CZ3 TRP A 111 -0.609 18.430 -16.149 1.00 1.00 C ATOM 552 CH2 TRP A 111 -0.767 18.309 -17.538 1.00 1.00 C ATOM 0 H TRP A 111 -0.993 22.267 -13.369 1.00 1.00 H new ATOM 0 HA TRP A 111 -3.321 23.615 -14.559 1.00 1.00 H new ATOM 0 HB2 TRP A 111 -3.256 20.774 -13.447 1.00 1.00 H new ATOM 0 HB3 TRP A 111 -4.701 21.622 -13.959 1.00 1.00 H new ATOM 0 HD1 TRP A 111 -4.939 22.105 -16.645 1.00 1.00 H new ATOM 0 HE1 TRP A 111 -4.008 20.862 -18.702 1.00 1.00 H new ATOM 0 HE3 TRP A 111 -1.370 19.286 -14.321 1.00 1.00 H new ATOM 0 HZ2 TRP A 111 -1.904 18.961 -19.260 1.00 1.00 H new ATOM 0 HZ3 TRP A 111 0.185 17.892 -15.652 1.00 1.00 H new ATOM 0 HH2 TRP A 111 -0.119 17.655 -18.103 1.00 1.00 H new ATOM 563 N GLY A 112 -2.692 22.830 -11.401 1.00 1.00 N ATOM 564 CA GLY A 112 -2.778 23.384 -10.032 1.00 1.00 C ATOM 565 C GLY A 112 -2.929 22.337 -8.921 1.00 1.00 C ATOM 566 O GLY A 112 -3.483 21.267 -9.159 1.00 1.00 O ATOM 0 H GLY A 112 -2.128 21.982 -11.461 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -1.882 23.973 -9.837 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -3.626 24.068 -9.985 1.00 1.00 H new ATOM 570 N PRO A 113 -2.499 22.630 -7.677 1.00 1.00 N ATOM 571 CA PRO A 113 -2.608 21.692 -6.553 1.00 1.00 C ATOM 572 C PRO A 113 -4.050 21.303 -6.204 1.00 1.00 C ATOM 573 O PRO A 113 -4.305 20.148 -5.878 1.00 1.00 O ATOM 574 CB PRO A 113 -1.889 22.357 -5.375 1.00 1.00 C ATOM 575 CG PRO A 113 -1.855 23.840 -5.736 1.00 1.00 C ATOM 576 CD PRO A 113 -1.824 23.852 -7.260 1.00 1.00 C ATOM 0 HA PRO A 113 -2.148 20.741 -6.821 1.00 1.00 H new ATOM 0 HB2 PRO A 113 -2.421 22.188 -4.439 1.00 1.00 H new ATOM 0 HB3 PRO A 113 -0.883 21.957 -5.247 1.00 1.00 H new ATOM 0 HG2 PRO A 113 -2.730 24.364 -5.351 1.00 1.00 H new ATOM 0 HG3 PRO A 113 -0.978 24.332 -5.316 1.00 1.00 H new ATOM 0 HD2 PRO A 113 -2.330 24.733 -7.655 1.00 1.00 H new ATOM 0 HD3 PRO A 113 -0.799 23.879 -7.631 1.00 1.00 H new ATOM 584 N GLU A 114 -5.016 22.216 -6.346 1.00 1.00 N ATOM 585 CA GLU A 114 -6.435 21.940 -6.075 1.00 1.00 C ATOM 586 C GLU A 114 -6.967 20.836 -6.984 1.00 1.00 C ATOM 587 O GLU A 114 -7.615 19.885 -6.546 1.00 1.00 O ATOM 588 CB GLU A 114 -7.272 23.198 -6.325 1.00 1.00 C ATOM 589 CG GLU A 114 -6.683 24.471 -5.714 1.00 1.00 C ATOM 590 CD GLU A 114 -7.681 25.644 -5.808 1.00 1.00 C ATOM 591 OE1 GLU A 114 -7.675 26.373 -6.830 1.00 1.00 O ATOM 592 OE2 GLU A 114 -8.479 25.847 -4.861 1.00 1.00 O ATOM 0 H GLU A 114 -4.837 23.172 -6.653 1.00 1.00 H new ATOM 0 HA GLU A 114 -6.512 21.625 -5.034 1.00 1.00 H new ATOM 0 HB2 GLU A 114 -7.382 23.341 -7.400 1.00 1.00 H new ATOM 0 HB3 GLU A 114 -8.272 23.043 -5.920 1.00 1.00 H new ATOM 0 HG2 GLU A 114 -6.425 24.292 -4.670 1.00 1.00 H new ATOM 0 HG3 GLU A 114 -5.759 24.733 -6.230 1.00 1.00 H new ATOM 599 N ALA A 115 -6.628 20.970 -8.265 1.00 1.00 N ATOM 600 CA ALA A 115 -6.940 20.010 -9.314 1.00 1.00 C ATOM 601 C ALA A 115 -6.310 18.653 -8.984 1.00 1.00 C ATOM 602 O ALA A 115 -6.988 17.633 -8.872 1.00 1.00 O ATOM 603 CB ALA A 115 -6.392 20.554 -10.639 1.00 1.00 C ATOM 0 H ALA A 115 -6.111 21.779 -8.609 1.00 1.00 H new ATOM 0 HA ALA A 115 -8.018 19.869 -9.393 1.00 1.00 H new ATOM 0 HB1 ALA A 115 -6.614 19.850 -11.441 1.00 1.00 H new ATOM 0 HB2 ALA A 115 -6.859 21.514 -10.859 1.00 1.00 H new ATOM 0 HB3 ALA A 115 -5.313 20.685 -10.560 1.00 1.00 H new ATOM 609 N VAL A 116 -4.999 18.690 -8.759 1.00 1.00 N ATOM 610 CA VAL A 116 -4.148 17.536 -8.529 1.00 1.00 C ATOM 611 C VAL A 116 -4.613 16.709 -7.330 1.00 1.00 C ATOM 612 O VAL A 116 -4.770 15.495 -7.447 1.00 1.00 O ATOM 613 CB VAL A 116 -2.700 18.027 -8.392 1.00 1.00 C ATOM 614 CG1 VAL A 116 -1.718 17.016 -7.802 1.00 1.00 C ATOM 615 CG2 VAL A 116 -2.196 18.435 -9.780 1.00 1.00 C ATOM 0 H VAL A 116 -4.481 19.569 -8.732 1.00 1.00 H new ATOM 0 HA VAL A 116 -4.211 16.855 -9.378 1.00 1.00 H new ATOM 0 HB VAL A 116 -2.733 18.856 -7.686 1.00 1.00 H new ATOM 0 HG11 VAL A 116 -0.725 17.462 -7.748 1.00 1.00 H new ATOM 0 HG12 VAL A 116 -2.044 16.734 -6.801 1.00 1.00 H new ATOM 0 HG13 VAL A 116 -1.684 16.130 -8.435 1.00 1.00 H new ATOM 0 HG21 VAL A 116 -1.167 18.787 -9.704 1.00 1.00 H new ATOM 0 HG22 VAL A 116 -2.237 17.575 -10.449 1.00 1.00 H new ATOM 0 HG23 VAL A 116 -2.825 19.233 -10.175 1.00 1.00 H new ATOM 625 N GLU A 117 -4.905 17.350 -6.198 1.00 1.00 N ATOM 626 CA GLU A 117 -5.454 16.682 -5.014 1.00 1.00 C ATOM 627 C GLU A 117 -6.876 16.151 -5.255 1.00 1.00 C ATOM 628 O GLU A 117 -7.219 15.078 -4.756 1.00 1.00 O ATOM 629 CB GLU A 117 -5.491 17.650 -3.821 1.00 1.00 C ATOM 630 CG GLU A 117 -4.102 18.013 -3.275 1.00 1.00 C ATOM 631 CD GLU A 117 -4.251 18.944 -2.051 1.00 1.00 C ATOM 632 OE1 GLU A 117 -4.648 18.458 -0.961 1.00 1.00 O ATOM 633 OE2 GLU A 117 -4.001 20.171 -2.165 1.00 1.00 O ATOM 0 H GLU A 117 -4.767 18.353 -6.074 1.00 1.00 H new ATOM 0 HA GLU A 117 -4.798 15.838 -4.800 1.00 1.00 H new ATOM 0 HB2 GLU A 117 -6.003 18.564 -4.122 1.00 1.00 H new ATOM 0 HB3 GLU A 117 -6.081 17.203 -3.020 1.00 1.00 H new ATOM 0 HG2 GLU A 117 -3.564 17.108 -2.993 1.00 1.00 H new ATOM 0 HG3 GLU A 117 -3.514 18.505 -4.049 1.00 1.00 H new ATOM 640 N SER A 118 -7.701 16.862 -6.035 1.00 1.00 N ATOM 641 CA SER A 118 -9.074 16.430 -6.351 1.00 1.00 C ATOM 642 C SER A 118 -9.107 15.159 -7.207 1.00 1.00 C ATOM 643 O SER A 118 -10.031 14.353 -7.085 1.00 1.00 O ATOM 644 CB SER A 118 -9.874 17.529 -7.065 1.00 1.00 C ATOM 645 OG SER A 118 -10.006 18.682 -6.248 1.00 1.00 O ATOM 0 H SER A 118 -7.439 17.749 -6.464 1.00 1.00 H new ATOM 0 HA SER A 118 -9.537 16.216 -5.388 1.00 1.00 H new ATOM 0 HB2 SER A 118 -9.377 17.796 -7.998 1.00 1.00 H new ATOM 0 HB3 SER A 118 -10.862 17.151 -7.327 1.00 1.00 H new ATOM 0 HG SER A 118 -9.272 19.303 -6.438 1.00 1.00 H new ATOM 651 N TRP A 119 -8.088 14.949 -8.044 1.00 1.00 N ATOM 652 CA TRP A 119 -7.909 13.727 -8.832 1.00 1.00 C ATOM 653 C TRP A 119 -7.403 12.519 -8.014 1.00 1.00 C ATOM 654 O TRP A 119 -7.322 11.417 -8.566 1.00 1.00 O ATOM 655 CB TRP A 119 -6.925 13.981 -9.986 1.00 1.00 C ATOM 656 CG TRP A 119 -7.126 15.164 -10.888 1.00 1.00 C ATOM 657 CD1 TRP A 119 -8.298 15.778 -11.178 1.00 1.00 C ATOM 658 CD2 TRP A 119 -6.107 15.882 -11.658 1.00 1.00 C ATOM 659 NE1 TRP A 119 -8.071 16.847 -12.026 1.00 1.00 N ATOM 660 CE2 TRP A 119 -6.739 16.955 -12.358 1.00 1.00 C ATOM 661 CE3 TRP A 119 -4.716 15.728 -11.851 1.00 1.00 C ATOM 662 CZ2 TRP A 119 -6.026 17.841 -13.181 1.00 1.00 C ATOM 663 CZ3 TRP A 119 -3.989 16.604 -12.686 1.00 1.00 C ATOM 664 CH2 TRP A 119 -4.640 17.663 -13.342 1.00 1.00 C ATOM 0 H TRP A 119 -7.350 15.637 -8.196 1.00 1.00 H new ATOM 0 HA TRP A 119 -8.901 13.472 -9.204 1.00 1.00 H new