USER MOD reduce.3.24.130724 H: found=0, std=0, add=1015, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1013 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 20 HIS HE2 : A 20 HIS NE2 : A 83 ZNZN :(H bumps) USER MOD NoAdj-H: A 24 HIS HE2 : A 24 HIS NE2 : A 83 ZNZN :(H bumps) USER MOD NoAdj-H: A 48 HIS HE2 : A 48 HIS NE2 : A 84 ZNZN :(H bumps) USER MOD NoAdj-H: A 52 HIS HE2 : A 52 HIS NE2 : A 84 ZNZN :(H bumps) USER MOD NoAdj-H: A 76 HIS HE2 : A 76 HIS NE2 : A 85 ZNZN :(H bumps) USER MOD NoAdj-H: A 80 HIS HE2 : A 80 HIS NE2 : A 85 ZNZN :(H bumps) USER MOD Set 1.1: A 71 SER OG : rot 119:sc= -1.56! USER MOD Set 1.2: C 211 DT C7 :methyl 150:sc= -3.21! (180deg=-0.0736) USER MOD Set 2.1: A 58 HIS : no HD1:sc= -0.054 K(o=-0.049,f=0.79) USER MOD Set 2.2: A 70 SER OG : rot 179:sc= 0.0053 USER MOD Set 3.1: A 47 LYS NZ :NH3+ -178:sc= 0.376 (180deg=0) USER MOD Set 3.2: A 69 GLN : amide:sc= -1.86 K(o=-1.5,f=-6!) USER MOD Set 4.1: A 43 SER OG : rot -150:sc= 0 USER MOD Set 4.2: C 208 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Set 5.1: A 15 SER OG : rot -132:sc= -0.988 USER MOD Set 5.2: A 16 THR OG1 : rot 69:sc= -0.856 USER MOD Set 5.3: B 111 DT C7 :methyl 150:sc= -0.16 (180deg=0) USER MOD Single : A 1 SER N :NH3+ -115:sc= 0.108 (180deg=0) USER MOD Single : A 1 SER OG : rot 46:sc= 0.59 USER MOD Single : A 5 LYS NZ :NH3+ -165:sc= -0.0313 (180deg=-0.463) USER MOD Single : A 9 LYS NZ :NH3+ -154:sc= -0.203 (180deg=-1.45!) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ -139:sc= 0.403 (180deg=-0.151) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot -150:sc= -0.341 USER MOD Single : A 30 TYR OH : rot -66:sc= 0.0637 USER MOD Single : A 33 GLN : amide:sc= -1.63! C(o=-1.6!,f=-1.7!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 164:sc=-0.00208 (180deg=-0.123) USER MOD Single : A 40 HIS : no HD1:sc= -1.39! C(o=-1.4!,f=-11!) USER MOD Single : A 41 GLN : amide:sc= -1.14 K(o=-1.1,f=-4!) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 135:sc= 0.108 (180deg=-0.305) USER MOD Single : A 49 THR OG1 : rot -7:sc= -1.99 USER MOD Single : A 53 THR OG1 : rot -17:sc= -1.87! USER MOD Single : A 56 LYS NZ :NH3+ -97:sc= 0.0166 (180deg=-1.17) USER MOD Single : A 59 LYS NZ :NH3+ 135:sc= -0.119 (180deg=-0.752) USER MOD Single : A 61 GLN : amide:sc= -2.29! X(o=-2.3!,f=-2) USER MOD Single : A 65 LYS NZ :NH3+ -120:sc= -0.661 (180deg=-2.04) USER MOD Single : A 68 SER OG : rot 180:sc= -0.133 USER MOD Single : A 72 ASN : amide:sc= -0.389 K(o=-0.39,f=-3.9!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 161:sc= -0.0379 (180deg=-0.532) USER MOD Single : A 81 THR OG1 : rot -8:sc= -0.0873 USER MOD Single : B 101 DC O5' : rot 26:sc=0.000172 USER MOD Single : B 103 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 107 DT C7 :methyl -30:sc= -0.173 (180deg=-1.17) USER MOD Single : B 115 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 116 DA O3' : rot 180:sc= 0 USER MOD Single : C 201 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : C 201 DT O5' : rot 29:sc=0.000208 USER MOD Single : C 212 DT C7 :methyl 150:sc= -0.185 (180deg=-0.185) USER MOD Single : C 213 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : C 215 DT C7 :methyl 150:sc= -0.022 (180deg=-0.022) USER MOD Single : C 216 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -11.360 -9.420 39.688 1.00 1.51 N ATOM 2 CA SER A 1 -11.178 -8.624 38.442 1.00 1.28 C ATOM 3 C SER A 1 -12.263 -7.549 38.363 1.00 1.16 C ATOM 4 O SER A 1 -13.268 -7.614 39.045 1.00 1.37 O ATOM 5 CB SER A 1 -11.302 -9.555 37.228 1.00 1.39 C ATOM 6 OG SER A 1 -11.323 -8.782 36.035 1.00 2.19 O ATOM 0 H1 SER A 1 -10.545 -9.271 40.317 1.00 1.51 H new ATOM 0 H2 SER A 1 -12.230 -9.116 40.170 1.00 1.51 H new ATOM 0 H3 SER A 1 -11.432 -10.429 39.448 1.00 1.51 H new ATOM 0 HA SER A 1 -10.195 -8.152 38.449 1.00 1.28 H new ATOM 0 HB2 SER A 1 -10.466 -10.254 37.206 1.00 1.39 H new ATOM 0 HB3 SER A 1 -12.212 -10.150 37.304 1.00 1.39 H new ATOM 0 HG SER A 1 -10.620 -8.101 36.074 1.00 2.19 H new ATOM 14 N PHE A 2 -12.072 -6.571 37.513 1.00 0.92 N ATOM 15 CA PHE A 2 -13.092 -5.490 37.351 1.00 0.79 C ATOM 16 C PHE A 2 -13.708 -5.645 35.967 1.00 0.61 C ATOM 17 O PHE A 2 -12.998 -5.745 34.983 1.00 0.48 O ATOM 18 CB PHE A 2 -12.422 -4.112 37.489 1.00 0.76 C ATOM 19 CG PHE A 2 -11.295 -4.215 38.489 1.00 0.96 C ATOM 20 CD1 PHE A 2 -10.090 -4.805 38.104 1.00 1.06 C ATOM 21 CD2 PHE A 2 -11.455 -3.740 39.798 1.00 1.06 C ATOM 22 CE1 PHE A 2 -9.043 -4.931 39.018 1.00 1.26 C ATOM 23 CE2 PHE A 2 -10.403 -3.862 40.717 1.00 1.26 C ATOM 24 CZ PHE A 2 -9.196 -4.456 40.327 1.00 1.35 C ATOM 0 H PHE A 2 -11.247 -6.475 36.920 1.00 0.92 H new ATOM 0 HA PHE A 2 -13.862 -5.567 38.119 1.00 0.79 H new ATOM 0 HB2 PHE A 2 -12.040 -3.780 36.524 1.00 0.76 H new ATOM 0 HB3 PHE A 2 -13.150 -3.370 37.816 1.00 0.76 H new ATOM 0 HD1 PHE A 2 -9.967 -5.166 37.093 1.00 1.06 H new ATOM 0 HD2 PHE A 2 -12.386 -3.281 40.098 1.00 1.06 H new ATOM 0 HE1 PHE A 2 -8.115 -5.394 38.716 1.00 1.26 H new ATOM 0 HE2 PHE A 2 -10.524 -3.498 41.726 1.00 1.26 H new ATOM 0 HZ PHE A 2 -8.385 -4.548 41.034 1.00 1.35 H new ATOM 34 N ASP A 3 -15.017 -5.698 35.878 1.00 0.67 N ATOM 35 CA ASP A 3 -15.643 -5.876 34.551 1.00 0.59 C ATOM 36 C ASP A 3 -16.373 -4.605 34.116 1.00 0.60 C ATOM 37 O ASP A 3 -17.122 -3.999 34.852 1.00 0.74 O ATOM 38 CB ASP A 3 -16.583 -7.076 34.565 1.00 0.75 C ATOM 39 CG ASP A 3 -15.862 -8.271 35.200 1.00 1.01 C ATOM 40 OD1 ASP A 3 -14.945 -8.046 35.973 1.00 1.67 O ATOM 41 OD2 ASP A 3 -16.237 -9.392 34.900 1.00 1.38 O ATOM 0 H ASP A 3 -15.663 -5.626 36.664 1.00 0.67 H new ATOM 0 HA ASP A 3 -14.857 -6.069 33.821 1.00 0.59 H new ATOM 0 HB2 ASP A 3 -17.486 -6.840 35.128 1.00 0.75 H new ATOM 0 HB3 ASP A 3 -16.895 -7.321 33.550 1.00 0.75 H new ATOM 46 N CYS A 4 -16.117 -4.243 32.894 1.00 0.52 N ATOM 47 CA CYS A 4 -16.736 -3.019 32.293 1.00 0.60 C ATOM 48 C CYS A 4 -18.262 -3.158 32.209 1.00 0.82 C ATOM 49 O CYS A 4 -18.798 -4.143 31.735 1.00 0.92 O ATOM 50 CB CYS A 4 -16.196 -2.773 30.888 1.00 0.57 C ATOM 51 SG CYS A 4 -17.415 -1.813 29.943 1.00 0.77 S ATOM 0 H CYS A 4 -15.492 -4.751 32.268 1.00 0.52 H new ATOM 0 HA CYS A 4 -16.481 -2.179 32.939 1.00 0.60 H new ATOM 0 HB2 CYS A 4 -15.250 -2.234 30.938 1.00 0.57 H new ATOM 0 HB3 CYS A 4 -15.997 -3.722 30.390 1.00 0.57 H new ATOM 56 N LYS A 5 -18.962 -2.173 32.686 1.00 0.91 N ATOM 57 CA LYS A 5 -20.455 -2.229 32.647 1.00 1.13 C ATOM 58 C LYS A 5 -20.964 -1.329 31.528 1.00 1.20 C ATOM 59 O LYS A 5 -22.035 -0.753 31.630 1.00 1.37 O ATOM 60 CB LYS A 5 -21.022 -1.744 33.991 1.00 1.22 C ATOM 61 CG LYS A 5 -19.970 -1.942 35.080 1.00 1.43 C ATOM 62 CD LYS A 5 -20.433 -1.228 36.336 1.00 1.41 C ATOM 63 CE LYS A 5 -19.285 -1.138 37.340 1.00 1.74 C ATOM 64 NZ LYS A 5 -18.658 -2.479 37.510 1.00 2.46 N ATOM 0 H LYS A 5 -18.570 -1.329 33.103 1.00 0.91 H new ATOM 0 HA LYS A 5 -20.777 -3.255 32.467 1.00 1.13 H new ATOM 0 HB2 LYS A 5 -21.300 -0.692 33.924 1.00 1.22 H new ATOM 0 HB3 LYS A 5 -21.928 -2.298 34.238 1.00 1.22 H new ATOM 0 HG2 LYS A 5 -19.827 -3.004 35.279 1.00 1.43 H new ATOM 0 HG3 LYS A 5 -19.008 -1.547 34.753 1.00 1.43 H new ATOM 0 HD2 LYS A 5 -20.787 -0.228 36.086 1.00 1.41 H new ATOM 0 HD3 LYS A 5 -21.273 -1.762 36.779 1.00 1.41 H new ATOM 0 HE2 LYS A 5 -18.542 -0.420 36.993 1.00 1.74 H new ATOM 0 HE3 LYS A 5 -19.656 -0.775 38.299 1.00 1.74 H new ATOM 0 HZ1 LYS A 5 -18.060 -2.477 38.361 1.00 2.46 H new ATOM 0 HZ2 LYS A 5 -19.401 -3.200 37.610 1.00 2.46 H new ATOM 0 HZ3 LYS A 5 -18.074 -2.697 36.677 1.00 2.46 H new ATOM 78 N ILE A 6 -20.198 -1.179 30.476 1.00 1.10 N ATOM 79 CA ILE A 6 -20.632 -0.284 29.367 1.00 1.22 C ATOM 80 C ILE A 6 -20.722 -1.041 28.065 1.00 1.32 C ATOM 81 O ILE A 6 -21.509 -0.697 27.192 1.00 1.51 O ATOM 82 CB ILE A 6 -19.604 0.817 29.208 1.00 1.11 C ATOM 83 CG1 ILE A 6 -19.510 1.600 30.525 1.00 1.04 C ATOM 84 CG2 ILE A 6 -20.003 1.716 28.037 1.00 1.30 C ATOM 85 CD1 ILE A 6 -18.602 2.829 30.367 1.00 0.94 C ATOM 0 H ILE A 6 -19.296 -1.636 30.340 1.00 1.10 H new ATOM 0 HA ILE A 6 -21.615 0.121 29.608 1.00 1.22 H new ATOM 0 HB ILE A 6 -18.621 0.402 28.987 1.00 1.11 H new ATOM 0 HG12 ILE A 6 -20.505 1.916 30.837 1.00 1.04 H new ATOM 0 HG13 ILE A 6 -19.120 0.953 31.311 1.00 1.04 H new ATOM 0 HG21 ILE A 6 -19.265 2.510 27.920 1.00 1.30 H new ATOM 0 HG22 ILE A 6 -20.048 1.124 27.123 1.00 1.30 H new ATOM 0 HG23 ILE A 6 -20.981 2.156 28.233 1.00 1.30 H new ATOM 0 HD11 ILE A 6 -18.551 3.368 31.313 1.00 0.94 H new ATOM 0 HD12 ILE A 6 -17.601 2.507 30.078 1.00 0.94 H new ATOM 0 HD13 ILE A 6 -19.008 3.485 29.597 1.00 0.94 H new ATOM 97 N CYS A 7 -19.929 -2.054 27.895 1.00 1.22 N ATOM 98 CA CYS A 7 -19.985 -2.801 26.623 1.00 1.35 C ATOM 99 C CYS A 7 -19.802 -4.286 26.890 1.00 1.35 C ATOM 100 O CYS A 7 -20.304 -5.106 26.156 1.00 1.50 O ATOM 101 CB CYS A 7 -18.888 -2.298 25.697 1.00 1.31 C ATOM 102 SG CYS A 7 -17.252 -2.829 26.297 1.00 1.05 S ATOM 0 H CYS A 7 -19.251 -2.393 28.577 1.00 1.22 H new ATOM 0 HA CYS A 7 -20.955 -2.646 26.150 1.00 1.35 H new ATOM 0 HB2 CYS A 7 -19.053 -2.678 24.689 1.00 1.31 H new ATOM 0 HB3 CYS A 7 -18.925 -1.210 25.638 1.00 1.31 H new ATOM 107 N GLY A 8 -19.109 -4.647 27.945 1.00 1.25 N ATOM 108 CA GLY A 8 -18.941 -6.103 28.254 1.00 1.27 C ATOM 109 C GLY A 8 -17.502 -6.618 28.088 1.00 1.07 C ATOM 110 O GLY A 8 -17.259 -7.535 27.336 1.00 1.10 O ATOM 0 H GLY A 8 -18.658 -4.006 28.597 1.00 1.25 H new ATOM 0 HA2 GLY A 8 -19.265 -6.286 29.279 1.00 1.27 H new ATOM 0 HA3 GLY A 8 -19.599 -6.680 27.604 1.00 1.27 H new ATOM 114 N LYS A 9 -16.562 -6.104 28.832 1.00 0.93 N ATOM 115 CA LYS A 9 -15.173 -6.658 28.760 1.00 0.77 C ATOM 116 C LYS A 9 -14.582 -6.631 30.178 1.00 0.58 C ATOM 117 O LYS A 9 -14.986 -5.839 31.007 1.00 0.61 O ATOM 118 CB LYS A 9 -14.297 -5.893 27.759 1.00 0.77 C ATOM 119 CG LYS A 9 -12.988 -6.660 27.609 1.00 1.00 C ATOM 120 CD LYS A 9 -12.186 -6.118 26.430 1.00 1.08 C ATOM 121 CE LYS A 9 -10.818 -6.799 26.399 1.00 1.21 C ATOM 122 NZ LYS A 9 -10.167 -6.627 27.724 1.00 1.33 N ATOM 0 H LYS A 9 -16.690 -5.330 29.484 1.00 0.93 H new ATOM 0 HA LYS A 9 -15.205 -7.683 28.391 1.00 0.77 H new ATOM 0 HB2 LYS A 9 -14.802 -5.806 26.797 1.00 0.77 H new ATOM 0 HB3 LYS A 9 -14.108 -4.879 28.112 1.00 0.77 H new ATOM 0 HG2 LYS A 9 -12.403 -6.576 28.525 1.00 1.00 H new ATOM 0 HG3 LYS A 9 -13.195 -7.720 27.460 1.00 1.00 H new ATOM 0 HD2 LYS A 9 -12.719 -6.302 25.497 1.00 1.08 H new ATOM 0 HD3 LYS A 9 -12.066 -5.038 26.521 1.00 1.08 H new ATOM 0 HE2 LYS A 9 -10.929 -7.858 26.168 1.00 1.21 H new ATOM 0 HE3 LYS A 9 -10.198 -6.365 25.615 1.00 1.21 H new ATOM 0 HZ1 LYS A 9 -9.134 -6.670 27.611 1.00 1.33 H new ATOM 0 HZ2 LYS A 9 -10.434 -5.705 28.125 1.00 1.33 H new ATOM 0 HZ3 LYS A 9 -10.477 -7.386 28.364 1.00 1.33 H new ATOM 136 N SER A 10 -13.681 -7.537 30.496 1.00 0.45 N ATOM 137 CA SER A 10 -13.149 -7.580 31.904 1.00 0.34 C ATOM 138 C SER A 10 -11.689 -7.120 31.978 1.00 0.22 C ATOM 139 O SER A 10 -10.965 -7.104 30.999 1.00 0.33 O ATOM 140 CB SER A 10 -13.282 -8.999 32.493 0.50 0.47 C ATOM 141 OG SER A 10 -12.945 -9.963 31.504 1.00 0.80 O ATOM 0 H SER A 10 -13.297 -8.235 29.858 1.00 0.45 H new ATOM 0 HA SER A 10 -13.749 -6.888 32.495 1.00 0.34 H new ATOM 0 HB2 SER A 10 -12.627 -9.107 33.358 0.50 0.47 H new ATOM 0 HB3 SER A 10 -14.301 -9.164 32.843 0.50 0.47 H new ATOM 0 HG SER A 10 -13.029 -10.863 31.882 1.00 0.80 H new ATOM 147 N PHE A 11 -11.286 -6.713 33.167 1.00 0.27 N ATOM 148 CA PHE A 11 -9.892 -6.201 33.395 1.00 0.40 C ATOM 149 C PHE A 11 -9.300 -6.759 34.685 1.00 0.61 C ATOM 150 O PHE A 11 -9.892 -6.685 35.747 1.00 0.70 O ATOM 151 CB PHE A 11 -9.946 -4.675 33.463 1.00 0.42 C ATOM 152 CG PHE A 11 -10.643 -4.230 32.220 1.00 0.30 C ATOM 153 CD1 PHE A 11 -9.921 -4.091 31.036 1.00 0.42 C ATOM 154 CD2 PHE A 11 -12.023 -4.029 32.233 1.00 0.23 C ATOM 155 CE1 PHE A 11 -10.585 -3.750 29.857 1.00 0.53 C ATOM 156 CE2 PHE A 11 -12.684 -3.709 31.056 1.00 0.36 C ATOM 157 CZ PHE A 11 -11.968 -3.562 29.869 1.00 0.52 C ATOM 0 H PHE A 11 -11.875 -6.715 33.999 1.00 0.27 H new ATOM 0 HA PHE A 11 -9.253 -6.525 32.574 1.00 0.40 H new ATOM 0 HB2 PHE A 11 -10.483 -4.343 34.351 1.00 0.42 H new ATOM 0 HB3 PHE A 11 -8.943 -4.252 33.520 1.00 0.42 H new ATOM 0 HD1 PHE A 11 -8.852 -4.247 31.031 1.00 0.42 H new ATOM 0 HD2 PHE A 11 -12.575 -4.122 33.156 1.00 0.23 H new ATOM 0 HE1 PHE A 11 -10.030 -3.632 28.938 1.00 0.53 H new ATOM 0 HE2 PHE A 11 -13.755 -3.574 31.059 1.00 0.36 H new ATOM 0 HZ PHE A 11 -12.484 -3.302 28.957 1.00 0.52 H new ATOM 167 N LYS A 12 -8.114 -7.321 34.567 1.00 0.77 N ATOM 168 CA LYS A 12 -7.428 -7.892 35.731 1.00 0.99 C ATOM 169 C LYS A 12 -6.985 -6.758 36.651 1.00 1.07 C ATOM 170 O LYS A 12 -6.706 -6.976 37.807 1.00 1.21 O ATOM 171 CB LYS A 12 -6.175 -8.652 35.263 1.00 1.16 C ATOM 172 CG LYS A 12 -6.527 -9.679 34.173 1.00 1.23 C ATOM 173 CD LYS A 12 -5.973 -9.223 32.818 1.00 1.67 C ATOM 174 CE LYS A 12 -6.708 -9.958 31.697 1.00 1.86 C ATOM 175 NZ LYS A 12 -8.056 -9.350 31.523 1.00 2.61 N ATOM 0 H LYS A 12 -7.601 -7.399 33.689 1.00 0.77 H new ATOM 0 HA LYS A 12 -8.103 -8.568 36.255 1.00 0.99 H new ATOM 0 HB2 LYS A 12 -5.440 -7.946 34.878 1.00 1.16 H new ATOM 0 HB3 LYS A 12 -5.716 -9.160 36.111 1.00 1.16 H new ATOM 0 HG2 LYS A 12 -6.114 -10.653 34.434 1.00 1.23 H new ATOM 0 HG3 LYS A 12 -7.609 -9.798 34.111 1.00 1.23 H new ATOM 0 HD2 LYS A 12 -6.098 -8.146 32.705 1.00 1.67 H new ATOM 0 HD3 LYS A 12 -4.904 -9.427 32.762 1.00 1.67 H new ATOM 0 HE2 LYS A 12 -6.142 -9.891 30.768 1.00 1.86 H new ATOM 0 HE3 LYS A 12 -6.801 -11.017 31.938 1.00 1.86 H new ATOM 0 HZ1 LYS A 12 -8.758 -10.101 31.368 1.00 2.61 H new ATOM 0 HZ2 LYS A 12 -8.307 -8.812 32.377 1.00 2.61 H new ATOM 0 HZ3 LYS A 12 -8.045 -8.711 30.702 1.00 2.61 H new ATOM 189 N ARG A 13 -6.871 -5.555 36.128 1.00 1.04 N ATOM 190 CA ARG A 13 -6.396 -4.424 36.964 1.00 1.13 C ATOM 191 C ARG A 13 -7.376 -3.252 36.864 1.00 1.00 C ATOM 192 O ARG A 13 -7.894 -2.929 35.810 1.00 0.84 O ATOM 193 CB ARG A 13 -5.010 -3.968 36.465 1.00 1.24 C ATOM 194 CG ARG A 13 -3.912 -4.518 37.393 1.00 1.37 C ATOM 195 CD ARG A 13 -3.645 -3.525 38.529 1.00 1.48 C ATOM 196 NE ARG A 13 -4.754 -3.599 39.527 1.00 1.63 N ATOM 197 CZ ARG A 13 -5.133 -2.531 40.179 1.00 1.65 C ATOM 198 NH1 ARG A 13 -4.539 -1.387 39.969 1.00 1.64 N ATOM 199 NH2 ARG A 13 -6.105 -2.610 41.046 1.00 2.04 N ATOM 0 H ARG A 13 -7.088 -5.318 35.160 1.00 1.04 H new ATOM 0 HA ARG A 13 -6.329 -4.750 38.002 1.00 1.13 H new ATOM 0 HB2 ARG A 13 -4.847 -4.319 35.446 1.00 1.24 H new ATOM 0 HB3 ARG A 13 -4.964 -2.879 36.438 1.00 1.24 H new ATOM 0 HG2 ARG A 13 -4.219 -5.480 37.804 1.00 1.37 H new ATOM 0 HG3 ARG A 13 -2.997 -4.690 36.826 1.00 1.37 H new ATOM 0 HD2 ARG A 13 -2.694 -3.753 39.009 1.00 1.48 H new ATOM 0 HD3 ARG A 13 -3.567 -2.513 38.131 1.00 1.48 H new ATOM 0 HE ARG A 13 -5.219 -4.490 39.701 1.00 1.63 H new ATOM 0 HH11 ARG A 13 -3.777 -1.325 39.294 1.00 1.64 H new ATOM 0 HH12 ARG A 13 -4.838 -0.556 40.480 1.00 1.64 H new ATOM 0 HH21 ARG A 13 -6.567 -3.504 41.214 1.00 2.04 H new ATOM 0 HH22 ARG A 13 -6.402 -1.778 41.556 1.00 2.04 H new ATOM 213 N SER A 14 -7.617 -2.587 37.942 1.00 1.08 N ATOM 214 CA SER A 14 -8.530 -1.418 37.867 1.00 0.98 C ATOM 215 C SER A 14 -7.928 -0.435 36.884 1.00 0.93 C ATOM 216 O SER A 14 -8.635 0.279 36.205 1.00 0.81 O ATOM 217 CB SER A 14 -8.661 -0.748 39.234 1.00 1.14 C ATOM 218 OG SER A 14 -9.557 0.354 39.140 1.00 1.27 O ATOM 0 H SER A 14 -7.231 -2.792 38.864 1.00 1.08 H new ATOM 0 HA SER A 14 -9.522 -1.740 37.550 1.00 0.98 H new ATOM 0 HB2 SER A 14 -9.026 -1.465 39.969 1.00 1.14 H new ATOM 0 HB3 SER A 14 -7.685 -0.408 39.579 1.00 1.14 H new ATOM 0 HG SER A 14 -9.642 0.782 40.017 1.00 1.27 H new ATOM 224 N SER A 15 -6.613 -0.369 36.826 1.00 1.07 N ATOM 225 CA SER A 15 -5.963 0.595 35.916 1.00 1.09 C ATOM 226 C SER A 15 -6.351 0.276 34.477 1.00 0.96 C ATOM 227 O SER A 15 -6.802 1.130 33.739 1.00 0.95 O ATOM 228 CB SER A 15 -4.447 0.492 36.061 1.00 1.31 C ATOM 229 OG SER A 15 -4.049 -0.849 35.795 1.00 1.48 O ATOM 0 H SER A 15 -5.976 -0.947 37.375 1.00 1.07 H new ATOM 0 HA SER A 15 -6.287 1.605 36.169 1.00 1.09 H new ATOM 0 HB2 SER A 15 -3.955 1.176 35.369 1.00 1.31 H new ATOM 0 HB3 SER A 15 -4.144 0.783 37.067 1.00 1.31 H new ATOM 0 HG SER A 15 -3.440 -1.155 36.499 1.00 1.48 H new ATOM 235 N THR A 16 -6.178 -0.953 34.069 1.00 0.90 N ATOM 236 CA THR A 16 -6.530 -1.341 32.678 1.00 0.80 C ATOM 237 C THR A 16 -8.007 -1.032 32.457 1.00 0.60 C ATOM 238 O THR A 16 -8.411 -0.594 31.394 1.00 0.59 O ATOM 239 CB THR A 16 -6.251 -2.834 32.520 1.00 0.78 C ATOM 240 OG1 THR A 16 -5.834 -3.363 33.769 1.00 0.95 O ATOM 241 CG2 THR A 16 -5.155 -3.054 31.487 1.00 0.81 C ATOM 0 H THR A 16 -5.805 -1.707 34.646 1.00 0.90 H new ATOM 0 HA THR A 16 -5.943 -0.791 31.943 1.00 0.80 H new ATOM 0 HB THR A 16 -7.159 -3.337 32.187 1.00 0.78 H new ATOM 0 HG1 THR A 16 -6.587 -3.353 34.396 1.00 0.95 H new ATOM 0 HG21 THR A 16 -4.963 -4.122 31.382 1.00 0.81 H new ATOM 0 HG22 THR A 16 -5.472 -2.646 30.527 1.00 0.81 H new ATOM 0 HG23 THR A 16 -4.243 -2.552 31.811 1.00 0.81 H new ATOM 249 N LEU A 17 -8.815 -1.216 33.464 1.00 0.51 N ATOM 250 CA LEU A 17 -10.252 -0.883 33.319 1.00 0.35 C ATOM 251 C LEU A 17 -10.354 0.632 33.230 1.00 0.36 C ATOM 252 O LEU A 17 -11.125 1.161 32.463 1.00 0.33 O ATOM 253 CB LEU A 17 -11.040 -1.398 34.536 1.00 0.41 C ATOM 254 CG LEU A 17 -12.399 -0.695 34.652 1.00 0.42 C ATOM 255 CD1 LEU A 17 -13.257 -1.007 33.423 1.00 0.38 C ATOM 256 CD2 LEU A 17 -13.117 -1.206 35.904 1.00 0.62 C ATOM 0 H LEU A 17 -8.540 -1.581 34.376 1.00 0.51 H new ATOM 0 HA LEU A 17 -10.671 -1.351 32.428 1.00 0.35 H new ATOM 0 HB2 LEU A 17 -11.190 -2.474 34.447 1.00 0.41 H new ATOM 0 HB3 LEU A 17 -10.462 -1.231 35.445 1.00 0.41 H new ATOM 0 HG LEU A 17 -12.244 0.382 34.718 1.00 0.42 H new ATOM 0 HD11 LEU A 17 -14.220 -0.504 33.514 1.00 0.38 H new ATOM 0 HD12 LEU A 17 -12.748 -0.656 32.525 1.00 0.38 H new ATOM 0 HD13 LEU A 17 -13.415 -2.083 33.353 1.00 0.38 H new ATOM 0 HD21 LEU A 17 -14.084 -0.712 35.996 1.00 0.62 H new ATOM 0 HD22 LEU A 17 -13.265 -2.283 35.824 1.00 0.62 H new ATOM 0 HD23 LEU A 17 -12.513 -0.987 36.785 1.00 0.62 H new ATOM 268 N SER A 18 -9.587 1.339 34.016 1.00 0.47 N ATOM 269 CA SER A 18 -9.647 2.817 33.965 1.00 0.49 C ATOM 270 C SER A 18 -9.450 3.283 32.524 1.00 0.57 C ATOM 271 O SER A 18 -10.229 4.058 32.019 1.00 0.57 O ATOM 272 CB SER A 18 -8.542 3.391 34.852 0.50 0.65 C ATOM 273 OG SER A 18 -8.738 4.790 35.018 1.00 0.74 O ATOM 0 H SER A 18 -8.924 0.952 34.688 1.00 0.47 H new ATOM 0 HA SER A 18 -10.617 3.163 34.323 1.00 0.49 H new ATOM 0 HB2 SER A 18 -8.548 2.896 35.823 0.50 0.65 H new ATOM 0 HB3 SER A 18 -7.567 3.201 34.403 0.50 0.65 H new ATOM 0 HG SER A 18 -8.029 5.154 35.588 1.00 0.74 H new ATOM 279 N THR A 19 -8.431 2.815 31.847 1.00 0.70 N ATOM 280 CA THR A 19 -8.227 3.252 30.434 1.00 0.84 C ATOM 281 C THR A 19 -9.392 2.745 29.589 1.00 0.79 C ATOM 282 O THR A 19 -9.895 3.436 28.722 1.00 0.89 O ATOM 283 CB THR A 19 -6.903 2.694 29.896 1.00 0.99 C ATOM 284 OG1 THR A 19 -5.825 3.233 30.652 1.00 1.08 O ATOM 285 CG2 THR A 19 -6.737 3.081 28.421 1.00 1.20 C ATOM 0 H THR A 19 -7.740 2.157 32.207 1.00 0.70 H new ATOM 0 HA THR A 19 -8.186 4.340 30.388 1.00 0.84 H new ATOM 0 HB THR A 19 -6.906 1.607 29.983 1.00 0.99 H new ATOM 0 HG1 THR A 19 -4.977 2.877 30.312 1.00 1.08 H new ATOM 0 HG21 THR A 19 -5.795 2.682 28.044 1.00 1.20 H new ATOM 0 HG22 THR A 19 -7.563 2.669 27.842 1.00 1.20 H new ATOM 0 HG23 THR A 19 -6.734 4.167 28.328 1.00 1.20 H new ATOM 293 N HIS A 20 -9.853 1.557 29.863 1.00 0.68 N ATOM 294 CA HIS A 20 -11.011 1.022 29.101 1.00 0.68 C ATOM 295 C HIS A 20 -12.215 1.952 29.339 1.00 0.66 C ATOM 296 O HIS A 20 -12.965 2.303 28.426 1.00 0.80 O ATOM 297 CB HIS A 20 -11.316 -0.397 29.598 1.00 0.57 C ATOM 298 CG HIS A 20 -12.510 -0.930 28.872 1.00 0.59 C ATOM 299 ND1 HIS A 20 -12.412 -1.736 27.727 1.00 0.72 N ATOM 300 CD2 HIS A 20 -13.841 -0.725 29.076 1.00 0.58 C ATOM 301 CE1 HIS A 20 -13.671 -1.966 27.285 1.00 0.78 C ATOM 302 NE2 HIS A 20 -14.541 -1.367 28.078 1.00 0.72 N ATOM 0 H HIS A 20 -9.478 0.936 30.580 1.00 0.68 H new ATOM 0 HA HIS A 20 -10.794 0.980 28.034 1.00 0.68 H new ATOM 0 HB2 HIS A 20 -10.456 -1.045 29.432 1.00 0.57 H new ATOM 0 HB3 HIS A 20 -11.504 -0.386 30.672 1.00 0.57 H new ATOM 0 HD1 HIS A 20 -11.551 -2.084 27.306 1.00 0.72 H new ATOM 0 HD2 HIS A 20 -14.275 -0.155 29.884 1.00 0.58 H new ATOM 0 HE1 HIS A 20 -13.926 -2.552 26.414 1.00 0.78 H new ATOM 310 N LEU A 21 -12.399 2.383 30.558 1.00 0.53 N ATOM 311 CA LEU A 21 -13.530 3.293 30.843 1.00 0.56 C ATOM 312 C LEU A 21 -13.294 4.559 30.038 1.00 0.70 C ATOM 313 O LEU A 21 -14.203 5.176 29.519 1.00 0.82 O ATOM 314 CB LEU A 21 -13.575 3.635 32.333 1.00 0.44 C ATOM 315 CG LEU A 21 -14.134 2.438 33.106 1.00 0.42 C ATOM 316 CD1 LEU A 21 -13.957 2.674 34.605 1.00 0.43 C ATOM 317 CD2 LEU A 21 -15.626 2.256 32.789 1.00 0.61 C ATOM 0 H LEU A 21 -11.816 2.143 31.360 1.00 0.53 H new ATOM 0 HA LEU A 21 -14.476 2.823 30.576 1.00 0.56 H new ATOM 0 HB2 LEU A 21 -12.576 3.881 32.692 1.00 0.44 H new ATOM 0 HB3 LEU A 21 -14.199 4.514 32.498 1.00 0.44 H new ATOM 0 HG LEU A 21 -13.595 1.538 32.809 1.00 0.42 H new ATOM 0 HD11 LEU A 21 -14.355 1.822 35.157 1.00 0.43 H new ATOM 0 HD12 LEU A 21 -12.897 2.791 34.832 1.00 0.43 H new ATOM 0 HD13 LEU A 21 -14.492 3.577 34.897 1.00 0.43 H new ATOM 0 HD21 LEU A 21 -16.014 1.402 33.344 1.00 0.61 H new ATOM 0 HD22 LEU A 21 -16.172 3.154 33.078 1.00 0.61 H new ATOM 0 HD23 LEU A 21 -15.752 2.082 31.720 1.00 0.61 H new ATOM 329 N LEU A 22 -12.041 4.930 29.908 1.00 0.73 N ATOM 330 CA LEU A 22 -11.728 6.128 29.112 1.00 0.90 C ATOM 331 C LEU A 22 -12.105 5.835 27.673 1.00 1.03 C ATOM 332 O LEU A 22 -12.495 6.729 26.953 1.00 1.16 O ATOM 333 CB LEU A 22 -10.247 6.516 29.196 1.00 0.97 C ATOM 334 CG LEU A 22 -9.812 6.630 30.657 1.00 0.86 C ATOM 335 CD1 LEU A 22 -8.388 7.184 30.717 1.00 1.00 C ATOM 336 CD2 LEU A 22 -10.756 7.560 31.431 1.00 0.78 C ATOM 0 H LEU A 22 -11.239 4.452 30.319 1.00 0.73 H new ATOM 0 HA LEU A 22 -12.293 6.972 29.508 1.00 0.90 H new ATOM 0 HB2 LEU A 22 -9.639 5.770 28.685 1.00 0.97 H new ATOM 0 HB3 LEU A 22 -10.083 7.465 28.685 1.00 0.97 H new ATOM 0 HG LEU A 22 -9.847 5.641 31.113 1.00 0.86 H new ATOM 0 HD11 LEU A 22 -8.073 7.267 31.757 1.00 1.00 H new ATOM 0 HD12 LEU A 22 -7.713 6.512 30.187 1.00 1.00 H new ATOM 0 HD13 LEU A 22 -8.361 8.169 30.250 1.00 1.00 H new ATOM 0 HD21 LEU A 22 -10.430 7.628 32.469 1.00 0.78 H new ATOM 0 HD22 LEU A 22 -10.740 8.552 30.980 1.00 0.78 H new ATOM 0 HD23 LEU A 22 -11.770 7.161 31.395 1.00 0.78 H new ATOM 348 N ILE A 23 -12.040 4.599 27.217 1.00 1.02 N ATOM 349 CA ILE A 23 -12.460 4.345 25.818 1.00 1.15 C ATOM 350 C ILE A 23 -13.907 4.772 25.716 1.00 1.22 C ATOM 351 O ILE A 23 -14.311 5.408 24.760 1.00 1.38 O ATOM 352 CB ILE A 23 -12.338 2.860 25.478 1.00 1.09 C ATOM 353 CG1 ILE A 23 -10.865 2.467 25.454 1.00 1.26 C ATOM 354 CG2 ILE A 23 -12.992 2.588 24.118 1.00 0.98 C ATOM 355 CD1 ILE A 23 -10.729 0.974 25.164 1.00 1.33 C ATOM 0 H ILE A 23 -11.723 3.786 27.744 1.00 1.02 H new ATOM 0 HA ILE A 23 -11.828 4.896 25.122 1.00 1.15 H new ATOM 0 HB ILE A 23 -12.849 2.264 26.234 1.00 1.09 H new ATOM 0 HG12 ILE A 23 -10.338 3.043 24.693 1.00 1.26 H new ATOM 0 HG13 ILE A 23 -10.401 2.704 26.411 1.00 1.26 H new ATOM 0 HG21 ILE A 23 -12.904 1.529 23.877 1.00 0.98 H new ATOM 0 HG22 ILE A 23 -14.046 2.864 24.159 1.00 0.98 H new ATOM 0 HG23 ILE A 23 -12.492 3.177 23.349 1.00 0.98 H new ATOM 0 HD11 ILE A 23 -9.674 0.701 25.148 1.00 1.33 H new ATOM 0 HD12 ILE A 23 -11.240 0.405 25.940 1.00 1.33 H new ATOM 0 HD13 ILE A 23 -11.176 0.749 24.196 1.00 1.33 H new ATOM 367 N HIS A 24 -14.690 4.486 26.721 1.00 1.11 N ATOM 368 CA HIS A 24 -16.106 4.952 26.673 1.00 1.19 C ATOM 369 C HIS A 24 -16.152 6.470 26.895 1.00 1.20 C ATOM 370 O HIS A 24 -16.620 7.201 26.048 1.00 1.29 O ATOM 371 CB HIS A 24 -16.937 4.248 27.744 1.00 1.11 C ATOM 372 CG HIS A 24 -17.019 2.788 27.418 1.00 1.11 C ATOM 373 ND1 HIS A 24 -17.459 2.323 26.175 1.00 1.29 N ATOM 374 CD2 HIS A 24 -16.673 1.675 28.139 1.00 0.96 C ATOM 375 CE1 HIS A 24 -17.356 0.980 26.184 1.00 1.23 C ATOM 376 NE2 HIS A 24 -16.893 0.565 27.354 1.00 1.03 N ATOM 0 H HIS A 24 -14.420 3.963 27.554 1.00 1.11 H new ATOM 0 HA HIS A 24 -16.524 4.712 25.695 1.00 1.19 H new ATOM 0 HB2 HIS A 24 -16.484 4.390 28.725 1.00 1.11 H new ATOM 0 HB3 HIS A 24 -17.937 4.680 27.789 1.00 1.11 H new ATOM 0 HD1 HIS A 24 -17.797 2.896 25.402 1.00 1.29 H new ATOM 0 HD2 HIS A 24 -16.293 1.669 29.150 1.00 0.96 H new ATOM 0 HE1 HIS A 24 -17.614 0.335 25.357 1.00 1.23 H new ATOM 384 N SER A 25 -15.695 6.956 28.025 1.00 1.12 N ATOM 385 CA SER A 25 -15.737 8.428 28.307 1.00 1.15 C ATOM 386 C SER A 25 -14.896 9.234 27.305 1.00 1.13 C ATOM 387 O SER A 25 -14.861 10.449 27.350 1.00 1.12 O ATOM 388 CB SER A 25 -15.138 8.635 29.697 1.00 1.14 C ATOM 389 OG SER A 25 -15.827 7.814 30.631 1.00 1.63 O ATOM 0 H SER A 25 -15.291 6.391 28.771 1.00 1.12 H new ATOM 0 HA SER A 25 -16.769 8.771 28.233 1.00 1.15 H new ATOM 0 HB2 SER A 25 -14.077 8.386 29.689 1.00 1.14 H new ATOM 0 HB3 SER A 25 -15.217 9.682 29.988 1.00 1.14 H new ATOM 0 HG SER A 25 -15.445 7.943 31.524 1.00 1.63 H new ATOM 395 N ASP A 26 -14.178 8.575 26.435 1.00 1.16 N ATOM 396 CA ASP A 26 -13.294 9.301 25.473 1.00 1.18 C ATOM 397 C ASP A 26 -12.546 10.411 26.218 1.00 1.18 C ATOM 398 O ASP A 26 -12.723 11.584 25.944 1.00 1.24 O ATOM 399 CB ASP A 26 -14.114 9.910 24.334 1.00 1.14 C ATOM 400 CG ASP A 26 -14.894 8.811 23.611 1.00 1.21 C ATOM 401 OD1 ASP A 26 -14.289 7.809 23.267 1.00 1.14 O ATOM 402 OD2 ASP A 26 -16.087 8.987 23.421 1.00 1.45 O ATOM 0 H ASP A 26 -14.165 7.559 26.348 1.00 1.16 H new ATOM 0 HA ASP A 26 -12.584 8.593 25.045 1.00 1.18 H new ATOM 0 HB2 ASP A 26 -14.802 10.657 24.729 1.00 1.14 H new ATOM 0 HB3 ASP A 26 -13.455 10.422 23.633 1.00 1.14 H new ATOM 407 N THR A 27 -11.718 10.048 27.169 1.00 1.13 N ATOM 408 CA THR A 27 -10.960 11.072 27.946 1.00 1.12 C ATOM 409 C THR A 27 -9.544 11.182 27.388 1.00 1.04 C ATOM 410 O THR A 27 -8.749 10.271 27.508 1.00 1.05 O ATOM 411 CB THR A 27 -10.903 10.640 29.418 1.00 1.19 C ATOM 412 OG1 THR A 27 -12.133 10.018 29.769 1.00 1.22 O ATOM 413 CG2 THR A 27 -10.674 11.860 30.311 1.00 1.21 C ATOM 0 H THR A 27 -11.536 9.081 27.439 1.00 1.13 H new ATOM 0 HA THR A 27 -11.454 12.040 27.868 1.00 1.12 H new ATOM 0 HB THR A 27 -10.081 9.938 29.558 1.00 1.19 H new ATOM 0 HG1 THR A 27 -12.315 10.166 30.721 1.00 1.22 H new ATOM 0 HG21 THR A 27 -10.635 11.545 31.354 1.00 1.21 H new ATOM 0 HG22 THR A 27 -9.732 12.337 30.040 1.00 1.21 H new ATOM 0 HG23 THR A 27 -11.492 12.568 30.176 1.00 1.21 H new ATOM 421 N ARG A 28 -9.227 12.286 26.767 1.00 0.97 N ATOM 422 CA ARG A 28 -7.865 12.448 26.181 1.00 0.89 C ATOM 423 C ARG A 28 -7.208 13.726 26.713 1.00 0.91 C ATOM 424 O ARG A 28 -7.181 14.738 26.045 1.00 0.95 O ATOM 425 CB ARG A 28 -7.983 12.523 24.653 1.00 0.87 C ATOM 426 CG ARG A 28 -8.212 11.118 24.065 1.00 0.88 C ATOM 427 CD ARG A 28 -9.712 10.821 23.959 1.00 0.84 C ATOM 428 NE ARG A 28 -9.906 9.403 23.534 1.00 0.73 N ATOM 429 CZ ARG A 28 -9.902 8.442 24.420 1.00 0.56 C ATOM 430 NH1 ARG A 28 -9.754 8.720 25.687 1.00 0.81 N ATOM 431 NH2 ARG A 28 -10.051 7.202 24.038 1.00 0.89 N ATOM 0 H ARG A 28 -9.852 13.082 26.640 1.00 0.97 H new ATOM 0 HA ARG A 28 -7.247 11.595 26.463 1.00 0.89 H new ATOM 0 HB2 ARG A 28 -8.808 13.179 24.377 1.00 0.87 H new ATOM 0 HB3 ARG A 28 -7.076 12.957 24.232 1.00 0.87 H new ATOM 0 HG2 ARG A 28 -7.751 11.050 23.080 1.00 0.88 H new ATOM 0 HG3 ARG A 28 -7.730 10.370 24.695 1.00 0.88 H new ATOM 0 HD2 ARG A 28 -10.197 10.994 24.919 1.00 0.84 H new ATOM 0 HD3 ARG A 28 -10.178 11.495 23.240 1.00 0.84 H new ATOM 0 HE ARG A 28 -10.042 9.183 22.547 1.00 0.73 H new ATOM 0 HH11 ARG A 28 -9.641 9.688 25.987 1.00 0.81 H new ATOM 0 HH12 ARG A 28 -9.751 7.969 26.377 1.00 0.81 H new ATOM 0 HH21 ARG A 28 -10.170 6.984 23.049 1.00 0.89 H new ATOM 0 HH22 ARG A 28 -10.048 6.452 24.729 1.00 0.89 H new ATOM 445 N PRO A 29 -6.682 13.675 27.915 1.00 0.93 N ATOM 446 CA PRO A 29 -6.009 14.842 28.548 1.00 0.98 C ATOM 447 C PRO A 29 -4.582 15.054 28.019 1.00 0.85 C ATOM 448 O PRO A 29 -3.823 15.843 28.548 1.00 0.90 O ATOM 449 CB PRO A 29 -5.989 14.475 30.039 1.00 1.10 C ATOM 450 CG PRO A 29 -5.990 12.981 30.081 1.00 1.08 C ATOM 451 CD PRO A 29 -6.669 12.494 28.794 1.00 0.96 C ATOM 0 HA PRO A 29 -6.526 15.777 28.335 1.00 0.98 H new ATOM 0 HB2 PRO A 29 -5.106 14.881 30.532 1.00 1.10 H new ATOM 0 HB3 PRO A 29 -6.858 14.883 30.556 1.00 1.10 H new ATOM 0 HG2 PRO A 29 -4.972 12.597 30.149 1.00 1.08 H new ATOM 0 HG3 PRO A 29 -6.526 12.621 30.959 1.00 1.08 H new ATOM 0 HD2 PRO A 29 -6.118 11.669 28.342 1.00 0.96 H new ATOM 0 HD3 PRO A 29 -7.679 12.134 28.990 1.00 0.96 H new ATOM 459 N TYR A 30 -4.208 14.336 26.985 1.00 0.72 N ATOM 460 CA TYR A 30 -2.830 14.479 26.425 1.00 0.62 C ATOM 461 C TYR A 30 -2.916 14.974 24.989 1.00 0.56 C ATOM 462 O TYR A 30 -2.905 14.194 24.055 1.00 0.51 O ATOM 463 CB TYR A 30 -2.129 13.121 26.445 1.00 0.59 C ATOM 464 CG TYR A 30 -1.802 12.760 27.870 1.00 0.62 C ATOM 465 CD1 TYR A 30 -0.843 13.500 28.571 1.00 0.69 C ATOM 466 CD2 TYR A 30 -2.460 11.694 28.493 1.00 0.63 C ATOM 467 CE1 TYR A 30 -0.541 13.173 29.896 1.00 0.75 C ATOM 468 CE2 TYR A 30 -2.158 11.366 29.817 1.00 0.68 C ATOM 469 CZ TYR A 30 -1.199 12.104 30.520 1.00 0.73 C ATOM 470 OH TYR A 30 -0.895 11.777 31.824 1.00 0.80 O ATOM 0 H TYR A 30 -4.800 13.657 26.506 1.00 0.72 H new ATOM 0 HA TYR A 30 -2.267 15.192 27.027 1.00 0.62 H new ATOM 0 HB2 TYR A 30 -2.770 12.360 26.001 1.00 0.59 H new ATOM 0 HB3 TYR A 30 -1.218 13.158 25.847 1.00 0.59 H new ATOM 0 HD1 TYR A 30 -0.337 14.323 28.089 1.00 0.69 H new ATOM 0 HD2 TYR A 30 -3.201 11.125 27.951 1.00 0.63 H new ATOM 0 HE1 TYR A 30 0.199 13.743 30.438 1.00 0.75 H new ATOM 0 HE2 TYR A 30 -2.665 10.543 30.298 1.00 0.68 H new ATOM 0 HH TYR A 30 0.029 11.453 31.873 1.00 0.80 H new ATOM 480 N PRO A 31 -3.013 16.262 24.807 1.00 0.61 N ATOM 481 CA PRO A 31 -3.113 16.866 23.458 1.00 0.57 C ATOM 482 C PRO A 31 -1.758 17.058 22.792 1.00 0.49 C ATOM 483 O PRO A 31 -0.774 17.364 23.431 1.00 0.54 O ATOM 484 CB PRO A 31 -3.750 18.223 23.724 0.50 0.69 C ATOM 485 CG PRO A 31 -3.299 18.599 25.096 0.50 0.85 C ATOM 486 CD PRO A 31 -3.038 17.290 25.860 0.50 0.76 C ATOM 0 HA PRO A 31 -3.678 16.227 22.779 1.00 0.57 H new ATOM 0 HB2 PRO A 31 -3.430 18.960 22.988 0.50 0.69 H new ATOM 0 HB3 PRO A 31 -4.837 18.167 23.667 0.50 0.69 H new ATOM 0 HG2 PRO A 31 -2.395 19.206 25.052 0.50 0.85 H new ATOM 0 HG3 PRO A 31 -4.059 19.195 25.601 0.50 0.85 H new ATOM 0 HD2 PRO A 31 -2.094 17.327 26.404 0.50 0.76 H new ATOM 0 HD3 PRO A 31 -3.821 17.092 26.592 0.50 0.76 H new ATOM 494 N CYS A 32 -1.693 16.859 21.514 1.00 0.41 N ATOM 495 CA CYS A 32 -0.392 17.018 20.820 1.00 0.38 C ATOM 496 C CYS A 32 0.033 18.479 20.850 1.00 0.47 C ATOM 497 O CYS A 32 -0.781 19.379 20.901 1.00 0.51 O ATOM 498 CB CYS A 32 -0.505 16.542 19.374 1.00 0.33 C ATOM 499 SG CYS A 32 0.465 17.598 18.258 1.00 0.34 S ATOM 0 H CYS A 32 -2.479 16.594 20.920 1.00 0.41 H new ATOM 0 HA CYS A 32 0.357 16.415 21.333 1.00 0.38 H new ATOM 0 HB2 CYS A 32 -0.156 15.512 19.299 1.00 0.33 H new ATOM 0 HB3 CYS A 32 -1.551 16.548 19.067 1.00 0.33 H new ATOM 504 N GLN A 33 1.315 18.714 20.861 1.00 0.53 N ATOM 505 CA GLN A 33 1.810 20.108 20.923 1.00 0.64 C ATOM 506 C GLN A 33 1.938 20.719 19.538 1.00 0.63 C ATOM 507 O GLN A 33 1.909 21.926 19.417 1.00 0.73 O ATOM 508 CB GLN A 33 3.182 20.167 21.614 1.00 0.72 C ATOM 509 CG GLN A 33 3.748 18.762 21.828 1.00 0.52 C ATOM 510 CD GLN A 33 5.140 18.896 22.456 1.00 0.72 C ATOM 511 OE1 GLN A 33 5.778 19.924 22.329 1.00 1.23 O ATOM 512 NE2 GLN A 33 5.642 17.908 23.146 1.00 1.31 N ATOM 0 H GLN A 33 2.039 17.996 20.830 1.00 0.53 H new ATOM 0 HA GLN A 33 1.079 20.678 21.497 1.00 0.64 H new ATOM 0 HB2 GLN A 33 3.873 20.753 21.009 1.00 0.72 H new ATOM 0 HB3 GLN A 33 3.088 20.675 22.574 1.00 0.72 H new ATOM 0 HG2 GLN A 33 3.092 18.183 22.478 1.00 0.52 H new ATOM 0 HG3 GLN A 33 3.809 18.228 20.880 1.00 0.52 H new ATOM 0 HE21 GLN A 33 5.113 17.043 23.257 1.00 1.31 H new ATOM 0 HE22 GLN A 33 6.563 18.001 23.574 1.00 1.31 H new ATOM 521 N TYR A 34 2.081 19.956 18.482 1.00 0.55 N ATOM 522 CA TYR A 34 2.218 20.635 17.157 1.00 0.58 C ATOM 523 C TYR A 34 0.915 20.568 16.362 1.00 0.54 C ATOM 524 O TYR A 34 0.269 21.577 16.150 1.00 0.61 O ATOM 525 CB TYR A 34 3.365 20.021 16.359 1.00 0.54 C ATOM 526 CG TYR A 34 4.549 19.805 17.275 1.00 0.58 C ATOM 527 CD1 TYR A 34 4.565 18.701 18.134 1.00 0.70 C ATOM 528 CD2 TYR A 34 5.627 20.704 17.270 1.00 0.53 C ATOM 529 CE1 TYR A 34 5.654 18.494 18.988 1.00 0.76 C ATOM 530 CE2 TYR A 34 6.718 20.495 18.125 1.00 0.57 C ATOM 531 CZ TYR A 34 6.729 19.389 18.984 1.00 0.68 C ATOM 532 OH TYR A 34 7.803 19.181 19.825 1.00 0.75 O ATOM 0 H TYR A 34 2.108 18.936 18.475 1.00 0.55 H new ATOM 