USER MOD reduce.3.24.130724 H: found=0, std=0, add=1491, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1491 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 18 GLN : amide:sc= -4.22! C(o=-2.7!,f=-2.8!) USER MOD Set 1.2: A 21 SER OG : rot 101:sc= 1.07 USER MOD Set 1.3: A 25 ASN : amide:sc= 0.972 K(o=-2.7,f=-3.6) USER MOD Set 1.4: A 54 GLN : amide:sc= 1.25 K(o=-2.7,f=-4.1) USER MOD Set 1.5: D 15 DT C7 :methyl -30:sc= -1.82 (180deg=-2.7!) USER MOD Set 2.1: B 18 GLN : amide:sc= -2.15 K(o=-10,f=-14!) USER MOD Set 2.2: D 7 DT C7 :methyl 150:sc= -7.34! (180deg=-7.02!) USER MOD Set 2.3: D 8 DT C7 :methyl -30:sc= -0.511 (180deg=-2.59!) USER MOD Set 3.1: B 29 HIS : no HD1:sc= -4.77! C(o=-17!,f=-16!) USER MOD Set 3.2: D 4 DT C7 :methyl 150:sc= -8.36! (180deg=-4.51!) USER MOD Set 3.3: D 5 DT C7 :methyl 150:sc= -4.06! (180deg=-4.06!) USER MOD Set 4.1: B 47 TYR OH : rot 180:sc= -0.729 USER MOD Set 4.2: B 54 GLN : amide:sc= -1.02 K(o=-1.7,f=-3.4!) USER MOD Set 5.1: B 31 SER OG : rot 64:sc= 0.557 USER MOD Set 5.2: B 34 THR OG1 : rot 50:sc= 1.44 USER MOD Set 6.1: B 17 TYR OH : rot -167:sc= 0.562 USER MOD Set 6.2: B 21 SER OG : rot 84:sc= 1 USER MOD Set 6.3: B 25 ASN : amide:sc= -0.37 K(o=-4.9,f=-9.4!) USER MOD Set 6.4: C 15 DT C7 :methyl -30:sc= -6.1! (180deg=-8.95!) USER MOD Set 7.1: B 16 SER OG : rot -46:sc= 1.3 USER MOD Set 7.2: B 19 THR OG1 : rot -138:sc= 1.43 USER MOD Set 8.1: A 31 SER OG : rot -12:sc= 0.244 USER MOD Set 8.2: A 34 THR OG1 : rot 150:sc= 0.395 USER MOD Set 9.1: A 29 HIS : no HD1:sc= -2.6! C(o=-18!,f=-17!) USER MOD Set 9.2: C 4 DT C7 :methyl -30:sc= -10.3! (180deg=-4.67!) USER MOD Set 9.3: C 5 DT C7 :methyl 150:sc= -5.16! (180deg=-5.16!) USER MOD Set10.1: A 16 SER OG : rot -71:sc= 1.26 USER MOD Set10.2: A 19 THR OG1 : rot 166:sc= 2.29 USER MOD Set10.3: C 7 DT C7 :methyl 150:sc= -6.62! (180deg=-6.62!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 162:sc= -0.0271 (180deg=-0.255) USER MOD Single : A 5 THR OG1 : rot -90:sc= 0.548 USER MOD Single : A 7 TYR OH : rot 30:sc= 0.377 USER MOD Single : A 12 TYR OH : rot 180:sc= -0.0171 USER MOD Single : A 17 TYR OH : rot 58:sc= 0.406 USER MOD Single : A 26 GLN : amide:sc= -0.33 K(o=-0.33,f=-6.4!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl 156:sc= -3.22! (180deg=-4.72!) USER MOD Single : A 46 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 47 TYR OH : rot -47:sc= 0.965 USER MOD Single : A 50 ASN : amide:sc= -0.137 X(o=-0.14,f=-0.58) USER MOD Single : A 55 GLN : amide:sc= -1.45! K(o=-1.5!,f=-0.099) USER MOD Single : A 59 LYS NZ :NH3+ 155:sc= -0.215 (180deg=-0.86) USER MOD Single : A 60 GLN : amide:sc= -3.14! C(o=-3.1!,f=-3.5!) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -150:sc= 0 (180deg=-0.611) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 THR OG1 : rot -86:sc= -0.443! USER MOD Single : B 7 TYR OH : rot -80:sc= 0.759 USER MOD Single : B 12 TYR OH : rot 180:sc= 0 USER MOD Single : B 26 GLN : amide:sc= 0.666 K(o=0.67,f=-0.27) USER MOD Single : B 28 SER OG : rot 180:sc= 0.0701 USER MOD Single : B 33 LYS NZ :NH3+ -161:sc= -0.0477 (180deg=-0.301) USER MOD Single : B 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 42 MET CE :methyl -116:sc= -0.0853 (180deg=-3.12!) USER MOD Single : B 46 ASN : amide:sc= -1.07 K(o=-1.1,f=-0.13) USER MOD Single : B 50 ASN : amide:sc= -6.6! C(o=-6.6!,f=-12!) USER MOD Single : B 55 GLN : amide:sc= -0.675 X(o=-0.68,f=-0.24) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : B 61 SER OG : rot 180:sc= 0 USER MOD Single : C 1 DG O5' : rot 180:sc= -1.64 USER MOD Single : C 21 DT C7 :methyl -30:sc= -5.77! (180deg=-7.29!) USER MOD Single : C 22 DT C7 :methyl -30:sc= -5.48! (180deg=-5.51!) USER MOD Single : C 23 DT C7 :methyl 150:sc= -3.12! (180deg=-3.12!) USER MOD Single : C 23 DT O3' : rot 180:sc= 0 USER MOD Single : D 1 DA O5' : rot 17:sc= 0.235 USER MOD Single : D 10 DT C7 :methyl -30:sc= -2.36 (180deg=-4.23!) USER MOD Single : D 21 DT C7 :methyl -30:sc= -4.7! (180deg=-6.11!) USER MOD Single : D 22 DT C7 :methyl 150:sc= -5.84! (180deg=-5.84!) USER MOD Single : D 23 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.132 -13.576 16.075 1.00 3.95 N ATOM 2 CA MET A 1 3.501 -13.064 15.833 1.00 3.34 C ATOM 3 C MET A 1 3.459 -11.936 14.811 1.00 2.37 C ATOM 4 O MET A 1 2.995 -12.127 13.685 1.00 2.63 O ATOM 5 CB MET A 1 4.413 -14.188 15.334 1.00 4.16 C ATOM 6 CG MET A 1 5.869 -13.773 15.203 1.00 4.94 C ATOM 7 SD MET A 1 6.864 -15.004 14.344 1.00 5.80 S ATOM 8 CE MET A 1 8.423 -14.137 14.194 1.00 6.41 C ATOM 0 H1 MET A 1 2.168 -14.346 16.773 1.00 3.95 H new ATOM 0 H2 MET A 1 1.533 -12.807 16.437 1.00 3.95 H new ATOM 0 H3 MET A 1 1.733 -13.935 15.184 1.00 3.95 H new ATOM 0 HA MET A 1 3.902 -12.682 16.772 1.00 3.34 H new ATOM 0 HB2 MET A 1 4.344 -15.033 16.020 1.00 4.16 H new ATOM 0 HB3 MET A 1 4.053 -14.534 14.365 1.00 4.16 H new ATOM 0 HG2 MET A 1 5.926 -12.826 14.667 1.00 4.94 H new ATOM 0 HG3 MET A 1 6.285 -13.603 16.196 1.00 4.94 H new ATOM 0 HE1 MET A 1 9.145 -14.772 13.681 1.00 6.41 H new ATOM 0 HE2 MET A 1 8.276 -13.220 13.623 1.00 6.41 H new ATOM 0 HE3 MET A 1 8.799 -13.889 15.187 1.00 6.41 H new ATOM 20 N LYS A 2 3.941 -10.764 15.205 1.00 1.92 N ATOM 21 CA LYS A 2 3.941 -9.597 14.331 1.00 1.46 C ATOM 22 C LYS A 2 4.974 -9.749 13.220 1.00 1.08 C ATOM 23 O LYS A 2 6.149 -9.989 13.490 1.00 1.16 O ATOM 24 CB LYS A 2 4.234 -8.339 15.151 1.00 2.29 C ATOM 25 CG LYS A 2 3.893 -7.039 14.440 1.00 2.81 C ATOM 26 CD LYS A 2 4.441 -5.836 15.194 1.00 3.27 C ATOM 27 CE LYS A 2 3.772 -4.542 14.758 1.00 4.06 C ATOM 28 NZ LYS A 2 2.352 -4.473 15.194 1.00 4.73 N ATOM 0 H LYS A 2 4.339 -10.596 16.129 1.00 1.92 H new ATOM 0 HA LYS A 2 2.957 -9.509 13.870 1.00 1.46 H new ATOM 0 HB2 LYS A 2 3.673 -8.388 16.084 1.00 2.29 H new ATOM 0 HB3 LYS A 2 5.291 -8.329 15.415 1.00 2.29 H new ATOM 0 HG2 LYS A 2 4.303 -7.056 13.430 1.00 2.81 H new ATOM 0 HG3 LYS A 2 2.811 -6.948 14.343 1.00 2.81 H new ATOM 0 HD2 LYS A 2 4.292 -5.979 16.264 1.00 3.27 H new ATOM 0 HD3 LYS A 2 5.516 -5.763 15.029 1.00 3.27 H new ATOM 0 HE2 LYS A 2 4.319 -3.694 15.171 1.00 4.06 H new ATOM 0 HE3 LYS A 2 3.822 -4.456 13.673 1.00 4.06 H new ATOM 0 HZ1 LYS A 2 2.025 -3.487 15.156 1.00 4.73 H new ATOM 0 HZ2 LYS A 2 1.766 -5.057 14.563 1.00 4.73 H new ATOM 0 HZ3 LYS A 2 2.270 -4.827 16.168 1.00 4.73 H new ATOM 42 N PRO A 3 4.541 -9.625 11.954 1.00 0.87 N ATOM 43 CA PRO A 3 5.433 -9.732 10.800 1.00 0.67 C ATOM 44 C PRO A 3 6.447 -8.596 10.784 1.00 0.57 C ATOM 45 O PRO A 3 6.079 -7.417 10.799 1.00 0.62 O ATOM 46 CB PRO A 3 4.491 -9.634 9.590 1.00 0.89 C ATOM 47 CG PRO A 3 3.128 -9.885 10.134 1.00 1.30 C ATOM 48 CD PRO A 3 3.151 -9.382 11.547 1.00 1.15 C ATOM 0 HA PRO A 3 6.015 -10.654 10.809 1.00 0.67 H new ATOM 0 HB2 PRO A 3 4.553 -8.652 9.121 1.00 0.89 H new ATOM 0 HB3 PRO A 3 4.752 -10.368 8.828 1.00 0.89 H new ATOM 0 HG2 PRO A 3 2.371 -9.365 9.547 1.00 1.30 H new ATOM 0 HG3 PRO A 3 2.884 -10.947 10.101 1.00 1.30 H new ATOM 0 HD2 PRO A 3 2.891 -8.325 11.605 1.00 1.15 H new ATOM 0 HD3 PRO A 3 2.444 -9.919 12.179 1.00 1.15 H new ATOM 56 N VAL A 4 7.719 -8.955 10.772 1.00 0.48 N ATOM 57 CA VAL A 4 8.789 -7.979 10.766 1.00 0.41 C ATOM 58 C VAL A 4 9.001 -7.440 9.362 1.00 0.36 C ATOM 59 O VAL A 4 9.062 -8.201 8.394 1.00 0.37 O ATOM 60 CB VAL A 4 10.090 -8.594 11.306 1.00 0.42 C ATOM 61 CG1 VAL A 4 11.230 -7.588 11.276 1.00 0.39 C ATOM 62 CG2 VAL A 4 9.870 -9.109 12.719 1.00 0.54 C ATOM 0 H VAL A 4 8.035 -9.925 10.766 1.00 0.48 H new ATOM 0 HA VAL A 4 8.505 -7.154 11.419 1.00 0.41 H new ATOM 0 HB VAL A 4 10.369 -9.428 10.662 1.00 0.42 H new ATOM 0 HG11 VAL A 4 12.136 -8.053 11.664 1.00 0.39 H new ATOM 0 HG12 VAL A 4 11.400 -7.262 10.250 1.00 0.39 H new ATOM 0 HG13 VAL A 4 10.972 -6.727 11.892 1.00 0.39 H new ATOM 0 HG21 VAL A 4 10.796 -9.544 13.096 1.00 0.54 H new ATOM 0 HG22 VAL A 4 9.567 -8.284 13.364 1.00 0.54 H new ATOM 0 HG23 VAL A 4 9.089 -9.869 12.712 1.00 0.54 H new ATOM 72 N THR A 5 9.127 -6.128 9.264 1.00 0.33 N ATOM 73 CA THR A 5 9.292 -5.474 7.985 1.00 0.31 C ATOM 74 C THR A 5 10.710 -4.953 7.828 1.00 0.26 C ATOM 75 O THR A 5 11.522 -5.062 8.747 1.00 0.26 O ATOM 76 CB THR A 5 8.290 -4.306 7.842 1.00 0.36 C ATOM 77 OG1 THR A 5 8.879 -3.085 8.302 1.00 0.37 O ATOM 78 CG2 THR A 5 7.028 -4.576 8.649 1.00 0.41 C ATOM 0 H THR A 5 9.118 -5.494 10.063 1.00 0.33 H new ATOM 0 HA THR A 5 9.098 -6.208 7.203 1.00 0.31 H new ATOM 0 HB THR A 5 8.032 -4.216 6.787 1.00 0.36 H new ATOM 0 HG1 THR A 5 8.695 -2.973 9.258 1.00 0.37 H new ATOM 0 HG21 THR A 5 6.337 -3.741 8.534 1.00 0.41 H new ATOM 0 HG22 THR A 5 6.555 -5.490 8.290 1.00 0.41 H new ATOM 0 HG23 THR A 5 7.287 -4.690 9.702 1.00 0.41 H new ATOM 86 N LEU A 6 11.010 -4.392 6.664 1.00 0.24 N ATOM 87 CA LEU A 6 12.332 -3.842 6.411 1.00 0.20 C ATOM 88 C LEU A 6 12.567 -2.604 7.273 1.00 0.21 C ATOM 89 O LEU A 6 13.700 -2.157 7.439 1.00 0.20 O ATOM 90 CB LEU A 6 12.511 -3.527 4.921 1.00 0.21 C ATOM 91 CG LEU A 6 11.887 -2.221 4.406 1.00 0.25 C ATOM 92 CD1 LEU A 6 12.095 -2.101 2.908 1.00 0.29 C ATOM 93 CD2 LEU A 6 10.403 -2.152 4.719 1.00 0.29 C ATOM 0 H LEU A 6 10.358 -4.307 5.884 1.00 0.24 H new ATOM 0 HA LEU A 6 13.079 -4.588 6.684 1.00 0.20 H new ATOM 0 HB2 LEU A 6 13.579 -3.500 4.706 1.00 0.21 H new ATOM 0 HB3 LEU A 6 12.091 -4.353 4.347 1.00 0.21 H new ATOM 0 HG LEU A 6 12.382 -1.394 4.915 1.00 0.25 H new ATOM 0 HD11 LEU A 6 11.649 -1.172 2.552 1.00 0.29 H new ATOM 0 HD12 LEU A 6 13.163 -2.099 2.688 1.00 0.29 H new ATOM 0 HD13 LEU A 6 11.623 -2.946 2.406 1.00 0.29 H new ATOM 0 HD21 LEU A 6 9.994 -1.215 4.340 1.00 0.29 H new ATOM 0 HD22 LEU A 6 9.892 -2.989 4.244 1.00 0.29 H new ATOM 0 HD23 LEU A 6 10.256 -2.202 5.798 1.00 0.29 H new ATOM 105 N TYR A 7 11.484 -2.067 7.832 1.00 0.25 N ATOM 106 CA TYR A 7 11.568 -0.904 8.693 1.00 0.28 C ATOM 107 C TYR A 7 12.091 -1.327 10.056 1.00 0.28 C ATOM 108 O TYR A 7 12.855 -0.605 10.693 1.00 0.30 O ATOM 109 CB TYR A 7 10.198 -0.231 8.854 1.00 0.34 C ATOM 110 CG TYR A 7 9.596 0.306 7.571 1.00 0.36 C ATOM 111 CD1 TYR A 7 10.170 1.379 6.901 1.00 0.38 C ATOM 112 CD2 TYR A 7 8.439 -0.251 7.038 1.00 0.41 C ATOM 113 CE1 TYR A 7 9.611 1.876 5.741 1.00 0.43 C ATOM 114 CE2 TYR A 7 7.874 0.243 5.878 1.00 0.44 C ATOM 115 CZ TYR A 7 8.464 1.305 5.232 1.00 0.44 C ATOM 116 OH TYR A 7 7.899 1.807 4.081 1.00 0.49 O ATOM 0 H TYR A 7 10.538 -2.425 7.699 1.00 0.25 H new ATOM 0 HA TYR A 7 12.248 -0.184 8.236 1.00 0.28 H new ATOM 0 HB2 TYR A 7 9.505 -0.951 9.290 1.00 0.34 H new ATOM 0 HB3 TYR A 7 10.294 0.590 9.565 1.00 0.34 H new ATOM 0 HD1 TYR A 7 11.068 1.832 7.294 1.00 0.38 H new ATOM 0 HD2 TYR A 7 7.973 -1.086 7.540 1.00 0.41 H new ATOM 0 HE1 TYR A 7 10.071 2.711 5.233 1.00 0.43 H new ATOM 0 HE2 TYR A 7 6.974 -0.202 5.480 1.00 0.44 H new ATOM 0 HH TYR A 7 8.600 2.188 3.512 1.00 0.49 H new ATOM 126 N ASP A 8 11.690 -2.525 10.484 1.00 0.28 N ATOM 127 CA ASP A 8 12.118 -3.054 11.774 1.00 0.29 C ATOM 128 C ASP A 8 13.613 -3.313 11.759 1.00 0.24 C ATOM 129 O ASP A 8 14.330 -2.970 12.698 1.00 0.25 O ATOM 130 CB ASP A 8 11.393 -4.359 12.105 1.00 0.35 C ATOM 131 CG ASP A 8 9.926 -4.167 12.408 1.00 0.93 C ATOM 132 OD1 ASP A 8 9.594 -3.797 13.554 1.00 1.75 O ATOM 133 OD2 ASP A 8 9.094 -4.402 11.504 1.00 1.51 O ATOM 0 H ASP A 8 11.072 -3.143 9.957 1.00 0.28 H new ATOM 0 HA ASP A 8 11.874 -2.312 12.534 1.00 0.29 H new ATOM 0 HB2 ASP A 8 11.497 -5.047 11.266 1.00 0.35 H new ATOM 0 HB3 ASP A 8 11.876 -4.827 12.963 1.00 0.35 H new ATOM 138 N VAL A 9 14.078 -3.899 10.665 1.00 0.21 N ATOM 139 CA VAL A 9 15.487 -4.222 10.504 1.00 0.19 C ATOM 140 C VAL A 9 16.304 -2.946 10.402 1.00 0.18 C ATOM 141 O VAL A 9 17.405 -2.848 10.942 1.00 0.20 O ATOM 142 CB VAL A 9 15.722 -5.071 9.243 1.00 0.19 C ATOM 143 CG1 VAL A 9 17.114 -5.677 9.247 1.00 0.20 C ATOM 144 CG2 VAL A 9 14.663 -6.156 9.125 1.00 0.22 C ATOM 0 H VAL A 9 13.494 -4.162 9.871 1.00 0.21 H new ATOM 0 HA VAL A 9 15.799 -4.796 11.377 1.00 0.19 H new ATOM 0 HB VAL A 9 15.643 -4.417 8.374 1.00 0.19 H new ATOM 0 HG11 VAL A 9 17.254 -6.272 8.345 1.00 0.20 H new ATOM 0 HG12 VAL A 9 17.858 -4.880 9.275 1.00 0.20 H new ATOM 0 HG13 VAL A 9 17.231 -6.314 10.124 1.00 0.20 H new ATOM 0 HG21 VAL A 9 14.845 -6.746 8.227 1.00 0.22 H new ATOM 0 HG22 VAL A 9 14.707 -6.804 10.000 1.00 0.22 H new ATOM 0 HG23 VAL A 9 13.677 -5.696 9.063 1.00 0.22 H new ATOM 154 N ALA A 10 15.746 -1.971 9.698 1.00 0.19 N ATOM 155 CA ALA A 10 16.388 -0.679 9.519 1.00 0.22 C ATOM 156 C ALA A 10 16.617 -0.008 10.868 1.00 0.26 C ATOM 157 O ALA A 10 17.678 0.560 11.117 1.00 0.30 O ATOM 158 CB ALA A 10 15.546 0.207 8.614 1.00 0.26 C ATOM 0 H ALA A 10 14.840 -2.054 9.237 1.00 0.19 H new ATOM 0 HA ALA A 10 17.357 -0.833 9.045 1.00 0.22 H new ATOM 0 HB1 ALA A 10 16.038 1.171 8.489 1.00 0.26 H new ATOM 0 HB2 ALA A 10 15.431 -0.271 7.641 1.00 0.26 H new ATOM 0 HB3 ALA A 10 14.564 0.357 9.063 1.00 0.26 H new ATOM 164 N GLU A 11 15.626 -0.109 11.745 1.00 0.29 N ATOM 165 CA GLU A 11 15.709 0.482 13.076 1.00 0.35 C ATOM 166 C GLU A 11 16.588 -0.360 13.998 1.00 0.37 C ATOM 167 O GLU A 11 17.162 0.149 14.960 1.00 0.46 O ATOM 168 CB GLU A 11 14.311 0.639 13.680 1.00 0.37 C ATOM 169 CG GLU A 11 13.523 1.796 13.082 1.00 0.94 C ATOM 170 CD GLU A 11 12.187 2.007 13.764 1.00 1.51 C ATOM 171 OE1 GLU A 11 12.160 2.642 14.841 1.00 2.21 O ATOM 172 OE2 GLU A 11 11.161 1.543 13.225 1.00 2.14 O ATOM 0 H GLU A 11 14.750 -0.597 11.557 1.00 0.29 H new ATOM 0 HA GLU A 11 16.164 1.467 12.977 1.00 0.35 H new ATOM 0 HB2 GLU A 11 13.753 -0.286 13.533 1.00 0.37 H new ATOM 0 HB3 GLU A 11 14.402 0.788 14.756 1.00 0.37 H new ATOM 0 HG2 GLU A 11 14.113 2.709 13.157 1.00 0.94 H new ATOM 0 HG3 GLU A 11 13.359 1.609 12.021 1.00 0.94 H new ATOM 179 N TYR A 12 16.696 -1.648 13.700 1.00 0.32 N ATOM 180 CA TYR A 12 17.514 -2.552 14.501 1.00 0.38 C ATOM 181 C TYR A 12 18.993 -2.402 14.146 1.00 0.38 C ATOM 182 O TYR A 12 19.856 -2.414 15.024 1.00 0.45 O ATOM 183 CB TYR A 12 17.061 -4.005 14.288 1.00 0.39 C ATOM 184 CG TYR A 12 17.420 -4.942 15.426 1.00 0.47 C ATOM 185 CD1 TYR A 12 18.720 -5.395 15.604 1.00 1.10 C ATOM 186 CD2 TYR A 12 16.447 -5.378 16.319 1.00 1.38 C ATOM 187 CE1 TYR A 12 19.039 -6.251 16.640 1.00 1.07 C ATOM 188 CE2 TYR A 12 16.759 -6.233 17.357 1.00 1.49 C ATOM 189 CZ TYR A 12 18.054 -6.665 17.515 1.00 0.69 C ATOM 190 OH TYR A 12 18.367 -7.519 18.548 1.00 0.82 O ATOM 0 H TYR A 12 16.228 -2.091 12.910 1.00 0.32 H new ATOM 0 HA TYR A 12 17.386 -2.292 15.552 1.00 0.38 H new ATOM 0 HB2 TYR A 12 15.980 -4.020 14.147 1.00 0.39 H new ATOM 0 HB3 TYR A 12 17.507 -4.382 13.368 1.00 0.39 H new ATOM 0 HD1 TYR A 12 19.493 -5.073 14.922 1.00 1.10 H new ATOM 0 HD2 TYR A 12 15.428 -5.041 16.198 1.00 1.38 H new ATOM 0 HE1 TYR A 12 20.055 -6.595 16.765 1.00 1.07 H new ATOM 0 HE2 TYR A 12 15.990 -6.560 18.041 1.00 1.49 H new ATOM 0 HH TYR A 12 17.560 -7.710 19.070 1.00 0.82 H new ATOM 200 N ALA A 13 19.279 -2.220 12.862 1.00 0.33 N ATOM 201 CA ALA A 13 20.656 -2.090 12.400 1.00 0.36 C ATOM 202 C ALA A 13 21.117 -0.637 12.407 1.00 0.39 C ATOM 203 O ALA A 13 22.315 -0.360 12.390 1.00 0.46 O ATOM 204 CB ALA A 13 20.793 -2.682 11.006 1.00 0.33 C ATOM 0 H ALA A 13 18.578 -2.159 12.124 1.00 0.33 H new ATOM 0 HA ALA A 13 21.296 -2.640 13.090 1.00 0.36 H new ATOM 0 HB1 ALA A 13 21.824 -2.581 10.668 1.00 0.33 H new ATOM 0 HB2 ALA A 13 20.521 -3.737 11.030 1.00 0.33 H new ATOM 0 HB3 ALA A 13 20.132 -2.153 10.319 1.00 0.33 H new ATOM 210 N GLY A 14 20.160 0.283 12.436 1.00 0.38 N ATOM 211 CA GLY A 14 20.489 1.697 12.432 1.00 0.43 C ATOM 212 C GLY A 14 20.689 2.225 11.027 1.00 0.43 C ATOM 213 O GLY A 14 21.517 3.105 10.786 1.00 0.52 O ATOM 0 H GLY A 14 19.162 0.076 12.462 1.00 0.38 H new ATOM 0 HA2 GLY A 14 19.691 2.257 12.920 1.00 0.43 H new ATOM 0 HA3 GLY A 14 21.396 1.861 13.014 1.00 0.43 H new ATOM 217 N VAL A 15 19.908 1.693 10.103 1.00 0.35 N ATOM 218 CA VAL A 15 19.990 2.069 8.705 1.00 0.35 C ATOM 219 C VAL A 15 18.623 2.477 8.177 1.00 0.34 C ATOM 220 O VAL A 15 17.689 2.700 8.949 1.00 0.36 O ATOM 221 CB VAL A 15 20.523 0.898 7.851 1.00 0.33 C ATOM 222 CG1 VAL A 15 21.960 0.574 8.221 1.00 0.36 C ATOM 223 CG2 VAL A 15 19.643 -0.339 8.014 1.00 0.28 C ATOM 0 H VAL A 15 19.199 0.988 10.303 1.00 0.35 H new ATOM 0 HA VAL A 15 20.677 2.912 8.633 1.00 0.35 H new ATOM 0 HB VAL A 15 20.495 1.205 6.805 1.00 0.33 H new ATOM 0 HG11 VAL A 15 22.316 -0.254 7.608 1.00 0.36 H new ATOM 0 HG12 VAL A 15 22.586 1.449 8.048 1.00 0.36 H new ATOM 0 HG13 VAL A 15 22.010 0.294 9.273 1.00 0.36 H new ATOM 0 HG21 VAL A 15 20.039 -1.150 7.403 1.00 0.28 H new ATOM 0 HG22 VAL A 15 19.634 -0.644 9.060 1.00 0.28 H new ATOM 0 HG23 VAL A 15 18.627 -0.107 7.695 1.00 0.28 H new ATOM 233 N SER A 16 18.512 2.573 6.864 1.00 0.35 N ATOM 234 CA SER A 16 17.257 2.927 6.237 1.00 0.35 C ATOM 235 C SER A 16 16.585 1.669 5.716 1.00 0.32 C ATOM 236 O SER A 16 17.260 0.664 5.472 1.00 0.32 O ATOM 237 CB SER A 16 17.479 3.910 5.091 1.00 0.40 C ATOM 238 OG SER A 16 18.243 3.317 4.050 1.00 1.26 O ATOM 0 H SER A 16 19.280 2.410 6.212 1.00 0.35 H new ATOM 0 HA SER A 16 16.618 3.408 6.978 1.00 0.35 H new ATOM 0 HB2 SER A 16 16.517 4.239 4.698 1.00 0.40 H new ATOM 0 HB3 SER A 16 17.992 4.797 5.463 1.00 0.40 H new ATOM 0 HG SER A 16 19.168 3.199 4.350 1.00 1.26 H new ATOM 244 N TYR A 17 15.271 1.712 5.550 1.00 0.32 N ATOM 245 CA TYR A 17 14.540 0.553 5.046 1.00 0.30 C ATOM 246 C TYR A 17 15.047 0.165 3.666 1.00 0.31 C ATOM 247 O TYR A 17 15.060 -1.011 3.296 1.00 0.30 O ATOM 248 CB TYR A 17 13.034 0.818 5.007 1.00 0.33 C ATOM 249 CG TYR A 17 12.600 1.937 4.087 1.00 0.37 C ATOM 250 CD1 TYR A 17 12.611 3.252 4.516 1.00 1.27 C ATOM 251 CD2 TYR A 17 12.158 1.671 2.795 1.00 1.14 C ATOM 252 CE1 TYR A 17 12.199 4.276 3.689 1.00 1.32 C ATOM 253 CE2 TYR A 17 11.744 2.688 1.962 1.00 1.16 C ATOM 254 CZ TYR A 17 11.765 3.988 2.412 1.00 0.54 C ATOM 255 OH TYR A 17 11.350 5.003 1.584 1.00 0.65 O ATOM 0 H TYR A 17 14.692 2.527 5.754 1.00 0.32 H new ATOM 0 HA TYR A 17 14.715 -0.277 5.731 1.00 0.30 H new ATOM 0 HB2 TYR A 17 12.528 -0.098 4.702 1.00 0.33 H new ATOM 0 HB3 TYR A 17 12.696 1.048 6.017 1.00 0.33 H new ATOM 0 HD1 TYR A 17 12.948 3.481 5.516 1.00 1.27 H new ATOM 0 HD2 TYR A 17 12.139 0.651 2.439 1.00 1.14 H new ATOM 0 HE1 TYR A 17 12.216 5.297 4.039 1.00 1.32 H new ATOM 0 HE2 TYR A 17 11.405 2.466 0.961 1.00 1.16 H new ATOM 0 HH TYR A 17 12.075 5.653 1.474 1.00 0.65 H new ATOM 265 N GLN A 18 15.479 1.164 2.913 1.00 0.35 N ATOM 266 CA GLN A 18 16.008 0.942 1.587 1.00 0.37 C ATOM 267 C GLN A 18 17.307 0.160 1.662 1.00 0.33 C ATOM 268 O GLN A 18 17.560 -0.712 0.839 1.00 0.34 O ATOM 269 CB GLN A 18 16.229 2.267 0.877 1.00 0.46 C ATOM 270 CG GLN A 18 15.331 2.439 -0.329 1.00 0.77 C ATOM 271 CD GLN A 18 15.735 1.549 -1.486 1.00 0.50 C ATOM 272 OE1 GLN A 18 16.444 1.976 -2.390 1.00 0.66 O ATOM 273 NE2 GLN A 18 15.278 0.303 -1.473 1.00 1.09 N ATOM 0 H GLN A 18 15.471 2.141 3.205 1.00 0.35 H new ATOM 0 HA GLN A 18 15.284 0.360 1.017 1.00 0.37 H new ATOM 0 HB2 GLN A 18 16.052 3.084 1.577 1.00 0.46 H new ATOM 0 HB3 GLN A 18 17.270 2.337 0.563 1.00 0.46 H new ATOM 0 HG2 GLN A 18 14.302 2.217 -0.046 1.00 0.77 H new ATOM 0 HG3 GLN A 18 15.355 3.480 -0.650 1.00 0.77 H new ATOM 0 HE21 GLN A 18 14.690 -0.017 -0.703 1.00 1.09 H new ATOM 0 HE22 GLN A 18 15.515 -0.335 -2.233 1.00 1.09 H new ATOM 282 N THR A 19 18.122 0.467 2.666 1.00 0.33 N ATOM 283 CA THR A 19 19.385 -0.224 2.844 1.00 0.34 C ATOM 284 C THR A 19 19.123 -1.681 3.181 1.00 0.29 C ATOM 285 O THR A 19 19.800 -2.574 2.676 1.00 0.31 O ATOM 286 CB THR A 19 20.241 0.435 3.939 1.00 0.39 C ATOM 287 OG1 THR A 19 20.551 1.778 3.550 1.00 0.49 O ATOM 288 CG2 THR A 19 21.532 -0.336 4.166 1.00 0.45 C ATOM 0 H THR A 19 17.928 1.186 3.363 1.00 0.33 H new ATOM 0 HA THR A 19 19.945 -0.161 1.911 1.00 0.34 H new ATOM 0 HB THR A 19 19.673 0.432 4.870 1.00 0.39 H new ATOM 0 HG1 THR A 19 20.903 2.269 4.322 1.00 0.49 H new ATOM 0 HG21 THR A 19 22.116 0.154 4.945 1.00 0.45 H new ATOM 0 HG22 THR A 19 21.298 -1.355 4.474 1.00 0.45 H new ATOM 0 HG23 THR A 19 22.109 -0.360 3.241 1.00 0.45 H new ATOM 296 N VAL A 20 18.127 -1.908 4.029 1.00 0.25 N ATOM 297 CA VAL A 20 17.737 -3.258 4.410 1.00 0.21 C ATOM 298 C VAL A 20 17.335 -4.062 3.179 1.00 0.20 C ATOM 299 O VAL A 20 17.859 -5.148 2.942 1.00 0.24 O ATOM 300 CB VAL A 20 16.574 -3.229 5.414 1.00 0.21 C ATOM 301 CG1 VAL A 20 16.075 -4.636 5.708 1.00 0.23 C ATOM 302 CG2 VAL A 20 17.018 -2.544 6.690 1.00 0.24 C ATOM 0 H VAL A 20 17.574 -1.171 4.467 1.00 0.25 H new ATOM 0 HA VAL A 20 18.595 -3.735 4.884 1.00 0.21 H new ATOM 0 HB VAL A 20 15.749 -2.667 4.977 1.00 0.21 H new ATOM 0 HG11 VAL A 20 15.252 -4.589 6.421 1.00 0.23 H new ATOM 0 HG12 VAL A 20 15.729 -5.100 4.784 1.00 0.23 H new ATOM 0 HG13 VAL A 20 16.887 -5.229 6.129 1.00 0.23 H new ATOM 0 HG21 VAL A 20 16.191 -2.525 7.400 1.00 0.24 H new ATOM 0 HG22 VAL A 20 17.856 -3.090 7.124 1.00 0.24 H new ATOM 0 HG23 VAL A 20 17.327 -1.523 6.466 1.00 0.24 H new ATOM 312 N SER A 21 16.418 -3.508 2.388 1.00 0.22 N ATOM 313 CA SER A 21 15.952 -4.163 1.165 1.00 0.25 C ATOM 314 C SER A 21 17.112 -4.378 0.198 1.00 0.27 C ATOM 315 O SER A 21 17.166 -5.392 -0.500 1.00 0.32 O ATOM 316 CB SER A 21 14.846 -3.328 0.505 1.00 0.32 C ATOM 317 OG SER A 21 14.611 -3.734 -0.834 1.00 0.87 O ATOM 0 H SER A 21 15.981 -2.605 2.572 1.00 0.22 H new ATOM 0 HA SER A 21 15.541 -5.138 1.427 1.00 0.25 H new ATOM 0 HB2 SER A 21 13.925 -3.423 1.081 1.00 0.32 H new ATOM 0 HB3 SER A 21 15.126 -2.275 0.522 1.00 0.32 H new ATOM 0 HG SER A 21 13.811 -4.299 -0.869 1.00 0.87 H new ATOM 323 N ARG A 22 18.042 -3.431 0.178 1.00 0.30 N ATOM 324 CA ARG A 22 19.208 -3.523 -0.692 1.00 0.40 C ATOM 325 C ARG A 22 20.085 -4.709 -0.292 1.00 0.39 C ATOM 326 O ARG A 22 20.723 -5.331 -1.139 1.00 0.58 O ATOM 327 CB ARG A 22 20.017 -2.224 -0.648 1.00 0.51 C ATOM 328 CG ARG A 22 19.455 -1.129 -1.541 1.00 0.82 C ATOM 329 CD ARG A 22 20.313 0.130 -1.502 1.00 0.75 C ATOM 330 NE ARG A 22 20.171 0.872 -0.247 1.00 0.73 N ATOM 331 CZ ARG A 22 19.786 2.149 -0.170 1.00 1.18 C ATOM 332 NH1 ARG A 22 19.474 2.823 -1.269 1.00 2.03 N ATOM 333 NH2 ARG A 22 19.713 2.752 1.010 1.00 1.28 N ATOM 0 H ARG A 22 18.011 -2.590 0.755 1.00 0.30 H new ATOM 0 HA ARG A 22 18.860 -3.679 -1.713 1.00 0.40 H new ATOM 0 HB2 ARG A 22 20.052 -1.862 0.379 1.00 0.51 H new ATOM 0 HB3 ARG A 22 21.044 -2.434 -0.947 1.00 0.51 H new ATOM 0 HG2 ARG A 22 19.391 -1.493 -2.566 1.00 0.82 H new ATOM 0 HG3 ARG A 22 18.440 -0.887 -1.225 1.00 0.82 H new ATOM 0 HD2 ARG A 22 21.359 -0.144 -1.641 1.00 0.75 H new ATOM 0 HD3 ARG A 22 20.039 0.777 -2.335 1.00 0.75 H new ATOM 0 HE ARG A 22 20.379 0.383 0.623 1.00 0.73 H new ATOM 0 HH11 ARG A 22 19.527 2.367 -2.180 1.00 2.03 H new ATOM 0 HH12 ARG A 22 19.181 3.798 -1.203 1.00 2.03 H new ATOM 0 HH21 ARG A 22 19.951 2.240 1.860 1.00 1.28 H new ATOM 0 HH22 ARG A 22 19.419 3.727 1.067 1.00 1.28 H new ATOM 347 N VAL A 23 20.095 -5.023 0.998 1.00 0.29 N ATOM 348 CA VAL A 23 20.878 -6.144 1.512 1.00 0.33 C ATOM 349 C VAL A 23 20.130 -7.448 1.289 1.00 0.34 C ATOM 350 O VAL A 23 20.710 -8.445 0.880 1.00 0.43 O ATOM 351 CB VAL A 23 21.183 -5.984 3.017 1.00 0.34 C ATOM 352 CG1 VAL A 23 21.944 -7.188 3.552 1.00 0.44 C ATOM 353 CG2 VAL A 23 21.963 -4.705 3.268 1.00 0.33 C ATOM 0 H VAL A 23 19.569 -4.517 1.710 1.00 0.29 H new ATOM 0 HA VAL A 23 21.824 -6.159 0.970 1.00 0.33 H new ATOM 0 HB VAL A 23 20.234 -5.922 3.550 1.00 0.34 H new ATOM 0 HG11 VAL A 23 22.146 -7.048 4.614 1.00 0.44 H new ATOM 0 HG12 VAL A 23 21.346 -8.088 3.411 1.00 0.44 H new ATOM 0 HG13 VAL A 23 22.887 -7.291 3.014 1.00 0.44 H new ATOM 0 HG21 VAL A 23 22.169 -4.608 4.334 1.00 0.33 H new ATOM 0 HG22 VAL A 23 22.903 -4.738 2.718 1.00 0.33 H new ATOM 0 HG23 VAL A 23 21.377 -3.850 2.933 1.00 0.33 H new ATOM 363 N VAL A 24 18.833 -7.424 1.561 1.00 0.29 N ATOM 364 CA VAL A 24 17.987 -8.600 1.379 1.00 0.32 