ATOM 0 HB2 TRP A 119 -5.929 14.068 -9.552 1.00 1.00 H new ATOM 0 HB3 TRP A 119 -6.922 13.090 -10.614 1.00 1.00 H new ATOM 0 HD1 TRP A 119 -9.265 15.478 -10.803 1.00 1.00 H new ATOM 0 HE1 TRP A 119 -8.799 17.477 -12.363 1.00 1.00 H new ATOM 0 HE3 TRP A 119 -4.198 14.924 -11.350 1.00 1.00 H new ATOM 0 HZ2 TRP A 119 -6.535 18.649 -13.684 1.00 1.00 H new ATOM 0 HZ3 TRP A 119 -2.927 16.460 -12.821 1.00 1.00 H new ATOM 0 HH2 TRP A 119 -4.077 18.339 -13.969 1.00 1.00 H new ATOM 675 N ALA A 120 -7.000 12.693 -6.746 1.00 1.00 N ATOM 676 CA ALA A 120 -6.373 11.638 -5.970 1.00 1.00 C ATOM 677 C ALA A 120 -7.316 10.496 -5.545 1.00 1.00 C ATOM 678 O ALA A 120 -8.549 10.565 -5.583 1.00 1.00 O ATOM 679 CB ALA A 120 -5.639 12.216 -4.750 1.00 1.00 C ATOM 0 H ALA A 120 -7.104 13.572 -6.240 1.00 1.00 H new ATOM 0 HA ALA A 120 -5.655 11.179 -6.649 1.00 1.00 H new ATOM 0 HB1 ALA A 120 -5.178 11.406 -4.185 1.00 1.00 H new ATOM 0 HB2 ALA A 120 -4.868 12.910 -5.084 1.00 1.00 H new ATOM 0 HB3 ALA A 120 -6.350 12.743 -4.114 1.00 1.00 H new ATOM 685 N THR A 121 -6.643 9.468 -5.056 1.00 1.00 N ATOM 686 CA THR A 121 -7.118 8.152 -4.603 1.00 1.00 C ATOM 687 C THR A 121 -6.267 7.723 -3.419 1.00 1.00 C ATOM 688 O THR A 121 -5.063 7.953 -3.430 1.00 1.00 O ATOM 689 CB THR A 121 -6.919 7.142 -5.739 1.00 1.00 C ATOM 690 OG1 THR A 121 -7.632 7.528 -6.898 1.00 1.00 O ATOM 691 CG2 THR A 121 -7.422 5.763 -5.331 1.00 1.00 C ATOM 0 H THR A 121 -5.631 9.534 -4.951 1.00 1.00 H new ATOM 0 HA THR A 121 -8.170 8.200 -4.322 1.00 1.00 H new ATOM 0 HB THR A 121 -5.850 7.113 -5.949 1.00 1.00 H new ATOM 0 HG1 THR A 121 -7.486 6.867 -7.607 1.00 1.00 H new ATOM 0 HG21 THR A 121 -7.271 5.063 -6.153 1.00 1.00 H new ATOM 0 HG22 THR A 121 -6.872 5.419 -4.455 1.00 1.00 H new ATOM 0 HG23 THR A 121 -8.484 5.819 -5.093 1.00 1.00 H new ATOM 699 N LEU A 122 -6.849 7.066 -2.419 1.00 1.00 N ATOM 700 CA LEU A 122 -6.159 6.668 -1.186 1.00 1.00 C ATOM 701 C LEU A 122 -5.920 5.151 -1.193 1.00 1.00 C ATOM 702 O LEU A 122 -6.851 4.358 -1.341 1.00 1.00 O ATOM 703 CB LEU A 122 -6.987 7.156 0.016 1.00 1.00 C ATOM 704 CG LEU A 122 -6.168 7.366 1.308 1.00 1.00 C ATOM 705 CD1 LEU A 122 -7.073 7.957 2.389 1.00 1.00 C ATOM 706 CD2 LEU A 122 -5.544 6.085 1.859 1.00 1.00 C ATOM 0 H LEU A 122 -7.830 6.788 -2.439 1.00 1.00 H new ATOM 0 HA LEU A 122 -5.174 7.130 -1.113 1.00 1.00 H new ATOM 0 HB2 LEU A 122 -7.472 8.095 -0.249 1.00 1.00 H new ATOM 0 HB3 LEU A 122 -7.778 6.433 0.215 1.00 1.00 H new ATOM 0 HG LEU A 122 -5.352 8.038 1.044 1.00 1.00 H new ATOM 0 HD11 LEU A 122 -6.498 8.107 3.303 1.00 1.00 H new ATOM 0 HD12 LEU A 122 -7.469 8.914 2.049 1.00 1.00 H new ATOM 0 HD13 LEU A 122 -7.898 7.273 2.587 1.00 1.00 H new ATOM 0 HD21 LEU A 122 -4.985 6.314 2.766 1.00 1.00 H new ATOM 0 HD22 LEU A 122 -6.331 5.367 2.089 1.00 1.00 H new ATOM 0 HD23 LEU A 122 -4.870 5.659 1.115 1.00 1.00 H new ATOM 718 N LEU A 123 -4.652 4.768 -1.050 1.00 1.00 N ATOM 719 CA LEU A 123 -4.134 3.407 -1.152 1.00 1.00 C ATOM 720 C LEU A 123 -3.427 2.993 0.151 1.00 1.00 C ATOM 721 O LEU A 123 -2.554 3.690 0.672 1.00 1.00 O ATOM 722 CB LEU A 123 -3.180 3.336 -2.362 1.00 1.00 C ATOM 723 CG LEU A 123 -3.824 3.697 -3.711 1.00 1.00 C ATOM 724 CD1 LEU A 123 -2.761 3.568 -4.791 1.00 1.00 C ATOM 725 CD2 LEU A 123 -4.993 2.782 -4.079 1.00 1.00 C ATOM 0 H LEU A 123 -3.914 5.443 -0.847 1.00 1.00 H new ATOM 0 HA LEU A 123 -4.955 2.706 -1.302 1.00 1.00 H new ATOM 0 HB2 LEU A 123 -2.340 4.008 -2.185 1.00 1.00 H new ATOM 0 HB3 LEU A 123 -2.773 2.327 -2.428 1.00 1.00 H new ATOM 0 HG LEU A 123 -4.215 4.711 -3.630 1.00 1.00 H new ATOM 0 HD11 LEU A 123 -3.194 3.819 -5.759 1.00 1.00 H new ATOM 0 HD12 LEU A 123 -1.937 4.248 -4.574 1.00 1.00 H new ATOM 0 HD13 LEU A 123 -2.389 2.544 -4.815 1.00 1.00 H new ATOM 0 HD21 LEU A 123 -5.405 3.087 -5.041 1.00 1.00 H new ATOM 0 HD22 LEU A 123 -4.642 1.752 -4.145 1.00 1.00 H new ATOM 0 HD23 LEU A 123 -5.766 2.854 -3.314 1.00 1.00 H new ATOM 737 N GLY A 124 -3.820 1.827 0.665 1.00 1.00 N ATOM 738 CA GLY A 124 -3.375 1.310 1.970 1.00 1.00 C ATOM 739 C GLY A 124 -1.944 0.746 2.000 1.00 1.00 C ATOM 740 O GLY A 124 -1.356 0.631 3.079 1.00 1.00 O ATOM 0 H GLY A 124 -4.466 1.202 0.183 1.00 1.00 H new ATOM 0 HA2 GLY A 124 -3.447 2.113 2.704 1.00 1.00 H new ATOM 0 HA3 GLY A 124 -4.064 0.526 2.286 1.00 1.00 H new ATOM 744 N HIS A 125 -1.379 0.410 0.833 1.00 1.00 N ATOM 745 CA HIS A 125 -0.021 -0.129 0.655 1.00 1.00 C ATOM 746 C HIS A 125 0.557 0.189 -0.741 1.00 1.00 C ATOM 747 O HIS A 125 1.770 0.477 -0.831 1.00 1.00 O ATOM 748 CB HIS A 125 -0.020 -1.647 0.941 1.00 1.00 C ATOM 749 CG HIS A 125 -1.020 -2.472 0.155 1.00 1.00 C ATOM 750 ND1 HIS A 125 -1.396 -2.271 -1.162 1.00 1.00 N ATOM 751 CD2 HIS A 125 -1.698 -3.569 0.612 1.00 1.00 C ATOM 752 CE1 HIS A 125 -2.287 -3.222 -1.499 1.00 1.00 C ATOM 753 NE2 HIS A 125 -2.488 -4.021 -0.430 1.00 1.00 N ATOM 0 H HIS A 125 -1.876 0.510 -0.052 1.00 1.00 H new ATOM 0 HA HIS A 125 0.636 0.363 1.372 1.00 1.00 H new ATOM 0 HB2 HIS A 125 0.979 -2.034 0.739 1.00 1.00 H new ATOM 0 HB3 HIS A 125 -0.211 -1.797 2.004 1.00 1.00 H new ATOM 0 HD2 HIS A 125 -1.629 -4.001 1.600 1.00 1.00 H new ATOM 0 HE1 HIS A 125 -2.762 -3.328 -2.463 1.00 1.00 H new ATOM 0 HE2 HIS A 125 -3.117 -4.823 -0.396 1.00 1.00 H new TER 762 HIS A 125 ATOM 763 O5' DC B 1 -3.673 27.927 6.498 1.00 1.00 O ATOM 764 C5' DC B 1 -3.889 29.044 7.369 1.00 1.00 C ATOM 765 C4' DC B 1 -3.173 28.933 8.729 1.00 1.00 C ATOM 766 O4' DC B 1 -3.741 27.896 9.525 1.00 1.00 O ATOM 767 C3' DC B 1 -1.668 28.674 8.570 1.00 1.00 C ATOM 768 O3' DC B 1 -0.920 29.574 9.388 1.00 1.00 O ATOM 769 C2' DC B 1 -1.535 27.210 8.967 1.00 1.00 C ATOM 770 C1' DC B 1 -2.725 26.982 9.901 1.00 1.00 C ATOM 771 N1 DC B 1 -3.265 25.603 9.839 1.00 1.00 N ATOM 772 C2 DC B 1 -3.502 24.873 11.009 1.00 1.00 C ATOM 773 O2 DC B 1 -3.217 25.313 12.124 1.00 1.00 O ATOM 774 N3 DC B 1 -4.066 23.638 10.953 1.00 1.00 N ATOM 775 C4 DC B 1 -4.343 23.132 9.768 1.00 1.00 C ATOM 776 N4 DC B 1 -4.908 21.957 9.777 1.00 1.00 N ATOM 777 C5 DC B 1 -4.111 23.825 8.543 1.00 1.00 C ATOM 778 C6 DC B 1 -3.576 25.062 8.628 1.00 1.00 C ATOM 0 H5' DC B 1 -4.960 29.153 7.543 1.00 1.00 H new ATOM 0 H5'' DC B 1 -3.553 29.952 6.867 1.00 1.00 H new ATOM 0 H4' DC B 1 -3.309 29.893 9.227 1.00 1.00 H new ATOM 0 H3' DC B 1 -1.274 28.848 7.569 1.00 1.00 H new ATOM 0 H2' DC B 1 -1.576 26.553 8.098 1.00 1.00 H new ATOM 0 H2'' DC B 1 -0.588 27.015 9.470 1.00 1.00 H new ATOM 0 HO5' DC B 1 -4.158 28.068 5.658 1.00 1.00 H new ATOM 0 H1' DC B 1 -2.386 27.134 10.926 1.00 1.00 H new ATOM 0 H41 DC B 1 -5.152 21.502 8.897 1.00 1.00 H new ATOM 0 H42 