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=-0.42) USER MOD Set 1.2: A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 165:sc= 1.21 (180deg=0.728) USER MOD Single : A 83 LYS NZ :NH3+ 165:sc= 2.09 (180deg=1.43) 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 87 ASN : amide:sc= 1.56 K(o=1.6,f=-8.9!) USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0.0777 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.183 USER MOD Single : A 97 LYS NZ :NH3+ 167:sc= 1.23 (180deg=1.04) USER MOD Single : A 100 ASN : amide:sc= 0.105 K(o=0.11,f=-1.3) USER MOD Single : A 101 HIS : no HE2:sc= 0.782 K(o=0.78,f=-2.4!) USER MOD Single : A 102 LYS NZ :NH3+ -175:sc= 1.28 (180deg=1.15) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -158:sc= 1.11 (180deg=0.539) USER MOD Single : A 108 LYS NZ :NH3+ -145:sc= 2.37 (180deg=-0.635) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 68:sc= 1.23 USER MOD Single : A 125 HIS : no HE2:sc= 0.853 K(o=0.85,f=-3.3!) 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= -0.352 (180deg=-0.352) 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= -0.156 (180deg=-0.156) USER MOD Single : C 21 DT C7 :methyl 150:sc= -1.11 (180deg=-1.11) USER MOD Single : C 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 79 -0.996 6.688 9.538 1.00 1.00 N ATOM 2 CA ALA A 79 0.090 6.017 8.773 1.00 1.00 C ATOM 3 C ALA A 79 0.451 6.804 7.513 1.00 1.00 C ATOM 4 O ALA A 79 -0.366 7.550 6.992 1.00 1.00 O ATOM 5 CB ALA A 79 -0.346 4.583 8.420 1.00 1.00 C ATOM 0 HA ALA A 79 0.985 5.977 9.394 1.00 1.00 H new ATOM 0 HB1 ALA A 79 0.448 4.089 7.859 1.00 1.00 H new ATOM 0 HB2 ALA A 79 -0.543 4.027 9.336 1.00 1.00 H new ATOM 0 HB3 ALA A 79 -1.251 4.617 7.814 1.00 1.00 H new ATOM 11 N ARG A 80 1.669 6.622 6.989 1.00 1.00 N ATOM 12 CA ARG A 80 2.186 7.214 5.726 1.00 1.00 C ATOM 13 C ARG A 80 1.503 6.624 4.468 1.00 1.00 C ATOM 14 O ARG A 80 2.145 6.033 3.603 1.00 1.00 O ATOM 15 CB ARG A 80 3.728 7.114 5.707 1.00 1.00 C ATOM 16 CG ARG A 80 4.353 7.991 6.807 1.00 1.00 C ATOM 17 CD ARG A 80 4.404 9.479 6.440 1.00 1.00 C ATOM 18 NE ARG A 80 4.435 10.339 7.643 1.00 1.00 N ATOM 19 CZ ARG A 80 3.419 11.002 8.168 1.00 1.00 C ATOM 20 NH1 ARG A 80 2.225 10.995 7.660 1.00 1.00 N ATOM 21 NH2 ARG A 80 3.558 11.761 9.208 1.00 1.00 N ATOM 0 H ARG A 80 2.363 6.031 7.448 1.00 1.00 H new ATOM 0 HA ARG A 80 1.924 8.272 5.696 1.00 1.00 H new ATOM 0 HB2 ARG A 80 4.030 6.076 5.849 1.00 1.00 H new ATOM 0 HB3 ARG A 80 4.104 7.425 4.732 1.00 1.00 H new ATOM 0 HG2 ARG A 80 3.781 7.870 7.727 1.00 1.00 H new ATOM 0 HG3 ARG A 80 5.364 7.639 7.012 1.00 1.00 H new ATOM 0 HD2 ARG A 80 5.287 9.673 5.831 1.00 1.00 H new ATOM 0 HD3 ARG A 80 3.535 9.734 5.833 1.00 1.00 H new ATOM 0 HE ARG A 80 5.334 10.430 8.117 1.00 1.00 H new ATOM 0 HH11 ARG A 80 2.034 10.459 6.813 1.00 1.00 H new ATOM 0 HH12 ARG A 80 1.477 11.525 8.107 1.00 1.00 H new ATOM 0 HH21 ARG A 80 4.473 11.861 9.648 1.00 1.00 H new ATOM 0 HH22 ARG A 80 2.753 12.259 9.588 1.00 1.00 H new ATOM 35 N LYS A 81 0.174 6.752 4.401 1.00 1.00 N ATOM 36 CA LYS A 81 -0.732 6.325 3.335 1.00 1.00 C ATOM 37 C LYS A 81 -0.322 6.928 1.995 1.00 1.00 C ATOM 38 O LYS A 81 -0.098 8.130 1.852 1.00 1.00 O ATOM 39 CB LYS A 81 -2.165 6.769 3.691 1.00 1.00 C ATOM 40 CG LYS A 81 -2.799 5.960 4.838 1.00 1.00 C ATOM 41 CD LYS A 81 -3.854 6.780 5.600 1.00 1.00 C ATOM 42 CE LYS A 81 -4.618 5.883 6.587 1.00 1.00 C ATOM 43 NZ LYS A 81 -5.399 6.681 7.575 1.00 1.00 N ATOM 0 H LYS A 81 -0.339 7.198 5.161 1.00 1.00 H new ATOM 0 HA LYS A 81 -0.686 5.240 3.245 1.00 1.00 H new ATOM 0 HB2 LYS A 81 -2.151 7.823 3.967 1.00 1.00 H new ATOM 0 HB3 LYS A 81 -2.794 6.680 2.805 1.00 1.00 H new ATOM 0 HG2 LYS A 81 -3.261 5.059 4.435 1.00 1.00 H new ATOM 0 HG3 LYS A 81 -2.020 5.638 5.529 1.00 1.00 H new ATOM 0 HD2 LYS A 81 -3.371 7.595 6.138 1.00 1.00 H new ATOM 0 HD3 LYS A 81 -4.551 7.232 4.895 1.00 1.00 H new ATOM 0 HE2 LYS A 81 -5.292 5.228 6.035 1.00 1.00 H new ATOM 0 HE3 LYS A 81 -3.913 5.242 7.115 1.00 1.00 H new ATOM 0 HZ1 LYS A 81 -6.088 6.065 8.051 1.00 1.00 H new ATOM 0 HZ2 LYS A 81 -4.753 7.088 8.281 1.00 1.00 H new ATOM 0 HZ3 LYS A 81 -5.902 7.447 7.083 1.00 1.00 H new ATOM 57 N VAL A 82 -0.255 6.043 1.015 1.00 1.00 N ATOM 58 CA VAL A 82 -0.034 6.368 -0.395 1.00 1.00 C ATOM 59 C VAL A 82 -1.286 6.986 -1.016 1.00 1.00 C ATOM 60 O VAL A 82 -2.393 6.460 -0.880 1.00 1.00 O ATOM 61 CB VAL A 82 0.323 5.098 -1.193 1.00 1.00 C ATOM 62 CG1 VAL A 82 0.462 5.366 -2.702 1.00 1.00 C ATOM 63 CG2 VAL A 82 1.609 4.461 -0.662 1.00 1.00 C ATOM 0 H VAL A 82 -0.356 5.041 1.179 1.00 1.00 H new ATOM 0 HA VAL A 82 0.788 7.082 -0.439 1.00 1.00 H new ATOM 0 HB VAL A 82 -0.508 4.407 -1.055 1.00 1.00 H new ATOM 0 HG11 VAL A 82 0.714 4.438 -3.215 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -0.480 5.751 -3.091 1.00 1.00 H new ATOM 0 HG13 VAL A 82 1.251 6.099 -2.870 1.00 1.00 H new ATOM 0 HG21 VAL A 82 1.839 3.567 -1.242 1.00 1.00 H new ATOM 0 HG22 VAL A 82 2.431 5.172 -0.750 1.00 1.00 H new ATOM 0 HG23 VAL A 82 1.475 4.190 0.385 1.00 1.00 H new ATOM 73 N LYS A 83 -1.097 8.073 -1.759 1.00 1.00 N ATOM 74 CA LYS A 83 -2.094 8.664 -2.638 1.00 1.00 C ATOM 75 C LYS A 83 -1.646 8.382 -4.061 1.00 1.00 C ATOM 76 O LYS A 83 -0.517 8.693 -4.448 1.00 1.00 O ATOM 77 CB LYS A 83 -2.244 10.178 -2.442 1.00 1.00 C ATOM 78 CG LYS A 83 -3.431 10.519 -1.536 1.00 1.00 C ATOM 79 CD LYS A 83 -3.465 12.032 -1.304 1.00 1.00 C ATOM 80 CE LYS A 83 -4.776 12.470 -0.655 1.00 1.00 C ATOM 81 NZ LYS A 83 -4.638 13.800 -0.028 1.00 1.00 N ATOM 0 H LYS A 83 -0.213 8.582 -1.764 1.00 1.00 H new ATOM 0 HA LYS A 83 -3.067 8.229 -2.412 1.00 1.00 H new ATOM 0 HB2 LYS A 83 -1.329 10.581 -2.009 1.00 1.00 H new ATOM 0 HB3 LYS A 83 -2.377 10.659 -3.411 1.00 1.00 H new ATOM 0 HG2 LYS A 83 -4.362 10.188 -1.996 1.00 1.00 H new ATOM 0 HG3 LYS A 83 -3.341 9.995 -0.585 1.00 1.00 H new ATOM 0 HD2 LYS A 83 -2.628 12.322 -0.668 1.00 1.00 H new ATOM 0 HD3 LYS A 83 -3.338 12.550 -2.255 1.00 1.00 H new ATOM 0 HE2 LYS A 83 -5.566 12.498 -1.406 1.00 1.00 H new ATOM 0 HE3 LYS A 83 -5.076 11.739 0.096 1.00 1.00 H new ATOM 0 HZ1 LYS A 83 -5.581 14.186 0.179 1.00 1.00 H new ATOM 0 HZ2 LYS A 83 -4.098 13.712 0.857 1.00 1.00 H new ATOM 0 HZ3 LYS A 83 -4.137 14.440 -0.677 1.00 1.00 H new ATOM 95 N GLN A 84 -2.507 7.716 -4.821 1.00 1.00 N ATOM 96 CA GLN A 84 -2.329 7.605 -6.250 1.00 1.00 C ATOM 97 C GLN A 84 -2.950 8.889 -6.799 1.00 1.00 C ATOM 98 O GLN A 84 -3.976 9.355 -6.303 1.00 1.00 O ATOM 99 CB GLN A 84 -2.983 6.325 -6.807 1.00 1.00 C ATOM 100 CG GLN A 84 -3.686 6.472 -8.160 1.00 1.00 C ATOM 101 CD GLN A 84 -4.196 5.125 -8.667 1.00 1.00 C ATOM 102 OE1 GLN A 84 -5.371 4.801 -8.583 1.00 1.00 O ATOM 103 NE2 GLN A 84 -3.334 4.273 -9.181 1.00 1.00 N ATOM 0 H GLN A 84 -3.337 7.245 -4.462 1.00 1.00 H new ATOM 0 HA GLN A 84 -1.284 7.510 -6.545 1.00 1.00 H new ATOM 0 HB2 GLN A 84 -2.215 5.557 -6.899 1.00 1.00 H new ATOM 0 HB3 GLN A 84 -3.709 5.964 -6.079 1.00 1.00 H new ATOM 0 HG2 GLN A 84 -4.520 7.167 -8.066 1.00 1.00 H new ATOM 0 HG3 GLN A 84 -2.995 6.899 -8.887 1.00 1.00 H new ATOM 0 HE21 GLN A 84 -2.349 4.528 -9.258 1.00 1.00 H new ATOM 0 HE22 GLN A 84 -3.651 3.358 -9.502 1.00 1.00 H new ATOM 112 N TYR A 85 -2.349 9.417 -7.849 1.00 1.00 N ATOM 113 CA TYR A 85 -2.869 10.561 -8.587 1.00 1.00 C ATOM 114 C TYR A 85 -2.927 10.178 -10.063 1.00 1.00 C ATOM 115 O TYR A 85 -1.997 9.550 -10.563 1.00 1.00 O ATOM 116 CB TYR A 85 -1.960 11.780 -8.355 1.00 1.00 C ATOM 117 CG TYR A 85 -1.727 12.179 -6.907 1.00 1.00 C ATOM 118 CD1 TYR A 85 -2.668 12.991 -6.249 1.00 1.00 C ATOM 119 CD2 TYR A 85 -0.547 11.791 -6.243 1.00 1.00 C ATOM 120 CE1 TYR A 85 -2.430 13.450 -4.938 1.00 1.00 C ATOM 121 CE2 TYR A 85 -0.298 12.243 -4.933 1.00 1.00 C ATOM 122 CZ TYR A 85 -1.233 13.086 -4.281 1.00 1.00 C ATOM 123 OH TYR A 85 -0.988 13.535 -3.021 1.00 1.00 O ATOM 0 H TYR A 85 -1.470 9.059 -8.222 1.00 1.00 H new ATOM 0 HA TYR A 85 -3.869 10.829 -8.246 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -0.992 11.578 -8.814 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -2.390 12.633 -8.880 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -3.583 13.266 -6.754 1.00 1.00 H new ATOM 0 HD2 TYR A 85 0.166 11.148 -6.738 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -3.156 14.075 -4.440 1.00 1.00 H new ATOM 0 HE2 TYR A 85 0.607 11.947 -4.424 1.00 1.00 H new ATOM 0 HH TYR A 85 -0.123 13.192 -2.714 1.00 1.00 H new ATOM 133 N LYS A 86 -3.996 10.552 -10.771 1.00 1.00 N ATOM 134 CA LYS A 86 -4.196 10.261 -12.201 1.00 1.00 C ATOM 135 C LYS A 86 -4.615 11.529 -12.933 1.00 1.00 C ATOM 136 O LYS A 86 -5.570 12.181 -12.528 1.00 1.00 O ATOM 137 CB LYS A 86 -5.239 9.138 -12.339 1.00 1.00 C ATOM 138 CG LYS A 86 -5.655 8.904 -13.803 1.00 1.00 C ATOM 139 CD LYS A 86 -6.430 7.588 -13.948 1.00 1.00 C ATOM 140 CE LYS A 86 -6.730 7.309 -15.428 1.00 1.00 C ATOM 141 NZ LYS A 86 -7.516 6.054 -15.607 1.00 1.00 N ATOM 0 H LYS A 86 -4.767 11.078 -10.360 1.00 1.00 H new ATOM 0 HA LYS A 86 -3.267 9.919 -12.657 1.00 1.00 H new ATOM 0 HB2 LYS A 86 -4.832 8.214 -11.927 1.00 1.00 H new ATOM 0 HB3 LYS A 86 -6.120 9.389 -11.749 1.00 1.00 H new ATOM 0 HG2 LYS A 86 -6.272 9.734 -14.147 1.00 1.00 H new ATOM 0 HG3 LYS A 86 -4.769 8.881 -14.438 1.00 1.00 H new ATOM 0 HD2 LYS A 86 -5.850 6.767 -13.526 1.00 1.00 H new ATOM 0 HD3 LYS A 86 -7.362 7.642 -13.385 1.00 1.00 H new ATOM 0 HE2 LYS A 86 -7.283 8.148 -15.851 1.00 1.00 H new ATOM 0 HE3 LYS A 86 -5.794 7.233 -15.981 1.00 1.00 H new ATOM 0 HZ1 LYS A 86 -7.699 5.900 -16.619 1.00 1.00 H new ATOM 0 HZ2 LYS A 86 -6.978 5.250 -15.226 1.00 1.00 H new ATOM 0 HZ3 LYS A 86 -8.421 6.136 -15.101 1.00 1.00 H new ATOM 155 N ASN A 87 -3.900 11.890 -13.990 1.00 1.00 N ATOM 156 CA ASN A 87 -4.092 13.157 -14.689 1.00 1.00 C ATOM 157 C ASN A 87 -5.085 13.018 -15.865 1.00 1.00 C ATOM 158 O ASN A 87 -4.732 12.413 -16.880 1.00 1.00 O ATOM 159 CB ASN A 87 -2.714 13.652 -15.130 1.00 1.00 C ATOM 160 CG ASN A 87 -2.745 15.046 -15.721 1.00 1.00 C ATOM 161 OD1 ASN A 87 -3.723 15.495 -16.299 1.00 1.00 O ATOM 162 ND2 ASN A 87 -1.688 15.795 -15.561 1.00 1.00 N ATOM 0 H ASN A 87 -3.164 11.308 -14.391 1.00 1.00 H new ATOM 0 HA ASN A 87 -4.545 13.894 -14.026 1.00 1.00 H new ATOM 0 HB2 ASN A 87 -2.040 13.642 -14.274 1.00 1.00 H new ATOM 0 HB3 ASN A 87 -2.305 12.961 -15.866 1.00 1.00 H new ATOM 0 HD21 ASN A 87 -1.681 16.751 -15.918 1.00 1.00 H new ATOM 0 HD22 ASN A 87 -0.869 15.425 -15.079 1.00 1.00 H new ATOM 169 N PRO A 88 -6.297 13.606 -15.791 1.00 1.00 N ATOM 170 CA PRO A 88 -7.300 13.523 -16.857 1.00 1.00 C ATOM 171 C PRO A 88 -6.901 14.225 -18.173 1.00 