USER MOD reduce.3.24.130724 H: found=0, std=0, add=922, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 923 hydrogens (164 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 NoAdj-H: B 109 TEDHOY7A: B 109 TED OY7A: B 109 TED CY7A:(short bond) USER MOD NoAdj-H: B 109 TEDHOY7B: B 109 TED OY7B: B 109 TED CY7B:(short bond) USER MOD NoAdj-H: B 109 TEDHOY7C: B 109 TED OY7C: B 109 TED CY7C:(short bond) USER MOD NoAdj-H: B 109 TEDHOY6A: B 109 TED OY6A: B 109 TED CY6A:(short bond) USER MOD NoAdj-H: B 109 TEDHOY6B: B 109 TED OY6B: B 109 TED CY6B:(short bond) USER MOD NoAdj-H: B 109 TEDHOY6C: B 109 TED OY6C: B 109 TED CY6C:(short bond) USER MOD NoAdj-H: C 119 TEDHOY7A: C 119 TED OY7A: C 119 TED CY7A:(short bond) USER MOD NoAdj-H: C 119 TEDHOY7B: C 119 TED OY7B: C 119 TED CY7B:(short bond) USER MOD NoAdj-H: C 119 TEDHOY7C: C 119 TED OY7C: C 119 TED CY7C:(short bond) USER MOD NoAdj-H: C 119 TEDHOY6A: C 119 TED OY6A: C 119 TED CY6A:(short bond) USER MOD NoAdj-H: C 119 TEDHOY6B: C 119 TED OY6B: C 119 TED CY6B:(short bond) USER MOD NoAdj-H: C 119 TEDHOY6C: C 119 TED OY6C: C 119 TED CY6C:(short bond) USER MOD Set 1.1: A 39 SER OG : rot 179:sc= 0.618 USER MOD Set 1.2: A 41 SER OG : rot -68:sc= 0.627 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -1.58 K(o=-1.6,f=-0.019) USER MOD Single : A 8 THR OG1 : rot 180:sc= -0.612 USER MOD Single : A 10 CYS SG : rot 180:sc= -3.94 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -158:sc= -5.32! (180deg=-6.94!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0.171 USER MOD Single : A 29 SER OG : rot 180:sc= 0.0101 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot -74:sc= 0.116 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot 46:sc= -4.05! USER MOD Single : A 48 LYS NZ :NH3+ 166:sc= -0.35 (180deg=-0.937) USER MOD Single : A 50 GLN : amide:sc= -0.142 X(o=-0.14,f=-0.14) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -1.6! C(o=-1.6!,f=-2.4!) USER MOD Single : A 62 SER OG : rot 61:sc= 1.27 USER MOD Single : A 63 CYS SG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -117:sc= 0 (180deg=-0.45) USER MOD Single : A 71 MET CE :methyl -168:sc= 0 (180deg=-0.298) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 100 DG O5' : rot 84:sc= -1.5! USER MOD Single : B 104 DT C7 :methyl 150:sc= -0.0943 (180deg=-0.0943) USER MOD Single : B 110 DC O3' : rot 180:sc= 0 USER MOD Single : C 111 DG O5' : rot 56:sc= -2.73! USER MOD Single : C 118 DT C7 :methyl 150:sc= -0.395 (180deg=-0.395) USER MOD Single : C 121 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 3 -12.222 0.033 11.031 1.00 0.00 N ATOM 2 CA ASP A 3 -12.248 -0.093 9.547 1.00 0.00 C ATOM 3 C ASP A 3 -10.816 -0.184 9.017 1.00 0.00 C ATOM 4 O ASP A 3 -10.313 -1.256 8.742 1.00 0.00 O ATOM 5 CB ASP A 3 -12.938 1.131 8.943 1.00 0.00 C ATOM 6 CG ASP A 3 -14.445 1.047 9.199 1.00 0.00 C ATOM 7 OD1 ASP A 3 -14.907 -0.026 9.550 1.00 0.00 O ATOM 8 OD2 ASP A 3 -15.110 2.058 9.039 1.00 0.00 O ATOM 0 HA ASP A 3 -12.796 -0.993 9.269 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -12.534 2.043 9.383 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -12.743 1.180 7.872 1.00 0.00 H new ATOM 13 N LYS A 4 -10.155 0.931 8.871 1.00 0.00 N ATOM 14 CA LYS A 4 -8.758 0.907 8.354 1.00 0.00 C ATOM 15 C LYS A 4 -7.800 0.549 9.492 1.00 0.00 C ATOM 16 O LYS A 4 -8.004 0.923 10.630 1.00 0.00 O ATOM 17 CB LYS A 4 -8.396 2.286 7.798 1.00 0.00 C ATOM 18 CG LYS A 4 -9.415 2.689 6.730 1.00 0.00 C ATOM 19 CD LYS A 4 -9.138 1.914 5.441 1.00 0.00 C ATOM 20 CE LYS A 4 -10.109 2.370 4.351 1.00 0.00 C ATOM 21 NZ LYS A 4 -9.831 1.622 3.093 1.00 0.00 N ATOM 0 H LYS A 4 -10.522 1.858 9.087 1.00 0.00 H new ATOM 0 HA LYS A 4 -8.676 0.163 7.562 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.385 3.022 8.602 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -7.394 2.266 7.370 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -10.426 2.482 7.081 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -9.356 3.761 6.542 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -8.110 2.079 5.119 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.249 0.844 5.617 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -11.137 2.197 4.670 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -10.004 3.441 4.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -10.491 1.932 2.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -8.855 1.808 2.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -9.953 0.603 3.261 1.00 0.00 H new ATOM 35 N GLN A 5 -6.756 -0.175 9.195 1.00 0.00 N ATOM 36 CA GLN A 5 -5.782 -0.551 10.259 1.00 0.00 C ATOM 37 C GLN A 5 -4.890 0.650 10.582 1.00 0.00 C ATOM 38 O GLN A 5 -5.114 1.746 10.109 1.00 0.00 O ATOM 39 CB GLN A 5 -4.915 -1.712 9.769 1.00 0.00 C ATOM 40 CG GLN A 5 -4.514 -2.587 10.957 1.00 0.00 C ATOM 41 CD GLN A 5 -5.603 -3.630 11.215 1.00 0.00 C ATOM 42 OE1 GLN A 5 -5.366 -4.625 11.870 1.00 0.00 O ATOM 43 NE2 GLN A 5 -6.798 -3.442 10.724 1.00 0.00 N ATOM 0 H GLN A 5 -6.535 -0.523 8.262 1.00 0.00 H new ATOM 0 HA GLN A 5 -6.323 -0.854 11.156 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -5.463 -2.304 9.036 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -4.025 -1.329 9.269 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -3.564 -3.081 10.754 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -4.369 -1.970 11.844 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -6.998 -2.607 10.174 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -7.532 -4.130 10.891 1.00 0.00 H new ATOM 52 N GLY A 6 -3.883 0.452 11.386 1.00 0.00 N ATOM 53 CA GLY A 6 -2.976 1.582 11.738 1.00 0.00 C ATOM 54 C GLY A 6 -1.603 1.033 12.128 1.00 0.00 C ATOM 55 O GLY A 6 -0.946 1.550 13.010 1.00 0.00 O ATOM 0 H GLY A 6 -3.648 -0.443 11.815 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -2.880 2.262 10.892 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -3.397 2.157 12.563 1.00 0.00 H new ATOM 59 N ARG A 7 -1.165 -0.011 11.479 1.00 0.00 N ATOM 60 CA ARG A 7 0.165 -0.592 11.816 1.00 0.00 C ATOM 61 C ARG A 7 1.250 0.100 10.988 1.00 0.00 C ATOM 62 O ARG A 7 1.053 0.420 9.832 1.00 0.00 O ATOM 63 CB ARG A 7 0.160 -2.089 11.500 1.00 0.00 C ATOM 64 CG ARG A 7 -0.815 -2.806 12.436 1.00 0.00 C ATOM 65 CD ARG A 7 -0.879 -4.290 12.069 1.00 0.00 C ATOM 66 NE ARG A 7 -1.507 -4.440 10.726 1.00 0.00 N ATOM 67 CZ ARG A 7 -1.411 -5.573 10.084 1.00 0.00 C ATOM 68 NH1 ARG A 7 -0.765 -6.574 10.620 1.00 0.00 N ATOM 69 NH2 ARG A 7 -1.960 -5.706 8.909 1.00 0.00 N ATOM 0 H ARG A 7 -1.670 -0.486 10.731 1.00 0.00 H new ATOM 0 HA ARG A 7 0.369 -0.444 12.876 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -0.130 -2.251 10.462 1.00 0.00 H new ATOM 0 HB3 ARG A 7 1.163 -2.500 11.618 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -0.493 -2.690 13.471 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -1.806 -2.358 12.358 1.00 0.00 H new ATOM 0 HD2 ARG A 7 0.123 -4.718 12.064 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -1.456 -4.836 12.816 1.00 0.00 H new ATOM 0 HE ARG A 7 -2.012 -3.658 10.308 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -0.336 -6.470 11.540 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -0.690 -7.459 10.119 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -2.465 -4.925 8.491 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -1.885 -6.591 8.408 1.00 0.00 H new ATOM 83 N THR A 8 2.394 0.333 11.570 1.00 0.00 N ATOM 84 CA THR A 8 3.486 1.015 10.820 1.00 0.00 C ATOM 85 C THR A 8 4.830 0.391 11.198 1.00 0.00 C ATOM 86 O THR A 8 4.989 -0.164 12.268 1.00 0.00 O ATOM 87 CB THR A 8 3.498 2.504 11.176 1.00 0.00 C ATOM 88 OG1 THR A 8 3.820 2.658 12.550 1.00 0.00 O ATOM 89 CG2 THR A 8 2.118 3.107 10.902 1.00 0.00 C ATOM 0 H THR A 8 2.620 0.081 12.532 1.00 0.00 H new ATOM 0 HA THR A 8 3.318 0.899 9.749 1.00 0.00 H new ATOM 0 HB THR A 8 4.243 3.017 10.568 1.00 0.00 H new ATOM 0 HG1 THR A 8 3.830 3.611 12.779 1.00 0.00 H new ATOM 0 HG21 THR A 8 2.127 4.167 11.156 1.00 0.00 H new ATOM 0 HG22 THR A 8 1.872 2.989 9.847 1.00 0.00 H new ATOM 0 HG23 THR A 8 1.370 2.595 11.508 1.00 0.00 H new ATOM 97 N ASP A 9 5.801 0.474 10.330 1.00 0.00 N ATOM 98 CA ASP A 9 7.140 -0.095 10.651 1.00 0.00 C ATOM 99 C ASP A 9 7.825 0.778 11.704 1.00 0.00 C ATOM 100 O ASP A 9 7.573 1.962 11.804 1.00 0.00 O ATOM 101 CB ASP A 9 7.996 -0.131 9.383 1.00 0.00 C ATOM 102 CG ASP A 9 7.475 -1.221 8.445 1.00 0.00 C ATOM 103 OD1 ASP A 9 6.716 -2.058 8.906 1.00 0.00 O ATOM 104 OD2 ASP A 9 7.844 -1.201 7.283 1.00 0.00 O ATOM 0 H ASP A 9 5.725 0.912 9.412 1.00 0.00 H new ATOM 0 HA ASP A 9 7.022 -1.107 11.038 1.00 0.00 H new ATOM 0 HB2 ASP A 9 7.966 0.838 8.884 1.00 0.00 H new ATOM 0 HB3 ASP A 9 9.037 -0.325 9.640 1.00 0.00 H new ATOM 109 N CYS A 10 8.692 0.202 12.493 1.00 0.00 N ATOM 110 CA CYS A 10 9.390 0.997 13.541 1.00 0.00 C ATOM 111 C CYS A 10 10.825 1.281 13.094 1.00 0.00 C ATOM 112 O CYS A 10 11.598 0.377 12.843 1.00 0.00 O ATOM 113 CB CYS A 10 9.410 0.208 14.852 1.00 0.00 C ATOM 114 SG CYS A 10 7.760 0.232 15.596 1.00 0.00 S ATOM 0 H CYS A 10 8.946 -0.785 12.456 1.00 0.00 H new ATOM 0 HA CYS A 10 8.864 1.939 13.693 1.00 0.00 H new ATOM 0 HB2 CYS A 10 9.722 -0.820 14.666 1.00 0.00 H new ATOM 0 HB3 CYS A 10 10.137 0.642 15.539 1.00 0.00 H new ATOM 0 HG CYS A 10 7.776 -0.440 16.709 1.00 0.00 H new ATOM 120 N PRO A 11 11.176 2.534 12.997 1.00 0.00 N ATOM 121 CA PRO A 11 12.536 2.963 12.563 1.00 0.00 C ATOM 122 C PRO A 11 13.595 2.713 13.641 1.00 0.00 C ATOM 123 O PRO A 11 14.748 2.470 13.348 1.00 0.00 O ATOM 124 CB PRO A 11 12.382 4.462 12.303 1.00 0.00 C ATOM 125 CG PRO A 11 11.224 4.895 13.142 1.00 0.00 C ATOM 126 CD PRO A 11 10.307 3.683 13.292 1.00 0.00 C ATOM 0 HA PRO A 11 12.876 2.404 11.691 1.00 0.00 H new ATOM 0 HB2 PRO A 11 13.288 5.003 12.576 1.00 0.00 H new ATOM 0 HB3 PRO A 11 12.198 4.660 11.247 1.00 0.00 H new ATOM 0 HG2 PRO A 11 11.563 5.246 14.117 1.00 0.00 H new ATOM 0 HG3 PRO A 11 10.695 5.724 12.672 1.00 0.00 H new ATOM 0 HD2 PRO A 11 9.891 3.620 14.298 1.00 0.00 H new ATOM 0 HD3 PRO A 11 9.465 3.733 12.602 1.00 0.00 H new ATOM 134 N ALA A 12 13.211 2.772 14.888 1.00 0.00 N ATOM 135 CA ALA A 12 14.196 2.540 15.981 1.00 0.00 C ATOM 136 C ALA A 12 14.380 1.036 16.192 1.00 0.00 C ATOM 137 O ALA A 12 15.292 0.601 16.867 1.00 0.00 O ATOM 138 CB ALA A 12 13.681 3.177 17.274 1.00 0.00 C ATOM 0 H ALA A 12 12.259 2.971 15.196 1.00 0.00 H new ATOM 0 HA ALA A 12 15.152 2.988 15.710 1.00 0.00 H new ATOM 0 HB1 ALA A 12 14.401 3.008 18.075 1.00 0.00 H new ATOM 0 HB2 ALA A 12 13.550 4.249 17.124 1.00 0.00 H new ATOM 0 HB3 ALA A 12 12.725 2.729 17.545 1.00 0.00 H new ATOM 144 N LEU A 13 13.521 0.237 15.620 1.00 0.00 N ATOM 145 CA LEU A 13 13.643 -1.238 15.795 1.00 0.00 C ATOM 146 C LEU A 13 13.974 -1.887 14.450 1.00 0.00 C ATOM 147 O LEU A 13 13.604 -1.390 13.404 1.00 0.00 O ATOM 148 CB LEU A 13 12.320 -1.800 16.321 1.00 0.00 C ATOM 149 CG LEU A 13 12.340 -1.804 17.850 1.00 0.00 C ATOM 150 CD1 LEU A 13 12.398 -0.366 18.365 1.00 0.00 C ATOM 151 CD2 LEU A 13 11.069 -2.480 18.372 1.00 0.00 C ATOM 0 H LEU A 13 12.740 0.542 15.039 1.00 0.00 H new ATOM 0 HA LEU A 13 14.439 -1.454 16.507 1.00 0.00 H new ATOM 0 HB2 LEU A 13 11.487 -1.197 15.959 1.00 0.00 H new ATOM 0 HB3 LEU A 13 12.168 -2.812 15.946 1.00 0.00 H new ATOM 0 HG LEU A 13 13.216 -2.350 18.200 1.00 0.00 H new ATOM 0 HD11 LEU A 13 12.412 -0.370 19.455 1.00 0.00 H new ATOM 0 HD12 LEU A 13 13.301 0.118 17.992 1.00 0.00 H new ATOM 0 HD13 LEU A 13 11.522 0.181 18.016 1.00 0.00 H new ATOM 0 HD21 LEU A 13 11.081 -2.484 19.462 1.00 0.00 H new ATOM 0 HD22 LEU A 13 10.195 -1.932 18.021 1.00 0.00 H new ATOM 0 HD23 LEU A 13 11.026 -3.506 18.006 1.00 0.00 H new ATOM 163 N PRO A 14 14.669 -2.991 14.482 1.00 0.00 N ATOM 164 CA PRO A 14 15.059 -3.737 13.251 1.00 0.00 C ATOM 165 C PRO A 14 13.911 -3.828 12.241 1.00 0.00 C ATOM 166 O PRO A 14 12.751 -3.756 12.598 1.00 0.00 O ATOM 167 CB PRO A 14 15.428 -5.131 13.765 1.00 0.00 C ATOM 168 CG PRO A 14 15.815 -4.940 15.195 1.00 0.00 C ATOM 169 CD PRO A 14 15.157 -3.649 15.702 1.00 0.00 C ATOM 0 HA PRO A 14 15.872 -3.241 12.721 1.00 0.00 H new ATOM 0 HB2 PRO A 14 14.587 -5.818 13.675 1.00 0.00 H new ATOM 0 HB3 PRO A 14 16.250 -5.557 13.189 1.00 0.00 H new ATOM 0 HG2 PRO A 14 15.492 -5.792 15.793 1.00 0.00 H new ATOM 0 HG3 PRO A 14 16.899 -4.877 15.290 1.00 0.00 H new ATOM 0 HD2 PRO A 14 14.341 -3.862 16.393 1.00 0.00 H new ATOM 0 HD3 PRO A 14 15.871 -3.021 16.235 1.00 0.00 H new ATOM 177 N PRO A 15 14.239 -3.985 10.988 1.00 0.00 N ATOM 178 CA PRO A 15 13.230 -4.117 9.899 1.00 0.00 C ATOM 179 C PRO A 15 12.224 -5.238 10.173 1.00 0.00 C ATOM 180 O PRO A 15 12.592 -6.369 10.423 1.00 0.00 O ATOM 181 CB PRO A 15 14.070 -4.443 8.663 1.00 0.00 C ATOM 182 CG PRO A 15 15.444 -3.942 8.973 1.00 0.00 C ATOM 183 CD PRO A 15 15.615 -4.056 10.474 1.00 0.00 C ATOM 0 HA PRO A 15 12.630 -3.213 9.792 1.00 0.00 H new ATOM 0 HB2 PRO A 15 14.078 -5.515 8.465 1.00 0.00 H new ATOM 0 HB3 PRO A 15 13.666 -3.958 7.774 1.00 0.00 H new ATOM 0 HG2 PRO A 15 16.198 -4.530 8.451 1.00 0.00 H new ATOM 0 HG3 PRO A 15 15.563 -2.909 8.646 1.00 0.00 H new ATOM 0 HD2 PRO A 15 16.098 -4.993 10.752 1.00 0.00 H new ATOM 0 HD3 PRO A 15 16.232 -3.249 10.869 1.00 0.00 H new ATOM 191 N GLY A 16 10.956 -4.933 10.130 1.00 0.00 N ATOM 192 CA GLY A 16 9.927 -5.985 10.371 1.00 0.00 C ATOM 193 C GLY A 16 9.093 -5.611 11.598 1.00 0.00 C ATOM 194 O GLY A 16 7.925 -5.929 11.687 1.00 0.00 O ATOM 0 H GLY A 16 10.588 -4.001 9.939 1.00 0.00 H new ATOM 0 HA2 GLY A 16 9.283 -6.086 9.497 1.00 0.00 H new ATOM 0 HA3 GLY A 16 10.408 -6.951 10.526 1.00 0.00 H new ATOM 198 N TRP A 17 9.686 -4.937 12.547 1.00 0.00 N ATOM 199 CA TRP A 17 8.926 -4.544 13.767 1.00 0.00 C ATOM 200 C TRP A 17 7.742 -3.662 13.367 1.00 0.00 C ATOM 201 O TRP A 17 7.853 -2.807 12.511 1.00 0.00 O ATOM 202 CB TRP A 17 9.846 -3.765 14.711 1.00 0.00 C ATOM 203 CG TRP A 17 10.591 -4.724 15.583 1.00 0.00 C ATOM 204 CD1 TRP A 17 11.848 -5.167 15.354 1.00 0.00 C ATOM 205 CD2 TRP A 17 10.149 -5.364 16.816 1.00 0.00 C ATOM 206 NE1 TRP A 17 12.207 -6.038 16.367 1.00 0.00 N ATOM 207 CE2 TRP A 17 11.194 -6.192 17.292 1.00 0.00 C ATOM 208 CE3 TRP A 17 8.957 -5.306 17.560 1.00 0.00 C ATOM 209 CZ2 TRP A 17 11.059 -6.936 18.465 1.00 0.00 C ATOM 210 CZ3 TRP A 17 8.819 -6.054 18.740 1.00 0.00 C ATOM 211 CH2 TRP A 17 9.868 -6.868 19.192 1.00 0.00 C ATOM 0 H TRP A 17 10.662 -4.642 12.529 1.00 0.00 H new ATOM 0 HA TRP A 17 8.559 -5.438 14.272 1.00 0.00 H new ATOM 0 HB2 TRP A 17 10.547 -3.160 14.136 1.00 0.00 H new ATOM 0 HB3 TRP A 17 9.260 -3.079 15.323 1.00 0.00 H new ATOM 0 HD1 TRP A 17 12.470 -4.887 14.517 1.00 0.00 H new ATOM 0 HE1 TRP A 17 13.110 -6.509 16.424 1.00 0.00 H new ATOM 0 HE3 TRP A 17 8.143 -4.682 17.222 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 11.870 -7.561 18.809 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 7.899 -6.002 19.303 1.00 0.00 H new ATOM 0 HH2 TRP A 17 9.755 -7.441 20.100 1.00 0.00 H new ATOM 222 N LYS A 18 6.608 -3.863 13.980 1.00 0.00 N ATOM 223 CA LYS A 18 5.412 -3.050 13.620 1.00 0.00 C ATOM 224 C LYS A 18 4.818 -2.429 14.886 1.00 0.00 C ATOM 225 O LYS A 18 4.982 -2.941 15.976 1.00 0.00 O ATOM 226 CB LYS A 18 4.367 -3.947 12.953 1.00 0.00 C ATOM 227 CG LYS A 18 4.899 -4.435 11.604 1.00 0.00 C ATOM 228 CD LYS A 18 3.871 -5.364 10.954 1.00 0.00 C ATOM 229 CE LYS A 18 4.420 -5.884 9.625 1.00 0.00 C ATOM 230 NZ LYS A 18 3.447 -6.841 9.025 1.00 0.00 N ATOM 0 H LYS A 18 6.458 -4.555 14.714 1.00 0.00 H new ATOM 0 HA LYS A 18 5.705 -2.259 12.930 1.00 0.00 H new ATOM 0 HB2 LYS A 18 4.139 -4.798 13.595 1.00 0.00 H new ATOM 0 HB3 LYS A 18 3.437 -3.397 12.811 1.00 0.00 H new ATOM 0 HG2 LYS A 18 5.100 -3.585 10.952 1.00 0.00 H new ATOM 0 HG3 LYS A 18 5.844 -4.961 11.743 1.00 0.00 H new ATOM 0 HD2 LYS A 18 3.648 -6.199 11.619 1.00 0.00 H new ATOM 0 HD3 LYS A 18 2.936 -4.829 10.789 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.597 -5.053 8.942 1.00 0.00 H new ATOM 0 HE3 LYS A 18 5.380 -6.376 9.