0 HA TYR A 34 2.443 21.686 17.340 1.00 0.58 H new ATOM 0 HB2 TYR A 34 3.052 19.074 15.920 1.00 0.54 H new ATOM 0 HB3 TYR A 34 3.643 20.678 15.535 1.00 0.54 H new ATOM 0 HD1 TYR A 34 3.737 18.008 18.138 1.00 0.70 H new ATOM 0 HD2 TYR A 34 5.616 21.557 16.607 1.00 0.53 H new ATOM 0 HE1 TYR A 34 5.665 17.642 19.651 1.00 0.76 H new ATOM 0 HE2 TYR A 34 7.548 21.186 18.121 1.00 0.57 H new ATOM 0 HH TYR A 34 8.463 19.894 19.696 1.00 0.75 H new ATOM 542 N CYS A 35 0.522 19.415 15.887 1.00 0.46 N ATOM 543 CA CYS A 35 -0.742 19.358 15.078 1.00 0.45 C ATOM 544 C CYS A 35 -1.998 19.321 15.980 1.00 0.45 C ATOM 545 O CYS A 35 -3.044 19.781 15.572 1.00 0.51 O ATOM 546 CB CYS A 35 -0.709 18.188 14.082 1.00 0.41 C ATOM 547 SG CYS A 35 -0.939 16.608 14.914 1.00 0.34 S ATOM 0 H CYS A 35 1.005 18.526 16.017 1.00 0.46 H new ATOM 0 HA CYS A 35 -0.805 20.277 14.495 1.00 0.45 H new ATOM 0 HB2 CYS A 35 -1.490 18.324 13.334 1.00 0.41 H new ATOM 0 HB3 CYS A 35 0.244 18.186 13.552 1.00 0.41 H new ATOM 552 N GLY A 36 -1.904 18.885 17.223 1.00 0.43 N ATOM 553 CA GLY A 36 -3.111 18.967 18.133 1.00 0.50 C ATOM 554 C GLY A 36 -3.885 17.649 18.371 1.00 0.46 C ATOM 555 O GLY A 36 -4.812 17.648 19.151 1.00 0.54 O ATOM 0 H GLY A 36 -1.065 18.484 17.642 1.00 0.43 H new ATOM 0 HA2 GLY A 36 -2.784 19.350 19.100 1.00 0.50 H new ATOM 0 HA3 GLY A 36 -3.803 19.699 17.717 1.00 0.50 H new ATOM 559 N LYS A 37 -3.579 16.541 17.761 1.00 0.39 N ATOM 560 CA LYS A 37 -4.413 15.323 18.073 1.00 0.42 C ATOM 561 C LYS A 37 -4.565 15.208 19.605 1.00 0.45 C ATOM 562 O LYS A 37 -3.757 15.724 20.347 1.00 0.45 O ATOM 563 CB LYS A 37 -3.776 14.058 17.481 1.00 0.41 C ATOM 564 CG LYS A 37 -4.203 13.950 16.012 1.00 0.52 C ATOM 565 CD LYS A 37 -3.632 12.691 15.346 1.00 0.66 C ATOM 566 CE LYS A 37 -3.792 12.819 13.824 1.00 0.89 C ATOM 567 NZ LYS A 37 -2.725 13.713 13.292 1.00 1.38 N ATOM 0 H LYS A 37 -2.824 16.414 17.087 1.00 0.39 H new ATOM 0 HA LYS A 37 -5.399 15.427 17.619 1.00 0.42 H new ATOM 0 HB2 LYS A 37 -2.690 14.107 17.559 1.00 0.41 H new ATOM 0 HB3 LYS A 37 -4.096 13.176 18.036 1.00 0.41 H new ATOM 0 HG2 LYS A 37 -5.291 13.933 15.950 1.00 0.52 H new ATOM 0 HG3 LYS A 37 -3.866 14.833 15.469 1.00 0.52 H new ATOM 0 HD2 LYS A 37 -2.580 12.571 15.606 1.00 0.66 H new ATOM 0 HD3 LYS A 37 -4.153 11.804 15.707 1.00 0.66 H new ATOM 0 HE2 LYS A 37 -3.727 11.837 13.356 1.00 0.89 H new ATOM 0 HE3 LYS A 37 -4.775 13.223 13.582 1.00 0.89 H new ATOM 0 HZ1 LYS A 37 -2.654 13.594 12.261 1.00 1.38 H new ATOM 0 HZ2 LYS A 37 -2.960 14.702 13.511 1.00 1.38 H new ATOM 0 HZ3 LYS A 37 -1.815 13.468 13.732 1.00 1.38 H new ATOM 581 N ARG A 38 -5.589 14.534 20.077 1.00 0.54 N ATOM 582 CA ARG A 38 -5.817 14.366 21.553 1.00 0.58 C ATOM 583 C ARG A 38 -5.575 12.890 21.891 1.00 0.58 C ATOM 584 O ARG A 38 -6.213 12.017 21.329 1.00 0.63 O ATOM 585 CB ARG A 38 -7.283 14.720 21.884 1.00 0.70 C ATOM 586 CG ARG A 38 -7.610 16.153 21.429 1.00 0.73 C ATOM 587 CD ARG A 38 -7.520 17.108 22.624 1.00 0.92 C ATOM 588 NE ARG A 38 -7.457 18.516 22.134 1.00 1.13 N ATOM 589 CZ ARG A 38 -6.388 18.939 21.519 1.00 1.51 C ATOM 590 NH1 ARG A 38 -5.374 18.135 21.358 1.00 2.11 N ATOM 591 NH2 ARG A 38 -6.327 20.165 21.072 1.00 1.89 N ATOM 0 H ARG A 38 -6.291 14.084 19.490 1.00 0.54 H new ATOM 0 HA ARG A 38 -5.151 15.013 22.123 1.00 0.58 H new ATOM 0 HB2 ARG A 38 -7.953 14.015 21.392 1.00 0.70 H new ATOM 0 HB3 ARG A 38 -7.452 14.626 22.957 1.00 0.70 H new ATOM 0 HG2 ARG A 38 -6.915 16.465 20.649 1.00 0.73 H new ATOM 0 HG3 ARG A 38 -8.610 16.188 20.997 1.00 0.73 H new ATOM 0 HD2 ARG A 38 -8.385 16.977 23.274 1.00 0.92 H new ATOM 0 HD3 ARG A 38 -6.636 16.879 23.220 1.00 0.92 H new ATOM 0 HE ARG A 38 -8.247 19.145 22.280 1.00 1.13 H new ATOM 0 HH11 ARG A 38 -5.419 17.180 21.713 1.00 2.11 H new ATOM 0 HH12 ARG A 38 -4.536 18.461 20.877 1.00 2.11 H new ATOM 0 HH21 ARG A 38 -7.118 20.796 21.204 1.00 1.89 H new ATOM 0 HH22 ARG A 38 -5.489 20.492 20.591 1.00 1.89 H new ATOM 605 N PHE A 39 -4.675 12.583 22.813 1.00 0.56 N ATOM 606 CA PHE A 39 -4.418 11.155 23.162 1.00 0.59 C ATOM 607 C PHE A 39 -4.859 10.884 24.597 1.00 0.66 C ATOM 608 O PHE A 39 -5.078 11.792 25.383 1.00 0.69 O ATOM 609 CB PHE A 39 -2.914 10.884 23.069 1.00 0.52 C ATOM 610 CG PHE A 39 -2.435 11.205 21.685 1.00 0.44 C ATOM 611 CD1 PHE A 39 -2.455 10.219 20.698 1.00 0.50 C ATOM 612 CD2 PHE A 39 -1.975 12.490 21.388 1.00 0.40 C ATOM 613 CE1 PHE A 39 -2.015 10.517 19.408 1.00 0.49 C ATOM 614 CE2 PHE A 39 -1.533 12.789 20.100 1.00 0.37 C ATOM 615 CZ PHE A 39 -1.552 11.803 19.108 1.00 0.40 C ATOM 0 H PHE A 39 -4.117 13.263 23.329 1.00 0.56 H new ATOM 0 HA PHE A 39 -4.972 10.515 22.475 1.00 0.59 H new ATOM 0 HB2 PHE A 39 -2.378 11.489 23.801 1.00 0.52 H new ATOM 0 HB3 PHE A 39 -2.706 9.840 23.305 1.00 0.52 H new ATOM 0 HD1 PHE A 39 -2.811 9.226 20.932 1.00 0.50 H new ATOM 0 HD2 PHE A 39 -1.962 13.251 22.155 1.00 0.40 H new ATOM 0 HE1 PHE A 39 -2.032 9.756 18.642 1.00 0.49 H new ATOM 0 HE2 PHE A 39 -1.176 13.782 19.868 1.00 0.37 H new ATOM 0 HZ PHE A 39 -1.209 12.034 18.110 1.00 0.40 H new ATOM 625 N HIS A 40 -4.985 9.626 24.936 1.00 0.73 N ATOM 626 CA HIS A 40 -5.414 9.236 26.311 1.00 0.80 C ATOM 627 C HIS A 40 -4.222 8.754 27.144 1.00 0.76 C ATOM 628 O HIS A 40 -4.369 8.501 28.322 1.00 0.80 O ATOM 629 CB HIS A 40 -6.426 8.100 26.193 1.00 0.90 C ATOM 630 CG HIS A 40 -5.914 7.106 25.187 1.00 0.91 C ATOM 631 ND1 HIS A 40 -4.611 7.150 24.711 1.00 0.96 N ATOM 632 CD2 HIS A 40 -6.508 6.044 24.556 1.00 1.00 C ATOM 633 CE1 HIS A 40 -4.466 6.141 23.833 1.00 1.00 C ATOM 634 NE2 HIS A 40 -5.592 5.435 23.701 1.00 1.03 N ATOM 0 H HIS A 40 -4.806 8.842 24.308 1.00 0.73 H new ATOM 0 HA HIS A 40 -5.851 10.103 26.806 1.00 0.80 H new ATOM 0 HB2 HIS A 40 -6.570 7.619 27.161 1.00 0.90 H new ATOM 0 HB3 HIS A 40 -7.396 8.488 25.882 1.00 0.90 H new ATOM 0 HD2 HIS A 40 -7.531 5.727 24.700 1.00 1.00 H new ATOM 0 HE1 HIS A 40 -3.551 5.928 23.300 1.00 1.00 H new ATOM 0 HE2 HIS A 40 -5.748 4.624 23.103 1.00 1.03 H new ATOM 642 N GLN A 41 -3.049 8.607 26.571 1.00 0.69 N ATOM 643 CA GLN A 41 -1.899 8.120 27.396 1.00 0.65 C ATOM 644 C GLN A 41 -0.654 8.991 27.140 1.00 0.54 C ATOM 645 O GLN A 41 -0.177 9.077 26.024 1.00 0.51 O ATOM 646 CB GLN A 41 -1.605 6.663 27.029 1.00 0.71 C ATOM 647 CG GLN A 41 -2.839 5.807 27.321 1.00 0.80 C ATOM 648 CD GLN A 41 -2.599 4.363 26.858 1.00 0.82 C ATOM 649 OE1 GLN A 41 -1.568 4.059 26.295 1.00 0.85 O ATOM 650 NE2 GLN A 41 -3.522 3.453 27.067 1.00 1.03 N ATOM 0 H GLN A 41 -2.842 8.798 25.591 1.00 0.69 H new ATOM 0 HA GLN A 41 -2.155 8.187 28.453 1.00 0.65 H new ATOM 0 HB2 GLN A 41 -1.338 6.589 25.975 1.00 0.71 H new ATOM 0 HB3 GLN A 41 -0.752 6.298 27.600 1.00 0.71 H new ATOM 0 HG2 GLN A 41 -3.059 5.823 28.389 1.00 0.80 H new ATOM 0 HG3 GLN A 41 -3.708 6.221 26.810 1.00 0.80 H new ATOM 0 HE21 GLN A 41 -4.390 3.706 27.540 1.00 1.03 H new ATOM 0 HE22 GLN A 41 -3.371 2.493 26.756 1.00 1.03 H new ATOM 659 N LYS A 42 -0.132 9.639 28.166 1.00 0.50 N ATOM 660 CA LYS A 42 1.077 10.521 27.996 1.00 0.41 C ATOM 661 C LYS A 42 2.112 9.861 27.066 1.00 0.37 C ATOM 662 O LYS A 42 2.470 10.400 26.031 1.00 0.34 O ATOM 663 CB LYS A 42 1.730 10.767 29.371 1.00 0.42 C ATOM 664 CG LYS A 42 3.110 11.416 29.188 1.00 0.49 C ATOM 665 CD LYS A 42 3.758 11.677 30.554 1.00 0.57 C ATOM 666 CE LYS A 42 4.985 12.573 30.363 1.00 0.58 C ATOM 667 NZ LYS A 42 5.744 12.672 31.645 1.00 0.59 N ATOM 0 H LYS A 42 -0.495 9.593 29.118 1.00 0.50 H new ATOM 0 HA LYS A 42 0.754 11.464 27.554 1.00 0.41 H new ATOM 0 HB2 LYS A 42 1.093 11.412 29.975 1.00 0.42 H new ATOM 0 HB3 LYS A 42 1.831 9.824 29.909 1.00 0.42 H new ATOM 0 HG2 LYS A 42 3.750 10.765 28.592 1.00 0.49 H new ATOM 0 HG3 LYS A 42 3.010 12.353 28.640 1.00 0.49 H new ATOM 0 HD2 LYS A 42 3.044 12.155 31.224 1.00 0.57 H new ATOM 0 HD3 LYS A 42 4.049 10.735 31.018 1.00 0.57 H new ATOM 0 HE2 LYS A 42 5.626 12.166 29.581 1.00 0.58 H new ATOM 0 HE3 LYS A 42 4.675 13.565 30.036 1.00 0.58 H new ATOM 0 HZ1 LYS A 42 6.576 13.281 31.510 1.00 0.59 H new ATOM 0 HZ2 LYS A 42 5.132 13.080 32.380 1.00 0.59 H new ATOM 0 HZ3 LYS A 42 6.054 11.724 31.939 1.00 0.59 H new ATOM 681 N SER A 43 2.618 8.719 27.445 1.00 0.45 N ATOM 682 CA SER A 43 3.653 8.030 26.615 1.00 0.48 C ATOM 683 C SER A 43 3.193 7.838 25.172 1.00 0.49 C ATOM 684 O SER A 43 4.011 7.841 24.274 1.00 0.46 O ATOM 685 CB SER A 43 3.971 6.674 27.232 1.00 0.60 C ATOM 686 OG SER A 43 2.927 5.766 26.936 1.00 1.42 O ATOM 0 H SER A 43 2.358 8.228 28.301 1.00 0.45 H new ATOM 0 HA SER A 43 4.543 8.659 26.598 1.00 0.48 H new ATOM 0 HB2 SER A 43 4.917 6.298 26.842 1.00 0.60 H new ATOM 0 HB3 SER A 43 4.088 6.772 28.311 1.00 0.60 H new ATOM 0 HG SER A 43 2.853 5.106 27.657 1.00 1.42 H new ATOM 692 N ASP A 44 1.914 7.689 24.913 1.00 0.56 N ATOM 693 CA ASP A 44 1.517 7.535 23.484 1.00 0.59 C ATOM 694 C ASP A 44 1.575 8.916 22.838 1.00 0.48 C ATOM 695 O ASP A 44 2.055 9.063 21.731 1.00 0.49 O ATOM 696 CB ASP A 44 0.129 6.932 23.300 1.00 0.71 C ATOM 697 CG ASP A 44 0.118 5.512 23.865 1.00 0.81 C ATOM 698 OD1 ASP A 44 1.160 5.059 24.312 1.00 1.24 O ATOM 699 OD2 ASP A 44 -0.936 4.901 23.837 1.00 1.48 O ATOM 0 H ASP A 44 1.159 7.668 25.599 1.00 0.56 H new ATOM 0 HA ASP A 44 2.208 6.837 23.012 1.00 0.59 H new ATOM 0 HB2 ASP A 44 -0.616 7.544 23.808 1.00 0.71 H new ATOM 0 HB3 ASP A 44 -0.137 6.918 22.243 1.00 0.71 H new ATOM 704 N MET A 45 1.153 9.948 23.529 1.00 0.40 N ATOM 705 CA MET A 45 1.274 11.308 22.945 1.00 0.31 C ATOM 706 C MET A 45 2.759 11.529 22.721 1.00 0.24 C ATOM 707 O MET A 45 3.197 11.989 21.690 1.00 0.28 O ATOM 708 CB MET A 45 0.755 12.341 23.949 0.50 0.33 C ATOM 709 CG MET A 45 1.108 13.752 23.461 0.50 0.38 C ATOM 710 SD MET A 45 2.596 14.340 24.312 1.00 0.48 S ATOM 711 CE MET A 45 1.770 15.028 25.765 1.00 0.45 C ATOM 0 H MET A 45 0.736 9.903 24.459 1.00 0.40 H new ATOM 0 HA MET A 45 0.703 11.406 22.022 1.00 0.31 H new ATOM 0 HB2 MET A 45 -0.325 12.243 24.062 0.50 0.33 H new ATOM 0 HB3 MET A 45 1.195 12.163 24.930 0.50 0.33 H new ATOM 0 HG2 MET A 45 1.273 13.744 22.384 0.50 0.38 H new ATOM 0 HG3 MET A 45 0.277 14.431 23.651 0.50 0.38 H new ATOM 0 HE1 MET A 45 2.514 15.453 26.439 1.00 0.45 H new ATOM 0 HE2 MET A 45 1.075 15.808 25.453 1.00 0.45 H new ATOM 0 HE3 MET A 45 1.222 14.239 26.280 1.00 0.45 H new ATOM 721 N LYS A 46 3.538 11.212 23.712 1.00 0.24 N ATOM 722 CA LYS A 46 5.002 11.401 23.586 1.00 0.29 C ATOM 723 C LYS A 46 5.469 10.670 22.326 1.00 0.36 C ATOM 724 O LYS A 46 6.302 11.149 21.589 1.00 0.42 O ATOM 725 CB LYS A 46 5.689 10.838 24.824 1.00 0.34 C ATOM 726 CG LYS A 46 7.153 11.269 24.826 1.00 0.41 C ATOM 727 CD LYS A 46 7.860 10.712 26.060 1.00 0.73 C ATOM 728 CE LYS A 46 9.365 10.938 25.916 1.00 1.59 C ATOM 729 NZ LYS A 46 9.647 12.401 25.846 1.00 2.61 N ATOM 0 H LYS A 46 3.223 10.830 24.604 1.00 0.24 H new ATOM 0 HA LYS A 46 5.254 12.459 23.506 1.00 0.29 H new ATOM 0 HB2 LYS A 46 5.191 11.196 25.725 1.00 0.34 H new ATOM 0 HB3 LYS A 46 5.618 9.750 24.831 1.00 0.34 H new ATOM 0 HG2 LYS A 46 7.647 10.913 23.922 1.00 0.41 H new ATOM 0 HG3 LYS A 46 7.220 12.357 24.818 1.00 0.41 H new ATOM 0 HD2 LYS A 46 7.490 11.203 26.960 1.00 0.73 H new ATOM 0 HD3 LYS A 46 7.648 9.648 26.168 1.00 0.73 H new ATOM 0 HE2 LYS A 46 9.892 10.496 26.762 1.00 1.59 H new ATOM 0 HE3 LYS A 46 9.733 10.443 25.017 1.00 1.59 H new ATOM 0 HZ1 LYS A 46 10.453 12.629 26.462 1.00 2.61 H new ATOM 0 HZ2 LYS A 46 9.875 12.664 24.866 1.00 2.61 H new ATOM 0 HZ3 LYS A 46 8.810 12.931 26.161 1.00 2.61 H new ATOM 743 N LYS A 47 4.907 9.527 22.047 1.00 0.40 N ATOM 744 CA LYS A 47 5.297 8.800 20.803 1.00 0.51 C ATOM 745 C LYS A 47 4.825 9.648 19.641 1.00 0.49 C ATOM 746 O LYS A 47 5.470 9.765 18.615 1.00 0.56 O ATOM 747 CB LYS A 47 4.612 7.427 20.764 1.00 0.59 C ATOM 748 CG LYS A 47 5.304 6.488 21.758 1.00 0.67 C ATOM 749 CD LYS A 47 4.408 5.278 22.065 1.00 0.92 C ATOM 750 CE LYS A 47 4.531 4.245 20.951 1.00 1.19 C ATOM 751 NZ LYS A 47 3.632 3.091 21.248 1.00 1.55 N ATOM 0 H LYS A 47 4.200 9.066 22.620 1.00 0.40 H new ATOM 0 HA LYS A 47 6.374 8.639 20.760 1.00 0.51 H new ATOM 0 HB2 LYS A 47 3.556 7.527 21.015 1.00 0.59 H new ATOM 0 HB3 LYS A 47 4.662 7.011 19.758 1.00 0.59 H new ATOM 0 HG2 LYS A 47 6.255 6.149 21.346 1.00 0.67 H new ATOM 0 HG3 LYS A 47 5.529 7.025 22.679 1.00 0.67 H new ATOM 0 HD2 LYS A 47 4.696 4.834 23.018 1.00 0.92 H new ATOM 0 HD3 LYS A 47 3.371 5.598 22.163 1.00 0.92 H new ATOM 0 HE2 LYS A 47 4.264 4.692 19.993 1.00 1.19 H new ATOM 0 HE3 LYS A 47 5.563 3.905 20.867 1.00 1.19 H new ATOM 0 HZ1 LYS A 47 3.738 2.369 20.508 1.00 1.55 H new ATOM 0 HZ2 LYS A 47 3.885 2.682 22.170 1.00 1.55 H new ATOM 0 HZ3 LYS A 47 2.645 3.418 21.274 1.00 1.55 H new ATOM 765 N HIS A 48 3.736 10.325 19.844 1.00 0.42 N ATOM 766 CA HIS A 48 3.234 11.247 18.799 1.00 0.40 C ATOM 767 C HIS A 48 4.277 12.360 18.644 1.00 0.39 C ATOM 768 O HIS A 48 4.869 12.573 17.589 1.00 0.45 O ATOM 769 CB HIS A 48 1.892 11.810 19.277 1.00 0.36 C ATOM 770 CG HIS A 48 1.372 12.753 18.253 1.00 0.32 C ATOM 771 ND1 HIS A 48 0.609 12.338 17.153 1.00 0.39 N ATOM 772 CD2 HIS A 48 1.512 14.095 18.132 1.00 0.27 C ATOM 773 CE1 HIS A 48 0.327 13.437 16.425 1.00 0.36 C ATOM 774 NE2 HIS A 48 0.856 14.493 17.002 1.00 0.29 N ATOM 0 H HIS A 48 3.170 10.279 20.692 1.00 0.42 H new ATOM 0 HA HIS A 48 3.084 10.753 17.839 1.00 0.40 H new ATOM 0 HB2 HIS A 48 1.180 11.001 19.440 1.00 0.36 H new ATOM 0 HB3 HIS A 48 2.017 12.321 20.231 1.00 0.36 H new ATOM 0 HD1 HIS A 48 0.321 11.382 16.943 1.00 0.39 H new ATOM 0 HD2 HIS A 48 2.050 14.739 18.812 1.00 0.27 H new ATOM 0 HE1 HIS A 48 -0.245 13.448 15.509 1.00 0.36 H new ATOM 782 N THR A 49 4.521 13.072 19.702 1.00 0.35 N ATOM 783 CA THR A 49 5.515 14.165 19.673 1.00 0.40 C ATOM 784 C THR A 49 6.817 13.709 19.016 1.00 0.49 C ATOM 785 O THR A 49 7.455 14.469 18.312 1.00 0.56 O ATOM 786 CB THR A 49 5.830 14.562 21.108 1.00 0.40 C ATOM 787 OG1 THR A 49 6.268 13.412 21.812 1.00 0.45 O ATOM 788 CG2 THR A 49 4.581 15.128 21.778 1.00 0.35 C ATOM 0 H THR A 49 4.062 12.937 20.603 1.00 0.35 H new ATOM 0 HA THR A 49 5.101 14.997 19.103 1.00 0.40 H new ATOM 0 HB THR A 49 6.609 15.324 21.116 1.00 0.40 H new ATOM 0 HG1 THR A 49 6.155 12.620 21.247 1.00 0.45 H new ATOM 0 HG21 THR A 49 4.815 15.410 22.805 1.00 0.35 H new ATOM 0 HG22 THR A 49 4.240 16.006 21.229 1.00 0.35 H new ATOM 0 HG23 THR A 49 3.795 14.373 21.779 1.00 0.35 H new ATOM 796 N PHE A 50 7.231 12.485 19.222 1.00 0.52 N ATOM 797 CA PHE A 50 8.501 12.026 18.575 1.00 0.63 C ATOM 798 C PHE A 50 8.295 11.909 17.057 1.00 0.67 C ATOM 799 O PHE A 50 9.203 12.166 16.290 1.00 0.76 O ATOM 800 CB PHE A 50 8.936 10.675 19.169 1.00 0.68 C ATOM 801 CG PHE A 50 9.728 10.923 20.449 1.00 0.68 C ATOM 802 CD1 PHE A 50 9.370 11.974 21.311 1.00 0.64 C ATOM 803 CD2 PHE A 50 10.815 10.099 20.780 1.00 0.77 C ATOM 804 CE1 PHE A 50 10.100 12.201 22.485 1.00 0.68 C ATOM 805 CE2 PHE A 50 11.544 10.331 21.957 1.00 0.80 C ATOM 806 CZ PHE A 50 11.181 11.378 22.810 1.00 0.75 C ATOM 0 H PHE A 50 6.755 11.792 19.800 1.00 0.52 H new ATOM 0 HA PHE A 50 9.288 12.755 18.766 1.00 0.63 H new ATOM 0 HB2 PHE A 50 8.062 10.059 19.381 1.00 0.68 H new ATOM 0 HB3 PHE A 50 9.545 10.127 18.450 1.00 0.68 H new ATOM 0 HD1 PHE A 50 8.530 12.608 21.068 1.00 0.64 H new ATOM 0 HD2 PHE A 50 11.091 9.284 20.127 1.00 0.77 H new ATOM 0 HE1 PHE A 50 9.826 13.014 23.141 1.00 0.68 H new ATOM 0 HE2 PHE A 50 12.386 9.701 22.204 1.00 0.80 H new ATOM 0 HZ PHE A 50 11.736 11.550 23.720 1.00 0.75 H new ATOM 816 N ILE A 51 7.099 11.574 16.608 1.00 0.62 N ATOM 817 CA ILE A 51 6.882 11.520 15.121 1.00 0.66 C ATOM 818 C ILE A 51 7.037 12.955 14.558 1.00 0.68 C ATOM 819 O ILE A 51 7.525 13.138 13.460 1.00 0.76 O ATOM 820 CB ILE A 51 5.515 10.916 14.734 1.00 0.59 C ATOM 821 CG1 ILE A 51 4.418 11.982 14.797 1.00 0.66 C ATOM 822 CG2 ILE A 51 5.162 9.760 15.672 1.00 0.50 C ATOM 823 CD1 ILE A 51 3.066 11.351 14.462 1.00 0.63 C ATOM 0 H ILE A 51 6.291 11.343 17.186 1.00 0.62 H new ATOM 0 HA ILE A 51 7.628 10.856 14.685 1.00 0.66 H new ATOM 0 HB ILE A 51 5.585 10.541 13.713 1.00 0.59 H new ATOM 0 HG12 ILE A 51 4.386 12.426 15.792 1.00 0.66 H new ATOM 0 HG13 ILE A 51 4.639 12.786 14.095 1.00 0.66 H new ATOM 0 HG21 ILE A 51 4.196 9.343 15.388 1.00 0.50 H new ATOM 0 HG22 ILE A 51 5.926 8.986 15.600 1.00 0.50 H new ATOM 0 HG23 ILE A 51 5.112 10.126 16.698 1.00 0.50 H new ATOM 0 HD11 ILE A 51 2.288 12.113 14.508 1.00 0.63 H new ATOM 0 HD12 ILE A 51 3.101 10.928 13.458 1.00 