USER MOD reduce.3.24.130724 H: found=0, std=0, add=512, rem=0, adj=18 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+ 141:sc= 0.0496 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= -2.8! C(o=-2.8!,f=-4.4!) USER MOD Single : A 12 GLN : amide:sc=-0.00802 X(o=-0.008,f=-0.049) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= -0.163 K(o=-0.16,f=-0.94) USER MOD Single : A 25 GLN : amide:sc= -0.485 X(o=-0.49,f=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.00866) USER MOD Single : A 32 LYS NZ :NH3+ -138:sc= 0.148 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ -172:sc= -0.0226 (180deg=-0.145) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ -140:sc= -0.577! (180deg=-3.62!) USER MOD Single : A 52 GLN : amide:sc= -0.567 K(o=-0.57,f=-1.8!) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.529 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : B 493 A O2' : rot -24:sc= 0.425 USER MOD Single : B 494 A O2' : rot 131:sc= -0.779! USER MOD Single : B 495 C O2' : rot -32:sc= 0.495 USER MOD Single : B 496 A O2' : rot -23:sc= 0.58 USER MOD Single : B 497 G O2' : rot -22:sc= -0.95! USER MOD Single : B 498 U O2' : rot -24:sc= 0.542 USER MOD Single : B 498 U O3' : rot 180:sc= 0.344 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 33.308 -62.511 -14.973 1.00 0.00 N ATOM 2 CA ALA A 1 32.081 -62.007 -14.381 1.00 0.00 C ATOM 3 C ALA A 1 31.217 -61.372 -15.472 1.00 0.00 C ATOM 4 O ALA A 1 31.737 -60.754 -16.399 1.00 0.00 O ATOM 5 CB ALA A 1 32.421 -61.023 -13.259 1.00 0.00 C ATOM 0 H1 ALA A 1 34.104 -62.330 -14.329 1.00 0.00 H new ATOM 0 H2 ALA A 1 33.220 -63.534 -15.135 1.00 0.00 H new ATOM 0 H3 ALA A 1 33.479 -62.030 -15.879 1.00 0.00 H new ATOM 0 HA ALA A 1 31.507 -62.820 -13.937 1.00 0.00 H new ATOM 0 HB1 ALA A 1 31.500 -60.645 -12.815 1.00 0.00 H new ATOM 0 HB2 ALA A 1 33.010 -61.531 -12.495 1.00 0.00 H new ATOM 0 HB3 ALA A 1 32.995 -60.191 -13.666 1.00 0.00 H new ATOM 11 N THR A 2 29.911 -61.546 -15.326 1.00 0.00 N ATOM 12 CA THR A 2 28.970 -60.997 -16.287 1.00 0.00 C ATOM 13 C THR A 2 27.563 -60.948 -15.689 1.00 0.00 C ATOM 14 O THR A 2 27.134 -61.892 -15.026 1.00 0.00 O ATOM 15 CB THR A 2 29.058 -61.835 -17.564 1.00 0.00 C ATOM 16 OG1 THR A 2 28.209 -61.154 -18.484 1.00 0.00 O ATOM 17 CG2 THR A 2 28.410 -63.212 -17.407 1.00 0.00 C ATOM 0 H THR A 2 29.483 -62.060 -14.556 1.00 0.00 H new ATOM 0 HA THR A 2 29.218 -59.966 -16.538 1.00 0.00 H new ATOM 0 HB THR A 2 30.103 -61.957 -17.847 1.00 0.00 H new ATOM 0 HG1 THR A 2 28.208 -61.629 -19.341 1.00 0.00 H new ATOM 0 HG21 THR A 2 28.500 -63.765 -18.342 1.00 0.00 H new ATOM 0 HG22 THR A 2 28.911 -63.761 -16.610 1.00 0.00 H new ATOM 0 HG23 THR A 2 27.356 -63.092 -17.157 1.00 0.00 H new ATOM 25 N VAL A 3 26.885 -59.839 -15.943 1.00 0.00 N ATOM 26 CA VAL A 3 25.535 -59.655 -15.437 1.00 0.00 C ATOM 27 C VAL A 3 24.919 -58.412 -16.083 1.00 0.00 C ATOM 28 O VAL A 3 25.575 -57.378 -16.198 1.00 0.00 O ATOM 29 CB VAL A 3 25.554 -59.587 -13.908 1.00 0.00 C ATOM 30 CG1 VAL A 3 26.322 -58.356 -13.423 1.00 0.00 C ATOM 31 CG2 VAL A 3 24.133 -59.607 -13.341 1.00 0.00 C ATOM 0 H VAL A 3 27.245 -59.059 -16.492 1.00 0.00 H new ATOM 0 HA VAL A 3 24.907 -60.505 -15.703 1.00 0.00 H new ATOM 0 HB VAL A 3 26.074 -60.471 -13.539 1.00 0.00 H new ATOM 0 HG11 VAL A 3 26.320 -58.332 -12.333 1.00 0.00 H new ATOM 0 HG12 VAL A 3 27.350 -58.403 -13.783 1.00 0.00 H new ATOM 0 HG13 VAL A 3 25.844 -57.455 -13.807 1.00 0.00 H new ATOM 0 HG21 VAL A 3 24.175 -59.558 -12.253 1.00 0.00 H new ATOM 0 HG22 VAL A 3 23.577 -58.750 -13.722 1.00 0.00 H new ATOM 0 HG23 VAL A 3 23.633 -60.527 -13.644 1.00 0.00 H new ATOM 41 N VAL A 4 23.665 -58.555 -16.486 1.00 0.00 N ATOM 42 CA VAL A 4 22.953 -57.456 -17.117 1.00 0.00 C ATOM 43 C VAL A 4 21.535 -57.378 -16.545 1.00 0.00 C ATOM 44 O VAL A 4 20.770 -58.336 -16.639 1.00 0.00 O ATOM 45 CB VAL A 4 22.975 -57.623 -18.637 1.00 0.00 C ATOM 46 CG1 VAL A 4 22.130 -58.823 -19.069 1.00 0.00 C ATOM 47 CG2 VAL A 4 22.511 -56.344 -19.336 1.00 0.00 C ATOM 0 H VAL A 4 23.124 -59.414 -16.388 1.00 0.00 H new ATOM 0 HA VAL A 4 23.444 -56.508 -16.900 1.00 0.00 H new ATOM 0 HB VAL A 4 24.005 -57.814 -18.938 1.00 0.00 H new ATOM 0 HG11 VAL A 4 22.163 -58.919 -20.154 1.00 0.00 H new ATOM 0 HG12 VAL A 4 22.526 -59.730 -18.612 1.00 0.00 H new ATOM 0 HG13 VAL A 4 21.099 -58.676 -18.749 1.00 0.00 H new ATOM 0 HG21 VAL A 4 22.536 -56.490 -20.416 1.00 0.00 H new ATOM 0 HG22 VAL A 4 21.493 -56.108 -19.025 1.00 0.00 H new ATOM 0 HG23 VAL A 4 23.173 -55.521 -19.066 1.00 0.00 H new ATOM 57 N SER A 5 21.230 -56.228 -15.963 1.00 0.00 N ATOM 58 CA SER A 5 19.918 -56.012 -15.375 1.00 0.00 C ATOM 59 C SER A 5 19.074 -55.124 -16.292 1.00 0.00 C ATOM 60 O SER A 5 19.612 -54.388 -17.118 1.00 0.00 O ATOM 61 CB SER A 5 20.033 -55.382 -13.987 1.00 0.00 C ATOM 62 OG SER A 5 20.642 -54.094 -14.032 1.00 0.00 O ATOM 0 H SER A 5 21.868 -55.436 -15.886 1.00 0.00 H new ATOM 0 HA SER A 5 19.429 -56.980 -15.265 1.00 0.00 H new ATOM 0 HB2 SER A 5 19.041 -55.298 -13.544 1.00 0.00 H new ATOM 0 HB3 SER A 5 20.617 -56.036 -13.340 1.00 0.00 H new ATOM 0 HG SER A 5 20.695 -53.725 -13.126 1.00 0.00 H new ATOM 68 N GLY A 6 17.764 -55.222 -16.116 1.00 0.00 N ATOM 69 CA GLY A 6 16.840 -54.437 -16.918 1.00 0.00 C ATOM 70 C GLY A 6 16.960 -52.947 -16.588 1.00 0.00 C ATOM 71 O GLY A 6 17.844 -52.543 -15.836 1.00 0.00 O ATOM 0 H GLY A 6 17.321 -55.833 -15.430 1.00 0.00 H new ATOM 0 HA2 GLY A 6 17.045 -54.597 -17.977 1.00 0.00 H new ATOM 0 HA3 GLY A 6 15.819 -54.773 -16.737 1.00 0.00 H new ATOM 75 N GLN A 7 16.056 -52.171 -17.170 1.00 0.00 N ATOM 76 CA GLN A 7 16.048 -50.736 -16.949 1.00 0.00 C ATOM 77 C GLN A 7 14.629 -50.183 -17.103 1.00 0.00 C ATOM 78 O GLN A 7 13.749 -50.860 -17.630 1.00 0.00 O ATOM 79 CB GLN A 7 17.018 -50.029 -17.896 1.00 0.00 C ATOM 80 CG GLN A 7 18.453 -50.107 -17.371 1.00 0.00 C ATOM 81 CD GLN A 7 19.402 -49.282 -18.244 1.00 0.00 C ATOM 82 OE1 GLN A 7 19.002 -48.620 -19.187 1.00 0.00 O ATOM 83 NE2 GLN A 7 20.678 -49.359 -17.876 1.00 0.00 N ATOM 0 H GLN A 7 15.324 -52.510 -17.794 1.00 0.00 H new ATOM 0 HA GLN A 7 16.383 -50.544 -15.930 1.00 0.00 H new ATOM 0 HB2 GLN A 7 16.964 -50.485 -18.885 1.00 0.00 H new ATOM 0 HB3 GLN A 7 16.725 -48.985 -18.010 1.00 0.00 H new ATOM 0 HG2 GLN A 7 18.489 -49.743 -16.344 1.00 0.00 H new ATOM 0 HG3 GLN A 7 18.781 -51.146 -17.352 1.00 0.00 H new ATOM 0 HE21 GLN A 7 20.944 -49.933 -17.076 1.00 0.00 H new ATOM 0 HE22 GLN A 7 21.390 -48.844 -18.394 1.00 0.00 H new ATOM 92 N LYS A 8 14.452 -48.957 -16.633 1.00 0.00 N ATOM 93 CA LYS A 8 13.157 -48.304 -16.713 1.00 0.00 C ATOM 94 C LYS A 8 13.313 -46.950 -17.406 1.00 0.00 C ATOM 95 O LYS A 8 14.327 -46.273 -17.234 1.00 0.00 O ATOM 96 CB LYS A 8 12.517 -48.214 -15.326 1.00 0.00 C ATOM 97 CG LYS A 8 11.311 -49.150 -15.215 1.00 0.00 C ATOM 98 CD LYS A 8 10.229 -48.547 -14.318 1.00 0.00 C ATOM 99 CE LYS A 8 10.098 -49.335 -13.013 1.00 0.00 C ATOM 100 NZ LYS A 8 11.051 -48.826 -12.003 1.00 0.00 N ATOM 0 H LYS A 8 15.185 -48.399 -16.195 1.00 0.00 H new ATOM 0 HA LYS A 8 12.470 -48.895 -17.320 1.00 0.00 H new ATOM 0 HB2 LYS A 8 13.253 -48.472 -14.565 1.00 0.00 H new ATOM 0 HB3 LYS A 8 12.204 -47.188 -15.132 1.00 0.00 H new ATOM 0 HG2 LYS A 8 10.901 -49.340 -16.207 1.00 0.00 H new ATOM 0 HG3 LYS A 8 11.628 -50.112 -14.812 1.00 0.00 H new ATOM 0 HD2 LYS A 8 10.472 -47.508 -14.097 1.00 0.00 H new ATOM 0 HD3 LYS A 8 9.274 -48.546 -14.844 1.00 0.00 H new ATOM 0 HE2 LYS A 8 9.079 -49.255 -12.633 1.00 0.00 H new ATOM 0 HE3 LYS A 8 10.286 -50.392 -13.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 10.949 -49.372 -11.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 12.022 -48.925 -12.