USER MOD reduce.3.24.130724 H: found=0, std=0, add=512, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 509 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 34 HIS HE2 : A 34 HIS NE2 : A 57 ZNZN :(H bumps) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 39:sc= 0.128 USER MOD Single : A 7 GLN : amide:sc= -2.83! C(o=-2.8!,f=-7.1!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= -0.378 K(o=-0.38,f=-2.9!) USER MOD Single : A 12 GLN : amide:sc= -0.32 K(o=-0.32,f=-2.8!) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc=-0.00936 X(o=-0.0094,f=0) USER MOD Single : A 25 GLN : amide:sc= -2.01 X(o=-2,f=-1.8!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 160:sc= -0.062 (180deg=-0.694) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 136:sc= 0.561 (180deg=-0.515) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : B 493 A O2' : rot -25:sc= 0.421 USER MOD Single : B 494 A O2' : rot -160:sc= -1.49 USER MOD Single : B 495 C O2' : rot -42:sc= 0.478 USER MOD Single : B 496 A O2' : rot -29:sc= 0.398 USER MOD Single : B 497 G O2' : rot -27:sc= 0.246 USER MOD Single : B 498 U O2' : rot -31:sc= 0.438 USER MOD Single : B 498 U O3' : rot 180:sc= 0.25 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 13.076 -57.415 8.485 1.00 0.00 N ATOM 2 CA ALA A 1 13.431 -56.765 7.236 1.00 0.00 C ATOM 3 C ALA A 1 12.923 -55.322 7.253 1.00 0.00 C ATOM 4 O ALA A 1 11.715 -55.086 7.247 1.00 0.00 O ATOM 5 CB ALA A 1 12.866 -57.569 6.063 1.00 0.00 C ATOM 0 H1 ALA A 1 13.420 -58.396 8.476 1.00 0.00 H new ATOM 0 H2 ALA A 1 13.511 -56.903 9.279 1.00 0.00 H new ATOM 0 H3 ALA A 1 12.042 -57.412 8.596 1.00 0.00 H new ATOM 0 HA ALA A 1 14.514 -56.731 7.116 1.00 0.00 H new ATOM 0 HB1 ALA A 1 13.133 -57.081 5.125 1.00 0.00 H new ATOM 0 HB2 ALA A 1 13.282 -58.576 6.079 1.00 0.00 H new ATOM 0 HB3 ALA A 1 11.781 -57.623 6.148 1.00 0.00 H new ATOM 11 N THR A 2 13.868 -54.395 7.276 1.00 0.00 N ATOM 12 CA THR A 2 13.531 -52.982 7.294 1.00 0.00 C ATOM 13 C THR A 2 13.605 -52.397 5.882 1.00 0.00 C ATOM 14 O THR A 2 14.690 -52.262 5.318 1.00 0.00 O ATOM 15 CB THR A 2 14.462 -52.287 8.289 1.00 0.00 C ATOM 16 OG1 THR A 2 14.045 -50.925 8.262 1.00 0.00 O ATOM 17 CG2 THR A 2 15.912 -52.242 7.802 1.00 0.00 C ATOM 0 H THR A 2 14.868 -54.595 7.283 1.00 0.00 H new ATOM 0 HA THR A 2 12.504 -52.825 7.623 1.00 0.00 H new ATOM 0 HB THR A 2 14.417 -52.803 9.248 1.00 0.00 H new ATOM 0 HG1 THR A 2 14.596 -50.402 8.881 1.00 0.00 H new ATOM 0 HG21 THR A 2 16.530 -51.738 8.545 1.00 0.00 H new ATOM 0 HG22 THR A 2 16.278 -53.258 7.654 1.00 0.00 H new ATOM 0 HG23 THR A 2 15.962 -51.697 6.859 1.00 0.00 H new ATOM 25 N VAL A 3 12.437 -52.067 5.351 1.00 0.00 N ATOM 26 CA VAL A 3 12.356 -51.500 4.016 1.00 0.00 C ATOM 27 C VAL A 3 11.029 -50.753 3.863 1.00 0.00 C ATOM 28 O VAL A 3 10.036 -51.110 4.495 1.00 0.00 O ATOM 29 CB VAL A 3 12.549 -52.597 2.968 1.00 0.00 C ATOM 30 CG1 VAL A 3 11.307 -53.485 2.870 1.00 0.00 C ATOM 31 CG2 VAL A 3 12.905 -51.999 1.606 1.00 0.00 C ATOM 0 H VAL A 3 11.539 -52.181 5.821 1.00 0.00 H new ATOM 0 HA VAL A 3 13.156 -50.776 3.860 1.00 0.00 H new ATOM 0 HB VAL A 3 13.384 -53.222 3.287 1.00 0.00 H new ATOM 0 HG11 VAL A 3 11.470 -54.257 2.118 1.00 0.00 H new ATOM 0 HG12 VAL A 3 11.118 -53.954 3.836 1.00 0.00 H new ATOM 0 HG13 VAL A 3 10.447 -52.878 2.586 1.00 0.00 H new ATOM 0 HG21 VAL A 3 13.037 -52.801 0.880 1.00 0.00 H new ATOM 0 HG22 VAL A 3 12.102 -51.340 1.277 1.00 0.00 H new ATOM 0 HG23 VAL A 3 13.831 -51.430 1.689 1.00 0.00 H new ATOM 41 N VAL A 4 11.055 -49.732 3.019 1.00 0.00 N ATOM 42 CA VAL A 4 9.865 -48.934 2.775 1.00 0.00 C ATOM 43 C VAL A 4 9.372 -49.184 1.349 1.00 0.00 C ATOM 44 O VAL A 4 10.141 -49.080 0.395 1.00 0.00 O ATOM 45 CB VAL A 4 10.159 -47.459 3.056 1.00 0.00 C ATOM 46 CG1 VAL A 4 11.215 -46.917 2.089 1.00 0.00 C ATOM 47 CG2 VAL A 4 8.880 -46.622 2.994 1.00 0.00 C ATOM 0 H VAL A 4 11.880 -49.439 2.496 1.00 0.00 H new ATOM 0 HA VAL A 4 9.063 -49.227 3.452 1.00 0.00 H new ATOM 0 HB VAL A 4 10.559 -47.385 4.067 1.00 0.00 H new ATOM 0 HG11 VAL A 4 11.406 -45.867 2.310 1.00 0.00 H new ATOM 0 HG12 VAL A 4 12.138 -47.485 2.203 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.854 -47.013 1.065 1.00 0.00 H new ATOM 0 HG21 VAL A 4 9.118 -45.578 3.198 1.00 0.00 H new ATOM 0 HG22 VAL A 4 8.438 -46.706 2.001 1.00 0.00 H new ATOM 0 HG23 VAL A 4 8.172 -46.984 3.739 1.00 0.00 H new ATOM 57 N SER A 5 8.091 -49.509 1.249 1.00 0.00 N ATOM 58 CA SER A 5 7.486 -49.775 -0.046 1.00 0.00 C ATOM 59 C SER A 5 6.451 -48.696 -0.371 1.00 0.00 C ATOM 60 O SER A 5 5.510 -48.484 0.391 1.00 0.00 O ATOM 61 CB SER A 5 6.836 -51.160 -0.075 1.00 0.00 C ATOM 62 OG SER A 5 5.933 -51.350 1.011 1.00 0.00 O ATOM 0 H SER A 5 7.456 -49.594 2.043 1.00 0.00 H new ATOM 0 HA SER A 5 8.271 -49.756 -0.802 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.303 -51.290 -1.017 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.612 -51.925 -0.039 1.00 0.00 H new ATOM 0 HG SER A 5 5.440 -50.519 1.175 1.00 0.00 H new ATOM 68 N GLY A 6 6.661 -48.044 -1.504 1.00 0.00 N ATOM 69 CA GLY A 6 5.758 -46.992 -1.940 1.00 0.00 C ATOM 70 C GLY A 6 6.401 -45.614 -1.775 1.00 0.00 C ATOM 71 O GLY A 6 7.398 -45.471 -1.069 1.00 0.00 O ATOM 0 H GLY A 6 7.443 -48.223 -2.134 1.00 0.00 H new ATOM 0 HA2 GLY A 6 5.489 -47.149 -2.985 1.00 0.00 H new ATOM 0 HA3 GLY A 6 4.835 -47.038 -1.362 1.00 0.00 H new ATOM 75 N GLN A 7 5.803 -44.634 -2.437 1.00 0.00 N ATOM 76 CA GLN A 7 6.305 -43.271 -2.372 1.00 0.00 C ATOM 77 C GLN A 7 5.248 -42.344 -1.771 1.00 0.00 C ATOM 78 O GLN A 7 4.052 -42.534 -1.992 1.00 0.00 O ATOM 79 CB GLN A 7 6.741 -42.782 -3.755 1.00 0.00 C ATOM 80 CG GLN A 7 5.543 -42.667 -4.699 1.00 0.00 C ATOM 81 CD GLN A 7 4.844 -41.315 -4.535 1.00 0.00 C ATOM 82 OE1 GLN A 7 5.219 -40.488 -3.721 1.00 0.00 O ATOM 83 NE2 GLN A 7 3.808 -41.139 -5.350 1.00 0.00 N ATOM 0 H GLN A 7 4.976 -44.756 -3.021 1.00 0.00 H new ATOM 0 HA GLN A 7 7.182 -43.257 -1.724 1.00 0.00 H new ATOM 0 HB2 GLN A 7 7.231 -41.813 -3.664 1.00 0.00 H new ATOM 0 HB3 GLN A 7 7.474 -43.472 -4.174 1.00 0.00 H new ATOM 0 HG2 GLN A 7 5.875 -42.786 -5.730 1.00 0.00 H new ATOM 0 HG3 GLN A 7 4.837 -43.472 -4.497 1.00 0.00 H new ATOM 0 HE21 GLN A 7 3.547 -41.873 -6.009 1.00 0.00 H new ATOM 0 HE22 GLN A 7 3.274 -40.270 -5.316 1.00 0.00 H new ATOM 92 N LYS A 8 5.725 -41.362 -1.021 1.00 0.00 N ATOM 93 CA LYS A 8 4.836 -40.404 -0.386 1.00 0.00 C ATOM 94 C LYS A 8 4.965 -39.051 -1.089 1.00 0.00 C ATOM 95 O LYS A 8 4.001 -38.554 -1.669 1.00 0.00 O ATOM 96 CB LYS A 8 5.101 -40.344 1.119 1.00 0.00 C ATOM 97 CG LYS A 8 3.805 -40.103 1.895 1.00 0.00 C ATOM 98 CD LYS A 8 3.150 -41.428 2.293 1.00 0.00 C ATOM 99 CE LYS A 8 1.812 -41.189 2.994 1.00 0.00 C ATOM 100 NZ LYS A 8 0.843 -42.250 2.637 1.00 0.00 N ATOM 0 H LYS A 8 6.717 -41.209 -0.839 1.00 0.00 H new ATOM 0 HA LYS A 8 3.798 -40.719 -0.491 1.00 0.00 H new ATOM 0 HB2 LYS A 8 5.558 -41.277 1.449 1.00 0.00 H new ATOM 0 HB3 LYS A 8 5.812 -39.547 1.335 1.00 0.00 H new ATOM 0 HG2 LYS A 8 4.016 -39.515 2.788 1.00 0.00 H new ATOM 0 HG3 LYS A 8 3.115 -39.521 1.285 1.00 0.00 H new ATOM 0 HD2 LYS A 8 2.995 -42.042 1.406 1.00 0.00 H new ATOM 0 HD3 LYS A 8 3.816 -41.983 2.953 1.00 0.00 H new ATOM 0 HE2 LYS A 8 1.959 -41.171 4.074 1.00 0.00 H new ATOM 0 HE3 LYS A 8 1.415 -40.215 2.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -0.060 -42.073 3.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 0.690 -42.249 1.