0.63 H new ATOM 0 HD13 ILE A 51 2.845 10.562 15.181 1.00 0.63 H new ATOM 835 N HIS A 52 6.675 13.976 15.307 1.00 0.63 N ATOM 836 CA HIS A 52 6.877 15.407 14.785 1.00 0.69 C ATOM 837 C HIS A 52 8.337 15.831 14.900 1.00 0.77 C ATOM 838 O HIS A 52 8.851 16.609 14.115 1.00 0.84 O ATOM 839 CB HIS A 52 6.201 16.442 15.655 1.00 0.64 C ATOM 840 CG HIS A 52 4.753 16.547 15.397 1.00 0.56 C ATOM 841 ND1 HIS A 52 4.206 17.119 14.237 1.00 0.58 N ATOM 842 CD2 HIS A 52 3.716 16.236 16.196 1.00 0.46 C ATOM 843 CE1 HIS A 52 2.863 17.133 14.401 1.00 0.50 C ATOM 844 NE2 HIS A 52 2.555 16.609 15.580 1.00 0.42 N ATOM 0 H HIS A 52 6.258 13.903 16.235 1.00 0.63 H new ATOM 0 HA HIS A 52 6.488 15.375 13.767 1.00 0.69 H new ATOM 0 HB2 HIS A 52 6.361 16.190 16.703 1.00 0.64 H new ATOM 0 HB3 HIS A 52 6.667 17.413 15.486 1.00 0.64 H new ATOM 0 HD1 HIS A 52 4.722 17.459 13.426 1.00 0.58 H new ATOM 0 HD2 HIS A 52 3.789 15.768 17.166 1.00 0.46 H new ATOM 0 HE1 HIS A 52 2.151 17.512 13.683 1.00 0.50 H new ATOM 852 N THR A 53 8.992 15.368 15.910 1.00 0.77 N ATOM 853 CA THR A 53 10.411 15.759 16.104 1.00 0.84 C ATOM 854 C THR A 53 11.211 14.904 15.169 1.00 0.91 C ATOM 855 O THR A 53 12.394 15.106 14.941 1.00 0.99 O ATOM 856 CB THR A 53 10.873 15.413 17.531 1.00 0.80 C ATOM 857 OG1 THR A 53 10.696 14.020 17.740 1.00 0.69 O ATOM 858 CG2 THR A 53 10.075 16.178 18.585 1.00 0.90 C ATOM 0 H THR A 53 8.612 14.735 16.614 1.00 0.77 H new ATOM 0 HA THR A 53 10.534 16.828 15.930 1.00 0.84 H new ATOM 0 HB THR A 53 11.921 15.696 17.630 1.00 0.80 H new ATOM 0 HG1 THR A 53 10.092 13.661 17.057 1.00 0.69 H new ATOM 0 HG21 THR A 53 10.431 15.906 19.579 1.00 0.90 H new ATOM 0 HG22 THR A 53 10.205 17.249 18.433 1.00 0.90 H new ATOM 0 HG23 THR A 53 9.019 15.925 18.496 1.00 0.90 H new ATOM 866 N GLY A 54 10.581 13.863 14.715 1.00 0.90 N ATOM 867 CA GLY A 54 11.270 12.870 13.899 1.00 0.98 C ATOM 868 C GLY A 54 12.254 12.219 14.849 1.00 0.97 C ATOM 869 O GLY A 54 13.438 12.404 14.747 1.00 1.09 O ATOM 0 H GLY A 54 9.595 13.666 14.887 1.00 0.90 H new ATOM 0 HA2 GLY A 54 10.572 12.140 13.488 1.00 0.98 H new ATOM 0 HA3 GLY A 54 11.780 13.334 13.055 1.00 0.98 H new ATOM 873 N GLU A 55 11.757 11.475 15.793 1.00 0.84 N ATOM 874 CA GLU A 55 12.666 10.824 16.771 1.00 0.82 C ATOM 875 C GLU A 55 12.460 9.320 16.692 1.00 0.76 C ATOM 876 O GLU A 55 11.348 8.846 16.764 1.00 0.80 O ATOM 877 CB GLU A 55 12.349 11.327 18.184 1.00 0.81 C ATOM 878 CG GLU A 55 13.157 12.596 18.468 1.00 0.90 C ATOM 879 CD GLU A 55 12.801 13.126 19.858 1.00 1.27 C ATOM 880 OE1 GLU A 55 11.819 12.668 20.413 1.00 1.84 O ATOM 881 OE2 GLU A 55 13.519 13.990 20.343 1.00 1.92 O ATOM 0 H GLU A 55 10.763 11.290 15.930 1.00 0.84 H new ATOM 0 HA GLU A 55 13.704 11.067 16.541 1.00 0.82 H new ATOM 0 HB2 GLU A 55 11.283 11.534 18.277 1.00 0.81 H new ATOM 0 HB3 GLU A 55 12.590 10.558 18.918 1.00 0.81 H new ATOM 0 HG2 GLU A 55 14.224 12.381 18.411 1.00 0.90 H new ATOM 0 HG3 GLU A 55 12.944 13.353 17.713 1.00 0.90 H new ATOM 888 N LYS A 56 13.509 8.573 16.539 1.00 0.71 N ATOM 889 CA LYS A 56 13.361 7.092 16.447 1.00 0.66 C ATOM 890 C LYS A 56 14.389 6.424 17.356 1.00 0.66 C ATOM 891 O LYS A 56 15.414 5.965 16.902 1.00 0.66 O ATOM 892 CB LYS A 56 13.607 6.658 14.997 1.00 0.64 C ATOM 893 CG LYS A 56 12.642 7.388 14.049 1.00 0.54 C ATOM 894 CD LYS A 56 11.321 6.616 13.955 1.00 1.26 C ATOM 895 CE LYS A 56 10.320 7.401 13.097 1.00 1.27 C ATOM 896 NZ LYS A 56 9.537 8.319 13.969 1.00 1.22 N ATOM 0 H LYS A 56 14.466 8.919 16.473 1.00 0.71 H new ATOM 0 HA LYS A 56 12.358 6.799 16.757 1.00 0.66 H new ATOM 0 HB2 LYS A 56 14.637 6.875 14.715 1.00 0.64 H new ATOM 0 HB3 LYS A 56 13.472 5.580 14.905 1.00 0.64 H new ATOM 0 HG2 LYS A 56 12.458 8.399 14.411 1.00 0.54 H new ATOM 0 HG3 LYS A 56 13.090 7.481 13.060 1.00 0.54 H new ATOM 0 HD2 LYS A 56 11.494 5.632 13.519 1.00 1.26 H new ATOM 0 HD3 LYS A 56 10.911 6.455 14.952 1.00 1.26 H new ATOM 0 HE2 LYS A 56 10.848 7.970 12.332 1.00 1.27 H new ATOM 0 HE3 LYS A 56 9.651 6.714 12.579 1.00 1.27 H new ATOM 0 HZ1 LYS A 56 8.629 7.875 14.214 1.00 1.22 H new ATOM 0 HZ2 LYS A 56 10.073 8.514 14.838 1.00 1.22 H new ATOM 0 HZ3 LYS A 56 9.360 9.211 13.464 1.00 1.22 H new ATOM 910 N PRO A 57 14.127 6.378 18.636 1.00 0.69 N ATOM 911 CA PRO A 57 15.058 5.751 19.613 1.00 0.70 C ATOM 912 C PRO A 57 15.126 4.221 19.474 1.00 0.64 C ATOM 913 O PRO A 57 15.840 3.567 20.211 1.00 0.67 O ATOM 914 CB PRO A 57 14.496 6.153 20.980 1.00 0.77 C ATOM 915 CG PRO A 57 13.050 6.453 20.748 1.00 0.77 C ATOM 916 CD PRO A 57 12.921 6.917 19.297 1.00 0.73 C ATOM 0 HA PRO A 57 16.083 6.087 19.456 1.00 0.70 H new ATOM 0 HB2 PRO A 57 14.618 5.349 21.706 1.00 0.77 H new ATOM 0 HB3 PRO A 57 15.018 7.023 21.378 1.00 0.77 H new ATOM 0 HG2 PRO A 57 12.438 5.569 20.927 1.00 0.77 H new ATOM 0 HG3 PRO A 57 12.701 7.226 21.433 1.00 0.77 H new ATOM 0 HD2 PRO A 57 12.010 6.535 18.836 1.00 0.73 H new ATOM 0 HD3 PRO A 57 12.881 8.004 19.228 1.00 0.73 H new ATOM 924 N HIS A 58 14.402 3.641 18.535 1.00 0.57 N ATOM 925 CA HIS A 58 14.460 2.149 18.369 1.00 0.52 C ATOM 926 C HIS A 58 15.122 1.826 17.027 1.00 0.46 C ATOM 927 O HIS A 58 14.470 1.740 16.010 1.00 0.43 O ATOM 928 CB HIS A 58 13.047 1.565 18.420 1.00 0.51 C ATOM 929 CG HIS A 58 12.497 1.770 19.800 1.00 0.59 C ATOM 930 ND1 HIS A 58 12.937 1.029 20.886 1.00 0.66 N ATOM 931 CD2 HIS A 58 11.552 2.632 20.293 1.00 0.67 C ATOM 932 CE1 HIS A 58 12.259 1.454 21.968 1.00 0.74 C ATOM 933 NE2 HIS A 58 11.401 2.432 21.660 1.00 0.75 N ATOM 0 H HIS A 58 13.784 4.129 17.887 1.00 0.57 H new ATOM 0 HA HIS A 58 15.044 1.708 19.177 1.00 0.52 H new ATOM 0 HB2 HIS A 58 12.409 2.051 17.682 1.00 0.51 H new ATOM 0 HB3 HIS A 58 13.067 0.503 18.174 1.00 0.51 H new ATOM 0 HD2 HIS A 58 11.007 3.357 19.707 1.00 0.67 H new ATOM 0 HE1 HIS A 58 12.392 1.054 22.963 1.00 0.74 H new ATOM 0 HE2 HIS A 58 10.771 2.925 22.292 1.00 0.75 H new ATOM 941 N LYS A 59 16.418 1.684 17.010 1.00 0.46 N ATOM 942 CA LYS A 59 17.107 1.417 15.719 1.00 0.44 C ATOM 943 C LYS A 59 17.322 -0.065 15.478 1.00 0.38 C ATOM 944 O LYS A 59 17.818 -0.787 16.318 1.00 0.41 O ATOM 945 CB LYS A 59 18.466 2.099 15.717 1.00 0.55 C ATOM 946 CG LYS A 59 18.266 3.592 15.910 1.00 1.20 C ATOM 947 CD LYS A 59 19.612 4.309 15.849 1.00 1.52 C ATOM 948 CE LYS A 59 19.383 5.804 16.067 1.00 1.47 C ATOM 949 NZ LYS A 59 18.830 6.019 17.434 1.00 1.79 N ATOM 0 H LYS A 59 17.025 1.741 17.828 1.00 0.46 H new ATOM 0 HA LYS A 59 16.467 1.807 14.928 1.00 0.44 H new ATOM 0 HB2 LYS A 59 19.091 1.696 16.514 1.00 0.55 H new ATOM 0 HB3 LYS A 59 18.983 1.906 14.777 1.00 0.55 H new ATOM 0 HG2 LYS A 59 17.602 3.981 15.139 1.00 1.20 H new ATOM 0 HG3 LYS A 59 17.786 3.782 16.870 1.00 1.20 H new ATOM 0 HD2 LYS A 59 20.285 3.915 16.611 1.00 1.52 H new ATOM 0 HD3 LYS A 59 20.088 4.137 14.884 1.00 1.52 H new ATOM 0 HE2 LYS A 59 20.320 6.349 15.951 1.00 1.47 H new ATOM 0 HE3 LYS A 59 18.693 6.192 15.317 1.00 1.47 H new ATOM 0 HZ1 LYS A 59 19.324 6.814 17.887 1.00 1.79 H new ATOM 0 HZ2 LYS A 59 17.815 6.234 17.368 1.00 1.79 H new ATOM 0 HZ3 LYS A 59 18.965 5.159 18.002 1.00 1.79 H new ATOM 963 N CYS A 60 17.008 -0.502 14.298 1.00 0.33 N ATOM 964 CA CYS A 60 17.249 -1.927 13.945 1.00 0.29 C ATOM 965 C CYS A 60 18.734 -2.050 13.586 1.00 0.34 C ATOM 966 O CYS A 60 19.206 -1.448 12.640 1.00 0.39 O ATOM 967 CB CYS A 60 16.360 -2.335 12.758 1.00 0.25 C ATOM 968 SG CYS A 60 17.247 -3.517 11.714 1.00 0.30 S ATOM 0 H CYS A 60 16.594 0.065 13.558 1.00 0.33 H new ATOM 0 HA CYS A 60 17.002 -2.588 14.775 1.00 0.29 H new ATOM 0 HB2 CYS A 60 15.433 -2.779 13.121 1.00 0.25 H new ATOM 0 HB3 CYS A 60 16.086 -1.455 12.176 1.00 0.25 H new ATOM 973 N GLN A 61 19.467 -2.834 14.333 1.00 0.37 N ATOM 974 CA GLN A 61 20.923 -3.011 14.051 1.00 0.45 C ATOM 975 C GLN A 61 21.099 -4.074 12.989 1.00 0.40 C ATOM 976 O GLN A 61 22.185 -4.567 12.761 1.00 0.47 O ATOM 977 CB GLN A 61 21.653 -3.483 15.308 1.00 0.55 C ATOM 978 CG GLN A 61 21.001 -2.904 16.564 1.00 0.95 C ATOM 979 CD GLN A 61 21.106 -1.378 16.554 1.00 1.85 C ATOM 980 OE1 GLN A 61 22.040 -0.823 16.009 1.00 2.78 O ATOM 981 NE2 GLN A 61 20.180 -0.674 17.144 1.00 2.18 N ATOM 0 H GLN A 61 19.117 -3.363 15.132 1.00 0.37 H new ATOM 0 HA GLN A 61 21.330 -2.056 13.720 1.00 0.45 H new ATOM 0 HB2 GLN A 61 21.639 -4.572 15.355 1.00 0.55 H new ATOM 0 HB3 GLN A 61 22.699 -3.179 15.262 1.00 0.55 H new ATOM 0 HG2 GLN A 61 19.954 -3.204 16.611 1.00 0.95 H new ATOM 0 HG3 GLN A 61 21.488 -3.304 17.453 1.00 0.95 H new ATOM 0 HE21 GLN A 61 19.397 -1.142 17.601 1.00 2.18 H new ATOM 0 HE22 GLN A 61 20.239 0.344 17.149 1.00 2.18 H new ATOM 990 N VAL A 62 20.038 -4.442 12.349 1.00 0.34 N ATOM 991 CA VAL A 62 20.127 -5.492 11.306 1.00 0.35 C ATOM 992 C VAL A 62 20.209 -4.878 9.917 1.00 0.37 C ATOM 993 O VAL A 62 21.191 -5.033 9.221 1.00 0.47 O ATOM 994 CB VAL A 62 18.899 -6.399 11.383 1.00 0.35 C ATOM 995 CG1 VAL A 62 19.130 -7.631 10.496 1.00 0.43 C ATOM 996 CG2 VAL A 62 18.712 -6.847 12.832 1.00 0.43 C ATOM 0 H VAL A 62 19.105 -4.060 12.502 1.00 0.34 H new ATOM 0 HA VAL A 62 21.032 -6.072 11.484 1.00 0.35 H new ATOM 0 HB VAL A 62 18.013 -5.864 11.042 1.00 0.35 H new ATOM 0 HG11 VAL A 62 18.258 -8.283 10.545 1.00 0.43 H new ATOM 0 HG12 VAL A 62 19.287 -7.313 9.465 1.00 0.43 H new ATOM 0 HG13 VAL A 62 20.009 -8.172 10.847 1.00 0.43 H new ATOM 0 HG21 VAL A 62 17.839 -7.495 12.903 1.00 0.43 H new ATOM 0 HG22 VAL A 62 19.596 -7.392 13.161 1.00 0.43 H new ATOM 0 HG23 VAL A 62 18.567 -5.973 13.467 1.00 0.43 H new ATOM 1006 N CYS A 63 19.167 -4.217 9.488 1.00 0.33 N ATOM 1007 CA CYS A 63 19.176 -3.644 8.108 1.00 0.37 C ATOM 1008 C CYS A 63 19.324 -2.106 8.089 1.00 0.42 C ATOM 1009 O CYS A 63 19.549 -1.544 7.041 1.00 0.59 O ATOM 1010 CB CYS A 63 17.910 -4.080 7.368 1.00 0.35 C ATOM 1011 SG CYS A 63 16.470 -3.212 8.020 1.00 0.32 S ATOM 0 H CYS A 63 18.317 -4.049 10.026 1.00 0.33 H new ATOM 0 HA CYS A 63 20.057 -4.034 7.598 1.00 0.37 H new ATOM 0 HB2 CYS A 63 18.015 -3.874 6.303 1.00 0.35 H new ATOM 0 HB3 CYS A 63 17.772 -5.156 7.473 1.00 0.35 H new ATOM 1016 N GLY A 64 19.277 -1.414 9.212 1.00 0.41 N ATOM 1017 CA GLY A 64 19.517 0.081 9.149 1.00 0.48 C ATOM 1018 C GLY A 64 18.270 0.924 9.451 1.00 0.46 C ATOM 1019 O GLY A 64 18.375 2.124 9.596 1.00 0.53 O ATOM 0 H GLY A 64 19.091 -1.797 10.139 1.00 0.41 H new ATOM 0 HA2 GLY A 64 20.302 0.343 9.859 1.00 0.48 H new ATOM 0 HA3 GLY A 64 19.886 0.338 8.156 1.00 0.48 H new ATOM 1023 N LYS A 65 17.089 0.358 9.503 1.00 0.39 N ATOM 1024 CA LYS A 65 15.870 1.213 9.750 1.00 0.39 C ATOM 1025 C LYS A 65 15.728 1.578 11.240 1.00 0.40 C ATOM 1026 O LYS A 65 16.420 1.057 12.092 1.00 0.42 O ATOM 1027 CB LYS A 65 14.625 0.444 9.278 1.00 0.36 C ATOM 1028 CG LYS A 65 13.717 1.335 8.403 1.00 0.46 C ATOM 1029 CD LYS A 65 12.734 0.435 7.642 1.00 0.52 C ATOM 1030 CE LYS A 65 12.147 1.174 6.434 1.00 0.68 C ATOM 1031 NZ LYS A 65 11.327 0.227 5.618 1.00 0.77 N ATOM 0 H LYS A 65 16.910 -0.640 9.388 1.00 0.39 H new ATOM 0 HA LYS A 65 15.976 2.144 9.193 1.00 0.39 H new ATOM 0 HB2 LYS A 65 14.931 -0.436 8.711 1.00 0.36 H new ATOM 0 HB3 LYS A 65 14.065 0.088 10.143 1.00 0.36 H new ATOM 0 HG2 LYS A 65 13.174 2.047 9.024 1.00 0.46 H new ATOM 0 HG3 LYS A 65 14.318 1.916 7.703 1.00 0.46 H new ATOM 0 HD2 LYS A 65 13.244 -0.469 7.309 1.00 0.52 H new ATOM 0 HD3 LYS A 65 11.930 0.121 8.308 1.00 0.52 H new ATOM 0 HE2 LYS A 65 11.531 2.009 6.769 1.00 0.68 H new ATOM 0 HE3 LYS A 65 12.949 1.593 5.826 1.00 0.68 H new ATOM 0 HZ1 LYS A 65 11.720 0.167 4.657 1.00 0.77 H new ATOM 0 HZ2 LYS A 65 11.344 -0.715 6.058 1.00 0.77 H new ATOM 0 HZ3 LYS A 65 10.346 0.569 5.570 1.00 0.77 H new ATOM 1045 N ALA A 66 14.837 2.495 11.548 1.00 0.45 N ATOM 1046 CA ALA A 66 14.638 2.929 12.961 1.00 0.50 C ATOM 1047 C ALA A 66 13.138 3.085 13.242 1.00 0.46 C ATOM 1048 O ALA A 66 12.353 3.342 12.350 1.00 0.48 O ATOM 1049 CB ALA A 66 15.327 4.275 13.169 1.00 0.65 C ATOM 0 H ALA A 66 14.236 2.963 10.870 1.00 0.45 H new ATOM 0 HA ALA A 66 15.060 2.185 13.636 1.00 0.50 H new ATOM 0 HB1 ALA A 66 15.187 4.600 14.200 1.00 0.65 H new ATOM 0 HB2 ALA A 66 16.392 4.174 12.962 1.00 0.65 H new ATOM 0 HB3 ALA A 66 14.895 5.013 12.494 1.00 0.65 H new ATOM 1055 N PHE A 67 12.727 2.878 14.470 1.00 0.45 N ATOM 1056 CA PHE A 67 11.272 2.955 14.795 1.00 0.47 C ATOM 1057 C PHE A 67 10.988 3.782 16.051 1.00 0.52 C ATOM 1058 O PHE A 67 11.794 3.887 16.964 1.00 0.56 O ATOM 1059 CB PHE A 67 10.766 1.546 15.042 1.00 0.48 C ATOM 1060 CG PHE A 67 11.145 0.701 13.867 1.00 0.41 C ATOM 1061 CD1 PHE A 67 12.446 0.193 13.764 1.00 0.37 C ATOM 1062 CD2 PHE A 67 10.210 0.452 12.862 1.00 0.47 C ATOM 1063 CE1 PHE A 67 12.805 -0.573 12.656 1.00 0.36 C ATOM 1064 CE2 PHE A 67 10.573 -0.307 11.748 1.00 0.46 C ATOM 1065 CZ PHE A 67 11.870 -0.815 11.646 1.00 0.40 C ATOM 0 H PHE A 67 13.336 2.660 15.258 1.00 0.45 H new ATOM 0 HA PHE A 67 10.772 3.437 13.955 1.00 0.47 H new ATOM 0 HB2 PHE A 67 11.199 1.141 15.957 1.00 0.48 H new ATOM 0 HB3 PHE A 67 9.684 1.548 15.175 1.00 0.48 H new ATOM 0 HD1 PHE A 67 13.169 0.394 14.541 1.00 0.37 H new ATOM 0 HD2 PHE A 67 9.208 0.845 12.946 1.00 0.47 H new ATOM 0 HE1 PHE A 67 13.803 -0.978 12.578 1.00 0.36 H new ATOM 0 HE2 PHE A 67 9.853 -0.501 10.967 1.00 0.46 H new ATOM 0 HZ PHE A 67 12.152 -1.398 10.782 1.00 0.40 H new ATOM 1075 N SER A 68 9.823 4.349 16.083 1.00 0.56 N ATOM 1076 CA SER A 68 9.404 5.163 17.250 1.00 0.65 C ATOM 1077 C SER A 68 8.899 4.220 18.345 1.00 0.67 C ATOM 1078 O SER A 68 8.984 4.516 19.516 1.00 0.75 O ATOM 1079 CB SER A 68 8.263 6.074 16.836 1.00 0.71 C ATOM 1080 OG SER A 68 7.249 5.274 16.232 1.00 1.64 O ATOM 0 H SER A 68 9.130 4.283 15.337 1.00 0.56 H new ATOM 0 HA SER A 68 10.244 5.756 17.612 1.00 0.65 H new ATOM 0 HB2 SER A 68 7.865 6.602 17.703 1.00 0.71 H new ATOM 0 HB3 SER A 68 8.616 6.831 16.136 1.00 0.71 H new ATOM 0 HG SER A 68 6.501 5.845 15.959 1.00 1.64 H new ATOM 1086 N GLN A 69 8.351 3.091 17.967 1.00 0.67 N ATOM 1087 CA GLN A 69 7.804 2.153 18.991 1.00 0.71 C ATOM 1088 C GLN A 69 8.545 0.815 18.982 1.00 0.65 C ATOM 1089 O GLN A 69 8.974 0.319 17.955 1.00 0.64 O ATOM 1090 CB GLN A 69 6.329 1.902 18.681 1.00 0.75 C ATOM 1091 CG GLN A 69 5.699 3.173 18.113 1.00 0.91 C ATOM 1092 CD GLN A 69 4.177 3.035 18.147 1.00 0.95 C ATOM 1093 OE1 GLN A 69 3.662 2.013 18.555 1.00 1.59 O ATOM 1094 NE2 GLN A 69 3.429 4.024 17.739 1.00 1.22 N ATOM 0 H GLN A 69 8.260 2.781 16.999 1.00 0.67 H new ATOM 0 HA GLN A 69 7.930 2.605 19.975 1.00 0.71 H new ATOM 0 HB2 GLN A 69 6.232 1.085 17.966 1.00 0.75 H new ATOM 0 HB3 GLN A 69 5.804 1.597 19.586 1.00 0.75 H new ATOM 0 HG2 GLN A 69 6.011 4.040 18.695 1.00 0.91 H new ATOM 0 HG3 GLN A 69 6.039 3.337 17.090 1.00 0.91 H new ATOM 0 HE21 GLN A 69 3.861 4.882 17.396 1.00 1.22 H new ATOM 0 HE22 GLN A 69 2.413 3.938 17.763 1.00 1.22 H new ATOM 1103 N SER A 70 8.669 0.211 20.121 1.00 0.66 N ATOM 1104 CA SER A 70 9.340 -1.114 20.159 1.00 0.63 C ATOM 1105 C SER A 70 8.469 -2.102 19.399 1.00 0.62 C ATOM 1106 O SER A 70 8.947 -2.870 18.616 1.00 0.60 O ATOM 1107 CB SER A 70 9.495 -1.629 21.586 1.00 0.69 C ATOM 1108 OG SER A 70 9.993 -0.598 22.422 1.00 1.23 O ATOM 0 H SER A 70 8.341 0.568 21.018 1.00 0.66 H new ATOM 0 HA SER A 70 10.332 -1.011 19.718 1.00 0.63 H new ATOM 0 HB2 SER A 70 8.534 -1.980 21.961 1.00 0.69 H new ATOM 0 HB3 SER A 70 10.174 -2.481 21.602 1.00 0.69 H new ATOM 0 HG SER A 70 10.069 -0.930 23.341 1.00 1.23 H new ATOM 1114 N SER A 71 7.181 -2.073 19.617 1.00 0.67 N ATOM 1115 CA SER A 71 6.290 -3.018 18.899 1.00 0.70 C ATOM 1116 C SER A 71 6.615 -2.980 17.418 1.00 0.63 C ATOM 1117 O SER A 71 6.688 -4.004 16.766 1.00 0.64 O ATOM 1118 CB SER A 71 4.835 -2.623 19.103 1.00 0.80 C ATOM 1119 OG SER A 71 4.032 -3.368 18.196 1.00 1.80 O ATOM 0 H SER A 71 6.712 -1.436 20.261 1.00 0.67 H new ATOM 0 HA SER A 71 6.445 -4.024 19.290 1.00 0.70 H new ATOM 0 HB2 SER A 71 4.529 -2.822 20.130 1.00 0.80 H new ATOM 0 HB3 SER A 71 4.706 -1.554 18.933 1.00 0.80 H new ATOM 0 HG SER A 71 3.399 -3.922 18.699 1.00 1.80 H new ATOM 1125 N ASN A 72 6.827 -1.823 16.865 1.00 0.59 N ATOM 1126 CA ASN A 72 7.163 -1.801 15.416 1.00 0.54 C ATOM 1127 C ASN A 72 8.592 -2.357 15.247 1.00 0.47 C ATOM 1128 O ASN A 72 8.882 -3.074 14.308 1.00 0.45 O ATOM 1129 CB ASN A 72 7.008 -0.391 14.855 1.00 0.55 C ATOM 1130 CG ASN A 72 5.525 -0.012 14.978 1.00 0.65 C ATOM 1131 OD1 ASN A 72 4.762 -0.742 15.575 1.00 0.82 O ATOM 1132 ND2 ASN A 72 5.072 1.090 14.442 1.00 0.74 N ATOM 0 H ASN A 72 6.785 -0.918 