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 10.853 -47.823 -11.813 1.00 0.00 H new ATOM 114 N GLN A 9 12.296 -46.595 -18.178 1.00 0.00 N ATOM 115 CA GLN A 9 12.309 -45.334 -18.899 1.00 0.00 C ATOM 116 C GLN A 9 11.091 -44.490 -18.513 1.00 0.00 C ATOM 117 O GLN A 9 10.183 -44.975 -17.842 1.00 0.00 O ATOM 118 CB GLN A 9 12.358 -45.566 -20.410 1.00 0.00 C ATOM 119 CG GLN A 9 11.081 -46.250 -20.901 1.00 0.00 C ATOM 120 CD GLN A 9 10.002 -45.220 -21.238 1.00 0.00 C ATOM 121 OE1 GLN A 9 9.231 -44.792 -20.396 1.00 0.00 O ATOM 122 NE2 GLN A 9 9.990 -44.846 -22.514 1.00 0.00 N ATOM 0 H GLN A 9 11.458 -47.159 -18.320 1.00 0.00 H new ATOM 0 HA GLN A 9 13.210 -44.787 -18.620 1.00 0.00 H new ATOM 0 HB2 GLN A 9 12.485 -44.613 -20.924 1.00 0.00 H new ATOM 0 HB3 GLN A 9 13.223 -46.181 -20.659 1.00 0.00 H new ATOM 0 HG2 GLN A 9 11.302 -46.852 -21.783 1.00 0.00 H new ATOM 0 HG3 GLN A 9 10.712 -46.931 -20.135 1.00 0.00 H new ATOM 0 HE21 GLN A 9 10.664 -45.243 -23.168 1.00 0.00 H new ATOM 0 HE22 GLN A 9 9.307 -44.162 -22.838 1.00 0.00 H new ATOM 131 N ASP A 10 11.113 -43.241 -18.955 1.00 0.00 N ATOM 132 CA ASP A 10 10.023 -42.325 -18.665 1.00 0.00 C ATOM 133 C ASP A 10 10.350 -40.949 -19.247 1.00 0.00 C ATOM 134 O ASP A 10 11.484 -40.695 -19.651 1.00 0.00 O ATOM 135 CB ASP A 10 9.825 -42.165 -17.157 1.00 0.00 C ATOM 136 CG ASP A 10 11.080 -41.769 -16.378 1.00 0.00 C ATOM 137 OD1 ASP A 10 11.559 -40.638 -16.611 1.00 0.00 O ATOM 138 OD2 ASP A 10 11.532 -42.604 -15.566 1.00 0.00 O ATOM 0 H ASP A 10 11.869 -42.842 -19.512 1.00 0.00 H new ATOM 0 HA ASP A 10 9.114 -42.732 -19.107 1.00 0.00 H new ATOM 0 HB2 ASP A 10 9.056 -41.412 -16.985 1.00 0.00 H new ATOM 0 HB3 ASP A 10 9.447 -43.104 -16.754 1.00 0.00 H new ATOM 143 N ARG A 11 9.336 -40.097 -19.273 1.00 0.00 N ATOM 144 CA ARG A 11 9.501 -38.752 -19.799 1.00 0.00 C ATOM 145 C ARG A 11 9.817 -37.774 -18.666 1.00 0.00 C ATOM 146 O ARG A 11 9.627 -38.094 -17.493 1.00 0.00 O ATOM 147 CB ARG A 11 8.239 -38.287 -20.529 1.00 0.00 C ATOM 148 CG ARG A 11 8.350 -38.544 -22.032 1.00 0.00 C ATOM 149 CD ARG A 11 8.220 -40.037 -22.345 1.00 0.00 C ATOM 150 NE ARG A 11 8.915 -40.351 -23.612 1.00 0.00 N ATOM 151 CZ ARG A 11 8.373 -40.186 -24.828 1.00 0.00 C ATOM 152 NH1 ARG A 11 7.127 -39.708 -24.946 1.00 0.00 N ATOM 153 NH2 ARG A 11 9.077 -40.497 -25.924 1.00 0.00 N ATOM 0 H ARG A 11 8.397 -40.312 -18.938 1.00 0.00 H new ATOM 0 HA ARG A 11 10.329 -38.772 -20.507 1.00 0.00 H new ATOM 0 HB2 ARG A 11 7.370 -38.810 -20.130 1.00 0.00 H new ATOM 0 HB3 ARG A 11 8.081 -37.224 -20.349 1.00 0.00 H new ATOM 0 HG2 ARG A 11 7.572 -37.990 -22.558 1.00 0.00 H new ATOM 0 HG3 ARG A 11 9.308 -38.174 -22.398 1.00 0.00 H new ATOM 0 HD2 ARG A 11 8.645 -40.626 -21.532 1.00 0.00 H new ATOM 0 HD3 ARG A 11 7.168 -40.311 -22.420 1.00 0.00 H new ATOM 0 HE ARG A 11 9.866 -40.716 -23.558 1.00 0.00 H new ATOM 0 HH11 ARG A 11 6.591 -39.470 -24.112 1.00 0.00 H new ATOM 0 HH12 ARG A 11 6.714 -39.582 -25.870 1.00 0.00 H new ATOM 0 HH21 ARG A 11 10.026 -40.860 -25.835 1.00 0.00 H new ATOM 0 HH22 ARG A 11 8.664 -40.371 -26.848 1.00 0.00 H new ATOM 167 N GLN A 12 10.293 -36.600 -19.055 1.00 0.00 N ATOM 168 CA GLN A 12 10.635 -35.573 -18.088 1.00 0.00 C ATOM 169 C GLN A 12 11.809 -36.032 -17.219 1.00 0.00 C ATOM 170 O GLN A 12 11.615 -36.744 -16.234 1.00 0.00 O ATOM 171 CB GLN A 12 9.427 -35.205 -17.226 1.00 0.00 C ATOM 172 CG GLN A 12 9.394 -33.703 -16.938 1.00 0.00 C ATOM 173 CD GLN A 12 8.140 -33.058 -17.533 1.00 0.00 C ATOM 174 OE1 GLN A 12 7.817 -33.227 -18.697 1.00 0.00 O ATOM 175 NE2 GLN A 12 7.455 -32.311 -16.672 1.00 0.00 N ATOM 0 H GLN A 12 10.450 -36.338 -20.028 1.00 0.00 H new ATOM 0 HA GLN A 12 10.937 -34.678 -18.631 1.00 0.00 H new ATOM 0 HB2 GLN A 12 8.510 -35.501 -17.734 1.00 0.00 H new ATOM 0 HB3 GLN A 12 9.464 -35.758 -16.287 1.00 0.00 H new ATOM 0 HG2 GLN A 12 9.418 -33.535 -15.861 1.00 0.00 H new ATOM 0 HG3 GLN A 12 10.283 -33.230 -17.354 1.00 0.00 H new ATOM 0 HE21 GLN A 12 7.781 -32.212 -15.711 1.00 0.00 H new ATOM 0 HE22 GLN A 12 6.603 -31.837 -16.973 1.00 0.00 H new ATOM 184 N GLY A 13 12.999 -35.608 -17.614 1.00 0.00 N ATOM 185 CA GLY A 13 14.203 -35.967 -16.884 1.00 0.00 C ATOM 186 C GLY A 13 15.442 -35.343 -17.530 1.00 0.00 C ATOM 187 O GLY A 13 16.007 -35.905 -18.467 1.00 0.00 O ATOM 0 H GLY A 13 13.156 -35.018 -18.431 1.00 0.00 H new ATOM 0 HA2 GLY A 13 14.119 -35.632 -15.850 1.00 0.00 H new ATOM 0 HA3 GLY A 13 14.308 -37.052 -16.860 1.00 0.00 H new ATOM 191 N GLY A 14 15.829 -34.191 -17.003 1.00 0.00 N ATOM 192 CA GLY A 14 16.991 -33.485 -17.515 1.00 0.00 C ATOM 193 C GLY A 14 17.365 -32.313 -16.607 1.00 0.00 C ATOM 194 O GLY A 14 17.903 -32.511 -15.520 1.00 0.00 O ATOM 0 H GLY A 14 15.358 -33.728 -16.226 1.00 0.00 H new ATOM 0 HA2 GLY A 14 17.833 -34.172 -17.593 1.00 0.00 H new ATOM 0 HA3 GLY A 14 16.784 -33.119 -18.521 1.00 0.00 H new ATOM 198 N GLU A 15 17.063 -31.114 -17.087 1.00 0.00 N ATOM 199 CA GLU A 15 17.361 -29.910 -16.333 1.00 0.00 C ATOM 200 C GLU A 15 18.869 -29.775 -16.120 1.00 0.00 C ATOM 201 O GLU A 15 19.627 -30.696 -16.421 1.00 0.00 O ATOM 202 CB GLU A 15 16.616 -29.902 -14.996 1.00 0.00 C ATOM 203 CG GLU A 15 15.356 -29.038 -15.075 1.00 0.00 C ATOM 204 CD GLU A 15 14.140 -29.793 -14.534 1.00 0.00 C ATOM 205 OE1 GLU A 15 13.439 -29.204 -13.683 1.00 0.00 O ATOM 206 OE2 GLU A 15 13.937 -30.941 -14.985 1.00 0.00 O ATOM 0 H GLU A 15 16.615 -30.952 -17.989 1.00 0.00 H new ATOM 0 HA GLU A 15 17.017 -29.051 -16.909 1.00 0.00 H new ATOM 0 HB2 GLU A 15 16.345 -30.921 -14.720 1.00 0.00 H new ATOM 0 HB3 GLU A 15 17.272 -29.523 -14.212 1.00 0.00 H new ATOM 0 HG2 GLU A 15 15.503 -28.121 -14.504 1.00 0.00 H new ATOM 0 HG3 GLU A 15 15.176 -28.744 -16.109 1.00 0.00 H new ATOM 213 N ARG A 16 19.262 -28.620 -15.604 1.00 0.00 N ATOM 214 CA ARG A 16 20.667 -28.353 -15.348 1.00 0.00 C ATOM 215 C ARG A 16 21.450 -28.326 -16.661 1.00 0.00 C ATOM 216 O ARG A 16 21.393 -29.275 -17.442 1.00 0.00 O ATOM 217 CB ARG A 16 21.270 -29.414 -14.425 1.00 0.00 C ATOM 218 CG ARG A 16 22.742 -29.115 -14.133 1.00 0.00 C ATOM 219 CD ARG A 16 22.982 -28.952 -12.631 1.00 0.00 C ATOM 220 NE ARG A 16 23.106 -27.517 -12.291 1.00 0.00 N ATOM 221 CZ ARG A 16 23.711 -27.057 -11.186 1.00 0.00 C ATOM 222 NH1 ARG A 16 24.248 -27.916 -10.309 1.00 0.00 N ATOM 223 NH2 ARG A 16 23.776 -25.738 -10.959 1.00 0.00 N ATOM 0 H ARG A 16 18.631 -27.858 -15.356 1.00 0.00 H new ATOM 0 HA ARG A 16 20.736 -27.381 -14.860 1.00 0.00 H new ATOM 0 HB2 ARG A 16 20.710 -29.449 -13.490 1.00 0.00 H new ATOM 0 HB3 ARG A 16 21.180 -30.397 -14.887 1.00 0.00 H new ATOM 0 HG2 ARG A 16 23.364 -29.923 -14.519 1.00 0.00 H new ATOM 0 HG3 ARG A 16 23.042 -28.205 -14.653 1.00 0.00 H new ATOM 0 HD2 ARG A 16 22.158 -29.397 -12.072 1.00 0.00 H new ATOM 0 HD3 ARG A 16 23.888 -29.483 -12.339 1.00 0.00 H new ATOM 0 HE ARG A 16 22.707 -26.836 -12.937 1.00 0.00 H new ATOM 0 HH11 ARG A 16 24.197 -28.920 -10.482 1.00 0.00 H new ATOM 0 HH12 ARG A 16 24.708 -27.566 -9.469 1.00 0.00 H new ATOM 0 HH21 ARG A 16 23.366 -25.085 -11.626 1.00 0.00 H new ATOM 0 HH22 ARG A 16 24.236 -25.387 -10.119 1.00 0.00 H new ATOM 237 N ARG A 17 22.164 -27.228 -16.865 1.00 0.00 N ATOM 238 CA ARG A 17 22.958 -27.065 -18.072 1.00 0.00 C ATOM 239 C ARG A 17 24.439 -27.299 -17.768 1.00 0.00 C ATOM 240 O ARG A 17 24.834 -27.375 -16.606 1.00 0.00 O ATOM 241 CB ARG A 17 22.780 -25.664 -18.662 1.00 0.00 C ATOM 242 CG ARG A 17 22.293 -25.736 -20.110 1.00 0.00 C ATOM 243 CD ARG A 17 20.890 -25.142 -20.247 1.00 0.00 C ATOM 244 NE ARG A 17 20.031 -26.049 -21.042 1.00 0.00 N ATOM 245 CZ ARG A 17 20.003 -26.073 -22.382 1.00 0.00 C ATOM 246 NH1 ARG A 17 20.784 -25.241 -23.083 1.00 0.00 N ATOM 247 NH2 ARG A 17 19.193 -26.930 -23.019 1.00 0.00 N ATOM 0 H ARG A 17 22.209 -26.443 -16.215 1.00 0.00 H new ATOM 0 HA ARG A 17 22.613 -27.800 -18.799 1.00 0.00 H new ATOM 0 HB2 ARG A 17 22.065 -25.101 -18.062 1.00 0.00 H new ATOM 0 HB3 ARG A 17 23.726 -25.125 -18.619 1.00 0.00 H new ATOM 0 HG2 ARG A 17 22.985 -25.197 -20.757 1.00 0.00 H new ATOM 0 HG3 ARG A 17 22.287 -26.774 -20.444 1.00 0.00 H new ATOM 0 HD2 ARG A 17 20.454 -24.987 -19.260 1.00 0.00 H new ATOM 0 HD3 ARG A 17 