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 1.217 -43.175 2.930 1.00 0.00 H new ATOM 114 N GLN A 9 6.164 -38.493 -1.012 1.00 0.00 N ATOM 115 CA GLN A 9 6.432 -37.207 -1.633 1.00 0.00 C ATOM 116 C GLN A 9 7.434 -37.368 -2.778 1.00 0.00 C ATOM 117 O GLN A 9 8.358 -38.175 -2.690 1.00 0.00 O ATOM 118 CB GLN A 9 6.935 -36.194 -0.603 1.00 0.00 C ATOM 119 CG GLN A 9 8.295 -36.614 -0.041 1.00 0.00 C ATOM 120 CD GLN A 9 8.297 -36.563 1.489 1.00 0.00 C ATOM 121 OE1 GLN A 9 7.332 -36.168 2.122 1.00 0.00 O ATOM 122 NE2 GLN A 9 9.429 -36.983 2.042 1.00 0.00 N ATOM 0 H GLN A 9 6.961 -38.908 -0.529 1.00 0.00 H new ATOM 0 HA GLN A 9 5.498 -36.824 -2.045 1.00 0.00 H new ATOM 0 HB2 GLN A 9 7.016 -35.210 -1.065 1.00 0.00 H new ATOM 0 HB3 GLN A 9 6.213 -36.106 0.209 1.00 0.00 H new ATOM 0 HG2 GLN A 9 8.534 -37.624 -0.375 1.00 0.00 H new ATOM 0 HG3 GLN A 9 9.072 -35.957 -0.431 1.00 0.00 H new ATOM 0 HE21 GLN A 9 10.198 -37.301 1.452 1.00 0.00 H new ATOM 0 HE22 GLN A 9 9.530 -36.988 3.057 1.00 0.00 H new ATOM 131 N ASP A 10 7.219 -36.587 -3.826 1.00 0.00 N ATOM 132 CA ASP A 10 8.091 -36.633 -4.987 1.00 0.00 C ATOM 133 C ASP A 10 8.672 -35.241 -5.238 1.00 0.00 C ATOM 134 O ASP A 10 8.068 -34.236 -4.867 1.00 0.00 O ATOM 135 CB ASP A 10 7.321 -37.058 -6.239 1.00 0.00 C ATOM 136 CG ASP A 10 8.048 -36.809 -7.561 1.00 0.00 C ATOM 137 OD1 ASP A 10 8.953 -37.613 -7.872 1.00 0.00 O ATOM 138 OD2 ASP A 10 7.684 -35.818 -8.231 1.00 0.00 O ATOM 0 H ASP A 10 6.452 -35.918 -3.895 1.00 0.00 H new ATOM 0 HA ASP A 10 8.880 -37.358 -4.787 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.091 -38.121 -6.163 1.00 0.00 H new ATOM 0 HB3 ASP A 10 6.369 -36.527 -6.260 1.00 0.00 H new ATOM 143 N ARG A 11 9.838 -35.225 -5.869 1.00 0.00 N ATOM 144 CA ARG A 11 10.506 -33.973 -6.174 1.00 0.00 C ATOM 145 C ARG A 11 11.825 -34.240 -6.903 1.00 0.00 C ATOM 146 O ARG A 11 12.867 -34.404 -6.270 1.00 0.00 O ATOM 147 CB ARG A 11 10.788 -33.174 -4.901 1.00 0.00 C ATOM 148 CG ARG A 11 10.518 -31.683 -5.118 1.00 0.00 C ATOM 149 CD ARG A 11 11.737 -30.842 -4.731 1.00 0.00 C ATOM 150 NE ARG A 11 11.384 -29.914 -3.634 1.00 0.00 N ATOM 151 CZ ARG A 11 11.419 -30.239 -2.335 1.00 0.00 C ATOM 152 NH1 ARG A 11 11.791 -31.472 -1.962 1.00 0.00 N ATOM 153 NH2 ARG A 11 11.083 -29.332 -1.408 1.00 0.00 N ATOM 0 H ARG A 11 10.336 -36.060 -6.177 1.00 0.00 H new ATOM 0 HA ARG A 11 9.843 -33.391 -6.814 1.00 0.00 H new ATOM 0 HB2 ARG A 11 10.164 -33.546 -4.088 1.00 0.00 H new ATOM 0 HB3 ARG A 11 11.825 -33.319 -4.598 1.00 0.00 H new ATOM 0 HG2 ARG A 11 10.265 -31.504 -6.163 1.00 0.00 H new ATOM 0 HG3 ARG A 11 9.657 -31.376 -4.525 1.00 0.00 H new ATOM 0 HD2 ARG A 11 12.554 -31.493 -4.419 1.00 0.00 H new ATOM 0 HD3 ARG A 11 12.090 -30.279 -5.595 1.00 0.00 H new ATOM 0 HE ARG A 11 11.096 -28.968 -3.882 1.00 0.00 H new ATOM 0 HH11 ARG A 11 12.047 -32.163 -2.667 1.00 0.00 H new ATOM 0 HH12 ARG A 11 11.818 -31.719 -0.973 1.00 0.00 H new ATOM 0 HH21 ARG A 11 10.800 -28.394 -1.691 1.00 0.00 H new ATOM 0 HH22 ARG A 11 11.110 -29.580 -0.419 1.00 0.00 H new ATOM 167 N GLN A 12 11.737 -34.273 -8.225 1.00 0.00 N ATOM 168 CA GLN A 12 12.911 -34.516 -9.047 1.00 0.00 C ATOM 169 C GLN A 12 12.548 -34.425 -10.530 1.00 0.00 C ATOM 170 O GLN A 12 11.383 -34.572 -10.898 1.00 0.00 O ATOM 171 CB GLN A 12 13.538 -35.872 -8.718 1.00 0.00 C ATOM 172 CG GLN A 12 15.065 -35.777 -8.685 1.00 0.00 C ATOM 173 CD GLN A 12 15.693 -36.676 -9.753 1.00 0.00 C ATOM 174 OE1 GLN A 12 15.051 -37.535 -10.334 1.00 0.00 O ATOM 175 NE2 GLN A 12 16.981 -36.430 -9.976 1.00 0.00 N ATOM 0 H GLN A 12 10.872 -34.136 -8.747 1.00 0.00 H new ATOM 0 HA GLN A 12 13.651 -33.747 -8.827 1.00 0.00 H new ATOM 0 HB2 GLN A 12 13.171 -36.222 -7.753 1.00 0.00 H new ATOM 0 HB3 GLN A 12 13.232 -36.608 -9.461 1.00 0.00 H new ATOM 0 HG2 GLN A 12 15.372 -34.744 -8.847 1.00 0.00 H new ATOM 0 HG3 GLN A 12 15.430 -36.067 -7.700 1.00 0.00 H new ATOM 0 HE21 GLN A 12 17.458 -35.695 -9.453 1.00 0.00 H new ATOM 0 HE22 GLN A 12 17.492 -36.976 -10.670 1.00 0.00 H new ATOM 184 N GLY A 13 13.567 -34.184 -11.342 1.00 0.00 N ATOM 185 CA GLY A 13 13.370 -34.071 -12.778 1.00 0.00 C ATOM 186 C GLY A 13 14.705 -34.149 -13.522 1.00 0.00 C ATOM 187 O GLY A 13 15.161 -35.237 -13.871 1.00 0.00 O ATOM 0 H GLY A 13 14.532 -34.064 -11.033 1.00 0.00 H new ATOM 0 HA2 GLY A 13 12.711 -34.868 -13.122 1.00 0.00 H new ATOM 0 HA3 GLY A 13 12.876 -33.127 -13.008 1.00 0.00 H new ATOM 191 N GLY A 14 15.292 -32.983 -13.743 1.00 0.00 N ATOM 192 CA GLY A 14 16.565 -32.906 -14.440 1.00 0.00 C ATOM 193 C GLY A 14 16.817 -31.492 -14.967 1.00 0.00 C ATOM 194 O GLY A 14 16.956 -31.291 -16.172 1.00 0.00 O ATOM 0 H GLY A 14 14.910 -32.083 -13.452 1.00 0.00 H new ATOM 0 HA2 GLY A 14 17.371 -33.196 -13.766 1.00 0.00 H new ATOM 0 HA3 GLY A 14 16.573 -33.614 -15.269 1.00 0.00 H new ATOM 198 N GLU A 15 16.867 -30.549 -14.038 1.00 0.00 N ATOM 199 CA GLU A 15 17.099 -29.160 -14.394 1.00 0.00 C ATOM 200 C GLU A 15 18.498 -28.725 -13.951 1.00 0.00 C ATOM 201 O GLU A 15 18.679 -28.246 -12.833 1.00 0.00 O ATOM 202 CB GLU A 15 16.027 -28.252 -13.790 1.00 0.00 C ATOM 203 CG GLU A 15 14.939 -27.930 -14.816 1.00 0.00 C ATOM 204 CD GLU A 15 14.610 -26.435 -14.816 1.00 0.00 C ATOM 205 OE1 GLU A 15 14.421 -25.896 -13.703 1.00 0.00 O ATOM 206 OE2 GLU A 15 14.553 -25.866 -15.927 1.00 0.00 O ATOM 0 H GLU A 15 16.751 -30.720 -13.039 1.00 0.00 H new ATOM 0 HA GLU A 15 17.037 -29.069 -15.478 1.00 0.00 H new ATOM 0 HB2 GLU A 15 15.581 -28.738 -12.922 1.00 0.00 H new ATOM 0 HB3 GLU A 15 16.485 -27.328 -13.438 1.00 0.00 H new ATOM 0 HG2 GLU A 15 15.270 -28.233 -15.809 1.00 0.00 H new ATOM 0 HG3 GLU A 15 14.040 -28.504 -14.590 1.00 0.00 H new ATOM 213 N ARG A 16 19.453 -28.909 -14.852 1.00 0.00 N ATOM 214 CA ARG A 16 20.830 -28.542 -14.568 1.00 0.00 C ATOM 215 C ARG A 16 21.562 -28.189 -15.864 1.00 0.00 C ATOM 216 O ARG A 16 21.358 -28.834 -16.892 1.00 0.00 O ATOM 217 CB ARG A 16 21.570 -29.681 -13.865 1.00 0.00 C ATOM 218 CG ARG A 16 21.615 -30.932 -14.746 1.00 0.00 C ATOM 219 CD ARG A 16 21.833 -32.188 -13.902 1.00 0.00 C ATOM 220 NE ARG A 16 22.965 -31.984 -12.971 1.00 0.00 N ATOM 221 CZ ARG A 16 22.829 -31.577 -11.701 1.00 0.00 C ATOM 222 NH1 ARG A 16 21.610 -31.330 -11.204 1.00 0.00 N ATOM 223 NH2 ARG A 16 23.913 -31.418 -10.929 1.00 0.00 N ATOM 0 H ARG A 16 19.300 -29.307 -15.778 1.00 0.00 H new ATOM 0 HA ARG A 16 20.813 -27.675 -13.908 1.00 0.00 H new ATOM 0 HB2 ARG A 16 22.585 -29.365 -13.623 1.00 0.00 H new ATOM 0 HB3 ARG A 16 21.075 -29.914 -12.922 1.00 0.00 H new ATOM 0 HG2 ARG A 16 20.683 -31.022 -15.304 1.00 0.00 H new ATOM 0 HG3 ARG A 16 22.417 -30.837 -15.478 1.00 0.00 H new ATOM 0 HD2 ARG A 16 20.928 -32.420 -13.341 1.00 0.00 H new ATOM 0 HD3 ARG A 16 22.034 -33.041 -14.550 1.00 0.00 H new ATOM 0 HE ARG A 16 23.907 -32.164 -13.317 1.00 0.00 H new ATOM 0 HH11 ARG A 16 20.785 -31.452 -11.792 1.00 0.00 H new ATOM 0 HH12 ARG A 16 21.506 -31.020 -10.238 1.00 0.00 H new ATOM 0 HH21 ARG A 16 24.841 -31.607 -11.308 1.00 0.00 H new ATOM 0 HH22 ARG A 16 23.810 -31.108 -9.963 1.00 0.00 H new ATOM 237 N ARG A 17 22.402 -27.167 -15.773 1.00 0.00 N ATOM 238 CA ARG A 17 23.166 -26.722 -16.926 1.00 0.00 C ATOM 239 C ARG A 17 24.647 -27.055 -16.741 1.00 0.00 C ATOM 240 O ARG A 17 25.100 -27.287 -15.621 1.00 0.00 O ATOM 241 CB ARG A 17 23.012 -25.215 -17.140 1.00 0.00 C ATOM 242 CG ARG A 17 22.949 -24.877 -18.631 1.00 0.00 C ATOM 243 CD ARG A 17 22.232 -23.545 -18.861 1.00 0.00 C ATOM 244 NE ARG A 17 21.674 -23.500 -20.231 1.00 0.00 N ATOM 245 CZ ARG A 17 20.850 -22.541 -20.675 1.00 0.00 C ATOM 246 NH1 ARG A 17 20.482 -21.543 -19.861 1.00 0.00 N ATOM 247 NH2 ARG A 17 20.392 -22.582 -21.934 1.00 0.00 N ATOM 0 H ARG A 17 22.570 -26.635 -14.919 1.00 0.00 H new ATOM 0 HA ARG A 17 22.779 -27.243 -17.802 1.00 0.00 H new ATOM 0 HB2 ARG A 17 22.106 -24.864 -16.645 1.00 0.00 H new ATOM 0 HB3 ARG A 17 23.850 -24.691 -16.680 1.00 0.00 H new ATOM 0 HG2 ARG A 17 23.958 -24.826 -19.039 1.00 0.00 H new ATOM 0 HG3 ARG A 17 22.429 -25.671 -19.166 1.00 0.00 H new ATOM 0 HD2 ARG A 17 21.433 -23.422 -18.130 1.00 0.00 H new ATOM 0 HD3 ARG A 17 22.927 -22.718 -18.715 1.00 0.00 H new ATOM 0 HE ARG A 17 21.933 -24.245 -20.878 1.00 0.00 H new ATOM 0 HH11 ARG A 17 20.829 -21.513 -18.902 1.00 0.00 H new ATOM 0 HH12 ARG A 17 19.855 -20.813 -20.200 