C ATOM 365 C VAL A 24 18.001 -9.052 -0.079 1.00 0.34 C ATOM 366 O VAL A 24 18.081 -10.243 -0.375 1.00 0.41 O ATOM 367 CB VAL A 24 16.529 -8.315 1.801 1.00 0.32 C ATOM 368 CG1 VAL A 24 15.661 -9.551 1.612 1.00 0.39 C ATOM 369 CG2 VAL A 24 16.469 -7.831 3.244 1.00 0.35 C ATOM 0 H VAL A 24 18.340 -6.602 1.910 1.00 0.29 H new ATOM 0 HA VAL A 24 18.391 -9.389 2.013 1.00 0.32 H new ATOM 0 HB VAL A 24 16.139 -7.524 1.160 1.00 0.32 H new ATOM 0 HG11 VAL A 24 14.638 -9.327 1.915 1.00 0.39 H new ATOM 0 HG12 VAL A 24 15.672 -9.846 0.563 1.00 0.39 H new ATOM 0 HG13 VAL A 24 16.050 -10.366 2.222 1.00 0.39 H new ATOM 0 HG21 VAL A 24 15.433 -7.636 3.520 1.00 0.35 H new ATOM 0 HG22 VAL A 24 16.882 -8.596 3.902 1.00 0.35 H new ATOM 0 HG23 VAL A 24 17.049 -6.914 3.345 1.00 0.35 H new ATOM 379 N ASN A 25 17.923 -8.087 -0.980 1.00 0.33 N ATOM 380 CA ASN A 25 17.925 -8.373 -2.411 1.00 0.42 C ATOM 381 C ASN A 25 19.346 -8.538 -2.941 1.00 0.76 C ATOM 382 O ASN A 25 19.549 -9.114 -4.014 1.00 0.94 O ATOM 383 CB ASN A 25 17.201 -7.264 -3.179 1.00 0.83 C ATOM 384 CG ASN A 25 15.695 -7.386 -3.071 1.00 1.11 C ATOM 385 OD1 ASN A 25 15.046 -7.984 -3.929 1.00 1.72 O ATOM 386 ND2 ASN A 25 15.128 -6.816 -2.019 1.00 1.15 N ATOM 0 H ASN A 25 17.857 -7.096 -0.749 1.00 0.33 H new ATOM 0 HA ASN A 25 17.396 -9.314 -2.563 1.00 0.42 H new ATOM 0 HB2 ASN A 25 17.514 -6.293 -2.794 1.00 0.83 H new ATOM 0 HB3 ASN A 25 17.493 -7.300 -4.229 1.00 0.83 H new ATOM 0 HD21 ASN A 25 14.116 -6.863 -1.897 1.00 1.15 H new ATOM 0 HD22 ASN A 25 15.703 -6.330 -1.331 1.00 1.15 H new ATOM 393 N GLN A 26 20.318 -8.029 -2.183 1.00 1.08 N ATOM 394 CA GLN A 26 21.733 -8.101 -2.557 1.00 1.58 C ATOM 395 C GLN A 26 21.956 -7.437 -3.909 1.00 1.10 C ATOM 396 O GLN A 26 22.566 -8.013 -4.811 1.00 1.64 O ATOM 397 CB GLN A 26 22.226 -9.554 -2.579 1.00 2.64 C ATOM 398 CG GLN A 26 22.228 -10.212 -1.209 1.00 3.42 C ATOM 399 CD GLN A 26 23.406 -9.797 -0.339 1.00 4.28 C ATOM 400 OE1 GLN A 26 23.969 -8.711 -0.498 1.00 4.88 O ATOM 401 NE2 GLN A 26 23.777 -10.655 0.599 1.00 4.73 N ATOM 0 H GLN A 26 20.149 -7.556 -1.295 1.00 1.08 H new ATOM 0 HA GLN A 26 22.312 -7.564 -1.805 1.00 1.58 H new ATOM 0 HB2 GLN A 26 21.594 -10.134 -3.251 1.00 2.64 H new ATOM 0 HB3 GLN A 26 23.236 -9.581 -2.988 1.00 2.64 H new ATOM 0 HG2 GLN A 26 21.300 -9.963 -0.694 1.00 3.42 H new ATOM 0 HG3 GLN A 26 22.243 -11.295 -1.334 1.00 3.42 H new ATOM 0 HE21 GLN A 26 23.287 -11.544 0.700 1.00 4.73 H new ATOM 0 HE22 GLN A 26 24.553 -10.427 1.221 1.00 4.73 H new ATOM 410 N ALA A 27 21.444 -6.220 -4.033 1.00 0.83 N ATOM 411 CA ALA A 27 21.557 -5.452 -5.263 1.00 1.50 C ATOM 412 C ALA A 27 22.799 -4.564 -5.247 1.00 1.34 C ATOM 413 O ALA A 27 23.743 -4.819 -4.500 1.00 2.01 O ATOM 414 CB ALA A 27 20.303 -4.611 -5.457 1.00 2.27 C ATOM 0 H ALA A 27 20.941 -5.740 -3.287 1.00 0.83 H new ATOM 0 HA ALA A 27 21.658 -6.146 -6.097 1.00 1.50 H new ATOM 0 HB1 ALA A 27 20.389 -4.036 -6.379 1.00 2.27 H new ATOM 0 HB2 ALA A 27 19.432 -5.264 -5.517 1.00 2.27 H new ATOM 0 HB3 ALA A 27 20.188 -3.930 -4.614 1.00 2.27 H new ATOM 420 N SER A 28 22.795 -3.530 -6.076 1.00 1.04 N ATOM 421 CA SER A 28 23.916 -2.606 -6.147 1.00 0.84 C ATOM 422 C SER A 28 23.802 -1.549 -5.048 1.00 0.71 C ATOM 423 O SER A 28 22.760 -1.432 -4.400 1.00 0.73 O ATOM 424 CB SER A 28 23.955 -1.945 -7.522 1.00 0.91 C ATOM 425 OG SER A 28 24.071 -2.915 -8.549 1.00 1.52 O ATOM 0 H SER A 28 22.026 -3.310 -6.709 1.00 1.04 H new ATOM 0 HA SER A 28 24.843 -3.159 -5.996 1.00 0.84 H new ATOM 0 HB2 SER A 28 23.049 -1.357 -7.673 1.00 0.91 H new ATOM 0 HB3 SER A 28 24.796 -1.254 -7.573 1.00 0.91 H new ATOM 0 HG SER A 28 24.092 -2.468 -9.421 1.00 1.52 H new ATOM 431 N HIS A 29 24.865 -0.756 -4.873 1.00 0.61 N ATOM 432 CA HIS A 29 24.930 0.279 -3.844 1.00 0.53 C ATOM 433 C HIS A 29 24.811 -0.321 -2.447 1.00 0.59 C ATOM 434 O HIS A 29 24.276 0.320 -1.539 1.00 0.76 O ATOM 435 CB HIS A 29 23.858 1.365 -3.968 1.00 0.50 C ATOM 436 CG HIS A 29 23.265 1.626 -5.316 1.00 0.50 C ATOM 437 ND1 HIS A 29 22.042 2.230 -5.447 1.00 0.46 N ATOM 438 CD2 HIS A 29 23.735 1.455 -6.573 1.00 0.64 C ATOM 439 CE1 HIS A 29 21.780 2.425 -6.712 1.00 0.53 C ATOM 440 NE2 HIS A 29 22.789 1.961 -7.427 1.00 0.63 N ATOM 0 H HIS A 29 25.707 -0.817 -5.446 1.00 0.61 H new ATOM 0 HA HIS A 29 25.904 0.744 -3.999 1.00 0.53 H new ATOM 0 HB2 HIS A 29 23.044 1.107 -3.291 1.00 0.50 H new ATOM 0 HB3 HIS A 29 24.288 2.299 -3.608 1.00 0.50 H new ATOM 0 HD2 HIS A 29 24.677 1.005 -6.851 1.00 0.64 H new ATOM 0 HE1 HIS A 29 20.888 2.888 -7.107 1.00 0.53 H new ATOM 0 HE2 HIS A 29 22.854 1.976 -8.445 1.00 0.63 H new ATOM 449 N VAL A 30 25.292 -1.539 -2.266 1.00 0.66 N ATOM 450 CA VAL A 30 25.213 -2.180 -0.967 1.00 0.76 C ATOM 451 C VAL A 30 26.588 -2.536 -0.442 1.00 0.72 C ATOM 452 O VAL A 30 27.208 -3.498 -0.892 1.00 0.78 O ATOM 453 CB VAL A 30 24.353 -3.454 -1.001 1.00 0.94 C ATOM 454 CG1 VAL A 30 23.999 -3.882 0.408 1.00 1.01 C ATOM 455 CG2 VAL A 30 23.096 -3.234 -1.816 1.00 1.16 C ATOM 0 H VAL A 30 25.737 -2.098 -2.994 1.00 0.66 H new ATOM 0 HA VAL A 30 24.743 -1.455 -0.302 1.00 0.76 H new ATOM 0 HB VAL A 30 24.931 -4.247 -1.476 1.00 0.94 H new ATOM 0 HG11 VAL A 30 23.390 -4.785 0.372 1.00 1.01 H new ATOM 0 HG12 VAL A 30 24.913 -4.083 0.968 1.00 1.01 H new ATOM 0 HG13 VAL A 30 23.439 -3.087 0.900 1.00 1.01 H new ATOM 0 HG21 VAL A 30 22.504 -4.149 -1.826 1.00 1.16 H new ATOM 0 HG22 VAL A 30 22.511 -2.428 -1.373 1.00 1.16 H new ATOM 0 HG23 VAL A 30 23.367 -2.966 -2.837 1.00 1.16 H new ATOM 465 N SER A 31 27.062 -1.752 0.506 1.00 0.71 N ATOM 466 CA SER A 31 28.361 -1.993 1.107 1.00 0.76 C ATOM 467 C SER A 31 28.288 -3.178 2.066 1.00 0.83 C ATOM 468 O SER A 31 27.219 -3.495 2.589 1.00 1.30 O ATOM 469 CB SER A 31 28.838 -0.746 1.856 1.00 0.75 C ATOM 470 OG SER A 31 27.959 -0.423 2.925 1.00 0.74 O ATOM 0 H SER A 31 26.567 -0.941 0.878 1.00 0.71 H new ATOM 0 HA SER A 31 29.072 -2.223 0.314 1.00 0.76 H new ATOM 0 HB2 SER A 31 29.842 -0.914 2.245 1.00 0.75 H new ATOM 0 HB3 SER A 31 28.900 0.095 1.165 1.00 0.75 H new ATOM 0 HG SER A 31 27.135 -0.946 2.840 1.00 0.74 H new ATOM 476 N ALA A 32 29.424 -3.820 2.300 1.00 0.86 N ATOM 477 CA ALA A 32 29.484 -4.956 3.206 1.00 0.86 C ATOM 478 C ALA A 32 29.256 -4.488 4.634 1.00 0.75 C ATOM 479 O ALA A 32 28.759 -5.235 5.473 1.00 0.69 O ATOM 480 CB ALA A 32 30.826 -5.662 3.082 1.00 1.06 C ATOM 0 H ALA A 32 30.317 -3.572 1.874 1.00 0.86 H new ATOM 0 HA ALA A 32 28.700 -5.665 2.939 1.00 0.86 H new ATOM 0 HB1 ALA A 32 30.856 -6.510 3.766 1.00 1.06 H new ATOM 0 HB2 ALA A 32 30.958 -6.016 2.060 1.00 1.06 H new ATOM 0 HB3 ALA A 32 31.627 -4.966 3.331 1.00 1.06 H new ATOM 486 N LYS A 33 29.603 -3.231 4.883 1.00 0.80 N ATOM 487 CA LYS A 33 29.447 -2.627 6.198 1.00 0.78 C ATOM 488 C LYS A 33 28.003 -2.746 6.668 1.00 0.67 C ATOM 489 O LYS A 33 27.738 -3.216 7.774 1.00 0.69 O ATOM 490 CB LYS A 33 29.883 -1.161 6.160 1.00 0.94 C ATOM 491 CG LYS A 33 31.164 -0.943 5.367 1.00 1.53 C ATOM 492 CD LYS A 33 31.594 0.512 5.369 1.00 1.99 C ATOM 493 CE LYS A 33 30.677 1.371 4.517 1.00 2.99 C ATOM 494 NZ LYS A 33 31.243 2.725 4.294 1.00 3.39 N ATOM 0 H LYS A 33 29.999 -2.605 4.182 1.00 0.80 H new ATOM 0 HA LYS A 33 30.082 -3.159 6.906 1.00 0.78 H new ATOM 0 HB2 LYS A 33 29.085 -0.561 5.723 1.00 0.94 H new ATOM 0 HB3 LYS A 33 30.028 -0.804 7.180 1.00 0.94 H new ATOM 0 HG2 LYS A 33 31.960 -1.557 5.789 1.00 1.53 H new ATOM 0 HG3 LYS A 33 31.015 -1.276 4.340 1.00 1.53 H new ATOM 0 HD2 LYS A 33 31.598 0.889 6.392 1.00 1.99 H new ATOM 0 HD3 LYS A 33 32.615 0.590 4.996 1.00 1.99 H new ATOM 0 HE2 LYS A 33 30.511 0.884 3.556 1.00 2.99 H new ATOM 0 HE3 LYS A 33 29.705 1.458 5.003 1.00 2.99 H new ATOM 0 HZ1 LYS A 33 30.589 3.283 3.708 1.00 3.39 H new ATOM 0 HZ2 LYS A 33 31.378 3.200 5.209 1.00 3.39 H new ATOM 0 HZ3 LYS A 33 32.159 2.643 3.808 1.00 3.39 H new ATOM 508 N THR A 34 27.073 -2.342 5.816 1.00 0.61 N ATOM 509 CA THR A 34 25.666 -2.429 6.148 1.00 0.54 C ATOM 510 C THR A 34 25.139 -3.838 5.899 1.00 0.51 C ATOM 511 O THR A 34 24.278 -4.325 6.622 1.00 0.49 O ATOM 512 CB THR A 34 24.841 -1.431 5.327 1.00 0.53 C ATOM 513 OG1 THR A 34 25.436 -1.254 4.031 1.00 0.65 O ATOM 514 CG2 THR A 34 24.745 -0.094 6.046 1.00 0.56 C ATOM 0 H THR A 34 27.270 -1.953 4.894 1.00 0.61 H new ATOM 0 HA THR A 34 25.566 -2.186 7.206 1.00 0.54 H new ATOM 0 HB THR A 34 23.833 -1.829 5.207 1.00 0.53 H new ATOM 0 HG1 THR A 34 24.738 -1.044 3.376 1.00 0.65 H new ATOM 0 HG21 THR A 34 24.156 0.600 5.447 1.00 0.56 H new ATOM 0 HG22 THR A 34 24.265 -0.235 7.014 1.00 0.56 H new ATOM 0 HG23 THR A 34 25.746 0.313 6.193 1.00 0.56 H new ATOM 522 N ARG A 35 25.689 -4.494 4.881 1.00 0.51 N ATOM 523 CA ARG A 35 25.289 -5.852 4.516 1.00 0.51 C ATOM 524 C ARG A 35 25.358 -6.795 5.714 1.00 0.52 C ATOM 525 O ARG A 35 24.409 -7.524 6.007 1.00 0.52 O ATOM 526 CB ARG A 35 26.200 -6.364 3.396 1.00 0.53 C ATOM 527 CG ARG A 35 25.589 -7.466 2.548 1.00 0.70 C ATOM 528 CD ARG A 35 26.558 -7.932 1.474 1.00 0.79 C ATOM 529 NE ARG A 35 27.053 -6.818 0.662 1.00 1.64 N ATOM 530 CZ ARG A 35 28.201 -6.841 -0.018 1.00 2.19 C ATOM 531 NH1 ARG A 35 28.969 -7.924 -0.007 1.00 2.09 N ATOM 532 NH2 ARG A 35 28.573 -5.778 -0.715 1.00 3.31 N ATOM 0 H ARG A 35 26.421 -4.103 4.288 1.00 0.51 H new ATOM 0 HA ARG A 35 24.255 -5.826 4.172 1.00 0.51 H new ATOM 0 HB2 ARG A 35 26.465 -5.528 2.749 1.00 0.53 H new ATOM 0 HB3 ARG A 35 27.126 -6.732 3.837 1.00 0.53 H new ATOM 0 HG2 ARG A 35 25.314 -8.308 3.184 1.00 0.70 H new ATOM 0 HG3 ARG A 35 24.672 -7.105 2.083 1.00 0.70 H new ATOM 0 HD2 ARG A 35 27.400 -8.442 1.942 1.00 0.79 H new ATOM 0 HD3 ARG A 35 26.063 -8.659 0.830 1.00 0.79 H new ATOM 0 HE ARG A 35 26.485 -5.972 0.613 1.00 1.64 H new ATOM 0 HH11 ARG A 35 28.683 -8.747 0.524 1.00 2.09 H new ATOM 0 HH12 ARG A 35 29.845 -7.933 -0.529 1.00 2.09 H new ATOM 0 HH21 ARG A 35 27.983 -4.946 -0.731 1.00 3.31 H new ATOM 0 HH22 ARG A 35 29.450 -5.791 -1.236 1.00 3.31 H new ATOM 546 N GLU A 36 26.470 -6.730 6.433 1.00 0.56 N ATOM 547 CA GLU A 36 26.703 -7.595 7.583 1.00 0.58 C ATOM 548 C GLU A 36 25.865 -7.215 8.797 1.00 0.54 C ATOM 549 O GLU A 36 25.540 -8.072 9.617 1.00 0.61 O ATOM 550 CB GLU A 36 28.180 -7.572 7.959 1.00 0.67 C ATOM 551 CG GLU A 36 29.098 -7.896 6.798 1.00 0.70 C ATOM 552 CD GLU A 36 30.557 -7.918 7.203 1.00 0.85 C ATOM 553 OE1 GLU A 36 31.157 -6.833 7.347 1.00 1.39 O ATOM 554 OE2 GLU A 36 31.104 -9.027 7.388 1.00 1.45 O ATOM 0 H GLU A 36 27.232 -6.081 6.238 1.00 0.56 H new ATOM 0 HA GLU A 36 26.400 -8.599 7.285 1.00 0.58 H new ATOM 0 HB2 GLU A 36 28.433 -6.586 8.350 1.00 0.67 H new ATOM 0 HB3 GLU A 36 28.355 -8.288 8.762 1.00 0.67 H new ATOM 0 HG2 GLU A 36 28.825 -8.866 6.382 1.00 0.70 H new ATOM 0 HG3 GLU A 36 28.954 -7.159 6.008 1.00 0.70 H new ATOM 561 N LYS A 37 25.500 -5.945 8.917 1.00 0.49 N ATOM 562 CA LYS A 37 24.720 -5.507 10.066 1.00 0.47 C ATOM 563 C LYS A 37 23.234 -5.716 9.827 1.00 0.39 C ATOM 564 O LYS A 37 22.471 -5.931 10.766 1.00 0.38 O ATOM 565 CB LYS A 37 25.017 -4.044 10.421 1.00 0.52 C ATOM 566 CG LYS A 37 24.469 -3.018 9.440 1.00 0.86 C ATOM 567 CD LYS A 37 24.722 -1.596 9.922 1.00 0.84 C ATOM 568 CE LYS A 37 26.190 -1.352 10.222 1.00 0.73 C ATOM 569 NZ LYS A 37 26.424 0.016 10.760 1.00 0.98 N ATOM 0 H LYS A 37 25.727 -5.212 8.245 1.00 0.49 H new ATOM 0 HA LYS A 37 25.016 -6.120 10.917 1.00 0.47 H new ATOM 0 HB2 LYS A 37 24.606 -3.835 11.409 1.00 0.52 H new ATOM 0 HB3 LYS A 37 26.097 -3.915 10.492 1.00 0.52 H new ATOM 0 HG2 LYS A 37 24.934 -3.161 8.465 1.00 0.86 H new ATOM 0 HG3 LYS A 37 23.398 -3.174 9.309 1.00 0.86 H new ATOM 0 HD2 LYS A 37 24.384 -0.890 9.163 1.00 0.84 H new ATOM 0 HD3 LYS A 37 24.132 -1.406 10.819 1.00 0.84 H new ATOM 0 HE2 LYS A 37 26.542 -2.091 10.942 1.00 0.73 H new ATOM 0 HE3 LYS A 37 26.775 -1.490 9.313 1.00 0.73 H new ATOM 0 HZ1 LYS A 37 27.438 0.145 10.952 1.00 0.98 H new ATOM 0 HZ2 LYS A 37 26.112 0.721 10.063 1.00 0.98 H new ATOM 0 HZ3 LYS A 37 25.886 0.139 11.641 1.00 0.98 H new ATOM 583 N VAL A 38 22.828 -5.673 8.565 1.00 0.36 N ATOM 584 CA VAL A 38 21.426 -5.866 8.221 1.00 0.31 C ATOM 585 C VAL A 38 21.073 -7.342 8.278 1.00 0.32 C ATOM 586 O VAL A 38 20.023 -7.718 8.804 1.00 0.31 O ATOM 587 CB VAL A 38 21.084 -5.292 6.832 1.00 0.29 C ATOM 588 CG1 VAL A 38 19.644 -5.600 6.454 1.00 0.26 C ATOM 589 CG2 VAL A 38 21.324 -3.795 6.815 1.00 0.30 C ATOM 0 H VAL A 38 23.444 -5.508 7.769 1.00 0.36 H new ATOM 0 HA VAL A 38 20.832 -5.320 8.954 1.00 0.31 H new ATOM 0 HB VAL A 38 21.734 -5.765 6.096 1.00 0.29 H new ATOM 0 HG11 VAL A 38 19.429 -5.184 5.470 1.00 0.26 H new ATOM 0 HG12 VAL A 38 19.497 -6.680 6.431 1.00 0.26 H new ATOM 0 HG13 VAL A 38 18.972 -5.158 7.190 1.00 0.26 H new ATOM 0 HG21 VAL A 38 21.080 -3.398 5.830 1.00 0.30 H new ATOM 0 HG22 VAL A 38 20.694 -3.317 7.565 1.00 0.30 H new ATOM 0 HG23 VAL A 38 22.371 -3.592 7.038 1.00 0.30 H new ATOM 599 N GLU A 39 21.965 -8.179 7.760 1.00 0.36 N ATOM 600 CA GLU A 39 21.746 -9.620 7.772 1.00 0.39 C ATOM 601 C GLU A 39 21.719 -10.121 9.206 1.00 0.41 C ATOM 602 O GLU A 39 21.037 -11.091 9.530 1.00 0.43 O ATOM 603 CB GLU A 39 22.834 -10.350 6.985 1.00 0.44 C ATOM 604 CG GLU A 39 22.695 -10.229 5.478 1.00 0.55 C ATOM 605 CD GLU A 39 23.664 -11.129 4.741 1.00 0.82 C ATOM 606 OE1 GLU A 39 24.846 -10.752 4.605 1.00 1.44 O ATOM 607 OE2 GLU A 39 23.254 -12.230 4.313 1.00 1.59 O ATOM 0 H GLU A 39 22.842 -7.886 7.329 1.00 0.36 H new ATOM 0 HA GLU A 39 20.788 -9.826 7.295 1.00 0.39 H new ATOM 0 HB2 GLU A 39 23.807 -9.959 7.282 1.00 0.44 H new ATOM 0 HB3 GLU A 39 22.818 -11.405 7.257 1.00 0.44 H new ATOM 0 HG2 GLU A 39 21.675 -10.481 5.187 1.00 0.55 H new ATOM 0 HG3 GLU A 39 22.865 -9.194 5.181 1.00 0.55 H new ATOM 614 N ALA A 40 22.461 -9.433 10.063 1.00 0.43 N ATOM 615 CA ALA A 40 22.529 -9.777 11.471 1.00 0.46 C ATOM 616 C ALA A 40 21.288 -9.282 12.207 1.00 0.41 C ATOM 617 O ALA A 40 20.726 -9.991 13.040 1.00 0.43 O ATOM 618 CB ALA A 40 23.783 -9.185 12.087 1.00 0.52 C ATOM 0 H ALA A 40 23.028 -8.627 9.801 1.00 0.43 H new ATOM 0 HA ALA A 40 22.568 -10.862 11.564 1.00 0.46 H new ATOM 0 HB1 ALA A 40 23.828 -9.447 13.144 1.00 0.52 H new ATOM 0 HB2 ALA A 40 24.661 -9.582 11.577 1.00 0.52 H new ATOM 0 HB3 ALA A 40 23.762 -8.100 11.983 1.00 0.52 H new ATOM 624 N ALA A 41 20.852 -8.071 11.871 1.00 0.37 N ATOM 625 CA ALA A 41 19.684 -7.472 12.504 1.00 0.34 C ATOM 626 C ALA A 41 18.416 -8.225 12.149 1.00 0.31 C ATOM 627 O ALA A 41 17.597 -8.513 13.020 1.00 0.34 O ATOM 628 CB ALA A 41 19.550 -6.005 12.117 1.00 0.31 C ATOM 0 H ALA A 41 21.292 -7.485 11.162 1.00 0.37 H new ATOM 0 HA ALA A 41 19.827 -7.537 13.583 1.00 0.34 H new ATOM 0 HB1 ALA A 41 18.671 -5.580 12.602 1.00 0.31 H new ATOM 0 HB2 ALA A 41 20.439 -5.462 12.437 1.00 0.31 H new ATOM 0 HB3 ALA A 41 19.444 -5.922 11.035 1.00 0.31 H new ATOM 634 N MET A 42 18.270 -8.566 10.874 1.00 0.28 N ATOM 635 CA MET A 42 17.087 -9.281 10.400 1.00 0.29 C ATOM 636 C MET A 42 17.009 -10.695 10.978 1.00 0.35 C ATOM 637 O MET A 42 15.964 -11.345 10.911 1.00 0.39 O ATOM 638 CB MET A 42 17.064 -9.334 8.868 1.00 0.27 C ATOM 639 CG MET A 42 18.063 -10.310 8.270 1.00 0.33 C ATOM 640 SD MET A 42 17.848 -10.532 6.493 1.00 0.35 S ATOM 641 CE MET A 42 18.615 -9.040 5.869 1.00 0.33 C ATOM 0 H MET A 42 18.956 -8.359 10.148 1.00 0.28 H new ATOM 0 HA MET A 42 16.214 -8.729 10.749 1.00 0.29 H new ATOM 0 HB2 MET A 42 16.062 -9.608 8.539 1.00 0.27 H new ATOM 0 HB3 MET A 42 17.266 -8.337 8.477 1.00 0.27 H new ATOM 0 HG2 MET A 42 19.074 -9.954 8.467 1.00 0.33 H new ATOM 0 HG3 MET A 42 17.963 -11.275 8.767 1.00 0.33 H new ATOM 0 HE1 MET A 42 18.947 -9.203 4.844 1.00 0.33 H new ATOM 0 HE2 MET A 42 17.893 -8.223 5.891 1.00 0.33 H new ATOM 0 HE3 MET A 42 19.472 -8.784 6.492 1.00 0.33 H new ATOM 651 N ALA A 43 18.106 -11.159 11.560 1.00 0.40 N ATOM 652 CA ALA A 43 18.154 -12.491 12.152 1.00 0.47 C ATOM 653 C ALA A 43 17.800 -12.422 13.632 1.00 0.48 C ATOM 654 O ALA A 43 17.546 -13.439 14.276 1.00 0.53 O ATOM 655 CB ALA A 43 19.538 -13.099 11.963 1.00 0.52 C ATOM 0 H ALA A 43 18.977 -10.633 11.636 1.00 0.40 H new ATOM 0 HA ALA A 43 17.424 -13.126 11.651 1.00 0.47 H new ATOM 0 HB1 ALA A 43 19.563 -14.093 12.409 1.00 0.52 H new ATOM 0 HB2 ALA A 43 19.761 -13.173 10.899 1.00 0.52 H new ATOM 0 HB3 ALA A 43 20.282 -12.466 12.446 1.00 0.52 H new ATOM 661 N GLU A 44 17.767 -11.205 14.154 1.00 0.46 N ATOM 662 CA GLU A 44 17.458 -10.975 15.557 1.00 0.46 C ATOM 663 C GLU A 44 15.962 -10.870 15.784 1.00 0.45 C ATOM 664 O GLU A 44 15.374 -11.666 16.514 1.00 0.48 O ATOM 665 CB GLU A 44 18.126 -9.688 16.032 1.00 0.45 C ATOM 666 CG GLU A 44 19.637 -9.737 15.976 1.00 0.51 C ATOM 667 CD GLU A 44 20.215 -10.829 16.855 1.00 0.63 C ATOM 668 OE1 GLU A 44 19.589 -11.167 17.886 1.00 1.36 O ATOM 669 OE2 GLU A 44 21.290 -11.366 16.515 1.00 1.21 O ATOM 0 H GLU A 44 17.952 -10.355 13.622 1.00 0.46 H new ATOM 0 HA GLU A 44 17.837 -11.825 16.124 1.00 0.46 H new ATOM 0 HB2 GLU A 44 17.774 -8.858 15.419 1.00 0.45 H new ATOM 0 HB3 GLU A 44 17.815 -9.483 17.056 1.00 0.45 H new ATOM 0 HG2 GLU A 44 19.954 -9.898 14.946 1.00 0.51 H new ATOM 0 HG3 GLU A 44 20.040 -8.773 16.287 1.00 0.51 H new ATOM 676 N LEU A 45 15.352 -9.876 15.154 1.00 0.42 N ATOM 677 CA LEU A 45 13.914 -9.641 15.295 1.00 0.44 C ATOM 678 C LEU A 45 13.073 -10.595 14.438 1.00 0.48 C ATOM 679 O LEU A 45 11.846 -10.554 14.485 1.00 0.52 O ATOM 680 CB LEU A 45 13.549 -8.161 15.017 1.00 0.49 C ATOM 681 CG LEU A 45 13.758 -7.576 13.596 1.00 0.82 C ATOM 682 CD1 LEU A 45 14.374 -6.193 13.689 1.00 0.39 C ATOM 683 CD2 LEU A 45 14.632 -8.437 12.703 1.00 1.88 C ATOM 0 H LEU A 45 15.828 -9.216 14.538 1.00 0.42 H new ATOM 0 HA LEU A 45 13.667 -9.856 16.335 1.00 0.44 H new ATOM 0 HB2 LEU A 45 12.497 -8.031 15.272 1.00 0.49 H new ATOM 0 HB3 LEU A 45 14.124 -7.547 15.711 1.00 0.49 H new ATOM 0 HG LEU A 45 12.768 -7.538 13.141 1.00 0.82 H new ATOM 0 HD11 LEU A 45 14.517 -5.790 12.686 1.00 0.39 H new ATOM 0 HD12 LEU A 45 13.711 -5.537 14.253 1.00 0.39 H new ATOM 0 HD13 LEU A 45 15.337 -6.257 14.195 1.00 0.39 H new ATOM 0 HD21 LEU A 45 14.732 -7.963 11.726 1.00 1.88 H new ATOM 0 HD22 LEU A 45 15.617 -8.548 13.156 1.00 1.88 H new ATOM 0 HD23 LEU A 45 14.175 -9.419 12.585 1.00 1.88 H new ATOM 695 N ASN A 46 13.752 -11.457 13.674 1.00 0.49 N ATOM 696 CA ASN A 46 13.096 -12.443 12.806 1.00 0.54 C ATOM 697 C ASN A 46 12.361 -11.752 11.663 1.00 0.51 C ATOM 698 O ASN A 46 11.137 -11.802 11.568 1.00 0.60 O ATOM 699 CB ASN A 46 12.123 -13.334 13.593 1.00 0.62 C ATOM 700 CG ASN A 46 12.816 -14.206 14.626 1.00 1.22 C ATOM 701 OD1 ASN A 46 13.958 -14.632 14.443 1.00 2.01 O ATOM 702 ND2 ASN A 46 12.126 -14.470 15.725 1.00 1.90 N ATOM 0 H ASN A 46 14.771 -11.492 13.639 1.00 0.49 H new ATOM 0 HA ASN A 46 13.878 -13.080 12.392 1.00 0.54 H new ATOM 0 HB2 ASN A 46 11.387 -12.705 14.093 1.00 0.62 H new ATOM 0 HB3 ASN A 46 11.578 -13.970 12.896 1.00 0.62 H new ATOM 0 HD21 ASN A 46 12.538 -15.046 16.460 1.00 1.90 H new ATOM 0 HD22 ASN A 46 11.183 -14.098 15.837 1.00 1.90 H new ATOM 709 N TYR A 47 13.125 -11.113 10.794 1.00 0.42 N ATOM 710 CA TYR A 47 12.567 -10.408 9.657 1.00 0.39 C ATOM 711 C TYR A 47 12.008 -11.384 8.624 1.00 0.49 C ATOM 712 O TYR A 47 12.643 -12.386 8.286 1.00 0.58 O ATOM 713 CB TYR A 47 13.648 -9.519 9.048 1.00 0.27 C ATOM 714 CG TYR A 47 13.302 -8.916 7.706 1.00 0.25 C ATOM 715 CD1 TYR A 47 12.038 -8.393 7.444 1.00 1.16 C ATOM 716 CD2 TYR A 47 14.255 -8.859 6.703 1.00 1.07 C ATOM 717 CE1 TYR A 47 11.742 -7.837 6.217 1.00 1.16 C ATOM 718 CE2 TYR A 47 13.963 -8.305 5.475 1.00 1.08 C ATOM 719 CZ TYR A 47 12.708 -7.797 5.236 1.00 0.23 C ATOM 720 OH TYR A 47 12.419 -7.244 4.014 1.00 0.24 O ATOM 0 H TYR A 47 14.142 -11.069 10.857 1.00 0.42 H new ATOM 0 HA TYR A 47 11.735 -9.787 9.990 1.00 0.39 H new ATOM 0 HB2 TYR A 47 13.868 -8.711 9.746 1.00 0.27 H new ATOM 0 HB3 TYR A 47 14.561 -10.105 8.941 1.00 0.27 H new ATOM 0 HD1 TYR A 47 11.279 -8.423 8.212 1.00 1.16 H new ATOM 0 HD2 TYR A 47 15.243 -9.255 6.886 1.00 1.07 H new ATOM 0 HE1 TYR A 47 10.758 -7.435 6.026 1.00 1.16 H new ATOM 0 HE2 TYR A 47 14.718 -8.270 4.703 1.00 1.08 H new ATOM 0 HH TYR A 47 11.561 -7.592 3.692 1.00 0.24 H new ATOM 730 N ILE A 48 10.811 -11.086 8.138 1.00 0.56 N ATOM 731 CA ILE A 48 10.152 -11.918 7.145 1.00 0.66 C ATOM 732 C ILE A 48 10.116 -11.208 5.793 1.00 0.52 C ATOM 733 O ILE A 48 9.356 -10.258 5.613 1.00 0.55 O ATOM 734 CB ILE A 48 8.701 -12.260 7.550 1.00 0.91 C ATOM 735 CG1 ILE A 48 8.588 -12.514 9.060 1.00 1.16 C ATOM 736 CG2 ILE A 48 8.217 -13.471 6.762 1.00 0.98 C ATOM 737 CD1 ILE A 48 9.342 -13.737 9.543 1.00 1.01 C ATOM 0 H ILE A 48 10.274 -10.266 8.420 1.00 0.56 H new ATOM 0 HA ILE A 48 10.728 -12.841 7.077 1.00 0.66 H new ATOM 0 HB ILE A 48 8.067 -11.405 7.314 1.00 0.91 H new ATOM 0 HG12 ILE A 48 8.959 -11.639 9.593 1.00 1.16 H new ATOM 0 HG13 ILE A 48 7.535 -12.624 9.321 1.00 1.16 H new ATOM 0 HG21 ILE A 48 7.193 -13.708 7.051 1.00 0.98 H new ATOM 0 HG22 ILE A 48 8.250 -13.248 5.696 1.00 0.98 H new ATOM 0 HG23 ILE A 48 8.861 -14.324 6.975 1.00 0.98 H new ATOM 0 HD11 ILE A 48 9.210 -13.844 10.620 1.00 1.01 H new ATOM 0 HD12 ILE A 48 8.957 -14.624 9.040 1.00 1.01 H new ATOM 0 HD13 ILE A 48 10.402 -13.624 9.317 1.00 1.01 H new ATOM 749 N PRO A 49 10.956 -11.638 4.839 1.00 0.44 N ATOM 750 CA PRO A 49 10.985 -11.054 3.497 1.00 0.35 C ATOM 751 C PRO A 49 9.671 -11.322 2.775 1.00 0.39 C ATOM 752 O PRO A 49 9.412 -12.443 2.334 1.00 0.49 O ATOM 753 CB PRO A 49 12.147 -11.777 2.798 1.00 0.40 C ATOM 754 CG PRO A 49 12.930 -12.414 3.895 1.00 0.51 C ATOM 755 CD PRO A 49 11.946 -12.709 4.990 1.00 0.55 C ATOM 0 HA PRO A 49 11.116 -9.972 3.510 1.00 0.35 H new ATOM 0 HB2 PRO A 49 11.779 -12.523 2.093 1.00 0.40 H new ATOM 0 HB3 PRO A 49 12.761 -11.078 2.231 1.00 0.40 H new ATOM 0 HG2 PRO A 49 13.414 -13.327 3.549 1.00 0.51 H new ATOM 0 HG3 PRO A 49 13.719 -11.749 4.248 1.00 0.51 H new ATOM 0 HD2 PRO A 49 11.496 -13.695 4.873 1.00 0.55 H new ATOM 0 HD3 PRO A 49 12.417 -12.688 5.973 1.00 0.55 H new ATOM 763 N ASN A 50 8.837 -10.297 2.683 1.00 0.40 N ATOM 764 CA ASN A 50 7.530 -10.412 2.046 1.00 0.45 C ATOM 765 C ASN A 50 7.658 -10.530 0.537 1.00 0.49 C ATOM 766 O ASN A 50 7.864 -9.534 -0.159 1.00 0.54 O ATOM 767 CB ASN A 50 6.662 -9.205 2.397 1.00 0.45 C ATOM 768 CG ASN A 50 6.324 -9.146 3.870 1.00 0.46 C ATOM 769 OD1 ASN A 50 5.371 -9.776 4.330 1.00 0.50 O ATOM 770 ND2 ASN A 50 7.096 -8.380 4.618 1.00 0.46 N ATOM 0 H ASN A 50 9.044 -9.366 3.045 1.00 0.40 H new ATOM 0 HA ASN A 50 7.057 -11.320 2.421 1.00 0.45 H new ATOM 0 HB2 ASN A 50 7.182 -8.291 2.110 1.00 0.45 H new ATOM 0 HB3 ASN A 50 5.740 -9.243 1.817 1.00 0.45 H new ATOM 0 HD21 ASN A 50 6.913 -8.293 5.618 1.00 0.46 H new ATOM 0 HD22 ASN A 50 7.876 -7.875 4.196 1.00 0.46 H new ATOM 777 N ARG A 51 7.518 -11.752 0.039 1.00 0.51 N ATOM 778 CA ARG A 51 7.607 -12.008 -1.391 1.00 0.57 C ATOM 779 C ARG A 51 6.338 -11.542 -2.094 1.00 0.56 C ATOM 780 O ARG A 51 6.324 -11.341 -3.311 1.00 0.59 O ATOM 781 CB ARG A 51 7.849 -13.492 -1.664 1.00 0.63 C ATOM 782 CG ARG A 51 9.222 -13.971 -1.238 1.00 1.42 C ATOM 783 CD ARG A 51 9.550 -15.300 -1.883 1.00 2.25 C ATOM 784 NE ARG A 51 10.851 -15.814 -1.463 1.00 3.08 N ATOM 785 CZ ARG A 51 11.328 -17.004 -1.820 1.00 4.17 C ATOM 786 NH1 ARG A 51 10.634 -17.780 -2.641 1.00 4.66 N ATOM 787 NH2 ARG A 51 12.506 -17.417 -1.366 1.00 5.04 N ATOM 0 H ARG A 51 7.342 -12.582 0.606 1.00 0.51 H new ATOM 0 HA ARG A 51 8.453 -11.445 -1.785 1.00 0.57 H new ATOM 0 HB2 ARG A 51 7.091 -14.077 -1.143 1.00 0.63 H new ATOM 0 HB3 ARG A 51 7.721 -13.682 -2.730 1.00 0.63 H new ATOM 0 HG2 ARG A 51 9.973 -13.231 -1.516 1.00 1.42 H new ATOM 0 HG3 ARG A 51 9.258 -14.069 -0.153 1.00 1.42 H new ATOM 0 HD2 ARG A 51 8.776 -16.025 -1.630 1.00 2.25 H new ATOM 0 HD3 ARG A 51 9.539 -15.188 -2.967 1.00 2.25 H new ATOM 0 HE ARG A 51 11.428 -15.227 -0.861 1.00 3.08 H new ATOM 