1.00 C ATOM 172 O PRO A 88 -7.522 13.969 -19.205 1.00 1.00 O ATOM 173 CB PRO A 88 -8.587 14.102 -16.253 1.00 1.00 C ATOM 174 CG PRO A 88 -8.095 15.026 -15.140 1.00 1.00 C ATOM 175 CD PRO A 88 -6.832 14.332 -14.650 1.00 1.00 C ATOM 0 HA PRO A 88 -7.422 12.486 -17.170 1.00 1.00 H new ATOM 0 HB2 PRO A 88 -9.166 14.648 -16.998 1.00 1.00 H new ATOM 0 HB3 PRO A 88 -9.232 13.316 -15.862 1.00 1.00 H new ATOM 0 HG2 PRO A 88 -7.886 16.029 -15.512 1.00 1.00 H new ATOM 0 HG3 PRO A 88 -8.833 15.128 -14.345 1.00 1.00 H new ATOM 0 HD2 PRO A 88 -6.109 15.058 -14.277 1.00 1.00 H new ATOM 0 HD3 PRO A 88 -7.056 13.653 -13.827 1.00 1.00 H new ATOM 183 N HIS A 89 -5.865 15.079 -18.164 1.00 1.00 N ATOM 184 CA HIS A 89 -5.355 15.785 -19.352 1.00 1.00 C ATOM 185 C HIS A 89 -4.275 15.011 -20.130 1.00 1.00 C ATOM 186 O HIS A 89 -4.038 15.327 -21.296 1.00 1.00 O ATOM 187 CB HIS A 89 -4.836 17.174 -18.933 1.00 1.00 C ATOM 188 CG HIS A 89 -5.866 17.990 -18.193 1.00 1.00 C ATOM 189 ND1 HIS A 89 -6.926 18.675 -18.763 1.00 1.00 N ATOM 190 CD2 HIS A 89 -5.932 18.177 -16.837 1.00 1.00 C ATOM 191 CE1 HIS A 89 -7.622 19.269 -17.771 1.00 1.00 C ATOM 192 NE2 HIS A 89 -7.033 18.980 -16.592 1.00 1.00 N ATOM 0 H HIS A 89 -5.348 15.303 -17.314 1.00 1.00 H new ATOM 0 HA HIS A 89 -6.191 15.882 -20.044 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -3.956 17.052 -18.302 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -4.518 17.720 -19.821 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -5.254 17.774 -16.099 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -8.506 19.876 -17.900 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -7.346 19.299 -15.675 1.00 1.00 H new ATOM 201 N THR A 90 -3.634 14.003 -19.520 1.00 1.00 N ATOM 202 CA THR A 90 -2.497 13.261 -20.116 1.00 1.00 C ATOM 203 C THR A 90 -2.648 11.737 -20.080 1.00 1.00 C ATOM 204 O THR A 90 -2.023 11.043 -20.884 1.00 1.00 O ATOM 205 CB THR A 90 -1.182 13.610 -19.408 1.00 1.00 C ATOM 206 OG1 THR A 90 -1.224 13.113 -18.087 1.00 1.00 O ATOM 207 CG2 THR A 90 -0.932 15.109 -19.287 1.00 1.00 C ATOM 0 H THR A 90 -3.888 13.671 -18.589 1.00 1.00 H new ATOM 0 HA THR A 90 -2.488 13.575 -21.160 1.00 1.00 H new ATOM 0 HB THR A 90 -0.391 13.168 -20.013 1.00 1.00 H new ATOM 0 HG1 THR A 90 -0.386 13.331 -17.629 1.00 1.00 H new ATOM 0 HG21 THR A 90 0.016 15.280 -18.776 1.00 1.00 H new ATOM 0 HG22 THR A 90 -0.893 15.553 -20.282 1.00 1.00 H new ATOM 0 HG23 THR A 90 -1.740 15.568 -18.717 1.00 1.00 H new ATOM 215 N GLY A 91 -3.467 11.203 -19.164 1.00 1.00 N ATOM 216 CA GLY A 91 -3.592 9.768 -18.904 1.00 1.00 C ATOM 217 C GLY A 91 -2.439 9.166 -18.082 1.00 1.00 C ATOM 218 O GLY A 91 -2.376 7.944 -17.936 1.00 1.00 O ATOM 0 H GLY A 91 -4.073 11.771 -18.572 1.00 1.00 H new ATOM 0 HA2 GLY A 91 -4.529 9.587 -18.378 1.00 1.00 H new ATOM 0 HA3 GLY A 91 -3.655 9.243 -19.857 1.00 1.00 H new ATOM 222 N GLU A 92 -1.521 9.982 -17.547 1.00 1.00 N ATOM 223 CA GLU A 92 -0.477 9.542 -16.637 1.00 1.00 C ATOM 224 C GLU A 92 -1.031 9.340 -15.232 1.00 1.00 C ATOM 225 O GLU A 92 -2.016 9.948 -14.808 1.00 1.00 O ATOM 226 CB GLU A 92 0.681 10.548 -16.574 1.00 1.00 C ATOM 227 CG GLU A 92 1.621 10.418 -17.768 1.00 1.00 C ATOM 228 CD GLU A 92 2.650 9.281 -17.574 1.00 1.00 C ATOM 229 OE1 GLU A 92 2.273 8.087 -17.651 1.00 1.00 O ATOM 230 OE2 GLU A 92 3.848 9.574 -17.340 1.00 1.00 O ATOM 0 H GLU A 92 -1.490 10.982 -17.743 1.00 1.00 H new ATOM 0 HA GLU A 92 -0.101 8.595 -17.024 1.00 1.00 H new ATOM 0 HB2 GLU A 92 0.279 11.561 -16.538 1.00 1.00 H new ATOM 0 HB3 GLU A 92 1.243 10.396 -15.653 1.00 1.00 H new ATOM 0 HG2 GLU A 92 1.038 10.229 -18.669 1.00 1.00 H new ATOM 0 HG3 GLU A 92 2.147 11.361 -17.920 1.00 1.00 H new ATOM 237 N VAL A 93 -0.323 8.504 -14.492 1.00 1.00 N ATOM 238 CA VAL A 93 -0.594 8.118 -13.107 1.00 1.00 C ATOM 239 C VAL A 93 0.710 8.119 -12.303 1.00 1.00 C ATOM 240 O VAL A 93 1.802 7.907 -12.833 1.00 1.00 O ATOM 241 CB VAL A 93 -1.257 6.732 -13.068 1.00 1.00 C ATOM 242 CG1 VAL A 93 -1.773 6.324 -11.671 1.00 1.00 C ATOM 243 CG2 VAL A 93 -2.451 6.655 -14.029 1.00 1.00 C ATOM 0 H VAL A 93 0.510 8.045 -14.860 1.00 1.00 H new ATOM 0 HA VAL A 93 -1.278 8.839 -12.659 1.00 1.00 H new ATOM 0 HB VAL A 93 -0.463 6.047 -13.363 1.00 1.00 H new ATOM 0 HG11 VAL A 93 -2.227 5.335 -11.726 1.00 1.00 H new ATOM 0 HG12 VAL A 93 -0.941 6.303 -10.968 1.00 1.00 H new ATOM 0 HG13 VAL A 93 -2.516 7.046 -11.332 1.00 1.00 H new ATOM 0 HG21 VAL A 93 -2.897 5.662 -13.977 1.00 1.00 H new ATOM 0 HG22 VAL A 93 -3.194 7.401 -13.747 1.00 1.00 H new ATOM 0 HG23 VAL A 93 -2.112 6.847 -15.047 1.00 1.00 H new ATOM 253 N ILE A 94 0.565 8.329 -11.002 1.00 1.00 N ATOM 254 CA ILE A 94 1.609 8.329 -9.973 1.00 1.00 C ATOM 255 C ILE A 94 1.053 7.723 -8.686 1.00 1.00 C ATOM 256 O ILE A 94 -0.158 7.614 -8.500 1.00 1.00 O ATOM 257 CB ILE A 94 2.146 9.750 -9.635 1.00 1.00 C ATOM 258 CG1 ILE A 94 1.554 10.905 -10.465 1.00 1.00 C ATOM 259 CG2 ILE A 94 3.681 9.757 -9.697 1.00 1.00 C ATOM 260 CD1 ILE A 94 1.954 12.275 -9.915 1.00 1.00 C ATOM 0 H ILE A 94 -0.354 8.519 -10.603 1.00 1.00 H new ATOM 0 HA ILE A 94 2.436 7.745 -10.378 1.00 1.00 H new ATOM 0 HB ILE A 94 1.802 9.952 -8.621 1.00 1.00 H new ATOM 0 HG12 ILE A 94 1.891 10.818 -11.498 1.00 1.00 H new ATOM 0 HG13 ILE A 94 0.467 10.823 -10.476 1.00 1.00 H new ATOM 0 HG21 ILE A 94 4.050 10.755 -9.459 1.00 1.00 H new ATOM 0 HG22 ILE A 94 4.078 9.042 -8.976 1.00 1.00 H new ATOM 0 HG23 ILE A 94 4.006 9.479 -10.700 1.00 1.00 H new ATOM 0 HD11 ILE A 94 1.513 13.058 -10.532 1.00 1.00 H new ATOM 0 HD12 ILE A 94 1.594 12.375 -8.891 1.00 1.00 H new ATOM 0 HD13 ILE A 94 3.040 12.370 -9.929 1.00 1.00 H new ATOM 272 N GLU A 95 1.957 7.437 -7.757 1.00 1.00 N ATOM 273 CA GLU A 95 1.720 6.981 -6.388 1.00 1.00 C ATOM 274 C GLU A 95 2.819 7.542 -5.473 1.00 1.00 C ATOM 275 O GLU A 95 4.004 7.287 -5.694 1.00 1.00 O ATOM 276 CB GLU A 95 1.789 5.452 -6.337 1.00 1.00 C ATOM 277 CG GLU A 95 0.487 4.783 -6.776 1.00 1.00 C ATOM 278 CD GLU A 95 0.651 3.253 -6.882 1.00 1.00 C ATOM 279 OE1 GLU A 95 0.953 2.588 -5.861 1.00 1.00 O ATOM 280 OE2 GLU A 95 0.466 2.701 -7.994 1.00 1.00 O ATOM 0 H GLU A 95 2.954 7.524 -7.954 1.00 1.00 H new ATOM 0 HA GLU A 95 0.738 7.323 -6.061 1.00 1.00 H new ATOM 0 HB2 GLU A 95 2.602 5.108 -6.977 1.00 1.00 H new ATOM 0 HB3 GLU A 95 2.028 5.138 -5.321 1.00 1.00 H new ATOM 0 HG2 GLU A 95 -0.303 5.018 -6.063 1.00 1.00 H new ATOM 0 HG3 GLU A 95 0.176 5.185 -7.740 1.00 1.00 H new ATOM 287 N THR A 96 2.433 8.311 -4.457 1.00 1.00 N ATOM 288 CA THR A 96 3.367 8.950 -3.505 1.00 1.00 C ATOM 289 C THR A 96 2.731 9.009 -2.109 1.00 1.00 C ATOM 290 O THR A 96 1.508 8.989 -1.986 1.00 1.00 O ATOM 291 CB THR A 96 3.819 10.363 -3.969 1.00 1.00 C ATOM 292 OG1 THR A 96 3.113 11.383 -3.288 1.00 1.00 O ATOM 293 CG2 THR A 96 3.634 10.658 -5.467 1.00 1.00 C ATOM 0 H THR A 96 1.453 8.516 -4.261 1.00 1.00 H new ATOM 0 HA THR A 96 4.267 8.336 -3.466 1.00 1.00 H new ATOM 0 HB THR A 96 4.885 10.359 -3.741 1.00 1.00 H new ATOM 0 HG1 THR A 96 3.421 12.259 -3.601 1.00 1.00 H new ATOM 0 HG21 THR A 96 3.980 11.669 -5.684 1.00 1.00 H new ATOM 0 HG22 THR A 96 4.212 9.943 -6.053 1.00 1.00 H new ATOM 0 HG23 THR A 96 2.579 10.572 -5.727 1.00 1.00 H new ATOM 301 N LYS A 97 3.530 9.082 -1.043 1.00 1.00 N ATOM 302 CA LYS A 97 3.045 9.255 0.345 1.00 1.00 C ATOM 303 C LYS A 97 3.114 10.731 0.794 1.00 1.00 C ATOM 304 O LYS A 97 2.971 11.029 1.982 1.00 1.00 O ATOM 305 CB LYS A 97 3.861 8.350 1.284 1.00 1.00 C ATOM 306 CG LYS A 97 3.927 6.869 0.859 1.00 1.00 C ATOM 307 CD LYS A 97 4.989 6.085 1.648 1.00 1.00 C ATOM 308 CE LYS A 97 5.351 4.738 1.003 1.00 1.00 C ATOM 309 NZ LYS A 97 6.118 4.901 -0.267 1.00 1.00 N ATOM 0 H LYS A 97 4.546 9.023 -1.110 1.00 1.00 H new ATOM 0 HA LYS A 97 1.996 8.964 0.387 1.00 1.00 H new ATOM 0 HB2 LYS A 97 4.877 8.740 1.350 1.00 1.00 H new ATOM 0 HB3 LYS A 97 3.432 8.408 2.284 1.00 1.00 H new ATOM 0 HG2 LYS A 97 2.951 6.406 1.008 1.00 1.00 H new ATOM 0 HG3 LYS A 97 4.150 6.808 -0.206 1.00 1.00 H new ATOM 0 HD2 LYS A 97 5.890 6.693 1.735 1.00 1.00 H new ATOM 0 HD3 LYS A 97 4.624 5.909 2.660 1.00 1.00 H new ATOM 0 HE2 LYS A 97 5.939 4.148 1.706 1.00 1.00 H new ATOM 0 HE3 LYS A 97 4.438 4.177 0.803 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 6.526 3.986 -0.546 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 5.481 5.239 -1.016 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 6.883 5.592 -0.125 1.00 1.00 H new ATOM 323 N GLY A 98 3.381 11.634 -0.155 1.00 1.00 N ATOM 324 CA GLY A 98 3.667 13.055 0.032 1.00 1.00 C ATOM 325 C GLY A 98 4.980 13.495 -0.624 1.00 1.00 C ATOM 326 O GLY A 98 5.569 12.782 -1.444 1.00 1.00 O ATOM 0 H GLY A 98 3.404 11.371 -1.140 1.00 1.00 H new ATOM 0 HA2 GLY A 98 2.847 13.642 -0.381 1.00 1.00 H new ATOM 0 HA3 GLY A 98 3.710 13.274 1.099 1.00 1.00 H new ATOM 330 N GLY A 99 5.434 14.684 -0.230 1.00 1.00 N ATOM 331 CA GLY A 99 6.752 15.230 -0.540 1.00 1.00 C ATOM 332 C GLY A 99 6.970 15.771 -1.960 1.00 1.00 C ATOM 333 O GLY A 99 6.184 15.568 -2.891 1.00 1.00 O ATOM 0 H GLY A 99 4.870 15.318 0.337 1.00 1.00 H new ATOM 0 HA2 GLY A 99 6.958 16.036 0.164 1.00 1.00 H new ATOM 0 HA3 GLY A 99 7.492 14.451 -0.358 1.00 1.00 H new ATOM 337 N ASN A 100 8.097 16.470 -2.111 1.00 1.00 N ATOM 338 CA ASN A 100 8.698 16.927 -3.363 1.00 1.00 C ATOM 339 C ASN A 100 8.961 15.703 -4.273 1.00 1.00 C ATOM 340 O ASN A 100 9.916 14.951 -4.068 1.00 1.00 O ATOM 341 CB ASN A 100 9.960 17.730 -2.965 1.00 1.00 C ATOM 342 CG ASN A 100 11.037 17.921 -4.023 1.00 1.00 C ATOM 343 OD1 ASN A 100 10.850 17.737 -5.220 1.00 1.00 O ATOM 344 ND2 ASN A 100 12.213 18.311 -3.579 1.00 1.00 N ATOM 0 H ASN A 100 8.652 16.751 -1.303 1.00 1.00 H new ATOM 0 HA ASN A 100 8.055 17.582 -3.951 1.00 1.00 H new ATOM 0 HB2 ASN A 100 9.639 18.717 -2.631 1.00 1.00 H new ATOM 0 HB3 ASN A 100 10.416 17.236 -2.107 1.00 1.00 H new ATOM 0 HD21 ASN A 100 12.980 18.463 -4.233 1.00 1.00 H new ATOM 0 HD22 ASN A 100 12.357 18.461 -2.580 1.00 1.00 H new ATOM 351 N HIS A 101 8.068 15.481 -5.253 1.00 1.00 N ATOM 352 CA HIS A 101 8.137 14.399 -6.249 1.00 1.00 C ATOM 353 C HIS A 101 7.938 14.983 -7.657 1.00 1.00 C ATOM 354 O HIS A 101 6.937 15.659 -7.893 1.00 1.00 O ATOM 355 CB HIS A 101 7.111 13.314 -5.867 1.00 1.00 C ATOM 356 CG HIS A 101 7.297 12.025 -6.629 1.00 1.00 C ATOM 357 ND1 HIS A 101 8.267 11.061 -6.392 1.00 1.00 N ATOM 358 CD2 HIS A 101 6.546 11.602 -7.693 1.00 1.00 C ATOM 359 CE1 HIS A 101 8.103 10.076 -7.295 1.00 1.00 C ATOM 360 NE2 HIS A 101 7.067 10.385 -8.101 1.00 1.00 N ATOM 0 H HIS A 101 7.247 16.073 -5.377 1.00 1.00 H new ATOM 0 HA HIS A 101 9.117 13.921 -6.259 