1.00 0.00 H new ATOM 0 HH21 ARG A 17 20.671 -23.343 -22.554 1.00 0.00 H new ATOM 0 HH22 ARG A 17 19.765 -21.852 -22.273 1.00 0.00 H new ATOM 261 N ARG A 18 25.362 -27.069 -17.856 1.00 0.00 N ATOM 262 CA ARG A 18 26.783 -27.369 -17.832 1.00 0.00 C ATOM 263 C ARG A 18 27.600 -26.089 -18.021 1.00 0.00 C ATOM 264 O ARG A 18 28.485 -26.034 -18.874 1.00 0.00 O ATOM 265 CB ARG A 18 27.154 -28.369 -18.929 1.00 0.00 C ATOM 266 CG ARG A 18 27.114 -27.709 -20.308 1.00 0.00 C ATOM 267 CD ARG A 18 28.478 -27.794 -20.997 1.00 0.00 C ATOM 268 NE ARG A 18 28.563 -26.784 -22.075 1.00 0.00 N ATOM 269 CZ ARG A 18 29.662 -26.558 -22.807 1.00 0.00 C ATOM 270 NH1 ARG A 18 30.775 -27.271 -22.582 1.00 0.00 N ATOM 271 NH2 ARG A 18 29.649 -25.621 -23.765 1.00 0.00 N ATOM 0 H ARG A 18 24.983 -26.877 -18.783 1.00 0.00 H new ATOM 0 HA ARG A 18 27.012 -27.810 -16.862 1.00 0.00 H new ATOM 0 HB2 ARG A 18 28.151 -28.767 -18.741 1.00 0.00 H new ATOM 0 HB3 ARG A 18 26.464 -29.213 -18.905 1.00 0.00 H new ATOM 0 HG2 ARG A 18 26.360 -28.196 -20.926 1.00 0.00 H new ATOM 0 HG3 ARG A 18 26.818 -26.665 -20.207 1.00 0.00 H new ATOM 0 HD2 ARG A 18 29.273 -27.630 -20.270 1.00 0.00 H new ATOM 0 HD3 ARG A 18 28.625 -28.792 -21.410 1.00 0.00 H new ATOM 0 HE ARG A 18 27.733 -26.225 -22.273 1.00 0.00 H new ATOM 0 HH11 ARG A 18 30.785 -27.985 -21.854 1.00 0.00 H new ATOM 0 HH12 ARG A 18 31.612 -27.099 -23.139 1.00 0.00 H new ATOM 0 HH21 ARG A 18 28.802 -25.079 -23.937 1.00 0.00 H new ATOM 0 HH22 ARG A 18 30.486 -25.449 -24.322 1.00 0.00 H new ATOM 285 N SER A 19 27.275 -25.093 -17.210 1.00 0.00 N ATOM 286 CA SER A 19 27.967 -23.817 -17.277 1.00 0.00 C ATOM 287 C SER A 19 29.462 -24.045 -17.519 1.00 0.00 C ATOM 288 O SER A 19 30.175 -24.502 -16.627 1.00 0.00 O ATOM 289 CB SER A 19 27.754 -23.007 -15.997 1.00 0.00 C ATOM 290 OG SER A 19 27.118 -21.758 -16.256 1.00 0.00 O ATOM 0 H SER A 19 26.542 -25.144 -16.503 1.00 0.00 H new ATOM 0 HA SER A 19 27.553 -23.246 -18.108 1.00 0.00 H new ATOM 0 HB2 SER A 19 27.148 -23.585 -15.299 1.00 0.00 H new ATOM 0 HB3 SER A 19 28.716 -22.831 -15.515 1.00 0.00 H new ATOM 0 HG SER A 19 26.998 -21.271 -15.414 1.00 0.00 H new ATOM 296 N GLN A 20 29.890 -23.715 -18.728 1.00 0.00 N ATOM 297 CA GLN A 20 31.285 -23.877 -19.098 1.00 0.00 C ATOM 298 C GLN A 20 31.851 -25.161 -18.486 1.00 0.00 C ATOM 299 O GLN A 20 32.837 -25.122 -17.752 1.00 0.00 O ATOM 300 CB GLN A 20 32.110 -22.659 -18.675 1.00 0.00 C ATOM 301 CG GLN A 20 32.377 -21.737 -19.866 1.00 0.00 C ATOM 302 CD GLN A 20 33.793 -21.160 -19.806 1.00 0.00 C ATOM 303 OE1 GLN A 20 34.777 -21.835 -20.058 1.00 0.00 O ATOM 304 NE2 GLN A 20 33.840 -19.878 -19.458 1.00 0.00 N ATOM 0 H GLN A 20 29.295 -23.336 -19.464 1.00 0.00 H new ATOM 0 HA GLN A 20 31.345 -23.957 -20.183 1.00 0.00 H new ATOM 0 HB2 GLN A 20 31.581 -22.109 -17.897 1.00 0.00 H new ATOM 0 HB3 GLN A 20 33.056 -22.988 -18.246 1.00 0.00 H new ATOM 0 HG2 GLN A 20 32.245 -22.290 -20.796 1.00 0.00 H new ATOM 0 HG3 GLN A 20 31.650 -20.925 -19.872 1.00 0.00 H new ATOM 0 HE21 GLN A 20 32.977 -19.371 -19.260 1.00 0.00 H new ATOM 0 HE22 GLN A 20 34.739 -19.401 -19.389 1.00 0.00 H new ATOM 313 N LEU A 21 31.200 -26.269 -18.812 1.00 0.00 N ATOM 314 CA LEU A 21 31.626 -27.562 -18.303 1.00 0.00 C ATOM 315 C LEU A 21 32.618 -28.189 -19.285 1.00 0.00 C ATOM 316 O LEU A 21 32.251 -29.056 -20.076 1.00 0.00 O ATOM 317 CB LEU A 21 30.413 -28.447 -18.007 1.00 0.00 C ATOM 318 CG LEU A 21 30.598 -29.493 -16.906 1.00 0.00 C ATOM 319 CD1 LEU A 21 29.990 -30.835 -17.317 1.00 0.00 C ATOM 320 CD2 LEU A 21 32.073 -29.626 -16.520 1.00 0.00 C ATOM 0 H LEU A 21 30.382 -26.298 -19.421 1.00 0.00 H new ATOM 0 HA LEU A 21 32.147 -27.445 -17.353 1.00 0.00 H new ATOM 0 HB2 LEU A 21 29.577 -27.803 -17.732 1.00 0.00 H new ATOM 0 HB3 LEU A 21 30.131 -28.961 -18.926 1.00 0.00 H new ATOM 0 HG LEU A 21 30.062 -29.155 -16.019 1.00 0.00 H new ATOM 0 HD11 LEU A 21 30.135 -31.561 -16.517 1.00 0.00 H new ATOM 0 HD12 LEU A 21 28.923 -30.709 -17.504 1.00 0.00 H new ATOM 0 HD13 LEU A 21 30.477 -31.193 -18.224 1.00 0.00 H new ATOM 0 HD21 LEU A 21 32.178 -30.376 -15.736 1.00 0.00 H new ATOM 0 HD22 LEU A 21 32.651 -29.930 -17.392 1.00 0.00 H new ATOM 0 HD23 LEU A 21 32.442 -28.667 -16.157 1.00 0.00 H new ATOM 332 N ASP A 22 33.857 -27.726 -19.201 1.00 0.00 N ATOM 333 CA ASP A 22 34.905 -28.230 -20.071 1.00 0.00 C ATOM 334 C ASP A 22 34.957 -29.757 -19.968 1.00 0.00 C ATOM 335 O ASP A 22 34.530 -30.329 -18.967 1.00 0.00 O ATOM 336 CB ASP A 22 36.273 -27.682 -19.662 1.00 0.00 C ATOM 337 CG ASP A 22 36.335 -26.163 -19.490 1.00 0.00 C ATOM 338 OD1 ASP A 22 35.268 -25.581 -19.195 1.00 0.00 O ATOM 339 OD2 ASP A 22 37.447 -25.618 -19.659 1.00 0.00 O ATOM 0 H ASP A 22 34.158 -27.007 -18.543 1.00 0.00 H new ATOM 0 HA ASP A 22 34.680 -27.912 -21.089 1.00 0.00 H new ATOM 0 HB2 ASP A 22 36.570 -28.151 -18.724 1.00 0.00 H new ATOM 0 HB3 ASP A 22 37.006 -27.978 -20.413 1.00 0.00 H new ATOM 344 N ARG A 23 35.486 -30.371 -21.016 1.00 0.00 N ATOM 345 CA ARG A 23 35.599 -31.818 -21.055 1.00 0.00 C ATOM 346 C ARG A 23 36.629 -32.298 -20.031 1.00 0.00 C ATOM 347 O ARG A 23 36.786 -33.500 -19.818 1.00 0.00 O ATOM 348 CB ARG A 23 36.013 -32.301 -22.447 1.00 0.00 C ATOM 349 CG ARG A 23 34.791 -32.483 -23.350 1.00 0.00 C ATOM 350 CD ARG A 23 33.933 -33.660 -22.880 1.00 0.00 C ATOM 351 NE ARG A 23 34.220 -34.856 -23.702 1.00 0.00 N ATOM 352 CZ ARG A 23 33.704 -36.070 -23.470 1.00 0.00 C ATOM 353 NH1 ARG A 23 32.870 -36.256 -22.437 1.00 0.00 N ATOM 354 NH2 ARG A 23 34.020 -37.098 -24.268 1.00 0.00 N ATOM 0 H ARG A 23 35.841 -29.893 -21.844 1.00 0.00 H new ATOM 0 HA ARG A 23 34.620 -32.233 -20.814 1.00 0.00 H new ATOM 0 HB2 ARG A 23 36.698 -31.582 -22.897 1.00 0.00 H new ATOM 0 HB3 ARG A 23 36.552 -33.245 -22.363 1.00 0.00 H new ATOM 0 HG2 ARG A 23 34.195 -31.571 -23.350 1.00 0.00 H new ATOM 0 HG3 ARG A 23 35.115 -32.652 -24.377 1.00 0.00 H new ATOM 0 HD2 ARG A 23 34.136 -33.873 -21.830 1.00 0.00 H new ATOM 0 HD3 ARG A 23 32.876 -33.403 -22.954 1.00 0.00 H new ATOM 0 HE ARG A 23 34.851 -34.749 -24.496 1.00 0.00 H new ATOM 0 HH11 ARG A 23 32.629 -35.473 -21.829 1.00 0.00 H new ATOM 0 HH12 ARG A 23 32.476 -37.180 -22.259 1.00 0.00 H new ATOM 0 HH21 ARG A 23 34.655 -36.957 -25.054 1.00 0.00 H new ATOM 0 HH22 ARG A 23 33.626 -38.022 -24.090 1.00 0.00 H new ATOM 368 N ASP A 24 37.306 -31.334 -19.423 1.00 0.00 N ATOM 369 CA ASP A 24 38.316 -31.643 -18.426 1.00 0.00 C ATOM 370 C ASP A 24 38.061 -30.805 -17.171 1.00 0.00 C ATOM 371 O ASP A 24 38.963 -30.606 -16.360 1.00 0.00 O ATOM 372 CB ASP A 24 39.717 -31.309 -18.940 1.00 0.00 C ATOM 373 CG ASP A 24 40.354 -32.381 -19.827 1.00 0.00 C ATOM 374 OD1 ASP A 24 41.425 -32.082 -20.398 1.00 0.00 O ATOM 375 OD2 ASP A 24 39.754 -33.474 -19.914 1.00 0.00 O ATOM 0 H ASP A 24 37.174 -30.339 -19.602 1.00 0.00 H new ATOM 0 HA ASP A 24 38.257 -32.709 -18.205 1.00 0.00 H new ATOM 0 HB2 ASP A 24 39.669 -30.376 -19.502 1.00 0.00 H new ATOM 0 HB3 ASP A 24 40.369 -31.133 -18.084 1.00 0.00 H new ATOM 380 N GLN A 25 36.827 -30.338 -17.051 1.00 0.00 N ATOM 381 CA GLN A 25 36.441 -29.526 -15.909 1.00 0.00 C ATOM 382 C GLN A 25 35.492 -30.309 -14.999 1.00 0.00 C ATOM 383 O GLN A 25 34.388 -30.665 -15.407 1.00 0.00 O ATOM 384 CB GLN A 25 35.807 -28.209 -16.362 1.00 0.00 C ATOM 385 CG GLN A 25 35.156 -27.482 -15.184 1.00 0.00 C ATOM 386 CD GLN A 25 34.380 -26.252 -15.661 1.00 0.00 C ATOM 387 OE1 GLN A 25 34.840 -25.475 -16.481 1.00 0.00 O ATOM 388 NE2 GLN A 25 33.181 -26.118 -15.100 1.00 0.00 N ATOM 0 H GLN A 25 36.081 -30.506 -17.726 1.00 0.00 H new ATOM 0 HA GLN A 25 37.338 -29.281 -15.341 1.00 0.00 H new ATOM 0 HB2 GLN A 25 36.567 -27.571 -16.813 1.00 0.00 H new ATOM 0 HB3 GLN A 25 35.060 -28.406 -17.131 1.00 0.00 H new ATOM 0 HG2 GLN A 25 34.483 -28.161 -14.660 1.00 0.00 H new ATOM 0 HG3 GLN A 25 35.922 -27.179 -14.470 1.00 0.00 H new ATOM 0 HE21 GLN A 