DC B 1 -5.106 21.493 10.664 1.00 1.00 H new ATOM 0 H5 DC B 1 -4.353 23.380 7.589 1.00 1.00 H new ATOM 0 H6 DC B 1 -3.393 25.628 7.727 1.00 1.00 H new ATOM 791 P DG B 2 0.704 29.615 9.408 1.00 1.00 P ATOM 792 OP1 DG B 2 1.112 30.992 9.802 1.00 1.00 O ATOM 793 OP2 DG B 2 1.217 29.071 8.119 1.00 1.00 O ATOM 794 O5' DG B 2 1.126 28.589 10.599 1.00 1.00 O ATOM 795 C5' DG B 2 0.899 28.906 11.973 1.00 1.00 C ATOM 796 C4' DG B 2 1.439 27.860 12.973 1.00 1.00 C ATOM 797 O4' DG B 2 0.585 26.717 13.038 1.00 1.00 O ATOM 798 C3' DG B 2 2.866 27.383 12.641 1.00 1.00 C ATOM 799 O3' DG B 2 3.672 27.377 13.820 1.00 1.00 O ATOM 800 C2' DG B 2 2.582 25.999 12.058 1.00 1.00 C ATOM 801 C1' DG B 2 1.369 25.543 12.864 1.00 1.00 C ATOM 802 N9 DG B 2 0.565 24.508 12.180 1.00 1.00 N ATOM 803 C8 DG B 2 0.173 24.499 10.872 1.00 1.00 C ATOM 804 N7 DG B 2 -0.583 23.489 10.534 1.00 1.00 N ATOM 805 C5 DG B 2 -0.669 22.744 11.720 1.00 1.00 C ATOM 806 C6 DG B 2 -1.340 21.503 12.024 1.00 1.00 C ATOM 807 O6 DG B 2 -2.068 20.815 11.312 1.00 1.00 O ATOM 808 N1 DG B 2 -1.117 21.053 13.306 1.00 1.00 N ATOM 809 C2 DG B 2 -0.377 21.725 14.216 1.00 1.00 C ATOM 810 N2 DG B 2 -0.265 21.173 15.394 1.00 1.00 N ATOM 811 N3 DG B 2 0.238 22.889 14.002 1.00 1.00 N ATOM 812 C4 DG B 2 0.060 23.348 12.725 1.00 1.00 C ATOM 0 H5' DG B 2 -0.173 29.022 12.133 1.00 1.00 H new ATOM 0 H5'' DG B 2 1.360 29.869 12.191 1.00 1.00 H new ATOM 0 H4' DG B 2 1.464 28.370 13.936 1.00 1.00 H new ATOM 0 H3' DG B 2 3.436 28.008 11.954 1.00 1.00 H new ATOM 0 H2' DG B 2 2.366 26.045 10.991 1.00 1.00 H new ATOM 0 H2'' DG B 2 3.429 25.324 12.183 1.00 1.00 H new ATOM 0 H1' DG B 2 1.692 25.086 13.799 1.00 1.00 H new ATOM 0 H8 DG B 2 0.465 25.267 10.171 1.00 1.00 H new ATOM 0 H1 DG B 2 -1.533 20.164 13.584 1.00 1.00 H new ATOM 0 H21 DG B 2 0.281 21.633 16.123 1.00 1.00 H new ATOM 0 H22 DG B 2 -0.723 20.282 15.585 1.00 1.00 H new ATOM 824 P DC B 3 5.244 26.962 13.815 1.00 1.00 P ATOM 825 OP1 DC B 3 5.933 27.778 14.854 1.00 1.00 O ATOM 826 OP2 DC B 3 5.766 27.012 12.418 1.00 1.00 O ATOM 827 O5' DC B 3 5.221 25.413 14.303 1.00 1.00 O ATOM 828 C5' DC B 3 4.852 25.081 15.641 1.00 1.00 C ATOM 829 C4' DC B 3 4.776 23.568 15.915 1.00 1.00 C ATOM 830 O4' DC B 3 3.695 23.009 15.183 1.00 1.00 O ATOM 831 C3' DC B 3 6.072 22.808 15.576 1.00 1.00 C ATOM 832 O3' DC B 3 6.659 22.285 16.768 1.00 1.00 O ATOM 833 C2' DC B 3 5.597 21.718 14.607 1.00 1.00 C ATOM 834 C1' DC B 3 4.073 21.737 14.700 1.00 1.00 C ATOM 835 N1 DC B 3 3.422 21.515 13.386 1.00 1.00 N ATOM 836 C2 DC B 3 2.605 20.396 13.190 1.00 1.00 C ATOM 837 O2 DC B 3 2.444 19.541 14.061 1.00 1.00 O ATOM 838 N3 DC B 3 1.946 20.211 12.022 1.00 1.00 N ATOM 839 C4 DC B 3 2.128 21.096 11.064 1.00 1.00 C ATOM 840 N4 DC B 3 1.451 20.879 9.973 1.00 1.00 N ATOM 841 C5 DC B 3 2.970 22.240 11.186 1.00 1.00 C ATOM 842 C6 DC B 3 3.605 22.416 12.373 1.00 1.00 C ATOM 0 H5' DC B 3 3.883 25.528 15.861 1.00 1.00 H new ATOM 0 H5'' DC B 3 5.572 25.528 16.327 1.00 1.00 H new ATOM 0 H4' DC B 3 4.624 23.456 16.988 1.00 1.00 H new ATOM 0 H3' DC B 3 6.853 23.424 15.130 1.00 1.00 H new ATOM 0 H2' DC B 3 5.932 21.922 13.590 1.00 1.00 H new ATOM 0 H2'' DC B 3 5.996 20.743 14.885 1.00 1.00 H new ATOM 0 H1' DC B 3 3.755 20.930 15.360 1.00 1.00 H new ATOM 0 H41 DC B 3 1.537 21.519 9.184 1.00 1.00 H new ATOM 0 H42 DC B 3 0.835 20.069 9.908 1.00 1.00 H new ATOM 0 H5 DC B 3 3.097 22.936 10.370 1.00 1.00 H new ATOM 0 H6 DC B 3 4.254 23.267 12.517 1.00 1.00 H new ATOM 854 P DA B 4 8.131 21.587 16.796 1.00 1.00 P ATOM 855 OP1 DA B 4 8.613 21.594 18.206 1.00 1.00 O ATOM 856 OP2 DA B 4 8.988 22.222 15.755 1.00 1.00 O ATOM 857 O5' DA B 4 7.856 20.048 16.359 1.00 1.00 O ATOM 858 C5' DA B 4 7.073 19.183 17.179 1.00 1.00 C ATOM 859 C4' DA B 4 6.737 17.835 16.516 1.00 1.00 C ATOM 860 O4' DA B 4 5.765 17.989 15.486 1.00 1.00 O ATOM 861 C3' DA B 4 7.963 17.099 15.937 1.00 1.00 C ATOM 862 O3' DA B 4 8.081 15.805 16.522 1.00 1.00 O ATOM 863 C2' DA B 4 7.644 17.095 14.441 1.00 1.00 C ATOM 864 C1' DA B 4 6.118 17.118 14.428 1.00 1.00 C ATOM 865 N9 DA B 4 5.570 17.639 13.164 1.00 1.00 N ATOM 866 C8 DA B 4 5.931 18.796 12.535 1.00 1.00 C ATOM 867 N7 DA B 4 5.243 19.073 11.459 1.00 1.00 N ATOM 868 C5 DA B 4 4.392 17.960 11.353 1.00 1.00 C ATOM 869 C6 DA B 4 3.409 17.539 10.424 1.00 1.00 C ATOM 870 N6 DA B 4 3.042 18.233 9.366 1.00 1.00 N ATOM 871 N1 DA B 4 2.789 16.365 10.549 1.00 1.00 N ATOM 872 C2 DA B 4 3.106 15.608 11.590 1.00 1.00 C ATOM 873 N3 DA B 4 3.988 15.868 12.551 1.00 1.00 N ATOM 874 C4 DA B 4 4.602 17.071 12.373 1.00 1.00 C ATOM 0 H5' DA B 4 6.144 19.689 17.442 1.00 1.00 H new ATOM 0 H5'' DA B 4 7.609 18.996 18.110 1.00 1.00 H new ATOM 0 H4' DA B 4 6.337 17.222 17.324 1.00 1.00 H new ATOM 0 H3' DA B 4 8.932 17.555 16.139 1.00 1.00 H new ATOM 0 H2' DA B 4 8.067 17.962 13.934 1.00 1.00 H new ATOM 0 H2'' DA B 4 8.041 16.210 13.944 1.00 1.00 H new ATOM 0 H1' DA B 4 5.718 16.110 14.536 1.00 1.00 H new ATOM 0 H8 DA B 4 6.724 19.433 12.899 1.00 1.00 H new ATOM 0 H61 DA B 4 2.326 17.867 8.739 1.00 1.00 H new ATOM 0 H62 DA B 4 3.474 19.137 9.174 1.00 1.00 H new ATOM 0 H2 DA B 4 2.585 14.665 11.667 1.00 1.00 H new ATOM 886 P DT B 5 9.376 14.850 16.284 1.00 1.00 P ATOM 887 OP1 DT B 5 9.527 13.977 17.486 1.00 1.00 O ATOM 888 OP2 DT B 5 10.539 15.686 15.872 1.00 1.00 O ATOM 889 O5' DT B 5 8.944 13.922 15.027 1.00 1.00 O ATOM 890 C5' DT B 5 7.935 12.922 15.165 1.00 1.00 C ATOM 891 C4' DT B 5 7.533 12.275 13.829 1.00 1.00 C ATOM 892 O4' DT B 5 6.855 13.228 13.019 1.00 1.00 O ATOM 893 C3' DT B 5 8.728 11.711 13.037 1.00 1.00 C ATOM 894 O3' DT B 5 8.560 10.320 12.773 1.00 1.00 O ATOM 895 C2' DT B 5 8.715 12.564 11.770 1.00 1.00 C ATOM 896 C1' DT B 5 7.261 13.030 11.683 1.00 1.00 C ATOM 897 N1 DT B 5 7.044 14.281 10.897 1.00 1.00 N ATOM 898 C2 DT B 5 5.977 14.303 9.990 1.00 1.00 C ATOM 899 O2 DT B 5 5.196 13.363 9.821 1.00 1.00 O ATOM 900 N3 DT B 5 5.821 15.444 9.240 1.00 1.00 N ATOM 901 C4 DT B 5 6.597 16.575 9.327 1.00 1.00 C ATOM 902 O4 DT B 5 6.311 17.539 8.626 1.00 1.00 O ATOM 903 C5 DT B 5 7.696 16.493 10.289 1.00 1.00 C ATOM 904 C7 DT B 5 8.655 17.657 10.458 1.00 1.00 C ATOM 905 C6 DT B 5 7.876 15.376 11.040 1.00 1.00 C ATOM 0 H5' DT B 5 7.053 13.367 15.625 1.00 1.00 H new ATOM 0 H5'' DT B 5 8.292 12.147 15.843 1.00 1.00 H new ATOM 0 H4' DT B 5 6.884 11.436 14.078 1.00 1.00 H new ATOM 0 H3' DT B 5 9.680 11.765 13.565 1.00 1.00 H new ATOM 0 H2' DT B 5 9.405 13.405 11.843 1.00 1.00 H new ATOM 0 H2'' DT B 5 9.007 11.987 10.892 1.00 1.00 H new ATOM 0 H1' DT B 5 6.682 12.277 11.149 1.00 1.00 H new ATOM 0 H3 DT B 5 5.062 15.452 8.558 