1.00 1.00 H new ATOM 0 HB2 HIS A 101 7.187 13.111 -4.799 1.00 1.00 H new ATOM 0 HB3 HIS A 101 6.106 13.694 -6.048 1.00 1.00 H new ATOM 0 HD1 HIS A 101 8.979 11.093 -5.662 1.00 1.00 H new ATOM 0 HD2 HIS A 101 5.706 12.120 -8.132 1.00 1.00 H new ATOM 0 HE1 HIS A 101 8.705 9.182 -7.363 1.00 1.00 H new ATOM 369 N LYS A 102 8.860 14.717 -8.592 1.00 1.00 N ATOM 370 CA LYS A 102 8.953 15.379 -9.919 1.00 1.00 C ATOM 371 C LYS A 102 7.630 15.542 -10.677 1.00 1.00 C ATOM 372 O LYS A 102 7.151 16.664 -10.792 1.00 1.00 O ATOM 373 CB LYS A 102 10.055 14.714 -10.757 1.00 1.00 C ATOM 374 CG LYS A 102 10.448 15.665 -11.903 1.00 1.00 C ATOM 375 CD LYS A 102 11.653 15.163 -12.692 1.00 1.00 C ATOM 376 CE LYS A 102 12.941 15.160 -11.856 1.00 1.00 C ATOM 377 NZ LYS A 102 14.122 14.722 -12.648 1.00 1.00 N ATOM 0 H LYS A 102 9.587 14.016 -8.451 1.00 1.00 H new ATOM 0 HA LYS A 102 9.232 16.414 -9.722 1.00 1.00 H new ATOM 0 HB2 LYS A 102 10.922 14.495 -10.134 1.00 1.00 H new ATOM 0 HB3 LYS A 102 9.702 13.764 -11.159 1.00 1.00 H new ATOM 0 HG2 LYS A 102 9.600 15.785 -12.578 1.00 1.00 H new ATOM 0 HG3 LYS A 102 10.671 16.650 -11.493 1.00 1.00 H new ATOM 0 HD2 LYS A 102 11.454 14.153 -13.051 1.00 1.00 H new ATOM 0 HD3 LYS A 102 11.795 15.791 -13.571 1.00 1.00 H new ATOM 0 HE2 LYS A 102 13.120 16.161 -11.463 1.00 1.00 H new ATOM 0 HE3 LYS A 102 12.815 14.499 -10.999 1.00 1.00 H new ATOM 0 HZ1 LYS A 102 14.952 14.653 -12.025 1.00 1.00 H new ATOM 0 HZ2 LYS A 102 13.930 13.792 -13.072 1.00 1.00 H new ATOM 0 HZ3 LYS A 102 14.311 15.414 -13.401 1.00 1.00 H new ATOM 391 N THR A 103 6.988 14.456 -11.117 1.00 1.00 N ATOM 392 CA THR A 103 5.754 14.534 -11.938 1.00 1.00 C ATOM 393 C THR A 103 4.617 15.251 -11.204 1.00 1.00 C ATOM 394 O THR A 103 3.934 16.100 -11.776 1.00 1.00 O ATOM 395 CB THR A 103 5.288 13.140 -12.395 1.00 1.00 C ATOM 396 OG1 THR A 103 6.358 12.472 -13.030 1.00 1.00 O ATOM 397 CG2 THR A 103 4.124 13.254 -13.377 1.00 1.00 C ATOM 0 H THR A 103 7.296 13.503 -10.923 1.00 1.00 H new ATOM 0 HA THR A 103 6.010 15.121 -12.820 1.00 1.00 H new ATOM 0 HB THR A 103 4.960 12.581 -11.519 1.00 1.00 H new ATOM 0 HG1 THR A 103 6.063 11.584 -13.320 1.00 1.00 H new ATOM 0 HG21 THR A 103 3.811 12.257 -13.687 1.00 1.00 H new ATOM 0 HG22 THR A 103 3.290 13.763 -12.895 1.00 1.00 H new ATOM 0 HG23 THR A 103 4.440 13.823 -14.251 1.00 1.00 H new ATOM 405 N LEU A 104 4.467 14.969 -9.905 1.00 1.00 N ATOM 406 CA LEU A 104 3.467 15.600 -9.038 1.00 1.00 C ATOM 407 C LEU A 104 3.653 17.129 -8.979 1.00 1.00 C ATOM 408 O LEU A 104 2.676 17.875 -9.032 1.00 1.00 O ATOM 409 CB LEU A 104 3.554 14.922 -7.652 1.00 1.00 C ATOM 410 CG LEU A 104 2.507 15.352 -6.612 1.00 1.00 C ATOM 411 CD1 LEU A 104 1.082 15.100 -7.098 1.00 1.00 C ATOM 412 CD2 LEU A 104 2.712 14.559 -5.322 1.00 1.00 C ATOM 0 H LEU A 104 5.047 14.285 -9.419 1.00 1.00 H new ATOM 0 HA LEU A 104 2.464 15.457 -9.440 1.00 1.00 H new ATOM 0 HB2 LEU A 104 3.472 13.844 -7.793 1.00 1.00 H new ATOM 0 HB3 LEU A 104 4.544 15.115 -7.239 1.00 1.00 H new ATOM 0 HG LEU A 104 2.638 16.421 -6.445 1.00 1.00 H new ATOM 0 HD11 LEU A 104 0.375 15.418 -6.332 1.00 1.00 H new ATOM 0 HD12 LEU A 104 0.904 15.665 -8.013 1.00 1.00 H new ATOM 0 HD13 LEU A 104 0.948 14.037 -7.296 1.00 1.00 H new ATOM 0 HD21 LEU A 104 1.969 14.865 -4.585 1.00 1.00 H new ATOM 0 HD22 LEU A 104 2.602 13.494 -5.528 1.00 1.00 H new ATOM 0 HD23 LEU A 104 3.711 14.752 -4.931 1.00 1.00 H new ATOM 424 N LYS A 105 4.904 17.609 -8.941 1.00 1.00 N ATOM 425 CA LYS A 105 5.229 19.047 -8.989 1.00 1.00 C ATOM 426 C LYS A 105 4.922 19.684 -10.342 1.00 1.00 C ATOM 427 O LYS A 105 4.497 20.838 -10.373 1.00 1.00 O ATOM 428 CB LYS A 105 6.703 19.279 -8.597 1.00 1.00 C ATOM 429 CG LYS A 105 6.993 19.113 -7.089 1.00 1.00 C ATOM 430 CD LYS A 105 6.287 20.121 -6.159 1.00 1.00 C ATOM 431 CE LYS A 105 6.494 21.586 -6.588 1.00 1.00 C ATOM 432 NZ LYS A 105 5.918 22.537 -5.598 1.00 1.00 N ATOM 0 H LYS A 105 5.726 17.009 -8.876 1.00 1.00 H new ATOM 0 HA LYS A 105 4.582 19.540 -8.263 1.00 1.00 H new ATOM 0 HB2 LYS A 105 7.329 18.582 -9.154 1.00 1.00 H new ATOM 0 HB3 LYS A 105 6.994 20.284 -8.903 1.00 1.00 H new ATOM 0 HG2 LYS A 105 6.703 18.106 -6.790 1.00 1.00 H new ATOM 0 HG3 LYS A 105 8.069 19.194 -6.933 1.00 1.00 H new ATOM 0 HD2 LYS A 105 5.219 19.902 -6.139 1.00 1.00 H new ATOM 0 HD3 LYS A 105 6.658 19.990 -5.143 1.00 1.00 H new ATOM 0 HE2 LYS A 105 7.560 21.784 -6.705 1.00 1.00 H new ATOM 0 HE3 LYS A 105 6.031 21.749 -7.561 1.00 1.00 H new ATOM 0 HZ1 LYS A 105 5.735 23.451 -6.060 1.00 1.00 H new ATOM 0 HZ2 LYS A 105 5.026 22.153 -5.225 1.00 1.00 H new ATOM 0 HZ3 LYS A 105 6.590 22.673 -4.816 1.00 1.00 H new ATOM 446 N GLU A 106 5.050 18.956 -11.454 1.00 1.00 N ATOM 447 CA GLU A 106 4.691 19.492 -12.773 1.00 1.00 C ATOM 448 C GLU A 106 3.191 19.682 -12.890 1.00 1.00 C ATOM 449 O GLU A 106 2.714 20.706 -13.369 1.00 1.00 O ATOM 450 CB GLU A 106 5.124 18.580 -13.922 1.00 1.00 C ATOM 451 CG GLU A 106 6.560 18.106 -13.791 1.00 1.00 C ATOM 452 CD GLU A 106 7.080 17.517 -15.115 1.00 1.00 C ATOM 453 OE1 GLU A 106 6.924 16.294 -15.350 1.00 1.00 O ATOM 454 OE2 GLU A 106 7.650 18.278 -15.936 1.00 1.00 O ATOM 0 H GLU A 106 5.398 17.997 -11.470 1.00 1.00 H new ATOM 0 HA GLU A 106 5.216 20.444 -12.853 1.00 1.00 H new ATOM 0 HB2 GLU A 106 4.463 17.714 -13.961 1.00 1.00 H new ATOM 0 HB3 GLU A 106 5.007 19.113 -14.866 1.00 1.00 H new ATOM 0 HG2 GLU A 106 7.194 18.940 -13.488 1.00 1.00 H new ATOM 0 HG3 GLU A 106 6.626 17.353 -13.005 1.00 1.00 H new ATOM 461 N TRP A 107 2.431 18.704 -12.404 1.00 1.00 N ATOM 462 CA TRP A 107 0.966 18.778 -12.432 1.00 1.00 C ATOM 463 C TRP A 107 0.422 19.960 -11.610 1.00 1.00 C ATOM 464 O TRP A 107 -0.527 20.628 -12.031 1.00 1.00 O ATOM 465 CB TRP A 107 0.352 17.460 -11.957 1.00 1.00 C ATOM 466 CG TRP A 107 0.599 16.228 -12.777 1.00 1.00 C ATOM 467 CD1 TRP A 107 1.414 16.095 -13.853 1.00 1.00 C ATOM 468 CD2 TRP A 107 0.018 14.908 -12.564 1.00 1.00 C ATOM 469 NE1 TRP A 107 1.379 14.791 -14.304 1.00 1.00 N ATOM 470 CE2 TRP A 107 0.588 14.006 -13.505 1.00 1.00 C ATOM 471 CE3 TRP A 107 -0.927 14.380 -11.660 1.00 1.00 C ATOM 472 CZ2 TRP A 107 0.301 12.640 -13.508 1.00 1.00 C ATOM 473 CZ3 TRP A 107 -1.284 13.019 -11.707 1.00 1.00 C ATOM 474 CH2 TRP A 107 -0.658 12.146 -12.612 1.00 1.00 C ATOM 0 H TRP A 107 2.801 17.850 -11.986 1.00 1.00 H new ATOM 0 HA TRP A 107 0.674 18.951 -13.468 1.00 1.00 H new ATOM 0 HB2 TRP A 107 0.716 17.267 -10.948 1.00 1.00 H new ATOM 0 HB3 TRP A 107 -0.726 17.602 -11.885 1.00 1.00 H new ATOM 0 HD1 TRP A 107 2.001 16.889 -14.290 1.00 1.00 H new ATOM 0 HE1 TRP A 107 1.878 14.454 -15.127 1.00 1.00 H new ATOM 0 HE3 TRP A 107 -1.382 15.027 -10.924 1.00 1.00 H new ATOM 0 HZ2 TRP A 107 0.809 11.974 -14.190 1.00 1.00 H new ATOM 0 HZ3 TRP A 107 -2.046 12.643 -11.041 1.00 1.00 H new ATOM 0 HH2 TRP A 107 -0.915 11.097 -12.618 1.00 1.00 H new ATOM 485 N LYS A 108 1.062 20.288 -10.480 1.00 1.00 N ATOM 486 CA LYS A 108 0.736 21.500 -9.709 1.00 1.00 C ATOM 487 C LYS A 108 1.065 22.787 -10.474 1.00 1.00 C ATOM 488 O LYS A 108 0.321 23.759 -10.366 1.00 1.00 O ATOM 489 CB LYS A 108 1.496 21.519 -8.379 1.00 1.00 C ATOM 490 CG LYS A 108 0.975 20.444 -7.431 1.00 1.00 C ATOM 491 CD LYS A 108 1.640 20.624 -6.066 1.00 1.00 C ATOM 492 CE LYS A 108 1.234 19.459 -5.165 1.00 1.00 C ATOM 493 NZ LYS A 108 1.746 19.665 -3.792 1.00 1.00 N ATOM 0 H LYS A 108 1.813 19.729 -10.076 1.00 1.00 H new ATOM 0 HA LYS A 108 -0.339 21.466 -9.531 1.00 1.00 H new ATOM 0 HB2 LYS A 108 2.559 21.362 -8.562 1.00 1.00 H new ATOM 0 HB3 LYS A 108 1.394 22.499 -7.913 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -0.108 20.518 -7.335 1.00 1.00 H new ATOM 0 HG3 LYS A 108 1.193 19.453 -7.829 1.00 1.00 H new ATOM 0 HD2 LYS A 108 2.724 20.657 -6.175 1.00 1.00 H new ATOM 0 HD3 LYS A 108 1.336 21.571 -5.620 1.00 1.00 H new ATOM 0 HE2 LYS A 108 0.148 19.368 -5.145 1.00 1.00 H new ATOM 0 HE3 LYS A 108 1.625 18.525 -5.569 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 2.009 18.748 -3.378 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 2.582 20.283 -3.822 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 1.008 20.109 -3.209 1.00 1.00 H new ATOM 507 N ALA A 109 2.152 22.797 -11.252 1.00 1.00 N ATOM 508 CA ALA A 109 2.519 23.935 -12.087 1.00 1.00 C ATOM 509 C ALA A 109 1.499 24.140 -13.218 1.00 1.00 C ATOM 510 O ALA A 109 1.007 25.246 -13.459 1.00 1.00 O ATOM 511 CB ALA A 109 3.906 23.679 -12.688 1.00 1.00 C ATOM 0 H ALA A 109 2.801 22.012 -11.317 1.00 1.00 H new ATOM 0 HA ALA A 109 2.531 24.835 -11.473 1.00 1.00 H new ATOM 0 HB1 ALA A 109 4.192 24.523 -13.315 1.00 1.00 H new ATOM 0 HB2 ALA A 109 4.634 23.560 -11.885 1.00 1.00 H new ATOM 0 HB3 ALA A 109 3.879 22.772 -13.291 1.00 1.00 H new ATOM 517 N LYS A 110 1.194 23.036 -13.909 1.00 1.00 N ATOM 518 CA LYS A 110 0.433 22.993 -15.145 1.00 1.00 C ATOM 519 C LYS A 110 -1.080 23.202 -14.971 1.00 1.00 C ATOM 520 O LYS A 110 -1.702 23.802 -15.849 1.00 1.00 O ATOM 521 CB LYS A 110 0.737 21.669 -15.865 1.00 1.00 C ATOM 522 CG LYS A 110 2.129 21.669 -16.523 1.00 1.00 C ATOM 523 CD LYS A 110 2.474 20.331 -17.196 1.00 1.00 C ATOM 524 CE LYS A 110 1.696 20.090 -18.502 1.00 1.00 C ATOM 525 NZ LYS A 110 2.240 20.873 -19.651 1.00 1.00 N ATOM 0 H LYS A 110 1.489 22.110 -13.600 1.00 1.00 H new ATOM 0 HA LYS A 110 0.753 23.841 -15.750 1.00 1.00 H new ATOM 0 HB2 LYS A 110 0.675 20.847 -15.152 1.00 1.00 H new ATOM 0 HB3 LYS A 110 -0.022 21.489 -16.626 1.00 1.00 H new ATOM 0 HG2 LYS A 110 2.174 22.465 -17.266 1.00 1.00 H new ATOM 0 HG3 LYS A 110 2.882 21.895 -15.768 1.00 1.00 H new ATOM 0 HD2 LYS A 110 3.543 20.303 -17.407 1.00 1.00 H new ATOM 0 HD3 LYS A 110 2.265 19.518 -16.501 1.00 1.00 H new ATOM 0 HE2 LYS A 110 1.724 19.028 -18.746 1.00 1.00 H new ATOM 0 HE3 LYS A 110 0.650 20.355 -18.351 1.00 1.00 H new ATOM 0 HZ1 LYS A 110 1.679 20.673 -20.504 1.00 1.00 H new ATOM 0 HZ2 LYS A 110 2.190 21.889 -19.434 1.00 1.00 H new ATOM 0 HZ3 LYS A 110 3.231 20.603 -19.817 1.00 1.00 H new ATOM 539 N TRP A 111 -1.656 22.746 -13.849 1.00 1.00 N ATOM 540 CA TRP A 111 -3.107 22.808 -13.577 1.00 1.00 C ATOM 541 C TRP A 111 -3.454 23.302 -12.160 1.00 1.00 C ATOM 542 O TRP A 111 -4.269 24.217 -12.035 1.00 1.00 O ATOM 543 CB TRP A 111 -3.746 21.440 -13.855 1.00 1.00 C ATOM 544 CG TRP A 111 -3.572 20.929 -15.258 1.00 1.00 C ATOM 545 CD1 TRP A 111 -4.309 21.296 -16.331 1.00 1.00 C ATOM 546 CD2 TRP A 111 -2.563 20.008 -15.774 1.00 1.00 C ATOM 547 NE1 TRP A 111 -3.824 20.672 -17.469 1.00 1.00 N ATOM 548 CE2 TRP A 111 -2.740 19.869 -17.183 1.00 1.00 C ATOM 549 CE3 TRP A 111 -1.503 19.293 -15.187 