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 Set 1.1: A 28 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: B 494 A O2' : rot 142:sc= -0.51! USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot -69:sc= 0.41 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc=-0.00984 X(o=-0.0098,f=0) USER MOD Single : A 12 GLN : amide:sc= -0.0137 X(o=-0.014,f=-0.015) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= -0.0674 K(o=-0.067,f=-0.97) USER MOD Single : A 25 GLN : amide:sc= -0.498 K(o=-0.5,f=-6.1!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 148:sc= 0.49 (180deg=-0.093) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 142:sc= 0.0207! (180deg=-0.5!) USER MOD Single : A 52 GLN : amide:sc= -0.198 K(o=-0.2,f=-0.76) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 29:sc= 0.427 USER MOD Single : B 493 A O2' : rot -26:sc= 0.388 USER MOD Single : B 495 C O2' : rot -34:sc= 1.26 USER MOD Single : B 496 A O2' : rot -32:sc= 0.335 USER MOD Single : B 497 G O2' : rot -18:sc= 0.477 USER MOD Single : B 498 U O2' : rot -26:sc= 0.42 USER MOD Single : B 498 U O3' : rot 180:sc= 0.379 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 5.189 -39.798 24.110 1.00 0.00 N ATOM 2 CA ALA A 1 5.485 -38.817 23.081 1.00 0.00 C ATOM 3 C ALA A 1 6.967 -38.899 22.714 1.00 0.00 C ATOM 4 O ALA A 1 7.831 -38.846 23.588 1.00 0.00 O ATOM 5 CB ALA A 1 5.082 -37.425 23.570 1.00 0.00 C ATOM 0 H1 ALA A 1 4.181 -39.744 24.361 1.00 0.00 H new ATOM 0 H2 ALA A 1 5.407 -40.751 23.754 1.00 0.00 H new ATOM 0 H3 ALA A 1 5.767 -39.603 24.952 1.00 0.00 H new ATOM 0 HA ALA A 1 4.910 -39.024 22.178 1.00 0.00 H new ATOM 0 HB1 ALA A 1 5.305 -36.689 22.797 1.00 0.00 H new ATOM 0 HB2 ALA A 1 4.014 -37.411 23.788 1.00 0.00 H new ATOM 0 HB3 ALA A 1 5.640 -37.181 24.474 1.00 0.00 H new ATOM 11 N THR A 2 7.218 -39.028 21.419 1.00 0.00 N ATOM 12 CA THR A 2 8.582 -39.119 20.927 1.00 0.00 C ATOM 13 C THR A 2 8.600 -39.088 19.397 1.00 0.00 C ATOM 14 O THR A 2 8.996 -40.060 18.756 1.00 0.00 O ATOM 15 CB THR A 2 9.215 -40.382 21.515 1.00 0.00 C ATOM 16 OG1 THR A 2 10.524 -40.409 20.953 1.00 0.00 O ATOM 17 CG2 THR A 2 8.560 -41.662 20.994 1.00 0.00 C ATOM 0 H THR A 2 6.500 -39.072 20.696 1.00 0.00 H new ATOM 0 HA THR A 2 9.175 -38.262 21.247 1.00 0.00 H new ATOM 0 HB THR A 2 9.140 -40.352 22.602 1.00 0.00 H new ATOM 0 HG1 THR A 2 10.464 -40.603 19.994 1.00 0.00 H new ATOM 0 HG21 THR A 2 9.047 -42.528 21.442 1.00 0.00 H new ATOM 0 HG22 THR A 2 7.502 -41.663 21.258 1.00 0.00 H new ATOM 0 HG23 THR A 2 8.664 -41.708 19.910 1.00 0.00 H new ATOM 25 N VAL A 3 8.165 -37.959 18.855 1.00 0.00 N