USER MOD reduce.3.24.130724 H: found=0, std=0, add=555, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 553 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 147 HIS HE2 : A 147 HIS NE2 : A 187 ZNZN :(H bumps) USER MOD NoAdj-H: A 169 HIS HE2 : A 169 HIS NE2 : A 188 ZNZN :(H bumps) USER MOD Set 1.1: A 179 GLN : amide:sc= 0.773 K(o=1.8,f=-0.58) USER MOD Set 1.2: A 180 GLN : amide:sc= 1.05 K(o=1.8,f=-0.33) USER MOD Set 2.1: A 150 LYS NZ :NH3+ -145:sc= -0.0275 (180deg=-0.35) USER MOD Set 2.2: B 4 A O2' : rot 180:sc= 0.0719 USER MOD Set 3.1: A 148 HIS : no HD1:sc= -0.324 X(o=-0.068,f=0.26) USER MOD Set 3.2: B 5 G O2' : rot 18:sc= 0.256 USER MOD Set 4.1: A 131 LYS NZ :NH3+ -133:sc= 0.724 (180deg=0.139) USER MOD Set 4.2: A 140 TYR OH : rot -77:sc= 0.139 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 MET CE :methyl 168:sc= -0.0194 (180deg=-0.238) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 SER OG : rot 147:sc= 0.345 USER MOD Single : A 135 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0274) USER MOD Single : A 141 ASN : amide:sc= -0.0779 K(o=-0.078,f=-7.8!) USER MOD Single : A 153 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.116) USER MOD Single : A 157 GLN : amide:sc= -0.635 X(o=-0.63,f=-0.16) USER MOD Single : A 159 LYS NZ :NH3+ 138:sc= 0.125 (180deg=-0.000985) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 HIS : no HD1:sc= -0.615 X(o=-0.62,f=-1.1) USER MOD Single : A 165 GLN : amide:sc= -1.11 X(o=-1.1,f=-1.3) USER MOD Single : A 166 SER OG : rot 76:sc= 1.3 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 170 MET CE :methyl 179:sc= -2.92! (180deg=-2.93!) USER MOD Single : A 173 SER OG : rot -51:sc= 0.0116 USER MOD Single : A 177 LYS NZ :NH3+ -113:sc= -0.0131 (180deg=-0.143) USER MOD Single : A 183 SER OG : rot 180:sc= 0.31 USER MOD Single : A 185 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : B 1 A O2' : rot 56:sc= -1.64 USER MOD Single : B 1 A O5' : rot 180:sc= 0 USER MOD Single : B 2 G O2' : rot 60:sc= 1.19 USER MOD Single : B 3 G O2' : rot -122:sc= 1.24 USER MOD Single : B 6 A O2' : rot 106:sc= 0.879 USER MOD Single : B 7 U O2' : rot 27:sc= 0.697 USER MOD Single : B 7 U O3' : rot -70:sc= -0.0248 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 124 9.078 -11.408 2.412 1.00 0.00 N ATOM 2 CA PRO A 124 9.078 -10.002 1.984 1.00 0.00 C ATOM 3 C PRO A 124 10.438 -9.553 1.468 1.00 0.00 C ATOM 4 O PRO A 124 11.452 -9.796 2.115 1.00 0.00 O ATOM 5 CB PRO A 124 8.622 -9.177 3.187 1.00 0.00 C ATOM 6 CG PRO A 124 7.860 -10.175 4.064 1.00 0.00 C ATOM 7 CD PRO A 124 7.877 -11.464 3.250 1.00 0.00 C ATOM 0 HA PRO A 124 8.400 -9.863 1.142 1.00 0.00 H new ATOM 0 HB2 PRO A 124 9.471 -8.747 3.719 1.00 0.00 H new ATOM 0 HB3 PRO A 124 7.984 -8.348 2.882 1.00 0.00 H new ATOM 0 HG2 PRO A 124 8.344 -10.307 5.032 1.00 0.00 H new ATOM 0 HG3 PRO A 124 6.842 -9.839 4.260 1.00 0.00 H new ATOM 0 HD2 PRO A 124 7.900 -12.336 3.904 1.00 0.00 H new ATOM 0 HD3 PRO A 124 6.979 -11.548 2.637 1.00 0.00 H new ATOM 15 N LYS A 125 10.459 -8.901 0.301 1.00 0.00 N ATOM 16 CA LYS A 125 11.688 -8.401 -0.303 1.00 0.00 C ATOM 17 C LYS A 125 11.406 -7.210 -1.213 1.00 0.00 C ATOM 18 O LYS A 125 10.268 -6.985 -1.624 1.00 0.00 O ATOM 19 CB LYS A 125 12.408 -9.521 -1.069 1.00 0.00 C ATOM 20 CG LYS A 125 11.788 -9.872 -2.425 1.00 0.00 C ATOM 21 CD LYS A 125 10.375 -10.436 -2.302 1.00 0.00 C ATOM 22 CE LYS A 125 9.892 -10.859 -3.686 1.00 0.00 C ATOM 23 NZ LYS A 125 8.508 -11.373 -3.640 1.00 0.00 N ATOM 0 H LYS A 125 9.621 -8.707 -0.248 1.00 0.00 H new ATOM 0 HA LYS A 125 12.345 -8.059 0.497 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.446 -9.226 -1.225 1.00 0.00 H new ATOM 0 HB3 LYS A 125 12.421 -10.417 -0.448 1.00 0.00 H new ATOM 0 HG2 LYS A 125 11.765 -8.980 -3.050 1.00 0.00 H new ATOM 0 HG3 LYS A 125 12.422 -10.600 -2.932 1.00 0.00 H new ATOM 0 HD2 LYS A 125 10.367 -11.288 -1.623 1.00 0.00 H new ATOM 0 HD3 LYS A 125 9.705 -9.686 -1.881 1.00 0.00 H new ATOM 0 HE2 LYS A 125 9.944 -10.009 -4.367 1.00 0.00 H new ATOM 0 HE3 LYS A 125 10.554 -11.627 -4.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 8.209 -11.652 -4.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 8.465 -12.199 -3.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 7.874 -10.631 -3.282 1.00 0.00 H new ATOM 37 N GLY A 126 12.453 -6.444 -1.532 1.00 0.00 N ATOM 38 CA GLY A 126 12.320 -5.243 -2.335 1.00 0.00 C ATOM 39 C GLY A 126 13.661 -4.527 -2.480 1.00 0.00 C ATOM 40 O GLY A 126 14.721 -5.138 -2.329 1.00 0.00 O ATOM 0 H GLY A 126 13.409 -6.645 -1.239 1.00 0.00 H new ATOM 0 HA2 GLY A 126 11.934 -5.502 -3.321 1.00 0.00 H new ATOM 0 HA3 GLY A 126 11.594 -4.573 -1.875 1.00 0.00 H new ATOM 44 N LYS A 127 13.600 -3.224 -2.775 1.00 0.00 N ATOM 45 CA LYS A 127 14.767 -2.361 -2.904 1.00 0.00 C ATOM 46 C LYS A 127 14.471 -1.013 -2.263 1.00 0.00 C ATOM 47 O LYS A 127 13.336 -0.741 -1.878 1.00 0.00 O ATOM 48 CB LYS A 127 15.103 -2.149 -4.380 1.00 0.00 C ATOM 49 CG LYS A 127 15.560 -3.449 -5.043 1.00 0.00 C ATOM 50 CD LYS A 127 15.868 -3.229 -6.524 1.00 0.00 C ATOM 51 CE LYS A 127 16.974 -2.189 -6.705 1.00 0.00 C ATOM 52 NZ LYS A 127 17.224 -1.919 -8.128 1.00 0.00 N ATOM 0 H LYS A 127 12.719 -2.736 -2.933 1.00 0.00 H new ATOM 0 HA LYS A 127 15.614 -2.833 -2.406 1.00 0.00 H new ATOM 0 HB2 LYS A 127 14.228 -1.762 -4.901 1.00 0.00 H new ATOM 0 HB3 LYS A 127 15.887 -1.397 -4.471 1.00 0.00 H new ATOM 0 HG2 LYS A 127 16.447 -3.828 -4.536 1.00 0.00 H new ATOM 0 HG3 LYS A 127 14.784 -4.207 -4.938 1.00 0.00 H new ATOM 0 HD2 LYS A 127 16.172 -4.171 -6.980 1.00 0.00 H new ATOM 0 HD3 LYS A 127 14.967 -2.901 -7.042 1.00 0.00 H new ATOM 0 HE2 LYS A 127 16.693 -1.264 -6.201 1.00 0.00 H new ATOM 0 HE3 LYS A 127 17.890 -2.543 -6.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 17.979 -1.210 -8.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 17.515 -2.798 -8.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 16.355 -1.558 -8.571 1.00 0.00 H new ATOM 66 N SER A 128 15.494 -0.168 -2.145 1.00 0.00 N ATOM 67 CA SER A 128 15.338 1.128 -1.511 1.00 0.00 C ATOM 68 C SER A 128 14.395 2.024 -2.302 1.00 0.00 C ATOM 69 O SER A 128 14.448 2.070 -3.531 1.00 0.00 O ATOM 70 CB SER A 128 16.698 1.813 -1.375 1.00 0.00 C ATOM 71 OG SER A 128 16.528 3.076 -0.776 1.00 0.00 O ATOM 0 H SER A 128 16.437 -0.363 -2.482 1.00 0.00 H new ATOM 0 HA SER A 128 14.908 0.965 -0.523 1.00 0.00 H new ATOM 0 HB2 SER A 128 17.368 1.200 -0.772 1.00 0.00 H new ATOM 0 HB3 SER A 128 17.162 1.923 -2.355 1.00 0.00 H new ATOM 0 HG SER A 128 17.399 3.516 -0.687 1.00 0.00 H new ATOM 77 N MET A 129 13.530 2.741 -1.584 1.00 0.00 N ATOM 78 CA MET A 129 12.641 3.734 -2.155 1.00 0.00 C ATOM 79 C MET A 129 12.205 4.706 -1.062 1.00 0.00 C ATOM 80 O MET A 129 12.456 4.477 0.119 1.00 0.00 O ATOM 81 CB MET A 129 11.438 3.051 -2.809 1.00 0.00 C ATOM 82 CG MET A 129 10.607 2.287 -1.784 1.00 0.00 C ATOM 83 SD MET A 129 9.105 1.525 -2.449 1.00 0.00 S ATOM 84 CE MET A 129 9.848 0.304 -3.564 1.00 0.00 C ATOM 0 H MET A 129 13.431 2.641 -0.574 1.00 0.00 H new ATOM 0 HA MET A 129 13.162 4.296 -2.930 1.00 0.00 H new ATOM 0 HB2 MET A 129 10.815 3.799 -3.300 1.00 0.00 H new ATOM 0 HB3 MET A 129 11.783 2.366 -3.583 1.00 0.00 H new ATOM 0 HG2 MET A 129 11.228 1.509 -1.340 1.00 0.00 H new ATOM 0 HG3 MET A 129 10.328 2.969 -0.981 1.00 0.00 H new ATOM 0 HE1 MET A 129 9.083 -0.397 -3.898 1.00 0.00 H new ATOM 0 HE2 MET A 129 10.275 0.813 -4.428 1.00 0.00 H new ATOM 0 HE3 MET A 129 10.633 -0.239 -3.038 1.00 0.00 H new ATOM 94 N GLN A 130 11.552 5.795 -1.463 1.00 0.00 N ATOM 95 CA GLN A 130 11.131 6.856 -0.555 1.00 0.00 C ATOM 96 C GLN A 130 9.799 7.423 -1.023 1.00 0.00 C ATOM 97 O GLN A 130 9.336 7.099 -2.117 1.00 0.00 O ATOM 98 CB GLN A 130 12.189 7.967 -0.545 1.00 0.00 C ATOM 99 CG GLN A 130 13.495 7.489 0.088 1.00 0.00 C ATOM 100 CD GLN A 130 14.571 8.562 0.009 1.00 0.00 C ATOM 101 OE1 GLN A 130 15.254 8.688 -1.004 1.00 0.00 O ATOM 102 NE2 GLN A 130 14.732 9.343 1.071 1.00 0.00 N ATOM 0 H GLN A 130 11.299 5.966 -2.436 1.00 0.00 H new ATOM 0 HA GLN A 130 11.019 6.453 0.452 1.00 0.00 H new ATOM 0 HB2 GLN A 130 12.378 8.300 -1.565 1.00 0.00 H new ATOM 0 HB3 GLN A 130 11.810 8.828 0.006 1.00 0.00 H new ATOM 0 HG2 GLN A 130 13.320 7.222 1.130 1.00 0.00 H new ATOM 0 HG3 GLN A 130 13.839 6.587 -0.419 1.00 0.00 H new ATOM 0 HE21 GLN A 130 14.147 9.210 1.896 1.00 0.00 H new ATOM 0 HE22 GLN A 130 15.441 10.076 1.062 1.00 0.00 H new ATOM 111 N LYS A 131 9.184 8.277 -0.201 1.00 0.00 N ATOM 112 CA LYS A 131 7.978 8.986 -0.598 1.00 0.00 C ATOM 113 C LYS A 131 8.336 9.915 -1.753 1.00 0.00 C ATOM 114 O LYS A 131 8.941 10.965 -1.543 1.00 0.00 O ATOM 115 CB LYS A 131 7.426 9.745 0.607 1.00 0.00 C ATOM 116 CG LYS A 131 6.224 10.640 0.287 1.00 0.00 C ATOM 117 CD LYS A 131 4.977 9.881 -0.193 1.00 0.00 C ATOM 118 CE LYS A 131 5.061 9.492 -1.669 1.00 0.00 C ATOM 119 NZ LYS A 131 3.779 8.957 -2.152 1.00 0.00 N ATOM 0 H LYS A 131 9.506 8.490 0.743 1.00 0.00 H new ATOM 0 HA LYS A 131 7.200 8.301 -0.935 1.00 0.00 H new ATOM 0 HB2 LYS A 131 7.136 9.026 1.374 1.00 0.00 H new ATOM 0 HB3 LYS A 131 8.220 10.360 1.030 1.00 0.00 H new ATOM 0 HG2 LYS A 131 5.965 11.212 1.178 1.00 0.00 H new ATOM 0 HG3 LYS A 131 6.515 11.358 -0.480 1.00 0.00 H new ATOM 0 HD2 LYS A 131 4.848 8.982 0.410 1.00 0.00 H new ATOM 0 HD3 LYS A 131 4.095 10.501 -0.033 1.00 0.00 H new ATOM 0 HE2 LYS A 131 5.341 10.363 -2.262 1.00 0.00 H new ATOM 0 HE3 LYS A 131 5.844 8.747 -1.