1.00 1.00 C ATOM 550 CZ2 TRP A 111 -1.909 19.051 -17.964 1.00 1.00 C ATOM 551 CZ3 TRP A 111 -0.633 18.509 -15.970 1.00 1.00 C ATOM 552 CH2 TRP A 111 -0.850 18.362 -17.351 1.00 1.00 C ATOM 0 H TRP A 111 -1.123 22.317 -13.092 1.00 1.00 H new ATOM 0 HA TRP A 111 -3.522 23.555 -14.254 1.00 1.00 H new ATOM 0 HB2 TRP A 111 -3.322 20.711 -13.164 1.00 1.00 H new ATOM 0 HB3 TRP A 111 -4.812 21.503 -13.637 1.00 1.00 H new ATOM 0 HD1 TRP A 111 -5.149 21.974 -16.305 1.00 1.00 H new ATOM 0 HE1 TRP A 111 -4.219 20.792 -18.402 1.00 1.00 H new ATOM 0 HE3 TRP A 111 -1.354 19.346 -14.119 1.00 1.00 H new ATOM 0 HZ2 TRP A 111 -2.082 18.952 -19.025 1.00 1.00 H new ATOM 0 HZ3 TRP A 111 0.208 18.016 -15.505 1.00 1.00 H new ATOM 0 HH2 TRP A 111 -0.206 17.723 -17.937 1.00 1.00 H new ATOM 563 N GLY A 112 -2.827 22.763 -11.104 1.00 1.00 N ATOM 564 CA GLY A 112 -2.921 23.302 -9.730 1.00 1.00 C ATOM 565 C GLY A 112 -3.013 22.246 -8.620 1.00 1.00 C ATOM 566 O GLY A 112 -3.526 21.155 -8.860 1.00 1.00 O ATOM 0 H GLY A 112 -2.235 21.935 -11.175 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -2.049 23.929 -9.542 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -3.797 23.948 -9.669 1.00 1.00 H new ATOM 570 N PRO A 113 -2.583 22.546 -7.377 1.00 1.00 N ATOM 571 CA PRO A 113 -2.632 21.592 -6.260 1.00 1.00 C ATOM 572 C PRO A 113 -4.048 21.144 -5.878 1.00 1.00 C ATOM 573 O PRO A 113 -4.244 19.990 -5.507 1.00 1.00 O ATOM 574 CB PRO A 113 -1.906 22.274 -5.093 1.00 1.00 C ATOM 575 CG PRO A 113 -1.946 23.762 -5.440 1.00 1.00 C ATOM 576 CD PRO A 113 -1.947 23.790 -6.966 1.00 1.00 C ATOM 0 HA PRO A 113 -2.147 20.660 -6.550 1.00 1.00 H new ATOM 0 HB2 PRO A 113 -2.403 22.074 -4.144 1.00 1.00 H new ATOM 0 HB3 PRO A 113 -0.881 21.915 -4.998 1.00 1.00 H new ATOM 0 HG2 PRO A 113 -2.835 24.242 -5.032 1.00 1.00 H new ATOM 0 HG3 PRO A 113 -1.084 24.289 -5.032 1.00 1.00 H new ATOM 0 HD2 PRO A 113 -2.495 24.654 -7.342 1.00 1.00 H new ATOM 0 HD3 PRO A 113 -0.932 23.860 -7.358 1.00 1.00 H new ATOM 584 N GLU A 114 -5.046 22.022 -6.022 1.00 1.00 N ATOM 585 CA GLU A 114 -6.457 21.709 -5.759 1.00 1.00 C ATOM 586 C GLU A 114 -6.962 20.617 -6.703 1.00 1.00 C ATOM 587 O GLU A 114 -7.583 19.636 -6.293 1.00 1.00 O ATOM 588 CB GLU A 114 -7.323 22.953 -5.986 1.00 1.00 C ATOM 589 CG GLU A 114 -6.773 24.224 -5.335 1.00 1.00 C ATOM 590 CD GLU A 114 -7.803 25.367 -5.388 1.00 1.00 C ATOM 591 OE1 GLU A 114 -7.856 26.103 -6.405 1.00 1.00 O ATOM 592 OE2 GLU A 114 -8.573 25.541 -4.410 1.00 1.00 O ATOM 0 H GLU A 114 -4.896 22.983 -6.329 1.00 1.00 H new ATOM 0 HA GLU A 114 -6.528 21.369 -4.726 1.00 1.00 H new ATOM 0 HB2 GLU A 114 -7.424 23.121 -7.058 1.00 1.00 H new ATOM 0 HB3 GLU A 114 -8.323 22.762 -5.597 1.00 1.00 H new ATOM 0 HG2 GLU A 114 -6.507 24.019 -4.298 1.00 1.00 H new ATOM 0 HG3 GLU A 114 -5.859 24.530 -5.844 1.00 1.00 H new ATOM 599 N ALA A 115 -6.637 20.801 -7.983 1.00 1.00 N ATOM 600 CA ALA A 115 -6.938 19.876 -9.067 1.00 1.00 C ATOM 601 C ALA A 115 -6.300 18.516 -8.775 1.00 1.00 C ATOM 602 O ALA A 115 -6.966 17.488 -8.714 1.00 1.00 O ATOM 603 CB ALA A 115 -6.380 20.456 -10.375 1.00 1.00 C ATOM 0 H ALA A 115 -6.138 21.632 -8.301 1.00 1.00 H new ATOM 0 HA ALA A 115 -8.016 19.741 -9.158 1.00 1.00 H new ATOM 0 HB1 ALA A 115 -6.597 19.774 -11.197 1.00 1.00 H new ATOM 0 HB2 ALA A 115 -6.845 21.422 -10.572 1.00 1.00 H new ATOM 0 HB3 ALA A 115 -5.301 20.584 -10.285 1.00 1.00 H new ATOM 609 N VAL A 116 -4.993 18.562 -8.521 1.00 1.00 N ATOM 610 CA VAL A 116 -4.128 17.417 -8.304 1.00 1.00 C ATOM 611 C VAL A 116 -4.615 16.549 -7.139 1.00 1.00 C ATOM 612 O VAL A 116 -4.757 15.337 -7.291 1.00 1.00 O ATOM 613 CB VAL A 116 -2.694 17.935 -8.120 1.00 1.00 C ATOM 614 CG1 VAL A 116 -1.712 16.924 -7.530 1.00 1.00 C ATOM 615 CG2 VAL A 116 -2.163 18.385 -9.485 1.00 1.00 C ATOM 0 H VAL A 116 -4.489 19.447 -8.459 1.00 1.00 H new ATOM 0 HA VAL A 116 -4.152 16.754 -9.169 1.00 1.00 H new ATOM 0 HB VAL A 116 -2.758 18.750 -7.399 1.00 1.00 H new ATOM 0 HG11 VAL A 116 -0.728 17.383 -7.439 1.00 1.00 H new ATOM 0 HG12 VAL A 116 -2.059 16.612 -6.545 1.00 1.00 H new ATOM 0 HG13 VAL A 116 -1.648 16.055 -8.184 1.00 1.00 H new ATOM 0 HG21 VAL A 116 -1.144 18.757 -9.375 1.00 1.00 H new ATOM 0 HG22 VAL A 116 -2.168 17.540 -10.174 1.00 1.00 H new ATOM 0 HG23 VAL A 116 -2.798 19.179 -9.879 1.00 1.00 H new ATOM 625 N GLU A 117 -4.952 17.162 -6.001 1.00 1.00 N ATOM 626 CA GLU A 117 -5.560 16.468 -4.860 1.00 1.00 C ATOM 627 C GLU A 117 -6.955 15.912 -5.189 1.00 1.00 C ATOM 628 O GLU A 117 -7.306 14.818 -4.743 1.00 1.00 O ATOM 629 CB GLU A 117 -5.714 17.458 -3.693 1.00 1.00 C ATOM 630 CG GLU A 117 -4.417 17.708 -2.924 1.00 1.00 C ATOM 631 CD GLU A 117 -4.237 16.634 -1.828 1.00 1.00 C ATOM 632 OE1 GLU A 117 -4.045 15.442 -2.158 1.00 1.00 O ATOM 633 OE2 GLU A 117 -4.379 16.941 -0.618 1.00 1.00 O ATOM 0 H GLU A 117 -4.810 18.160 -5.843 1.00 1.00 H new ATOM 0 HA GLU A 117 -4.906 15.635 -4.603 1.00 1.00 H new ATOM 0 HB2 GLU A 117 -6.085 18.407 -4.080 1.00 1.00 H new ATOM 0 HB3 GLU A 117 -6.468 17.078 -3.003 1.00 1.00 H new ATOM 0 HG2 GLU A 117 -3.569 17.687 -3.608 1.00 1.00 H new ATOM 0 HG3 GLU A 117 -4.438 18.700 -2.473 1.00 1.00 H new ATOM 640 N SER A 118 -7.756 16.646 -5.968 1.00 1.00 N ATOM 641 CA SER A 118 -9.115 16.223 -6.348 1.00 1.00 C ATOM 642 C SER A 118 -9.111 14.986 -7.253 1.00 1.00 C ATOM 643 O SER A 118 -10.033 14.170 -7.191 1.00 1.00 O ATOM 644 CB SER A 118 -9.895 17.351 -7.038 1.00 1.00 C ATOM 645 OG SER A 118 -10.039 18.476 -6.189 1.00 1.00 O ATOM 0 H SER A 118 -7.484 17.550 -6.355 1.00 1.00 H new ATOM 0 HA SER A 118 -9.614 15.966 -5.413 1.00 1.00 H new ATOM 0 HB2 SER A 118 -9.378 17.647 -7.951 1.00 1.00 H new ATOM 0 HB3 SER A 118 -10.879 16.987 -7.332 1.00 1.00 H new ATOM 0 HG SER A 118 -9.162 18.888 -6.040 1.00 1.00 H new ATOM 651 N TRP A 119 -8.058 14.812 -8.058 1.00 1.00 N ATOM 652 CA TRP A 119 -7.824 13.616 -8.869 1.00 1.00 C ATOM 653 C TRP A 119 -7.342 12.389 -8.063 1.00 1.00 C ATOM 654 O TRP A 119 -7.240 11.299 -8.634 1.00 1.00 O ATOM 655 CB TRP A 119 -6.774 13.920 -9.949 1.00 1.00 C ATOM 656 CG TRP A 119 -6.953 15.117 -10.835 1.00 1.00 C ATOM 657 CD1 TRP A 119 -8.114 15.746 -11.137 1.00 1.00 C ATOM 658 CD2 TRP A 119 -5.912 15.837 -11.568 1.00 1.00 C ATOM 659 NE1 TRP A 119 -7.857 16.827 -11.958 1.00 1.00 N ATOM 660 CE2 TRP A 119 -6.514 16.935 -12.253 1.00 1.00 C ATOM 661 CE3 TRP A 119 -4.519 15.667 -11.733 1.00 1.00 C ATOM 662 CZ2 TRP A 119 -5.771 17.832 -13.035 1.00 1.00 C ATOM 663 CZ3 TRP A 119 -3.765 16.551 -12.532 1.00 1.00 C ATOM 664 CH2 TRP A 119 -4.387 17.635 -13.173 1.00 1.00 C ATOM 0 H TRP A 119 -7.328 15.516 -8.165 1.00 1.00 H new ATOM 0 HA TRP A 119 -8.792 13.360 -9.301 1.00 1.00 H new ATOM 0 HB2 TRP A 119 -5.811 14.025 -9.449 1.00 1.00 H new ATOM 0 HB3 TRP A 119 -6.705 13.044 -10.593 1.00 1.00 H new ATOM 0 HD1 TRP A 119 -9.092 15.448 -10.789 1.00 1.00 H new ATOM 0 HE1 TRP A 119 -8.572 17.467 -12.304 1.00 1.00 H new ATOM 0 HE3 TRP A 119 -4.023 14.845 -11.238 1.00 1.00 H new ATOM 0 HZ2 TRP A 119 -6.257 18.663 -13.525 1.00 1.00 H new ATOM 0 HZ3 TRP A 119 -2.703 16.394 -12.652 1.00 1.00 H new ATOM 0 HH2 TRP A 119 -3.801 18.317 -13.772 1.00 1.00 H new ATOM 675 N ALA A 120 -6.977 12.538 -6.780 1.00 1.00 N ATOM 676 CA ALA A 120 -6.348 11.475 -6.019 1.00 1.00 C ATOM 677 C ALA A 120 -7.276 10.311 -5.636 1.00 1.00 C ATOM 678 O ALA A 120 -8.509 10.357 -5.704 1.00 1.00 O ATOM 679 CB ALA A 120 -5.646 12.030 -4.770 1.00 1.00 C ATOM 0 H ALA A 120 -7.114 13.400 -6.253 1.00 1.00 H new ATOM 0 HA ALA A 120 -5.612 11.048 -6.700 1.00 1.00 H new ATOM 0 HB1 ALA A 120 -5.183 11.211 -4.219 1.00 1.00 H new ATOM 0 HB2 ALA A 120 -4.879 12.744 -5.071 1.00 1.00 H new ATOM 0 HB3 ALA A 120 -6.377 12.529 -4.133 1.00 1.00 H new ATOM 685 N THR A 121 -6.591 9.284 -5.162 1.00 1.00 N ATOM 686 CA THR A 121 -7.055 7.957 -4.745 1.00 1.00 C ATOM 687 C THR A 121 -6.221 7.510 -3.553 1.00 1.00 C ATOM 688 O THR A 121 -5.010 7.693 -3.551 1.00 1.00 O ATOM 689 CB THR A 121 -6.824 6.970 -5.896 1.00 1.00 C ATOM 690 OG1 THR A 121 -7.463 7.391 -7.089 1.00 1.00 O ATOM 691 CG2 THR A 121 -7.364 5.587 -5.540 1.00 1.00 C ATOM 0 H THR A 121 -5.581 9.362 -5.044 1.00 1.00 H new ATOM 0 HA THR A 121 -8.112 7.991 -4.483 1.00 1.00 H new ATOM 0 HB THR A 121 -5.747 6.931 -6.056 1.00 1.00 H new ATOM 0 HG1 THR A 121 -7.292 6.738 -7.800 1.00 1.00 H new ATOM 0 HG21 THR A 121 -7.189 4.903 -6.371 1.00 1.00 H new ATOM 0 HG22 THR A 121 -6.855 5.215 -4.651 1.00 1.00 H new ATOM 0 HG23 THR A 121 -8.434 5.654 -5.344 1.00 1.00 H new ATOM 699 N LEU A 122 -6.843 6.886 -2.559 1.00 1.00 N ATOM 700 CA LEU A 122 -6.195 6.451 -1.323 1.00 1.00 C ATOM 701 C LEU A 122 -5.835 4.965 -1.422 1.00 1.00 C ATOM 702 O LEU A 122 -6.699 4.130 -1.693 1.00 1.00 O ATOM 703 CB LEU A 122 -7.155 6.736 -0.156 1.00 1.00 C ATOM 704 CG LEU A 122 -6.740 6.124 1.198 1.00 1.00 C ATOM 705 CD1 LEU A 122 -5.372 6.597 1.698 1.00 1.00 C ATOM 706 CD2 LEU A 122 -7.776 6.474 2.267 1.00 1.00 C ATOM 0 H LEU A 122 -7.838 6.662 -2.589 1.00 1.00 H new ATOM 0 HA LEU A 122 -5.265 6.995 -1.154 1.00 1.00 H new ATOM 0 HB2 LEU A 122 -7.246 7.816 -0.036 1.00 1.00 H new ATOM 0 HB3 LEU A 122 -8.144 6.360 -0.419 1.00 1.00 H new ATOM 0 HG LEU A 122 -6.679 5.049 1.028 1.00 1.00 H new ATOM 0 HD11 LEU A 122 -5.151 6.123 2.654 1.00 1.00 H new ATOM 0 HD12 LEU A 122 -4.605 6.325 0.972 1.00 1.00 H new ATOM 0 HD13 LEU A 122 -5.385 7.680 1.824 1.00 1.00 H new ATOM 0 HD21 LEU A 122 -7.476 6.039 3.220 1.00 1.00 H new ATOM 0 HD22 LEU A 122 -7.843 7.557 2.368 1.00 1.00 H new ATOM 0 HD23 LEU A 122 -8.748 6.076 1.976 1.00 1.00 H new ATOM 718 N LEU A 123 -4.565 4.645 -1.174 1.00 1.00 N ATOM 719 CA LEU A 123 -3.989 3.307 -1.264 1.00 1.00 C ATOM 720 C LEU A 123 -3.318 2.903 0.058 1.00 1.00 C ATOM 721 O LEU A 123 -2.386 3.549 0.540 1.00 1.00 O ATOM 722 CB LEU A 123 -3.010 3.268 -2.450 1.00 1.00 C ATOM 723 CG LEU A 123 -3.656 3.582 -3.808 1.00 1.00 C ATOM 724 CD1 LEU A 123 -2.573 3.509 -4.876 1.00 1.00 C ATOM 725 CD2 LEU A 123 -4.750 2.586 -4.200 1.00 1.00 C ATOM 0 H LEU A 123 -3.879 5.346 -0.892 1.00 1.00 H new ATOM 0 HA LEU A 123 -4.778 2.576 -1.440 1.00 1.00 H new ATOM 0 HB2 LEU A 123 -2.207 3.982 -2.268 1.00 1.00 H new ATOM 0 HB3 LEU A 123 -2.553 2.280 -2.497 1.00 1.00 H new ATOM 0 HG LEU A 123 -4.112 4.569 -3.728 1.00 1.00 H new ATOM 0 HD11 LEU A 123 -3.008 3.729 -5.851 1.00 1.00 H new ATOM 0 HD12 LEU A 123 -1.793 4.238 -4.654 1.00 1.00 H new ATOM 0 HD13 LEU A 123 -2.141 2.508 -4.889 1.00 1.00 H new ATOM 0 HD21 LEU A 123 -5.165 2.864 -5.169 1.00 1.00 H new ATOM 0 HD22 LEU A 123 -4.325 1.584 -4.262 1.00 1.00 H new ATOM 0 HD23 LEU A 123 -5.540 