ATOM 26 CA VAL A 3 8.126 -37.788 17.413 1.00 0.00 C ATOM 27 C VAL A 3 9.555 -37.776 16.866 1.00 0.00 C ATOM 28 O VAL A 3 10.502 -37.501 17.601 1.00 0.00 O ATOM 29 CB VAL A 3 7.339 -36.525 17.057 1.00 0.00 C ATOM 30 CG1 VAL A 3 8.091 -35.267 17.499 1.00 0.00 C ATOM 31 CG2 VAL A 3 7.024 -36.478 15.561 1.00 0.00 C ATOM 0 H VAL A 3 7.837 -37.154 19.389 1.00 0.00 H new ATOM 0 HA VAL A 3 7.605 -38.623 16.943 1.00 0.00 H new ATOM 0 HB VAL A 3 6.393 -36.557 17.597 1.00 0.00 H new ATOM 0 HG11 VAL A 3 7.510 -34.384 17.234 1.00 0.00 H new ATOM 0 HG12 VAL A 3 8.240 -35.293 18.578 1.00 0.00 H new ATOM 0 HG13 VAL A 3 9.059 -35.228 17.000 1.00 0.00 H new ATOM 0 HG21 VAL A 3 6.464 -35.570 15.335 1.00 0.00 H new ATOM 0 HG22 VAL A 3 7.954 -36.481 14.993 1.00 0.00 H new ATOM 0 HG23 VAL A 3 6.429 -37.349 15.287 1.00 0.00 H new ATOM 41 N VAL A 4 9.665 -38.075 15.580 1.00 0.00 N ATOM 42 CA VAL A 4 10.962 -38.101 14.927 1.00 0.00 C ATOM 43 C VAL A 4 10.872 -37.358 13.593 1.00 0.00 C ATOM 44 O VAL A 4 9.789 -36.944 13.181 1.00 0.00 O ATOM 45 CB VAL A 4 11.441 -39.547 14.774 1.00 0.00 C ATOM 46 CG1 VAL A 4 11.617 -40.213 16.140 1.00 0.00 C ATOM 47 CG2 VAL A 4 10.486 -40.351 13.889 1.00 0.00 C ATOM 0 H VAL A 4 8.877 -38.301 14.973 1.00 0.00 H new ATOM 0 HA VAL A 4 11.706 -37.587 15.536 1.00 0.00 H new ATOM 0 HB VAL A 4 12.414 -39.528 14.283 1.00 0.00 H new ATOM 0 HG11 VAL A 4 11.958 -41.239 16.003 1.00 0.00 H new ATOM 0 HG12 VAL A 4 12.354 -39.660 16.722 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.664 -40.215 16.669 1.00 0.00 H new ATOM 0 HG21 VAL A 4 10.850 -41.374 13.797 1.00 0.00 H new ATOM 0 HG22 VAL A 4 9.493 -40.358 14.338 1.00 0.00 H new ATOM 0 HG23 VAL A 4 10.434 -39.894 12.901 1.00 0.00 H new ATOM 57 N SER A 5 12.023 -37.210 12.954 1.00 0.00 N ATOM 58 CA SER A 5 12.088 -36.523 11.676 1.00 0.00 C ATOM 59 C SER A 5 13.264 -37.055 10.855 1.00 0.00 C ATOM 60 O SER A 5 14.360 -37.241 11.382 1.00 0.00 O ATOM 61 CB SER A 5 12.217 -35.011 11.868 1.00 0.00 C ATOM 62 OG SER A 5 11.012 -34.326 11.535 1.00 0.00 O ATOM 0 H SER A 5 12.919 -37.555 13.298 1.00 0.00 H new ATOM 0 HA SER A 5 11.160 -36.716 11.138 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.481 -34.798 12.904 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.031 -34.635 11.248 1.00 0.00 H new ATOM 0 HG SER A 5 11.134 -33.363 11.672 1.00 0.00 H new ATOM 68 N GLY A 6 12.997 -37.286 9.577 1.00 0.00 N ATOM 69 CA GLY A 6 14.019 -37.792 8.678 1.00 0.00 C ATOM 70 C GLY A 6 13.484 -37.909 7.250 1.00 0.00 C ATOM 71 O GLY A 6 12.451 -38.536 7.020 1.00 0.00 O ATOM 0 H GLY A 6 12.087 -37.132 9.144 