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=-1.5) USER MOD Set 1.2: A 121 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 87 ASN : amide:sc= 2.06 K(o=2.4,f=-8.2!) USER MOD Set 2.2: A 90 THR OG1 : rot 167:sc= 0.352 USER MOD Single : A 81 LYS NZ :NH3+ 167:sc= 1.22 (180deg=0.787) USER MOD Single : A 83 LYS NZ :NH3+ -157:sc= 1.06 (180deg=-0.0709) 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= 0.186 USER MOD Single : A 97 LYS NZ :NH3+ 167:sc= 1.23 (180deg=1.04) USER MOD Single : A 100 ASN : amide:sc= 0.116 K(o=0.12,f=-1.3) USER MOD Single : A 101 HIS : no HE2:sc= 0.776 K(o=0.78,f=-2.4!) USER MOD Single : A 102 LYS NZ :NH3+ -160:sc= 1.27 (180deg=1.25) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -153:sc= 1.03 (180deg=0.528) USER MOD Single : A 108 LYS NZ :NH3+ -151:sc= 2.42 (180deg=0.168) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 125 HIS : no HD1:sc= -0.233 K(o=-0.23,f=-1) 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= -0.226 (180deg=-0.226) 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= -0.165 (180deg=-0.165) USER MOD Single : C 21 DT C7 :methyl -30:sc= -1.24 (180deg=-1.25) USER MOD Single : C 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 79 -0.904 6.432 9.645 1.00 1.00 N ATOM 2 CA ALA A 79 0.204 5.822 8.857 1.00 1.00 C ATOM 3 C ALA A 79 0.513 6.644 7.608 1.00 1.00 C ATOM 4 O ALA A 79 -0.345 7.361 7.111 1.00 1.00 O ATOM 5 CB ALA A 79 -0.174 4.380 8.481 1.00 1.00 C ATOM 0 HA ALA A 79 1.106 5.811 9.469 1.00 1.00 H new ATOM 0 HB1 ALA A 79 0.634 3.931 7.904 1.00 1.00 H new ATOM 0 HB2 ALA A 79 -0.339 3.799 9.388 1.00 1.00 H new ATOM 0 HB3 ALA A 79 -1.086 4.387 7.883 1.00 1.00 H new ATOM 11 N ARG A 80 1.729 6.523 7.061 1.00 1.00 N ATOM 12 CA ARG A 80 2.206 7.153 5.802 1.00 1.00 C ATOM 13 C ARG A 80 1.508 6.590 4.539 1.00 1.00 C ATOM 14 O ARG A 80 2.145 6.029 3.651 1.00 1.00 O ATOM 15 CB ARG A 80 3.750 7.075 5.741 1.00 1.00 C ATOM 16 CG ARG A 80 4.398 7.926 6.849 1.00 1.00 C ATOM 17 CD ARG A 80 4.459 9.418 6.504 1.00 1.00 C ATOM 18 NE ARG A 80 4.532 10.253 7.721 1.00 1.00 N ATOM 19 CZ ARG A 80 3.533 10.895 8.301 1.00 1.00 C ATOM 20 NH1 ARG A 80 2.318 10.869 7.849 1.00 1.00 N ATOM 21 NH2 ARG A 80 3.706 11.644 9.341 1.00 1.00 N ATOM 0 H ARG A 80 2.453 5.955 7.501 1.00 1.00 H new ATOM 0 HA ARG A 80 1.922 8.205 5.812 1.00 1.00 H new ATOM 0 HB2 ARG A 80 4.068 6.037 5.844 1.00 1.00 H new ATOM 0 HB3 ARG A 80 4.095 7.419 4.766 1.00 1.00 H new ATOM 0 HG2 ARG A 80 3.836 7.796 7.774 1.00 1.00 H new ATOM 0 HG3 ARG A 80 5.408 7.561 7.035 1.00 1.00 H new ATOM 0 HD2 ARG A 80 5.328 9.612 5.876 1.00 1.00 H new ATOM 0 HD3 ARG A 80 3.579 9.695 5.924 1.00 1.00 H new ATOM 0 HE ARG A 80 5.449 10.343 8.159 1.00 1.00 H new ATOM 0 HH11 ARG A 80 2.098 10.335 7.008 1.00 1.00 H new ATOM 0 HH12 ARG A 80 1.582 11.382 8.334 1.00 1.00 H new ATOM 0 HH21 ARG A 80 4.638 11.755 9.741 1.00 1.00 H new ATOM 0 HH22 ARG A 80 2.910 12.124 9.762 1.00 1.00 H new ATOM 35 N LYS A 81 0.176 6.706 4.491 1.00 1.00 N ATOM 36 CA LYS A 81 -0.741 6.297 3.428 1.00 1.00 C ATOM 37 C LYS A 81 -0.352 6.929 2.094 1.00 1.00 C ATOM 38 O LYS A 81 -0.120 8.132 1.974 1.00 1.00 O ATOM 39 CB LYS A 81 -2.173 6.723 3.814 1.00 1.00 C ATOM 40 CG LYS A 81 -2.786 5.874 4.940 1.00 1.00 C ATOM 41 CD LYS A 81 -3.807 6.675 5.765 1.00 1.00 C ATOM 42 CE LYS A 81 -4.565 5.746 6.725 1.00 1.00 C ATOM 43 NZ LYS A 81 -5.317 6.515 7.755 1.00 1.00 N ATOM 0 H LYS A 81 -0.331 7.128 5.269 1.00 1.00 H new ATOM 0 HA LYS A 81 -0.690 5.214 3.313 1.00 1.00 H new ATOM 0 HB2 LYS A 81 -2.161 7.768 4.124 1.00 1.00 H new ATOM 0 HB3 LYS A 81 -2.812 6.659 2.933 1.00 1.00 H new ATOM 0 HG2 LYS A 81 -3.272 4.997 4.511 1.00 1.00 H new ATOM 0 HG3 LYS A 81 -1.994 5.511 5.595 1.00 1.00 H new ATOM 0 HD2 LYS A 81 -3.296 7.454 6.330 1.00 1.00 H new ATOM 0 HD3 LYS A 81 -4.511 7.174 5.099 1.00 1.00 H new ATOM 0 HE2 LYS A 81 -5.257 5.123 6.158 1.00 1.00 H new ATOM 0 HE3 LYS A 81 -3.860 5.075 7.215 1.00 1.00 H new ATOM 0 HZ1 LYS A 81 -5.984 5.883 8.242 1.00 1.00 H new ATOM 0 HZ2 LYS A 81 -4.650 6.914 8.446 1.00 1.00 H new ATOM 0 HZ3 LYS A 81 -5.843 7.286 7.297 1.00 1.00 H new ATOM 57 N VAL A 82 -0.300 6.066 1.094 1.00 1.00 N ATOM 58 CA VAL A 82 -0.081 6.411 -0.312 1.00 1.00 C ATOM 59 C VAL A 82 -1.322 7.053 -0.929 1.00 1.00 C ATOM 60 O VAL A 82 -2.435 6.541 -0.794 1.00 1.00 O ATOM 61 CB VAL A 82 0.250 5.140 -1.127 1.00 1.00 C ATOM 62 CG1 VAL A 82 0.371 5.413 -2.637 1.00 1.00 C ATOM 63 CG2 VAL A 82 1.538 4.489 -0.622 1.00 1.00 C ATOM 0 H VAL A 82 -0.413 5.063 1.239 1.00 1.00 H new ATOM 0 HA VAL A 82 0.748 7.118 -0.344 1.00 1.00 H new ATOM 0 HB VAL A 82 -0.589 4.459 -0.981 1.00 1.00 H new ATOM 0 HG11 VAL A 82 0.604 4.484 -3.157 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -0.572 5.812 -3.011 1.00 1.00 H new ATOM 0 HG13 VAL A 82 1.166 6.137 -2.813 1.00 1.00 H new ATOM 0 HG21 VAL A 82 1.750 3.597 -1.211 1.00 1.00 H new ATOM 0 HG22 VAL A 82 2.364 5.193 -0.720 1.00 1.00 H new ATOM 0 HG23 VAL A 82 1.419 4.212 0.426 1.00 1.00 H new ATOM 73 N LYS A 83 -1.123 8.143 -1.665 1.00 1.00 N ATOM 74 CA LYS A 83 -2.123 8.739 -2.538 1.00 1.00 C ATOM 75 C LYS A 83 -1.674 8.459 -3.969 1.00 1.00 C ATOM 76 O LYS A 83 -0.544 8.768 -4.354 1.00 1.00 O ATOM 77 CB LYS A 83 -2.301 10.249 -2.327 1.00 1.00 C ATOM 78 CG LYS A 83 -3.482 10.559 -1.399 1.00 1.00 C ATOM 79 CD LYS A 83 -3.641 12.078 -1.226 1.00 1.00 C ATOM 80 CE LYS A 83 -5.034 12.465 -0.705 1.00 1.00 C ATOM 81 NZ LYS A 83 -5.224 12.118 0.731 1.00 1.00 N ATOM 0 H LYS A 83 -0.237 8.648 -1.669 1.00 1.00 H new ATOM 0 HA LYS A 83 -3.095 8.300 -2.313 1.00 1.00 H new ATOM 0 HB2 LYS A 83 -1.387 10.667 -1.905 1.00 1.00 H new ATOM 0 HB3 LYS A 83 -2.458 10.735 -3.290 1.00 1.00 H new ATOM 0 HG2 LYS A 83 -4.398 10.135 -1.811 1.00 1.00 H new ATOM 0 HG3 LYS A 83 -3.323 10.090 -0.428 1.00 1.00 H new ATOM 0 HD2 LYS A 83 -2.883 12.444 -0.534 1.00 1.00 H new ATOM 0 HD3 LYS A 83 -3.464 12.570 -2.182 1.00 1.00 H new ATOM 0 HE2 LYS A 83 -5.184 13.536 -0.839 1.00 1.00 H new ATOM 0 HE3 LYS A 83 -5.794 11.960 -1.301 1.00 1.00 H new ATOM 0 HZ1 LYS A 83 -6.240 12.026 0.934 1.00 1.00 H new ATOM 0 HZ2 LYS A 83 -4.747 11.217 0.937 1.00 1.00 H new ATOM 0 HZ3 LYS A 83 -4.818 12.868 1.326 1.00 1.00 H new ATOM 95 N GLN A 84 -2.538 7.807 -4.737 1.00 1.00 N ATOM 96 CA GLN A 84 -2.357 7.697 -6.167 1.00 1.00 C ATOM 97 C GLN A 84 -2.950 8.987 -6.726 1.00 1.00 C ATOM 98 O GLN A 84 -3.967 9.481 -6.235 1.00 1.00 O ATOM 99 CB GLN A 84 -3.025 6.422 -6.723 1.00 1.00 C ATOM 100 CG GLN A 84 -3.733 6.585 -8.073 1.00 1.00 C ATOM 101 CD GLN A 84 -4.341 5.270 -8.557 1.00 1.00 C ATOM 102 OE1 GLN A 84 -5.543 5.056 -8.485 1.00 1.00 O ATOM 103 NE2 GLN A 84 -3.547 4.336 -9.041 1.00 1.00 N ATOM 0 H GLN A 84 -3.376 7.345 -4.383 1.00 1.00 H new ATOM 0 HA GLN A 84 -1.312 7.592 -6.457 1.00 1.00 H new ATOM 0 HB2 GLN A 84 -2.264 5.648 -6.822 1.00 1.00 H new ATOM 0 HB3 GLN A 84 -3.751 6.064 -5.992 1.00 1.00 H new ATOM 0 HG2 GLN A 84 -4.517 7.337 -7.984 1.00 1.00 H new ATOM 0 HG3 GLN A 84 -3.023 6.952 -8.814 1.00 1.00 H new ATOM 0 HE21 GLN A 84 -2.543 4.503 -9.106 1.00 1.00 H new ATOM 0 HE22 GLN A 84 -3.937 3.446 -9.351 1.00 1.00 H new ATOM 112 N TYR A 85 -2.351 9.481 -7.791 1.00 1.00 N ATOM 113 CA TYR A 85 -2.851 10.617 -8.554 1.00 1.00 C ATOM 114 C TYR A 85 -2.907 10.215 -10.027 1.00 1.00 C ATOM 115 O TYR A 85 -2.012 9.515 -10.499 1.00 1.00 O ATOM 116 CB TYR A 85 -1.937 11.832 -8.323 1.00 1.00 C ATOM 117 CG TYR A 85 -1.730 12.259 -6.883 1.00 1.00 C ATOM 118 CD1 TYR A 85 -2.640 13.150 -6.288 1.00 1.00 C ATOM 119 CD2 TYR A 85 -0.606 11.817 -6.160 1.00 1.00 C ATOM 120 CE1 TYR A 85 -2.429 13.619 -4.976 1.00 1.00 C ATOM 121 CE2 TYR A 85 -0.381 12.280 -4.848 1.00 1.00 C ATOM 122 CZ TYR A 85 -1.291 13.188 -4.256 1.00 1.00 C ATOM 123 OH TYR A 85 -1.092 13.657 -2.996 1.00 1.00 O ATOM 0 H TYR A 85 -1.482 9.097 -8.162 1.00 1.00 H new ATOM 0 HA TYR A 85 -3.853 10.898 -8.231 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -0.962 11.613 -8.757 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -2.348 12.678 -8.874 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -3.508 13.478 -6.841 1.00 1.00 H new ATOM 0 HD2 TYR A 85 0.086 11.121 -6.612 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -3.132 14.303 -4.524 1.00 1.00 H new ATOM 0 HE2 TYR A 85 0.484 11.943 -4.296 1.00 1.00 H new ATOM 0 HH TYR A 85 -0.270 13.270 -2.629 1.00 1.00 H new ATOM 133 N LYS A 86 -3.926 10.655 -10.765 1.00 1.00 N ATOM 134 CA LYS A 86 -4.101 10.392 -12.204 1.00 1.00 C ATOM 135 C LYS A 86 -4.448 11.694 -12.921 1.00 1.00 C ATOM 136 O LYS A 86 -5.218 12.487 -12.395 1.00 1.00 O ATOM 137 CB LYS A 86 -5.190 9.317 -12.376 1.00 1.00 C ATOM 138 CG LYS A 86 -5.554 9.063 -13.849 1.00 1.00 C ATOM 139 CD LYS A 86 -6.392 7.783 -13.984 1.00 1.00 C ATOM 140 CE LYS A 86 -6.681 7.488 -15.464 1.00 1.00 C ATOM 141 NZ LYS A 86 -7.542 6.282 -15.628 1.00 1.00 N ATOM 0 H LYS A 86 -4.678 11.221 -10.372 1.00 1.00 H new ATOM 0 HA LYS A 86 -3.180 10.016 -12.650 1.00 1.00 H new ATOM 0 HB2 LYS A 86 -4.848 8.385 -11.926 1.00 1.00 H new ATOM 0 HB3 LYS A 86 -6.085 9.623 -11.834 1.00 1.00 H new ATOM 0 HG2 LYS A 86 -6.111 9.913 -14.244 1.00 1.00 H new ATOM 0 HG3 LYS A 86 -4.645 8.974 -14.444 1.00 1.00 H new ATOM 0 HD2 LYS A 86 -5.861 6.943 -13.536 1.00 1.00 H new ATOM 0 HD3 LYS A 86 -7.329 7.895 -13.439 1.00 1.00 H new ATOM 0 HE2 LYS A 86 -7.171 8.349 -15.918 1.00 1.00 H new ATOM 0 HE3 LYS A 86 -5.741 7.339 -15.996 1.00 1.00 H new ATOM 0 HZ1 LYS A 86 -7.716 6.114 -16.640 1.00 1.00 H new ATOM 0 HZ2 LYS A 86 -7.063 5.455 -15.217 1.00 1.00 H new ATOM 0 HZ3 LYS A 86 -8.449 6.434 -15.142 1.00 1.00 H new ATOM 155 N ASN A 87 -3.889 11.915 -14.109 1.00 1.00 N ATOM 156 CA ASN A 87 -4.027 13.180 -14.840 1.00 1.00 C ATOM 157 C ASN A 87 -4.973 13.059 -16.059 1.00 1.00 C ATOM 158 O ASN A 87 -4.591 12.448 -17.062 1.00 1.00 O ATOM 159 CB ASN A 87 -2.619 13.635 -15.229 1.00 1.00 C ATOM 160 CG ASN A 87 -2.583 15.010 -15.863 1.00 1.00 C ATOM 161 OD1 ASN A 87 -3.534 15.491 -16.461 1.00 1.00 O ATOM 162 ND2 ASN A 87 -1.492 15.715 -15.713 1.00 1.00 N ATOM 0 H ASN A 87 -3.324 11.220 -14.597 1.00 1.00 H new ATOM 0 HA ASN A 87 -4.498 13.931 -14.205 1.00 1.00 H new ATOM 0 HB2 ASN A 87 -1.988 13.636 -14.340 1.00 1.00 H new ATOM 0 HB3 ASN A 87 -2.191 12.912 -15.923 1.00 1.00 H new ATOM 0 HD21 ASN A 87 -1.439 16.660 -16.094 1.00 1.00 H new ATOM 0 HD22 ASN A 87 -0.694 15.320 -15.215 1.00 1.00 H new ATOM 169 N PRO A 88 -6.178 13.670 -16.019 1.00 1.00 N ATOM 170 CA PRO A 88 -7.130 13.694 -17.136 1.00 1.00 C ATOM 171 C PRO A 88 -6.578 14.200 -18.481 1.00 1.00 C ATOM 172 O PRO A 88 -7.095 13.820 -19.535 1.00 1.00 O ATOM 173 CB PRO A 88 -8.283 14.594 -16.669 1.00 1.00 C ATOM 174 CG PRO A 88 -8.240 14.501 -15.148 1.00 1.00 C ATOM 175 CD PRO A 88 -6.750 14.362 -14.869 1.00 1.00 C ATOM 0 HA PRO A 88 -7.423 12.667 -17.355 1.00 1.00 H new ATOM 0 HB2 PRO A 88 -8.149 15.621 -17.009 1.00 1.00 H new ATOM 0 HB3 PRO A 88 -9.240 14.251 -17.062 1.00 1.00 H new ATOM 0 HG2 PRO A 88 -8.660 15.388 -14.675 1.00 1.00 H new ATOM 0 HG3 PRO A 88 -8.804 13.645 -14.778 1.00 1.00 H new ATOM 0 HD2 PRO A 88 -6.287 15.340 -14.735 1.00 1.00 H new ATOM 0 HD3 PRO A 88 -6.578 13.799 -13.952 1.00 1.00 H new ATOM 183 N HIS A 89 -5.542 15.055 -18.464 1.00 1.00 N ATOM 184 CA HIS A 89 -4.984 15.715 -19.658 1.00 1.00 C ATOM 185 C HIS A 89 -3.875 14.910 -20.357 1.00 1.00 C ATOM 186 O HIS A 89 -3.589 15.167 -21.528 1.00 1.00 O ATOM 187 CB HIS A 89 -4.462 17.109 -19.254 1.00 1.00 C ATOM 188 CG HIS A 89 -5.493 17.954 -18.546 1.00 1.00 C ATOM 189 ND1 HIS A 89 -6.523 18.654 -19.149 1.00 1.00 N ATOM 190 CD2 HIS A 89 -5.580 18.160 -17.194 1.00 1.00 C ATOM 191 CE1 HIS A 89 -7.226 19.279 -18.180 1.00 1.00 C ATOM 192 NE2 HIS A 89 -6.666 18.993 -16.985 1.00 1.00 N ATOM 0 H HIS A 89 -5.059 15.312 -17.603 1.00 1.00 H new ATOM 0 HA HIS A 89 -5.789 15.795 -20.388 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -3.594 16.990 -18.606 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -4.123 17.635 -20.147 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -4.927 17.751 -16.437 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -8.093 19.904 -18.335 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -6.989 19.334 -16.080 1.00 1.00 H new ATOM 201 N THR A 90 -3.259 13.941 -19.667 1.00 1.00 N ATOM 202 CA THR A 90 -2.075 13.195 -20.159 1.00 1.00 C ATOM 203 C THR A 90 -2.202 11.669 -20.068 1.00 1.00 C ATOM 204 O THR A 90 -1.485 10.957 -20.776 1.00 1.00 O ATOM 205 CB THR A 90 -0.812 13.610 -19.392 1.00 1.00 C ATOM 206 OG1 THR A 90 -0.924 13.201 -18.052 1.00 1.00 O ATOM 207 CG2 THR A 90 -0.597 15.118 -19.360 1.00 1.00 C ATOM 0 H THR A 90 -3.566 13.644 -18.741 1.00 1.00 H new ATOM 0 HA THR A 90 -2.006 13.458 -21.215 1.00 1.00 H new ATOM 0 HB THR A 90 0.023 13.140 -19.912 1.00 1.00 H new ATOM 0 HG1 THR A 90 -0.052 13.278 -17.612 1.00 1.00 H new ATOM 0 HG21 THR A 90 0.312 15.344 -18.803 1.00 1.00 H new ATOM 0 HG22 THR A 90 -0.501 15.494 -20.379 1.00 1.00 H new ATOM 0 HG23 THR A 90 -1.448 15.597 -18.875 1.00 1.00 H new ATOM 215 N GLY A 91 -3.111 11.146 -19.231 1.00 1.00 N ATOM 216 CA GLY A 91 -3.231 9.708 -18.955 1.00 1.00 C ATOM 217 C GLY A 91 -2.085 9.132 -18.102 1.00 1.00 C ATOM 218 O GLY A 91 -1.954 7.910 -17.986 1.00 1.00 O ATOM 0 H GLY A 91 -3.788 11.715 -18.723 1.00 1.00 H new ATOM 0 HA2 GLY A 91 -4.177 9.525 -18.445 1.00 1.00 H new ATOM 0 HA3 GLY A 91 -3.270 9.170 -19.902 1.00 1.00 H new ATOM 222 N GLU A 92 -1.246 9.986 -17.508 1.00 1.00 N ATOM 223 CA GLU A 92 -0.235 9.628 -16.530 1.00 1.00 C ATOM 224 C GLU A 92 -0.907 9.346 -15.184 1.00 1.00 C ATOM 225 O GLU A 92 -1.905 9.964 -14.803 1.00 1.00 O ATOM 226 CB GLU A 92 0.739 10.800 -16.327 1.00 1.00 C ATOM 227 CG GLU A 92 1.635 11.140 -17.519 1.00 1.00 C ATOM 228 CD GLU A 92 2.457 12.420 -17.247 1.00 1.00 C ATOM 229 OE1 GLU A 92 1.873 13.460 -16.854 1.00 1.00 O ATOM 230 OE2 GLU A 92 3.700 12.390 -17.439 1.00 1.00 O ATOM 0 H GLU A 92 -1.260 10.986 -17.710 1.00 1.00 H new ATOM 0 HA GLU A 92 0.300 8.749 -16.890 1.00 1.00 H new ATOM 0 HB2 GLU A 92 0.161 11.687 -16.068 1.00 1.00 H new ATOM 0 HB3 GLU A 92 1.376 10.574 -15.472 1.00 1.00 H new ATOM 0 HG2 GLU A 92 2.309 10.307 -17.721 1.00 1.00 H new ATOM 0 HG3 GLU A 92 1.023 11.279 -18.410 1.00 1.00 H new ATOM 237 N VAL A 93 -0.284 8.454 -14.429 1.00 1.00 N ATOM 238 CA VAL A 93 -0.602 8.104 -13.046 1.00 1.00 C ATOM 239 C VAL A 93 0.693 8.096 -12.221 1.00 1.00 C ATOM 240 O VAL A 93 1.795 7.877 -12.735 1.00 1.00 O ATOM 241 CB VAL A 93 -1.290 6.727 -12.990 1.00 1.00 C ATOM 242 CG1 VAL A 93 -1.843 6.351 -11.599 1.00 1.00 C ATOM 243 CG2 VAL A 93 -2.453 6.641 -13.986 1.00 1.00 C ATOM 0 H VAL A 93 0.508 7.919 -14.785 1.00 1.00 H new ATOM 0 HA VAL A 93 -1.288 8.841 -12.630 1.00 1.00 H new ATOM 0 HB VAL A 93 -0.497 6.024 -13.245 1.00 1.00 H new ATOM 0 HG11 VAL A 93 -2.311 5.368 -11.647 1.00 1.00 H new ATOM 0 HG12 VAL A 93 -1.027 6.330 -10.877 1.00 1.00 H new ATOM 0 HG13 VAL A 93 -2.582 7.090 -11.289 1.00 1.00 H new ATOM 0 HG21 VAL A 93 -2.916 5.656 -13.920 1.00 1.00 H new ATOM 0 HG22 VAL A 93 -3.192 7.406 -13.749 1.00 1.00 H new ATOM 0 HG23 VAL A 93 -2.078 6.799 -14.997 1.00 1.00 H new ATOM 253 N ILE A 94 0.539 8.315 -10.924 1.00 1.00 N ATOM 254 CA ILE A 94 1.581 8.319 -9.894 1.00 1.00 C ATOM 255 C ILE A 94 1.019 7.729 -8.602 1.00 1.00 C ATOM 256 O ILE A 94 -0.190 7.633 -8.415 1.00 1.00 O ATOM 257 CB ILE A 94 2.122 9.739 -9.566 1.00 1.00 C ATOM 258 CG1 ILE A 94 1.527 10.893 -10.393 1.00 1.00 C ATOM 259 CG2 ILE A 94 3.658 9.745 -9.647 1.00 1.00 C ATOM 260 CD1 ILE A 94 1.919 12.260 -9.833 1.00 1.00 C ATOM 0 H ILE A 94 -0.381 8.509 -10.530 1.00 1.00 H new ATOM 0 HA ILE A 94 2.405 7.728 -10.293 1.00 1.00 H new ATOM 0 HB ILE A 94 1.787 9.942 -8.549 1.00 1.00 H new ATOM 0 HG12 ILE A 94 1.868 10.813 -11.425 1.00 1.00 H new ATOM 0 HG13 ILE A 94 0.441 10.805 -10.408 1.00 1.00 H new ATOM 0 HG21 ILE A 94 4.031 10.743 -9.416 1.00 1.00 H new ATOM 0 HG22 ILE A 94 4.063 9.031 -8.929 1.00 1.00 H new ATOM 0 HG23 ILE A 94 3.970 9.465 -10.653 1.00 1.00 H new ATOM 0 HD11 ILE A 94 1.478 13.045 -10.447 1.00 1.00 H new ATOM 0 HD12 ILE A 94 1.555 12.352 -8.810 1.00 1.00 H new ATOM 0 HD13 ILE A 94 3.004 12.359 -9.842 1.00 1.00 H new ATOM 272 N GLU A 95 1.922 7.440 -7.673 1.00 1.00 N ATOM 273 CA GLU A 95 1.677 6.987 -6.304 1.00 1.00 C ATOM 274 C GLU A 95 2.779 7.543 -5.392 1.00 1.00 C ATOM 275 O GLU A 95 3.964 7.279 -5.612 1.00 1.00 O ATOM 276 CB GLU A 95 1.737 5.457 -6.254 1.00 1.00 C ATOM 277 CG GLU A 95 0.434 4.799 -6.706 1.00 1.00 C ATOM 278 CD GLU A 95 0.582 3.268 -6.822 1.00 1.00 C ATOM 279 OE1 GLU A 95 0.917 2.596 -5.817 1.00 1.00 O ATOM 280 OE2 GLU A 95 0.350 2.721 -7.927 1.00 1.00 O ATOM 0 H GLU A 95 2.920 7.521 -7.869 1.00 1.00 H new ATOM 0 HA GLU A 95 0.697 7.333 -5.976 1.00 1.00 H new ATOM 0 HB2 GLU A 95 2.553 5.109 -6.887 1.00 1.00 H new ATOM 0 HB3 GLU A 95 1.965 5.140 -5.236 1.00 1.00 H new ATOM 0 HG2 GLU A 95 -0.359 5.036 -5.997 1.00 1.00 H new ATOM 0 HG3 GLU A 95 0.133 5.210 -7.670 1.00 1.00 H new ATOM 287 N THR A 96 2.401 8.328 -4.385 1.00 1.00 N ATOM 288 CA THR A 96 3.344 8.970 -3.446 1.00 1.00 C ATOM 289 C THR A 96 2.715 9.033 -2.048 1.00 1.00 C ATOM 290 O THR A 96 1.491 9.048 -1.919 1.00 1.00 O ATOM 291 CB THR A 96 3.803 10.377 -3.918 1.00 1.00 C ATOM 292 OG1 THR A 96 3.139 11.407 -3.211 1.00 1.00 O ATOM 293 CG2 THR A 96 3.564 10.690 -5.405 1.00 1.00 C ATOM 0 H THR A 96 1.424 8.544 -4.189 1.00 1.00 H new ATOM 0 HA THR A 96 4.245 8.357 -3.412 1.00 1.00 H new ATOM 0 HB THR A 96 4.876 10.347 -3.728 1.00 1.00 H new ATOM 0 HG1 THR A 96 3.452 12.278 -3.532 1.00 1.00 H new ATOM 0 HG21 THR A 96 3.921 11.696 -5.627 1.00 1.00 H new ATOM 0 HG22 THR A 96 4.104 9.970 -6.020 1.00 1.00 H new ATOM 0 HG23 THR A 96 2.498 10.627 -5.623 1.00 1.00 H new ATOM 301 N LYS A 97 3.521 9.062 -0.984 1.00 1.00 N ATOM 302 CA LYS A 97 3.044 9.225 0.407 1.00 1.00 C ATOM 303 C LYS A 97 3.112 10.701 0.862 1.00 1.00 C ATOM 304 O LYS A 97 2.961 10.995 2.050 1.00 1.00 O ATOM 305 CB LYS A 97 3.871 8.322 1.337 1.00 1.00 C ATOM 306 CG LYS A 97 3.926 6.844 0.904 1.00 1.00 C ATOM 307 CD LYS A 97 5.002 6.058 1.674 1.00 1.00 C ATOM 308 CE LYS A 97 5.346 4.712 1.015 1.00 1.00 C ATOM 309 NZ LYS A 97 6.096 4.880 -0.265 1.00 1.00 N ATOM 0 H LYS A 97 4.535 8.973 -1.056 1.00 1.00 H new ATOM 0 HA LYS A 97 1.997 8.927 0.455 1.00 1.00 H new ATOM 0 HB2 LYS A 97 4.888 8.710 1.391 1.00 1.00 H new ATOM 0 HB3 LYS A 97 3.455 8.378 2.343 1.00 1.00 H new ATOM 0 HG2 LYS A 97 2.953 6.382 1.068 1.00 1.00 H new ATOM 0 HG3 LYS A 97 4.130 6.787 -0.165 1.00 1.00 H new ATOM 0 HD2 LYS A 97 5.906 6.663 1.745 1.00 1.00 H new ATOM 0 HD3 LYS A 97 4.656 5.880 2.692 1.00 1.00 H new ATOM 0 HE2 LYS A 97 5.941 4.114 1.706 1.00 1.00 H new ATOM 0 HE3 LYS A 97 4.427 4.158 0.824 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 6.494 3.965 -0.557 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 5.450 5.228 -1.003 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 6.867 5.565 -0.129 1.00 1.00 H new ATOM 323 N GLY A 98 3.393 11.608 -0.079 1.00 1.00 N ATOM 324 CA GLY A 98 3.680 13.024 0.118 1.00 1.00 C ATOM 325 C GLY A 98 4.982 13.476 -0.555 1.00 1.00 C ATOM 326 O GLY A 98 5.573 12.765 -1.373 1.00 1.00 O ATOM 0 H GLY A 98 3.427 11.350 -1.065 1.00 1.00 H new ATOM 0 HA2 GLY A 98 2.852 13.614 -0.275 1.00 1.00 H new ATOM 0 HA3 GLY A 98 3.740 13.231 1.187 1.00 1.00 H new ATOM 330 N GLY A 99 5.419 14.674 -0.172 1.00 1.00 N ATOM 331 CA GLY A 99 6.723 15.239 -0.496 1.00 1.00 C ATOM 332 C GLY A 99 6.924 15.773 -1.922 1.00 1.00 C ATOM 333 O GLY A 99 6.131 15.561 -2.844 1.00 1.00 O ATOM 0 H GLY A 99 4.849 15.301 0.396 1.00 1.00 H new ATOM 0 HA2 GLY A 99 6.920 16.054 0.200 1.00 1.00 H new ATOM 0 HA3 GLY A 99 7.477 14.474 -0.313 1.00 1.00 H new ATOM 337 N ASN A 100 8.047 16.476 -2.084 1.00 1.00 N ATOM 338 CA ASN A 100 8.640 16.935 -3.336 1.00 1.00 C ATOM 339 C ASN A 100 8.904 15.709 -4.247 1.00 1.00 C ATOM 340 O ASN A 100 9.848 14.949 -4.034 1.00 1.00 O ATOM 341 CB ASN A 100 9.904 17.738 -2.938 1.00 1.00 C ATOM 342 CG ASN A 100 10.981 17.927 -3.999 1.00 1.00 C ATOM 343 OD1 ASN A 100 10.789 17.743 -5.194 1.00 1.00 O ATOM 344 ND2 ASN A 100 12.156 18.318 -3.554 1.00 1.00 N ATOM 0 H ASN A 100 8.606 16.759 -1.279 1.00 1.00 H new ATOM 0 HA ASN A 100 7.995 17.589 -3.923 1.00 1.00 H new ATOM 0 HB2 ASN A 100 9.584 18.725 -2.604 1.00 1.00 H new ATOM 0 HB3 ASN A 100 10.360 17.244 -2.080 1.00 1.00 H new ATOM 0 HD21 ASN A 100 12.923 18.472 -4.208 1.00 1.00 H new ATOM 0 HD22 ASN A 100 12.299 18.467 -2.555 1.00 1.00 H new ATOM 351 N HIS A 101 8.017 15.496 -5.234 1.00 1.00 N ATOM 352 CA HIS A 101 8.096 14.420 -6.237 1.00 1.00 C ATOM 353 C HIS A 101 7.901 15.010 -7.644 1.00 1.00 C ATOM 354 O HIS A 101 6.929 15.728 -7.869 1.00 1.00 O ATOM 355 CB HIS A 101 7.084 13.318 -5.866 1.00 1.00 C ATOM 356 CG HIS A 101 7.283 12.034 -6.638 1.00 1.00 C ATOM 357 ND1 HIS A 101 8.254 11.074 -6.400 1.00 1.00 N ATOM 358 CD2 HIS A 101 6.539 11.614 -7.706 1.00 1.00 C ATOM 359 CE1 HIS A 101 8.104 10.093 -7.311 1.00 1.00 C ATOM 360 NE2 HIS A 101 7.069 10.400 -8.119 1.00 1.00 N ATOM 0 H HIS A 101 7.197 16.089 -5.360 1.00 1.00 H new ATOM 0 HA HIS A 101 9.080 13.951 -6.245 1.00 1.00 H new ATOM 0 HB2 HIS A 