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 3.948 8.081 -2.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 3.160 8.753 -1.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 3.321 9.657 -2.770 1.00 0.00 H new ATOM 133 N ARG A 132 7.959 9.529 -2.976 1.00 0.00 N ATOM 134 CA ARG A 132 8.290 10.256 -4.192 1.00 0.00 C ATOM 135 C ARG A 132 7.065 10.321 -5.098 1.00 0.00 C ATOM 136 O ARG A 132 5.987 9.885 -4.703 1.00 0.00 O ATOM 137 CB ARG A 132 9.453 9.563 -4.898 1.00 0.00 C ATOM 138 CG ARG A 132 10.749 9.612 -4.084 1.00 0.00 C ATOM 139 CD ARG A 132 11.249 11.049 -3.951 1.00 0.00 C ATOM 140 NE ARG A 132 12.531 11.098 -3.237 1.00 0.00 N ATOM 141 CZ ARG A 132 12.675 11.388 -1.944 1.00 0.00 C ATOM 142 NH1 ARG A 132 11.621 11.632 -1.168 1.00 0.00 N ATOM 143 NH2 ARG A 132 13.889 11.431 -1.412 1.00 0.00 N ATOM 0 H ARG A 132 7.407 8.688 -3.145 1.00 0.00 H new ATOM 0 HA ARG A 132 8.591 11.274 -3.945 1.00 0.00 H new ATOM 0 HB2 ARG A 132 9.189 8.523 -5.091 1.00 0.00 H new ATOM 0 HB3 ARG A 132 9.618 10.035 -5.867 1.00 0.00 H new ATOM 0 HG2 ARG A 132 10.579 9.188 -3.094 1.00 0.00 H new ATOM 0 HG3 ARG A 132 11.511 9.000 -4.567 1.00 0.00 H new ATOM 0 HD2 ARG A 132 11.363 11.491 -4.941 1.00 0.00 H new ATOM 0 HD3 ARG A 132 10.509 11.647 -3.419 1.00 0.00 H new ATOM 0 HE ARG A 132 13.376 10.895 -3.771 1.00 0.00 H new ATOM 0 HH11 ARG A 132 10.680 11.599 -1.561 1.00 0.00 H new ATOM 0 HH12 ARG A 132 11.754 11.852 -0.181 1.00 0.00 H new ATOM 0 HH21 ARG A 132 14.707 11.243 -1.992 1.00 0.00 H new ATOM 0 HH22 ARG A 132 14.005 11.652 -0.423 1.00 0.00 H new ATOM 157 N ARG A 133 7.227 10.861 -6.308 1.00 0.00 N ATOM 158 CA ARG A 133 6.145 11.001 -7.274 1.00 0.00 C ATOM 159 C ARG A 133 6.669 10.755 -8.682 1.00 0.00 C ATOM 160 O ARG A 133 7.881 10.719 -8.893 1.00 0.00 O ATOM 161 CB ARG A 133 5.552 12.409 -7.156 1.00 0.00 C ATOM 162 CG ARG A 133 4.733 12.557 -5.872 1.00 0.00 C ATOM 163 CD ARG A 133 4.049 13.926 -5.856 1.00 0.00 C ATOM 164 NE ARG A 133 3.218 14.106 -4.664 1.00 0.00 N ATOM 165 CZ ARG A 133 2.434 15.171 -4.461 1.00 0.00 C ATOM 166 NH1 ARG A 133 2.354 16.150 -5.359 1.00 0.00 N ATOM 167 NH2 ARG A 133 1.714 15.269 -3.350 1.00 0.00 N ATOM 0 H ARG A 133 8.123 11.215 -6.644 1.00 0.00 H new ATOM 0 HA ARG A 133 5.367 10.266 -7.068 1.00 0.00 H new ATOM 0 HB2 ARG A 133 6.354 13.147 -7.166 1.00 0.00 H new ATOM 0 HB3 ARG A 133 4.920 12.614 -8.020 1.00 0.00 H new ATOM 0 HG2 ARG A 133 3.986 11.765 -5.811 1.00 0.00 H new ATOM 0 HG3 ARG A 133 5.380 12.452 -5.001 1.00 0.00 H new ATOM 0 HD2 ARG A 133 4.805 14.710 -5.894 1.00 0.00 H new ATOM 0 HD3 ARG A 133 3.433 14.035 -6.748 1.00 0.00 H new ATOM 0 HE ARG A 133 3.238 13.379 -3.949 1.00 0.00 H new ATOM 0 HH11 ARG A 133 2.896 16.097 -6.221 1.00 0.00 H new ATOM 0 HH12 ARG A 133 1.750 16.953 -5.185 1.00 0.00 H new ATOM 0 HH21 ARG A 133 1.757 14.531 -2.647 1.00 0.00 H new ATOM 0 HH22 ARG A 133 1.118 16.083 -3.199 1.00 0.00 H new ATOM 181 N SER A 134 5.755 10.590 -9.641 1.00 0.00 N ATOM 182 CA SER A 134 6.111 10.353 -11.034 1.00 0.00 C ATOM 183 C SER A 134 7.027 9.134 -11.171 1.00 0.00 C ATOM 184 O SER A 134 6.914 8.188 -10.393 1.00 0.00 O ATOM 185 CB SER A 134 6.726 11.628 -11.611 1.00 0.00 C ATOM 186 OG SER A 134 6.759 11.569 -13.019 1.00 0.00 O ATOM 0 H SER A 134 4.750 10.618 -9.470 1.00 0.00 H new ATOM 0 HA SER A 134 5.218 10.116 -11.612 1.00 0.00 H new ATOM 0 HB2 SER A 134 6.147 12.494 -11.291 1.00 0.00 H new ATOM 0 HB3 SER A 134 7.736 11.759 -11.223 1.00 0.00 H new ATOM 0 HG SER A 134 6.633 12.468 -13.387 1.00 0.00 H new ATOM 192 N LYS A 135 7.926 9.168 -12.164 1.00 0.00 N ATOM 193 CA LYS A 135 8.886 8.106 -12.414 1.00 0.00 C ATOM 194 C LYS A 135 9.618 7.703 -11.138 1.00 0.00 C ATOM 195 O LYS A 135 9.937 8.540 -10.297 1.00 0.00 O ATOM 196 CB LYS A 135 9.889 8.569 -13.468 1.00 0.00 C ATOM 197 CG LYS A 135 9.237 8.517 -14.847 1.00 0.00 C ATOM 198 CD LYS A 135 10.133 9.134 -15.919 1.00 0.00 C ATOM 199 CE LYS A 135 11.495 8.450 -15.981 1.00 0.00 C ATOM 200 NZ LYS A 135 11.383 7.045 -16.409 1.00 0.00 N ATOM 0 H LYS A 135 8.001 9.946 -12.819 1.00 0.00 H new ATOM 0 HA LYS A 135 8.345 7.232 -12.776 1.00 0.00 H new ATOM 0 HB2 LYS A 135 10.221 9.584 -13.249 1.00 0.00 H new ATOM 0 HB3 LYS A 135 10.774 7.933 -13.448 1.00 0.00 H new ATOM 0 HG2 LYS A 135 9.018 7.481 -15.107 1.00 0.00 H new ATOM 0 HG3 LYS A 135 8.285 9.047 -14.820 1.00 0.00 H new ATOM 0 HD2 LYS A 135 9.643 9.058 -16.890 1.00 0.00 H new ATOM 0 HD3 LYS A 135 10.268 10.196 -15.713 1.00 0.00 H new ATOM 0 HE2 LYS A 135 12.142 8.990 -16.673 1.00 0.00 H new ATOM 0 HE3 LYS A 135 11.969 8.495 -15.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 12.334 6.644 -16.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 10.873 6.501 -15.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 10.863 6.996 -17.308 1.00 0.00 H new ATOM 214 N GLY A 136 9.885 6.401 -11.014 1.00 0.00 N ATOM 215 CA GLY A 136 10.555 5.836 -9.858 1.00 0.00 C ATOM 216 C GLY A 136 9.557 5.116 -8.951 1.00 0.00 C ATOM 217 O GLY A 136 9.963 4.419 -8.025 1.00 0.00 O ATOM 0 H GLY A 136 9.637 5.710 -11.723 1.00 0.00 H new ATOM 0 HA2 GLY A 136 11.326 5.138 -10.184 1.00 0.00 H new ATOM 0 HA3 GLY A 136 11.056 6.627 -9.300 1.00 0.00 H new ATOM 221 N ASP A 137 8.257 5.287 -9.217 1.00 0.00 N ATOM 222 CA ASP A 137 7.190 4.622 -8.490 1.00 0.00 C ATOM 223 C ASP A 137 6.098 4.199 -9.480 1.00 0.00 C ATOM 224 O ASP A 137 6.241 4.396 -10.686 1.00 0.00 O ATOM 225 CB ASP A 137 6.659 5.543 -7.388 1.00 0.00 C ATOM 226 CG ASP A 137 6.114 4.758 -6.195 1.00 0.00 C ATOM 227 OD1 ASP A 137 5.738 3.580 -6.387 1.00 0.00 O ATOM 228 OD2 ASP A 137 6.083 5.345 -5.092 1.00 0.00 O ATOM 0 H ASP A 137 7.920 5.903 -9.957 1.00 0.00 H new ATOM 0 HA ASP A 137 7.562 3.722 -8.000 1.00 0.00 H new ATOM 0 HB2 ASP A 137 7.458 6.204 -7.052 1.00 0.00 H new ATOM 0 HB3 ASP A 137 5.871 6.177 -7.795 1.00 0.00 H new ATOM 233 N ARG A 138 5.005 3.611 -8.982 1.00 0.00 N ATOM 234 CA ARG A 138 3.970 3.006 -9.807 1.00 0.00 C ATOM 235 C ARG A 138 2.588 3.486 -9.388 1.00 0.00 C ATOM 236 O ARG A 138 2.458 4.241 -8.426 1.00 0.00 O ATOM 237 CB ARG A 138 4.091 1.489 -9.665 1.00 0.00 C ATOM 238 CG ARG A 138 5.376 0.971 -10.317 1.00 0.00 C ATOM 239 CD ARG A 138 5.533 -0.527 -10.061 1.00 0.00 C ATOM 240 NE ARG A 138 6.867 -0.989 -10.449 1.00 0.00 N ATOM 241 CZ ARG A 138 7.565 -1.930 -9.804 1.00 0.00 C ATOM 242 NH1 ARG A 138 7.082 -2.524 -8.721 1.00 0.00 N ATOM 243 NH2 ARG A 138 8.767 -2.292 -10.241 1.00 0.00 N ATOM 0 H ARG A 138 4.818 3.544 -7.982 1.00 0.00 H new ATOM 0 HA ARG A 138 4.101 3.297 -10.849 1.00 0.00 H new ATOM 0 HB2 ARG A 138 4.082 1.218 -8.609 1.00 0.00 H new ATOM 0 HB3 ARG A 138 3.228 1.008 -10.125 1.00 0.00 H new ATOM 0 HG2 ARG A 138 5.351 1.163 -11.390 1.00 0.00 H new ATOM 0 HG3 ARG A 138 6.237 1.507 -9.917 1.00 0.00 H new ATOM 0 HD2 ARG A 138 5.364 -0.739 -9.005 1.00 0.00 H new ATOM 0 HD3 ARG A 138 4.777 -1.077 -10.622 1.00 0.00 H new ATOM 0 HE ARG A 138 7.295 -0.562 -11.271 1.00 0.00 H new ATOM 0 HH11 ARG A 138 6.162 -2.266 -8.365 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.631 -3.239 -8.244 1.00 0.00 H new ATOM 0 HH21 ARG A 138 9.161 -1.852 -11.072 1.00 0.00 H new ATOM 0 HH22 ARG A 138 9.295 -3.010 -9.745 1.00 0.00 H new ATOM 257 N CYS A 139 1.560 3.042 -10.115 1.00 0.00 N ATOM 258 CA CYS A 139 0.158 3.275 -9.808 1.00 0.00 C ATOM 259 C CYS A 139 -0.071 3.035 -8.320 1.00 0.00 C ATOM 260 O CYS A 139 0.099 1.926 -7.825 1.00 0.00 O ATOM 261 CB CYS A 139 -0.693 2.365 -10.702 1.00 0.00 C ATOM 262 SG CYS A 139 -2.378 2.194 -10.065 1.00 0.00 S ATOM 0 H CYS A 139 1.692 2.491 -10.963 1.00 0.00 H new ATOM 0 HA CYS A 139 -0.135 4.305 -10.014 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -0.725 2.773 -11.712 