17.333 1.00 0.59 H new ATOM 0 HA ASN A 72 6.478 -2.430 14.847 1.00 0.54 H new ATOM 0 HB2 ASN A 72 7.632 0.313 15.406 1.00 0.55 H new ATOM 0 HB3 ASN A 72 7.329 -0.354 13.814 1.00 0.55 H new ATOM 0 HD21 ASN A 72 4.084 1.330 14.527 1.00 0.74 H new ATOM 0 HD22 ASN A 72 5.706 1.710 13.938 1.00 0.74 H new ATOM 1139 N LEU A 73 9.463 -2.108 16.207 1.00 0.46 N ATOM 1140 CA LEU A 73 10.841 -2.707 16.151 1.00 0.41 C ATOM 1141 C LEU A 73 10.652 -4.225 16.261 1.00 0.44 C ATOM 1142 O LEU A 73 11.134 -4.972 15.453 1.00 0.42 O ATOM 1143 CB LEU A 73 11.698 -2.202 17.332 1.00 0.44 C ATOM 1144 CG LEU A 73 13.089 -2.866 17.313 1.00 0.42 C ATOM 1145 CD1 LEU A 73 13.666 -2.876 15.898 1.00 0.44 C ATOM 1146 CD2 LEU A 73 14.040 -2.091 18.227 1.00 0.52 C ATOM 0 H LEU A 73 9.279 -1.520 17.020 1.00 0.46 H new ATOM 0 HA LEU A 73 11.352 -2.428 15.230 1.00 0.41 H new ATOM 0 HB2 LEU A 73 11.805 -1.119 17.274 1.00 0.44 H new ATOM 0 HB3 LEU A 73 11.196 -2.423 18.274 1.00 0.44 H new ATOM 0 HG LEU A 73 12.982 -3.893 17.662 1.00 0.42 H new ATOM 0 HD11 LEU A 73 14.648 -3.349 15.909 1.00 0.44 H new ATOM 0 HD12 LEU A 73 13.002 -3.434 15.238 1.00 0.44 H new ATOM 0 HD13 LEU A 73 13.761 -1.852 15.536 1.00 0.44 H new ATOM 0 HD21 LEU A 73 15.023 -2.562 18.212 1.00 0.52 H new ATOM 0 HD22 LEU A 73 14.125 -1.063 17.876 1.00 0.52 H new ATOM 0 HD23 LEU A 73 13.651 -2.096 19.245 1.00 0.52 H new ATOM 1158 N ILE A 74 9.948 -4.673 17.250 1.00 0.51 N ATOM 1159 CA ILE A 74 9.690 -6.126 17.427 1.00 0.56 C ATOM 1160 C ILE A 74 9.125 -6.742 16.139 1.00 0.55 C ATOM 1161 O ILE A 74 9.663 -7.701 15.631 1.00 0.56 O ATOM 1162 CB ILE A 74 8.683 -6.299 18.565 1.00 0.66 C ATOM 1163 CG1 ILE A 74 9.279 -5.676 19.827 1.00 0.70 C ATOM 1164 CG2 ILE A 74 8.393 -7.787 18.812 1.00 0.73 C ATOM 1165 CD1 ILE A 74 8.349 -5.907 21.010 1.00 0.83 C ATOM 0 H ILE A 74 9.527 -4.080 17.965 1.00 0.51 H new ATOM 0 HA ILE A 74 10.625 -6.634 17.662 1.00 0.56 H new ATOM 0 HB ILE A 74 7.745 -5.810 18.301 1.00 0.66 H new ATOM 0 HG12 ILE A 74 10.257 -6.113 20.031 1.00 0.70 H new ATOM 0 HG13 ILE A 74 9.432 -4.607 19.678 1.00 0.70 H new ATOM 0 HG21 ILE A 74 7.674 -7.888 19.625 1.00 0.73 H new ATOM 0 HG22 ILE A 74 7.981 -8.233 17.907 1.00 0.73 H new ATOM 0 HG23 ILE A 74 9.318 -8.298 19.080 1.00 0.73 H new ATOM 0 HD11 ILE A 74 8.781 -5.460 21.905 1.00 0.83 H new ATOM 0 HD12 ILE A 74 7.381 -5.449 20.807 1.00 0.83 H new ATOM 0 HD13 ILE A 74 8.218 -6.978 21.166 1.00 0.83 H new ATOM 1177 N THR A 75 8.043 -6.238 15.595 1.00 0.55 N ATOM 1178 CA THR A 75 7.526 -6.873 14.356 1.00 0.55 C ATOM 1179 C THR A 75 8.622 -6.786 13.297 1.00 0.48 C ATOM 1180 O THR A 75 8.874 -7.713 12.555 1.00 0.51 O ATOM 1181 CB THR A 75 6.252 -6.156 13.889 1.00 0.58 C ATOM 1182 OG1 THR A 75 5.163 -6.551 14.719 1.00 0.70 O ATOM 1183 CG2 THR A 75 5.935 -6.530 12.436 1.00 0.62 C ATOM 0 H THR A 75 7.514 -5.440 15.946 1.00 0.55 H new ATOM 0 HA THR A 75 7.267 -7.917 14.536 1.00 0.55 H new ATOM 0 HB THR A 75 6.405 -5.079 13.955 1.00 0.58 H new ATOM 0 HG1 THR A 75 4.346 -6.095 14.427 1.00 0.70 H new ATOM 0 HG21 THR A 75 5.029 -6.015 12.117 1.00 0.62 H new ATOM 0 HG22 THR A 75 6.765 -6.234 11.795 1.00 0.62 H new ATOM 0 HG23 THR A 75 5.785 -7.607 12.362 1.00 0.62 H new ATOM 1191 N HIS A 76 9.283 -5.660 13.230 1.00 0.42 N ATOM 1192 CA HIS A 76 10.366 -5.472 12.230 1.00 0.36 C ATOM 1193 C HIS A 76 11.501 -6.494 12.490 1.00 0.36 C ATOM 1194 O HIS A 76 12.004 -7.157 11.579 1.00 0.38 O ATOM 1195 CB HIS A 76 10.878 -4.031 12.375 1.00 0.31 C ATOM 1196 CG HIS A 76 12.033 -3.822 11.454 1.00 0.24 C ATOM 1197 ND1 HIS A 76 11.888 -3.258 10.181 1.00 0.26 N ATOM 1198 CD2 HIS A 76 13.348 -4.177 11.566 1.00 0.21 C ATOM 1199 CE1 HIS A 76 13.095 -3.310 9.579 1.00 0.23 C ATOM 1200 NE2 HIS A 76 13.982 -3.853 10.394 1.00 0.18 N ATOM 0 H HIS A 76 9.114 -4.856 13.834 1.00 0.42 H new ATOM 0 HA HIS A 76 10.001 -5.637 11.216 1.00 0.36 H new ATOM 0 HB2 HIS A 76 10.081 -3.325 12.143 1.00 0.31 H new ATOM 0 HB3 HIS A 76 11.181 -3.843 13.405 1.00 0.31 H new ATOM 0 HD1 HIS A 76 11.029 -2.878 9.782 1.00 0.26 H new ATOM 0 HD2 HIS A 76 13.809 -4.634 12.429 1.00 0.21 H new ATOM 0 HE1 HIS A 76 13.305 -2.960 8.579 1.00 0.23 H new ATOM 1208 N SER A 77 11.890 -6.646 13.731 1.00 0.38 N ATOM 1209 CA SER A 77 12.953 -7.620 14.073 1.00 0.41 C ATOM 1210 C SER A 77 12.403 -9.019 13.836 1.00 0.48 C ATOM 1211 O SER A 77 13.113 -9.920 13.437 1.00 0.51 O ATOM 1212 CB SER A 77 13.354 -7.441 15.534 1.00 0.47 C ATOM 1213 OG SER A 77 14.400 -8.352 15.835 1.00 0.56 O ATOM 0 H SER A 77 11.509 -6.129 14.524 1.00 0.38 H new ATOM 0 HA SER A 77 13.837 -7.463 13.454 1.00 0.41 H new ATOM 0 HB2 SER A 77 13.682 -6.417 15.713 1.00 0.47 H new ATOM 0 HB3 SER A 77 12.498 -7.620 16.185 1.00 0.47 H new ATOM 0 HG SER A 77 14.667 -8.245 16.772 1.00 0.56 H new ATOM 1219 N ARG A 78 11.122 -9.197 14.055 1.00 0.53 N ATOM 1220 CA ARG A 78 10.503 -10.529 13.811 1.00 0.61 C ATOM 1221 C ARG A 78 10.682 -10.862 12.332 1.00 0.59 C ATOM 1222 O ARG A 78 10.948 -11.990 11.974 1.00 0.66 O ATOM 1223 CB ARG A 78 9.006 -10.518 14.160 1.00 0.70 C ATOM 1224 CG ARG A 78 8.838 -10.644 15.678 1.00 0.82 C ATOM 1225 CD ARG A 78 7.351 -10.673 16.054 1.00 0.95 C ATOM 1226 NE ARG A 78 7.224 -10.729 17.539 1.00 1.11 N ATOM 1227 CZ ARG A 78 6.090 -11.067 18.092 1.00 1.23 C ATOM 1228 NH1 ARG A 78 5.050 -11.332 17.349 1.00 1.36 N ATOM 1229 NH2 ARG A 78 5.992 -11.135 19.393 1.00 1.70 N ATOM 0 H ARG A 78 10.483 -8.476 14.391 1.00 0.53 H new ATOM 0 HA ARG A 78 10.985 -11.276 14.442 1.00 0.61 H new ATOM 0 HB2 ARG A 78 8.546 -9.595 13.807 1.00 0.70 H new ATOM 0 HB3 ARG A 78 8.498 -11.341 13.657 1.00 0.70 H new ATOM 0 HG2 ARG A 78 9.326 -11.553 16.029 1.00 0.82 H new ATOM 0 HG3 ARG A 78 9.328 -9.807 16.175 1.00 0.82 H new ATOM 0 HD2 ARG A 78 6.848 -9.787 15.667 1.00 0.95 H new ATOM 0 HD3 ARG A 78 6.866 -11.538 15.602 1.00 0.95 H new ATOM 0 HE ARG A 78 8.027 -10.502 18.126 1.00 1.11 H new ATOM 0 HH11 ARG A 78 5.121 -11.275 16.333 1.00 1.36 H new ATOM 0 HH12 ARG A 78 4.166 -11.596 17.784 1.00 1.36 H new ATOM 0 HH21 ARG A 78 6.801 -10.924 19.977 1.00 1.70 H new ATOM 0 HH22 ARG A 78 5.106 -11.399 19.825 1.00 1.70 H new ATOM 1243 N LYS A 79 10.551 -9.896 11.453 1.00 0.53 N ATOM 1244 CA LYS A 79 10.750 -10.221 10.021 1.00 0.54 C ATOM 1245 C LYS A 79 12.194 -10.680 9.856 1.00 0.52 C ATOM 1246 O LYS A 79 12.466 -11.674 9.211 1.00 0.56 O ATOM 1247 CB LYS A 79 10.479 -8.992 9.135 1.00 0.49 C ATOM 1248 CG LYS A 79 9.331 -9.288 8.137 1.00 0.51 C ATOM 1249 CD LYS A 79 8.030 -8.625 8.617 1.00 0.54 C ATOM 1250 CE LYS A 79 6.939 -8.780 7.550 1.00 1.18 C ATOM 1251 NZ LYS A 79 6.886 -10.195 7.083 1.00 1.93 N ATOM 0 H LYS A 79 10.321 -8.925 11.665 1.00 0.53 H new ATOM 0 HA LYS A 79 10.055 -11.002 9.713 1.00 0.54 H new ATOM 0 HB2 LYS A 79 10.216 -8.137 9.758 1.00 0.49 H new ATOM 0 HB3 LYS A 79 11.383 -8.723 8.589 1.00 0.49 H new ATOM 0 HG2 LYS A 79 9.594 -8.916 7.147 1.00 0.51 H new ATOM 0 HG3 LYS A 79 9.187 -10.365 8.045 1.00 0.51 H new ATOM 0 HD2 LYS A 79 7.703 -9.080 9.552 1.00 0.54 H new ATOM 0 HD3 LYS A 79 8.204 -7.568 8.821 1.00 0.54 H new ATOM 0 HE2 LYS A 79 5.973 -8.486 7.960 1.00 1.18 H new ATOM 0 HE3 LYS A 79 7.143 -8.117 6.709 1.00 1.18 H new ATOM 0 HZ1 LYS A 79 5.971 -10.374 6.621 1.00 1.93 H new ATOM 0 HZ2 LYS A 79 7.656 -10.366 6.405 1.00 1.93 H new ATOM 0 HZ3 LYS A 79 6.994 -10.833 7.897 1.00 1.93 H new ATOM 1265 N HIS A 80 13.131 -9.986 10.447 1.00 0.47 N ATOM 1266 CA HIS A 80 14.543 -10.457 10.314 1.00 0.48 C ATOM 1267 C HIS A 80 14.649 -11.868 10.839 1.00 0.58 C ATOM 1268 O HIS A 80 15.162 -12.752 10.188 1.00 0.65 O ATOM 1269 CB HIS A 80 15.490 -9.611 11.148 1.00 0.42 C ATOM 1270 CG HIS A 80 15.722 -8.321 10.457 1.00 0.34 C ATOM 1271 ND1 HIS A 80 15.996 -8.236 9.087 1.00 0.37 N ATOM 1272 CD2 HIS A 80 15.663 -7.048 10.916 1.00 0.27 C ATOM 1273 CE1 HIS A 80 16.077 -6.926 8.777 1.00 0.33 C ATOM 1274 NE2 HIS A 80 15.893 -6.193 9.864 1.00 0.24 N ATOM 0 H HIS A 80 12.989 -9.140 10.999 1.00 0.47 H new ATOM 0 HA HIS A 80 14.812 -10.390 9.260 1.00 0.48 H new ATOM 0 HB2 HIS A 80 15.067 -9.437 12.137 1.00 0.42 H new ATOM 0 HB3 HIS A 80 16.435 -10.135 11.293 1.00 0.42 H new ATOM 0 HD1 HIS A 80 16.113 -9.019 8.443 1.00 0.37 H new ATOM 0 HD2 HIS A 80 15.468 -6.754 11.937 1.00 0.27 H new ATOM 0 HE1 HIS A 80 16.264 -6.533 7.789 1.00 0.33 H new ATOM 1282 N THR A 81 14.209 -12.092 12.037 1.00 0.61 N ATOM 1283 CA THR A 81 14.343 -13.446 12.588 1.00 0.72 C ATOM 1284 C THR A 81 13.605 -14.430 11.677 1.00 0.79 C ATOM 1285 O THR A 81 14.169 -15.451 11.301 1.00 1.03 O ATOM 1286 CB THR A 81 13.849 -13.467 14.051 1.00 0.78 C ATOM 1287 OG1 THR A 81 12.506 -12.992 14.124 1.00 0.86 O ATOM 1288 CG2 THR A 81 14.763 -12.549 14.884 1.00 1.00 C ATOM 0 H THR A 81 13.769 -11.403 12.647 1.00 0.61 H new ATOM 0 HA THR A 81 15.387 -13.757 12.615 1.00 0.72 H new ATOM 0 HB THR A 81 13.879 -14.487 14.435 1.00 0.78 H new ATOM 0 HG1 THR A 81 12.239 -12.630 13.253 1.00 0.86 H new ATOM 0 HG21 THR A 81 14.431 -12.550 15.922 1.00 1.00 H new ATOM 0 HG22 THR A 81 15.789 -12.912 14.831 1.00 1.00 H new ATOM 0 HG23 THR A 81 14.717 -11.534 14.489 1.00 1.00 H new ATOM 1296 N GLY A 82 12.381 -14.153 11.285 1.00 0.75 N ATOM 1297 CA GLY A 82 11.681 -15.106 10.384 1.00 0.91 C ATOM 1298 C GLY A 82 11.076 -16.252 11.208 1.00 1.85 C ATOM 0 H GLY A 82 11.851 -13.322 11.548 1.00 0.75 H new ATOM 0 HA2 GLY A 82 10.896 -14.589 9.832 1.00 0.91 H new ATOM 0 HA3 GLY A 82 12.379 -15.504 9.648 1.00 0.91 H new TER 1302 GLY A 82 ATOM 1303 O5' DC B 101 3.958 -9.209 -1.789 1.00 0.00 O ATOM 1304 C5' DC B 101 5.327 -8.853 -1.999 1.00 0.00 C ATOM 1305 C4' DC B 101 5.773 -7.752 -1.042 1.00 0.00 C ATOM 1306 O4' DC B 101 4.967 -6.590 -1.245 1.00 0.00 O ATOM 1307 C3' DC B 101 5.659 -8.122 0.445 1.00 0.00 C ATOM 1308 O3' DC B 101 6.967 -8.147 1.026 1.00 0.00 O ATOM 1309 C2' DC B 101 4.831 -6.991 1.066 1.00 0.00 C ATOM 1310 C1' DC B 101 4.866 -5.909 -0.003 1.00 0.00 C ATOM 1311 N1 DC B 101 3.655 -5.062 -0.054 1.00 0.00 N ATOM 1312 C2 DC B 101 3.811 -3.696 0.141 1.00 0.00 C ATOM 1313 O2 DC B 101 4.927 -3.229 0.357 1.00 0.00 O ATOM 1314 N3 DC B 101 2.706 -2.905 0.083 1.00 0.00 N ATOM 1315 C4 DC B 101 1.497 -3.428 -0.153 1.00 0.00 C ATOM 1316 N4 DC B 101 0.436 -2.624 -0.202 1.00 0.00 N ATOM 1317 C5 DC B 101 1.330 -4.834 -0.352 1.00 0.00 C ATOM 1318 C6 DC B 101 2.429 -5.610 -0.295 1.00 0.00 C ATOM 0 H5' DC B 101 5.463 -8.519 -3.028 1.00 0.00 H new ATOM 0 H5'' DC B 101 5.957 -9.732 -1.863 1.00 0.00 H new ATOM 0 H4' DC B 101 6.826 -7.583 -1.266 1.00 0.00 H new ATOM 0 H3' DC B 101 5.204 -9.099 0.604 1.00 0.00 H new ATOM 0 H2' DC B 101 3.812 -7.310 1.283 1.00 0.00 H new ATOM 0 H2'' DC B 101 5.263 -6.644 2.005 1.00 0.00 H new ATOM 0 HO5' DC B 101 3.478 -8.448 -1.399 1.00 0.00 H new ATOM 0 H1' DC B 101 5.698 -5.242 0.220 1.00 0.00 H new ATOM 0 H41 DC B 101 -0.490 -3.012 -0.381 1.00 0.00 H new ATOM 0 H42 DC B 101 0.550 -1.620 -0.060 1.00 0.00 H new ATOM 0 H5 DC B 101 0.355 -5.259 -0.542 1.00 0.00 H new ATOM 0 H6 DC B 101 2.339 -6.676 -0.441 1.00 0.00 H new ATOM 1331 P DA B 102 7.176 -8.597 2.558 1.00 0.00 P ATOM 1332 OP1 DA B 102 8.534 -9.170 2.691 1.00 0.00 O ATOM 1333 OP2 DA B 102 5.996 -9.388 2.974 1.00 0.00 O ATOM 1334 O5' DA B 102 7.142 -7.193 3.344 1.00 0.00 O ATOM 1335 C5' DA B 102 8.184 -6.233 3.155 1.00 0.00 C ATOM 1336 C4' DA B 102 7.864 -4.914 3.852 1.00 0.00 C ATOM 1337 O4' DA B 102 6.630 -4.406 3.355 1.00 0.00 O ATOM 1338 C3' DA B 102 7.714 -5.023 5.373 1.00 0.00 C ATOM 1339 O3' DA B 102 8.854 -4.427 6.001 1.00 0.00 O ATOM 1340 C2' DA B 102 6.447 -4.220 5.702 1.00 0.00 C ATOM 1341 C1' DA B 102 6.063 -3.588 4.368 1.00 0.00 C ATOM 1342 N9 DA B 102 4.609 -3.523 4.126 1.00 0.00 N ATOM 1343 C8 DA B 102 3.738 -4.539 3.852 1.00 0.00 C ATOM 1344 N7 DA B 102 2.503 -4.173 3.682 1.00 0.00 N ATOM 1345 C5 DA B 102 2.556 -2.792 3.855 1.00 0.00 C ATOM 1346 C6 DA B 102 1.577 -1.792 3.803 1.00 0.00 C ATOM 1347 N6 DA B 102 0.293 -2.043 3.551 1.00 0.00 N ATOM 1348 N1 DA B 102 1.974 -0.527 4.021 1.00 0.00 N ATOM 1349 C2 DA B 102 3.255 -0.258 4.277 1.00 0.00 C ATOM 1350 N3 DA B 102 4.258 -1.128 4.349 1.00 0.00 N ATOM 1351 C4 DA B 102 3.833 -2.387 4.126 1.00 0.00 C ATOM 0 H5' DA B 102 8.328 -6.057 2.089 1.00 0.00 H new ATOM 0 H5'' DA B 102 9.122 -6.632 3.542 1.00 0.00 H new ATOM 0 H4' DA B 102 8.713 -4.263 3.642 1.00 0.00 H new ATOM 0 H3' DA B 102 7.643 -6.054 5.720 1.00 0.00 H new ATOM 0 H2' DA B 102 5.654 -4.863 6.084 1.00 0.00 H new ATOM 0 H2'' DA B 102 6.639 -3.464 6.463 1.00 0.00 H new ATOM 0 H1' DA B 102 6.426 -2.560 4.371 1.00 0.00 H new ATOM 0 H8 DA B 102 4.053 -5.570 3.782 1.00 0.00 H new ATOM 0 H61 DA B 102 -0.381 -1.278 3.524 1.00 0.00 H new ATOM 0 H62 DA B 102 -0.016 -3.001 3.385 1.00 0.00 H new ATOM 0 H2 DA B 102 3.505 0.779 4.444 1.00 0.00 H new ATOM 1363 P DT B 103 8.922 -4.251 7.601 1.00 0.00 P ATOM 1364 OP1 DT B 103 10.338 -4.360 8.020 1.00 0.00 O ATOM 1365 OP2 DT B 103 7.902 -5.135 8.210 1.00 0.00 O ATOM 1366 O5' DT B 103 8.452 -2.726 7.799 1.00 0.00 O ATOM 1367 C5' DT B 103 9.029 -1.691 7.000 1.00 0.00 C ATOM 1368 C4' DT B 103 8.140 -0.452 6.953 1.00 0.00 C ATOM 1369 O4' DT B 103 6.792 -0.844 6.680 1.00 0.00 O ATOM 1370 C3' DT B 103 8.105 0.363 8.259 1.00 0.00 C ATOM 1371 O3' DT B 103 8.652 1.666 8.024 1.00 0.00 O ATOM 1372 C2' DT B 103 6.618 0.484 8.592 1.00 0.00 C ATOM 1373 C1' DT B 103 5.960 0.139 7.271 1.00 0.00 C ATOM 1374 N1 DT B 103 4.588 -0.396 7.392 1.00 0.00 N ATOM 1375 C2 DT B 103 3.542 0.483 7.115 1.00 0.00 C ATOM 1376 O2 DT B 103 3.739 1.645 6.773 1.00 0.00 O ATOM 1377 N3 DT B 103 2.263 -0.031 7.244 1.00 0.00 N ATOM 1378 C4 DT B 103 1.941 -1.323 7.596 1.00 0.00 C ATOM 1379 O4 DT B 103 0.767 -1.675 7.673 1.00 0.00 O ATOM 1380 C5 DT B 103 3.074 -2.161 7.863 1.00 0.00 C ATOM 1381 C7 DT B 103 2.848 -3.616 8.275 1.00 0.00 C ATOM 1382 C6 DT B 103 4.335 -1.698 7.767 1.00 0.00 C ATOM 0 H5' DT B 103 9.192 -2.061 5.988 1.00 0.00 H new ATOM 0 H5'' DT B 103 10.006 -1.423 7.402 1.00 0.00 H new ATOM 0 H4' DT B 103 8.572 0.177 6.175 1.00 0.00 H new ATOM 0 H3' DT B 103 8.679 -0.101 9.061 1.00 0.00 H new ATOM 0 H2' DT B 103 6.322 -0.203 9.385 1.00 0.00 H new ATOM 0 H2'' DT B 103 6.357 1.488 8.926 1.00 0.00 H new ATOM 0 H1' DT B 103 5.858 1.050 6.681 1.00 0.00 H new ATOM 0 H3 DT B 103 1.488 0.606 7.061 1.00 0.00 H new ATOM 0 H71 DT B 103 3.686 -4.225 7.935 1.00 0.00 H new ATOM 0 H72 DT B 103 2.771 -3.679 9.360 1.00 0.00 H new ATOM 0 H73 DT B 103 1.926 -3.983 7.824 1.00 0.00 H new ATOM 0 H6 DT B 103 5.161 -2.358 7.987 1.00 0.00 H new ATOM 1395 P DA B 104 8.901 2.688 9.246 1.00 0.00 P ATOM 1396 OP1 DA B 104 9.950 3.650 8.836 1.00 0.00 O ATOM 1397 OP2 DA B 104 9.075 1.895 10.483 1.00 0.00 O ATOM 1398 O5' DA B 104 7.502 3.484 9.351 1.00 0.00 O ATOM 1399 C5' DA B 104 7.234 4.603 8.499 1.00 0.00 C ATOM 1400 C4' DA B 104 6.000 5.381 8.955 1.00 0.00 C ATOM 1401 O4' DA B 104 4.852 4.519 8.919 1.00 0.00 O ATOM 1402 C3' DA B 104 6.100 5.946 10.376 1.00 0.00 C ATOM 1403 O3' DA B 104 5.580 7.280 10.395 1.00 0.00 O ATOM 1404 C2' DA B 104 5.209 5.023 11.198 1.00 0.00 C ATOM 1405 C1' DA B 104 4.174 4.590 10.175 1.00 0.00 C ATOM 1406 N9 DA B 104 3.590 3.264 10.438 1.00 0.00 N ATOM 1407 C8 DA B 104 4.228 2.082 10.674 1.00 0.00 C ATOM 1408 N7 DA B 104 3.449 1.056 10.829 1.00 0.00 N ATOM 1409 C5 DA B 104 2.176 1.605 10.688 1.00 0.00 C ATOM 1410 C6 DA B 104 0.897 1.047 10.745 1.00 0.00 C ATOM 1411 N6 DA B 104 0.679 -0.245 10.981 1.00 0.00 N ATOM 1412 N1 DA B 104 -0.147 1.872 10.567 1.00 0.00 N ATOM 1413 C2 DA B 104 0.050 3.172 10.351 1.00 0.00 C ATOM 1414 N3 DA B 104 1.219 3.804 10.271 1.00 0.00 N ATOM 1415 C4 DA B 104 2.250 2.950 10.453 1.00 0.00 C ATOM 0 H5' DA B 104 7.087 4.254 7.477 1.00 0.00 H new ATOM 0 H5'' DA B 104 8.099 5.267 8.488 1.00 0.00 H new ATOM 0 H4' DA B 104 5.917 6.223 8.268 1.00 0.00 H new ATOM 0 H3' DA B 104 7.122 5.989 10.754 1.00 0.00 H new ATOM 0 H2' DA B 104 5.762 4.175 11.602 1.00 0.00 H new ATOM 0 H2'' DA B 104 4.755 5.540 12.043 1.00 0.00 H new ATOM 0 H1' DA B 104 3.354 5.308 10.204 1.00 0.00 H new ATOM 0 H8 DA B 104 5.304 2.005 10.728 1.00 0.00 H new ATOM 0 H61 DA B 104 -0.275 -0.604 11.013 1.00 0.00 H new ATOM 0 H62 DA B 104 1.466 -0.876 11.130 1.00 0.00 H new ATOM 0 H2 DA B 104 -0.835 3.779 10.227 1.00 0.00 H new ATOM 1427 P DA B 105 5.458 8.099 11.776 1.00 0.00 P ATOM 1428 OP1 DA B 105 5.538 9.544 11.467 1.00 0.00 O ATOM 1429 OP2 DA B 105 6.393 7.501 12.755 1.00 0.00 O ATOM 1430 O5' DA B 105 3.953 7.768 12.250 1.00 0.00 O ATOM 1431 C5' DA