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 3.820 -7.195 8.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 3.300 -7.639 9.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 2.541 -6.357 8.860 1.00 0.00 H new ATOM 244 N LYS A 19 4.128 -1.329 14.750 1.00 0.00 N ATOM 245 CA LYS A 19 3.524 -0.678 15.947 1.00 0.00 C ATOM 246 C LYS A 19 2.111 -0.200 15.609 1.00 0.00 C ATOM 247 O LYS A 19 1.826 0.186 14.493 1.00 0.00 O ATOM 248 CB LYS A 19 4.381 0.520 16.363 1.00 0.00 C ATOM 249 CG LYS A 19 4.617 1.424 15.152 1.00 0.00 C ATOM 250 CD LYS A 19 4.858 2.860 15.625 1.00 0.00 C ATOM 251 CE LYS A 19 6.223 2.949 16.310 1.00 0.00 C ATOM 252 NZ LYS A 19 6.413 4.321 16.860 1.00 0.00 N ATOM 0 H LYS A 19 3.957 -0.854 13.864 1.00 0.00 H new ATOM 0 HA LYS A 19 3.479 -1.395 16.767 1.00 0.00 H new ATOM 0 HB2 LYS A 19 3.883 1.079 17.156 1.00 0.00 H new ATOM 0 HB3 LYS A 19 5.334 0.177 16.765 1.00 0.00 H new ATOM 0 HG2 LYS A 19 5.475 1.069 14.582 1.00 0.00 H new ATOM 0 HG3 LYS A 19 3.755 1.389 14.486 1.00 0.00 H new ATOM 0 HD2 LYS A 19 4.819 3.545 14.778 1.00 0.00 H new ATOM 0 HD3 LYS A 19 4.072 3.163 16.316 1.00 0.00 H new ATOM 0 HE2 LYS A 19 6.289 2.212 17.110 1.00 0.00 H new ATOM 0 HE3 LYS A 19 7.015 2.718 15.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 7.429 4.508 16.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 6.011 5.018 16.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 5.932 4.396 17.779 1.00 0.00 H new ATOM 266 N GLU A 20 1.222 -0.224 16.565 1.00 0.00 N ATOM 267 CA GLU A 20 -0.170 0.234 16.300 1.00 0.00 C ATOM 268 C GLU A 20 -0.618 1.179 17.417 1.00 0.00 C ATOM 269 O GLU A 20 -0.151 1.096 18.536 1.00 0.00 O ATOM 270 CB GLU A 20 -1.105 -0.977 16.251 1.00 0.00 C ATOM 271 CG GLU A 20 -2.531 -0.510 15.957 1.00 0.00 C ATOM 272 CD GLU A 20 -3.459 -1.723 15.872 1.00 0.00 C ATOM 273 OE1 GLU A 20 -3.031 -2.799 16.256 1.00 0.00 O ATOM 274 OE2 GLU A 20 -4.582 -1.555 15.426 1.00 0.00 O ATOM 0 H GLU A 20 1.401 -0.541 17.518 1.00 0.00 H new ATOM 0 HA GLU A 20 -0.204 0.758 15.345 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -0.774 -1.674 15.482 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -1.075 -1.512 17.200 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -2.872 0.167 16.740 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -2.557 0.047 15.020 1.00 0.00 H new ATOM 281 N GLU A 21 -1.517 2.077 17.124 1.00 0.00 N ATOM 282 CA GLU A 21 -1.987 3.030 18.168 1.00 0.00 C ATOM 283 C GLU A 21 -3.516 3.011 18.229 1.00 0.00 C ATOM 284 O GLU A 21 -4.188 3.273 17.251 1.00 0.00 O ATOM 285 CB GLU A 21 -1.508 4.441 17.822 1.00 0.00 C ATOM 286 CG GLU A 21 -1.978 5.419 18.901 1.00 0.00 C ATOM 287 CD GLU A 21 -1.399 6.807 18.620 1.00 0.00 C ATOM 288 OE1 GLU A 21 -1.451 7.228 17.476 1.00 0.00 O ATOM 289 OE2 GLU A 21 -0.915 7.425 19.553 1.00 0.00 O ATOM 0 H GLU A 21 -1.947 2.192 16.206 1.00 0.00 H new ATOM 0 HA GLU A 21 -1.583 2.735 19.136 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -0.421 4.459 17.748 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -1.899 4.741 16.850 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -3.067 5.464 18.916 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -1.659 5.073 19.884 1.00 0.00 H new ATOM 296 N VAL A 22 -4.070 2.701 19.369 1.00 0.00 N ATOM 297 CA VAL A 22 -5.554 2.676 19.493 1.00 0.00 C ATOM 298 C VAL A 22 -5.988 3.629 20.608 1.00 0.00 C ATOM 299 O VAL A 22 -5.421 3.642 21.683 1.00 0.00 O ATOM 300 CB VAL A 22 -6.013 1.255 19.829 1.00 0.00 C ATOM 301 CG1 VAL A 22 -7.499 1.272 20.196 1.00 0.00 C ATOM 302 CG2 VAL A 22 -5.801 0.351 18.613 1.00 0.00 C ATOM 0 H VAL A 22 -3.559 2.464 20.219 1.00 0.00 H new ATOM 0 HA VAL A 22 -6.003 2.990 18.551 1.00 0.00 H new ATOM 0 HB VAL A 22 -5.434 0.876 20.671 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -7.826 0.260 20.435 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -7.653 1.917 21.061 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -8.078 1.651 19.353 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -6.127 -0.661 18.851 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -6.381 0.731 17.772 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -4.744 0.339 18.349 1.00 0.00 H new ATOM 312 N ILE A 23 -6.990 4.429 20.362 1.00 0.00 N ATOM 313 CA ILE A 23 -7.455 5.383 21.408 1.00 0.00 C ATOM 314 C ILE A 23 -8.717 4.834 22.075 1.00 0.00 C ATOM 315 O ILE A 23 -9.547 4.214 21.440 1.00 0.00 O ATOM 316 CB ILE A 23 -7.765 6.735 20.763 1.00 0.00 C ATOM 317 CG1 ILE A 23 -6.502 7.282 20.095 1.00 0.00 C ATOM 318 CG2 ILE A 23 -8.240 7.716 21.836 1.00 0.00 C ATOM 319 CD1 ILE A 23 -6.858 8.513 19.259 1.00 0.00 C ATOM 0 H ILE A 23 -7.506 4.463 19.483 1.00 0.00 H new ATOM 0 HA ILE A 23 -6.674 5.509 22.158 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.547 6.610 20.015 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.763 7.545 20.851 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.052 6.517 19.462 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -8.461 8.679 21.376 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -9.140 7.327 22.312 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -7.458 7.842 22.585 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.958 8.902 18.783 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.582 8.236 18.493 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -7.288 9.279 19.904 1.00 0.00 H new ATOM 331 N ARG A 24 -8.869 5.055 23.351 1.00 0.00 N ATOM 332 CA ARG A 24 -10.072 4.536 24.060 1.00 0.00 C ATOM 333 C ARG A 24 -11.333 5.107 23.411 1.00 0.00 C ATOM 334 O ARG A 24 -11.581 6.296 23.452 1.00 0.00 O ATOM 335 CB ARG A 24 -10.019 4.958 25.530 1.00 0.00 C ATOM 336 CG ARG A 24 -8.694 4.505 26.145 1.00 0.00 C ATOM 337 CD ARG A 24 -8.797 4.542 27.671 1.00 0.00 C ATOM 338 NE ARG A 24 -7.490 4.151 28.267 1.00 0.00 N ATOM 339 CZ ARG A 24 -7.390 3.969 29.556 1.00 0.00 C ATOM 340 NH1 ARG A 24 -8.437 4.122 30.319 1.00 0.00 N ATOM 341 NH2 ARG A 24 -6.243 3.634 30.080 1.00 0.00 N ATOM 0 H ARG A 24 -8.212 5.573 23.934 1.00 0.00 H new ATOM 0 HA ARG A 24 -10.091 3.448 23.994 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -10.119 6.040 25.612 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -10.854 4.519 26.076 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -8.453 3.496 25.811 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -7.885 5.154 25.809 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -9.075 5.542 28.003 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -9.580 3.864 28.010 1.00 0.00 H new ATOM 0 HE ARG A 24 -6.673 4.025 27.669 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -9.333 4.384 29.909 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -8.359 3.980 31.326 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -5.425 3.514 29.483 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -6.164 3.492 31.087 1.00 0.00 H new ATOM 355 N LYS A 25 -12.134 4.269 22.811 1.00 0.00 N ATOM 356 CA LYS A 25 -13.370 4.766 22.146 1.00 0.00 C ATOM 357 C LYS A 25 -14.419 5.106 23.208 1.00 0.00 C ATOM 358 O LYS A 25 -15.504 5.559 22.900 1.00 0.00 O ATOM 359 CB LYS A 25 -13.921 3.684 21.214 1.00 0.00 C ATOM 360 CG LYS A 25 -13.979 2.349 21.962 1.00 0.00 C ATOM 361 CD LYS A 25 -12.905 1.408 21.412 1.00 0.00 C ATOM 362 CE LYS A 25 -13.400 0.771 20.113 1.00 0.00 C ATOM 363 NZ LYS A 25 -12.239 0.222 19.355 1.00 0.00 N ATOM 0 H LYS A 25 -11.985 3.262 22.753 1.00 0.00 H new ATOM 0 HA LYS A 25 -13.135 5.659 21.566 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -14.916 3.961 20.865 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -13.288 3.592 20.332 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -13.824 2.511 23.029 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -14.965 1.899 21.848 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.982 1.959 21.230 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.675 0.634 22.144 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -14.113 -0.024 20.334 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.925 1.511 19.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.575 -0.211 18.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.575 0.991 19.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -11.757 -0.497 19.931 1.00 0.00 H new ATOM 377 N SER A 26 -14.104 4.891 24.456 1.00 0.00 N ATOM 378 CA SER A 26 -15.086 5.190 25.534 1.00 0.00 C ATOM 379 C SER A 26 -15.077 6.691 25.831 1.00 0.00 C ATOM 380 O SER A 26 -14.602 7.487 25.045 1.00 0.00 O ATOM 381 CB SER A 26 -14.707 4.419 26.799 1.00 0.00 C ATOM 382 OG SER A 26 -15.849 4.299 27.636 1.00 0.00 O ATOM 0 H SER A 26 -13.209 4.521 24.775 1.00 0.00 H new ATOM 0 HA SER A 26 -16.082 4.889 25.210 1.00 0.00 H new ATOM 0 HB2 SER A 26 -14.329 3.431 26.537 1.00 0.00 H new ATOM 0 HB3 SER A 26 -13.907 4.937 27.328 1.00 0.00 H new ATOM 0 HG SER A 26 -15.610 3.804 28.447 1.00 0.00 H new ATOM 388 N GLY A 27 -15.601 7.086 26.960 1.00 0.00 N ATOM 389 CA GLY A 27 -15.721 8.541 27.258 1.00 0.00 C ATOM 390 C GLY A 27 -14.808 9.332 26.321 1.00 0.00 C ATOM 391 O GLY A 27 -13.689 8.941 26.055 1.00 0.00 O ATOM 0 H GLY A 27 -15.951 6.464 27.688 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -16.755 8.864 27.134 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -15.449 8.734 28.296 1.00 0.00 H new ATOM 395 N LEU A 28 -15.274 10.442 25.818 1.00 0.00 N ATOM 396 CA LEU A 28 -14.434 11.252 24.893 1.00 0.00 C ATOM 397 C LEU A 28 -13.199 11.761 25.640 1.00 0.00 C ATOM 398 O LEU A 28 -12.114 11.822 25.095 1.00 0.00 O ATOM 399 CB LEU A 28 -15.245 12.443 24.378 1.00 0.00 C ATOM 400 CG LEU A 28 -14.381 13.278 23.431 1.00 0.00 C ATOM 401 CD1 LEU A 28 -13.914 12.407 22.264 1.00 0.00 C ATOM 402 CD2 LEU A 28 -15.204 14.451 22.893 1.00 0.00 C ATOM 0 H LEU A 28 -16.201 10.823 26.008 1.00 0.00 H new ATOM 0 HA LEU A 28 -14.121 10.634 24.051 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -16.137 12.092 23.859 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -15.583 13.055 25.214 1.00 0.00 H new ATOM 0 HG LEU A 28 -13.513 13.658 23.970 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -13.298 13.002 21.589 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -13.329 11.570 22.646 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -14.781 12.027 21.724 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -14.590 15.047 22.218 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -16.071 14.070 22.354 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -15.538 15.073 23.724 1.00 0.00 H new ATOM 414 N SER A 29 -13.354 12.127 26.883 1.00 0.00 N ATOM 415 CA SER A 29 -12.185 12.611 27.669 1.00 0.00 C ATOM 416 C SER A 29 -11.083 11.549 27.649 1.00 0.00 C ATOM 417 O SER A 29 -10.101 11.647 28.359 1.00 0.00 O ATOM 418 CB SER A 29 -12.615 12.873 29.113 1.00 0.00 C ATOM 419 OG SER A 29 -13.861 13.556 29.115 1.00 0.00 O ATOM 0 H SER A 29 -14.240 12.112 27.388 1.00 0.00 H new ATOM 0 HA SER A 29 -11.808 13.534 27.229 1.00 0.00 H new ATOM 0 HB2 SER A 29 -12.702 11.931 29.655 1.00 0.00 H new ATOM 0 HB3 SER A 29 -11.860 13.468 29.627 1.00 0.00 H new ATOM 0 HG SER A 29 -14.140 13.724 30.039 1.00 0.00 H new ATOM 425 N ALA A 30 -11.237 10.535 26.843 1.00 0.00 N ATOM 426 CA ALA A 30 -10.210 9.457 26.797 1.00 0.00 C ATOM 427 C ALA A 30 -8.819 10.082 26.671 1.00 0.00 C ATOM 428 O ALA A 30 -8.099 10.218 27.641 1.00 0.00 O ATOM 429 CB ALA A 30 -10.473 8.552 25.591 1.00 0.00 C ATOM 0 H ALA A 30 -12.030 10.406 26.214 1.00 0.00 H new ATOM 0 HA ALA A 30 -10.262 8.867 27.712 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.722 7.763 25.557 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -11.464 8.106 25.680 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.421 9.142 24.676 1.00 0.00 H new ATOM 435 N GLY A 31 -8.436 10.463 25.484 1.00 0.00 N ATOM 436 CA GLY A 31 -7.094 11.086 25.298 1.00 0.00 C ATOM 437 C GLY A 31 -6.006 10.053 25.594 1.00 0.00 C ATOM 438 O GLY A 31 -4.860 10.222 25.226 1.00 0.00 O ATOM 0 H GLY A 31 -8.993 10.370 24.635 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -6.991 11.456 24.278 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.985 11.945 25.961 1.00 0.00 H new ATOM 442 N LYS A 32 -6.353 8.985 26.258 1.00 0.00 N ATOM 443 CA LYS A 32 -5.338 7.941 26.573 1.00 0.00 C ATOM 444 C LYS A 32 -5.140 7.037 25.355 1.00 0.00 C ATOM 445 O LYS A 32 -6.087 6.543 24.776 1.00 0.00 O ATOM 446 CB LYS A 32 -5.820 7.103 27.759 1.00 0.00 C ATOM 447 CG LYS A 32 -5.803 7.956 29.029 1.00 0.00 C ATOM 448 CD LYS A 32 -6.251 7.108 30.220 1.00 0.00 C ATOM 449 CE LYS A 32 -6.219 7.958 31.492 1.00 0.00 C ATOM 450 NZ LYS A 32 -6.640 7.127 32.656 1.00 0.00 N ATOM 0 H LYS A 32 -7.295 8.790 26.596 1.00 0.00 H new ATOM 0 HA LYS A 32 -4.392 8.419 26.827 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.828 6.733 27.570 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -5.179 6.231 27.886 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -4.801 8.347 29.204 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -6.464 8.815 28.912 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -7.258 6.726 30.050 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -5.597 6.243 30.331 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -5.215 8.350 31.655 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -6.882 8.816 31.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -6.618 7.704 33.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -7.606 6.774 32.