20.945 -24.165 -20.728 1.00 0.00 H new ATOM 0 HE ARG A 17 19.423 -26.695 -20.539 1.00 0.00 H new ATOM 0 HH11 ARG A 17 21.400 -24.589 -22.597 1.00 0.00 H new ATOM 0 HH12 ARG A 17 20.763 -25.259 -24.103 1.00 0.00 H new ATOM 0 HH21 ARG A 17 18.599 -27.563 -22.484 1.00 0.00 H new ATOM 0 HH22 ARG A 17 19.171 -26.949 -24.039 1.00 0.00 H new ATOM 261 N ARG A 18 25.218 -27.409 -18.834 1.00 0.00 N ATOM 262 CA ARG A 18 26.647 -27.633 -18.697 1.00 0.00 C ATOM 263 C ARG A 18 27.406 -26.309 -18.808 1.00 0.00 C ATOM 264 O ARG A 18 28.208 -26.126 -19.722 1.00 0.00 O ATOM 265 CB ARG A 18 27.158 -28.599 -19.769 1.00 0.00 C ATOM 266 CG ARG A 18 27.000 -30.052 -19.318 1.00 0.00 C ATOM 267 CD ARG A 18 26.447 -30.921 -20.449 1.00 0.00 C ATOM 268 NE ARG A 18 24.983 -30.734 -20.561 1.00 0.00 N ATOM 269 CZ ARG A 18 24.162 -31.589 -21.186 1.00 0.00 C ATOM 270 NH1 ARG A 18 24.656 -32.694 -21.759 1.00 0.00 N ATOM 271 NH2 ARG A 18 22.847 -31.338 -21.238 1.00 0.00 N ATOM 0 H ARG A 18 24.886 -27.347 -19.797 1.00 0.00 H new ATOM 0 HA ARG A 18 26.821 -28.073 -17.715 1.00 0.00 H new ATOM 0 HB2 ARG A 18 26.609 -28.441 -20.697 1.00 0.00 H new ATOM 0 HB3 ARG A 18 28.207 -28.392 -19.980 1.00 0.00 H new ATOM 0 HG2 ARG A 18 27.964 -30.442 -18.993 1.00 0.00 H new ATOM 0 HG3 ARG A 18 26.331 -30.099 -18.459 1.00 0.00 H new ATOM 0 HD2 ARG A 18 26.929 -30.657 -21.390 1.00 0.00 H new ATOM 0 HD3 ARG A 18 26.674 -31.970 -20.258 1.00 0.00 H new ATOM 0 HE ARG A 18 24.573 -29.902 -20.136 1.00 0.00 H new ATOM 0 HH11 ARG A 18 25.657 -32.885 -21.720 1.00 0.00 H new ATOM 0 HH12 ARG A 18 24.031 -33.345 -22.235 1.00 0.00 H new ATOM 0 HH21 ARG A 18 22.471 -30.496 -20.802 1.00 0.00 H new ATOM 0 HH22 ARG A 18 22.222 -31.989 -21.714 1.00 0.00 H new ATOM 285 N SER A 19 27.124 -25.421 -17.867 1.00 0.00 N ATOM 286 CA SER A 19 27.771 -24.120 -17.848 1.00 0.00 C ATOM 287 C SER A 19 29.256 -24.268 -18.183 1.00 0.00 C ATOM 288 O SER A 19 30.063 -24.589 -17.312 1.00 0.00 O ATOM 289 CB SER A 19 27.598 -23.439 -16.488 1.00 0.00 C ATOM 290 OG SER A 19 26.774 -22.280 -16.573 1.00 0.00 O ATOM 0 H SER A 19 26.456 -25.576 -17.112 1.00 0.00 H new ATOM 0 HA SER A 19 27.297 -23.491 -18.602 1.00 0.00 H new ATOM 0 HB2 SER A 19 27.160 -24.145 -15.782 1.00 0.00 H new ATOM 0 HB3 SER A 19 28.576 -23.161 -16.095 1.00 0.00 H new ATOM 0 HG SER A 19 26.686 -21.875 -15.685 1.00 0.00 H new ATOM 296 N GLN A 20 29.571 -24.027 -19.447 1.00 0.00 N ATOM 297 CA GLN A 20 30.945 -24.130 -19.908 1.00 0.00 C ATOM 298 C GLN A 20 31.642 -25.316 -19.239 1.00 0.00 C ATOM 299 O GLN A 20 32.787 -25.202 -18.802 1.00 0.00 O ATOM 300 CB GLN A 20 31.708 -22.829 -19.651 1.00 0.00 C ATOM 301 CG GLN A 20 31.500 -21.835 -20.795 1.00 0.00 C ATOM 302 CD GLN A 20 32.779 -21.042 -21.072 1.00 0.00 C ATOM 303 OE1 GLN A 20 33.883 -21.561 -21.035 1.00 0.00 O ATOM 304 NE2 GLN A 20 32.569 -19.758 -21.349 1.00 0.00 N ATOM 0 H GLN A 20 28.898 -23.761 -20.166 1.00 0.00 H new ATOM 0 HA GLN A 20 30.935 -24.300 -20.985 1.00 0.00 H new ATOM 0 HB2 GLN A 20 31.372 -22.385 -18.714 1.00 0.00 H new ATOM 0 HB3 GLN A 20 32.771 -23.043 -19.539 1.00 0.00 H new ATOM 0 HG2 GLN A 20 31.197 -22.370 -21.695 1.00 0.00 H new ATOM 0 HG3 GLN A 20 30.690 -21.150 -20.544 1.00 0.00 H new ATOM 0 HE21 GLN A 20 31.619 -19.388 -21.363 1.00 0.00 H new ATOM 0 HE22 GLN A 20 33.358 -19.143 -21.547 1.00 0.00 H new ATOM 313 N LEU A 21 30.923 -26.427 -19.179 1.00 0.00 N ATOM 314 CA LEU A 21 31.458 -27.633 -18.570 1.00 0.00 C ATOM 315 C LEU A 21 32.591 -28.179 -19.441 1.00 0.00 C ATOM 316 O LEU A 21 32.346 -28.920 -20.392 1.00 0.00 O ATOM 317 CB LEU A 21 30.340 -28.644 -18.312 1.00 0.00 C ATOM 318 CG LEU A 21 30.390 -29.369 -16.965 1.00 0.00 C ATOM 319 CD1 LEU A 21 29.534 -30.638 -16.994 1.00 0.00 C ATOM 320 CD2 LEU A 21 31.834 -29.662 -16.553 1.00 0.00 C ATOM 0 H LEU A 21 29.974 -26.518 -19.542 1.00 0.00 H new ATOM 0 HA LEU A 21 31.886 -27.409 -17.593 1.00 0.00 H new ATOM 0 HB2 LEU A 21 29.384 -28.126 -18.388 1.00 0.00 H new ATOM 0 HB3 LEU A 21 30.362 -29.391 -19.105 1.00 0.00 H new ATOM 0 HG LEU A 21 29.966 -28.711 -16.207 1.00 0.00 H new ATOM 0 HD11 LEU A 21 29.587 -31.135 -16.025 1.00 0.00 H new ATOM 0 HD12 LEU A 21 28.499 -30.374 -17.211 1.00 0.00 H new ATOM 0 HD13 LEU A 21 29.906 -31.310 -17.767 1.00 0.00 H new ATOM 0 HD21 LEU A 21 31.841 -30.177 -15.593 1.00 0.00 H new ATOM 0 HD22 LEU A 21 32.307 -30.292 -17.306 1.00 0.00 H new ATOM 0 HD23 LEU A 21 32.385 -28.725 -16.466 1.00 0.00 H new ATOM 332 N ASP A 22 33.807 -27.793 -19.085 1.00 0.00 N ATOM 333 CA ASP A 22 34.979 -28.234 -19.822 1.00 0.00 C ATOM 334 C ASP A 22 35.021 -29.763 -19.838 1.00 0.00 C ATOM 335 O ASP A 22 34.704 -30.406 -18.838 1.00 0.00 O ATOM 336 CB ASP A 22 36.266 -27.734 -19.163 1.00 0.00 C ATOM 337 CG ASP A 22 37.134 -26.831 -20.042 1.00 0.00 C ATOM 338 OD1 ASP A 22 37.354 -27.219 -21.210 1.00 0.00 O ATOM 339 OD2 ASP A 22 37.560 -25.776 -19.526 1.00 0.00 O ATOM 0 H ASP A 22 34.006 -27.179 -18.295 1.00 0.00 H new ATOM 0 HA ASP A 22 34.911 -27.832 -20.833 1.00 0.00 H new ATOM 0 HB2 ASP A 22 36.004 -27.189 -18.256 1.00 0.00 H new ATOM 0 HB3 ASP A 22 36.859 -28.596 -18.857 1.00 0.00 H new ATOM 344 N ARG A 23 35.412 -30.301 -20.984 1.00 0.00 N ATOM 345 CA ARG A 23 35.498 -31.743 -21.142 1.00 0.00 C ATOM 346 C ARG A 23 36.608 -32.309 -20.255 1.00 0.00 C ATOM 347 O ARG A 23 36.748 -33.525 -20.130 1.00 0.00 O ATOM 348 CB ARG A 23 35.775 -32.120 -22.599 1.00 0.00 C ATOM 349 CG ARG A 23 34.488 -32.105 -23.425 1.00 0.00 C ATOM 350 CD ARG A 23 33.562 -33.254 -23.018 1.00 0.00 C ATOM 351 NE ARG A 23 33.588 -34.314 -24.050 1.00 0.00 N ATOM 352 CZ ARG A 23 32.798 -35.397 -24.035 1.00 0.00 C ATOM 353 NH1 ARG A 23 31.917 -35.570 -23.041 1.00 0.00 N ATOM 354 NH2 ARG A 23 32.892 -36.308 -25.013 1.00 0.00 N ATOM 0 H ARG A 23 35.673 -29.765 -21.812 1.00 0.00 H new ATOM 0 HA ARG A 23 34.540 -32.168 -20.844 1.00 0.00 H new ATOM 0 HB2 ARG A 23 36.494 -31.423 -23.028 1.00 0.00 H new ATOM 0 HB3 ARG A 23 36.227 -33.111 -22.642 1.00 0.00 H new ATOM 0 HG2 ARG A 23 33.975 -31.153 -23.288 1.00 0.00 H new ATOM 0 HG3 ARG A 23 34.731 -32.186 -24.485 1.00 0.00 H new ATOM 0 HD2 ARG A 23 33.876 -33.662 -22.057 1.00 0.00 H new ATOM 0 HD3 ARG A 23 32.545 -32.884 -22.890 1.00 0.00 H new ATOM 0 HE ARG A 23 34.248 -34.214 -24.821 1.00 0.00 H new ATOM 0 HH11 ARG A 23 31.847 -34.878 -22.295 1.00 0.00 H new ATOM 0 HH12 ARG A 23 31.316 -36.394 -23.030 1.00 0.00 H new ATOM 0 HH21 ARG A 23 33.565 -36.177 -25.769 1.00 0.00 H new ATOM 0 HH22 ARG A 23 32.291 -37.132 -25.002 1.00 0.00 H new ATOM 368 N ASP A 24 37.369 -31.401 -19.663 1.00 0.00 N ATOM 369 CA ASP A 24 38.463 -31.795 -18.791 1.00 0.00 C ATOM 370 C ASP A 24 38.313 -31.090 -17.442 1.00 0.00 C ATOM 371 O ASP A 24 39.299 -30.872 -16.739 1.00 0.00 O ATOM 372 CB ASP A 24 39.815 -31.394 -19.387 1.00 0.00 C ATOM 373 CG ASP A 24 40.885 -32.486 -19.351 1.00 0.00 C ATOM 374 OD1 ASP A 24 40.645 -33.538 -19.981 1.00 0.00 O ATOM 375 OD2 ASP A 24 41.921 -32.243 -18.694 1.00 0.00 O ATOM 0 H ASP A 24 37.250 -30.394 -19.770 1.00 0.00 H new ATOM 0 HA ASP A 24 38.428 -32.878 -18.674 1.00 0.00 H new ATOM 0 HB2 ASP A 24 39.663 -31.089 -20.422 1.00 0.00 H new ATOM 0 HB3 ASP A 24 40.188 -30.522 -18.849 1.00 0.00 H new ATOM 380 N GLN A 25 37.073 -30.751 -17.121 1.00 0.00 N ATOM 381 CA GLN A 25 36.782 -30.074 -15.869 1.00 0.00 C ATOM 382 C GLN A 25 36.062 -31.023 -14.909 1.00 0.00 C ATOM 383 O GLN A 25 35.851 -32.191 -15.227 1.00 0.00 O ATOM 384 CB GLN A 25 35.958 -28.807 -16.109 1.00 0.00 C ATOM 385 CG GLN A 25 36.798 -27.552 -15.865 1.00 0.00 C ATOM 386 CD GLN A 25 35.918 -26.378 -15.432 1.00 0.00 C ATOM 387 OE1 GLN A 25 35.400 -26.332 -14.327 1.00 0.00 O ATOM 388 NE2 GLN A 25 35.777 -25.436 -16.359 1.00 0.00 N ATOM 0 H GLN A 25 36.258 -30.933 -17.707 1.00 0.00 H new ATOM 0 HA GLN A 25 37.725 -29.773 -15.413 1.00 0.00 H new ATOM 0 HB2 GLN A 25 35.580 -28.803 -17.131 1.00 0.00 H new ATOM 0 HB3 GLN A 25 35.091 -28.802 -15.449 