25 32.856 -26.805 -14.420 1.00 0.00 H new ATOM 0 HE22 GLN A 25 32.586 -25.328 -15.350 1.00 0.00 H new ATOM 397 N CYS A 26 35.956 -30.551 -13.783 1.00 0.00 N ATOM 398 CA CYS A 26 35.163 -31.284 -12.811 1.00 0.00 C ATOM 399 C CYS A 26 33.768 -30.659 -12.761 1.00 0.00 C ATOM 400 O CYS A 26 33.619 -29.449 -12.924 1.00 0.00 O ATOM 401 CB CYS A 26 35.829 -31.303 -11.434 1.00 0.00 C ATOM 402 SG CYS A 26 34.831 -32.300 -10.269 1.00 0.00 S ATOM 0 H CYS A 26 36.872 -30.252 -13.448 1.00 0.00 H new ATOM 0 HA CYS A 26 35.083 -32.327 -13.117 1.00 0.00 H new ATOM 0 HB2 CYS A 26 36.834 -31.718 -11.513 1.00 0.00 H new ATOM 0 HB3 CYS A 26 35.933 -30.285 -11.057 1.00 0.00 H new ATOM 407 N ALA A 27 32.779 -31.512 -12.536 1.00 0.00 N ATOM 408 CA ALA A 27 31.401 -31.059 -12.462 1.00 0.00 C ATOM 409 C ALA A 27 30.884 -31.238 -11.033 1.00 0.00 C ATOM 410 O ALA A 27 29.703 -31.509 -10.826 1.00 0.00 O ATOM 411 CB ALA A 27 30.558 -31.819 -13.487 1.00 0.00 C ATOM 0 H ALA A 27 32.905 -32.515 -12.402 1.00 0.00 H new ATOM 0 HA ALA A 27 31.333 -29.999 -12.706 1.00 0.00 H new ATOM 0 HB1 ALA A 27 29.524 -31.479 -13.431 1.00 0.00 H new ATOM 0 HB2 ALA A 27 30.948 -31.633 -14.488 1.00 0.00 H new ATOM 0 HB3 ALA A 27 30.601 -32.887 -13.273 1.00 0.00 H new ATOM 417 N TYR A 28 31.795 -31.082 -10.084 1.00 0.00 N ATOM 418 CA TYR A 28 31.448 -31.225 -8.681 1.00 0.00 C ATOM 419 C TYR A 28 32.015 -30.068 -7.855 1.00 0.00 C ATOM 420 O TYR A 28 31.273 -29.366 -7.172 1.00 0.00 O ATOM 421 CB TYR A 28 32.092 -32.532 -8.217 1.00 0.00 C ATOM 422 CG TYR A 28 31.456 -33.127 -6.959 1.00 0.00 C ATOM 423 CD1 TYR A 28 30.229 -33.757 -7.039 1.00 0.00 C ATOM 424 CD2 TYR A 28 32.107 -33.035 -5.747 1.00 0.00 C ATOM 425 CE1 TYR A 28 29.630 -34.317 -5.855 1.00 0.00 C ATOM 426 CE2 TYR A 28 31.508 -33.595 -4.563 1.00 0.00 C ATOM 427 CZ TYR A 28 30.300 -34.209 -4.675 1.00 0.00 C ATOM 428 OH TYR A 28 29.733 -34.738 -3.558 1.00 0.00 O ATOM 0 H TYR A 28 32.774 -30.858 -10.260 1.00 0.00 H new ATOM 0 HA TYR A 28 30.366 -31.225 -8.552 1.00 0.00 H new ATOM 0 HB2 TYR A 28 32.029 -33.262 -9.024 1.00 0.00 H new ATOM 0 HB3 TYR A 28 33.151 -32.356 -8.028 1.00 0.00 H new ATOM 0 HD1 TYR A 28 29.720 -33.829 -7.989 1.00 0.00 H new ATOM 0 HD2 TYR A 28 33.066 -32.543 -5.686 1.00 0.00 H new ATOM 0 HE1 TYR A 28 28.671 -34.811 -5.902 1.00 0.00 H new ATOM 0 HE2 TYR A 28 32.007 -33.529 -3.608 1.00 0.00 H new ATOM 0 HH TYR A 28 30.323 -34.588 -2.790 1.00 0.00 H new ATOM 438 N CYS A 29 33.328 -29.907 -7.947 1.00 0.00 N ATOM 439 CA CYS A 29 34.004 -28.849 -7.216 1.00 0.00 C ATOM 440 C CYS A 29 34.194 -27.660 -8.159 1.00 0.00 C ATOM 441 O CYS A 29 34.207 -26.510 -7.722 1.00 0.00 O ATOM 442 CB CYS A 29 35.332 -29.327 -6.626 1.00 0.00 C ATOM 443 SG CYS A 29 36.442 -29.899 -7.966 1.00 0.00 S ATOM 0 H CYS A 29 33.940 -30.491 -8.516 1.00 0.00 H new ATOM 0 HA CYS A 29 33.394 -28.544 -6.366 1.00 0.00 H new ATOM 0 HB2 CYS A 29 35.805 -28.517 -6.071 1.00 0.00 H new ATOM 0 HB3 CYS A 29 35.155 -30.137 -5.919 1.00 0.00 H new ATOM 448 N LYS A 30 34.335 -27.976 -9.438 1.00 0.00 N ATOM 449 CA LYS A 30 34.524 -26.949 -10.448 1.00 0.00 C ATOM 450 C LYS A 30 36.021 -26.746 -10.689 1.00 0.00 C ATOM 451 O LYS A 30 36.452 -25.650 -11.048 1.00 0.00 O ATOM 452 CB LYS A 30 33.785 -25.669 -10.054 1.00 0.00 C ATOM 453 CG LYS A 30 32.401 -25.987 -9.485 1.00 0.00 C ATOM 454 CD LYS A 30 31.300 -25.337 -10.327 1.00 0.00 C ATOM 455 CE LYS A 30 30.318 -26.387 -10.849 1.00 0.00 C ATOM 456 NZ LYS A 30 28.934 -25.862 -10.819 1.00 0.00 N ATOM 0 H LYS A 30 34.322 -28.930 -9.798 1.00 0.00 H new ATOM 0 HA LYS A 30 34.088 -27.262 -11.397 1.00 0.00 H new ATOM 0 HB2 LYS A 30 34.369 -25.121 -9.314 1.00 0.00 H new ATOM 0 HB3 LYS A 30 33.684 -25.021 -10.924 1.00 0.00 H new ATOM 0 HG2 LYS A 30 32.254 -27.067 -9.458 1.00 0.00 H new ATOM 0 HG3 LYS A 30 32.336 -25.631 -8.457 1.00 0.00 H new ATOM 0 HD2 LYS A 30 30.766 -24.600 -9.727 1.00 0.00 H new ATOM 0 HD3 LYS A 30 31.746 -24.802 -11.166 1.00 0.00 H new ATOM 0 HE2 LYS A 30 30.585 -26.668 -11.868 1.00 0.00 H new ATOM 0 HE3 LYS A 30 30.384 -27.290 -10.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 28.338 -26.417 -11.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 28.556 -25.934 -9.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 28.934 -24.866 -11.118 1.00 0.00 H new ATOM 470 N GLU A 31 36.772 -27.817 -10.482 1.00 0.00 N ATOM 471 CA GLU A 31 38.212 -27.769 -10.672 1.00 0.00 C ATOM 472 C GLU A 31 38.608 -28.552 -11.927 1.00 0.00 C ATOM 473 O GLU A 31 38.226 -29.710 -12.087 1.00 0.00 O ATOM 474 CB GLU A 31 38.946 -28.302 -9.441 1.00 0.00 C ATOM 475 CG GLU A 31 40.135 -27.409 -9.082 1.00 0.00 C ATOM 476 CD GLU A 31 41.347 -27.732 -9.959 1.00 0.00 C ATOM 477 OE1 GLU A 31 41.239 -27.497 -11.182 1.00 0.00 O ATOM 478 OE2 GLU A 31 42.352 -28.204 -9.387 1.00 0.00 O ATOM 0 H GLU A 31 36.411 -28.723 -10.185 1.00 0.00 H new ATOM 0 HA GLU A 31 38.506 -26.728 -10.807 1.00 0.00 H new ATOM 0 HB2 GLU A 31 38.258 -28.354 -8.597 1.00 0.00 H new ATOM 0 HB3 GLU A 31 39.294 -29.317 -9.632 1.00 0.00 H new ATOM 0 HG2 GLU A 31 39.859 -26.362 -9.208 1.00 0.00 H new ATOM 0 HG3 GLU A 31 40.394 -27.547 -8.032 1.00 0.00 H new ATOM 485 N LYS A 32 39.368 -27.886 -12.785 1.00 0.00 N ATOM 486 CA LYS A 32 39.819 -28.504 -14.020 1.00 0.00 C ATOM 487 C LYS A 32 41.111 -29.280 -13.755 1.00 0.00 C ATOM 488 O LYS A 32 41.991 -28.801 -13.042 1.00 0.00 O ATOM 489 CB LYS A 32 39.947 -27.457 -15.127 1.00 0.00 C ATOM 490 CG LYS A 32 40.963 -26.378 -14.747 1.00 0.00 C ATOM 491 CD LYS A 32 40.260 -25.078 -14.350 1.00 0.00 C ATOM 492 CE LYS A 32 41.158 -24.221 -13.455 1.00 0.00 C ATOM 493 NZ LYS A 32 40.360 -23.185 -12.762 1.00 0.00 N ATOM 0 H LYS A 32 39.682 -26.925 -12.649 1.00 0.00 H new ATOM 0 HA LYS A 32 39.082 -29.223 -14.377 1.00 0.00 H new ATOM 0 HB2 LYS A 32 40.254 -27.940 -16.055 1.00 0.00 H new ATOM 0 HB3 LYS A 32 38.976 -26.998 -15.312 1.00 0.00 H new ATOM 0 HG2 LYS A 32 41.580 -26.729 -13.920 1.00 0.00 H new ATOM 0 HG3 LYS A 32 41.632 -26.192 -15.587 1.00 0.00 H new ATOM 0 HD2 LYS A 32 39.991 -24.517 -15.245 1.00 0.00 H new ATOM 0 HD3 LYS A 32 39.332 -25.307 -13.827 1.00 0.00 H new ATOM 0 HE2 LYS A 32 41.660 -24.852 -12.722 1.00 0.00 H new ATOM 0 HE3 LYS A 32 41.936 -23.749 -14.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 40.984 -22.612 -12.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 39.901 -22.572 -13.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 39.634 -23.642 -12.174 1.00 0.00 H new ATOM 507 N GLY A 33 41.182 -30.466 -14.341 1.00 0.00 N ATOM 508 CA GLY A 33 42.352 -31.313 -14.177 1.00 0.00 C ATOM 509 C GLY A 33 41.948 -32.737 -13.789 1.00 0.00 C ATOM 510 O GLY A 33 42.713 -33.679 -13.989 1.00 0.00 O ATOM 0 H GLY A 33 40.449 -30.861 -14.930 1.00 0.00 H new ATOM 0 HA2 GLY A 33 42.924 -31.333 -15.105 1.00 0.00 H new ATOM 0 HA3 GLY A 33 43.004 -30.894 -13.410 1.00 0.00 H new ATOM 514 N HIS A 34 40.747 -32.848 -13.242 1.00 0.00 N ATOM 515 CA HIS A 34 40.232 -34.140 -12.824 1.00 0.00 C ATOM 516 C HIS A 34 38.742 -34.234 -13.162 1.00 0.00 C ATOM 517 O HIS A 34 38.073 -33.214 -13.319 1.00 0.00 O ATOM 518 CB HIS A 34 40.519 -34.387 -11.342 1.00 0.00 C ATOM 519 CG HIS A 34 39.685 -33.545 -10.406 1.00 0.00 C ATOM 520 ND1 HIS A 34 40.148 -32.371 -9.841 1.00 0.00 N ATOM 521 CD2 HIS A 34 38.413 -33.721 -9.944 1.00 0.00 C ATOM 522 CE1 HIS A 34 39.190 -31.870 -9.074 1.00 0.00 C ATOM 523 NE2 HIS A 34 38.117 -32.708 -9.139 1.00 0.00 N ATOM 0 H HIS A 34 40.115 -32.064 -13.079 1.00 0.00 H new ATOM 0 HA HIS A 34 40.744 -34.932 -13.371 1.00 0.00 H new ATOM 0 HB2 HIS A 34 40.345 -35.440 -11.119 1.00 0.00 H new ATOM 0 HB3 HIS A 34 41.574 -34.190 -11.149 1.00 0.00 H new ATOM 0 HD1 HIS A 34 41.070 -31.960 -9.989 1.00 0.00 H new ATOM 0 HD2 HIS A 34 37.759 -34.544 -10.191 1.00 0.00 H new ATOM 0 HE1 HIS A 34 39.249 -30.958 -8.499 1.00 0.00 H new ATOM 531 N TRP A 35 38.267 -35.466 -13.264 