1.00 1.00 H new ATOM 0 H71 DT B 5 9.027 17.677 11.483 1.00 1.00 H new ATOM 0 H72 DT B 5 9.493 17.541 9.770 1.00 1.00 H new ATOM 0 H73 DT B 5 8.135 18.591 10.243 1.00 1.00 H new ATOM 0 H6 DT B 5 8.681 15.342 11.759 1.00 1.00 H new ATOM 918 P DA B 6 9.729 9.412 12.096 1.00 1.00 P ATOM 919 OP1 DA B 6 9.682 8.066 12.735 1.00 1.00 O ATOM 920 OP2 DA B 6 11.019 10.160 12.123 1.00 1.00 O ATOM 921 O5' DA B 6 9.257 9.271 10.549 1.00 1.00 O ATOM 922 C5' DA B 6 8.126 8.476 10.207 1.00 1.00 C ATOM 923 C4' DA B 6 7.844 8.369 8.700 1.00 1.00 C ATOM 924 O4' DA B 6 7.355 9.613 8.201 1.00 1.00 O ATOM 925 C3' DA B 6 9.050 7.939 7.853 1.00 1.00 C ATOM 926 O3' DA B 6 8.615 6.940 6.934 1.00 1.00 O ATOM 927 C2' DA B 6 9.486 9.269 7.239 1.00 1.00 C ATOM 928 C1' DA B 6 8.200 10.086 7.167 1.00 1.00 C ATOM 929 N9 DA B 6 8.424 11.537 7.347 1.00 1.00 N ATOM 930 C8 DA B 6 9.327 12.158 8.173 1.00 1.00 C ATOM 931 N7 DA B 6 9.362 13.461 8.066 1.00 1.00 N ATOM 932 C5 DA B 6 8.398 13.709 7.077 1.00 1.00 C ATOM 933 C6 DA B 6 7.928 14.869 6.419 1.00 1.00 C ATOM 934 N6 DA B 6 8.381 16.090 6.639 1.00 1.00 N ATOM 935 N1 DA B 6 6.986 14.800 5.480 1.00 1.00 N ATOM 936 C2 DA B 6 6.492 13.603 5.184 1.00 1.00 C ATOM 937 N3 DA B 6 6.824 12.429 5.715 1.00 1.00 N ATOM 938 C4 DA B 6 7.804 12.551 6.653 1.00 1.00 C ATOM 0 H5' DA B 6 7.246 8.891 10.698 1.00 1.00 H new ATOM 0 H5'' DA B 6 8.271 7.473 10.607 1.00 1.00 H new ATOM 0 H4' DA B 6 7.097 7.581 8.606 1.00 1.00 H new ATOM 0 H3' DA B 6 9.889 7.471 8.368 1.00 1.00 H new ATOM 0 H2' DA B 6 10.238 9.764 7.853 1.00 1.00 H new ATOM 0 H2'' DA B 6 9.924 9.127 6.251 1.00 1.00 H new ATOM 0 H1' DA B 6 7.761 9.963 6.177 1.00 1.00 H new ATOM 0 H8 DA B 6 9.960 11.613 8.858 1.00 1.00 H new ATOM 0 H61 DA B 6 7.991 16.879 6.124 1.00 1.00 H new ATOM 0 H62 DA B 6 9.121 16.244 7.324 1.00 1.00 H new ATOM 0 H2 DA B 6 5.729 13.580 4.420 1.00 1.00 H new ATOM 950 P DT B 7 9.519 6.372 5.714 1.00 1.00 P ATOM 951 OP1 DT B 7 9.039 4.999 5.383 1.00 1.00 O ATOM 952 OP2 DT B 7 10.963 6.564 6.022 1.00 1.00 O ATOM 953 O5' DT B 7 9.087 7.375 4.518 1.00 1.00 O ATOM 954 C5' DT B 7 7.722 7.470 4.134 1.00 1.00 C ATOM 955 C4' DT B 7 7.437 8.605 3.145 1.00 1.00 C ATOM 956 O4' DT B 7 7.737 9.866 3.724 1.00 1.00 O ATOM 957 C3' DT B 7 8.215 8.474 1.828 1.00 1.00 C ATOM 958 O3' DT B 7 7.315 8.670 0.741 1.00 1.00 O ATOM 959 C2' DT B 7 9.216 9.613 1.949 1.00 1.00 C ATOM 960 C1' DT B 7 8.395 10.629 2.733 1.00 1.00 C ATOM 961 N1 DT B 7 9.223 11.683 3.357 1.00 1.00 N ATOM 962 C2 DT B 7 8.981 13.015 3.008 1.00 1.00 C ATOM 963 O2 DT B 7 8.179 13.375 2.147 1.00 1.00 O ATOM 964 N3 DT B 7 9.711 13.965 3.677 1.00 1.00 N ATOM 965 C4 DT B 7 10.710 13.723 4.584 1.00 1.00 C ATOM 966 O4 DT B 7 11.292 14.693 5.068 1.00 1.00 O ATOM 967 C5 DT B 7 10.965 12.306 4.857 1.00 1.00 C ATOM 968 C7 DT B 7 12.065 11.901 5.820 1.00 1.00 C ATOM 969 C6 DT B 7 10.224 11.346 4.243 1.00 1.00 C ATOM 0 H5' DT B 7 7.112 7.616 5.026 1.00 1.00 H new ATOM 0 H5'' DT B 7 7.413 6.525 3.687 1.00 1.00 H new ATOM 0 H4' DT B 7 6.374 8.532 2.915 1.00 1.00 H new ATOM 0 H3' DT B 7 8.692 7.509 1.655 1.00 1.00 H new ATOM 0 H2' DT B 7 10.120 9.314 2.479 1.00 1.00 H new ATOM 0 H2'' DT B 7 9.528 9.995 0.977 1.00 1.00 H new ATOM 0 H1' DT B 7 7.710 11.163 2.075 1.00 1.00 H new ATOM 0 H3 DT B 7 9.490 14.941 3.481 1.00 1.00 H new ATOM 0 H71 DT B 7 11.798 10.961 6.303 1.00 1.00 H new ATOM 0 H72 DT B 7 12.999 11.775 5.273 1.00 1.00 H new ATOM 0 H73 DT B 7 12.190 12.676 6.577 1.00 1.00 H new ATOM 0 H6 DT B 7 10.422 10.305 4.452 1.00 1.00 H new ATOM 982 P DA B 8 7.552 8.037 -0.723 1.00 1.00 P ATOM 983 OP1 DA B 8 6.247 8.084 -1.431 1.00 1.00 O ATOM 984 OP2 DA B 8 8.206 6.712 -0.558 1.00 1.00 O ATOM 985 O5' DA B 8 8.570 9.057 -1.438 1.00 1.00 O ATOM 986 C5' DA B 8 8.076 10.214 -2.100 1.00 1.00 C ATOM 987 C4' DA B 8 9.157 11.203 -2.563 1.00 1.00 C ATOM 988 O4' DA B 8 9.551 12.039 -1.486 1.00 1.00 O ATOM 989 C3' DA B 8 10.429 10.570 -3.167 1.00 1.00 C ATOM 990 O3' DA B 8 10.540 10.895 -4.551 1.00 1.00 O ATOM 991 C2' DA B 8 11.540 11.174 -2.302 1.00 1.00 C ATOM 992 C1' DA B 8 10.891 12.414 -1.704 1.00 1.00 C ATOM 993 N9 DA B 8 11.474 12.841 -0.413 1.00 1.00 N ATOM 994 C8 DA B 8 11.720 12.111 0.728 1.00 1.00 C ATOM 995 N7 DA B 8 12.195 12.810 1.731 1.00 1.00 N ATOM 996 C5 DA B 8 12.273 14.104 1.196 1.00 1.00 C ATOM 997 C6 DA B 8 12.673 15.381 1.675 1.00 1.00 C ATOM 998 N6 DA B 8 13.050 15.676 2.907 1.00 1.00 N ATOM 999 N1 DA B 8 12.632 16.456 0.889 1.00 1.00 N ATOM 1000 C2 DA B 8 12.190 16.306 -0.344 1.00 1.00 C ATOM 1001 N3 DA B 8 11.772 15.200 -0.934 1.00 1.00 N ATOM 1002 C4 DA B 8 11.842 14.124 -0.106 1.00 1.00 C ATOM 0 H5' DA B 8 7.391 10.734 -1.430 1.00 1.00 H new ATOM 0 H5'' DA B 8 7.496 9.899 -2.968 1.00 1.00 H new ATOM 0 H4' DA B 8 8.678 11.762 -3.367 1.00 1.00 H new ATOM 0 H3' DA B 8 10.451 9.480 -3.151 1.00 1.00 H new ATOM 0 H2' DA B 8 11.868 10.480 -1.528 1.00 1.00 H new ATOM 0 H2'' DA B 8 12.418 11.427 -2.896 1.00 1.00 H new ATOM 0 H1' DA B 8 11.030 13.258 -2.380 1.00 1.00 H new ATOM 0 H8 DA B 8 11.537 11.049 0.792 1.00 1.00 H new ATOM 0 H61 DA B 8 13.318 16.631 3.143 1.00 1.00 H new ATOM 0 H62 DA B 8 13.073 14.948 3.621 1.00 1.00 H new ATOM 0 H2 DA B 8 12.167 17.201 -0.949 1.00 1.00 H new ATOM 1014 P DT B 9 11.782 10.380 -5.481 1.00 1.00 P ATOM 1015 OP1 DT B 9 11.207 9.928 -6.774 1.00 1.00 O ATOM 1016 OP2 DT B 9 12.655 9.443 -4.721 1.00 1.00 O ATOM 1017 O5' DT B 9 12.590 11.758 -5.727 1.00 1.00 O ATOM 1018 C5' DT B 9 11.984 12.816 -6.459 1.00 1.00 C ATOM 1019 C4' DT B 9 12.842 14.086 -6.559 1.00 1.00 C ATOM 1020 O4' DT B 9 12.929 14.700 -5.281 1.00 1.00 O ATOM 1021 C3' DT B 9 14.257 13.821 -7.096 1.00 1.00 C ATOM 1022 O3' DT B 9 14.559 14.720 -8.162 1.00 1.00 O ATOM 1023 C2' DT B 9 15.110 13.991 -5.848 1.00 1.00 C ATOM 1024 C1' DT B 9 14.286 14.940 -4.977 1.00 1.00 C ATOM 1025 N1 DT B 9 14.511 14.755 -3.519 1.00 1.00 N ATOM 1026 C2 DT B 9 14.789 15.893 -2.749 1.00 1.00 C ATOM 1027 O2 DT B 9 14.754 17.046 -3.186 1.00 1.00 O ATOM 1028 N3 DT B 9 15.115 15.682 -1.431 1.00 1.00 N ATOM 1029 C4 DT B 9 15.163 14.462 -0.805 1.00 1.00 C ATOM 1030 O4 DT B 9 15.424 14.426 0.394 1.00 1.00 O ATOM 1031 C5 DT B 9 14.850 13.313 -1.656 1.00 1.00 C ATOM 1032 C7 DT B 9 14.912 11.908 -1.085 1.00 1.00 C ATOM 1033 C6 DT B 9 14.513 13.493 -2.958 1.00 1.00 C ATOM 0 H5' DT B 9 11.034 13.069 -5.989 1.00 1.00 H new ATOM 0 H5'' DT B 9 11.758 12.464 -7.465 1.00 1.00 H new ATOM 0 H4' DT B 9 12.350 14.745 -7.274 1.00 1.00 H new ATOM 0 H3' DT B 9 14.416 12.842 -7.549 1.00 1.00 H new ATOM 0 H2' DT B 9 15.285 13.038 -5.349 1.00 1.00 H new ATOM 0 H2'' DT B 9 16.088 14.411 -6.085 