1.00 0.00 H new ATOM 0 HG2 GLN A 25 37.545 -27.754 -15.097 1.00 0.00 H new ATOM 0 HG3 GLN A 25 37.339 -27.290 -16.774 1.00 0.00 H new ATOM 0 HE21 GLN A 25 36.238 -25.537 -17.263 1.00 0.00 H new ATOM 0 HE22 GLN A 25 35.208 -24.612 -16.166 1.00 0.00 H new ATOM 397 N CYS A 26 35.707 -30.484 -13.750 1.00 0.00 N ATOM 398 CA CYS A 26 35.016 -31.268 -12.742 1.00 0.00 C ATOM 399 C CYS A 26 33.633 -30.651 -12.519 1.00 0.00 C ATOM 400 O CYS A 26 33.519 -29.464 -12.220 1.00 0.00 O ATOM 401 CB CYS A 26 35.819 -31.351 -11.442 1.00 0.00 C ATOM 402 SG CYS A 26 34.869 -32.272 -10.177 1.00 0.00 S ATOM 0 H CYS A 26 35.886 -29.514 -13.488 1.00 0.00 H new ATOM 0 HA CYS A 26 34.904 -32.295 -13.090 1.00 0.00 H new ATOM 0 HB2 CYS A 26 36.772 -31.847 -11.625 1.00 0.00 H new ATOM 0 HB3 CYS A 26 36.045 -30.348 -11.080 1.00 0.00 H new ATOM 407 N ALA A 27 32.617 -31.487 -12.672 1.00 0.00 N ATOM 408 CA ALA A 27 31.246 -31.041 -12.492 1.00 0.00 C ATOM 409 C ALA A 27 30.823 -31.280 -11.041 1.00 0.00 C ATOM 410 O ALA A 27 29.659 -31.570 -10.771 1.00 0.00 O ATOM 411 CB ALA A 27 30.337 -31.760 -13.491 1.00 0.00 C ATOM 0 H ALA A 27 32.716 -32.472 -12.919 1.00 0.00 H new ATOM 0 HA ALA A 27 31.162 -29.972 -12.688 1.00 0.00 H new ATOM 0 HB1 ALA A 27 29.309 -31.424 -13.355 1.00 0.00 H new ATOM 0 HB2 ALA A 27 30.661 -31.533 -14.507 1.00 0.00 H new ATOM 0 HB3 ALA A 27 30.392 -32.836 -13.324 1.00 0.00 H new ATOM 417 N TYR A 28 31.791 -31.149 -10.147 1.00 0.00 N ATOM 418 CA TYR A 28 31.534 -31.347 -8.730 1.00 0.00 C ATOM 419 C TYR A 28 32.064 -30.173 -7.906 1.00 0.00 C ATOM 420 O TYR A 28 31.293 -29.466 -7.259 1.00 0.00 O ATOM 421 CB TYR A 28 32.295 -32.616 -8.337 1.00 0.00 C ATOM 422 CG TYR A 28 31.739 -33.313 -7.095 1.00 0.00 C ATOM 423 CD1 TYR A 28 30.764 -34.281 -7.225 1.00 0.00 C ATOM 424 CD2 TYR A 28 32.213 -32.976 -5.844 1.00 0.00 C ATOM 425 CE1 TYR A 28 30.241 -34.939 -6.056 1.00 0.00 C ATOM 426 CE2 TYR A 28 31.690 -33.634 -4.674 1.00 0.00 C ATOM 427 CZ TYR A 28 30.731 -34.583 -4.838 1.00 0.00 C ATOM 428 OH TYR A 28 30.236 -35.204 -3.733 1.00 0.00 O ATOM 0 H TYR A 28 32.755 -30.908 -10.376 1.00 0.00 H new ATOM 0 HA TYR A 28 30.463 -31.426 -8.542 1.00 0.00 H new ATOM 0 HB2 TYR A 28 32.273 -33.314 -9.174 1.00 0.00 H new ATOM 0 HB3 TYR A 28 33.340 -32.361 -8.161 1.00 0.00 H new ATOM 0 HD1 TYR A 28 30.393 -34.545 -8.204 1.00 0.00 H new ATOM 0 HD2 TYR A 28 32.976 -32.219 -5.742 1.00 0.00 H new ATOM 0 HE1 TYR A 28 29.477 -35.698 -6.144 1.00 0.00 H new ATOM 0 HE2 TYR A 28 32.052 -33.379 -3.689 1.00 0.00 H new ATOM 0 HH TYR A 28 30.679 -34.850 -2.933 1.00 0.00 H new ATOM 438 N CYS A 29 33.377 -30.000 -7.959 1.00 0.00 N ATOM 439 CA CYS A 29 34.019 -28.921 -7.226 1.00 0.00 C ATOM 440 C CYS A 29 34.246 -27.754 -8.188 1.00 0.00 C ATOM 441 O CYS A 29 34.397 -26.611 -7.759 1.00 0.00 O ATOM 442 CB CYS A 29 35.322 -29.383 -6.570 1.00 0.00 C ATOM 443 SG CYS A 29 36.516 -29.911 -7.853 1.00 0.00 S ATOM 0 H CYS A 29 34.013 -30.588 -8.497 1.00 0.00 H new ATOM 0 HA CYS A 29 33.373 -28.596 -6.411 1.00 0.00 H new ATOM 0 HB2 CYS A 29 35.747 -28.573 -5.977 1.00 0.00 H new ATOM 0 HB3 CYS A 29 35.122 -30.208 -5.886 1.00 0.00 H new ATOM 448 N LYS A 30 34.262 -28.082 -9.472 1.00 0.00 N ATOM 449 CA LYS A 30 34.469 -27.075 -10.499 1.00 0.00 C ATOM 450 C LYS A 30 35.966 -26.941 -10.784 1.00 0.00 C ATOM 451 O LYS A 30 36.417 -25.912 -11.285 1.00 0.00 O ATOM 452 CB LYS A 30 33.799 -25.757 -10.100 1.00 0.00 C ATOM 453 CG LYS A 30 32.444 -26.011 -9.436 1.00 0.00 C ATOM 454 CD LYS A 30 31.338 -25.206 -10.120 1.00 0.00 C ATOM 455 CE LYS A 30 30.423 -26.118 -10.939 1.00 0.00 C ATOM 456 NZ LYS A 30 29.127 -25.453 -11.199 1.00 0.00 N ATOM 0 H LYS A 30 34.135 -29.031 -9.824 1.00 0.00 H new ATOM 0 HA LYS A 30 33.993 -27.380 -11.431 1.00 0.00 H new ATOM 0 HB2 LYS A 30 34.446 -25.208 -9.416 1.00 0.00 H new ATOM 0 HB3 LYS A 30 33.664 -25.131 -10.982 1.00 0.00 H new ATOM 0 HG2 LYS A 30 32.206 -27.074 -9.482 1.00 0.00 H new ATOM 0 HG3 LYS A 30 32.496 -25.741 -8.381 1.00 0.00 H new ATOM 0 HD2 LYS A 30 30.752 -24.676 -9.369 1.00 0.00 H new ATOM 0 HD3 LYS A 30 31.781 -24.451 -10.770 1.00 0.00 H new ATOM 0 HE2 LYS A 30 30.904 -26.372 -11.884 1.00 0.00 H new ATOM 0 HE3 LYS A 30 30.258 -27.053 -10.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 28.564 -26.033 -11.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 28.609 -25.339 -10.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 29.295 -24.518 -11.623 1.00 0.00 H new ATOM 470 N GLU A 31 36.696 -27.996 -10.451 1.00 0.00 N ATOM 471 CA GLU A 31 38.133 -28.009 -10.665 1.00 0.00 C ATOM 472 C GLU A 31 38.450 -28.399 -12.110 1.00 0.00 C ATOM 473 O GLU A 31 37.701 -29.149 -12.733 1.00 0.00 O ATOM 474 CB GLU A 31 38.825 -28.952 -9.677 1.00 0.00 C ATOM 475 CG GLU A 31 40.340 -28.947 -9.884 1.00 0.00 C ATOM 476 CD GLU A 31 40.779 -30.125 -10.757 1.00 0.00 C ATOM 477 OE1 GLU A 31 40.059 -30.402 -11.739 1.00 0.00 O ATOM 478 OE2 GLU A 31 41.825 -30.721 -10.419 1.00 0.00 O ATOM 0 H GLU A 31 36.319 -28.847 -10.035 1.00 0.00 H new ATOM 0 HA GLU A 31 38.517 -27.005 -10.488 1.00 0.00 H new ATOM 0 HB2 GLU A 31 38.593 -28.649 -8.656 1.00 0.00 H new ATOM 0 HB3 GLU A 31 38.440 -29.964 -9.804 1.00 0.00 H new ATOM 0 HG2 GLU A 31 40.643 -28.010 -10.352 1.00 0.00 H new ATOM 0 HG3 GLU A 31 40.843 -28.999 -8.918 1.00 0.00 H new ATOM 485 N LYS A 32 39.562 -27.872 -12.599 1.00 0.00 N ATOM 486 CA LYS A 32 39.990 -28.155 -13.959 1.00 0.00 C ATOM 487 C LYS A 32 41.228 -29.054 -13.924 1.00 0.00 C ATOM 488 O LYS A 32 42.278 -28.650 -13.429 1.00 0.00 O ATOM 489 CB LYS A 32 40.195 -26.854 -14.737 1.00 0.00 C ATOM 490 CG LYS A 32 40.217 -27.115 -16.245 1.00 0.00 C ATOM 491 CD LYS A 32 39.718 -25.894 -17.019 1.00 0.00 C ATOM 492 CE LYS A 32 40.877 -25.166 -17.704 1.00 0.00 C ATOM 493 NZ LYS A 32 40.394 -24.412 -18.881 1.00 0.00 N ATOM 0 H LYS A 32 40.180 -27.250 -12.078 1.00 0.00 H new ATOM 0 HA LYS A 32 39.215 -28.702 -14.496 1.00 0.00 H new ATOM 0 HB2 LYS A 32 39.396 -26.153 -14.497 1.00 0.00 H new ATOM 0 HB3 LYS A 32 41.131 -26.387 -14.431 1.00 0.00 H new ATOM 0 HG2 LYS A 32 41.231 -27.361 -16.561 1.00 0.00 H new ATOM 0 HG3 LYS A 32 39.593 -27.978 -16.478 1.00 0.00 H new ATOM 0 HD2 LYS A 32 38.988 -26.206 -17.766 1.00 0.00 H new ATOM 0 HD3 LYS A 32 39.207 -25.212 -16.339 1.00 0.00 H new ATOM 0 HE2 LYS A 32 41.353 -24.485 -16.999 1.00 0.00 H new ATOM 0 HE3 LYS A 32 41.635 -25.886 -18.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 41.065 -24.529 -19.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 39.461 -24.772 -19.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 40.317 -23.403 -18.639 1.00 0.00 H new ATOM 507 N GLY A 33 41.061 -30.256 -14.456 1.00 0.00 N ATOM 508 CA GLY A 33 42.152 -31.215 -14.493 1.00 0.00 C ATOM 509 C GLY A 33 41.647 -32.631 -14.204 1.00 0.00 C ATOM 510 O GLY A 33 41.946 -33.564 -14.947 1.00 0.00 O ATOM 0 H GLY A 33 40.187 -30.587 -14.865 1.00 0.00 H new ATOM 0 HA2 GLY A 33 42.631 -31.189 -15.472 1.00 0.00 H new ATOM 0 HA3 GLY A 33 42.909 -30.938 -13.760 1.00 0.00 H new ATOM 514 N HIS A 34 40.890 -32.746 -13.123 1.00 0.00 N ATOM 515 CA HIS A 34 40.341 -34.031 -12.727 1.00 0.00 C ATOM 516 C HIS A 34 38.842 -34.065 -13.034 1.00 0.00 C ATOM 517 O HIS A 34 38.201 -33.021 -13.132 1.00 0.00 O ATOM 518 CB HIS A 34 40.652 -34.326 -11.259 1.00 0.00 C ATOM 519 CG HIS A 34 39.818 -33.533 -10.282 1.00 0.00 C ATOM 520 ND1 HIS A 34 40.337 -32.504 -9.516 1.00 0.00 N ATOM 521 CD2 HIS A 34 38.496 -33.627 -9.957 1.00 0.00 C ATOM 522 CE1 HIS A 34 39.363 -32.009 -8.765 1.00 0.00 C ATOM 523 NE2 HIS A 34 38.224 -32.706 -9.040 1.00 0.00 N ATOM 0 H HIS A 34 40.644 -31.970 -12.509 1.00 0.00 H new ATOM 0 HA HIS A 34 40.813 -34.826 -13.305 1.00 0.00 H new ATOM 0 HB2 HIS A 34 40.499 -35.389 -11.072 1.00 0.00 H new ATOM 0 HB3 HIS A 34 41.706 -34.119 -11.073 1.00 0.00 H new ATOM 0 HD1 HIS A 34 41.305 -32.181 -9.527 1.00 0.00 H new ATOM 0 HD2 HIS A 34 37.791 -34.331 -10.375 1.00 0.00 