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -0.227 1.382 -10.770 1.00 0.00 H new ATOM 267 N TYR A 140 -0.453 4.098 -7.620 1.00 0.00 N ATOM 268 CA TYR A 140 -0.713 4.095 -6.189 1.00 0.00 C ATOM 269 C TYR A 140 -1.949 3.279 -5.811 1.00 0.00 C ATOM 270 O TYR A 140 -2.347 3.275 -4.649 1.00 0.00 O ATOM 271 CB TYR A 140 -0.863 5.541 -5.718 1.00 0.00 C ATOM 272 CG TYR A 140 0.375 6.401 -5.780 1.00 0.00 C ATOM 273 CD1 TYR A 140 1.650 5.832 -5.938 1.00 0.00 C ATOM 274 CD2 TYR A 140 0.237 7.788 -5.679 1.00 0.00 C ATOM 275 CE1 TYR A 140 2.787 6.657 -5.989 1.00 0.00 C ATOM 276 CE2 TYR A 140 1.367 8.618 -5.723 1.00 0.00 C ATOM 277 CZ TYR A 140 2.644 8.052 -5.878 1.00 0.00 C ATOM 278 OH TYR A 140 3.744 8.850 -5.925 1.00 0.00 O ATOM 0 H TYR A 140 -0.594 5.013 -8.048 1.00 0.00 H new ATOM 0 HA TYR A 140 0.130 3.615 -5.693 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -1.639 6.016 -6.318 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -1.219 5.529 -4.688 1.00 0.00 H new ATOM 0 HD1 TYR A 140 1.756 4.760 -6.020 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -0.745 8.223 -5.566 1.00 0.00 H new ATOM 0 HE1 TYR A 140 3.767 6.221 -6.113 1.00 0.00 H new ATOM 0 HE2 TYR A 140 1.256 9.689 -5.638 1.00 0.00 H new ATOM 0 HH TYR A 140 4.211 8.815 -5.064 1.00 0.00 H new ATOM 288 N ASN A 141 -2.562 2.592 -6.780 1.00 0.00 N ATOM 289 CA ASN A 141 -3.756 1.822 -6.524 1.00 0.00 C ATOM 290 C ASN A 141 -3.519 0.337 -6.781 1.00 0.00 C ATOM 291 O ASN A 141 -3.998 -0.497 -6.023 1.00 0.00 O ATOM 292 CB ASN A 141 -4.883 2.347 -7.414 1.00 0.00 C ATOM 293 CG ASN A 141 -6.204 1.681 -7.081 1.00 0.00 C ATOM 294 OD1 ASN A 141 -6.677 1.778 -5.954 1.00 0.00 O ATOM 295 ND2 ASN A 141 -6.815 0.993 -8.043 1.00 0.00 N ATOM 0 H ASN A 141 -2.240 2.561 -7.747 1.00 0.00 H new ATOM 0 HA ASN A 141 -4.033 1.931 -5.476 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -4.976 3.426 -7.289 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -4.636 2.168 -8.460 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -7.703 0.528 -7.852 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -6.396 0.931 -8.971 1.00 0.00 H new ATOM 302 N CYS A 142 -2.789 -0.015 -7.842 1.00 0.00 N ATOM 303 CA CYS A 142 -2.644 -1.412 -8.212 1.00 0.00 C ATOM 304 C CYS A 142 -1.182 -1.838 -8.203 1.00 0.00 C ATOM 305 O CYS A 142 -0.860 -2.959 -7.808 1.00 0.00 O ATOM 306 CB CYS A 142 -3.342 -1.624 -9.547 1.00 0.00 C ATOM 307 SG CYS A 142 -2.269 -1.177 -10.928 1.00 0.00 S ATOM 0 H CYS A 142 -2.298 0.642 -8.448 1.00 0.00 H new ATOM 0 HA CYS A 142 -3.122 -2.059 -7.477 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -3.643 -2.668 -9.641 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -4.252 -1.025 -9.583 1.00 0.00 H new ATOM 312 N GLY A 143 -0.300 -0.933 -8.638 1.00 0.00 N ATOM 313 CA GLY A 143 1.128 -1.188 -8.642 1.00 0.00 C ATOM 314 C GLY A 143 1.660 -1.350 -10.064 1.00 0.00 C ATOM 315 O GLY A 143 2.746 -1.897 -10.240 1.00 0.00 O ATOM 0 H GLY A 143 -0.561 -0.013 -8.993 1.00 0.00 H new ATOM 0 HA2 GLY A 143 1.647 -0.366 -8.149 1.00 0.00 H new ATOM 0 HA3 GLY A 143 1.340 -2.090 -8.067 1.00 0.00 H new ATOM 319 N GLY A 144 0.915 -0.885 -11.074 1.00 0.00 N ATOM 320 CA GLY A 144 1.367 -0.938 -12.453 1.00 0.00 C ATOM 321 C GLY A 144 2.148 0.316 -12.835 1.00 0.00 C ATOM 322 O GLY A 144 2.101 1.313 -12.131 1.00 0.00 O ATOM 0 H GLY A 144 -0.007 -0.467 -10.952 1.00 0.00 H new ATOM 0 HA2 GLY A 144 1.995 -1.817 -12.597 1.00 0.00 H new ATOM 0 HA3 GLY A 144 0.508 -1.048 -13.115 1.00 0.00 H new ATOM 326 N LEU A 145 2.870 0.267 -13.951 1.00 0.00 N ATOM 327 CA LEU A 145 3.813 1.314 -14.320 1.00 0.00 C ATOM 328 C LEU A 145 3.384 2.031 -15.595 1.00 0.00 C ATOM 329 O LEU A 145 3.814 3.156 -15.849 1.00 0.00 O ATOM 330 CB LEU A 145 5.230 0.757 -14.509 1.00 0.00 C ATOM 331 CG LEU A 145 5.292 -0.756 -14.735 1.00 0.00 C ATOM 332 CD1 LEU A 145 6.649 -1.094 -15.345 1.00 0.00 C ATOM 333 CD2 LEU A 145 5.181 -1.504 -13.412 1.00 0.00 C ATOM 0 H LEU A 145 2.817 -0.499 -14.623 1.00 0.00 H new ATOM 0 HA LEU A 145 3.819 2.027 -13.496 1.00 0.00 H new ATOM 0 HB2 LEU A 145 5.693 1.258 -15.359 1.00 0.00 H new ATOM 0 HB3 LEU A 145 5.825 1.005 -13.630 1.00 0.00 H new ATOM 0 HG LEU A 145 4.470 -1.048 -15.388 1.00 0.00 H new ATOM 0 HD11 LEU A 145 6.714 -2.169 -15.514 1.00 0.00 H new ATOM 0 HD12 LEU A 145 6.762 -0.570 -16.294 1.00 0.00 H new ATOM 0 HD13 LEU A 145 7.441 -0.785 -14.663 1.00 0.00 H new ATOM 0 HD21 LEU A 145 5.227 -2.577 -13.596 1.00 0.00 H new ATOM 0 HD22 LEU A 145 6.003 -1.212 -12.759 1.00 0.00 H new ATOM 0 HD23 LEU A 145 4.233 -1.258 -12.934 1.00 0.00 H new ATOM 345 N ASP A 146 2.543 1.376 -16.388 1.00 0.00 N ATOM 346 CA ASP A 146 2.043 1.932 -17.634 1.00 0.00 C ATOM 347 C ASP A 146 0.965 3.000 -17.381 1.00 0.00 C ATOM 348 O ASP A 146 0.456 3.599 -18.326 1.00 0.00 O ATOM 349 CB ASP A 146 1.530 0.765 -18.472 1.00 0.00 C ATOM 350 CG ASP A 146 0.804 1.190 -19.744 1.00 0.00 C ATOM 351 OD1 ASP A 146 1.449 1.840 -20.593 1.00 0.00 O ATOM 352 OD2 ASP A 146 -0.397 0.857 -19.860 1.00 0.00 O ATOM 0 H ASP A 146 2.190 0.442 -16.181 1.00 0.00 H new ATOM 0 HA ASP A 146 2.835 2.450 -18.174 1.00 0.00 H new ATOM 0 HB2 ASP A 146 2.371 0.127 -18.742 1.00 0.00 H new ATOM 0 HB3 ASP A 146 0.855 0.163 -17.864 1.00 0.00 H new ATOM 357 N HIS A 147 0.618 3.235 -16.110 1.00 0.00 N ATOM 358 CA HIS A 147 -0.419 4.186 -15.732 1.00 0.00 C ATOM 359 C HIS A 147 -0.229 4.660 -14.288 1.00 0.00 C ATOM 360 O HIS A 147 0.780 4.349 -13.654 1.00 0.00 O ATOM 361 CB HIS A 147 -1.781 3.504 -15.867 1.00 0.00 C ATOM 362 CG HIS A 147 -1.913 2.303 -14.969 1.00 0.00 C ATOM 363 ND1 HIS A 147 -1.377 1.049 -15.174 1.00 0.00 N ATOM 364 CD2 HIS A 147 -2.582 2.261 -13.778 1.00 0.00 C ATOM 365 CE1 HIS A 147 -1.705 0.286 -14.117 1.00 0.00 C ATOM 366 NE2 HIS A 147 -2.452 0.979 -13.237 1.00 0.00 N ATOM 0 H HIS A 147 1.054 2.766 -15.316 1.00 0.00 H new ATOM 0 HA HIS A 147 -0.359 5.055 -16.387 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -2.568 4.220 -15.630 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -1.930 3.198 -16.903 1.00 0.00 H new ATOM 0 HD1 HIS A 147 -0.830 0.754 -15.983 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -3.121 3.082 -13.329 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -1.409 -0.745 -13.991 1.00 0.00 H new ATOM 374 N HIS A 148 -1.208 5.406 -13.769 1.00 0.00 N ATOM 375 CA HIS A 148 -1.228 5.893 -12.395 1.00 0.00 C ATOM 376 C HIS A 148 -2.577 5.578 -11.762 1.00 0.00 C ATOM 377 O HIS A 148 -3.502 5.159 -12.454 1.00 0.00 O ATOM 378 CB HIS A 148 -0.963 7.399 -12.381 1.00 0.00 C ATOM 379 CG HIS A 148 0.440 7.764 -12.778 1.00 0.00 C ATOM 380 ND1 HIS A 148 0.789 8.792 -13.659 1.00 0.00 N ATOM 381 CD2 HIS A 148 1.572 7.143 -12.335 1.00 0.00 C ATOM 382 CE1 HIS A 148 2.131 8.770 -13.718 1.00 0.00 C ATOM 383 NE2 HIS A 148 2.625 7.792 -12.942 1.00 0.00 N ATOM 0 H HIS A 148 -2.025 5.692 -14.308 1.00 0.00 H new ATOM 0 HA HIS A 148 -0.448 5.397 -11.817 1.00 0.00 H new ATOM 0 HB2 HIS A 148 -1.663 7.889 -13.058 1.00 0.00 H new ATOM 0 HB3 HIS A 148 -1.162 7.786 -11.381 1.00 0.00 H new ATOM 0 HD2 HIS A 148 1.630 6.312 -11.648 1.00 0.00 H new ATOM 0 HE1 HIS A 148 2.731 9.447 -14.309 1.00 0.00 H new ATOM 0 HE2 HIS A 148 3.613 7.567 -12.822 1.00 0.00 H new ATOM 391 N ALA A 149 -2.703 5.779 -10.447 1.00 0.00 N ATOM 392 CA ALA A 149 -3.894 5.403 -9.697 1.00 0.00 C ATOM 393 C ALA A 149 -5.181 6.050 -10.221 1.00 0.00 C ATOM 394 O ALA A 149 -6.273 5.577 -9.911 1.00 0.00 O ATOM 395 CB ALA A 149 -3.691 5.798 -8.238 1.00 0.00 C ATOM 0 H ALA A 149 -1.976 6.209 -9.875 1.00 0.00 H new ATOM 0 HA ALA A 149 -4.021 4.327 -9.812 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -4.574 5.524 -7.661 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -2.820 5.278 -7.838 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -3.534 6.875 -8.171 1.00 0.00 H new ATOM 401 N LYS A 150 -5.062 7.120 -11.006 1.00 0.00 N ATOM 402 CA LYS A 150 -6.198 7.847 -11.550 1.00 0.00 C ATOM 403 C LYS A 150 -6.548 7.384 -12.958 1.00 0.00 C ATOM 404 O LYS A 150 -7.566 7.794 -13.519 1.00 0.00 O ATOM 405 CB LYS A 150 -5.853 9.328 -11.569 1.00 0.00 C ATOM 406 CG LYS A 150 -4.607 9.594 -12.423 1.00 0.00 C ATOM 407 CD LYS A 150 -3.982 10.923 -12.029 1.00 0.00 C ATOM 408 CE LYS A 150 -3.360 10.794 -10.637 1.00 0.00 C ATOM 409 NZ LYS A 150 -2.872 12.094 -10.148 1.00 0.00 N ATOM 0 H LYS A 150 -4.160 7.508 -11.283 1.00 0.00 H new ATOM 0 HA LYS A 150 -7.068 7.657 -10.921 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -6.696 9.896 -11.963 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -5.681 9.678 -10.551 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -3.885 8.789 -12.288 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -4.876 9.608 -13.479 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -3.221 11.210 -12.755 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -4.738 11.709 -12.031 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -4.099 10.395 -9.942 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -2.535 10.082 -10.