2.599 -3.449 1.00 1.00 H new ATOM 737 N GLY A 124 -3.816 1.808 0.635 1.00 1.00 N ATOM 738 CA GLY A 124 -3.399 1.298 1.952 1.00 1.00 C ATOM 739 C GLY A 124 -2.204 0.331 1.938 1.00 1.00 C ATOM 740 O GLY A 124 -1.687 -0.011 3.004 1.00 1.00 O ATOM 0 H GLY A 124 -4.536 1.235 0.194 1.00 1.00 H new ATOM 0 HA2 GLY A 124 -3.150 2.147 2.589 1.00 1.00 H new ATOM 0 HA3 GLY A 124 -4.248 0.792 2.412 1.00 1.00 H new ATOM 744 N HIS A 125 -1.759 -0.103 0.751 1.00 1.00 N ATOM 745 CA HIS A 125 -0.623 -1.015 0.532 1.00 1.00 C ATOM 746 C HIS A 125 0.043 -0.797 -0.842 1.00 1.00 C ATOM 747 O HIS A 125 -0.688 -0.621 -1.847 1.00 1.00 O ATOM 748 CB HIS A 125 -1.071 -2.480 0.729 1.00 1.00 C ATOM 749 CG HIS A 125 -2.270 -2.920 -0.082 1.00 1.00 C ATOM 750 ND1 HIS A 125 -2.554 -2.562 -1.385 1.00 1.00 N ATOM 751 CD2 HIS A 125 -3.263 -3.761 0.340 1.00 1.00 C ATOM 752 CE1 HIS A 125 -3.698 -3.170 -1.754 1.00 1.00 C ATOM 753 NE2 HIS A 125 -4.147 -3.909 -0.717 1.00 1.00 N ATOM 0 H HIS A 125 -2.199 0.184 -0.123 1.00 1.00 H new ATOM 0 HA HIS A 125 0.140 -0.787 1.277 1.00 1.00 H new ATOM 0 HB2 HIS A 125 -0.232 -3.132 0.484 1.00 1.00 H new ATOM 0 HB3 HIS A 125 -1.295 -2.632 1.785 1.00 1.00 H new ATOM 0 HD1 HIS A 125 -1.993 -1.942 -1.969 1.00 1.00 H new ATOM 0 HD2 HIS A 125 -3.343 -4.222 1.313 1.00 1.00 H new ATOM 0 HE1 HIS A 125 -4.176 -3.081 -2.718 1.00 1.00 H new TER 762 HIS A 125 ATOM 763 O5' DC B 1 -3.389 28.137 6.371 1.00 1.00 O ATOM 764 C5' DC B 1 -3.600 29.246 7.251 1.00 1.00 C ATOM 765 C4' DC B 1 -2.851 29.138 8.595 1.00 1.00 C ATOM 766 O4' DC B 1 -3.403 28.107 9.409 1.00 1.00 O ATOM 767 C3' DC B 1 -1.350 28.877 8.402 1.00 1.00 C ATOM 768 O3' DC B 1 -0.583 29.783 9.196 1.00 1.00 O ATOM 769 C2' DC B 1 -1.208 27.416 8.808 1.00 1.00 C ATOM 770 C1' DC B 1 -2.386 27.180 9.755 1.00 1.00 C ATOM 771 N1 DC B 1 -2.942 25.804 9.692 1.00 1.00 N ATOM 772 C2 DC B 1 -3.194 25.082 10.866 1.00 1.00 C ATOM 773 O2 DC B 1 -2.908 25.520 11.982 1.00 1.00 O ATOM 774 N3 DC B 1 -3.773 23.856 10.813 1.00 1.00 N ATOM 775 C4 DC B 1 -4.051 23.351 9.627 1.00 1.00 C ATOM 776 N4 DC B 1 -4.625 22.182 9.634 1.00 1.00 N ATOM 777 C5 DC B 1 -3.812 24.039 8.401 1.00 1.00 C ATOM 778 C6 DC B 1 -3.263 25.270 8.482 1.00 1.00 C ATOM 0 H5' DC B 1 -4.668 29.340 7.449 1.00 1.00 H new ATOM 0 H5'' DC B 1 -3.288 30.160 6.746 1.00 1.00 H new ATOM 0 H4' DC B 1 -2.973 30.100 9.092 1.00 1.00 H new ATOM 0 H3' DC B 1 -0.980 29.042 7.390 1.00 1.00 H new ATOM 0 H2' DC B 1 -1.253 26.755 7.943 1.00 1.00 H new ATOM 0 H2'' DC B 1 -0.255 27.230 9.302 1.00 1.00 H new ATOM 0 HO5' DC B 1 -3.895 28.275 5.543 1.00 1.00 H new ATOM 0 H1' DC B 1 -2.024 27.314 10.775 1.00 1.00 H new ATOM 0 H41 DC B 1 -4.870 21.729 8.754 1.00 1.00 H new ATOM 0 H42 DC B 1 -4.830 21.720 10.520 1.00 1.00 H new ATOM 0 H5 DC B 1 -4.060 23.594 7.448 1.00 1.00 H new ATOM 0 H6 DC B 1 -3.077 25.835 7.580 1.00 1.00 H new ATOM 791 P DG B 2 1.041 29.825 9.171 1.00 1.00 P ATOM 792 OP1 DG B 2 1.460 31.201 9.558 1.00 1.00 O ATOM 793 OP2 DG B 2 1.519 29.284 7.868 1.00 1.00 O ATOM 794 O5' DG B 2 1.491 28.796 10.349 1.00 1.00 O ATOM 795 C5' DG B 2 1.284 29.106 11.726 1.00 1.00 C ATOM 796 C4' DG B 2 1.778 28.022 12.705 1.00 1.00 C ATOM 797 O4' DG B 2 0.883 26.909 12.736 1.00 1.00 O ATOM 798 C3' DG B 2 3.193 27.501 12.387 1.00 1.00 C ATOM 799 O3' DG B 2 3.983 27.479 13.577 1.00 1.00 O ATOM 800 C2' DG B 2 2.876 26.126 11.800 1.00 1.00 C ATOM 801 C1' DG B 2 1.639 25.717 12.596 1.00 1.00 C ATOM 802 N9 DG B 2 0.835 24.676 11.924 1.00 1.00 N ATOM 803 C8 DG B 2 0.455 24.644 10.611 1.00 1.00 C ATOM 804 N7 DG B 2 -0.298 23.631 10.282 1.00 1.00 N ATOM 805 C5 DG B 2 -0.402 22.910 11.482 1.00 1.00 C ATOM 806 C6 DG B 2 -1.090 21.683 11.803 1.00 1.00 C ATOM 807 O6 DG B 2 -1.819 20.987 11.097 1.00 1.00 O ATOM 808 N1 DG B 2 -0.879 21.251 13.094 1.00 1.00 N ATOM 809 C2 DG B 2 -0.142 21.932 13.998 1.00 1.00 C ATOM 810 N2 DG B 2 -0.025 21.384 15.178 1.00 1.00 N ATOM 811 N3 DG B 2 0.477 23.089 13.773 1.00 1.00 N ATOM 812 C4 DG B 2 0.315 23.531 12.486 1.00 1.00 C ATOM 0 H5' DG B 2 0.219 29.271 11.893 1.00 1.00 H new ATOM 0 H5'' DG B 2 1.791 30.043 11.955 1.00 1.00 H new ATOM 0 H4' DG B 2 1.812 28.513 13.677 1.00 1.00 H new ATOM 0 H3' DG B 2 3.791 28.103 11.703 1.00 1.00 H new ATOM 0 H2' DG B 2 2.674 26.176 10.730 1.00 1.00 H new ATOM 0 H2'' DG B 2 3.699 25.425 11.937 1.00 1.00 H new ATOM 0 H1' DG B 2 1.930 25.278 13.551 1.00 1.00 H new ATOM 0 H8 DG B 2 0.755 25.400 9.900 1.00 1.00 H new ATOM 0 H1 DG B 2 -1.302 20.369 13.383 1.00 1.00 H new ATOM 0 H21 DG B 2 0.519 21.849 15.905 1.00 1.00 H new ATOM 0 H22 DG B 2 -0.478 20.491 15.373 1.00 1.00 H new ATOM 824 P DC B 3 5.534 26.995 13.607 1.00 1.00 P ATOM 825 OP1 DC B 3 6.239 27.798 14.647 1.00 1.00 O ATOM 826 OP2 DC B 3 6.082 27.003 12.222 1.00 1.00 O ATOM 827 O5' DC B 3 5.436 25.457 14.113 1.00 1.00 O ATOM 828 C5' DC B 3 5.013 25.158 15.445 1.00 1.00 C ATOM 829 C4' DC B 3 4.869 23.656 15.739 1.00 1.00 C ATOM 830 O4' DC B 3 3.799 23.116 14.977 1.00 1.00 O ATOM 831 C3' DC B 3 6.145 22.842 15.465 1.00 1.00 C ATOM 832 O3' DC B 3 6.656 22.318 16.692 1.00 1.00 O ATOM 833 C2' DC B 3 5.682 21.755 14.492 1.00 1.00 C ATOM 834 C1' DC B 3 4.157 21.826 14.521 1.00 1.00 C ATOM 835 N1 DC B 3 3.564 21.605 13.183 1.00 1.00 N ATOM 836 C2 DC B 3 2.749 20.491 12.957 1.00 1.00 C ATOM 837 O2 DC B 3 2.545 19.643 13.824 1.00 1.00 O ATOM 838 N3 DC B 3 2.144 20.308 11.761 1.00 1.00 N ATOM 839 C4 DC B 3 2.373 21.186 10.809 1.00 1.00 C ATOM 840 N4 DC B 3 1.747 20.957 9.690 1.00 1.00 N ATOM 841 C5 DC B 3 3.218 22.324 10.961 1.00 1.00 C ATOM 842 C6 DC B 3 3.803 22.496 12.174 1.00 1.00 C ATOM 0 H5' DC B 3 4.056 25.646 15.628 1.00 1.00 H new ATOM 0 H5'' DC B 3 5.729 25.587 16.146 1.00 1.00 H new ATOM 0 H4' DC B 3 4.669 23.576 16.807 1.00 1.00 H new ATOM 0 H3' DC B 3 6.965 23.422 15.040 1.00 1.00 H new ATOM 0 H2' DC B 3 6.067 21.933 13.488 1.00 1.00 H new ATOM 0 H2'' DC B 3 6.038 20.772 14.800 1.00 1.00 H new ATOM 0 H1' DC B 3 3.780 21.042 15.178 1.00 1.00 H new ATOM 0 H41 DC B 3 1.868 21.589 8.899 1.00 1.00 H new ATOM 0 H42 DC B 3 1.135 20.145 9.605 1.00 1.00 H new ATOM 0 H5 DC B 3 3.385 23.017 10.149 1.00 1.00 H new ATOM 0 H6 DC B 3 4.458 23.338 12.342 1.00 1.00 H new ATOM 854 P DA B 4 8.092 21.563 16.795 1.00 1.00 P ATOM 855 OP1 DA B 4 8.503 21.566 18.227 1.00 1.00 O ATOM 856 OP2 DA B 4 9.025 22.158 15.796 1.00 1.00 O ATOM 857 O5' DA B 4 7.782 20.033 16.355 1.00 1.00 O ATOM 858 C5' DA B 4 6.912 19.209 17.131 1.00 1.00 C ATOM 859 C4' DA B 4 6.593 17.852 16.477 1.00 1.00 C ATOM 860 O4' DA B 4 5.673 17.983 15.398 1.00 1.00 O ATOM 861 C3' DA B 4 7.844 17.107 15.963 1.00 1.00 C ATOM 862 O3' DA B 4 7.925 15.813 16.558 1.00 1.00 O ATOM 863 C2' DA B 4 7.593 17.098 14.455 1.00 1.00 C ATOM 864 C1' DA B 4 6.072 17.090 14.374 1.00 1.00 C ATOM 865 N9 DA B 4 5.588 17.581 13.076 1.00 1.00 N ATOM 866 C8 DA B 4 5.935 18.761 12.483 1.00 1.00 C ATOM 867 N7 DA B 4 5.300 19.020 11.369 1.00 1.00 N ATOM 868 C5 DA B 4 4.506 17.873 11.205 1.00 1.00 C ATOM 869 C6 DA B 4 3.590 17.431 10.220 1.00 1.00 C ATOM 870 N6 DA B 4 3.233 18.150 9.180 1.00 1.00 N ATOM 871 N1 DA B 4 3.015 16.226 10.279 1.00 1.00 N ATOM 872 C2 DA B 4 3.316 15.463 11.322 1.00 1.00 C ATOM 873 N3 DA B 4 4.135 15.736 12.333 1.00 1.00 N ATOM 874 C4 DA B 4 4.703 16.972 12.216 1.00 1.00 C ATOM 0 H5' DA B 4 5.979 19.745 17.306 1.00 1.00 H new ATOM 0 H5'' DA B 4 7.367 19.034 18.106 1.00 1.00 H new ATOM 0 H4' DA B 4 6.147 17.262 17.277 1.00 1.00 H new ATOM 0 H3' DA B 4 8.805 17.558 16.211 1.00 1.00 H new ATOM 0 H2' DA B 4 8.021 17.974 13.967 1.00 1.00 H new ATOM 0 H2'' DA B 4 8.030 16.221 13.976 1.00 1.00 H new ATOM 0 H1' DA B 4 5.670 16.083 14.485 1.00 1.00 H new ATOM 0 H8 DA B 4 6.675 19.428 12.901 1.00 1.00 H new ATOM 0 H61 DA B 4 2.567 17.774 8.504 1.00 1.00 H new ATOM 0 H62 DA B 4 3.621 19.084 9.048 1.00 1.00 H new ATOM 0 H2 DA B 4 2.834 14.497 11.354 1.00 1.00 H new ATOM 886 P DT B 5 9.224 14.848 16.387 1.00 1.00 P ATOM 887 OP1 DT B 5 9.274 13.935 17.564 1.00 1.00 O ATOM 888 OP2 DT B 5 10.422 15.683 16.091 1.00 1.00 O ATOM 889 O5' DT B 5 8.875 13.972 15.070 1.00 1.00 O ATOM 890 C5' DT B 5 7.825 13.009 15.093 1.00 1.00 C ATOM 891 C4' DT B 5 7.588 12.329 13.737 1.00 1.00 C ATOM 892 O4' DT B 5 6.969 13.227 12.817 1.00 1.00 O ATOM 893 C3' DT B 5 8.873 11.776 13.093 1.00 1.00 C ATOM 894 O3' DT B 5 8.704 10.388 12.823 1.00 1.00 O ATOM 895 C2' DT B 5 9.007 12.653 11.846 1.00 1.00 C ATOM 896 C1' DT B 5 7.558 13.034 11.548 1.00 1.00 C ATOM 897 N1 DT B 5 7.373 14.262 10.721 1.00 1.00 N ATOM 898 C2 DT B 5 6.455 14.208 9.664 1.00 1.00 C ATOM 899 O2 DT B 5 5.879 13.179 9.320 1.00 1.00 O ATOM 900 N3 DT B 5 6.216 15.373 8.969 1.00 1.00 N ATOM 901 C4 DT B 5 6.864 16.567 9.182 1.00 1.00 C ATOM 902 O4 DT B 5 6.554 17.534 8.493 1.00 1.00 O ATOM 903 C5 DT B 5 7.877 16.541 10.238 1.00 1.00 C ATOM 904 C7 DT B 5 8.728 17.765 10.513 1.00 1.00 C ATOM 905 C6 DT B 5 8.080 15.421 10.980 1.00 1.00 C ATOM 0 H5' DT B 5 6.903 13.496 15.413 1.00 1.00 H new ATOM 0 H5'' DT B 5 8.058 12.247 15.837 1.00 1.00 H new ATOM 0 H4' DT B 5 6.931 11.485 13.950 1.00 1.00 H new ATOM 0 H3' DT B 5 9.775 11.820 13.704 1.00 1.00 H new ATOM 0 H2' DT B 5 9.627 13.530 12.032 1.00 1.00 H new ATOM 0 H2'' DT B 5 9.462 12.111 11.017 1.00 1.00 H new ATOM 0 H1' DT B 5 7.105 12.244 10.948 1.00 1.00 H new ATOM 0 H3 DT B 5 5.503 15.348 8.240 1.00 1.00 H new ATOM 0 H71 DT B 5 9.005 17.786 11.567 1.00 1.00 H new ATOM 0 H72 DT B 5 9.630 17.726 9.902 1.00 1.00 H new ATOM 0 H73 DT B 5 8.162 18.664 10.268 1.00 1.00 H new ATOM 0 H6 DT B 5 8.803 15.437 11.782 1.00 1.00 H new ATOM 918 P DA B 6 9.854 9.468 12.137 1.00 1.00 P ATOM 919 OP1 DA B 6 9.827 8.131 12.796 1.00 1.00 O ATOM 920 OP2 DA B 6 11.145 10.214 12.099 1.00 1.00 O ATOM 921 O5' DA B 6 9.300 9.317 10.622 1.00 1.00 O ATOM 922 C5' DA B 6 8.080 8.624 10.373 1.00 1.00 C ATOM 923 C4' DA B 6 7.669 8.563 8.896 1.00 1.00 C ATOM 924 O4' DA B 6 7.257 9.854 8.438 1.00 1.00 O ATOM 925 C3' DA B 6 8.778 8.037 7.971 1.00 1.00 C ATOM 926 O3' DA B 6 8.217 7.087 7.071 1.00 1.00 O ATOM 927 C2' DA B 6 9.286 9.328 7.339 1.00 1.00 C ATOM 928 C1' DA B 6 8.057 10.233 7.327 1.00 1.00 C ATOM 929 N9 DA B 6 8.417 11.661 7.425 1.00 1.00 N ATOM 930 C8 DA B 6 9.384 12.238 8.204 1.00 1.00 C ATOM 931 N7 DA B 6 9.533 13.526 8.037 1.00 1.00 N ATOM 932 C5 DA B 6 8.584 13.807 7.046 1.00 1.00 C ATOM 933 C6 DA B 6 8.192 14.972 6.344 1.00 1.00 C ATOM 934 N6 DA B 6 8.718 16.169 6.524 1.00 1.00 N ATOM 935 N1 DA B 6 7.242 14.936 5.415 1.00 1.00 N ATOM 936 C2 DA B 6 6.660 13.770 5.167 1.00 1.00 C ATOM 937 N3 DA B 6 6.901 12.599 5.743 1.00 1.00 N ATOM 938 C4 DA B 6 7.889 12.686 