H new ATOM 0 HE1 HIS A 34 39.456 -31.197 -8.059 1.00 0.00 H new ATOM 531 N TRP A 35 38.328 -35.278 -13.177 1.00 0.00 N ATOM 532 CA TRP A 35 36.917 -35.462 -13.470 1.00 0.00 C ATOM 533 C TRP A 35 36.176 -35.635 -12.143 1.00 0.00 C ATOM 534 O TRP A 35 36.767 -36.050 -11.148 1.00 0.00 O ATOM 535 CB TRP A 35 36.704 -36.635 -14.430 1.00 0.00 C ATOM 536 CG TRP A 35 36.641 -36.229 -15.903 1.00 0.00 C ATOM 537 CD1 TRP A 35 37.436 -35.374 -16.559 1.00 0.00 C ATOM 538 CD2 TRP A 35 35.694 -36.701 -16.885 1.00 0.00 C ATOM 539 NE1 TRP A 35 37.074 -35.260 -17.886 1.00 0.00 N ATOM 540 CE2 TRP A 35 35.979 -36.092 -18.090 1.00 0.00 C ATOM 541 CE3 TRP A 35 34.630 -37.612 -16.759 1.00 0.00 C ATOM 542 CZ2 TRP A 35 35.249 -36.329 -19.261 1.00 0.00 C ATOM 543 CZ3 TRP A 35 33.909 -37.837 -17.938 1.00 0.00 C ATOM 544 CH2 TRP A 35 34.184 -37.232 -19.159 1.00 0.00 C ATOM 0 H TRP A 35 38.863 -36.142 -13.095 1.00 0.00 H new ATOM 0 HA TRP A 35 36.514 -34.589 -13.983 1.00 0.00 H new ATOM 0 HB2 TRP A 35 37.513 -37.353 -14.296 1.00 0.00 H new ATOM 0 HB3 TRP A 35 35.778 -37.145 -14.164 1.00 0.00 H new ATOM 0 HD1 TRP A 35 38.258 -34.840 -16.106 1.00 0.00 H new ATOM 0 HE1 TRP A 35 37.526 -34.674 -18.587 1.00 0.00 H new ATOM 0 HE3 TRP A 35 34.388 -38.100 -15.826 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 35.494 -35.841 -20.193 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 33.081 -38.529 -17.896 1.00 0.00 H new ATOM 0 HH2 TRP A 35 33.579 -37.457 -20.025 1.00 0.00 H new ATOM 555 N ALA A 36 34.893 -35.306 -12.171 1.00 0.00 N ATOM 556 CA ALA A 36 34.065 -35.420 -10.981 1.00 0.00 C ATOM 557 C ALA A 36 34.068 -36.872 -10.501 1.00 0.00 C ATOM 558 O ALA A 36 33.988 -37.131 -9.300 1.00 0.00 O ATOM 559 CB ALA A 36 32.655 -34.910 -11.290 1.00 0.00 C ATOM 0 H ALA A 36 34.406 -34.961 -12.998 1.00 0.00 H new ATOM 0 HA ALA A 36 34.464 -34.806 -10.174 1.00 0.00 H new ATOM 0 HB1 ALA A 36 32.034 -34.995 -10.398 1.00 0.00 H new ATOM 0 HB2 ALA A 36 32.705 -33.866 -11.599 1.00 0.00 H new ATOM 0 HB3 ALA A 36 32.221 -35.505 -12.093 1.00 0.00 H new ATOM 565 N LYS A 37 34.160 -37.780 -11.460 1.00 0.00 N ATOM 566 CA LYS A 37 34.175 -39.199 -11.150 1.00 0.00 C ATOM 567 C LYS A 37 35.426 -39.525 -10.332 1.00 0.00 C ATOM 568 O LYS A 37 35.536 -40.612 -9.767 1.00 0.00 O ATOM 569 CB LYS A 37 34.042 -40.029 -12.428 1.00 0.00 C ATOM 570 CG LYS A 37 32.576 -40.163 -12.845 1.00 0.00 C ATOM 571 CD LYS A 37 32.319 -39.461 -14.180 1.00 0.00 C ATOM 572 CE LYS A 37 32.407 -40.448 -15.345 1.00 0.00 C ATOM 573 NZ LYS A 37 33.780 -40.988 -15.465 1.00 0.00 N ATOM 0 H LYS A 37 34.225 -37.560 -12.454 1.00 0.00 H new ATOM 0 HA LYS A 37 33.314 -39.463 -10.536 1.00 0.00 H new ATOM 0 HB2 LYS A 37 34.611 -39.560 -13.231 1.00 0.00 H new ATOM 0 HB3 LYS A 37 34.471 -41.019 -12.269 1.00 0.00 H new ATOM 0 HG2 LYS A 37 32.313 -41.217 -12.928 1.00 0.00 H new ATOM 0 HG3 LYS A 37 31.935 -39.734 -12.075 1.00 0.00 H new ATOM 0 HD2 LYS A 37 31.333 -38.996 -14.166 1.00 0.00 H new ATOM 0 HD3 LYS A 37 33.047 -38.662 -14.320 1.00 0.00 H new ATOM 0 HE2 LYS A 37 31.701 -41.264 -15.192 1.00 0.00 H new ATOM 0 HE3 LYS A 37 32.123 -39.951 -16.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 33.857 -41.549 -16.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 34.461 -40.202 -15.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 33.988 -41.593 -14.645 1.00 0.00 H new ATOM 587 N ASP A 38 36.337 -38.564 -10.295 1.00 0.00 N ATOM 588 CA ASP A 38 37.576 -38.735 -9.557 1.00 0.00 C ATOM 589 C ASP A 38 37.845 -37.481 -8.722 1.00 0.00 C ATOM 590 O ASP A 38 38.998 -37.113 -8.502 1.00 0.00 O ATOM 591 CB ASP A 38 38.761 -38.935 -10.505 1.00 0.00 C ATOM 592 CG ASP A 38 39.715 -40.065 -10.118 1.00 0.00 C ATOM 593 OD1 ASP A 38 40.895 -39.975 -10.522 1.00 0.00 O ATOM 594 OD2 ASP A 38 39.245 -40.995 -9.428 1.00 0.00 O ATOM 0 H ASP A 38 36.241 -37.664 -10.765 1.00 0.00 H new ATOM 0 HA ASP A 38 37.470 -39.615 -8.922 1.00 0.00 H new ATOM 0 HB2 ASP A 38 38.377 -39.131 -11.506 1.00 0.00 H new ATOM 0 HB3 ASP A 38 39.326 -38.004 -10.557 1.00 0.00 H new ATOM 599 N CYS A 39 36.762 -36.860 -8.280 1.00 0.00 N ATOM 600 CA CYS A 39 36.866 -35.655 -7.475 1.00 0.00 C ATOM 601 C CYS A 39 37.374 -36.048 -6.086 1.00 0.00 C ATOM 602 O CYS A 39 36.872 -36.994 -5.481 1.00 0.00 O ATOM 603 CB CYS A 39 35.534 -34.905 -7.403 1.00 0.00 C ATOM 604 SG CYS A 39 35.767 -33.293 -6.569 1.00 0.00 S ATOM 0 H CYS A 39 35.807 -37.169 -8.464 1.00 0.00 H new ATOM 0 HA CYS A 39 37.572 -34.965 -7.938 1.00 0.00 H new ATOM 0 HB2 CYS A 39 35.140 -34.750 -8.407 1.00 0.00 H new ATOM 0 HB3 CYS A 39 34.800 -35.501 -6.861 1.00 0.00 H new ATOM 609 N PRO A 40 38.392 -35.282 -5.610 1.00 0.00 N ATOM 610 CA PRO A 40 38.975 -35.540 -4.304 1.00 0.00 C ATOM 611 C PRO A 40 38.046 -35.064 -3.185 1.00 0.00 C ATOM 612 O PRO A 40 38.376 -35.182 -2.006 1.00 0.00 O ATOM 613 CB PRO A 40 40.309 -34.812 -4.317 1.00 0.00 C ATOM 614 CG PRO A 40 40.219 -33.796 -5.444 1.00 0.00 C ATOM 615 CD PRO A 40 39.012 -34.154 -6.298 1.00 0.00 C ATOM 0 HA PRO A 40 39.118 -36.603 -4.111 1.00 0.00 H new ATOM 0 HB2 PRO A 40 40.495 -34.320 -3.362 1.00 0.00 H new ATOM 0 HB3 PRO A 40 41.132 -35.507 -4.483 1.00 0.00 H new ATOM 0 HG2 PRO A 40 40.117 -32.788 -5.042 1.00 0.00 H new ATOM 0 HG3 PRO A 40 41.129 -33.809 -6.044 1.00 0.00 H new ATOM 0 HD2 PRO A 40 38.323 -33.314 -6.381 1.00 0.00 H new ATOM 0 HD3 PRO A 40 39.310 -34.424 -7.311 1.00 0.00 H new ATOM 623 N LYS A 41 36.902 -34.537 -3.594 1.00 0.00 N ATOM 624 CA LYS A 41 35.922 -34.043 -2.641 1.00 0.00 C ATOM 625 C LYS A 41 34.899 -35.142 -2.351 1.00 0.00 C ATOM 626 O LYS A 41 34.208 -35.098 -1.335 1.00 0.00 O ATOM 627 CB LYS A 41 35.298 -32.738 -3.141 1.00 0.00 C ATOM 628 CG LYS A 41 34.503 -32.049 -2.030 1.00 0.00 C ATOM 629 CD LYS A 41 33.568 -30.983 -2.605 1.00 0.00 C ATOM 630 CE LYS A 41 32.414 -30.690 -1.645 1.00 0.00 C ATOM 631 NZ LYS A 41 32.585 -29.360 -1.019 1.00 0.00 N ATOM 0 H LYS A 41 36.631 -34.441 -4.573 1.00 0.00 H new ATOM 0 HA LYS A 41 36.403 -33.797 -1.694 1.00 0.00 H new ATOM 0 HB2 LYS A 41 36.081 -32.070 -3.500 1.00 0.00 H new ATOM 0 HB3 LYS A 41 34.643 -32.945 -3.987 1.00 0.00 H new ATOM 0 HG2 LYS A 41 33.922 -32.790 -1.481 1.00 0.00 H new ATOM 0 HG3 LYS A 41 35.189 -31.590 -1.318 1.00 0.00 H new ATOM 0 HD2 LYS A 41 34.128 -30.068 -2.796 1.00 0.00 H new ATOM 0 HD3 LYS A 41 33.172 -31.320 -3.563 1.00 0.00 H new ATOM 0 HE2 LYS A 41 31.467 -30.726 -2.184 1.00 0.00 H new ATOM 0 HE3 LYS A 41 32.371 -31.459 -0.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 31.793 -29.177 -0.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 33.479 -29.338 -0.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 32.603 -28.628 -1.758 1.00 0.00 H new ATOM 645 N LYS A 42 34.835 -36.102 -3.261 1.00 0.00 N ATOM 646 CA LYS A 42 33.909 -37.211 -3.115 1.00 0.00 C ATOM 647 C LYS A 42 34.289 -38.029 -1.879 1.00 0.00 C ATOM 648 O LYS A 42 35.377 -38.600 -1.818 1.00 0.00 O ATOM 649 CB LYS A 42 33.853 -38.035 -4.404 1.00 0.00 C ATOM 650 CG LYS A 42 32.557 -37.764 -5.171 1.00 0.00 C ATOM 651 CD LYS A 42 32.129 -38.993 -5.976 1.00 0.00 C ATOM 652 CE LYS A 42 33.018 -39.179 -7.207 1.00 0.00 C ATOM 653 NZ LYS A 42 32.226 -39.698 -8.344 1.00 0.00 N ATOM 0 H LYS A 42 35.410 -36.135 -4.103 1.00 0.00 H new ATOM 0 HA LYS A 42 32.896 -36.842 -2.954 1.00 0.00 H new ATOM 0 HB2 LYS A 42 34.710 -37.792 -5.033 1.00 0.00 H new ATOM 0 HB3 LYS A 42 33.924 -39.096 -4.165 1.00 0.00 H new ATOM 0 HG2 LYS A 42 31.767 -37.490 -4.472 1.00 0.00 H new ATOM 0 HG3 LYS A 42 32.698 -36.916 -5.842 1.00 0.00 H new ATOM 0 HD2 LYS A 42 32.183 -39.881 -5.347 1.00 0.00 H new ATOM 0 HD3 LYS A 42 31.090 -38.885 -6.286 1.00 0.00 H new ATOM 0 HE2 LYS A 42 33.476 -38.228 -7.479 1.00 0.00 H new ATOM 0 HE3 LYS A 42 33.829 -39.869 -6.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 32.783 -40.409 -8.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 31.352 -40.135 -7.