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -5.990 6.322 32.761 1.00 0.00 H new ATOM 464 N SER A 33 -3.916 6.815 24.962 1.00 0.00 N ATOM 465 CA SER A 33 -3.660 5.961 23.767 1.00 0.00 C ATOM 466 C SER A 33 -2.746 4.797 24.158 1.00 0.00 C ATOM 467 O SER A 33 -1.896 4.925 25.017 1.00 0.00 O ATOM 468 CB SER A 33 -2.986 6.796 22.679 1.00 0.00 C ATOM 469 OG SER A 33 -1.771 7.333 23.185 1.00 0.00 O ATOM 0 H SER A 33 -3.082 7.188 25.416 1.00 0.00 H new ATOM 0 HA SER A 33 -4.605 5.570 23.391 1.00 0.00 H new ATOM 0 HB2 SER A 33 -2.787 6.180 21.802 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.648 7.601 22.360 1.00 0.00 H new ATOM 0 HG SER A 33 -1.335 7.868 22.489 1.00 0.00 H new ATOM 475 N ASP A 34 -2.913 3.664 23.534 1.00 0.00 N ATOM 476 CA ASP A 34 -2.045 2.498 23.860 1.00 0.00 C ATOM 477 C ASP A 34 -1.256 2.086 22.615 1.00 0.00 C ATOM 478 O ASP A 34 -1.795 1.997 21.529 1.00 0.00 O ATOM 479 CB ASP A 34 -2.915 1.327 24.323 1.00 0.00 C ATOM 480 CG ASP A 34 -3.531 1.655 25.684 1.00 0.00 C ATOM 481 OD1 ASP A 34 -3.051 2.579 26.322 1.00 0.00 O ATOM 482 OD2 ASP A 34 -4.470 0.977 26.067 1.00 0.00 O ATOM 0 H ASP A 34 -3.613 3.495 22.812 1.00 0.00 H new ATOM 0 HA ASP A 34 -1.352 2.772 24.656 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -3.701 1.134 23.593 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -2.315 0.420 24.393 1.00 0.00 H new ATOM 487 N VAL A 35 0.016 1.835 22.762 1.00 0.00 N ATOM 488 CA VAL A 35 0.835 1.424 21.587 1.00 0.00 C ATOM 489 C VAL A 35 1.228 -0.047 21.730 1.00 0.00 C ATOM 490 O VAL A 35 1.717 -0.473 22.757 1.00 0.00 O ATOM 491 CB VAL A 35 2.096 2.285 21.520 1.00 0.00 C ATOM 492 CG1 VAL A 35 2.931 1.874 20.305 1.00 0.00 C ATOM 493 CG2 VAL A 35 1.702 3.757 21.389 1.00 0.00 C ATOM 0 H VAL A 35 0.523 1.897 23.645 1.00 0.00 H new ATOM 0 HA VAL A 35 0.255 1.558 20.674 1.00 0.00 H new ATOM 0 HB VAL A 35 2.680 2.143 22.429 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.830 2.488 20.257 1.00 0.00 H new ATOM 0 HG12 VAL A 35 3.212 0.825 20.395 1.00 0.00 H new ATOM 0 HG13 VAL A 35 2.346 2.016 19.396 1.00 0.00 H new ATOM 0 HG21 VAL A 35 2.601 4.371 21.341 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.118 3.898 20.480 1.00 0.00 H new ATOM 0 HG23 VAL A 35 1.106 4.052 22.253 1.00 0.00 H new ATOM 503 N TYR A 36 1.020 -0.828 20.705 1.00 0.00 N ATOM 504 CA TYR A 36 1.391 -2.269 20.778 1.00 0.00 C ATOM 505 C TYR A 36 2.485 -2.566 19.750 1.00 0.00 C ATOM 506 O TYR A 36 2.505 -2.008 18.671 1.00 0.00 O ATOM 507 CB TYR A 36 0.162 -3.128 20.476 1.00 0.00 C ATOM 508 CG TYR A 36 -0.963 -2.744 21.408 1.00 0.00 C ATOM 509 CD1 TYR A 36 -0.981 -3.229 22.721 1.00 0.00 C ATOM 510 CD2 TYR A 36 -1.987 -1.902 20.958 1.00 0.00 C ATOM 511 CE1 TYR A 36 -2.024 -2.873 23.584 1.00 0.00 C ATOM 512 CE2 TYR A 36 -3.029 -1.546 21.821 1.00 0.00 C ATOM 513 CZ TYR A 36 -3.048 -2.031 23.135 1.00 0.00 C ATOM 514 OH TYR A 36 -4.075 -1.679 23.986 1.00 0.00 O ATOM 0 H TYR A 36 0.609 -0.530 19.820 1.00 0.00 H new ATOM 0 HA TYR A 36 1.759 -2.499 21.778 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -0.146 -2.989 19.440 1.00 0.00 H new ATOM 0 HB3 TYR A 36 0.404 -4.184 20.597 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -0.190 -3.878 23.068 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -1.973 -1.527 19.945 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -2.039 -3.248 24.597 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -3.819 -0.897 21.474 1.00 0.00 H new ATOM 0 HH TYR A 36 -4.701 -1.089 23.517 1.00 0.00 H new ATOM 524 N TYR A 37 3.396 -3.443 20.075 1.00 0.00 N ATOM 525 CA TYR A 37 4.497 -3.762 19.123 1.00 0.00 C ATOM 526 C TYR A 37 4.411 -5.233 18.718 1.00 0.00 C ATOM 527 O TYR A 37 4.314 -6.113 19.551 1.00 0.00 O ATOM 528 CB TYR A 37 5.846 -3.494 19.796 1.00 0.00 C ATOM 529 CG TYR A 37 5.917 -2.048 20.225 1.00 0.00 C ATOM 530 CD1 TYR A 37 6.270 -1.060 19.298 1.00 0.00 C ATOM 531 CD2 TYR A 37 5.630 -1.696 21.549 1.00 0.00 C ATOM 532 CE1 TYR A 37 6.336 0.281 19.697 1.00 0.00 C ATOM 533 CE2 TYR A 37 5.696 -0.356 21.948 1.00 0.00 C ATOM 534 CZ TYR A 37 6.050 0.632 21.021 1.00 0.00 C ATOM 535 OH TYR A 37 6.115 1.954 21.413 1.00 0.00 O ATOM 0 H TYR A 37 3.425 -3.952 20.958 1.00 0.00 H new ATOM 0 HA TYR A 37 4.403 -3.136 18.235 1.00 0.00 H new ATOM 0 HB2 TYR A 37 5.969 -4.147 20.660 1.00 0.00 H new ATOM 0 HB3 TYR A 37 6.660 -3.720 19.107 1.00 0.00 H new ATOM 0 HD1 TYR A 37 6.491 -1.332 18.276 1.00 0.00 H new ATOM 0 HD2 TYR A 37 5.357 -2.459 22.263 1.00 0.00 H new ATOM 0 HE1 TYR A 37 6.608 1.044 18.983 1.00 0.00 H new ATOM 0 HE2 TYR A 37 5.474 -0.084 22.969 1.00 0.00 H new ATOM 0 HH TYR A 37 7.053 2.227 21.490 1.00 0.00 H new ATOM 545 N PHE A 38 4.447 -5.511 17.443 1.00 0.00 N ATOM 546 CA PHE A 38 4.379 -6.927 16.986 1.00 0.00 C ATOM 547 C PHE A 38 5.730 -7.339 16.396 1.00 0.00 C ATOM 548 O PHE A 38 6.277 -6.666 15.545 1.00 0.00 O ATOM 549 CB PHE A 38 3.293 -7.068 15.918 1.00 0.00 C ATOM 550 CG PHE A 38 1.947 -6.749 16.525 1.00 0.00 C ATOM 551 CD1 PHE A 38 1.184 -7.767 17.109 1.00 0.00 C ATOM 552 CD2 PHE A 38 1.461 -5.436 16.502 1.00 0.00 C ATOM 553 CE1 PHE A 38 -0.064 -7.472 17.671 1.00 0.00 C ATOM 554 CE2 PHE A 38 0.213 -5.141 17.064 1.00 0.00 C ATOM 555 CZ PHE A 38 -0.549 -6.159 17.649 1.00 0.00 C ATOM 0 H PHE A 38 4.521 -4.818 16.698 1.00 0.00 H new ATOM 0 HA PHE A 38 4.141 -7.570 17.833 1.00 0.00 H new ATOM 0 HB2 PHE A 38 3.497 -6.395 15.085 1.00 0.00 H new ATOM 0 HB3 PHE A 38 3.292 -8.081 15.516 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.558 -8.780 17.126 1.00 0.00 H new ATOM 0 HD2 PHE A 38 2.049 -4.651 16.051 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -0.653 -8.258 18.122 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -0.162 -4.128 17.046 1.00 0.00 H new ATOM 0 HZ PHE A 38 -1.511 -5.931 18.083 1.00 0.00 H new ATOM 565 N SER A 39 6.271 -8.440 16.841 1.00 0.00 N ATOM 566 CA SER A 39 7.588 -8.889 16.309 1.00 0.00 C ATOM 567 C SER A 39 7.398 -10.174 15.499 1.00 0.00 C ATOM 568 O SER A 39 6.357 -10.798 15.546 1.00 0.00 O ATOM 569 CB SER A 39 8.543 -9.157 17.472 1.00 0.00 C ATOM 570 OG SER A 39 9.030 -10.490 17.384 1.00 0.00 O ATOM 0 H SER A 39 5.858 -9.047 17.549 1.00 0.00 H new ATOM 0 HA SER A 39 8.005 -8.112 15.668 1.00 0.00 H new ATOM 0 HB2 SER A 39 9.374 -8.452 17.445 1.00 0.00 H new ATOM 0 HB3 SER A 39 8.029 -9.008 18.421 1.00 0.00 H new ATOM 0 HG SER A 39 9.656 -10.659 18.119 1.00 0.00 H new ATOM 576 N PRO A 40 8.403 -10.562 14.764 1.00 0.00 N ATOM 577 CA PRO A 40 8.370 -11.803 13.939 1.00 0.00 C ATOM 578 C PRO A 40 8.064 -13.047 14.778 1.00 0.00 C ATOM 579 O PRO A 40 7.640 -14.064 14.264 1.00 0.00 O ATOM 580 CB PRO A 40 9.780 -11.885 13.352 1.00 0.00 C ATOM 581 CG PRO A 40 10.612 -10.969 14.187 1.00 0.00 C ATOM 582 CD PRO A 40 9.687 -9.853 14.639 1.00 0.00 C ATOM 0 HA PRO A 40 7.586 -11.768 13.183 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.162 -12.905 13.389 1.00 0.00 H new ATOM 0 HB3 PRO A 40 9.788 -11.579 12.306 1.00 0.00 H new ATOM 0 HG2 PRO A 40 11.033 -11.497 15.043 1.00 0.00 H new ATOM 0 HG3 PRO A 40 11.450 -10.572 13.614 1.00 0.00 H new ATOM 0 HD2 PRO A 40 10.006 -9.414 15.584 1.00 0.00 H new ATOM 0 HD3 PRO A 40 9.638 -9.042 13.912 1.00 0.00 H new ATOM 590 N SER A 41 8.276 -12.975 16.063 1.00 0.00 N ATOM 591 CA SER A 41 7.978 -14.146 16.934 1.00 0.00 C ATOM 592 C SER A 41 6.463 -14.296 17.084 1.00 0.00 C ATOM 593 O SER A 41 5.968 -15.333 17.478 1.00 0.00 O ATOM 594 CB SER A 41 8.608 -13.931 18.311 1.00 0.00 C ATOM 595 OG SER A 41 8.022 -12.789 18.922 1.00 0.00 O ATOM 0 H SER A 41 8.643 -12.156 16.547 1.00 0.00 H new ATOM 0 HA SER A 41 8.390 -15.049 16.483 1.00 0.00 H new ATOM 0 HB2 SER A 41 8.454 -14.811 18.935 1.00 0.00 H new ATOM 0 HB3 SER A 41 9.685 -13.793 18.214 1.00 0.00 H new ATOM 0 HG SER A 41 8.294 -11.982 18.436 1.00 0.00 H new ATOM 601 N GLY A 42 5.721 -13.268 16.773 1.00 0.00 N ATOM 602 CA GLY A 42 4.237 -13.360 16.878 1.00 0.00 C ATOM 603 C GLY A 42 3.806 -13.044 18.311 1.00 0.00 C ATOM 604 O GLY A 42 2.632 -13.013 18.624 1.00 0.00 O ATOM 0 H GLY A 42 6.078 -12.369 16.451 1.00 0.00 H new ATOM 0 HA2 GLY A 42 3.769 -12.662 16.184 1.00 0.00 H new ATOM 0 HA3 GLY A 42 3.903 -14.359 16.599 1.00 0.00 H new ATOM 608 N LYS A 43 4.746 -12.807 19.185 1.00 0.00 N ATOM 609 CA LYS A 43 4.389 -12.496 20.597 1.00 0.00 C ATOM 610 C LYS A 43 3.955 -11.033 20.704 1.00 0.00 C ATOM 611 O LYS A 43 4.511 -10.163 20.065 1.00 0.00 O ATOM 612 CB LYS A 43 5.606 -12.733 21.495 1.00 0.00 C ATOM 613 CG LYS A 43 5.204 -12.546 22.960 1.00 0.00 C ATOM 614 CD LYS A 43 6.397 -12.870 23.862 1.00 0.00 C ATOM 615 CE LYS A 43 5.987 -12.715 25.327 1.00 0.00 C ATOM 616 NZ LYS A 43 7.149 -13.031 26.204 1.00 0.00 N ATOM 0 H LYS A 43 5.745 -12.815 18.982 1.00 0.00 H new ATOM 0 HA LYS A 43 3.571 -13.142 20.915 1.00 0.00 H new ATOM 0 HB2 LYS A 43 5.996 -13.739 21.339 1.00 0.00 H new ATOM 0 HB3 LYS A 43 6.404 -12.038 21.234 1.00 0.00 H new ATOM 0 HG2 LYS A 43 4.874 -11.521 23.130 1.00 0.00 H new ATOM 0 HG3 LYS A 43 4.363 -13.196 23.203 1.00 0.00 H new ATOM 0 HD2 LYS A 43 6.741 -13.887 23.676 1.00 0.00 H new ATOM 0 HD3 LYS A 43 7.230 -12.205 23.634 1.00 0.00 H new ATOM 0 HE2 LYS A 43 5.643 -11.698 25.514 1.00 0.00 H new ATOM 0 HE3 LYS A 43 5.154 -13.380 25.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 6.871 -12.926 27.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 7.458 -14.009 26.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 7.931 -12.379 25.992 1.00 0.00 H new ATOM 630 N LYS A 44 2.962 -10.755 21.505 1.00 0.00 N ATOM 631 CA LYS A 44 2.480 -9.351 21.635 1.00 0.00 C ATOM 632 C LYS A 44 3.267 -8.642 22.739 1.00 0.00 C ATOM 633 O LYS A 44 3.528 -9.201 23.785 1.00 0.00 O ATOM 634 CB LYS A 44 0.991 -9.355 21.991 1.00 0.00 C ATOM 635 CG LYS A 44 0.480 -7.916 22.066 1.00 0.00 C ATOM 636 CD LYS A 44 -1.026 -7.921 22.337 1.00 0.00 C ATOM 637 CE LYS A 44 -1.539 -6.482 22.398 1.00 0.00 C ATOM 638 NZ LYS A 44 -3.019 -6.490 22.578 1.00 0.00 N ATOM 0 H LYS A 44 2.464 -11.439 22.074 1.00 0.00 H new ATOM 0 HA LYS A 44 2.627 -8.827 20.691 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.429 -9.913 21.242 1.00 0.00 H new ATOM 0 HB3 LYS A 44 0.836 -9.857 22.946 1.00 0.00 H new ATOM 0 HG2 LYS A 44 1.000 -7.375 22.856 1.00 0.00 H new ATOM 0 HG3 LYS A 44 0.690 -7.395 21.132 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -1.546 -8.470 21.552 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -1.235 -8.433 23.276 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -1.064 -5.950 23.222 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -1.276 -5.952 21.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -3.369 -5.512 22.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -3.463 -6.983 21.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -3.258 -6.981 23.463 1.00 0.00 H new ATOM 652 N PHE A 45 3.645 -7.414 22.514 1.00 0.00 N ATOM 653 CA PHE A 45 4.421 -6.673 23.548 1.00 0.00 C ATOM 654 C PHE A 45 3.728 -5.343 23.851 1.00 0.00 C ATOM 655 O PHE A 45 3.001 -4.811 23.036 1.00 0.00 O ATOM 656 CB PHE A 45 5.835 -6.404 23.029 1.00 0.00 C ATOM 657 CG PHE A 45 6.524 -7.716 22.740 1.00 0.00 C ATOM 658 CD1 PHE A 45 7.254 -8.360 23.746 1.00 0.00 C ATOM 659 CD2 PHE A 45 6.431 -8.288 21.465 1.00 0.00 C ATOM 660 CE1 PHE A 45 7.893 -9.576 23.476 1.00 0.00 C ATOM 661 CE2 PHE A 45 7.070 -9.504 21.197 1.00 0.00 C ATOM 662 CZ PHE A 45 7.801 -10.148 22.203 1.00 0.00 C ATOM 0 H PHE A 45 3.450 -6.892 21.660 1.00 0.00 H new ATOM 0 HA PHE A 45 4.475 -7.270 24.458 1.00 0.00 H new ATOM 0 HB2 PHE A 45 5.792 -5.797 22.125 1.00 0.00 H new ATOM 0 HB3 PHE A 45 6.403 -5.838 23.767 1.00 0.00 H new ATOM 0 HD1 PHE A 45 7.324 -7.919 24.729 1.00 0.00 H new ATOM 0 HD2 PHE A 45 5.867 -7.791 20.689 1.00 0.00 H new ATOM 0 HE1 PHE A 45 8.457 -10.073 24.251 1.00 0.00 H new ATOM 0 HE2 PHE A 45 6.999 -9.946 20.214 1.00 0.00 H new ATOM 0 HZ PHE A 45 8.294 -11.086 21.996 1.00 0.00 H new ATOM 672 N ARG A 46 3.947 -4.802 25.018 1.00 0.00 N ATOM 673 CA ARG A 46 3.319 -3.495 25.363 1.00 0.00 C ATOM 674 C ARG A 46 4.081 -2.856 26.526 1.00 0.00 C ATOM 675 O ARG A 46 3.655 -2.907 27.664 1.00 0.00 O ATOM 676 CB ARG A 46 1.862 -3.720 25.771 1.00 0.00 C ATOM 677 CG ARG A 46 1.705 -5.128 26.350 1.00 0.00 C ATOM 678 CD ARG A 46 0.471 -5.174 27.253 1.00 0.00 C ATOM 679 NE ARG A 46 0.836 -4.702 28.618 1.00 0.00 N ATOM 680 CZ ARG A 46 -0.101 -4.387 29.471 1.00 0.00 C ATOM 681 NH1 ARG A 46 -1.356 -4.489 29.128 1.00 0.00 N ATOM 682 NH2 ARG A 46 0.217 -3.972 30.666 1.00 0.00 N ATOM 0 H ARG A 46 4.533 -5.208 25.747 1.00 0.00 H new ATOM 0 HA ARG A 46 3.355 -2.834 24.497 1.00 0.00 H new ATOM 0 HB2 ARG A 46 1.561 -2.976 26.509 1.00 0.00 H new ATOM 0 HB3 ARG A 46 1.208 -3.595 24.908 1.00 0.00 H new ATOM 0 HG2 ARG A 46 1.606 -5.855 25.544 1.00 0.00 H new ATOM 0 HG3 ARG A 46 2.595 -5.400 26.918 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -0.319 -4.547 26.839 1.00 0.00 H new ATOM 0 HD3 ARG A 46 0.080 -6.190 27.301 1.00 0.00 H new ATOM 0 HE ARG A 46 1.817 -4.625 28.886 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -1.605 -4.815 28.194 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -2.088 -4.243 29.794 1.00 0.00 H new ATOM 0 HH21 ARG A 46 1.198 -3.893 30.934 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -0.515 -3.726 31.332 1.00 0.00 H new ATOM 696 N SER A 47 5.205 -2.253 26.251 1.00 0.00 N ATOM 697 CA SER A 47 6.002 -1.626 27.343 1.00 0.00 C ATOM 698 C SER A 47 7.456 -1.477 26.892 1.00 0.00 C ATOM 699 O SER A 47 8.133 -2.447 26.616 1.00 0.00 O ATOM 700 CB SER A 47 5.943 -2.511 28.589 1.00 0.00 C ATOM 701 OG SER A 47 4.978 -1.988 29.491 1.00 0.00 O ATOM 0 H SER A 47 5.606 -2.167 25.317 1.00 0.00 H new ATOM 0 HA SER A 47 5.591 -0.643 27.575 1.00 0.00 H new ATOM 0 HB2 SER A 47 5.682 -3.532 28.312 1.00 0.00 H new ATOM 0 HB3 SER A 47 6.921 -2.550 29.068 1.00 0.00 H new ATOM 0 HG SER A 47 4.157 -1.771 29.002 1.00 0.00 H new ATOM 707 N LYS A 48 7.941 -0.268 26.814 1.00 0.00 N ATOM 708 CA LYS A 48 9.356 -0.057 26.397 1.00 0.00 C ATOM 709 C LYS A 48 10.254 -1.076 27.102 1.00 0.00 C ATOM 710 O LYS A 48 10.994 -1.805 26.471 1.00 0.00 O ATOM 711 CB LYS A 48 9.794 1.358 26.778 1.00 0.00 C ATOM 712 CG LYS A 48 11.322 1.418 26.853 1.00 0.00 C ATOM 713 CD LYS A 48 11.778 2.877 26.821 1.00 0.00 C ATOM 714 CE LYS A 48 13.254 2.961 27.210 1.00 0.00 C ATOM 715 NZ LYS A 48 13.941 1.696 26.824 1.00 0.00 N ATOM 0 H LYS A 48 7.418 0.583 27.021 1.00 0.00 H new ATOM 0 HA LYS A 48 9.439 -0.185 25.318 1.00 0.00 H new ATOM 0 HB2 LYS A 48 9.427 2.074 26.042 1.00 0.00 H new ATOM 0 HB3 LYS A 48 9.361 1.638 27.738 1.00 0.00 H new ATOM 0 HG2 LYS A 48 11.671 0.937 27.767 1.00 0.00 H new ATOM 0 HG3 LYS A 48 11.759 0.871 26.018 1.00 0.00 H new ATOM 0 HD2 LYS A 48 11.630 3.293 25.825 1.00 0.00 H new ATOM 0 HD3 LYS A 48 11.176 3.472 27.508 1.00 0.00 H new ATOM 0 HE2 LYS A 48 13.725 3.809 26.713 1.00 0.00 H new ATOM 0 HE3 LYS A 48 13.350 3.127 28.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 14.971 1.834 26.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 13.667 0.938 27.