101 7.162 13.108 -4.799 1.00 1.00 H new ATOM 0 HB3 HIS A 101 6.074 13.688 -6.045 1.00 1.00 H new ATOM 0 HD1 HIS A 101 8.959 11.105 -5.664 1.00 1.00 H new ATOM 0 HD2 HIS A 101 5.698 12.130 -8.145 1.00 1.00 H new ATOM 0 HE1 HIS A 101 8.714 9.205 -7.383 1.00 1.00 H new ATOM 369 N LYS A 102 8.787 14.690 -8.600 1.00 1.00 N ATOM 370 CA LYS A 102 8.876 15.348 -9.930 1.00 1.00 C ATOM 371 C LYS A 102 7.554 15.499 -10.695 1.00 1.00 C ATOM 372 O LYS A 102 7.077 16.616 -10.850 1.00 1.00 O ATOM 373 CB LYS A 102 9.987 14.687 -10.755 1.00 1.00 C ATOM 374 CG LYS A 102 10.383 15.632 -11.902 1.00 1.00 C ATOM 375 CD LYS A 102 11.603 15.132 -12.670 1.00 1.00 C ATOM 376 CE LYS A 102 12.881 15.155 -11.815 1.00 1.00 C ATOM 377 NZ LYS A 102 14.076 14.729 -12.591 1.00 1.00 N ATOM 0 H LYS A 102 9.480 13.952 -8.476 1.00 1.00 H new ATOM 0 HA LYS A 102 9.140 16.388 -9.740 1.00 1.00 H new ATOM 0 HB2 LYS A 102 10.851 14.477 -10.124 1.00 1.00 H new ATOM 0 HB3 LYS A 102 9.644 13.733 -11.154 1.00 1.00 H new ATOM 0 HG2 LYS A 102 9.543 15.738 -12.588 1.00 1.00 H new ATOM 0 HG3 LYS A 102 10.592 16.623 -11.498 1.00 1.00 H new ATOM 0 HD2 LYS A 102 11.419 14.115 -13.017 1.00 1.00 H new ATOM 0 HD3 LYS A 102 11.750 15.750 -13.556 1.00 1.00 H new ATOM 0 HE2 LYS A 102 13.040 16.161 -11.427 1.00 1.00 H new ATOM 0 HE3 LYS A 102 12.754 14.498 -10.955 1.00 1.00 H new ATOM 0 HZ1 LYS A 102 14.828 14.432 -11.936 1.00 1.00 H new ATOM 0 HZ2 LYS A 102 13.822 13.933 -13.210 1.00 1.00 H new ATOM 0 HZ3 LYS A 102 14.415 15.523 -13.170 1.00 1.00 H new ATOM 391 N THR A 103 6.913 14.404 -11.114 1.00 1.00 N ATOM 392 CA THR A 103 5.684 14.477 -11.943 1.00 1.00 C ATOM 393 C THR A 103 4.540 15.178 -11.208 1.00 1.00 C ATOM 394 O THR A 103 3.849 16.016 -11.784 1.00 1.00 O ATOM 395 CB THR A 103 5.235 13.081 -12.410 1.00 1.00 C ATOM 396 OG1 THR A 103 6.309 12.448 -13.075 1.00 1.00 O ATOM 397 CG2 THR A 103 4.059 13.185 -13.379 1.00 1.00 C ATOM 0 H THR A 103 7.216 13.454 -10.899 1.00 1.00 H new ATOM 0 HA THR A 103 5.936 15.072 -12.821 1.00 1.00 H new ATOM 0 HB THR A 103 4.928 12.506 -11.536 1.00 1.00 H new ATOM 0 HG1 THR A 103 6.030 11.557 -13.373 1.00 1.00 H new ATOM 0 HG21 THR A 103 3.759 12.186 -13.696 1.00 1.00 H new ATOM 0 HG22 THR A 103 3.221 13.675 -12.883 1.00 1.00 H new ATOM 0 HG23 THR A 103 4.356 13.768 -14.251 1.00 1.00 H new ATOM 405 N LEU A 104 4.404 14.916 -9.904 1.00 1.00 N ATOM 406 CA LEU A 104 3.406 15.559 -9.043 1.00 1.00 C ATOM 407 C LEU A 104 3.584 17.088 -9.008 1.00 1.00 C ATOM 408 O LEU A 104 2.598 17.822 -9.081 1.00 1.00 O ATOM 409 CB LEU A 104 3.504 14.910 -7.644 1.00 1.00 C ATOM 410 CG LEU A 104 2.470 15.372 -6.604 1.00 1.00 C ATOM 411 CD1 LEU A 104 1.034 15.131 -7.071 1.00 1.00 C ATOM 412 CD2 LEU A 104 2.672 14.602 -5.299 1.00 1.00 C ATOM 0 H LEU A 104 4.991 14.243 -9.411 1.00 1.00 H new ATOM 0 HA LEU A 104 2.403 15.402 -9.441 1.00 1.00 H new ATOM 0 HB2 LEU A 104 3.413 13.830 -7.761 1.00 1.00 H new ATOM 0 HB3 LEU A 104 4.500 15.104 -7.246 1.00 1.00 H new ATOM 0 HG LEU A 104 2.620 16.442 -6.461 1.00 1.00 H new ATOM 0 HD11 LEU A 104 0.340 15.473 -6.304 1.00 1.00 H new ATOM 0 HD12 LEU A 104 0.854 15.682 -7.994 1.00 1.00 H new ATOM 0 HD13 LEU A 104 0.883 14.066 -7.248 1.00 1.00 H new ATOM 0 HD21 LEU A 104 1.938 14.932 -4.564 1.00 1.00 H new ATOM 0 HD22 LEU A 104 2.547 13.535 -5.483 1.00 1.00 H new ATOM 0 HD23 LEU A 104 3.676 14.789 -4.918 1.00 1.00 H new ATOM 424 N LYS A 105 4.832 17.579 -8.975 1.00 1.00 N ATOM 425 CA LYS A 105 5.146 19.016 -9.046 1.00 1.00 C ATOM 426 C LYS A 105 4.806 19.623 -10.410 1.00 1.00 C ATOM 427 O LYS A 105 4.312 20.748 -10.460 1.00 1.00 O ATOM 428 CB LYS A 105 6.622 19.243 -8.665 1.00 1.00 C ATOM 429 CG LYS A 105 7.093 20.707 -8.743 1.00 1.00 C ATOM 430 CD LYS A 105 6.350 21.698 -7.831 1.00 1.00 C ATOM 431 CE LYS A 105 6.707 21.502 -6.350 1.00 1.00 C ATOM 432 NZ LYS A 105 5.966 22.456 -5.476 1.00 1.00 N ATOM 0 H LYS A 105 5.659 16.986 -8.898 1.00 1.00 H new ATOM 0 HA LYS A 105 4.515 19.538 -8.327 1.00 1.00 H new ATOM 0 HB2 LYS A 105 6.780 18.879 -7.650 1.00 1.00 H new ATOM 0 HB3 LYS A 105 7.249 18.639 -9.321 1.00 1.00 H new ATOM 0 HG2 LYS A 105 8.154 20.741 -8.497 1.00 1.00 H new ATOM 0 HG3 LYS A 105 6.994 21.047 -9.774 1.00 1.00 H new ATOM 0 HD2 LYS A 105 6.594 22.717 -8.130 1.00 1.00 H new ATOM 0 HD3 LYS A 105 5.275 21.575 -7.963 1.00 1.00 H new ATOM 0 HE2 LYS A 105 6.476 20.479 -6.052 1.00 1.00 H new ATOM 0 HE3 LYS A 105 7.780 21.639 -6.212 1.00 1.00 H new ATOM 0 HZ1 LYS A 105 6.515 22.632 -4.610 1.00 1.00 H new ATOM 0 HZ2 LYS A 105 5.823 23.353 -5.983 1.00 1.00 H new ATOM 0 HZ3 LYS A 105 5.042 22.050 -5.224 1.00 1.00 H new ATOM 446 N GLU A 106 4.985 18.889 -11.508 1.00 1.00 N ATOM 447 CA GLU A 106 4.677 19.412 -12.849 1.00 1.00 C ATOM 448 C GLU A 106 3.187 19.622 -13.000 1.00 1.00 C ATOM 449 O GLU A 106 2.730 20.644 -13.496 1.00 1.00 O ATOM 450 CB GLU A 106 5.073 18.476 -13.986 1.00 1.00 C ATOM 451 CG GLU A 106 6.535 18.088 -13.949 1.00 1.00 C ATOM 452 CD GLU A 106 7.445 19.185 -14.538 1.00 1.00 C ATOM 453 OE1 GLU A 106 7.779 20.163 -13.826 1.00 1.00 O ATOM 454 OE2 GLU A 106 7.832 19.075 -15.728 1.00 1.00 O ATOM 0 H GLU A 106 5.340 17.933 -11.501 1.00 1.00 H new ATOM 0 HA GLU A 106 5.251 20.336 -12.922 1.00 1.00 H new ATOM 0 HB2 GLU A 106 4.462 17.575 -13.937 1.00 1.00 H new ATOM 0 HB3 GLU A 106 4.854 18.958 -14.939 1.00 1.00 H new ATOM 0 HG2 GLU A 106 6.830 17.888 -12.919 1.00 1.00 H new ATOM 0 HG3 GLU A 106 6.678 17.162 -14.507 1.00 1.00 H new ATOM 461 N TRP A 107 2.418 18.646 -12.536 1.00 1.00 N ATOM 462 CA TRP A 107 0.957 18.749 -12.559 1.00 1.00 C ATOM 463 C TRP A 107 0.439 19.946 -11.745 1.00 1.00 C ATOM 464 O TRP A 107 -0.474 20.650 -12.187 1.00 1.00 O ATOM 465 CB TRP A 107 0.315 17.454 -12.073 1.00 1.00 C ATOM 466 CG TRP A 107 0.548 16.190 -12.842 1.00 1.00 C ATOM 467 CD1 TRP A 107 1.355 15.987 -13.913 1.00 1.00 C ATOM 468 CD2 TRP A 107 -0.064 14.899 -12.563 1.00 1.00 C ATOM 469 NE1 TRP A 107 1.288 14.661 -14.298 1.00 1.00 N ATOM 470 CE2 TRP A 107 0.514 13.932 -13.431 1.00 1.00 C ATOM 471 CE3 TRP A 107 -1.046 14.451 -11.658 1.00 1.00 C ATOM 472 CZ2 TRP A 107 0.220 12.572 -13.325 1.00 1.00 C ATOM 473 CZ3 TRP A 107 -1.428 13.098 -11.629 1.00 1.00 C ATOM 474 CH2 TRP A 107 -0.773 12.152 -12.433 1.00 1.00 C ATOM 0 H TRP A 107 2.775 17.776 -12.140 1.00 1.00 H new ATOM 0 HA TRP A 107 0.669 18.918 -13.597 1.00 1.00 H new ATOM 0 HB2 TRP A 107 0.653 17.283 -11.051 1.00 1.00 H new ATOM 0 HB3 TRP A 107 -0.762 17.618 -12.029 1.00 1.00 H new ATOM 0 HD1 TRP A 107 1.957 16.745 -14.392 1.00 1.00 H new ATOM 0 HE1 TRP A 107 1.753 14.275 -15.119 1.00 1.00 H new ATOM 0 HE3 TRP A 107 -1.510 15.153 -10.980 1.00 1.00 H new ATOM 0 HZ2 TRP A 107 0.754 11.850 -13.926 1.00 1.00 H new ATOM 0 HZ3 TRP A 107 -2.233 12.784 -10.982 1.00 1.00 H new ATOM 0 HH2 TRP A 107 -1.034 11.106 -12.364 1.00 1.00 H new ATOM 485 N LYS A 108 1.056 20.241 -10.591 1.00 1.00 N ATOM 486 CA LYS A 108 0.750 21.466 -9.823 1.00 1.00 C ATOM 487 C LYS A 108 1.138 22.745 -10.577 1.00 1.00 C ATOM 488 O LYS A 108 0.439 23.749 -10.458 1.00 1.00 O ATOM 489 CB LYS A 108 1.464 21.464 -8.467 1.00 1.00 C ATOM 490 CG LYS A 108 0.902 20.405 -7.517 1.00 1.00 C ATOM 491 CD LYS A 108 1.538 20.580 -6.136 1.00 1.00 C ATOM 492 CE LYS A 108 1.140 19.406 -5.236 1.00 1.00 C ATOM 493 NZ LYS A 108 1.641 19.608 -3.855 1.00 1.00 N ATOM 0 H LYS A 108 1.771 19.650 -10.166 1.00 1.00 H new ATOM 0 HA LYS A 108 -0.330 21.462 -9.676 1.00 1.00 H new ATOM 0 HB2 LYS A 108 2.528 21.284 -8.619 1.00 1.00 H new ATOM 0 HB3 LYS A 108 1.370 22.448 -8.008 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -0.181 20.501 -7.446 1.00 1.00 H new ATOM 0 HG3 LYS A 108 1.109 19.407 -7.902 1.00 1.00 H new ATOM 0 HD2 LYS A 108 2.623 20.630 -6.228 1.00 1.00 H new ATOM 0 HD3 LYS A 108 1.212 21.520 -5.691 1.00 1.00 H new ATOM 0 HE2 LYS A 108 0.055 19.304 -5.223 1.00 1.00 H new ATOM 0 HE3 LYS A 108 1.543 18.478 -5.642 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 1.814 18.684 -3.410 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 2.528 20.150 -3.883 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 0.933 20.132 -3.302 1.00 1.00 H new ATOM 507 N ALA A 109 2.225 22.712 -11.354 1.00 1.00 N ATOM 508 CA ALA A 109 2.655 23.834 -12.176 1.00 1.00 C ATOM 509 C ALA A 109 1.665 24.095 -13.321 1.00 1.00 C ATOM 510 O ALA A 109 1.226 25.225 -13.557 1.00 1.00 O ATOM 511 CB ALA A 109 4.042 23.521 -12.760 1.00 1.00 C ATOM 0 H ALA A 109 2.833 21.896 -11.427 1.00 1.00 H new ATOM 0 HA ALA A 109 2.697 24.728 -11.553 1.00 1.00 H new ATOM 0 HB1 ALA A 109 4.373 24.356 -13.378 1.00 1.00 H new ATOM 0 HB2 ALA A 109 4.752 23.366 -11.948 1.00 1.00 H new ATOM 0 HB3 ALA A 109 3.985 22.619 -13.369 1.00 1.00 H new ATOM 517 N LYS A 110 1.336 23.013 -14.036 1.00 1.00 N ATOM 518 CA LYS A 110 0.600 23.012 -15.285 1.00 1.00 C ATOM 519 C LYS A 110 -0.911 23.259 -15.144 1.00 1.00 C ATOM 520 O LYS A 110 -1.490 23.914 -16.011 1.00 1.00 O ATOM 521 CB LYS A 110 0.879 21.693 -16.022 1.00 1.00 C ATOM 522 CG LYS A 110 2.287 21.673 -16.649 1.00 1.00 C ATOM 523 CD LYS A 110 2.612 20.350 -17.360 1.00 1.00 C ATOM 524 CE LYS A 110 1.868 20.188 -18.697 1.00 1.00 C ATOM 525 NZ LYS A 110 2.466 21.004 -19.793 1.00 1.00 N ATOM 0 H LYS A 110 1.593 22.073 -13.736 1.00 1.00 H new ATOM 0 HA LYS A 110 0.958 23.863 -15.863 1.00 1.00 H new ATOM 0 HB2 LYS A 110 0.779 20.860 -15.326 1.00 1.00 H new ATOM 0 HB3 LYS A 110 0.132 21.548 -16.802 1.00 1.00 H new ATOM 0 HG2 LYS A 110 2.372 22.492 -17.363 1.00 1.00 H new ATOM 0 HG3 LYS A 110 3.028 21.851 -15.870 1.00 1.00 H new ATOM 0 HD2 LYS A 110 3.686 20.294 -17.539 1.00 1.00 H new ATOM 0 HD3 LYS A 110 2.354 19.518 -16.704 1.00 1.00 H new ATOM 0 HE2 LYS A 110 1.875 19.137 -18.987 1.00 1.00 H new ATOM 0 HE3 LYS A 110 0.825 20.475 -18.564 1.00 1.00 H new ATOM 0 HZ1 LYS A 110 1.926 20.857 -20.670 1.00 1.00 H new ATOM 0 HZ2 LYS A 110 2.436 22.010 -19.533 1.00 1.00 H new ATOM 0 HZ3 LYS A 110 3.454 20.714 -19.942 1.00 1.00 H new ATOM 539 N TRP A 111 -1.528 22.781 -14.056 1.00 1.00 N ATOM 540 CA TRP A 111 -2.986 22.869 -13.828 1.00 1.00 C ATOM 541 C TRP A 111 -3.362 23.367 -12.421 1.00 1.00 C ATOM 542 O TRP A 111 -4.185 24.277 -12.310 1.00 1.00 O ATOM 543 CB TRP A 111 -3.644 21.511 -14.131 1.00 1.00 C ATOM 544 CG TRP A 111 -3.427 20.999 -15.526 1.00 1.00 C ATOM 545 CD1 TRP A 111 -4.097 21.392 -16.633 1.00 1.00 C ATOM 546 CD2 TRP A 111 -2.427 20.042 -15.994 1.00 1.00 C ATOM 547 NE1 TRP A 111 -3.577 20.754 -17.745 1.00 1.00 N ATOM 548 CE2 TRP A 111 -2.526 19.923 -17.410 1.00 1.00 C ATOM 549 CE3 TRP A 111 -1.425 19.286 -15.353 1.00 1.00 C ATOM 550 