B 105 2.836 8.308 11.539 1.00 0.00 C ATOM 1432 C4' DA B 105 1.509 7.880 12.163 1.00 0.00 C ATOM 1433 O4' DA B 105 1.383 6.459 12.094 1.00 0.00 O ATOM 1434 C3' DA B 105 1.346 8.274 13.639 1.00 0.00 C ATOM 1435 O3' DA B 105 0.246 9.182 13.765 1.00 0.00 O ATOM 1436 C2' DA B 105 1.026 6.959 14.358 1.00 0.00 C ATOM 1437 C1' DA B 105 0.622 6.041 13.218 1.00 0.00 C ATOM 1438 N9 DA B 105 0.908 4.614 13.455 1.00 0.00 N ATOM 1439 C8 DA B 105 2.062 4.032 13.886 1.00 0.00 C ATOM 1440 N7 DA B 105 2.015 2.735 14.005 1.00 0.00 N ATOM 1441 C5 DA B 105 0.705 2.436 13.610 1.00 0.00 C ATOM 1442 C6 DA B 105 -0.010 1.233 13.500 1.00 0.00 C ATOM 1443 N6 DA B 105 0.515 0.047 13.802 1.00 0.00 N ATOM 1444 N1 DA B 105 -1.291 1.305 13.073 1.00 0.00 N ATOM 1445 C2 DA B 105 -1.827 2.493 12.777 1.00 0.00 C ATOM 1446 N3 DA B 105 -1.237 3.679 12.852 1.00 0.00 N ATOM 1447 C4 DA B 105 0.034 3.575 13.276 1.00 0.00 C ATOM 0 H5' DA B 105 2.872 7.980 10.500 1.00 0.00 H new ATOM 0 H5'' DA B 105 2.901 9.396 11.532 1.00 0.00 H new ATOM 0 H4' DA B 105 0.742 8.401 11.590 1.00 0.00 H new ATOM 0 H3' DA B 105 2.230 8.762 14.049 1.00 0.00 H new ATOM 0 H2' DA B 105 1.890 6.574 14.900 1.00 0.00 H new ATOM 0 H2'' DA B 105 0.222 7.080 15.084 1.00 0.00 H new ATOM 0 H1' DA B 105 -0.458 6.116 13.088 1.00 0.00 H new ATOM 0 H8 DA B 105 2.950 4.603 14.112 1.00 0.00 H new ATOM 0 H61 DA B 105 -0.047 -0.799 13.705 1.00 0.00 H new ATOM 0 H62 DA B 105 1.479 -0.015 14.130 1.00 0.00 H new ATOM 0 H2 DA B 105 -2.853 2.487 12.440 1.00 0.00 H new ATOM 1459 P DA B 106 -0.226 9.709 15.211 1.00 0.00 P ATOM 1460 OP1 DA B 106 -0.766 11.079 15.051 1.00 0.00 O ATOM 1461 OP2 DA B 106 0.865 9.454 16.178 1.00 0.00 O ATOM 1462 O5' DA B 106 -1.449 8.723 15.560 1.00 0.00 O ATOM 1463 C5' DA B 106 -2.636 8.726 14.761 1.00 0.00 C ATOM 1464 C4' DA B 106 -3.563 7.575 15.134 1.00 0.00 C ATOM 1465 O4' DA B 106 -2.844 6.343 15.012 1.00 0.00 O ATOM 1466 C3' DA B 106 -4.117 7.653 16.561 1.00 0.00 C ATOM 1467 O3' DA B 106 -5.541 7.526 16.525 1.00 0.00 O ATOM 1468 C2' DA B 106 -3.501 6.456 17.285 1.00 0.00 C ATOM 1469 C1' DA B 106 -3.111 5.524 16.148 1.00 0.00 C ATOM 1470 N9 DA B 106 -1.891 4.736 16.408 1.00 0.00 N ATOM 1471 C8 DA B 106 -0.654 5.172 16.811 1.00 0.00 C ATOM 1472 N7 DA B 106 0.253 4.243 16.861 1.00 0.00 N ATOM 1473 C5 DA B 106 -0.439 3.094 16.497 1.00 0.00 C ATOM 1474 C6 DA B 106 -0.048 1.761 16.382 1.00 0.00 C ATOM 1475 N6 DA B 106 1.197 1.343 16.611 1.00 0.00 N ATOM 1476 N1 DA B 106 -0.984 0.876 16.021 1.00 0.00 N ATOM 1477 C2 DA B 106 -2.236 1.265 15.787 1.00 0.00 C ATOM 1478 N3 DA B 106 -2.714 2.506 15.851 1.00 0.00 N ATOM 1479 C4 DA B 106 -1.746 3.379 16.222 1.00 0.00 C ATOM 0 H5' DA B 106 -2.367 8.651 13.707 1.00 0.00 H new ATOM 0 H5'' DA B 106 -3.160 9.673 14.890 1.00 0.00 H new ATOM 0 H4' DA B 106 -4.412 7.637 14.453 1.00 0.00 H new ATOM 0 H3' DA B 106 -3.881 8.596 17.054 1.00 0.00 H new ATOM 0 H2' DA B 106 -2.636 6.748 17.881 1.00 0.00 H new ATOM 0 H2'' DA B 106 -4.213 5.987 17.964 1.00 0.00 H new ATOM 0 H1' DA B 106 -3.930 4.818 16.011 1.00 0.00 H new ATOM 0 H8 DA B 106 -0.451 6.202 17.065 1.00 0.00 H new ATOM 0 H61 DA B 106 1.429 0.355 16.512 1.00 0.00 H new ATOM 0 H62 DA B 106 1.917 2.011 16.885 1.00 0.00 H new ATOM 0 H2 DA B 106 -2.939 0.491 15.516 1.00 0.00 H new ATOM 1491 P DT B 107 -6.413 7.704 17.866 1.00 0.00 P ATOM 1492 OP1 DT B 107 -7.784 8.105 17.477 1.00 0.00 O ATOM 1493 OP2 DT B 107 -5.641 8.537 18.815 1.00 0.00 O ATOM 1494 O5' DT B 107 -6.471 6.205 18.443 1.00 0.00 O ATOM 1495 C5' DT B 107 -7.111 5.171 17.692 1.00 0.00 C ATOM 1496 C4' DT B 107 -6.891 3.801 18.322 1.00 0.00 C ATOM 1497 O4' DT B 107 -5.509 3.463 18.285 1.00 0.00 O ATOM 1498 C3' DT B 107 -7.304 3.707 19.791 1.00 0.00 C ATOM 1499 O3' DT B 107 -8.588 3.082 19.888 1.00 0.00 O ATOM 1500 C2' DT B 107 -6.231 2.811 20.432 1.00 0.00 C ATOM 1501 C1' DT B 107 -5.321 2.448 19.261 1.00 0.00 C ATOM 1502 N1 DT B 107 -3.886 2.392 19.609 1.00 0.00 N ATOM 1503 C2 DT B 107 -3.290 1.146 19.644 1.00 0.00 C ATOM 1504 O2 DT B 107 -3.909 0.119 19.374 1.00 0.00 O ATOM 1505 N3 DT B 107 -1.955 1.116 20.002 1.00 0.00 N ATOM 1506 C4 DT B 107 -1.168 2.218 20.294 1.00 0.00 C ATOM 1507 O4 DT B 107 0.020 2.082 20.579 1.00 0.00 O ATOM 1508 C5 DT B 107 -1.876 3.479 20.231 1.00 0.00 C ATOM 1509 C7 DT B 107 -1.132 4.776 20.541 1.00 0.00 C ATOM 1510 C6 DT B 107 -3.186 3.530 19.908 1.00 0.00 C ATOM 0 H5' DT B 107 -6.725 5.169 16.672 1.00 0.00 H new ATOM 0 H5'' DT B 107 -8.180 5.375 17.628 1.00 0.00 H new ATOM 0 H4' DT B 107 -7.516 3.127 17.736 1.00 0.00 H new ATOM 0 H3' DT B 107 -7.376 4.681 20.275 1.00 0.00 H new ATOM 0 H2' DT B 107 -5.686 3.337 21.216 1.00 0.00 H new ATOM 0 H2'' DT B 107 -6.670 1.924 20.889 1.00 0.00 H new ATOM 0 H1' DT B 107 -5.586 1.449 18.916 1.00 0.00 H new ATOM 0 H3 DT B 107 -1.509 0.200 20.056 1.00 0.00 H new ATOM 0 H71 DT B 107 -0.335 4.576 21.257 1.00 0.00 H new ATOM 0 H72 DT B 107 -0.702 5.177 19.623 1.00 0.00 H new ATOM 0 H73 DT B 107 -1.827 5.502 20.964 1.00 0.00 H new ATOM 0 H6 DT B 107 -3.690 4.485 19.885 1.00 0.00 H new ATOM 1523 P DC B 108 -9.334 2.957 21.308 1.00 0.00 P ATOM 1524 OP1 DC B 108 -10.768 2.690 21.057 1.00 0.00 O ATOM 1525 OP2 DC B 108 -8.934 4.109 22.146 1.00 0.00 O ATOM 1526 O5' DC B 108 -8.675 1.628 21.931 1.00 0.00 O ATOM 1527 C5' DC B 108 -8.788 0.382 21.241 1.00 0.00 C ATOM 1528 C4' DC B 108 -7.944 -0.709 21.895 1.00 0.00 C ATOM 1529 O4' DC B 108 -6.560 -0.374 21.803 1.00 0.00 O ATOM 1530 C3' DC B 108 -8.247 -0.942 23.374 1.00 0.00 C ATOM 1531 O3' DC B 108 -8.908 -2.206 23.513 1.00 0.00 O ATOM 1532 C2' DC B 108 -6.871 -0.971 24.057 1.00 0.00 C ATOM 1533 C1' DC B 108 -5.897 -1.013 22.887 1.00 0.00 C ATOM 1534 N1 DC B 108 -4.624 -0.295 23.125 1.00 0.00 N ATOM 1535 C2 DC B 108 -3.462 -1.051 23.233 1.00 0.00 C ATOM 1536 O2 DC B 108 -3.509 -2.276 23.136 1.00 0.00 O ATOM 1537 N3 DC B 108 -2.285 -0.400 23.447 1.00 0.00 N ATOM 1538 C4 DC B 108 -2.248 0.936 23.551 1.00 0.00 C ATOM 1539 N4 DC B 108 -1.080 1.543 23.762 1.00 0.00 N ATOM 1540 C5 DC B 108 -3.442 1.717 23.440 1.00 0.00 C ATOM 1541 C6 DC B 108 -4.601 1.064 23.230 1.00 0.00 C ATOM 0 H5' DC B 108 -8.475 0.511 20.205 1.00 0.00 H new ATOM 0 H5'' DC B 108 -9.832 0.071 21.222 1.00 0.00 H new ATOM 0 H4' DC B 108 -8.194 -1.620 21.352 1.00 0.00 H new ATOM 0 H3' DC B 108 -8.892 -0.179 23.809 1.00 0.00 H new ATOM 0 H2' DC B 108 -6.713 -0.091 24.680 1.00 0.00 H new ATOM 0 H2'' DC B 108 -6.761 -1.842 24.703 1.00 0.00 H new ATOM 0 H1' DC B 108 -5.631 -2.054 22.706 1.00 0.00 H new ATOM 0 H41 DC B 108 -1.041 2.559 23.843 1.00 0.00 H new ATOM 0 H42 DC B 108 -0.226 0.991 23.843 1.00 0.00 H new ATOM 0 H5 DC B 108 -3.415 2.794 23.522 1.00 0.00 H new ATOM 0 H6 DC B 108 -5.521 1.623 23.144 1.00 0.00 H new ATOM 1553 P DA B 109 -9.520 -2.688 24.923 1.00 0.00 P ATOM 1554 OP1 DA B 109 -10.450 -3.810 24.666 1.00 0.00 O ATOM 1555 OP2 DA B 109 -9.990 -1.503 25.667 1.00 0.00 O ATOM 1556 O5' DA B 109 -8.228 -3.269 25.673 1.00 0.00 O ATOM 1557 C5' DA B 109 -7.503 -4.357 25.102 1.00 0.00 C ATOM 1558 C4' DA B 109 -6.276 -4.700 25.933 1.00 0.00 C ATOM 1559 O4' DA B 109 -5.245 -3.723 25.725 1.00 0.00 O ATOM 1560 C3' DA B 109 -6.541 -4.756 27.442 1.00 0.00 C ATOM 1561 O3' DA B 109 -5.993 -5.979 27.945 1.00 0.00 O ATOM 1562 C2' DA B 109 -5.771 -3.550 27.990 1.00 0.00 C ATOM 1563 C1' DA B 109 -4.644 -3.453 26.989 1.00 0.00 C ATOM 1564 N9 DA B 109 -3.929 -2.159 26.898 1.00 0.00 N ATOM 1565 C8 DA B 109 -4.405 -0.891 26.693 1.00 0.00 C ATOM 1566 N7 DA B 109 -3.484 0.026 26.577 1.00 0.00 N ATOM 1567 C5 DA B 109 -2.298 -0.695 26.731 1.00 0.00 C ATOM 1568 C6 DA B 109 -0.942 -0.325 26.722 1.00 0.00 C ATOM 1569 N6 DA B 109 -0.529 0.928 26.539 1.00 0.00 N ATOM 1570 N1 DA B 109 -0.029 -1.302 26.915 1.00 0.00 N ATOM 1571 C2 DA B 109 -0.432 -2.560 27.104 1.00 0.00 C ATOM 1572 N3 DA B 109 -1.679 -3.004 27.117 1.00 0.00 N ATOM 1573 C4 DA B 109 -2.564 -2.016 26.926 1.00 0.00 C ATOM 0 H5' DA B 109 -7.198 -4.101 24.087 1.00 0.00 H new ATOM 0 H5'' DA B 109 -8.151 -5.230 25.029 1.00 0.00 H new ATOM 0 H4' DA B 109 -5.977 -5.693 25.598 1.00 0.00 H new ATOM 0 H3' DA B 109 -7.595 -4.725 27.716 1.00 0.00 H new ATOM 0 H2' DA B 109 -6.381 -2.647 28.014 1.00 0.00 H new ATOM 0 H2'' DA B 109 -5.409 -3.717 29.004 1.00 0.00 H new ATOM 0 H1' DA B 109 -3.872 -4.152 27.311 1.00 0.00 H new ATOM 0 H8 DA B 109 -5.460 -0.668 26.632 1.00 0.00 H new ATOM 0 H61 DA B 109 0.468 1.142 26.542 1.00 0.00 H new ATOM 0 H62 DA B 109 -1.210 1.674 26.396 1.00 0.00 H new ATOM 0 H2 DA B 109 0.343 -3.295 27.264 1.00 0.00 H new ATOM 1585 P DC B 110 -6.079 -6.367 29.501 1.00 0.00 P ATOM 1586 OP1 DC B 110 -6.639 -7.733 29.606 1.00 0.00 O ATOM 1587 OP2 DC B 110 -6.721 -5.251 30.227 1.00 0.00 O ATOM 1588 O5' DC B 110 -4.523 -6.430 29.918 1.00 0.00 O ATOM 1589 C5' DC B 110 -3.651 -7.378 29.291 1.00 0.00 C ATOM 1590 C4' DC B 110 -2.191 -7.151 29.675 1.00 0.00 C ATOM 1591 O4' DC B 110 -1.796 -5.828 29.286 1.00 0.00 O ATOM 1592 C3' DC B 110 -1.908 -7.289 31.177 1.00 0.00 C ATOM 1593 O3' DC B 110 -0.792 -8.164 31.374 1.00 0.00 O ATOM 1594 C2' DC B 110 -1.545 -5.877 31.618 1.00 0.00 C ATOM 1595 C1' DC B 110 -1.015 -5.267 30.336 1.00 0.00 C ATOM 1596 N1 DC B 110 -1.151 -3.798 30.266 1.00 0.00 N ATOM 1597 C2 DC B 110 -0.035 -3.031 30.571 1.00 0.00 C ATOM 1598 O2 DC B 110 1.023 -3.577 30.875 1.00 0.00 O ATOM 1599 N3 DC B 110 -0.151 -1.675 30.521 1.00 0.00 N ATOM 1600 C4 DC B 110 -1.313 -1.095 30.190 1.00 0.00 C ATOM 1601 N4 DC B 110 -1.398 0.235 30.156 1.00 0.00 N ATOM 1602 C5 DC B 110 -2.463 -1.883 29.875 1.00 0.00 C ATOM 1603 C6 DC B 110 -2.338 -3.222 29.924 1.00 0.00 C ATOM 0 H5' DC B 110 -3.757 -7.307 28.208 1.00 0.00 H new ATOM 0 H5'' DC B 110 -3.948 -8.388 29.575 1.00 0.00 H new ATOM 0 H4' DC B 110 -1.627 -7.927 29.157 1.00 0.00 H new ATOM 0 H3' DC B 110 -2.750 -7.699 31.734 1.00 0.00 H new ATOM 0 H2' DC B 110 -2.410 -5.335 32.000 1.00 0.00 H new ATOM 0 H2'' DC B 110 -0.795 -5.878 32.409 1.00 0.00 H new ATOM 0 H1' DC B 110 0.052 -5.480 30.270 1.00 0.00 H new ATOM 0 H41 DC B 110 -2.279 0.683 29.905 1.00 0.00 H new ATOM 0 H42 DC B 110 -0.582 0.804 30.381 1.00 0.00 H new ATOM 0 H5 DC B 110 -3.401 -1.419 29.607 1.00 0.00 H new ATOM 0 H6 DC B 110 -3.187 -3.847 29.690 1.00 0.00 H new ATOM 1615 P DT B 111 -0.335 -8.596 32.858 1.00 0.00 P ATOM 1616 OP1 DT B 111 0.390 -9.882 32.762 1.00 0.00 O ATOM 1617 OP2 DT B 111 -1.505 -8.474 33.756 1.00 0.00 O ATOM 1618 O5' DT B 111 0.725 -7.449 33.254 1.00 0.00 O ATOM 1619 C5' DT B 111 2.019 -7.416 32.647 1.00 0.00 C ATOM 1620 C4' DT B 111 2.848 -6.234 33.149 1.00 0.00 C ATOM 1621 O4' DT B 111 2.178 -5.016 32.828 1.00 0.00 O ATOM 1622 C3' DT B 111 3.086 -6.230 34.666 1.00 0.00 C ATOM 1623 O3' DT B 111 4.483 -6.396 34.925 1.00 0.00 O ATOM 1624 C2' DT B 111 2.634 -4.840 35.130 1.00 0.00 C ATOM 1625 C1' DT B 111 2.511 -4.062 33.828 1.00 0.00 C ATOM 1626 N1 DT B 111 1.451 -3.027 33.824 1.00 0.00 N ATOM 1627 C2 DT B 111 1.818 -1.728 33.506 1.00 0.00 C ATOM 1628 O2 DT B 111 2.982 -1.417 33.267 1.00 0.00 O ATOM 1629 N3 DT B 111 0.794 -0.800 33.483 1.00 0.00 N ATOM 1630 C4 DT B 111 -0.540 -1.049 33.748 1.00 0.00 C ATOM 1631 O4 DT B 111 -1.367 -0.142 33.697 1.00 0.00 O ATOM 1632 C5 DT B 111 -0.829 -2.424 34.071 1.00 0.00 C ATOM 1633 C7 DT B 111 -2.262 -2.826 34.402 1.00 0.00 C ATOM 1634 C6 DT B 111 0.148 -3.354 34.100 1.00 0.00 C ATOM 0 H5' DT B 111 1.912 -7.352 31.564 1.00 0.00 H new ATOM 0 H5'' DT B 111 2.545 -8.346 32.860 1.00 0.00 H new ATOM 0 H4' DT B 111 3.817 -6.328 32.658 1.00 0.00 H new ATOM 0 H3' DT B 111 2.551 -7.030 35.178 1.00 0.00 H new ATOM 0 H2' DT B 111 1.685 -4.883 35.665 1.00 0.00 H new ATOM 0 H2'' DT B 111 3.360 -4.385 35.804 1.00 0.00 H new ATOM 0 H1' DT B 111 3.453 -3.538 33.666 1.00 0.00 H new ATOM 0 H3 DT B 111 1.046 0.160 33.248 1.00 0.00 H new ATOM 0 H71 DT B 111 -2.427 -3.862 34.105 1.00 0.00 H new ATOM 0 H72 DT B 111 -2.430 -2.725 35.474 1.00 0.00 H new ATOM 0 H73 DT B 111 -2.955 -2.179 33.864 1.00 0.00 H new ATOM 0 H6 DT B 111 -0.101 -4.376 34.345 1.00 0.00 H new ATOM 1647 P DG B 112 5.017 -6.627 36.427 1.00 0.00 P ATOM 1648 OP1 DG B 112 6.164 -7.561 36.372 1.00 0.00 O ATOM 1649 OP2 DG B 112 3.853 -6.940 37.287 1.00 0.00 O ATOM 1650 O5' DG B 112 5.570 -5.172 36.837 1.00 0.00 O ATOM 1651 C5' DG B 112 6.847 -4.722 36.373 1.00 0.00 C ATOM 1652 C4' DG B 112 7.239 -3.394 37.014 1.00 0.00 C ATOM 1653 O4' DG B 112 6.249 -2.404 36.695 1.00 0.00 O ATOM 1654 C3' DG B 112 7.346 -3.445 38.539 1.00 0.00 C ATOM 1655 O3' DG B 112 8.400 -2.582 38.983 1.00 0.00 O ATOM 1656 C2' DG B 112 6.006 -2.905 39.000 1.00 0.00 C ATOM 1657 C1' DG B 112 5.682 -1.897 37.907 1.00 0.00 C ATOM 1658 N9 DG B 112 4.238 -1.687 37.672 1.00 0.00 N ATOM 1659 C8 DG B 112 3.216 -2.594 37.698 1.00 0.00 C ATOM 1660 N7 DG B 112 2.041 -2.109 37.434 1.00 0.00 N ATOM 1661 C5 DG B 112 2.295 -0.759 37.211 1.00 0.00 C ATOM 1662 C6 DG B 112 1.400 0.293 36.879 1.00 0.00 C ATOM 1663 O6 DG B 112 0.183 0.235 36.713 1.00 0.00 O ATOM 1664 N1 DG B 112 2.064 1.503 36.742 1.00 0.00 N ATOM 1665 C2 DG B 112 3.422 1.685 36.903 1.00 0.00 C ATOM 1666 N2 DG B 112 3.875 2.927 36.730 1.00 0.00 N ATOM 1667 N3 DG B 112 4.268 0.699 37.216 1.00 0.00 N ATOM 1668 C4 DG B 112 3.638 -0.490 37.354 1.00 0.00 C ATOM 0 H5' DG B 112 6.823 -4.611 35.289 1.00 0.00 H new ATOM 0 H5'' DG B 112 7.603 -5.474 36.600 1.00 0.00 H new ATOM 0 H4' DG B 112 8.224 -3.153 36.615 1.00 0.00 H new ATOM 0 H3' DG B 112 7.565 -4.441 38.924 1.00 0.00 H new ATOM 0 H2' DG B 112 5.252 -3.689 39.070 1.00 0.00 H new ATOM 0 H2'' DG B 112 6.070 -2.436 39.982 1.00 0.00 H new ATOM 0 H1' DG B 112 6.086 -0.935 38.223 1.00 0.00 H new ATOM 0 H8 DG B 112 3.374 -3.639 37.922 1.00 0.00 H new ATOM 0 H1 DG B 112 1.505 2.322 36.504 1.00 0.00 H new ATOM 0 H21 DG B 112 4.870 3.126 36.835 1.00 0.00 H new ATOM 0 H22 DG B 112 3.227 3.678 36.492 1.00 0.00 H new ATOM 1680 P DC B 113 8.736 -2.443 40.553 1.00 0.00 P ATOM 1681 OP1 DC B 113 10.206 -2.358 40.705 1.00 0.00 O ATOM 1682 OP2 DC B 113 7.980 -3.487 41.282 1.00 0.00 O ATOM 1683 O5' DC B 113 8.108 -1.009 40.934 1.00 0.00 O ATOM 1684 C5' DC B 113 8.871 0.189 40.756 1.00 0.00 C ATOM 1685 C4' DC B 113 8.155 1.410 41.332 1.00 0.00 C ATOM 1686 O4' DC B 113 6.892 1.571 40.674 1.00 0.00 O ATOM 1687 C3' DC B 113 7.877 1.328 42.840 1.00 0.00 C ATOM 1688 O3' DC B 113 8.299 2.543 43.469 1.00 0.00 O ATOM 1689 C2' DC B 113 6.363 1.194 42.937 1.00 0.00 C ATOM 1690 C1' DC B 113 5.897 1.858 41.654 1.00 0.00 C ATOM 1691 N1 DC B 113 4.608 1.352 41.136 1.00 0.00 N ATOM 1692 C2 DC B 113 3.582 2.264 40.945 1.00 0.00 C ATOM 1693 O2 DC B 113 3.751 3.449 41.228 1.00 0.00 O ATOM 1694 N3 DC B 113 2.402 1.811 40.442 1.00 0.00 N ATOM 1695 C4 DC B 113 2.236 0.516 40.139 1.00 0.00 C ATOM 1696 N4 DC B 113 1.076 0.106 39.629 1.00 0.00 N ATOM 1697 C5 DC B 113 3.289 -0.427 40.338 1.00 0.00 C ATOM 1698 C6 DC B 113 4.451 0.031 40.838 1.00 0.00 C ATOM 0 H5' DC B 113 9.059 0.346 39.694 1.00 0.00 H new ATOM 0 H5'' DC B 113 9.842 0.076 41.238 1.00 0.00 H new ATOM 0 H4' DC B 113 8.829 2.250 41.166 1.00 0.00 H new ATOM 0 H3' DC B 113 8.401 0.504 43.325 1.00 0.00 H new ATOM 0 H2' DC B 113 6.050 0.151 42.992 1.00 0.00 H new ATOM 0 H2'' DC B 113 5.966 1.694 43.821 1.00 0.00 H new ATOM 0 H1' DC B 113 5.753 2.918 41.862 1.00 0.00 H new ATOM 0 H41 DC B 113 0.941 -0.878 39.395 1.00 0.00 H new ATOM 0 H42 DC B 113 0.323 0.776 39.472 1.00 0.00 H new ATOM 0 H5 DC B 113 3.158 -1.471 40.096 1.00 0.00 H new ATOM 0 H6 DC B 113 5.268 -0.655 41.005 1.00 0.00 H new ATOM 1710 P DC B 114 8.181 2.723 45.066 1.00 0.00 P ATOM 1711 OP1 DC B 114 9.214 3.691 45.499 1.00 0.00 O ATOM 1712 OP2 DC B 114 8.128 1.378 45.681 1.00 0.00 O ATOM 1713 O5' DC B 114 6.737 3.415 45.244 1.00 0.00 O ATOM 1714 C5' DC B 114 6.558 4.805 44.959 1.00 0.00 C ATOM 1715 C4' DC B 114 5.212 5.316 45.468 1.00 0.00 C ATOM 1716 O4' DC B 114 4.152 4.656 44.770 1.00 0.00 O ATOM 1717 C3' DC B 114 4.975 5.086 46.970 1.00 0.00 C ATOM 1718 O3' DC B 114 4.776 6.344 47.620 1.00 0.00 O ATOM 1719 C2' DC B 114 3.689 4.258 47.031 1.00 0.00 C ATOM 1720 C1' DC B 114 3.063 4.518 45.674 1.00 0.00 C ATOM 1721 N1 DC B 114 2.197 3.425 45.184 1.00 0.00 N ATOM 1722 C2 DC B 114 0.829 3.539 45.399 1.00 0.00 C ATOM 1723 O2 DC B 114 0.374 4.530 45.965 1.00 0.00 O ATOM 1724 N3 DC B 114 0.021 2.536 44.963 1.00 0.00 N ATOM 1725 C4 DC B 114 0.530 1.461 44.346 1.00 0.00 C ATOM 1726 N4 DC B 114 -0.289 0.494 43.936 1.00 0.00 N ATOM 1727 C5 DC B 114 1.935 1.340 44.123 1.00 0.00 C