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 31.985 -38.915 -8.985 1.00 0.00 H new ATOM 667 N PRO A 43 33.347 -38.062 -0.899 1.00 0.00 N ATOM 668 CA PRO A 43 33.572 -38.800 0.332 1.00 0.00 C ATOM 669 C PRO A 43 33.433 -40.305 0.101 1.00 0.00 C ATOM 670 O PRO A 43 32.432 -40.763 -0.449 1.00 0.00 O ATOM 671 CB PRO A 43 32.548 -38.252 1.312 1.00 0.00 C ATOM 672 CG PRO A 43 31.488 -37.564 0.467 1.00 0.00 C ATOM 673 CD PRO A 43 32.047 -37.398 -0.937 1.00 0.00 C ATOM 0 HA PRO A 43 34.582 -38.673 0.720 1.00 0.00 H new ATOM 0 HB2 PRO A 43 32.112 -39.053 1.910 1.00 0.00 H new ATOM 0 HB3 PRO A 43 33.009 -37.550 2.007 1.00 0.00 H new ATOM 0 HG2 PRO A 43 30.573 -38.156 0.446 1.00 0.00 H new ATOM 0 HG3 PRO A 43 31.231 -36.594 0.893 1.00 0.00 H new ATOM 0 HD2 PRO A 43 31.392 -37.852 -1.680 1.00 0.00 H new ATOM 0 HD3 PRO A 43 32.148 -36.345 -1.201 1.00 0.00 H new ATOM 681 N ARG A 44 34.450 -41.035 0.534 1.00 0.00 N ATOM 682 CA ARG A 44 34.454 -42.480 0.382 1.00 0.00 C ATOM 683 C ARG A 44 33.821 -43.144 1.606 1.00 0.00 C ATOM 684 O ARG A 44 34.498 -43.386 2.605 1.00 0.00 O ATOM 685 CB ARG A 44 35.878 -43.010 0.201 1.00 0.00 C ATOM 686 CG ARG A 44 35.916 -44.133 -0.839 1.00 0.00 C ATOM 687 CD ARG A 44 37.327 -44.710 -0.972 1.00 0.00 C ATOM 688 NE ARG A 44 38.115 -43.907 -1.933 1.00 0.00 N ATOM 689 CZ ARG A 44 38.808 -42.808 -1.604 1.00 0.00 C ATOM 690 NH1 ARG A 44 38.815 -42.375 -0.337 1.00 0.00 N ATOM 691 NH2 ARG A 44 39.494 -42.143 -2.543 1.00 0.00 N ATOM 0 H ARG A 44 35.278 -40.652 0.991 1.00 0.00 H new ATOM 0 HA ARG A 44 33.873 -42.722 -0.508 1.00 0.00 H new ATOM 0 HB2 ARG A 44 36.535 -42.198 -0.111 1.00 0.00 H new ATOM 0 HB3 ARG A 44 36.257 -43.379 1.154 1.00 0.00 H new ATOM 0 HG2 ARG A 44 35.222 -44.923 -0.552 1.00 0.00 H new ATOM 0 HG3 ARG A 44 35.583 -43.751 -1.804 1.00 0.00 H new ATOM 0 HD2 ARG A 44 37.820 -44.715 0.000 1.00 0.00 H new ATOM 0 HD3 ARG A 44 37.275 -45.746 -1.308 1.00 0.00 H new ATOM 0 HE ARG A 44 38.132 -44.209 -2.907 1.00 0.00 H new ATOM 0 HH11 ARG A 44 38.293 -42.882 0.378 1.00 0.00 H new ATOM 0 HH12 ARG A 44 39.342 -41.539 -0.087 1.00 0.00 H new ATOM 0 HH21 ARG A 44 39.489 -42.473 -3.508 1.00 0.00 H new ATOM 0 HH22 ARG A 44 40.021 -41.307 -2.293 1.00 0.00 H new ATOM 705 N GLY A 45 32.530 -43.420 1.489 1.00 0.00 N ATOM 706 CA GLY A 45 31.800 -44.052 2.573 1.00 0.00 C ATOM 707 C GLY A 45 31.847 -43.195 3.840 1.00 0.00 C ATOM 708 O GLY A 45 32.501 -42.153 3.864 1.00 0.00 O ATOM 0 H GLY A 45 31.972 -43.217 0.660 1.00 0.00 H new ATOM 0 HA2 GLY A 45 30.764 -44.210 2.275 1.00 0.00 H new ATOM 0 HA3 GLY A 45 32.225 -45.034 2.778 1.00 0.00 H new ATOM 712 N PRO A 46 31.129 -43.677 4.889 1.00 0.00 N ATOM 713 CA PRO A 46 30.383 -44.919 4.777 1.00 0.00 C ATOM 714 C PRO A 46 29.111 -44.721 3.950 1.00 0.00 C ATOM 715 O PRO A 46 28.752 -43.594 3.616 1.00 0.00 O ATOM 716 CB PRO A 46 30.102 -45.340 6.209 1.00 0.00 C ATOM 717 CG PRO A 46 30.292 -44.091 7.056 1.00 0.00 C ATOM 718 CD PRO A 46 31.007 -43.056 6.204 1.00 0.00 C ATOM 0 HA PRO A 46 30.936 -45.696 4.250 1.00 0.00 H new ATOM 0 HB2 PRO A 46 29.089 -45.730 6.310 1.00 0.00 H new ATOM 0 HB3 PRO A 46 30.781 -46.132 6.524 1.00 0.00 H new ATOM 0 HG2 PRO A 46 29.329 -43.708 7.394 1.00 0.00 H new ATOM 0 HG3 PRO A 46 30.875 -44.320 7.948 1.00 0.00 H new ATOM 0 HD2 PRO A 46 30.440 -42.127 6.152 1.00 0.00 H new ATOM 0 HD3 PRO A 46 31.985 -42.810 6.618 1.00 0.00 H new ATOM 726 N ARG A 47 28.463 -45.836 3.645 1.00 0.00 N ATOM 727 CA ARG A 47 27.237 -45.799 2.864 1.00 0.00 C ATOM 728 C ARG A 47 27.518 -45.260 1.461 1.00 0.00 C ATOM 729 O ARG A 47 28.559 -44.649 1.223 1.00 0.00 O ATOM 730 CB ARG A 47 26.181 -44.922 3.539 1.00 0.00 C ATOM 731 CG ARG A 47 24.952 -45.747 3.927 1.00 0.00 C ATOM 732 CD ARG A 47 24.331 -45.226 5.225 1.00 0.00 C ATOM 733 NE ARG A 47 24.559 -46.195 6.320 1.00 0.00 N ATOM 734 CZ ARG A 47 23.902 -47.357 6.444 1.00 0.00 C ATOM 735 NH1 ARG A 47 22.971 -47.700 5.542 1.00 0.00 N ATOM 736 NH2 ARG A 47 24.174 -48.175 7.470 1.00 0.00 N ATOM 0 H ARG A 47 28.763 -46.770 3.924 1.00 0.00 H new ATOM 0 HA ARG A 47 26.856 -46.818 2.795 1.00 0.00 H new ATOM 0 HB2 ARG A 47 26.605 -44.454 4.427 1.00 0.00 H new ATOM 0 HB3 ARG A 47 25.886 -44.118 2.865 1.00 0.00 H new ATOM 0 HG2 ARG A 47 24.215 -45.707 3.125 1.00 0.00 H new ATOM 0 HG3 ARG A 47 25.235 -46.793 4.049 1.00 0.00 H new ATOM 0 HD2 ARG A 47 24.767 -44.262 5.485 1.00 0.00 H new ATOM 0 HD3 ARG A 47 23.262 -45.065 5.087 1.00 0.00 H new ATOM 0 HE ARG A 47 25.260 -45.964 7.024 1.00 0.00 H new ATOM 0 HH11 ARG A 47 22.763 -47.077 4.762 1.00 0.00 H new ATOM 0 HH12 ARG A 47 22.471 -48.584 5.636 1.00 0.00 H new ATOM 0 HH21 ARG A 47 24.881 -47.914 8.157 1.00 0.00 H new ATOM 0 HH22 ARG A 47 23.674 -49.059 7.564 1.00 0.00 H new ATOM 750 N GLY A 48 26.571 -45.505 0.566 1.00 0.00 N ATOM 751 CA GLY A 48 26.704 -45.050 -0.807 1.00 0.00 C ATOM 752 C GLY A 48 25.366 -44.542 -1.348 1.00 0.00 C ATOM 753 O GLY A 48 24.760 -45.175 -2.211 1.00 0.00 O ATOM 0 H GLY A 48 25.709 -46.013 0.766 1.00 0.00 H new ATOM 0 HA2 GLY A 48 27.447 -44.255 -0.860 1.00 0.00 H new ATOM 0 HA3 GLY A 48 27.066 -45.867 -1.431 1.00 0.00 H new ATOM 757 N PRO A 49 24.933 -43.374 -0.804 1.00 0.00 N ATOM 758 CA PRO A 49 23.679 -42.773 -1.223 1.00 0.00 C ATOM 759 C PRO A 49 23.815 -42.120 -2.600 1.00 0.00 C ATOM 760 O PRO A 49 24.920 -41.798 -3.031 1.00 0.00 O ATOM 761 CB PRO A 49 23.333 -41.778 -0.126 1.00 0.00 C ATOM 762 CG PRO A 49 24.629 -41.522 0.626 1.00 0.00 C ATOM 763 CD PRO A 49 25.624 -42.596 0.220 1.00 0.00 C ATOM 0 HA PRO A 49 22.882 -43.507 -1.344 1.00 0.00 H new ATOM 0 HB2 PRO A 49 22.936 -40.854 -0.547 1.00 0.00 H new ATOM 0 HB3 PRO A 49 22.568 -42.179 0.539 1.00 0.00 H new ATOM 0 HG2 PRO A 49 25.018 -40.532 0.389 1.00 0.00 H new ATOM 0 HG3 PRO A 49 24.457 -41.548 1.702 1.00 0.00 H new ATOM 0 HD2 PRO A 49 26.543 -42.158 -0.169 1.00 0.00 H new ATOM 0 HD3 PRO A 49 25.903 -43.219 1.070 1.00 0.00 H new ATOM 771 N ARG A 50 22.675 -41.947 -3.253 1.00 0.00 N ATOM 772 CA ARG A 50 22.654 -41.340 -4.573 1.00 0.00 C ATOM 773 C ARG A 50 23.584 -42.099 -5.522 1.00 0.00 C ATOM 774 O ARG A 50 24.785 -41.837 -5.560 1.00 0.00 O ATOM 775 CB ARG A 50 23.085 -39.874 -4.512 1.00 0.00 C ATOM 776 CG ARG A 50 22.527 -39.087 -5.699 1.00 0.00 C ATOM 777 CD ARG A 50 22.195 -37.649 -5.298 1.00 0.00 C ATOM 778 NE ARG A 50 21.053 -37.151 -6.099 1.00 0.00 N ATOM 779 CZ ARG A 50 20.777 -35.853 -6.285 1.00 0.00 C ATOM 780 NH1 ARG A 50 21.555 -34.915 -5.728 1.00 0.00 N ATOM 781 NH2 ARG A 50 19.722 -35.493 -7.027 1.00 0.00 N ATOM 0 H ARG A 50 21.760 -42.216 -2.893 1.00 0.00 H new ATOM 0 HA ARG A 50 21.631 -41.391 -4.945 1.00 0.00 H new ATOM 0 HB2 ARG A 50 22.738 -39.428 -3.580 1.00 0.00 H new ATOM 0 HB3 ARG A 50 24.173 -39.811 -4.509 1.00 0.00 H new ATOM 0 HG2 ARG A 50 23.254 -39.083 -6.511 1.00 0.00 H new ATOM 0 HG3 ARG A 50 21.631 -39.579 -6.077 1.00 0.00 H new ATOM 0 HD2 ARG A 50 21.952 -37.606 -4.236 1.00 0.00 H new ATOM 0 HD3 ARG A 50 23.064 -37.010 -5.452 1.00 0.00 H new ATOM 0 HE ARG A 50 20.439 -37.838 -6.536 1.00 0.00 H new ATOM 0 HH11 ARG A 50 22.358 -35.189 -5.162 1.00 0.00 H new ATOM 0 HH12 ARG A 50 21.344 -33.927 -5.870 1.00 0.00 H new ATOM 0 HH21 ARG A 50 19.129 -36.207 -7.450 1.00 0.00 H new ATOM 0 HH22 ARG A 50 19.512 -34.505 -7.169 1.00 0.00 H new ATOM 795 N PRO A 51 22.978 -43.049 -6.283 1.00 0.00 N ATOM 796 CA PRO A 51 23.739 -43.847 -7.229 1.00 0.00 C ATOM 797 C PRO A 51 24.098 -43.030 -8.472 1.00 0.00 C ATOM 798 O PRO A 51 25.258 -42.991 -8.879 1.00 0.00 O ATOM 799 CB PRO A 51 22.851 -45.042 -7.540 1.00 0.00 C ATOM 800 CG PRO A 51 21.446 -44.636 -7.123 1.00 0.00 C ATOM 801 CD PRO A 51 21.558 -43.386 -6.265 1.00 0.00 C ATOM 0 HA PRO A 51 24.698 -44.174 -6.827 1.00 0.00 H new ATOM 0 HB2 PRO A 51 22.887 -45.290 -8.601 1.00 0.00 H new ATOM 0 HB3 PRO A 51 23.180 -45.926 -6.994 1.00 0.00 H new ATOM 0 HG2 PRO A 51 20.828 -44.443 -8.000 1.00 0.00 H new ATOM 0 HG3 PRO A 51 20.966 -45.440 -6.565 1.00 0.00 H new