CZ2 TRP A 111 -1.670 19.098 -18.156 1.00 1.00 C ATOM 551 CZ3 TRP A 111 -0.531 18.488 -16.097 1.00 1.00 C ATOM 552 CH2 TRP A 111 -0.665 18.374 -17.491 1.00 1.00 C ATOM 0 H TRP A 111 -1.028 22.316 -13.298 1.00 1.00 H new ATOM 0 HA TRP A 111 -3.370 23.623 -14.515 1.00 1.00 H new ATOM 0 HB2 TRP A 111 -3.262 20.773 -13.426 1.00 1.00 H new ATOM 0 HB3 TRP A 111 -4.716 21.596 -13.954 1.00 1.00 H new ATOM 0 HD1 TRP A 111 -4.915 22.097 -16.647 1.00 1.00 H new ATOM 0 HE1 TRP A 111 -3.927 20.882 -18.695 1.00 1.00 H new ATOM 0 HE3 TRP A 111 -1.340 19.318 -14.277 1.00 1.00 H new ATOM 0 HZ2 TRP A 111 -1.782 19.020 -19.227 1.00 1.00 H new ATOM 0 HZ3 TRP A 111 0.264 17.960 -15.591 1.00 1.00 H new ATOM 0 HH2 TRP A 111 0.001 17.733 -18.049 1.00 1.00 H new ATOM 563 N GLY A 112 -2.749 22.829 -11.357 1.00 1.00 N ATOM 564 CA GLY A 112 -2.865 23.373 -9.987 1.00 1.00 C ATOM 565 C GLY A 112 -3.012 22.318 -8.881 1.00 1.00 C ATOM 566 O GLY A 112 -3.541 21.238 -9.135 1.00 1.00 O ATOM 0 H GLY A 112 -2.156 22.001 -11.418 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -1.983 23.978 -9.776 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -3.726 24.040 -9.949 1.00 1.00 H new ATOM 570 N PRO A 113 -2.608 22.611 -7.629 1.00 1.00 N ATOM 571 CA PRO A 113 -2.723 21.669 -6.509 1.00 1.00 C ATOM 572 C PRO A 113 -4.169 21.264 -6.181 1.00 1.00 C ATOM 573 O PRO A 113 -4.411 20.108 -5.845 1.00 1.00 O ATOM 574 CB PRO A 113 -2.031 22.341 -5.320 1.00 1.00 C ATOM 575 CG PRO A 113 -2.017 23.824 -5.673 1.00 1.00 C ATOM 576 CD PRO A 113 -1.969 23.847 -7.197 1.00 1.00 C ATOM 0 HA PRO A 113 -2.248 20.724 -6.772 1.00 1.00 H new ATOM 0 HB2 PRO A 113 -2.572 22.159 -4.392 1.00 1.00 H new ATOM 0 HB3 PRO A 113 -1.021 21.957 -5.180 1.00 1.00 H new ATOM 0 HG2 PRO A 113 -2.905 24.331 -5.295 1.00 1.00 H new ATOM 0 HG3 PRO A 113 -1.153 24.328 -5.240 1.00 1.00 H new ATOM 0 HD2 PRO A 113 -2.492 24.718 -7.592 1.00 1.00 H new ATOM 0 HD3 PRO A 113 -0.941 23.903 -7.556 1.00 1.00 H new ATOM 584 N GLU A 114 -5.141 22.167 -6.349 1.00 1.00 N ATOM 585 CA GLU A 114 -6.564 21.878 -6.116 1.00 1.00 C ATOM 586 C GLU A 114 -7.064 20.768 -7.036 1.00 1.00 C ATOM 587 O GLU A 114 -7.716 19.814 -6.614 1.00 1.00 O ATOM 588 CB GLU A 114 -7.407 23.126 -6.387 1.00 1.00 C ATOM 589 CG GLU A 114 -6.855 24.405 -5.758 1.00 1.00 C ATOM 590 CD GLU A 114 -7.865 25.564 -5.875 1.00 1.00 C ATOM 591 OE1 GLU A 114 -7.852 26.289 -6.902 1.00 1.00 O ATOM 592 OE2 GLU A 114 -8.678 25.764 -4.940 1.00 1.00 O ATOM 0 H GLU A 114 -4.964 23.125 -6.652 1.00 1.00 H new ATOM 0 HA GLU A 114 -6.663 21.563 -5.077 1.00 1.00 H new ATOM 0 HB2 GLU A 114 -7.487 23.270 -7.465 1.00 1.00 H new ATOM 0 HB3 GLU A 114 -8.417 22.957 -6.012 1.00 1.00 H new ATOM 0 HG2 GLU A 114 -6.622 24.226 -4.708 1.00 1.00 H new ATOM 0 HG3 GLU A 114 -5.922 24.681 -6.249 1.00 1.00 H new ATOM 599 N ALA A 115 -6.692 20.905 -8.310 1.00 1.00 N ATOM 600 CA ALA A 115 -6.967 19.940 -9.362 1.00 1.00 C ATOM 601 C ALA A 115 -6.336 18.589 -9.009 1.00 1.00 C ATOM 602 O ALA A 115 -7.007 17.562 -8.912 1.00 1.00 O ATOM 603 CB ALA A 115 -6.389 20.479 -10.677 1.00 1.00 C ATOM 0 H ALA A 115 -6.175 21.719 -8.643 1.00 1.00 H new ATOM 0 HA ALA A 115 -8.042 19.793 -9.468 1.00 1.00 H new ATOM 0 HB1 ALA A 115 -6.586 19.768 -11.479 1.00 1.00 H new ATOM 0 HB2 ALA A 115 -6.857 21.434 -10.916 1.00 1.00 H new ATOM 0 HB3 ALA A 115 -5.313 20.619 -10.571 1.00 1.00 H new ATOM 609 N VAL A 116 -5.029 18.636 -8.752 1.00 1.00 N ATOM 610 CA VAL A 116 -4.172 17.489 -8.503 1.00 1.00 C ATOM 611 C VAL A 116 -4.660 16.664 -7.312 1.00 1.00 C ATOM 612 O VAL A 116 -4.812 15.448 -7.430 1.00 1.00 O ATOM 613 CB VAL A 116 -2.734 17.993 -8.326 1.00 1.00 C ATOM 614 CG1 VAL A 116 -1.760 16.981 -7.720 1.00 1.00 C ATOM 615 CG2 VAL A 116 -2.196 18.414 -9.698 1.00 1.00 C ATOM 0 H VAL A 116 -4.520 19.519 -8.711 1.00 1.00 H new ATOM 0 HA VAL A 116 -4.206 16.809 -9.354 1.00 1.00 H new ATOM 0 HB VAL A 116 -2.792 18.819 -7.617 1.00 1.00 H new ATOM 0 HG11 VAL A 116 -0.772 17.433 -7.636 1.00 1.00 H new ATOM 0 HG12 VAL A 116 -2.110 16.687 -6.730 1.00 1.00 H new ATOM 0 HG13 VAL A 116 -1.704 16.101 -8.361 1.00 1.00 H new ATOM 0 HG21 VAL A 116 -1.173 18.776 -9.592 1.00 1.00 H new ATOM 0 HG22 VAL A 116 -2.210 17.558 -10.373 1.00 1.00 H new ATOM 0 HG23 VAL A 116 -2.821 19.208 -10.106 1.00 1.00 H new ATOM 625 N GLU A 117 -4.973 17.308 -6.186 1.00 1.00 N ATOM 626 CA GLU A 117 -5.523 16.638 -5.009 1.00 1.00 C ATOM 627 C GLU A 117 -6.938 16.089 -5.262 1.00 1.00 C ATOM 628 O GLU A 117 -7.277 15.015 -4.760 1.00 1.00 O ATOM 629 CB GLU A 117 -5.568 17.608 -3.815 1.00 1.00 C ATOM 630 CG GLU A 117 -4.182 17.965 -3.263 1.00 1.00 C ATOM 631 CD GLU A 117 -4.335 18.885 -2.033 1.00 1.00 C ATOM 632 OE1 GLU A 117 -4.712 18.384 -0.941 1.00 1.00 O ATOM 633 OE2 GLU A 117 -4.112 20.117 -2.141 1.00 1.00 O ATOM 0 H GLU A 117 -4.851 18.314 -6.066 1.00 1.00 H new ATOM 0 HA GLU A 117 -4.865 15.798 -4.786 1.00 1.00 H new ATOM 0 HB2 GLU A 117 -6.076 18.523 -4.120 1.00 1.00 H new ATOM 0 HB3 GLU A 117 -6.164 17.163 -3.018 1.00 1.00 H new ATOM 0 HG2 GLU A 117 -3.645 17.058 -2.986 1.00 1.00 H new ATOM 0 HG3 GLU A 117 -3.591 18.464 -4.031 1.00 1.00 H new ATOM 640 N SER A 118 -7.759 16.788 -6.056 1.00 1.00 N ATOM 641 CA SER A 118 -9.117 16.338 -6.403 1.00 1.00 C ATOM 642 C SER A 118 -9.105 15.053 -7.245 1.00 1.00 C ATOM 643 O SER A 118 -9.962 14.181 -7.073 1.00 1.00 O ATOM 644 CB SER A 118 -9.883 17.450 -7.129 1.00 1.00 C ATOM 645 OG SER A 118 -11.244 17.090 -7.314 1.00 1.00 O ATOM 0 H SER A 118 -7.503 17.681 -6.477 1.00 1.00 H new ATOM 0 HA SER A 118 -9.629 16.107 -5.469 1.00 1.00 H new ATOM 0 HB2 SER A 118 -9.822 18.374 -6.554 1.00 1.00 H new ATOM 0 HB3 SER A 118 -9.419 17.645 -8.096 1.00 1.00 H new ATOM 0 HG SER A 118 -11.714 17.814 -7.778 1.00 1.00 H new ATOM 651 N TRP A 119 -8.095 14.890 -8.108 1.00 1.00 N ATOM 652 CA TRP A 119 -7.878 13.682 -8.905 1.00 1.00 C ATOM 653 C TRP A 119 -7.376 12.473 -8.087 1.00 1.00 C ATOM 654 O TRP A 119 -7.293 11.371 -8.635 1.00 1.00 O ATOM 655 CB TRP A 119 -6.863 13.960 -10.025 1.00 1.00 C ATOM 656 CG TRP A 119 -7.057 15.138 -10.938 1.00 1.00 C ATOM 657 CD1 TRP A 119 -8.229 15.745 -11.239 1.00 1.00 C ATOM 658 CD2 TRP A 119 -6.035 15.856 -11.703 1.00 1.00 C ATOM 659 NE1 TRP A 119 -7.999 16.808 -12.092 1.00 1.00 N ATOM 660 CE2 TRP A 119 -6.664 16.923 -12.410 1.00 1.00 C ATOM 661 CE3 TRP A 119 -4.639 15.710 -11.874 1.00 1.00 C ATOM 662 CZ2 TRP A 119 -5.946 17.812 -13.226 1.00 1.00 C ATOM 663 CZ3 TRP A 119 -3.912 16.585 -12.705 1.00 1.00 C ATOM 664 CH2 TRP A 119 -4.559 17.638 -13.374 1.00 1.00 C ATOM 0 H TRP A 119 -7.392 15.611 -8.273 1.00 1.00 H new ATOM 0 HA TRP A 119 -8.856 13.421 -9.309 1.00 1.00 H new ATOM 0 HB2 TRP A 119 -5.885 14.070 -9.556 1.00 1.00 H new ATOM 0 HB3 TRP A 119 -6.818 13.069 -10.651 1.00 1.00 H new ATOM 0 HD1 TRP A 119 -9.198 15.444 -10.868 1.00 1.00 H new ATOM 0 HE1 TRP A 119 -8.728 17.430 -12.442 1.00 1.00 H new ATOM 0 HE3 TRP A 119 -4.121 14.914 -11.359 1.00 1.00 H new ATOM 0 HZ2 TRP A 119 -6.453 18.619 -13.734 1.00 1.00 H new ATOM 0 HZ3 TRP A 119 -2.848 16.445 -12.829 1.00 1.00 H new ATOM 0 HH2 TRP A 119 -3.992 18.311 -14.000 1.00 1.00 H new ATOM 675 N ALA A 120 -6.988 12.647 -6.815 1.00 1.00 N ATOM 676 CA ALA A 120 -6.359 11.598 -6.033 1.00 1.00 C ATOM 677 C ALA A 120 -7.294 10.450 -5.611 1.00 1.00 C ATOM 678 O ALA A 120 -8.526 10.508 -5.654 1.00 1.00 O ATOM 679 CB ALA A 120 -5.645 12.187 -4.807 1.00 1.00 C ATOM 0 H ALA A 120 -7.106 13.524 -6.308 1.00 1.00 H new ATOM 0 HA ALA A 120 -5.632 11.143 -6.706 1.00 1.00 H new ATOM 0 HB1 ALA A 120 -5.181 11.383 -4.235 1.00 1.00 H new ATOM 0 HB2 ALA A 120 -4.878 12.889 -5.135 1.00 1.00 H new ATOM 0 HB3 ALA A 120 -6.369 12.707 -4.180 1.00 1.00 H new ATOM 685 N THR A 121 -6.611 9.427 -5.123 1.00 1.00 N ATOM 686 CA THR A 121 -7.073 8.104 -4.682 1.00 1.00 C ATOM 687 C THR A 121 -6.227 7.690 -3.488 1.00 1.00 C ATOM 688 O THR A 121 -5.029 7.938 -3.484 1.00 1.00 O ATOM 689 CB THR A 121 -6.849 7.097 -5.814 1.00 1.00 C ATOM 690 OG1 THR A 121 -7.559 7.474 -6.978 1.00 1.00 O ATOM 691 CG2 THR A 121 -7.339 5.709 -5.409 1.00 1.00 C ATOM 0 H THR A 121 -5.600 9.505 -5.010 1.00 1.00 H new ATOM 0 HA THR A 121 -8.130 8.134 -4.418 1.00 1.00 H new ATOM 0 HB THR A 121 -5.778 7.081 -6.015 1.00 1.00 H new ATOM 0 HG1 THR A 121 -7.398 6.816 -7.687 1.00 1.00 H new ATOM 0 HG21 THR A 121 -7.170 5.010 -6.228 1.00 1.00 H new ATOM 0 HG22 THR A 121 -6.793 5.373 -4.527 1.00 1.00 H new ATOM 0 HG23 THR A 121 -8.404 5.751 -5.182 1.00 1.00 H new ATOM 699 N LEU A 122 -6.809 7.025 -2.494 1.00 1.00 N ATOM 700 CA LEU A 122 -6.122 6.640 -1.252 1.00 1.00 C ATOM 701 C LEU A 122 -5.878 5.124 -1.242 1.00 1.00 C ATOM 702 O LEU A 122 -6.807 4.327 -1.390 1.00 1.00 O ATOM 703 CB LEU A 122 -6.952 7.147 -0.058 1.00 1.00 C ATOM 704 CG LEU A 122 -6.135 7.380 1.230 1.00 1.00 C ATOM 705 CD1 LEU A 122 -7.041 7.995 2.298 1.00 1.00 C ATOM 706 CD2 LEU A 122 -5.514 6.108 1.808 1.00 1.00 C ATOM 0 H LEU A 122 -7.785 6.731 -2.523 1.00 1.00 H new ATOM 0 HA LEU A 122 -5.137 7.101 -1.179 1.00 1.00 H new ATOM 0 HB2 LEU A 122 -7.439 8.081 -0.339 1.00 1.00 H new ATOM 0 HB3 LEU A 122 -7.742 6.426 0.152 1.00 1.00 H new ATOM 0 HG LEU A 122 -5.316 8.045 0.954 1.00 1.00 H new ATOM 0 HD11 LEU A 122 -6.467 8.161 3.210 1.00 1.00 H new ATOM 0 HD12 LEU A 122 -7.434 8.946 1.938 1.00 1.00 H new ATOM 0 HD13 LEU A 122 -7.868 7.317 2.508 1.00 1.00 H new ATOM 0 HD21 LEU A 122 -4.956 6.354 2.712 1.00 1.00 H new ATOM 0 HD22 LEU A 122 -6.303 5.396 2.051 1.00 1.00 H new ATOM 0 HD23 LEU A 122 -4.840 5.666 1.074 1.00 1.00 H new ATOM 718 N LEU A 123 -4.606 4.749 -1.090 1.00 1.00 N ATOM 719 CA LEU A 123 -4.078 3.393 -1.189 1.00 1.00 C ATOM 720 C LEU A 123 -3.387 2.981 0.124 1.00 1.00 C ATOM 721 O LEU A 123 -2.539 3.688 0.668 1.00 1.00 O ATOM 722 CB LEU A 123 -3.110 3.334 -2.386 1.00 1.00 C ATOM 723 CG LEU A 123 -3.737 3.694 -3.743 1.00 1.00 C ATOM 724 CD1 LEU A 123 -2.653 3.573 -4.805 1.00 1.00 C ATOM 725 CD2 LEU A 123 -4.896 2.777 -4.135 1.00 1.00 C ATOM 0 H LEU A 123 -3.875 5.429 -0.882 1.00 1.00 H new ATOM 0 HA LEU A 123 -4.890 2.684 -1.352 1.00 1.00 H new ATOM 0 HB2 LEU A 123 -2.278 4.012 -2.195 1.00 1.00 H new ATOM 0 HB3 LEU A 123 -2.694 2.328 -2.449 1.00 1.00 H new ATOM 0 HG LEU A 123 -4.137 4.705 -3.664 1.00 1.00 H new ATOM 0 HD11 LEU A 123 -3.070 3.823 -5.781 1.00 1.00 H new ATOM 0 HD12 LEU A 123 -1.838 4.258 -4.572 1.00 1.00 H new ATOM 0 HD13 LEU A 123 -2.274 2.551 -4.824 1.00 1.00 H new ATOM 0 HD21 LEU A 123 -5.293 3.086 -5.102 1.00 1.00 H new ATOM 0 HD22 LEU A 123 -4.540 1.749 -4.200 1.00 1.00 H new ATOM 0 HD23 LEU A 123 -5.682 2.842 -3.383 