ATOM 1728 C6 DC B 114 2.728 2.339 44.552 1.00 0.00 C ATOM 0 H5' DC B 114 6.626 4.968 43.883 1.00 0.00 H new ATOM 0 H5'' DC B 114 7.363 5.378 45.420 1.00 0.00 H new ATOM 0 H4' DC B 114 5.228 6.391 45.291 1.00 0.00 H new ATOM 0 H3' DC B 114 5.813 4.590 47.460 1.00 0.00 H new ATOM 0 H2' DC B 114 3.896 3.199 47.186 1.00 0.00 H new ATOM 0 H2'' DC B 114 3.039 4.578 47.845 1.00 0.00 H new ATOM 0 H1' DC B 114 2.423 5.397 45.752 1.00 0.00 H new ATOM 0 H41 DC B 114 0.088 -0.328 43.465 1.00 0.00 H new ATOM 0 H42 DC B 114 -1.294 0.576 44.093 1.00 0.00 H new ATOM 0 H5 DC B 114 2.348 0.475 43.626 1.00 0.00 H new ATOM 0 H6 DC B 114 3.795 2.280 44.394 1.00 0.00 H new ATOM 1740 P DT B 115 4.675 6.432 49.226 1.00 0.00 P ATOM 1741 OP1 DT B 115 5.031 7.809 49.637 1.00 0.00 O ATOM 1742 OP2 DT B 115 5.404 5.279 49.798 1.00 0.00 O ATOM 1743 O5' DT B 115 3.102 6.217 49.495 1.00 0.00 O ATOM 1744 C5' DT B 115 2.162 7.241 49.160 1.00 0.00 C ATOM 1745 C4' DT B 115 0.734 6.830 49.505 1.00 0.00 C ATOM 1746 O4' DT B 115 0.362 5.688 48.730 1.00 0.00 O ATOM 1747 C3' DT B 115 0.521 6.452 50.979 1.00 0.00 C ATOM 1748 O3' DT B 115 -0.363 7.397 51.590 1.00 0.00 O ATOM 1749 C2' DT B 115 -0.146 5.073 50.934 1.00 0.00 C ATOM 1750 C1' DT B 115 -0.597 4.963 49.486 1.00 0.00 C ATOM 1751 N1 DT B 115 -0.642 3.579 48.966 1.00 0.00 N ATOM 1752 C2 DT B 115 -1.869 3.091 48.549 1.00 0.00 C ATOM 1753 O2 DT B 115 -2.892 3.772 48.594 1.00 0.00 O ATOM 1754 N3 DT B 115 -1.879 1.793 48.078 1.00 0.00 N ATOM 1755 C4 DT B 115 -0.785 0.950 47.988 1.00 0.00 C ATOM 1756 O4 DT B 115 -0.908 -0.193 47.552 1.00 0.00 O ATOM 1757 C5 DT B 115 0.453 1.543 48.444 1.00 0.00 C ATOM 1758 C7 DT B 115 1.740 0.722 48.405 1.00 0.00 C ATOM 1759 C6 DT B 115 0.489 2.810 48.909 1.00 0.00 C ATOM 0 H5' DT B 115 2.230 7.463 48.095 1.00 0.00 H new ATOM 0 H5'' DT B 115 2.416 8.157 49.693 1.00 0.00 H new ATOM 0 H4' DT B 115 0.126 7.708 49.289 1.00 0.00 H new ATOM 0 H3' DT B 115 1.450 6.445 51.550 1.00 0.00 H new ATOM 0 H2' DT B 115 0.550 4.278 51.202 1.00 0.00 H new ATOM 0 H2'' DT B 115 -0.986 5.007 51.625 1.00 0.00 H new ATOM 0 H1' DT B 115 -1.615 5.345 49.412 1.00 0.00 H new ATOM 0 H3 DT B 115 -2.776 1.421 47.767 1.00 0.00 H new ATOM 0 H71 DT B 115 2.591 1.386 48.255 1.00 0.00 H new ATOM 0 H72 DT B 115 1.859 0.187 49.347 1.00 0.00 H new ATOM 0 H73 DT B 115 1.690 0.006 47.585 1.00 0.00 H new ATOM 0 H6 DT B 115 1.429 3.225 49.243 1.00 0.00 H new ATOM 1772 P DA B 116 -0.799 7.232 53.132 1.00 0.00 P ATOM 1773 OP1 DA B 116 -1.015 8.581 53.700 1.00 0.00 O ATOM 1774 OP2 DA B 116 0.148 6.300 53.784 1.00 0.00 O ATOM 1775 O5' DA B 116 -2.230 6.498 53.019 1.00 0.00 O ATOM 1776 C5' DA B 116 -3.385 7.227 52.597 1.00 0.00 C ATOM 1777 C4' DA B 116 -4.665 6.418 52.791 1.00 0.00 C ATOM 1778 O4' DA B 116 -4.614 5.243 51.967 1.00 0.00 O ATOM 1779 C3' DA B 116 -4.905 5.956 54.235 1.00 0.00 C ATOM 1780 O3' DA B 116 -6.269 6.139 54.622 1.00 0.00 O ATOM 1781 C2' DA B 116 -4.533 4.481 54.191 1.00 0.00 C ATOM 1782 C1' DA B 116 -4.914 4.105 52.773 1.00 0.00 C ATOM 1783 N9 DA B 116 -4.166 2.957 52.229 1.00 0.00 N ATOM 1784 C8 DA B 116 -2.826 2.699 52.283 1.00 0.00 C ATOM 1785 N7 DA B 116 -2.454 1.598 51.701 1.00 0.00 N ATOM 1786 C5 DA B 116 -3.653 1.077 51.217 1.00 0.00 C ATOM 1787 C6 DA B 116 -3.961 -0.084 50.498 1.00 0.00 C ATOM 1788 N6 DA B 116 -3.042 -0.973 50.122 1.00 0.00 N ATOM 1789 N1 DA B 116 -5.251 -0.292 50.182 1.00 0.00 N ATOM 1790 C2 DA B 116 -6.184 0.588 50.550 1.00 0.00 C ATOM 1791 N3 DA B 116 -5.999 1.715 51.230 1.00 0.00 N ATOM 1792 C4 DA B 116 -4.699 1.897 51.533 1.00 0.00 C ATOM 0 H5' DA B 116 -3.281 7.497 51.546 1.00 0.00 H new ATOM 0 H5'' DA B 116 -3.454 8.158 53.160 1.00 0.00 H new ATOM 0 H4' DA B 116 -5.481 7.088 52.518 1.00 0.00 H new ATOM 0 H3' DA B 116 -4.326 6.521 54.966 1.00 0.00 H new ATOM 0 H2' DA B 116 -3.472 4.321 54.385 1.00 0.00 H new ATOM 0 H2'' DA B 116 -5.083 3.899 54.930 1.00 0.00 H new ATOM 0 HO3' DA B 116 -6.391 5.834 55.545 1.00 0.00 H new ATOM 0 H1' DA B 116 -5.965 3.815 52.771 1.00 0.00 H new ATOM 0 H8 DA B 116 -2.127 3.361 52.773 1.00 0.00 H new ATOM 0 H61 DA B 116 -3.320 -1.804 49.599 1.00 0.00 H new ATOM 0 H62 DA B 116 -2.061 -0.823 50.357 1.00 0.00 H new ATOM 0 H2 DA B 116 -7.200 0.360 50.264 1.00 0.00 H new TER 1805 DA B 116 ATOM 1806 O5' DT C 201 -10.370 -7.554 47.903 1.00 0.00 O ATOM 1807 C5' DT C 201 -11.386 -6.842 48.614 1.00 0.00 C ATOM 1808 C4' DT C 201 -11.252 -5.334 48.424 1.00 0.00 C ATOM 1809 O4' DT C 201 -9.978 -4.904 48.911 1.00 0.00 O ATOM 1810 C3' DT C 201 -11.359 -4.869 46.963 1.00 0.00 C ATOM 1811 O3' DT C 201 -12.444 -3.946 46.842 1.00 0.00 O ATOM 1812 C2' DT C 201 -10.031 -4.158 46.685 1.00 0.00 C ATOM 1813 C1' DT C 201 -9.526 -3.842 48.082 1.00 0.00 C ATOM 1814 N1 DT C 201 -8.052 -3.771 48.207 1.00 0.00 N ATOM 1815 C2 DT C 201 -7.510 -2.615 48.742 1.00 0.00 C ATOM 1816 O2 DT C 201 -8.209 -1.667 49.094 1.00 0.00 O ATOM 1817 N3 DT C 201 -6.133 -2.588 48.861 1.00 0.00 N ATOM 1818 C4 DT C 201 -5.263 -3.599 48.494 1.00 0.00 C ATOM 1819 O4 DT C 201 -4.050 -3.467 48.643 1.00 0.00 O ATOM 1820 C5 DT C 201 -5.917 -4.765 47.944 1.00 0.00 C ATOM 1821 C7 DT C 201 -5.076 -5.958 47.495 1.00 0.00 C ATOM 1822 C6 DT C 201 -7.259 -4.818 47.820 1.00 0.00 C ATOM 0 H5' DT C 201 -11.325 -7.083 49.675 1.00 0.00 H new ATOM 0 H5'' DT C 201 -12.368 -7.167 48.270 1.00 0.00 H new ATOM 0 H4' DT C 201 -12.085 -4.897 48.975 1.00 0.00 H new ATOM 0 H3' DT C 201 -11.539 -5.689 46.268 1.00 0.00 H new ATOM 0 H2' DT C 201 -9.337 -4.795 46.137 1.00 0.00 H new ATOM 0 H2'' DT C 201 -10.171 -3.255 46.091 1.00 0.00 H new ATOM 0 HO5' DT C 201 -9.568 -6.995 47.831 1.00 0.00 H new ATOM 0 H1' DT C 201 -9.901 -2.856 48.356 1.00 0.00 H new ATOM 0 H3 DT C 201 -5.720 -1.743 49.256 1.00 0.00 H new ATOM 0 H71 DT C 201 -5.651 -6.876 47.618 1.00 0.00 H new ATOM 0 H72 DT C 201 -4.805 -5.838 46.446 1.00 0.00 H new ATOM 0 H73 DT C 201 -4.171 -6.013 48.100 1.00 0.00 H new ATOM 0 H6 DT C 201 -7.717 -5.704 47.407 1.00 0.00 H new ATOM 1836 P DA C 202 -12.820 -3.301 45.415 1.00 0.00 P ATOM 1837 OP1 DA C 202 -14.266 -2.984 45.417 1.00 0.00 O ATOM 1838 OP2 DA C 202 -12.256 -4.164 44.354 1.00 0.00 O ATOM 1839 O5' DA C 202 -12.002 -1.916 45.428 1.00 0.00 O ATOM 1840 C5' DA C 202 -12.413 -0.837 46.274 1.00 0.00 C ATOM 1841 C4' DA C 202 -11.529 0.391 46.082 1.00 0.00 C ATOM 1842 O4' DA C 202 -10.193 0.084 46.487 1.00 0.00 O ATOM 1843 C3' DA C 202 -11.457 0.892 44.634 1.00 0.00 C ATOM 1844 O3' DA C 202 -11.989 2.217 44.566 1.00 0.00 O ATOM 1845 C2' DA C 202 -9.963 0.911 44.298 1.00 0.00 C ATOM 1846 C1' DA C 202 -9.305 0.832 45.667 1.00 0.00 C ATOM 1847 N9 DA C 202 -7.999 0.146 45.678 1.00 0.00 N ATOM 1848 C8 DA C 202 -7.648 -1.047 45.115 1.00 0.00 C ATOM 1849 N7 DA C 202 -6.407 -1.393 45.288 1.00 0.00 N ATOM 1850 C5 DA C 202 -5.886 -0.336 46.034 1.00 0.00 C ATOM 1851 C6 DA C 202 -4.613 -0.081 46.555 1.00 0.00 C ATOM 1852 N6 DA C 202 -3.580 -0.908 46.395 1.00 0.00 N ATOM 1853 N1 DA C 202 -4.445 1.060 47.245 1.00 0.00 N ATOM 1854 C2 DA C 202 -5.467 1.899 47.418 1.00 0.00 C ATOM 1855 N3 DA C 202 -6.709 1.755 46.965 1.00 0.00 N ATOM 1856 C4 DA C 202 -6.848 0.603 46.276 1.00 0.00 C ATOM 0 H5' DA C 202 -12.375 -1.155 47.316 1.00 0.00 H new ATOM 0 H5'' DA C 202 -13.449 -0.578 46.058 1.00 0.00 H new ATOM 0 H4' DA C 202 -11.984 1.175 46.687 1.00 0.00 H new ATOM 0 H3' DA C 202 -12.024 0.267 43.944 1.00 0.00 H new ATOM 0 H2' DA C 202 -9.681 0.070 43.665 1.00 0.00 H new ATOM 0 H2'' DA C 202 -9.680 1.819 43.766 1.00 0.00 H new ATOM 0 H1' DA C 202 -9.119 1.850 46.009 1.00 0.00 H new ATOM 0 H8 DA C 202 -8.349 -1.658 44.566 1.00 0.00 H new ATOM 0 H61 DA C 202 -2.672 -0.673 46.796 1.00 0.00 H new ATOM 0 H62 DA C 202 -3.698 -1.775 45.871 1.00 0.00 H new ATOM 0 H2 DA C 202 -5.264 2.793 47.988 1.00 0.00 H new ATOM 1868 P DG C 203 -12.336 2.888 43.144 1.00 0.00 P ATOM 1869 OP1 DG C 203 -13.352 3.941 43.364 1.00 0.00 O ATOM 1870 OP2 DG C 203 -12.597 1.802 42.172 1.00 0.00 O ATOM 1871 O5' DG C 203 -10.950 3.600 42.744 1.00 0.00 O ATOM 1872 C5' DG C 203 -10.654 4.916 43.215 1.00 0.00 C ATOM 1873 C4' DG C 203 -9.288 5.392 42.732 1.00 0.00 C ATOM 1874 O4' DG C 203 -8.270 4.583 43.312 1.00 0.00 O ATOM 1875 C3' DG C 203 -9.096 5.324 41.211 1.00 0.00 C ATOM 1876 O3' DG C 203 -9.041 6.655 40.685 1.00 0.00 O ATOM 1877 C2' DG C 203 -7.742 4.626 41.020 1.00 0.00 C ATOM 1878 C1' DG C 203 -7.159 4.606 42.428 1.00 0.00 C ATOM 1879 N9 DG C 203 -6.321 3.430 42.730 1.00 0.00 N ATOM 1880 C8 DG C 203 -6.583 2.107 42.516 1.00 0.00 C ATOM 1881 N7 DG C 203 -5.646 1.290 42.896 1.00 0.00 N ATOM 1882 C5 DG C 203 -4.671 2.143 43.413 1.00 0.00 C ATOM 1883 C6 DG C 203 -3.406 1.838 43.984 1.00 0.00 C ATOM 1884 O6 DG C 203 -2.891 0.736 44.150 1.00 0.00 O ATOM 1885 N1 DG C 203 -2.735 2.989 44.378 1.00 0.00 N ATOM 1886 C2 DG C 203 -3.219 4.273 44.244 1.00 0.00 C ATOM 1887 N2 DG C 203 -2.431 5.253 44.690 1.00 0.00 N ATOM 1888 N3 DG C 203 -4.409 4.564 43.707 1.00 0.00 N ATOM 1889 C4 DG C 203 -5.077 3.454 43.315 1.00 0.00 C ATOM 0 H5' DG C 203 -10.679 4.927 44.305 1.00 0.00 H new ATOM 0 H5'' DG C 203 -11.423 5.608 42.871 1.00 0.00 H new ATOM 0 H4' DG C 203 -9.225 6.437 43.034 1.00 0.00 H new ATOM 0 H3' DG C 203 -9.904 4.797 40.704 1.00 0.00 H new ATOM 0 H2' DG C 203 -7.861 3.619 40.619 1.00 0.00 H new ATOM 0 H2'' DG C 203 -7.102 5.172 40.327 1.00 0.00 H new ATOM 0 H1' DG C 203 -6.510 5.476 42.533 1.00 0.00 H new ATOM 0 H8 DG C 203 -7.502 1.764 42.064 1.00 0.00 H new ATOM 0 H1 DG C 203 -1.813 2.875 44.799 1.00 0.00 H new ATOM 0 H21 DG C 203 -2.735 6.224 44.618 1.00 0.00 H new ATOM 0 H22 DG C 203 -1.525 5.031 45.103 1.00 0.00 H new ATOM 1901 P DG C 204 -8.918 6.911 39.099 1.00 0.00 P ATOM 1902 OP1 DG C 204 -9.653 8.154 38.773 1.00 0.00 O ATOM 1903 OP2 DG C 204 -9.252 5.651 38.398 1.00 0.00 O ATOM 1904 O5' DG C 204 -7.345 7.193 38.911 1.00 0.00 O ATOM 1905 C5' DG C 204 -6.748 8.352 39.498 1.00 0.00 C ATOM 1906 C4' DG C 204 -5.230 8.342 39.350 1.00 0.00 C ATOM 1907 O4' DG C 204 -4.712 7.117 39.859 1.00 0.00 O ATOM 1908 C3' DG C 204 -4.727 8.463 37.905 1.00 0.00 C ATOM 1909 O3' DG C 204 -4.145 9.757 37.720 1.00 0.00 O ATOM 1910 C2' DG C 204 -3.647 7.380 37.777 1.00 0.00 C ATOM 1911 C1' DG C 204 -3.474 6.885 39.206 1.00 0.00 C ATOM 1912 N9 DG C 204 -3.167 5.449 39.325 1.00 0.00 N ATOM 1913 C8 DG C 204 -3.976 4.372 39.097 1.00 0.00 C ATOM 1914 N7 DG C 204 -3.429 3.215 39.318 1.00 0.00 N ATOM 1915 C5 DG C 204 -2.139 3.548 39.729 1.00 0.00 C ATOM 1916 C6 DG C 204 -1.063 2.707 40.114 1.00 0.00 C ATOM 1917 O6 DG C 204 -1.045 1.480 40.178 1.00 0.00 O ATOM 1918 N1 DG C 204 0.063 3.443 40.454 1.00 0.00 N ATOM 1919 C2 DG C 204 0.146 4.821 40.430 1.00 0.00 C ATOM 1920 N2 DG C 204 1.314 5.352 40.791 1.00 0.00 N ATOM 1921 N3 DG C 204 -0.866 5.615 40.072 1.00 0.00 N ATOM 1922 C4 DG C 204 -1.972 4.913 39.734 1.00 0.00 C ATOM 0 H5' DG C 204 -7.010 8.400 40.555 1.00 0.00 H new ATOM 0 H5'' DG C 204 -7.153 9.248 39.028 1.00 0.00 H new ATOM 0 H4' DG C 204 -4.887 9.218 39.901 1.00 0.00 H new ATOM 0 H3' DG C 204 -5.520 8.342 37.167 1.00 0.00 H new ATOM 0 H2' DG C 204 -3.960 6.578 37.109 1.00 0.00 H new ATOM 0 H2'' DG C 204 -2.718 7.785 37.376 1.00 0.00 H new ATOM 0 H1' DG C 204 -2.626 7.415 39.640 1.00 0.00 H new ATOM 0 H8 DG C 204 -4.996 4.475 38.758 1.00 0.00 H new ATOM 0 H1 DG C 204 0.893 2.926 40.744 1.00 0.00 H new ATOM 0 H21 DG C 204 1.435 6.365 40.793 1.00 0.00 H new ATOM 0 H22 DG C 204 2.087 4.746 41.065 1.00 0.00 H new ATOM 1934 P DC C 205 -3.708 10.260 36.254 1.00 0.00 P ATOM 1935 OP1 DC C 205 -3.710 11.740 36.252 1.00 0.00 O ATOM 1936 OP2 DC C 205 -4.511 9.521 35.252 1.00 0.00 O ATOM 1937 O5' DC C 205 -2.184 9.757 36.147 1.00 0.00 O ATOM 1938 C5' DC C 205 -1.164 10.356 36.953 1.00 0.00 C ATOM 1939 C4' DC C 205 0.170 9.636 36.791 1.00 0.00 C ATOM 1940 O4' DC C 205 0.003 8.256 37.136 1.00 0.00 O ATOM 1941 C3' DC C 205 0.744 9.686 35.367 1.00 0.00 C ATOM 1942 O3' DC C 205 2.073 10.212 35.405 1.00 0.00 O ATOM 1943 C2' DC C 205 0.778 8.227 34.915 1.00 0.00 C ATOM 1944 C1' DC C 205 0.767 7.469 36.230 1.00 0.00 C ATOM 1945 N1 DC C 205 0.135 6.133 36.155 1.00 0.00 N ATOM 1946 C2 DC C 205 0.918 5.031 36.467 1.00 0.00 C ATOM 1947 O2 DC C 205 2.095 5.183 36.786 1.00 0.00 O ATOM 1948 N3 DC C 205 0.348 3.797 36.408 1.00 0.00 N ATOM 1949 C4 DC C 205 -0.936 3.648 36.059 1.00 0.00 C ATOM 1950 N4 DC C 205 -1.462 2.424 36.013 1.00 0.00 N ATOM 1951 C5 DC C 205 -1.748 4.780 35.737 1.00 0.00 C ATOM 1952 C6 DC C 205 -1.175 5.998 35.797 1.00 0.00 C ATOM 0 H5' DC C 205 -1.466 10.334 38.000 1.00 0.00 H new ATOM 0 H5'' DC C 205 -1.049 11.404 36.677 1.00 0.00 H new ATOM 0 H4' DC C 205 0.869 10.155 37.447 1.00 0.00 H new ATOM 0 H3' DC C 205 0.157 10.316 34.699 1.00 0.00 H new ATOM 0 H2' DC C 205 -0.083 7.975 34.295 1.00 0.00 H new ATOM 0 H2'' DC C 205 1.669 8.006 34.328 1.00 0.00 H new ATOM 0 H1' DC C 205 1.801 7.307 36.533 1.00 0.00 H new ATOM 0 H41 DC C 205 -2.439 2.298 35.748 1.00 0.00 H new ATOM 0 H42 DC C 205 -0.887 1.613 36.242 1.00 0.00 H new ATOM 0 H5 DC C 205 -2.784 4.663 35.456 1.00 0.00 H new ATOM 0 H6 DC C 205 -1.758 6.876 35.560 1.00 0.00 H new ATOM 1964 P DA C 206 2.859 10.557 34.041 1.00 0.00 P ATOM 1965 OP1 DA C 206 3.802 11.663 34.316 1.00 0.00 O ATOM 1966 OP2 DA C 206 1.862 10.690 32.956 1.00 0.00 O ATOM 1967 O5' DA C 206 3.716 9.220 33.774 1.00 0.00 O ATOM 1968 C5' DA C 206 4.898 8.951 34.535 1.00 0.00 C ATOM 1969 C4' DA C 206 5.599 7.681 34.060 1.00 0.00 C ATOM 1970 O4' DA C 206 4.683 6.578 34.144 1.00 0.00 O ATOM 1971 C3' DA C 206 6.105 7.743 32.614 1.00 0.00 C ATOM 1972 O3' DA C 206 7.425 7.191 32.551 1.00 0.00 O ATOM 1973 C2' DA C 206 5.131 6.860 31.845 1.00 0.00 C ATOM 1974 C1' DA C 206 4.697 5.869 32.907 1.00 0.00 C ATOM 1975 N9 DA C 206 3.348 5.313 32.698 1.00 0.00 N ATOM 1976 C8 DA C 206 2.179 5.968 32.439 1.00 0.00 C ATOM 1977 N7 DA C 206 1.133 5.203 32.329 1.00 0.00 N ATOM 1978 C5 DA C 206 1.656 3.927 32.531 1.00 0.00 C ATOM 1979 C6 DA C 206 1.074 2.655 32.544 1.00 0.00 C ATOM 1980 N6 DA C 206 -0.228 2.447 32.345 1.00 0.00 N ATOM 1981 N1 DA C 206 1.884 1.606 32.774 1.00 0.00 N ATOM 1982 C2 DA C 206 3.189 1.796 32.975 1.00 0.00 C ATOM 1983 N3 DA C 206 3.837 2.954 32.986 1.00 0.00 N ATOM 1984 C4 DA C 206 3.002 3.986 32.754 1.00 0.00 C ATOM 0 H5' DA C 206 4.637 8.850 35.589 1.00 0.00 H new ATOM 0 H5'' DA C 206 5.582 9.796 34.455 1.00 0.00 H new ATOM 0 H4' DA C 206 6.467 7.563 34.709 1.00 0.00 H new ATOM 0 H3' DA C 206 6.153 8.757 32.217 1.00 0.00 H new ATOM 0 H2' DA C 206 4.289 7.429 31.450 1.00 0.00 H new ATOM 0 H2'' DA C 206 5.609 6.367 30.998 1.00 0.00 H new ATOM 0 H1' DA C 206 5.391 5.029 32.880 1.00 0.00 H new ATOM 0 H8 DA C 206 2.126 7.042 32.333 1.00 0.00 H new ATOM 0 H61 DA C 206 -0.602 1.498 32.365 1.00 0.00 H new ATOM 0 H62 DA C 206 -0.850 3.237 32.173 1.00 0.00 H new ATOM 0 H2 DA C 206 3.783 0.911 33.148 1.00 0.00 H new ATOM 1996 P DG C 207 8.187 7.034 31.140 1.00 0.00 P ATOM 1997 OP1 DG C 207 9.621 7.340 31.352 1.00 0.00 O ATOM 1998 OP2 DG C 207 7.418 7.771 30.113 1.00 0.00 O ATOM 1999 O5' DG C 207 8.049 5.457 30.839 1.00 0.00 O ATOM 2000 C5' DG C 207 8.797 4.504 31.600 1.00 0.00 C ATOM 2001 C4' DG C 207 8.570 3.080 31.100 1.00 0.00 C ATOM 2002 O4' DG C 207 7.177 2.758 31.204 1.00 0.00 O ATOM 2003 C3' DG C 207 8.984 2.849 29.639 1.00 0.00 C ATOM 2004 O3' DG C 207 9.877 1.734 29.568 1.00 0.00 O ATOM 2005 C2' DG C 207 7.677 2.517 28.920 1.00 0.00 C ATOM 2006 C1' DG C 207 6.801 2.012 30.052 1.00 0.00 C ATOM 2007 N9 DG C 207 5.356 2.213 29.839 1.00 0.00 N ATOM 2008 C8 DG C 207 4.696 3.339 29.440 1.00 0.00 C ATOM 2009 N7 DG C 207 3.405 3.222 29.357 1.00 0.00 N ATOM 2010 C5 DG C 207 3.182 1.897 29.734 1.00 0.00 C ATOM 2011 C6 DG C 207 1.965 1.172 29.840 1.00 0.00 C ATOM 2012 O6 DG C 207 0.822 1.564 29.617 1.00 0.00 O ATOM 2013 N1 DG C 207 2.185 -0.137 30.251 1.00 0.00 N ATOM 2014 C2 DG C 207 3.421 -0.685 30.526 1.00 0.00 C ATOM 2015 N2 DG C 207 3.431 -1.964 30.899 1.00 0.00 N ATOM 2016 N3 DG C 207 4.568 -0.006 30.429 1.00 0.00 N ATOM 2017 C4 DG C 207 4.374 1.273 30.030 1.00 0.00 C ATOM 0 H5' DG C 207 8.511 4.571 32.650 1.00 0.00 H new ATOM 0 H5'' DG C 207 9.858 4.745 31.543 1.00 0.00 H new ATOM 0 H4' DG C 207 9.199 2.446 31.726 1.00 0.00 H new ATOM 0 H3' DG C 207 9.492 3.708 29.201 1.00 0.00 H new ATOM 0 H2' DG C 207 7.247 3.393 28.434 1.00 0.00 H new ATOM 0 H2'' DG C 207 7.819 1.761 28.148 1.00 0.00 H new ATOM 0 H1' DG C 207 6.951 0.936 30.139 1.00 0.00 H new ATOM 0 H8 DG C 207 5.210 4.261 