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 13.665 1.433 25.856 1.00 0.00 H new ATOM 729 N PRO A 49 10.185 -1.122 28.404 1.00 0.00 N ATOM 730 CA PRO A 49 10.997 -2.065 29.224 1.00 0.00 C ATOM 731 C PRO A 49 10.772 -3.526 28.822 1.00 0.00 C ATOM 732 O PRO A 49 11.608 -4.379 29.050 1.00 0.00 O ATOM 733 CB PRO A 49 10.505 -1.822 30.651 1.00 0.00 C ATOM 734 CG PRO A 49 9.208 -1.098 30.506 1.00 0.00 C ATOM 735 CD PRO A 49 9.320 -0.274 29.238 1.00 0.00 C ATOM 0 HA PRO A 49 12.066 -1.894 29.097 1.00 0.00 H new ATOM 0 HB2 PRO A 49 10.372 -2.762 31.186 1.00 0.00 H new ATOM 0 HB3 PRO A 49 11.223 -1.231 31.219 1.00 0.00 H new ATOM 0 HG2 PRO A 49 8.376 -1.799 30.442 1.00 0.00 H new ATOM 0 HG3 PRO A 49 9.020 -0.460 31.369 1.00 0.00 H new ATOM 0 HD2 PRO A 49 8.348 -0.101 28.775 1.00 0.00 H new ATOM 0 HD3 PRO A 49 9.763 0.704 29.424 1.00 0.00 H new ATOM 743 N GLN A 50 9.649 -3.822 28.228 1.00 0.00 N ATOM 744 CA GLN A 50 9.384 -5.222 27.790 1.00 0.00 C ATOM 745 C GLN A 50 10.236 -5.545 26.561 1.00 0.00 C ATOM 746 O GLN A 50 10.937 -6.537 26.522 1.00 0.00 O ATOM 747 CB GLN A 50 7.903 -5.374 27.437 1.00 0.00 C ATOM 748 CG GLN A 50 7.579 -6.855 27.224 1.00 0.00 C ATOM 749 CD GLN A 50 7.544 -7.569 28.576 1.00 0.00 C ATOM 750 OE1 GLN A 50 8.441 -8.320 28.904 1.00 0.00 O ATOM 751 NE2 GLN A 50 6.537 -7.366 29.381 1.00 0.00 N ATOM 0 H GLN A 50 8.903 -3.156 28.027 1.00 0.00 H new ATOM 0 HA GLN A 50 9.639 -5.908 28.598 1.00 0.00 H new ATOM 0 HB2 GLN A 50 7.284 -4.967 28.236 1.00 0.00 H new ATOM 0 HB3 GLN A 50 7.673 -4.807 26.535 1.00 0.00 H new ATOM 0 HG2 GLN A 50 6.618 -6.959 26.721 1.00 0.00 H new ATOM 0 HG3 GLN A 50 8.328 -7.313 26.578 1.00 0.00 H new ATOM 0 HE21 GLN A 50 5.784 -6.736 29.106 1.00 0.00 H new ATOM 0 HE22 GLN A 50 6.503 -7.838 30.285 1.00 0.00 H new ATOM 760 N LEU A 51 10.180 -4.716 25.554 1.00 0.00 N ATOM 761 CA LEU A 51 11.024 -4.949 24.348 1.00 0.00 C ATOM 762 C LEU A 51 12.502 -4.843 24.730 1.00 0.00 C ATOM 763 O LEU A 51 13.315 -5.656 24.334 1.00 0.00 O ATOM 764 CB LEU A 51 10.694 -3.899 23.285 1.00 0.00 C ATOM 765 CG LEU A 51 9.329 -4.207 22.670 1.00 0.00 C ATOM 766 CD1 LEU A 51 8.732 -2.927 22.083 1.00 0.00 C ATOM 767 CD2 LEU A 51 9.494 -5.247 21.559 1.00 0.00 C ATOM 0 H LEU A 51 9.586 -3.888 25.515 1.00 0.00 H new ATOM 0 HA LEU A 51 10.823 -5.944 23.951 1.00 0.00 H new ATOM 0 HB2 LEU A 51 10.688 -2.904 23.731 1.00 0.00 H new ATOM 0 HB3 LEU A 51 11.461 -3.896 22.511 1.00 0.00 H new ATOM 0 HG LEU A 51 8.664 -4.598 23.440 1.00 0.00 H new ATOM 0 HD11 LEU A 51 7.759 -3.147 21.645 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.615 -2.185 22.873 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.397 -2.535 21.313 1.00 0.00 H new ATOM 0 HD21 LEU A 51 8.521 -5.468 21.120 1.00 0.00 H new ATOM 0 HD22 LEU A 51 10.159 -4.855 20.790 1.00 0.00 H new ATOM 0 HD23 LEU A 51 9.919 -6.160 21.976 1.00 0.00 H new ATOM 779 N ALA A 52 12.857 -3.848 25.496 1.00 0.00 N ATOM 780 CA ALA A 52 14.275 -3.714 25.935 1.00 0.00 C ATOM 781 C ALA A 52 14.753 -5.037 26.535 1.00 0.00 C ATOM 782 O ALA A 52 15.861 -5.474 26.297 1.00 0.00 O ATOM 783 CB ALA A 52 14.379 -2.610 26.989 1.00 0.00 C ATOM 0 H ALA A 52 12.227 -3.122 25.837 1.00 0.00 H new ATOM 0 HA ALA A 52 14.897 -3.460 25.077 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.416 -2.511 27.311 1.00 0.00 H new ATOM 0 HB2 ALA A 52 14.040 -1.666 26.562 1.00 0.00 H new ATOM 0 HB3 ALA A 52 13.756 -2.865 27.846 1.00 0.00 H new ATOM 789 N ARG A 53 13.926 -5.678 27.315 1.00 0.00 N ATOM 790 CA ARG A 53 14.330 -6.977 27.924 1.00 0.00 C ATOM 791 C ARG A 53 14.491 -8.031 26.828 1.00 0.00 C ATOM 792 O ARG A 53 15.384 -8.853 26.870 1.00 0.00 O ATOM 793 CB ARG A 53 13.257 -7.428 28.915 1.00 0.00 C ATOM 794 CG ARG A 53 13.688 -8.742 29.570 1.00 0.00 C ATOM 795 CD ARG A 53 12.595 -9.222 30.526 1.00 0.00 C ATOM 796 NE ARG A 53 13.222 -9.769 31.762 1.00 0.00 N ATOM 797 CZ ARG A 53 14.175 -10.657 31.671 1.00 0.00 C ATOM 798 NH1 ARG A 53 14.582 -11.058 30.497 1.00 0.00 N ATOM 799 NH2 ARG A 53 14.721 -11.142 32.752 1.00 0.00 N ATOM 0 H ARG A 53 12.988 -5.358 27.557 1.00 0.00 H new ATOM 0 HA ARG A 53 15.279 -6.854 28.446 1.00 0.00 H new ATOM 0 HB2 ARG A 53 13.105 -6.663 29.676 1.00 0.00 H new ATOM 0 HB3 ARG A 53 12.305 -7.560 28.401 1.00 0.00 H new ATOM 0 HG2 ARG A 53 13.874 -9.497 28.806 1.00 0.00 H new ATOM 0 HG3 ARG A 53 14.623 -8.600 30.112 1.00 0.00 H new ATOM 0 HD2 ARG A 53 11.929 -8.397 30.778 1.00 0.00 H new ATOM 0 HD3 ARG A 53 11.986 -9.987 30.045 1.00 0.00 H new ATOM 0 HE ARG A 53 12.907 -9.450 32.678 1.00 0.00 H new ATOM 0 HH11 ARG A 53 14.156 -10.678 29.652 1.00 0.00 H new ATOM 0 HH12 ARG A 53 15.326 -11.752 30.425 1.00 0.00 H new ATOM 0 HH21 ARG A 53 14.403 -10.828 33.669 1.00 0.00 H new ATOM 0 HH22 ARG A 53 15.465 -11.836 32.680 1.00 0.00 H new ATOM 813 N TYR A 54 13.632 -8.016 25.845 1.00 0.00 N ATOM 814 CA TYR A 54 13.733 -9.026 24.754 1.00 0.00 C ATOM 815 C TYR A 54 15.051 -8.835 24.002 1.00 0.00 C ATOM 816 O TYR A 54 15.815 -9.762 23.824 1.00 0.00 O ATOM 817 CB TYR A 54 12.563 -8.849 23.785 1.00 0.00 C ATOM 818 CG TYR A 54 12.539 -10.000 22.809 1.00 0.00 C ATOM 819 CD1 TYR A 54 12.121 -11.267 23.230 1.00 0.00 C ATOM 820 CD2 TYR A 54 12.936 -9.800 21.481 1.00 0.00 C ATOM 821 CE1 TYR A 54 12.099 -12.335 22.325 1.00 0.00 C ATOM 822 CE2 TYR A 54 12.915 -10.867 20.575 1.00 0.00 C ATOM 823 CZ TYR A 54 12.497 -12.135 20.997 1.00 0.00 C ATOM 824 OH TYR A 54 12.476 -13.187 20.105 1.00 0.00 O ATOM 0 H TYR A 54 12.866 -7.349 25.751 1.00 0.00 H new ATOM 0 HA TYR A 54 13.701 -10.028 25.183 1.00 0.00 H new ATOM 0 HB2 TYR A 54 11.624 -8.806 24.336 1.00 0.00 H new ATOM 0 HB3 TYR A 54 12.661 -7.905 23.248 1.00 0.00 H new ATOM 0 HD1 TYR A 54 11.815 -11.421 24.254 1.00 0.00 H new ATOM 0 HD2 TYR A 54 13.259 -8.822 21.156 1.00 0.00 H new ATOM 0 HE1 TYR A 54 11.775 -13.313 22.651 1.00 0.00 H new ATOM 0 HE2 TYR A 54 13.221 -10.712 19.551 1.00 0.00 H new ATOM 0 HH TYR A 54 12.781 -12.877 19.227 1.00 0.00 H new ATOM 834 N LEU A 55 15.323 -7.639 23.556 1.00 0.00 N ATOM 835 CA LEU A 55 16.593 -7.389 22.818 1.00 0.00 C ATOM 836 C LEU A 55 17.783 -7.642 23.746 1.00 0.00 C ATOM 837 O LEU A 55 18.883 -7.906 23.303 1.00 0.00 O ATOM 838 CB LEU A 55 16.624 -5.939 22.332 1.00 0.00 C ATOM 839 CG LEU A 55 15.484 -5.710 21.338 1.00 0.00 C ATOM 840 CD1 LEU A 55 15.459 -4.238 20.919 1.00 0.00 C ATOM 841 CD2 LEU A 55 15.703 -6.586 20.103 1.00 0.00 C ATOM 0 H LEU A 55 14.720 -6.824 23.671 1.00 0.00 H new ATOM 0 HA LEU A 55 16.652 -8.061 21.962 1.00 0.00 H new ATOM 0 HB2 LEU A 55 16.525 -5.259 23.178 1.00 0.00 H new ATOM 0 HB3 LEU A 55 17.582 -5.723 21.859 1.00 0.00 H new ATOM 0 HG LEU A 55 14.535 -5.970 21.807 1.00 0.00 H new ATOM 0 HD11 LEU A 55 14.647 -4.075 20.211 1.00 0.00 H new ATOM 0 HD12 LEU A 55 15.305 -3.612 21.798 1.00 0.00 H new ATOM 0 HD13 LEU A 55 16.407 -3.977 20.449 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.891 -6.424 19.394 1.00 0.00 H new ATOM 0 HD22 LEU A 55 16.652 -6.324 19.635 1.00 0.00 H new ATOM 0 HD23 LEU A 55 15.722 -7.635 20.400 1.00 0.00 H new ATOM 853 N GLY A 56 17.574 -7.561 25.031 1.00 0.00 N ATOM 854 CA GLY A 56 18.690 -7.817 25.986 1.00 0.00 C ATOM 855 C GLY A 56 19.754 -6.729 25.830 1.00 0.00 C ATOM 856 O GLY A 56 19.450 -5.557 25.743 1.00 0.00 O ATOM 0 H GLY A 56 16.679 -7.329 25.462 1.00 0.00 H new ATOM 0 HA2 GLY A 56 18.313 -7.828 27.009 1.00 0.00 H new ATOM 0 HA3 GLY A 56 19.127 -8.798 25.797 1.00 0.00 H new ATOM 860 N ASN A 57 21.003 -7.109 25.796 1.00 0.00 N ATOM 861 CA ASN A 57 22.086 -6.096 25.654 1.00 0.00 C ATOM 862 C ASN A 57 22.588 -6.083 24.209 1.00 0.00 C ATOM 863 O ASN A 57 23.754 -5.861 23.948 1.00 0.00 O ATOM 864 CB ASN A 57 23.242 -6.451 26.592 1.00 0.00 C ATOM 865 CG ASN A 57 24.349 -5.404 26.458 1.00 0.00 C ATOM 866 OD1 ASN A 57 25.321 -5.616 25.760 1.00 0.00 O ATOM 867 ND2 ASN A 57 24.242 -4.273 27.101 1.00 0.00 N ATOM 0 H ASN A 57 21.319 -8.077 25.860 1.00 0.00 H new ATOM 0 HA ASN A 57 21.697 -5.111 25.912 1.00 0.00 H new ATOM 0 HB2 ASN A 57 22.889 -6.492 27.622 1.00 0.00 H new ATOM 0 HB3 ASN A 57 23.631 -7.440 26.349 1.00 0.00 H new ATOM 0 HD21 ASN A 57 24.974 -3.568 27.017 1.00 0.00 H new ATOM 0 HD22 ASN A 57 23.426 -4.095 27.687 1.00 0.00 H new ATOM 874 N ALA A 58 21.716 -6.320 23.267 1.00 0.00 N ATOM 875 CA ALA A 58 22.145 -6.321 21.840 1.00 0.00 C ATOM 876 C ALA A 58 21.716 -5.008 21.179 1.00 0.00 C ATOM 877 O ALA A 58 22.277 -4.590 20.186 1.00 0.00 O ATOM 878 CB ALA A 58 21.491 -7.496 21.111 1.00 0.00 C ATOM 0 H ALA A 58 20.727 -6.513 23.424 1.00 0.00 H new ATOM 0 HA ALA A 58 23.229 -6.419 21.786 1.00 0.00 H new ATOM 0 HB1 ALA A 58 21.805 -7.497 20.067 1.00 0.00 H new ATOM 0 HB2 ALA A 58 21.795 -8.431 21.582 1.00 0.00 H new ATOM 0 HB3 ALA A 58 20.407 -7.399 21.164 1.00 0.00 H new ATOM 884 N VAL A 59 20.725 -4.357 21.722 1.00 0.00 N ATOM 885 CA VAL A 59 20.258 -3.075 21.122 1.00 0.00 C ATOM 886 C VAL A 59 19.883 -2.096 22.237 1.00 0.00 C ATOM 887 O VAL A 59 19.347 -2.479 23.258 1.00 0.00 O ATOM 888 CB VAL A 59 19.034 -3.341 20.244 1.00 0.00 C ATOM 889 CG1 VAL A 59 18.535 -2.022 19.649 1.00 0.00 C ATOM 890 CG2 VAL A 59 19.417 -4.296 19.112 1.00 0.00 C ATOM 0 H VAL A 59 20.218 -4.657 22.555 1.00 0.00 H new ATOM 0 HA VAL A 59 21.055 -2.646 20.515 1.00 0.00 H new ATOM 0 HB VAL A 59 18.245 -3.789 20.848 1.00 0.00 H new ATOM 0 HG11 VAL A 59 17.663 -2.212 19.023 1.00 0.00 H new ATOM 0 HG12 VAL A 59 18.262 -1.340 20.454 1.00 0.00 H new ATOM 0 HG13 VAL A 59 19.324 -1.574 19.045 1.00 0.00 H new ATOM 0 HG21 VAL A 59 18.545 -4.486 18.486 1.00 0.00 H new ATOM 0 HG22 VAL A 59 20.206 -3.847 18.509 1.00 0.00 H new ATOM 0 HG23 VAL A 59 19.773 -5.236 19.534 1.00 0.00 H new ATOM 900 N ASP A 60 20.162 -0.835 22.050 1.00 0.00 N ATOM 901 CA ASP A 60 19.819 0.167 23.099 1.00 0.00 C ATOM 902 C ASP A 60 18.547 0.915 22.694 1.00 0.00 C ATOM 903 O ASP A 60 18.501 1.574 21.675 1.00 0.00 O ATOM 904 CB ASP A 60 20.971 1.163 23.249 1.00 0.00 C ATOM 905 CG ASP A 60 20.667 2.124 24.398 1.00 0.00 C ATOM 906 OD1 ASP A 60 19.535 2.138 24.851 1.00 0.00 O ATOM 907 OD2 ASP A 60 21.574 2.832 24.807 1.00 0.00 O ATOM 0 H ASP A 60 20.612 -0.455 21.217 1.00 0.00 H new ATOM 0 HA ASP A 60 19.654 -0.343 24.048 1.00 0.00 H new ATOM 0 HB2 ASP A 60 21.903 0.631 23.442 1.00 0.00 H new ATOM 0 HB3 ASP A 60 21.108 1.719 22.322 1.00 0.00 H new ATOM 912 N LEU A 61 17.514 0.817 23.485 1.00 0.00 N ATOM 913 CA LEU A 61 16.248 1.530 23.149 1.00 0.00 C ATOM 914 C LEU A 61 16.071 2.723 24.091 1.00 0.00 C ATOM 915 O LEU A 61 14.988 3.252 24.242 1.00 0.00 O ATOM 916 CB LEU A 61 15.065 0.574 23.310 1.00 0.00 C ATOM 917 CG LEU A 61 15.171 -0.548 22.275 1.00 0.00 C ATOM 918 CD1 LEU A 61 14.026 -1.541 22.479 1.00 0.00 C ATOM 919 CD2 LEU A 61 15.082 0.048 20.868 1.00 0.00 C ATOM 0 H LEU A 61 17.491 0.275 24.349 1.00 0.00 H new ATOM 0 HA LEU A 61 16.292 1.882 22.118 1.00 0.00 H new ATOM 0 HB2 LEU A 61 15.056 0.155 24.316 1.00 0.00 H new ATOM 0 HB3 LEU A 61 14.127 1.114 23.182 1.00 0.00 H new ATOM 0 HG LEU A 61 16.124 -1.063 22.394 1.00 0.00 H new ATOM 0 HD11 LEU A 61 14.102 -2.340 21.742 1.00 0.00 H new ATOM 0 HD12 LEU A 61 14.086 -1.965 23.481 1.00 0.00 H new ATOM 0 HD13 LEU A 61 13.073 -1.026 22.360 1.00 0.00 H new ATOM 0 HD21 LEU A 61 15.157 -0.750 20.129 1.00 0.00 H new ATOM 0 HD22 LEU A 61 14.128 0.562 20.750 1.00 0.00 H new ATOM 0 HD23 LEU A 61 15.897 0.757 20.721 1.00 0.00 H new ATOM 931 N SER A 62 17.128 3.152 24.724 1.00 0.00 N ATOM 932 CA SER A 62 17.016 4.299 25.669 1.00 0.00 C ATOM 933 C SER A 62 16.404 5.500 24.944 1.00 0.00 C ATOM 934 O SER A 62 15.549 6.185 25.470 1.00 0.00 O ATOM 935 CB SER A 62 18.405 4.670 26.187 1.00 0.00 C ATOM 936 OG SER A 62 18.927 3.590 26.950 1.00 0.00 O ATOM 0 H SER A 62 18.064 2.758 24.628 1.00 0.00 H new ATOM 0 HA SER A 62 16.379 4.018 26.507 1.00 0.00 H new ATOM 0 HB2 SER A 62 19.069 4.894 25.352 1.00 0.00 H new ATOM 0 HB3 SER A 62 18.349 5.569 26.800 1.00 0.00 H new ATOM 0 HG SER A 62 19.011 2.797 26.380 1.00 0.00 H new ATOM 942 N CYS A 63 16.835 5.759 23.740 1.00 0.00 N ATOM 943 CA CYS A 63 16.276 6.913 22.981 1.00 0.00 C ATOM 944 C CYS A 63 15.003 6.475 22.253 1.00 0.00 C ATOM 945 O CYS A 63 14.686 6.964 21.187 1.00 0.00 O ATOM 946 CB CYS A 63 17.306 7.399 21.960 1.00 0.00 C ATOM 947 SG CYS A 63 18.718 8.125 22.827 1.00 0.00 S ATOM 0 H CYS A 63 17.550 5.222 23.249 1.00 0.00 H new ATOM 0 HA CYS A 63 16.040 7.723 23.672 1.00 0.00 H new ATOM 0 HB2 CYS A 63 17.636 6.568 21.337 1.00 0.00 H new ATOM 0 HB3 CYS A 63 16.855 8.136 21.295 1.00 0.00 H new ATOM 0 HG CYS A 63 19.595 8.536 21.960 1.00 0.00 H new ATOM 953 N PHE A 64 14.270 5.556 22.821 1.00 0.00 N ATOM 954 CA PHE A 64 13.018 5.089 22.162 1.00 0.00 C ATOM 955 C PHE A 64 11.808 5.575 22.964 1.00 0.00 C ATOM 956 O PHE A 64 11.685 5.307 24.142 1.00 0.00 O ATOM 957 CB PHE A 64 13.012 3.561 22.103 1.00 0.00 C ATOM 958 CG PHE A 64 11.774 3.090 21.377 1.00 0.00 C ATOM 959 CD1 PHE A 64 11.639 3.319 20.003 1.00 0.00 C ATOM 960 CD2 PHE A 64 10.762 2.424 22.078 1.00 0.00 C ATOM 961 CE1 PHE A 64 10.492 2.883 19.329 1.00 0.00 C ATOM 962 CE2 PHE A 64 9.615 1.986 21.405 1.00 0.00 C ATOM 963 CZ PHE A 64 9.480 2.217 20.031 1.00 0.00 C ATOM 0 H PHE A 64 14.484 5.109 23.712 1.00 0.00 H new ATOM 0 HA PHE A 64 12.968 5.491 21.150 1.00 0.00 H new ATOM 0 HB2 PHE A 64 13.905 3.203 21.591 1.00 0.00 H new ATOM 0 HB3 PHE A 64 13.035 3.147 23.111 1.00 0.00 H new ATOM 0 HD1 PHE A 64 12.420 3.832 19.462 1.00 0.00 H new ATOM 0 HD2 PHE A 64 10.866 2.248 23.138 1.00 0.00 H new ATOM 0 HE1 PHE A 64 10.388 3.060 18.269 1.00 0.00 H new ATOM 0 HE2 PHE A 64 8.835 1.470 21.946 1.00 0.00 H new ATOM 0 HZ PHE A 64 8.594 1.881 19.512 1.00 0.00 H new ATOM 973 N ASP A 65 10.914 6.286 22.335 1.00 0.00 N ATOM 974 CA ASP A 65 9.700 6.765 23.055 1.00 0.00 C ATOM 975 C ASP A 65 8.645 5.657 23.069 1.00 0.00 C ATOM 976 O ASP A 65 8.856 4.578 22.552 1.00 0.00 O ATOM 977 CB ASP A 65 9.138 7.997 22.345 1.00 0.00 C ATOM 978 CG ASP A 65 9.992 9.219 22.689 1.00 0.00 C ATOM 979 OD1 ASP A 65 11.090 9.029 23.184 1.00 0.00 O ATOM 980 OD2 ASP A 65 9.532 10.324 22.454 1.00 0.00 O ATOM 0 H ASP A 65 10.971 6.556 21.353 1.00 0.00 H new ATOM 0 HA ASP A 65 9.965 7.027 24.079 1.00 0.00 H new ATOM 0 HB2 ASP A 65 9.131 7.837 21.267 1.00 0.00 H new ATOM 0 HB3 ASP A 65 8.105 8.165 22.649 1.00 0.00 H new ATOM 985 N PHE A 66 7.507 5.917 23.654 1.00 0.00 N ATOM 986 CA PHE A 66 6.439 4.878 23.700 1.00 0.00 C ATOM 987 C PHE A 66 5.203 5.386 22.955 1.00 0.00 C ATOM 988 O PHE A 66 4.713 4.752 22.041 1.00 0.00 O ATOM 989 CB PHE A 66 6.074 4.587 25.157 1.00 0.00 C ATOM 990 CG PHE A 66 5.106 3.429 25.210 1.00 0.00 C ATOM 991 CD1 PHE A 66 5.588 2.114 25.216 1.00 0.00 C ATOM 992 CD2 PHE A 66 3.728 3.671 25.256 1.00 0.00 C ATOM 993 CE1 PHE A 66 4.690 1.041 25.267 1.00 0.00 C ATOM 994 CE2 PHE A 66 2.830 2.597 25.306 1.00 0.00 C ATOM 995 CZ PHE A 66 3.312 1.282 25.312 1.00 0.00 C ATOM 0 H PHE A 66 7.271 6.803 24.101 1.00 0.00 H new ATOM 0 HA PHE A 66 6.798 3.964 23.227 1.00 0.00 H new ATOM 0 HB2 PHE A 66 6.972 4.351 25.728 1.00 0.00 H new ATOM 0 HB3 PHE A 66 5.628 5.470 25.615 1.00 0.00 H new ATOM 0 HD1 PHE A 66 6.651 1.928 25.181 1.00 0.00 H new ATOM 0 HD2 PHE A 66 3.357 4.685 25.253 1.00 0.00 H new ATOM 0 HE1 PHE A 66 5.061 0.027 25.272 1.00 0.00 H new ATOM 0 HE2 PHE A 66 1.767 2.783 25.340 1.00 0.00 H new ATOM 0 HZ PHE A 66 2.620 0.454 25.351 1.00 0.00 H new ATOM 1005 N ARG A 67 4.694 6.525 23.338 1.00 0.00 N ATOM 1006 CA ARG A 67 3.478 7.062 22.663 1.00 0.00 C ATOM 1007 C ARG A 67 3.704 7.083 21.150 1.00 0.00 C ATOM 1008 O ARG A 67 2.846 6.697 20.380 1.00 0.00 O ATOM 1009 CB ARG A 67 3.207 8.484 23.159 1.00 0.00 C ATOM 1010 CG ARG A 67 2.130 8.450 24.245 1.00 0.00 C ATOM 1011 CD ARG A 67 2.692 7.776 25.499 1.00 0.00 C ATOM 1012 NE ARG A 67 1.671 6.848 26.062 1.00 0.00 N ATOM 1013 CZ ARG A 67 0.450 7.263 26.260 1.00 0.00 C ATOM 1014 NH1 ARG A 67 0.122 8.491 25.964 1.00 0.00 N ATOM 1015 NH2 ARG A 67 -0.444 6.450 26.754 1.00 0.00 N ATOM 0 H ARG A 67 5.067 7.107 24.088 1.00 0.00 H new ATOM 0 HA ARG A 67 2.622 6.428 22.894 1.00 0.00 H new ATOM 0 HB2 ARG A 67 4.123 8.923 23.554 1.00 0.00 H new ATOM 0 HB3 ARG A 67 2.883 9.114 22.330 1.00 0.00 H new ATOM 0 HG2 ARG A 67 1.802 9.463 24.479 1.00 0.00 H new ATOM 0 HG3 ARG A 67 1.255 7.907 23.888 1.00 0.00 H new ATOM 0 HD2 ARG A 67 3.602 7.228 25.254 1.00 0.00 H new ATOM 0 HD3 ARG A 67 2.963 8.529 26.239 1.00 0.00 H new ATOM 0 HE ARG A 67 1.927 5.888 26.293 1.00 0.00 H new ATOM 0 HH11 ARG A 67 0.820 9.126 25.578 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -0.833 8.815 26.119 