1.00 1.00 H new ATOM 737 N GLY A 124 -3.768 1.804 0.620 1.00 1.00 N ATOM 738 CA GLY A 124 -3.340 1.279 1.928 1.00 1.00 C ATOM 739 C GLY A 124 -1.915 0.697 1.977 1.00 1.00 C ATOM 740 O GLY A 124 -1.371 0.507 3.069 1.00 1.00 O ATOM 0 H GLY A 124 -4.394 1.173 0.119 1.00 1.00 H new ATOM 0 HA2 GLY A 124 -3.411 2.081 2.662 1.00 1.00 H new ATOM 0 HA3 GLY A 124 -4.041 0.503 2.235 1.00 1.00 H new ATOM 744 N HIS A 125 -1.310 0.422 0.815 1.00 1.00 N ATOM 745 CA HIS A 125 0.043 -0.131 0.642 1.00 1.00 C ATOM 746 C HIS A 125 0.680 0.361 -0.678 1.00 1.00 C ATOM 747 O HIS A 125 -0.048 0.524 -1.684 1.00 1.00 O ATOM 748 CB HIS A 125 -0.025 -1.665 0.726 1.00 1.00 C ATOM 749 CG HIS A 125 1.298 -2.397 0.752 1.00 1.00 C ATOM 750 ND1 HIS A 125 2.517 -1.929 0.299 1.00 1.00 N ATOM 751 CD2 HIS A 125 1.504 -3.662 1.229 1.00 1.00 C ATOM 752 CE1 HIS A 125 3.446 -2.884 0.492 1.00 1.00 C ATOM 753 NE2 HIS A 125 2.849 -3.953 1.061 1.00 1.00 N ATOM 0 H HIS A 125 -1.774 0.587 -0.078 1.00 1.00 H new ATOM 0 HA HIS A 125 0.691 0.226 1.443 1.00 1.00 H new ATOM 0 HB2 HIS A 125 -0.582 -1.933 1.624 1.00 1.00 H new ATOM 0 HB3 HIS A 125 -0.600 -2.029 -0.126 1.00 1.00 H new ATOM 0 HD2 HIS A 125 0.757 -4.314 1.657 1.00 1.00 H new ATOM 0 HE1 HIS A 125 4.492 -2.808 0.235 1.00 1.00 H new ATOM 0 HE2 HIS A 125 3.309 -4.825 1.322 1.00 1.00 H new TER 762 HIS A 125 ATOM 763 O5' DC B 1 -3.414 27.780 6.440 1.00 1.00 O ATOM 764 C5' DC B 1 -3.609 28.913 7.292 1.00 1.00 C ATOM 765 C4' DC B 1 -2.856 28.828 8.637 1.00 1.00 C ATOM 766 O4' DC B 1 -3.405 27.813 9.471 1.00 1.00 O ATOM 767 C3' DC B 1 -1.357 28.565 8.443 1.00 1.00 C ATOM 768 O3' DC B 1 -0.585 29.483 9.219 1.00 1.00 O ATOM 769 C2' DC B 1 -1.213 27.110 8.871 1.00 1.00 C ATOM 770 C1' DC B 1 -2.387 26.894 9.832 1.00 1.00 C ATOM 771 N1 DC B 1 -2.938 25.517 9.799 1.00 1.00 N ATOM 772 C2 DC B 1 -3.175 24.809 10.983 1.00 1.00 C ATOM 773 O2 DC B 1 -2.876 25.265 12.089 1.00 1.00 O ATOM 774 N3 DC B 1 -3.756 23.583 10.956 1.00 1.00 N ATOM 775 C4 DC B 1 -4.046 23.060 9.781 1.00 1.00 C ATOM 776 N4 DC B 1 -4.627 21.894 9.810 1.00 1.00 N ATOM 777 C5 DC B 1 -3.812 23.726 8.544 1.00 1.00 C ATOM 778 C6 DC B 1 -3.265 24.958 8.601 1.00 1.00 C ATOM 0 H5' DC B 1 -4.675 29.025 7.491 1.00 1.00 H new ATOM 0 H5'' DC B 1 -3.287 29.811 6.764 1.00 1.00 H new ATOM 0 H4' DC B 1 -2.977 29.798 9.119 1.00 1.00 H new ATOM 0 H3' DC B 1 -0.991 28.716 7.427 1.00 1.00 H new ATOM 0 H2' DC B 1 -1.266 26.435 8.017 1.00 1.00 H new ATOM 0 H2'' DC B 1 -0.256 26.930 9.361 1.00 1.00 H new ATOM 0 HO5' DC B 1 -3.921 27.903 5.610 1.00 1.00 H new ATOM 0 H1' DC B 1 -2.024 27.050 10.848 1.00 1.00 H new ATOM 0 H41 DC B 1 -4.881 21.429 8.938 1.00 1.00 H new ATOM 0 H42 DC B 1 -4.828 21.447 10.704 1.00 1.00 H new ATOM 0 H5 DC B 1 -4.062 23.264 7.600 1.00 1.00 H new ATOM 0 H6 DC B 1 -3.085 25.506 7.688 1.00 1.00 H new ATOM 791 P DG B 2 1.040 29.516 9.191 1.00 1.00 P ATOM 792 OP1 DG B 2 1.467 30.899 9.544 1.00 1.00 O ATOM 793 OP2 DG B 2 1.513 28.940 7.903 1.00 1.00 O ATOM 794 O5' DG B 2 1.492 28.516 10.392 1.00 1.00 O ATOM 795 C5' DG B 2 1.286 28.865 11.762 1.00 1.00 C ATOM 796 C4' DG B 2 1.801 27.819 12.773 1.00 1.00 C ATOM 797 O4' DG B 2 0.923 26.693 12.843 1.00 1.00 O ATOM 798 C3' DG B 2 3.221 27.312 12.458 1.00 1.00 C ATOM 799 O3' DG B 2 4.015 27.319 13.647 1.00 1.00 O ATOM 800 C2' DG B 2 2.918 25.922 11.904 1.00 1.00 C ATOM 801 C1' DG B 2 1.692 25.507 12.714 1.00 1.00 C ATOM 802 N9 DG B 2 0.887 24.459 12.052 1.00 1.00 N ATOM 803 C8 DG B 2 0.497 24.418 10.742 1.00 1.00 C ATOM 804 N7 DG B 2 -0.259 23.401 10.427 1.00 1.00 N ATOM 805 C5 DG B 2 -0.349 22.686 11.631 1.00 1.00 C ATOM 806 C6 DG B 2 -1.025 21.457 11.964 1.00 1.00 C ATOM 807 O6 DG B 2 -1.761 20.756 11.273 1.00 1.00 O ATOM 808 N1 DG B 2 -0.798 21.035 13.255 1.00 1.00 N ATOM 809 C2 DG B 2 -0.055 21.724 14.151 1.00 1.00 C ATOM 810 N2 DG B 2 0.069 21.190 15.335 1.00 1.00 N ATOM 811 N3 DG B 2 0.552 22.884 13.912 1.00 1.00 N ATOM 812 C4 DG B 2 0.376 23.314 12.625 1.00 1.00 C ATOM 0 H5' DG B 2 0.220 29.018 11.928 1.00 1.00 H new ATOM 0 H5'' DG B 2 1.780 29.817 11.960 1.00 1.00 H new ATOM 0 H4' DG B 2 1.832 28.338 13.731 1.00 1.00 H new ATOM 0 H3' DG B 2 3.807 27.910 11.760 1.00 1.00 H new ATOM 0 H2' DG B 2 2.709 25.948 10.835 1.00 1.00 H new ATOM 0 H2'' DG B 2 3.752 25.236 12.049 1.00 1.00 H new ATOM 0 H1' DG B 2 1.997 25.079 13.669 1.00 1.00 H new ATOM 0 H8 DG B 2 0.791 25.169 10.024 1.00 1.00 H new ATOM 0 H1 DG B 2 -1.214 20.152 13.553 1.00 1.00 H new ATOM 0 H21 DG B 2 0.618 21.663 16.053 1.00 1.00 H new ATOM 0 H22 DG B 2 -0.383 20.299 15.543 1.00 1.00 H new ATOM 824 P DC B 3 5.571 26.850 13.681 1.00 1.00 P ATOM 825 OP1 DC B 3 6.269 27.665 14.716 1.00 1.00 O ATOM 826 OP2 DC B 3 6.121 26.848 12.296 1.00 1.00 O ATOM 827 O5' DC B 3 5.484 25.314 14.201 1.00 1.00 O ATOM 828 C5' DC B 3 5.064 25.024 15.533 1.00 1.00 C ATOM 829 C4' DC B 3 4.944 23.521 15.844 1.00 1.00 C ATOM 830 O4' DC B 3 3.875 22.959 15.099 1.00 1.00 O ATOM 831 C3' DC B 3 6.233 22.723 15.570 1.00 1.00 C ATOM 832 O3' DC B 3 6.763 22.206 16.794 1.00 1.00 O ATOM 833 C2' DC B 3 5.775 21.626 14.604 1.00 1.00 C ATOM 834 C1' DC B 3 4.249 21.672 14.648 1.00 1.00 C ATOM 835 N1 DC B 3 3.648 21.435 13.314 1.00 1.00 N ATOM 836 C2 DC B 3 2.828 20.320 13.106 1.00 1.00 C ATOM 837 O2 DC B 3 2.634 19.471 13.979 1.00 1.00 O ATOM 838 N3 DC B 3 2.214 20.126 11.917 1.00 1.00 N ATOM 839 C4 DC B 3 2.435 20.995 10.956 1.00 1.00 C ATOM 840 N4 DC B 3 1.801 20.756 9.843 1.00 1.00 N ATOM 841 C5 DC B 3 3.279 22.137 11.091 1.00 1.00 C ATOM 842 C6 DC B 3 3.875 22.320 12.297 1.00 1.00 C ATOM 0 H5' DC B 3 4.098 25.498 15.709 1.00 1.00 H new ATOM 0 H5'' DC B 3 5.771 25.473 16.231 1.00 1.00 H new ATOM 0 H4' DC B 3 4.753 23.447 16.915 1.00 1.00 H new ATOM 0 H3' DC B 3 7.043 23.315 15.144 1.00 1.00 H new ATOM 0 H2' DC B 3 6.146 21.808 13.596 1.00 1.00 H new ATOM 0 H2'' DC B 3 6.149 20.649 14.910 1.00 1.00 H new ATOM 0 H1' DC B 3 3.890 20.887 15.313 1.00 1.00 H new ATOM 0 H41 DC B 3 1.916 21.382 9.046 1.00 1.00 H new ATOM 0 H42 DC B 3 1.189 19.943 9.769 1.00 1.00 H new ATOM 0 H5 DC B 3 3.436 22.824 10.272 1.00 1.00 H new ATOM 0 H6 DC B 3 4.529 23.165 12.453 1.00 1.00 H new ATOM 854 P DA B 4 8.208 21.460 16.878 1.00 1.00 P ATOM 855 OP1 DA B 4 8.635 21.461 18.307 1.00 1.00 O ATOM 856 OP2 DA B 4 9.125 22.068 15.872 1.00 1.00 O ATOM 857 O5' DA B 4 7.915 19.928 16.436 1.00 1.00 O ATOM 858 C5' DA B 4 7.062 19.090 17.214 1.00 1.00 C ATOM 859 C4' DA B 4 6.752 17.728 16.564 1.00 1.00 C ATOM 860 O4' DA B 4 5.810 17.850 15.498 1.00 1.00 O ATOM 861 C3' DA B 4 8.002 17.001 16.031 1.00 1.00 C ATOM 862 O3' DA B 4 8.104 15.706 16.619 1.00 1.00 O ATOM 863 C2' DA B 4 7.732 16.998 14.526 1.00 1.00 C ATOM 864 C1' DA B 4 6.209 16.966 14.467 1.00 1.00 C ATOM 865 N9 DA B 4 5.700 17.460 13.178 1.00 1.00 N ATOM 866 C8 DA B 4 6.027 18.643 12.583 1.00 1.00 C ATOM 867 N7 DA B 4 5.376 18.900 11.479 1.00 1.00 N ATOM 868 C5 DA B 4 4.598 17.743 11.317 1.00 1.00 C ATOM 869 C6 DA B 4 3.678 17.290 10.340 1.00 1.00 C ATOM 870 N6 DA B 4 3.298 18.005 9.304 1.00 1.00 N ATOM 871 N1 DA B 4 3.118 16.079 10.404 1.00 1.00 N ATOM 872 C2 DA B 4 3.437 15.315 11.442 1.00 1.00 C ATOM 873 N3 DA B 4 4.263 15.601 12.446 1.00 1.00 N ATOM 874 C4 DA B 4 4.813 16.843 12.327 1.00 1.00 C ATOM 0 H5' DA B 4 6.124 19.615 17.397 1.00 1.00 H new ATOM 0 H5'' DA B 4 7.526 18.919 18.185 1.00 1.00 H new ATOM 0 H4' DA B 4 6.328 17.129 17.370 1.00 1.00 H new ATOM 0 H3' DA B 4 8.962 17.460 16.268 1.00 1.00 H new ATOM 0 H2' DA B 4 8.139 17.884 14.038 1.00 1.00 H new ATOM 0 H2'' DA B 4 8.176 16.132 14.035 1.00 1.00 H new ATOM 0 H1' DA B 4 5.825 15.952 14.580 1.00 1.00 H new ATOM 0 H8 DA B 4 6.767 19.315 12.992 1.00 1.00 H new ATOM 0 H61 DA B 4 2.631 17.620 8.635 1.00 1.00 H new ATOM 0 H62 DA B 4 3.670 18.945 9.169 1.00 1.00 H new ATOM 0 H2 DA B 4 2.969 14.342 11.476 1.00 1.00 H new ATOM 886 P DT B 5 9.403 14.754 16.414 1.00 1.00 P ATOM 887 OP1 DT B 5 9.481 13.828 17.579 1.00 1.00 O ATOM 888 OP2 DT B 5 10.592 15.599 16.108 1.00 1.00 O ATOM 889 O5' DT B 5 9.042 13.889 15.092 1.00 1.00 O ATOM 890 C5' DT B 5 7.993 12.922 15.119 1.00 1.00 C ATOM 891 C4' DT B 5 7.744 12.249 13.760 1.00 1.00 C ATOM 892 O4' DT B 5 7.115 13.152 12.857 1.00 1.00 O ATOM 893 C3' DT B 5 9.024 11.702 13.100 1.00 1.00 C ATOM 894 O3' DT B 5 8.860 10.313 12.826 1.00 1.00 O ATOM 895 C2' DT B 5 9.138 12.583 11.855 1.00 1.00 C ATOM 896 C1' DT B 5 7.682 12.959 11.577 1.00 1.00 C ATOM 897 N1 DT B 5 7.487 14.191 10.759 1.00 1.00 N ATOM 898 C2 DT B 5 6.569 14.137 9.705 1.00 1.00 C ATOM 899 O2 DT B 5 6.002 13.107 9.353 1.00 1.00 O ATOM 900 N3 DT B 5 6.311 15.305 9.028 1.00 1.00 N ATOM 901 C4 DT B 5 6.950 16.504 9.244 1.00 1.00 C ATOM 902 O4 DT B 5 6.626 17.474 8.563 1.00 1.00 O ATOM 903 C5 DT B 5 7.970 16.476 10.294 1.00 1.00 C ATOM 904 C7 DT B 5 8.809 17.708 10.578 1.00 1.00 C ATOM 905 C6 DT B 5 8.183 15.353 11.025 1.00 1.00 C ATOM 0 H5' DT B 5 7.073 13.404 15.450 1.00 1.00 H new ATOM 0 H5'' DT B 5 8.235 12.156 15.856 1.00 1.00 H new ATOM 0 H4' DT B 5 7.092 11.401 13.971 1.00 1.00 H new ATOM 0 H3' DT B 5 9.932 11.747 13.702 1.00 1.00 H new ATOM 0 H2' DT B 5 9.756 13.462 12.036 1.00 1.00 H new ATOM 0 H2'' DT B 5 9.585 12.046 11.018 1.00 1.00 H new ATOM 0 H1' DT B 5 7.220 12.170 10.984 1.00 1.00 H new ATOM 0 H3 DT B 5 5.588 15.281 8.308 1.00 1.00 H new ATOM 0 H71 DT B 5 9.092 17.721 11.630 1.00 1.00 H new ATOM 0 H72 DT B 5 9.707 17.687 9.961 1.00 1.00 H new ATOM 0 H73 DT B 5 8.231 18.603 10.347 1.00 1.00 H new ATOM 0 H6 DT B 5 8.907 15.368 11.826 1.00 1.00 H new ATOM 918 P DA B 6 10.002 9.400 12.118 1.00 1.00 P ATOM 919 OP1 DA B 6 9.983 8.059 12.766 1.00 1.00 O ATOM 920 OP2 DA B 6 11.291 10.146 12.070 1.00 1.00 O ATOM 921 O5' DA B 6 9.429 9.260 10.610 1.00 1.00 O ATOM 922 C5' DA B 6 8.200 8.578 10.376 1.00 1.00 C ATOM 923 C4' DA B 6 7.774 8.516 8.902 1.00 1.00 C ATOM 924 O4' DA B 6 7.353 9.806 8.451 1.00 1.00 O ATOM 925 C3' DA B 6 8.874 7.993 7.965 1.00 1.00 C ATOM 926 O3' DA B 6 8.302 7.045 7.071 1.00 1.00 O ATOM 927 C2' DA B 6 9.369 9.288 7.331 1.00 1.00 C ATOM 928 C1' DA B 6 8.133 10.186 7.329 1.00 1.00 C ATOM 929 N9 DA B 6 8.476 11.617 7.424 1.00 1.00 N ATOM 930 C8 DA B 6 9.450 12.201 8.192 1.00 1.00 C ATOM 931 N7 DA B 6 9.582 13.491 8.027 1.00 1.00 N ATOM 932 C5 DA B 6 8.620 13.766 7.045 1.00 1.00 C ATOM 933 C6 DA B 6 8.213 14.929 6.349 1.00 1.00 C ATOM 934 N6 DA B 6 8.736 16.130 6.523 1.00 1.00 N ATOM 935 N1 DA B 6 7.255 14.883 5.427 1.00 1.00 N ATOM 936 C2 DA B 6 6.679 13.715 5.183 1.00 1.00 C ATOM 937 N3 DA B 6 6.939 12.546 5.756 1.00 1.00 N ATOM 938 C4 DA B 6 7.932 12.638 6.682 1.00 1.00 C ATOM 0 