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -2.009 11.952 -9.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -2.660 12.712 -10.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -3.602 12.538 -9.555 1.00 0.00 H new ATOM 423 N GLU A 151 -5.697 6.529 -13.518 1.00 0.00 N ATOM 424 CA GLU A 151 -5.919 5.896 -14.812 1.00 0.00 C ATOM 425 C GLU A 151 -5.923 4.378 -14.694 1.00 0.00 C ATOM 426 O GLU A 151 -5.947 3.675 -15.698 1.00 0.00 O ATOM 427 CB GLU A 151 -4.873 6.339 -15.838 1.00 0.00 C ATOM 428 CG GLU A 151 -4.638 7.844 -15.767 1.00 0.00 C ATOM 429 CD GLU A 151 -3.999 8.410 -17.026 1.00 0.00 C ATOM 430 OE1 GLU A 151 -3.782 7.634 -17.986 1.00 0.00 O ATOM 431 OE2 GLU A 151 -3.725 9.631 -17.016 1.00 0.00 O ATOM 0 H GLU A 151 -4.820 6.253 -13.077 1.00 0.00 H new ATOM 0 HA GLU A 151 -6.901 6.218 -15.160 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -3.936 5.812 -15.657 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -5.204 6.066 -16.840 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -5.590 8.346 -15.593 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -3.999 8.066 -14.912 1.00 0.00 H new ATOM 438 N CYS A 152 -5.898 3.863 -13.458 1.00 0.00 N ATOM 439 CA CYS A 152 -6.001 2.444 -13.200 1.00 0.00 C ATOM 440 C CYS A 152 -7.279 1.883 -13.824 1.00 0.00 C ATOM 441 O CYS A 152 -8.189 2.635 -14.180 1.00 0.00 O ATOM 442 CB CYS A 152 -5.928 2.212 -11.690 1.00 0.00 C ATOM 443 SG CYS A 152 -5.291 0.547 -11.405 1.00 0.00 S ATOM 0 H CYS A 152 -5.805 4.430 -12.615 1.00 0.00 H new ATOM 0 HA CYS A 152 -5.172 1.909 -13.663 1.00 0.00 H new ATOM 0 HB2 CYS A 152 -5.279 2.952 -11.223 1.00 0.00 H new ATOM 0 HB3 CYS A 152 -6.915 2.324 -11.240 1.00 0.00 H new ATOM 448 N LYS A 153 -7.357 0.561 -13.956 1.00 0.00 N ATOM 449 CA LYS A 153 -8.440 -0.095 -14.682 1.00 0.00 C ATOM 450 C LYS A 153 -9.199 -1.097 -13.821 1.00 0.00 C ATOM 451 O LYS A 153 -10.071 -1.822 -14.300 1.00 0.00 O ATOM 452 CB LYS A 153 -7.916 -0.711 -15.980 1.00 0.00 C ATOM 453 CG LYS A 153 -6.544 -1.349 -15.823 1.00 0.00 C ATOM 454 CD LYS A 153 -6.546 -2.474 -14.798 1.00 0.00 C ATOM 455 CE LYS A 153 -5.116 -2.933 -14.565 1.00 0.00 C ATOM 456 NZ LYS A 153 -4.559 -3.604 -15.749 1.00 0.00 N ATOM 0 H LYS A 153 -6.672 -0.084 -13.563 1.00 0.00 H new ATOM 0 HA LYS A 153 -9.172 0.667 -14.949 1.00 0.00 H new ATOM 0 HB2 LYS A 153 -8.623 -1.463 -16.330 1.00 0.00 H new ATOM 0 HB3 LYS A 153 -7.866 0.061 -16.748 1.00 0.00 H new ATOM 0 HG2 LYS A 153 -6.214 -1.738 -16.786 1.00 0.00 H new ATOM 0 HG3 LYS A 153 -5.824 -0.588 -15.523 1.00 0.00 H new ATOM 0 HD2 LYS A 153 -6.988 -2.131 -13.863 1.00 0.00 H new ATOM 0 HD3 LYS A 153 -7.155 -3.305 -15.152 1.00 0.00 H new ATOM 0 HE2 LYS A 153 -4.496 -2.074 -14.308 1.00 0.00 H new ATOM 0 HE3 LYS A 153 -5.087 -3.613 -13.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 -3.645 -4.036 -15.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 -5.216 -4.343 -16.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 -4.422 -2.908 -16.510 1.00 0.00 H new ATOM 470 N LEU A 154 -8.853 -1.128 -12.538 1.00 0.00 N ATOM 471 CA LEU A 154 -9.507 -1.933 -11.518 1.00 0.00 C ATOM 472 C LEU A 154 -10.085 -1.004 -10.451 1.00 0.00 C ATOM 473 O LEU A 154 -9.742 0.176 -10.428 1.00 0.00 O ATOM 474 CB LEU A 154 -8.521 -2.986 -10.985 1.00 0.00 C ATOM 475 CG LEU A 154 -7.099 -2.480 -10.786 1.00 0.00 C ATOM 476 CD1 LEU A 154 -7.068 -1.580 -9.562 1.00 0.00 C ATOM 477 CD2 LEU A 154 -6.184 -3.679 -10.568 1.00 0.00 C ATOM 0 H LEU A 154 -8.081 -0.572 -12.169 1.00 0.00 H new ATOM 0 HA LEU A 154 -10.348 -2.495 -11.924 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -8.894 -3.365 -10.034 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -8.500 -3.828 -11.677 1.00 0.00 H new ATOM 0 HG LEU A 154 -6.765 -1.918 -11.658 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.054 -1.210 -9.408 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -7.743 -0.737 -9.713 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -7.385 -2.146 -8.686 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -5.160 -3.334 -10.424 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -6.509 -4.229 -9.685 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -6.227 -4.333 -11.439 1.00 0.00 H new ATOM 489 N PRO A 155 -10.947 -1.504 -9.558 1.00 0.00 N ATOM 490 CA PRO A 155 -11.582 -0.694 -8.538 1.00 0.00 C ATOM 491 C PRO A 155 -10.551 -0.127 -7.561 1.00 0.00 C ATOM 492 O PRO A 155 -9.391 -0.536 -7.579 1.00 0.00 O ATOM 493 CB PRO A 155 -12.584 -1.621 -7.850 1.00 0.00 C ATOM 494 CG PRO A 155 -12.034 -3.014 -8.108 1.00 0.00 C ATOM 495 CD PRO A 155 -11.386 -2.883 -9.481 1.00 0.00 C ATOM 0 HA PRO A 155 -12.083 0.177 -8.960 1.00 0.00 H new ATOM 0 HB2 PRO A 155 -12.654 -1.411 -6.783 1.00 0.00 H new ATOM 0 HB3 PRO A 155 -13.585 -1.504 -8.264 1.00 0.00 H new ATOM 0 HG2 PRO A 155 -11.311 -3.309 -7.348 1.00 0.00 H new ATOM 0 HG3 PRO A 155 -12.823 -3.766 -8.105 1.00 0.00 H new ATOM 0 HD2 PRO A 155 -10.547 -3.571 -9.589 1.00 0.00 H new ATOM 0 HD3 PRO A 155 -12.094 -3.117 -10.276 1.00 0.00 H new ATOM 503 N PRO A 156 -10.964 0.814 -6.708 1.00 0.00 N ATOM 504 CA PRO A 156 -10.083 1.462 -5.758 1.00 0.00 C ATOM 505 C PRO A 156 -9.615 0.477 -4.698 1.00 0.00 C ATOM 506 O PRO A 156 -10.319 0.194 -3.729 1.00 0.00 O ATOM 507 CB PRO A 156 -10.899 2.602 -5.148 1.00 0.00 C ATOM 508 CG PRO A 156 -12.351 2.144 -5.311 1.00 0.00 C ATOM 509 CD PRO A 156 -12.315 1.335 -6.606 1.00 0.00 C ATOM 0 HA PRO A 156 -9.179 1.841 -6.235 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -10.645 2.759 -4.100 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -10.717 3.544 -5.664 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -12.680 1.539 -4.466 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -13.035 2.990 -5.383 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -13.045 0.526 -6.583 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -12.559 1.960 -7.465 1.00 0.00 H new ATOM 517 N GLN A 157 -8.406 -0.042 -4.899 1.00 0.00 N ATOM 518 CA GLN A 157 -7.783 -0.986 -3.999 1.00 0.00 C ATOM 519 C GLN A 157 -7.320 -0.290 -2.732 1.00 0.00 C ATOM 520 O GLN A 157 -7.212 0.936 -2.694 1.00 0.00 O ATOM 521 CB GLN A 157 -6.522 -1.547 -4.656 1.00 0.00 C ATOM 522 CG GLN A 157 -6.782 -2.162 -6.026 1.00 0.00 C ATOM 523 CD GLN A 157 -7.734 -3.341 -5.942 1.00 0.00 C ATOM 524 OE1 GLN A 157 -7.603 -4.205 -5.079 1.00 0.00 O ATOM 525 NE2 GLN A 157 -8.702 -3.375 -6.849 1.00 0.00 N ATOM 0 H GLN A 157 -7.829 0.191 -5.707 1.00 0.00 H new ATOM 0 HA GLN A 157 -8.513 -1.763 -3.772 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -5.787 -0.749 -4.757 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -6.085 -2.302 -4.003 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -7.198 -1.405 -6.691 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -5.838 -2.487 -6.464 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -8.772 -2.635 -7.548 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -9.376 -4.141 -6.848 1.00 0.00 H new ATOM 534 N PRO A 158 -7.036 -1.058 -1.682 1.00 0.00 N ATOM 535 CA PRO A 158 -6.352 -0.563 -0.506 1.00 0.00 C ATOM 536 C PRO A 158 -4.873 -0.503 -0.837 1.00 0.00 C ATOM 537 O PRO A 158 -4.310 -1.437 -1.406 1.00 0.00 O ATOM 538 CB PRO A 158 -6.638 -1.607 0.575 1.00 0.00 C ATOM 539 CG PRO A 158 -6.759 -2.906 -0.219 1.00 0.00 C ATOM 540 CD PRO A 158 -7.345 -2.472 -1.560 1.00 0.00 C ATOM 0 HA PRO A 158 -6.670 0.428 -0.180 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -5.834 -1.657 1.309 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -7.554 -1.381 1.120 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -5.789 -3.387 -0.345 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -7.407 -3.622 0.286 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -6.909 -3.041 -2.381 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -8.421 -2.642 -1.591 1.00 0.00 H new ATOM 548 N LYS A 159 -4.239 0.609 -0.471 1.00 0.00 N ATOM 549 CA LYS A 159 -2.805 0.747 -0.612 1.00 0.00 C ATOM 550 C LYS A 159 -2.153 -0.078 0.485 1.00 0.00 C ATOM 551 O LYS A 159 -2.652 -0.139 1.607 1.00 0.00 O ATOM 552 CB LYS A 159 -2.395 2.217 -0.588 1.00 0.00 C ATOM 553 CG LYS A 159 -2.857 2.944 0.673 1.00 0.00 C ATOM 554 CD LYS A 159 -2.316 4.371 0.637 1.00 0.00 C ATOM 555 CE LYS A 159 -1.636 4.673 1.965 1.00 0.00 C ATOM 556 NZ LYS A 159 -2.625 4.891 3.037 1.00 0.00 N ATOM 0 H LYS A 159 -4.704 1.426 -0.074 1.00 0.00 H new ATOM 0 HA LYS A 159 -2.466 0.371 -1.578 1.00 0.00 H new ATOM 0 HB2 LYS A 159 -1.310 2.287 -0.665 1.00 0.00 H new ATOM 0 HB3 LYS A 159 -2.809 2.719 -1.463 1.00 0.00 H new ATOM 0 HG2 LYS A 159 -3.946 2.953 0.727 1.00 0.00 H new ATOM 0 HG3 LYS A 159 -2.498 2.425 1.562 1.00 0.00 H new ATOM 0 HD2 LYS A 159 -1.608 4.485 -0.184 1.00 0.00 H new ATOM 0 HD3 LYS A 159 -3.127 5.077 0.459 1.00 0.00 H new ATOM 0 HE2 LYS A 159 -0.979 3.846 2.236 1.00 0.00 H new ATOM 0 HE3 LYS A 159 -1.008 5.558 1.