1.00 0.00 N ATOM 532 CA TRP A 35 36.869 -35.706 -13.580 1.00 0.00 C ATOM 533 C TRP A 35 36.103 -35.844 -12.263 1.00 0.00 C ATOM 534 O TRP A 35 36.698 -36.116 -11.220 1.00 0.00 O ATOM 535 CB TRP A 35 36.714 -36.925 -14.492 1.00 0.00 C ATOM 536 CG TRP A 35 36.739 -36.591 -15.986 1.00 0.00 C ATOM 537 CD1 TRP A 35 37.444 -35.636 -16.606 1.00 0.00 C ATOM 538 CD2 TRP A 35 35.992 -37.255 -17.027 1.00 0.00 C ATOM 539 NE1 TRP A 35 37.209 -35.636 -17.965 1.00 0.00 N ATOM 540 CE2 TRP A 35 36.297 -36.652 -18.230 1.00 0.00 C ATOM 541 CE3 TRP A 35 35.090 -38.331 -16.954 1.00 0.00 C ATOM 542 CZ2 TRP A 35 35.744 -37.054 -19.451 1.00 0.00 C ATOM 543 CZ3 TRP A 35 34.545 -38.721 -18.184 1.00 0.00 C ATOM 544 CH2 TRP A 35 34.841 -38.123 -19.403 1.00 0.00 C ATOM 0 H TRP A 35 38.825 -36.309 -13.133 1.00 0.00 H new ATOM 0 HA TRP A 35 36.451 -34.869 -14.140 1.00 0.00 H new ATOM 0 HB2 TRP A 35 37.514 -37.633 -14.275 1.00 0.00 H new ATOM 0 HB3 TRP A 35 35.774 -37.425 -14.257 1.00 0.00 H new ATOM 0 HD1 TRP A 35 38.113 -34.952 -16.105 1.00 0.00 H new ATOM 0 HE1 TRP A 35 37.627 -35.006 -18.650 1.00 0.00 H new ATOM 0 HE3 TRP A 35 34.837 -38.818 -16.024 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 36.000 -36.566 -20.380 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 33.846 -39.544 -18.185 1.00 0.00 H new ATOM 0 HH2 TRP A 35 34.376 -38.481 -20.310 1.00 0.00 H new ATOM 555 N ALA A 36 34.795 -35.651 -12.353 1.00 0.00 N ATOM 556 CA ALA A 36 33.942 -35.750 -11.181 1.00 0.00 C ATOM 557 C ALA A 36 34.080 -37.147 -10.573 1.00 0.00 C ATOM 558 O ALA A 36 34.034 -37.305 -9.354 1.00 0.00 O ATOM 559 CB ALA A 36 32.499 -35.423 -11.571 1.00 0.00 C ATOM 0 H ALA A 36 34.305 -35.427 -13.219 1.00 0.00 H new ATOM 0 HA ALA A 36 34.246 -35.029 -10.422 1.00 0.00 H new ATOM 0 HB1 ALA A 36 31.859 -35.497 -10.692 1.00 0.00 H new ATOM 0 HB2 ALA A 36 32.451 -34.410 -11.971 1.00 0.00 H new ATOM 0 HB3 ALA A 36 32.158 -36.129 -12.329 1.00 0.00 H new ATOM 565 N LYS A 37 34.244 -38.127 -11.450 1.00 0.00 N ATOM 566 CA LYS A 37 34.388 -39.505 -11.015 1.00 0.00 C ATOM 567 C LYS A 37 35.660 -39.641 -10.176 1.00 0.00 C ATOM 568 O LYS A 37 35.859 -40.649 -9.502 1.00 0.00 O ATOM 569 CB LYS A 37 34.339 -40.454 -12.214 1.00 0.00 C ATOM 570 CG LYS A 37 32.894 -40.713 -12.651 1.00 0.00 C ATOM 571 CD LYS A 37 32.820 -41.019 -14.147 1.00 0.00 C ATOM 572 CE LYS A 37 31.515 -41.737 -14.495 1.00 0.00 C ATOM 573 NZ LYS A 37 31.734 -42.708 -15.592 1.00 0.00 N ATOM 0 H LYS A 37 34.280 -37.993 -12.461 1.00 0.00 H new ATOM 0 HA LYS A 37 33.552 -39.791 -10.377 1.00 0.00 H new ATOM 0 HB2 LYS A 37 34.902 -40.027 -13.044 1.00 0.00 H new ATOM 0 HB3 LYS A 37 34.819 -41.398 -11.955 1.00 0.00 H new ATOM 0 HG2 LYS A 37 32.483 -41.549 -12.085 1.00 0.00 H new ATOM 0 HG3 LYS A 37 32.280 -39.842 -12.424 1.00 0.00 H new ATOM 0 HD2 LYS A 37 32.892 -40.092 -14.716 1.00 0.00 H new ATOM 0 HD3 LYS A 37 33.669 -41.638 -14.438 1.00 0.00 H new ATOM 0 HE2 LYS A 37 31.131 -42.254 -13.615 1.00 0.00 H new ATOM 0 HE3 LYS A 37 30.760 -41.009 -14.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 30.838 -43.187 -15.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 32.079 -42.207 -16.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 32.439 -43.413 -15.296 1.00 0.00 H new ATOM 587 N ASP A 38 36.489 -38.609 -10.247 1.00 0.00 N ATOM 588 CA ASP A 38 37.737 -38.600 -9.501 1.00 0.00 C ATOM 589 C ASP A 38 37.872 -37.271 -8.757 1.00 0.00 C ATOM 590 O ASP A 38 38.978 -36.762 -8.583 1.00 0.00 O ATOM 591 CB ASP A 38 38.938 -38.742 -10.438 1.00 0.00 C ATOM 592 CG ASP A 38 40.031 -39.694 -9.949 1.00 0.00 C ATOM 593 OD1 ASP A 38 41.131 -39.647 -10.540 1.00 0.00 O ATOM 594 OD2 ASP A 38 39.742 -40.448 -8.994 1.00 0.00 O ATOM 0 H ASP A 38 36.321 -37.774 -10.809 1.00 0.00 H new ATOM 0 HA ASP A 38 37.721 -39.439 -8.805 1.00 0.00 H new ATOM 0 HB2 ASP A 38 38.583 -39.088 -11.409 1.00 0.00 H new ATOM 0 HB3 ASP A 38 39.378 -37.757 -10.592 1.00 0.00 H new ATOM 599 N CYS A 39 36.731 -36.746 -8.337 1.00 0.00 N ATOM 600 CA CYS A 39 36.707 -35.485 -7.614 1.00 0.00 C ATOM 601 C CYS A 39 37.294 -35.719 -6.221 1.00 0.00 C ATOM 602 O CYS A 39 36.850 -36.609 -5.497 1.00 0.00 O ATOM 603 CB CYS A 39 35.296 -34.897 -7.548 1.00 0.00 C ATOM 604 SG CYS A 39 35.339 -33.260 -6.733 1.00 0.00 S ATOM 0 H CYS A 39 35.815 -37.171 -8.483 1.00 0.00 H new ATOM 0 HA CYS A 39 37.312 -34.748 -8.143 1.00 0.00 H new ATOM 0 HB2 CYS A 39 34.885 -34.801 -8.553 1.00 0.00 H new ATOM 0 HB3 CYS A 39 34.638 -35.569 -6.998 1.00 0.00 H new ATOM 609 N PRO A 40 38.308 -34.881 -5.877 1.00 0.00 N ATOM 610 CA PRO A 40 38.961 -34.989 -4.583 1.00 0.00 C ATOM 611 C PRO A 40 38.073 -34.422 -3.473 1.00 0.00 C ATOM 612 O PRO A 40 38.259 -34.744 -2.300 1.00 0.00 O ATOM 613 CB PRO A 40 40.270 -34.231 -4.739 1.00 0.00 C ATOM 614 CG PRO A 40 40.095 -33.341 -5.957 1.00 0.00 C ATOM 615 CD PRO A 40 38.861 -33.815 -6.707 1.00 0.00 C ATOM 0 HA PRO A 40 39.146 -36.022 -4.290 1.00 0.00 H new ATOM 0 HB2 PRO A 40 40.486 -33.638 -3.850 1.00 0.00 H new ATOM 0 HB3 PRO A 40 41.105 -34.918 -4.874 1.00 0.00 H new ATOM 0 HG2 PRO A 40 39.982 -32.300 -5.656 1.00 0.00 H new ATOM 0 HG3 PRO A 40 40.975 -33.394 -6.598 1.00 0.00 H new ATOM 0 HD2 PRO A 40 38.144 -33.005 -6.841 1.00 0.00 H new ATOM 0 HD3 PRO A 40 39.118 -34.180 -7.701 1.00 0.00 H new ATOM 623 N LYS A 41 37.125 -33.591 -3.882 1.00 0.00 N ATOM 624 CA LYS A 41 36.208 -32.979 -2.938 1.00 0.00 C ATOM 625 C LYS A 41 35.191 -34.023 -2.469 1.00 0.00 C ATOM 626 O LYS A 41 34.421 -33.774 -1.543 1.00 0.00 O ATOM 627 CB LYS A 41 35.569 -31.728 -3.545 1.00 0.00 C ATOM 628 CG LYS A 41 34.813 -30.927 -2.483 1.00 0.00 C ATOM 629 CD LYS A 41 33.398 -30.590 -2.954 1.00 0.00 C ATOM 630 CE LYS A 41 32.374 -30.851 -1.846 1.00 0.00 C ATOM 631 NZ LYS A 41 32.493 -29.831 -0.780 1.00 0.00 N ATOM 0 H LYS A 41 36.973 -33.328 -4.856 1.00 0.00 H new ATOM 0 HA LYS A 41 36.745 -32.637 -2.053 1.00 0.00 H new ATOM 0 HB2 LYS A 41 36.340 -31.104 -3.996 1.00 0.00 H new ATOM 0 HB3 LYS A 41 34.885 -32.016 -4.344 1.00 0.00 H new ATOM 0 HG2 LYS A 41 34.765 -31.499 -1.557 1.00 0.00 H new ATOM 0 HG3 LYS A 41 35.355 -30.008 -2.262 1.00 0.00 H new ATOM 0 HD2 LYS A 41 33.352 -29.544 -3.258 1.00 0.00 H new ATOM 0 HD3 LYS A 41 33.151 -31.188 -3.831 1.00 0.00 H new ATOM 0 HE2 LYS A 41 31.367 -30.835 -2.262 1.00 0.00 H new ATOM 0 HE3 LYS A 41 32.529 -31.845 -1.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 31.792 -30.023 -0.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 33.449 -29.866 -0.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 32.322 -28.887 -1.182 1.00 0.00 H new ATOM 645 N LYS A 42 35.223 -35.171 -3.130 1.00 0.00 N ATOM 646 CA LYS A 42 34.315 -36.253 -2.794 1.00 0.00 C ATOM 647 C LYS A 42 34.819 -36.964 -1.537 1.00 0.00 C ATOM 648 O LYS A 42 35.882 -37.583 -1.552 1.00 0.00 O ATOM 649 CB LYS A 42 34.125 -37.186 -3.993 1.00 0.00 C ATOM 650 CG LYS A 42 33.186 -36.563 -5.028 1.00 0.00 C ATOM 651 CD LYS A 42 33.066 -37.455 -6.265 1.00 0.00 C ATOM 652 CE LYS A 42 31.984 -38.520 -6.071 1.00 0.00 C ATOM 653 NZ LYS A 42 31.643 -39.153 -7.364 1.00 0.00 N ATOM 0 H LYS A 42 35.864 -35.375 -3.897 1.00 0.00 H new ATOM 0 HA LYS A 42 33.324 -35.861 -2.564 1.00 0.00 H new ATOM 0 HB2 LYS A 42 35.091 -37.395 -4.452 1.00 0.00 H new ATOM 0 HB3 LYS A 42 33.719 -38.140 -3.656 1.00 0.00 H new ATOM 0 HG2 LYS A 42 32.201 -36.412 -4.587 1.00 0.00 H new ATOM 0 HG3 LYS A 42 33.559 -35.581 -5.318 1.00 0.00 H new ATOM 0 HD2 LYS A 42 32.828 -36.845 -7.136 1.00 0.00 H new ATOM 0 HD3 LYS A 42 34.023 -37.936 -6.465 1.00 0.00 H new ATOM 0 HE2 LYS A 42 32.333 -39.278 -5.369 1.00 0.00 H new ATOM 0 HE3 LYS A 42 31.094 -38.067 -5.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 31.573 -40.183 -7.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 30.732 -38.783 -7.