ATOM 0 HD2 PRO A 51 20.953 -42.574 -6.668 1.00 0.00 H new ATOM 0 HD3 PRO A 51 21.208 -43.570 -5.249 1.00 0.00 H new ATOM 809 N GLN A 52 23.082 -42.398 -9.040 1.00 0.00 N ATOM 810 CA GLN A 52 23.276 -41.585 -10.228 1.00 0.00 C ATOM 811 C GLN A 52 21.998 -40.811 -10.557 1.00 0.00 C ATOM 812 O GLN A 52 22.004 -39.582 -10.592 1.00 0.00 O ATOM 813 CB GLN A 52 23.717 -42.444 -11.415 1.00 0.00 C ATOM 814 CG GLN A 52 24.176 -41.570 -12.584 1.00 0.00 C ATOM 815 CD GLN A 52 23.063 -41.418 -13.624 1.00 0.00 C ATOM 816 OE1 GLN A 52 22.226 -42.287 -13.807 1.00 0.00 O ATOM 817 NE2 GLN A 52 23.100 -40.269 -14.293 1.00 0.00 N ATOM 0 H GLN A 52 22.121 -42.433 -8.699 1.00 0.00 H new ATOM 0 HA GLN A 52 24.071 -40.867 -10.026 1.00 0.00 H new ATOM 0 HB2 GLN A 52 24.529 -43.104 -11.109 1.00 0.00 H new ATOM 0 HB3 GLN A 52 22.892 -43.081 -11.734 1.00 0.00 H new ATOM 0 HG2 GLN A 52 24.470 -40.588 -12.215 1.00 0.00 H new ATOM 0 HG3 GLN A 52 25.056 -42.012 -13.050 1.00 0.00 H new ATOM 0 HE21 GLN A 52 23.828 -39.584 -14.090 1.00 0.00 H new ATOM 0 HE22 GLN A 52 22.400 -40.073 -15.009 1.00 0.00 H new ATOM 826 N THR A 53 20.932 -41.563 -10.789 1.00 0.00 N ATOM 827 CA THR A 53 19.649 -40.964 -11.113 1.00 0.00 C ATOM 828 C THR A 53 19.844 -39.734 -12.002 1.00 0.00 C ATOM 829 O THR A 53 20.853 -39.620 -12.697 1.00 0.00 O ATOM 830 CB THR A 53 18.925 -40.656 -9.801 1.00 0.00 C ATOM 831 OG1 THR A 53 19.733 -39.657 -9.185 1.00 0.00 O ATOM 832 CG2 THR A 53 18.970 -41.829 -8.819 1.00 0.00 C ATOM 0 H THR A 53 20.931 -42.583 -10.759 1.00 0.00 H new ATOM 0 HA THR A 53 19.028 -41.649 -11.690 1.00 0.00 H new ATOM 0 HB THR A 53 17.887 -40.397 -10.011 1.00 0.00 H new ATOM 0 HG1 THR A 53 19.335 -39.398 -8.328 1.00 0.00 H new ATOM 0 HG21 THR A 53 18.442 -41.558 -7.905 1.00 0.00 H new ATOM 0 HG22 THR A 53 18.493 -42.699 -9.270 1.00 0.00 H new ATOM 0 HG23 THR A 53 20.007 -42.066 -8.582 1.00 0.00 H new ATOM 840 N SER A 54 18.863 -38.844 -11.950 1.00 0.00 N ATOM 841 CA SER A 54 18.915 -37.627 -12.743 1.00 0.00 C ATOM 842 C SER A 54 18.966 -37.973 -14.232 1.00 0.00 C ATOM 843 O SER A 54 19.576 -38.968 -14.621 1.00 0.00 O ATOM 844 CB SER A 54 20.122 -36.769 -12.356 1.00 0.00 C ATOM 845 OG SER A 54 20.415 -35.784 -13.343 1.00 0.00 O ATOM 0 H SER A 54 18.028 -38.941 -11.372 1.00 0.00 H new ATOM 0 HA SER A 54 18.013 -37.050 -12.542 1.00 0.00 H new ATOM 0 HB2 SER A 54 19.928 -36.279 -11.402 1.00 0.00 H new ATOM 0 HB3 SER A 54 20.992 -37.410 -12.214 1.00 0.00 H new ATOM 0 HG SER A 54 21.190 -35.256 -13.058 1.00 0.00 H new ATOM 851 N LEU A 55 18.316 -37.134 -15.025 1.00 0.00 N ATOM 852 CA LEU A 55 18.278 -37.338 -16.462 1.00 0.00 C ATOM 853 C LEU A 55 17.341 -38.504 -16.783 1.00 0.00 C ATOM 854 O LEU A 55 16.263 -38.303 -17.341 1.00 0.00 O ATOM 855 CB LEU A 55 19.694 -37.518 -17.014 1.00 0.00 C ATOM 856 CG LEU A 55 19.875 -37.226 -18.505 1.00 0.00 C ATOM 857 CD1 LEU A 55 19.333 -38.373 -19.359 1.00 0.00 C ATOM 858 CD2 LEU A 55 19.242 -35.884 -18.881 1.00 0.00 C ATOM 0 H LEU A 55 17.811 -36.310 -14.698 1.00 0.00 H new ATOM 0 HA LEU A 55 17.874 -36.457 -16.961 1.00 0.00 H new ATOM 0 HB2 LEU A 55 20.367 -36.869 -16.453 1.00 0.00 H new ATOM 0 HB3 LEU A 55 20.009 -38.544 -16.824 1.00 0.00 H new ATOM 0 HG LEU A 55 20.943 -37.149 -18.710 1.00 0.00 H new ATOM 0 HD11 LEU A 55 19.474 -38.139 -20.414 1.00 0.00 H new ATOM 0 HD12 LEU A 55 19.867 -39.291 -19.116 1.00 0.00 H new ATOM 0 HD13 LEU A 55 18.270 -38.507 -19.156 1.00 0.00 H new ATOM 0 HD21 LEU A 55 19.385 -35.700 -19.946 1.00 0.00 H new ATOM 0 HD22 LEU A 55 18.176 -35.909 -18.657 1.00 0.00 H new ATOM 0 HD23 LEU A 55 19.714 -35.086 -18.309 1.00 0.00 H new ATOM 870 N LEU A 56 17.785 -39.698 -16.417 1.00 0.00 N ATOM 871 CA LEU A 56 16.999 -40.895 -16.659 1.00 0.00 C ATOM 872 C LEU A 56 15.666 -40.784 -15.916 1.00 0.00 C ATOM 873 O LEU A 56 15.357 -41.615 -15.062 1.00 0.00 O ATOM 874 CB LEU A 56 17.803 -42.146 -16.297 1.00 0.00 C ATOM 875 CG LEU A 56 17.650 -43.339 -17.243 1.00 0.00 C ATOM 876 CD1 LEU A 56 16.210 -43.856 -17.243 1.00 0.00 C ATOM 877 CD2 LEU A 56 18.134 -42.988 -18.651 1.00 0.00 C ATOM 0 H LEU A 56 18.679 -39.861 -15.955 1.00 0.00 H new ATOM 0 HA LEU A 56 16.766 -40.990 -17.720 1.00 0.00 H new ATOM 0 HB2 LEU A 56 18.858 -41.876 -16.253 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.513 -42.463 -15.295 1.00 0.00 H new ATOM 0 HG LEU A 56 18.283 -44.148 -16.879 1.00 0.00 H new ATOM 0 HD11 LEU A 56 16.128 -44.704 -17.923 1.00 0.00 H new ATOM 0 HD12 LEU A 56 15.936 -44.171 -16.236 1.00 0.00 H new ATOM 0 HD13 LEU A 56 15.538 -43.062 -17.570 1.00 0.00 H new ATOM 0 HD21 LEU A 56 18.014 -43.853 -19.303 1.00 0.00 H new ATOM 0 HD22 LEU A 56 17.547 -42.156 -19.041 1.00 0.00 H new ATOM 0 HD23 LEU A 56 19.186 -42.704 -18.614 1.00 0.00 H new TER 889 LEU A 56 ATOM 890 P A B 493 21.756 -31.613 -6.810 1.00 0.00 P ATOM 891 OP1 A B 493 20.397 -31.427 -6.256 1.00 0.00 O ATOM 892 OP2 A B 493 21.971 -31.248 -8.228 1.00 0.00 O ATOM 893 O5' A B 493 22.775 -30.759 -5.920 1.00 0.00 O ATOM 894 C5' A B 493 22.440 -29.427 -5.533 1.00 0.00 C ATOM 895 C4' A B 493 22.981 -29.135 -4.152 1.00 0.00 C ATOM 896 O4' A B 493 22.521 -30.148 -3.237 1.00 0.00 O ATOM 897 C3' A B 493 24.450 -29.501 -3.960 1.00 0.00 C ATOM 898 O3' A B 493 25.270 -28.453 -4.471 1.00 0.00 O ATOM 899 C2' A B 493 24.627 -29.668 -2.476 1.00 0.00 C ATOM 900 O2' A B 493 24.714 -28.334 -2.023 1.00 0.00 O ATOM 901 C1' A B 493 23.338 -30.400 -2.116 1.00 0.00 C ATOM 902 N9 A B 493 23.524 -31.851 -1.906 1.00 0.00 N ATOM 903 C8 A B 493 23.373 -32.837 -2.814 1.00 0.00 C ATOM 904 N7 A B 493 23.614 -34.042 -2.309 1.00 0.00 N ATOM 905 C5 A B 493 23.936 -33.792 -1.002 1.00 0.00 C ATOM 906 C6 A B 493 24.292 -34.655 0.056 1.00 0.00 C ATOM 907 N6 A B 493 24.385 -36.006 -0.053 1.00 0.00 N ATOM 908 N1 A B 493 24.560 -34.089 1.264 1.00 0.00 N ATOM 909 C2 A B 493 24.469 -32.746 1.380 1.00 0.00 C ATOM 910 N3 A B 493 24.142 -31.832 0.448 1.00 0.00 N ATOM 911 C4 A B 493 23.887 -32.460 -0.734 1.00 0.00 C ATOM 0 H5' A B 493 21.358 -29.299 -5.543 1.00 0.00 H new ATOM 0 H5'' A B 493 22.851 -28.717 -6.251 1.00 0.00 H new ATOM 0 H4' A B 493 22.718 -28.087 -4.011 1.00 0.00 H new ATOM 0 H3' A B 493 24.734 -30.411 -4.489 1.00 0.00 H new ATOM 0 H2' A B 493 25.479 -30.213 -2.070 1.00 0.00 H new ATOM 0 HO2' A B 493 25.020 -27.759 -2.755 1.00 0.00 H new ATOM 0 H1' A B 493 22.921 -30.056 -1.169 1.00 0.00 H new ATOM 0 H8 A B 493 23.087 -32.665 -3.841 1.00 0.00 H new ATOM 0 H61 A B 493 24.649 -36.566 0.758 1.00 0.00 H new ATOM 0 H62 A B 493 24.191 -36.460 -0.946 1.00 0.00 H new ATOM 0 H2 A B 493 24.690 -32.350 2.360 1.00 0.00 H new ATOM 923 P A B 494 25.793 -28.510 -5.982 1.00 0.00 P ATOM 924 OP1 A B 494 26.066 -27.139 -6.468 1.00 0.00 O ATOM 925 OP2 A B 494 24.885 -29.354 -6.792 1.00 0.00 O ATOM 926 O5' A B 494 27.192 -29.275 -5.851 1.00 0.00 O ATOM 927 C5' A B 494 27.921 -29.636 -7.022 1.00 0.00 C ATOM 928 C4' A B 494 28.031 -31.141 -7.123 1.00 0.00 C ATOM 929 O4' A B 494 29.252 -31.417 -6.371 1.00 0.00 O ATOM 930 C3' A B 494 26.946 -31.904 -6.369 1.00 0.00 C ATOM 931 O3' A B 494 26.217 -32.720 -7.283 1.00 0.00 O ATOM 932 C2' A B 494 27.680 -32.734 -5.351 1.00 0.00 C ATOM 933 O2' A B 494 27.950 -33.924 -6.058 1.00 0.00 O ATOM 934 C1' A B 494 28.889 -31.844 -5.078 1.00 0.00 C ATOM 935 N9 A B 494 28.589 -30.694 -4.200 1.00 0.00 N ATOM 936 C8 A B 494 27.670 -30.635 -3.212 1.00 0.00 C ATOM 937 N7 A B 494 27.646 -29.453 -2.606 1.00 0.00 N ATOM 938 C5 A B 494 28.610 -28.729 -3.256 1.00 0.00 C ATOM 939 C6 A B 494 29.062 -27.405 -3.079 1.00 0.00 C ATOM 940 N6 A B 494 28.576 -26.543 -2.149 1.00 0.00 N ATOM 941 N1 A B 494 30.055 -26.968 -3.900 1.00 0.00 N ATOM 942 C2 A B 494 30.546 -27.819 -4.829 1.00 0.00 C ATOM 943 N3 A B 494 30.192 -29.092 -5.085 1.00 0.00 N ATOM 944 C4 A B 494 29.198 -29.467 -4.233 1.00 0.00 C ATOM 0 H5' A B 494 28.916 -29.192 -6.991 1.00 0.00 H new ATOM 0 H5'' A B 494 27.422 -29.240 -7.907 1.00 0.00 H new ATOM 0 