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 -2.307 4.415 3.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 -2.722 5.911 3.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 -3.544 4.502 2.746 1.00 0.00 H new ATOM 570 N LYS A 160 -1.036 -0.714 0.150 1.00 0.00 N ATOM 571 CA LYS A 160 -0.369 -1.657 1.033 1.00 0.00 C ATOM 572 C LYS A 160 1.001 -1.144 1.440 1.00 0.00 C ATOM 573 O LYS A 160 1.569 -0.266 0.792 1.00 0.00 O ATOM 574 CB LYS A 160 -0.189 -2.989 0.313 1.00 0.00 C ATOM 575 CG LYS A 160 -1.515 -3.641 -0.060 1.00 0.00 C ATOM 576 CD LYS A 160 -1.332 -4.665 -1.171 1.00 0.00 C ATOM 577 CE LYS A 160 -2.665 -4.772 -1.900 1.00 0.00 C ATOM 578 NZ LYS A 160 -2.579 -5.686 -3.056 1.00 0.00 N ATOM 0 H LYS A 160 -0.567 -0.588 -0.747 1.00 0.00 H new ATOM 0 HA LYS A 160 -0.985 -1.781 1.924 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.401 -2.832 -0.590 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.378 -3.668 0.950 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -1.945 -4.125 0.817 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -2.222 -2.876 -0.380 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.542 -4.355 -1.855 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -1.038 -5.631 -0.761 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -3.430 -5.128 -1.210 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -2.976 -3.784 -2.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -3.504 -5.735 -3.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -1.866 -5.333 -3.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -2.307 -6.635 -2.729 1.00 0.00 H new ATOM 592 N CYS A 161 1.519 -1.719 2.525 1.00 0.00 N ATOM 593 CA CYS A 161 2.880 -1.505 2.964 1.00 0.00 C ATOM 594 C CYS A 161 3.829 -1.754 1.792 1.00 0.00 C ATOM 595 O CYS A 161 3.823 -2.834 1.200 1.00 0.00 O ATOM 596 CB CYS A 161 3.120 -2.473 4.126 1.00 0.00 C ATOM 597 SG CYS A 161 4.827 -2.402 4.706 1.00 0.00 S ATOM 0 H CYS A 161 0.991 -2.353 3.125 1.00 0.00 H new ATOM 0 HA CYS A 161 3.057 -0.484 3.301 1.00 0.00 H new ATOM 0 HB2 CYS A 161 2.445 -2.231 4.947 1.00 0.00 H new ATOM 0 HB3 CYS A 161 2.885 -3.489 3.809 1.00 0.00 H new ATOM 602 N HIS A 162 4.653 -0.762 1.450 1.00 0.00 N ATOM 603 CA HIS A 162 5.651 -0.867 0.394 1.00 0.00 C ATOM 604 C HIS A 162 6.763 -1.844 0.775 1.00 0.00 C ATOM 605 O HIS A 162 7.790 -1.905 0.098 1.00 0.00 O ATOM 606 CB HIS A 162 6.262 0.518 0.154 1.00 0.00 C ATOM 607 CG HIS A 162 5.384 1.429 -0.661 1.00 0.00 C ATOM 608 ND1 HIS A 162 4.588 1.028 -1.738 1.00 0.00 N ATOM 609 CD2 HIS A 162 5.244 2.774 -0.476 1.00 0.00 C ATOM 610 CE1 HIS A 162 4.000 2.147 -2.185 1.00 0.00 C ATOM 611 NE2 HIS A 162 4.379 3.211 -1.449 1.00 0.00 N ATOM 0 H HIS A 162 4.642 0.149 1.908 1.00 0.00 H new ATOM 0 HA HIS A 162 5.164 -1.238 -0.508 1.00 0.00 H new ATOM 0 HB2 HIS A 162 6.466 0.988 1.116 1.00 0.00 H new ATOM 0 HB3 HIS A 162 7.220 0.401 -0.353 1.00 0.00 H new ATOM 0 HD2 HIS A 162 5.719 3.375 0.285 1.00 0.00 H new ATOM 0 HE1 HIS A 162 3.317 2.190 -3.020 1.00 0.00 H new ATOM 0 HE2 HIS A 162 4.076 4.175 -1.590 1.00 0.00 H new ATOM 619 N PHE A 163 6.570 -2.608 1.856 1.00 0.00 N ATOM 620 CA PHE A 163 7.629 -3.402 2.438 1.00 0.00 C ATOM 621 C PHE A 163 7.221 -4.846 2.712 1.00 0.00 C ATOM 622 O PHE A 163 8.055 -5.743 2.593 1.00 0.00 O ATOM 623 CB PHE A 163 7.990 -2.703 3.730 1.00 0.00 C ATOM 624 CG PHE A 163 9.381 -2.948 4.229 1.00 0.00 C ATOM 625 CD1 PHE A 163 9.691 -4.166 4.846 1.00 0.00 C ATOM 626 CD2 PHE A 163 10.352 -1.952 4.078 1.00 0.00 C ATOM 627 CE1 PHE A 163 11.001 -4.392 5.298 1.00 0.00 C ATOM 628 CE2 PHE A 163 11.647 -2.163 4.555 1.00 0.00 C ATOM 629 CZ PHE A 163 11.975 -3.389 5.146 1.00 0.00 C ATOM 0 H PHE A 163 5.676 -2.685 2.341 1.00 0.00 H new ATOM 0 HA PHE A 163 8.466 -3.473 1.744 1.00 0.00 H new ATOM 0 HB2 PHE A 163 7.856 -1.630 3.592 1.00 0.00 H new ATOM 0 HB3 PHE A 163 7.286 -3.016 4.501 1.00 0.00 H new ATOM 0 HD1 PHE A 163 8.931 -4.923 4.973 1.00 0.00 H new ATOM 0 HD2 PHE A 163 10.100 -1.021 3.593 1.00 0.00 H new ATOM 0 HE1 PHE A 163 11.260 -5.333 5.761 1.00 0.00 H new ATOM 0 HE2 PHE A 163 12.391 -1.385 4.469 1.00 0.00 H new ATOM 0 HZ PHE A 163 12.984 -3.566 5.488 1.00 0.00 H new ATOM 639 N CYS A 164 5.955 -5.071 3.068 1.00 0.00 N ATOM 640 CA CYS A 164 5.437 -6.418 3.267 1.00 0.00 C ATOM 641 C CYS A 164 4.057 -6.600 2.619 1.00 0.00 C ATOM 642 O CYS A 164 3.445 -7.660 2.727 1.00 0.00 O ATOM 643 CB CYS A 164 5.364 -6.673 4.766 1.00 0.00 C ATOM 644 SG CYS A 164 4.062 -5.626 5.431 1.00 0.00 S ATOM 0 H CYS A 164 5.270 -4.332 3.224 1.00 0.00 H new ATOM 0 HA CYS A 164 6.102 -7.136 2.788 1.00 0.00 H new ATOM 0 HB2 CYS A 164 5.151 -7.723 4.966 1.00 0.00 H new ATOM 0 HB3 CYS A 164 6.319 -6.445 5.240 1.00 0.00 H new ATOM 649 N GLN A 165 3.580 -5.549 1.942 1.00 0.00 N ATOM 650 CA GLN A 165 2.287 -5.483 1.277 1.00 0.00 C ATOM 651 C GLN A 165 1.111 -5.749 2.221 1.00 0.00 C ATOM 652 O GLN A 165 0.042 -6.170 1.777 1.00 0.00 O ATOM 653 CB GLN A 165 2.255 -6.368 0.024 1.00 0.00 C ATOM 654 CG GLN A 165 3.178 -5.809 -1.060 1.00 0.00 C ATOM 655 CD GLN A 165 4.653 -5.920 -0.682 1.00 0.00 C ATOM 656 OE1 GLN A 165 5.218 -7.010 -0.664 1.00 0.00 O ATOM 657 NE2 GLN A 165 5.286 -4.792 -0.376 1.00 0.00 N ATOM 0 H GLN A 165 4.114 -4.686 1.842 1.00 0.00 H new ATOM 0 HA GLN A 165 2.158 -4.453 0.945 1.00 0.00 H new ATOM 0 HB2 GLN A 165 2.562 -7.382 0.282 1.00 0.00 H new ATOM 0 HB3 GLN A 165 1.236 -6.430 -0.357 1.00 0.00 H new ATOM 0 HG2 GLN A 165 3.004 -6.344 -1.993 1.00 0.00 H new ATOM 0 HG3 GLN A 165 2.930 -4.763 -1.241 1.00 0.00 H new ATOM 0 HE21 GLN A 165 4.786 -3.903 -0.401 1.00 0.00 H new ATOM 0 HE22 GLN A 165 6.272 -4.815 -0.116 1.00 0.00 H new ATOM 666 N SER A 166 1.299 -5.500 3.521 1.00 0.00 N ATOM 667 CA SER A 166 0.244 -5.645 4.507 1.00 0.00 C ATOM 668 C SER A 166 -0.539 -4.340 4.621 1.00 0.00 C ATOM 669 O SER A 166 -0.002 -3.351 5.106 1.00 0.00 O ATOM 670 CB SER A 166 0.872 -5.971 5.861 1.00 0.00 C ATOM 671 OG SER A 166 1.604 -7.177 5.781 1.00 0.00 O ATOM 0 H SER A 166 2.190 -5.193 3.911 1.00 0.00 H new ATOM 0 HA SER A 166 -0.431 -6.445 4.203 1.00 0.00 H new ATOM 0 HB2 SER A 166 1.529 -5.158 6.171 1.00 0.00 H new ATOM 0 HB3 SER A 166 0.094 -6.059 6.619 1.00 0.00 H new ATOM 0 HG SER A 166 2.451 -7.015 5.315 1.00 0.00 H new ATOM 677 N ILE A 167 -1.807 -4.342 4.186 1.00 0.00 N ATOM 678 CA ILE A 167 -2.716 -3.207 4.348 1.00 0.00 C ATOM 679 C ILE A 167 -2.964 -2.869 5.815 1.00 0.00 C ATOM 680 O ILE A 167 -3.379 -1.760 6.134 1.00 0.00 O ATOM 681 CB ILE A 167 -4.066 -3.515 3.696 1.00 0.00 C ATOM 682 CG1 ILE A 167 -4.679 -4.788 4.299 1.00 0.00 C ATOM 683 CG2 ILE A 167 -3.854 -3.671 2.197 1.00 0.00 C ATOM 684 CD1 ILE A 167 -5.715 -5.398 3.361 1.00 0.00 C ATOM 0 H ILE A 167 -2.230 -5.138 3.709 1.00 0.00 H new ATOM 0 HA ILE A 167 -2.238 -2.353 3.868 1.00 0.00 H new ATOM 0 HB ILE A 167 -4.763 -2.698 3.882 1.00 0.00 H new ATOM 0 HG12 ILE A 167 -3.892 -5.515 4.498 1.00 0.00 H new ATOM 0 HG13 ILE A 167 -5.145 -4.553 5.256 1.00 0.00 H new ATOM 0 HG21 ILE A 167 -4.807 -3.891 1.716 1.00 0.00 H new ATOM 0 HG22 ILE A 167 -3.446 -2.746 1.789 1.00 0.00 H new ATOM 0 HG23 ILE A 167 -3.157 -4.488 2.011 1.00 0.00 H new ATOM 0 HD11 ILE A 167 -6.132 -6.297 3.814 1.00 0.00 H new ATOM 0 HD12 ILE A 167 -6.514 -4.678 3.183 1.00 0.00 H new ATOM 0 HD13 ILE A 167 -5.241 -5.655 2.414 1.00 0.00 H new ATOM 696 N SER A 168 -2.707 -3.836 6.697 1.00 0.00 N ATOM 697 CA SER A 168 -2.801 -3.672 8.135 1.00 0.00 C ATOM 698 C SER A 168 -2.120 -2.374 8.565 1.00 0.00 C ATOM 699 O SER A 168 -2.694 -1.589 9.320 1.00 0.00 O ATOM 700 CB SER A 168 -2.208 -4.894 8.823 1.00 0.00 C ATOM 701 OG SER A 168 -2.330 -4.749 10.221 1.00 0.00 O ATOM 0 H SER A 168 -2.422 -4.774 6.417 1.00 0.00 H new ATOM 0 HA SER A 168 -3.846 -3.595 8.435 1.00 0.00 H new ATOM 0 HB2 SER A 168 -2.723 -5.796 8.493 1.00 0.00 H new ATOM 0 HB3 SER A 168 -1.159 -5.007 8.548 1.00 0.00 H new