H5' DA B 6 7.413 9.069 10.948 1.00 1.00 H new ATOM 0 H5'' DA B 6 8.285 7.561 10.759 1.00 1.00 H new ATOM 0 H4' DA B 6 6.949 7.805 8.861 1.00 1.00 H new ATOM 0 H3' DA B 6 9.701 7.447 8.418 1.00 1.00 H new ATOM 0 H2' DA B 6 10.184 9.729 7.905 1.00 1.00 H new ATOM 0 H2'' DA B 6 9.745 9.122 6.321 1.00 1.00 H new ATOM 0 H1' DA B 6 7.594 10.060 6.390 1.00 1.00 H new ATOM 0 H8 DA B 6 10.062 11.638 8.881 1.00 1.00 H new ATOM 0 H61 DA B 6 8.388 16.921 5.982 1.00 1.00 H new ATOM 0 H62 DA B 6 9.488 16.266 7.199 1.00 1.00 H new ATOM 0 H2 DA B 6 5.906 13.714 4.428 1.00 1.00 H new ATOM 950 P DT B 7 9.128 6.347 5.859 1.00 1.00 P ATOM 951 OP1 DT B 7 8.490 5.034 5.560 1.00 1.00 O ATOM 952 OP2 DT B 7 10.590 6.379 6.156 1.00 1.00 O ATOM 953 O5' DT B 7 8.817 7.362 4.638 1.00 1.00 O ATOM 954 C5' DT B 7 7.474 7.588 4.232 1.00 1.00 C ATOM 955 C4' DT B 7 7.321 8.730 3.222 1.00 1.00 C ATOM 956 O4' DT B 7 7.729 9.961 3.800 1.00 1.00 O ATOM 957 C3' DT B 7 8.109 8.518 1.915 1.00 1.00 C ATOM 958 O3' DT B 7 7.244 8.741 0.807 1.00 1.00 O ATOM 959 C2' DT B 7 9.179 9.595 2.027 1.00 1.00 C ATOM 960 C1' DT B 7 8.417 10.669 2.792 1.00 1.00 C ATOM 961 N1 DT B 7 9.299 11.700 3.387 1.00 1.00 N ATOM 962 C2 DT B 7 9.120 13.033 3.001 1.00 1.00 C ATOM 963 O2 DT B 7 8.319 13.409 2.145 1.00 1.00 O ATOM 964 N3 DT B 7 9.908 13.962 3.633 1.00 1.00 N ATOM 965 C4 DT B 7 10.900 13.697 4.539 1.00 1.00 C ATOM 966 O4 DT B 7 11.537 14.651 4.986 1.00 1.00 O ATOM 967 C5 DT B 7 11.080 12.280 4.858 1.00 1.00 C ATOM 968 C7 DT B 7 12.162 11.850 5.830 1.00 1.00 C ATOM 969 C6 DT B 7 10.287 11.340 4.279 1.00 1.00 C ATOM 0 H5' DT B 7 6.870 7.809 5.112 1.00 1.00 H new ATOM 0 H5'' DT B 7 7.077 6.672 3.795 1.00 1.00 H new ATOM 0 H4' DT B 7 6.262 8.749 2.965 1.00 1.00 H new ATOM 0 H3' DT B 7 8.524 7.520 1.772 1.00 1.00 H new ATOM 0 H2' DT B 7 10.060 9.249 2.567 1.00 1.00 H new ATOM 0 H2'' DT B 7 9.519 9.944 1.052 1.00 1.00 H new ATOM 0 H1' DT B 7 7.757 11.224 2.126 1.00 1.00 H new ATOM 0 H3 DT B 7 9.739 14.942 3.407 1.00 1.00 H new ATOM 0 H71 DT B 7 11.848 10.943 6.346 1.00 1.00 H new ATOM 0 H72 DT B 7 13.085 11.656 5.284 1.00 1.00 H new ATOM 0 H73 DT B 7 12.332 12.642 6.559 1.00 1.00 H new ATOM 0 H6 DT B 7 10.433 10.298 4.521 1.00 1.00 H new ATOM 982 P DA B 8 7.487 8.084 -0.645 1.00 1.00 P ATOM 983 OP1 DA B 8 6.182 8.120 -1.356 1.00 1.00 O ATOM 984 OP2 DA B 8 8.129 6.755 -0.456 1.00 1.00 O ATOM 985 O5' DA B 8 8.514 9.079 -1.380 1.00 1.00 O ATOM 986 C5' DA B 8 8.031 10.221 -2.075 1.00 1.00 C ATOM 987 C4' DA B 8 9.129 11.175 -2.572 1.00 1.00 C ATOM 988 O4' DA B 8 9.548 12.025 -1.517 1.00 1.00 O ATOM 989 C3' DA B 8 10.382 10.498 -3.167 1.00 1.00 C ATOM 990 O3' DA B 8 10.490 10.772 -4.563 1.00 1.00 O ATOM 991 C2' DA B 8 11.517 11.104 -2.338 1.00 1.00 C ATOM 992 C1' DA B 8 10.897 12.364 -1.753 1.00 1.00 C ATOM 993 N9 DA B 8 11.502 12.800 -0.473 1.00 1.00 N ATOM 994 C8 DA B 8 11.748 12.081 0.675 1.00 1.00 C ATOM 995 N7 DA B 8 12.261 12.782 1.655 1.00 1.00 N ATOM 996 C5 DA B 8 12.362 14.067 1.099 1.00 1.00 C ATOM 997 C6 DA B 8 12.798 15.341 1.554 1.00 1.00 C ATOM 998 N6 DA B 8 13.210 15.640 2.774 1.00 1.00 N ATOM 999 N1 DA B 8 12.759 16.407 0.756 1.00 1.00 N ATOM 1000 C2 DA B 8 12.291 16.251 -0.468 1.00 1.00 C ATOM 1001 N3 DA B 8 11.842 15.148 -1.036 1.00 1.00 N ATOM 1002 C4 DA B 8 11.904 14.081 -0.194 1.00 1.00 C ATOM 0 H5' DA B 8 7.358 10.772 -1.419 1.00 1.00 H new ATOM 0 H5'' DA B 8 7.442 9.889 -2.930 1.00 1.00 H new ATOM 0 H4' DA B 8 8.659 11.725 -3.387 1.00 1.00 H new ATOM 0 H3' DA B 8 10.376 9.409 -3.113 1.00 1.00 H new ATOM 0 H2' DA B 8 11.852 10.422 -1.557 1.00 1.00 H new ATOM 0 H2'' DA B 8 12.386 11.333 -2.955 1.00 1.00 H new ATOM 0 H1' DA B 8 11.047 13.193 -2.445 1.00 1.00 H new ATOM 0 H8 DA B 8 11.535 11.026 0.760 1.00 1.00 H new ATOM 0 H61 DA B 8 13.503 16.592 2.995 1.00 1.00 H new ATOM 0 H62 DA B 8 13.235 14.919 3.495 1.00 1.00 H new ATOM 0 H2 DA B 8 12.273 17.139 -1.083 1.00 1.00 H new ATOM 1014 P DT B 9 11.707 10.178 -5.479 1.00 1.00 P ATOM 1015 OP1 DT B 9 11.117 9.681 -6.749 1.00 1.00 O ATOM 1016 OP2 DT B 9 12.569 9.264 -4.684 1.00 1.00 O ATOM 1017 O5' DT B 9 12.535 11.530 -5.794 1.00 1.00 O ATOM 1018 C5' DT B 9 11.948 12.561 -6.585 1.00 1.00 C ATOM 1019 C4' DT B 9 12.835 13.806 -6.738 1.00 1.00 C ATOM 1020 O4' DT B 9 12.924 14.478 -5.489 1.00 1.00 O ATOM 1021 C3' DT B 9 14.245 13.472 -7.246 1.00 1.00 C ATOM 1022 O3' DT B 9 14.573 14.278 -8.378 1.00 1.00 O ATOM 1023 C2' DT B 9 15.100 13.724 -6.007 1.00 1.00 C ATOM 1024 C1' DT B 9 14.282 14.728 -5.193 1.00 1.00 C ATOM 1025 N1 DT B 9 14.514 14.612 -3.727 1.00 1.00 N ATOM 1026 C2 DT B 9 14.825 15.779 -3.012 1.00 1.00 C ATOM 1027 O2 DT B 9 14.802 16.914 -3.495 1.00 1.00 O ATOM 1028 N3 DT B 9 15.173 15.623 -1.689 1.00 1.00 N ATOM 1029 C4 DT B 9 15.217 14.428 -1.010 1.00 1.00 C ATOM 1030 O4 DT B 9 15.501 14.437 0.185 1.00 1.00 O ATOM 1031 C5 DT B 9 14.871 13.249 -1.804 1.00 1.00 C ATOM 1032 C7 DT B 9 14.923 11.870 -1.176 1.00 1.00 C ATOM 1033 C6 DT B 9 14.504 13.379 -3.106 1.00 1.00 C ATOM 0 H5' DT B 9 10.999 12.855 -6.136 1.00 1.00 H new ATOM 0 H5'' DT B 9 11.722 12.163 -7.574 1.00 1.00 H new ATOM 0 H4' DT B 9 12.369 14.447 -7.486 1.00 1.00 H new ATOM 0 H3' DT B 9 14.382 12.458 -7.621 1.00 1.00 H new ATOM 0 H2' DT B 9 15.274 12.804 -5.448 1.00 1.00 H new ATOM 0 H2'' DT B 9 16.078 14.127 -6.272 1.00 1.00 H new ATOM 0 H1' DT B 9 14.583 15.740 -5.463 1.00 1.00 H new ATOM 0 H3 DT B 9 15.419 16.465 -1.169 1.00 1.00 H new ATOM 0 H71 DT B 9 14.184 11.225 -1.652 1.00 1.00 H new ATOM 0 H72 DT B 9 15.917 11.445 -1.313 1.00 1.00 H new ATOM 0 H73 DT B 9 14.705 11.947 -0.111 1.00 1.00 H new ATOM 0 H6 DT B 9 14.200 12.505 -3.663 1.00 1.00 H new ATOM 1046 P DG B 10 16.042 14.277 -9.072 1.00 1.00 P ATOM 1047 OP1 DG B 10 15.870 14.597 -10.514 1.00 1.00 O ATOM 1048 OP2 DG B 10 16.776 13.035 -8.704 1.00 1.00 O ATOM 1049 O5' DG B 10 16.752 15.538 -8.350 1.00 1.00 O ATOM 1050 C5' DG B 10 16.228 16.853 -8.509 1.00 1.00 C ATOM 1051 C4' DG B 10 17.080 17.951 -7.848 1.00 1.00 C ATOM 1052 O4' DG B 10 16.985 17.883 -6.425 1.00 1.00 O ATOM 1053 C3' DG B 10 18.565 17.872 -8.248 1.00 1.00 C ATOM 1054 O3' DG B 10 19.070 19.177 -8.532 1.00 1.00 O ATOM 1055 C2' DG B 10 19.164 17.212 -7.006 1.00 1.00 C ATOM 1056 C1' DG B 10 18.294 17.778 -5.886 1.00 1.00 C ATOM 1057 N9 DG B 10 18.291 16.918 -4.684 1.00 1.00 N ATOM 1058 C8 DG B 10 18.116 15.564 -4.644 1.00 1.00 C ATOM 1059 N7 DG B 10 18.120 15.047 -3.444 1.00 1.00 N ATOM 1060 C5 DG B 10 18.383 16.155 -2.623 1.00 1.00 C ATOM 1061 C6 DG B 10 18.564 16.265 -1.197 1.00 1.00 C ATOM 1062 O6 DG B 10 18.457 15.399 -0.328 1.00 1.00 O ATOM 1063 N1 DG B 10 18.915 17.530 -0.783 1.00 1.00 N ATOM 1064 C2 DG B 10 19.037 18.585 -1.621 1.00 1.00 C ATOM 1065 N2 DG B 10 19.408 19.710 -1.076 1.00 1.00 N ATOM 1066 N3 DG B 10 18.835 18.553 -2.937 1.00 1.00 N ATOM 1067 C4 DG B 10 18.519 17.299 -3.383 1.00 1.00 C ATOM 0 H5' DG B 10 15.223 16.886 -8.089 1.00 1.00 H new ATOM 0 H5'' DG B 10 16.136 17.070 -9.573 1.00 1.00 H new ATOM 0 H4' DG B 10 16.678 18.899 -8.207 1.00 1.00 H new ATOM 0 H3' DG B 10 18.793 17.316 -9.158 1.00 1.00 H new ATOM 0 H2' DG B 10 19.107 16.125 -7.056 1.00 1.00 H new ATOM 0 H2'' DG B 10 20.215 17.470 -6.875 1.00 1.00 H new ATOM 0 H1' DG B 10 18.683 18.742 -5.557 1.00 1.00 H new ATOM 0 H8 DG B 10 17.985 14.967 -5.535 1.00 1.00 H new ATOM 0 H1 DG B 10 19.093 17.680 0.210 1.00 1.00 H new ATOM 0 H21 DG B 10 19.519 20.544 -1.653 1.00 1.00 H new ATOM 0 H22 DG B 10 19.587 19.756 -0.073 1.00 1.00 H new ATOM 1079 P DC B 11 20.583 19.453 -9.065 1.00 1.00 P ATOM 1080 OP1 DC B 11 20.514 20.523 -10.102 1.00 1.00 O ATOM 1081 OP2 DC B 11 21.228 18.158 -9.428 1.00 1.00 O ATOM 1082 O5' DC B 11 21.343 20.049 -7.760 1.00 1.00 O ATOM 1083 C5' DC B 11 20.958 21.307 -7.205 1.00 1.00 C ATOM 1084 C4' DC B 11 21.804 21.764 -5.999 1.00 1.00 C ATOM 1085 O4' DC B 11 21.547 20.933 -4.870 1.00 1.00 O ATOM 1086 C3' DC B 11 23.317 21.761 -6.287 1.00 1.00 C ATOM 1087 O3' DC B 11 23.919 22.953 -5.775 1.00 1.00 O ATOM 1088 C2' DC B 11 23.767 20.479 -5.585 1.00 1.00 C ATOM 1089 C1' DC B 11 22.764 20.351 -4.434 1.00 1.00 C ATOM 1090 N1 DC B 11 22.508 18.964 -3.965 1.00 1.00 N ATOM 1091 C2 DC B 11 22.526 18.673 -2.594 1.00 1.00 C ATOM 1092 O2 DC B 11 22.853 19.504 -1.743 1.00 1.00 O ATOM 1093 N3 DC B 11 22.192 17.439 -2.144 1.00 1.00 N ATOM 1094 C4 DC B 11 21.853 16.527 -3.030 1.00 1.00 C ATOM 1095 N4 DC B 11 21.485 15.377 -2.540 1.00 1.00 N ATOM 1096 C5 DC B 11 21.847 16.746 -4.434 1.00 1.00 C ATOM 1097 C6 DC B 11 22.180 17.988 -4.863 1.00 1.00 C ATOM 0 H5' DC B 11 19.914 21.249 -6.898 1.00 1.00 H new ATOM 0 H5'' DC B 11 21.020 22.067 -7.984 1.00 1.00 H new ATOM 0 H4' DC B 11 21.508 22.793 -5.793 1.00 1.00 H new ATOM 0 H3' DC B 11 23.597 21.764 -7.340 1.00 1.00 H new ATOM 0 H2' DC B 11 23.729 19.618 -6.252 1.00 1.00 H new ATOM 0 H2'' DC B 11 24.792 20.555 -5.222 1.00 1.00 H new ATOM 0 H1' DC B 11 23.199 20.859 -3.574 1.00 1.00 H new ATOM 0 H41 DC B 11 21.208 14.621 -3.166 1.00 1.00 H new ATOM 0 H42 DC B 11 21.474 15.233 -1.530 1.00 1.00 H new ATOM 0 H5 DC B 11 21.589 15.959 -5.127 1.00 1.00 H new ATOM 0 H6 DC B 11 22.186 18.207 -5.921 1.00 1.00 H new ATOM 1109 P DG B 12 25.440 23.393 -6.140 1.00 1.00 P ATOM 1110 OP1 DG B 12 25.576 24.849 -5.848 1.00 1.00 O ATOM 1111 OP2 DG B 12 25.769 22.917 -7.514 1.00 1.00 O ATOM 1112 O5' DG B 12 26.358 22.574 -5.087 1.00 1.00 O ATOM 1113 C5' DG B 12 26.360 22.903 -3.701 1.00 1.00 C ATOM 1114 C4' DG B 12 26.947 21.791 -2.815 1.00 1.00 C ATOM 1115 O4' DG B 12 26.066 20.683 -2.735 1.00 1.00 O ATOM 1116 C3' DG B 12 28.306 21.229 -3.268 1.00 1.00 C ATOM 1117 O3' DG B 12 29.417 21.883 -2.653 1.00 1.00 O ATOM 1118 C2' DG B 12 28.238 19.764 -2.832 1.00 1.00 C ATOM 1119 C1' DG B 12 26.824 19.590 -2.266 1.00 1.00 C ATOM 1120 N9 DG B 12 26.198 18.320 -2.679 1.00 1.00 N ATOM 1121 C8 DG B 12 25.942 17.889 -3.952 1.00 1.00 C ATOM 1122 N7 DG B 12 25.419 16.692 -4.022 1.00 1.00 N ATOM 1123 C5 DG B 12 25.333 16.294 -2.678 1.00 1.00 C ATOM 1124 C6 DG B 12 24.861 15.080 -2.056 1.00 1.00 C ATOM 1125 O6 DG B 12 24.394 14.057 -2.559 1.00 1.00 O ATOM 1126 N1 DG B 12 24.969 15.092 -0.682 1.00 1.00 N ATOM 1127 C2 DG B 12 25.489 16.115 0.031 1.00 1.00 C ATOM 1128 N2 DG B 12 25.570 15.956 1.323 1.00 1.00 N ATOM 1129 N3 DG B 12 25.935 17.255 -0.490 1.00 1.00 N ATOM 1130 C4 DG B 12 25.823 17.288 -1.852 1.00 1.00 C ATOM 0 H5' DG B 12 25.339 23.112 -3.382 1.00 1.00 H new ATOM 0 H5'' DG B 12 26.933 23.818 -3.552 1.00 1.00 H new ATOM 0 H4' DG B 12 27.088 22.290 -1.856 1.00 1.00 H new ATOM 0 H3' DG B 12 28.465 21.371 -4.337 1.00 1.00 H new ATOM 0 