29.210 1.00 0.00 H new ATOM 0 H1 DG C 207 1.369 -0.740 30.358 1.00 0.00 H new ATOM 0 H21 DG C 207 4.315 -2.425 31.116 1.00 0.00 H new ATOM 0 H22 DG C 207 2.555 -2.482 30.968 1.00 0.00 H new ATOM 2029 P DT C 208 10.497 1.264 28.158 1.00 0.00 P ATOM 2030 OP1 DT C 208 11.803 0.618 28.418 1.00 0.00 O ATOM 2031 OP2 DT C 208 10.410 2.400 27.213 1.00 0.00 O ATOM 2032 O5' DT C 208 9.461 0.129 27.677 1.00 0.00 O ATOM 2033 C5' DT C 208 9.403 -1.131 28.350 1.00 0.00 C ATOM 2034 C4' DT C 208 8.308 -2.026 27.776 1.00 0.00 C ATOM 2035 O4' DT C 208 7.045 -1.392 27.932 1.00 0.00 O ATOM 2036 C3' DT C 208 8.460 -2.336 26.285 1.00 0.00 C ATOM 2037 O3' DT C 208 8.893 -3.691 26.129 1.00 0.00 O ATOM 2038 C2' DT C 208 7.046 -2.166 25.702 1.00 0.00 C ATOM 2039 C1' DT C 208 6.180 -1.919 26.937 1.00 0.00 C ATOM 2040 N1 DT C 208 5.081 -0.945 26.744 1.00 0.00 N ATOM 2041 C2 DT C 208 3.797 -1.362 27.041 1.00 0.00 C ATOM 2042 O2 DT C 208 3.556 -2.503 27.426 1.00 0.00 O ATOM 2043 N3 DT C 208 2.798 -0.422 26.881 1.00 0.00 N ATOM 2044 C4 DT C 208 2.970 0.888 26.469 1.00 0.00 C ATOM 2045 O4 DT C 208 2.009 1.646 26.376 1.00 0.00 O ATOM 2046 C5 DT C 208 4.346 1.237 26.179 1.00 0.00 C ATOM 2047 C7 DT C 208 4.683 2.654 25.723 1.00 0.00 C ATOM 2048 C6 DT C 208 5.337 0.330 26.311 1.00 0.00 C ATOM 0 H5' DT C 208 9.221 -0.968 29.412 1.00 0.00 H new ATOM 0 H5'' DT C 208 10.366 -1.634 28.265 1.00 0.00 H new ATOM 0 H4' DT C 208 8.389 -2.963 28.327 1.00 0.00 H new ATOM 0 H3' DT C 208 9.187 -1.692 25.791 1.00 0.00 H new ATOM 0 H2' DT C 208 6.997 -1.331 25.004 1.00 0.00 H new ATOM 0 H2'' DT C 208 6.726 -3.055 25.158 1.00 0.00 H new ATOM 0 H1' DT C 208 5.706 -2.866 27.196 1.00 0.00 H new ATOM 0 H3 DT C 208 1.845 -0.721 27.086 1.00 0.00 H new ATOM 0 H71 DT C 208 5.691 2.911 26.050 1.00 0.00 H new ATOM 0 H72 DT C 208 4.629 2.709 24.636 1.00 0.00 H new ATOM 0 H73 DT C 208 3.971 3.355 26.158 1.00 0.00 H new ATOM 0 H6 DT C 208 6.351 0.614 26.071 1.00 0.00 H new ATOM 2061 P DG C 209 9.208 -4.293 24.670 1.00 0.00 P ATOM 2062 OP1 DG C 209 10.236 -5.348 24.815 1.00 0.00 O ATOM 2063 OP2 DG C 209 9.437 -3.162 23.745 1.00 0.00 O ATOM 2064 O5' DG C 209 7.817 -4.997 24.274 1.00 0.00 O ATOM 2065 C5' DG C 209 7.333 -6.106 25.035 1.00 0.00 C ATOM 2066 C4' DG C 209 5.907 -6.483 24.647 1.00 0.00 C ATOM 2067 O4' DG C 209 5.057 -5.335 24.790 1.00 0.00 O ATOM 2068 C3' DG C 209 5.750 -6.998 23.215 1.00 0.00 C ATOM 2069 O3' DG C 209 5.109 -8.279 23.257 1.00 0.00 O ATOM 2070 C2' DG C 209 4.841 -5.976 22.535 1.00 0.00 C ATOM 2071 C1' DG C 209 4.131 -5.322 23.708 1.00 0.00 C ATOM 2072 N9 DG C 209 3.737 -3.919 23.466 1.00 0.00 N ATOM 2073 C8 DG C 209 4.519 -2.860 23.099 1.00 0.00 C ATOM 2074 N7 DG C 209 3.890 -1.736 22.939 1.00 0.00 N ATOM 2075 C5 DG C 209 2.567 -2.067 23.224 1.00 0.00 C ATOM 2076 C6 DG C 209 1.406 -1.249 23.217 1.00 0.00 C ATOM 2077 O6 DG C 209 1.318 -0.053 22.952 1.00 0.00 O ATOM 2078 N1 DG C 209 0.270 -1.969 23.559 1.00 0.00 N ATOM 2079 C2 DG C 209 0.248 -3.312 23.877 1.00 0.00 C ATOM 2080 N2 DG C 209 -0.943 -3.825 24.183 1.00 0.00 N ATOM 2081 N3 DG C 209 1.341 -4.088 23.886 1.00 0.00 N ATOM 2082 C4 DG C 209 2.461 -3.402 23.550 1.00 0.00 C ATOM 0 H5' DG C 209 7.368 -5.861 26.096 1.00 0.00 H new ATOM 0 H5'' DG C 209 7.989 -6.963 24.885 1.00 0.00 H new ATOM 0 H4' DG C 209 5.631 -7.299 25.315 1.00 0.00 H new ATOM 0 H3' DG C 209 6.699 -7.111 22.690 1.00 0.00 H new ATOM 0 H2' DG C 209 5.411 -5.252 21.953 1.00 0.00 H new ATOM 0 H2'' DG C 209 4.138 -6.452 21.851 1.00 0.00 H new ATOM 0 H1' DG C 209 3.211 -5.874 23.899 1.00 0.00 H new ATOM 0 H8 DG C 209 5.585 -2.952 22.952 1.00 0.00 H new ATOM 0 H1 DG C 209 -0.618 -1.467 23.577 1.00 0.00 H new ATOM 0 H21 DG C 209 -1.026 -4.812 24.427 1.00 0.00 H new ATOM 0 H22 DG C 209 -1.772 -3.231 24.173 1.00 0.00 H new ATOM 2094 P DA C 210 4.727 -9.062 21.903 1.00 0.00 P ATOM 2095 OP1 DA C 210 4.705 -10.512 22.199 1.00 0.00 O ATOM 2096 OP2 DA C 210 5.580 -8.544 20.810 1.00 0.00 O ATOM 2097 O5' DA C 210 3.216 -8.578 21.636 1.00 0.00 O ATOM 2098 C5' DA C 210 2.174 -8.909 22.560 1.00 0.00 C ATOM 2099 C4' DA C 210 0.840 -8.303 22.136 1.00 0.00 C ATOM 2100 O4' DA C 210 0.930 -6.871 22.182 1.00 0.00 O ATOM 2101 C3' DA C 210 0.403 -8.688 20.714 1.00 0.00 C ATOM 2102 O3' DA C 210 -0.914 -9.247 20.760 1.00 0.00 O ATOM 2103 C2' DA C 210 0.388 -7.364 19.952 1.00 0.00 C ATOM 2104 C1' DA C 210 0.224 -6.346 21.063 1.00 0.00 C ATOM 2105 N9 DA C 210 0.789 -5.022 20.749 1.00 0.00 N ATOM 2106 C8 DA C 210 2.076 -4.693 20.437 1.00 0.00 C ATOM 2107 N7 DA C 210 2.279 -3.434 20.195 1.00 0.00 N ATOM 2108 C5 DA C 210 1.016 -2.873 20.360 1.00 0.00 C ATOM 2109 C6 DA C 210 0.542 -1.562 20.245 1.00 0.00 C ATOM 2110 N6 DA C 210 1.323 -0.531 19.924 1.00 0.00 N ATOM 2111 N1 DA C 210 -0.766 -1.356 20.475 1.00 0.00 N ATOM 2112 C2 DA C 210 -1.560 -2.377 20.799 1.00 0.00 C ATOM 2113 N3 DA C 210 -1.213 -3.653 20.934 1.00 0.00 N ATOM 2114 C4 DA C 210 0.103 -3.830 20.698 1.00 0.00 C ATOM 0 H5' DA C 210 2.439 -8.549 23.554 1.00 0.00 H new ATOM 0 H5'' DA C 210 2.078 -9.993 22.629 1.00 0.00 H new ATOM 0 H4' DA C 210 0.101 -8.699 22.833 1.00 0.00 H new ATOM 0 H3' DA C 210 1.058 -9.425 20.249 1.00 0.00 H new ATOM 0 H2' DA C 210 1.310 -7.208 19.392 1.00 0.00 H new ATOM 0 H2'' DA C 210 -0.432 -7.318 19.235 1.00 0.00 H new ATOM 0 H1' DA C 210 -0.841 -6.193 21.236 1.00 0.00 H new ATOM 0 H8 DA C 210 2.868 -5.426 20.395 1.00 0.00 H new ATOM 0 H61 DA C 210 0.927 0.406 19.853 1.00 0.00 H new ATOM 0 H62 DA C 210 2.317 -0.679 19.749 1.00 0.00 H new ATOM 0 H2 DA C 210 -2.600 -2.141 20.971 1.00 0.00 H new ATOM 2126 P DT C 211 -1.673 -9.683 19.407 1.00 0.00 P ATOM 2127 OP1 DT C 211 -2.699 -10.691 19.756 1.00 0.00 O ATOM 2128 OP2 DT C 211 -0.653 -9.992 18.381 1.00 0.00 O ATOM 2129 O5' DT C 211 -2.424 -8.326 18.978 1.00 0.00 O ATOM 2130 C5' DT C 211 -3.285 -7.659 19.902 1.00 0.00 C ATOM 2131 C4' DT C 211 -3.762 -6.315 19.361 1.00 0.00 C ATOM 2132 O4' DT C 211 -2.658 -5.425 19.209 1.00 0.00 O ATOM 2133 C3' DT C 211 -4.442 -6.390 17.989 1.00 0.00 C ATOM 2134 O3' DT C 211 -5.853 -6.235 18.143 1.00 0.00 O ATOM 2135 C2' DT C 211 -3.865 -5.202 17.212 1.00 0.00 C ATOM 2136 C1' DT C 211 -3.068 -4.448 18.265 1.00 0.00 C ATOM 2137 N1 DT C 211 -1.870 -3.762 17.734 1.00 0.00 N ATOM 2138 C2 DT C 211 -2.018 -2.443 17.349 1.00 0.00 C ATOM 2139 O2 DT C 211 -3.083 -1.842 17.473 1.00 0.00 O ATOM 2140 N3 DT C 211 -0.898 -1.834 16.816 1.00 0.00 N ATOM 2141 C4 DT C 211 0.341 -2.419 16.639 1.00 0.00 C ATOM 2142 O4 DT C 211 1.273 -1.779 16.155 1.00 0.00 O ATOM 2143 C5 DT C 211 0.405 -3.798 17.069 1.00 0.00 C ATOM 2144 C7 DT C 211 1.708 -4.574 16.904 1.00 0.00 C ATOM 2145 C6 DT C 211 -0.674 -4.416 17.595 1.00 0.00 C ATOM 0 H5' DT C 211 -2.759 -7.506 20.844 1.00 0.00 H new ATOM 0 H5'' DT C 211 -4.147 -8.291 20.117 1.00 0.00 H new ATOM 0 H4' DT C 211 -4.491 -5.968 20.094 1.00 0.00 H new ATOM 0 H3' DT C 211 -4.271 -7.341 17.484 1.00 0.00 H new ATOM 0 H2' DT C 211 -3.232 -5.530 16.387 1.00 0.00 H new ATOM 0 H2'' DT C 211 -4.652 -4.582 16.783 1.00 0.00 H new ATOM 0 H1' DT C 211 -3.695 -3.662 18.686 1.00 0.00 H new ATOM 0 H3 DT C 211 -0.995 -0.861 16.526 1.00 0.00 H new ATOM 0 H71 DT C 211 1.786 -5.326 17.690 1.00 0.00 H new ATOM 0 H72 DT C 211 1.719 -5.064 15.931 1.00 0.00 H new ATOM 0 H73 DT C 211 2.552 -3.887 16.974 1.00 0.00 H new ATOM 0 H6 DT C 211 -0.593 -5.445 17.912 1.00 0.00 H new ATOM 2158 P DT C 212 -6.852 -6.658 16.954 1.00 0.00 P ATOM 2159 OP1 DT C 212 -8.229 -6.688 17.493 1.00 0.00 O ATOM 2160 OP2 DT C 212 -6.294 -7.853 16.283 1.00 0.00 O ATOM 2161 O5' DT C 212 -6.737 -5.412 15.940 1.00 0.00 O ATOM 2162 C5' DT C 212 -7.444 -4.201 16.205 1.00 0.00 C ATOM 2163 C4' DT C 212 -7.262 -3.184 15.083 1.00 0.00 C ATOM 2164 O4' DT C 212 -5.899 -2.773 15.017 1.00 0.00 O ATOM 2165 C3' DT C 212 -7.627 -3.707 13.685 1.00 0.00 C ATOM 2166 O3' DT C 212 -8.829 -3.069 13.240 1.00 0.00 O ATOM 2167 C2' DT C 212 -6.445 -3.288 12.798 1.00 0.00 C ATOM 2168 C1' DT C 212 -5.675 -2.326 13.690 1.00 0.00 C ATOM 2169 N1 DT C 212 -4.218 -2.299 13.444 1.00 0.00 N ATOM 2170 C2 DT C 212 -3.723 -1.227 12.742 1.00 0.00 C ATOM 2171 O2 DT C 212 -4.452 -0.322 12.343 1.00 0.00 O ATOM 2172 N3 DT C 212 -2.368 -1.218 12.506 1.00 0.00 N ATOM 2173 C4 DT C 212 -1.470 -2.206 12.880 1.00 0.00 C ATOM 2174 O4 DT C 212 -0.282 -2.123 12.580 1.00 0.00 O ATOM 2175 C5 DT C 212 -2.080 -3.303 13.618 1.00 0.00 C ATOM 2176 C7 DT C 212 -1.214 -4.480 14.056 1.00 0.00 C ATOM 2177 C6 DT C 212 -3.409 -3.306 13.894 1.00 0.00 C ATOM 0 H5' DT C 212 -7.093 -3.773 17.144 1.00 0.00 H new ATOM 0 H5'' DT C 212 -8.505 -4.419 16.330 1.00 0.00 H new ATOM 0 H4' DT C 212 -7.942 -2.369 15.333 1.00 0.00 H new ATOM 0 H3' DT C 212 -7.797 -4.783 13.663 1.00 0.00 H new ATOM 0 H2' DT C 212 -5.836 -4.143 12.506 1.00 0.00 H new ATOM 0 H2'' DT C 212 -6.780 -2.807 11.879 1.00 0.00 H new ATOM 0 H1' DT C 212 -6.026 -1.313 13.491 1.00 0.00 H new ATOM 0 H3 DT C 212 -1.989 -0.411 12.011 1.00 0.00 H new ATOM 0 H71 DT C 212 -1.615 -4.904 14.977 1.00 0.00 H new ATOM 0 H72 DT C 212 -1.213 -5.241 13.276 1.00 0.00 H new ATOM 0 H73 DT C 212 -0.194 -4.137 14.229 1.00 0.00 H new ATOM 0 H6 DT C 212 -3.832 -4.112 14.475 1.00 0.00 H new ATOM 2190 P DT C 213 -9.357 -3.261 11.730 1.00 0.00 P ATOM 2191 OP1 DT C 213 -10.836 -3.201 11.744 1.00 0.00 O ATOM 2192 OP2 DT C 213 -8.671 -4.434 11.143 1.00 0.00 O ATOM 2193 O5' DT C 213 -8.806 -1.936 10.999 1.00 0.00 O ATOM 2194 C5' DT C 213 -9.178 -0.644 11.485 1.00 0.00 C ATOM 2195 C4' DT C 213 -8.370 0.467 10.818 1.00 0.00 C ATOM 2196 O4' DT C 213 -6.972 0.224 11.000 1.00 0.00 O ATOM 2197 C3' DT C 213 -8.604 0.610 9.303 1.00 0.00 C ATOM 2198 O3' DT C 213 -9.119 1.918 9.030 1.00 0.00 O ATOM 2199 C2' DT C 213 -7.208 0.455 8.690 1.00 0.00 C ATOM 2200 C1' DT C 213 -6.309 0.769 9.870 1.00 0.00 C ATOM 2201 N1 DT C 213 -4.950 0.187 9.789 1.00 0.00 N ATOM 2202 C2 DT C 213 -3.880 1.061 9.877 1.00 0.00 C ATOM 2203 O2 DT C 213 -4.037 2.268 10.044 1.00 0.00 O ATOM 2204 N3 DT C 213 -2.622 0.503 9.767 1.00 0.00 N ATOM 2205 C4 DT C 213 -2.341 -0.838 9.580 1.00 0.00 C ATOM 2206 O4 DT C 213 -1.181 -1.229 9.477 1.00 0.00 O ATOM 2207 C5 DT C 213 -3.514 -1.678 9.505 1.00 0.00 C ATOM 2208 C7 DT C 213 -3.346 -3.182 9.306 1.00 0.00 C ATOM 2209 C6 DT C 213 -4.754 -1.159 9.611 1.00 0.00 C ATOM 0 H5' DT C 213 -9.028 -0.605 12.564 1.00 0.00 H new ATOM 0 H5'' DT C 213 -10.240 -0.480 11.304 1.00 0.00 H new ATOM 0 H4' DT C 213 -8.708 1.386 11.298 1.00 0.00 H new ATOM 0 H3' DT C 213 -9.314 -0.116 8.906 1.00 0.00 H new ATOM 0 H2' DT C 213 -7.041 -0.551 8.306 1.00 0.00 H new ATOM 0 H2'' DT C 213 -7.048 1.144 7.860 1.00 0.00 H new ATOM 0 H1' DT C 213 -6.153 1.847 9.910 1.00 0.00 H new ATOM 0 H3 DT C 213 -1.827 1.138 9.829 1.00 0.00 H new ATOM 0 H71 DT C 213 -4.175 -3.707 9.780 1.00 0.00 H new ATOM 0 H72 DT C 213 -3.335 -3.409 8.240 1.00 0.00 H new ATOM 0 H73 DT C 213 -2.407 -3.506 9.756 1.00 0.00 H new ATOM 0 H6 DT C 213 -5.609 -1.816 9.555 1.00 0.00 H new ATOM 2222 P DA C 214 -9.330 2.431 7.517 1.00 0.00 P ATOM 2223 OP1 DA C 214 -10.446 3.402 7.509 1.00 0.00 O ATOM 2224 OP2 DA C 214 -9.375 1.247 6.629 1.00 0.00 O ATOM 2225 O5' DA C 214 -7.964 3.231 7.223 1.00 0.00 O ATOM 2226 C5' DA C 214 -7.611 4.378 8.003 1.00 0.00 C ATOM 2227 C4' DA C 214 -6.256 4.947 7.591 1.00 0.00 C ATOM 2228 O4' DA C 214 -5.256 3.923 7.705 1.00 0.00 O ATOM 2229 C3' DA C 214 -6.203 5.475 6.149 1.00 0.00 C ATOM 2230 O3' DA C 214 -5.632 6.789 6.147 1.00 0.00 O ATOM 2231 C2' DA C 214 -5.278 4.501 5.428 1.00 0.00 C ATOM 2232 C1' DA C 214 -4.410 3.991 6.562 1.00 0.00 C ATOM 2233 N9 DA C 214 -3.850 2.649 6.328 1.00 0.00 N ATOM 2234 C8 DA C 214 -4.488 1.512 5.924 1.00 0.00 C ATOM 2235 N7 DA C 214 -3.722 0.472 5.786 1.00 0.00 N ATOM 2236 C5 DA C 214 -2.462 0.961 6.129 1.00 0.00 C ATOM 2237 C6 DA C 214 -1.200 0.364 6.193 1.00 0.00 C ATOM 2238 N6 DA C 214 -0.981 -0.914 5.889 1.00 0.00 N ATOM 2239 N1 DA C 214 -0.168 1.136 6.574 1.00 0.00 N ATOM 2240 C2 DA C 214 -0.364 2.419 6.874 1.00 0.00 C ATOM 2241 N3 DA C 214 -1.515 3.084 6.845 1.00 0.00 N ATOM 2242 C4 DA C 214 -2.532 2.284 6.462 1.00 0.00 C ATOM 0 H5' DA C 214 -7.586 4.106 9.058 1.00 0.00 H new ATOM 0 H5'' DA C 214 -8.377 5.145 7.889 1.00 0.00 H new ATOM 0 H4' DA C 214 -6.078 5.789 8.259 1.00 0.00 H new ATOM 0 H3' DA C 214 -7.185 5.541 5.680 1.00 0.00 H new ATOM 0 H2' DA C 214 -5.831 3.696 4.944 1.00 0.00 H new ATOM 0 H2'' DA C 214 -4.690 4.994 4.654 1.00 0.00 H new ATOM 0 H1' DA C 214 -3.560 4.664 6.674 1.00 0.00 H new ATOM 0 H8 DA C 214 -5.551 1.479 5.733 1.00 0.00 H new ATOM 0 H61 DA C 214 -0.039 -1.299 5.953 1.00 0.00 H new ATOM 0 H62 DA C 214 -1.756 -1.508 5.592 1.00 0.00 H new ATOM 0 H2 DA C 214 0.508 2.981 7.174 1.00 0.00 H new ATOM 2254 P DT C 215 -5.325 7.557 4.764 1.00 0.00 P ATOM 2255 OP1 DT C 215 -5.398 9.013 5.016 1.00 0.00 O ATOM 2256 OP2 DT C 215 -6.159 6.949 3.702 1.00 0.00 O ATOM 2257 O5' DT C 215 -3.787 7.170 4.480 1.00 0.00 O ATOM 2258 C5' DT C 215 -2.747 7.669 5.325 1.00 0.00 C ATOM 2259 C4' DT C 215 -1.378 7.129 4.917 1.00 0.00 C ATOM 2260 O4' DT C 215 -1.376 5.703 5.017 1.00 0.00 O ATOM 2261 C3' DT C 215 -0.962 7.474 3.478 1.00 0.00 C ATOM 2262 O3' DT C 215 0.201 8.308 3.508 1.00 0.00 O ATOM 2263 C2' DT C 215 -0.616 6.125 2.841 1.00 0.00 C ATOM 2264 C1' DT C 215 -0.463 5.213 4.046 1.00 0.00 C ATOM 2265 N1 DT C 215 -0.787 3.794 3.784 1.00 0.00 N ATOM 2266 C2 DT C 215 0.210 2.858 3.995 1.00 0.00 C ATOM 2267 O2 DT C 215 1.331 3.174 4.389 1.00 0.00 O ATOM 2268 N3 DT C 215 -0.127 1.543 3.734 1.00 0.00 N ATOM 2269 C4 DT C 215 -1.356 1.089 3.290 1.00 0.00 C ATOM 2270 O4 DT C 215 -1.547 -0.109 3.090 1.00 0.00 O ATOM 2271 C5 DT C 215 -2.335 2.136 3.099 1.00 0.00 C ATOM 2272 C7 DT C 215 -3.735 1.776 2.608 1.00 0.00 C ATOM 2273 C6 DT C 215 -2.031 3.426 3.345 1.00 0.00 C ATOM 0 H5' DT C 215 -2.954 7.392 6.359 1.00 0.00 H new ATOM 0 H5'' DT C 215 -2.736 8.758 5.283 1.00 0.00 H new ATOM 0 H4' DT C 215 -0.670 7.605 5.596 1.00 0.00 H new ATOM 0 H3' DT C 215 -1.741 8.004 2.929 1.00 0.00 H new ATOM 0 H2' DT C 215 -1.403 5.781 2.170 1.00 0.00 H new ATOM 0 H2'' DT C 215 0.301 6.178 2.255 1.00 0.00 H new ATOM 0 H1' DT C 215 0.582 5.228 4.357 1.00 0.00 H new ATOM 0 H3 DT C 215 0.599 0.842 3.883 1.00 0.00 H new ATOM 0 H71 DT C 215 -4.455 2.492 3.004 1.00 0.00 H new ATOM 0 H72 DT C 215 -3.757 1.804 1.519 1.00 0.00 H new ATOM 0 H73 DT C 215 -3.994 0.774 2.950 1.00 0.00 H new ATOM 0 H6 DT C 215 -2.784 4.185 3.193 1.00 0.00 H new ATOM 2286 P DG C 216 0.888 8.805 2.138 1.00 0.00 P ATOM 2287 OP1 DG C 216 1.513 10.123 2.386 1.00 0.00 O ATOM 2288 OP2 DG C 216 -0.097 8.651 1.043 1.00 0.00 O ATOM 2289 O5' DG C 216 2.062 7.725 1.914 1.00 0.00 O ATOM 2290 C5' DG C 216 3.224 7.735 2.748 1.00 0.00 C ATOM 2291 C4' DG C 216 4.319 6.821 2.204 1.00 0.00 C ATOM 2292 O4' DG C 216 3.845 5.462 2.199 1.00 0.00 O ATOM 2293 C3' DG C 216 4.761 7.152 0.772 1.00 0.00 C ATOM 2294 O3' DG C 216 6.181 7.050 0.627 1.00 0.00 O ATOM 2295 C2' DG C 216 4.041 6.098 -0.055 1.00 0.00 C ATOM 2296 C1' DG C 216 4.046 4.916 0.895 1.00 0.00 C ATOM 2297 N9 DG C 216 2.980 3.925 0.647 1.00 0.00 N ATOM 2298 C8 DG C 216 1.646 4.131 0.433 1.00 0.00 C ATOM 2299 N7 DG C 216 0.945 3.052 0.249 1.00 0.00 N ATOM 2300 C5 DG C 216 1.893 2.035 0.347 1.00 0.00 C ATOM 2301 C6 DG C 216 1.732 0.627 0.234 1.00 0.00 C ATOM 2302 O6 DG C 216 0.702 -0.008 0.022 1.00 0.00 O ATOM 2303 N1 DG C 216 2.939 -0.038 0.395 1.00 0.00 N ATOM 2304 C2 DG C 216 4.152 0.570 0.638 1.00 0.00 C ATOM 2305 N2 DG C 216 5.203 -0.241 0.765 1.00 0.00 N ATOM 2306 N3 DG C 216 4.309 1.893 0.745 1.00 0.00 N ATOM 2307 C4 DG C 216 3.141 2.561 0.590 1.00 0.00 C ATOM 0 H5' DG C 216 2.952 7.417 3.755 1.00 0.00 H new ATOM 0 H5'' DG C 216 3.606 8.753 2.827 1.00 0.00 H new ATOM 0 H4' DG C 216 5.177 6.968 2.860 1.00 0.00 H new ATOM 0 H3' DG C 216 4.521 8.172 0.472 1.00 0.00 H new ATOM 0 H2' DG C 216 3.030 6.406 -0.322 1.00 0.00 H new ATOM 0 H2'' DG C 216 4.564 5.879 -0.986 1.00 0.00 H new ATOM 0 HO3' DG C 216 6.432 7.265 -0.296 1.00 0.00 H new ATOM 0 H1' DG C 216 4.988 4.383 0.766 1.00 0.00 H new ATOM 0 H8 DG C 216 1.207 5.118 0.418 1.00 0.00 H new ATOM 0 H1 DG C 216 2.928 -1.056 0.328 1.00 0.00 H new ATOM 0 H21 DG C 216 6.128 0.148 0.946 1.00 0.00 H new ATOM 0 H22 DG C 216 5.081 -1.250 0.681 1.00 0.00 H new TER 2320 DG C 216 HETATM 2321 ZN ZN A 83 -16.506 -1.323 27.897 1.00 0.87 ZN HETATM 2322 ZN ZN A 84 0.781 16.322 16.388 1.00 0.30 ZN HETATM 2323 ZN ZN A 85 15.867 -4.216 10.000 1.00 0.20 ZN