6.678 1.00 1.00 C ATOM 0 H5' DA B 6 7.282 9.105 10.939 1.00 1.00 H new ATOM 0 H5'' DA B 6 8.171 7.607 10.753 1.00 1.00 H new ATOM 0 H4' DA B 6 6.842 7.855 8.848 1.00 1.00 H new ATOM 0 H3' DA B 6 9.598 7.490 8.437 1.00 1.00 H new ATOM 0 H2' DA B 6 10.099 9.765 7.919 1.00 1.00 H new ATOM 0 H2'' DA B 6 9.668 9.158 6.332 1.00 1.00 H new ATOM 0 H1' DA B 6 7.522 10.114 6.385 1.00 1.00 H new ATOM 0 H8 DA B 6 9.979 11.671 8.904 1.00 1.00 H new ATOM 0 H61 DA B 6 8.381 16.962 5.978 1.00 1.00 H new ATOM 0 H62 DA B 6 9.462 16.301 7.209 1.00 1.00 H new ATOM 0 H2 DA B 6 5.897 13.774 4.403 1.00 1.00 H new ATOM 950 P DT B 7 9.060 6.387 5.870 1.00 1.00 P ATOM 951 OP1 DT B 7 8.428 5.071 5.564 1.00 1.00 O ATOM 952 OP2 DT B 7 10.514 6.421 6.191 1.00 1.00 O ATOM 953 O5' DT B 7 8.766 7.398 4.643 1.00 1.00 O ATOM 954 C5' DT B 7 7.427 7.629 4.225 1.00 1.00 C ATOM 955 C4' DT B 7 7.290 8.769 3.209 1.00 1.00 C ATOM 956 O4' DT B 7 7.694 10.002 3.785 1.00 1.00 O ATOM 957 C3' DT B 7 8.090 8.546 1.914 1.00 1.00 C ATOM 958 O3' DT B 7 7.236 8.771 0.797 1.00 1.00 O ATOM 959 C2' DT B 7 9.167 9.615 2.033 1.00 1.00 C ATOM 960 C1' DT B 7 8.398 10.701 2.781 1.00 1.00 C ATOM 961 N1 DT B 7 9.280 11.729 3.378 1.00 1.00 N ATOM 962 C2 DT B 7 9.112 13.063 2.985 1.00 1.00 C ATOM 963 O2 DT B 7 8.325 13.442 2.119 1.00 1.00 O ATOM 964 N3 DT B 7 9.902 13.990 3.614 1.00 1.00 N ATOM 965 C4 DT B 7 10.888 13.722 4.529 1.00 1.00 C ATOM 966 O4 DT B 7 11.530 14.673 4.979 1.00 1.00 O ATOM 967 C5 DT B 7 11.053 12.304 4.859 1.00 1.00 C ATOM 968 C7 DT B 7 12.126 11.872 5.841 1.00 1.00 C ATOM 969 C6 DT B 7 10.254 11.366 4.281 1.00 1.00 C ATOM 0 H5' DT B 7 6.816 7.857 5.099 1.00 1.00 H new ATOM 0 H5'' DT B 7 7.029 6.714 3.788 1.00 1.00 H new ATOM 0 H4' DT B 7 6.234 8.793 2.941 1.00 1.00 H new ATOM 0 H3' DT B 7 8.500 7.545 1.779 1.00 1.00 H new ATOM 0 H2' DT B 7 10.038 9.266 2.588 1.00 1.00 H new ATOM 0 H2'' DT B 7 9.524 9.954 1.061 1.00 1.00 H new ATOM 0 H1' DT B 7 7.747 11.256 2.105 1.00 1.00 H new ATOM 0 H3 DT B 7 9.742 14.970 3.380 1.00 1.00 H new ATOM 0 H71 DT B 7 11.801 10.971 6.362 1.00 1.00 H new ATOM 0 H72 DT B 7 13.051 11.666 5.302 1.00 1.00 H new ATOM 0 H73 DT B 7 12.298 12.668 6.565 1.00 1.00 H new ATOM 0 H6 DT B 7 10.386 10.324 4.534 1.00 1.00 H new ATOM 982 P DA B 8 7.497 8.110 -0.651 1.00 1.00 P ATOM 983 OP1 DA B 8 6.205 8.143 -1.382 1.00 1.00 O ATOM 984 OP2 DA B 8 8.143 6.785 -0.450 1.00 1.00 O ATOM 985 O5' DA B 8 8.528 9.110 -1.374 1.00 1.00 O ATOM 986 C5' DA B 8 8.049 10.255 -2.070 1.00 1.00 C ATOM 987 C4' DA B 8 9.153 11.199 -2.576 1.00 1.00 C ATOM 988 O4' DA B 8 9.578 12.056 -1.528 1.00 1.00 O ATOM 989 C3' DA B 8 10.397 10.501 -3.166 1.00 1.00 C ATOM 990 O3' DA B 8 10.511 10.770 -4.563 1.00 1.00 O ATOM 991 C2' DA B 8 11.535 11.091 -2.333 1.00 1.00 C ATOM 992 C1' DA B 8 10.932 12.367 -1.759 1.00 1.00 C ATOM 993 N9 DA B 8 11.538 12.798 -0.480 1.00 1.00 N ATOM 994 C8 DA B 8 11.774 12.079 0.670 1.00 1.00 C ATOM 995 N7 DA B 8 12.282 12.779 1.654 1.00 1.00 N ATOM 996 C5 DA B 8 12.389 14.066 1.099 1.00 1.00 C ATOM 997 C6 DA B 8 12.827 15.338 1.557 1.00 1.00 C ATOM 998 N6 DA B 8 13.233 15.635 2.780 1.00 1.00 N ATOM 999 N1 DA B 8 12.795 16.405 0.759 1.00 1.00 N ATOM 1000 C2 DA B 8 12.330 16.249 -0.465 1.00 1.00 C ATOM 1001 N3 DA B 8 11.878 15.146 -1.037 1.00 1.00 N ATOM 1002 C4 DA B 8 11.940 14.077 -0.196 1.00 1.00 C ATOM 0 H5' DA B 8 7.384 10.814 -1.411 1.00 1.00 H new ATOM 0 H5'' DA B 8 7.452 9.925 -2.920 1.00 1.00 H new ATOM 0 H4' DA B 8 8.690 11.751 -3.394 1.00 1.00 H new ATOM 0 H3' DA B 8 10.377 9.413 -3.111 1.00 1.00 H new ATOM 0 H2' DA B 8 11.852 10.407 -1.545 1.00 1.00 H new ATOM 0 H2'' DA B 8 12.412 11.302 -2.944 1.00 1.00 H new ATOM 0 H1' DA B 8 11.099 13.188 -2.456 1.00 1.00 H new ATOM 0 H8 DA B 8 11.558 11.024 0.754 1.00 1.00 H new ATOM 0 H61 DA B 8 13.528 16.586 3.003 1.00 1.00 H new ATOM 0 H62 DA B 8 13.251 14.913 3.501 1.00 1.00 H new ATOM 0 H2 DA B 8 12.317 17.137 -1.080 1.00 1.00 H new ATOM 1014 P DT B 9 11.721 10.158 -5.473 1.00 1.00 P ATOM 1015 OP1 DT B 9 11.121 9.644 -6.731 1.00 1.00 O ATOM 1016 OP2 DT B 9 12.582 9.248 -4.668 1.00 1.00 O ATOM 1017 O5' DT B 9 12.558 11.495 -5.811 1.00 1.00 O ATOM 1018 C5' DT B 9 11.977 12.516 -6.617 1.00 1.00 C ATOM 1019 C4' DT B 9 12.866 13.757 -6.776 1.00 1.00 C ATOM 1020 O4' DT B 9 12.954 14.443 -5.531 1.00 1.00 O ATOM 1021 C3' DT B 9 14.277 13.412 -7.279 1.00 1.00 C ATOM 1022 O3' DT B 9 14.601 14.200 -8.425 1.00 1.00 O ATOM 1023 C2' DT B 9 15.131 13.684 -6.047 1.00 1.00 C ATOM 1024 C1' DT B 9 14.311 14.688 -5.233 1.00 1.00 C ATOM 1025 N1 DT B 9 14.534 14.573 -3.767 1.00 1.00 N ATOM 1026 C2 DT B 9 14.851 15.738 -3.052 1.00 1.00 C ATOM 1027 O2 DT B 9 14.832 16.874 -3.533 1.00 1.00 O ATOM 1028 N3 DT B 9 15.198 15.579 -1.728 1.00 1.00 N ATOM 1029 C4 DT B 9 15.235 14.383 -1.052 1.00 1.00 C ATOM 1030 O4 DT B 9 15.517 14.389 0.145 1.00 1.00 O ATOM 1031 C5 DT B 9 14.883 13.209 -1.847 1.00 1.00 C ATOM 1032 C7 DT B 9 14.935 11.828 -1.219 1.00 1.00 C ATOM 1033 C6 DT B 9 14.521 13.339 -3.147 1.00 1.00 C ATOM 0 H5' DT B 9 11.025 12.816 -6.178 1.00 1.00 H new ATOM 0 H5'' DT B 9 11.759 12.108 -7.604 1.00 1.00 H new ATOM 0 H4' DT B 9 12.403 14.395 -7.529 1.00 1.00 H new ATOM 0 H3' DT B 9 14.416 12.391 -7.635 1.00 1.00 H new ATOM 0 H2' DT B 9 15.316 12.771 -5.482 1.00 1.00 H new ATOM 0 H2'' DT B 9 16.104 14.093 -6.320 1.00 1.00 H new ATOM 0 H1' DT B 9 14.619 15.698 -5.503 1.00 1.00 H new ATOM 0 H3 DT B 9 15.448 16.419 -1.206 1.00 1.00 H new ATOM 0 H71 DT B 9 14.193 11.185 -1.692 1.00 1.00 H new ATOM 0 H72 DT B 9 15.928 11.401 -1.361 1.00 1.00 H new ATOM 0 H73 DT B 9 14.722 11.905 -0.153 1.00 1.00 H new ATOM 0 H6 DT B 9 14.218 12.466 -3.705 1.00 1.00 H new ATOM 1046 P DG B 10 16.070 14.196 -9.118 1.00 1.00 P ATOM 1047 OP1 DG B 10 15.899 14.505 -10.564 1.00 1.00 O ATOM 1048 OP2 DG B 10 16.807 12.958 -8.737 1.00 1.00 O ATOM 1049 O5' DG B 10 16.773 15.465 -8.410 1.00 1.00 O ATOM 1050 C5' DG B 10 16.229 16.774 -8.562 1.00 1.00 C ATOM 1051 C4' DG B 10 17.078 17.888 -7.922 1.00 1.00 C ATOM 1052 O4' DG B 10 17.000 17.830 -6.497 1.00 1.00 O ATOM 1053 C3' DG B 10 18.559 17.818 -8.339 1.00 1.00 C ATOM 1054 O3' DG B 10 19.054 19.124 -8.627 1.00 1.00 O ATOM 1055 C2' DG B 10 19.172 17.162 -7.104 1.00 1.00 C ATOM 1056 C1' DG B 10 18.316 17.725 -5.972 1.00 1.00 C ATOM 1057 N9 DG B 10 18.325 16.862 -4.776 1.00 1.00 N ATOM 1058 C8 DG B 10 18.139 15.510 -4.735 1.00 1.00 C ATOM 1059 N7 DG B 10 18.144 14.990 -3.535 1.00 1.00 N ATOM 1060 C5 DG B 10 18.410 16.096 -2.713 1.00 1.00 C ATOM 1061 C6 DG B 10 18.592 16.200 -1.285 1.00 1.00 C ATOM 1062 O6 DG B 10 18.472 15.334 -0.418 1.00 1.00 O ATOM 1063 N1 DG B 10 18.960 17.457 -0.870 1.00 1.00 N ATOM 1064 C2 DG B 10 19.093 18.512 -1.704 1.00 1.00 C ATOM 1065 N2 DG B 10 19.466 19.636 -1.152 1.00 1.00 N ATOM 1066 N3 DG B 10 18.889 18.490 -3.020 1.00 1.00 N ATOM 1067 C4 DG B 10 18.559 17.240 -3.474 1.00 1.00 C ATOM 0 H5' DG B 10 15.232 16.794 -8.122 1.00 1.00 H new ATOM 0 H5'' DG B 10 16.113 16.986 -9.625 1.00 1.00 H new ATOM 0 H4' DG B 10 16.664 18.829 -8.284 1.00 1.00 H new ATOM 0 H3' DG B 10 18.781 17.265 -9.252 1.00 1.00 H new ATOM 0 H2' DG B 10 19.117 16.074 -7.152 1.00 1.00 H new ATOM 0 H2'' DG B 10 20.224 17.423 -6.986 1.00 1.00 H new ATOM 0 H1' DG B 10 18.709 18.687 -5.644 1.00 1.00 H new ATOM 0 H8 DG B 10 17.998 14.915 -5.626 1.00 1.00 H new ATOM 0 H1 DG B 10 19.143 17.602 0.123 1.00 1.00 H new ATOM 0 H21 DG B 10 19.585 20.471 -1.726 1.00 1.00 H new ATOM 0 H22 DG B 10 19.638 19.678 -0.147 1.00 1.00 H new ATOM 1079 P DC B 11 20.557 19.407 -9.181 1.00 1.00 P ATOM 1080 OP1 DC B 11 20.471 20.483 -10.208 1.00 1.00 O ATOM 1081 OP2 DC B 11 21.197 18.116 -9.562 1.00 1.00 O ATOM 1082 O5' DC B 11 21.335 19.993 -7.880 1.00 1.00 O ATOM 1083 C5' DC B 11 20.967 21.255 -7.321 1.00 1.00 C ATOM 1084 C4' DC B 11 21.831 21.700 -6.126 1.00 1.00 C ATOM 1085 O4' DC B 11 21.585 20.866 -4.998 1.00 1.00 O ATOM 1086 C3' DC B 11 23.341 21.696 -6.434 1.00 1.00 C ATOM 1087 O3' DC B 11 23.949 22.892 -5.942 1.00 1.00 O ATOM 1088 C2' DC B 11 23.799 20.414 -5.731 1.00 1.00 C ATOM 1089 C1' DC B 11 22.804 20.279 -4.573 1.00 1.00 C ATOM 1090 N1 DC B 11 22.542 18.891 -4.112 1.00 1.00 N ATOM 1091 C2 DC B 11 22.555 18.592 -2.742 1.00 1.00 C ATOM 1092 O2 DC B 11 22.881 19.420 -1.889 1.00 1.00 O ATOM 1093 N3 DC B 11 22.219 17.357 -2.297 1.00 1.00 N ATOM 1094 C4 DC B 11 21.883 16.448 -3.186 1.00 1.00 C ATOM 1095 N4 DC B 11 21.510 15.298 -2.701 1.00 1.00 N ATOM 1096 C5 DC B 11 21.879 16.673 -4.589 1.00 1.00 C ATOM 1097 C6 DC B 11 22.215 17.918 -5.014 1.00 1.00 C ATOM 0 H5' DC B 11 19.926 21.207 -7.003 1.00 1.00 H new ATOM 0 H5'' DC B 11 21.028 22.015 -8.100 1.00 1.00 H new ATOM 0 H4' DC B 11 21.542 22.729 -5.911 1.00 1.00 H new ATOM 0 H3' DC B 11 23.610 21.693 -7.490 1.00 1.00 H new ATOM 0 H2' DC B 11 23.761 19.553 -6.398 1.00 1.00 H new ATOM 0 H2'' DC B 11 24.825 20.495 -5.373 1.00 1.00 H new ATOM 0 H1' DC B 11 23.251 20.778 -3.713 1.00 1.00 H new ATOM 0 H41 DC B 11 21.235 14.544 -3.331 1.00 1.00 H new ATOM 0 H42 DC B 11 21.493 15.151 -1.692 1.00 1.00 H new ATOM 0 H5 DC B 11 21.620 15.889 -5.286 1.00 1.00 H new ATOM 0 H6 DC B 11 22.224 18.141 -6.071 1.00 1.00 H new ATOM 1109 P DG B 12 25.477 23.313 -6.308 1.00 1.00 P ATOM 1110 OP1 DG B 12 25.625 24.771 -6.036 1.00 1.00 O ATOM 1111 OP2 DG B 12 25.804 22.814 -7.675 1.00 1.00 O ATOM 1112 O5' DG B 12 26.381 22.495 -5.238 1.00 1.00 O ATOM 1113 C5' DG B 12 26.392 22.854 -3.860 1.00 1.00 C ATOM 1114 C4' DG B 12 26.965 21.753 -2.953 1.00 1.00 C ATOM 1115 O4' DG B 12 26.091 20.642 -2.879 1.00 1.00 O ATOM 1116 C3' DG B 12 28.336 21.196 -3.379 1.00 1.00 C ATOM 1117 O3' DG B 12 29.417 21.875 -2.739 1.00 1.00 O ATOM 1118 C2' DG B 12 28.269 19.731 -2.940 1.00 1.00 C ATOM 1119 C1' DG B 12 26.848 19.550 -2.395 1.00 1.00 C ATOM 1120 N9 DG B 12 26.234 18.278 -2.819 1.00 1.00 N ATOM 1121 C8 DG B 12 25.987 17.856 -4.094 1.00 1.00 C ATOM 1122 N7 DG B 12 25.466 16.657 -4.177 1.00 1.00 N ATOM 1123 C5 DG B 12 25.373 16.251 -2.834 1.00 1.00 C ATOM 1124 C6 DG B 12 24.902 15.030 -2.222 1.00 1.00 C ATOM 1125 O6 DG B 12 24.443 14.011 -2.738 1.00 1.00 O ATOM 1126 N1 DG B 12 25.006 15.031 -0.847 1.00 1.00 N ATOM 1127 C2 DG B 12 25.523 16.052 -0.128 1.00 1.00 C ATOM 1128 N2 DG B 12 25.612 15.876 1.162 1.00 1.00 N ATOM 1129 N3 DG B 12 25.964 17.198 -0.636 1.00 1.00 N ATOM 1130 C4 DG B 12 25.855 17.241 -1.999 1.00 1.00 C ATOM 0 H5' DG B 12 25.375 23.084 -3.543 1.00 1.00 H new ATOM 0 H5'' DG B 12 26.979 23.763 -3.733 1.00 1.00 H new ATOM 0 H4' DG B 12 27.083 22.259 -1.995 1.00 1.00 H new ATOM 0 H3' DG B 12 28.523 21.322 -4.445 1.00 1.00 