0 HH11 ARG A 51 9.733 -17.465 -3.000 1.00 4.66 H new ATOM 0 HH12 ARG A 51 11.001 -18.692 -2.913 1.00 4.66 H new ATOM 0 HH21 ARG A 51 13.049 -16.821 -0.741 1.00 5.04 H new ATOM 0 HH22 ARG A 51 12.868 -18.330 -1.642 1.00 5.04 H new ATOM 801 N CYS A 52 5.276 -11.356 -1.318 1.00 0.55 N ATOM 802 CA CYS A 52 4.009 -10.897 -1.856 1.00 0.55 C ATOM 803 C CYS A 52 4.110 -9.415 -2.182 1.00 0.52 C ATOM 804 O CYS A 52 3.626 -8.955 -3.216 1.00 0.57 O ATOM 805 CB CYS A 52 2.880 -11.155 -0.863 1.00 0.56 C ATOM 806 SG CYS A 52 1.709 -12.441 -1.404 1.00 0.83 S ATOM 0 H CYS A 52 5.272 -11.518 -0.311 1.00 0.55 H new ATOM 0 HA CYS A 52 3.784 -11.450 -2.768 1.00 0.55 H new ATOM 0 HB2 CYS A 52 3.310 -11.448 0.095 1.00 0.56 H new ATOM 0 HB3 CYS A 52 2.335 -10.226 -0.697 1.00 0.56 H new ATOM 811 N ALA A 53 4.761 -8.674 -1.295 1.00 0.45 N ATOM 812 CA ALA A 53 4.970 -7.252 -1.497 1.00 0.43 C ATOM 813 C ALA A 53 5.925 -7.048 -2.660 1.00 0.43 C ATOM 814 O ALA A 53 5.851 -6.054 -3.383 1.00 0.44 O ATOM 815 CB ALA A 53 5.499 -6.618 -0.239 1.00 0.41 C ATOM 0 H ALA A 53 5.153 -9.038 -0.427 1.00 0.45 H new ATOM 0 HA ALA A 53 4.021 -6.771 -1.734 1.00 0.43 H new ATOM 0 HB1 ALA A 53 5.651 -5.552 -0.405 1.00 0.41 H new ATOM 0 HB2 ALA A 53 4.782 -6.761 0.570 1.00 0.41 H new ATOM 0 HB3 ALA A 53 6.448 -7.082 0.031 1.00 0.41 H new ATOM 821 N GLN A 54 6.819 -8.017 -2.835 1.00 0.45 N ATOM 822 CA GLN A 54 7.781 -7.992 -3.928 1.00 0.48 C ATOM 823 C GLN A 54 7.053 -8.204 -5.252 1.00 0.51 C ATOM 824 O GLN A 54 7.438 -7.654 -6.285 1.00 0.55 O ATOM 825 CB GLN A 54 8.854 -9.066 -3.715 1.00 0.50 C ATOM 826 CG GLN A 54 9.887 -9.130 -4.827 1.00 0.74 C ATOM 827 CD GLN A 54 11.014 -10.096 -4.519 1.00 0.82 C ATOM 828 OE1 GLN A 54 10.926 -11.285 -4.817 1.00 1.21 O ATOM 829 NE2 GLN A 54 12.087 -9.588 -3.930 1.00 1.07 N ATOM 0 H GLN A 54 6.896 -8.834 -2.229 1.00 0.45 H new ATOM 0 HA GLN A 54 8.277 -7.022 -3.953 1.00 0.48 H new ATOM 0 HB2 GLN A 54 9.363 -8.876 -2.770 1.00 0.50 H new ATOM 0 HB3 GLN A 54 8.369 -10.038 -3.626 1.00 0.50 H new ATOM 0 HG2 GLN A 54 9.399 -9.430 -5.754 1.00 0.74 H new ATOM 0 HG3 GLN A 54 10.301 -8.135 -4.992 1.00 0.74 H new ATOM 0 HE21 GLN A 54 12.120 -8.595 -3.699 1.00 1.07 H new ATOM 0 HE22 GLN A 54 12.880 -10.190 -3.708 1.00 1.07 H new ATOM 838 N GLN A 55 5.971 -8.977 -5.202 1.00 0.52 N ATOM 839 CA GLN A 55 5.161 -9.247 -6.383 1.00 0.57 C ATOM 840 C GLN A 55 4.282 -8.042 -6.697 1.00 0.58 C ATOM 841 O GLN A 55 3.609 -7.996 -7.727 1.00 0.74 O ATOM 842 CB GLN A 55 4.291 -10.489 -6.176 1.00 0.62 C ATOM 843 CG GLN A 55 5.046 -11.799 -6.305 1.00 0.65 C ATOM 844 CD GLN A 55 4.123 -12.986 -6.504 1.00 1.22 C ATOM 845 OE1 GLN A 55 4.377 -14.077 -5.992 1.00 1.83 O ATOM 846 NE2 GLN A 55 3.049 -12.787 -7.255 1.00 2.01 N ATOM 0 H GLN A 55 5.635 -9.428 -4.351 1.00 0.52 H new ATOM 0 HA GLN A 55 5.830 -9.434 -7.223 1.00 0.57 H new ATOM 0 HB2 GLN A 55 3.835 -10.440 -5.187 1.00 0.62 H new ATOM 0 HB3 GLN A 55 3.479 -10.476 -6.903 1.00 0.62 H new ATOM 0 HG2 GLN A 55 5.736 -11.735 -7.146 1.00 0.65 H new ATOM 0 HG3 GLN A 55 5.648 -11.957 -5.410 1.00 0.65 H new ATOM 0 HE21 GLN A 55 2.874 -11.868 -7.661 1.00 2.01 H new ATOM 0 HE22 GLN A 55 2.398 -13.553 -7.426 1.00 2.01 H new ATOM 855 N LEU A 56 4.276 -7.077 -5.786 1.00 0.51 N ATOM 856 CA LEU A 56 3.503 -5.862 -5.956 1.00 0.50 C ATOM 857 C LEU A 56 4.402 -4.701 -6.369 1.00 0.47 C ATOM 858 O LEU A 56 4.058 -3.916 -7.248 1.00 0.48 O ATOM 859 CB LEU A 56 2.782 -5.515 -4.655 1.00 0.49 C ATOM 860 CG LEU A 56 1.616 -4.554 -4.815 1.00 0.49 C ATOM 861 CD1 LEU A 56 0.460 -5.251 -5.515 1.00 0.51 C ATOM 862 CD2 LEU A 56 1.183 -4.020 -3.468 1.00 0.48 C ATOM 0 H LEU A 56 4.805 -7.118 -4.915 1.00 0.51 H new ATOM 0 HA LEU A 56 2.769 -6.032 -6.744 1.00 0.50 H new ATOM 0 HB2 LEU A 56 2.417 -6.436 -4.200 1.00 0.49 H new ATOM 0 HB3 LEU A 56 3.501 -5.080 -3.961 1.00 0.49 H new ATOM 0 HG LEU A 56 1.935 -3.711 -5.427 1.00 0.49 H new ATOM 0 HD11 LEU A 56 -0.371 -4.555 -5.625 1.00 0.51 H new ATOM 0 HD12 LEU A 56 0.782 -5.591 -6.499 1.00 0.51 H new ATOM 0 HD13 LEU A 56 0.139 -6.108 -4.923 1.00 0.51 H new ATOM 0 HD21 LEU A 56 0.347 -3.333 -3.601 1.00 0.48 H new ATOM 0 HD22 LEU A 56 0.875 -4.848 -2.830 1.00 0.48 H new ATOM 0 HD23 LEU A 56 2.015 -3.493 -3.001 1.00 0.48 H new ATOM 874 N ALA A 57 5.557 -4.605 -5.724 1.00 0.45 N ATOM 875 CA ALA A 57 6.503 -3.533 -6.004 1.00 0.44 C ATOM 876 C ALA A 57 7.413 -3.863 -7.185 1.00 0.46 C ATOM 877 O ALA A 57 7.626 -3.028 -8.067 1.00 0.49 O ATOM 878 CB ALA A 57 7.339 -3.248 -4.762 1.00 0.44 C ATOM 0 H ALA A 57 5.862 -5.258 -5.002 1.00 0.45 H new ATOM 0 HA ALA A 57 5.929 -2.647 -6.275 1.00 0.44 H new ATOM 0 HB1 ALA A 57 8.045 -2.446 -4.975 1.00 0.44 H new ATOM 0 HB2 ALA A 57 6.684 -2.947 -3.944 1.00 0.44 H new ATOM 0 HB3 ALA A 57 7.886 -4.147 -4.477 1.00 0.44 H new ATOM 884 N GLY A 58 7.936 -5.083 -7.209 1.00 0.53 N ATOM 885 CA GLY A 58 8.840 -5.484 -8.272 1.00 0.61 C ATOM 886 C GLY A 58 8.147 -6.206 -9.407 1.00 0.94 C ATOM 887 O GLY A 58 8.761 -6.477 -10.443 1.00 1.14 O ATOM 0 H GLY A 58 7.750 -5.803 -6.511 1.00 0.53 H new ATOM 0 HA2 GLY A 58 9.342 -4.600 -8.666 1.00 0.61 H new ATOM 0 HA3 GLY A 58 9.613 -6.131 -7.857 1.00 0.61 H new ATOM 891 N LYS A 59 6.880 -6.529 -9.214 1.00 1.36 N ATOM 892 CA LYS A 59 6.106 -7.222 -10.234 1.00 2.01 C ATOM 893 C LYS A 59 4.783 -6.515 -10.463 1.00 2.30 C ATOM 894 O LYS A 59 4.410 -5.630 -9.691 1.00 2.93 O ATOM 895 CB LYS A 59 5.852 -8.677 -9.838 1.00 2.88 C ATOM 896 CG LYS A 59 7.106 -9.529 -9.760 1.00 3.80 C ATOM 897 CD LYS A 59 7.745 -9.708 -11.127 1.00 4.74 C ATOM 898 CE LYS A 59 8.771 -10.825 -11.119 1.00 5.73 C ATOM 899 NZ LYS A 59 8.186 -12.112 -10.656 1.00 6.35 N ATOM 0 H LYS A 59 6.363 -6.323 -8.359 1.00 1.36 H new ATOM 0 HA LYS A 59 6.684 -7.211 -11.158 1.00 2.01 H new ATOM 0 HB2 LYS A 59 5.352 -8.696 -8.869 1.00 2.88 H new ATOM 0 HB3 LYS A 59 5.167 -9.124 -10.559 1.00 2.88 H new ATOM 0 HG2 LYS A 59 7.821 -9.064 -9.081 1.00 3.80 H new ATOM 0 HG3 LYS A 59 6.858 -10.505 -9.343 1.00 3.80 H new ATOM 0 HD2 LYS A 59 6.973 -9.927 -11.865 1.00 4.74 H new ATOM 0 HD3 LYS A 59 8.222 -8.776 -11.432 1.00 4.74 H new ATOM 0 HE2 LYS A 59 9.178 -10.951 -12.122 1.00 5.73 H new ATOM 0 HE3 LYS A 59 9.602 -10.550 -10.470 1.00 5.73 H new ATOM 0 HZ1 LYS A 59 8.737 -12.904 -11.045 1.00 6.35 H new ATOM 0 HZ2 LYS A 59 8.210 -12.150 -9.617 1.00 6.35 H new ATOM 0 HZ3 LYS A 59 7.201 -12.183 -10.982 1.00 6.35 H new ATOM 913 N GLN A 60 4.089 -6.915 -11.531 1.00 2.73 N ATOM 914 CA GLN A 60 2.791 -6.352 -11.902 1.00 3.69 C ATOM 915 C GLN A 60 2.927 -4.937 -12.468 1.00 4.33 C ATOM 916 O GLN A 60 3.539 -4.058 -11.865 1.00 4.64 O ATOM 917 CB GLN A 60 1.824 -6.364 -10.711 1.00 4.36 C ATOM 918 CG GLN A 60 0.542 -7.127 -10.985 1.00 5.02 C ATOM 919 CD GLN A 60 -0.315 -6.454 -12.036 1.00 5.85 C ATOM 920 OE1 GLN A 60 -0.123 -6.653 -13.233 1.00 6.22 O ATOM 921 NE2 GLN A 60 -1.272 -5.657 -11.592 1.00 6.50 N ATOM 0 H GLN A 60 4.415 -7.644 -12.166 1.00 2.73 H new ATOM 0 HA GLN A 60 2.379 -6.985 -12.688 1.00 3.69 H new ATOM 0 HB2 GLN A 60 2.325 -6.807 -9.850 1.00 4.36 H new ATOM 0 HB3 GLN A 60 1.577 -5.337 -10.443 1.00 4.36 H new ATOM 0 HG2 GLN A 60 0.786 -8.138 -11.312 1.00 5.02 H new ATOM 0 HG3 GLN A 60 -0.027 -7.220 -10.060 1.00 5.02 H new ATOM 0 HE21 GLN A 60 -1.397 -5.520 -10.589 1.00 6.50 H new ATOM 0 HE22 GLN A 60 -1.885 -5.180 -12.252 1.00 6.50 H new ATOM 930 N SER A 61 2.349 -4.735 -13.644 1.00 4.95 N ATOM 931 CA SER A 61 2.379 -3.442 -14.309 1.00 5.91 C ATOM 932 C SER A 61 1.013 -3.154 -14.929 1.00 6.64 C ATOM 933 O SER A 61 0.911 -2.657 -16.052 1.00 7.21 O ATOM 934 CB SER A 61 3.475 -3.415 -15.386 1.00 6.31 C ATOM 935 OG SER A 61 4.218 -4.628 -15.399 1.00 5.94 O ATOM 0 H SER A 61 1.849 -5.459 -14.160 1.00 4.95 H new ATOM 0 HA SER A 61 2.607 -2.670 -13.575 1.00 5.91 H new ATOM 0 HB2 SER A 61 3.022 -3.253 -16.364 1.00 6.31 H new ATOM 0 HB3 SER A 61 4.147 -2.577 -15.203 1.00 6.31 H new ATOM 0 HG SER A 61 4.907 -4.582 -16.095 1.00 5.94 H new ATOM 941 N LEU A 62 -0.040 -3.490 -14.196 1.00 6.90 N ATOM 942 CA LEU A 62 -1.399 -3.283 -14.667 1.00 7.83 C ATOM 943 C LEU A 62 -2.183 -2.412 -13.690 1.00 8.20 C ATOM 944 O LEU A 62 -2.477 -2.889 -12.575 1.00 8.50 O ATOM 945 CB LEU A 62 -2.096 -4.632 -14.856 1.00 8.36 C ATOM 946 CG LEU A 62 -3.582 -4.565 -15.208 1.00 8.95 C ATOM 947 CD1 LEU A 62 -3.772 -3.969 -16.586 1.00 9.40 C ATOM 948 CD2 LEU A 62 -4.200 -5.950 -15.148 1.00 9.63 C ATOM 949 OXT LEU A 62 -2.504 -1.257 -14.050 1.00 8.45 O ATOM 0 H LEU A 62 0.024 -3.909 -13.268 1.00 6.90 H new ATOM 0 HA LEU A 62 -1.360 -2.766 -15.626 1.00 7.83 H new ATOM 0 HB2 LEU A 62 -1.579 -5.180 -15.643 1.00 8.36 H new ATOM 0 HB3 LEU A 62 -1.984 -5.210 -13.939 1.00 8.36 H new ATOM 0 HG LEU A 62 -4.081 -3.926 -14.480 1.00 8.95 H new ATOM 0 HD11 LEU A 62 -4.836 -3.928 -16.821 1.00 9.40 H new ATOM 0 HD12 LEU A 62 -3.357 -2.961 -16.607 1.00 9.40 H new ATOM 0 HD13 LEU A 62 -3.261 -4.587 -17.324 1.00 9.40 H new ATOM 0 HD21 LEU A 62 -5.258 -5.887 -15.401 1.00 9.63 H new ATOM 0 HD22 LEU A 62 -3.695 -6.605 -15.858 1.00 9.63 H new ATOM 0 HD23 LEU A 62 -4.091 -6.354 -14.142 1.00 9.63 H new TER 961 LEU A 62 ATOM 962 N MET B 1 -4.552 -21.001 -10.669 1.00 4.93 N ATOM 963 CA MET B 1 -4.861 -20.110 -9.525 1.00 4.22 C ATOM 964 C MET B 1 -5.209 -18.707 -10.014 1.00 3.09 C ATOM 965 O MET B 1 -4.476 -18.113 -10.805 1.00 3.37 O ATOM 966 CB MET B 1 -3.664 -20.041 -8.574 1.00 4.90 C ATOM 967 CG MET B 1 -3.881 -19.130 -7.379 1.00 5.49 C ATOM 968 SD MET B 1 -2.363 -18.811 -6.462 1.00 6.59 S ATOM 969 CE MET B 1 -2.920 -17.553 -5.316 1.00 7.50 C ATOM 0 H1 MET B 1 -4.318 -21.951 -10.316 1.00 4.93 H new ATOM 0 H2 MET B 1 -5.379 -21.059 -11.297 1.00 4.93 H new ATOM 0 H3 MET B 1 -3.742 -20.619 -11.198 1.00 4.93 H new ATOM 0 HA MET B 1 -5.721 -20.520 -8.995 1.00 4.22 H new ATOM 0 HB2 MET B 1 -3.438 -21.046 -8.217 1.00 4.90 H new ATOM 0 HB3 MET B 1 -2.791 -19.696 -9.128 1.00 4.90 H new ATOM 0 HG2 MET B 1 -4.300 -18.183 -7.720 1.00 5.49 H new ATOM 0 HG3 MET B 1 -4.615 -19.581 -6.712 1.00 5.49 H new ATOM 0 HE1 MET B 1 -2.089 -16.892 -5.070 1.00 7.50 H new ATOM 0 HE2 MET B 1 -3.722 -16.973 -5.773 1.00 7.50 H new ATOM 0 HE3 MET B 1 -3.289 -18.027 -4.406 1.00 7.50 H new ATOM 981 N LYS B 2 -6.332 -18.183 -9.544 1.00 2.34 N ATOM 982 CA LYS B 2 -6.765 -16.844 -9.924 1.00 1.58 C ATOM 983 C LYS B 2 -7.082 -16.007 -8.689 1.00 1.26 C ATOM 984 O LYS B 2 -8.131 -16.180 -8.065 1.00 1.33 O ATOM 985 CB LYS B 2 -7.989 -16.900 -10.843 1.00 1.87 C ATOM 986 CG LYS B 2 -8.506 -15.519 -11.236 1.00 2.68 C ATOM 987 CD LYS B 2 -9.617 -15.598 -12.270 1.00 3.32 C ATOM 988 CE LYS B 2 -10.226 -14.228 -12.532 1.00 4.10 C ATOM 989 NZ LYS B 2 -10.963 -14.188 -13.826 1.00 4.87 N ATOM 0 H LYS B 2 -6.960 -18.663 -8.899 1.00 2.34 H new ATOM 0 HA LYS B 2 -5.945 -16.375 -10.467 1.00 1.58 H new ATOM 0 HB2 LYS B 2 -7.734 -17.456 -11.745 1.00 1.87 H new ATOM 0 HB3 LYS B 2 -8.786 -17.451 -10.344 1.00 1.87 H new ATOM 0 HG2 LYS B 2 -8.873 -15.004 -10.348 1.00 2.68 H new ATOM 0 HG3 LYS B 2 -7.684 -14.924 -11.633 1.00 2.68 H new ATOM 0 HD2 LYS B 2 -9.223 -16.007 -13.200 1.00 3.32 H new ATOM 0 HD3 LYS B 2 -10.391 -16.282 -11.924 1.00 3.32 H new ATOM 0 HE2 LYS B 2 -10.905 -13.971 -11.719 1.00 4.10 H new ATOM 0 HE3 LYS B 2 -9.438 -13.475 -12.539 1.00 4.10 H new ATOM 0 HZ1 LYS B 2 -11.363 -13.239 -13.968 1.00 4.87 H new ATOM 0 HZ2 LYS B 2 -10.310 -14.409 -14.605 1.00 4.87 H new ATOM 0 HZ3 LYS B 2 -11.731 -14.889 -13.810 1.00 4.87 H new ATOM 1003 N PRO B 3 -6.164 -15.108 -8.305 1.00 1.11 N ATOM 1004 CA PRO B 3 -6.346 -14.232 -7.151 1.00 1.02 C ATOM 1005 C PRO B 3 -7.321 -13.096 -7.444 1.00 0.91 C ATOM 1006 O PRO B 3 -6.933 -12.033 -7.937 1.00 1.09 O ATOM 1007 CB PRO B 3 -4.944 -13.670 -6.877 1.00 1.25 C ATOM 1008 CG PRO B 3 -4.020 -14.388 -7.808 1.00 1.49 C ATOM 1009 CD PRO B 3 -4.869 -14.879 -8.948 1.00 1.32 C ATOM 0 HA PRO B 3 -6.767 -14.771 -6.302 1.00 1.02 H new ATOM 0 HB2 PRO B 3 -4.914 -12.594 -7.051 1.00 1.25 H new ATOM 0 HB3 PRO B 3 -4.655 -13.833 -5.839 1.00 1.25 H new ATOM 0 HG2 PRO B 3 -3.235 -13.723 -8.166 1.00 1.49 H new ATOM 0 HG3 PRO B 3 -3.528 -15.219 -7.303 1.00 1.49 H new ATOM 0 HD2 PRO B 3 -4.938 -14.142 -9.749 1.00 1.32 H new ATOM 0 HD3 PRO B 3 -4.468 -15.792 -9.389 1.00 1.32 H new ATOM 1017 N VAL B 4 -8.587 -13.331 -7.133 1.00 0.78 N ATOM 1018 CA VAL B 4 -9.629 -12.343 -7.355 1.00 0.66 C ATOM 1019 C VAL B 4 -9.494 -11.209 -6.357 1.00 0.59 C ATOM 1020 O VAL B 4 -9.294 -11.433 -5.166 1.00 0.64 O ATOM 1021 CB VAL B 4 -11.032 -12.966 -7.249 1.00 0.63 C ATOM 1022 CG1 VAL B 4 -12.112 -11.936 -7.524 1.00 0.56 C ATOM 1023 CG2 VAL B 4 -11.159 -14.133 -8.210 1.00 0.73 C ATOM 0 H VAL B 4 -8.918 -14.204 -6.723 1.00 0.78 H new ATOM 0 HA VAL B 4 -9.508 -11.955 -8.366 1.00 0.66 H new ATOM 0 HB VAL B 4 -11.166 -13.329 -6.230 1.00 0.63 H new ATOM 0 HG11 VAL B 4 -13.092 -12.406 -7.442 1.00 0.56 H new ATOM 0 HG12 VAL B 4 -12.036 -11.126 -6.798 1.00 0.56 H new ATOM 0 HG13 VAL B 4 -11.985 -11.535 -8.530 1.00 0.56 H new ATOM 0 HG21 VAL B 4 -12.156 -14.566 -8.127 1.00 0.73 H new ATOM 0 HG22 VAL B 4 -11.000 -13.783 -9.230 1.00 0.73 H new ATOM 0 HG23 VAL B 4 -10.413 -14.889 -7.965 1.00 0.73 H new ATOM 1033 N THR B 5 -9.613 -9.999 -6.851 1.00 0.50 N ATOM 1034 CA THR B 5 -9.471 -8.826 -6.030 1.00 0.45 C ATOM 1035 C THR B 5 -10.829 -8.319 -5.582 1.00 0.40 C ATOM 1036 O THR B 5 -11.866 -8.796 -6.048 1.00 0.39 O ATOM 1037 CB THR B 5 -8.745 -7.728 -6.822 1.00 0.42 C ATOM 1038 OG1 THR B 5 -9.636 -7.174 -7.797 1.00 0.39 O ATOM 1039 CG2 THR B 5 -7.522 -8.300 -7.530 1.00 0.48 C ATOM 0 H THR B 5 -9.811 -9.803 -7.832 1.00 0.50 H new ATOM 0 HA THR B 5 -8.889 -9.087 -5.146 1.00 0.45 H new ATOM 0 HB THR B 5 -8.422 -6.952 -6.127 1.00 0.42 H new ATOM 0 HG1 THR B 5 -9.608 -7.717 -8.612 1.00 0.39 H new ATOM 0 HG21 THR B 5 -7.020 -7.508 -8.086 1.00 0.48 H new ATOM 0 HG22 THR B 5 -6.836 -8.716 -6.792 1.00 0.48 H new ATOM 0 HG23 THR B 5 -7.834 -9.085 -8.219 1.00 0.48 H new ATOM 1047 N LEU B 6 -10.832 -7.330 -4.696 1.00 0.39 N ATOM 1048 CA LEU B 6 -12.077 -6.769 -4.213 1.00 0.36 C ATOM 1049 C LEU B 6 -12.587 -5.800 -5.270 1.00 0.32 C ATOM 1050 O LEU B 6 -13.720 -5.319 -5.233 1.00 0.30 O ATOM 1051 CB LEU B 6 -11.828 -6.111 -2.854 1.00 0.41 C ATOM 1052 CG LEU B 6 -12.748 -4.972 -2.449 1.00 0.44 C ATOM 1053 CD1 LEU B 6 -13.119 -5.099 -0.986 1.00 0.65 C ATOM 1054 CD2 LEU B 6 -12.059 -3.652 -2.691 1.00 0.50 C ATOM 0 H LEU B 6 -9.991 -6.906 -4.303 1.00 0.39 H new ATOM 0 HA LEU B 6 -12.844 -7.527 -4.057 1.00 0.36 H new ATOM 0 HB2 LEU B 6 -11.893 -6.884 -2.089 1.00 0.41 H new ATOM 0 HB3 LEU B 6 -10.804 -5.737 -2.844 1.00 0.41 H new ATOM 0 HG LEU B 6 -13.657 -5.018 -3.048 1.00 0.44 H new ATOM 0 HD11 LEU B 6 -13.779 -4.278 -0.705 1.00 0.65 H new ATOM 0 HD12 LEU B 6 -13.630 -6.048 -0.821 1.00 0.65 H new ATOM 0 HD13 LEU B 6 -12.216 -5.063 -0.377 1.00 0.65 H new ATOM 0 HD21 LEU B 6 -12.721 -2.837 -2.400 1.00 0.50 H new ATOM 0 HD22 LEU B 6 -11.144 -3.605 -2.100 1.00 0.50 H new ATOM 0 HD23 LEU B 6 -11.813 -3.559 -3.749 1.00 0.50 H new ATOM 1066 N TYR B 7 -11.719 -5.576 -6.249 1.00 0.33 N ATOM 1067 CA TYR B 7 -11.998 -4.707 -7.372 1.00 0.32 C ATOM 1068 C TYR B 7 -12.864 -5.442 -8.389 1.00 0.32 C ATOM 1069 O TYR B 7 -13.783 -4.866 -8.978 1.00 0.35 O ATOM 1070 CB TYR B 7 -10.680 -4.280 -8.019 1.00 0.36 C ATOM 1071 CG TYR B 7 -10.032 -3.079 -7.362 1.00 0.37 C ATOM 1072 CD1 TYR B 7 -9.272 -3.186 -6.190 1.00 1.24 C ATOM 1073 CD2 TYR B 7 -10.188 -1.820 -7.925 1.00 1.27 C ATOM 1074 CE1 TYR B 7 -8.701 -2.067 -5.620 1.00 1.25 C ATOM 1075 CE2 TYR B 7 -9.613 -0.703 -7.354 1.00 1.27 C ATOM 1076 CZ TYR B 7 -8.870 -0.831 -6.204 1.00 0.44 C ATOM 1077 OH TYR B 7 -8.295 0.286 -5.633 1.00 0.49 O ATOM 0 H TYR B 7 -10.792 -6.001 -6.280 1.00 0.33 H new ATOM 0 HA TYR B 7 -12.534 -3.823 -7.026 1.00 0.32 H new ATOM 0 HB2 TYR B 7 -9.984 -5.118 -7.988 1.00 0.36 H new ATOM 0 HB3 TYR B 7 -10.860 -4.054 -9.070 1.00 0.36 H new ATOM 0 HD1 TYR B 7 -9.132 -4.153 -5.729 1.00 1.24 H new ATOM 0 HD2 TYR B 7 -10.771 -1.712 -8.828 1.00 1.27 H new ATOM 0 HE1 TYR B 7 -8.120 -2.160 -4.714 1.00 1.25 H new ATOM 0 HE2 TYR B 7 -9.746 0.268 -7.808 1.00 1.27 H new ATOM 0 HH TYR B 7 -8.847 0.591 -4.883 1.00 0.49 H new ATOM 1087 N ASP B 8 -12.564 -6.727 -8.573 1.00 0.33 N ATOM 1088 CA ASP B 8 -13.302 -7.574 -9.510 1.00 0.35 C ATOM 1089 C ASP B 8 -14.741 -7.745 -9.048 1.00 0.31 C ATOM 1090 O ASP B 8 -15.672 -7.724 -9.854 1.00 0.33 O ATOM 1091 CB ASP B 8 -12.640 -8.952 -9.648 1.00 0.41 C ATOM 1092 CG ASP B 8 -11.238 -8.872 -10.216 1.00 0.49 C ATOM 1093 OD1 ASP B 8 -11.094 -8.577 -11.421 1.00 1.07 O ATOM 1094 OD2 ASP B 8 -10.269 -9.111 -9.457 1.00 1.31 O ATOM 0 H ASP B 8 -11.810 -7.207 -8.082 1.00 0.33 H new ATOM 0 HA ASP B 8 -13.290 -7.083 -10.483 1.00 0.35 H new ATOM 0 HB2 ASP B 8 -12.605 -9.433 -8.671 1.00 0.41 H new ATOM 0 HB3 ASP B 8 -13.253 -9.582 -10.292 1.00 0.41 H new ATOM 1099 N VAL B 9 -14.909 -7.908 -7.739 1.00 0.27 N ATOM 1100 CA VAL B 9 -16.229 -8.078 -7.134 1.00 0.25 C ATOM 1101 C VAL B 9 -17.102 -6.855 -7.403 1.00 0.25 C ATOM 1102 O VAL B 9 -18.303 -6.972 -7.665 1.00 0.28 O ATOM 1103 CB VAL B 9 -16.108 -8.305 -5.611 1.00 0.25 C ATOM 1104 CG1 VAL B 9 -17.472 -8.502 -4.967 1.00 0.27 C ATOM 1105 CG2 VAL B 9 -15.211 -9.499 -5.328 1.00 0.28 C ATOM 0 H VAL B 9 -14.140 -7.926 -7.070 1.00 0.27 H new ATOM 0 HA VAL B 9 -16.695 -8.955 -7.584 1.00 0.25 H new ATOM 0 HB VAL B 9 -15.661 -7.412 -5.173 1.00 0.25 H new ATOM 0 HG11 VAL B 9 -17.349 -8.659 -3.895 1.00 0.27 H new ATOM 0 HG12 VAL B 9 -18.085 -7.617 -5.136 1.00 0.27 H new ATOM 0 HG13 VAL B 9 -17.960 -9.371 -5.407 1.00 0.27 H new ATOM 0 HG21 VAL B 9 -15.134 -9.649 -4.251 1.00 0.28 H new ATOM 0 HG22 VAL B 9 -15.636 -10.391 -5.789 1.00 0.28 H new ATOM 0 HG23 VAL B 9 -14.219 -9.315 -5.741 1.00 0.28 H new ATOM 1115 N ALA B 10 -16.477 -5.685 -7.354 1.00 0.25 N ATOM 1116 CA ALA B 10 -17.172 -4.431 -7.592 1.00 0.28 C ATOM 1117 C ALA B 10 -17.635 -4.311 -9.036 1.00 0.33 C ATOM 1118 O ALA B 10 -18.776 -3.930 -9.304 1.00 0.37 O ATOM 1119 CB ALA B 10 -16.267 -3.268 -7.246 1.00 0.31 C ATOM 0 H ALA B 10 -15.483 -5.581 -7.150 1.00 0.25 H new ATOM 0 HA ALA B 10 -18.056 -4.413 -6.954 1.00 0.28 H new ATOM 0 HB1 ALA B 10 -16.794 -2.331 -7.427 1.00 0.31 H new ATOM 0 HB2 ALA B 10 -15.983 -3.328 -6.195 1.00 0.31 H new ATOM 0 HB3 ALA B 10 -15.372 -3.306 -7.867 1.00 0.31 H new ATOM 1125 N GLU B 11 -16.740 -4.644 -9.958 1.00 0.36 N ATOM 1126 CA GLU B 11 -17.029 -4.567 -11.385 1.00 0.44 C ATOM 1127 C GLU B 11 -18.201 -5.465 -11.765 1.00 0.47 C ATOM 1128 O GLU B 11 -19.090 -5.062 -12.517 1.00 0.56 O ATOM 1129 CB GLU B 11 -15.794 -4.969 -12.184 1.00 0.51 C ATOM 1130 CG GLU B 11 -14.624 -4.017 -12.018 1.00 1.27 C ATOM 1131 CD GLU B 11 -13.683 -4.062 -13.201 1.00 1.67 C ATOM 1132 OE1 GLU B 11 -13.989 -3.415 -14.228 1.00 2.16 O ATOM 1133 OE2 GLU B 11 -12.645 -4.755 -13.117 1.00 2.34 O ATOM 0 H GLU B 11 -15.799 -4.973 -9.740 1.00 0.36 H new ATOM 0 HA GLU B 11 -17.301 -3.538 -11.619 1.00 0.44 H new ATOM 0 HB2 GLU B 11 -15.484 -5.968 -11.879 1.00 0.51 H new ATOM 0 HB3 GLU B 11 -16.058 -5.026 -13.240 1.00 0.51 H new ATOM 0 HG2 GLU B 11 -14.999 -3.001 -11.892 1.00 1.27 H new ATOM 0 HG3 GLU B 11 -14.077 -4.270 -11.110 1.00 1.27 H new ATOM 1140 N TYR B 12 -18.198 -6.677 -11.230 1.00 0.43 N ATOM 1141 CA TYR B 12 -19.249 -7.647 -11.513 1.00 0.49 C ATOM 1142 C TYR B 12 -20.600 -7.190 -10.963 1.00 0.49 C ATOM 1143 O TYR B 12 -21.631 -7.342 -11.620 1.00 0.58 O ATOM 1144 CB TYR B 12 -18.886 -9.002 -10.914 1.00 0.49 C ATOM 1145 CG TYR B 12 -19.803 -10.116 -11.356 1.00 0.58 C ATOM 1146 CD1 TYR B 12 -19.629 -10.730 -12.586 1.00 1.15 C ATOM 1147 CD2 TYR B 12 -20.850 -10.545 -10.549 1.00 1.48 C ATOM 1148 CE1 TYR B 12 -20.468 -11.739 -13.004 1.00 1.18 C ATOM 1149 CE2 TYR B 12 -21.696 -11.556 -10.961 1.00 1.58 C ATOM 1150 CZ TYR B 12 -21.502 -12.149 -12.189 1.00 0.81 C ATOM 1151 OH TYR B 12 -22.344 -13.157 -12.603 1.00 0.94 O ATOM 0 H TYR B 12 -17.476 -7.015 -10.594 1.00 0.43 H new ATOM 0 HA TYR B 12 -19.335 -7.734 -12.596 1.00 0.49 H new ATOM 0 HB2 TYR B 12 -17.862 -9.252 -11.192 1.00 0.49 H new ATOM 0 HB3 TYR B 12 -18.912 -8.929 -9.827 1.00 0.49 H new ATOM 0 HD1 TYR B 12 -18.821 -10.412 -13.228 1.00 1.15 H new ATOM 0 HD2 TYR B 12 -21.004 -10.081 -9.586 1.00 1.48 H new ATOM 0 HE1 TYR B 12 -20.317 -12.207 -13.966 1.00 1.18 H new ATOM 0 HE2 TYR B 12 -22.505 -11.880 -10.324 1.00 1.58 H new ATOM 0 HH TYR B 12 -23.018 -13.325 -11.911 1.00 0.94 H new ATOM 1161 N ALA B 13 -20.593 -6.643 -9.754 1.00 0.43 N ATOM 1162 CA ALA B 13 -21.821 -6.183 -9.122 1.00 0.48 C ATOM 1163 C ALA B 13 -22.310 -4.865 -9.723 1.00 0.52 C ATOM 1164 O ALA B 13 -23.479 -4.504 -9.577 1.00 0.64 O ATOM 1165 CB ALA B 13 -21.620 -6.050 -7.621 1.00 0.43 C ATOM 0 H ALA B 13 -19.752 -6.508 -9.193 1.00 0.43 H new ATOM 0 HA ALA B 13 -22.593 -6.929 -9.310 1.00 0.48 H new ATOM 0 HB1 ALA B 13 -22.545 -5.705 -7.159 1.00 0.43 H new ATOM 0 HB2 ALA B 13 -21.345 -7.019 -7.204 1.00 0.43 H new ATOM 0 HB3 ALA B 13 -20.825 -5.331 -7.423 1.00 0.43 H new ATOM 1171 N GLY B 14 -21.410 -4.150 -10.395 1.00 0.48 N ATOM 1172 CA GLY B 14 -21.771 -2.889 -11.021 1.00 0.55 C ATOM 1173 C GLY B 14 -21.690 -1.713 -10.068 1.00 0.52 C ATOM 1174 O GLY B 14 -22.315 -0.675 -10.292 1.00 0.59 O ATOM 0 H GLY B 14 -20.435 -4.423 -10.517 1.00 0.48 H new ATOM 0 HA2 GLY B 14 -21.111 -2.709 -11.870 1.00 0.55 H new ATOM 0 HA3 GLY B 14 -22.785 -2.962 -11.415 1.00 0.55 H new ATOM 1178 N VAL B 15 -20.919 -1.880 -9.003 1.00 0.47 N ATOM 1179 CA VAL B 15 -20.744 -0.841 -7.996 1.00 0.46 C ATOM 1180 C VAL B 15 -19.284 -0.402 -7.938 1.00 0.43 C ATOM 1181 O VAL B 15 -18.450 -0.910 -8.691 1.00 0.43 O ATOM 1182 CB VAL B 15 -21.176 -1.345 -6.599 1.00 0.43 C ATOM 1183 CG1 VAL B 15 -22.670 -1.657 -6.581 1.00 0.50 C ATOM 1184 CG2 VAL B 15 -20.357 -2.567 -6.193 1.00 0.36 C ATOM 0 H VAL B 15 -20.398 -2.736 -8.812 1.00 0.47 H new ATOM 0 HA VAL B 15 -21.372 0.004 -8.278 1.00 0.46 H new ATOM 0 HB VAL B 15 -20.987 -0.555 -5.872 1.00 0.43 H new ATOM 0 HG11 VAL B 15 -22.956 -2.010 -5.590 1.00 0.50 H new ATOM 0 HG12 VAL B 15 -23.233 -0.755 -6.821 1.00 0.50 H new ATOM 0 HG13 VAL B 15 -22.889 -2.429 -7.319 1.00 0.50 H new ATOM 0 HG21 VAL B 15 -20.675 -2.907 -5.208 1.00 0.36 H new ATOM 0 HG22 VAL B 15 -20.510 -3.365 -6.919 1.00 0.36 H new ATOM 0 HG23 VAL B 15 -19.300 -2.303 -6.162 1.00 0.36 H new ATOM 1194 N SER B 16 -18.972 0.546 -7.061 1.00 0.45 N ATOM 1195 CA SER B 16 -17.598 0.990 -6.917 1.00 0.46 C ATOM 1196 C SER B 16 -16.847 -0.032 -6.071 1.00 0.41 C ATOM 1197 O SER B 16 -17.463 -0.789 -5.318 1.00 0.39 O ATOM 1198 CB SER B 16 -17.534 2.376 -6.266 1.00 0.50 C ATOM 1199 OG SER B 16 -17.908 2.327 -4.900 1.00 0.64 O ATOM 0 H SER B 16 -19.642 1.013 -6.450 1.00 0.45 H new ATOM 0 HA SER B 16 -17.137 1.070 -7.901 1.00 0.46 H new ATOM 0 HB2 SER B 16 -16.523 2.774 -6.353 1.00 0.50 H new ATOM 0 HB3 SER B 16 -18.193 3.061 -6.800 1.00 0.50 H new ATOM 0 HG SER B 16 -18.724 1.793 -4.803 1.00 0.64 H new ATOM 1205 N TYR B 17 -15.526 -0.067 -6.179 1.00 0.42 N ATOM 1206 CA TYR B 17 -14.738 -1.026 -5.411 1.00 0.41 C ATOM 1207 C TYR B 17 -14.847 -0.742 -3.913 1.00 0.41 C ATOM 1208 O TYR B 17 -14.619 -1.623 -3.079 1.00 0.40 O ATOM 1209 CB TYR B 17 -13.282 -1.019 -5.890 1.00 0.51 C ATOM 1210 CG TYR B 17 -12.320 -0.275 -5.000 1.00 0.40 C ATOM 1211 CD1 TYR B 17 -12.216 1.105 -5.057 1.00 1.31 C ATOM 1212 CD2 TYR B 17 -11.509 -0.961 -4.114 1.00 1.26 C ATOM 1213 CE1 TYR B 17 -11.328 1.779 -4.253 1.00 1.49 C ATOM 1214 CE2 TYR B 17 -10.617 -0.305 -3.299 1.00 1.43 C ATOM 1215 CZ TYR B 17 -10.532 1.076 -3.375 1.00 1.02 C ATOM 1216 OH TYR B 17 -9.650 1.756 -2.582 1.00 1.42 O ATOM 0 H TYR B 17 -14.981 0.549 -6.783 1.00 0.42 H new ATOM 0 HA TYR B 17 -15.138 -2.026 -5.578 1.00 0.41 H new ATOM 0 HB2 TYR B 17 -12.942 -2.050 -5.985 1.00 0.51 H new ATOM 0 HB3 TYR B 17 -13.246 -0.579 -6.886 1.00 0.51 H new ATOM 0 HD1 TYR