1.00 1.00 H new ATOM 0 H1' DT B 9 14.590 15.964 -5.196 1.00 1.00 H new ATOM 0 H3 DT B 9 15.341 16.503 -0.870 1.00 1.00 H new ATOM 0 H71 DT B 9 14.192 11.273 -1.602 1.00 1.00 H new ATOM 0 H72 DT B 9 15.915 11.504 -1.221 1.00 1.00 H new ATOM 0 H73 DT B 9 14.673 11.936 -0.022 1.00 1.00 H new ATOM 0 H6 DT B 9 14.243 12.640 -3.563 1.00 1.00 H new ATOM 1046 P DG B 10 16.011 14.781 -8.885 1.00 1.00 P ATOM 1047 OP1 DG B 10 15.800 15.264 -10.275 1.00 1.00 O ATOM 1048 OP2 DG B 10 16.736 13.496 -8.672 1.00 1.00 O ATOM 1049 O5' DG B 10 16.752 15.951 -8.053 1.00 1.00 O ATOM 1050 C5' DG B 10 16.261 17.288 -8.089 1.00 1.00 C ATOM 1051 C4' DG B 10 17.149 18.300 -7.345 1.00 1.00 C ATOM 1052 O4' DG B 10 17.030 18.125 -5.933 1.00 1.00 O ATOM 1053 C3' DG B 10 18.634 18.182 -7.736 1.00 1.00 C ATOM 1054 O3' DG B 10 19.186 19.482 -7.943 1.00 1.00 O ATOM 1055 C2' DG B 10 19.194 17.435 -6.526 1.00 1.00 C ATOM 1056 C1' DG B 10 18.332 17.976 -5.389 1.00 1.00 C ATOM 1057 N9 DG B 10 18.297 17.077 -4.219 1.00 1.00 N ATOM 1058 C8 DG B 10 18.099 15.726 -4.218 1.00 1.00 C ATOM 1059 N7 DG B 10 18.087 15.177 -3.031 1.00 1.00 N ATOM 1060 C5 DG B 10 18.343 16.263 -2.175 1.00 1.00 C ATOM 1061 C6 DG B 10 18.505 16.333 -0.744 1.00 1.00 C ATOM 1062 O6 DG B 10 18.379 15.442 0.098 1.00 1.00 O ATOM 1063 N1 DG B 10 18.855 17.585 -0.289 1.00 1.00 N ATOM 1064 C2 DG B 10 18.994 18.660 -1.096 1.00 1.00 C ATOM 1065 N2 DG B 10 19.346 19.774 -0.513 1.00 1.00 N ATOM 1066 N3 DG B 10 18.818 18.665 -2.417 1.00 1.00 N ATOM 1067 C4 DG B 10 18.504 17.425 -2.903 1.00 1.00 C ATOM 0 H5' DG B 10 15.261 17.309 -7.655 1.00 1.00 H new ATOM 0 H5'' DG B 10 16.164 17.601 -9.129 1.00 1.00 H new ATOM 0 H4' DG B 10 16.798 19.290 -7.635 1.00 1.00 H new ATOM 0 H3' DG B 10 18.853 17.665 -8.670 1.00 1.00 H new ATOM 0 H2' DG B 10 19.096 16.355 -6.633 1.00 1.00 H new ATOM 0 H2'' DG B 10 20.252 17.646 -6.371 1.00 1.00 H new ATOM 0 H1' DG B 10 18.744 18.916 -5.021 1.00 1.00 H new ATOM 0 H8 DG B 10 17.963 15.156 -5.125 1.00 1.00 H new ATOM 0 H1 DG B 10 19.018 17.707 0.710 1.00 1.00 H new ATOM 0 H21 DG B 10 19.468 20.622 -1.066 1.00 1.00 H new ATOM 0 H22 DG B 10 19.499 19.796 0.495 1.00 1.00 H new ATOM 1079 P DC B 11 20.702 19.727 -8.480 1.00 1.00 P ATOM 1080 OP1 DC B 11 20.651 20.810 -9.502 1.00 1.00 O ATOM 1081 OP2 DC B 11 21.322 18.426 -8.861 1.00 1.00 O ATOM 1082 O5' DC B 11 21.473 20.288 -7.168 1.00 1.00 O ATOM 1083 C5' DC B 11 21.119 21.543 -6.594 1.00 1.00 C ATOM 1084 C4' DC B 11 21.961 21.949 -5.371 1.00 1.00 C ATOM 1085 O4' DC B 11 21.662 21.111 -4.258 1.00 1.00 O ATOM 1086 C3' DC B 11 23.477 21.906 -5.641 1.00 1.00 C ATOM 1087 O3' DC B 11 24.113 23.075 -5.118 1.00 1.00 O ATOM 1088 C2' DC B 11 23.880 20.603 -4.945 1.00 1.00 C ATOM 1089 C1' DC B 11 22.853 20.484 -3.814 1.00 1.00 C ATOM 1090 N1 DC B 11 22.538 19.099 -3.378 1.00 1.00 N ATOM 1091 C2 DC B 11 22.516 18.780 -2.013 1.00 1.00 C ATOM 1092 O2 DC B 11 22.836 19.590 -1.140 1.00 1.00 O ATOM 1093 N3 DC B 11 22.151 17.543 -1.595 1.00 1.00 N ATOM 1094 C4 DC B 11 21.820 16.653 -2.505 1.00 1.00 C ATOM 1095 N4 DC B 11 21.432 15.496 -2.050 1.00 1.00 N ATOM 1096 C5 DC B 11 21.848 16.902 -3.903 1.00 1.00 C ATOM 1097 C6 DC B 11 22.212 18.147 -4.300 1.00 1.00 C ATOM 0 H5' DC B 11 20.069 21.511 -6.301 1.00 1.00 H new ATOM 0 H5'' DC B 11 21.214 22.316 -7.357 1.00 1.00 H new ATOM 0 H4' DC B 11 21.694 22.982 -5.149 1.00 1.00 H new ATOM 0 H3' DC B 11 23.768 21.912 -6.691 1.00 1.00 H new ATOM 0 H2' DC B 11 23.833 19.752 -5.624 1.00 1.00 H new ATOM 0 H2'' DC B 11 24.899 20.649 -4.561 1.00 1.00 H new ATOM 0 H1' DC B 11 23.294 20.960 -2.938 1.00 1.00 H new ATOM 0 H41 DC B 11 21.160 14.758 -2.699 1.00 1.00 H new ATOM 0 H42 DC B 11 21.400 15.328 -1.044 1.00 1.00 H new ATOM 0 H5 DC B 11 21.591 16.134 -4.618 1.00 1.00 H new ATOM 0 H6 DC B 11 22.244 18.386 -5.353 1.00 1.00 H new ATOM 1109 P DG B 12 25.661 23.453 -5.443 1.00 1.00 P ATOM 1110 OP1 DG B 12 25.849 24.904 -5.157 1.00 1.00 O ATOM 1111 OP2 DG B 12 26.010 22.956 -6.804 1.00 1.00 O ATOM 1112 O5' DG B 12 26.512 22.603 -4.356 1.00 1.00 O ATOM 1113 C5' DG B 12 26.495 22.945 -2.974 1.00 1.00 C ATOM 1114 C4' DG B 12 27.005 21.819 -2.061 1.00 1.00 C ATOM 1115 O4' DG B 12 26.095 20.734 -2.027 1.00 1.00 O ATOM 1116 C3' DG B 12 28.369 21.226 -2.456 1.00 1.00 C ATOM 1117 O3' DG B 12 29.455 21.865 -1.782 1.00 1.00 O ATOM 1118 C2' DG B 12 28.250 19.761 -2.038 1.00 1.00 C ATOM 1119 C1' DG B 12 26.806 19.614 -1.540 1.00 1.00 C ATOM 1120 N9 DG B 12 26.176 18.363 -2.001 1.00 1.00 N ATOM 1121 C8 DG B 12 25.955 17.964 -3.289 1.00 1.00 C ATOM 1122 N7 DG B 12 25.419 16.776 -3.401 1.00 1.00 N ATOM 1123 C5 DG B 12 25.288 16.350 -2.068 1.00 1.00 C ATOM 1124 C6 DG B 12 24.783 15.129 -1.487 1.00 1.00 C ATOM 1125 O6 DG B 12 24.317 14.127 -2.030 1.00 1.00 O ATOM 1126 N1 DG B 12 24.851 15.110 -0.111 1.00 1.00 N ATOM 1127 C2 DG B 12 25.362 16.113 0.639 1.00 1.00 C ATOM 1128 N2 DG B 12 25.413 15.921 1.928 1.00 1.00 N ATOM 1129 N3 DG B 12 25.832 17.258 0.157 1.00 1.00 N ATOM 1130 C4 DG B 12 25.762 17.320 -1.207 1.00 1.00 C ATOM 0 H5' DG B 12 25.477 23.205 -2.684 1.00 1.00 H new ATOM 0 H5'' DG B 12 27.107 23.834 -2.819 1.00 1.00 H new ATOM 0 H4' DG B 12 27.108 22.309 -1.093 1.00 1.00 H new ATOM 0 H3' DG B 12 28.585 21.360 -3.516 1.00 1.00 H new ATOM 0 H2' DG B 12 28.450 19.093 -2.876 1.00 1.00 H new ATOM 0 H2'' DG B 12 28.966 19.513 -1.255 1.00 1.00 H new ATOM 0 HO3' DG B 12 30.300 21.455 -2.062 1.00 1.00 H new ATOM 0 H1' DG B 12 26.794 19.570 -0.451 1.00 1.00 H new ATOM 0 H8 DG B 12 26.202 18.578 -4.143 1.00 1.00 H new ATOM 0 H1 DG B 12 24.493 14.287 0.373 1.00 1.00 H new ATOM 0 H21 DG B 12 25.790 16.647 2.537 1.00 1.00 H new ATOM 0 H22 DG B 12 25.076 15.045 2.327 1.00 1.00 H new TER 1143 DG B 12 ATOM 1144 O5' DC C 13 22.413 8.095 5.536 1.00 1.00 O ATOM 1145 C5' DC C 13 23.722 8.220 6.099 1.00 1.00 C ATOM 1146 C4' DC C 13 24.233 9.672 6.183 1.00 1.00 C ATOM 1147 O4' DC C 13 24.427 10.222 4.880 1.00 1.00 O ATOM 1148 C3' DC C 13 23.257 10.572 6.956 1.00 1.00 C ATOM 1149 O3' DC C 13 23.961 11.389 7.893 1.00 1.00 O ATOM 1150 C2' DC C 13 22.597 11.370 5.831 1.00 1.00 C ATOM 1151 C1' DC C 13 23.735 11.459 4.809 1.00 1.00 C ATOM 1152 N1 DC C 13 23.327 11.733 3.405 1.00 1.00 N ATOM 1153 C2 DC C 13 24.002 12.708 2.655 1.00 1.00 C ATOM 1154 O2 DC C 13 24.856 13.446 3.149 1.00 1.00 O ATOM 1155 N3 DC C 13 23.739 12.875 1.335 1.00 1.00 N ATOM 1156 C4 DC C 13 22.800 12.131 0.786 1.00 1.00 C ATOM 1157 N4 DC C 13 22.621 12.297 -0.495 1.00 1.00 N ATOM 1158 C5 DC C 13 22.064 11.145 1.501 1.00 1.00 C ATOM 1159 C6 DC C 13 22.361 10.976 2.809 1.00 1.00 C ATOM 0 H5' DC C 13 24.421 