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.883 -37.128 8.693 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.361 -38.768 9.023 1.00 0.00 H new ATOM 75 N GLN A 7 14.212 -37.297 6.328 1.00 0.00 N ATOM 76 CA GLN A 7 13.823 -37.324 4.928 1.00 0.00 C ATOM 77 C GLN A 7 14.959 -36.793 4.051 1.00 0.00 C ATOM 78 O GLN A 7 15.912 -36.201 4.555 1.00 0.00 O ATOM 79 CB GLN A 7 12.536 -36.528 4.700 1.00 0.00 C ATOM 80 CG GLN A 7 12.766 -35.035 4.943 1.00 0.00 C ATOM 81 CD GLN A 7 12.057 -34.191 3.883 1.00 0.00 C ATOM 82 OE1 GLN A 7 10.962 -34.496 3.439 1.00 0.00 O ATOM 83 NE2 GLN A 7 12.739 -33.115 3.501 1.00 0.00 N ATOM 0 H GLN A 7 15.069 -36.779 6.523 1.00 0.00 H new ATOM 0 HA GLN A 7 13.626 -38.358 4.646 1.00 0.00 H new ATOM 0 HB2 GLN A 7 12.183 -36.684 3.681 1.00 0.00 H new ATOM 0 HB3 GLN A 7 11.755 -36.893 5.367 1.00 0.00 H new ATOM 0 HG2 GLN A 7 12.400 -34.764 5.933 1.00 0.00 H new ATOM 0 HG3 GLN A 7 13.835 -34.821 4.928 1.00 0.00 H new ATOM 0 HE21 GLN A 7 13.651 -32.917 3.912 1.00 0.00 H new ATOM 0 HE22 GLN A 7 12.350 -32.488 2.797 1.00 0.00 H new ATOM 92 N LYS A 8 14.821 -37.026 2.754 1.00 0.00 N ATOM 93 CA LYS A 8 15.824 -36.578 1.803 1.00 0.00 C ATOM 94 C LYS A 8 15.128 -36.029 0.555 1.00 0.00 C ATOM 95 O LYS A 8 14.853 -36.772 -0.385 1.00 0.00 O ATOM 96 CB LYS A 8 16.820 -37.702 1.506 1.00 0.00 C ATOM 97 CG LYS A 8 17.838 -37.845 2.639 1.00 0.00 C ATOM 98 CD LYS A 8 17.860 -39.275 3.180 1.00 0.00 C ATOM 99 CE LYS A 8 18.625 -40.207 2.238 1.00 0.00 C ATOM 100 NZ LYS A 8 18.708 -41.568 2.812 1.00 0.00 N ATOM 0 H LYS A 8 14.030 -37.519 2.340 1.00 0.00 H new ATOM 0 HA LYS A 8 16.413 -35.764 2.225 1.00 0.00 H new ATOM 0 HB2 LYS A 8 16.284 -38.642 1.373 1.00 0.00 H new ATOM 0 HB3 LYS A 8 17.339 -37.495 0.570 1.00 0.00 H new ATOM 0 HG2 LYS A 8 18.830 -37.574 2.277 1.00 0.00 H new ATOM 0 HG3 LYS A 8 17.592 -37.152 3.443 1.00 0.00 H new ATOM 0 HD2 LYS A 8 18.325 -39.287 4.166 1.00 0.00 H new ATOM 0 HD3 LYS A 8 16.839 -39.636 3.304 1.00 0.00 H new ATOM 0 HE2 LYS A 8 18.127 -40.244 1.269 1.00 0.00 H new ATOM 0 HE3 LYS A 8 19.628 -39.817 2.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 19.230 -42.188 2.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 19.203 -41.530 3.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 17.749 -41.944 2.954 1.00 0.00 H new ATOM 114 N GLN A 9 14.864 -34.731 0.588 1.00 0.00 N ATOM 115 CA GLN A 9 14.206 -34.073 -0.527 1.00 0.00 C ATOM 116 C GLN A 9 15.030 -32.871 -0.996 1.00 0.00 C ATOM 117 O GLN A 9 15.159 -31.884 -0.274 1.00 0.00 O ATOM 118 CB GLN A 9 12.784 -33.651 -0.154 1.00 0.00 C ATOM 119 CG GLN A 9 11.870 -33.656 -1.380 1.00 0.00 C ATOM 120 CD GLN A 9 10.462 -34.132 -1.013 1.00 0.00 C ATOM 121 OE1 GLN A 9 9.829 -33.631 -0.099 1.00 0.00 O ATOM 122 NE2 GLN A 9 10.011 -35.124 -1.775 1.00 0.00 N ATOM 0 H GLN A 9 15.094 -34.118 1.370 1.00 0.00 H new ATOM 0 HA GLN A 9 14.134 -34.783 -1.351 1.00 0.00 H new ATOM 0 HB2 GLN A 9 12.387 -34.328 0.603 1.00 0.00 H new ATOM 0 HB3 GLN A 9 12.801 -32.654 0.287 1.00 0.00 H new ATOM 0 HG2 GLN A 9 11.820 -32.653 -1.804 1.00 0.00 H new ATOM 0 HG3 GLN A 9 12.289 -34.306 -2.148 1.00 0.00 H new ATOM 0 HE21 GLN A 9 10.594 -35.497 -2.524 1.00 0.00 H new ATOM 0 HE22 GLN A 9 9.082 -35.512 -1.610 1.00 0.00 H new ATOM 131 N ASP A 10 15.565 -32.995 -2.202 1.00 0.00 N ATOM 132 CA ASP A 10 16.372 -31.932 -2.776 1.00 0.00 C ATOM 133 C ASP A 10 15.496 -31.065 -3.682 1.00 0.00 C ATOM 134 O ASP A 10 14.387 -31.458 -4.039 1.00 0.00 O ATOM 135 CB ASP A 10 17.512 -32.502 -3.622 1.00 0.00 C ATOM 136 CG ASP A 10 18.913 -32.045 -3.212 1.00 0.00 C ATOM 137 OD1 ASP A 10 19.835 -32.230 -4.036 1.00 0.00 O ATOM 138 OD2 ASP A 10 19.031 -31.520 -2.084 1.00 0.00 O ATOM 0 H ASP A 10 15.455 -33.816 -2.797 1.00 0.00 H new ATOM 0 HA ASP A 10 16.790 -31.346 -1.958 1.00 0.00 H new ATOM 0 HB2 ASP A 10 17.472 -33.590 -3.572 1.00 0.00 H new ATOM 0 HB3 ASP A 10 17.346 -32.224 -4.663 1.00 0.00 H new ATOM 143 N ARG A 11 16.028 -29.902 -4.028 1.00 0.00 N ATOM 144 CA ARG A 11 15.309 -28.977 -4.886 1.00 0.00 C ATOM 145 C ARG A 11 15.660 -29.231 -6.353 1.00 0.00 C ATOM 146 O ARG A 11 16.619 -29.941 -6.652 1.00 0.00 O ATOM 147 CB ARG A 11 15.644 -27.526 -4.534 1.00 0.00 C ATOM 148 CG ARG A 11 15.075 -27.149 -3.164 1.00 0.00 C ATOM 149 CD ARG A 11 16.061 -26.280 -2.382 1.00 0.00 C ATOM 150 NE ARG A 11 16.136 -24.930 -2.985 1.00 0.00 N ATOM 151 CZ ARG A 11 17.051 -24.009 -2.653 1.00 0.00 C ATOM 152 NH1 ARG A 11 17.974 -24.285 -1.722 1.00 0.00 N ATOM 153 NH2 ARG A 11 17.043 -22.811 -3.253 1.00 0.00 N ATOM 0 H ARG A 11 16.948 -29.580 -3.729 1.00 0.00 H new ATOM 0 HA ARG A 11 14.243 -29.141 -4.730 1.00 0.00 H new ATOM 0 HB2 ARG A 11 16.725 -27.389 -4.533 1.00 0.00 H new ATOM 0 HB3 ARG A 11 15.239 -26.860 -5.296 1.00 0.00 H new ATOM 0 HG2 ARG A 11 14.134 -26.613 -3.292 1.00 0.00 H new ATOM 0 HG3 ARG A 11 14.852 -28.053 -2.597 1.00 0.00 H new ATOM 0 HD2 ARG A 11 15.746 -26.205 -1.341 1.00 0.00 H new ATOM 0 HD3 ARG A 11 17.048 -26.743 -2.384 1.00 0.00 H new ATOM 0 HE ARG A 11 15.448 -24.686 -3.698 1.00 0.00 H new ATOM 0 HH11 ARG A 11 17.981 -25.197 -1.265 1.00 0.00 H new ATOM 0 HH12 ARG A 11 18.670 -23.583 -1.470 1.00 0.00 H new ATOM 0 HH21 ARG A 11 16.341 -22.600 -3.962 1.00 0.00 H new