B 17 -12.841 1.659 -5.742 1.00 1.31 H new ATOM 0 HD2 TYR B 17 -11.578 -2.037 -4.061 1.00 1.26 H new ATOM 0 HE1 TYR B 17 -11.254 2.855 -4.309 1.00 1.49 H new ATOM 0 HE2 TYR B 17 -9.993 -0.857 -2.611 1.00 1.43 H new ATOM 0 HH TYR B 17 -9.019 1.124 -2.178 1.00 1.42 H new ATOM 1226 N GLN B 18 -15.241 0.478 -3.575 1.00 0.42 N ATOM 1227 CA GLN B 18 -15.388 0.860 -2.184 1.00 0.44 C ATOM 1228 C GLN B 18 -16.723 0.389 -1.642 1.00 0.38 C ATOM 1229 O GLN B 18 -16.894 0.258 -0.434 1.00 0.38 O ATOM 1230 CB GLN B 18 -15.213 2.357 -2.003 1.00 0.52 C ATOM 1231 CG GLN B 18 -13.801 2.708 -1.600 1.00 0.97 C ATOM 1232 CD GLN B 18 -13.505 4.172 -1.732 1.00 0.84 C ATOM 1233 OE1 GLN B 18 -13.719 4.941 -0.801 1.00 0.93 O ATOM 1234 NE2 GLN B 18 -13.002 4.564 -2.892 1.00 0.87 N ATOM 0 H GLN B 18 -15.463 1.215 -4.244 1.00 0.42 H new ATOM 0 HA GLN B 18 -14.600 0.371 -1.611 1.00 0.44 H new ATOM 0 HB2 GLN B 18 -15.464 2.868 -2.932 1.00 0.52 H new ATOM 0 HB3 GLN B 18 -15.908 2.716 -1.244 1.00 0.52 H new ATOM 0 HG2 GLN B 18 -13.636 2.400 -0.567 1.00 0.97 H new ATOM 0 HG3 GLN B 18 -13.101 2.144 -2.216 1.00 0.97 H new ATOM 0 HE21 GLN B 18 -12.843 3.883 -3.635 1.00 0.87 H new ATOM 0 HE22 GLN B 18 -12.773 5.547 -3.043 1.00 0.87 H new ATOM 1243 N THR B 19 -17.667 0.125 -2.538 1.00 0.39 N ATOM 1244 CA THR B 19 -18.964 -0.394 -2.137 1.00 0.38 C ATOM 1245 C THR B 19 -18.745 -1.766 -1.522 1.00 0.34 C ATOM 1246 O THR B 19 -19.417 -2.168 -0.575 1.00 0.36 O ATOM 1247 CB THR B 19 -19.920 -0.502 -3.336 1.00 0.41 C ATOM 1248 OG1 THR B 19 -19.850 0.700 -4.107 1.00 0.54 O ATOM 1249 CG2 THR B 19 -21.353 -0.733 -2.882 1.00 0.45 C ATOM 0 H THR B 19 -17.557 0.262 -3.543 1.00 0.39 H new ATOM 0 HA THR B 19 -19.422 0.286 -1.418 1.00 0.38 H new ATOM 0 HB THR B 19 -19.615 -1.355 -3.942 1.00 0.41 H new ATOM 0 HG1 THR B 19 -20.752 0.965 -4.383 1.00 0.54 H new ATOM 0 HG21 THR B 19 -22.004 -0.805 -3.754 1.00 0.45 H new ATOM 0 HG22 THR B 19 -21.409 -1.659 -2.310 1.00 0.45 H new ATOM 0 HG23 THR B 19 -21.675 0.099 -2.256 1.00 0.45 H new ATOM 1257 N VAL B 20 -17.752 -2.456 -2.071 1.00 0.33 N ATOM 1258 CA VAL B 20 -17.357 -3.769 -1.596 1.00 0.33 C ATOM 1259 C VAL B 20 -16.548 -3.601 -0.316 1.00 0.36 C ATOM 1260 O VAL B 20 -16.708 -4.359 0.637 1.00 0.40 O ATOM 1261 CB VAL B 20 -16.527 -4.521 -2.656 1.00 0.39 C ATOM 1262 CG1 VAL B 20 -16.215 -5.940 -2.214 1.00 0.40 C ATOM 1263 CG2 VAL B 20 -17.259 -4.534 -3.985 1.00 0.44 C ATOM 0 H VAL B 20 -17.200 -2.117 -2.859 1.00 0.33 H new ATOM 0 HA VAL B 20 -18.251 -4.361 -1.400 1.00 0.33 H new ATOM 0 HB VAL B 20 -15.581 -3.993 -2.775 1.00 0.39 H new ATOM 0 HG11 VAL B 20 -15.629 -6.441 -2.985 1.00 0.40 H new ATOM 0 HG12 VAL B 20 -15.646 -5.915 -1.285 1.00 0.40 H new ATOM 0 HG13 VAL B 20 -17.146 -6.484 -2.055 1.00 0.40 H new ATOM 0 HG21 VAL B 20 -16.662 -5.068 -4.724 1.00 0.44 H new ATOM 0 HG22 VAL B 20 -18.221 -5.033 -3.866 1.00 0.44 H new ATOM 0 HG23 VAL B 20 -17.421 -3.510 -4.321 1.00 0.44 H new ATOM 1273 N SER B 21 -15.692 -2.576 -0.308 1.00 0.39 N ATOM 1274 CA SER B 21 -14.868 -2.239 0.845 1.00 0.45 C ATOM 1275 C SER B 21 -15.739 -2.016 2.083 1.00 0.45 C ATOM 1276 O SER B 21 -15.389 -2.440 3.187 1.00 0.52 O ATOM 1277 CB SER B 21 -14.066 -0.973 0.531 1.00 0.50 C ATOM 1278 OG SER B 21 -13.567 -0.361 1.707 1.00 1.29 O ATOM 0 H SER B 21 -15.554 -1.957 -1.107 1.00 0.39 H new ATOM 0 HA SER B 21 -14.187 -3.064 1.054 1.00 0.45 H new ATOM 0 HB2 SER B 21 -13.235 -1.223 -0.129 1.00 0.50 H new ATOM 0 HB3 SER B 21 -14.698 -0.266 -0.006 1.00 0.50 H new ATOM 0 HG SER B 21 -12.723 -0.787 1.965 1.00 1.29 H new ATOM 1284 N ARG B 22 -16.879 -1.360 1.882 1.00 0.44 N ATOM 1285 CA ARG B 22 -17.804 -1.073 2.974 1.00 0.51 C ATOM 1286 C ARG B 22 -18.390 -2.366 3.538 1.00 0.54 C ATOM 1287 O ARG B 22 -18.507 -2.526 4.753 1.00 0.65 O ATOM 1288 CB ARG B 22 -18.933 -0.156 2.502 1.00 0.59 C ATOM 1289 CG ARG B 22 -18.467 1.208 2.006 1.00 0.72 C ATOM 1290 CD ARG B 22 -17.822 2.026 3.117 1.00 1.03 C ATOM 1291 NE ARG B 22 -17.617 3.421 2.725 1.00 1.46 N ATOM 1292 CZ ARG B 22 -17.102 4.351 3.530 1.00 2.05 C ATOM 1293 NH1 ARG B 22 -16.700 4.036 4.755 1.00 2.55 N ATOM 1294 NH2 ARG B 22 -16.979 5.601 3.107 1.00 2.66 N ATOM 0 H ARG B 22 -17.184 -1.017 0.971 1.00 0.44 H new ATOM 0 HA ARG B 22 -17.245 -0.566 3.761 1.00 0.51 H new ATOM 0 HB2 ARG B 22 -19.479 -0.654 1.701 1.00 0.59 H new ATOM 0 HB3 ARG B 22 -19.635 -0.011 3.323 1.00 0.59 H new ATOM 0 HG2 ARG B 22 -17.754 1.074 1.193 1.00 0.72 H new ATOM 0 HG3 ARG B 22 -19.317 1.756 1.598 1.00 0.72 H new ATOM 0 HD2 ARG B 22 -18.451 1.988 4.006 1.00 1.03 H new ATOM 0 HD3 ARG B 22 -16.864 1.581 3.385 1.00 1.03 H new ATOM 0 HE ARG B 22 -17.884 3.698 1.780 1.00 1.46 H new ATOM 0 HH11 ARG B 22 -16.784 3.076 5.088 1.00 2.55 H new ATOM 0 HH12 ARG B 22 -16.307 4.754 5.363 1.00 2.55 H new ATOM 0 HH21 ARG B 22 -17.278 5.852 2.165 1.00 2.66 H new ATOM 0 HH22 ARG B 22 -16.585 6.312 3.724 1.00 2.66 H new ATOM 1308 N VAL B 23 -18.739 -3.288 2.643 1.00 0.50 N ATOM 1309 CA VAL B 23 -19.304 -4.575 3.031 1.00 0.58 C ATOM 1310 C VAL B 23 -18.241 -5.445 3.689 1.00 0.62 C ATOM 1311 O VAL B 23 -18.510 -6.157 4.657 1.00 0.74 O ATOM 1312 CB VAL B 23 -19.880 -5.327 1.809 1.00 0.57 C ATOM 1313 CG1 VAL B 23 -20.542 -6.626 2.234 1.00 0.67 C ATOM 1314 CG2 VAL B 23 -20.860 -4.452 1.045 1.00 0.55 C ATOM 0 H VAL B 23 -18.638 -3.164 1.636 1.00 0.50 H new ATOM 0 HA VAL B 23 -20.110 -4.377 3.737 1.00 0.58 H new ATOM 0 HB VAL B 23 -19.051 -5.569 1.144 1.00 0.57 H new ATOM 0 HG11 VAL B 23 -20.939 -7.136 1.356 1.00 0.67 H new ATOM 0 HG12 VAL B 23 -19.808 -7.265 2.724 1.00 0.67 H new ATOM 0 HG13 VAL B 23 -21.355 -6.410 2.927 1.00 0.67 H new ATOM 0 HG21 VAL B 23 -21.251 -5.004 0.190 1.00 0.55 H new ATOM 0 HG22 VAL B 23 -21.683 -4.169 1.701 1.00 0.55 H new ATOM 0 HG23 VAL B 23 -20.350 -3.555 0.695 1.00 0.55 H new ATOM 1324 N VAL B 24 -17.033 -5.383 3.149 1.00 0.59 N ATOM 1325 CA VAL B 24 -15.916 -6.148 3.670 1.00 0.69 C ATOM 1326 C VAL B 24 -15.543 -5.676 5.075 1.00 0.76 C ATOM 1327 O VAL B 24 -15.254 -6.491 5.954 1.00 0.89 O ATOM 1328 CB VAL B 24 -14.694 -6.054 2.722 1.00 0.68 C ATOM 1329 CG1 VAL B 24 -13.402 -6.414 3.433 1.00 0.81 C ATOM 1330 CG2 VAL B 24 -14.902 -6.962 1.521 1.00 0.66 C ATOM 0 H VAL B 24 -16.803 -4.804 2.342 1.00 0.59 H new ATOM 0 HA VAL B 24 -16.222 -7.192 3.730 1.00 0.69 H new ATOM 0 HB VAL B 24 -14.608 -5.020 2.387 1.00 0.68 H new ATOM 0 HG11 VAL B 24 -12.569 -6.336 2.735 1.00 0.81 H new ATOM 0 HG12 VAL B 24 -13.242 -5.730 4.266 1.00 0.81 H new ATOM 0 HG13 VAL B 24 -13.466 -7.435 3.809 1.00 0.81 H new ATOM 0 HG21 VAL B 24 -14.040 -6.892 0.858 1.00 0.66 H new ATOM 0 HG22 VAL B 24 -15.017 -7.992 1.859 1.00 0.66 H new ATOM 0 HG23 VAL B 24 -15.799 -6.654 0.983 1.00 0.66 H new ATOM 1340 N ASN B 25 -15.578 -4.362 5.289 1.00 0.72 N ATOM 1341 CA ASN B 25 -15.253 -3.786 6.590 1.00 0.79 C ATOM 1342 C ASN B 25 -16.312 -4.170 7.609 1.00 1.20 C ATOM 1343 O ASN B 25 -16.055 -4.953 8.524 1.00 1.68 O ATOM 1344 CB ASN B 25 -15.161 -2.260 6.498 1.00 0.77 C ATOM 1345 CG ASN B 25 -13.757 -1.774 6.202 1.00 1.05 C ATOM 1346 OD1 ASN B 25 -12.923 -1.680 7.101 1.00 1.59 O ATOM 1347 ND2 ASN B 25 -13.488 -1.460 4.943 1.00 1.07 N ATOM 0 H ASN B 25 -15.829 -3.676 4.577 1.00 0.72 H new ATOM 0 HA ASN B 25 -14.286 -4.178 6.906 1.00 0.79 H new ATOM 0 HB2 ASN B 25 -15.835 -1.906 5.718 1.00 0.77 H new ATOM 0 HB3 ASN B 25 -15.502 -1.823 7.436 1.00 0.77 H new ATOM 0 HD21 ASN B 25 -12.559 -1.125 4.688 1.00 1.07 H new ATOM 0 HD22 ASN B 25 -14.210 -1.553 4.229 1.00 1.07 H new ATOM 1354 N GLN B 26 -17.507 -3.626 7.426 1.00 1.35 N ATOM 1355 CA GLN B 26 -18.627 -3.901 8.313 1.00 1.99 C ATOM 1356 C GLN B 26 -19.929 -3.944 7.519 1.00 1.65 C ATOM 1357 O GLN B 26 -20.159 -4.869 6.743 1.00 2.19 O ATOM 1358 CB GLN B 26 -18.710 -2.845 9.422 1.00 2.71 C ATOM 1359 CG GLN B 26 -17.733 -3.068 10.570 1.00 2.97 C ATOM 1360 CD GLN B 26 -17.981 -4.372 11.309 1.00 3.58 C ATOM 1361 OE1 GLN B 26 -18.797 -4.437 12.227 1.00 4.02 O ATOM 1362 NE2 GLN B 26 -17.281 -5.419 10.912 1.00 4.03 N ATOM 0 H GLN B 26 -17.726 -2.985 6.663 1.00 1.35 H new ATOM 0 HA GLN B 26 -18.469 -4.874 8.779 1.00 1.99 H new ATOM 0 HB2 GLN B 26 -18.525 -1.863 8.988 1.00 2.71 H new ATOM 0 HB3 GLN B 26 -19.725 -2.831 9.820 1.00 2.71 H new ATOM 0 HG2 GLN B 26 -16.715 -3.064 10.181 1.00 2.97 H new ATOM 0 HG3 GLN B 26 -17.809 -2.238 11.272 1.00 2.97 H new ATOM 0 HE21 GLN B 26 -16.613 -5.326 10.147 1.00 4.03 H new ATOM 0 HE22 GLN B 26 -17.408 -6.321 11.371 1.00 4.03 H new ATOM 1371 N ALA B 27 -20.771 -2.938 7.712 1.00 1.33 N ATOM 1372 CA ALA B 27 -22.042 -2.850 7.010 1.00 1.22 C ATOM 1373 C ALA B 27 -22.579 -1.423 7.048 1.00 1.28 C ATOM 1374 O ALA B 27 -23.783 -1.202 6.898 1.00 2.15 O ATOM 1375 CB ALA B 27 -23.058 -3.799 7.626 1.00 1.58 C ATOM 0 H ALA B 27 -20.594 -2.166 8.355 1.00 1.33 H new ATOM 0 HA ALA B 27 -21.875 -3.136 5.971 1.00 1.22 H new ATOM 0 HB1 ALA B 27 -24.003 -3.720 7.088 1.00 1.58 H new ATOM 0 HB2 ALA B 27 -22.687 -4.822 7.560 1.00 1.58 H new ATOM 0 HB3 ALA B 27 -23.213 -3.537 8.673 1.00 1.58 H new ATOM 1381 N SER B 28 -21.686 -0.461 7.257 1.00 1.09 N ATOM 1382 CA SER B 28 -22.070 0.941 7.328 1.00 1.11 C ATOM 1383 C SER B 28 -22.152 1.550 5.933 1.00 1.02 C ATOM 1384 O SER B 28 -21.287 1.300 5.090 1.00 1.03 O ATOM 1385 CB SER B 28 -21.061 1.701 8.188 1.00 1.38 C ATOM 1386 OG SER B 28 -19.747 1.214 7.969 1.00 1.98 O ATOM 0 H SER B 28 -20.688 -0.630 7.380 1.00 1.09 H new ATOM 0 HA SER B 28 -23.058 1.016 7.783 1.00 1.11 H new ATOM 0 HB2 SER B 28 -21.104 2.765 7.953 1.00 1.38 H new ATOM 0 HB3 SER B 28 -21.322 1.597 9.241 1.00 1.38 H new ATOM 0 HG SER B 28 -19.116 1.714 8.527 1.00 1.98 H new ATOM 1392 N HIS B 29 -23.182 2.370 5.703 1.00 0.98 N ATOM 1393 CA HIS B 29 -23.409 3.012 4.419 1.00 0.93 C ATOM 1394 C HIS B 29 -23.595 1.968 3.324 1.00 0.85 C ATOM 1395 O HIS B 29 -23.199 2.178 2.179 1.00 1.08 O ATOM 1396 CB HIS B 29 -22.287 3.976 4.010 1.00 1.01 C ATOM 1397 CG HIS B 29 -21.431 4.546 5.100 1.00 0.97 C ATOM 1398 ND1 HIS B 29 -20.135 4.926 4.865 1.00 1.04 N ATOM 1399 CD2 HIS B 29 -21.678 4.840 6.401 1.00 1.26 C ATOM 1400 CE1 HIS B 29 -19.618 5.424 5.959 1.00 1.07 C ATOM 1401 NE2 HIS B 29 -20.528 5.387 6.915 1.00 1.31 N ATOM 0 H HIS B 29 -23.880 2.603 6.409 1.00 0.98 H new ATOM 0 HA HIS B 29 -24.317 3.603 4.539 1.00 0.93 H new ATOM 0 HB2 HIS B 29 -21.635 3.455 3.309 1.00 1.01 H new ATOM 0 HB3 HIS B 29 -22.739 4.807 3.468 1.00 1.01 H new ATOM 0 HD2 HIS B 29 -22.604 4.675 6.932 1.00 1.26 H new ATOM 0 HE1 HIS B 29 -18.612 5.803 6.063 1.00 1.07 H new ATOM 0 HE2 HIS B 29 -20.399 5.710 7.874 1.00 1.31 H new ATOM 1410 N VAL B 30 -24.178 0.836 3.688 1.00 0.81 N ATOM 1411 CA VAL B 30 -24.433 -0.231 2.738 1.00 0.78 C ATOM 1412 C VAL B 30 -25.889 -0.640 2.810 1.00 0.81 C ATOM 1413 O VAL B 30 -26.395 -0.982 3.881 1.00 0.92 O ATOM 1414 CB VAL B 30 -23.560 -1.478 2.986 1.00 0.88 C ATOM 1415 CG1 VAL B 30 -23.626 -2.401 1.784 1.00 1.01 C ATOM 1416 CG2 VAL B 30 -22.122 -1.098 3.284 1.00 1.22 C ATOM 0 H VAL B 30 -24.484 0.634 4.640 1.00 0.81 H new ATOM 0 HA VAL B 30 -24.182 0.161 1.752 1.00 0.78 H new ATOM 0 HB VAL B 30 -23.951 -1.999 3.860 1.00 0.88 H new ATOM 0 HG11 VAL B 30 -23.007 -3.280 1.966 1.00 1.01 H new ATOM 0 HG12 VAL B 30 -24.658 -2.711 1.620 1.00 1.01 H new ATOM 0 HG13 VAL B 30 -23.260 -1.876 0.902 1.00 1.01 H new ATOM 0 HG21 VAL B 30 -21.535 -2.001 3.454 1.00 1.22 H new ATOM 0 HG22 VAL B 30 -21.708 -0.549 2.438 1.00 1.22 H new ATOM 0 HG23 VAL B 30 -22.089 -0.471 4.175 1.00 1.22 H new ATOM 1426 N SER B 31 -26.565 -0.600 1.678 1.00 0.82 N ATOM 1427 CA SER B 31 -27.962 -0.973 1.628 1.00 0.88 C ATOM 1428 C SER B 31 -28.091 -2.490 1.543 1.00 0.94 C ATOM 1429 O SER B 31 -27.114 -3.185 1.251 1.00 1.42 O ATOM 1430 CB SER B 31 -28.648 -0.308 0.438 1.00 0.90 C ATOM 1431 OG SER B 31 -27.701 0.299 -0.426 1.00 0.83 O ATOM 0 H SER B 31 -26.169 -0.313 0.783 1.00 0.82 H new ATOM 0 HA SER B 31 -28.453 -0.630 2.539 1.00 0.88 H new ATOM 0 HB2 SER B 31 -29.225 -1.050 -0.114 1.00 0.90 H new ATOM 0 HB3 SER B 31 -29.353 0.443 0.794 1.00 0.90 H new ATOM 0 HG SER B 31 -27.125 -0.391 -0.816 1.00 0.83 H new ATOM 1437 N ALA B 32 -29.285 -3.003 1.808 1.00 0.88 N ATOM 1438 CA ALA B 32 -29.528 -4.438 1.756 1.00 0.92 C ATOM 1439 C ALA B 32 -29.244 -4.987 0.363 1.00 0.86 C ATOM 1440 O ALA B 32 -28.631 -6.045 0.212 1.00 0.88 O ATOM 1441 CB ALA B 32 -30.953 -4.750 2.172 1.00 1.07 C ATOM 0 H ALA B 32 -30.101 -2.446 2.061 1.00 0.88 H new ATOM 0 HA ALA B 32 -28.849 -4.924 2.456 1.00 0.92 H new ATOM 0 HB1 ALA B 32 -31.118 -5.827 2.127 1.00 1.07 H new ATOM 0 HB2 ALA B 32 -31.120 -4.399 3.190 1.00 1.07 H new ATOM 0 HB3 ALA B 32 -31.647 -4.249 1.497 1.00 1.07 H new ATOM 1447 N LYS B 33 -29.669 -4.239 -0.648 1.00 0.85 N ATOM 1448 CA LYS B 33 -29.478 -4.628 -2.042 1.00 0.87 C ATOM 1449 C LYS B 33 -27.998 -4.763 -2.392 1.00 0.79 C ATOM 1450 O LYS B 33 -27.591 -5.738 -3.026 1.00 0.86 O ATOM 1451 CB LYS B 33 -30.138 -3.599 -2.963 1.00 0.95 C ATOM 1452 CG LYS B 33 -31.655 -3.696 -2.992 1.00 1.51 C ATOM 1453 CD LYS B 33 -32.131 -4.849 -3.862 1.00 1.82 C ATOM 1454 CE LYS B 33 -32.079 -4.488 -5.338 1.00 2.55 C ATOM 1455 NZ LYS B 33 -33.097 -3.468 -5.697 1.00 3.30 N ATOM 0 H LYS B 33 -30.154 -3.350 -0.527 1.00 0.85 H new ATOM 0 HA LYS B 33 -29.945 -5.603 -2.184 1.00 0.87 H new ATOM 0 HB2 LYS B 33 -29.852 -2.598 -2.640 1.00 0.95 H new ATOM 0 HB3 LYS B 33 -29.754 -3.730 -3.975 1.00 0.95 H new ATOM 0 HG2 LYS B 33 -32.030 -3.828 -1.977 1.00 1.51 H new ATOM 0 HG3 LYS B 33 -32.072 -2.761 -3.367 1.00 1.51 H new ATOM 0 HD2 LYS B 33 -31.510 -5.726 -3.678 1.00 1.82 H new ATOM 0 HD3 LYS B 33 -33.151 -5.117 -3.587 1.00 1.82 H new ATOM 0 HE2 LYS B 33 -31.086 -4.112 -5.585 1.00 2.55 H new ATOM 0 HE3 LYS B 33 -32.238 -5.385 -5.937 1.00 2.55 H new ATOM 0 HZ1 LYS B 33 -33.254 -3.481 -6.725 1.00 3.30 H new ATOM 0 HZ2 LYS B 33 -33.990 -3.681 -5.208 1.00 3.30 H new ATOM 0 HZ3 LYS B 33 -32.761 -2.526 -5.410 1.00 3.30 H new ATOM 1469 N THR B 34 -27.196 -3.792 -1.973 1.00 0.68 N ATOM 1470 CA THR B 34 -25.768 -3.811 -2.264 1.00 0.61 C ATOM 1471 C THR B 34 -25.029 -4.856 -1.438 1.00 0.57 C ATOM 1472 O THR B 34 -24.191 -5.580 -1.969 1.00 0.54 O ATOM 1473 CB THR B 34 -25.122 -2.436 -2.030 1.00 0.64 C ATOM 1474 OG1 THR B 34 -25.918 -1.673 -1.119 1.00 0.79 O ATOM 1475 CG2 THR B 34 -24.974 -1.685 -3.343 1.00 0.73 C ATOM 0 H THR B 34 -27.508 -2.985 -1.433 1.00 0.68 H new ATOM 0 HA THR B 34 -25.680 -4.072 -3.319 1.00 0.61 H new ATOM 0 HB THR B 34 -24.131 -2.586 -1.603 1.00 0.64 H new ATOM 0 HG1 THR B 34 -26.115 -2.213 -0.325 1.00 0.79 H new ATOM 0 HG21 THR B 34 -24.515 -0.714 -3.157 1.00 0.73 H new ATOM 0 HG22 THR B 34 -24.344 -2.260 -4.022 1.00 0.73 H new ATOM 0 HG23 THR B 34 -25.956 -1.542 -3.793 1.00 0.73 H new ATOM 1483 N ARG B 35 -25.346 -4.951 -0.148 1.00 0.61 N ATOM 1484 CA ARG B 35 -24.683 -5.920 0.726 1.00 0.61 C ATOM 1485 C ARG B 35 -24.903 -7.343 0.219 1.00 0.60 C ATOM 1486 O ARG B 35 -23.998 -8.177 0.266 1.00 0.60 O ATOM 1487 CB ARG B 35 -25.183 -5.791 2.168 1.00 0.69 C ATOM 1488 CG ARG B 35 -24.416 -6.655 3.157 1.00 0.89 C ATOM 1489 CD ARG B 35 -24.741 -6.288 4.596 1.00 1.00 C ATOM 1490 NE ARG B 35 -26.168 -6.406 4.888 1.00 1.71 N ATOM 1491 CZ ARG B 35 -26.679 -6.449 6.119 1.00 2.09 C ATOM 1492 NH1 ARG B 35 -25.878 -6.463 7.178 1.00 1.87 N ATOM 1493 NH2 ARG B 35 -27.995 -6.496 6.288 1.00 3.21 N ATOM 0 H ARG B 35 -26.051 -4.375 0.313 1.00 0.61 H new ATOM 0 HA ARG B 35 -23.615 -5.705 0.712 1.00 0.61 H new ATOM 0 HB2 ARG B 35 -25.111 -4.748 2.477 1.00 0.69 H new ATOM 0 HB3 ARG B 35 -26.238 -6.062 2.204 1.00 0.69 H new ATOM 0 HG2 ARG B 35 -24.657 -7.704 2.986 1.00 0.89 H new ATOM 0 HG3 ARG B 35 -23.346 -6.541 2.986 1.00 0.89 H new ATOM 0 HD2 ARG B 35 -24.180 -6.935 5.270 1.00 1.00 H new ATOM 0 HD3 ARG B 35 -24.416 -5.266 4.791 1.00 1.00 H new ATOM 0 HE ARG B 35 -26.814 -6.459 4.100 1.00 1.71 H new ATOM 0 HH11 ARG B 35 -24.866 -6.441 7.052 1.00 1.87 H new ATOM 0 HH12 ARG B 35 -26.275 -6.496 8.117 1.00 1.87 H new ATOM 0 HH21 ARG B 35 -28.614 -6.499 5.477 1.00 3.21 H new ATOM 0 HH22 ARG B 35 -28.387 -6.529 7.229 1.00 3.21 H new ATOM 1507 N GLU B 36 -26.107 -7.606 -0.274 1.00 0.63 N ATOM 1508 CA GLU B 36 -26.448 -8.920 -0.798 1.00 0.67 C ATOM 1509 C GLU B 36 -25.769 -9.154 -2.143 1.00 0.62 C ATOM 1510 O GLU B 36 -25.242 -10.234 -2.402 1.00 0.65 O ATOM 1511 CB GLU B 36 -27.962 -9.049 -0.953 1.00 0.75 C ATOM 1512 CG GLU B 36 -28.704 -9.220 0.363 1.00 0.84 C ATOM 1513 CD GLU B 36 -30.184 -9.480 0.163 1.00 1.38 C ATOM 1514 OE1 GLU B 36 -30.534 -10.530 -0.423 1.00 2.09 O ATOM 1515 OE2 GLU B 36 -31.004 -8.637 0.589 1.00 1.98 O ATOM 0 H GLU B 36 -26.864 -6.924 -0.321 1.00 0.63 H new ATOM 0 HA GLU B 36 -26.095 -9.672 -0.093 1.00 0.67 H new ATOM 0 HB2 GLU B 36 -28.342 -8.162 -1.461 1.00 0.75 H new ATOM 0 HB3 GLU B 36 -28.180 -9.902 -1.595 1.00 0.75 H new ATOM 0 HG2 GLU B 36 -28.265 -10.048 0.920 1.00 0.84 H new ATOM 0 HG3 GLU B 36 -28.574 -8.324 0.969 1.00 0.84 H new ATOM 1522 N LYS B 37 -25.767 -8.126 -2.980 1.00 0.58 N ATOM 1523 CA LYS B 37 -25.169 -8.205 -4.308 1.00 0.56 C ATOM 1524 C LYS B 37 -23.657 -8.402 -4.234 1.00 0.48 C ATOM 1525 O LYS B 37 -23.093 -9.225 -4.954 1.00 0.49 O ATOM 1526 CB LYS B 37 -25.491 -6.936 -5.098 1.00 0.58 C ATOM 1527 CG LYS B 37 -24.938 -6.932 -6.512 1.00 1.00 C ATOM 1528 CD LYS B 37 -25.723 -5.988 -7.410 1.00 1.13 C ATOM 1529 CE LYS B 37 -25.734 -4.564 -6.868 1.00 1.31 C ATOM 1530 NZ LYS B 37 -26.815 -3.744 -7.476 1.00 1.66 N ATOM 0 H LYS B 37 -26.177 -7.218 -2.761 1.00 0.58 H new ATOM 0 HA LYS B 37 -25.593 -9.071 -4.815 1.00 0.56 H new ATOM 0 HB2 LYS B 37 -26.573 -6.812 -5.142 1.00 0.58 H new ATOM 0 HB3 LYS B 37 -25.093 -6.075 -4.561 1.00 0.58 H new ATOM 0 HG2 LYS B 37 -23.890 -6.633 -6.494 1.00 1.00 H new ATOM 0 HG3 LYS B 37 -24.974 -7.941 -6.922 1.00 1.00 H new ATOM 0 HD2 LYS B 37 -25.288 -5.992 -8.409 1.00 1.13 H new ATOM 0 HD3 LYS B 37 -26.748 -6.347 -7.507 1.00 1.13 H new ATOM 0 HE2 LYS B 37 -25.863 -4.589 -5.786 1.00 1.31 H new ATOM 0 HE3 LYS B 37 -24.770 -4.095 -7.063 1.00 1.31 H new ATOM 0 HZ1 LYS B 37 -26.787 -2.783 -7.079 1.00 1.66 H new ATOM 0 HZ2 LYS B 37 -26.678 -3.698 -8.506 1.00 1.66 H new ATOM 0 HZ3 LYS B 37 -27.738 -4.177 -7.268 1.00 1.66 H new ATOM 1544 N VAL B 38 -23.007 -7.647 -3.360 1.00 0.43 N ATOM 1545 CA VAL B 38 -21.563 -7.731 -3.206 1.00 0.37 C ATOM 1546 C VAL B 38 -21.127 -9.100 -2.680 1.00 0.39 C ATOM 1547 O VAL B 38 -20.259 -9.746 -3.268 1.00 0.37 O ATOM 1548 CB VAL B 38 -21.034 -6.626 -2.272 1.00 0.36 C ATOM 1549 CG1 VAL B 38 -19.554 -6.820 -1.995 1.00 0.36 C ATOM 1550 CG2 VAL B 38 -21.285 -5.256 -2.883 1.00 0.38 C ATOM 0 H VAL B 38 -23.458 -6.969 -2.746 1.00 0.43 H new ATOM 0 HA VAL B 38 -21.135 -7.590 -4.198 1.00 0.37 H new ATOM 0 HB VAL B 38 -21.569 -6.690 -1.325 1.00 0.36 H new ATOM 0 HG11 VAL B 38 -19.201 -6.029 -1.334 1.00 0.36 H new ATOM 0 HG12 VAL B 38 -19.397 -7.788 -1.519 1.00 0.36 H new ATOM 0 HG13 VAL B 38 -19.000 -6.783 -2.933 1.00 0.36 H new ATOM 0 HG21 VAL B 38 -20.907 -4.484 -2.213 1.00 0.38 H new ATOM 0 HG22 VAL B 38 -20.773 -5.186 -3.843 1.00 0.38 H new ATOM 0 HG23 VAL B 38 -22.356 -5.114 -3.032 1.00 0.38 H new ATOM 1560 N GLU B 39 -21.736 -9.543 -1.582 1.00 0.45 N ATOM 1561 CA GLU B 39 -21.391 -10.837 -0.994 1.00 0.50 C ATOM 1562 C GLU B 39 -21.690 -11.983 -1.956 1.00 0.53 C ATOM 1563 O GLU B 39 -20.982 -12.990 -1.967 1.00 0.55 O ATOM 1564 CB GLU B 39 -22.126 -11.048 0.329 1.00 0.59 C ATOM 1565 CG GLU B 39 -21.635 -10.140 1.445 1.00 0.63 C ATOM 1566 CD GLU B 39 -21.913 -10.705 2.821 1.00 1.12 C ATOM 1567 OE1 GLU B 39 -23.084 -10.682 3.252 1.00 1.79 O ATOM 1568 OE2 GLU B 39 -20.962 -11.182 3.477 1.00 1.76 O ATOM 0 H GLU B 39 -22.465 -9.031 -1.085 1.00 0.45 H new ATOM 0 HA GLU B 39 -20.319 -10.832 -0.798 1.00 0.50 H new ATOM 0 HB2 GLU B 39 -23.192 -10.878 0.175 1.00 0.59 H new ATOM 0 HB3 GLU B 39 -22.010 -12.087 0.639 1.00 0.59 H new ATOM 0 HG2 GLU B 39 -20.563 -9.979 1.332 1.00 0.63 H new ATOM 0 HG3 GLU B 39 -22.115 -9.166 1.353 1.00 0.63 H new ATOM 1575 N ALA B 40 -22.732 -11.827 -2.769 1.00 0.55 N ATOM 1576 CA ALA B 40 -23.095 -12.850 -3.743 1.00 0.61 C ATOM 1577 C ALA B 40 -22.102 -12.860 -4.899 1.00 0.53 C ATOM 1578 O ALA B 40 -21.762 -13.917 -5.433 1.00 0.55 O ATOM 1579 CB ALA B 40 -24.508 -12.631 -4.263 1.00 0.70 C ATOM 0 H ALA B 40 -23.337 -11.006 -2.772 1.00 0.55 H new ATOM 0 HA ALA B 40 -23.062 -13.818 -3.244 1.00 0.61 H new ATOM 0 HB1 ALA B 40 -24.753 -13.407 -4.988 1.00 0.70 H new ATOM 0 HB2 ALA B 40 -25.212 -12.674 -3.432 1.00 0.70 H new ATOM 0 HB3 ALA B 40 -24.572 -11.654 -4.742 1.00 0.70 H new ATOM 1585 N ALA B 41 -21.630 -11.673 -5.270 1.00 0.47 N ATOM 1586 CA ALA B 41 -20.665 -11.529 -6.351 1.00 0.43 C ATOM 1587 C ALA B 41 -19.344 -12.194 -5.984 1.00 0.38 C ATOM 1588 O ALA B 41 -18.619 -12.684 -6.848 1.00 0.39 O ATOM 1589 CB ALA B 41 -20.444 -10.060 -6.680 1.00 0.42 C ATOM 0 H ALA B 41 -21.904 -10.793 -4.833 1.00 0.47 H new ATOM 0 HA ALA B 41 -21.068 -12.025 -7.234 1.00 0.43 H new ATOM 0 HB1 ALA B 41 -19.720 -9.974 -7.490 1.00 0.42 H new ATOM 0 HB2 ALA B 41 -21.388 -9.610 -6.988 1.00 0.42 H new ATOM 0 HB3 ALA B 41 -20.066 -9.543 -5.798 1.00 0.42 H new ATOM 1595 N MET B 42 -19.057 -12.229 -4.688 1.00 0.38 N ATOM 1596 CA MET B 42 -17.832 -12.839 -4.177 1.00 0.40 C ATOM 1597 C MET B 42 -17.763 -14.324 -4.537 1.00 0.45 C ATOM 1598 O MET B 42 -16.686 -14.914 -4.575 1.00 0.52 O ATOM 1599 CB MET B 42 -17.751 -12.671 -2.661 1.00 0.44 C ATOM 1600 CG MET B 42 -17.556 -11.229 -2.219 1.00 0.41 C ATOM 1601 SD MET B 42 -17.713 -11.029 -0.436 1.00 0.51 S ATOM 1602 CE MET B 42 -17.415 -9.274 -0.261 1.00 0.46 C ATOM 0 H MET B 42 -19.661 -11.839 -3.965 1.00 0.38 H new ATOM 0 HA MET B 42 -16.986 -12.333 -4.642 1.00 0.40 H new ATOM 0 HB2 MET B 42 -18.664 -13.060 -2.211 1.00 0.44 H new ATOM 0 HB3 MET B 42 -16.927 -13.274 -2.280 1.00 0.44 H new ATOM 0 HG2 MET B 42 -16.571 -10.885 -2.535 1.00 0.41 H new ATOM 0 HG3 MET B 42 -18.290 -10.596 -2.719 1.00 0.41 H new ATOM 0 HE1 MET B 42 -16.505 -9.115 0.318 1.00 0.46 H new ATOM 0 HE2 MET B 42 -17.300 -8.824 -1.247 1.00 0.46 H new ATOM 0 HE3 MET B 42 -18.258 -8.811 0.253 1.00 0.46 H new ATOM 1612 N ALA B 43 -18.919 -14.917 -4.815 1.00 0.46 N ATOM 1613 CA ALA B 43 -18.984 -16.329 -5.166 1.00 0.53 C ATOM 1614 C ALA B 43 -18.918 -16.519 -6.678 1.00 0.55 C ATOM 1615 O ALA B 43 -18.481 -17.564 -7.164 1.00 0.62 O ATOM 1616 CB ALA B 43 -20.254 -16.953 -4.607 1.00 0.61 C ATOM 0 H ALA B 43 -19.822 -14.442 -4.804 1.00 0.46 H new ATOM 0 HA ALA B 43 -18.123 -16.830 -4.724 1.00 0.53 H new ATOM 0 HB1 ALA B 43 -20.290 -18.009 -4.877 1.00 0.61 H new ATOM 0 HB2 ALA B 43 -20.260 -16.855 -3.521 1.00 0.61 H new ATOM 0 HB3 ALA B 43 -21.123 -16.443 -5.022 1.00 0.61 H new ATOM 1622 N GLU B 44 -19.334 -15.495 -7.415 1.00 0.54 N ATOM 1623 CA GLU B 44 -19.331 -15.548 -8.869 1.00 0.58 C ATOM 1624 C GLU B 44 -17.913 -15.481 -9.411 1.00 0.59 C ATOM 1625 O GLU B 44 -17.514 -16.294 -10.248 1.00 0.68 O ATOM 1626 CB GLU B 44 -20.167 -14.406 -9.441 1.00 0.58 C ATOM 1627 CG GLU B 44 -21.542 -14.289 -8.804 1.00 0.63 C ATOM 1628 CD GLU B 44 -22.435 -15.471 -9.116 1.00 0.84 C ATOM 1629 OE1 GLU B 44 -22.413 -16.456 -8.350 1.00 1.29 O ATOM 1630 OE2 GLU B 44 -23.164 -15.419 -10.130 1.00 1.55 O ATOM 0 H GLU B 44 -19.678 -14.617 -7.026 1.00 0.54 H new ATOM 0 HA GLU B 44 -19.770 -16.497 -9.176 1.00 0.58 H new ATOM 0 HB2 GLU B 44 -19.630 -13.468 -9.304 1.00 0.58 H new ATOM 0 HB3 GLU B 44 -20.283 -14.553 -10.515 1.00 0.58 H new ATOM 0 HG2 GLU B 44 -21.430 -14.199 -7.723 1.00 0.63 H new ATOM 0 HG3 GLU B 44 -22.022 -13.375 -9.152 1.00 0.63 H new ATOM 1637 N LEU B 45 -17.148 -14.513 -8.921 1.00 0.52 N ATOM 1638 CA LEU B 45 -15.764 -14.343 -9.355 1.00 0.55 C ATOM 1639 C LEU B 45 -14.850 -15.274 -8.579 1.00 0.55 C ATOM 1640 O LEU B 45 -13.705 -15.488 -8.973 1.00 0.63 O ATOM 1641 CB LEU B 45 -15.261 -12.904 -9.135 1.00 0.51 C ATOM 1642 CG