H new ATOM 0 H2' DG B 12 28.461 19.058 -3.776 1.00 1.00 H new ATOM 0 H2'' DG B 12 29.016 19.512 -2.177 1.00 1.00 H new ATOM 0 HO3' DG B 12 30.267 21.489 -3.036 1.00 1.00 H new ATOM 0 H1' DG B 12 26.875 19.519 -1.306 1.00 1.00 H new ATOM 0 H8 DG B 12 26.203 18.461 -4.962 1.00 1.00 H new ATOM 0 H1 DG B 12 24.672 14.211 -0.341 1.00 1.00 H new ATOM 0 H21 DG B 12 25.995 16.615 1.752 1.00 1.00 H new ATOM 0 H22 DG B 12 25.299 15.000 1.580 1.00 1.00 H new TER 1143 DG B 12 ATOM 1144 O5' DC C 13 22.816 8.043 4.861 1.00 1.00 O ATOM 1145 C5' DC C 13 24.138 8.173 5.396 1.00 1.00 C ATOM 1146 C4' DC C 13 24.646 9.627 5.482 1.00 1.00 C ATOM 1147 O4' DC C 13 24.808 10.187 4.181 1.00 1.00 O ATOM 1148 C3' DC C 13 23.693 10.520 6.288 1.00 1.00 C ATOM 1149 O3' DC C 13 24.421 11.345 7.198 1.00 1.00 O ATOM 1150 C2' DC C 13 22.987 11.304 5.182 1.00 1.00 C ATOM 1151 C1' DC C 13 24.087 11.409 4.125 1.00 1.00 C ATOM 1152 N1 DC C 13 23.629 11.667 2.736 1.00 1.00 N ATOM 1153 C2 DC C 13 24.256 12.651 1.960 1.00 1.00 C ATOM 1154 O2 DC C 13 25.113 13.408 2.421 1.00 1.00 O ATOM 1155 N3 DC C 13 23.947 12.805 0.648 1.00 1.00 N ATOM 1156 C4 DC C 13 23.008 12.039 0.133 1.00 1.00 C ATOM 1157 N4 DC C 13 22.784 12.198 -1.143 1.00 1.00 N ATOM 1158 C5 DC C 13 22.315 11.041 0.874 1.00 1.00 C ATOM 1159 C6 DC C 13 22.660 10.885 2.173 1.00 1.00 C ATOM 0 H5' DC C 13 24.826 7.596 4.778 1.00 1.00 H new ATOM 0 H5'' DC C 13 24.159 7.733 6.393 1.00 1.00 H new ATOM 0 H4' DC C 13 25.609 9.590 5.992 1.00 1.00 H new ATOM 0 H3' DC C 13 22.991 9.986 6.929 1.00 1.00 H new ATOM 0 H2' DC C 13 22.108 10.781 4.807 1.00 1.00 H new ATOM 0 H2'' DC C 13 22.653 12.284 5.524 1.00 1.00 H new ATOM 0 HO5' DC C 13 22.565 7.096 4.836 1.00 1.00 H new ATOM 0 H1' DC C 13 24.690 12.285 4.362 1.00 1.00 H new ATOM 0 H41 DC C 13 22.070 11.638 -1.609 1.00 1.00 H new ATOM 0 H42 DC C 13 23.323 12.882 -1.674 1.00 1.00 H new ATOM 0 H5 DC C 13 21.546 10.434 0.419 1.00 1.00 H new ATOM 0 H6 DC C 13 22.164 10.135 2.771 1.00 1.00 H new ATOM 1172 P DG C 14 23.695 12.282 8.312 1.00 1.00 P ATOM 1173 OP1 DG C 14 24.519 12.227 9.554 1.00 1.00 O ATOM 1174 OP2 DG C 14 22.258 11.899 8.409 1.00 1.00 O ATOM 1175 O5' DG C 14 23.766 13.788 7.700 1.00 1.00 O ATOM 1176 C5' DG C 14 24.985 14.536 7.701 1.00 1.00 C ATOM 1177 C4' DG C 14 24.839 16.019 7.302 1.00 1.00 C ATOM 1178 O4' DG C 14 24.701 16.163 5.888 1.00 1.00 O ATOM 1179 C3' DG C 14 23.650 16.722 7.984 1.00 1.00 C ATOM 1180 O3' DG C 14 24.043 18.030 8.406 1.00 1.00 O ATOM 1181 C2' DG C 14 22.613 16.695 6.861 1.00 1.00 C ATOM 1182 C1' DG C 14 23.462 16.797 5.598 1.00 1.00 C ATOM 1183 N9 DG C 14 22.851 16.139 4.428 1.00 1.00 N ATOM 1184 C8 DG C 14 22.228 14.924 4.388 1.00 1.00 C ATOM 1185 N7 DG C 14 21.845 14.543 3.199 1.00 1.00 N ATOM 1186 C5 DG C 14 22.216 15.625 2.387 1.00 1.00 C ATOM 1187 C6 DG C 14 22.054 15.858 0.973 1.00 1.00 C ATOM 1188 O6 DG C 14 21.589 15.115 0.111 1.00 1.00 O ATOM 1189 N1 DG C 14 22.491 17.098 0.564 1.00 1.00 N ATOM 1190 C2 DG C 14 23.069 18.000 1.389 1.00 1.00 C ATOM 1191 N2 DG C 14 23.446 19.126 0.846 1.00 1.00 N ATOM 1192 N3 DG C 14 23.279 17.822 2.691 1.00 1.00 N ATOM 1193 C4 DG C 14 22.814 16.617 3.138 1.00 1.00 C ATOM 0 H5' DG C 14 25.687 14.059 7.018 1.00 1.00 H new ATOM 0 H5'' DG C 14 25.425 14.485 8.697 1.00 1.00 H new ATOM 0 H4' DG C 14 25.756 16.498 7.644 1.00 1.00 H new ATOM 0 H3' DG C 14 23.269 16.265 8.897 1.00 1.00 H new ATOM 0 H2' DG C 14 22.025 15.777 6.878 1.00 1.00 H new ATOM 0 H2'' DG C 14 21.911 17.525 6.942 1.00 1.00 H new ATOM 0 H1' DG C 14 23.571 17.849 5.336 1.00 1.00 H new ATOM 0 H8 DG C 14 22.065 14.325 5.271 1.00 1.00 H new ATOM 0 H1 DG C 14 22.372 17.351 -0.417 1.00 1.00 H new ATOM 0 H21 DG C 14 23.888 19.845 1.418 1.00 1.00 H new ATOM 0 H22 DG C 14 23.298 19.286 -0.150 1.00 1.00 H new ATOM 1205 P DC C 15 23.044 19.045 9.195 1.00 1.00 P ATOM 1206 OP1 DC C 15 23.887 20.039 9.920 1.00 1.00 O ATOM 1207 OP2 DC C 15 22.062 18.247 9.981 1.00 1.00 O ATOM 1208 O5' DC C 15 22.253 19.809 8.004 1.00 1.00 O ATOM 1209 C5' DC C 15 22.946 20.660 7.096 1.00 1.00 C ATOM 1210 C4' DC C 15 22.159 20.960 5.812 1.00 1.00 C ATOM 1211 O4' DC C 15 21.934 19.784 5.051 1.00 1.00 O ATOM 1212 C3' DC C 15 20.796 21.635 6.031 1.00 1.00 C ATOM 1213 O3' DC C 15 20.935 23.051 5.887 1.00 1.00 O ATOM 1214 C2' DC C 15 19.914 20.975 4.962 1.00 1.00 C ATOM 1215 C1' DC C 15 20.850 20.054 4.186 1.00 1.00 C ATOM 1216 N1 DC C 15 20.180 18.800 3.774 1.00 1.00 N ATOM 1217 C2 DC C 15 19.870 18.588 2.424 1.00 1.00 C ATOM 1218 O2 DC C 15 20.080 19.439 1.558 1.00 1.00 O ATOM 1219 N3 DC C 15 19.328 17.415 2.016 1.00 1.00 N ATOM 1220 C4 DC C 15 19.073 16.500 2.926 1.00 1.00 C ATOM 1221 N4 DC C 15 18.570 15.390 2.465 1.00 1.00 N ATOM 1222 C5 DC C 15 19.319 16.674 4.319 1.00 1.00 C ATOM 1223 C6 DC C 15 19.875 17.850 4.705 1.00 1.00 C ATOM 0 H5' DC C 15 23.896 20.197 6.830 1.00 1.00 H new ATOM 0 H5'' DC C 15 23.179 21.599 7.597 1.00 1.00 H new ATOM 0 H4' DC C 15 22.800 21.663 5.280 1.00 1.00 H new ATOM 0 H3' DC C 15 20.363 21.507 7.023 1.00 1.00 H new ATOM 0 H2' DC C 15 19.097 20.414 5.416 1.00 1.00 H new ATOM 0 H2'' DC C 15 19.463 21.721 4.307 1.00 1.00 H new ATOM 0 H1' DC C 15 21.178 20.530 3.262 1.00 1.00 H new ATOM 0 H41 DC C 15 18.343 14.628 3.105 1.00 1.00 H new ATOM 0 H42 DC C 15 18.403 15.283 1.465 1.00 1.00 H new ATOM 0 H5 DC C 15 19.074 15.904 5.036 1.00 1.00 H new ATOM 0 H6 DC C 15 20.076 18.034 5.750 1.00 1.00 H new ATOM 1235 P DA C 16 19.692 24.090 6.034 1.00 1.00 P ATOM 1236 OP1 DA C 16 20.264 25.448 6.258 1.00 1.00 O ATOM 1237 OP2 DA C 16 18.731 23.554 7.039 1.00 1.00 O ATOM 1238 O5' DA C 16 18.975 24.069 4.575 1.00 1.00 O ATOM 1239 C5' DA C 16 19.703 24.408 3.393 1.00 1.00 C ATOM 1240 C4' DA C 16 18.893 24.265 2.089 1.00 1.00 C ATOM 1241 O4' DA C 16 18.703 22.900 1.713 1.00 1.00 O ATOM 1242 C3' DA C 16 17.513 24.944 2.176 1.00 1.00 C ATOM 1243 O3' DA C 16 17.299 25.781 1.039 1.00 1.00 O ATOM 1244 C2' DA C 16 16.599 23.724 2.261 1.00 1.00 C ATOM 1245 C1' DA C 16 17.333 22.708 1.397 1.00 1.00 C ATOM 1246 N9 DA C 16 16.953 21.326 1.728 1.00 1.00 N ATOM 1247 C8 DA C 16 16.980 20.764 2.971 1.00 1.00 C ATOM 1248 N7 DA C 16 16.732 19.482 2.999 1.00 1.00 N ATOM 1249 C5 DA C 16 16.449 19.207 1.651 1.00 1.00 C ATOM 1250 C6 DA C 16 16.063 18.050 0.931 1.00 1.00 C ATOM 1251 N6 DA C 16 15.952 16.852 1.463 1.00 1.00 N ATOM 1252 N1 DA C 16 15.740 18.103 -0.363 1.00 1.00 N ATOM 1253 C2 DA C 16 15.821 19.280 -0.970 1.00 1.00 C ATOM 1254 N3 DA C 16 16.224 20.438 -0.453 1.00 1.00 N ATOM 1255 C4 DA C 16 16.527 20.333 0.875 1.00 1.00 C ATOM 0 H5' DA C 16 20.587 23.773 3.330 1.00 1.00 H new ATOM 0 H5'' DA C 16 20.054 25.436 3.478 1.00 1.00 H new ATOM 0 H4' DA C 16 19.492 24.767 1.329 1.00 1.00 H new ATOM 0 H3' DA C 16 17.359 25.628 3.010 1.00 1.00 H new ATOM 0 H2' DA C 16 16.481 23.375 3.287 1.00 1.00 H new ATOM 0 H2'' DA C 16 15.600 23.937 1.879 1.00 1.00 H new ATOM 0 H1' DA C 16 17.099 22.850 0.342 1.00 1.00 H new ATOM 0 H8 DA C 16 17.190 21.335 3.863 1.00 1.00 H new ATOM 0 H61 DA C 16 15.669 16.061 0.884 1.00 1.00 H new ATOM 0 H62 DA C 16 16.149 16.714 2.454 1.00 1.00 H new ATOM 0 H2 DA C 16 15.524 19.301 -2.008 1.00 1.00 H new ATOM 1267 P DT C 17 16.009 26.761 0.905 1.00 1.00 P ATOM 1268 OP1 DT C 17 16.348 27.827 -0.079 1.00 1.00 O ATOM 1269 OP2 DT C 17 15.568 27.179 2.268 1.00 1.00 O ATOM 1270 O5' DT C 17 14.861 25.811 0.264 1.00 1.00 O ATOM 1271 C5' DT C 17 14.984 25.317 -1.066 1.00 1.00 C ATOM 1272 C4' DT C 17 13.918 24.272 -1.434 1.00 1.00 C ATOM 1273 O4' DT C 17 14.141 23.051 -0.741 1.00 1.00 O ATOM 1274 C3' DT C 17 12.472 24.728 -1.161 1.00 1.00 C ATOM 1275 O3' DT C 17 11.747 24.763 -2.389 1.00 1.00 O ATOM 1276 C2' DT C 17 11.982 23.674 -0.160 1.00 1.00 C ATOM 1277 C1' DT C 17 12.876 22.477 -0.489 1.00 1.00 C ATOM 1278 N1 DT C 17 12.978 21.462 0.594 1.00 1.00 N ATOM 1279 C2 DT C 17 12.801 20.112 0.256 1.00 1.00 C ATOM 1280 O2 DT C 17 12.533 19.697 -0.874 1.00 1.00 O ATOM 1281 N3 DT C 17 12.952 19.203 1.274 1.00 1.00 N ATOM 1282 C4 DT C 17 13.247 19.486 2.583 1.00 1.00 C ATOM 1283 O4 DT C 17 13.390 18.546 3.365 1.00 1.00 O ATOM 1284 C5 DT C 17 13.383 20.911 2.879 1.00 1.00 C ATOM 1285 C7 DT C 17 13.667 21.375 4.294 1.00 1.00 C ATOM 1286 C6 DT C 17 13.262 21.836 1.893 1.00 1.00 C ATOM 0 H5' DT C 17 15.973 24.875 -1.191 1.00 1.00 H new ATOM 0 H5'' DT C 17 14.918 26.153 -1.763 1.00 1.00 H new ATOM 0 H4' DT C 17 14.023 24.133 -2.510 1.00 1.00 H new ATOM 0 H3' DT C 17 12.356 25.734 -0.757 1.00 1.00 H new ATOM 0 H2' DT C 17 12.106 24.003 0.872 1.00 1.00 H new ATOM 0 H2'' DT C 17 10.926 23.443 -0.296 1.00 1.00 H new ATOM 0 H1' DT C 17 12.459 21.921 -1.328 1.00 1.00 H new ATOM 0 H3 DT C 17 12.833 18.219 1.033 1.00 1.00 H new ATOM 0 H71 DT C 17 14.238 22.303 4.265 1.00 1.00 H new ATOM 0 H72 DT C 17 12.726 21.544 4.817 1.00 1.00 H new ATOM 0 H73 DT C 17 14.241 20.612 4.819 1.00 1.00 H new ATOM 0 H6 DT C 17 13.390 22.882 2.128 1.00 1.00 H new ATOM 1299 P DA C 18 10.218 25.301 -2.485 1.00 1.00 P ATOM 1300 OP1 DA C 18 9.948 25.670 -3.905 1.00 1.00 O ATOM 1301 OP2 DA C 18 9.988 26.331 -1.433 1.00 1.00 O ATOM 1302 O5' DA C 18 9.348 23.984 -2.123 1.00 1.00 O ATOM 1303 C5' DA C 18 9.425 22.823 -2.939 1.00 1.00 C ATOM 1304 C4' DA C 18 8.562 21.655 -2.442 1.00 1.00 C ATOM 1305 O4' DA C 18 9.204 20.913 -1.414 1.00 1.00 O ATOM 1306 C3' DA C 18 7.169 22.053 -1.934 1.00 1.00 C ATOM 1307 O3' DA C 18 6.250 21.458 -2.845 1.00 1.00 O ATOM 1308 C2' DA C 18 7.176 21.532 -0.495 1.00 1.00 C ATOM 1309 C1' DA C 18 8.211 20.413 -0.540 1.00 1.00 C ATOM 1310 N9 DA C 18 8.862 20.057 0.740 1.00 1.00 N ATOM 1311 C8 DA C 18 9.239 20.875 1.771 1.00 1.00 C ATOM 1312 N7 DA C 18 9.784 20.249 2.787 1.00 1.00 N ATOM 1313 C5 DA C 18 9.750 18.904 2.382 1.00 1.00 C ATOM 1314 C6 DA C 18 10.107 17.658 2.964 1.00 1.00 C ATOM 1315 N6 DA C 18 10.593 17.465 4.176 1.00 1.00 N ATOM 1316 N1 DA C 18 9.968 16.519 2.295 1.00 1.00 N ATOM 1317 C2 DA C 18 9.501 16.576 1.062 1.00 1.00 C ATOM 1318 N3 DA C 18 9.091 17.645 0.393 1.00 1.00 N ATOM 1319 C4 DA C 18 9.233 18.789 1.119 1.00 1.00 C ATOM 0 H5' DA C 18 10.464 22.497 -2.993 1.00 1.00 H new ATOM 0 H5'' DA C 18 9.119 23.082 -3.953 1.00 1.00 H new ATOM 0 H4' DA C 18 8.431 21.045 -3.336 1.00 1.00 H new ATOM 0 H3' DA C 18 6.893 23.107 -1.903 1.00 1.00 H new ATOM 0 H2' DA C 18 7.454 22.311 0.215 1.00 1.00 H new ATOM 0 H2'' DA C 18 6.195 21.163 -0.195 1.00 1.00 H new ATOM 0 H1' DA C 18 7.708 19.494 -0.840 1.00 1.00 H new ATOM 0 H8 DA C 18 9.099 21.946 1.750 1.00 1.00 H new ATOM 0 H61 DA C 18 10.815 16.521 4.492 1.00 1.00 H new ATOM 0 H62 DA C 18 10.746 18.260 4.797 1.00 1.00 H new