ATOM 0 HG SER A 168 -1.950 -5.535 10.666 1.00 0.00 H new ATOM 707 N HIS A 169 -0.898 -2.154 8.072 1.00 0.00 N ATOM 708 CA HIS A 169 -0.081 -1.002 8.402 1.00 0.00 C ATOM 709 C HIS A 169 0.513 -0.407 7.131 1.00 0.00 C ATOM 710 O HIS A 169 0.086 -0.722 6.020 1.00 0.00 O ATOM 711 CB HIS A 169 1.021 -1.437 9.374 1.00 0.00 C ATOM 712 CG HIS A 169 1.867 -2.572 8.842 1.00 0.00 C ATOM 713 ND1 HIS A 169 1.779 -3.892 9.214 1.00 0.00 N ATOM 714 CD2 HIS A 169 2.862 -2.490 7.911 1.00 0.00 C ATOM 715 CE1 HIS A 169 2.690 -4.583 8.511 1.00 0.00 C ATOM 716 NE2 HIS A 169 3.389 -3.765 7.704 1.00 0.00 N ATOM 0 H HIS A 169 -0.446 -2.792 7.417 1.00 0.00 H new ATOM 0 HA HIS A 169 -0.690 -0.234 8.879 1.00 0.00 H new ATOM 0 HB2 HIS A 169 1.663 -0.584 9.591 1.00 0.00 H new ATOM 0 HB3 HIS A 169 0.566 -1.742 10.317 1.00 0.00 H new ATOM 0 HD1 HIS A 169 1.134 -4.279 9.903 1.00 0.00 H new ATOM 0 HD2 HIS A 169 3.188 -1.587 7.416 1.00 0.00 H new ATOM 0 HE1 HIS A 169 2.841 -5.650 8.583 1.00 0.00 H new ATOM 724 N MET A 170 1.506 0.462 7.290 1.00 0.00 N ATOM 725 CA MET A 170 2.228 1.062 6.189 1.00 0.00 C ATOM 726 C MET A 170 3.706 0.779 6.396 1.00 0.00 C ATOM 727 O MET A 170 4.114 0.412 7.497 1.00 0.00 O ATOM 728 CB MET A 170 1.987 2.573 6.223 1.00 0.00 C ATOM 729 CG MET A 170 0.520 2.963 6.026 1.00 0.00 C ATOM 730 SD MET A 170 0.049 3.345 4.319 1.00 0.00 S ATOM 731 CE MET A 170 0.349 1.750 3.519 1.00 0.00 C ATOM 0 H MET A 170 1.832 0.770 8.206 1.00 0.00 H new ATOM 0 HA MET A 170 1.898 0.660 5.231 1.00 0.00 H new ATOM 0 HB2 MET A 170 2.334 2.967 7.178 1.00 0.00 H new ATOM 0 HB3 MET A 170 2.588 3.046 5.446 1.00 0.00 H new ATOM 0 HG2 MET A 170 -0.108 2.148 6.386 1.00 0.00 H new ATOM 0 HG3 MET A 170 0.304 3.831 6.649 1.00 0.00 H new ATOM 0 HE1 MET A 170 0.088 1.818 2.463 1.00 0.00 H new ATOM 0 HE2 MET A 170 1.402 1.487 3.616 1.00 0.00 H new ATOM 0 HE3 MET A 170 -0.262 0.983 3.995 1.00 0.00 H new ATOM 741 N VAL A 171 4.525 0.940 5.357 1.00 0.00 N ATOM 742 CA VAL A 171 5.971 0.819 5.516 1.00 0.00 C ATOM 743 C VAL A 171 6.444 1.788 6.583 1.00 0.00 C ATOM 744 O VAL A 171 7.492 1.604 7.188 1.00 0.00 O ATOM 745 CB VAL A 171 6.683 1.098 4.203 1.00 0.00 C ATOM 746 CG1 VAL A 171 6.633 2.586 3.899 1.00 0.00 C ATOM 747 CG2 VAL A 171 8.147 0.697 4.289 1.00 0.00 C ATOM 0 H VAL A 171 4.216 1.152 4.408 1.00 0.00 H new ATOM 0 HA VAL A 171 6.208 -0.201 5.820 1.00 0.00 H new ATOM 0 HB VAL A 171 6.184 0.523 3.423 1.00 0.00 H new ATOM 0 HG11 VAL A 171 7.145 2.782 2.957 1.00 0.00 H new ATOM 0 HG12 VAL A 171 5.594 2.907 3.822 1.00 0.00 H new ATOM 0 HG13 VAL A 171 7.124 3.138 4.700 1.00 0.00 H new ATOM 0 HG21 VAL A 171 8.638 0.905 3.338 1.00 0.00 H new ATOM 0 HG22 VAL A 171 8.634 1.266 5.081 1.00 0.00 H new ATOM 0 HG23 VAL A 171 8.220 -0.368 4.509 1.00 0.00 H new ATOM 757 N ALA A 172 5.643 2.830 6.803 1.00 0.00 N ATOM 758 CA ALA A 172 5.931 3.829 7.797 1.00 0.00 C ATOM 759 C ALA A 172 5.900 3.239 9.204 1.00 0.00 C ATOM 760 O ALA A 172 6.275 3.891 10.182 1.00 0.00 O ATOM 761 CB ALA A 172 4.887 4.927 7.670 1.00 0.00 C ATOM 0 H ALA A 172 4.777 2.993 6.289 1.00 0.00 H new ATOM 0 HA ALA A 172 6.933 4.226 7.634 1.00 0.00 H new ATOM 0 HB1 ALA A 172 5.080 5.701 8.413 1.00 0.00 H new ATOM 0 HB2 ALA A 172 4.936 5.362 6.672 1.00 0.00 H new ATOM 0 HB3 ALA A 172 3.895 4.506 7.834 1.00 0.00 H new ATOM 767 N SER A 173 5.447 1.990 9.295 1.00 0.00 N ATOM 768 CA SER A 173 5.298 1.275 10.550 1.00 0.00 C ATOM 769 C SER A 173 5.568 -0.212 10.364 1.00 0.00 C ATOM 770 O SER A 173 5.244 -1.001 11.247 1.00 0.00 O ATOM 771 CB SER A 173 3.871 1.475 11.044 1.00 0.00 C ATOM 772 OG SER A 173 3.814 1.357 12.449 1.00 0.00 O ATOM 0 H SER A 173 5.170 1.441 8.481 1.00 0.00 H new ATOM 0 HA SER A 173 6.016 1.661 11.274 1.00 0.00 H new ATOM 0 HB2 SER A 173 3.509 2.457 10.741 1.00 0.00 H new ATOM 0 HB3 SER A 173 3.214 0.737 10.584 1.00 0.00 H new ATOM 0 HG SER A 173 4.255 0.526 12.726 1.00 0.00 H new ATOM 778 N CYS A 174 6.150 -0.610 9.223 1.00 0.00 N ATOM 779 CA CYS A 174 6.342 -2.032 8.960 1.00 0.00 C ATOM 780 C CYS A 174 7.055 -2.699 10.138 1.00 0.00 C ATOM 781 O CYS A 174 8.081 -2.200 10.610 1.00 0.00 O ATOM 782 CB CYS A 174 7.098 -2.270 7.652 1.00 0.00 C ATOM 783 SG CYS A 174 6.866 -3.995 7.145 1.00 0.00 S ATOM 0 H CYS A 174 6.485 0.016 8.491 1.00 0.00 H new ATOM 0 HA CYS A 174 5.358 -2.487 8.847 1.00 0.00 H new ATOM 0 HB2 CYS A 174 6.732 -1.597 6.877 1.00 0.00 H new ATOM 0 HB3 CYS A 174 8.158 -2.056 7.785 1.00 0.00 H new ATOM 788 N PRO A 175 6.529 -3.826 10.632 1.00 0.00 N ATOM 789 CA PRO A 175 7.131 -4.564 11.728 1.00 0.00 C ATOM 790 C PRO A 175 8.401 -5.264 11.262 1.00 0.00 C ATOM 791 O PRO A 175 9.189 -5.731 12.084 1.00 0.00 O ATOM 792 CB PRO A 175 6.068 -5.582 12.143 1.00 0.00 C ATOM 793 CG PRO A 175 5.302 -5.834 10.850 1.00 0.00 C ATOM 794 CD PRO A 175 5.316 -4.474 10.174 1.00 0.00 C ATOM 0 HA PRO A 175 7.420 -3.917 12.556 1.00 0.00 H new ATOM 0 HB2 PRO A 175 6.516 -6.497 12.530 1.00 0.00 H new ATOM 0 HB3 PRO A 175 5.419 -5.190 12.926 1.00 0.00 H new ATOM 0 HG2 PRO A 175 5.785 -6.595 10.237 1.00 0.00 H new ATOM 0 HG3 PRO A 175 4.286 -6.178 11.043 1.00 0.00 H new ATOM 0 HD2 PRO A 175 5.311 -4.575 9.089 1.00 0.00 H new ATOM 0 HD3 PRO A 175 4.434 -3.892 10.444 1.00 0.00 H new ATOM 802 N LEU A 176 8.611 -5.343 9.945 1.00 0.00 N ATOM 803 CA LEU A 176 9.795 -5.991 9.408 1.00 0.00 C ATOM 804 C LEU A 176 10.954 -5.012 9.373 1.00 0.00 C ATOM 805 O LEU A 176 12.015 -5.289 9.917 1.00 0.00 O ATOM 806 CB LEU A 176 9.511 -6.479 7.991 1.00 0.00 C ATOM 807 CG LEU A 176 8.245 -7.326 7.918 1.00 0.00 C ATOM 808 CD1 LEU A 176 8.121 -7.837 6.490 1.00 0.00 C ATOM 809 CD2 LEU A 176 8.320 -8.511 8.866 1.00 0.00 C ATOM 0 H LEU A 176 7.977 -4.967 9.240 1.00 0.00 H new ATOM 0 HA LEU A 176 10.055 -6.836 10.046 1.00 0.00 H new ATOM 0 HB2 LEU A 176 9.411 -5.621 7.326 1.00 0.00 H new ATOM 0 HB3 LEU A 176 10.359 -7.063 7.633 1.00 0.00 H new ATOM 0 HG LEU A 176 7.384 -6.722 8.205 1.00 0.00 H new ATOM 0 HD11 LEU A 176 7.224 -8.449 6.399 1.00 0.00 H new ATOM 0 HD12 LEU A 176 8.054 -6.991 5.805 1.00 0.00 H new ATOM 0 HD13 LEU A 176 8.996 -8.437 6.241 1.00 0.00 H new ATOM 0 HD21 LEU A 176 7.403 -9.096 8.791 1.00 0.00 H new ATOM 0 HD22 LEU A 176 9.172 -9.137 8.600 1.00 0.00 H new ATOM 0 HD23 LEU A 176 8.439 -8.152 9.888 1.00 0.00 H new ATOM 821 N LYS A 177 10.762 -3.856 8.725 1.00 0.00 N ATOM 822 CA LYS A 177 11.846 -2.904 8.530 1.00 0.00 C ATOM 823 C LYS A 177 12.506 -2.513 9.842 1.00 0.00 C ATOM 824 O LYS A 177 13.651 -2.062 9.841 1.00 0.00 O ATOM 825 CB LYS A 177 11.330 -1.668 7.806 1.00 0.00 C ATOM 826 CG LYS A 177 10.552 -0.785 8.767 1.00 0.00 C ATOM 827 CD LYS A 177 10.066 0.481 8.062 1.00 0.00 C ATOM 828 CE LYS A 177 11.203 1.469 7.793 1.00 0.00 C ATOM 829 NZ LYS A 177 11.690 2.080 9.044 1.00 0.00 N ATOM 0 H LYS A 177 9.868 -3.564 8.331 1.00 0.00 H new ATOM 0 HA LYS A 177 12.606 -3.390 7.919 1.00 0.00 H new ATOM 0 HB2 LYS A 177 12.165 -1.110 7.383 1.00 0.00 H new ATOM 0 HB3 LYS A 177 10.691 -1.965 6.974 1.00 0.00 H new ATOM 0 HG2 LYS A 177 9.700 -1.335 9.166 1.00 0.00 H new ATOM 0 HG3 LYS A 177 11.183 -0.516 9.614 1.00 0.00 H new ATOM 0 HD2 LYS A 177 9.593 0.210 7.118 1.00 0.00 H new ATOM 0 HD3 LYS A 177 9.304 0.965 8.673 1.00 0.00 H new ATOM 0 HE2 LYS A 177 12.024 0.955 7.294 1.00 0.00 H new ATOM 0 HE3 LYS A 177 10.857 2.249 7.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 11.460 3.094 9.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 11.234 1.618 9.