LEU B 45 -15.985 -11.774 -9.874 1.00 0.60 C ATOM 1643 CD1 LEU B 45 -16.509 -12.232 -11.219 1.00 0.97 C ATOM 1644 CD2 LEU B 45 -17.100 -11.211 -9.016 1.00 0.99 C ATOM 0 H LEU B 45 -17.460 -13.835 -8.225 1.00 0.52 H new ATOM 0 HA LEU B 45 -15.743 -14.572 -10.420 1.00 0.55 H new ATOM 0 HB2 LEU B 45 -15.310 -12.691 -8.067 1.00 0.51 H new ATOM 0 HB3 LEU B 45 -14.209 -12.870 -9.419 1.00 0.51 H new ATOM 0 HG LEU B 45 -15.262 -10.981 -10.064 1.00 0.60 H new ATOM 0 HD11 LEU B 45 -17.016 -11.403 -11.713 1.00 0.97 H new ATOM 0 HD12 LEU B 45 -15.677 -12.569 -11.838 1.00 0.97 H new ATOM 0 HD13 LEU B 45 -17.211 -13.053 -11.075 1.00 0.97 H new ATOM 0 HD21 LEU B 45 -17.605 -10.409 -9.555 1.00 0.99 H new ATOM 0 HD22 LEU B 45 -17.816 -12.000 -8.786 1.00 0.99 H new ATOM 0 HD23 LEU B 45 -16.683 -10.818 -8.089 1.00 0.99 H new ATOM 1656 N ASN B 46 -15.373 -15.828 -7.482 1.00 0.53 N ATOM 1657 CA ASN B 46 -14.594 -16.694 -6.593 1.00 0.59 C ATOM 1658 C ASN B 46 -13.545 -15.822 -5.916 1.00 0.54 C ATOM 1659 O ASN B 46 -12.342 -16.074 -5.986 1.00 0.59 O ATOM 1660 CB ASN B 46 -13.947 -17.870 -7.346 1.00 0.71 C ATOM 1661 CG ASN B 46 -13.219 -18.841 -6.423 1.00 1.02 C ATOM 1662 OD1 ASN B 46 -12.190 -19.406 -6.796 1.00 1.77 O ATOM 1663 ND2 ASN B 46 -13.743 -19.047 -5.218 1.00 1.40 N ATOM 0 H ASN B 46 -16.340 -15.691 -7.187 1.00 0.53 H new ATOM 0 HA ASN B 46 -15.251 -17.149 -5.852 1.00 0.59 H new ATOM 0 HB2 ASN B 46 -14.718 -18.410 -7.897 1.00 0.71 H new ATOM 0 HB3 ASN B 46 -13.243 -17.480 -8.082 1.00 0.71 H new ATOM 0 HD21 ASN B 46 -13.291 -19.691 -4.569 1.00 1.40 H new ATOM 0 HD22 ASN B 46 -14.597 -18.561 -4.943 1.00 1.40 H new ATOM 1670 N TYR B 47 -14.046 -14.777 -5.272 1.00 0.48 N ATOM 1671 CA TYR B 47 -13.221 -13.788 -4.601 1.00 0.46 C ATOM 1672 C TYR B 47 -12.307 -14.402 -3.552 1.00 0.52 C ATOM 1673 O TYR B 47 -12.753 -14.981 -2.559 1.00 0.58 O ATOM 1674 CB TYR B 47 -14.105 -12.702 -3.975 1.00 0.43 C ATOM 1675 CG TYR B 47 -13.346 -11.633 -3.206 1.00 0.42 C ATOM 1676 CD1 TYR B 47 -12.046 -11.283 -3.550 1.00 1.31 C ATOM 1677 CD2 TYR B 47 -13.939 -10.973 -2.136 1.00 1.20 C ATOM 1678 CE1 TYR B 47 -11.357 -10.314 -2.847 1.00 1.33 C ATOM 1679 CE2 TYR B 47 -13.256 -10.000 -1.430 1.00 1.21 C ATOM 1680 CZ TYR B 47 -11.965 -9.677 -1.789 1.00 0.46 C ATOM 1681 OH TYR B 47 -11.277 -8.715 -1.081 1.00 0.51 O ATOM 0 H TYR B 47 -15.047 -14.592 -5.201 1.00 0.48 H new ATOM 0 HA TYR B 47 -12.575 -13.340 -5.357 1.00 0.46 H new ATOM 0 HB2 TYR B 47 -14.682 -12.222 -4.765 1.00 0.43 H new ATOM 0 HB3 TYR B 47 -14.819 -13.177 -3.302 1.00 0.43 H new ATOM 0 HD1 TYR B 47 -11.566 -11.777 -4.382 1.00 1.31 H new ATOM 0 HD2 TYR B 47 -14.950 -11.224 -1.851 1.00 1.20 H new ATOM 0 HE1 TYR B 47 -10.346 -10.057 -3.126 1.00 1.33 H new ATOM 0 HE2 TYR B 47 -13.731 -9.496 -0.602 1.00 1.21 H new ATOM 0 HH TYR B 47 -11.849 -8.363 -0.367 1.00 0.51 H new ATOM 1691 N ILE B 48 -11.019 -14.262 -3.802 1.00 0.56 N ATOM 1692 CA ILE B 48 -9.994 -14.733 -2.898 1.00 0.64 C ATOM 1693 C ILE B 48 -9.066 -13.566 -2.597 1.00 0.59 C ATOM 1694 O ILE B 48 -8.137 -13.295 -3.358 1.00 0.58 O ATOM 1695 CB ILE B 48 -9.192 -15.910 -3.486 1.00 0.73 C ATOM 1696 CG1 ILE B 48 -10.141 -17.037 -3.894 1.00 0.83 C ATOM 1697 CG2 ILE B 48 -8.178 -16.408 -2.470 1.00 0.84 C ATOM 1698 CD1 ILE B 48 -9.471 -18.156 -4.653 1.00 1.28 C ATOM 0 H ILE B 48 -10.655 -13.815 -4.644 1.00 0.56 H new ATOM 0 HA ILE B 48 -10.468 -15.103 -1.989 1.00 0.64 H new ATOM 0 HB ILE B 48 -8.656 -15.569 -4.372 1.00 0.73 H new ATOM 0 HG12 ILE B 48 -10.608 -17.447 -2.999 1.00 0.83 H new ATOM 0 HG13 ILE B 48 -10.940 -16.622 -4.509 1.00 0.83 H new ATOM 0 HG21 ILE B 48 -7.616 -17.240 -2.895 1.00 0.84 H new ATOM 0 HG22 ILE B 48 -7.493 -15.600 -2.214 1.00 0.84 H new ATOM 0 HG23 ILE B 48 -8.697 -16.742 -1.572 1.00 0.84 H new ATOM 0 HD11 ILE B 48 -10.209 -18.917 -4.907 1.00 1.28 H new ATOM 0 HD12 ILE B 48 -9.028 -17.761 -5.567 1.00 1.28 H new ATOM 0 HD13 ILE B 48 -8.691 -18.600 -4.034 1.00 1.28 H new ATOM 1710 N PRO B 49 -9.349 -12.857 -1.486 1.00 0.62 N ATOM 1711 CA PRO B 49 -8.611 -11.668 -1.043 1.00 0.64 C ATOM 1712 C PRO B 49 -7.127 -11.665 -1.391 1.00 0.60 C ATOM 1713 O PRO B 49 -6.416 -12.628 -1.095 1.00 0.66 O ATOM 1714 CB PRO B 49 -8.810 -11.726 0.466 1.00 0.80 C ATOM 1715 CG PRO B 49 -10.195 -12.248 0.622 1.00 0.83 C ATOM 1716 CD PRO B 49 -10.424 -13.193 -0.531 1.00 0.72 C ATOM 0 HA PRO B 49 -8.974 -10.765 -1.534 1.00 0.64 H new ATOM 0 HB2 PRO B 49 -8.080 -12.381 0.941 1.00 0.80 H new ATOM 0 HB3 PRO B 49 -8.700 -10.742 0.922 1.00 0.80 H new ATOM 0 HG2 PRO B 49 -10.311 -12.763 1.576 1.00 0.83 H new ATOM 0 HG3 PRO B 49 -10.921 -11.435 0.608 1.00 0.83 H new ATOM 0 HD2 PRO B 49 -10.364 -14.234 -0.212 1.00 0.72 H new ATOM 0 HD3 PRO B 49 -11.410 -13.051 -0.974 1.00 0.72 H new ATOM 1724 N ASN B 50 -6.684 -10.571 -2.035 1.00 0.57 N ATOM 1725 CA ASN B 50 -5.286 -10.397 -2.435 1.00 0.58 C ATOM 1726 C ASN B 50 -4.368 -10.614 -1.238 1.00 0.60 C ATOM 1727 O ASN B 50 -4.182 -9.715 -0.426 1.00 0.71 O ATOM 1728 CB ASN B 50 -5.031 -8.982 -2.994 1.00 0.74 C ATOM 1729 CG ASN B 50 -5.988 -8.544 -4.097 1.00 0.87 C ATOM 1730 OD1 ASN B 50 -7.199 -8.761 -4.020 1.00 1.64 O ATOM 1731 ND2 ASN B 50 -5.438 -7.905 -5.131 1.00 0.68 N ATOM 0 H ASN B 50 -7.286 -9.788 -2.290 1.00 0.57 H new ATOM 0 HA ASN B 50 -5.077 -11.131 -3.214 1.00 0.58 H new ATOM 0 HB2 ASN B 50 -5.094 -8.267 -2.174 1.00 0.74 H new ATOM 0 HB3 ASN B 50 -4.012 -8.938 -3.379 1.00 0.74 H new ATOM 0 HD21 ASN B 50 -6.025 -7.575 -5.897 1.00 0.68 H new ATOM 0 HD22 ASN B 50 -4.431 -7.746 -5.155 1.00 0.68 H new ATOM 1738 N ARG B 51 -3.782 -11.797 -1.135 1.00 0.72 N ATOM 1739 CA ARG B 51 -2.903 -12.112 -0.020 1.00 0.84 C ATOM 1740 C ARG B 51 -1.687 -11.189 0.004 1.00 0.76 C ATOM 1741 O ARG B 51 -1.138 -10.895 1.063 1.00 0.85 O ATOM 1742 CB ARG B 51 -2.450 -13.566 -0.100 1.00 1.06 C ATOM 1743 CG ARG B 51 -1.759 -14.057 1.158 1.00 1.68 C ATOM 1744 CD ARG B 51 -1.354 -15.512 1.027 1.00 2.18 C ATOM 1745 NE ARG B 51 -0.804 -16.045 2.270 1.00 2.97 N ATOM 1746 CZ ARG B 51 -1.372 -17.019 2.980 1.00 3.81 C ATOM 1747 NH1 ARG B 51 -2.523 -17.553 2.590 1.00 4.03 N ATOM 1748 NH2 ARG B 51 -0.787 -17.456 4.088 1.00 4.76 N ATOM 0 H ARG B 51 -3.899 -12.554 -1.809 1.00 0.72 H new ATOM 0 HA ARG B 51 -3.464 -11.960 0.902 1.00 0.84 H new ATOM 0 HB2 ARG B 51 -3.316 -14.197 -0.299 1.00 1.06 H new ATOM 0 HB3 ARG B 51 -1.772 -13.680 -0.945 1.00 1.06 H new ATOM 0 HG2 ARG B 51 -0.877 -13.447 1.354 1.00 1.68 H new ATOM 0 HG3 ARG B 51 -2.425 -13.937 2.013 1.00 1.68 H new ATOM 0 HD2 ARG B 51 -2.221 -16.104 0.732 1.00 2.18 H new ATOM 0 HD3 ARG B 51 -0.615 -15.612 0.232 1.00 2.18 H new ATOM 0 HE ARG B 51 0.069 -15.647 2.616 1.00 2.97 H new ATOM 0 HH11 ARG B 51 -2.979 -17.218 1.741 1.00 4.03 H new ATOM 0 HH12 ARG B 51 -2.951 -18.298 3.139 1.00 4.03 H new ATOM 0 HH21 ARG B 51 0.095 -17.046 4.394 1.00 4.76 H new ATOM 0 HH22 ARG B 51 -1.220 -18.201 4.633 1.00 4.76 H new ATOM 1762 N CYS B 52 -1.280 -10.718 -1.162 1.00 0.66 N ATOM 1763 CA CYS B 52 -0.127 -9.841 -1.256 1.00 0.62 C ATOM 1764 C CYS B 52 -0.487 -8.386 -0.964 1.00 0.58 C ATOM 1765 O CYS B 52 0.049 -7.780 -0.036 1.00 0.61 O ATOM 1766 CB CYS B 52 0.496 -9.958 -2.645 1.00 0.66 C ATOM 1767 SG CYS B 52 0.933 -11.666 -3.112 1.00 0.70 S ATOM 0 H CYS B 52 -1.729 -10.927 -2.054 1.00 0.66 H new ATOM 0 HA CYS B 52 0.592 -10.156 -0.500 1.00 0.62 H new ATOM 0 HB2 CYS B 52 -0.201 -9.557 -3.381 1.00 0.66 H new ATOM 0 HB3 CYS B 52 1.393 -9.339 -2.685 1.00 0.66 H new ATOM 1772 N ALA B 53 -1.412 -7.848 -1.745 1.00 0.54 N ATOM 1773 CA ALA B 53 -1.828 -6.454 -1.613 1.00 0.52 C ATOM 1774 C ALA B 53 -2.625 -6.170 -0.340 1.00 0.51 C ATOM 1775 O ALA B 53 -2.448 -5.116 0.260 1.00 0.52 O ATOM 1776 CB ALA B 53 -2.620 -6.039 -2.836 1.00 0.53 C ATOM 0 H ALA B 53 -1.894 -8.359 -2.484 1.00 0.54 H new ATOM 0 HA ALA B 53 -0.917 -5.861 -1.535 1.00 0.52 H new ATOM 0 HB1 ALA B 53 -2.929 -4.999 -2.734 1.00 0.53 H new ATOM 0 HB2 ALA B 53 -1.999 -6.148 -3.725 1.00 0.53 H new ATOM 0 HB3 ALA B 53 -3.503 -6.672 -2.930 1.00 0.53 H new ATOM 1782 N GLN B 54 -3.476 -7.096 0.092 1.00 0.52 N ATOM 1783 CA GLN B 54 -4.287 -6.866 1.290 1.00 0.53 C ATOM 1784 C GLN B 54 -3.471 -6.978 2.569 1.00 0.58 C ATOM 1785 O GLN B 54 -3.660 -6.187 3.486 1.00 0.65 O ATOM 1786 CB GLN B 54 -5.497 -7.801 1.338 1.00 0.54 C ATOM 1787 CG GLN B 54 -6.558 -7.441 0.315 1.00 0.48 C ATOM 1788 CD GLN B 54 -7.849 -8.216 0.498 1.00 0.76 C ATOM 1789 OE1 GLN B 54 -8.211 -8.602 1.606 1.00 1.49 O ATOM 1790 NE2 GLN B 54 -8.553 -8.438 -0.596 1.00 0.64 N ATOM 0 H GLN B 54 -3.623 -7.999 -0.359 1.00 0.52 H new ATOM 0 HA GLN B 54 -4.651 -5.841 1.224 1.00 0.53 H new ATOM 0 HB2 GLN B 54 -5.166 -8.825 1.167 1.00 0.54 H new ATOM 0 HB3 GLN B 54 -5.935 -7.770 2.336 1.00 0.54 H new ATOM 0 HG2 GLN B 54 -6.770 -6.374 0.380 1.00 0.48 H new ATOM 0 HG3 GLN B 54 -6.168 -7.628 -0.685 1.00 0.48 H new ATOM 0 HE21 GLN B 54 -8.216 -8.100 -1.497 1.00 0.64 H new ATOM 0 HE22 GLN B 54 -9.435 -8.948 -0.540 1.00 0.64 H new ATOM 1799 N GLN B 55 -2.571 -7.952 2.650 1.00 0.57 N ATOM 1800 CA GLN B 55 -1.739 -8.084 3.848 1.00 0.62 C ATOM 1801 C GLN B 55 -0.817 -6.874 3.953 1.00 0.60 C ATOM 1802 O GLN B 55 -0.460 -6.434 5.048 1.00 0.66 O ATOM 1803 CB GLN B 55 -0.925 -9.377 3.825 1.00 0.65 C ATOM 1804 CG GLN B 55 -1.764 -10.625 4.042 1.00 1.19 C ATOM 1805 CD GLN B 55 -2.521 -10.622 5.362 1.00 1.78 C ATOM 1806 OE1 GLN B 55 -3.652 -11.108 5.438 1.00 2.38 O ATOM 1807 NE2 GLN B 55 -1.897 -10.110 6.416 1.00 2.52 N ATOM 0 H GLN B 55 -2.398 -8.647 1.923 1.00 0.57 H new ATOM 0 HA GLN B 55 -2.390 -8.127 4.721 1.00 0.62 H new ATOM 0 HB2 GLN B 55 -0.411 -9.456 2.867 1.00 0.65 H new ATOM 0 HB3 GLN B 55 -0.156 -9.327 4.596 1.00 0.65 H new ATOM 0 HG2 GLN B 55 -2.477 -10.722 3.223 1.00 1.19 H new ATOM 0 HG3 GLN B 55 -1.116 -11.501 4.005 1.00 1.19 H new ATOM 0 HE21 GLN B 55 -0.961 -9.717 6.313 1.00 2.52 H new ATOM 0 HE22 GLN B 55 -2.353 -10.110 7.328 1.00 2.52 H new ATOM 1816 N LEU B 56 -0.434 -6.362 2.792 1.00 0.54 N ATOM 1817 CA LEU B 56 0.402 -5.182 2.688 1.00 0.53 C ATOM 1818 C LEU B 56 -0.375 -3.951 3.121 1.00 0.55 C ATOM 1819 O LEU B 56 -0.126 -3.393 4.183 1.00 0.58 O ATOM 1820 CB LEU B 56 0.839 -5.025 1.236 1.00 0.48 C ATOM 1821 CG LEU B 56 2.108 -4.221 1.012 1.00 0.46 C ATOM 1822 CD1 LEU B 56 3.268 -4.859 1.729 1.00 0.45 C ATOM 1823 CD2 LEU B 56 2.412 -4.124 -0.460 1.00 0.46 C ATOM 0 H LEU B 56 -0.699 -6.759 1.891 1.00 0.54 H new ATOM 0 HA LEU B 56 1.273 -5.290 3.335 1.00 0.53 H new ATOM 0 HB2 LEU B 56 0.980 -6.018 0.809 1.00 0.48 H new ATOM 0 HB3 LEU B 56 0.029 -4.552 0.681 1.00 0.48 H new ATOM 0 HG LEU B 56 1.954 -3.218 1.411 1.00 0.46 H new ATOM 0 HD11 LEU B 56 4.169 -4.271 1.558 1.00 0.45 H new ATOM 0 HD12 LEU B 56 3.058 -4.899 2.798 1.00 0.45 H new ATOM 0 HD13 LEU B 56 3.418 -5.870 1.351 1.00 0.45 H new ATOM 0 HD21 LEU B 56 3.324 -3.545 -0.606 1.00 0.46 H new ATOM 0 HD22 LEU B 56 2.548 -5.125 -0.870 1.00 0.46 H new ATOM 0 HD23 LEU B 56 1.584 -3.632 -0.971 1.00 0.46 H new ATOM 1835 N ALA B 57 -1.357 -3.595 2.304 1.00 0.56 N ATOM 1836 CA ALA B 57 -2.199 -2.425 2.515 1.00 0.59 C ATOM 1837 C ALA B 57 -2.868 -2.389 3.885 1.00 0.68 C ATOM 1838 O ALA B 57 -3.034 -1.322 4.477 1.00 1.02 O ATOM 1839 CB ALA B 57 -3.255 -2.385 1.429 1.00 0.55 C ATOM 0 H ALA B 57 -1.595 -4.120 1.462 1.00 0.56 H new ATOM 0 HA ALA B 57 -1.551 -1.550 2.472 1.00 0.59 H new ATOM 0 HB1 ALA B 57 -3.893 -1.514 1.574 1.00 0.55 H new ATOM 0 HB2 ALA B 57 -2.772 -2.323 0.454 1.00 0.55 H new ATOM 0 HB3 ALA B 57 -3.860 -3.290 1.477 1.00 0.55 H new ATOM 1845 N GLY B 58 -3.272 -3.548 4.371 1.00 0.81 N ATOM 1846 CA GLY B 58 -3.936 -3.620 5.656 1.00 0.90 C ATOM 1847 C GLY B 58 -5.382 -4.048 5.507 1.00 1.43 C ATOM 1848 O GLY B 58 -6.284 -3.212 5.464 1.00 2.13 O ATOM 0 H GLY B 58 -3.153 -4.444 3.899 1.00 0.81 H new ATOM 0 HA2 GLY B 58 -3.411 -4.325 6.300 1.00 0.90 H new ATOM 0 HA3 GLY B 58 -3.891 -2.647 6.146 1.00 0.90 H new ATOM 1852 N LYS B 59 -5.588 -5.354 5.401 1.00 1.92 N ATOM 1853 CA LYS B 59 -6.916 -5.934 5.235 1.00 2.90 C ATOM 1854 C LYS B 59 -7.853 -5.531 6.371 1.00 3.42 C ATOM 1855 O LYS B 59 -7.641 -5.910 7.524 1.00 4.00 O ATOM 1856 CB LYS B 59 -6.810 -7.458 5.158 1.00 3.56 C ATOM 1857 CG LYS B 59 -8.138 -8.153 4.919 1.00 3.84 C ATOM 1858 CD LYS B 59 -7.952 -9.633 4.618 1.00 4.53 C ATOM 1859 CE LYS B 59 -7.423 -10.395 5.818 1.00 4.85 C ATOM 1860 NZ LYS B 59 -7.205 -11.831 5.499 1.00 5.07 N ATOM 0 H LYS B 59 -4.837 -6.044 5.428 1.00 1.92 H new ATOM 0 HA LYS B 59 -7.337 -5.549 4.306 1.00 2.90 H new ATOM 0 HB2 LYS B 59 -6.121 -7.725 4.356 1.00 3.56 H new ATOM 0 HB3 LYS B 59 -6.378 -7.830 6.087 1.00 3.56 H new ATOM 0 HG2 LYS B 59 -8.773 -8.037 5.798 1.00 3.84 H new ATOM 0 HG3 LYS B 59 -8.655 -7.674 4.087 1.00 3.84 H new ATOM 0 HD2 LYS B 59 -8.905 -10.062 4.307 1.00 4.53 H new ATOM 0 HD3 LYS B 59 -7.262 -9.749 3.782 1.00 4.53 H new ATOM 0 HE2 LYS B 59 -6.486 -9.948 6.149 1.00 4.85 H new ATOM 0 HE3 LYS B 59 -8.128 -10.308 6.645 1.00 4.85 H new ATOM 0 HZ1 LYS B 59 -6.843 -12.323 6.341 1.00 5.07 H new ATOM 0 HZ2 LYS B 59 -8.105 -12.262 5.206 1.00 5.07 H new ATOM 0 HZ3 LYS B 59 -6.514 -11.914 4.726 1.00 5.07 H new ATOM 1874 N GLN B 60 -8.888 -4.763 6.017 1.00 3.78 N ATOM 1875 CA GLN B 60 -9.890 -4.289 6.975 1.00 4.67 C ATOM 1876 C GLN B 60 -9.224 -3.546 8.139 1.00 5.08 C ATOM 1877 O GLN B 60 -8.662 -2.467 7.952 1.00 5.63 O ATOM 1878 CB GLN B 60 -10.734 -5.465 7.483 1.00 5.29 C ATOM 1879 CG GLN B 60 -11.375 -6.280 6.370 1.00 5.85 C ATOM 1880 CD GLN B 60 -11.681 -7.705 6.785 1.00 6.71 C ATOM 1881 OE1 GLN B 60 -11.986 -7.982 7.944 1.00 7.07 O ATOM 1882 NE2 GLN B 60 -11.592 -8.630 5.839 1.00 7.34 N ATOM 0 H GLN B 60 -9.054 -4.453 5.060 1.00 3.78 H new ATOM 0 HA GLN B 60 -10.550 -3.585 6.468 1.00 4.67 H new ATOM 0 HB2 GLN B 60 -10.104 -6.120 8.085 1.00 5.29 H new ATOM 0 HB3 GLN B 60 -11.516 -5.083 8.139 1.00 5.29 H new ATOM 0 HG2 GLN B 60 -12.297 -5.793 6.054 1.00 5.85 H new ATOM 0 HG3 GLN B 60 -10.710 -6.293 5.507 1.00 5.85 H new ATOM 0 HE21 GLN B 60 -11.336 -8.364 4.888 1.00 7.34 H new ATOM 0 HE22 GLN B 60 -11.779 -9.607 6.062 1.00 7.34 H new ATOM 1891 N SER B 61 -9.298 -4.123 9.335 1.00 5.24 N ATOM 1892 CA SER B 61 -8.681 -3.537 10.520 1.00 5.99 C ATOM 1893 C SER B 61 -7.779 -4.570 11.188 1.00 6.18 C ATOM 1894 O SER B 61 -7.653 -4.605 12.414 1.00 6.54 O ATOM 1895 CB SER B 61 -9.745 -3.065 11.509 1.00 6.79 C ATOM 1896 OG SER B 61 -10.800 -2.380 10.851 1.00 6.96 O ATOM 0 H SER B 61 -9.783 -5.003 9.509 1.00 5.24 H new ATOM 0 HA SER B 61 -8.089 -2.674 10.214 1.00 5.99 H new ATOM 0 HB2 SER B 61 -10.147 -3.922 12.049 1.00 6.79 H new ATOM 0 HB3 SER B 61 -9.289 -2.408 12.249 1.00 6.79 H new ATOM 0 HG SER B 61 -11.465 -2.093 11.511 1.00 6.96 H new ATOM 1902 N LEU B 62 -7.159 -5.402 10.350 1.00 6.27 N ATOM 1903 CA LEU B 62 -6.263 -6.469 10.792 1.00 6.75 C ATOM 1904 C LEU B 62 -7.047 -7.594 11.464 1.00 7.27 C ATOM 1905 O LEU B 62 -7.287 -7.528 12.688 1.00 7.62 O ATOM 1906 CB LEU B 62 -5.162 -5.933 11.719 1.00 7.19 C ATOM 1907 CG LEU B 62 -4.044 -6.927 12.039 1.00 7.52 C ATOM 1908 CD1 LEU B 62 -3.350 -7.371 10.763 1.00 7.96 C ATOM 1909 CD2 LEU B 62 -3.043 -6.308 12.998 1.00 7.89 C ATOM 1910 OXT LEU B 62 -7.432 -8.547 10.750 1.00 7.60 O ATOM 0 H LEU B 62 -7.266 -5.353 9.337 1.00 6.27 H new ATOM 0 HA LEU B 62 -5.774 -6.877 9.907 1.00 6.75 H new ATOM 0 HB2 LEU B 62 -4.720 -5.048 11.260 1.00 7.19 H new ATOM 0 HB3 LEU B 62 -5.620 -5.612 12.654 1.00 7.19 H new ATOM 0 HG LEU B 62 -4.485 -7.802 12.517 1.00 7.52 H new ATOM 0 HD11 LEU B 62 -2.557 -8.078 11.007 1.00 7.96 H new ATOM 0 HD12 LEU B 62 -4.073 -7.850 10.103 1.00 7.96 H new ATOM 0 HD13 LEU B 62 -2.921 -6.504 10.261 1.00 7.96 H new ATOM 0 HD21 LEU B 62 -2.254 -7.028 13.215 1.00 7.89 H new ATOM 0 HD22 LEU B 62 -2.607 -5.418 12.544 1.00 7.89 H new ATOM 0 HD23 LEU B 62 -3.548 -6.033 13.924 1.00 7.89 H new TER 1922 LEU B 62 ATOM 1923 O5' DG C 1 30.662 12.226 -12.730 1.00 1.95 O ATOM 1924 C5' DG C 1 31.605 11.675 -13.653 1.00 1.87 C ATOM 1925 C4' DG C 1 31.878 10.220 -13.348 1.00 1.71 C ATOM 1926 O4' DG C 1 32.539 10.137 -12.064 1.00 1.64 O ATOM 1927 C3' DG C 1 30.637 9.350 -13.208 1.00 1.56 C ATOM 1928 O3' DG C 1 30.956 7.984 -13.502 1.00 1.48 O ATOM 1929 C2' DG C 1 30.272 9.527 -11.747 1.00 1.43 C ATOM 1930 C1' DG C 1 31.636 9.641 -11.084 1.00 1.46 C ATOM 1931 N9 DG C 1 31.673 10.540 -9.937 1.00 1.46 N ATOM 1932 C8 DG C 1 31.116 11.792 -9.848 1.00 1.53 C ATOM 1933 N7 DG C 1 31.311 12.363 -8.692 1.00 1.53 N ATOM 1934 C5 DG C 1 32.043 11.429 -7.970 1.00 1.46 C ATOM 1935 C6 DG C 1 32.547 11.482 -6.647 1.00 1.46 C ATOM 1936 O6 DG C 1 32.440 12.394 -5.817 1.00 1.50 O ATOM 1937 N1 DG C 1 33.233 10.320 -6.314 1.00 1.42 N ATOM 1938 C2 DG C 1 33.409 9.242 -7.145 1.00 1.39 C ATOM 1939 N2 DG C 1 34.098 8.211 -6.642 1.00 1.40 N ATOM 1940 N3 DG C 1 32.942 9.178 -8.382 1.00 1.39 N ATOM 1941 C4 DG C 1 32.275 10.299 -8.725 1.00 1.42 C ATOM 0 H5' DG C 1 32.536 12.240 -13.608 1.00 1.87 H new ATOM 0 H5'' DG C 1 31.223 11.771 -14.669 1.00 1.87 H new ATOM 0 H4' DG C 1 32.464 9.858 -14.193 1.00 1.71 H new ATOM 0 H3' DG C 1 29.827 9.619 -13.885 1.00 1.56 H new ATOM 0 H2' DG C 1 29.665 10.418 -11.584 1.00 1.43 H new ATOM 0 H2'' DG C 1 29.703 8.680 -11.364 1.00 1.43 H new ATOM 0 HO5' DG C 1 30.504 13.168 -12.948 1.00 1.95 H new ATOM 0 H1' DG C 1 31.899 8.652 -10.708 1.00 1.46 H new ATOM 0 H8 DG C 1 30.570 12.258 -10.655 1.00 1.53 H new ATOM 0 H1 DG C 1 33.637 10.264 -5.379 1.00 1.42 H new ATOM 0 H21 DG C 1 34.262 7.381 -7.211 1.00 1.40 H new ATOM 0 H22 DG C 1 34.459 8.255 -5.689 1.00 1.40 H new ATOM 1954 P DA C 2 29.851 6.837 -13.287 1.00 1.33 P ATOM 1955 OP1 DA C 2 29.977 5.885 -14.420 1.00 1.35 O ATOM 1956 OP2 DA C 2 28.543 7.488 -13.021 1.00 1.35 O ATOM 1957 O5' DA C 2 30.322 6.095 -11.958 1.00 1.18 O ATOM 1958 C5' DA C 2 31.706 5.835 -11.719 1.00 1.21 C ATOM 1959 C4' DA C 2 31.865 4.824 -10.607 1.00 1.11 C ATOM 1960 O4' DA C 2 32.019 5.538 -9.358 1.00 1.07 O ATOM 1961 C3' DA C 2 30.674 3.896 -10.388 1.00 1.02 C ATOM 1962 O3' DA C 2 31.109 2.673 -9.775 1.00 1.00 O ATOM 1963 C2' DA C 2 29.800 4.705 -9.449 1.00 0.95 C ATOM 1964 C1' DA C 2 30.828 5.430 -8.587 1.00 0.97 C ATOM 1965 N9 DA C 2 30.437 6.778 -8.176 1.00 0.99 N ATOM 1966 C8 DA C 2 29.768 7.726 -8.908 1.00 1.05 C ATOM 1967 N7 DA C 2 29.571 8.849 -8.262 1.00 1.07 N ATOM 1968 C5 DA C 2 30.146 8.625 -7.020 1.00 1.03 C ATOM 1969 C6 DA C 2 30.272 9.430 -5.876 1.00 1.04 C ATOM 1970 N6 DA C 2 29.806 10.676 -5.796 1.00 1.11 N ATOM 1971 N1 DA C 2 30.899 8.901 -4.802 1.00 1.02 N ATOM 1972 C2 DA C 2 31.365 7.646 -4.886 1.00 0.98 C ATOM 1973 N3 DA C 2 31.308 6.794 -5.903 1.00 0.96 N ATOM 1974 C4 DA C 2 30.679 7.352 -6.952 1.00 0.98 C ATOM 0 H5' DA C 2 32.216 6.761 -11.454 1.00 1.21 H new ATOM 0 H5'' DA C 2 32.175 5.462 -12.629 1.00 1.21 H new ATOM 0 H4' DA C 2 32.720 4.216 -10.904 1.00 1.11 H new ATOM 0 H3' DA C 2 30.160 3.602 -11.303 1.00 1.02 H new ATOM 0 H2' DA C 2 29.159 5.402 -9.990 1.00 0.95 H new ATOM 0 H2'' DA C 2 29.147 4.068 -8.853 1.00 0.95 H new ATOM 0 H1' DA C 2 30.944 4.851 -7.671 1.00 0.97 H new ATOM 0 H8 DA C 2 29.435 7.562 -9.922 1.00 1.05 H new ATOM 0 H61 DA C 2 29.928 11.212 -4.937 1.00 1.11 H new ATOM 0 H62 DA C 2 29.327 11.094 -6.594 1.00 1.11 H new ATOM 0 H2 DA C 2 31.857 7.275 -3.999 1.00 0.98 H new ATOM 1986 P DA C 3 30.027 1.654 -9.157 1.00 0.91 P ATOM 1987 OP1 DA C 3 30.596 0.286 -9.275 1.00 1.00 O ATOM 1988 OP2 DA C 3 28.696 1.948 -9.749 1.00 0.90 O ATOM 1989 O5' DA C 3 29.980 2.033 -7.609 1.00 0.80 O ATOM 1990 C5' DA C 3 31.185 2.193 -6.860 1.00 0.84 C ATOM 1991 C4' DA C 3 30.913 2.051 -5.379 1.00 0.77 C ATOM 1992 O4' DA C 3 30.611 3.356 -4.836 1.00 0.75 O ATOM 1993 C3' DA C 3 29.711 1.186 -5.012 1.00 0.69 C ATOM 1994 O3' DA C 3 29.907 0.654 -3.693 1.00 0.69 O ATOM 1995 C2' DA C 3 28.560 2.177 -5.064 1.00 0.64 C ATOM 1996 C1' DA C 3 29.219 3.458 -4.552 1.00 0.66 C ATOM 1997 N9 DA C 3 28.726 4.704 -5.141 1.00 0.68 N ATOM 1998 C8 DA C 3 28.348 4.956 -6.436 1.00 0.71 C ATOM 1999 N7 DA C 3 27.938 6.186 -6.637 1.00 0.75 N ATOM 2000 C5 DA C 3 28.058 6.785 -5.390 1.00 0.73 C ATOM 2001 C6 DA C 3 27.782 8.087 -4.932 1.00 0.77 C ATOM 2002 N6 DA C 3 27.309 9.065 -5.711 1.00 0.83 N ATOM 2003 N1 DA C 3 28.013 8.355 -3.627 1.00 0.77 N ATOM 2004 C2 DA C 3 28.488 7.374 -2.846 1.00 0.73 C ATOM 2005 N3 DA C 3 28.784 6.118 -3.159 1.00 0.70 N ATOM 2006 C4 DA C 3 28.543 5.884 -4.460 1.00 0.69 C ATOM 0 H5' DA C 3 31.619 3.172 -7.063 1.00 0.84 H new ATOM 0 H5'' DA C 3 31.917 1.449 -7.174 1.00 0.84 H new ATOM 0 H4' DA C 3 31.811 1.579 -4.980 1.00 0.77 H new ATOM 0 H3' DA C 3 29.542 0.328 -5.663 1.00 0.69 H new ATOM 0 H2' DA C 3 28.169 2.295 -6.075 1.00 0.64 H new ATOM 0 H2'' DA C 3 27.726 1.867 -4.434 1.00 0.64 H new ATOM 0 H1' DA C 3 28.982 3.524 -3.490 1.00 0.66 H new ATOM 0 H8 DA C 3 28.385 4.211 -7.217 1.00 0.71 H new ATOM 0 H61 DA C 3 27.129 9.989 -5.317 1.00 0.83 H new ATOM 0 H62 DA C 3 27.128 8.887 -6.699 1.00 0.83 H new ATOM 0 H2 DA C 3 28.654 7.644 -1.814 1.00 0.73 H new ATOM 2018 P DT C 4 28.659 0.075 -2.859 1.00 0.65 P ATOM 2019 OP1 DT C 4 29.193 -0.944 -1.923 1.00 0.73 O ATOM 2020 OP2 DT C 4 27.599 -0.303 -3.824 1.00 0.64 O ATOM 2021 O5' DT C 4 28.172 1.321 -1.992 1.00 0.61 O ATOM 2022 C5' DT C 4 29.125 2.105 -1.269 1.00 0.64 C ATOM 2023 C4' DT C 4 28.501 2.708 -0.031 1.00 0.61 C ATOM 2024 O4' DT C 4 28.011 4.029 -0.358 1.00 0.59 O ATOM 2025 C3' DT C 4 27.284 1.963 0.511 1.00 0.55 C ATOM 2026 O3' DT C 4 27.156 2.212 1.917 1.00 0.55 O ATOM 2027 C2' DT C 4 26.142 2.572 -0.283 1.00 0.49 C ATOM 2028 C1' DT C 4 26.591 4.021 -0.434 1.00 0.52 C ATOM 2029 N1 DT C 4 26.180 4.689 -1.689 1.00 0.52 N ATOM 2030 C2 DT C 4 25.825 6.016 -1.600 1.00 0.54 C ATOM 2031 O2 DT C 4 25.868 6.646 -0.557 1.00 0.56 O ATOM 2032 N3 DT C 4 25.417 6.582 -2.779 1.00 0.56 N ATOM 2033 C4 DT C 4 25.329 5.968 -4.010 1.00 0.57 C ATOM 2034 O4 DT C 4 24.927 6.603 -4.983 1.00 0.60 O ATOM 2035 C5 DT C 4 25.724 4.576 -4.036 1.00 0.54 C ATOM 2036 C7 DT C 4 25.590 3.816 -5.316 1.00 0.56 C ATOM 2037 C6 DT C 4 26.137 4.010 -2.890 1.00 0.52 C ATOM 0 H5' DT C 4 29.510 2.898 -1.910 1.00 0.64 H new ATOM 0 H5'' DT C 4 29.974 1.483 -0.987 1.00 0.64 H new ATOM 0 H4' DT C 4 29.290 2.679 0.721 1.00 0.61 H new ATOM 0 H3' DT C 4 27.329 0.879 0.406 1.00 0.55 H new ATOM 0 H2' DT C 4 26.012 2.083 -1.249 1.00 0.49 H new ATOM 0 H2'' DT C 4 25.192 2.493 0.245 1.00 0.49 H new ATOM 0 H1' DT C 4 26.104 4.585 0.361 1.00 0.52 H new ATOM 0 H3 DT C 4 25.149 7.565 -2.742 1.00 0.56 H new ATOM 0 H71 DT C 4 24.760 4.221 -5.895 1.00 0.56 H new ATOM 0 H72 DT C 4 26.512 3.907 -5.891 1.00 0.56 H new ATOM 0 H73 DT C 4 25.401 2.765 -5.097 1.00 0.56 H new ATOM 0 H6 DT C 4 26.450 2.976 -2.909 1.00 0.52 H new ATOM 2050 P DT C 5 25.784 1.856 2.675 1.00 0.52 P ATOM 2051 OP1 DT C 5 26.126 1.686 4.108 1.00 0.60 O ATOM 2052 OP2 DT C 5 25.107 0.751 1.944 1.00 0.51 O ATOM 2053 O5' DT C 5 24.929 3.192 2.543 1.00 0.44 O ATOM 2054 C5' DT C 5 25.472 4.440 2.979 1.00 0.49 C ATOM 2055 C4' DT C 5 24.420 5.267 3.680 1.00 0.44 C ATOM 2056 O4' DT C 5 23.845 6.181 2.718 1.00 0.45 O ATOM 2057 C3' DT C 5 23.236 4.488 4.246 1.00 0.34 C ATOM 2058 O3' DT C 5 22.689 5.209 5.363 1.00 0.34 O ATOM 2059 C2' DT C 5 22.299 4.417 3.051 1.00 0.30 C ATOM 2060 C1' DT C 5 22.533 5.759 2.362 1.00 0.37 C ATOM 2061 N1 DT C 5 22.432 5.753 0.881 1.00 0.40 N ATOM 2062 C2 DT C 5 22.099 6.946 0.273 1.00 0.44 C ATOM 2063 O2 DT C 5 21.923 7.984 0.892 1.00 0.47 O ATOM 2064 N3 DT C 5 21.974 6.883 -1.090 1.00 0.47 N ATOM 2065 C4 DT C 5 22.151 5.777 -1.894 1.00 0.47 C ATOM 2066 O4 DT C 5 22.000 5.873 -3.109 1.00 0.51 O ATOM 2067 C5 DT C 5 22.513 4.563 -1.201 1.00 0.44 C ATOM 2068 C7 DT C 5 22.676 3.305 -1.994 1.00 0.48 C ATOM 2069 C6 DT C 5 22.648 4.607 0.136 1.00 0.40 C ATOM 0 H5' DT C 5 25.863 4.990 2.123 1.00 0.49 H new ATOM 0 H5'' DT C 5 26.310 4.262 3.653 1.00 0.49 H new ATOM 0 H4' DT C 5 24.944 5.735 