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -0.188 5.490 26.985 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -1.398 6.775 26.909 1.00 0.00 H new ATOM 1029 N THR A 68 4.851 7.530 20.717 1.00 0.00 N ATOM 1030 CA THR A 68 5.118 7.603 19.253 1.00 0.00 C ATOM 1031 C THR A 68 6.221 6.608 18.886 1.00 0.00 C ATOM 1032 O THR A 68 6.743 6.622 17.789 1.00 0.00 O ATOM 1033 CB THR A 68 5.564 9.019 18.885 1.00 0.00 C ATOM 1034 OG1 THR A 68 6.714 9.363 19.645 1.00 0.00 O ATOM 1035 CG2 THR A 68 4.436 10.007 19.187 1.00 0.00 C ATOM 0 H THR A 68 5.615 7.848 21.314 1.00 0.00 H new ATOM 0 HA THR A 68 4.209 7.356 18.705 1.00 0.00 H new ATOM 0 HB THR A 68 5.804 9.060 17.823 1.00 0.00 H new ATOM 0 HG1 THR A 68 7.003 10.269 19.410 1.00 0.00 H new ATOM 0 HG21 THR A 68 4.756 11.015 18.924 1.00 0.00 H new ATOM 0 HG22 THR A 68 3.554 9.742 18.603 1.00 0.00 H new ATOM 0 HG23 THR A 68 4.193 9.969 20.249 1.00 0.00 H new ATOM 1043 N GLY A 69 6.580 5.744 19.796 1.00 0.00 N ATOM 1044 CA GLY A 69 7.654 4.754 19.500 1.00 0.00 C ATOM 1045 C GLY A 69 8.645 5.357 18.504 1.00 0.00 C ATOM 1046 O GLY A 69 9.018 4.733 17.529 1.00 0.00 O ATOM 0 H GLY A 69 6.176 5.681 20.731 1.00 0.00 H new ATOM 0 HA2 GLY A 69 8.170 4.476 20.419 1.00 0.00 H new ATOM 0 HA3 GLY A 69 7.220 3.842 19.090 1.00 0.00 H new ATOM 1050 N LYS A 70 9.077 6.565 18.739 1.00 0.00 N ATOM 1051 CA LYS A 70 10.033 7.211 17.796 1.00 0.00 C ATOM 1052 C LYS A 70 11.437 7.195 18.403 1.00 0.00 C ATOM 1053 O LYS A 70 11.622 6.865 19.558 1.00 0.00 O ATOM 1054 CB LYS A 70 9.603 8.659 17.546 1.00 0.00 C ATOM 1055 CG LYS A 70 10.012 9.075 16.132 1.00 0.00 C ATOM 1056 CD LYS A 70 8.893 8.720 15.151 1.00 0.00 C ATOM 1057 CE LYS A 70 9.217 9.301 13.774 1.00 0.00 C ATOM 1058 NZ LYS A 70 10.388 8.583 13.195 1.00 0.00 N ATOM 0 H LYS A 70 8.810 7.133 19.543 1.00 0.00 H new ATOM 0 HA LYS A 70 10.038 6.665 16.853 1.00 0.00 H new ATOM 0 HB2 LYS A 70 8.524 8.755 17.667 1.00 0.00 H new ATOM 0 HB3 LYS A 70 10.066 9.319 18.279 1.00 0.00 H new ATOM 0 HG2 LYS A 70 10.212 10.146 16.100 1.00 0.00 H new ATOM 0 HG3 LYS A 70 10.935 8.570 15.846 1.00 0.00 H new ATOM 0 HD2 LYS A 70 8.784 7.638 15.084 1.00 0.00 H new ATOM 0 HD3 LYS A 70 7.942 9.115 15.509 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.355 9.204 13.114 1.00 0.00 H new ATOM 0 HE3 LYS A 70 9.435 10.366 13.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 11.176 9.250 13.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 10.681 7.821 13.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 10.126 8.177 12.274 1.00 0.00 H new ATOM 1072 N MET A 71 12.430 7.549 17.634 1.00 0.00 N ATOM 1073 CA MET A 71 13.821 7.562 18.170 1.00 0.00 C ATOM 1074 C MET A 71 14.214 8.996 18.532 1.00 0.00 C ATOM 1075 O MET A 71 13.885 9.935 17.835 1.00 0.00 O ATOM 1076 CB MET A 71 14.782 7.023 17.109 1.00 0.00 C ATOM 1077 CG MET A 71 16.203 6.996 17.675 1.00 0.00 C ATOM 1078 SD MET A 71 16.271 5.859 19.081 1.00 0.00 S ATOM 1079 CE MET A 71 16.914 4.425 18.184 1.00 0.00 C ATOM 0 H MET A 71 12.338 7.830 16.658 1.00 0.00 H new ATOM 0 HA MET A 71 13.873 6.934 19.060 1.00 0.00 H new ATOM 0 HB2 MET A 71 14.481 6.020 16.806 1.00 0.00 H new ATOM 0 HB3 MET A 71 14.746 7.650 16.218 1.00 0.00 H new ATOM 0 HG2 MET A 71 16.907 6.681 16.905 1.00 0.00 H new ATOM 0 HG3 MET A 71 16.500 7.997 17.988 1.00 0.00 H new ATOM 0 HE1 MET A 71 16.836 3.538 18.812 1.00 0.00 H new ATOM 0 HE2 MET A 71 16.335 4.276 17.273 1.00 0.00 H new ATOM 0 HE3 MET A 71 17.959 4.596 17.926 1.00 0.00 H new ATOM 1089 N MET A 72 14.914 9.172 19.620 1.00 0.00 N ATOM 1090 CA MET A 72 15.319 10.546 20.031 1.00 0.00 C ATOM 1091 C MET A 72 16.693 10.870 19.442 1.00 0.00 C ATOM 1092 CB MET A 72 15.386 10.623 21.557 1.00 0.00 C ATOM 1093 CG MET A 72 15.157 12.067 22.007 1.00 0.00 C ATOM 1094 SD MET A 72 16.432 13.132 21.286 1.00 0.00 S ATOM 1095 CE MET A 72 15.632 14.716 21.644 1.00 0.00 C ATOM 0 H MET A 72 15.222 8.424 20.241 1.00 0.00 H new ATOM 0 HA MET A 72 14.588 11.266 19.663 1.00 0.00 H new ATOM 0 HB2 MET A 72 14.633 9.970 21.998 1.00 0.00 H new ATOM 0 HB3 MET A 72 16.357 10.272 21.907 1.00 0.00 H new ATOM 0 HG2 MET A 72 14.168 12.404 21.696 1.00 0.00 H new ATOM 0 HG3 MET A 72 15.188 12.130 23.095 1.00 0.00 H new ATOM 0 HE1 MET A 72 16.257 15.530 21.278 1.00 0.00 H new ATOM 0 HE2 MET A 72 14.661 14.753 21.149 1.00 0.00 H new ATOM 0 HE3 MET A 72 15.495 14.819 22.720 1.00 0.00 H new TER 1105 MET A 72 ATOM 1106 O5' DG B 100 -6.920 -22.577 35.473 1.00 0.00 O ATOM 1107 C5' DG B 100 -6.071 -23.492 34.778 1.00 0.00 C ATOM 1108 C4' DG B 100 -5.585 -22.912 33.453 1.00 0.00 C ATOM 1109 O4' DG B 100 -6.689 -22.813 32.539 1.00 0.00 O ATOM 1110 C3' DG B 100 -5.009 -21.520 33.560 1.00 0.00 C ATOM 1111 O3' DG B 100 -3.792 -21.486 32.809 1.00 0.00 O ATOM 1112 C2' DG B 100 -5.975 -20.493 33.018 1.00 0.00 C ATOM 1113 C1' DG B 100 -7.029 -21.372 32.338 1.00 0.00 C ATOM 1114 N9 DG B 100 -8.393 -21.158 32.856 1.00 0.00 N ATOM 1115 C8 DG B 100 -8.840 -21.198 34.145 1.00 0.00 C ATOM 1116 N7 DG B 100 -10.110 -20.966 34.297 1.00 0.00 N ATOM 1117 C5 DG B 100 -10.553 -20.751 32.993 1.00 0.00 C ATOM 1118 C6 DG B 100 -11.856 -20.450 32.512 1.00 0.00 C ATOM 1119 O6 DG B 100 -12.894 -20.310 33.156 1.00 0.00 O ATOM 1120 N1 DG B 100 -11.869 -20.310 31.130 1.00 0.00 N ATOM 1121 C2 DG B 100 -10.767 -20.443 30.310 1.00 0.00 C ATOM 1122 N2 DG B 100 -10.980 -20.272 29.005 1.00 0.00 N ATOM 1123 N3 DG B 100 -9.541 -20.727 30.758 1.00 0.00 N ATOM 1124 C4 DG B 100 -9.507 -20.866 32.104 1.00 0.00 C ATOM 0 H5' DG B 100 -6.610 -24.421 34.593 1.00 0.00 H new ATOM 0 H5'' DG B 100 -5.214 -23.740 35.403 1.00 0.00 H new ATOM 0 H4' DG B 100 -4.801 -23.590 33.116 1.00 0.00 H new ATOM 0 H3' DG B 100 -4.822 -21.281 34.607 1.00 0.00 H new ATOM 0 H2' DG B 100 -6.405 -19.880 33.810 1.00 0.00 H new ATOM 0 H2'' DG B 100 -5.495 -19.813 32.314 1.00 0.00 H new ATOM 0 HO5' DG B 100 -7.835 -22.654 35.130 1.00 0.00 H new ATOM 0 H1' DG B 100 -7.019 -21.094 31.284 1.00 0.00 H new ATOM 0 H8 DG B 100 -8.186 -21.407 34.978 1.00 0.00 H new ATOM 0 H1 DG B 100 -12.762 -20.092 30.687 1.00 0.00 H new ATOM 0 H21 DG B 100 -10.206 -20.357 28.346 1.00 0.00 H new ATOM 0 H22 DG B 100 -11.917 -20.056 28.665 1.00 0.00 H new ATOM 1137 P DG B 101 -2.864 -20.171 32.816 1.00 0.00 P ATOM 1138 OP1 DG B 101 -1.466 -20.591 32.573 1.00 0.00 O ATOM 1139 OP2 DG B 101 -3.196 -19.376 34.019 1.00 0.00 O ATOM 1140 O5' DG B 101 -3.382 -19.369 31.521 1.00 0.00 O ATOM 1141 C5' DG B 101 -3.272 -19.947 30.217 1.00 0.00 C ATOM 1142 C4' DG B 101 -3.806 -19.006 29.142 1.00 0.00 C ATOM 1143 O4' DG B 101 -5.223 -18.847 29.302 1.00 0.00 O ATOM 1144 C3' DG B 101 -3.225 -17.613 29.193 1.00 0.00 C ATOM 1145 O3' DG B 101 -2.747 -17.285 27.885 1.00 0.00 O ATOM 1146 C2' DG B 101 -4.269 -16.610 29.624 1.00 0.00 C ATOM 1147 C1' DG B 101 -5.561 -17.423 29.507 1.00 0.00 C ATOM 1148 N9 DG B 101 -6.425 -17.321 30.697 1.00 0.00 N ATOM 1149 C8 DG B 101 -6.095 -17.450 32.016 1.00 0.00 C ATOM 1150 N7 DG B 101 -7.080 -17.304 32.850 1.00 0.00 N ATOM 1151 C5 DG B 101 -8.169 -17.053 32.017 1.00 0.00 C ATOM 1152 C6 DG B 101 -9.530 -16.809 32.345 1.00 0.00 C ATOM 1153 O6 DG B 101 -10.050 -16.765 33.458 1.00 0.00 O ATOM 1154 N1 DG B 101 -10.299 -16.604 31.207 1.00 0.00 N ATOM 1155 C2 DG B 101 -9.822 -16.630 29.912 1.00 0.00 C ATOM 1156 N2 DG B 101 -10.718 -16.412 28.949 1.00 0.00 N ATOM 1157 N3 DG B 101 -8.543 -16.860 29.599 1.00 0.00 N ATOM 1158 C4 DG B 101 -7.777 -17.062 30.696 1.00 0.00 C ATOM 0 H5' DG B 101 -3.824 -20.886 30.187 1.00 0.00 H new ATOM 0 H5'' DG B 101 -2.228 -20.183 30.009 1.00 0.00 H new ATOM 0 H4' DG B 101 -3.525 -19.469 28.196 1.00 0.00 H new ATOM 0 H3' DG B 101 -2.412 -17.581 29.919 1.00 0.00 H new ATOM 0 H2' DG B 101 -4.100 -16.257 30.641 1.00 0.00 H new ATOM 0 H2'' DG B 101 -4.281 -15.731 28.980 1.00 0.00 H new ATOM 0 H1' DG B 101 -6.113 -17.011 28.662 1.00 0.00 H new ATOM 0 H8 DG B 101 -5.087 -17.659 32.342 1.00 0.00 H new ATOM 0 H1 DG B 101 -11.294 -16.420 31.338 1.00 0.00 H new ATOM 0 H21 DG B 101 -10.428 -16.418 27.971 1.00 0.00 H new ATOM 0 H22 DG B 101 -11.694 -16.239 29.190 1.00 0.00 H new ATOM 1170 P DA B 102 -1.991 -15.889 27.617 1.00 0.00 P ATOM 1171 OP1 DA B 102 -1.019 -16.091 26.520 1.00 0.00 O ATOM 1172 OP2 DA B 102 -1.535 -15.353 28.919 1.00 0.00 O ATOM 1173 O5' DA B 102 -3.177 -14.947 27.072 1.00 0.00 O ATOM 1174 C5' DA B 102 -3.848 -15.260 25.849 1.00 0.00 C ATOM 1175 C4' DA B 102 -4.906 -14.216 25.505 1.00 0.00 C ATOM 1176 O4' DA B 102 -5.960 -14.259 26.481 1.00 0.00 O ATOM 1177 C3' DA B 102 -4.397 -12.794 25.511 1.00 0.00 C ATOM 1178 O3' DA B 102 -4.766 -12.189 24.268 1.00 0.00 O ATOM 1179 C2' DA B 102 -4.992 -12.013 26.659 1.00 0.00 C ATOM 1180 C1' DA B 102 -6.093 -12.957 27.150 1.00 0.00 C ATOM 1181 N9 DA B 102 -6.061 -13.187 28.607 1.00 0.00 N ATOM 1182 C8 DA B 102 -4.992 -13.458 29.413 1.00 0.00 C ATOM 1183 N7 DA B 102 -5.278 -13.611 30.671 1.00 0.00 N ATOM 1184 C5 DA B 102 -6.659 -13.427 30.706 1.00 0.00 C ATOM 1185 C6 DA B 102 -7.594 -13.458 31.746 1.00 0.00 C ATOM 1186 N6 DA B 102 -7.264 -13.697 33.015 1.00 0.00 N ATOM 1187 N1 DA B 102 -8.881 -13.232 31.430 1.00 0.00 N ATOM 1188 C2 DA B 102 -9.230 -12.991 30.166 1.00 0.00 C ATOM 1189 N3 DA B 102 -8.426 -12.939 29.107 1.00 0.00 N ATOM 1190 C4 DA B 102 -7.143 -13.168 29.454 1.00 0.00 C ATOM 0 H5' DA B 102 -4.317 -16.240 25.931 1.00 0.00 H new ATOM 0 H5'' DA B 102 -3.120 -15.322 25.040 1.00 0.00 H new ATOM 0 H4' DA B 102 -5.236 -14.468 24.497 1.00 0.00 H new ATOM 0 H3' DA B 102 -3.314 -12.792 25.634 1.00 0.00 H new ATOM 0 H2' DA B 102 -4.256 -11.805 27.436 1.00 0.00 H new ATOM 0 H2'' DA B 102 -5.393 -11.053 26.335 1.00 0.00 H new ATOM 0 H1' DA B 102 -7.039 -12.473 26.909 1.00 0.00 H new ATOM 0 H8 DA B 102 -3.984 -13.539 29.033 1.00 0.00 H new ATOM 0 H61 DA B 102 -7.985 -13.708 33.736 1.00 0.00 H new ATOM 0 H62 DA B 102 -6.290 -13.868 33.265 1.00 0.00 H new ATOM 0 H2 DA B 102 -10.280 -12.819 29.981 1.00 0.00 H new ATOM 1202 P DA B 103 -4.286 -10.693 23.914 1.00 0.00 P ATOM 1203 OP1 DA B 103 -4.134 -10.591 22.445 1.00 0.00 O ATOM 1204 OP2 DA B 103 -3.151 -10.349 24.798 1.00 0.00 O ATOM 1205 O5' DA B 103 -5.555 -9.804 24.352 1.00 0.00 O ATOM 1206 C5' DA B 103 -6.810 -9.951 23.684 1.00 0.00 C ATOM 1207 C4' DA B 103 -7.857 -8.994 24.240 1.00 0.00 C ATOM 1208 O4' DA B 103 -8.163 -9.350 25.597 1.00 0.00 O ATOM 1209 C3' DA B 103 -7.417 -7.548 24.283 1.00 0.00 C ATOM 1210 O3' DA B 103 -8.430 -6.759 23.655 1.00 0.00 O ATOM 1211 C2' DA B 103 -7.217 -7.088 25.707 1.00 0.00 C ATOM 1212 C1' DA B 103 -7.898 -8.206 26.503 1.00 0.00 C ATOM 1213 N9 DA B 103 -7.093 -8.693 27.638 1.00 0.00 N ATOM 1214 C8 DA B 103 -5.766 -9.016 27.678 1.00 0.00 C ATOM 1215 N7 DA B 103 -5.332 -9.418 28.834 1.00 0.00 N ATOM 1216 C5 DA B 103 -6.471 -9.358 29.635 1.00 0.00 C ATOM 1217 C6 DA B 103 -6.699 -9.656 30.984 1.00 0.00 C ATOM 1218 N6 DA B 103 -5.744 -10.093 31.806 1.00 0.00 N ATOM 1219 N1 DA B 103 -7.947 -9.484 31.454 1.00 0.00 N ATOM 1220 C2 DA B 103 -8.914 -9.048 30.648 1.00 0.00 C ATOM 1221 N3 DA B 103 -8.805 -8.738 29.360 1.00 0.00 N ATOM 1222 C4 DA B 103 -7.545 -8.919 28.915 1.00 0.00 C ATOM 0 H5' DA B 103 -7.161 -10.977 23.790 1.00 0.00 H new ATOM 0 H5'' DA B 103 -6.679 -9.768 22.618 1.00 0.00 H new ATOM 0 H4' DA B 103 -8.707 -9.083 23.564 1.00 0.00 H new ATOM 0 H3' DA B 103 -6.466 -7.439 23.762 1.00 0.00 H new ATOM 0 H2' DA B 103 -6.161 -6.992 25.960 1.00 0.00 H new ATOM 0 H2'' DA B 103 -7.678 -6.118 25.891 1.00 0.00 H new ATOM 0 H1' DA B 103 -8.817 -7.785 26.911 1.00 0.00 H new ATOM 0 H8 DA B 103 -5.125 -8.942 26.812 1.00 0.00 H new ATOM 0 H61 DA B 103 -5.964 -10.296 32.781 1.00 0.00 H new ATOM 0 H62 DA B 103 -4.794 -10.225 31.459 1.00 0.00 H new ATOM 0 H2 DA B 103 -9.893 -8.934 31.089 1.00 0.00 H new ATOM 1234 P DT B 104 -8.234 -5.171 23.475 1.00 0.00 P ATOM 1235 OP1 DT B 104 -8.972 -4.748 22.263 1.00 0.00 O ATOM 1236 OP2 DT B 104 -6.793 -4.866 23.605 1.00 0.00 O ATOM 1237 O5' DT B 104 -8.995 -4.574 24.762 1.00 0.00 O ATOM 1238 C5' DT B 104 -10.385 -4.838 24.971 1.00 0.00 C ATOM 1239 C4' DT B 104 -10.876 -4.241 26.285 1.00 0.00 C ATOM 1240 O4' DT B 104 -10.234 -4.904 27.385 1.00 0.00 O ATOM 1241 C3' DT B 104 -10.568 -2.771 26.452 1.00 0.00 C ATOM 1242 O3' DT B 104 -11.789 -2.097 26.768 1.00 0.00 O ATOM 1243 C2' DT B 104 -9.562 -2.554 27.559 1.00 0.00 C ATOM 1244 C1' DT B 104 -9.573 -3.909 28.271 1.00 0.00 C ATOM 1245 N1 DT B 104 -8.230 -4.378 28.659 1.00 0.00 N ATOM 1246 C2 DT B 104 -8.060 -4.814 29.959 1.00 0.00 C ATOM 1247 O2 DT B 104 -8.981 -4.819 30.772 1.00 0.00 O ATOM 1248 N3 DT B 104 -6.790 -5.246 30.292 1.00 0.00 N ATOM 1249 C4 DT B 104 -5.693 -5.278 29.449 1.00 0.00 C ATOM 1250 O4 DT B 104 -4.605 -5.683 29.852 1.00 0.00 O ATOM 1251 C5 DT B 104 -5.966 -4.804 28.111 1.00 0.00 C ATOM 1252 C7 DT B 104 -4.844 -4.785 27.078 1.00 0.00 C ATOM 1253 C6 DT B 104 -7.197 -4.378 27.762 1.00 0.00 C ATOM 0 H5' DT B 104 -10.556 -5.915 24.973 1.00 0.00 H new ATOM 0 H5'' DT B 104 -10.963 -4.425 24.144 1.00 0.00 H new ATOM 0 H4' DT B 104 -11.958 -4.374 26.269 1.00 0.00 H new ATOM 0 H3' DT B 104 -10.139 -2.379 25.530 1.00 0.00 H new ATOM 0 H2' DT B 104 -8.575 -2.306 27.170 1.00 0.00 H new ATOM 0 H2'' DT B 104 -9.856 -1.742 28.224 1.00 0.00 H new ATOM 0 H1' DT B 104 -10.126 -3.790 29.203 1.00 0.00 H new ATOM 0 H3 DT B 104 -6.648 -5.572 31.248 1.00 0.00 H new ATOM 0 H71 DT B 104 -5.264 -4.929 26.082 1.00 0.00 H new ATOM 0 H72 DT B 104 -4.328 -3.826 27.119 1.00 0.00 H new ATOM 0 H73 DT B 104 -4.138 -5.587 27.293 1.00 0.00 H new ATOM 0 H6 DT B 104 -7.371 -4.030 26.754 1.00 0.00 H new HETATM 1266 N1 5CM B 105 -9.013 -0.946 31.296 1.00 0.00 N HETATM 1267 C2 5CM B 105 -8.069 -1.584 32.083 1.00 0.00 C HETATM 1268 N3 5CM B 105 -6.836 -1.811 31.555 1.00 0.00 N HETATM 1269 C4 5CM B 105 -6.544 -1.427 30.305 1.00 0.00 C HETATM 1270 C5 5CM B 105 -7.517 -0.763 29.494 1.00 0.00 C HETATM 1271 C5A 5CM B 105 -7.192 -0.322 28.069 1.00 0.00 C HETATM 1272 C6 5CM B 105 -8.728 -0.541 30.025 1.00 0.00 C HETATM 1273 O2 5CM B 105 -8.353 -1.929 33.228 1.00 0.00 O HETATM 1274 N4 5CM B 105 -5.328 -1.666 29.814 1.00 0.00 N HETATM 1275 C1' 5CM B 105 -10.325 -0.662 31.907 1.00 0.00 C HETATM 1276 C2' 5CM B 105 -10.761 0.799 31.757 1.00 0.00 C HETATM 1277 C3' 5CM B 105 -12.200 0.654 31.321 1.00 0.00 C HETATM 1278 C4' 5CM B 105 -12.500 -0.771 30.918 1.00 0.00 C HETATM 1279 O4' 5CM B 105 -11.343 -1.536 31.290 1.00 0.00 O HETATM 1280 O3' 5CM B 105 -13.072 1.002 32.398 1.00 0.00 O HETATM 1281 C5' 5CM B 105 -12.780 -0.957 29.431 1.00 0.00 C HETATM 1282 O5' 5CM B 105 -11.736 -0.404 28.625 1.00 0.00 O HETATM 1283 P 5CM B 105 -11.802 -0.507 27.020 1.00 0.00 P HETATM 1284 OP1 5CM B 105 -10.550 0.060 26.469 1.00 0.00 O HETATM 1285 OP2 5CM B 105 -13.109 0.023 26.575 1.00 0.00 O HETATM 0 HN42 5CM B 105 -5.096 -1.378 28.864 1.00 0.00 H new HETATM 0 HN41 5CM B 105 -4.630 -2.137 30.389 1.00 0.00 H new HETATM 0 H5A3 5CM B 105 -6.359 0.381 28.087 1.00 0.00 H new HETATM 0 H5A2 5CM B 105 -6.920 -1.192 27.472 1.00 0.00 H new HETATM 0 H5A1 5CM B 105 -8.065 0.161 27.630 1.00 0.00 H new HETATM 0 H5'' 5CM B 105 -12.887 -2.019 29.210 1.00 0.00 H new HETATM 0 H2'' 5CM B 105 -10.672 1.350 32.693 1.00 0.00 H new HETATM 0 H6 5CM B 105 -9.491 -0.033 29.436 1.00 0.00 H new HETATM 0 H5' 5CM B 105 -13.727 -0.482 29.176 1.00 0.00 