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 12.721 1.959 9.111 1.00 0.00 H new ATOM 843 N ALA A 178 11.790 -2.683 10.956 1.00 0.00 N ATOM 844 CA ALA A 178 12.299 -2.367 12.274 1.00 0.00 C ATOM 845 C ALA A 178 13.586 -3.130 12.574 1.00 0.00 C ATOM 846 O ALA A 178 14.331 -2.758 13.478 1.00 0.00 O ATOM 847 CB ALA A 178 11.230 -2.740 13.294 1.00 0.00 C ATOM 0 H ALA A 178 10.837 -3.046 10.959 1.00 0.00 H new ATOM 0 HA ALA A 178 12.531 -1.303 12.323 1.00 0.00 H new ATOM 0 HB1 ALA A 178 11.589 -2.511 14.297 1.00 0.00 H new ATOM 0 HB2 ALA A 178 10.322 -2.170 13.095 1.00 0.00 H new ATOM 0 HB3 ALA A 178 11.013 -3.806 13.220 1.00 0.00 H new ATOM 853 N GLN A 179 13.844 -4.197 11.817 1.00 0.00 N ATOM 854 CA GLN A 179 15.027 -5.028 11.960 1.00 0.00 C ATOM 855 C GLN A 179 15.546 -5.472 10.590 1.00 0.00 C ATOM 856 O GLN A 179 16.304 -6.434 10.493 1.00 0.00 O ATOM 857 CB GLN A 179 14.728 -6.190 12.920 1.00 0.00 C ATOM 858 CG GLN A 179 13.390 -6.901 12.684 1.00 0.00 C ATOM 859 CD GLN A 179 13.398 -7.872 11.511 1.00 0.00 C ATOM 860 OE1 GLN A 179 14.444 -8.339 11.073 1.00 0.00 O ATOM 861 NE2 GLN A 179 12.217 -8.185 10.989 1.00 0.00 N ATOM 0 H GLN A 179 13.220 -4.509 11.073 1.00 0.00 H new ATOM 0 HA GLN A 179 15.839 -4.453 12.407 1.00 0.00 H new ATOM 0 HB2 GLN A 179 15.531 -6.923 12.839 1.00 0.00 H new ATOM 0 HB3 GLN A 179 14.745 -5.810 13.942 1.00 0.00 H new ATOM 0 HG2 GLN A 179 13.115 -7.444 13.589 1.00 0.00 H new ATOM 0 HG3 GLN A 179 12.617 -6.151 12.515 1.00 0.00 H new ATOM 0 HE21 GLN A 179 11.365 -7.780 11.376 1.00 0.00 H new ATOM 0 HE22 GLN A 179 12.163 -8.831 10.201 1.00 0.00 H new ATOM 870 N GLN A 180 15.135 -4.767 9.531 1.00 0.00 N ATOM 871 CA GLN A 180 15.594 -5.040 8.171 1.00 0.00 C ATOM 872 C GLN A 180 16.193 -3.794 7.528 1.00 0.00 C ATOM 873 O GLN A 180 16.996 -3.903 6.602 1.00 0.00 O ATOM 874 CB GLN A 180 14.413 -5.489 7.305 1.00 0.00 C ATOM 875 CG GLN A 180 13.584 -6.606 7.916 1.00 0.00 C ATOM 876 CD GLN A 180 14.029 -7.976 7.420 1.00 0.00 C ATOM 877 OE1 GLN A 180 14.088 -8.225 6.217 1.00 0.00 O ATOM 878 NE2 GLN A 180 14.347 -8.878 8.333 1.00 0.00 N ATOM 0 H GLN A 180 14.475 -3.992 9.596 1.00 0.00 H new ATOM 0 HA GLN A 180 16.353 -5.820 8.233 1.00 0.00 H new ATOM 0 HB2 GLN A 180 13.766 -4.632 7.119 1.00 0.00 H new ATOM 0 HB3 GLN A 180 14.791 -5.819 6.337 1.00 0.00 H new ATOM 0 HG2 GLN A 180 13.667 -6.568 9.002 1.00 0.00 H new ATOM 0 HG3 GLN A 180 12.533 -6.454 7.671 1.00 0.00 H new ATOM 0 HE21 GLN A 180 14.289 -8.643 9.324 1.00 0.00 H new ATOM 0 HE22 GLN A 180 14.651 -9.809 8.046 1.00 0.00 H new ATOM 887 N GLY A 181 15.808 -2.612 8.016 1.00 0.00 N ATOM 888 CA GLY A 181 16.308 -1.344 7.503 1.00 0.00 C ATOM 889 C GLY A 181 15.732 -0.158 8.278 1.00 0.00 C ATOM 890 O GLY A 181 15.128 0.733 7.677 1.00 0.00 O ATOM 0 H GLY A 181 15.139 -2.512 8.780 1.00 0.00 H new ATOM 0 HA2 GLY A 181 17.396 -1.328 7.568 1.00 0.00 H new ATOM 0 HA3 GLY A 181 16.050 -1.250 6.448 1.00 0.00 H new ATOM 894 N PRO A 182 15.906 -0.134 9.607 1.00 0.00 N ATOM 895 CA PRO A 182 15.339 0.888 10.475 1.00 0.00 C ATOM 896 C PRO A 182 15.987 2.259 10.278 1.00 0.00 C ATOM 897 O PRO A 182 15.476 3.247 10.805 1.00 0.00 O ATOM 898 CB PRO A 182 15.576 0.373 11.894 1.00 0.00 C ATOM 899 CG PRO A 182 16.835 -0.478 11.757 1.00 0.00 C ATOM 900 CD PRO A 182 16.671 -1.103 10.375 1.00 0.00 C ATOM 0 HA PRO A 182 14.283 1.043 10.253 1.00 0.00 H new ATOM 0 HB2 PRO A 182 15.719 1.191 12.600 1.00 0.00 H new ATOM 0 HB3 PRO A 182 14.731 -0.214 12.254 1.00 0.00 H new ATOM 0 HG2 PRO A 182 17.740 0.125 11.823 1.00 0.00 H new ATOM 0 HG3 PRO A 182 16.899 -1.235 12.539 1.00 0.00 H new ATOM 0 HD2 PRO A 182 17.639 -1.296 9.913 1.00 0.00 H new ATOM 0 HD3 PRO A 182 16.150 -2.058 10.434 1.00 0.00 H new ATOM 908 N SER A 183 17.092 2.326 9.526 1.00 0.00 N ATOM 909 CA SER A 183 17.818 3.558 9.228 1.00 0.00 C ATOM 910 C SER A 183 18.128 4.391 10.479 1.00 0.00 C ATOM 911 O SER A 183 17.964 3.926 11.608 1.00 0.00 O ATOM 912 CB SER A 183 17.028 4.345 8.178 1.00 0.00 C ATOM 913 OG SER A 183 17.774 5.442 7.693 1.00 0.00 O ATOM 0 H SER A 183 17.514 1.501 9.099 1.00 0.00 H new ATOM 0 HA SER A 183 18.797 3.300 8.825 1.00 0.00 H new ATOM 0 HB2 SER A 183 16.763 3.687 7.350 1.00 0.00 H new ATOM 0 HB3 SER A 183 16.094 4.701 8.613 1.00 0.00 H new ATOM 0 HG SER A 183 17.247 5.926 7.023 1.00 0.00 H new ATOM 919 N ALA A 184 18.583 5.627 10.271 1.00 0.00 N ATOM 920 CA ALA A 184 18.895 6.566 11.341 1.00 0.00 C ATOM 921 C ALA A 184 18.664 8.005 10.878 1.00 0.00 C ATOM 922 O ALA A 184 19.114 8.941 11.535 1.00 0.00 O ATOM 923 CB ALA A 184 20.345 6.359 11.772 1.00 0.00 C ATOM 0 H ALA A 184 18.747 6.007 9.339 1.00 0.00 H new ATOM 0 HA ALA A 184 18.237 6.385 12.191 1.00 0.00 H new ATOM 0 HB1 ALA A 184 20.590 7.057 12.573 1.00 0.00 H new ATOM 0 HB2 ALA A 184 20.476 5.337 12.128 1.00 0.00 H new ATOM 0 HB3 ALA A 184 21.006 6.535 10.923 1.00 0.00 H new ATOM 929 N GLN A 185 17.970 8.189 9.751 1.00 0.00 N ATOM 930 CA GLN A 185 17.700 9.510 9.209 1.00 0.00 C ATOM 931 C GLN A 185 16.359 9.518 8.481 1.00 0.00 C ATOM 932 O GLN A 185 15.933 8.496 7.945 1.00 0.00 O ATOM 933 CB GLN A 185 18.845 9.883 8.266 1.00 0.00 C ATOM 934 CG GLN A 185 18.709 11.319 7.753 1.00 0.00 C ATOM 935 CD GLN A 185 19.871 11.724 6.858 1.00 0.00 C ATOM 936 OE1 GLN A 185 20.859 11.002 6.725 1.00 0.00 O ATOM 937 NE2 GLN A 185 19.771 12.888 6.227 1.00 0.00 N ATOM 0 H GLN A 185 17.584 7.425 9.196 1.00 0.00 H new ATOM 0 HA GLN A 185 17.638 10.245 10.012 1.00 0.00 H new ATOM 0 HB2 GLN A 185 19.796 9.771 8.786 1.00 0.00 H new ATOM 0 HB3 GLN A 185 18.860 9.194 7.421 1.00 0.00 H new ATOM 0 HG2 GLN A 185 17.775 11.418 7.200 1.00 0.00 H new ATOM 0 HG3 GLN A 185 18.651 12.002 8.601 1.00 0.00 H new ATOM 0 HE21 GLN A 185 18.941 13.468 6.354 1.00 0.00 H new ATOM 0 HE22 GLN A 185 20.524 13.203 5.615 1.00 0.00 H new ATOM 946 N GLY A 186 15.687 10.672 8.455 1.00 0.00 N ATOM 947 CA GLY A 186 14.395 10.826 7.800 1.00 0.00 C ATOM 948 C GLY A 186 13.985 12.289 7.759 1.00 0.00 C ATOM 949 O GLY A 186 14.848 13.114 7.386 1.00 0.00 O ATOM 950 OXT GLY A 186 12.817 12.568 8.102 1.00 0.00 O ATOM 0 H GLY A 186 16.030 11.528 8.892 1.00 0.00 H new ATOM 0 HA2 GLY A 186 14.446 10.429 6.786 1.00 0.00 H new ATOM 0 HA3 GLY A 186 13.641 10.246 8.332 1.00 0.00 H new TER 954 GLY A 186 ATOM 955 O5' A B 1 11.423 7.502 6.483 1.00 0.00 O ATOM 956 C5' A B 1 10.161 6.898 6.704 1.00 0.00 C ATOM 957 C4' A B 1 9.122 7.446 5.729 1.00 0.00 C ATOM 958 O4' A B 1 9.478 7.031 4.412 1.00 0.00 O ATOM 959 C3' A B 1 7.755 6.846 6.085 1.00 0.00 C ATOM 960 O3' A B 1 6.678 7.781 6.129 1.00 0.00 O ATOM 961 C2' A B 1 7.608 5.758 5.037 1.00 0.00 C ATOM 962 O2' A B 1 6.272 5.557 4.668 1.00 0.00 O ATOM 963 C1' A B 1 8.393 6.302 3.871 1.00 0.00 C ATOM 964 N9 A B 1 8.784 5.239 2.928 1.00 0.00 N ATOM 965 C8 A B 1 8.326 5.077 1.644 1.00 0.00 C ATOM 966 N7 A B 1 8.770 4.005 1.051 1.00 0.00 N ATOM 967 C5 A B 1 9.571 3.402 2.021 1.00 0.00 C ATOM 968 C6 A B 1 10.315 2.206 2.039 1.00 0.00 C ATOM 969 N6 A B 1 10.368 1.344 1.020 1.00 0.00 N ATOM 970 N1 A B 1 11.002 1.898 3.146 1.00 0.00 N ATOM 971 C2 A B 1 10.934 2.712 4.185 1.00 0.00 C ATOM 972 N3 A B 1 10.262 3.852 4.311 1.00 0.00 N ATOM 973 C4 A B 1 9.588 4.149 3.170 1.00 0.00 C ATOM 0 H5' A B 1 9.838 7.083 7.729 1.00 0.00 H new ATOM 0 H5'' A B 1 10.244 5.818 6.586 1.00 0.00 H new ATOM 0 H4' A B 1 9.081 8.534 5.784 1.00 0.00 H new ATOM 0 H3' A B 1 7.710 6.469 7.107 1.00 0.00 H new ATOM 0 H2' A B 1 7.957 4.790 5.396 1.00 0.00 H new ATOM 0 HO2' A B 1 5.889 6.402 4.352 1.00 0.00 H new ATOM 0 HO5' A B 1 12.075 7.139 7.118 1.00 0.00 H new ATOM 0 H1' A B 1 7.788 6.972 3.261 1.00 0.00 H new ATOM 0 H8 A B 1 7.656 5.777 1.167 1.00 0.00 H new ATOM 0 H61 A B 1 10.927 0.495 1.099 1.00 0.00 H new ATOM 0 H62 A B 1 9.849 1.535 0.163 1.00 0.00 H new ATOM 0 H2 A B 1 11.503 2.409 5.051 1.00 0.00 H new ATOM 986 P G B 2 6.438 8.997 5.080 1.00 0.00 P ATOM 987 OP1 G B 2 7.505 9.024 4.066 1.00 0.00 O ATOM 988 OP2 G B 2 6.199 10.209 5.894 1.00 0.00 O ATOM 989 O5' G B 2 5.046 8.642 4.346 1.00 0.00 O ATOM 990 C5' G B 2 4.452 9.591 3.478 1.00 0.00 C ATOM 991 C4' G B 2 3.011 9.248 3.081 1.00 0.00 C ATOM 992 O4' G B 2 2.952 8.149 2.189 1.00 0.00 O ATOM 993 C3' G B 2 2.131 8.952 4.303 1.00 0.00 C ATOM 994 O3' G B 2 1.258 10.005 4.707 1.00 0.00 O ATOM 995 C2' G B 2 1.348 7.694 3.926 1.00 0.00 C ATOM 996 O2' G B 2 -0.020 7.943 3.676 1.00 0.00 O ATOM 997 C1' G B 2 2.017 7.189 2.649 1.00 0.00 C ATOM 998 N9 G B 2 2.712 5.925 2.923 1.00 0.00 N ATOM 999 C8 G B 2 3.587 5.619 3.937 1.00 0.00 C ATOM 1000 N7 G B 2 3.935 4.369 3.954 1.00 0.00 N ATOM 1001 C5 G B 2 3.324 3.824 2.839 1.00 0.00 C ATOM 1002 C6 G B 2 3.399 2.503 2.320 1.00 0.00 C ATOM 1003 O6 G B 2 4.011 1.538 2.762 1.00 0.00 O ATOM 1004 N1 G B 2 2.667 2.349 1.166 1.00 0.00 N ATOM 1005 C2 G B 2 1.933 3.353 0.573 1.00 0.00 C ATOM 1006 N2 G B 2 1.289 3.030 -0.542 1.00 0.00 N ATOM 1007 N3 G B 2 1.851 4.600 1.052 1.00 0.00 N ATOM 1008 C4 G B 2 2.581 4.770 2.187 1.00 0.00 C ATOM 0 H5' G B 2 5.058 9.674 2.576 1.00 0.00 H new ATOM 0 H5'' G B 2 4.463 10.568 3.960 1.00 0.00 H new ATOM 0 H4' G B 2 2.625 10.133 2.575 1.00 0.00 H new ATOM 0 H3' G B 2 2.767 8.827 5.180 1.00 0.00 H new ATOM 0 H2' G B 2 1.368 6.978 4.747 1.00 0.00 H new ATOM 0 HO2' G B 2 -0.107 8.585 2.941 1.00 0.00 H new ATOM 0 H1' G B 2 1.256 7.028 1.885 1.00 0.00 H new ATOM 0 H8 G B 2 3.949 6.346 4.649 1.00 0.00 H new ATOM 0 H1 G B 2 2.667 1.432 0.720 1.00 0.00 H new ATOM 0 H21 G B 2 0.728 3.730 -1.028 1.00 0.00 H new ATOM 0 H22 G B 2 1.355 2.082 -0.913 1.00 0.00 H new ATOM 1020 P G B 3 0.557 11.036 3.676 1.00 0.00 P ATOM 1021 OP1 G B 3 1.572 12.029 3.256 1.00 0.00 O ATOM 1022 OP2 G B 3 -0.709 11.501 4.285 1.00 0.00 O ATOM 1023 O5' G B 3 0.206 10.115 2.407 1.00 0.00 O ATOM 