4.513 1.00 0.44 H new ATOM 0 H3' DT C 5 23.463 3.496 4.636 1.00 0.34 H new ATOM 0 H2' DT C 5 22.539 3.579 2.397 1.00 0.30 H new ATOM 0 H2'' DT C 5 21.260 4.295 3.357 1.00 0.30 H new ATOM 0 H1' DT C 5 21.738 6.425 2.698 1.00 0.37 H new ATOM 0 H3 DT C 5 21.722 7.751 -1.563 1.00 0.47 H new ATOM 0 H71 DT C 5 23.414 2.664 -1.512 1.00 0.48 H new ATOM 0 H72 DT C 5 21.721 2.782 -2.047 1.00 0.48 H new ATOM 0 H73 DT C 5 23.012 3.551 -3.001 1.00 0.48 H new ATOM 0 H6 DT C 5 22.939 3.705 0.653 1.00 0.40 H new ATOM 2082 P DG C 6 21.166 4.967 5.821 1.00 0.36 P ATOM 2083 OP1 DG C 6 21.097 5.244 7.276 1.00 0.50 O ATOM 2084 OP2 DG C 6 20.694 3.654 5.307 1.00 0.31 O ATOM 2085 O5' DG C 6 20.379 6.134 5.077 1.00 0.43 O ATOM 2086 C5' DG C 6 20.915 7.458 5.054 1.00 0.46 C ATOM 2087 C4' DG C 6 19.813 8.479 4.910 1.00 0.48 C ATOM 2088 O4' DG C 6 19.628 8.753 3.501 1.00 0.48 O ATOM 2089 C3' DG C 6 18.441 8.037 5.411 1.00 0.45 C ATOM 2090 O3' DG C 6 17.665 9.178 5.801 1.00 0.50 O ATOM 2091 C2' DG C 6 17.864 7.334 4.198 1.00 0.41 C ATOM 2092 C1' DG C 6 18.424 8.148 3.038 1.00 0.44 C ATOM 2093 N9 DG C 6 18.735 7.360 1.850 1.00 0.41 N ATOM 2094 C8 DG C 6 19.256 6.090 1.809 1.00 0.37 C ATOM 2095 N7 DG C 6 19.385 5.624 0.597 1.00 0.37 N ATOM 2096 C5 DG C 6 18.933 6.655 -0.216 1.00 0.41 C ATOM 2097 C6 DG C 6 18.832 6.735 -1.630 1.00 0.43 C ATOM 2098 O6 DG C 6 19.122 5.875 -2.471 1.00 0.43 O ATOM 2099 N1 DG C 6 18.330 7.966 -2.039 1.00 0.48 N ATOM 2100 C2 DG C 6 17.970 8.991 -1.198 1.00 0.50 C ATOM 2101 N2 DG C 6 17.518 10.113 -1.779 1.00 0.55 N ATOM 2102 N3 DG C 6 18.051 8.926 0.122 1.00 0.48 N ATOM 2103 C4 DG C 6 18.539 7.739 0.541 1.00 0.43 C ATOM 0 H5' DG C 6 21.618 7.556 4.227 1.00 0.46 H new ATOM 0 H5'' DG C 6 21.473 7.645 5.971 1.00 0.46 H new ATOM 0 H4' DG C 6 20.137 9.328 5.511 1.00 0.48 H new ATOM 0 H3' DG C 6 18.464 7.397 6.293 1.00 0.45 H new ATOM 0 H2' DG C 6 18.177 6.291 4.148 1.00 0.41 H new ATOM 0 H2'' DG C 6 16.774 7.340 4.207 1.00 0.41 H new ATOM 0 H1' DG C 6 17.661 8.866 2.737 1.00 0.44 H new ATOM 0 H8 DG C 6 19.532 5.532 2.692 1.00 0.37 H new ATOM 0 H1 DG C 6 18.221 8.120 -3.041 1.00 0.48 H new ATOM 0 H21 DG C 6 17.236 10.907 -1.204 1.00 0.55 H new ATOM 0 H22 DG C 6 17.456 10.172 -2.795 1.00 0.55 H new ATOM 2115 P DT C 7 16.083 9.024 6.053 1.00 0.51 P ATOM 2116 OP1 DT C 7 15.714 9.933 7.171 1.00 0.60 O ATOM 2117 OP2 DT C 7 15.750 7.579 6.141 1.00 0.48 O ATOM 2118 O5' DT C 7 15.449 9.612 4.717 1.00 0.49 O ATOM 2119 C5' DT C 7 16.003 10.773 4.100 1.00 0.51 C ATOM 2120 C4' DT C 7 14.960 11.462 3.252 1.00 0.52 C ATOM 2121 O4' DT C 7 15.074 10.969 1.897 1.00 0.50 O ATOM 2122 C3' DT C 7 13.513 11.196 3.651 1.00 0.52 C ATOM 2123 O3' DT C 7 12.679 12.284 3.238 1.00 0.54 O ATOM 2124 C2' DT C 7 13.197 9.919 2.895 1.00 0.48 C ATOM 2125 C1' DT C 7 13.990 10.094 1.605 1.00 0.47 C ATOM 2126 N1 DT C 7 14.551 8.843 1.054 1.00 0.44 N ATOM 2127 C2 DT C 7 14.569 8.695 -0.316 1.00 0.45 C ATOM 2128 O2 DT C 7 14.172 9.553 -1.085 1.00 0.48 O ATOM 2129 N3 DT C 7 15.074 7.499 -0.754 1.00 0.42 N ATOM 2130 C4 DT C 7 15.546 6.458 0.018 1.00 0.39 C ATOM 2131 O4 DT C 7 15.971 5.443 -0.523 1.00 0.38 O ATOM 2132 C5 DT C 7 15.501 6.681 1.445 1.00 0.39 C ATOM 2133 C7 DT C 7 15.894 5.562 2.361 1.00 0.37 C ATOM 2134 C6 DT C 7 15.025 7.850 1.892 1.00 0.41 C ATOM 0 H5' DT C 7 16.857 10.493 3.483 1.00 0.51 H new ATOM 0 H5'' DT C 7 16.372 11.458 4.863 1.00 0.51 H new ATOM 0 H4' DT C 7 15.157 12.527 3.377 1.00 0.52 H new ATOM 0 H3' DT C 7 13.351 11.101 4.725 1.00 0.52 H new ATOM 0 H2' DT C 7 13.510 9.033 3.447 1.00 0.48 H new ATOM 0 H2'' DT C 7 12.129 9.814 2.704 1.00 0.48 H new ATOM 0 H1' DT C 7 13.301 10.478 0.853 1.00 0.47 H new ATOM 0 H3 DT C 7 15.104 7.363 -1.764 1.00 0.42 H new ATOM 0 H71 DT C 7 16.317 5.973 3.277 1.00 0.37 H new ATOM 0 H72 DT C 7 15.015 4.965 2.604 1.00 0.37 H new ATOM 0 H73 DT C 7 16.636 4.933 1.869 1.00 0.37 H new ATOM 0 H6 DT C 7 15.011 8.026 2.957 1.00 0.41 H new ATOM 2147 P DG C 8 11.078 12.129 3.273 1.00 0.57 P ATOM 2148 OP1 DG C 8 10.519 13.471 3.574 1.00 0.65 O ATOM 2149 OP2 DG C 8 10.718 10.975 4.135 1.00 0.58 O ATOM 2150 O5' DG C 8 10.707 11.761 1.770 1.00 0.56 O ATOM 2151 C5' DG C 8 11.281 12.485 0.682 1.00 0.55 C ATOM 2152 C4' DG C 8 10.399 12.387 -0.540 1.00 0.55 C ATOM 2153 O4' DG C 8 10.845 11.266 -1.339 1.00 0.52 O ATOM 2154 C3' DG C 8 8.926 12.107 -0.254 1.00 0.56 C ATOM 2155 O3' DG C 8 8.116 12.606 -1.324 1.00 0.59 O ATOM 2156 C2' DG C 8 8.891 10.591 -0.178 1.00 0.52 C ATOM 2157 C1' DG C 8 9.925 10.186 -1.222 1.00 0.51 C ATOM 2158 N9 DG C 8 10.675 8.980 -0.883 1.00 0.47 N ATOM 2159 C8 DG C 8 11.080 8.583 0.367 1.00 0.46 C ATOM 2160 N7 DG C 8 11.703 7.437 0.365 1.00 0.45 N ATOM 2161 C5 DG C 8 11.715 7.056 -0.969 1.00 0.44 C ATOM 2162 C6 DG C 8 12.247 5.896 -1.585 1.00 0.44 C ATOM 2163 O6 DG C 8 12.828 4.941 -1.056 1.00 0.43 O ATOM 2164 N1 DG C 8 12.045 5.910 -2.962 1.00 0.45 N ATOM 2165 C2 DG C 8 11.411 6.914 -3.656 1.00 0.48 C ATOM 2166 N2 DG C 8 11.316 6.752 -4.983 1.00 0.51 N ATOM 2167 N3 DG C 8 10.909 8.000 -3.092 1.00 0.49 N ATOM 2168 C4 DG C 8 11.094 8.004 -1.754 1.00 0.46 C ATOM 0 H5' DG C 8 12.271 12.090 0.456 1.00 0.55 H new ATOM 0 H5'' DG C 8 11.411 13.531 0.961 1.00 0.55 H new ATOM 0 H4' DG C 8 10.478 13.360 -1.024 1.00 0.55 H new ATOM 0 H3' DG C 8 8.542 12.583 0.648 1.00 0.56 H new ATOM 0 H2' DG C 8 9.154 10.228 0.816 1.00 0.52 H new ATOM 0 H2'' DG C 8 7.902 10.195 -0.411 1.00 0.52 H new ATOM 0 H1' DG C 8 9.392 9.966 -2.147 1.00 0.51 H new ATOM 0 H8 DG C 8 10.901 9.161 1.262 1.00 0.46 H new ATOM 0 H1 DG C 8 12.394 5.115 -3.497 1.00 0.45 H new ATOM 0 H21 DG C 8 10.856 7.463 -5.552 1.00 0.51 H new ATOM 0 H22 DG C 8 11.703 5.918 -5.424 1.00 0.51 H new ATOM 2180 P DA C 9 6.559 12.215 -1.404 1.00 0.62 P ATOM 2181 OP1 DA C 9 5.837 13.416 -1.896 1.00 0.71 O ATOM 2182 OP2 DA C 9 6.143 11.580 -0.127 1.00 0.63 O ATOM 2183 O5' DA C 9 6.517 11.107 -2.549 1.00 0.56 O ATOM 2184 C5' DA C 9 7.329 11.240 -3.716 1.00 0.55 C ATOM 2185 C4' DA C 9 6.776 10.397 -4.841 1.00 0.54 C ATOM 2186 O4' DA C 9 7.432 9.109 -4.811 1.00 0.49 O ATOM 2187 C3' DA C 9 5.286 10.086 -4.752 1.00 0.56 C ATOM 2188 O3' DA C 9 4.757 9.841 -6.063 1.00 0.58 O ATOM 2189 C2' DA C 9 5.266 8.839 -3.889 1.00 0.53 C ATOM 2190 C1' DA C 9 6.538 8.116 -4.320 1.00 0.49 C ATOM 2191 N9 DA C 9 7.213 7.387 -3.246 1.00 0.45 N ATOM 2192 C8 DA C 9 7.341 7.754 -1.929 1.00 0.46 C ATOM 2193 N7 DA C 9 7.968 6.868 -1.194 1.00 0.44 N ATOM 2194 C5 DA C 9 8.283 5.853 -2.086 1.00 0.42 C ATOM 2195 C6 DA C 9 8.949 4.621 -1.925 1.00 0.40 C ATOM 2196 N6 DA C 9 9.422 4.178 -0.762 1.00 0.40 N ATOM 2197 N1 DA C 9 9.107 3.848 -3.023 1.00 0.38 N ATOM 2198 C2 DA C 9 8.617 4.282 -4.190 1.00 0.39 C ATOM 2199 N3 DA C 9 7.968 5.413 -4.464 1.00 0.42 N ATOM 2200 C4 DA C 9 7.833 6.163 -3.357 1.00 0.43 C ATOM 0 H5' DA C 9 8.351 10.934 -3.492 1.00 0.55 H new ATOM 0 H5'' DA C 9 7.369 12.285 -4.022 1.00 0.55 H new ATOM 0 H4' DA C 9 6.948 10.985 -5.743 1.00 0.54 H new ATOM 0 H3' DA C 9 4.678 10.892 -4.340 1.00 0.56 H new ATOM 0 H2' DA C 9 5.278 9.081 -2.826 1.00 0.53 H new ATOM 0 H2'' DA C 9 4.376 8.236 -4.069 1.00 0.53 H new ATOM 0 H1' DA C 9 6.255 7.371 -5.063 1.00 0.49 H new ATOM 0 H8 DA C 9 6.961 8.685 -1.536 1.00 0.46 H new ATOM 0 H61 DA C 9 9.895 3.276 -0.714 1.00 0.40 H new ATOM 0 H62 DA C 9 9.311 4.741 0.081 1.00 0.40 H new ATOM 0 H2 DA C 9 8.769 3.621 -5.030 1.00 0.39 H new ATOM 2212 P DG C 10 3.298 9.182 -6.235 1.00 0.64 P ATOM 2213 OP1 DG C 10 2.672 9.801 -7.432 1.00 0.73 O ATOM 2214 OP2 DG C 10 2.582 9.217 -4.933 1.00 0.69 O ATOM 2215 O5' DG C 10 3.617 7.663 -6.592 1.00 0.56 O ATOM 2216 C5' DG C 10 4.679 7.333 -7.489 1.00 0.51 C ATOM 2217 C4' DG C 10 4.442 5.974 -8.105 1.00 0.48 C ATOM 2218 O4' DG C 10 5.129 4.986 -7.304 1.00 0.44 O ATOM 2219 C3' DG C 10 2.988 5.514 -8.144 1.00 0.53 C ATOM 2220 O3' DG C 10 2.802 4.581 -9.216 1.00 0.53 O ATOM 2221 C2' DG C 10 2.818 4.864 -6.783 1.00 0.53 C ATOM 2222 C1' DG C 10 4.192 4.236 -6.543 1.00 0.47 C ATOM 2223 N9 DG C 10 4.629 4.242 -5.149 1.00 0.46 N ATOM 2224 C8 DG C 10 4.482 5.255 -4.233 1.00 0.46 C ATOM 2225 N7 DG C 10 4.945 4.950 -3.050 1.00 0.45 N ATOM 2226 C5 DG C 10 5.433 3.658 -3.197 1.00 0.44 C ATOM 2227 C6 DG C 10 6.051 2.791 -2.254 1.00 0.42 C ATOM 2228 O6 DG C 10 6.295 2.995 -1.057 1.00 0.42 O ATOM 2229 N1 DG C 10 6.390 1.571 -2.830 1.00 0.41 N ATOM 2230 C2 DG C 10 6.168 1.227 -4.139 1.00 0.42 C ATOM 2231 N2 DG C 10 6.567 0.004 -4.507 1.00 0.41 N ATOM 2232 N3 DG C 10 5.598 2.023 -5.027 1.00 0.43 N ATOM 2233 C4 DG C 10 5.256 3.213 -4.490 1.00 0.44 C ATOM 0 H5' DG C 10 5.629 7.337 -6.955 1.00 0.51 H new ATOM 0 H5'' DG C 10 4.750 8.088 -8.272 1.00 0.51 H new ATOM 0 H4' DG C 10 4.794 6.068 -9.132 1.00 0.48 H new ATOM 0 H3' DG C 10 2.262 6.308 -8.322 1.00 0.53 H new ATOM 0 H2' DG C 10 2.565 5.593 -6.014 1.00 0.53 H new ATOM 0 H2'' DG C 10 2.025 4.116 -6.786 1.00 0.53 H new ATOM 0 H1' DG C 10 4.125 3.188 -6.834 1.00 0.47 H new ATOM 0 H8 DG C 10 4.029 6.207 -4.467 1.00 0.46 H new ATOM 0 H1 DG C 10 6.839 0.878 -2.232 1.00 0.41 H new ATOM 0 H21 DG C 10 6.429 -0.310 -5.468 1.00 0.41 H new ATOM 0 H22 DG C 10 7.009 -0.614 -3.827 1.00 0.41 H new ATOM 2245 P DC C 11 1.455 3.702 -9.295 1.00 0.56 P ATOM 2246 OP1 DC C 11 1.139 3.506 -10.733 1.00 0.65 O ATOM 2247 OP2 DC C 11 0.432 4.293 -8.394 1.00 0.59 O ATOM 2248 O5' DC C 11 1.900 2.290 -8.711 1.00 0.51 O ATOM 2249 C5' DC C 11 3.084 1.650 -9.191 1.00 0.52 C ATOM 2250 C4' DC C 11 2.942 0.147 -9.114 1.00 0.49 C ATOM 2251 O4' DC C 11 3.500 -0.294 -7.855 1.00 0.49 O ATOM 2252 C3' DC C 11 1.515 -0.389 -9.126 1.00 0.47 C ATOM 2253 O3' DC C 11 1.461 -1.723 -9.641 1.00 0.47 O ATOM 2254 C2' DC C 11 1.138 -0.342 -7.659 1.00 0.45 C ATOM 2255 C1' DC C 11 2.457 -0.664 -6.958 1.00 0.46 C ATOM 2256 N1 DC C 11 2.648 0.089 -5.707 1.00 0.46 N ATOM 2257 C2 DC C 11 3.194 -0.557 -4.592 1.00 0.45 C ATOM 2258 O2 DC C 11 3.534 -1.748 -4.689 1.00 0.45 O ATOM 2259 N3 DC C 11 3.341 0.134 -3.436 1.00 0.45 N ATOM 2260 C4 DC C 11 2.973 1.418 -3.376 1.00 0.46 C ATOM 2261 N4 DC C 11 3.121 2.061 -2.219 1.00 0.47 N ATOM 2262 C5 DC C 11 2.431 2.101 -4.501 1.00 0.47 C ATOM 2263 C6 DC C 11 2.286 1.405 -5.633 1.00 0.46 C ATOM 0 H5' DC C 11 3.943 1.971 -8.601 1.00 0.52 H new ATOM 0 H5'' DC C 11 3.275 1.951 -10.221 1.00 0.52 H new ATOM 0 H4' DC C 11 3.444 -0.225 -10.007 1.00 0.49 H new ATOM 0 H3' DC C 11 0.841 0.181 -9.765 1.00 0.47 H new ATOM 0 H2' DC C 11 0.756 0.637 -7.371 1.00 0.45 H new ATOM 0 H2'' DC C 11 0.364 -1.070 -7.417 1.00 0.45 H new ATOM 0 H1' DC C 11 2.458 -1.723 -6.700 1.00 0.46 H new ATOM 0 H41 DC C 11 2.849 3.041 -2.142 1.00 0.47 H new ATOM 0 H42 DC C 11 3.506 1.573 -1.410 1.00 0.47 H new ATOM 0 H5 DC C 11 2.148 3.142 -4.442 1.00 0.47 H new ATOM 0 H6 DC C 11 1.875 1.892 -6.505 1.00 0.46 H new ATOM 2275 P DG C 12 0.227 -2.159 -10.578 1.00 0.49 P ATOM 2276 OP1 DG C 12 0.678 -3.294 -11.422 1.00 0.55 O ATOM 2277 OP2 DG C 12 -0.331 -0.943 -11.224 1.00 0.53 O ATOM 2278 O5' DG C 12 -0.868 -2.700 -9.552 1.00 0.46 O ATOM 2279 C5' DG C 12 -0.635 -3.882 -8.789 1.00 0.45 C ATOM 2280 C4' DG C 12 -1.894 -4.295 -8.060 1.00 0.43 C ATOM 2281 O4' DG C 12 -1.869 -3.711 -6.738 1.00 0.42 O ATOM 2282 C3' DG C 12 -3.212 -3.823 -8.673 1.00 0.43 C ATOM 2283 O3' DG C 12 -4.245 -4.777 -8.341 1.00 0.44 O ATOM 2284 C2' DG C 12 -3.374 -2.446 -8.052 1.00 0.43 C ATOM 2285 C1' DG C 12 -2.792 -2.634 -6.661 1.00 0.42 C ATOM 2286 N9 DG C 12 -2.091 -1.470 -6.128 1.00 0.43 N ATOM 2287 C8 DG C 12 -1.846 -0.282 -6.771 1.00 0.44 C ATOM 2288 N7 DG C 12 -1.229 0.590 -6.023 1.00 0.45 N ATOM 2289 C5 DG C 12 -1.046 -0.066 -4.814 1.00 0.44 C ATOM 2290 C6 DG C 12 -0.441 0.382 -3.622 1.00 0.46 C ATOM 2291 O6 DG C 12 0.060 1.481 -3.385 1.00 0.48 O ATOM 2292 N1 DG C 12 -0.463 -0.598 -2.634 1.00 0.46 N ATOM 2293 C2 DG C 12 -1.005 -1.851 -2.781 1.00 0.44 C ATOM 2294 N2 DG C 12 -0.928 -2.657 -1.713 1.00 0.46 N ATOM 2295 N3 DG C 12 -1.579 -2.281 -3.895 1.00 0.43 N ATOM 2296 C4 DG C 12 -1.564 -1.342 -4.864 1.00 0.43 C ATOM 0 H5' DG C 12 0.167 -3.708 -8.072 1.00 0.45 H new ATOM 0 H5'' DG C 12 -0.306 -4.688 -9.446 1.00 0.45 H new ATOM 0 H4' DG C 12 -1.880 -5.384 -8.095 1.00 0.43 H new ATOM 0 H3' DG C 12 -3.255 -3.757 -9.760 1.00 0.43 H new ATOM 0 H2' DG C 12 -2.837 -1.683 -8.615 1.00 0.43 H new ATOM 0 H2'' DG C 12 -4.419 -2.139 -8.015 1.00 0.43 H new ATOM 0 H1' DG C 12 -3.627 -2.816 -5.985 1.00 0.42 H new ATOM 0 H8 DG C 12 -2.135 -0.089 -7.794 1.00 0.44 H new ATOM 0 H1 DG C 12 -0.045 -0.368 -1.733 1.00 0.46 H new ATOM 0 H21 DG C 12 -1.312 -3.601 -1.758 1.00 0.46 H new ATOM 0 H22 DG C 12 -0.485 -2.327 -0.856 1.00 0.46 H new ATOM 2308 P DG C 13 -5.658 -4.298 -7.721 1.00 0.45 P ATOM 2309 OP1 DG C 13 -6.491 -5.524 -7.608 1.00 0.50 O ATOM 2310 OP2 DG C 13 -6.184 -3.119 -8.454 1.00 0.47 O ATOM 2311 O5' DG C 13 -5.303 -3.885 -6.228 1.00 0.44 O ATOM 2312 C5' DG C 13 -4.618 -4.808 -5.389 1.00 0.44 C ATOM 2313 C4' DG C 13 -5.236 -4.853 -4.012 1.00 0.44 C ATOM 2314 O4' DG C 13 -4.568 -3.865 -3.183 1.00 0.46 O ATOM 2315 C3' DG C 13 -6.718 -4.502 -3.911 1.00 0.43 C ATOM 2316 O3' DG C 13 -7.290 -5.157 -2.781 1.00 0.43 O ATOM 2317 C2' DG C 13 -6.682 -2.994 -3.771 1.00 0.44 C ATOM 2318 C1' DG C 13 -5.427 -2.748 -2.961 1.00 0.46 C ATOM 2319 N9 DG C 13 -4.742 -1.516 -3.344 1.00 0.47 N ATOM 2320 C8 DG C 13 -4.588 -1.020 -4.615 1.00 0.47 C ATOM 2321 N7 DG C 13 -3.986 0.137 -4.649 1.00 0.49 N ATOM 2322 C5 DG C 13 -3.716 0.424 -3.318 1.00 0.50 C ATOM 2323 C6 DG C 13 -3.076 1.548 -2.728 1.00 0.53 C ATOM 2324 O6 DG C 13 -2.613 2.551 -3.281 1.00 0.55 O ATOM 2325 N1 DG C 13 -3.006 1.429 -1.346 1.00 0.54 N ATOM 2326 C2 DG C 13 -3.492 0.372 -0.621 1.00 0.53 C ATOM 2327 N2 DG C 13 -3.330 0.452 0.705 1.00 0.55 N ATOM 2328 N3 DG C 13 -4.091 -0.680 -1.153 1.00 0.50 N ATOM 2329 C4 DG C 13 -4.167 -0.591 -2.498 1.00 0.49 C ATOM 0 H5' DG C 13 -3.569 -4.524 -5.311 1.00 0.44 H new ATOM 0 H5'' DG C 13 -4.647 -5.801 -5.837 1.00 0.44 H new ATOM 0 H4' DG C 13 -5.123 -5.894 -3.708 1.00 0.44 H new ATOM 0 H3' DG C 13 -7.330 -4.818 -4.756 1.00 0.43 H new ATOM 0 H2' DG C 13 -6.637 -2.501 -4.742 1.00 0.44 H new ATOM 0 H2'' DG C 13 -7.569 -2.616 -3.263 1.00 0.44 H new ATOM 0 H1' DG C 13 -5.694 -2.635 -1.910 1.00 0.46 H new ATOM 0 H8 DG C 13 -4.931 -1.537 -5.499 1.00 0.47 H new ATOM 0 H1 DG C 13 -2.558 2.187 -0.831 1.00 0.54 H new ATOM 0 H21 DG C 13 -3.668 -0.299 1.306 1.00 0.55 H new ATOM 0 H22 DG C 13 -2.869 1.264 1.114 1.00 0.55 H new ATOM 2341 P DA C 14 -8.806 -4.845 -2.372 1.00 0.41 P ATOM 2342 OP1 DA C 14 -9.304 -6.061 -1.682 1.00 0.43 O ATOM 2343 OP2 DA C 14 -9.499 -4.354 -3.585 1.00 0.42 O ATOM 2344 O5' DA C 14 -8.621 -3.693 -1.292 1.00 0.43 O ATOM 2345 C5' DA C 14 -7.569 -3.834 -0.351 1.00 0.47 C ATOM 2346 C4' DA C 14 -7.956 -3.287 0.999 1.00 0.48 C ATOM 2347 O4' DA C 14 -7.345 -1.996 1.166 1.00 0.50 O ATOM 2348 C3' DA C 14 -9.436 -3.068 1.277 1.00 0.46 C ATOM 2349 O3' DA C 14 -9.647 -3.163 2.693 1.00 0.51 O ATOM 2350 C2' DA C 14 -9.651 -1.668 0.721 1.00 0.45 C ATOM 2351 C1' DA C 14 -8.319 -0.976 1.038 1.00 0.48 C ATOM 2352 N9 DA C 14 -7.837 -0.070 -0.004 1.00 0.50 N ATOM 2353 C8 DA C 14 -7.900 -0.259 -1.363 1.00 0.52 C ATOM 2354 N7 DA C 14 -7.364 0.717 -2.057 1.00 0.55 N ATOM 2355 C5 DA C 14 -6.922 1.610 -1.090 1.00 0.55 C ATOM 2356 C6 DA C 14 -6.265 2.851 -1.176 1.00 0.58 C ATOM 2357 N6 DA C 14 -5.938 3.438 -2.329 1.00 0.63 N ATOM 2358 N1 DA C 14 -5.956 3.478 -0.020 1.00 0.59 N ATOM 2359 C2 DA C 14 -6.293 2.894 1.138 1.00 0.56 C ATOM 2360 N3 DA C 14 -6.917 1.737 1.346 1.00 0.53 N ATOM 2361 C4 DA C 14 -7.207 1.138 0.179 1.00 0.52 C ATOM 0 H5' DA C 14 -6.683 -3.314 -0.715 1.00 0.47 H new ATOM 0 H5'' DA C 14 -7.304 -4.887 -0.255 1.00 0.47 H new ATOM 0 H4' DA C 14 -7.622 -4.066 1.684 1.00 0.48 H new ATOM 0 H3' DA C 14 -10.127 -3.785 0.834 1.00 0.46 H new ATOM 0 H2' DA C 14 -9.855 -1.684 -0.350 1.00 0.45 H new ATOM 0 H2'' DA C 14 -10.493 -1.166 1.199 1.00 0.45 H new ATOM 0 H1' DA C 14 -8.480 -0.379 1.935 1.00 0.48 H new ATOM 0 H8 DA C 14 -8.349 -1.130 -1.818 1.00 0.52 H new ATOM 0 H61 DA C 14 -5.462 4.340 -2.325 1.00 0.63 H new ATOM 0 H62 DA C 14 -6.165 2.985 -3.214 1.00 0.63 H new ATOM 0 H2 DA C 14 -6.019 3.440 2.029 1.00 0.56 H new ATOM 2373 P DT C 15 -11.000 -2.604 3.354 1.00 0.58 P ATOM 2374 OP1 DT C 15 -11.348 -3.535 4.454 1.00 0.73 O ATOM 2375 OP2 DT C 15 -12.000 -2.320 2.297 1.00 0.57 O ATOM 2376 O5' DT C 15 -10.550 -1.224 4.010 1.00 0.72 O ATOM 2377 C5' DT C 15 -9.271 -1.106 4.636 1.00 0.70 C ATOM 2378 C4' DT C 15 -9.255 0.059 5.598 1.00 0.77 C ATOM 2379 O4' DT C 15 -8.745 1.220 4.904 1.00 0.75 O ATOM 2380 C3' DT C 15 -10.622 0.482 6.128 1.00 0.78 C ATOM 2381 O3' DT C 15 -10.488 1.126 7.400 1.00 0.88 O ATOM 2382 C2' DT C 15 -11.100 1.449 5.062 1.00 0.72 C ATOM 2383 C1' DT C 15 -9.805 2.129 4.628 1.00 0.72 C ATOM 2384 N1 DT C 15 -9.743 2.485 3.196 1.00 0.65 N ATOM 2385 C2 DT C 15 -9.134 3.673 2.849 1.00 0.66 C ATOM 2386 O2 DT C 15 -8.620 4.426 3.662 1.00 0.73 O ATOM 2387 N3 DT C 15 -9.150 3.952 1.509 1.00 0.62 N ATOM 2388 C4 DT C 15 -9.700 3.184 0.504 1.00 0.58 C ATOM 2389 O4 DT C 15 -9.677 3.589 -0.651 1.00 0.58 O ATOM 2390 C5 DT C 15 -10.309 1.946 0.937 1.00 0.57 C ATOM 2391 C7 DT C 15 -10.967 1.069 -0.080 1.00 0.59 C ATOM 2392 C6 DT C 15 -10.293 1.654 2.242 1.00 0.60 C ATOM 0 H5' DT C 15 -8.500 -0.969 3.878 1.00 0.70 H new ATOM 0 H5'' DT C 15 -9.034 -2.027 5.168 1.00 0.70 H new ATOM 0 H4' DT C 15 -8.650 -0.279 6.439 1.00 0.77 H new ATOM 0 H3' DT C 15 -11.311 -0.346 6.294 1.00 0.78 H new ATOM 0 H2' DT C 15 -11.584 0.932 4.233 1.00 0.72 H new ATOM 0 H2'' DT C 15 -11.821 2.164 5.457 1.00 0.72 H new ATOM 0 H1' DT C 15 -9.736 3.069 5.176 1.00 0.72 H new ATOM 0 H3 DT C 15 -8.706 4.824 1.222 1.00 0.62 H new ATOM 0 H71 DT C 15 -11.360 1.683 -0.890 1.00 0.59 H new ATOM 0 H72 DT C 15 -10.237 0.365 -0.480 1.00 0.59 H new ATOM 0 H73 DT C 15 -11.784 0.519 0.388 1.00 0.59 H new ATOM 0 H6 DT C 15 -10.732 0.722 2.565 1.00 0.60 H new ATOM 2405 P DA C 16 -11.730 1.932 8.026 1.00 0.93 P ATOM 2406 OP1 DA C 16 -11.600 1.868 9.503 1.00 1.05 O ATOM 2407 OP2 DA C 16 -12.986 1.464 7.381 1.00 0.91 O ATOM 2408 O5' DA C 16 -11.470 3.436 7.572 1.00 0.91 O ATOM 2409 C5' DA C 16 -10.222 4.076 7.840 1.00 0.95 C ATOM 2410 C4' DA C 16 -10.413 5.569 7.976 1.00 0.96 C ATOM 2411 O4' DA C 16 -10.184 6.179 6.683 1.00 0.91 O ATOM 2412 C3' DA C 16 -11.815 6.017 8.380 1.00 0.98 C ATOM 2413 O3' DA C 16 -11.750 7.290 9.038 1.00 1.05 O ATOM 2414 C2' DA C 16 -12.526 6.108 7.043 1.00 0.90 C ATOM 2415 C1' DA C 16 -11.420 6.594 6.112 1.00 0.87 C ATOM 2416 N9 DA C 16 -11.501 6.060 4.753 1.00 0.79 N ATOM 2417 C8 DA C 16 -11.881 4.799 4.370 1.00 0.74 C ATOM 2418 N7 DA C 16 -11.875 4.615 3.073 1.00 0.69 N ATOM 2419 C5 DA C 16 -11.457 5.837 2.565 1.00 0.70 C ATOM 2420 C6 DA C 16 -11.245 6.290 1.255 1.00 0.67 C ATOM 2421 N6 DA C 16 -11.433 5.537 0.176 1.00 0.63 N ATOM 2422 N1 DA C 16 -10.827 7.562 1.088 1.00 0.71 N ATOM 2423 C2 DA C 16 -10.639 8.321 2.172 1.00 0.77 C ATOM 2424 N3 DA C 16 -10.802 8.008 3.459 1.00 0.80 N ATOM 2425 C4 DA C 16 -11.220 6.737 3.588 1.00 0.76 C ATOM 0 H5' DA C 16 -9.518 3.865 7.035 1.00 0.95 H new ATOM 0 H5'' DA C 16 -9.789 3.674 8.756 1.00 0.95 H new ATOM 0 H4' DA C 16 -9.719 5.868 8.762 1.00 0.96 H new ATOM 0 H3' DA C 16 -12.319 5.351 9.080 1.00 0.98 H new ATOM 0 H2' DA C 16 -12.925 5.143 6.730 1.00 0.90 H new ATOM 0 H2'' DA C 16 -13.364 6.804 7.076 1.00 0.90 H new ATOM 0 H1' DA C 16 -11.517 7.676 6.021 1.00 0.87 H new ATOM 0 H8 DA C 16 -12.160 4.028 5.073 1.00 0.74 H new ATOM 0 H61 DA C 16 -11.262 5.924 -0.752 1.00 0.63 H new ATOM 0 H62 DA C 16 -11.749 4.572 0.276 1.00 0.63 H new ATOM 0 H2 DA C 16 -10.308 9.331 1.979 1.00 0.77 H new ATOM 2437 P DA C 17 -13.097 8.134 9.293 1.00 1.08 P ATOM 2438 OP1 DA C 17 -12.937 8.829 10.596 1.00 1.20 O ATOM 2439 OP2 DA C 17 -14.267 7.246 9.076 1.00 1.05 O ATOM 2440 O5' DA C 17 -13.074 9.239 8.145 1.00 1.05 O ATOM 2441 C5' DA C 17 -11.843 9.843 7.745 1.00 1.07 C ATOM 2442 C4' DA C 17 -12.099 11.122 6.985 1.00 1.08 C ATOM 2443 O4' DA C 17 -12.232 10.797 5.580 1.00 1.03 O ATOM 2444 C3' DA C 17 -13.396 11.840 7.348 1.00 1.11 C ATOM 2445 O3' DA C 17 -13.259 13.244 7.083 1.00 1.15 O ATOM 2446 C2' DA C 17 -14.407 11.165 6.438 1.00 1.05 C ATOM 2447 C1' DA C 17 -13.594 10.895 5.179 1.00 1.00 C ATOM 2448 N9 DA C 17 -13.955 9.667 4.469 1.00 0.94 N ATOM 2449 C8 DA C 17 -14.297 8.445 4.995 1.00 0.93 C ATOM 2450 N7 DA C 17 -14.604 7.549 4.089 1.00 0.87 N ATOM 2451 C5 DA C 17 -14.447 8.221 2.886 1.00 0.84 C ATOM 2452 C6 DA C 17 -14.627 7.823 1.549 1.00 0.79 C ATOM 2453 N6 DA C 17 -15.024 6.603 1.191 1.00 0.75 N ATOM 2454 N1 DA C 17 -14.384 8.737 0.584 1.00 0.79 N ATOM 2455 C2 DA C 17 -13.990 9.965 0.948 1.00 0.84 C ATOM 2456 N3 DA C 17 -13.791 10.459 2.170 1.00 0.89 N ATOM 2457 C4 DA C 17 -14.041 9.525 3.106 1.00 0.89 C ATOM 0 H5' DA C 17 -11.278 9.150 7.121 1.00 1.07 H new ATOM 0 H5'' DA C 17 -11.232 10.052 8.623 1.00 1.07 H new ATOM 0 H4' DA C 17 -11.262 11.774 7.233 1.00 1.08 H new ATOM 0 H3' DA C 17 -13.683 11.775 8.398 1.00 1.11 H new ATOM 0 H2' DA C 17 -14.795 10.245 6.875 1.00 1.05 H new ATOM 0 H2'' DA C 17 -15.264 11.808 6.237 1.00 1.05 H new ATOM 0 H1' DA C 17 -13.791 11.710 4.483 1.00 1.00 H new ATOM 0 H8 DA C 17 -14.312 8.242 6.056 1.00 0.93 H new ATOM 0 H61 DA C 17 -15.137 6.373 0.204 1.00 0.75 H new ATOM 0 H62 DA C 17 -15.215 5.899 1.904 1.00 0.75 H new ATOM 0 H2 DA C 17 -13.808 10.653 0.135 1.00 0.84 H new ATOM 2469 P DC C 18 -14.565 14.165 6.902 1.00 1.19 P ATOM 2470 OP1 DC C 18 -14.200 15.544 7.318 1.00 1.29 O ATOM 2471 OP2 DC C 18 -15.730 13.493 7.533 1.00 1.18 O ATOM 2472 O5' DC C 18 -14.790 14.181 5.325 1.00 1.14 O ATOM 2473 C5' DC C 18 -13.703 14.451 4.438 1.00 1.15 C ATOM 2474 C4' DC C 18 -14.209 15.101 3.172 1.00 1.16 C ATOM 2475 O4' DC C 18 -14.624 14.062 2.256 1.00 1.09 O ATOM 2476 C3' DC C 18 -15.437 15.988 3.345 1.00 1.20 C ATOM 2477 O3' DC C 18 -15.479 16.978 2.311 1.00 1.25 O ATOM 2478 C2' DC C 18 -16.577 14.996 3.219 1.00 1.14 C ATOM 2479 C1' DC C 18 -16.046 14.011 2.184 1.00 1.08 C ATOM 2480 N1 DC C 18 -16.458 12.610 2.391 1.00 1.00 N ATOM 2481 C2 DC C 18 -16.802 11.832 1.279 1.00 0.94 C ATOM 2482 O2 DC C 18 -16.739 12.335 0.148 1.00 0.95 O ATOM 2483 N3 DC C 18 -17.196 10.550 1.465 1.00 0.88 N ATOM 2484 C4 DC C 18 -17.250 10.041 2.696 1.00 0.89 C ATOM 2485 N4 DC C 18 -17.648 8.775 2.835 1.00 0.85 N ATOM 2486 C5 DC C 18 -16.896 10.806 3.846 1.00 0.96 C ATOM 2487 C6 DC C 18 -16.508 12.073 3.647 1.00 1.01 C ATOM 0 H5' DC C 18 -13.183 13.524 4.196 1.00 1.15 H new ATOM 0 H5'' DC C 18 -12.980 15.104 4.926 1.00 1.15 H new ATOM 0 H4' DC C 18 -13.382 15.720 2.825 1.00 1.16 H new ATOM 0 H3' DC C 18 -15.462 16.544 4.282 1.00 1.20 H new ATOM 0 H2' DC C 18 -16.796 14.508 4.168 1.00 1.14 H new ATOM 0 H2'' DC C 18 -17.498 15.476 2.887 1.00 1.14 H new ATOM 0 H1' DC C 18 -16.457 14.308 1.219 1.00 1.08 H new ATOM 0 H41 DC C 18 -17.700 8.356 3.763 1.00 0.85 H new ATOM 0 H42 DC C 18 -17.900 8.226 2.013 1.00 0.85 H new ATOM 0 H5 DC C 18 -16.939 10.381 4.838 1.00 0.96 H new ATOM 0 H6 DC C 18 -16.230 12.681 4.495 1.00 1.01 H new ATOM 2499 P DA C 19 -16.748 17.957 2.189 1.00 1.31 P ATOM 2500 OP1 DA C 19 -16.259 19.272 1.700 1.00 1.42 O ATOM 2501 OP2 DA C 19 -17.534 17.889 3.449 1.00 1.33 O ATOM 2502 O5' DA C 19 -17.617 17.296 1.030 1.00 1.25 O ATOM 2503 C5' DA C 19 -17.036 17.006 -0.242 1.00 1.25 C ATOM 2504 C4' DA C 19 -18.096 17.037 -1.318 1.00 1.27 C ATOM 2505 O4' DA C 19 -18.581 15.689 -1.514 1.00 1.20 O ATOM 2506 C3' DA C 19 -19.336 17.865 -1.000 1.00 1.33 C ATOM 2507 O3' DA C 19 -19.951 18.308 -2.217 1.00 1.39 O ATOM 2508 C2' DA C 19 -20.203 16.867 -0.252 1.00 1.27 C ATOM 2509 C1' DA C 19 -19.882 15.552 -0.953 1.00 1.19 C ATOM 2510 N9 DA C 19 -19.863 14.387 -0.067 1.00 1.11 N ATOM 2511 C8 DA C 19 -19.494 14.345 1.256 1.00 1.10 C ATOM 2512 N7 DA C 19 -19.573 13.149 1.788 1.00 1.03 N ATOM 2513 