H new HETATM 0 H4' 5CM B 105 -13.413 -1.092 31.419 1.00 0.00 H new HETATM 0 H3' 5CM B 105 -12.358 1.316 30.470 1.00 0.00 H new HETATM 0 H2' 5CM B 105 -10.162 1.330 31.017 1.00 0.00 H new HETATM 0 H1' 5CM B 105 -10.228 -0.856 32.975 1.00 0.00 H new ATOM 1299 P DG B 106 -12.979 2.454 33.088 1.00 0.00 P ATOM 1300 OP1 DG B 106 -14.339 2.853 33.514 1.00 0.00 O ATOM 1301 OP2 DG B 106 -12.195 3.340 32.199 1.00 0.00 O ATOM 1302 O5' DG B 106 -12.105 2.161 34.407 1.00 0.00 O ATOM 1303 C5' DG B 106 -12.524 1.171 35.351 1.00 0.00 C ATOM 1304 C4' DG B 106 -11.514 1.013 36.483 1.00 0.00 C ATOM 1305 O4' DG B 106 -10.278 0.506 35.957 1.00 0.00 O ATOM 1306 C3' DG B 106 -11.165 2.303 37.187 1.00 0.00 C ATOM 1307 O3' DG B 106 -11.350 2.104 38.591 1.00 0.00 O ATOM 1308 C2' DG B 106 -9.734 2.699 36.911 1.00 0.00 C ATOM 1309 C1' DG B 106 -9.168 1.423 36.280 1.00 0.00 C ATOM 1310 N9 DG B 106 -8.375 1.676 35.062 1.00 0.00 N ATOM 1311 C8 DG B 106 -8.712 2.390 33.947 1.00 0.00 C ATOM 1312 N7 DG B 106 -7.798 2.441 33.026 1.00 0.00 N ATOM 1313 C5 DG B 106 -6.754 1.695 33.571 1.00 0.00 C ATOM 1314 C6 DG B 106 -5.475 1.389 33.031 1.00 0.00 C ATOM 1315 O6 DG B 106 -5.006 1.724 31.946 1.00 0.00 O ATOM 1316 N1 DG B 106 -4.727 0.611 33.905 1.00 0.00 N ATOM 1317 C2 DG B 106 -5.153 0.179 35.144 1.00 0.00 C ATOM 1318 N2 DG B 106 -4.289 -0.560 35.840 1.00 0.00 N ATOM 1319 N3 DG B 106 -6.354 0.464 35.655 1.00 0.00 N ATOM 1320 C4 DG B 106 -7.100 1.223 34.818 1.00 0.00 C ATOM 0 H5' DG B 106 -12.655 0.215 34.843 1.00 0.00 H new ATOM 0 H5'' DG B 106 -13.494 1.448 35.764 1.00 0.00 H new ATOM 0 H4' DG B 106 -11.991 0.341 37.197 1.00 0.00 H new ATOM 0 H3' DG B 106 -11.808 3.104 36.822 1.00 0.00 H new ATOM 0 H2' DG B 106 -9.670 3.552 36.235 1.00 0.00 H new ATOM 0 H2'' DG B 106 -9.203 2.974 37.823 1.00 0.00 H new ATOM 0 H1' DG B 106 -8.492 0.980 37.012 1.00 0.00 H new ATOM 0 H8 DG B 106 -9.670 2.877 33.839 1.00 0.00 H new ATOM 0 H1 DG B 106 -3.790 0.338 33.608 1.00 0.00 H new ATOM 0 H21 DG B 106 -4.545 -0.910 36.763 1.00 0.00 H new ATOM 0 H22 DG B 106 -3.372 -0.776 35.449 1.00 0.00 H new ATOM 1332 P DG B 107 -11.019 3.285 39.634 1.00 0.00 P ATOM 1333 OP1 DG B 107 -11.963 3.179 40.769 1.00 0.00 O ATOM 1334 OP2 DG B 107 -10.912 4.553 38.880 1.00 0.00 O ATOM 1335 O5' DG B 107 -9.551 2.887 40.162 1.00 0.00 O ATOM 1336 C5' DG B 107 -9.317 1.611 40.765 1.00 0.00 C ATOM 1337 C4' DG B 107 -7.859 1.442 41.175 1.00 0.00 C ATOM 1338 O4' DG B 107 -7.028 1.432 40.004 1.00 0.00 O ATOM 1339 C3' DG B 107 -7.327 2.552 42.050 1.00 0.00 C ATOM 1340 O3' DG B 107 -6.722 1.957 43.200 1.00 0.00 O ATOM 1341 C2' DG B 107 -6.309 3.383 41.307 1.00 0.00 C ATOM 1342 C1' DG B 107 -6.020 2.513 40.081 1.00 0.00 C ATOM 1343 N9 DG B 107 -6.041 3.264 38.812 1.00 0.00 N ATOM 1344 C8 DG B 107 -6.993 4.118 38.333 1.00 0.00 C ATOM 1345 N7 DG B 107 -6.734 4.640 37.172 1.00 0.00 N ATOM 1346 C5 DG B 107 -5.498 4.087 36.843 1.00 0.00 C ATOM 1347 C6 DG B 107 -4.694 4.277 35.686 1.00 0.00 C ATOM 1348 O6 DG B 107 -4.921 4.986 34.708 1.00 0.00 O ATOM 1349 N1 DG B 107 -3.523 3.532 35.751 1.00 0.00 N ATOM 1350 C2 DG B 107 -3.167 2.707 36.797 1.00 0.00 C ATOM 1351 N2 DG B 107 -2.000 2.072 36.677 1.00 0.00 N ATOM 1352 N3 DG B 107 -3.920 2.524 37.886 1.00 0.00 N ATOM 1353 C4 DG B 107 -5.066 3.243 37.842 1.00 0.00 C ATOM 0 H5' DG B 107 -9.593 0.822 40.066 1.00 0.00 H new ATOM 0 H5'' DG B 107 -9.957 1.499 41.640 1.00 0.00 H new ATOM 0 H4' DG B 107 -7.830 0.509 41.737 1.00 0.00 H new ATOM 0 H3' DG B 107 -8.144 3.211 42.343 1.00 0.00 H new ATOM 0 H2' DG B 107 -6.704 4.360 41.030 1.00 0.00 H new ATOM 0 H2'' DG B 107 -5.413 3.559 41.903 1.00 0.00 H new ATOM 0 H1' DG B 107 -5.012 2.117 40.208 1.00 0.00 H new ATOM 0 H8 DG B 107 -7.896 4.343 38.880 1.00 0.00 H new ATOM 0 H1 DG B 107 -2.877 3.601 34.965 1.00 0.00 H new ATOM 0 H21 DG B 107 -1.681 1.447 37.417 1.00 0.00 H new ATOM 0 H22 DG B 107 -1.427 2.211 35.845 1.00 0.00 H new ATOM 1365 P DC B 108 -6.073 2.879 44.351 1.00 0.00 P ATOM 1366 OP1 DC B 108 -6.228 2.181 45.646 1.00 0.00 O ATOM 1367 OP2 DC B 108 -6.591 4.256 44.187 1.00 0.00 O ATOM 1368 O5' DC B 108 -4.512 2.878 43.961 1.00 0.00 O ATOM 1369 C5' DC B 108 -3.784 1.649 43.877 1.00 0.00 C ATOM 1370 C4' DC B 108 -2.322 1.886 43.515 1.00 0.00 C ATOM 1371 O4' DC B 108 -2.236 2.415 42.183 1.00 0.00 O ATOM 1372 C3' DC B 108 -1.617 2.887 44.402 1.00 0.00 C ATOM 1373 O3' DC B 108 -0.412 2.283 44.877 1.00 0.00 O ATOM 1374 C2' DC B 108 -1.293 4.150 43.639 1.00 0.00 C ATOM 1375 C1' DC B 108 -1.531 3.716 42.190 1.00 0.00 C ATOM 1376 N1 DC B 108 -2.338 4.676 41.414 1.00 0.00 N ATOM 1377 C2 DC B 108 -1.837 5.090 40.191 1.00 0.00 C ATOM 1378 O2 DC B 108 -0.759 4.656 39.790 1.00 0.00 O ATOM 1379 N3 DC B 108 -2.566 5.977 39.461 1.00 0.00 N ATOM 1380 C4 DC B 108 -3.740 6.440 39.913 1.00 0.00 C ATOM 1381 N4 DC B 108 -4.428 7.309 39.173 1.00 0.00 N ATOM 1382 C5 DC B 108 -4.262 6.015 41.175 1.00 0.00 C ATOM 1383 C6 DC B 108 -3.532 5.137 41.890 1.00 0.00 C ATOM 0 H5' DC B 108 -4.244 1.003 43.129 1.00 0.00 H new ATOM 0 H5'' DC B 108 -3.843 1.125 44.831 1.00 0.00 H new ATOM 0 H4' DC B 108 -1.842 0.914 43.630 1.00 0.00 H new ATOM 0 H3' DC B 108 -2.265 3.160 45.235 1.00 0.00 H new ATOM 0 H2' DC B 108 -1.939 4.979 43.928 1.00 0.00 H new ATOM 0 H2'' DC B 108 -0.266 4.474 43.804 1.00 0.00 H new ATOM 0 H1' DC B 108 -0.549 3.654 41.720 1.00 0.00 H new ATOM 0 H41 DC B 108 -5.322 7.668 39.507 1.00 0.00 H new ATOM 0 H42 DC B 108 -4.060 7.615 38.272 1.00 0.00 H new ATOM 0 H5 DC B 108 -5.208 6.385 41.542 1.00 0.00 H new ATOM 0 H6 DC B 108 -3.894 4.795 42.848 1.00 0.00 H new HETATM 1395 P TED B 109 0.560 3.081 45.882 1.00 0.00 P HETATM 1396 N1 TED B 109 1.581 6.668 42.356 1.00 0.00 N HETATM 1397 C2 TED B 109 1.183 7.309 41.201 1.00 0.00 C HETATM 1398 O2 TED B 109 1.844 7.260 40.165 1.00 0.00 O HETATM 1399 N3 TED B 109 -0.002 8.014 41.277 1.00 0.00 N HETATM 1400 C4 TED B 109 -0.813 8.128 42.393 1.00 0.00 C HETATM 1401 O4 TED B 109 -1.851 8.783 42.348 1.00 0.00 O HETATM 1402 C5 TED B 109 -0.319 7.424 43.557 1.00 0.00 C HETATM 1403 C6 TED B 109 0.837 6.731 43.504 1.00 0.00 C HETATM 1404 C7 TED B 109 -1.103 7.467 44.843 1.00 0.00 C HETATM 1405 C8 ATED B 109 -1.522 8.633 45.326 0.33 0.00 C HETATM 1406 C8 BTED B 109 -0.582 8.045 45.921 0.33 0.00 C HETATM 1407 C8 CTED B 109 -0.474 7.615 46.002 0.33 0.00 C HETATM 1408 C9 ATED B 109 -2.267 8.681 46.593 0.33 0.00 C HETATM 1409 C9 BTED B 109 -1.335 8.064 47.185 0.33 0.00 C HETATM 1410 C9 CTED B 109 -1.241 7.661 47.257 0.33 0.00 C HETATM 1411 O9 ATED B 109 -1.844 9.340 47.524 0.33 0.00 O HETATM 1412 O9 BTED B 109 -0.758 7.873 48.238 0.33 0.00 O HETATM 1413 O9 CTED B 109 -2.038 8.558 47.450 0.33 0.00 O HETATM 1414 C1' TED B 109 2.845 5.911 42.313 1.00 0.00 C HETATM 1415 N10ATED B 109 -3.421 7.996 46.722 0.33 0.00 N HETATM 1416 N10BTED B 109 -2.663 8.294 47.176 0.33 0.00 N HETATM 1417 N10CTED B 109 -1.059 6.708 48.192 0.33 0.00 N HETATM 1418 C11ATED B 109 -4.168 8.050 47.981 0.33 0.00 C HETATM 1419 C11BTED B 109 -3.411 8.308 48.435 0.33 0.00 C HETATM 1420 C11CTED B 109 -1.821 6.756 49.443 0.33 0.00 C HETATM 1421 C12ATED B 109 -5.285 7.004 47.954 0.33 0.00 C HETATM 1422 C12BTED B 109 -4.699 7.498 48.273 0.33 0.00 C HETATM 1423 C12CTED B 109 -1.964 5.341 50.008 0.33 0.00 C HETATM 1424 N13ATED B 109 -4.730 5.687 48.272 0.33 0.00 N HETATM 1425 N13BTED B 109 -5.376 7.393 49.568 0.33 0.00 N HETATM 1426 N13CTED B 109 -2.446 5.413 51.389 0.33 0.00 N HETATM 1427 C2' TED B 109 3.744 6.157 43.528 1.00 0.00 C HETATM 1428 C3' TED B 109 4.194 4.758 43.876 1.00 0.00 C HETATM 1429 O3' TED B 109 5.559 4.579 43.490 1.00 0.00 O HETATM 1430 C4' TED B 109 3.363 3.728 43.147 1.00 0.00 C HETATM 1431 O4' TED B 109 2.564 4.462 42.206 1.00 0.00 O HETATM 1432 C5' TED B 109 2.455 2.901 44.051 1.00 0.00 C HETATM 1433 O5' TED B 109 1.642 3.733 44.884 1.00 0.00 O HETATM 1434 CY1ATED B 109 -3.851 4.023 49.874 0.33 0.00 C HETATM 1435 CY1BTED B 109 -5.619 6.420 51.828 0.33 0.00 C HETATM 1436 CY1CTED B 109 -3.031 4.371 53.548 0.33 0.00 C HETATM 1437 OY1ATED B 109 -4.618 6.201 50.454 0.33 0.00 O HETATM 1438 OY1BTED B 109 -3.927 5.820 50.256 0.33 0.00 O HETATM 1439 OY1CTED B 109 -2.222 3.192 51.640 0.33 0.00 O HETATM 1440 CY2ATED B 109 -2.129 4.951 53.787 0.33 0.00 C HETATM 1441 CY2BTED B 109 -5.934 2.240 51.787 0.33 0.00 C HETATM 1442 CY2CTED B 109 -4.045 0.840 54.076 0.33 0.00 C HETATM 1443 OY2ATED B 109 -2.912 6.749 52.429 0.33 0.00 O HETATM 1444 OY2BTED B 109 -5.118 3.445 49.894 0.33 0.00 O HETATM 1445 OY2CTED B 109 -3.151 0.674 51.870 0.33 0.00 O HETATM 1446 CY3ATED B 109 -3.615 3.372 54.713 0.33 0.00 C HETATM 1447 CY3BTED B 109 -4.694 2.027 53.781 0.33 0.00 C HETATM 1448 CY3CTED B 109 -2.535 -0.465 55.330 0.33 0.00 C HETATM 1449 OY3ATED B 109 -5.146 5.196 54.855 0.33 0.00 O HETATM 1450 OY3BTED B 109 -2.820 1.915 52.309 0.33 0.00 O HETATM 1451 OY3CTED B 109 -1.165 -0.691 53.390 0.33 0.00 O HETATM 1452 CY4ATED B 109 -5.783 3.039 50.800 0.33 0.00 C HETATM 1453 CY4BTED B 109 -3.768 6.560 53.280 0.33 0.00 C HETATM 1454 CY4CTED B 109 -0.973 3.882 54.588 0.33 0.00 C HETATM 1455 OY4ATED B 109 -6.477 3.941 52.897 0.33 0.00 O HETATM 1456 OY4BTED B 109 -2.262 4.712 53.181 0.33 0.00 O HETATM 1457 OY4CTED B 109 -0.042 1.697 54.810 0.33 0.00 O HETATM 1458 CY5ATED B 109 -4.422 5.373 49.546 0.33 0.00 C HETATM 1459 CY5BTED B 109 -4.919 6.532 50.500 0.33 0.00 C HETATM 1460 CY5CTED B 109 -2.540 4.291 52.130 0.33 0.00 C HETATM 1461 CY6ATED B 109 -1.983 5.960 52.678 0.33 0.00 C HETATM 1462 CY6BTED B 109 -6.111 3.093 50.556 0.33 0.00 C HETATM 1463 CY6CTED B 109 -3.816 0.128 52.768 0.33 0.00 C HETATM 1464 OY6ATED B 109 -0.962 6.003 52.032 0.33 0.00 O HETATM 1465 OY6BTED B 109 -7.219 3.436 50.212 0.33 0.00 O HETATM 1466 OY6CTED B 109 -4.279 -0.976 52.592 0.33 0.00 O HETATM 1467 CY7ATED B 109 -4.556 4.282 55.459 0.33 0.00 C HETATM 1468 CY7BTED B 109 -3.457 1.368 53.227 0.33 0.00 C HETATM 1469 CY7CTED B 109 -1.832 -1.268 54.266 0.33 0.00 C HETATM 1470 OY7ATED B 109 -4.738 4.124 56.644 0.33 0.00 O HETATM 1471 OY7BTED B 109 -3.083 0.309 53.676 0.33 0.00 O HETATM 1472 OY7CTED B 109 -1.918 -2.475 54.265 0.33 0.00 O HETATM 1473 CY8ATED B 109 -6.665 3.078 52.021 0.33 0.00 C HETATM 1474 CY8BTED B 109 -2.556 5.788 53.733 0.33 0.00 C HETATM 1475 CY8CTED B 109 -0.146 2.838 55.293 0.33 0.00 C HETATM 1476 OY8ATED B 109 -7.559 2.272 52.149 0.33 0.00 O HETATM 1477 OY8BTED B 109 -1.869 6.213 54.633 0.33 0.00 O HETATM 1478 OY8CTED B 109 0.415 3.110 56.329 0.33 0.00 O HETATM 1479 CYAATED B 109 -3.652 2.452 51.619 0.33 0.00 C HETATM 1480 CYABTED B 109 -5.603 5.190 53.839 0.33 0.00 C HETATM 1481 CYACTED B 109 -2.994 3.210 55.598 0.33 0.00 C HETATM 1482 NYAATED B 109 -4.458 3.580 51.137 0.33 0.00 N HETATM 1483 NYABTED B 109 -4.759 5.631 52.720 0.33 0.00 N HETATM 1484 NYACTED B 109 -2.309 3.340 54.305 0.33 0.00 N HETATM 1485 CYBATED B 109 -2.612 2.961 52.619 0.33 0.00 C HETATM 1486 CYBBTED B 109 -6.202 3.820 53.516 0.33 0.00 C HETATM 1487 CYBCTED B 109 -3.035 1.737 56.009 0.33 0.00 C HETATM 1488 NYBATED B 109 -3.210 4.012 53.454 0.33 0.00 N HETATM 1489 NYBBTED B 109 -5.206 3.004 52.809 0.33 0.00 N HETATM 1490 NYBCTED B 109 -2.786 0.894 54.831 0.33 0.00 N HETATM 1491 OP1 TED B 109 -0.215 4.177 46.505 1.00 0.00 O HETATM 1492 OP2 TED B 109 1.255 2.091 46.736 1.00 0.00 O HETATM 0 HYBAATED B 109 -2.261 2.140 53.244 0.33 0.00 H new HETATM 0 HYBABTED B 109 -6.511 3.321 54.434 0.33 0.00 H new HETATM 0 HYBACTED B 109 -2.285 1.541 56.775 0.33 0.00 H new HETATM 0 HYAAATED B 109 -4.293 1.708 52.092 0.33 0.00 H new HETATM 0 HYAABTED B 109 -5.013 5.134 54.754 0.33 0.00 H new HETATM 0 HYAACTED B 109 -2.475 3.796 56.357 0.33 0.00 H new HETATM 0 HY4AATED B 109 -5.689 2.015 50.439 0.33 0.00 H new HETATM 0 HY4ABTED B 109 -4.199 7.106 54.119 0.33 0.00 H new HETATM 0 HY4ACTED B 109 -1.055 4.775 55.207 0.33 0.00 H new HETATM 0 HY3AATED B 109 -2.738 3.159 55.324 0.33 0.00 H new HETATM 0 HY3ABTED B 109 -5.455 1.276 53.993 0.33 0.00 H new HETATM 0 HY3ACTED B 109 -3.476 -0.944 55.600 0.33 0.00 H new HETATM 0 HY2AATED B 109 -1.193 4.410 53.927 0.33 0.00 H new HETATM 0 HY2ABTED B 109 -6.906 1.931 52.172 0.33 0.00 H new HETATM 0 HY2ACTED B 109 -4.415 1.849 53.893 0.33 0.00 H new HETATM 0 HY1AATED B 109 -4.065 3.312 49.076 0.33 0.00 H new HETATM 0 HY1ABTED B 109 -5.802 7.409 52.249 0.33 0.00 H new HETATM 0 HY1ACTED B 109 -2.844 5.360 53.967 0.33 0.00 H new HETATM 0 HN13ATED B 109 -4.576 5.006 47.528 0.33 0.00 H new HETATM 0 HN13BTED B 109 -6.193 7.971 49.765 0.33 0.00 H new HETATM 0 HN13CTED B 109 -2.711 6.313 51.790 0.33 0.00 H new HETATM 0 HN10ATED B 109 -3.774 7.440 45.943 0.33 0.00 H new HETATM 0 HN10BTED B 109 -3.147 8.458 46.293 0.33 0.00 H new HETATM 0 HN10CTED B 109 -0.392 5.954 48.029 0.33 0.00 H new HETATM 0 H5'A TED B 109 1.817 2.262 43.440 1.00 0.00 H new HETATM 0 H2'A TED B 109 4.585 6.808 43.288 1.00 0.00 H new HETATM 0 H12AATED B 109 -6.061 7.267 48.673 0.33 0.00 H new HETATM 0 H12ABTED B 109 -5.354 7.978 47.546 0.33 0.00 H new HETATM 0 H12ACTED B 109 -2.659 4.763 49.399 0.33 0.00 H new HETATM 0 H11AATED B 109 -3.500 7.863 48.822 0.33 0.00 H new HETATM 0 H11ABTED B 109 -2.803 7.888 49.236 0.33 0.00 H new HETATM 0 H11ACTED B 109 -1.316 7.398 50.165 0.33 0.00 H new HETATM 0 HYBATED B 109 -1.743 3.352 52.089 0.33 0.00 H new HETATM 0 HYBBTED B 109 -7.094 3.937 52.901 0.33 0.00 H new HETATM 0 HYBCTED B 109 -4.005 1.496 56.444 0.33 0.00 H new HETATM 0 HYAATED B 109 -3.157 1.960 50.782 0.33 0.00 H new HETATM 0 HYABTED B 109 -6.398 5.914 54.016 0.33 0.00 H new HETATM 0 HYACTED B 109 -4.007 3.607 55.526 0.33 0.00 H new HETATM 0 HY4ATED B 109 -6.232 3.621 49.995 0.33 0.00 H new HETATM 0 HY4BTED B 109 -3.483 7.299 52.531 0.33 0.00 H new HETATM 0 HY4CTED B 109 -0.486 4.181 53.660 0.33 0.00 H new HETATM 0 HY3ATED B 109 -4.101 2.418 54.509 0.33 0.00 H new HETATM 0 HY3BTED B 109 -4.464 2.523 54.724 0.33 0.00 H new HETATM 0 HY3CTED B 109 -1.926 -0.426 56.233 0.33 0.00 H new HETATM 0 HY2ATED B 109 -2.349 5.457 54.727 0.33 0.00 H new HETATM 0 HY2BTED B 109 -5.386 1.331 51.538 0.33 0.00 H new HETATM 0 HY2CTED B 109 -4.808 0.321 54.656 0.33 0.00 H new HETATM 0 HY1ATED B 109 -2.767 4.078 49.969 0.33 0.00 H new HETATM 0 HY1BTED B 109 -6.590 5.940 51.709 0.33 0.00 H new HETATM 0 HY1CTED B 109 -4.107 4.203 53.595 0.33 0.00 H new HETATM 0 HN3 TED B 109 -0.308 8.496 40.432 1.00 0.00 H new HETATM 0 H8 ATED B 109 -1.313 9.554 44.782 0.33 0.00 H new HETATM 0 H8 BTED B 109 0.405 8.506 45.868 0.33 0.00 H new HETATM 0 H8 CTED B 109 0.612 7.703 46.024 0.33 0.00 H new HETATM 0 H7 ATED B 109 -1.326 6.543 45.377 0.33 0.00 H new HETATM 0 H7 BTED B 109 -2.098 7.024 44.890 0.33 0.00 H new HETATM 0 H7 CTED B 109 -2.189 7.376 44.821 0.33 0.00 H new HETATM 0 H6 TED B 109 1.187 6.209 44.395 1.00 0.00 H new HETATM 0 H5' TED B 109 3.062 2.244 44.674 1.00 0.00 H new HETATM 0 H4' TED B 109 4.032 3.005 42.680 1.00 0.00 H new HETATM 0 H3' TED B 109 4.077 4.627 44.952 1.00 0.00 H new HETATM 0 H2' TED B 109 3.201 6.627 44.348 1.00 0.00 H new HETATM 0 H12ATED B 109 -5.755 6.984 46.971 0.33 0.00 H new HETATM 0 H12BTED B 109 -4.470 6.504 47.889 0.33 0.00 H new HETATM 0 H12CTED B 109 -1.004 4.825 49.973 0.33 0.00 H new HETATM 0 H11ATED B 109 -4.590 9.045 48.124 0.33 0.00 H new HETATM 0 H11BTED B 109 -3.647 9.334 