ATOM 0 H2 DA C 18 9.446 15.636 0.533 1.00 1.00 H new ATOM 1331 P DT C 19 4.669 21.544 -2.689 1.00 1.00 P ATOM 1332 OP1 DT C 19 4.082 21.228 -4.009 1.00 1.00 O ATOM 1333 OP2 DT C 19 4.269 22.778 -1.982 1.00 1.00 O ATOM 1334 O5' DT C 19 4.429 20.282 -1.799 1.00 1.00 O ATOM 1335 C5' DT C 19 4.709 18.976 -2.280 1.00 1.00 C ATOM 1336 C4' DT C 19 4.155 17.963 -1.281 1.00 1.00 C ATOM 1337 O4' DT C 19 5.132 17.806 -0.268 1.00 1.00 O ATOM 1338 C3' DT C 19 2.857 18.453 -0.602 1.00 1.00 C ATOM 1339 O3' DT C 19 1.901 17.437 -0.461 1.00 1.00 O ATOM 1340 C2' DT C 19 3.341 18.869 0.768 1.00 1.00 C ATOM 1341 C1' DT C 19 4.450 17.833 0.961 1.00 1.00 C ATOM 1342 N1 DT C 19 5.413 18.094 2.052 1.00 1.00 N ATOM 1343 C2 DT C 19 5.852 16.997 2.800 1.00 1.00 C ATOM 1344 O2 DT C 19 5.536 15.831 2.567 1.00 1.00 O ATOM 1345 N3 DT C 19 6.656 17.276 3.874 1.00 1.00 N ATOM 1346 C4 DT C 19 6.981 18.527 4.338 1.00 1.00 C ATOM 1347 O4 DT C 19 7.659 18.602 5.362 1.00 1.00 O ATOM 1348 C5 DT C 19 6.465 19.634 3.530 1.00 1.00 C ATOM 1349 C7 DT C 19 6.709 21.075 3.939 1.00 1.00 C ATOM 1350 C6 DT C 19 5.753 19.379 2.402 1.00 1.00 C ATOM 0 H5' DT C 19 5.784 18.839 -2.402 1.00 1.00 H new ATOM 0 H5'' DT C 19 4.256 18.828 -3.260 1.00 1.00 H new ATOM 0 H4' DT C 19 3.929 17.039 -1.813 1.00 1.00 H new ATOM 0 H3' DT C 19 2.368 19.236 -1.182 1.00 1.00 H new ATOM 0 H2' DT C 19 3.714 19.893 0.789 1.00 1.00 H new ATOM 0 H2'' DT C 19 2.563 18.798 1.528 1.00 1.00 H new ATOM 0 H1' DT C 19 3.986 16.892 1.257 1.00 1.00 H new ATOM 0 H3 DT C 19 7.050 16.480 4.376 1.00 1.00 H new ATOM 0 H71 DT C 19 6.752 21.703 3.049 1.00 1.00 H new ATOM 0 H72 DT C 19 5.897 21.413 4.583 1.00 1.00 H new ATOM 0 H73 DT C 19 7.653 21.145 4.479 1.00 1.00 H new ATOM 0 H6 DT C 19 5.449 20.200 1.769 1.00 1.00 H new ATOM 1363 P DA C 20 0.887 17.104 -1.660 1.00 1.00 P ATOM 1364 OP1 DA C 20 1.674 17.044 -2.918 1.00 1.00 O ATOM 1365 OP2 DA C 20 -0.250 18.060 -1.585 1.00 1.00 O ATOM 1366 O5' DA C 20 0.445 15.639 -1.187 1.00 1.00 O ATOM 1367 C5' DA C 20 -0.294 15.499 0.012 1.00 1.00 C ATOM 1368 C4' DA C 20 -0.005 14.167 0.702 1.00 1.00 C ATOM 1369 O4' DA C 20 1.266 14.236 1.354 1.00 1.00 O ATOM 1370 C3' DA C 20 -1.078 13.988 1.776 1.00 1.00 C ATOM 1371 O3' DA C 20 -1.530 12.647 1.838 1.00 1.00 O ATOM 1372 C2' DA C 20 -0.347 14.506 3.009 1.00 1.00 C ATOM 1373 C1' DA C 20 1.116 14.171 2.759 1.00 1.00 C ATOM 1374 N9 DA C 20 1.979 15.178 3.427 1.00 1.00 N ATOM 1375 C8 DA C 20 2.109 16.504 3.090 1.00 1.00 C ATOM 1376 N7 DA C 20 2.823 17.218 3.915 1.00 1.00 N ATOM 1377 C5 DA C 20 3.213 16.274 4.871 1.00 1.00 C ATOM 1378 C6 DA C 20 4.007 16.333 6.041 1.00 1.00 C ATOM 1379 N6 DA C 20 4.589 17.434 6.470 1.00 1.00 N ATOM 1380 N1 DA C 20 4.228 15.255 6.794 1.00 1.00 N ATOM 1381 C2 DA C 20 3.667 14.120 6.393 1.00 1.00 C ATOM 1382 N3 DA C 20 2.890 13.902 5.337 1.00 1.00 N ATOM 1383 C4 DA C 20 2.707 15.030 4.593 1.00 1.00 C ATOM 0 H5' DA C 20 -1.359 15.572 -0.207 1.00 1.00 H new ATOM 0 H5'' DA C 20 -0.050 16.319 0.687 1.00 1.00 H new ATOM 0 H4' DA C 20 -0.003 13.349 -0.018 1.00 1.00 H new ATOM 0 H3' DA C 20 -2.015 14.520 1.613 1.00 1.00 H new ATOM 0 H2' DA C 20 -0.492 15.579 3.134 1.00 1.00 H new ATOM 0 H2'' DA C 20 -0.713 14.027 3.917 1.00 1.00 H new ATOM 0 H1' DA C 20 1.400 13.194 3.151 1.00 1.00 H new ATOM 0 H8 DA C 20 1.653 16.924 2.206 1.00 1.00 H new ATOM 0 H61 DA C 20 5.150 17.416 7.321 1.00 1.00 H new ATOM 0 H62 DA C 20 4.478 18.305 5.951 1.00 1.00 H new ATOM 0 H2 DA C 20 3.870 13.256 7.009 1.00 1.00 H new ATOM 1395 P DT C 21 -2.880 12.260 2.634 1.00 1.00 P ATOM 1396 OP1 DT C 21 -3.395 10.970 2.107 1.00 1.00 O ATOM 1397 OP2 DT C 21 -3.787 13.442 2.594 1.00 1.00 O ATOM 1398 O5' DT C 21 -2.342 12.043 4.136 1.00 1.00 O ATOM 1399 C5' DT C 21 -1.426 10.993 4.410 1.00 1.00 C ATOM 1400 C4' DT C 21 -1.180 10.778 5.908 1.00 1.00 C ATOM 1401 O4' DT C 21 -0.278 11.753 6.405 1.00 1.00 O ATOM 1402 C3' DT C 21 -2.453 10.851 6.744 1.00 1.00 C ATOM 1403 O3' DT C 21 -2.373 9.825 7.720 1.00 1.00 O ATOM 1404 C2' DT C 21 -2.404 12.258 7.326 1.00 1.00 C ATOM 1405 C1' DT C 21 -0.897 12.474 7.454 1.00 1.00 C ATOM 1406 N1 DT C 21 -0.403 13.878 7.376 1.00 1.00 N ATOM 1407 C2 DT C 21 0.683 14.209 8.200 1.00 1.00 C ATOM 1408 O2 DT C 21 1.240 13.403 8.951 1.00 1.00 O ATOM 1409 N3 DT C 21 1.161 15.496 8.129 1.00 1.00 N ATOM 1410 C4 DT C 21 0.703 16.463 7.267 1.00 1.00 C ATOM 1411 O4 DT C 21 1.274 17.551 7.247 1.00 1.00 O ATOM 1412 C5 DT C 21 -0.416 16.060 6.418 1.00 1.00 C ATOM 1413 C7 DT C 21 -1.015 17.062 5.446 1.00 1.00 C ATOM 1414 C6 DT C 21 -0.922 14.800 6.483 1.00 1.00 C ATOM 0 H5' DT C 21 -0.477 11.211 3.921 1.00 1.00 H new ATOM 0 H5'' DT C 21 -1.804 10.068 3.974 1.00 1.00 H new ATOM 0 H4' DT C 21 -0.768 9.773 5.998 1.00 1.00 H new ATOM 0 H3' DT C 21 -3.392 10.696 6.213 1.00 1.00 H new ATOM 0 H2' DT C 21 -2.870 12.992 6.669 1.00 1.00 H new ATOM 0 H2'' DT C 21 -2.912 12.323 8.288 1.00 1.00 H new ATOM 0 H1' DT C 21 -0.647 12.140 8.461 1.00 1.00 H new ATOM 0 H3 DT C 21 1.915 15.753 8.766 1.00 1.00 H new ATOM 0 H71 DT C 21 -1.413 16.535 4.579 1.00 1.00 H new ATOM 0 H72 DT C 21 -1.819 17.610 5.938 1.00 1.00 H new ATOM 0 H73 DT C 21 -0.244 17.761 5.123 1.00 1.00 H new ATOM 0 H6 DT C 21 -1.736 14.516 5.832 1.00 1.00 H new ATOM 1427 P DG C 22 -3.593 9.432 8.668 1.00 1.00 P ATOM 1428 OP1 DG C 22 -3.403 8.001 9.011 1.00 1.00 O ATOM 1429 OP2 DG C 22 -4.880 9.843 8.054 1.00 1.00 O ATOM 1430 O5' DG C 22 -3.299 10.321 9.959 1.00 1.00 O ATOM 1431 C5' DG C 22 -2.202 10.017 10.806 1.00 1.00 C ATOM 1432 C4' DG C 22 -1.932 11.100 11.853 1.00 1.00 C ATOM 1433 O4' DG C 22 -1.320 12.234 11.250 1.00 1.00 O ATOM 1434 C3' DG C 22 -3.191 11.567 12.612 1.00 1.00 C ATOM 1435 O3' DG C 22 -2.977 11.389 14.010 1.00 1.00 O ATOM 1436 C2' DG C 22 -3.291 13.023 12.158 1.00 1.00 C ATOM 1437 C1' DG C 22 -1.826 13.364 11.928 1.00 1.00 C ATOM 1438 N9 DG C 22 -1.624 14.596 11.149 1.00 1.00 N ATOM 1439 C8 DG C 22 -2.234 14.964 9.985 1.00 1.00 C ATOM 1440 N7 DG C 22 -1.851 16.126 9.519 1.00 1.00 N ATOM 1441 C5 DG C 22 -0.933 16.576 10.483 1.00 1.00 C ATOM 1442 C6 DG C 22 -0.163 17.792 10.589 1.00 1.00 C ATOM 1443 O6 DG C 22 -0.076 18.733 9.800 1.00 1.00 O ATOM 1444 N1 DG C 22 0.564 17.884 11.755 1.00 1.00 N ATOM 1445 C2 DG C 22 0.593 16.916 12.697 1.00 1.00 C ATOM 1446 N2 DG C 22 1.311 17.154 13.759 1.00 1.00 N ATOM 1447 N3 DG C 22 -0.056 15.758 12.632 1.00 1.00 N ATOM 1448 C4 DG C 22 -0.812 15.649 11.498 1.00 1.00 C ATOM 0 H5' DG C 22 -1.309 9.878 10.197 1.00 1.00 H new ATOM 0 H5'' DG C 22 -2.393 9.071 11.312 1.00 1.00 H new ATOM 0 H4' DG C 22 -1.267 10.636 12.581 1.00 1.00 H new ATOM 0 H3' DG C 22 -4.117 11.027 12.415 1.00 1.00 H new ATOM 0 H2' DG C 22 -3.886 13.131 11.251 1.00 1.00 H new ATOM 0 H2'' DG C 22 -3.747 13.660 12.916 1.00 1.00 H new ATOM 0 H1' DG C 22 -1.314 13.569 12.868 1.00 1.00 H new ATOM 0 H8 DG C 22 -2.971 14.349 9.490 1.00 1.00 H new ATOM 0 H1 DG C 22 1.111 18.730 11.916 1.00 1.00 H new ATOM 0 H21 DG C 22 1.369 16.458 14.502 1.00 1.00 H new ATOM 0 H22 DG C 22 1.815 18.036 13.847 1.00 1.00 H new ATOM 1460 P DC C 23 -4.096 11.713 15.144 1.00 1.00 P ATOM 1461 OP1 DC C 23 -4.116 10.574 16.107 1.00 1.00 O ATOM 1462 OP2 DC C 23 -5.379 12.111 14.496 1.00 1.00 O ATOM 1463 O5' DC C 23 -3.470 13.014 15.881 1.00 1.00 O ATOM 1464 C5' DC C 23 -2.224 12.929 16.576 1.00 1.00 C ATOM 1465 C4' DC C 23 -1.797 14.228 17.285 1.00 1.00 C ATOM 1466 O4' DC C 23 -1.397 15.213 16.334 1.00 1.00 O ATOM 1467 C3' DC C 23 -2.906 14.811 18.180 1.00 1.00 C ATOM 1468 O3' DC C 23 -2.371 15.202 19.447 1.00 1.00 O ATOM 1469 C2' DC C 23 -3.419 15.970 17.321 1.00 1.00 C ATOM 1470 C1' DC C 23 -2.189 16.378 16.507 1.00 1.00 C ATOM 1471 N1 DC C 23 -2.514 16.962 15.182 1.00 1.00 N ATOM 1472 C2 DC C 23 -1.971 18.196 14.797 1.00 1.00 C ATOM 1473 O2 DC C 23 -1.252 18.867 15.541 1.00 1.00 O ATOM 1474 N3 DC C 23 -2.228 18.712 13.570 1.00 1.00 N ATOM 1475 C4 DC C 23 -3.010 18.027 12.761 1.00 1.00 C ATOM 1476 N4 DC C 23 -3.188 18.548 11.580 1.00 1.00 N ATOM 1477 C5 DC C 23 -3.597 16.773 13.091 1.00 1.00 C ATOM 1478 C6 DC C 23 -3.320 16.273 14.323 1.00 1.00 C ATOM 0 H5' DC C 23 -1.446 12.644 15.867 1.00 1.00 H new ATOM 0 H5'' DC C 23 -2.289 12.131 17.316 1.00 1.00 H new ATOM 0 H4' DC C 23 -0.956 13.963 17.925 1.00 1.00 H new ATOM 0 H3' DC C 23 -3.707 14.123 18.450 1.00 1.00 H new ATOM 0 H2' DC C 23 -4.242 15.660 16.677 1.00 1.00 H new ATOM 0 H2'' DC C 23 -3.786 16.793 17.934 1.00 1.00 H new ATOM 0 H1' DC C 23 -1.664 17.162 17.053 1.00 1.00 H new ATOM 0 H41 DC C 23 -3.781 18.075 10.898 1.00 1.00 H new ATOM 0 H42 DC C 23 -2.734 19.429 11.338 1.00 1.00 H new ATOM 0 H5 DC C 23 -4.232 16.245 12.395 1.00 1.00 H new ATOM 0 H6 DC C 23 -3.740 15.325 14.625 1.00 1.00 H new ATOM 1490 P DG C 24 -3.325 15.559 20.713 1.00 1.00 P ATOM 1491 OP1 DG C 24 -2.492 15.492 21.947 1.00 1.00 O ATOM 1492 OP2 DG C 24 -4.556 14.722 20.650 1.00 1.00 O ATOM 1493 O5' DG C 24 -3.747 17.102 20.465 1.00 1.00 O ATOM 1494 C5' DG C 24 -2.797 18.152 20.616 1.00 1.00 C ATOM 1495 C4' DG C 24 -3.242 19.475 19.967 1.00 1.00 C ATOM 1496 O4' DG C 24 -3.155 19.417 18.553 1.00 1.00 O ATOM 1497 C3' DG C 24 -4.680 19.922 20.282 1.00 1.00 C ATOM 1498 O3' DG C 24 -4.775 20.760 21.434 1.00 1.00 O ATOM 1499 C2' DG C 24 -5.090 20.693 19.028 1.00 1.00 C ATOM 1500 C1' DG C 24 -3.913 20.505 18.065 1.00 1.00 C ATOM 1501 N9 DG C 24 -4.348 20.274 16.676 1.00 1.00 N ATOM 1502 C8 DG C 24 -5.136 19.262 16.204 1.00 1.00 C ATOM 1503 N7 DG C 24 -5.444 19.365 14.935 1.00 1.00 N ATOM 1504 C5 DG C 24 -4.810 20.557 14.539 1.00 1.00 C ATOM 1505 C6 DG C 24 -4.766 21.262 13.280 1.00 1.00 C ATOM 1506 O6 DG C 24 -5.289 20.979 12.200 1.00 1.00 O ATOM 1507 N1 DG C 24 -4.049 22.439 13.332 1.00 1.00 N ATOM 1508 C2 DG C 24 -3.428 22.895 14.444 1.00 1.00 C ATOM 1509 N2 DG C 24 -2.786 24.027 14.346 1.00 1.00 N ATOM 1510 N3 DG C 24 -3.427 22.284 15.623 1.00 1.00 N ATOM 1511 C4 DG C 24 -4.137 21.115 15.607 1.00 1.00 C ATOM 0 H5' DG C 24 -1.849 17.841 20.177 1.00 1.00 H new ATOM 0 H5'' DG C 24 -2.616 18.319 21.678 1.00 1.00 H new ATOM 0 H4' DG C 24 -2.552 20.196 20.405 1.00 1.00 H new ATOM 0 H3' DG C 24 -5.318 19.070 20.515 1.00 1.00 H new ATOM 0 H2' DG C 24 -6.016 20.302 18.606 1.00 1.00 H new ATOM 0 H2'' DG C 24 -5.260 21.747 19.247 1.00 1.00 H new ATOM 0 HO3' DG C 24 -5.711 21.011 21.580 1.00 1.00 H new ATOM 0 H1' DG C 24 -3.316 21.416 18.029 1.00 1.00 H new ATOM 0 H8 DG C 24 -5.476 18.446 16.825 1.00 1.00 H new ATOM 0 H1 DG C 24 -3.983 22.999 12.482 1.00 1.00 H new ATOM 0 H21 DG C 24 -2.302 24.411 15.158 1.00 1.00 H new ATOM 0 H22 DG C 24 -2.768 24.528 13.458 1.00 1.00 H new TER 1524 DG C 24