7.634 5.502 1.00 1.00 H new ATOM 0 H5'' DC C 13 23.718 7.789 7.100 1.00 1.00 H new ATOM 0 H4' DC C 13 25.184 9.639 6.714 1.00 1.00 H new ATOM 0 H3' DC C 13 22.528 10.040 7.567 1.00 1.00 H new ATOM 0 H2' DC C 13 21.722 10.861 5.427 1.00 1.00 H new ATOM 0 H2'' DC C 13 22.268 12.354 6.165 1.00 1.00 H new ATOM 0 HO5' DC C 13 22.156 7.150 5.513 1.00 1.00 H new ATOM 0 H1' DC C 13 24.348 12.322 5.071 1.00 1.00 H new ATOM 0 H41 DC C 13 21.911 11.754 -0.985 1.00 1.00 H new ATOM 0 H42 DC C 13 23.191 12.970 -1.007 1.00 1.00 H new ATOM 0 H5 DC C 13 21.299 10.555 1.018 1.00 1.00 H new ATOM 0 H6 DC C 13 21.829 10.235 3.387 1.00 1.00 H new ATOM 1172 P DG C 14 23.205 12.322 8.990 1.00 1.00 P ATOM 1173 OP1 DG C 14 23.985 12.246 10.257 1.00 1.00 O ATOM 1174 OP2 DG C 14 21.762 11.949 9.032 1.00 1.00 O ATOM 1175 O5' DG C 14 23.314 13.833 8.393 1.00 1.00 O ATOM 1176 C5' DG C 14 24.533 14.577 8.463 1.00 1.00 C ATOM 1177 C4' DG C 14 24.413 16.070 8.086 1.00 1.00 C ATOM 1178 O4' DG C 14 24.338 16.238 6.672 1.00 1.00 O ATOM 1179 C3' DG C 14 23.195 16.765 8.726 1.00 1.00 C ATOM 1180 O3' DG C 14 23.560 18.070 9.182 1.00 1.00 O ATOM 1181 C2' DG C 14 22.205 16.751 7.559 1.00 1.00 C ATOM 1182 C1' DG C 14 23.110 16.867 6.334 1.00 1.00 C ATOM 1183 N9 DG C 14 22.551 16.219 5.133 1.00 1.00 N ATOM 1184 C8 DG C 14 21.930 15.004 5.053 1.00 1.00 C ATOM 1185 N7 DG C 14 21.600 14.635 3.844 1.00 1.00 N ATOM 1186 C5 DG C 14 22.007 15.726 3.060 1.00 1.00 C ATOM 1187 C6 DG C 14 21.897 15.976 1.647 1.00 1.00 C ATOM 1188 O6 DG C 14 21.465 15.245 0.757 1.00 1.00 O ATOM 1189 N1 DG C 14 22.350 17.221 1.267 1.00 1.00 N ATOM 1190 C2 DG C 14 22.897 18.111 2.124 1.00 1.00 C ATOM 1191 N2 DG C 14 23.298 19.242 1.609 1.00 1.00 N ATOM 1192 N3 DG C 14 23.056 17.920 3.431 1.00 1.00 N ATOM 1193 C4 DG C 14 22.577 16.707 3.846 1.00 1.00 C ATOM 0 H5' DG C 14 25.264 14.110 7.803 1.00 1.00 H new ATOM 0 H5'' DG C 14 24.927 14.505 9.477 1.00 1.00 H new ATOM 0 H4' DG C 14 25.315 16.539 8.478 1.00 1.00 H new ATOM 0 H3' DG C 14 22.781 16.295 9.618 1.00 1.00 H new ATOM 0 H2' DG C 14 21.617 15.833 7.540 1.00 1.00 H new ATOM 0 H2'' DG C 14 21.500 17.580 7.619 1.00 1.00 H new ATOM 0 H1' DG C 14 23.228 17.922 6.086 1.00 1.00 H new ATOM 0 H8 DG C 14 21.728 14.396 5.922 1.00 1.00 H new ATOM 0 H1 DG C 14 22.268 17.485 0.285 1.00 1.00 H new ATOM 0 H21 DG C 14 23.719 19.953 2.206 1.00 1.00 H new ATOM 0 H22 DG C 14 23.190 19.414 0.609 1.00 1.00 H new ATOM 1205 P DC C 15 22.526 19.073 9.938 1.00 1.00 P ATOM 1206 OP1 DC C 15 23.334 20.064 10.706 1.00 1.00 O ATOM 1207 OP2 DC C 15 21.516 18.263 10.675 1.00 1.00 O ATOM 1208 O5' DC C 15 21.778 19.848 8.728 1.00 1.00 O ATOM 1209 C5' DC C 15 22.500 20.715 7.855 1.00 1.00 C ATOM 1210 C4' DC C 15 21.759 21.029 6.547 1.00 1.00 C ATOM 1211 O4' DC C 15 21.583 19.862 5.763 1.00 1.00 O ATOM 1212 C3' DC C 15 20.375 21.675 6.722 1.00 1.00 C ATOM 1213 O3' DC C 15 20.488 23.095 6.598 1.00 1.00 O ATOM 1214 C2' DC C 15 19.540 21.011 5.620 1.00 1.00 C ATOM 1215 C1' DC C 15 20.524 20.124 4.864 1.00 1.00 C ATOM 1216 N1 DC C 15 19.897 18.866 4.406 1.00 1.00 N ATOM 1217 C2 DC C 15 19.650 18.670 3.043 1.00 1.00 C ATOM 1218 O2 DC C 15 19.898 19.531 2.198 1.00 1.00 O ATOM 1219 N3 DC C 15 19.131 17.501 2.600 1.00 1.00 N ATOM 1220 C4 DC C 15 18.835 16.575 3.485 1.00 1.00 C ATOM 1221 N4 DC C 15 18.354 15.471 2.988 1.00 1.00 N ATOM 1222 C5 DC C 15 19.025 16.730 4.891 1.00 1.00 C ATOM 1223 C6 DC C 15 19.557 17.905 5.315 1.00 1.00 C ATOM 0 H5' DC C 15 23.461 20.259 7.618 1.00 1.00 H new ATOM 0 H5'' DC C 15 22.710 21.649 8.377 1.00 1.00 H new ATOM 0 H4' DC C 15 22.406 21.755 6.055 1.00 1.00 H new ATOM 0 H3' DC C 15 19.913 21.526 7.698 1.00 1.00 H new ATOM 0 H2' DC C 15 18.723 20.425 6.042 1.00 1.00 H new ATOM 0 H2'' DC C 15 19.092 21.755 4.961 1.00 1.00 H new ATOM 0 H1' DC C 15 20.876 20.624 3.961 1.00 1.00 H new ATOM 0 H41 DC C 15 18.099 14.702 3.607 1.00 1.00 H new ATOM 0 H42 DC C 15 18.233 15.376 1.980 1.00 1.00 H new ATOM 0 H5 DC C 15 18.758 15.948 5.586 1.00 1.00 H new ATOM 0 H6 DC C 15 19.711 18.080 6.370 1.00 1.00 H new ATOM 1235 P DA C 16 19.216 24.106 6.716 1.00 1.00 P ATOM 1236 OP1 DA C 16 19.748 25.475 6.973 1.00 1.00 O ATOM 1237 OP2 DA C 16 18.230 23.541 7.682 1.00 1.00 O ATOM 1238 O5' DA C 16 18.550 24.087 5.235 1.00 1.00 O ATOM 1239 C5' DA C 16 19.304 24.459 4.082 1.00 1.00 C ATOM 1240 C4' DA C 16 18.536 24.315 2.753 1.00 1.00 C ATOM 1241 O4' DA C 16 18.394 22.953 2.352 1.00 1.00 O ATOM 1242 C3' DA C 16 17.134 24.954 2.808 1.00 1.00 C ATOM 1243 O3' DA C 16 16.931 25.814 1.686 1.00 1.00 O ATOM 1244 C2' DA C 16 16.249 23.709 2.830 1.00 1.00 C ATOM 1245 C1' DA C 16 17.046 22.741 1.965 1.00 1.00 C ATOM 1246 N9 DA C 16 16.683 21.341 2.236 1.00 1.00 N ATOM 1247 C8 DA C 16 16.694 20.737 3.459 1.00 1.00 C ATOM 1248 N7 DA C 16 16.476 19.449 3.435 1.00 1.00 N ATOM 1249 C5 DA C 16 16.228 19.215 2.071 1.00 1.00 C ATOM 1250 C6 DA C 16 15.887 18.075 1.301 1.00 1.00 C ATOM 1251 N6 DA C 16 15.812 16.852 1.784 1.00 1.00 N ATOM 1252 N1 DA C 16 15.587 18.167 0.004 1.00 1.00 N ATOM 1253 C2 DA C 16 15.649 19.366 -0.557 1.00 1.00 C ATOM 1254 N3 DA C 16 16.014 20.514 0.010 1.00 1.00 N ATOM 1255 C4 DA C 16 16.293 20.371 1.339 1.00 1.00 C ATOM 0 H5' DA C 16 20.204 23.846 4.037 1.00 1.00 H new ATOM 0 H5'' DA C 16 19.628 25.494 4.192 1.00 1.00 H new ATOM 0 H4' DA C 16 19.143 24.846 2.020 1.00 1.00 H new ATOM 0 H3' DA C 16 16.937 25.612 3.654 1.00 1.00 H new ATOM 0 H2' DA C 16 16.104 23.329 3.841 1.00 1.00 H new ATOM 0 H2'' DA C 16 15.259 23.904 2.418 1.00 1.00 H new ATOM 0 H1' DA C 16 16.859 22.913 0.905 1.00 1.00 H new ATOM 0 H8 DA C 16 16.869 21.281 4.375 1.00 1.00 H new ATOM 0 H61 DA C 16 15.560 16.076 1.171 1.00 1.00 H new ATOM 0 H62 DA C 16 16.006 16.681 2.771 1.00 1.00 H new ATOM 0 H2 DA C 16 15.370 19.418 -1.599 1.00 1.00 H new ATOM 1267 P DT C 17 15.606 26.743 1.522 1.00 1.00 P ATOM 1268 OP1 DT C 17 15.954 27.877 0.619 1.00 1.00 O ATOM 1269 OP2 DT C 17 15.058 27.063 2.872 1.00 1.00 O ATOM 1270 O5' DT C 17 14.544 25.785 0.756 1.00 1.00 O ATOM 1271 C5' DT C 17 14.770 25.382 -0.592 1.00 1.00 C ATOM 1272 C4' DT C 17 13.743 24.367 -1.118 1.00 1.00 C ATOM 1273 O4' DT C 17 13.918 23.101 -0.489 1.00 1.00 O ATOM 1274 C3' DT C 17 12.277 24.810 -0.928 1.00 1.00 C ATOM 1275 O3' DT C 17 11.616 24.826 -2.191 1.00 1.00 O ATOM 1276 C2' DT C 17 11.750 23.759 0.055 1.00 1.00 C ATOM 1277 C1' DT C 17 12.634 22.551 -0.266 1.00 1.00 C ATOM 1278 N1 DT C 17 12.707 21.521 0.805 1.00 1.00 N ATOM 1279 C2 DT C 17 12.576 20.173 0.438 1.00 1.00 C ATOM 1280 O2 DT C 17 12.354 19.771 -0.709 1.00 1.00 O ATOM 1281 N3 DT C 17 12.725 19.252 1.445 