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 32.384 -38.939 -8.062 1.00 0.00 H new ATOM 667 N PRO A 43 34.012 -36.847 -0.448 1.00 0.00 N ATOM 668 CA PRO A 43 34.365 -37.471 0.816 1.00 0.00 C ATOM 669 C PRO A 43 34.136 -38.983 0.764 1.00 0.00 C ATOM 670 O PRO A 43 34.905 -39.751 1.340 1.00 0.00 O ATOM 671 CB PRO A 43 33.501 -36.774 1.854 1.00 0.00 C ATOM 672 CG PRO A 43 32.369 -36.118 1.080 1.00 0.00 C ATOM 673 CD PRO A 43 32.747 -36.121 -0.392 1.00 0.00 C ATOM 0 HA PRO A 43 35.422 -37.361 1.059 1.00 0.00 H new ATOM 0 HB2 PRO A 43 33.115 -37.486 2.583 1.00 0.00 H new ATOM 0 HB3 PRO A 43 34.077 -36.032 2.408 1.00 0.00 H new ATOM 0 HG2 PRO A 43 31.436 -36.660 1.236 1.00 0.00 H new ATOM 0 HG3 PRO A 43 32.208 -35.099 1.430 1.00 0.00 H new ATOM 0 HD2 PRO A 43 31.983 -36.610 -0.996 1.00 0.00 H new ATOM 0 HD3 PRO A 43 32.855 -35.106 -0.775 1.00 0.00 H new ATOM 681 N ARG A 44 33.074 -39.365 0.071 1.00 0.00 N ATOM 682 CA ARG A 44 32.732 -40.771 -0.063 1.00 0.00 C ATOM 683 C ARG A 44 32.411 -41.372 1.306 1.00 0.00 C ATOM 684 O ARG A 44 33.125 -41.128 2.278 1.00 0.00 O ATOM 685 CB ARG A 44 33.880 -41.557 -0.702 1.00 0.00 C ATOM 686 CG ARG A 44 33.635 -41.766 -2.197 1.00 0.00 C ATOM 687 CD ARG A 44 34.175 -43.122 -2.657 1.00 0.00 C ATOM 688 NE ARG A 44 35.653 -43.083 -2.725 1.00 0.00 N ATOM 689 CZ ARG A 44 36.413 -44.106 -3.136 1.00 0.00 C ATOM 690 NH1 ARG A 44 35.840 -45.256 -3.516 1.00 0.00 N ATOM 691 NH2 ARG A 44 37.747 -43.980 -3.165 1.00 0.00 N ATOM 0 H ARG A 44 32.438 -38.725 -0.404 1.00 0.00 H new ATOM 0 HA ARG A 44 31.856 -40.840 -0.707 1.00 0.00 H new ATOM 0 HB2 ARG A 44 34.818 -41.022 -0.555 1.00 0.00 H new ATOM 0 HB3 ARG A 44 33.983 -42.523 -0.208 1.00 0.00 H new ATOM 0 HG2 ARG A 44 32.567 -41.706 -2.406 1.00 0.00 H new ATOM 0 HG3 ARG A 44 34.116 -40.968 -2.763 1.00 0.00 H new ATOM 0 HD2 ARG A 44 33.855 -43.903 -1.967 1.00 0.00 H new ATOM 0 HD3 ARG A 44 33.764 -43.373 -3.635 1.00 0.00 H new ATOM 0 HE ARG A 44 36.122 -42.223 -2.441 1.00 0.00 H new ATOM 0 HH11 ARG A 44 34.825 -45.352 -3.492 1.00 0.00 H new ATOM 0 HH12 ARG A 44 36.419 -46.035 -3.829 1.00 0.00 H new ATOM 0 HH21 ARG A 44 38.183 -43.105 -2.874 1.00 0.00 H new ATOM 0 HH22 ARG A 44 38.326 -44.759 -3.478 1.00 0.00 H new ATOM 705 N GLY A 45 31.337 -42.146 1.339 1.00 0.00 N ATOM 706 CA GLY A 45 30.913 -42.784 2.574 1.00 0.00 C ATOM 707 C GLY A 45 29.889 -41.920 3.314 1.00 0.00 C ATOM 708 O GLY A 45 29.585 -40.808 2.886 1.00 0.00 O ATOM 0 H GLY A 45 30.748 -42.346 0.531 1.00 0.00 H new ATOM 0 HA2 GLY A 45 30.479 -43.759 2.353 1.00 0.00 H new ATOM 0 HA3 GLY A 45 31.778 -42.957 3.214 1.00 0.00 H new ATOM 712 N PRO A 46 29.374 -42.480 4.441 1.00 0.00 N ATOM 713 CA PRO A 46 29.787 -43.802 4.878 1.00 0.00 C ATOM 714 C PRO A 46 29.156 -44.891 4.007 1.00 0.00 C ATOM 715 O PRO A 46 27.941 -44.911 3.817 1.00 0.00 O ATOM 716 CB PRO A 46 29.362 -43.887 6.335 1.00 0.00 C ATOM 717 CG PRO A 46 28.318 -42.799 6.528 1.00 0.00 C ATOM 718 CD PRO A 46 28.384 -41.871 5.326 1.00 0.00 C ATOM 0 HA PRO A 46 30.861 -43.959 4.781 1.00 0.00 H new ATOM 0 HB2 PRO A 46 28.950 -44.869 6.565 1.00 0.00 H new ATOM 0 HB3 PRO A 46 30.212 -43.735 7.000 1.00 0.00 H new ATOM 0 HG2 PRO A 46 27.324 -43.236 6.619 1.00 0.00 H new ATOM 0 HG3 PRO A 46 28.508 -42.246 7.448 1.00 0.00 H new ATOM 0 HD2 PRO A 46 27.414 -41.787 4.837 1.00 0.00 H new ATOM 0 HD3 PRO A 46 28.681 -40.864 5.619 1.00 0.00 H new ATOM 726 N ARG A 47 30.010 -45.768 3.501 1.00 0.00 N ATOM 727 CA ARG A 47 29.551 -46.857 2.655 1.00 0.00 C ATOM 728 C ARG A 47 28.816 -47.906 3.492 1.00 0.00 C ATOM 729 O ARG A 47 29.319 -48.343 4.526 1.00 0.00 O ATOM 730 CB ARG A 47 30.722 -47.522 1.930 1.00 0.00 C ATOM 731 CG ARG A 47 30.520 -47.485 0.414 1.00 0.00 C ATOM 732 CD ARG A 47 31.527 -48.392 -0.296 1.00 0.00 C ATOM 733 NE ARG A 47 30.823 -49.286 -1.244 1.00 0.00 N ATOM 734 CZ ARG A 47 30.087 -50.343 -0.873 1.00 0.00 C ATOM 735 NH1 ARG A 47 29.954 -50.645 0.425 1.00 0.00 N ATOM 736 NH2 ARG A 47 29.484 -51.098 -1.801 1.00 0.00 N ATOM 0 H ARG A 47 31.017 -45.747 3.660 1.00 0.00 H new ATOM 0 HA ARG A 47 28.871 -46.437 1.914 1.00 0.00 H new ATOM 0 HB2 ARG A 47 31.651 -47.014 2.189 1.00 0.00 H new ATOM 0 HB3 ARG A 47 30.821 -48.555 2.262 1.00 0.00 H new ATOM 0 HG2 ARG A 47 29.506 -47.802 0.171 1.00 0.00 H new ATOM 0 HG3 ARG A 47 30.630 -46.462 0.054 1.00 0.00 H new ATOM 0 HD2 ARG A 47 32.260 -47.787 -0.830 1.00 0.00 H new ATOM 0 HD3 ARG A 47 32.075 -48.984 0.437 1.00 0.00 H new ATOM 0 HE ARG A 47 30.903 -49.085 -2.241 1.00 0.00 H new ATOM 0 HH11 ARG A 47 30.413 -50.070 1.132 1.00 0.00 H new ATOM 0 HH12 ARG A 47 29.394 -51.449 0.707 1.00 0.00 H new ATOM 0 HH21 ARG A 47 29.585 -50.868 -2.790 1.00 0.00 H new ATOM 0 HH22 ARG A 47 28.924 -51.902 -1.519 1.00 0.00 H new ATOM 750 N GLY A 48 27.638 -48.280 3.013 1.00 0.00 N ATOM 751 CA GLY A 48 26.829 -49.269 3.704 1.00 0.00 C ATOM 752 C GLY A 48 27.660 -50.504 4.062 1.00 0.00 C ATOM 753 O GLY A 48 28.708 -50.746 3.464 1.00 0.00 O ATOM 0 H GLY A 48 27.225 -47.916 2.155 1.00 0.00 H new ATOM 0 HA2 GLY A 48 26.410 -48.832 4.611 1.00 0.00 H new ATOM 0 HA3 GLY A 48 25.989 -49.562 3.074 1.00 0.00 H new ATOM 757 N PRO A 49 27.149 -51.271 5.062 1.00 0.00 N ATOM 758 CA PRO A 49 27.831 -52.473 5.506 1.00 0.00 C ATOM 759 C PRO A 49 27.654 -53.610 4.497 1.00 0.00 C ATOM 760 O PRO A 49 26.633 -54.295 4.502 1.00 0.00 O ATOM 761 CB PRO A 49 27.230 -52.788 6.866 1.00 0.00 C ATOM 762 CG PRO A 49 25.916 -52.027 6.927 1.00 0.00 C ATOM 763 CD PRO A 49 25.911 -51.014 5.793 1.00 0.00 C ATOM 0 HA PRO A 49 28.910 -52.339 5.583 1.00 0.00 H new ATOM 0 HB2 PRO A 49 27.067 -53.859 6.982 1.00 0.00 H new ATOM 0 HB3 PRO A 49 27.898 -52.479 7.670 1.00 0.00 H new ATOM 0 HG2 PRO A 49 25.073 -52.712 6.831 1.00 0.00 H new ATOM 0 HG3 PRO A 49 25.810 -51.524 7.888 1.00 0.00 H new ATOM 0 HD2 PRO A 49 25.039 -51.141 5.152 1.00 0.00 H new ATOM 0 HD3 PRO A 49 25.880 -49.993 6.174 1.00 0.00 H new ATOM 771 N ARG A 50 28.665 -53.774 3.655 1.00 0.00 N ATOM 772 CA ARG A 50 28.634 -54.815 2.643 1.00 0.00 C ATOM 773 C ARG A 50 27.483 -54.569 1.665 1.00 0.00 C ATOM 774 O ARG A 50 26.395 -54.162 2.070 1.00 0.00 O ATOM 775 CB ARG A 50 28.467 -56.197 3.278 1.00 0.00 C ATOM 776 CG ARG A 50 29.823 -56.882 3.463 1.00 0.00 C ATOM 777 CD ARG A 50 30.568 -56.309 4.669 1.00 0.00 C ATOM 778 NE ARG A 50 31.344 -57.377 5.339 1.00 0.00 N ATOM 779 CZ ARG A 50 30.842 -58.202 6.268 1.00 0.00 C ATOM 780 NH1 ARG A 50 29.560 -58.088 6.643 1.00 0.00 N ATOM 781 NH2 ARG A 50 31.620 -59.142 6.821 1.00 0.00 N ATOM 0 H ARG A 50 29.510 -53.203 3.654 1.00 0.00 H new ATOM 0 HA ARG A 50 29.584 -54.786 2.109 1.00 0.00 H new ATOM 0 HB2 ARG A 50 27.970 -56.100 4.243 1.00 0.00 H new ATOM 0 HB3 ARG A 50 27.826 -56.815 2.649 1.00 0.00 H new ATOM 0 HG2 ARG A 50 29.677 -57.954 3.597 1.00 0.00 H new ATOM 0 HG3 ARG A 50 30.425 -56.752 2.564 1.00 0.00 H new ATOM 0 HD2 ARG A 50 31.236 -55.510 4.348 1.00 0.00 H new ATOM 0 HD3 ARG A 50 29.858 -55.869 5.370 1.00 0.00 H new ATOM 0 HE ARG A 50 32.323 -57.492 5.077 1.00 0.00 H new ATOM 0 HH11 ARG A 50 28.967 -57.373 6.221 1.00 0.00 H new ATOM 0 HH12 ARG A 50 29.178 -58.716 7.350 1.00 0.00 H new ATOM 0 HH21 ARG A 50 32.595 -59.230 6.535 1.00 0.00 H new ATOM 0 HH22 ARG A 50 31.237 -59.770 7.528 1.00 0.00 H new ATOM 795 N PRO A 51 27.770 -54.834 0.362 1.00 0.00 N ATOM 796 CA PRO A 51 26.771 -54.647 -0.677 1.00 0.00 C ATOM 797 C PRO A 51 25.727 -55.765 -0.643 1.00 0.00 C ATOM 798 O PRO A 51 26.062 -56.937 -0.810 1.00 0.00 O ATOM 799 CB PRO A 51 27.558 -54.609 -1.977 1.00 0.00 C ATOM 800 CG PRO A 51 28.907 -55.238 -1.666 1.00 0.00 C ATOM 801 CD PRO A 51 29.046 -55.318 -0.155 1.00 0.00 C ATOM 0 HA PRO A 51 26.196 -53.730 -0.547 1.00 0.00 H new ATOM 0 HB2 PRO A 51 27.042 -55.161 -2.762 1.00 0.00 H new ATOM 0 HB3 PRO A 51 27.677 -53.585 -2.332 1.00 0.00 H new ATOM 0 HG2 PRO A 51 28.976 -56.232 -2.109 1.00 0.00 H new ATOM 0 HG3 PRO A 51 29.714 -54.642 -2.093 1.00 0.00 H new ATOM 0 HD2 PRO A 51 29.243 -56.339 