H2' DG B 12 28.413 19.092 -3.672 1.00 1.00 H new ATOM 0 H2'' DG B 12 28.995 19.539 -2.081 1.00 1.00 H new ATOM 0 HO3' DG B 12 30.252 21.484 -2.977 1.00 1.00 H new ATOM 0 H1' DG B 12 26.868 19.560 -1.177 1.00 1.00 H new ATOM 0 H8 DG B 12 26.154 18.487 -4.826 1.00 1.00 H new ATOM 0 H1 DG B 12 24.635 14.275 -0.170 1.00 1.00 H new ATOM 0 H21 DG B 12 25.955 16.700 1.905 1.00 1.00 H new ATOM 0 H22 DG B 12 25.248 15.088 1.751 1.00 1.00 H new TER 1143 DG B 12 ATOM 1144 O5' DC C 13 22.696 8.187 5.132 1.00 1.00 O ATOM 1145 C5' DC C 13 24.018 8.327 5.659 1.00 1.00 C ATOM 1146 C4' DC C 13 24.525 9.780 5.722 1.00 1.00 C ATOM 1147 O4' DC C 13 24.689 10.315 4.410 1.00 1.00 O ATOM 1148 C3' DC C 13 23.568 10.688 6.506 1.00 1.00 C ATOM 1149 O3' DC C 13 24.290 11.524 7.413 1.00 1.00 O ATOM 1150 C2' DC C 13 22.872 11.459 5.385 1.00 1.00 C ATOM 1151 C1' DC C 13 23.981 11.541 4.333 1.00 1.00 C ATOM 1152 N1 DC C 13 23.535 11.785 2.936 1.00 1.00 N ATOM 1153 C2 DC C 13 24.178 12.751 2.151 1.00 1.00 C ATOM 1154 O2 DC C 13 25.040 13.504 2.608 1.00 1.00 O ATOM 1155 N3 DC C 13 23.881 12.890 0.833 1.00 1.00 N ATOM 1156 C4 DC C 13 22.939 12.124 0.323 1.00 1.00 C ATOM 1157 N4 DC C 13 22.721 12.262 -0.957 1.00 1.00 N ATOM 1158 C5 DC C 13 22.232 11.145 1.075 1.00 1.00 C ATOM 1159 C6 DC C 13 22.565 11.005 2.380 1.00 1.00 C ATOM 0 H5' DC C 13 24.704 7.741 5.047 1.00 1.00 H new ATOM 0 H5'' DC C 13 24.043 7.902 6.662 1.00 1.00 H new ATOM 0 H4' DC C 13 25.485 9.753 6.237 1.00 1.00 H new ATOM 0 H3' DC C 13 22.859 10.164 7.148 1.00 1.00 H new ATOM 0 H2' DC C 13 21.992 10.935 5.012 1.00 1.00 H new ATOM 0 H2'' DC C 13 22.542 12.446 5.710 1.00 1.00 H new ATOM 0 HO5' DC C 13 22.446 7.239 5.122 1.00 1.00 H new ATOM 0 H1' DC C 13 24.590 12.415 4.563 1.00 1.00 H new ATOM 0 H41 DC C 13 22.005 11.699 -1.416 1.00 1.00 H new ATOM 0 H42 DC C 13 23.267 12.933 -1.498 1.00 1.00 H new ATOM 0 H5 DC C 13 21.461 10.538 0.623 1.00 1.00 H new ATOM 0 H6 DC C 13 22.058 10.269 2.986 1.00 1.00 H new ATOM 1172 P DG C 14 23.551 12.472 8.511 1.00 1.00 P ATOM 1173 OP1 DG C 14 24.361 12.421 9.762 1.00 1.00 O ATOM 1174 OP2 DG C 14 22.113 12.093 8.593 1.00 1.00 O ATOM 1175 O5' DG C 14 23.639 13.973 7.888 1.00 1.00 O ATOM 1176 C5' DG C 14 24.862 14.713 7.899 1.00 1.00 C ATOM 1177 C4' DG C 14 24.728 16.196 7.490 1.00 1.00 C ATOM 1178 O4' DG C 14 24.610 16.332 6.074 1.00 1.00 O ATOM 1179 C3' DG C 14 23.533 16.910 8.148 1.00 1.00 C ATOM 1180 O3' DG C 14 23.921 18.223 8.561 1.00 1.00 O ATOM 1181 C2' DG C 14 22.507 16.872 7.013 1.00 1.00 C ATOM 1182 C1' DG C 14 23.374 16.955 5.761 1.00 1.00 C ATOM 1183 N9 DG C 14 22.782 16.279 4.593 1.00 1.00 N ATOM 1184 C8 DG C 14 22.155 15.065 4.559 1.00 1.00 C ATOM 1185 N7 DG C 14 21.787 14.673 3.369 1.00 1.00 N ATOM 1186 C5 DG C 14 22.175 15.741 2.548 1.00 1.00 C ATOM 1187 C6 DG C 14 22.032 15.960 1.131 1.00 1.00 C ATOM 1188 O6 DG C 14 21.577 15.211 0.268 1.00 1.00 O ATOM 1189 N1 DG C 14 22.475 17.196 0.715 1.00 1.00 N ATOM 1190 C2 DG C 14 23.046 18.104 1.538 1.00 1.00 C ATOM 1191 N2 DG C 14 23.428 19.226 0.991 1.00 1.00 N ATOM 1192 N3 DG C 14 23.240 17.939 2.844 1.00 1.00 N ATOM 1193 C4 DG C 14 22.767 16.737 3.297 1.00 1.00 C ATOM 0 H5' DG C 14 25.569 14.228 7.226 1.00 1.00 H new ATOM 0 H5'' DG C 14 25.290 14.665 8.900 1.00 1.00 H new ATOM 0 H4' DG C 14 25.642 16.671 7.845 1.00 1.00 H new ATOM 0 H3' DG C 14 23.141 16.464 9.062 1.00 1.00 H new ATOM 0 H2' DG C 14 21.916 15.956 7.034 1.00 1.00 H new ATOM 0 H2'' DG C 14 21.807 17.705 7.074 1.00 1.00 H new ATOM 0 H1' DG C 14 23.483 18.004 5.487 1.00 1.00 H new ATOM 0 H8 DG C 14 21.978 14.476 5.447 1.00 1.00 H new ATOM 0 H1 DG C 14 22.366 17.440 -0.269 1.00 1.00 H new ATOM 0 H21 DG C 14 23.865 19.949 1.562 1.00 1.00 H new ATOM 0 H22 DG C 14 23.289 19.380 -0.008 1.00 1.00 H new ATOM 1205 P DC C 15 22.916 19.252 9.322 1.00 1.00 P ATOM 1206 OP1 DC C 15 23.754 20.258 10.033 1.00 1.00 O ATOM 1207 OP2 DC C 15 21.927 18.468 10.116 1.00 1.00 O ATOM 1208 O5' DC C 15 22.133 19.995 8.112 1.00 1.00 O ATOM 1209 C5' DC C 15 22.835 20.824 7.188 1.00 1.00 C ATOM 1210 C4' DC C 15 22.055 21.109 5.895 1.00 1.00 C ATOM 1211 O4' DC C 15 21.845 19.923 5.148 1.00 1.00 O ATOM 1212 C3' DC C 15 20.682 21.771 6.102 1.00 1.00 C ATOM 1213 O3' DC C 15 20.802 23.188 5.953 1.00 1.00 O ATOM 1214 C2' DC C 15 19.814 21.092 5.032 1.00 1.00 C ATOM 1215 C1' DC C 15 20.768 20.177 4.269 1.00 1.00 C ATOM 1216 N1 DC C 15 20.110 18.918 3.854 1.00 1.00 N ATOM 1217 C2 DC C 15 19.817 18.695 2.503 1.00 1.00 C ATOM 1218 O2 DC C 15 20.040 19.538 1.633 1.00 1.00 O ATOM 1219 N3 DC C 15 19.281 17.523 2.098 1.00 1.00 N ATOM 1220 C4 DC C 15 19.014 16.615 3.010 1.00 1.00 C ATOM 1221 N4 DC C 15 18.522 15.500 2.551 1.00 1.00 N ATOM 1222 C5 DC C 15 19.248 16.796 4.405 1.00 1.00 C ATOM 1223 C6 DC C 15 19.797 17.974 4.790 1.00 1.00 C ATOM 0 H5' DC C 15 23.782 20.347 6.933 1.00 1.00 H new ATOM 0 H5'' DC C 15 23.075 21.770 7.673 1.00 1.00 H new ATOM 0 H4' DC C 15 22.691 21.815 5.360 1.00 1.00 H new ATOM 0 H3' DC C 15 20.246 21.645 7.093 1.00 1.00 H new ATOM 0 H2' DC C 15 19.001 20.524 5.485 1.00 1.00 H new ATOM 0 H2'' DC C 15 19.358 21.827 4.369 1.00 1.00 H new ATOM 0 H1' DC C 15 21.105 20.649 3.346 1.00 1.00 H new ATOM 0 H41 DC C 15 18.287 14.743 3.194 1.00 1.00 H new ATOM 0 H42 DC C 15 18.371 15.383 1.549 1.00 1.00 H new ATOM 0 H5 DC C 15 18.999 16.029 5.123 1.00 1.00 H new ATOM 0 H6 DC C 15 19.987 18.166 5.836 1.00 1.00 H new ATOM 1235 P DA C 16 19.541 24.208 6.086 1.00 1.00 P ATOM 1236 OP1 DA C 16 20.085 25.578 6.308 1.00 1.00 O ATOM 1237 OP2 DA C 16 18.578 23.662 7.084 1.00 1.00 O ATOM 1238 O5' DA C 16 18.838 24.170 4.622 1.00 1.00 O ATOM 1239 C5' DA C 16 19.569 24.517 3.445 1.00 1.00 C ATOM 1240 C4' DA C 16 18.770 24.353 2.136 1.00 1.00 C ATOM 1241 O4' DA C 16 18.601 22.984 1.767 1.00 1.00 O ATOM 1242 C3' DA C 16 17.378 25.013 2.205 1.00 1.00 C ATOM 1243 O3' DA C 16 17.162 25.840 1.062 1.00 1.00 O ATOM 1244 C2' DA C 16 16.480 23.778 2.288 1.00 1.00 C ATOM 1245 C1' DA C 16 17.238 22.773 1.431 1.00 1.00 C ATOM 1246 N9 DA C 16 16.871 21.386 1.762 1.00 1.00 N ATOM 1247 C8 DA C 16 16.902 20.826 3.006 1.00 1.00 C ATOM 1248 N7 DA C 16 16.669 19.542 3.034 1.00 1.00 N ATOM 1249 C5 DA C 16 16.386 19.261 1.686 1.00 1.00 C ATOM 1250 C6 DA C 16 16.007 18.099 0.968 1.00 1.00 C ATOM 1251 N6 DA C 16 15.911 16.899 1.498 1.00 1.00 N ATOM 1252 N1 DA C 16 15.681 18.149 -0.326 1.00 1.00 N ATOM 1253 C2 DA C 16 15.757 19.323 -0.936 1.00 1.00 C ATOM 1254 N3 DA C 16 16.149 20.484 -0.419 1.00 1.00 N ATOM 1255 C4 DA C 16 16.454 20.388 0.908 1.00 1.00 C ATOM 0 H5' DA C 16 20.465 23.898 3.391 1.00 1.00 H new ATOM 0 H5'' DA C 16 19.901 25.552 3.528 1.00 1.00 H new ATOM 0 H4' DA C 16 19.369 24.859 1.379 1.00 1.00 H new ATOM 0 H3' DA C 16 17.206 25.700 3.034 1.00 1.00 H new ATOM 0 H2' DA C 16 16.360 23.430 3.314 1.00 1.00 H new ATOM 0 H2'' DA C 16 15.481 23.974 1.899 1.00 1.00 H new ATOM 0 H1' DA C 16 17.018 22.911 0.372 1.00 1.00 H new ATOM 0 H8 DA C 16 17.104 21.401 3.898 1.00 1.00 H new ATOM 0 H61 DA C 16 15.632 16.107 0.919 1.00 1.00 H new ATOM 0 H62 DA C 16 16.116 16.761 2.488 1.00 1.00 H new ATOM 0 H2 DA C 16 15.466 19.339 -1.976 1.00 1.00 H new ATOM 1267 P DT C 17 15.869 26.815 0.916 1.00 1.00 P ATOM 1268 OP1 DT C 17 16.208 27.868 -0.084 1.00 1.00 O ATOM 1269 OP2 DT C 17 15.424 27.247 2.271 1.00 1.00 O ATOM 1270 O5' DT C 17 14.726 25.855 0.285 1.00 1.00 O ATOM 1271 C5' DT C 17 14.848 25.354 -1.044 1.00 1.00 C ATOM 1272 C4' DT C 17 13.791 24.298 -1.406 1.00 1.00 C ATOM 1273 O4' DT C 17 14.027 23.078 -0.712 1.00 1.00 O ATOM 1274 C3' DT C 17 12.338 24.736 -1.133 1.00 1.00 C ATOM 1275 O3' DT C 17 11.612 24.764 -2.359 1.00 1.00 O ATOM 1276 C2' DT C 17 11.862 23.674 -0.134 1.00 1.00 C ATOM 1277 C1' DT C 17 12.769 22.489 -0.464 1.00 1.00 C ATOM 1278 N1 DT C 17 12.881 21.470 0.614 1.00 1.00 N ATOM 1279 C2 DT C 17 12.718 20.121 0.268 1.00 1.00 C ATOM 1280 O2 DT C 17 12.457 19.708 -0.863 1.00 1.00 O ATOM 1281 N3 DT C 17 12.876 19.210 1.284 1.00 1.00 N ATOM 1282 C4 DT C 17 13.175 19.491 2.595 1.00 1.00 C ATOM 1283 O4 DT C 17 13.328 18.550 3.373 1.00 1.00 O ATOM 1284 C5 DT C 17 13.291 20.915 2.899 1.00 1.00 C ATOM 1285 C7 DT C 17 13.572 21.378 4.314 1.00 1.00 C ATOM 1286 C6 DT C 17 13.160 21.843 1.916 1.00 1.00 C ATOM 0 H5' DT C 17 15.840 24.920 -1.170 1.00 1.00 H new ATOM 0 H5'' DT C 17 14.773 26.186 -1.745 1.00 1.00 H new ATOM 0 H4' DT C 17 13.897 24.162 -2.482 1.00 1.00 H new ATOM 0 H3' DT C 17 12.209 25.740 -0.728 1.00 1.00 H new ATOM 0 H2' DT C 17 11.982 24.003 0.898 1.00 1.00 H new ATOM 0 H2'' DT C 17 10.808 23.430 -0.270 1.00 1.00 H new ATOM 0 H1' DT C 17 12.358 21.931 -1.305 1.00 1.00 H new ATOM 0 H3 DT C 17 12.760 18.226 1.041 1.00 1.00 H new ATOM 0 H71 DT C 17 14.129 22.314 4.287 1.00 1.00 H new ATOM 0 H72 DT C 17 12.630 21.532 4.840 1.00 1.00 H new ATOM 0 H73 DT C 17 14.159 20.622 4.834 1.00 1.00 H new ATOM 0 H6 DT C 17 13.276 22.890 2.155 1.00 1.00 H new ATOM 1299 P DA C 18 10.079 25.285 -2.455 1.00 1.00 P ATOM 1300 OP1 DA C 18 9.802 25.636 -3.877 1.00 1.00 O ATOM 1301 OP2 DA C 18 9.841 26.320 -1.411 1.00 1.00 O ATOM 1302 O5' DA C 18 9.219 23.965 -2.081 1.00 1.00 O ATOM 1303 C5' DA C 18 9.307 22.793 -2.880 1.00 1.00 C ATOM 1304 C4' DA C 18 8.438 21.633 -2.378 1.00 1.00 C ATOM 1305 O4' DA C 18 9.086 20.894 -1.356 1.00 1.00 O ATOM 1306 C3' DA C 18 7.045 22.030 -1.862 1.00 1.00 C ATOM 1307 O3' DA C 18 6.133 21.435 -2.776 1.00 1.00 O ATOM 1308 C2' DA C 18 7.054 21.490 -0.428 1.00 1.00 C ATOM 1309 C1' DA C 18 8.100 20.384 -0.481 1.00 1.00 C ATOM 1310 N9 DA C 18 8.765 20.029 0.791 1.00 1.00 N ATOM 1311 C8 DA C 18 9.137 20.846 1.825 1.00 1.00 C ATOM 1312 N7 DA C 18 9.700 20.224 2.835 1.00 1.00 N ATOM 1313 C5 DA C 18 9.686 18.881 2.423 1.00 1.00 C ATOM 1314 C6 DA C 18 10.068 17.638 2.995 1.00 1.00 C ATOM 1315 N6 DA C 18 10.558 17.444 4.206 1.00 1.00 N ATOM 1316 N1 DA C 18 9.946 16.501 2.316 1.00 1.00 N ATOM 1317 C2 DA C 18 9.473 16.559 1.086 1.00 1.00 C ATOM 1318 N3 DA C 18 9.041 17.625 0.427 1.00 1.00 N ATOM 1319 C4 DA C 18 9.163 18.766 1.161 1.00 1.00 C ATOM 0 H5' DA C 18 10.346 22.467 -2.916 1.00 1.00 H new ATOM 0 H5'' DA C 18 9.014 23.038 -3.901 1.00 1.00 H new ATOM 0 H4' DA C 18 8.294 21.028 -3.273 1.00 1.00 H new ATOM 0 H3' DA C 18 6.768 23.083 -1.818 1.00 1.00 H new ATOM 0 H2' DA C 18 7.321 22.263 0.292 1.00 1.00 H new ATOM 0 H2'' DA C 18 6.076 21.106 -0.136 1.00 1.00 H new ATOM 0 H1' DA C 18 7.599 19.463 -0.781 1.00 1.00 H new ATOM 0 H8 DA C 18 8.980 21.914 1.811 1.00 1.00 H new ATOM 0 H61 DA C 18 10.799 16.502 4.514 1.00 1.00 H new ATOM 0 H62 DA C 18 10.695 18.236 4.834 1.00 1.00 H new ATOM 0 