48.719 0.33 0.00 H new HETATM 0 H11CTED B 109 -2.805 7.189 49.265 0.33 0.00 H new HETATM 0 H1' TED B 109 3.384 6.268 41.435 1.00 0.00 H new ATOM 1562 P DC B 110 6.720 5.472 44.158 1.00 0.00 P ATOM 1563 OP1 DC B 110 7.972 4.683 44.156 1.00 0.00 O ATOM 1564 OP2 DC B 110 6.203 6.029 45.428 1.00 0.00 O ATOM 1565 O5' DC B 110 6.883 6.680 43.107 1.00 0.00 O ATOM 1566 C5' DC B 110 7.297 6.422 41.763 1.00 0.00 C ATOM 1567 C4' DC B 110 7.379 7.706 40.946 1.00 0.00 C ATOM 1568 O4' DC B 110 6.061 8.252 40.776 1.00 0.00 O ATOM 1569 C3' DC B 110 8.204 8.797 41.591 1.00 0.00 C ATOM 1570 O3' DC B 110 9.181 9.287 40.668 1.00 0.00 O ATOM 1571 C2' DC B 110 7.316 9.929 42.058 1.00 0.00 C ATOM 1572 C1' DC B 110 6.024 9.670 41.281 1.00 0.00 C ATOM 1573 N1 DC B 110 4.804 9.881 42.083 1.00 0.00 N ATOM 1574 C2 DC B 110 3.804 10.664 41.528 1.00 0.00 C ATOM 1575 O2 DC B 110 3.954 11.152 40.410 1.00 0.00 O ATOM 1576 N3 DC B 110 2.670 10.870 42.252 1.00 0.00 N ATOM 1577 C4 DC B 110 2.523 10.330 43.469 1.00 0.00 C ATOM 1578 N4 DC B 110 1.399 10.552 44.151 1.00 0.00 N ATOM 1579 C5 DC B 110 3.553 9.522 44.046 1.00 0.00 C ATOM 1580 C6 DC B 110 4.671 9.324 43.322 1.00 0.00 C ATOM 0 H5' DC B 110 6.596 5.734 41.291 1.00 0.00 H new ATOM 0 H5'' DC B 110 8.270 5.931 41.769 1.00 0.00 H new ATOM 0 H4' DC B 110 7.852 7.418 40.007 1.00 0.00 H new ATOM 0 H3' DC B 110 8.715 8.377 42.458 1.00 0.00 H new ATOM 0 H2' DC B 110 7.155 9.902 43.136 1.00 0.00 H new ATOM 0 H2'' DC B 110 7.743 10.904 41.824 1.00 0.00 H new ATOM 0 HO3' DC B 110 9.709 9.994 41.095 1.00 0.00 H new ATOM 0 H1' DC B 110 5.976 10.389 40.463 1.00 0.00 H new ATOM 0 H41 DC B 110 1.277 10.146 45.079 1.00 0.00 H new ATOM 0 H42 DC B 110 0.662 11.128 43.745 1.00 0.00 H new ATOM 0 H5 DC B 110 3.438 9.086 45.027 1.00 0.00 H new ATOM 0 H6 DC B 110 5.470 8.719 43.725 1.00 0.00 H new TER 1593 DC B 110 ATOM 1594 O5' DG C 111 -5.419 15.629 39.864 1.00 0.00 O ATOM 1595 C5' DG C 111 -5.244 16.837 39.122 1.00 0.00 C ATOM 1596 C4' DG C 111 -4.366 16.619 37.894 1.00 0.00 C ATOM 1597 O4' DG C 111 -3.019 16.342 38.309 1.00 0.00 O ATOM 1598 C3' DG C 111 -4.783 15.449 37.034 1.00 0.00 C ATOM 1599 O3' DG C 111 -4.743 15.869 35.668 1.00 0.00 O ATOM 1600 C2' DG C 111 -3.858 14.273 37.238 1.00 0.00 C ATOM 1601 C1' DG C 111 -2.726 14.894 38.062 1.00 0.00 C ATOM 1602 N9 DG C 111 -2.530 14.244 39.371 1.00 0.00 N ATOM 1603 C8 DG C 111 -3.412 14.110 40.405 1.00 0.00 C ATOM 1604 N7 DG C 111 -2.952 13.482 41.445 1.00 0.00 N ATOM 1605 C5 DG C 111 -1.645 13.168 41.076 1.00 0.00 C ATOM 1606 C6 DG C 111 -0.634 12.479 41.800 1.00 0.00 C ATOM 1607 O6 DG C 111 -0.697 12.002 42.930 1.00 0.00 O ATOM 1608 N1 DG C 111 0.538 12.375 41.064 1.00 0.00 N ATOM 1609 C2 DG C 111 0.720 12.870 39.789 1.00 0.00 C ATOM 1610 N2 DG C 111 1.920 12.671 39.244 1.00 0.00 N ATOM 1611 N3 DG C 111 -0.227 13.519 39.105 1.00 0.00 N ATOM 1612 C4 DG C 111 -1.378 13.631 39.806 1.00 0.00 C ATOM 0 H5' DG C 111 -4.794 17.596 39.762 1.00 0.00 H new ATOM 0 H5'' DG C 111 -6.217 17.218 38.812 1.00 0.00 H new ATOM 0 H4' DG C 111 -4.462 17.535 37.311 1.00 0.00 H new ATOM 0 H3' DG C 111 -5.789 15.131 37.310 1.00 0.00 H new ATOM 0 H2' DG C 111 -4.348 13.457 37.769 1.00 0.00 H new ATOM 0 H2'' DG C 111 -3.499 13.868 36.292 1.00 0.00 H new ATOM 0 HO5' DG C 111 -4.542 15.266 40.110 1.00 0.00 H new ATOM 0 H1' DG C 111 -1.816 14.757 37.478 1.00 0.00 H new ATOM 0 H8 DG C 111 -4.419 14.498 40.361 1.00 0.00 H new ATOM 0 H1 DG C 111 1.326 11.895 41.499 1.00 0.00 H new ATOM 0 H21 DG C 111 2.116 13.014 38.303 1.00 0.00 H new ATOM 0 H22 DG C 111 2.642 12.176 39.768 1.00 0.00 H new ATOM 1625 P DA C 112 -5.262 14.894 34.497 1.00 0.00 P ATOM 1626 OP1 DA C 112 -5.686 15.729 33.351 1.00 0.00 O ATOM 1627 OP2 DA C 112 -6.206 13.920 35.089 1.00 0.00 O ATOM 1628 O5' DA C 112 -3.921 14.105 34.078 1.00 0.00 O ATOM 1629 C5' DA C 112 -2.797 14.815 33.551 1.00 0.00 C ATOM 1630 C4' DA C 112 -1.646 13.873 33.218 1.00 0.00 C ATOM 1631 O4' DA C 112 -1.143 13.283 34.426 1.00 0.00 O ATOM 1632 C3' DA C 112 -2.029 12.718 32.323 1.00 0.00 C ATOM 1633 O3' DA C 112 -1.096 12.671 31.239 1.00 0.00 O ATOM 1634 C2' DA C 112 -1.996 11.413 33.084 1.00 0.00 C ATOM 1635 C1' DA C 112 -1.263 11.810 34.367 1.00 0.00 C ATOM 1636 N9 DA C 112 -1.942 11.357 35.597 1.00 0.00 N ATOM 1637 C8 DA C 112 -3.259 11.462 35.941 1.00 0.00 C ATOM 1638 N7 DA C 112 -3.565 10.963 37.102 1.00 0.00 N ATOM 1639 C5 DA C 112 -2.342 10.485 37.571 1.00 0.00 C ATOM 1640 C6 DA C 112 -1.968 9.837 38.754 1.00 0.00 C ATOM 1641 N6 DA C 112 -2.829 9.543 39.728 1.00 0.00 N ATOM 1642 N1 DA C 112 -0.673 9.504 38.894 1.00 0.00 N ATOM 1643 C2 DA C 112 0.202 9.790 37.930 1.00 0.00 C ATOM 1644 N3 DA C 112 -0.046 10.399 36.775 1.00 0.00 N ATOM 1645 C4 DA C 112 -1.350 10.722 36.662 1.00 0.00 C ATOM 0 H5' DA C 112 -2.463 15.558 34.275 1.00 0.00 H new ATOM 0 H5'' DA C 112 -3.096 15.357 32.654 1.00 0.00 H new ATOM 0 H4' DA C 112 -0.915 14.492 32.699 1.00 0.00 H new ATOM 0 H3' DA C 112 -3.044 12.862 31.952 1.00 0.00 H new ATOM 0 H2' DA C 112 -2.998 11.034 33.287 1.00 0.00 H new ATOM 0 H2'' DA C 112 -1.466 10.634 32.536 1.00 0.00 H new ATOM 0 H1' DA C 112 -0.289 11.322 34.328 1.00 0.00 H new ATOM 0 H8 DA C 112 -3.992 11.925 35.297 1.00 0.00 H new ATOM 0 H61 DA C 112 -2.503 9.069 40.571 1.00 0.00 H new ATOM 0 H62 DA C 112 -3.813 9.792 39.631 1.00 0.00 H new ATOM 0 H2 DA C 112 1.226 9.494 38.107 1.00 0.00 H new ATOM 1657 P DG C 113 -1.280 11.603 30.050 1.00 0.00 P ATOM 1658 OP1 DG C 113 -0.714 12.184 28.812 1.00 0.00 O ATOM 1659 OP2 DG C 113 -2.682 11.126 30.066 1.00 0.00 O ATOM 1660 O5' DG C 113 -0.331 10.390 30.517 1.00 0.00 O ATOM 1661 C5' DG C 113 1.079 10.583 30.652 1.00 0.00 C ATOM 1662 C4' DG C 113 1.777 9.312 31.124 1.00 0.00 C ATOM 1663 O4' DG C 113 1.366 9.007 32.466 1.00 0.00 O ATOM 1664 C3' DG C 113 1.451 8.085 30.304 1.00 0.00 C ATOM 1665 O3' DG C 113 2.684 7.471 29.920 1.00 0.00 O ATOM 1666 C2' DG C 113 0.620 7.109 31.102 1.00 0.00 C ATOM 1667 C1' DG C 113 0.762 7.656 32.525 1.00 0.00 C ATOM 1668 N9 DG C 113 -0.521 7.749 33.247 1.00 0.00 N ATOM 1669 C8 DG C 113 -1.715 8.256 32.820 1.00 0.00 C ATOM 1670 N7 DG C 113 -2.682 8.199 33.686 1.00 0.00 N ATOM 1671 C5 DG C 113 -2.083 7.599 34.792 1.00 0.00 C ATOM 1672 C6 DG C 113 -2.636 7.267 36.059 1.00 0.00 C ATOM 1673 O6 DG C 113 -3.785 7.443 36.458 1.00 0.00 O ATOM 1674 N1 DG C 113 -1.692 6.675 36.887 1.00 0.00 N ATOM 1675 C2 DG C 113 -0.379 6.430 36.544 1.00 0.00 C ATOM 1676 N2 DG C 113 0.377 5.851 37.478 1.00 0.00 N ATOM 1677 N3 DG C 113 0.145 6.740 35.355 1.00 0.00 N ATOM 1678 C4 DG C 113 -0.759 7.319 34.532 1.00 0.00 C ATOM 0 H5' DG C 113 1.270 11.389 31.361 1.00 0.00 H new ATOM 0 H5'' DG C 113 1.497 10.895 29.695 1.00 0.00 H new ATOM 0 H4' DG C 113 2.842 9.524 31.033 1.00 0.00 H new ATOM 0 H3' DG C 113 0.874 8.374 29.426 1.00 0.00 H new ATOM 0 H2' DG C 113 -0.419 7.094 30.773 1.00 0.00 H new ATOM 0 H2'' DG C 113 0.996 6.089 31.018 1.00 0.00 H new ATOM 0 H1' DG C 113 1.392 6.954 33.070 1.00 0.00 H new ATOM 0 H8 DG C 113 -1.846 8.674 31.833 1.00 0.00 H new ATOM 0 H1 DG C 113 -1.993 6.400 37.822 1.00 0.00 H new ATOM 0 H21 DG C 113 1.357 5.644 37.285 1.00 0.00 H new ATOM 0 H22 DG C 113 -0.025 5.615 38.385 1.00 0.00 H new ATOM 1690 P DC C 114 2.686 6.152 28.997 1.00 0.00 P ATOM 1691 OP1 DC C 114 3.924 6.154 28.188 1.00 0.00 O ATOM 1692 OP2 DC C 114 1.368 6.050 28.331 1.00 0.00 O ATOM 1693 O5' DC C 114 2.794 4.966 30.080 1.00 0.00 O ATOM 1694 C5' DC C 114 3.924 4.880 30.951 1.00 0.00 C ATOM 1695 C4' DC C 114 3.798 3.712 31.923 1.00 0.00 C ATOM 1696 O4' DC C 114 2.689 3.939 32.808 1.00 0.00 O ATOM 1697 C3' DC C 114 3.530 2.380 31.261 1.00 0.00 C ATOM 1698 O3' DC C 114 4.501 1.446 31.739 1.00 0.00 O ATOM 1699 C2' DC C 114 2.140 1.887 31.584 1.00 0.00 C ATOM 1700 C1' DC C 114 1.732 2.814 32.733 1.00 0.00 C ATOM 1701 N1 DC C 114 0.371 3.362 32.589 1.00 0.00 N ATOM 1702 C2 DC C 114 -0.477 3.260 33.680 1.00 0.00 C ATOM 1703 O2 DC C 114 -0.084 2.729 34.716 1.00 0.00 O ATOM 1704 N3 DC C 114 -1.739 3.759 33.566 1.00 0.00 N ATOM 1705 C4 DC C 114 -2.150 4.335 32.429 1.00 0.00 C ATOM 1706 N4 DC C 114 -3.392 4.813 32.351 1.00 0.00 N ATOM 1707 C5 DC C 114 -1.278 4.442 31.300 1.00 0.00 C ATOM 1708 C6 DC C 114 -0.032 3.945 31.423 1.00 0.00 C ATOM 0 H5' DC C 114 4.024 5.810 31.510 1.00 0.00 H new ATOM 0 H5'' DC C 114 4.832 4.765 30.359 1.00 0.00 H new ATOM 0 H4' DC C 114 4.760 3.665 32.433 1.00 0.00 H new ATOM 0 H3' DC C 114 3.600 2.488 30.179 1.00 0.00 H new ATOM 0 H2' DC C 114 1.468 1.975 30.731 1.00 0.00 H new ATOM 0 H2'' DC C 114 2.138 0.839 31.885 1.00 0.00 H new ATOM 0 H1' DC C 114 1.743 2.213 33.642 1.00 0.00 H new ATOM 0 H41 DC C 114 -3.716 5.254 31.490 1.00 0.00 H new ATOM 0 H42 DC C 114 -4.019 4.738 33.152 1.00 0.00 H new ATOM 0 H5 DC C 114 -1.607 4.905 30.381 1.00 0.00 H new ATOM 0 H6 DC C 114 0.654 4.009 30.591 1.00 0.00 H new HETATM 1720 N1 5CM C 115 0.017 -1.004 33.589 1.00 0.00 N HETATM 1721 C2 5CM C 115 -1.238 -0.607 34.022 1.00 0.00 C HETATM 1722 N3 5CM C 115 -2.096 -0.076 33.110 1.00 0.00 N HETATM 1723 C4 5CM C 115 -1.731 0.073 31.830 1.00 0.00 C HETATM 1724 C5 5CM C 115 -0.433 -0.333 31.382 1.00 0.00 C HETATM 1725 C5A 5CM C 115 -0.013 -0.173 29.925 1.00 0.00 C HETATM 1726 C6 5CM C 115 0.403 -0.859 32.288 1.00 0.00 C HETATM 1727 O2 5CM C 115 -1.552 -0.739 35.203 1.00 0.00 O HETATM 1728 N4 5CM C 115 -2.591 0.607 30.962 1.00 0.00 N HETATM 1729 C1' 5CM C 115 0.905 -1.642 34.578 1.00 0.00 C HETATM 1730 C2' 5CM C 115 1.469 -2.988 34.112 1.00 0.00 C HETATM 1731 C3' 5CM C 115 2.932 -2.852 34.459 1.00 0.00 C HETATM 1732 C4' 5CM C 115 3.272 -1.425 34.820 1.00 0.00 C HETATM 1733 O4' 5CM C 115 2.017 -0.729 34.888 1.00 0.00 O HETATM 1734 O3' 5CM C 115 3.242 -3.678 35.585 1.00 0.00 O HETATM 1735 C5' 5CM C 115 4.190 -0.727 33.822 1.00 0.00 C HETATM 1736 O5' 5CM C 115 3.677 -0.807 32.489 1.00 0.00 O HETATM 1737 P 5CM C 115 4.453 -0.094 31.272 1.00 0.00 P HETATM 1738 OP1 5CM C 115 3.601 -0.185 30.064 1.00 0.00 O HETATM 1739 OP2 5CM C 115 5.839 -0.612 31.239 1.00 0.00 O HETATM 0 HN42 5CM C 115 -2.323 0.725 29.985 1.00 0.00 H new HETATM 0 HN41 5CM C 115 -3.517 0.898 31.275 1.00 0.00 H new HETATM 0 H5A3 5CM C 115 -0.688 -0.744 29.287 1.00 0.00 H new HETATM 0 H5A2 5CM C 115 -0.055 0.880 29.648 1.00 0.00 H new HETATM 0 H5A1 5CM C 115 1.005 -0.541 29.797 1.00 0.00 H new HETATM 0 H5'' 5CM C 115 4.308 0.319 34.105 1.00 0.00 H new HETATM 0 H2'' 5CM C 115 1.003 -3.827 34.629 1.00 0.00 H new HETATM 0 H6 5CM C 115 1.401 -1.174 31.983 1.00 0.00 H new HETATM 0 H5' 5CM C 115 5.180 -1.181 33.859 1.00 0.00 H new HETATM 0 H4' 5CM C 115 3.824 -1.422 35.760 1.00 0.00 H new HETATM 0 H3' 5CM C 115 3.510 -3.156 33.586 1.00 0.00 H new HETATM 0 H2' 5CM C 115 1.316 -3.147 33.045 1.00 0.00 H new HETATM 0 H1' 5CM C 115 0.301 -1.844 35.463 1.00 0.00 H new ATOM 1753 P DG C 116 2.952 -5.261 35.544 1.00 0.00 P ATOM 1754 OP1 DG C 116 3.980 -5.943 36.360 1.00 0.00 O ATOM 1755 OP2 DG C 116 2.748 -5.657 34.132 1.00 0.00 O ATOM 1756 O5' DG C 116 1.540 -5.380 36.308 1.00 0.00 O ATOM 1757 C5' DG C 116 1.390 -4.873 37.637 1.00 0.00 C ATOM 1758 C4' DG C 116 -0.029 -5.074 38.158 1.00 0.00 C ATOM 1759 O4' DG C 116 -0.944 -4.288 37.377 1.00 0.00 O ATOM 1760 C3' DG C 116 -0.527 -6.498 38.068 1.00 0.00 C ATOM 1761 O3' DG C 116 -1.015 -6.877 39.356 1.00 0.00 O ATOM 1762 C2' DG C 116 -1.631 -6.619 37.044 1.00 0.00 C ATOM 1763 C1' DG C 116 -1.980 -5.153 36.776 1.00 0.00 C ATOM 1764 N9 DG C 116 -2.076 -4.827 35.340 1.00 0.00 N ATOM 1765 C8 DG C 116 -1.189 -5.095 34.336 1.00 0.00 C ATOM 1766 N7 DG C 116 -1.550 -4.684 33.157 1.00 0.00 N ATOM 1767 C5 DG C 116 -2.787 -4.087 33.393 1.00 0.00 C ATOM 1768 C6 DG C 116 -3.679 -3.453 32.486 1.00 0.00 C ATOM 1769 O6 DG C 116 -3.547 -3.292 31.273 1.00 0.00 O ATOM 1770 N1 DG C 116 -4.816 -2.986 33.132 1.00 0.00 N ATOM 1771 C2 DG C 116 -5.067 -3.112 34.482 1.00 0.00 C ATOM 1772 N2 DG C 116 -6.217 -2.596 34.918 1.00 0.00 N ATOM 1773 N3 DG C 116 -4.232 -3.708 35.338 1.00 0.00 N ATOM 1774 C4 DG C 116 -3.116 -4.170 34.727 1.00 0.00 C ATOM 0 H5' DG C 116 1.637 -3.811 37.652 1.00 0.00 H new ATOM 0 H5'' DG C 116 2.096 -5.374 38.300 1.00 0.00 H new ATOM 0 H4' DG C 116 0.011 -4.781 39.207 1.00 0.00 H new ATOM 0 H3' DG C 116 0.287 -7.152 37.757 1.00 0.00 H new ATOM 0 H2' DG C 116 -1.296 -7.130 36.141 1.00 0.00 H new ATOM 0 H2'' DG C 116 -2.484 -7.178 37.428 1.00 0.00 H new ATOM 0 H1' DG C 116 -2.961 -4.981 37.220 1.00 0.00 H new ATOM 0 H8 DG C 116 -0.256 -5.611 34.509 1.00 0.00 H new ATOM 0 H1 DG C 116 -5.520 -2.514 32.564 1.00 0.00 H new ATOM 0 H21 DG C 116 -6.461 -2.657 35.907 1.00 0.00 H new ATOM 0 H22 DG C 116 -6.852 -2.140 34.263 1.00 0.00 H new ATOM 1786 P DA C 117 -1.598 -8.357 39.607 1.00 0.00 P ATOM 1787 OP1 DA C 117 -1.298 -8.746 41.002 1.00 0.00 O ATOM 1788 OP2 DA C 117 -1.160 -9.222 38.489 1.00 0.00 O ATOM 1789 O5' DA C 117 -3.187 -8.134 39.477 1.00 0.00 O ATOM 1790 C5' DA C 117 -3.867 -7.231 40.353 1.00 0.00 C ATOM 1791 C4' DA C 117 -5.367 -7.203 40.076 1.00 0.00 C ATOM 1792 O4' DA C 117 -5.605 -6.641 38.776 1.00 0.00 O ATOM 1793 C3' DA C 117 -6.020 -8.564 40.061 1.00 0.00 C ATOM 1794 O3' DA C 117 -7.154 -8.519 40.931 1.00 0.00 O ATOM 1795 C2' DA C 117 -6.459 -8.938 38.667 1.00 0.00 C ATOM 1796 C1' DA C 117 -6.353 -7.599 37.930 1.00 0.00 C ATOM 1797 N9 DA C 117 -5.657 -7.696 36.634 1.00 0.00 N ATOM 1798 C8 DA C 117 -4.492 -8.339 36.327 1.00 0.00 C ATOM 1799 N7 DA C 117 -4.124 -8.248 35.084 1.00 0.00 N ATOM 1800 C5 DA C 117 -5.133 -7.475 34.513 1.00 0.00 C ATOM 1801 C6 DA C 117 -5.349 -7.007 33.212 1.00 0.00 C ATOM 1802 N6 DA C 117 -4.520 -7.260 32.199 1.00 0.00 N ATOM 1803 N1 DA C 117 -6.451 -6.269 32.994 1.00 0.00 N ATOM 1804 C2 DA C 117 -7.292 -6.004 33.994 1.00 0.00 C ATOM 1805 N3 DA C 117 -7.182 -6.398 35.259 1.00 0.00 N ATOM 1806 C4 DA C 117 -6.070 -7.136 35.448 1.00 0.00 C ATOM 0 H5' DA C 117 -3.456 -6.229 40.234 1.00 0.00 H new ATOM 0 H5'' DA C 117 -3.693 -7.526 41.388 1.00 0.00 H new ATOM 0 H4' DA C 117 -5.794 -6.617 40.890 1.00 0.00 H new ATOM 0 H3' DA C 117 -5.305 -9.316 40.396 1.00 0.00 H new ATOM 0 H2' DA C 117 -5.814 -9.698 38.226 1.00 0.00 H new ATOM 0 H2'' DA C 117 -7.475 -9.333 38.651 1.00 0.00 H new ATOM 0 H1' DA C 117 -7.374 -7.270 37.735 1.00 0.00 H new ATOM 0 H8 DA C 117 -3.919 -8.883 37.063 1.00 0.00 H new ATOM 0 H61 DA C 117 -4.725 -6.894 31.269 1.00 0.00 H new ATOM 0 H62 DA C 117 -3.681 -7.819 32.354 1.00 0.00 H new ATOM 0 H2 DA C 117 -8.156 -5.404 33.750 1.00 0.00 H new ATOM 1818 P DT C 118 -8.037 -9.839 41.191 1.00 0.00 P ATOM 1819 OP1 DT C 118 -8.631 -9.741 42.543 1.00 0.00 O ATOM 1820 OP2 DT C 118 -7.223 -11.020 40.826 1.00 0.00 O ATOM 1821 O5' DT C 118 -9.220 -9.688 40.110 1.00 0.00 O ATOM 1822 C5' DT C 118 -10.079 -8.546 40.127 1.00 0.00 C ATOM 1823 C4' DT C 118 -11.095 -8.591 38.990 1.00 0.00 C ATOM 1824 O4' DT C 118 -10.415 -8.475 37.731 1.00 0.00 O ATOM 1825 C3' DT C 118 -11.885 -9.877 38.917 1.00 0.00 C ATOM 1826 O3' DT C 118 -13.275 -9.541 38.888 1.00 0.00 O ATOM 1827 C2' DT C 118 -11.521 -10.662 37.679 1.00 0.00 C ATOM 1828 C1' DT C 118 -10.790 -9.611 36.838 1.00 0.00 C ATOM 1829 N1 DT C 118 -9.605 -10.142 36.138 1.00 0.00 N ATOM 1830 C2 DT C 118 -9.516 -9.912 34.778 1.00 0.00 C ATOM 1831 O2 DT C 118 -10.379 -9.292 34.161 1.00 0.00 O ATOM 1832 N3 DT C 118 -8.395 -10.424 34.150 1.00 0.00 N ATOM 1833 C4 DT C 118 -7.373 -11.133 34.757 1.00 0.00 C ATOM 1834 O4 DT C 118 -6.419 -11.544 34.099 1.00 0.00 O ATOM 1835 C5 DT C 118 -7.554 -11.323 36.179 1.00 0.00 C ATOM 1836 C7 DT C 118 -6.500 -12.089 36.972 1.00 0.00 C ATOM 1837 C6 DT C 118 -8.638 -10.834 36.814 1.00 0.00 C ATOM 0 H5' DT C 118 -9.481 -7.639 40.045 1.00 0.00 H new ATOM 0 H5'' DT C 118 -10.602 -8.498 41.082 1.00 0.00 H new ATOM 0 H4' DT C 118 -11.781 -7.768 39.190 1.00 0.00 H new ATOM 0 H3' DT C 118 -11.657 -10.497 39.784 1.00 0.00 H new ATOM 0 H2' DT C 118 -10.883 -11.515 37.910 1.00 0.00 H new ATOM 0 H2'' DT C 118 -12.402 -11.051 37.169 1.00 0.00 H new ATOM 0 H1' DT C 118 -11.466 -9.277 36.051 1.00 0.00 H new ATOM 0 H3 DT C 118 -8.314 -10.264 33.146 1.00 0.00 H new ATOM 0 H71 DT C 118 -6.472 -11.715 37.996 1.00 0.00 H new ATOM 0 H72 DT C 118 -6.750 -13.150 36.980 1.00 0.00 H new ATOM 0 H73 DT C 118 -5.523 -11.950 36.508 1.00 0.00 H new ATOM 0 H6 DT C 118 -8.745 -10.992 37.877 1.00 0.00 H new HETATM 1850 P TED C 119 -14.394 -10.698 38.855 1.00 0.00 P HETATM 1851 N1 TED C 119 -12.903 -12.252 34.174 1.00 0.00 N HETATM 1852 C2 TED C 119 -11.919 -12.299 33.206 1.00 0.00 C HETATM 1853 O2 TED C 119 -12.067 -11.790 32.098 1.00 0.00 O HETATM 1854 N3 TED C 119 -10.755 -12.955 33.559 1.00 0.00 N HETATM 1855 C4 TED C 119 -10.495 -13.558 34.777 1.00 0.00 C HETATM 1856 O4 TED C 119 -9.419 -14.115 34.982 1.00 0.00 O HETATM 1857 C5 TED C 119 -11.581 -13.460 35.729 1.00 0.00 C HETATM 1858 C6 TED C 119 -12.726 -12.824 35.405 1.00 0.00 C HETATM 1859 C7 TED C 119 -11.430 -14.076 37.096 1.00 0.00 C HETATM 1860 C8 ATED C 119 -10.894 -15.286 37.226 0.33 0.00 C HETATM 1861 C8 BTED C 119 -12.457 -14.710 37.657 0.33 0.00 C HETATM 1862 C8 CTED C 119 -10.808 -15.243 37.235 0.33 0.00 C HETATM 1863 C9 ATED C 119 -10.749 -15.888 38.560 0.33 0.00 C HETATM 1864 C9 BTED C 119 -12.313 -15.304 38.994 0.33 0.00 C HETATM 1865 C9 CTED C 119 -10.667 -15.848 38.569 0.33 0.00 C HETATM 1866 O9 ATED C 119 -9.653 -15.953 39.082 0.33 0.00 O HETATM 1867 O9 BTED C 119 -11.409 -14.946 39.725 0.33 0.00 O HETATM 1868 O9 CTED C 119 -11.068 -16.978 38.769 0.33 0.00 O HETATM 1869 C1' TED C 119 -14.159 -11.561 33.830 1.00 0.00 C HETATM 1870 N10ATED C 119 -11.832 -16.366 39.204 0.33 0.00 N HETATM 1871 N10BTED C 119 -13.182 -16.248 39.411 0.33 0.00 N HETATM 1872 N10CTED C 119 -10.094 -15.149 39.569 0.33 0.00 N HETATM 1873 C11ATED C 119 -11.688 -16.968 40.533 0.33 0.00 C HETATM 1874 C11BTED C 119 -13.035 -16.841 40.743 0.33 0.00 C HETATM 1875 C11CTED C 119 -9.950 -15.753 40.896 0.33 0.00 C HETATM 1876 C12ATED C 119 -11.951 -15.907 41.604 0.33 0.00 C HETATM 1877 C12BTED C 119 -14.104 -16.270 41.677 0.33 0.00 C HETATM 1878 C12CTED C 119 -10.492 -14.792 41.955 0.33 0.00 C HETATM 1879 N13ATED C 119 -11.976 -16.542 42.924 0.33 0.00 N HETATM 1880 N13BTED C 119 -15.360 -17.000 41.487 0.33 0.00 N HETATM 1881 N13CTED C 119 -10.957 -15.555 43.116 0.33 0.00 N HETATM 1882 C2' TED C 119 -15.414 -12.344 34.230 1.00 0.00 C HETATM 1883 C3' TED C 119 -16.277 -11.263 34.836 1.00 0.00 C HETATM 1884 O3' TED C 119 -17.336 -10.927 33.937 1.00 0.00 O HETATM 1885 C4' TED C 119 -15.472 -10.011 35.097 1.00 0.00 C HETATM 1886 O4' TED C 119 -14.197 -10.229 34.474 1.00 0.00 O HETATM 1887 C5' TED C 119 -15.270 -9.693 36.574 1.00 0.00 C HETATM 1888 O5' TED C 119 -14.734 -10.812 37.284 1.00 0.00 O HETATM 1889 CY1ATED C 119 -13.144 -17.922 44.642 0.33 0.00 C HETATM 1890 CY1BTED C 119 -17.650 -17.622 42.223 0.33 0.00 C HETATM 1891 CY1CTED C 119 -10.511 -16.910 45.149 0.33 0.00 C HETATM 1892 OY1ATED C 119 -14.039 -17.345 42.554 0.33 0.00 O HETATM 1893 OY1BTED C 119 -16.217 -16.122 43.367 0.33 0.00 O HETATM 1894 OY1CTED C 119 -8.845 -15.980 43.747 0.33 0.00 O HETATM 1895 CY2ATED C 119 -16.292 -15.285 42.582 0.33 0.00 C HETATM 1896 CY2BTED C 119 -18.285 -18.524 46.016 0.33 0.00 C HETATM 1897 CY2CTED C 119 -6.535 -19.182 46.588 0.33 0.00 C HETATM 1898 OY2ATED C 119 -17.023 -17.332 41.595 0.33 0.00 O HETATM 1899 OY2BTED C 119 -16.877 -16.621 46.317 0.33 0.00 O HETATM 1900 OY2CTED C 119 -6.788 -18.255 44.405 0.33 0.00 O HETATM 1901 CY3ATED C 119 -17.255 -16.307 44.475 0.33 0.00 C HETATM 1902 CY3BTED C 119 -20.189 -17.137 46.116 0.33 0.00 C HETATM 1903 CY3CTED C 119 -6.993 -17.619 48.293 0.33 0.00 C HETATM 1904 OY3ATED C 119 -18.124 -18.124 43.197 0.33 0.00 O HETATM 1905 OY3BTED C 119 -18.839 -15.252 46.677 0.33 0.00 O HETATM 1906 OY3CTED C 119 -5.767 -16.054 46.971 0.33 0.00 O HETATM 1907 CY4ATED C 119 -14.656 -18.539 46.343 0.33 0.00 C HETATM 1908 CY4BTED C 119 -19.128 -15.855 41.727 0.33 0.00 C HETATM 1909 CY4CTED C 119 -9.925 -15.424 46.882 0.33 0.00 C HETATM 1910 OY4ATED C 119 -15.450 -20.132 44.753 0.33 0.00 O HETATM 1911 OY4BTED C 119 -17.625 -14.314 42.757 0.33 0.00 O HETATM 1912 OY4CTED C 119 -8.404 -14.301 45.427 0.33 0.00 O HETATM 1913 CY5ATED C 119 -13.054 -17.253 43.308 0.33 0.00 C HETATM 1914 CY5BTED C 119 -16.358 -16.870 42.383 0.33 0.00 C HETATM 1915 CY5CTED C 119 -10.064 -16.122 43.951 0.33 0.00 C HETATM 1916 CY6ATED C 119 -17.042 -16.089 41.549 0.33 0.00 C HETATM 1917 CY6BTED C 119 -17.296 -17.693 46.791 0.33 0.00 C HETATM 1918 CY6CTED C 119 -6.493 -19.254 45.084 0.33 0.00 C HETATM 1919 OY6ATED C 119 -17.661 -15.524 40.677 0.33 0.00 O HETATM 1920 OY6BTED C 119 -16.908 -18.067 47.874 0.33 0.00 O HETATM 1921 OY6CTED C 119 -6.172 -20.285 44.536 0.33 0.00 O HETATM 1922 CY7ATED C 119 -17.744 -17.723 44.311 0.33 0.00 C HETATM 1923 CY7BTED C 119 -19.584 -16.159 47.089 0.33 0.00 C HETATM 1924 CY7CTED C 119 -5.861 -16.651 48.058 0.33 0.00 C HETATM 1925 OY7ATED C 119 -17.766 -18.469 45.263 0.33 0.00 O HETATM 1926 OY7BTED C 119 -19.821 -16.256 48.272 0.33 0.00 O HETATM 1927 OY7CTED C 119 -5.044 -16.455 48.929 0.33 0.00 O HETATM 1928 CY8ATED C 119 -14.969 -19.941 45.884 0.33 0.00 C HETATM 1929 CY8BTED C 119 -18.097 -14.756 41.693 0.33 0.00 C HETATM 1930 CY8CTED C 119 -9.529 -14.301 45.958 0.33 0.00 C HETATM 1931 OY8ATED C 119 -14.752 -20.879 46.615 0.33 0.00 O HETATM 1932 OY8BTED C 119 -17.730 -14.303 40.634 0.33 0.00 O HETATM 1933 OY8CTED C 119 -10.304 -13.400 45.734 0.33 0.00 O HETATM 1934 CYAATED C 119 -14.494 -16.286 45.671 0.33 0.00 C HETATM 1935 CYABTED C 119 -19.907 -17.751 42.890 0.33 0.00 C HETATM 1936 CYACTED C 119 -9.879 -17.751 47.258 0.33 0.00 C HETATM 1937 NYAATED C 119 -14.491 -17.668 45.172 0.33 0.00 N HETATM 1938 NYABTED C 119 -18.767 -16.834 42.761 0.33 0.00 N HETATM 1939 NYACTED C 119 -9.577 -16.712 46.265 0.33 0.00 N HETATM 1940 CYBATED C 119 -15.100 -15.362 44.614 0.33 0.00 C HETATM 1941 CYBBTED C 119 -19.816 -18.494 44.224 0.33 0.00 C HETATM 1942 CYBCTED C 119 -8.759 -18.793 47.263 0.33 0.00 C HETATM 1943 NYBATED C 119 -15.993 -16.137 43.741 0.33 0.00 N HETATM 1944 NYBBTED C 119 -19.143 -17.642 45.215 0.33 0.00 N HETATM 1945 NYBCTED C 119 -7.474 -18.130 47.001 0.33 0.00 N HETATM 1946 OP1 TED C 119 -13.762 -11.966 39.285 1.00 0.00 O HETATM 1947 OP2 TED C 119 -15.598 -10.199 39.554 1.00 0.00 O HETATM 0 HYBAATED C 119 -15.654 -14.555 45.095 0.33 0.00 H new HETATM 0 HYBABTED C 119 -20.814 -18.758 44.574 0.33 0.00 H new HETATM 0 HYBACTED C 119 -8.727 -19.304 48.225 0.33 0.00 H new HETATM 0 HYAAATED C 119 -15.068 -16.223 46.596 0.33 0.00 H new HETATM 0 HYAABTED C 119 -20.843 -17.195 42.835 0.33 0.00 H new HETATM 0 HYAACTED C 119 -9.980 -17.305 48.247 0.33 0.00 H new HETATM 0 HY4AATED C 119 -15.459 -18.165 46.978 0.33 0.00 H new HETATM 0 HY4ABTED C 119 -20.113 -15.438 41.935 0.33 0.00 H new HETATM 0 HY4ACTED C 119 -9.416 -15.318 47.840 0.33 0.00 H new HETATM 0 HY3AATED C 119 -18.003 -15.607 44.102 0.33 0.00 H new HETATM 0 HY3ABTED C 119 -20.650 -17.964 46.655 0.33 0.00 H new HETATM 0 HY3ACTED C 119 -6.656 -18.444 48.920 0.33 0.00 H new HETATM 0 HY2AATED C 119 -15.368 -14.896 42.155 0.33 0.00 H new HETATM 0 HY2ABTED C 119 -17.759 -19.224 45.367 0.33 0.00 H new HETATM 0 HY2ACTED C 119 -6.844 -20.143 47.000 0.33 0.00 H new HETATM 0 HY1AATED C 119 -12.965 -18.993 44.547 0.33 0.00 H new HETATM 0 HY1ABTED C 119 -17.824 -17.840 41.169 0.33 0.00 H new HETATM 0 HY1ACTED C 119 -11.513 -16.599 45.445 0.33 0.00 H new HETATM 0 HN13ATED C 119 -11.178 -16.446 43.552 0.33 0.00 H new HETATM 0 HN13BTED C 119 -15.479 -17.607 40.676 0.33 0.00 H new HETATM 0 HN13CTED C 119 -11.956 -15.657 43.292 0.33 0.00 H new HETATM 0 HN10ATED C 119 -12.752 -16.309 38.767 0.33 0.00 H new HETATM 0 HN10BTED C 119 -13.941 -16.549 38.799 0.33 0.00 H new HETATM 0 HN10CTED C 119 -9.761 -14.200 39.402 0.33 0.00 H new HETATM 0 H5'A TED C 119 -14.597 -8.841 36.675 1.00 0.00 H new HETATM 0 H2'A TED C 119 -15.892 -12.815 33.371 1.00 0.00 H new HETATM 0 H12AATED C 119 -11.175 -15.142 41.571 0.33 0.00 H new HETATM 0 H12ABTED C 119 -13.777 -16.351 42.714 0.33 0.00 H new HETATM 0 H12ACTED C 119 -9.715 -14.090 42.256 0.33 0.00 H new HETATM 0 H11AATED C 119 -12.387 -17.796 40.647 0.33 0.00 H new HETATM 0 H11ABTED C 119 -13.131 -17.925 40.683 0.33 0.00 H new HETATM 0 H11ACTED C 119 -10.490 -16.699 40.937 0.33 0.00 H new HETATM 0 HYBATED C 119 -14.309 -14.898 44.024 0.33 0.00 H new HETATM 0 HYBBTED C 119 -19.266 -19.426 44.096 0.33 0.00 H new HETATM 0 HYBCTED C 119 -8.950 -19.552 46.505 0.33 0.00 H new HETATM 0 HYAATED C 119 -13.477 -15.971 45.905 0.33 0.00 H new HETATM 0 HYABTED C 119 -19.910 -18.463 42.065 0.33 0.00 H new HETATM 0 HYACTED C 119 -10.832 -18.227 47.024 0.33 0.00 H new HETATM 0 HY4ATED C 119 -13.746 -18.536 46.944 0.33 0.00 H new HETATM 0 HY4BTED C 119 -19.187 -16.343 40.754 0.33 0.00 H new HETATM 0 HY4CTED C 119 -10.995 -15.383 47.084 0.33 0.00 H new HETATM 0 HY3ATED C 119 -17.107 -16.082 45.531 0.33 0.00 H new HETATM 0 HY3BTED C 119 -20.978 -16.653 45.540 0.33 0.00 H new HETATM 0 HY3CTED C 119 -7.805 -17.124 48.826 0.33 0.00 H new HETATM 0 HY2ATED C 119 -16.887 -14.426 42.892 0.33 0.00 H new HETATM 0 HY2BTED C 119 -18.892 -19.117 46.699 0.33 0.00 H new HETATM 0 HY2CTED C 119 -5.540 -18.971 46.981 0.33 0.00 H new HETATM 0 HY1ATED C 119 -12.385 -17.531 45.319 0.33 0.00 H new HETATM 0 HY1BTED C 119 -17.588 -18.579 42.741 0.33 0.00 H new HETATM 0 HY1CTED C 119 -10.568 -17.969 44.896 0.33 0.00 H new HETATM 0 HN3 TED C 119 -10.018 -12.999 32.855 1.00 0.00 H new HETATM 0 H8 ATED C 119 -10.562 -15.832 36.343 0.33 0.00 H new HETATM 0 H8 BTED C 119 -13.405 -14.789 37.125 0.33 0.00 H new HETATM 0 H8 CTED C 119 -10.402 -15.752 36.360 0.33 0.00 H new HETATM 0 H7 ATED C 119 -11.760 -13.529 37.979 0.33 0.00 H new HETATM 0 H7 BTED C 119 -10.480 -14.002 37.625 0.33 0.00 H new HETATM 0 H7 CTED C 119 -11.831 -13.565 37.971 0.33 0.00 H new HETATM 0 H6 TED C 119 -13.528 -12.764 36.140 1.00 0.00 H new HETATM 0 H5' TED C 119 -16.222 -9.402 37.018 1.00 0.00 H new HETATM 0 H4' TED C 119 -16.013 -9.155 34.695 1.00 0.00 H new HETATM 0 H3' TED C 119 -16.675 -11.644 35.776 1.00 0.00 H new HETATM 0 H2' TED C 119 -15.190 -13.136 34.944 1.00 0.00 H new HETATM 0 H12ATED C 119 -12.900 -15.407 41.411 0.33 0.00 H new HETATM 0 H12BTED C 119 -14.253 -15.210 41.472 0.33 0.00 H new HETATM 0 H12CTED C 119 -11.311 -14.203 41.542 0.33 0.00 H new HETATM 0 H11ATED C 119 -10.685 -17.379 40.651 0.33 0.00 H new HETATM 0 H11BTED C 119 -12.041 -16.631 41.139 0.33 0.00 H new HETATM 0 H11CTED C 119 -8.902 -15.976 41.094 0.33 0.00 H new HETATM 0 H1' TED C 119 -14.168 -11.468 32.744 1.00 0.00 H new ATOM 2017 P DC C 120 -18.431 -12.031 33.517 1.00 0.00 P ATOM 2018 OP1 DC C 120 -19.710 -11.335 33.246 1.00 0.00 O ATOM 2019 OP2 DC C 120 -18.384 -13.130 34.506 1.00 0.00 O ATOM 2020 O5' DC C 120 -17.854 -12.584 32.120 1.00 0.00 O ATOM 2021 C5' DC C 120 -17.715 -11.712 30.995 1.00 0.00 C ATOM 2022 C4' DC C 120 -17.228 -12.463 29.760 1.00 0.00 C ATOM 2023 O4' DC C 120 -15.881 -12.913 29.970 1.00 0.00 O ATOM 2024 C3' DC C 120 -18.030 -13.700 29.431 1.00 0.00 C ATOM 2025 O3' DC C 120 -18.407 -13.628 28.053 1.00 0.00 O ATOM 2026 C2' DC C 120 -17.220 -14.950 29.675 1.00 0.00 C ATOM 2027 C1' DC C 120 -15.799 -14.392 29.790 1.00 0.00 C ATOM 2028 N1 DC C 120 -15.033 -14.963 30.914 1.00 0.00 N ATOM 2029 C2 DC C 120 -13.770 -15.461 30.639 1.00 0.00 C ATOM 2030 O2 DC C 120 -13.326 -15.415 29.493 1.00 0.00 O ATOM 2031 N3 DC C 120 -13.049 -15.992 31.662 1.00 0.00 N ATOM 2032 C4 DC C 120 -13.547 -16.035 32.905 1.00 0.00 C ATOM 2033 N4 DC C 120 -12.813 -16.564 33.885 1.00 0.00 N ATOM 2034 C5 DC C 120 -14.850 -15.523 33.193 1.00 0.00 C ATOM 2035 C6 DC C 120 -15.557 -14.999 32.174 1.00 0.00 C ATOM 0 H5' DC C 120 -17.013 -10.914 31.237 1.00 0.00 H new ATOM 0 H5'' DC C 120 -18.673 -11.239 30.780 1.00 0.00 H new ATOM 0 H4' DC C 120 -17.326 -11.752 28.940 1.00 0.00 H new ATOM 0 H3' DC C 120 -18.911 -13.745 30.071 1.00 0.00 H new ATOM 0 H2' DC C 120 -17.530 -15.466 30.584 1.00 0.00 H new ATOM 0 H2'' DC C 120 -17.313 -15.663 28.856 1.00 0.00 H new ATOM 0 H1' DC C 120 -15.273 -14.664 28.875 1.00 0.00 H new ATOM 0 H41 DC C 120 -13.182 -16.602 34.835 1.00 0.00 H new ATOM 0 H42 DC C 120 -11.883 -16.931 33.684 1.00 0.00 H new ATOM 0 H5 DC C 120 -15.254 -15.555 34.194 1.00 0.00 H new ATOM 0 H6 DC C 120 -16.546 -14.604 32.355 1.00 0.00 H new ATOM 2047 P DC C 121 -19.362 -14.753 27.407 1.00 0.00 P ATOM 2048 OP1 DC C 121 -20.112 -14.136 26.290 1.00 0.00 O ATOM 2049 OP2 DC C 121 -20.091 -15.427 28.504 1.00 0.00 O ATOM 2050 O5' DC C 121 -18.304 -15.797 26.788 1.00 0.00 O ATOM 2051 C5' DC C 121 -17.430 -15.403 25.727 1.00 0.00 C ATOM 2052 C4' DC C 121 -16.479 -16.530 25.337 1.00 0.00 C ATOM 2053 O4' DC C 121 -15.577 -16.794 26.423 1.00 0.00 O ATOM 2054 C3' DC C 121 -17.165 -17.842 25.033 1.00 0.00 C ATOM 2055 O3' DC C 121 -17.038 -18.154 23.643 1.00 0.00 O ATOM 2056 C2' DC C 121 -16.580 -18.955 25.871 1.00 0.00 C ATOM 2057 C1' DC C 121 -15.447 -18.240 26.614 1.00 0.00 C ATOM 2058 N1 DC C 121 -15.443 -18.501 28.066 1.00 0.00 N ATOM 2059 C2 DC C 121 -14.280 -19.012 28.619 1.00 0.00 C ATOM 2060 O2 DC C 121 -13.304 -19.230 27.905 1.00 0.00 O ATOM 2061 N3 DC C 121 -14.256 -19.257 29.958 1.00 0.00 N ATOM 2062 C4 DC C 121 -15.329 -19.013 30.722 1.00 0.00 C ATOM 2063 N4 DC C 121 -15.271 -19.263 32.030 1.00 0.00 N ATOM 2064 C5 DC C 121 -16.532 -18.485 30.154 1.00 0.00 C ATOM 2065 C6 DC C 121 -16.545 -18.245 28.829 1.00 0.00 C ATOM 0 H5' DC C 121 -16.854 -14.530 26.034 1.00 0.00 H new ATOM 0 H5'' DC C 121 -18.020 -15.107 24.860 1.00 0.00 H new ATOM 0 H4' DC C 121 -15.978 -16.181 24.434 1.00 0.00 H new ATOM 0 H3' DC C 121 -18.222 -17.743 25.279 1.00 0.00 H new ATOM 0 H2' DC C 121 -17.314 -19.377 26.557 1.00 0.00 H new ATOM 0 H2'' DC C 121 -16.210 -19.776 25.257 1.00 0.00 H new ATOM 0 HO3' DC C 121 -17.484 -19.006 23.457 1.00 0.00 H new ATOM 0 H1' DC C 121 -14.517 -18.627 26.198 1.00 0.00 H new ATOM 0 H41 DC C 121 -16.082 -19.081 32.621 1.00 0.00 H new ATOM 0 H42 DC C 121 -14.415 -19.637 32.440 1.00 0.00 H new ATOM 0 H5 DC C 121 -17.399 -18.286 30.767 1.00 0.00 H new ATOM 0 H6 DC C 121 -17.436 -17.846 28.366 1.00 0.00 H new TER 2078 DC C 121 HETATM 2079 MN A MN C 301 -15.897 -18.413 43.195 1.00 0.00 MN HETATM 2080 MN B MN C 301 -17.964 -15.589 44.657 1.00 0.00 MN HETATM 2081 MN C MN C 301 -7.352 -16.323 45.378 1.00 0.00 MN HETATM 2082 MN A MN B 302 -4.740 5.470 52.565 1.00 0.00 MN HETATM 2083 MN B MN B 302 -3.604 3.961 51.457 1.00 0.00 MN HETATM 2084 MN C MN B 302 -1.451 1.591 52.997 1.00 0.00 MN