1024 C5' G B 3 -0.332 10.666 1.225 1.00 0.00 C ATOM 1025 C4' G B 3 0.117 9.800 0.049 1.00 0.00 C ATOM 1026 O4' G B 3 -0.604 8.574 0.007 1.00 0.00 O ATOM 1027 C3' G B 3 -0.111 10.525 -1.275 1.00 0.00 C ATOM 1028 O3' G B 3 1.098 10.451 -2.006 1.00 0.00 O ATOM 1029 C2' G B 3 -1.188 9.687 -1.951 1.00 0.00 C ATOM 1030 O2' G B 3 -1.051 9.681 -3.355 1.00 0.00 O ATOM 1031 C1' G B 3 -0.910 8.324 -1.348 1.00 0.00 C ATOM 1032 N9 G B 3 -2.049 7.404 -1.531 1.00 0.00 N ATOM 1033 C8 G B 3 -2.063 6.230 -2.232 1.00 0.00 C ATOM 1034 N7 G B 3 -3.228 5.650 -2.278 1.00 0.00 N ATOM 1035 C5 G B 3 -4.052 6.497 -1.544 1.00 0.00 C ATOM 1036 C6 G B 3 -5.442 6.382 -1.227 1.00 0.00 C ATOM 1037 O6 G B 3 -6.232 5.494 -1.548 1.00 0.00 O ATOM 1038 N1 G B 3 -5.884 7.443 -0.454 1.00 0.00 N ATOM 1039 C2 G B 3 -5.095 8.485 -0.032 1.00 0.00 C ATOM 1040 N2 G B 3 -5.686 9.409 0.721 1.00 0.00 N ATOM 1041 N3 G B 3 -3.801 8.607 -0.327 1.00 0.00 N ATOM 1042 C4 G B 3 -3.341 7.581 -1.087 1.00 0.00 C ATOM 0 H5' G B 3 0.010 11.693 1.094 1.00 0.00 H new ATOM 0 H5'' G B 3 -1.420 10.697 1.281 1.00 0.00 H new ATOM 0 H4' G B 3 1.179 9.599 0.191 1.00 0.00 H new ATOM 0 H3' G B 3 -0.399 11.572 -1.184 1.00 0.00 H new ATOM 0 H2' G B 3 -2.204 10.050 -1.793 1.00 0.00 H new ATOM 0 HO2' G B 3 -1.872 10.025 -3.765 1.00 0.00 H new ATOM 0 H1' G B 3 -0.081 7.816 -1.840 1.00 0.00 H new ATOM 0 H8 G B 3 -1.184 5.819 -2.706 1.00 0.00 H new ATOM 0 H1 G B 3 -6.866 7.451 -0.178 1.00 0.00 H new ATOM 0 H21 G B 3 -5.150 10.206 1.064 1.00 0.00 H new ATOM 0 H22 G B 3 -6.675 9.320 0.955 1.00 0.00 H new ATOM 1054 P A B 4 1.661 11.727 -2.798 1.00 0.00 P ATOM 1055 OP1 A B 4 3.119 11.552 -2.938 1.00 0.00 O ATOM 1056 OP2 A B 4 1.140 12.947 -2.147 1.00 0.00 O ATOM 1057 O5' A B 4 1.021 11.613 -4.264 1.00 0.00 O ATOM 1058 C5' A B 4 -0.109 12.367 -4.637 1.00 0.00 C ATOM 1059 C4' A B 4 -0.395 12.112 -6.119 1.00 0.00 C ATOM 1060 O4' A B 4 -1.190 10.945 -6.281 1.00 0.00 O ATOM 1061 C3' A B 4 -1.189 13.268 -6.728 1.00 0.00 C ATOM 1062 O3' A B 4 -0.894 13.332 -8.109 1.00 0.00 O ATOM 1063 C2' A B 4 -2.627 12.841 -6.486 1.00 0.00 C ATOM 1064 O2' A B 4 -3.517 13.357 -7.459 1.00 0.00 O ATOM 1065 C1' A B 4 -2.532 11.317 -6.539 1.00 0.00 C ATOM 1066 N9 A B 4 -3.476 10.724 -5.574 1.00 0.00 N ATOM 1067 C8 A B 4 -3.580 10.947 -4.225 1.00 0.00 C ATOM 1068 N7 A B 4 -4.562 10.305 -3.653 1.00 0.00 N ATOM 1069 C5 A B 4 -5.151 9.601 -4.706 1.00 0.00 C ATOM 1070 C6 A B 4 -6.256 8.737 -4.792 1.00 0.00 C ATOM 1071 N6 A B 4 -7.014 8.400 -3.744 1.00 0.00 N ATOM 1072 N1 A B 4 -6.570 8.217 -5.988 1.00 0.00 N ATOM 1073 C2 A B 4 -5.831 8.543 -7.039 1.00 0.00 C ATOM 1074 N3 A B 4 -4.772 9.335 -7.098 1.00 0.00 N ATOM 1075 C4 A B 4 -4.478 9.838 -5.875 1.00 0.00 C ATOM 0 H5' A B 4 0.069 13.428 -4.463 1.00 0.00 H new ATOM 0 H5'' A B 4 -0.970 12.085 -4.031 1.00 0.00 H new ATOM 0 H4' A B 4 0.571 12.002 -6.613 1.00 0.00 H new ATOM 0 H3' A B 4 -0.972 14.252 -6.312 1.00 0.00 H new ATOM 0 H2' A B 4 -3.032 13.216 -5.546 1.00 0.00 H new ATOM 0 HO2' A B 4 -4.428 13.054 -7.262 1.00 0.00 H new ATOM 0 H1' A B 4 -2.809 10.941 -7.524 1.00 0.00 H new ATOM 0 H8 A B 4 -2.908 11.597 -3.683 1.00 0.00 H new ATOM 0 H61 A B 4 -7.804 7.767 -3.869 1.00 0.00 H new ATOM 0 H62 A B 4 -6.802 8.775 -2.820 1.00 0.00 H new ATOM 0 H2 A B 4 -6.135 8.101 -7.977 1.00 0.00 H new ATOM 1087 P G B 5 -0.862 14.736 -8.895 1.00 0.00 P ATOM 1088 OP1 G B 5 -0.695 15.834 -7.917 1.00 0.00 O ATOM 1089 OP2 G B 5 -1.993 14.768 -9.850 1.00 0.00 O ATOM 1090 O5' G B 5 0.502 14.584 -9.719 1.00 0.00 O ATOM 1091 C5' G B 5 1.738 14.901 -9.112 1.00 0.00 C ATOM 1092 C4' G B 5 2.862 14.034 -9.678 1.00 0.00 C ATOM 1093 O4' G B 5 2.686 12.725 -9.159 1.00 0.00 O ATOM 1094 C3' G B 5 2.833 13.948 -11.207 1.00 0.00 C ATOM 1095 O3' G B 5 4.129 13.788 -11.745 1.00 0.00 O ATOM 1096 C2' G B 5 2.069 12.652 -11.423 1.00 0.00 C ATOM 1097 O2' G B 5 2.406 12.053 -12.653 1.00 0.00 O ATOM 1098 C1' G B 5 2.529 11.820 -10.230 1.00 0.00 C ATOM 1099 N9 G B 5 1.534 10.786 -9.898 1.00 0.00 N ATOM 1100 C8 G B 5 0.176 10.909 -9.802 1.00 0.00 C ATOM 1101 N7 G B 5 -0.446 9.794 -9.516 1.00 0.00 N ATOM 1102 C5 G B 5 0.586 8.862 -9.408 1.00 0.00 C ATOM 1103 C6 G B 5 0.539 7.468 -9.109 1.00 0.00 C ATOM 1104 O6 G B 5 -0.447 6.760 -8.896 1.00 0.00 O ATOM 1105 N1 G B 5 1.802 6.905 -9.068 1.00 0.00 N ATOM 1106 C2 G B 5 2.964 7.577 -9.364 1.00 0.00 C ATOM 1107 N2 G B 5 4.081 6.857 -9.351 1.00 0.00 N ATOM 1108 N3 G B 5 3.022 8.876 -9.662 1.00 0.00 N ATOM 1109 C4 G B 5 1.797 9.460 -9.655 1.00 0.00 C ATOM 0 H5' G B 5 1.667 14.753 -8.034 1.00 0.00 H new ATOM 0 H5'' G B 5 1.968 15.954 -9.275 1.00 0.00 H new ATOM 0 H4' G B 5 3.815 14.480 -9.394 1.00 0.00 H new ATOM 0 H3' G B 5 2.409 14.838 -11.672 1.00 0.00 H new ATOM 0 H2' G B 5 0.987 12.774 -11.476 1.00 0.00 H new ATOM 0 HO2' G B 5 3.248 12.432 -12.982 1.00 0.00 H new ATOM 0 H1' G B 5 3.461 11.298 -10.448 1.00 0.00 H new ATOM 0 H8 G B 5 -0.339 11.846 -9.950 1.00 0.00 H new ATOM 0 H1 G B 5 1.876 5.924 -8.800 1.00 0.00 H new ATOM 0 H21 G B 5 4.975 7.299 -9.563 1.00 0.00 H new ATOM 0 H22 G B 5 4.044 5.862 -9.129 1.00 0.00 H new ATOM 1121 P A B 6 5.183 15.001 -11.789 1.00 0.00 P ATOM 1122 OP1 A B 6 4.434 16.266 -11.969 1.00 0.00 O ATOM 1123 OP2 A B 6 6.254 14.640 -12.747 1.00 0.00 O ATOM 1124 O5' A B 6 5.800 14.968 -10.313 1.00 0.00 O ATOM 1125 C5' A B 6 6.070 16.158 -9.601 1.00 0.00 C ATOM 1126 C4' A B 6 6.348 15.778 -8.148 1.00 0.00 C ATOM 1127 O4' A B 6 7.553 15.030 -8.084 1.00 0.00 O ATOM 1128 C3' A B 6 6.527 17.000 -7.256 1.00 0.00 C ATOM 1129 O3' A B 6 6.085 16.632 -5.963 1.00 0.00 O ATOM 1130 C2' A B 6 8.039 17.170 -7.318 1.00 0.00 C ATOM 1131 O2' A B 6 8.552 17.975 -6.279 1.00 0.00 O ATOM 1132 C1' A B 6 8.454 15.710 -7.232 1.00 0.00 C ATOM 1133 N9 A B 6 9.862 15.502 -7.611 1.00 0.00 N ATOM 1134 C8 A B 6 10.871 16.426 -7.646 1.00 0.00 C ATOM 1135 N7 A B 6 12.026 15.945 -8.009 1.00 0.00 N ATOM 1136 C5 A B 6 11.767 14.590 -8.218 1.00 0.00 C ATOM 1137 C6 A B 6 12.570 13.505 -8.614 1.00 0.00 C ATOM 1138 N6 A B 6 13.877 13.608 -8.865 1.00 0.00 N ATOM 1139 N1 A B 6 11.996 12.304 -8.739 1.00 0.00 N ATOM 1140 C2 A B 6 10.706 12.180 -8.471 1.00 0.00 C ATOM 1141 N3 A B 6 9.842 13.109 -8.083 1.00 0.00 N ATOM 1142 C4 A B 6 10.448 14.314 -7.980 1.00 0.00 C ATOM 0 H5' A B 6 5.222 16.841 -9.662 1.00 0.00 H new ATOM 0 H5'' A B 6 6.927 16.675 -10.032 1.00 0.00 H new ATOM 0 H4' A B 6 5.490 15.205 -7.797 1.00 0.00 H new ATOM 0 H3' A B 6 5.989 17.908 -7.530 1.00 0.00 H new ATOM 0 H2' A B 6 8.414 17.698 -8.195 1.00 0.00 H new ATOM 0 HO2' A B 6 9.007 17.409 -5.621 1.00 0.00 H new ATOM 0 H1' A B 6 8.403 15.333 -6.211 1.00 0.00 H new ATOM 0 H8 A B 6 10.722 17.466 -7.394 1.00 0.00 H new ATOM 0 H61 A B 6 14.408 12.785 -9.149 1.00 0.00 H new ATOM 0 H62 A B 6 14.344 14.510 -8.773 1.00 0.00 H new ATOM 0 H2 A B 6 10.301 11.185 -8.584 1.00 0.00 H new ATOM 1154 P U B 7 5.651 17.720 -4.874 1.00 0.00 P ATOM 1155 OP1 U B 7 4.537 18.504 -5.449 1.00 0.00 O ATOM 1156 OP2 U B 7 6.864 18.415 -4.395 1.00 0.00 O ATOM 1157 O5' U B 7 5.052 16.850 -3.658 1.00 0.00 O ATOM 1158 C5' U B 7 5.884 16.214 -2.704 1.00 0.00 C ATOM 1159 C4' U B 7 6.515 14.934 -3.263 1.00 0.00 C ATOM 1160 O4' U B 7 7.582 15.239 -4.153 1.00 0.00 O ATOM 1161 C3' U B 7 7.143 14.132 -2.126 1.00 0.00 C ATOM 1162 O3' U B 7 7.169 12.772 -2.496 1.00 0.00 O ATOM 1163 C2' U B 7 8.551 14.711 -2.084 1.00 0.00 C ATOM 1164 O2' U B 7 9.460 13.846 -1.441 1.00 0.00 O ATOM 1165 C1' U B 7 8.815 14.846 -3.581 1.00 0.00 C ATOM 1166 N1 U B 7 9.880 15.826 -3.867 1.00 0.00 N ATOM 1167 C2 U B 7 11.073 15.343 -4.381 1.00 0.00 C ATOM 1168 O2 U B 7 11.261 14.149 -4.612 1.00 0.00 O ATOM 1169 N3 U B 7 12.058 16.286 -4.626 1.00 0.00 N ATOM 1170 C4 U B 7 11.950 17.644 -4.413 1.00 0.00 C ATOM 1171 O4 U B 7 12.891 18.394 -4.668 1.00 0.00 O ATOM 1172 C5 U B 7 10.674 18.065 -3.888 1.00 0.00 C ATOM 1173 C6 U B 7 9.694 17.162 -3.636 1.00 0.00 C ATOM 0 H5' U B 7 5.300 15.973 -1.815 1.00 0.00 H new ATOM 0 H5'' U B 7 6.671 16.901 -2.392 1.00 0.00 H new ATOM 0 H4' U B 7 5.725 14.382 -3.773 1.00 0.00 H new ATOM 0 H3' U B 7 6.624 14.190 -1.169 1.00 0.00 H new ATOM 0 H2' U B 7 8.660 15.637 -1.519 1.00 0.00 H new ATOM 0 HO2' U B 7 9.147 12.921 -1.526 1.00 0.00 H new ATOM 0 HO3' U B 7 6.256 12.417 -2.502 1.00 0.00 H new ATOM 0 H1' U B 7 9.170 13.906 -4.003 1.00 0.00 H new ATOM 0 H3 U B 7 12.944 15.944 -4.998 1.00 0.00 H new ATOM 0 H5 U B 7 10.497 19.112 -3.693 1.00 0.00 H new ATOM 0 H6 U B 7 8.747 17.504 -3.245 1.00 0.00 H new TER 1185 U B 7 HETATM 1186 ZN ZN A 187 -3.177 0.678 -11.313 1.00 0.00 ZN HETATM 1187 ZN ZN A 188 4.933 -3.875 6.227 1.00 0.00 ZN