C5 DA C 19 -20.024 12.350 0.748 1.00 0.98 C ATOM 2514 C6 DA C 19 -20.310 10.977 0.669 1.00 0.91 C ATOM 2515 N6 DA C 19 -20.171 10.135 1.693 1.00 0.88 N ATOM 2516 N1 DA C 19 -20.749 10.493 -0.514 1.00 0.89 N ATOM 2517 C2 DA C 19 -20.880 11.341 -1.543 1.00 0.95 C ATOM 2518 N3 DA C 19 -20.638 12.650 -1.592 1.00 1.02 N ATOM 2519 C4 DA C 19 -20.209 13.098 -0.401 1.00 1.04 C ATOM 0 H5' DA C 19 -16.560 16.026 -0.218 1.00 1.25 H new ATOM 0 H5'' DA C 19 -16.256 17.733 -0.468 1.00 1.25 H new ATOM 0 H4' DA C 19 -17.605 17.487 -2.181 1.00 1.27 H new ATOM 0 H3' DA C 19 -19.146 18.772 -0.425 1.00 1.33 H new ATOM 0 H2' DA C 19 -19.956 16.831 0.809 1.00 1.27 H new ATOM 0 H2'' DA C 19 -21.262 17.116 -0.324 1.00 1.27 H new ATOM 0 H1' DA C 19 -20.667 15.373 -1.688 1.00 1.19 H new ATOM 0 H8 DA C 19 -19.169 15.216 1.806 1.00 1.10 H new ATOM 0 H61 DA C 19 -20.395 9.147 1.575 1.00 0.88 H new ATOM 0 H62 DA C 19 -19.841 10.479 2.595 1.00 0.88 H new ATOM 0 H2 DA C 19 -21.232 10.900 -2.464 1.00 0.95 H new ATOM 2531 P DA C 20 -21.441 18.916 -2.193 1.00 1.45 P ATOM 2532 OP1 DA C 20 -21.480 20.052 -3.148 1.00 1.52 O ATOM 2533 OP2 DA C 20 -21.862 19.133 -0.784 1.00 1.46 O ATOM 2534 O5' DA C 20 -22.325 17.742 -2.802 1.00 1.42 O ATOM 2535 C5' DA C 20 -21.834 16.949 -3.885 1.00 1.38 C ATOM 2536 C4' DA C 20 -22.969 16.206 -4.550 1.00 1.40 C ATOM 2537 O4' DA C 20 -23.082 14.903 -3.932 1.00 1.31 O ATOM 2538 C3' DA C 20 -24.346 16.842 -4.390 1.00 1.49 C ATOM 2539 O3' DA C 20 -25.202 16.458 -5.474 1.00 1.55 O ATOM 2540 C2' DA C 20 -24.817 16.264 -3.070 1.00 1.45 C ATOM 2541 C1' DA C 20 -24.230 14.859 -3.090 1.00 1.33 C ATOM 2542 N9 DA C 20 -23.809 14.368 -1.778 1.00 1.26 N ATOM 2543 C8 DA C 20 -23.147 15.057 -0.793 1.00 1.28 C ATOM 2544 N7 DA C 20 -22.917 14.349 0.286 1.00 1.23 N ATOM 2545 C5 DA C 20 -23.465 13.109 -0.007 1.00 1.17 C ATOM 2546 C6 DA C 20 -23.553 11.917 0.731 1.00 1.12 C ATOM 2547 N6 DA C 20 -23.075 11.781 1.970 1.00 1.12 N ATOM 2548 N1 DA C 20 -24.158 10.861 0.148 1.00 1.07 N ATOM 2549 C2 DA C 20 -24.645 11.005 -1.095 1.00 1.09 C ATOM 2550 N3 DA C 20 -24.627 12.076 -1.887 1.00 1.16 N ATOM 2551 C4 DA C 20 -24.015 13.105 -1.276 1.00 1.19 C ATOM 0 H5' DA C 20 -21.092 16.240 -3.518 1.00 1.38 H new ATOM 0 H5'' DA C 20 -21.332 17.587 -4.613 1.00 1.38 H new ATOM 0 H4' DA C 20 -22.718 16.197 -5.611 1.00 1.40 H new ATOM 0 H3' DA C 20 -24.341 17.932 -4.400 1.00 1.49 H new ATOM 0 H2' DA C 20 -24.452 16.843 -2.222 1.00 1.45 H new ATOM 0 H2'' DA C 20 -25.905 16.247 -3.001 1.00 1.45 H new ATOM 0 H1' DA C 20 -25.008 14.180 -3.440 1.00 1.33 H new ATOM 0 H8 DA C 20 -22.843 16.088 -0.897 1.00 1.28 H new ATOM 0 H61 DA C 20 -23.168 10.890 2.458 1.00 1.12 H new ATOM 0 H62 DA C 20 -22.617 12.568 2.429 1.00 1.12 H new ATOM 0 H2 DA C 20 -25.118 10.128 -1.512 1.00 1.09 H new ATOM 2563 P DT C 21 -26.785 16.738 -5.385 1.00 1.66 P ATOM 2564 OP1 DT C 21 -27.247 17.091 -6.752 1.00 1.77 O ATOM 2565 OP2 DT C 21 -27.056 17.666 -4.255 1.00 1.73 O ATOM 2566 O5' DT C 21 -27.396 15.314 -5.015 1.00 1.60 O ATOM 2567 C5' DT C 21 -26.854 14.118 -5.578 1.00 1.51 C ATOM 2568 C4' DT C 21 -27.855 12.989 -5.491 1.00 1.52 C ATOM 2569 O4' DT C 21 -27.610 12.257 -4.268 1.00 1.43 O ATOM 2570 C3' DT C 21 -29.319 13.409 -5.412 1.00 1.66 C ATOM 2571 O3' DT C 21 -30.157 12.359 -5.911 1.00 1.71 O ATOM 2572 C2' DT C 21 -29.517 13.620 -3.922 1.00 1.65 C ATOM 2573 C1' DT C 21 -28.627 12.542 -3.314 1.00 1.50 C ATOM 2574 N1 DT C 21 -27.973 12.911 -2.038 1.00 1.44 N ATOM 2575 C2 DT C 21 -27.898 11.941 -1.066 1.00 1.37 C ATOM 2576 O2 DT C 21 -28.341 10.815 -1.214 1.00 1.35 O ATOM 2577 N3 DT C 21 -27.285 12.337 0.092 1.00 1.35 N ATOM 2578 C4 DT C 21 -26.756 13.577 0.375 1.00 1.40 C ATOM 2579 O4 DT C 21 -26.213 13.777 1.460 1.00 1.40 O ATOM 2580 C5 DT C 21 -26.874 14.553 -0.681 1.00 1.46 C ATOM 2581 C7 DT C 21 -26.406 15.952 -0.425 1.00 1.52 C ATOM 2582 C6 DT C 21 -27.461 14.180 -1.830 1.00 1.48 C ATOM 0 H5' DT C 21 -25.940 13.843 -5.051 1.00 1.51 H new ATOM 0 H5'' DT C 21 -26.582 14.291 -6.619 1.00 1.51 H new ATOM 0 H4' DT C 21 -27.714 12.423 -6.412 1.00 1.52 H new ATOM 0 H3' DT C 21 -29.567 14.291 -6.002 1.00 1.66 H new ATOM 0 H2' DT C 21 -29.214 14.620 -3.610 1.00 1.65 H new ATOM 0 H2'' DT C 21 -30.560 13.497 -3.630 1.00 1.65 H new ATOM 0 H1' DT C 21 -29.270 11.693 -3.081 1.00 1.50 H new ATOM 0 H3 DT C 21 -27.212 11.635 0.828 1.00 1.35 H new ATOM 0 H71 DT C 21 -26.525 16.188 0.633 1.00 1.52 H new ATOM 0 H72 DT C 21 -25.355 16.040 -0.700 1.00 1.52 H new ATOM 0 H73 DT C 21 -26.997 16.648 -1.021 1.00 1.52 H new ATOM 0 H6 DT C 21 -27.537 14.903 -2.628 1.00 1.48 H new ATOM 2595 P DT C 22 -31.744 12.393 -5.637 1.00 1.86 P ATOM 2596 OP1 DT C 22 -32.399 11.704 -6.777 1.00 1.95 O ATOM 2597 OP2 DT C 22 -32.146 13.780 -5.286 1.00 1.95 O ATOM 2598 O5' DT C 22 -31.922 11.474 -4.349 1.00 1.81 O ATOM 2599 C5' DT C 22 -31.295 10.193 -4.279 1.00 1.69 C ATOM 2600 C4' DT C 22 -32.047 9.285 -3.335 1.00 1.73 C ATOM 2601 O4' DT C 22 -31.504 9.458 -2.006 1.00 1.64 O ATOM 2602 C3' DT C 22 -33.538 9.575 -3.193 1.00 1.92 C ATOM 2603 O3' DT C 22 -34.230 8.381 -2.811 1.00 1.97 O ATOM 2604 C2' DT C 22 -33.562 10.629 -2.101 1.00 1.94 C ATOM 2605 C1' DT C 22 -32.411 10.197 -1.195 1.00 1.77 C ATOM 2606 N1 DT C 22 -31.659 11.301 -0.555 1.00 1.73 N ATOM 2607 C2 DT C 22 -31.136 11.069 0.697 1.00 1.67 C ATOM 2608 O2 DT C 22 -31.270 10.009 1.287 1.00 1.64 O ATOM 2609 N3 DT C 22 -30.453 12.126 1.241 1.00 1.66 N ATOM 2610 C4 DT C 22 -30.250 13.367 0.671 1.00 1.70 C ATOM 2611 O4 DT C 22 -29.591 14.215 1.272 1.00 1.71 O ATOM 2612 C5 DT C 22 -30.829 13.547 -0.639 1.00 1.76 C ATOM 2613 C7 DT C 22 -30.717 14.885 -1.302 1.00 1.83 C ATOM 2614 C6 DT C 22 -31.491 12.517 -1.190 1.00 1.77 C ATOM 0 H5' DT C 22 -30.264 10.304 -3.942 1.00 1.69 H new ATOM 0 H5'' DT C 22 -31.259 9.745 -5.272 1.00 1.69 H new ATOM 0 H4' DT C 22 -31.933 8.287 -3.759 1.00 1.73 H new ATOM 0 H3' DT C 22 -34.027 9.912 -4.107 1.00 1.92 H new ATOM 0 H2' DT C 22 -33.408 11.631 -2.501 1.00 1.94 H new ATOM 0 H2'' DT C 22 -34.514 10.641 -1.570 1.00 1.94 H new ATOM 0 H1' DT C 22 -32.849 9.627 -0.376 1.00 1.77 H new ATOM 0 H3 DT C 22 -30.051 11.980 2.167 1.00 1.66 H new ATOM 0 H71 DT C 22 -30.689 15.666 -0.542 1.00 1.83 H new ATOM 0 H72 DT C 22 -29.803 14.922 -1.895 1.00 1.83 H new ATOM 0 H73 DT C 22 -31.578 15.042 -1.952 1.00 1.83 H new ATOM 0 H6 DT C 22 -31.912 12.645 -2.176 1.00 1.77 H new ATOM 2627 P DT C 23 -35.711 8.471 -2.189 1.00 2.16 P ATOM 2628 OP1 DT C 23 -36.409 7.217 -2.567 1.00 2.22 O ATOM 2629 OP2 DT C 23 -36.312 9.783 -2.544 1.00 2.31 O ATOM 2630 O5' DT C 23 -35.451 8.436 -0.618 1.00 2.11 O ATOM 2631 C5' DT C 23 -34.563 7.472 -0.047 1.00 1.97 C ATOM 2632 C4' DT C 23 -34.921 7.217 1.398 1.00 2.05 C ATOM 2633 O4' DT C 23 -34.221 8.176 2.223 1.00 2.01 O ATOM 2634 C3' DT C 23 -36.395 7.401 1.746 1.00 2.28 C ATOM 2635 O3' DT C 23 -36.747 6.617 2.888 1.00 2.36 O ATOM 2636 C2' DT C 23 -36.479 8.884 2.053 1.00 2.35 C ATOM 2637 C1' DT C 23 -35.129 9.160 2.712 1.00 2.19 C ATOM 2638 N1 DT C 23 -34.547 10.491 2.438 1.00 2.15 N ATOM 2639 C2 DT C 23 -33.727 11.031 3.405 1.00 2.11 C ATOM 2640 O2 DT C 23 -33.452 10.451 4.442 1.00 2.10 O ATOM 2641 N3 DT C 23 -33.236 12.273 3.112 1.00 2.10 N ATOM 2642 C4 DT C 23 -33.471 13.015 1.974 1.00 2.12 C ATOM 2643 O4 DT C 23 -32.958 14.125 1.852 1.00 2.12 O ATOM 2644 C5 DT C 23 -34.331 12.388 0.994 1.00 2.17 C ATOM 2645 C7 DT C 23 -34.667 13.135 -0.257 1.00 2.23 C ATOM 2646 C6 DT C 23 -34.818 11.170 1.266 1.00 2.18 C ATOM 0 H5' DT C 23 -33.535 7.829 -0.116 1.00 1.97 H new ATOM 0 H5'' DT C 23 -34.616 6.541 -0.611 1.00 1.97 H new ATOM 0 H4' DT C 23 -34.653 6.175 1.571 1.00 2.05 H new ATOM 0 H3' DT C 23 -37.075 7.085 0.955 1.00 2.28 H new ATOM 0 H2' DT C 23 -36.619 9.478 1.150 1.00 2.35 H new ATOM 0 H2'' DT C 23 -37.311 9.114 2.719 1.00 2.35 H new ATOM 0 HO3' DT C 23 -37.695 6.750 3.096 1.00 2.36 H new ATOM 0 H1' DT C 23 -35.294 9.127 3.789 1.00 2.19 H new ATOM 0 H3 DT C 23 -32.629 12.698 3.813 1.00 2.10 H new ATOM 0 H71 DT C 23 -34.831 12.428 -1.070 1.00 2.23 H new ATOM 0 H72 DT C 23 -35.572 13.722 -0.098 1.00 2.23 H new ATOM 0 H73 DT C 23 -33.843 13.800 -0.516 1.00 2.23 H new ATOM 0 H6 DT C 23 -35.454 10.696 0.533 1.00 2.18 H new TER 2660 DT C 23 ATOM 2661 O5' DA D 1 -28.787 17.734 9.607 1.00 2.60 O ATOM 2662 C5' DA D 1 -28.344 17.469 10.935 1.00 2.59 C ATOM 2663 C4' DA D 1 -28.361 15.986 11.225 1.00 2.49 C ATOM 2664 O4' DA D 1 -29.316 15.357 10.338 1.00 2.40 O ATOM 2665 C3' DA D 1 -27.041 15.271 10.959 1.00 2.34 C ATOM 2666 O3' DA D 1 -26.943 14.094 11.774 1.00 2.33 O ATOM 2667 C2' DA D 1 -27.148 14.927 9.485 1.00 2.18 C ATOM 2668 C1' DA D 1 -28.633 14.627 9.324 1.00 2.21 C ATOM 2669 N9 DA D 1 -29.192 15.014 8.029 1.00 2.17 N ATOM 2670 C8 DA D 1 -28.986 16.187 7.350 1.00 2.20 C ATOM 2671 N7 DA D 1 -29.612 16.250 6.199 1.00 2.17 N ATOM 2672 C5 DA D 1 -30.279 15.037 6.115 1.00 2.11 C ATOM 2673 C6 DA D 1 -31.119 14.484 5.132 1.00 2.09 C ATOM 2674 N6 DA D 1 -31.430 15.108 3.991 1.00 2.10 N ATOM 2675 N1 DA D 1 -31.627 13.253 5.362 1.00 2.06 N ATOM 2676 C2 DA D 1 -31.297 12.624 6.501 1.00 2.06 C ATOM 2677 N3 DA D 1 -30.512 13.037 7.493 1.00 2.09 N ATOM 2678 C4 DA D 1 -30.032 14.266 7.237 1.00 2.11 C ATOM 0 H5' DA D 1 -28.985 17.990 11.647 1.00 2.59 H new ATOM 0 H5'' DA D 1 -27.335 17.858 11.070 1.00 2.59 H new ATOM 0 H4' DA D 1 -28.596 15.902 12.286 1.00 2.49 H new ATOM 0 H3' DA D 1 -26.155 15.861 11.193 1.00 2.34 H new ATOM 0 H2' DA D 1 -26.830 15.755 8.851 1.00 2.18 H new ATOM 0 H2'' DA D 1 -26.530 14.069 9.223 1.00 2.18 H new ATOM 0 HO5' DA D 1 -29.254 16.948 9.255 1.00 2.60 H new ATOM 0 H1' DA D 1 -28.758 13.547 9.399 1.00 2.21 H new ATOM 0 H8 DA D 1 -28.365 16.986 7.728 1.00 2.20 H new ATOM 0 H61 DA D 1 -32.045 14.657 3.314 1.00 2.10 H new ATOM 0 H62 DA D 1 -31.052 16.035 3.797 1.00 2.10 H new ATOM 0 H2 DA D 1 -31.730 11.643 6.631 1.00 2.06 H new ATOM 2691 P DA D 2 -25.783 13.012 11.493 1.00 2.19 P ATOM 2692 OP1 DA D 2 -25.348 12.486 12.812 1.00 2.27 O ATOM 2693 OP2 DA D 2 -24.779 13.605 10.574 1.00 2.14 O ATOM 2694 O5' DA D 2 -26.537 11.836 10.727 1.00 2.04 O ATOM 2695 C5' DA D 2 -27.824 11.383 11.156 1.00 2.09 C ATOM 2696 C4' DA D 2 -28.120 10.019 10.574 1.00 1.97 C ATOM 2697 O4' DA D 2 -28.752 10.200 9.286 1.00 1.88 O ATOM 2698 C3' DA D 2 -26.903 9.141 10.298 1.00 1.84 C ATOM 2699 O3' DA D 2 -27.284 7.759 10.319 1.00 1.81 O ATOM 2700 C2' DA D 2 -26.495 9.583 8.905 1.00 1.71 C ATOM 2701 C1' DA D 2 -27.837 9.878 8.244 1.00 1.72 C ATOM 2702 N9 DA D 2 -27.810 10.999 7.303 1.00 1.70 N ATOM 2703 C8 DA D 2 -27.156 12.195 7.453 1.00 1.76 C ATOM 2704 N7 DA D 2 -27.315 13.017 6.443 1.00 1.74 N ATOM 2705 C5 DA D 2 -28.125 12.311 5.565 1.00 1.67 C ATOM 2706 C6 DA D 2 -28.654 12.630 4.305 1.00 1.66 C ATOM 2707 N6 DA D 2 -28.443 13.795 3.690 1.00 1.70 N ATOM 2708 N1 DA D 2 -29.421 11.702 3.693 1.00 1.62 N ATOM 2709 C2 DA D 2 -29.637 10.535 4.316 1.00 1.59 C ATOM 2710 N3 DA D 2 -29.197 10.120 5.501 1.00 1.60 N ATOM 2711 C4 DA D 2 -28.437 11.064 6.081 1.00 1.65 C ATOM 0 H5' DA D 2 -28.590 12.093 10.844 1.00 2.09 H new ATOM 0 H5'' DA D 2 -27.857 11.337 12.245 1.00 2.09 H new ATOM 0 H4' DA D 2 -28.731 9.523 11.328 1.00 1.97 H new ATOM 0 H3' DA D 2 -26.100 9.239 11.028 1.00 1.84 H new ATOM 0 H2' DA D 2 -25.853 10.464 8.931 1.00 1.71 H new ATOM 0 H2'' DA D 2 -25.946 8.804 8.377 1.00 1.71 H new ATOM 0 H1' DA D 2 -28.119 8.997 7.667 1.00 1.72 H new ATOM 0 H8 DA D 2 -26.564 12.438 8.323 1.00 1.76 H new ATOM 0 H61 DA D 2 -28.855 13.970 2.773 1.00 1.70 H new ATOM 0 H62 DA D 2 -27.870 14.511 4.137 1.00 1.70 H new ATOM 0 H2 DA D 2 -30.256 9.831 3.780 1.00 1.59 H new ATOM 2723 P DA D 3 -26.275 6.636 9.759 1.00 1.69 P ATOM 2724 OP1 DA D 3 -26.397 5.447 10.641 1.00 1.79 O ATOM 2725 OP2 DA D 3 -24.940 7.250 9.538 1.00 1.66 O ATOM 2726 O5' DA D 3 -26.889 6.246 8.342 1.00 1.54 O ATOM 2727 C5' DA D 3 -28.301 6.099 8.171 1.00 1.57 C ATOM 2728 C4' DA D 3 -28.606 5.401 6.866 1.00 1.43 C ATOM 2729 O4' DA D 3 -28.668 6.390 5.818 1.00 1.38 O ATOM 2730 C3' DA D 3 -27.562 4.393 6.396 1.00 1.28 C ATOM 2731 O3' DA D 3 -28.191 3.427 5.539 1.00 1.19 O ATOM 2732 C2' DA D 3 -26.586 5.269 5.630 1.00 1.19 C ATOM 2733 C1' DA D 3 -27.510 6.306 4.997 1.00 1.23 C ATOM 2734 N9 DA D 3 -26.956 7.652 4.883 1.00 1.25 N ATOM 2735 C8 DA D 3 -26.219 8.350 5.803 1.00 1.32 C ATOM 2736 N7 DA D 3 -25.887 9.555 5.409 1.00 1.34 N ATOM 2737 C5 DA D 3 -26.439 9.654 4.140 1.00 1.28 C ATOM 2738 C6 DA D 3 -26.445 10.689 3.188 1.00 1.29 C ATOM 2739 N6 DA D 3 -25.858 11.874 3.374 1.00 1.35 N ATOM 2740 N1 DA D 3 -27.086 10.460 2.021 1.00 1.26 N ATOM 2741 C2 DA D 3 -27.680 9.271 1.834 1.00 1.22 C ATOM 2742 N3 DA D 3 -27.743 8.226 2.652 1.00 1.20 N ATOM 2743 C4 DA D 3 -27.097 8.485 3.802 1.00 1.23 C ATOM 0 H5' DA D 3 -28.779 7.078 8.187 1.00 1.57 H new ATOM 0 H5'' DA D 3 -28.716 5.528 9.001 1.00 1.57 H new ATOM 0 H4' DA D 3 -29.536 4.864 7.055 1.00 1.43 H new ATOM 0 H3' DA D 3 -27.080 3.826 7.192 1.00 1.28 H new ATOM 0 H2' DA D 3 -25.849 5.729 6.288 1.00 1.19 H new ATOM 0 H2'' DA D 3 -26.034 4.703 4.879 1.00 1.19 H new ATOM 0 H1' DA D 3 -27.700 5.970 3.978 1.00 1.23 H new ATOM 0 H8 DA D 3 -25.938 7.945 6.764 1.00 1.32 H new ATOM 0 H61 DA D 3 -25.899 12.584 2.643 1.00 1.35 H new ATOM 0 H62 DA D 3 -25.369 12.069 4.248 1.00 1.35 H new ATOM 0 H2 DA D 3 -28.177 9.146 0.884 1.00 1.22 H new ATOM 2755 P DT D 4 -27.295 2.484 4.590 1.00 1.05 P ATOM 2756 OP1 DT D 4 -28.145 1.343 4.171 1.00 1.04 O ATOM 2757 OP2 DT D 4 -26.012 2.223 5.282 1.00 1.07 O ATOM 2758 O5' DT D 4 -27.009 3.378 3.298 1.00 0.97 O ATOM 2759 C5' DT D 4 -28.087 3.850 2.483 1.00 1.00 C ATOM 2760 C4' DT D 4 -27.676 3.915 1.029 1.00 0.93 C ATOM 2761 O4' DT D 4 -27.158 5.238 0.750 1.00 0.93 O ATOM 2762 C3' DT D 4 -26.548 2.966 0.633 1.00 0.83 C ATOM 2763 O3' DT D 4 -26.643 2.677 -0.770 1.00 0.79 O ATOM 2764 C2' DT D 4 -25.303 3.775 0.954 1.00 0.82 C ATOM 2765 C1' DT D 4 -25.742 5.190 0.607 1.00 0.86 C ATOM 2766 N1 DT D 4 -25.149 6.281 1.415 1.00 0.91 N ATOM 2767 C2 DT D 4 -25.037 7.505 0.793 1.00 0.93 C ATOM 2768 O2 DT D 4 -25.431 7.709 -0.345 1.00 0.93 O ATOM 2769 N3 DT D 4 -24.446 8.484 1.543 1.00 0.98 N ATOM 2770 C4 DT D 4 -23.968 8.370 2.829 1.00 1.02 C ATOM 2771 O4 DT D 4 -23.413 9.329 3.361 1.00 1.07 O ATOM 2772 C5 DT D 4 -24.131 7.067 3.436 1.00 1.00 C ATOM 2773 C7 DT D 4 -23.635 6.860 4.830 1.00 1.09 C ATOM 2774 C6 DT D 4 -24.709 6.093 2.715 1.00 0.95 C ATOM 0 H5' DT D 4 -28.398 4.838 2.822 1.00 1.00 H new ATOM 0 H5'' DT D 4 -28.947 3.190 2.593 1.00 1.00 H new ATOM 0 H4' DT D 4 -28.574 3.644 0.474 1.00 0.93 H new ATOM 0 H3' DT D 4 -26.563 2.004 1.145 1.00 0.83 H new ATOM 0 H2' DT D 4 -25.016 3.683 2.002 1.00 0.82 H new ATOM 0 H2'' DT D 4 -24.446 3.457 0.360 1.00 0.82 H new ATOM 0 H1' DT D 4 -25.387 5.375 -0.407 1.00 0.86 H new ATOM 0 H3 DT D 4 -24.349 9.398 1.101 1.00 0.98 H new ATOM 0 H71 DT D 4 -24.247 6.107 5.326 1.00 1.09 H new ATOM 0 H72 DT D 4 -22.599 6.524 4.801 1.00 1.09 H new ATOM 0 H73 DT D 4 -23.697 7.798 5.381 1.00 1.09 H new ATOM 0 H6 DT D 4 -24.836 5.121 3.168 1.00 0.95 H new ATOM 2787 P DT D 5 -25.437 1.930 -1.527 1.00 0.74 P ATOM 2788 OP1 DT D 5 -26.036 1.176 -2.653 1.00 0.76 O ATOM 2789 OP2 DT D 5 -24.652 1.202 -0.498 1.00 0.74 O ATOM 2790 O5' DT D 5 -24.581 3.122 -2.152 1.00 0.74 O ATOM 2791 C5' DT D 5 -25.232 4.144 -2.907 1.00 0.78 C ATOM 2792 C4' DT D 5 -24.354 4.631 -4.039 1.00 0.75 C ATOM 2793 O4' DT D 5 -23.638 5.807 -3.595 1.00 0.75 O ATOM 2794 C3' DT D 5 -23.267 3.666 -4.507 1.00 0.69 C ATOM 2795 O3' DT D 5 -22.956 3.941 -5.884 1.00 0.70 O ATOM 2796 C2' DT D 5 -22.122 3.989 -3.564 1.00 0.67 C ATOM 2797 C1' DT D 5 -22.271 5.492 -3.363 1.00 0.70 C ATOM 2798 N1 DT D 5 -21.896 6.015 -2.027 1.00 0.72 N ATOM 2799 C2 DT D 5 -21.755 7.381 -1.910 1.00 0.76 C ATOM 2800 O2 DT D 5 -21.947 8.153 -2.836 1.00 0.80 O ATOM 2801 N3 DT D 5 -21.383 7.813 -0.664 1.00 0.77 N ATOM 2802 C4 DT D 5 -21.140 7.039 0.449 1.00 0.77 C ATOM 2803 O4 DT D 5 -20.826 7.572 1.509 1.00 0.80 O ATOM 2804 C5 DT D 5 -21.298 5.617 0.259 1.00 0.76 C ATOM 2805 C7 DT D 5 -20.894 4.696 1.365 1.00 0.82 C ATOM 2806 C6 DT D 5 -21.680 5.176 -0.947 1.00 0.73 C ATOM 0 H5' DT D 5 -25.483 4.979 -2.253 1.00 0.78 H new ATOM 0 H5'' DT D 5 -26.170 3.761 -3.309 1.00 0.78 H new ATOM 0 H4' DT D 5 -25.046 4.787 -4.866 1.00 0.75 H new ATOM 0 H3' DT D 5 -23.531 2.609 -4.477 1.00 0.69 H new ATOM 0 H2' DT D 5 -22.205 3.444 -2.624 1.00 0.67 H new ATOM 0 H2'' DT D 5 -21.155 3.732 -3.997 1.00 0.67 H new ATOM 0 H1' DT D 5 -21.573 5.963 -4.055 1.00 0.70 H new ATOM 0 H3 DT D 5 -21.274 8.820 -0.548 1.00 0.77 H new ATOM 0 H71 DT D 5 -21.513 3.799 1.336 1.00 0.82 H new ATOM 0 H72 DT D 5 -19.847 4.419 1.243 1.00 0.82 H new ATOM 0 H73 DT D 5 -21.027 5.198 2.323 1.00 0.82 H new ATOM 0 H6 DT D 5 -21.827 4.115 -1.083 1.00 0.73 H new ATOM 2819 P DG D 6 -21.582 3.415 -6.535 1.00 0.63 P ATOM 2820 OP1 DG D 6 -21.891 3.038 -7.936 1.00 0.64 O ATOM 2821 OP2 DG D 6 -20.956 2.415 -5.634 1.00 0.59 O ATOM 2822 O5' DG D 6 -20.666 4.720 -6.573 1.00 0.63 O ATOM 2823 C5' DG D 6 -21.234 5.989 -6.898 1.00 0.69 C ATOM 2824 C4' DG D 6 -20.156 6.989 -7.248 1.00 0.70 C ATOM 2825 O4' DG D 6 -19.812 7.727 -6.051 1.00 0.70 O ATOM 2826 C3' DG D 6 -18.834 6.402 -7.739 1.00 0.66 C ATOM 2827 O3' DG D 6 -18.146 7.355 -8.562 1.00 0.71 O ATOM 2828 C2' DG D 6 -18.091 6.148 -6.442 1.00 0.62 C ATOM 2829 C1' DG D 6 -18.541 7.307 -5.567 1.00 0.66 C ATOM 2830 N9 DG D 6 -18.669 6.978 -4.149 1.00 0.65 N ATOM 2831 C8 DG D 6 -19.082 5.790 -3.597 1.00 0.62 C ATOM 2832 N7 DG D 6 -19.031 5.784 -2.293 1.00 0.64 N ATOM 2833 C5 DG D 6 -18.570 7.051 -1.962 1.00 0.67 C ATOM 2834 C6 DG D 6 -18.305 7.636 -0.694 1.00 0.71 C ATOM 2835 O6 DG D 6 -18.412 7.127 0.431 1.00 0.73 O ATOM 2836 N1 DG D 6 -17.860 8.949 -0.821 1.00 0.75 N ATOM 2837 C2 DG D 6 -17.686 9.613 -2.012 1.00 0.75 C ATOM 2838 N2 DG D 6 -17.255 10.879 -1.934 1.00 0.81 N ATOM 2839 N3 DG D 6 -17.919 9.076 -3.197 1.00 0.72 N ATOM 2840 C4 DG D 6 -18.356 7.804 -3.098 1.00 0.68 C ATOM 0 H5' DG D 6 -21.817 6.358 -6.054 1.00 0.69 H new ATOM 0 H5'' DG D 6 -21.921 5.880 -7.737 1.00 0.69 H new ATOM 0 H4' DG D 6 -20.585 7.579 -8.058 1.00 0.70 H new ATOM 0 H3' DG D 6 -18.940 5.507 -8.352 1.00 0.66 H new ATOM 0 H2' DG D 6 -18.355 5.185 -6.006 1.00 0.62 H new ATOM 0 H2'' DG D 6 -17.011 6.146 -6.588 1.00 0.62 H new ATOM 0 H1' DG D 6 -17.776 8.081 -5.628 1.00 0.66 H new ATOM 0 H8 DG D 6 -19.415 4.946 -4.183 1.00 0.62 H new ATOM 0 H1 DG D 6 -17.646 9.458 0.037 1.00 0.75 H new ATOM 0 H21 DG D 6 -17.108 11.421 -2.785 1.00 0.81 H new ATOM 0 H22 DG D 6 -17.074 11.301 -1.023 1.00 0.81 H new ATOM 2852 P DT D 7 -16.598 7.126 -8.943 1.00 0.70 P ATOM 2853 OP1 DT D 7 -16.432 7.579 -10.347 1.00 0.77 O ATOM 2854 OP2 DT D 7 -16.198 5.747 -8.567 1.00 0.67 O ATOM 2855 O5' DT D 7 -15.824 8.155 -8.005 1.00 0.69 O ATOM 2856 C5' DT D 7 -16.328 9.475 -7.814 1.00 0.72 C ATOM 2857 C4' DT D 7 -15.217 10.423 -7.425 1.00 0.74 C ATOM 2858 O4' DT D 7 -15.167 10.501 -5.981 1.00 0.72 O ATOM 2859 C3' DT D 7 -13.805 10.019 -7.842 1.00 0.76 C ATOM 2860 O3' DT D 7 -12.970 11.178 -7.965 1.00 0.82 O ATOM 2861 C2' DT D 7 -13.366 9.133 -6.690 1.00 0.71 C ATOM 2862 C1' DT D 7 -14.035 9.792 -5.491 1.00 0.71 C ATOM 2863 N1 DT D 7 -14.499 8.846 -4.457 1.00 0.67 N ATOM 2864 C2 DT D 7 -14.355 9.213 -3.137 1.00 0.71 C ATOM 2865 O2 DT D 7 -13.884 10.282 -2.788 1.00 0.76 O ATOM 2866 N3 DT D 7 -14.785 8.275 -2.234 1.00 0.70 N ATOM 2867 C4 DT D 7 -15.327 7.038 -2.514 1.00 0.66 C ATOM 2868 O4 DT D 7 -15.723 6.329 -1.595 1.00 0.67 O ATOM 2869 C5 DT D 7 -15.446 6.716 -3.917 1.00 0.62 C ATOM 2870 C7 DT D 7 -15.892 5.342 -4.311 1.00 0.61 C ATOM 2871 C6 DT D 7 -15.047 7.630 -4.813 1.00 0.63 C ATOM 0 H5' DT D 7 -17.094 9.468 -7.039 1.00 0.72 H new ATOM 0 H5'' DT D 7 -16.805 9.823 -8.730 1.00 0.72 H new ATOM 0 H4' DT D 7 -15.465 11.350 -7.942 1.00 0.74 H new ATOM 0 H3' DT D 7 -13.751 9.519 -8.809 1.00 0.76 H new ATOM 0 H2' DT D 7 -13.696 8.103 -6.823 1.00 0.71 H new ATOM 0 H2'' DT D 7 -12.281 9.110 -6.587 1.00 0.71 H new ATOM 0 H1' DT D 7 -13.291 10.430 -5.013 1.00 0.71 H new ATOM 0 H3 DT D 7 -14.694 8.519 -1.248 1.00 0.70 H new ATOM 0 H71 DT D 7 -16.426 5.391 -5.260 1.00 0.61 H new ATOM 0 H72 DT D 7 -15.022 4.694 -4.417 1.00 0.61 H new ATOM 0 H73 DT D 7 -16.553 4.940 -3.543 1.00 0.61 H new ATOM 0 H6 DT D 7 -15.160 7.404 -5.863 1.00 0.63 H new ATOM 2884 P DT D 8 -11.381 11.013 -8.159 1.00 0.84 P ATOM 2885 OP1 DT D 8 -10.944 12.062 -9.112 1.00 0.94 O ATOM 2886 OP2 DT D 8 -11.069 9.587 -8.441 1.00 0.81 O ATOM 2887 O5' DT D 8 -10.787 11.383 -6.728 1.00 0.82 O ATOM 2888 C5' DT D 8 -11.346 12.449 -5.962 1.00 0.84 C ATOM 2889 C4' DT D 8 -10.326 13.000 -4.992 1.00 0.86 C ATOM 2890 O4' DT D 8 -10.480 12.313 -3.729 1.00 0.82 O ATOM 2891 C3' DT D 8 -8.862 12.796 -5.374 1.00 0.89 C ATOM 2892 O3' DT D 8 -8.054 13.812 -4.763 1.00 0.95 O ATOM 2893 C2' DT D 8 -8.566 11.421 -4.810 1.00 0.82 C ATOM 2894 C1' DT D 8 -9.406 11.397 -3.538 1.00 0.79 C ATOM 2895 N1 DT D 8 -9.982 10.077 -3.216 1.00 0.72 N ATOM 2896 C2 DT D 8 -10.114 9.737 -1.886 1.00 0.71 C ATOM 2897 O2 DT D 8 -9.822 10.488 -0.969 1.00 0.76 O ATOM 2898 N3 DT D 8 -10.610 8.481 -1.669 1.00 0.66 N ATOM 2899 C4 DT D 8 -10.984 7.558 -2.619 1.00 0.62 C ATOM 2900 O4 DT D 8 -11.391 6.458 -2.272 1.00 0.61 O ATOM 2901 C5 DT D 8 -10.840 7.981 -3.990 1.00 0.64 C ATOM 2902 C7 DT D 8 -11.187 7.020 -5.085 1.00 0.62 C ATOM 2903 C6 DT D 8 -10.358 9.209 -4.223 1.00 0.69 C ATOM 0 H5' DT D 8 -12.219 12.092 -5.416 1.00 0.84 H new ATOM 0 H5'' DT D 8 -11.688 13.242 -6.628 1.00 0.84 H new ATOM 0 H4' DT D 8 -10.522 14.072 -4.972 1.00 0.86 H new ATOM 0 H3' DT D 8 -8.658 12.863 -6.443 1.00 0.89 H new ATOM 0 H2' DT D 8 -8.854 10.629 -5.501 1.00 0.82 H new ATOM 0 H2'' DT D 8 -7.505 11.289 -4.598 1.00 0.82 H new ATOM 0 H1' DT D 8 -8.750 11.658 -2.708 1.00 0.79 H new ATOM 0 H3 DT D 8 -10.714 8.197 -0.695 1.00 0.66 H new ATOM 0 H71 DT D 8 -11.003 6.000 -4.746 1.00 0.62 H new ATOM 0 H72 DT D 8 -12.239 7.131 -5.347 1.00 0.62 H new ATOM 0 H73 DT D 8 -10.572 7.228 -5.960 1.00 0.62 H new ATOM 0 H6 DT D 8 -10.259 9.536 -5.247 1.00 0.69 H new ATOM 2916 P DA D 9 -6.466 13.599 -4.613 1.00 0.99 P ATOM 2917 OP1 DA D 9 -5.855 14.950 -4.537 1.00 1.11 O ATOM 2918 OP2 DA D 9 -5.998 12.636 -5.643 1.00 0.99 O ATOM 2919 O5' DA D 9 -6.315 12.911 -3.183 1.00 0.93 O ATOM 2920 C5' DA D 9 -6.872 13.521 -2.020 1.00 0.93 C ATOM 2921 C4' DA D 9 -6.038 13.194 -0.803 1.00 0.92 C ATOM 2922 O4' DA D 9 -6.534 11.958 -0.234 1.00 0.85 O ATOM 2923 C3' DA D 9 -4.556 12.940 -1.074 1.00 0.93 C ATOM 2924 O3' DA D 9 -3.786 13.262 0.096 1.00 0.96 O ATOM 2925 C2' DA D 9 -4.542 11.459 -1.410 1.00 0.86 C ATOM 2926 C1' DA D 9 -5.627 10.895 -0.505 1.00 0.81 C ATOM 2927 N9 DA D 9 -6.382 9.784 -1.083 1.00 0.75 N ATOM 2928 C8 DA D 9 -6.738 9.592 -2.397 1.00 0.73 C ATOM 2929 N7 DA D 9 -7.390 8.475 -2.608 1.00 0.69 N ATOM 2930 C5 DA D 9 -7.478 7.896 -1.351 1.00 0.67 C ATOM 2931 C6 DA D 9 -8.054 6.695 -0.903 1.00 0.64 C ATOM 2932 N6 DA D 9 -8.665 5.828 -1.711 1.00 0.62 N ATOM 2933 N1 DA D 9 -7.974 6.412 0.416 1.00 0.65 N ATOM 2934 C2 DA D 9 -7.351 7.283 1.222 1.00 0.69 C ATOM 2935 N3 DA D 9 -6.767 8.443 0.917 1.00 0.73 N ATOM 2936 C4 DA D 9 -6.867 8.693 -0.401 1.00 0.71 C ATOM 0 H5' DA D 9 -7.894 13.172 -1.873 1.00 0.93 H new ATOM 0 H5'' DA D 9 -6.920 14.601 -2.156 1.00 0.93 H new ATOM 0 H4' DA D 9 -6.120 14.070 -0.160 1.00 0.92 H new ATOM 0 H3' DA D 9 -4.117 13.543 -1.869 1.00 0.93 H new ATOM 0 H2' DA D 9 -4.761 11.282 -2.463 1.00 0.86 H new ATOM 0 H2'' DA D 9 -3.571 11.008 -1.206 1.00 0.86 H new ATOM 0 H1' DA D 9 -5.138 10.497 0.384 1.00 0.81 H new ATOM 0 H8 DA D 9 -6.502 10.296 -3.182 1.00 0.73 H new ATOM 0 H61 DA D 9 -9.066 4.971 -1.330 1.00 0.62 H new ATOM 0 H62 DA D 9 -8.732 6.022 -2.710 1.00 0.62 H new ATOM 0 H2 DA D 9 -7.317 7.007 2.266 1.00 0.69 H new ATOM 2948 P DT D 10 -2.318 12.632 