H2 DA C 18 9.433 15.622 0.550 1.00 1.00 H new ATOM 1331 P DT C 19 4.545 21.517 -2.639 1.00 1.00 P ATOM 1332 OP1 DT C 19 3.981 21.207 -3.972 1.00 1.00 O ATOM 1333 OP2 DT C 19 4.139 22.752 -1.936 1.00 1.00 O ATOM 1334 O5' DT C 19 4.294 20.255 -1.747 1.00 1.00 O ATOM 1335 C5' DT C 19 4.579 18.949 -2.215 1.00 1.00 C ATOM 1336 C4' DT C 19 4.053 17.936 -1.203 1.00 1.00 C ATOM 1337 O4' DT C 19 5.042 17.783 -0.202 1.00 1.00 O ATOM 1338 C3' DT C 19 2.758 18.416 -0.505 1.00 1.00 C ATOM 1339 O3' DT C 19 1.815 17.391 -0.351 1.00 1.00 O ATOM 1340 C2' DT C 19 3.259 18.829 0.863 1.00 1.00 C ATOM 1341 C1' DT C 19 4.376 17.795 1.034 1.00 1.00 C ATOM 1342 N1 DT C 19 5.346 18.054 2.122 1.00 1.00 N ATOM 1343 C2 DT C 19 5.804 16.955 2.856 1.00 1.00 C ATOM 1344 O2 DT C 19 5.498 15.788 2.612 1.00 1.00 O ATOM 1345 N3 DT C 19 6.621 17.231 3.924 1.00 1.00 N ATOM 1346 C4 DT C 19 6.939 18.481 4.395 1.00 1.00 C ATOM 1347 O4 DT C 19 7.626 18.556 5.411 1.00 1.00 O ATOM 1348 C5 DT C 19 6.404 19.591 3.600 1.00 1.00 C ATOM 1349 C7 DT C 19 6.636 21.032 4.021 1.00 1.00 C ATOM 1350 C6 DT C 19 5.680 19.339 2.479 1.00 1.00 C ATOM 0 H5' DT C 19 5.653 18.823 -2.351 1.00 1.00 H new ATOM 0 H5'' DT C 19 4.114 18.787 -3.187 1.00 1.00 H new ATOM 0 H4' DT C 19 3.832 17.009 -1.732 1.00 1.00 H new ATOM 0 H3' DT C 19 2.256 19.197 -1.076 1.00 1.00 H new ATOM 0 H2' DT C 19 3.628 19.854 0.884 1.00 1.00 H new ATOM 0 H2'' DT C 19 2.492 18.751 1.633 1.00 1.00 H new ATOM 0 H1' DT C 19 3.925 16.846 1.324 1.00 1.00 H new ATOM 0 H3 DT C 19 7.029 16.434 4.413 1.00 1.00 H new ATOM 0 H71 DT C 19 6.666 21.669 3.137 1.00 1.00 H new ATOM 0 H72 DT C 19 5.825 21.355 4.674 1.00 1.00 H new ATOM 0 H73 DT C 19 7.584 21.107 4.554 1.00 1.00 H new ATOM 0 H6 DT C 19 5.361 20.162 1.857 1.00 1.00 H new ATOM 1363 P DA C 20 0.779 17.056 -1.534 1.00 1.00 P ATOM 1364 OP1 DA C 20 1.533 17.032 -2.815 1.00 1.00 O ATOM 1365 OP2 DA C 20 -0.380 17.979 -1.413 1.00 1.00 O ATOM 1366 O5' DA C 20 0.389 15.569 -1.062 1.00 1.00 O ATOM 1367 C5' DA C 20 -0.318 15.397 0.158 1.00 1.00 C ATOM 1368 C4' DA C 20 0.009 14.068 0.839 1.00 1.00 C ATOM 1369 O4' DA C 20 1.286 14.167 1.475 1.00 1.00 O ATOM 1370 C3' DA C 20 -1.043 13.849 1.927 1.00 1.00 C ATOM 1371 O3' DA C 20 -1.438 12.488 2.003 1.00 1.00 O ATOM 1372 C2' DA C 20 -0.314 14.386 3.151 1.00 1.00 C ATOM 1373 C1' DA C 20 1.151 14.081 2.882 1.00 1.00 C ATOM 1374 N9 DA C 20 2.004 15.093 3.550 1.00 1.00 N ATOM 1375 C8 DA C 20 2.111 16.423 3.221 1.00 1.00 C ATOM 1376 N7 DA C 20 2.823 17.142 4.045 1.00 1.00 N ATOM 1377 C5 DA C 20 3.235 16.196 4.990 1.00 1.00 C ATOM 1378 C6 DA C 20 4.040 16.252 6.152 1.00 1.00 C ATOM 1379 N6 DA C 20 4.625 17.354 6.579 1.00 1.00 N ATOM 1380 N1 DA C 20 4.274 15.173 6.905 1.00 1.00 N ATOM 1381 C2 DA C 20 3.716 14.038 6.505 1.00 1.00 C ATOM 1382 N3 DA C 20 2.933 13.820 5.452 1.00 1.00 N ATOM 1383 C4 DA C 20 2.737 14.951 4.712 1.00 1.00 C ATOM 0 H5' DA C 20 -1.389 15.449 -0.036 1.00 1.00 H new ATOM 0 H5'' DA C 20 -0.076 16.217 0.834 1.00 1.00 H new ATOM 0 H4' DA C 20 0.018 13.255 0.113 1.00 1.00 H new ATOM 0 H3' DA C 20 -1.999 14.348 1.770 1.00 1.00 H new ATOM 0 H2' DA C 20 -0.481 15.456 3.275 1.00 1.00 H new ATOM 0 H2'' DA C 20 -0.660 13.901 4.064 1.00 1.00 H new ATOM 0 H1' DA C 20 1.454 13.105 3.261 1.00 1.00 H new ATOM 0 H8 DA C 20 1.640 16.843 2.344 1.00 1.00 H new ATOM 0 H61 DA C 20 5.195 17.334 7.425 1.00 1.00 H new ATOM 0 H62 DA C 20 4.508 18.226 6.063 1.00 1.00 H new ATOM 0 H2 DA C 20 3.926 13.174 7.117 1.00 1.00 H new ATOM 1395 P DT C 21 -2.749 12.045 2.820 1.00 1.00 P ATOM 1396 OP1 DT C 21 -3.227 10.748 2.280 1.00 1.00 O ATOM 1397 OP2 DT C 21 -3.716 13.174 2.813 1.00 1.00 O ATOM 1398 O5' DT C 21 -2.201 11.836 4.310 1.00 1.00 O ATOM 1399 C5' DT C 21 -1.258 10.814 4.583 1.00 1.00 C ATOM 1400 C4' DT C 21 -1.039 10.598 6.083 1.00 1.00 C ATOM 1401 O4' DT C 21 -0.157 11.585 6.587 1.00 1.00 O ATOM 1402 C3' DT C 21 -2.325 10.658 6.905 1.00 1.00 C ATOM 1403 O3' DT C 21 -2.245 9.636 7.881 1.00 1.00 O ATOM 1404 C2' DT C 21 -2.299 12.069 7.479 1.00 1.00 C ATOM 1405 C1' DT C 21 -0.798 12.307 7.624 1.00 1.00 C ATOM 1406 N1 DT C 21 -0.316 13.716 7.545 1.00 1.00 N ATOM 1407 C2 DT C 21 0.771 14.061 8.361 1.00 1.00 C ATOM 1408 O2 DT C 21 1.338 13.267 9.118 1.00 1.00 O ATOM 1409 N3 DT C 21 1.237 15.350 8.280 1.00 1.00 N ATOM 1410 C4 DT C 21 0.764 16.313 7.420 1.00 1.00 C ATOM 1411 O4 DT C 21 1.321 17.407 7.393 1.00 1.00 O ATOM 1412 C5 DT C 21 -0.354 15.896 6.578 1.00 1.00 C ATOM 1413 C7 DT C 21 -0.973 16.889 5.611 1.00 1.00 C ATOM 1414 C6 DT C 21 -0.845 14.631 6.651 1.00 1.00 C ATOM 0 H5' DT C 21 -0.307 11.068 4.114 1.00 1.00 H new ATOM 0 H5'' DT C 21 -1.598 9.882 4.132 1.00 1.00 H new ATOM 0 H4' DT C 21 -0.625 9.595 6.181 1.00 1.00 H new ATOM 0 H3' DT C 21 -3.258 10.490 6.367 1.00 1.00 H new ATOM 0 H2' DT C 21 -2.767 12.793 6.812 1.00 1.00 H new ATOM 0 H2'' DT C 21 -2.819 12.133 8.435 1.00 1.00 H new ATOM 0 H1' DT C 21 -0.559 11.985 8.638 1.00 1.00 H new ATOM 0 H3 DT C 21 1.995 15.615 8.909 1.00 1.00 H new ATOM 0 H71 DT C 21 -0.874 17.898 6.012 1.00 1.00 H new ATOM 0 H72 DT C 21 -0.461 16.829 4.650 1.00 1.00 H new ATOM 0 H73 DT C 21 -2.029 16.655 5.475 1.00 1.00 H new ATOM 0 H6 DT C 21 -1.658 14.336 6.004 1.00 1.00 H new ATOM 1427 P DG C 22 -3.461 9.251 8.838 1.00 1.00 P ATOM 1428 OP1 DG C 22 -3.291 7.817 9.172 1.00 1.00 O ATOM 1429 OP2 DG C 22 -4.749 9.689 8.247 1.00 1.00 O ATOM 1430 O5' DG C 22 -3.132 10.125 10.133 1.00 1.00 O ATOM 1431 C5' DG C 22 -2.026 9.799 10.957 1.00 1.00 C ATOM 1432 C4' DG C 22 -1.741 10.861 12.023 1.00 1.00 C ATOM 1433 O4' DG C 22 -1.140 12.006 11.429 1.00 1.00 O ATOM 1434 C3' DG C 22 -2.991 11.314 12.805 1.00 1.00 C ATOM 1435 O3' DG C 22 -2.748 11.143 14.200 1.00 1.00 O ATOM 1436 C2' DG C 22 -3.114 12.772 12.360 1.00 1.00 C ATOM 1437 C1' DG C 22 -1.656 13.130 12.111 1.00 1.00 C ATOM 1438 N9 DG C 22 -1.476 14.366 11.331 1.00 1.00 N ATOM 1439 C8 DG C 22 -2.111 14.730 10.177 1.00 1.00 C ATOM 1440 N7 DG C 22 -1.754 15.900 9.712 1.00 1.00 N ATOM 1441 C5 DG C 22 -0.830 16.361 10.668 1.00 1.00 C ATOM 1442 C6 DG C 22 -0.076 17.588 10.766 1.00 1.00 C ATOM 1443 O6 DG C 22 -0.007 18.529 9.975 1.00 1.00 O ATOM 1444 N1 DG C 22 0.658 17.692 11.927 1.00 1.00 N ATOM 1445 C2 DG C 22 0.718 16.720 12.864 1.00 1.00 C ATOM 1446 N2 DG C 22 1.447 16.963 13.918 1.00 1.00 N ATOM 1447 N3 DG C 22 0.093 15.549 12.796 1.00 1.00 N ATOM 1448 C4 DG C 22 -0.680 15.432 11.674 1.00 1.00 C ATOM 0 H5' DG C 22 -1.141 9.671 10.334 1.00 1.00 H new ATOM 0 H5'' DG C 22 -2.213 8.843 11.445 1.00 1.00 H new ATOM 0 H4' DG C 22 -1.067 10.386 12.735 1.00 1.00 H new ATOM 0 H3' DG C 22 -3.912 10.762 12.621 1.00 1.00 H new ATOM 0 H2' DG C 22 -3.723 12.878 11.462 1.00 1.00 H new ATOM 0 H2'' DG C 22 -3.566 13.400 13.128 1.00 1.00 H new ATOM 0 H1' DG C 22 -1.138 13.341 13.046 1.00 1.00 H new ATOM 0 H8 DG C 22 -2.845 14.105 9.690 1.00 1.00 H new ATOM 0 H1 DG C 22 1.185 18.550 12.088 1.00 1.00 H new ATOM 0 H21 DG C 22 1.526 16.263 14.656 1.00 1.00 H new ATOM 0 H22 DG C 22 1.938 17.853 14.005 1.00 1.00 H new ATOM 1460 P DC C 23 -3.854 11.452 15.351 1.00 1.00 P ATOM 1461 OP1 DC C 23 -3.831 10.322 16.324 1.00 1.00 O ATOM 1462 OP2 DC C 23 -5.156 11.822 14.725 1.00 1.00 O ATOM 1463 O5' DC C 23 -3.244 12.772 16.070 1.00 1.00 O ATOM 1464 C5' DC C 23 -1.994 12.711 16.756 1.00 1.00 C ATOM 1465 C4' DC C 23 -1.583 14.018 17.458 1.00 1.00 C ATOM 1466 O4' DC C 23 -1.207 15.005 16.499 1.00 1.00 O ATOM 1467 C3' DC C 23 -2.696 14.585 18.360 1.00 1.00 C ATOM 1468 O3' DC C 23 -2.161 14.989 19.621 1.00 1.00 O ATOM 1469 C2' DC C 23 -3.236 15.730 17.501 1.00 1.00 C ATOM 1470 C1' DC C 23 -2.017 16.156 16.675 1.00 1.00 C ATOM 1471 N1 DC C 23 -2.357 16.732 15.350 1.00 1.00 N ATOM 1472 C2 DC C 23 -1.835 17.973 14.957 1.00 1.00 C ATOM 1473 O2 DC C 23 -1.115 18.651 15.691 1.00 1.00 O ATOM 1474 N3 DC C 23 -2.121 18.486 13.735 1.00 1.00 N ATOM 1475 C4 DC C 23 -2.905 17.789 12.938 1.00 1.00 C ATOM 1476 N4 DC C 23 -3.109 18.312 11.763 1.00 1.00 N ATOM 1477 C5 DC C 23 -3.465 16.525 13.274 1.00 1.00 C ATOM 1478 C6 DC C 23 -3.159 16.029 14.498 1.00 1.00 C ATOM 0 H5' DC C 23 -1.216 12.437 16.043 1.00 1.00 H new ATOM 0 H5'' DC C 23 -2.041 11.914 17.499 1.00 1.00 H new ATOM 0 H4' DC C 23 -0.733 13.771 18.094 1.00 1.00 H new ATOM 0 H3' DC C 23 -3.483 13.884 18.639 1.00 1.00 H new ATOM 0 H2' DC C 23 -4.058 15.403 16.865 1.00 1.00 H new ATOM 0 H2'' DC C 23 -3.613 16.549 18.113 1.00 1.00 H new ATOM 0 H1' DC C 23 -1.504 16.951 17.216 1.00 1.00 H new ATOM 0 H41 DC C 23 -3.705 17.833 11.088 1.00 1.00 H new ATOM 0 H42 DC C 23 -2.673 19.201 11.518 1.00 1.00 H new ATOM 0 H5 DC C 23 -4.102 15.987 12.588 1.00 1.00 H new ATOM 0 H6 DC C 23 -3.553 15.070 14.801 1.00 1.00 H new ATOM 1490 P DG C 24 -3.108 15.353 20.892 1.00 1.00 P ATOM 1491 OP1 DG C 24 -2.260 15.302 22.116 1.00 1.00 O ATOM 1492 OP2 DG C 24 -4.334 14.507 20.843 1.00 1.00 O ATOM 1493 O5' DG C 24 -3.545 16.891 20.635 1.00 1.00 O ATOM 1494 C5' DG C 24 -2.610 17.954 20.791 1.00 1.00 C ATOM 1495 C4' DG C 24 -3.062 19.264 20.125 1.00 1.00 C ATOM 1496 O4' DG C 24 -2.993 19.189 18.710 1.00 1.00 O ATOM 1497 C3' DG C 24 -4.491 19.722 20.454 1.00 1.00 C ATOM 1498 O3' DG C 24 -4.544 20.566 21.604 1.00 1.00 O ATOM 1499 C2' DG C 24 -4.913 20.486 19.200 1.00 1.00 C ATOM 1500 C1' DG C 24 -3.750 20.278 18.220 1.00 1.00 C ATOM 1501 N9 DG C 24 -4.211 20.032 16.843 1.00 1.00 N ATOM 1502 C8 DG C 24 -5.006 19.014 16.395 1.00 1.00 C ATOM 1503 N7 DG C 24 -5.342 19.105 15.133 1.00 1.00 N ATOM 1504 C5 DG C 24 -4.722 20.297 14.716 1.00 1.00 C ATOM 1505 C6 DG C 24 -4.719 20.999 13.454 1.00 1.00 C ATOM 1506 O6 DG C 24 -5.262 20.706 12.387 1.00 1.00 O ATOM 1507 N1 DG C 24 -3.999 22.176 13.481 1.00 1.00 N ATOM 1508 C2 DG C 24 -3.358 22.644 14.577 1.00 1.00 C ATOM 1509 N2 DG C 24 -2.718 23.774 14.457 1.00 1.00 N ATOM 1510 N3 DG C 24 -3.328 22.042 15.760 1.00 1.00 N ATOM 1511 C4 DG C 24 -4.029 20.866 15.766 1.00 1.00 C ATOM 0 H5' DG C 24 -1.652 17.651 20.368 1.00 1.00 H new ATOM 0 H5'' DG C 24 -2.447 18.132 21.854 1.00 1.00 H new ATOM 0 H4' DG C 24 -2.362 19.987 20.542 1.00 1.00 H new ATOM 0 H3' DG C 24 -5.143 18.883 20.697 1.00 1.00 H new ATOM 0 H2' DG C 24 -5.848 20.100 18.795 1.00 1.00 H new ATOM 0 H2'' DG C 24 -5.070 21.544 19.412 1.00 1.00 H new ATOM 0 HO3' DG C 24 -5.472 20.832 21.772 1.00 1.00 H new ATOM 0 H1' DG C 24 -3.146 21.183 18.163 1.00 1.00 H new ATOM 0 H8 DG C 24 -5.330 18.202 17.029 1.00 1.00 H new ATOM 0 H1 DG C 24 -3.947 22.726 12.624 1.00 1.00 H new ATOM 0 H21 DG C 24 -2.220 24.166 15.257 1.00 1.00 H new ATOM 0 H22 DG C 24 -2.715 24.266 13.564 1.00 1.00 H new TER 1524 DG C 24