0.171 1.00 0.00 H new ATOM 0 HD3 PRO A 51 29.875 -54.705 0.199 1.00 0.00 H new ATOM 809 N GLN A 52 24.483 -55.364 -0.425 1.00 0.00 N ATOM 810 CA GLN A 52 23.388 -56.317 -0.367 1.00 0.00 C ATOM 811 C GLN A 52 22.160 -55.760 -1.089 1.00 0.00 C ATOM 812 O GLN A 52 21.692 -56.342 -2.066 1.00 0.00 O ATOM 813 CB GLN A 52 23.055 -56.682 1.081 1.00 0.00 C ATOM 814 CG GLN A 52 22.890 -58.194 1.241 1.00 0.00 C ATOM 815 CD GLN A 52 21.774 -58.522 2.234 1.00 0.00 C ATOM 816 OE1 GLN A 52 21.985 -58.641 3.431 1.00 0.00 O ATOM 817 NE2 GLN A 52 20.576 -58.661 1.674 1.00 0.00 N ATOM 0 H GLN A 52 24.209 -54.391 -0.286 1.00 0.00 H new ATOM 0 HA GLN A 52 23.700 -57.230 -0.874 1.00 0.00 H new ATOM 0 HB2 GLN A 52 23.847 -56.327 1.741 1.00 0.00 H new ATOM 0 HB3 GLN A 52 22.137 -56.178 1.385 1.00 0.00 H new ATOM 0 HG2 GLN A 52 22.664 -58.643 0.274 1.00 0.00 H new ATOM 0 HG3 GLN A 52 23.827 -58.631 1.585 1.00 0.00 H new ATOM 0 HE21 GLN A 52 20.468 -58.548 0.666 1.00 0.00 H new ATOM 0 HE22 GLN A 52 19.765 -58.880 2.252 1.00 0.00 H new ATOM 826 N THR A 53 21.673 -54.637 -0.579 1.00 0.00 N ATOM 827 CA THR A 53 20.508 -53.995 -1.165 1.00 0.00 C ATOM 828 C THR A 53 20.834 -52.551 -1.552 1.00 0.00 C ATOM 829 O THR A 53 21.337 -51.783 -0.734 1.00 0.00 O ATOM 830 CB THR A 53 19.354 -54.110 -0.166 1.00 0.00 C ATOM 831 OG1 THR A 53 18.355 -53.238 -0.687 1.00 0.00 O ATOM 832 CG2 THR A 53 19.698 -53.508 1.198 1.00 0.00 C ATOM 0 H THR A 53 22.063 -54.157 0.232 1.00 0.00 H new ATOM 0 HA THR A 53 20.208 -54.487 -2.090 1.00 0.00 H new ATOM 0 HB THR A 53 19.085 -55.159 -0.043 1.00 0.00 H new ATOM 0 HG1 THR A 53 17.570 -53.253 -0.101 1.00 0.00 H new ATOM 0 HG21 THR A 53 18.846 -53.616 1.869 1.00 0.00 H new ATOM 0 HG22 THR A 53 20.559 -54.028 1.619 1.00 0.00 H new ATOM 0 HG23 THR A 53 19.935 -52.451 1.080 1.00 0.00 H new ATOM 840 N SER A 54 20.534 -52.227 -2.802 1.00 0.00 N ATOM 841 CA SER A 54 20.789 -50.889 -3.309 1.00 0.00 C ATOM 842 C SER A 54 19.477 -50.108 -3.406 1.00 0.00 C ATOM 843 O SER A 54 18.492 -50.607 -3.948 1.00 0.00 O ATOM 844 CB SER A 54 21.479 -50.939 -4.673 1.00 0.00 C ATOM 845 OG SER A 54 20.633 -51.490 -5.680 1.00 0.00 O ATOM 0 H SER A 54 20.117 -52.867 -3.478 1.00 0.00 H new ATOM 0 HA SER A 54 21.457 -50.381 -2.613 1.00 0.00 H new ATOM 0 HB2 SER A 54 21.781 -49.933 -4.964 1.00 0.00 H new ATOM 0 HB3 SER A 54 22.388 -51.535 -4.598 1.00 0.00 H new ATOM 0 HG SER A 54 21.109 -51.503 -6.536 1.00 0.00 H new ATOM 851 N LEU A 55 19.506 -48.895 -2.874 1.00 0.00 N ATOM 852 CA LEU A 55 18.332 -48.040 -2.894 1.00 0.00 C ATOM 853 C LEU A 55 18.408 -47.106 -4.103 1.00 0.00 C ATOM 854 O LEU A 55 19.463 -46.545 -4.393 1.00 0.00 O ATOM 855 CB LEU A 55 18.180 -47.307 -1.559 1.00 0.00 C ATOM 856 CG LEU A 55 17.211 -46.122 -1.551 1.00 0.00 C ATOM 857 CD1 LEU A 55 15.798 -46.572 -1.176 1.00 0.00 C ATOM 858 CD2 LEU A 55 17.719 -45.005 -0.638 1.00 0.00 C ATOM 0 H LEU A 55 20.325 -48.484 -2.426 1.00 0.00 H new ATOM 0 HA LEU A 55 17.427 -48.637 -3.008 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.851 -48.025 -0.808 1.00 0.00 H new ATOM 0 HB3 LEU A 55 19.162 -46.950 -1.249 1.00 0.00 H new ATOM 0 HG LEU A 55 17.161 -45.714 -2.561 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.129 -45.711 -1.178 1.00 0.00 H new ATOM 0 HD12 LEU A 55 15.446 -47.306 -1.900 1.00 0.00 H new ATOM 0 HD13 LEU A 55 15.810 -47.020 -0.182 1.00 0.00 H new ATOM 0 HD21 LEU A 55 17.012 -44.175 -0.650 1.00 0.00 H new ATOM 0 HD22 LEU A 55 17.817 -45.383 0.380 1.00 0.00 H new ATOM 0 HD23 LEU A 55 18.690 -44.659 -0.992 1.00 0.00 H new ATOM 870 N LEU A 56 17.274 -46.969 -4.776 1.00 0.00 N ATOM 871 CA LEU A 56 17.199 -46.112 -5.947 1.00 0.00 C ATOM 872 C LEU A 56 16.761 -44.709 -5.521 1.00 0.00 C ATOM 873 O LEU A 56 17.475 -44.029 -4.786 1.00 0.00 O ATOM 874 CB LEU A 56 16.297 -46.739 -7.012 1.00 0.00 C ATOM 875 CG LEU A 56 16.898 -46.857 -8.415 1.00 0.00 C ATOM 876 CD1 LEU A 56 17.231 -45.477 -8.985 1.00 0.00 C ATOM 877 CD2 LEU A 56 18.114 -47.785 -8.415 1.00 0.00 C ATOM 0 H LEU A 56 16.401 -47.437 -4.533 1.00 0.00 H new ATOM 0 HA LEU A 56 18.181 -46.013 -6.410 1.00 0.00 H new ATOM 0 HB2 LEU A 56 16.010 -47.735 -6.676 1.00 0.00 H new ATOM 0 HB3 LEU A 56 15.383 -46.149 -7.078 1.00 0.00 H new ATOM 0 HG LEU A 56 16.151 -47.306 -9.070 1.00 0.00 H new ATOM 0 HD11 LEU A 56 17.657 -45.588 -9.982 1.00 0.00 H new ATOM 0 HD12 LEU A 56 16.322 -44.878 -9.043 1.00 0.00 H new ATOM 0 HD13 LEU A 56 17.952 -44.980 -8.336 1.00 0.00 H new ATOM 0 HD21 LEU A 56 18.521 -47.851 -9.424 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.874 -47.389 -7.742 1.00 0.00 H new ATOM 0 HD23 LEU A 56 17.814 -48.778 -8.079 1.00 0.00 H new TER 889 LEU A 56 ATOM 890 P A B 493 21.077 -32.844 -4.910 1.00 0.00 P ATOM 891 OP1 A B 493 20.267 -32.819 -6.149 1.00 0.00 O ATOM 892 OP2 A B 493 22.108 -33.898 -4.789 1.00 0.00 O ATOM 893 O5' A B 493 21.801 -31.424 -4.764 1.00 0.00 O ATOM 894 C5' A B 493 21.069 -30.294 -4.296 1.00 0.00 C ATOM 895 C4' A B 493 22.005 -29.298 -3.651 1.00 0.00 C ATOM 896 O4' A B 493 22.514 -30.003 -2.503 1.00 0.00 O ATOM 897 C3' A B 493 23.352 -29.152 -4.353 1.00 0.00 C ATOM 898 O3' A B 493 23.276 -28.094 -5.306 1.00 0.00 O ATOM 899 C2' A B 493 24.338 -28.844 -3.262 1.00 0.00 C ATOM 900 O2' A B 493 24.096 -27.479 -3.003 1.00 0.00 O ATOM 901 C1' A B 493 23.872 -29.809 -2.176 1.00 0.00 C ATOM 902 N9 A B 493 24.608 -31.091 -2.173 1.00 0.00 N ATOM 903 C8 A B 493 24.725 -31.972 -3.187 1.00 0.00 C ATOM 904 N7 A B 493 25.456 -33.034 -2.864 1.00 0.00 N ATOM 905 C5 A B 493 25.819 -32.799 -1.564 1.00 0.00 C ATOM 906 C6 A B 493 26.596 -33.552 -0.660 1.00 0.00 C ATOM 907 N6 A B 493 27.171 -34.749 -0.951 1.00 0.00 N ATOM 908 N1 A B 493 26.779 -33.040 0.587 1.00 0.00 N ATOM 909 C2 A B 493 26.211 -31.850 0.885 1.00 0.00 C ATOM 910 N3 A B 493 25.457 -31.051 0.108 1.00 0.00 N ATOM 911 C4 A B 493 25.311 -31.619 -1.122 1.00 0.00 C ATOM 0 H5' A B 493 20.314 -30.613 -3.578 1.00 0.00 H new ATOM 0 H5'' A B 493 20.541 -29.824 -5.126 1.00 0.00 H new ATOM 0 H4' A B 493 21.455 -28.360 -3.571 1.00 0.00 H new ATOM 0 H3' A B 493 23.647 -30.049 -4.898 1.00 0.00 H new ATOM 0 H2' A B 493 25.409 -28.967 -3.422 1.00 0.00 H new ATOM 0 HO2' A B 493 23.705 -27.059 -3.798 1.00 0.00 H new ATOM 0 H1' A B 493 24.042 -29.413 -1.175 1.00 0.00 H new ATOM 0 H8 A B 493 24.273 -31.830 -4.158 1.00 0.00 H new ATOM 0 H61 A B 493 27.721 -35.236 -0.243 1.00 0.00 H new ATOM 0 H62 A B 493 27.053 -35.160 -1.877 1.00 0.00 H new ATOM 0 H2 A B 493 26.387 -31.490 1.888 1.00 0.00 H new ATOM 923 P A B 494 23.074 -28.428 -6.858 1.00 0.00 P ATOM 924 OP1 A B 494 22.018 -27.556 -7.422 1.00 0.00 O ATOM 925 OP2 A B 494 22.921 -29.889 -7.038 1.00 0.00 O ATOM 926 O5' A B 494 24.471 -27.992 -7.506 1.00 0.00 O ATOM 927 C5' A B 494 24.832 -28.460 -8.803 1.00 0.00 C ATOM 928 C4' A B 494 26.017 -29.394 -8.709 1.00 0.00 C ATOM 929 O4' A B 494 26.791 -28.849 -7.625 1.00 0.00 O ATOM 930 C3' A B 494 25.750 -30.673 -7.922 1.00 0.00 C ATOM 931 O3' A B 494 25.178 -31.651 -8.786 1.00 0.00 O ATOM 932 C2' A B 494 27.094 -31.109 -7.407 1.00 0.00 C ATOM 933 O2' A B 494 27.635 -31.806 -8.506 1.00 0.00 O ATOM 934 C1' A B 494 27.736 -29.759 -7.105 1.00 0.00 C ATOM 935 N9 A B 494 27.967 -29.523 -5.665 1.00 0.00 N ATOM 936 C8 A B 494 27.311 -30.084 -4.627 1.00 0.00 C ATOM 937 N7 A B 494 27.758 -29.663 -3.449 1.00 0.00 N ATOM 938 C5 A B 494 28.755 -28.783 -3.772 1.00 0.00 C ATOM 939 C6 A B 494 29.613 -28.004 -2.966 1.00 0.00 C ATOM 940 N6 A B 494 29.592 -27.994 -1.608 1.00 0.00 N ATOM 941 N1 A B 494 30.519 -27.211 -3.599 1.00 0.00 N ATOM 942 C2 A B 494 30.547 -27.216 -4.951 1.00 0.00 C ATOM 943 N3 A B 494 29.784 -27.912 -5.813 1.00 0.00 N ATOM 944 C4 A B 494 28.900 -28.682 -5.120 1.00 0.00 C ATOM 0 H5' A B 494 25.075 -27.616 -9.448 1.00 0.00 H new ATOM 0 H5'' A B 494 23.988 -28.977 -9.259 1.00 0.00 H new ATOM 0 H4' A B 494 26.373 -29.528 -9.730 1.00 0.00 H new