1.00 1.00 N ATOM 1282 C4 DT C 17 12.974 19.519 2.768 1.00 1.00 C ATOM 1283 O4 DT C 17 13.115 18.569 3.537 1.00 1.00 O ATOM 1284 C5 DT C 17 13.064 20.940 3.092 1.00 1.00 C ATOM 1285 C7 DT C 17 13.299 21.386 4.522 1.00 1.00 C ATOM 1286 C6 DT C 17 12.947 21.880 2.119 1.00 1.00 C ATOM 0 H5' DT C 17 15.767 24.949 -0.669 1.00 1.00 H new ATOM 0 H5'' DT C 17 14.755 26.264 -1.232 1.00 1.00 H new ATOM 0 H4' DT C 17 13.931 24.298 -2.189 1.00 1.00 H new ATOM 0 H3' DT C 17 12.128 25.819 -0.542 1.00 1.00 H new ATOM 0 H2' DT C 17 11.858 24.079 1.091 1.00 1.00 H new ATOM 0 H2'' DT C 17 10.693 23.545 -0.104 1.00 1.00 H new ATOM 0 H1' DT C 17 12.215 22.015 -1.118 1.00 1.00 H new ATOM 0 H3 DT C 17 12.642 18.270 1.183 1.00 1.00 H new ATOM 0 H71 DT C 17 13.846 22.329 4.524 1.00 1.00 H new ATOM 0 H72 DT C 17 12.341 21.521 5.023 1.00 1.00 H new ATOM 0 H73 DT C 17 13.880 20.629 5.048 1.00 1.00 H new ATOM 0 H6 DT C 17 13.043 22.925 2.375 1.00 1.00 H new ATOM 1299 P DA C 18 10.084 25.331 -2.369 1.00 1.00 P ATOM 1300 OP1 DA C 18 9.883 25.684 -3.804 1.00 1.00 O ATOM 1301 OP2 DA C 18 9.779 26.365 -1.339 1.00 1.00 O ATOM 1302 O5' DA C 18 9.218 24.004 -2.041 1.00 1.00 O ATOM 1303 C5' DA C 18 9.340 22.842 -2.849 1.00 1.00 C ATOM 1304 C4' DA C 18 8.485 21.657 -2.378 1.00 1.00 C ATOM 1305 O4' DA C 18 9.116 20.928 -1.338 1.00 1.00 O ATOM 1306 C3' DA C 18 7.072 22.026 -1.905 1.00 1.00 C ATOM 1307 O3' DA C 18 6.189 21.413 -2.838 1.00 1.00 O ATOM 1308 C2' DA C 18 7.049 21.493 -0.469 1.00 1.00 C ATOM 1309 C1' DA C 18 8.106 20.394 -0.505 1.00 1.00 C ATOM 1310 N9 DA C 18 8.720 20.032 0.788 1.00 1.00 N ATOM 1311 C8 DA C 18 9.066 20.846 1.835 1.00 1.00 C ATOM 1312 N7 DA C 18 9.576 20.216 2.866 1.00 1.00 N ATOM 1313 C5 DA C 18 9.547 18.875 2.460 1.00 1.00 C ATOM 1314 C6 DA C 18 9.883 17.627 3.049 1.00 1.00 C ATOM 1315 N6 DA C 18 10.330 17.430 4.278 1.00 1.00 N ATOM 1316 N1 DA C 18 9.765 16.492 2.368 1.00 1.00 N ATOM 1317 C2 DA C 18 9.342 16.554 1.120 1.00 1.00 C ATOM 1318 N3 DA C 18 8.957 17.625 0.441 1.00 1.00 N ATOM 1319 C4 DA C 18 9.072 18.763 1.180 1.00 1.00 C ATOM 0 H5' DA C 18 10.386 22.536 -2.870 1.00 1.00 H new ATOM 0 H5'' DA C 18 9.061 23.093 -3.872 1.00 1.00 H new ATOM 0 H4' DA C 18 8.386 21.048 -3.276 1.00 1.00 H new ATOM 0 H3' DA C 18 6.778 23.075 -1.878 1.00 1.00 H new ATOM 0 H2' DA C 18 7.296 22.269 0.255 1.00 1.00 H new ATOM 0 H2'' DA C 18 6.068 21.103 -0.197 1.00 1.00 H new ATOM 0 H1' DA C 18 7.633 19.471 -0.841 1.00 1.00 H new ATOM 0 H8 DA C 18 8.930 21.917 1.813 1.00 1.00 H new ATOM 0 H61 DA C 18 10.541 16.485 4.599 1.00 1.00 H new ATOM 0 H62 DA C 18 10.464 18.223 4.905 1.00 1.00 H new ATOM 0 H2 DA C 18 9.305 15.616 0.586 1.00 1.00 H new ATOM 1331 P DT C 19 4.597 21.489 -2.743 1.00 1.00 P ATOM 1332 OP1 DT C 19 4.061 21.157 -4.084 1.00 1.00 O ATOM 1333 OP2 DT C 19 4.171 22.732 -2.068 1.00 1.00 O ATOM 1334 O5' DT C 19 4.316 20.239 -1.840 1.00 1.00 O ATOM 1335 C5' DT C 19 4.589 18.922 -2.290 1.00 1.00 C ATOM 1336 C4' DT C 19 4.027 17.925 -1.280 1.00 1.00 C ATOM 1337 O4' DT C 19 5.005 17.763 -0.268 1.00 1.00 O ATOM 1338 C3' DT C 19 2.738 18.441 -0.597 1.00 1.00 C ATOM 1339 O3' DT C 19 1.768 17.443 -0.416 1.00 1.00 O ATOM 1340 C2' DT C 19 3.247 18.868 0.763 1.00 1.00 C ATOM 1341 C1' DT C 19 4.326 17.802 0.962 1.00 1.00 C ATOM 1342 N1 DT C 19 5.282 18.039 2.067 1.00 1.00 N ATOM 1343 C2 DT C 19 5.668 16.934 2.834 1.00 1.00 C ATOM 1344 O2 DT C 19 5.345 15.774 2.583 1.00 1.00 O ATOM 1345 N3 DT C 19 6.427 17.195 3.948 1.00 1.00 N ATOM 1346 C4 DT C 19 6.757 18.441 4.422 1.00 1.00 C ATOM 1347 O4 DT C 19 7.393 18.511 5.471 1.00 1.00 O ATOM 1348 C5 DT C 19 6.306 19.558 3.585 1.00 1.00 C ATOM 1349 C7 DT C 19 6.561 21.000 3.995 1.00 1.00 C ATOM 1350 C6 DT C 19 5.641 19.317 2.425 1.00 1.00 C ATOM 0 H5' DT C 19 5.664 18.778 -2.403 1.00 1.00 H new ATOM 0 H5'' DT C 19 4.141 18.758 -3.270 1.00 1.00 H new ATOM 0 H4' DT C 19 3.788 17.000 -1.804 1.00 1.00 H new ATOM 0 H3' DT C 19 2.253 19.215 -1.192 1.00 1.00 H new ATOM 0 H2' DT C 19 3.651 19.880 0.762 1.00 1.00 H new ATOM 0 H2'' DT C 19 2.475 18.833 1.531 1.00 1.00 H new ATOM 0 H1' DT C 19 3.848 16.867 1.254 1.00 1.00 H new ATOM 0 H3 DT C 19 6.777 16.392 4.470 1.00 1.00 H new ATOM 0 H71 DT C 19 6.660 21.620 3.104 1.00 1.00 H new ATOM 0 H72 DT C 19 5.726 21.360 4.596 1.00 1.00 H new ATOM 0 H73 DT C 19 7.479 21.055 4.579 1.00 1.00 H new ATOM 0 H6 DT C 19 5.391 20.142 1.774 1.00 1.00 H new ATOM 1363 P DA C 20 0.744 17.069 -1.597 1.00 1.00 P ATOM 1364 OP1 DA C 20 1.498 17.069 -2.879 1.00 1.00 O ATOM 1365 OP2 DA C 20 -0.449 17.946 -1.475 1.00 1.00 O ATOM 1366 O5' DA C 20 0.407 15.566 -1.128 1.00 1.00 O ATOM 1367 C5' DA C 20 -0.317 15.358 0.076 1.00 1.00 C ATOM 1368 C4' DA C 20 0.071 14.047 0.761 1.00 1.00 C ATOM 1369 O4' DA C 20 1.338 14.237 1.391 1.00 1.00 O ATOM 1370 C3' DA C 20 -0.959 13.768 1.854 1.00 1.00 C ATOM 1371 O3' DA C 20 -1.223 12.381 2.002 1.00 1.00 O ATOM 1372 C2' DA C 20 -0.278 14.406 3.053 1.00 1.00 C ATOM 1373 C1' DA C 20 1.200 14.168 2.796 1.00 1.00 C ATOM 1374 N9 DA C 20 1.979 15.236 3.463 1.00 1.00 N ATOM 1375 C8 DA C 20 2.033 16.564 3.113 1.00 1.00 C ATOM 1376 N7 DA C 20 2.671 17.332 3.955 1.00 1.00 N ATOM 1377 C5 DA C 20 3.075 16.425 4.941 1.00 1.00 C ATOM 1378 C6 DA C 20 3.815 16.533 6.140 1.00 1.00 C ATOM 1379 N6 DA C 20 4.342 17.659 6.586 1.00 1.00 N ATOM 1380 N1 DA C 20 4.056 15.471 6.912 1.00 1.00 N ATOM 1381 C2 DA C 20 3.582 14.304 6.501 1.00 1.00 C ATOM 1382 N3 DA C 20 2.877 14.035 5.410 1.00 1.00 N ATOM 1383 C4 DA C 20 2.662 15.148 4.655 1.00 1.00 C ATOM 0 H5' DA C 20 -1.385 15.351 -0.140 1.00 1.00 H new ATOM 0 H5'' DA C 20 -0.135 16.190 0.756 1.00 1.00 H new ATOM 0 H4' DA C 20 0.112 13.228 0.043 1.00 1.00 H new ATOM 0 H3' DA C 20 -1.956 14.167 1.665 1.00 1.00 H new ATOM 0 H2' DA C 20 -0.506 15.470 3.124 1.00 1.00 H new ATOM 0 H2'' DA C 20 -0.601 13.948 3.988 1.00 1.00 H new ATOM 0 H1' DA C 20 1.560 13.214 3.181 1.00 1.00 H new ATOM 0 H8 DA C 20 1.581 16.944 2.209 1.00 1.00 H new ATOM 0 H61 DA C 20 4.865 17.665 7.461 1.00 1.00 H new ATOM 0 H62 DA C 20 4.225 18.522 6.055 1.00 1.00 H new ATOM 0 H2 DA C 20 3.798 13.460 7.139 1.00 1.00 H new ATOM 1395 P DT C 21 -2.466 11.864 2.887 1.00 1.00 P ATOM 1396 OP1 DT C 21 -2.844 10.506 2.429 1.00 1.00 O ATOM 1397 OP2 DT C 21 -3.520 12.912 2.846 1.00 1.00 O ATOM 1398 O5' DT C 21 -1.888 11.789 4.385 1.00 1.00 O ATOM 1399 C5' DT C 21 -0.883 10.850 4.737 1.00 1.00 C ATOM 1400 C4' DT C 21 -0.741 10.685 6.259 1.00 1.00 C ATOM 1401 O4' DT C 21 0.074 11.712 6.810 1.00 1.00 O ATOM 1402 C3' DT C 21 -2.085 10.708 6.990 1.00 1.00 C ATOM 1403 O3' DT C 21 -2.065 9.733 8.020 1.00 1.00 O ATOM 