0.297 1.00 0.95 P ATOM 2949 OP1 DT D 10 -1.527 13.598 1.101 1.00 1.03 O ATOM 2950 OP2 DT D 10 -1.797 12.179 -1.020 1.00 0.96 O ATOM 2951 O5' DT D 10 -2.594 11.362 1.216 1.00 0.88 O ATOM 2952 C5' DT D 10 -3.519 11.450 2.301 1.00 0.86 C ATOM 2953 C4' DT D 10 -3.246 10.370 3.320 1.00 0.83 C ATOM 2954 O4' DT D 10 -3.923 9.161 2.900 1.00 0.77 O ATOM 2955 C3' DT D 10 -1.778 9.973 3.453 1.00 0.83 C ATOM 2956 O3' DT D 10 -1.532 9.447 4.763 1.00 0.83 O ATOM 2957 C2' DT D 10 -1.626 8.914 2.378 1.00 0.78 C ATOM 2958 C1' DT D 10 -2.980 8.214 2.408 1.00 0.73 C ATOM 2959 N1 DT D 10 -3.461 7.710 1.100 1.00 0.70 N ATOM 2960 C2 DT D 10 -4.158 6.519 1.093 1.00 0.66 C ATOM 2961 O2 DT D 10 -4.415 5.890 2.106 1.00 0.65 O ATOM 2962 N3 DT D 10 -4.546 6.088 -0.148 1.00 0.65 N ATOM 2963 C4 DT D 10 -4.317 6.711 -1.355 1.00 0.68 C ATOM 2964 O4 DT D 10 -4.701 6.183 -2.399 1.00 0.69 O ATOM 2965 C5 DT D 10 -3.594 7.961 -1.279 1.00 0.73 C ATOM 2966 C7 DT D 10 -3.280 8.688 -2.547 1.00 0.77 C ATOM 2967 C6 DT D 10 -3.208 8.402 -0.069 1.00 0.73 C ATOM 0 H5' DT D 10 -4.538 11.355 1.926 1.00 0.86 H new ATOM 0 H5'' DT D 10 -3.443 12.430 2.772 1.00 0.86 H new ATOM 0 H4' DT D 10 -3.585 10.781 4.271 1.00 0.83 H new ATOM 0 H3' DT D 10 -1.073 10.796 3.332 1.00 0.83 H new ATOM 0 H2' DT D 10 -1.418 9.353 1.402 1.00 0.78 H new ATOM 0 H2'' DT D 10 -0.809 8.227 2.598 1.00 0.78 H new ATOM 0 H1' DT D 10 -2.869 7.330 3.036 1.00 0.73 H new ATOM 0 H3 DT D 10 -5.061 5.209 -0.182 1.00 0.65 H new ATOM 0 H71 DT D 10 -3.164 7.970 -3.359 1.00 0.77 H new ATOM 0 H72 DT D 10 -4.093 9.375 -2.783 1.00 0.77 H new ATOM 0 H73 DT D 10 -2.354 9.250 -2.425 1.00 0.77 H new ATOM 0 H6 DT D 10 -2.676 9.340 -0.008 1.00 0.73 H new ATOM 2980 P DC D 11 -0.154 8.680 5.068 1.00 0.86 P ATOM 2981 OP1 DC D 11 0.141 8.838 6.516 1.00 0.94 O ATOM 2982 OP2 DC D 11 0.855 9.105 4.063 1.00 0.87 O ATOM 2983 O5' DC D 11 -0.516 7.154 4.804 1.00 0.80 O ATOM 2984 C5' DC D 11 -1.650 6.555 5.431 1.00 0.76 C ATOM 2985 C4' DC D 11 -1.376 5.098 5.721 1.00 0.72 C ATOM 2986 O4' DC D 11 -1.855 4.319 4.602 1.00 0.66 O ATOM 2987 C3' DC D 11 0.099 4.737 5.860 1.00 0.72 C ATOM 2988 O3' DC D 11 0.250 3.574 6.683 1.00 0.72 O ATOM 2989 C2' DC D 11 0.502 4.472 4.421 1.00 0.69 C ATOM 2990 C1' DC D 11 -0.755 3.843 3.835 1.00 0.64 C ATOM 2991 N1 DC D 11 -1.003 4.167 2.418 1.00 0.62 N ATOM 2992 C2 DC D 11 -1.615 3.205 1.609 1.00 0.58 C ATOM 2993 O2 DC D 11 -1.974 2.135 2.117 1.00 0.57 O ATOM 2994 N3 DC D 11 -1.800 3.465 0.293 1.00 0.57 N ATOM 2995 C4 DC D 11 -1.399 4.630 -0.218 1.00 0.60 C ATOM 2996 N4 DC D 11 -1.567 4.828 -1.528 1.00 0.60 N ATOM 2997 C5 DC D 11 -0.797 5.641 0.589 1.00 0.64 C ATOM 2998 C6 DC D 11 -0.627 5.370 1.890 1.00 0.65 C ATOM 0 H5' DC D 11 -2.523 6.647 4.785 1.00 0.76 H new ATOM 0 H5'' DC D 11 -1.882 7.080 6.357 1.00 0.76 H new ATOM 0 H4' DC D 11 -1.869 4.893 6.671 1.00 0.72 H new ATOM 0 H3' DC D 11 0.710 5.504 6.336 1.00 0.72 H new ATOM 0 H2' DC D 11 0.776 5.390 3.901 1.00 0.69 H new ATOM 0 H2'' DC D 11 1.359 3.801 4.357 1.00 0.69 H new ATOM 0 H1' DC D 11 -0.626 2.762 3.877 1.00 0.64 H new ATOM 0 H41 DC D 11 -1.272 5.707 -1.953 1.00 0.60 H new ATOM 0 H42 DC D 11 -1.990 4.100 -2.104 1.00 0.60 H new ATOM 0 H5 DC D 11 -0.491 6.587 0.168 1.00 0.64 H new ATOM 0 H6 DC D 11 -0.185 6.116 2.533 1.00 0.65 H new ATOM 3010 P DC D 12 1.612 2.719 6.622 1.00 0.73 P ATOM 3011 OP1 DC D 12 1.740 1.994 7.912 1.00 0.81 O ATOM 3012 OP2 DC D 12 2.717 3.600 6.165 1.00 0.77 O ATOM 3013 O5' DC D 12 1.324 1.636 5.491 1.00 0.63 O ATOM 3014 C5' DC D 12 0.282 0.670 5.658 1.00 0.63 C ATOM 3015 C4' DC D 12 0.773 -0.706 5.275 1.00 0.60 C ATOM 3016 O4' DC D 12 0.452 -0.920 3.882 1.00 0.57 O ATOM 3017 C3' DC D 12 2.282 -0.912 5.371 1.00 0.57 C ATOM 3018 O3' DC D 12 2.648 -2.280 5.581 1.00 0.56 O ATOM 3019 C2' DC D 12 2.762 -0.428 4.022 1.00 0.54 C ATOM 3020 C1' DC D 12 1.628 -0.838 3.087 1.00 0.53 C ATOM 3021 N1 DC D 12 1.370 0.119 1.995 1.00 0.53 N ATOM 3022 C2 DC D 12 0.805 -0.344 0.801 1.00 0.50 C ATOM 3023 O2 DC D 12 0.506 -1.543 0.698 1.00 0.49 O ATOM 3024 N3 DC D 12 0.597 0.531 -0.213 1.00 0.50 N ATOM 3025 C4 DC D 12 0.926 1.816 -0.062 1.00 0.53 C ATOM 3026 N4 DC D 12 0.726 2.642 -1.086 1.00 0.53 N ATOM 3027 C5 DC D 12 1.484 2.316 1.147 1.00 0.55 C ATOM 3028 C6 DC D 12 1.683 1.443 2.141 1.00 0.55 C ATOM 0 H5' DC D 12 -0.576 0.941 5.043 1.00 0.63 H new ATOM 0 H5'' DC D 12 -0.057 0.667 6.694 1.00 0.63 H new ATOM 0 H4' DC D 12 0.294 -1.388 5.978 1.00 0.60 H new ATOM 0 H3' DC D 12 2.718 -0.387 6.220 1.00 0.57 H new ATOM 0 H2' DC D 12 2.922 0.650 4.014 1.00 0.54 H new ATOM 0 H2'' DC D 12 3.706 -0.893 3.739 1.00 0.54 H new ATOM 0 H1' DC D 12 1.911 -1.779 2.615 1.00 0.53 H new ATOM 0 H41 DC D 12 0.968 3.629 -1.000 1.00 0.53 H new ATOM 0 H42 DC D 12 0.331 2.288 -1.957 1.00 0.53 H new ATOM 0 H5 DC D 12 1.737 3.360 1.258 1.00 0.55 H new ATOM 0 H6 DC D 12 2.098 1.790 3.076 1.00 0.55 H new ATOM 3040 P DG D 13 4.026 -2.610 6.346 1.00 0.55 P ATOM 3041 OP1 DG D 13 3.686 -3.541 7.451 1.00 0.61 O ATOM 3042 OP2 DG D 13 4.725 -1.332 6.652 1.00 0.58 O ATOM 3043 O5' DG D 13 4.908 -3.398 5.277 1.00 0.49 O ATOM 3044 C5' DG D 13 5.409 -4.699 5.573 1.00 0.49 C ATOM 3045 C4' DG D 13 6.063 -5.315 4.359 1.00 0.45 C ATOM 3046 O4' DG D 13 5.573 -4.651 3.176 1.00 0.43 O ATOM 3047 C3' DG D 13 7.578 -5.141 4.303 1.00 0.41 C ATOM 3048 O3' DG D 13 8.128 -6.211 3.517 1.00 0.40 O ATOM 3049 C2' DG D 13 7.730 -3.790 3.626 1.00 0.37 C ATOM 3050 C1' DG D 13 6.572 -3.802 2.638 1.00 0.39 C ATOM 3051 N9 DG D 13 5.950 -2.518 2.333 1.00 0.40 N ATOM 3052 C8 DG D 13 5.763 -1.447 3.170 1.00 0.41 C ATOM 3053 N7 DG D 13 5.167 -0.441 2.590 1.00 0.42 N ATOM 3054 C5 DG D 13 4.948 -0.876 1.290 1.00 0.41 C ATOM 3055 C6 DG D 13 4.339 -0.219 0.188 1.00 0.42 C ATOM 3056 O6 DG D 13 3.865 0.920 0.142 1.00 0.43 O ATOM 3057 N1 DG D 13 4.317 -1.029 -0.947 1.00 0.41 N ATOM 3058 C2 DG D 13 4.833 -2.300 -1.015 1.00 0.40 C ATOM 3059 N2 DG D 13 4.727 -2.924 -2.201 1.00 0.40 N ATOM 3060 N3 DG D 13 5.409 -2.919 0.001 1.00 0.39 N ATOM 3061 C4 DG D 13 5.429 -2.154 1.115 1.00 0.40 C ATOM 0 H5' DG D 13 4.594 -5.337 5.915 1.00 0.49 H new ATOM 0 H5'' DG D 13 6.130 -4.638 6.388 1.00 0.49 H new ATOM 0 H4' DG D 13 5.825 -6.377 4.416 1.00 0.45 H new ATOM 0 H3' DG D 13 8.091 -5.172 5.264 1.00 0.41 H new ATOM 0 H2' DG D 13 7.653 -2.966 4.336 1.00 0.37 H new ATOM 0 H2'' DG D 13 8.693 -3.690 3.125 1.00 0.37 H new ATOM 0 H1' DG D 13 7.000 -4.135 1.692 1.00 0.39 H new ATOM 0 H8 DG D 13 6.077 -1.437 4.203 1.00 0.41 H new ATOM 0 H1 DG D 13 3.885 -0.649 -1.790 1.00 0.41 H new ATOM 0 H21 DG D 13 5.092 -3.870 -2.314 1.00 0.40 H new ATOM 0 H22 DG D 13 4.282 -2.452 -2.988 1.00 0.40 H new ATOM 3073 P DC D 14 9.592 -6.080 2.866 1.00 0.37 P ATOM 3074 OP1 DC D 14 10.061 -7.476 2.691 1.00 0.41 O ATOM 3075 OP2 DC D 14 10.398 -5.133 3.671 1.00 0.34 O ATOM 3076 O5' DC D 14 9.322 -5.467 1.420 1.00 0.38 O ATOM 3077 C5' DC D 14 8.329 -6.047 0.579 1.00 0.39 C ATOM 3078 C4' DC D 14 8.620 -5.788 -0.881 1.00 0.39 C ATOM 3079 O4' DC D 14 7.929 -4.571 -1.270 1.00 0.39 O ATOM 3080 C3' DC D 14 10.085 -5.530 -1.222 1.00 0.39 C ATOM 3081 O3' DC D 14 10.379 -5.876 -2.577 1.00 0.41 O ATOM 3082 C2' DC D 14 10.216 -4.037 -1.002 1.00 0.37 C ATOM 3083 C1' DC D 14 8.864 -3.508 -1.436 1.00 0.38 C ATOM 3084 N1 DC D 14 8.408 -2.321 -0.686 1.00 0.37 N ATOM 3085 C2 DC D 14 7.811 -1.274 -1.394 1.00 0.38 C ATOM 3086 O2 DC D 14 7.637 -1.396 -2.610 1.00 0.39 O ATOM 3087 N3 DC D 14 7.444 -0.153 -0.738 1.00 0.39 N ATOM 3088 C4 DC D 14 7.654 -0.051 0.574 1.00 0.39 C ATOM 3089 N4 DC D 14 7.295 1.086 1.172 1.00 0.40 N ATOM 3090 C5 DC D 14 8.243 -1.108 1.330 1.00 0.38 C ATOM 3091 C6 DC D 14 8.593 -2.221 0.665 1.00 0.37 C ATOM 0 H5' DC D 14 7.351 -5.639 0.834 1.00 0.39 H new ATOM 0 H5'' DC D 14 8.282 -7.121 0.757 1.00 0.39 H new ATOM 0 H4' DC D 14 8.303 -6.695 -1.396 1.00 0.39 H new ATOM 0 H3' DC D 14 10.775 -6.124 -0.623 1.00 0.39 H new ATOM 0 H2' DC D 14 10.426 -3.800 0.041 1.00 0.37 H new ATOM 0 H2'' DC D 14 11.025 -3.611 -1.595 1.00 0.37 H new ATOM 0 H1' DC D 14 8.947 -3.177 -2.471 1.00 0.38 H new ATOM 0 H41 DC D 14 7.439 1.202 2.175 1.00 0.40 H new ATOM 0 H42 DC D 14 6.876 1.839 0.626 1.00 0.40 H new ATOM 0 H5 DC D 14 8.401 -1.017 2.394 1.00 0.38 H new ATOM 0 H6 DC D 14 9.027 -3.049 1.205 1.00 0.37 H new ATOM 3103 P DT D 15 11.875 -5.682 -3.136 1.00 0.41 P ATOM 3104 OP1 DT D 15 12.222 -6.904 -3.903 1.00 0.46 O ATOM 3105 OP2 DT D 15 12.751 -5.243 -2.018 1.00 0.42 O ATOM 3106 O5' DT D 15 11.740 -4.471 -4.161 1.00 0.37 O ATOM 3107 C5' DT D 15 10.625 -4.396 -5.043 1.00 0.37 C ATOM 3108 C4' DT D 15 10.913 -3.451 -6.186 1.00 0.37 C ATOM 3109 O4' DT D 15 10.414 -2.141 -5.832 1.00 0.37 O ATOM 3110 C3' DT D 15 12.390 -3.239 -6.501 1.00 0.37 C ATOM 3111 O3' DT D 15 12.542 -2.884 -7.883 1.00 0.40 O ATOM 3112 C2' DT D 15 12.765 -2.110 -5.556 1.00 0.36 C ATOM 3113 C1' DT D 15 11.494 -1.270 -5.522 1.00 0.36 C ATOM 3114 N1 DT D 15 11.201 -0.608 -4.232 1.00 0.35 N ATOM 3115 C2 DT D 15 10.557 0.608 -4.287 1.00 0.36 C ATOM 3116 O2 DT D 15 10.189 1.120 -5.331 1.00 0.38 O ATOM 3117 N3 DT D 15 10.353 1.204 -3.070 1.00 0.35 N ATOM 3118 C4 DT D 15 10.717 0.720 -1.833 1.00 0.34 C ATOM 3119 O4 DT D 15 10.499 1.392 -0.827 1.00 0.35 O ATOM 3120 C5 DT D 15 11.373 -0.568 -1.841 1.00 0.33 C ATOM 3121 C7 DT D 15 11.849 -1.145 -0.546 1.00 0.33 C ATOM 3122 C6 DT D 15 11.575 -1.171 -3.026 1.00 0.33 C ATOM 0 H5' DT D 15 9.745 -4.057 -4.497 1.00 0.37 H new ATOM 0 H5'' DT D 15 10.396 -5.388 -5.433 1.00 0.37 H new ATOM 0 H4' DT D 15 10.440 -3.909 -7.055 1.00 0.37 H new ATOM 0 H3' DT D 15 13.024 -4.115 -6.363 1.00 0.37 H new ATOM 0 H2' DT D 15 13.032 -2.481 -4.567 1.00 0.36 H new ATOM 0 H2'' DT D 15 13.618 -1.540 -5.924 1.00 0.36 H new ATOM 0 H1' DT D 15 11.634 -0.459 -6.237 1.00 0.36 H new ATOM 0 H3 DT D 15 9.879 2.107 -3.082 1.00 0.35 H new ATOM 0 H71 DT D 15 12.114 -0.338 0.137 1.00 0.33 H new ATOM 0 H72 DT D 15 11.057 -1.749 -0.104 1.00 0.33 H new ATOM 0 H73 DT D 15 12.724 -1.770 -0.726 1.00 0.33 H new ATOM 0 H6 DT D 15 12.052 -2.140 -3.036 1.00 0.33 H new ATOM 3135 P DC D 16 13.926 -2.251 -8.410 1.00 0.40 P ATOM 3136 OP1 DC D 16 14.200 -2.835 -9.748 1.00 0.44 O ATOM 3137 OP2 DC D 16 14.959 -2.350 -7.348 1.00 0.40 O ATOM 3138 O5' DC D 16 13.557 -0.715 -8.622 1.00 0.42 O ATOM 3139 C5' DC D 16 12.254 -0.345 -9.071 1.00 0.45 C ATOM 3140 C4' DC D 16 12.266 1.052 -9.643 1.00 0.48 C ATOM 3141 O4' DC D 16 11.908 1.978 -8.592 1.00 0.48 O ATOM 3142 C3' DC D 16 13.620 1.535 -10.152 1.00 0.48 C ATOM 3143 O3' DC D 16 13.438 2.540 -11.157 1.00 0.54 O ATOM 3144 C2' DC D 16 14.254 2.106 -8.896 1.00 0.46 C ATOM 3145 C1' DC D 16 13.058 2.699 -8.165 1.00 0.47 C ATOM 3146 N1 DC D 16 13.128 2.627 -6.694 1.00 0.44 N ATOM 3147 C2 DC D 16 12.682 3.722 -5.945 1.00 0.45 C ATOM 3148 O2 DC D 16 12.207 4.707 -6.537 1.00 0.48 O ATOM 3149 N3 DC D 16 12.775 3.685 -4.597 1.00 0.43 N ATOM 3150 C4 DC D 16 13.281 2.609 -3.995 1.00 0.41 C ATOM 3151 N4 DC D 16 13.371 2.621 -2.668 1.00 0.41 N ATOM 3152 C5 DC D 16 13.725 1.470 -4.730 1.00 0.40 C ATOM 3153 C6 DC D 16 13.628 1.519 -6.066 1.00 0.41 C ATOM 0 H5' DC D 16 11.549 -0.398 -8.241 1.00 0.45 H new ATOM 0 H5'' DC D 16 11.910 -1.051 -9.827 1.00 0.45 H new ATOM 0 H4' DC D 16 11.576 1.017 -10.486 1.00 0.48 H new ATOM 0 H3' DC D 16 14.228 0.761 -10.620 1.00 0.48 H new ATOM 0 H2' DC D 16 14.750 1.336 -8.305 1.00 0.46 H new ATOM 0 H2'' DC D 16 15.004 2.862 -9.128 1.00 0.46 H new ATOM 0 H1' DC D 16 13.030 3.761 -8.409 1.00 0.47 H new ATOM 0 H41 DC D 16 13.753 1.814 -2.175 1.00 0.41 H new ATOM 0 H42 DC D 16 13.058 3.437 -2.143 1.00 0.41 H new ATOM 0 H5 DC D 16 14.124 0.601 -4.229 1.00 0.40 H new ATOM 0 H6 DC D 16 13.949 0.672 -6.655 1.00 0.41 H new ATOM 3165 P DA D 17 14.692 3.407 -11.667 1.00 0.56 P ATOM 3166 OP1 DA D 17 14.466 3.674 -13.110 1.00 0.64 O ATOM 3167 OP2 DA D 17 15.948 2.746 -11.232 1.00 0.54 O ATOM 3168 O5' DA D 17 14.543 4.782 -10.876 1.00 0.57 O ATOM 3169 C5' DA D 17 13.264 5.402 -10.733 1.00 0.60 C ATOM 3170 C4' DA D 17 13.420 6.883 -10.478 1.00 0.63 C ATOM 3171 O4' DA D 17 13.431 7.104 -9.048 1.00 0.60 O ATOM 3172 C3' DA D 17 14.719 7.502 -10.985 1.00 0.64 C ATOM 3173 O3' DA D 17 14.521 8.896 -11.252 1.00 0.70 O ATOM 3174 C2' DA D 17 15.665 7.266 -9.821 1.00 0.60 C ATOM 3175 C1' DA D 17 14.749 7.416 -8.612 1.00 0.58 C ATOM 3176 N9 DA D 17 15.078 6.533 -7.494 1.00 0.53 N ATOM 3177 C8 DA D 17 15.520 5.234 -7.541 1.00 0.50 C ATOM 3178 N7 DA D 17 15.750 4.711 -6.359 1.00 0.46 N ATOM 3179 C5 DA D 17 15.435 5.734 -5.475 1.00 0.47 C ATOM 3180 C6 DA D 17 15.471 5.817 -4.074 1.00 0.45 C ATOM 3181 N6 DA D 17 15.868 4.817 -3.283 1.00 0.43 N ATOM 3182 N1 DA D 17 15.085 6.983 -3.504 1.00 0.47 N ATOM 3183 C2 DA D 17 14.698 7.988 -4.301 1.00 0.51 C ATOM 3184 N3 DA D 17 14.628 8.031 -5.629 1.00 0.53 N ATOM 3185 C4 DA D 17 15.014 6.859 -6.160 1.00 0.51 C ATOM 0 H5' DA D 17 12.720 4.940 -9.909 1.00 0.60 H new ATOM 0 H5'' DA D 17 12.673 5.242 -11.635 1.00 0.60 H new ATOM 0 H4' DA D 17 12.591 7.346 -11.013 1.00 0.63 H new ATOM 0 H3' DA D 17 15.094 7.081 -11.918 1.00 0.64 H new ATOM 0 H2' DA D 17 16.121 6.277 -9.864 1.00 0.60 H new ATOM 0 H2'' DA D 17 16.478 7.992 -9.806 1.00 0.60 H new ATOM 0 H1' DA D 17 14.860 8.435 -8.242 1.00 0.58 H new ATOM 0 H8 DA D 17 15.665 4.693 -8.464 1.00 0.50 H new ATOM 0 H61 DA D 17 15.872 4.939 -2.270 1.00 0.43 H new ATOM 0 H62 DA D 17 16.167 3.932 -3.692 1.00 0.43 H new ATOM 0 H2 DA D 17 14.400 8.893 -3.793 1.00 0.51 H new ATOM 3197 P DC D 18 15.785 9.855 -11.510 1.00 0.74 P ATOM 3198 OP1 DC D 18 15.366 10.894 -12.487 1.00 0.81 O ATOM 3199 OP2 DC D 18 16.982 9.023 -11.793 1.00 0.73 O ATOM 3200 O5' DC D 18 15.996 10.571 -10.103 1.00 0.74 O ATOM 3201 C5' DC D 18 14.877 11.061 -9.365 1.00 0.74 C ATOM 3202 C4' DC D 18 15.313 12.139 -8.401 1.00 0.76 C ATOM 3203 O4' DC D 18 15.605 11.518 -7.127 1.00 0.71 O ATOM 3204 C3' DC D 18 16.592 12.874 -8.788 1.00 0.80 C ATOM 3205 O3' DC D 18 16.596 14.185 -8.211 1.00 0.84 O ATOM 3206 C2' DC D 18 17.670 11.988 -8.192 1.00 0.76 C ATOM 3207 C1' DC D 18 17.011 11.483 -6.913 1.00 0.71 C ATOM 3208 N1 DC D 18 17.383 10.111 -6.526 1.00 0.65 N ATOM 3209 C2 DC D 18 17.538 9.812 -5.167 1.00 0.61 C ATOM 3210 O2 DC D 18 17.327 10.702 -4.327 1.00 0.63 O ATOM 3211 N3 DC D 18 17.919 8.567 -4.802 1.00 0.56 N ATOM 3212 C4 DC D 18 18.142 7.639 -5.734 1.00 0.55 C ATOM 3213 N4 DC D 18 18.539 6.434 -5.329 1.00 0.51 N ATOM 3214 C5 DC D 18 17.970 7.909 -7.125 1.00 0.59 C ATOM 3215 C6 DC D 18 17.588 9.144 -7.470 1.00 0.64 C ATOM 0 H5' DC D 18 14.408 10.243 -8.818 1.00 0.74 H new ATOM 0 H5'' DC D 18 14.127 11.458 -10.050 1.00 0.74 H new ATOM 0 H4' DC D 18 14.494 12.859 -8.388 1.00 0.76 H new ATOM 0 H3' DC D 18 16.720 13.028 -9.859 1.00 0.80 H new ATOM 0 H2' DC D 18 17.939 11.170 -8.860 1.00 0.76 H new ATOM 0 H2'' DC D 18 18.584 12.544 -7.985 1.00 0.76 H new ATOM 0 H1' DC D 18 17.350 12.126 -6.101 1.00 0.71 H new ATOM 0 H41 DC D 18 18.719 5.700 -6.014 1.00 0.51 H new ATOM 0 H42 DC D 18 18.663 6.246 -4.334 1.00 0.51 H new ATOM 0 H5 DC D 18 18.142 7.146 -7.870 1.00 0.59 H new ATOM 0 H6 DC D 18 17.439 9.381 -8.513 1.00 0.64 H new ATOM 3227 P DA D 19 17.942 15.066 -8.224 1.00 0.89 P ATOM 3228 OP1 DA D 19 17.537 16.473 -8.471 1.00 0.95 O ATOM 3229 OP2 DA D 19 18.943 14.422 -9.117 1.00 0.89 O ATOM 3230 O5' DA D 19 18.456 14.972 -6.721 1.00 0.88 O ATOM 3231 C5' DA D 19 17.537 15.073 -5.633 1.00 0.87 C ATOM 3232 C4' DA D 19 18.262 15.449 -4.362 1.00 0.89 C ATOM 3233 O4' DA D 19 18.606 14.233 -3.658 1.00 0.83 O ATOM 3234 C3' DA D 19 19.587 16.182 -4.555 1.00 0.94 C ATOM 3235 O3' DA D 19 19.881 16.983 -3.402 1.00 1.00 O ATOM 3236 C2' DA D 19 20.570 15.038 -4.711 1.00 0.90 C ATOM 3237 C1' DA D 19 20.001 13.982 -3.772 1.00 0.83 C ATOM 3238 N9 DA D 19 20.180 12.606 -4.236 1.00 0.76 N ATOM 3239 C8 DA D 19 20.076 12.129 -5.520 1.00 0.76 C ATOM 3240 N7 DA D 19 20.329 10.845 -5.628 1.00 0.70 N ATOM 3241 C5 DA D 19 20.607 10.451 -4.327 1.00 0.66 C ATOM 3242 C6 DA D 19 20.953 9.208 -3.768 1.00 0.60 C ATOM 3243 N6 DA D 19 21.086 8.088 -4.482 1.00 0.58 N ATOM 3244 N1 DA D 19 21.164 9.154 -2.435 1.00 0.59 N ATOM 3245 C2 DA D 19 21.035 10.278 -1.720 1.00 0.63 C ATOM 3246 N3 DA D 19 20.717 11.503 -2.129 1.00 0.69 N ATOM 3247 C4 DA D 19 20.513 11.522 -3.459 1.00 0.70 C ATOM 0 H5' DA D 19 17.020 14.123 -5.496 1.00 0.87 H new ATOM 0 H5'' DA D 19 16.776 15.820 -5.860 1.00 0.87 H new ATOM 0 H4' DA D 19 17.578 16.115 -3.836 1.00 0.89 H new ATOM 0 H3' DA D 19 19.602 16.872 -5.399 1.00 0.94 H new ATOM 0 H2' DA D 19 20.618 14.682 -5.740 1.00 0.90 H new ATOM 0 H2'' DA D 19 21.581 15.330 -4.427 1.00 0.90 H new ATOM 0 H1' DA D 19 20.538 14.060 -2.827 1.00 0.83 H new ATOM 0 H8 DA D 19 19.811 12.752 -6.362 1.00 0.76 H new ATOM 0 H61 DA D 19 21.339 7.215 -4.019 1.00 0.58 H new ATOM 0 H62 DA D 19 20.934 8.105 -5.491 1.00 0.58 H new ATOM 0 H2 DA D 19 21.215 10.176 -0.660 1.00 0.63 H new ATOM 3259 P DA D 20 21.350 17.610 -3.211 1.00 1.06 P ATOM 3260 OP1 DA D 20 21.184 18.918 -2.526 1.00 1.15 O ATOM 3261 OP2 DA D 20 22.073 17.549 -4.509 1.00 1.08 O ATOM 3262 O5' DA D 20 22.054 16.608 -2.193 1.00 1.01 O ATOM 3263 C5' DA D 20 21.370 16.161 -1.020 1.00 0.97 C ATOM 3264 C4' DA D 20 22.359 15.756 0.047 1.00 0.96 C ATOM 3265 O4' DA D 20 22.609 14.336 -0.079 1.00 0.88 O ATOM 3266 C3' DA D 20 23.735 16.411 -0.047 1.00 1.02 C ATOM 3267 O3' DA D 20 24.344 16.453 1.253 1.00 1.05 O ATOM 3268 C2' DA D 20 24.468 15.482 -0.996 1.00 0.99 C ATOM 3269 C1' DA D 20 23.900 14.118 -0.633 1.00 0.89 C ATOM 3270 N9 DA D 20 23.766 13.202 -1.764 1.00 0.83 N ATOM 3271 C8 DA D 20 23.294 13.474 -3.022 1.00 0.84 C ATOM 3272 N7 DA D 20 23.333 12.446 -3.834 1.00 0.79 N ATOM 3273 C5 DA D 20 23.859 11.426 -3.056 1.00 0.73 C ATOM 3274 C6 DA D 20 24.157 10.081 -3.332 1.00 0.67 C ATOM 3275 N6 DA D 20 23.969 9.512 -4.523 1.00 0.66 N ATOM 3276 N1 DA D 20 24.669 9.332 -2.329 1.00 0.64 N ATOM 3277 C2 DA D 20 24.868 9.910 -1.134 1.00 0.67 C ATOM 3278 N3 DA D 20 24.633 11.161 -0.757 1.00 0.73 N ATOM 3279 C4 DA D 20 24.124 11.875 -1.775 1.00 0.76 C ATOM 0 H5' DA D 20 20.726 15.317 -1.267 1.00 0.97 H new ATOM 0 H5'' DA D 20 20.725 16.955 -0.644 1.00 0.97 H new ATOM 0 H4' DA D 20 21.899 16.067 0.985 1.00 0.96 H new ATOM 0 H3' DA D 20 23.729 17.444 -0.395 1.00 1.02 H new ATOM 0 H2' DA D 20 24.277 15.736 -2.039 1.00 0.99 H new ATOM 0 H2'' DA D 20 25.547 15.523 -0.850 1.00 0.99 H new ATOM 0 H1' DA D 20 24.597 13.647 0.060 1.00 0.89 H new ATOM 0 H8 DA D 20 22.924 14.445 -3.317 1.00 0.84 H new ATOM 0 H61 DA D 20 24.205 8.529 -4.662 1.00 0.66 H new ATOM 0 H62 DA D 20 23.589 10.059 -5.295 1.00 0.66 H new ATOM 0 H2 DA D 20 25.278 9.265 -0.370 1.00 0.67 H new ATOM 3291 P DT D 21 25.932 16.666 1.397 1.00 1.12 P ATOM 3292 OP1 DT D 21 26.171 17.313 2.712 1.00 1.18 O ATOM 3293 OP2 DT D 21 26.470 17.293 0.163 1.00 1.19 O ATOM 3294 O5' DT D 21 26.501 15.181 1.494 1.00 1.06 O ATOM 3295 C5' DT D 21 25.897 14.231 2.369 1.00 0.97 C ATOM 3296 C4' DT D 21 26.919 13.229 2.852 1.00 0.98 C ATOM 3297 O4' DT D 21 26.963 12.131 1.912 1.00 0.91 O ATOM 3298 C3' DT D 21 28.354 13.747 2.923 1.00 1.10 C ATOM 3299 O3' DT D 21 29.103 12.997 3.888 1.00 1.14 O ATOM 3300 C2' DT D 21 28.862 13.495 1.515 1.00 1.10 C ATOM 3301 C1' DT D 21 28.158 12.197 1.139 1.00 0.97 C ATOM 3302 N1 DT D 21 27.797 12.079 -0.292 1.00 0.92 N ATOM 3303 C2 DT D 21 27.984 10.853 -0.892 1.00 0.86 C ATOM 3304 O2 DT D 21 28.408 9.877 -0.296 1.00 0.84 O ATOM 3305 N3 DT D 21 27.658 10.811 -2.221 1.00 0.84 N ATOM 3306 C4 DT D 21 27.181 11.845 -2.998 1.00 0.88 C ATOM 3307 O4 DT D 21 26.947 11.657 -4.190 1.00 0.88 O ATOM 3308 C5 DT D 21 27.004 13.104 -2.309 1.00 0.94 C ATOM 3309 C7 DT D 21 26.568 14.300 -3.097 1.00 1.01 C ATOM 3310 C6 DT D 21 27.306 13.160 -1.001 1.00 0.96 C ATOM 0 H5' DT D 21 25.089 13.714 1.851 1.00 0.97 H new ATOM 0 H5'' DT D 21 25.452 14.745 3.221 1.00 0.97 H new ATOM 0 H4' DT D 21 26.599 12.964 3.860 1.00 0.98 H new ATOM 0 H3' DT D 21 28.438 14.790 3.228 1.00 1.10 H new ATOM 0 H2' DT D 21 28.602 14.309 0.838 1.00 1.10 H new ATOM 0 H2'' DT D 21 29.947 13.391 1.487 1.00 1.10 H new ATOM 0 H1' DT D 21 28.854 11.382 1.338 1.00 0.97 H new ATOM 0 H3 DT D 21 27.782 9.913 -2.689 1.00 0.84 H new ATOM 0 H71 DT D 21 26.936 14.216 -4.120 1.00 1.01 H new ATOM 0 H72 DT D 21 25.479 14.353 -3.106 1.00 1.01 H new ATOM 0 H73 DT D 21 26.971 15.204 -2.640 1.00 1.01 H new ATOM 0 H6 DT D 21 27.158 14.094 -0.479 1.00 0.96 H new ATOM 3323 P DT D 22 30.701 13.166 3.970 1.00 1.28 P ATOM 3324 OP1 DT D 22 31.092 13.022 5.395 1.00 1.34 O ATOM 3325 OP2 DT D 22 31.093 14.388 3.221 1.00 1.37 O ATOM 3326 O5' DT D 22 31.254 11.898 3.182 1.00 1.25 O ATOM 3327 C5' DT D 22 30.682 10.607 3.395 1.00 1.16 C ATOM 3328 C4' DT D 22 31.670 9.523 3.031 1.00 1.22 C ATOM 3329 O4' DT D 22 31.453 9.149 1.651 1.00 1.15 O ATOM 3330 C3' DT D 22 33.140 9.927 3.103 1.00 1.38 C ATOM 3331 O3' DT D 22 33.950 8.764 3.338 1.00 1.46 O ATOM 3332 C2' DT D 22 33.381 10.525 1.728 1.00 1.40 C ATOM 3333 C1' DT D 22 32.500 9.661 0.833 1.00 1.26 C ATOM 3334 N1 DT D 22 31.881 10.355 -0.315 1.00 1.20 N ATOM 3335 C2 DT D 22 31.731 9.629 -1.473 1.00 1.14 C ATOM 3336 O2 DT D 22 32.086 8.468 -1.581 1.00 1.13 O ATOM 3337 N3 DT D 22 31.150 10.312 -2.508 1.00 1.13 N ATOM 3338 C4 DT D 22 30.717 11.619 -2.505 1.00 1.17 C ATOM 3339 O4 DT D 22 30.196 12.089 -3.513 1.00 1.18 O ATOM 3340 C5 DT D 22 30.910 12.330 -1.261 1.00 1.22 C ATOM 3341 C7 DT D 22 30.536 13.778 -1.194 1.00 1.29 C ATOM 3342 C6 DT D 22 31.470 11.673 -0.232 1.00 1.23 C ATOM 0 H5' DT D 22 29.778 10.500 2.795 1.00 1.16 H new ATOM 0 H5'' DT D 22 30.386 10.502 4.439 1.00 1.16 H new ATOM 0 H4' DT D 22 31.496 8.732 3.760 1.00 1.22 H new ATOM 0 H3' DT D 22 33.385 10.621 3.907 1.00 1.38 H new ATOM 0 H2' DT D 22 33.094 11.576 1.687 1.00 1.40 H new ATOM 0 H2'' DT D 22 34.431 10.469 1.440 1.00 1.40 H new ATOM 0 H1' DT D 22 33.149 8.899 0.400 1.00 1.26 H new ATOM 0 H3 DT D 22 31.024 9.795 -3.378 1.00 1.13 H new ATOM 0 H71 DT D 22 30.228 14.028 -0.179 1.00 1.29 H new ATOM 0 H72 DT D 22 31.395 14.389 -1.473 1.00 1.29 H new ATOM 0 H73 DT D 22 29.713 13.973 -1.881 1.00 1.29 H new ATOM 0 H6 DT D 22 31.605 12.198 0.702 1.00 1.23 H new ATOM 3355 P DC D 23 35.533 8.807 3.045 1.00 1.65 P ATOM 3356 OP1 DC D 23 36.159 7.780 3.915 1.00 1.77 O ATOM 3357 OP2 DC D 23 35.999 10.217 3.122 1.00 1.76 O ATOM 3358 O5' DC D 23 35.654 8.315 1.533 1.00 1.62 O ATOM 3359 C5' DC D 23 35.088 7.067 1.124 1.00 1.53 C ATOM 3360 C4' DC D 23 35.861 6.490 -0.038 1.00 1.59 C ATOM 3361 O4' DC D 23 35.334 7.048 -1.265 1.00 1.52 O ATOM 3362 C3' DC D 23 37.350 6.820 -0.065 1.00 1.78 C ATOM 3363 O3' DC D 23 38.072 5.824 -0.795 1.00 1.87 O ATOM 3364 C2' DC D 23 37.379 8.152 -0.789 1.00 1.79 C ATOM 3365 C1' DC D 23 36.246 8.002 -1.803 1.00 1.64 C ATOM 3366 N1 DC D 23 35.490 9.235 -2.096 1.00 1.57 N ATOM 3367 C2 DC D 23 34.938 9.395 -3.375 1.00 1.51 C ATOM 3368 O2 DC D 23 35.091 8.495 -4.216 1.00 1.49 O ATOM 3369 N3 DC D 23 34.254 10.524 -3.662 1.00 1.49 N ATOM 3370 C4 DC D 23 34.107 11.471 -2.733 1.00 1.52 C ATOM 3371 N4 DC D 23 33.429 12.570 -3.065 1.00 1.54 N ATOM 3372 C5 DC D 23 34.649 11.331 -1.422 1.00 1.58 C ATOM 3373 C6 DC D 23 35.327 10.209 -1.150 1.00 1.60 C ATOM 0 H5' DC D 23 34.045 7.210 0.840 1.00 1.53 H new ATOM 0 H5'' DC D 23 35.098 6.366 1.959 1.00 1.53 H new ATOM 0 H4' DC D 23 35.751 5.411 0.067 1.00 1.59 H new ATOM 0 H3' DC D 23 37.810 6.855 0.922 1.00 1.78 H new ATOM 0 H2' DC D 23 37.208 8.987 -0.110 1.00 1.79 H new ATOM 0 H2'' DC D 23 38.338 8.329 -1.276 1.00 1.79 H new ATOM 0 HO3' DC D 23 39.025 6.052 -0.804 1.00 1.87 H new ATOM 0 H1' DC D 23 36.706 7.706 -2.746 1.00 1.64 H new ATOM 0 H41 DC D 23 33.297 13.314 -2.380 1.00 1.54 H new ATOM 0 H42 DC D 23 33.042 12.666 -4.004 1.00 1.54 H new ATOM 0 H5 DC D 23 34.518 12.101 -0.676 1.00 1.58 H new ATOM 0 H6 DC D 23 35.752 10.071 -0.167 1.00 1.60 H new TER 3386 DC D 23