ATOM 0 HH22 ARG A 11 17.739 -22.110 -3.001 1.00 0.00 H new ATOM 167 N GLN A 12 14.863 -28.638 -7.231 1.00 0.00 N ATOM 168 CA GLN A 12 15.078 -28.792 -8.660 1.00 0.00 C ATOM 169 C GLN A 12 14.993 -27.433 -9.359 1.00 0.00 C ATOM 170 O GLN A 12 14.241 -26.558 -8.933 1.00 0.00 O ATOM 171 CB GLN A 12 14.076 -29.780 -9.261 1.00 0.00 C ATOM 172 CG GLN A 12 14.630 -31.207 -9.232 1.00 0.00 C ATOM 173 CD GLN A 12 13.787 -32.140 -10.105 1.00 0.00 C ATOM 174 OE1 GLN A 12 13.644 -31.951 -11.302 1.00 0.00 O ATOM 175 NE2 GLN A 12 13.240 -33.154 -9.441 1.00 0.00 N ATOM 0 H GLN A 12 14.068 -28.050 -6.980 1.00 0.00 H new ATOM 0 HA GLN A 12 16.078 -29.198 -8.816 1.00 0.00 H new ATOM 0 HB2 GLN A 12 13.140 -29.738 -8.705 1.00 0.00 H new ATOM 0 HB3 GLN A 12 13.849 -29.495 -10.288 1.00 0.00 H new ATOM 0 HG2 GLN A 12 15.662 -31.208 -9.584 1.00 0.00 H new ATOM 0 HG3 GLN A 12 14.642 -31.575 -8.206 1.00 0.00 H new ATOM 0 HE21 GLN A 12 13.401 -33.253 -8.439 1.00 0.00 H new ATOM 0 HE22 GLN A 12 12.660 -33.833 -9.934 1.00 0.00 H new ATOM 184 N GLY A 13 15.776 -27.299 -10.418 1.00 0.00 N ATOM 185 CA GLY A 13 15.800 -26.062 -11.181 1.00 0.00 C ATOM 186 C GLY A 13 15.617 -26.335 -12.674 1.00 0.00 C ATOM 187 O GLY A 13 15.622 -27.487 -13.104 1.00 0.00 O ATOM 0 H GLY A 13 16.400 -28.027 -10.767 1.00 0.00 H new ATOM 0 HA2 GLY A 13 15.010 -25.399 -10.830 1.00 0.00 H new ATOM 0 HA3 GLY A 13 16.746 -25.547 -11.015 1.00 0.00 H new ATOM 191 N GLY A 14 15.459 -25.255 -13.426 1.00 0.00 N ATOM 192 CA GLY A 14 15.274 -25.363 -14.863 1.00 0.00 C ATOM 193 C GLY A 14 16.615 -25.557 -15.574 1.00 0.00 C ATOM 194 O GLY A 14 16.971 -26.675 -15.941 1.00 0.00 O ATOM 0 H GLY A 14 15.455 -24.300 -13.066 1.00 0.00 H new ATOM 0 HA2 GLY A 14 14.615 -26.202 -15.087 1.00 0.00 H new ATOM 0 HA3 GLY A 14 14.785 -24.464 -15.239 1.00 0.00 H new ATOM 198 N GLU A 15 17.322 -24.450 -15.749 1.00 0.00 N ATOM 199 CA GLU A 15 18.615 -24.484 -16.410 1.00 0.00 C ATOM 200 C GLU A 15 18.474 -25.053 -17.824 1.00 0.00 C ATOM 201 O GLU A 15 17.523 -25.779 -18.112 1.00 0.00 O ATOM 202 CB GLU A 15 19.627 -25.291 -15.594 1.00 0.00 C ATOM 203 CG GLU A 15 21.055 -25.029 -16.077 1.00 0.00 C ATOM 204 CD GLU A 15 22.078 -25.446 -15.020 1.00 0.00 C ATOM 205 OE1 GLU A 15 22.865 -24.564 -14.613 1.00 0.00 O ATOM 206 OE2 GLU A 15 22.050 -26.637 -14.641 1.00 0.00 O ATOM 0 H GLU A 15 17.023 -23.524 -15.444 1.00 0.00 H new ATOM 0 HA GLU A 15 18.989 -23.463 -16.485 1.00 0.00 H new ATOM 0 HB2 GLU A 15 19.542 -25.028 -14.540 1.00 0.00 H new ATOM 0 HB3 GLU A 15 19.401 -26.354 -15.676 1.00 0.00 H new ATOM 0 HG2 GLU A 15 21.237 -25.579 -17.000 1.00 0.00 