1404 C2' DT C 21 -2.164 12.134 7.509 1.00 1.00 C ATOM 1405 C1' DT C 21 -0.694 12.474 7.730 1.00 1.00 C ATOM 1406 N1 DT C 21 -0.316 13.907 7.590 1.00 1.00 N ATOM 1407 C2 DT C 21 0.626 14.401 8.505 1.00 1.00 C ATOM 1408 O2 DT C 21 1.104 13.733 9.420 1.00 1.00 O ATOM 1409 N3 DT C 21 1.039 15.694 8.352 1.00 1.00 N ATOM 1410 C4 DT C 21 0.583 16.572 7.407 1.00 1.00 C ATOM 1411 O4 DT C 21 1.063 17.705 7.387 1.00 1.00 O ATOM 1412 C5 DT C 21 -0.430 16.029 6.501 1.00 1.00 C ATOM 1413 C7 DT C 21 -1.045 16.924 5.441 1.00 1.00 C ATOM 1414 C6 DT C 21 -0.833 14.731 6.603 1.00 1.00 C ATOM 0 H5' DT C 21 0.071 11.170 4.319 1.00 1.00 H new ATOM 0 H5'' DT C 21 -1.120 9.884 4.290 1.00 1.00 H new ATOM 0 H4' DT C 21 -0.281 9.708 6.403 1.00 1.00 H new ATOM 0 H3' DT C 21 -2.954 10.464 6.380 1.00 1.00 H new ATOM 0 H2' DT C 21 -2.634 12.804 6.789 1.00 1.00 H new ATOM 0 H2'' DT C 21 -2.741 12.201 8.431 1.00 1.00 H new ATOM 0 H1' DT C 21 -0.495 12.235 8.775 1.00 1.00 H new ATOM 0 H3 DT C 21 1.750 16.035 8.999 1.00 1.00 H new ATOM 0 H71 DT C 21 -1.058 17.954 5.797 1.00 1.00 H new ATOM 0 H72 DT C 21 -0.455 16.864 4.527 1.00 1.00 H new ATOM 0 H73 DT C 21 -2.065 16.598 5.237 1.00 1.00 H new ATOM 0 H6 DT C 21 -1.562 14.341 5.908 1.00 1.00 H new ATOM 1427 P DG C 22 -3.374 9.343 8.852 1.00 1.00 P ATOM 1428 OP1 DG C 22 -3.236 7.908 9.198 1.00 1.00 O ATOM 1429 OP2 DG C 22 -4.599 9.772 8.134 1.00 1.00 O ATOM 1430 O5' DG C 22 -3.193 10.216 10.177 1.00 1.00 O ATOM 1431 C5' DG C 22 -2.174 9.895 11.109 1.00 1.00 C ATOM 1432 C4' DG C 22 -2.001 10.960 12.198 1.00 1.00 C ATOM 1433 O4' DG C 22 -1.364 12.111 11.655 1.00 1.00 O ATOM 1434 C3' DG C 22 -3.318 11.395 12.871 1.00 1.00 C ATOM 1435 O3' DG C 22 -3.184 11.223 14.282 1.00 1.00 O ATOM 1436 C2' DG C 22 -3.430 12.846 12.401 1.00 1.00 C ATOM 1437 C1' DG C 22 -1.967 13.236 12.257 1.00 1.00 C ATOM 1438 N9 DG C 22 -1.760 14.451 11.454 1.00 1.00 N ATOM 1439 C8 DG C 22 -2.322 14.768 10.250 1.00 1.00 C ATOM 1440 N7 DG C 22 -1.961 15.933 9.775 1.00 1.00 N ATOM 1441 C5 DG C 22 -1.099 16.433 10.766 1.00 1.00 C ATOM 1442 C6 DG C 22 -0.360 17.670 10.867 1.00 1.00 C ATOM 1443 O6 DG C 22 -0.264 18.589 10.055 1.00 1.00 O ATOM 1444 N1 DG C 22 0.320 17.813 12.056 1.00 1.00 N ATOM 1445 C2 DG C 22 0.343 16.867 13.021 1.00 1.00 C ATOM 1446 N2 DG C 22 1.043 17.137 14.087 1.00 1.00 N ATOM 1447 N3 DG C 22 -0.282 15.694 12.965 1.00 1.00 N ATOM 1448 C4 DG C 22 -0.993 15.537 11.808 1.00 1.00 C ATOM 0 H5' DG C 22 -1.230 9.769 10.578 1.00 1.00 H new ATOM 0 H5'' DG C 22 -2.406 8.939 11.578 1.00 1.00 H new ATOM 0 H4' DG C 22 -1.389 10.493 12.970 1.00 1.00 H new ATOM 0 H3' DG C 22 -4.218 10.833 12.620 1.00 1.00 H new ATOM 0 H2' DG C 22 -3.971 12.931 11.459 1.00 1.00 H new ATOM 0 H2'' DG C 22 -3.951 13.472 13.125 1.00 1.00 H new ATOM 0 H1' DG C 22 -1.533 13.487 13.225 1.00 1.00 H new ATOM 0 H8 DG C 22 -3.007 14.112 9.733 1.00 1.00 H new ATOM 0 H1 DG C 22 0.834 18.679 12.217 1.00 1.00 H new ATOM 0 H21 DG C 22 1.096 16.459 14.848 1.00 1.00 H new ATOM 0 H22 DG C 22 1.538 18.026 14.161 1.00 1.00 H new ATOM 1460 P DC C 23 -4.366 11.550 15.345 1.00 1.00 P ATOM 1461 OP1 DC C 23 -4.429 10.427 16.322 1.00 1.00 O ATOM 1462 OP2 DC C 23 -5.613 11.932 14.622 1.00 1.00 O ATOM 1463 O5' DC C 23 -3.790 12.865 16.102 1.00 1.00 O ATOM 1464 C5' DC C 23 -2.583 12.791 16.862 1.00 1.00 C ATOM 1465 C4' DC C 23 -2.193 14.100 17.574 1.00 1.00 C ATOM 1466 O4' DC C 23 -1.762 15.076 16.627 1.00 1.00 O ATOM 1467 C3' DC C 23 -3.344 14.681 18.414 1.00 1.00 C ATOM 1468 O3' DC C 23 -2.867 15.076 19.702 1.00 1.00 O ATOM 1469 C2' DC C 23 -3.827 15.829 17.524 1.00 1.00 C ATOM 1470 C1' DC C 23 -2.568 16.236 16.753 1.00 1.00 C ATOM 1471 N1 DC C 23 -2.842 16.804 15.407 1.00 1.00 N ATOM 1472 C2 DC C 23 -2.283 18.034 15.029 1.00 1.00 C ATOM 1473 O2 DC C 23 -1.573 18.700 15.785 1.00 1.00 O ATOM 1474 N3 DC C 23 -2.519 18.548 13.796 1.00 1.00 N ATOM 1475 C4 DC C 23 -3.280 17.859 12.971 1.00 1.00 C ATOM 1476 N4 DC C 23 -3.433 18.377 11.784 1.00 1.00 N ATOM 1477 C5 DC C 23 -3.868 16.605 13.289 1.00 1.00 C ATOM 1478 C6 DC C 23 -3.619 16.108 14.527 1.00 1.00 C ATOM 0 H5' DC C 23 -1.769 12.497 16.199 1.00 1.00 H new ATOM 0 H5'' DC C 23 -2.687 12.004 17.609 1.00 1.00 H new ATOM 0 H4' DC C 23 -1.376 13.852 18.252 1.00 1.00 H new ATOM 0 H3' DC C 23 -4.156 13.994 18.653 1.00 1.00 H new ATOM 0 H2' DC C 23 -4.623 15.509 16.852 1.00 1.00 H new ATOM 0 H2'' DC C 23 -4.221 16.656 18.114 1.00 1.00 H new ATOM 0 H1' DC C 23 -2.072 17.031 17.309 1.00 1.00 H new ATOM 0 H41 DC C 23 -4.009 17.900 11.090 1.00 1.00 H new ATOM 0 H42 DC C 23 -2.977 19.259 11.550 1.00 1.00 H new ATOM 0 H5 DC C 23 -4.484 16.073 12.579 1.00 1.00 H new ATOM 0 H6 DC C 23 -4.038 15.156 14.818 1.00 1.00 H new ATOM 1490 P DG C 24 -3.871 15.446 20.927 1.00 1.00 P ATOM 1491 OP1 DG C 24 -3.100 15.358 22.200 1.00 1.00 O ATOM 1492 OP2 DG C 24 -5.117 14.638 20.805 1.00 1.00 O ATOM 1493 O5' DG C 24 -4.241 16.998 20.659 1.00 1.00 O ATOM 1494 C5' DG C 24 -3.278 18.031 20.860 1.00 1.00 C ATOM 1495 C4' DG C 24 -3.648 19.356 20.175 1.00 1.00 C ATOM 1496 O4' DG C 24 -3.535 19.265 18.764 1.00 1.00 O ATOM 1497 C3' DG C 24 -5.065 19.875 20.459 1.00 1.00 C ATOM 1498 O3' DG C 24 -5.112 20.733 21.601 1.00 1.00 O ATOM 1499 C2' DG C 24 -5.420 20.635 19.181 1.00 1.00 C ATOM 1500 C1' DG C 24 -4.237 20.372 18.239 1.00 1.00 C ATOM 1501 N9 DG C 24 -4.670 20.121 16.852 1.00 1.00 N ATOM 1502 C8 DG C 24 -5.481 19.119 16.397 1.00 1.00 C ATOM 1503 N7 DG C 24 -5.780 19.202 15.124 1.00 1.00 N ATOM 1504 C5 DG C 24 -5.119 20.373 14.711 1.00 1.00 C ATOM 1505 C6 DG C 24 -5.063 21.061 13.441 1.00 1.00 C ATOM 1506 O6 DG C 24 -5.584 20.772 12.362 1.00 1.00 O ATOM 1507 N1 DG C 24 -4.322 22.225 13.476 1.00 1.00 N ATOM 1508 C2 DG C 24 -3.696 22.686 14.581 1.00 1.00 C ATOM 1509 N2 DG C 24 -3.044 23.810 14.474 1.00 1.00 N ATOM 1510 N3 DG C 24 -3.709 22.094 15.770 1.00 1.00 N ATOM 1511 C4 DG C 24 -4.438 20.937 15.771 1.00 1.00 C ATOM 0 H5' DG C 24 -2.312 17.694 20.484 1.00 1.00 H new ATOM 0 H5'' DG C 24 -3.161 18.204 21.930 1.00 1.00 H new ATOM 0 H4' DG C 24 -2.932 20.055 20.608 1.00 1.00 H new ATOM 0 H3' DG C 24 -5.762 19.070 20.694 1.00 1.00 H new ATOM 0 H2' DG C 24 -6.356 20.277 18.753 1.00 1.00 H new ATOM 0 H2'' DG C 24 -5.545 21.700 19.374 1.00 1.00 H new ATOM 0 HO3' DG C 24 -6.032 21.040 21.742 1.00 1.00 H new ATOM 0 H1' DG C 24 -3.598 21.254 18.188 1.00 1.00 H new ATOM 0 H8 DG C 24 -5.845 18.326 17.033 1.00 1.00 H new ATOM 0 H1 DG C 24 -4.242 22.769 12.617 1.00 1.00 H new ATOM 0 H21 DG C 24 -2.556 24.196 15.283 1.00 1.00 H new ATOM 0 H22 DG C 24 -3.022 24.304 13.582 1.00 1.00 H new TER 1524 DG C 24