ATOM 0 H3' A B 494 25.048 -30.528 -7.101 1.00 0.00 H new ATOM 0 H2' A B 494 27.178 -31.753 -6.532 1.00 0.00 H new ATOM 0 HO2' A B 494 28.358 -32.392 -8.198 1.00 0.00 H new ATOM 0 H1' A B 494 28.732 -29.673 -7.540 1.00 0.00 H new ATOM 0 H8 A B 494 26.509 -30.798 -4.742 1.00 0.00 H new ATOM 0 H61 A B 494 30.245 -27.404 -1.092 1.00 0.00 H new ATOM 0 H62 A B 494 28.924 -28.577 -1.104 1.00 0.00 H new ATOM 0 H2 A B 494 31.286 -26.570 -5.402 1.00 0.00 H new ATOM 956 P C B 495 24.934 -33.142 -8.258 1.00 0.00 P ATOM 957 OP1 C B 495 23.530 -33.537 -8.510 1.00 0.00 O ATOM 958 OP2 C B 495 25.441 -33.269 -6.873 1.00 0.00 O ATOM 959 O5' C B 495 25.873 -34.020 -9.210 1.00 0.00 O ATOM 960 C5' C B 495 26.336 -33.482 -10.447 1.00 0.00 C ATOM 961 C4' C B 495 27.557 -34.239 -10.919 1.00 0.00 C ATOM 962 O4' C B 495 28.451 -34.482 -9.819 1.00 0.00 O ATOM 963 C3' C B 495 27.296 -35.703 -11.263 1.00 0.00 C ATOM 964 O3' C B 495 26.854 -35.800 -12.616 1.00 0.00 O ATOM 965 C2' C B 495 28.614 -36.399 -11.063 1.00 0.00 C ATOM 966 O2' C B 495 29.331 -36.047 -12.225 1.00 0.00 O ATOM 967 C1' C B 495 29.091 -35.737 -9.773 1.00 0.00 C ATOM 968 N1 C B 495 28.715 -36.484 -8.554 1.00 0.00 N ATOM 969 C2 C B 495 29.366 -37.692 -8.308 1.00 0.00 C ATOM 970 O2 C B 495 30.219 -38.079 -9.113 1.00 0.00 O ATOM 971 N3 C B 495 29.041 -38.390 -7.204 1.00 0.00 N ATOM 972 C4 C B 495 28.128 -37.961 -6.356 1.00 0.00 C ATOM 973 N4 C B 495 27.821 -38.664 -5.273 1.00 0.00 N ATOM 974 C5 C B 495 27.440 -36.712 -6.587 1.00 0.00 C ATOM 975 C6 C B 495 27.774 -36.029 -7.692 1.00 0.00 C ATOM 0 H5' C B 495 26.578 -32.426 -10.325 1.00 0.00 H new ATOM 0 H5'' C B 495 25.548 -33.544 -11.197 1.00 0.00 H new ATOM 0 H4' C B 495 27.905 -33.626 -11.750 1.00 0.00 H new ATOM 0 H3' C B 495 26.521 -36.153 -10.643 1.00 0.00 H new ATOM 0 H2' C B 495 28.666 -37.483 -10.957 1.00 0.00 H new ATOM 0 HO2' C B 495 28.737 -36.095 -13.003 1.00 0.00 H new ATOM 0 H1' C B 495 30.178 -35.685 -9.716 1.00 0.00 H new ATOM 0 H41 C B 495 27.112 -38.320 -4.625 1.00 0.00 H new ATOM 0 H42 C B 495 28.294 -39.549 -5.088 1.00 0.00 H new ATOM 0 H5 C B 495 26.691 -36.345 -5.901 1.00 0.00 H new ATOM 0 H6 C B 495 27.280 -35.092 -7.900 1.00 0.00 H new ATOM 987 P A B 496 25.289 -35.857 -12.942 1.00 0.00 P ATOM 988 OP1 A B 496 24.511 -35.678 -11.695 1.00 0.00 O ATOM 989 OP2 A B 496 24.994 -37.053 -13.765 1.00 0.00 O ATOM 990 O5' A B 496 25.064 -34.562 -13.854 1.00 0.00 O ATOM 991 C5' A B 496 24.493 -34.695 -15.155 1.00 0.00 C ATOM 992 C4' A B 496 25.382 -34.036 -16.183 1.00 0.00 C ATOM 993 O4' A B 496 25.372 -32.640 -15.834 1.00 0.00 O ATOM 994 C3' A B 496 26.874 -34.280 -15.977 1.00 0.00 C ATOM 995 O3' A B 496 27.283 -35.405 -16.755 1.00 0.00 O ATOM 996 C2' A B 496 27.551 -33.019 -16.433 1.00 0.00 C ATOM 997 O2' A B 496 27.527 -33.144 -17.838 1.00 0.00 O ATOM 998 C1' A B 496 26.610 -31.966 -15.853 1.00 0.00 C ATOM 999 N9 A B 496 26.994 -31.516 -14.498 1.00 0.00 N ATOM 1000 C8 A B 496 27.047 -32.258 -13.372 1.00 0.00 C ATOM 1001 N7 A B 496 27.431 -31.553 -12.313 1.00 0.00 N ATOM 1002 C5 A B 496 27.630 -30.293 -12.809 1.00 0.00 C ATOM 1003 C6 A B 496 28.042 -29.096 -12.186 1.00 0.00 C ATOM 1004 N6 A B 496 28.339 -28.980 -10.865 1.00 0.00 N ATOM 1005 N1 A B 496 28.147 -27.987 -12.966 1.00 0.00 N ATOM 1006 C2 A B 496 27.853 -28.094 -14.282 1.00 0.00 C ATOM 1007 N3 A B 496 27.454 -29.175 -14.977 1.00 0.00 N ATOM 1008 C4 A B 496 27.369 -30.247 -14.143 1.00 0.00 C ATOM 0 H5' A B 496 23.503 -34.240 -15.174 1.00 0.00 H new ATOM 0 H5'' A B 496 24.364 -35.750 -15.398 1.00 0.00 H new ATOM 0 H4' A B 496 25.030 -34.380 -17.156 1.00 0.00 H new ATOM 0 H3' A B 496 27.128 -34.503 -14.941 1.00 0.00 H new ATOM 0 H2' A B 496 28.576 -32.794 -16.138 1.00 0.00 H new ATOM 0 HO2' A B 496 27.550 -34.093 -18.082 1.00 0.00 H new ATOM 0 H1' A B 496 26.612 -31.047 -16.439 1.00 0.00 H new ATOM 0 H8 A B 496 26.804 -33.310 -13.336 1.00 0.00 H new ATOM 0 H61 A B 496 28.631 -28.080 -10.485 1.00 0.00 H new ATOM 0 H62 A B 496 28.270 -29.793 -10.253 1.00 0.00 H new ATOM 0 H2 A B 496 27.952 -27.184 -14.855 1.00 0.00 H new ATOM 1020 P G B 497 27.219 -36.876 -16.130 1.00 0.00 P ATOM 1021 OP1 G B 497 25.807 -37.305 -16.008 1.00 0.00 O ATOM 1022 OP2 G B 497 28.058 -36.937 -14.912 1.00 0.00 O ATOM 1023 O5' G B 497 27.914 -37.775 -17.256 1.00 0.00 O ATOM 1024 C5' G B 497 27.562 -37.601 -18.626 1.00 0.00 C ATOM 1025 C4' G B 497 28.807 -37.419 -19.465 1.00 0.00 C ATOM 1026 O4' G B 497 29.339 -36.157 -18.998 1.00 0.00 O ATOM 1027 C3' G B 497 29.993 -38.275 -19.025 1.00 0.00 C ATOM 1028 O3' G B 497 30.005 -39.489 -19.772 1.00 0.00 O ATOM 1029 C2' G B 497 31.211 -37.440 -19.308 1.00 0.00 C ATOM 1030 O2' G B 497 31.361 -37.574 -20.703 1.00 0.00 O ATOM 1031 C1' G B 497 30.736 -36.072 -18.827 1.00 0.00 C ATOM 1032 N9 G B 497 31.084 -35.787 -17.419 1.00 0.00 N ATOM 1033 C8 G B 497 30.582 -36.379 -16.316 1.00 0.00 C ATOM 1034 N7 G B 497 31.105 -35.896 -15.193 1.00 0.00 N ATOM 1035 C5 G B 497 31.988 -34.944 -15.624 1.00 0.00 C ATOM 1036 C6 G B 497 32.851 -34.080 -14.916 1.00 0.00 C ATOM 1037 O6 G B 497 32.964 -34.031 -13.693 1.00 0.00 O ATOM 1038 N1 G B 497 33.622 -33.229 -15.647 1.00 0.00 N ATOM 1039 C2 G B 497 33.517 -33.259 -16.994 1.00 0.00 C ATOM 1040 N2 G B 497 34.331 -32.372 -17.562 1.00 0.00 N ATOM 1041 N3 G B 497 32.736 -34.035 -17.769 1.00 0.00 N ATOM 1042 C4 G B 497 31.992 -34.860 -16.980 1.00 0.00 C ATOM 0 H5' G B 497 26.911 -36.733 -18.735 1.00 0.00 H new ATOM 0 H5'' G B 497 27.001 -38.467 -18.978 1.00 0.00 H new ATOM 0 H4' G B 497 28.521 -37.589 -20.503 1.00 0.00 H new ATOM 0 H3' G B 497 29.949 -38.553 -17.972 1.00 0.00 H new ATOM 0 H2' G B 497 32.171 -37.673 -18.848 1.00 0.00 H new ATOM 0 HO2' G B 497 30.973 -38.426 -20.993 1.00 0.00 H new ATOM 0 H1' G B 497 31.209 -35.258 -19.377 1.00 0.00 H new ATOM 0 H8 G B 497 29.837 -37.160 -16.342 1.00 0.00 H new ATOM 0 H1 G B 497 34.265 -32.583 -15.188 1.00 0.00 H new ATOM 0 H21 G B 497 34.359 -32.283 -18.578 1.00 0.00 H new ATOM 0 H22 G B 497 34.927 -31.782 -16.981 1.00 0.00 H new ATOM 1054 P U B 498 30.855 -40.740 -19.252 1.00 0.00 P ATOM 1055 OP1 U B 498 29.948 -41.873 -18.961 1.00 0.00 O ATOM 1056 OP2 U B 498 31.774 -40.306 -18.176 1.00 0.00 O ATOM 1057 O5' U B 498 31.738 -41.130 -20.528 1.00 0.00 O ATOM 1058 C5' U B 498 31.101 -41.498 -21.751 1.00 0.00 C ATOM 1059 C4' U B 498 31.988 -42.438 -22.537 1.00 0.00 C ATOM 1060 O4' U B 498 33.313 -41.868 -22.361 1.00 0.00 O ATOM 1061 C3' U B 498 32.343 -43.729 -21.804 1.00 0.00 C ATOM 1062 O3' U B 498 31.349 -44.725 -22.092 1.00 0.00 O ATOM 1063 C2' U B 498 33.693 -44.127 -22.333 1.00 0.00 C ATOM 1064 O2' U B 498 33.383 -44.679 -23.592 1.00 0.00 O ATOM 1065 C1' U B 498 34.394 -42.772 -22.367 1.00 0.00 C ATOM 1066 N1 U B 498 35.289 -42.542 -21.213 1.00 0.00 N ATOM 1067 C2 U B 498 36.624 -42.528 -21.478 1.00 0.00 C ATOM 1068 O2 U B 498 37.095 -42.690 -22.593 1.00 0.00 O ATOM 1069 N3 U B 498 37.459 -42.314 -20.404 1.00 0.00 N ATOM 1070 C4 U B 498 37.012 -42.121 -19.121 1.00 0.00 C ATOM 1071 O4 U B 498 37.850 -41.939 -18.240 1.00 0.00 O ATOM 1072 C5 U B 498 35.610 -42.146 -18.900 1.00 0.00 C ATOM 1073 C6 U B 498 34.819 -42.355 -19.955 1.00 0.00 C ATOM 0 H5' U B 498 30.888 -40.607 -22.342 1.00 0.00 H new ATOM 0 H5'' U B 498 30.145 -41.977 -21.542 1.00 0.00 H new ATOM 0 H4' U B 498 31.507 -42.583 -23.504 1.00 0.00 H new ATOM 0 H3' U B 498 32.371 -43.611 -20.721 1.00 0.00 H new ATOM 0 H2' U B 498 34.315 -44.846 -21.800 1.00 0.00 H new ATOM 0 HO2' U B 498 32.493 -45.089 -23.560 1.00 0.00 H new ATOM 0 HO3' U B 498 31.574 -45.556 -21.625 1.00 0.00 H new ATOM 0 H1' U B 498 35.056 -42.675 -23.227 1.00 0.00 H new ATOM 0 H3 U B 498 38.465 -42.298 -20.571 1.00 0.00 H new ATOM 0 H5 U B 498 35.197 -42.001 -17.912 1.00 0.00 H new ATOM 0 H6 U B 498 33.751 -42.376 -19.798 1.00 0.00 H new TER 1084 U B 498 HETATM 1085 ZN ZN A 57 36.311 -32.139 -8.494 1.00 0.00 ZN