H4' A B 494 27.980 -31.439 -8.170 1.00 0.00 H new ATOM 0 H3' A B 494 26.222 -31.247 -5.886 1.00 0.00 H new ATOM 0 H2' A B 494 27.211 -33.009 -4.406 1.00 0.00 H new ATOM 0 HO2' A B 494 28.896 -34.158 -5.956 1.00 0.00 H new ATOM 0 H1' A B 494 29.676 -32.375 -4.542 1.00 0.00 H new ATOM 0 H8 A B 494 27.025 -31.459 -2.944 1.00 0.00 H new ATOM 0 H61 A B 494 28.955 -25.598 -2.082 1.00 0.00 H new ATOM 0 H62 A B 494 27.832 -26.840 -1.518 1.00 0.00 H new ATOM 0 H2 A B 494 31.333 -27.421 -5.453 1.00 0.00 H new ATOM 956 P C B 495 25.551 -32.067 -8.582 1.00 0.00 P ATOM 957 OP1 C B 495 26.003 -30.665 -8.723 1.00 0.00 O ATOM 958 OP2 C B 495 24.092 -32.315 -8.572 1.00 0.00 O ATOM 959 O5' C B 495 26.189 -32.916 -9.779 1.00 0.00 O ATOM 960 C5' C B 495 26.784 -34.185 -9.515 1.00 0.00 C ATOM 961 C4' C B 495 27.748 -34.546 -10.624 1.00 0.00 C ATOM 962 O4' C B 495 28.940 -34.931 -9.918 1.00 0.00 O ATOM 963 C3' C B 495 27.436 -35.866 -11.324 1.00 0.00 C ATOM 964 O3' C B 495 26.752 -35.603 -12.547 1.00 0.00 O ATOM 965 C2' C B 495 28.771 -36.513 -11.566 1.00 0.00 C ATOM 966 O2' C B 495 29.245 -35.827 -12.704 1.00 0.00 O ATOM 967 C1' C B 495 29.487 -36.184 -10.259 1.00 0.00 C ATOM 968 N1 C B 495 29.250 -37.178 -9.192 1.00 0.00 N ATOM 969 C2 C B 495 29.857 -38.427 -9.323 1.00 0.00 C ATOM 970 O2 C B 495 30.559 -38.642 -10.318 1.00 0.00 O ATOM 971 N3 C B 495 29.656 -39.349 -8.365 1.00 0.00 N ATOM 972 C4 C B 495 28.904 -39.102 -7.310 1.00 0.00 C ATOM 973 N4 C B 495 28.719 -40.025 -6.375 1.00 0.00 N ATOM 974 C5 C B 495 28.264 -37.817 -7.150 1.00 0.00 C ATOM 975 C6 C B 495 28.475 -36.908 -8.114 1.00 0.00 C ATOM 0 H5' C B 495 26.010 -34.948 -9.432 1.00 0.00 H new ATOM 0 H5'' C B 495 27.309 -34.158 -8.560 1.00 0.00 H new ATOM 0 H4' C B 495 27.760 -33.718 -11.333 1.00 0.00 H new ATOM 0 H3' C B 495 26.791 -36.517 -10.734 1.00 0.00 H new ATOM 0 H2' C B 495 28.849 -37.582 -11.765 1.00 0.00 H new ATOM 0 HO2' C B 495 28.487 -35.569 -13.270 1.00 0.00 H new ATOM 0 H1' C B 495 30.571 -36.185 -10.374 1.00 0.00 H new ATOM 0 H41 C B 495 28.135 -39.820 -5.564 1.00 0.00 H new ATOM 0 H42 C B 495 29.161 -40.940 -6.467 1.00 0.00 H new ATOM 0 H5 C B 495 27.644 -37.598 -6.293 1.00 0.00 H new ATOM 0 H6 C B 495 28.015 -35.935 -8.028 1.00 0.00 H new ATOM 987 P A B 496 25.152 -35.609 -12.587 1.00 0.00 P ATOM 988 OP1 A B 496 24.647 -34.219 -12.550 1.00 0.00 O ATOM 989 OP2 A B 496 24.633 -36.553 -11.572 1.00 0.00 O ATOM 990 O5' A B 496 24.832 -36.213 -14.034 1.00 0.00 O ATOM 991 C5' A B 496 23.839 -35.604 -14.857 1.00 0.00 C ATOM 992 C4' A B 496 24.481 -34.610 -15.797 1.00 0.00 C ATOM 993 O4' A B 496 24.740 -33.458 -14.978 1.00 0.00 O ATOM 994 C3' A B 496 25.974 -34.832 -16.026 1.00 0.00 C ATOM 995 O3' A B 496 26.156 -35.795 -17.062 1.00 0.00 O ATOM 996 C2' A B 496 26.520 -33.487 -16.419 1.00 0.00 C ATOM 997 O2' A B 496 26.221 -33.423 -17.796 1.00 0.00 O ATOM 998 C1' A B 496 25.690 -32.571 -15.525 1.00 0.00 C ATOM 999 N9 A B 496 26.479 -31.911 -14.464 1.00 0.00 N ATOM 1000 C8 A B 496 26.902 -32.452 -13.302 1.00 0.00 C ATOM 1001 N7 A B 496 27.593 -31.593 -12.558 1.00 0.00 N ATOM 1002 C5 A B 496 27.600 -30.445 -13.304 1.00 0.00 C ATOM 1003 C6 A B 496 28.170 -29.177 -13.062 1.00 0.00 C ATOM 1004 N6 A B 496 28.871 -28.849 -11.946 1.00 0.00 N ATOM 1005 N1 A B 496 28.000 -28.222 -14.017 1.00 0.00 N ATOM 1006 C2 A B 496 27.303 -28.540 -15.130 1.00 0.00 C ATOM 1007 N3 A B 496 26.721 -29.707 -15.464 1.00 0.00 N ATOM 1008 C4 A B 496 26.926 -30.616 -14.471 1.00 0.00 C ATOM 0 H5' A B 496 23.098 -35.102 -14.235 1.00 0.00 H new ATOM 0 H5'' A B 496 23.311 -36.367 -15.428 1.00 0.00 H new ATOM 0 H4' A B 496 23.854 -34.609 -16.688 1.00 0.00 H new ATOM 0 H3' A B 496 26.487 -35.216 -15.144 1.00 0.00 H new ATOM 0 H2' A B 496 27.577 -33.252 -16.297 1.00 0.00 H new ATOM 0 HO2' A B 496 26.107 -34.330 -18.148 1.00 0.00 H new ATOM 0 H1' A B 496 25.259 -31.737 -16.079 1.00 0.00 H new ATOM 0 H8 A B 496 26.701 -33.472 -13.008 1.00 0.00 H new ATOM 0 H61 A B 496 29.254 -27.909 -11.842 1.00 0.00 H new ATOM 0 H62 A B 496 29.015 -29.542 -11.212 1.00 0.00 H new ATOM 0 H2 A B 496 27.198 -27.746 -15.854 1.00 0.00 H new ATOM 1020 P G B 497 26.491 -37.315 -16.693 1.00 0.00 P ATOM 1021 OP1 G B 497 25.239 -38.099 -16.621 1.00 0.00 O ATOM 1022 OP2 G B 497 27.391 -37.355 -15.518 1.00 0.00 O ATOM 1023 O5' G B 497 27.319 -37.819 -17.965 1.00 0.00 O ATOM 1024 C5' G B 497 27.050 -37.272 -19.255 1.00 0.00 C ATOM 1025 C4' G B 497 28.342 -36.879 -19.933 1.00 0.00 C ATOM 1026 O4' G B 497 28.845 -35.703 -19.227 1.00 0.00 O ATOM 1027 C3' G B 497 29.536 -37.762 -19.576 1.00 0.00 C ATOM 1028 O3' G B 497 29.581 -38.878 -20.464 1.00 0.00 O ATOM 1029 C2' G B 497 30.743 -36.881 -19.734 1.00 0.00 C ATOM 1030 O2' G B 497 30.908 -36.829 -21.134 1.00 0.00 O ATOM 1031 C1' G B 497 30.243 -35.594 -19.085 1.00 0.00 C ATOM 1032 N9 G B 497 30.626 -35.464 -17.662 1.00 0.00 N ATOM 1033 C8 G B 497 30.047 -36.062 -16.600 1.00 0.00 C ATOM 1034 N7 G B 497 30.629 -35.739 -15.450 1.00 0.00 N ATOM 1035 C5 G B 497 31.634 -34.886 -15.819 1.00 0.00 C ATOM 1036 C6 G B 497 32.605 -34.201 -15.057 1.00 0.00 C ATOM 1037 O6 G B 497 32.723 -34.260 -13.834 1.00 0.00 O ATOM 1038 N1 G B 497 33.485 -33.411 -15.730 1.00 0.00 N ATOM 1039 C2 G B 497 33.380 -33.328 -17.075 1.00 0.00 C ATOM 1040 N2 G B 497 34.307 -32.520 -17.584 1.00 0.00 N ATOM 1041 N3 G B 497 32.501 -33.931 -17.896 1.00 0.00 N ATOM 1042 C4 G B 497 31.651 -34.704 -17.165 1.00 0.00 C ATOM 0 H5' G B 497 26.400 -36.402 -19.161 1.00 0.00 H new ATOM 0 H5'' G B 497 26.518 -38.003 -19.865 1.00 0.00 H new ATOM 0 H4' G B 497 28.095 -36.849 -20.994 1.00 0.00 H new ATOM 0 H3' G B 497 29.480 -38.164 -18.564 1.00 0.00 H new ATOM 0 H2' G B 497 31.702 -37.159 -19.297 1.00 0.00 H new ATOM 0 HO2' G B 497 30.470 -37.604 -21.544 1.00 0.00 H new ATOM 0 H1' G B 497 30.674 -34.707 -19.549 1.00 0.00 H new ATOM 0 H8 G B 497 29.202 -36.731 -16.676 1.00 0.00 H new ATOM 0 H1 G B 497 34.208 -32.893 -15.231 1.00 0.00 H new ATOM 0 H21 G B 497 34.348 -32.362 -18.591 1.00 0.00 H new ATOM 0 H22 G B 497 34.976 -32.059 -16.967 1.00 0.00 H new ATOM 1054 P U B 498 30.633 -40.057 -20.212 1.00 0.00 P ATOM 1055 OP1 U B 498 31.183 -39.951 -18.841 1.00 0.00 O ATOM 1056 OP2 U B 498 31.599 -40.111 -21.332 1.00 0.00 O ATOM 1057 O5' U B 498 29.724 -41.371 -20.280 1.00 0.00 O ATOM 1058 C5' U B 498 29.464 -41.995 -21.535 1.00 0.00 C ATOM 1059 C4' U B 498 30.334 -43.221 -21.697 1.00 0.00 C ATOM 1060 O4' U B 498 31.718 -42.828 -21.642 1.00 0.00 O ATOM 1061 C3' U B 498 30.484 -44.059 -20.430 1.00 0.00 C ATOM 1062 O3' U B 498 29.315 -44.876 -20.262 1.00 0.00 O ATOM 1063 C2' U B 498 31.715 -44.894 -20.650 1.00 0.00 C ATOM 1064 O2' U B 498 31.226 -45.972 -21.417 1.00 0.00 O ATOM 1065 C1' U B 498 32.600 -43.903 -21.402 1.00 0.00 C ATOM 1066 N1 U B 498 33.780 -43.464 -20.630 1.00 0.00 N ATOM 1067 C2 U B 498 34.845 -44.313 -20.620 1.00 0.00 C ATOM 1068 O2 U B 498 34.860 -45.385 -21.203 1.00 0.00 O ATOM 1069 N3 U B 498 35.946 -43.905 -19.901 1.00 0.00 N ATOM 1070 C4 U B 498 36.010 -42.717 -19.218 1.00 0.00 C ATOM 1071 O4 U B 498 37.046 -42.456 -18.610 1.00 0.00 O ATOM 1072 C5 U B 498 34.872 -41.868 -19.262 1.00 0.00 C ATOM 1073 C6 U B 498 33.816 -42.282 -19.965 1.00 0.00 C ATOM 0 H5' U B 498 29.657 -41.293 -22.346 1.00 0.00 H new ATOM 0 H5'' U B 498 28.413 -42.275 -21.600 1.00 0.00 H new ATOM 0 H4' U B 498 29.899 -43.702 -22.573 1.00 0.00 H new ATOM 0 H3' U B 498 30.582 -43.455 -19.528 1.00 0.00 H new ATOM 0 H2' U B 498 32.269 -45.310 -19.808 1.00 0.00 H new ATOM 0 HO2' U B 498 30.267 -46.083 -21.250 1.00 0.00 H new ATOM 0 HO3' U B 498 29.408 -45.417 -19.450 1.00 0.00 H new ATOM 0 H1' U B 498 33.032 -44.340 -22.302 1.00 0.00 H new ATOM 0 H3 U B 498 36.759 -44.520 -19.875 1.00 0.00 H new ATOM 0 H5 U B 498 34.862 -40.920 -18.744 1.00 0.00 H new ATOM 0 H6 U B 498 32.946 -41.644 -20.007 1.00 0.00 H new TER 1084 U B 498 HETATM 1085 ZN ZN A 57 36.405 -32.137 -8.457 1.00 0.00 ZN