H new ATOM 0 HG3 GLU A 15 21.176 -23.970 -16.307 1.00 0.00 H new ATOM 213 N ARG A 16 19.433 -24.703 -18.666 1.00 0.00 N ATOM 214 CA ARG A 16 19.427 -25.170 -20.043 1.00 0.00 C ATOM 215 C ARG A 16 20.823 -25.651 -20.446 1.00 0.00 C ATOM 216 O ARG A 16 20.996 -26.802 -20.844 1.00 0.00 O ATOM 217 CB ARG A 16 18.983 -24.061 -20.999 1.00 0.00 C ATOM 218 CG ARG A 16 18.441 -24.648 -22.304 1.00 0.00 C ATOM 219 CD ARG A 16 16.955 -24.989 -22.176 1.00 0.00 C ATOM 220 NE ARG A 16 16.143 -23.756 -22.267 1.00 0.00 N ATOM 221 CZ ARG A 16 14.829 -23.739 -22.530 1.00 0.00 C ATOM 222 NH1 ARG A 16 14.170 -24.890 -22.730 1.00 0.00 N ATOM 223 NH2 ARG A 16 14.172 -22.573 -22.593 1.00 0.00 N ATOM 0 H ARG A 16 20.220 -24.102 -18.423 1.00 0.00 H new ATOM 0 HA ARG A 16 18.720 -25.997 -20.110 1.00 0.00 H new ATOM 0 HB2 ARG A 16 18.215 -23.452 -20.523 1.00 0.00 H new ATOM 0 HB3 ARG A 16 19.825 -23.402 -21.214 1.00 0.00 H new ATOM 0 HG2 ARG A 16 18.586 -23.935 -23.115 1.00 0.00 H new ATOM 0 HG3 ARG A 16 19.003 -25.545 -22.564 1.00 0.00 H new ATOM 0 HD2 ARG A 16 16.664 -25.685 -22.963 1.00 0.00 H new ATOM 0 HD3 ARG A 16 16.769 -25.488 -21.225 1.00 0.00 H new ATOM 0 HE ARG A 16 16.613 -22.863 -22.120 1.00 0.00 H new ATOM 0 HH11 ARG A 16 14.669 -25.778 -22.682 1.00 0.00 H new ATOM 0 HH12 ARG A 16 13.170 -24.877 -22.930 1.00 0.00 H new ATOM 0 HH21 ARG A 16 14.672 -21.697 -22.441 1.00 0.00 H new ATOM 0 HH22 ARG A 16 13.172 -22.561 -22.793 1.00 0.00 H new ATOM 237 N ARG A 17 21.784 -24.747 -20.328 1.00 0.00 N ATOM 238 CA ARG A 17 23.158 -25.064 -20.675 1.00 0.00 C ATOM 239 C ARG A 17 24.027 -25.109 -19.416 1.00 0.00 C ATOM 240 O ARG A 17 23.844 -24.307 -18.502 1.00 0.00 O ATOM 241 CB ARG A 17 23.734 -24.032 -21.646 1.00 0.00 C ATOM 242 CG ARG A 17 23.684 -24.547 -23.086 1.00 0.00 C ATOM 243 CD ARG A 17 24.934 -24.129 -23.862 1.00 0.00 C ATOM 244 NE ARG A 17 26.090 -24.953 -23.443 1.00 0.00 N ATOM 245 CZ ARG A 17 27.201 -25.115 -24.173 1.00 0.00 C ATOM 246 NH1 ARG A 17 27.316 -24.511 -25.362 1.00 0.00 N ATOM 247 NH2 ARG A 17 28.200 -25.882 -23.712 1.00 0.00 N ATOM 0 H ARG A 17 21.638 -23.794 -19.996 1.00 0.00 H new ATOM 0 HA ARG A 17 23.160 -26.041 -21.158 1.00 0.00 H new ATOM 0 HB2 ARG A 17 23.172 -23.101 -21.569 1.00 0.00 H new ATOM 0 HB3 ARG A 17 24.765 -23.805 -21.373 1.00 0.00 H new ATOM 0 HG2 ARG A 17 23.599 -25.634 -23.084 1.00 0.00 H new ATOM 0 HG3 ARG A 17 22.796 -24.159 -23.584 1.00 0.00 H new ATOM 0 HD2 ARG A 17 24.763 -24.245 -24.932 1.00 0.00 H new ATOM 0 HD3 ARG A 17 25.146 -23.074 -23.686 1.00 0.00 H new ATOM 0 HE ARG A 17 26.037 -25.427 -22.542 1.00 0.00 H new ATOM 0 HH11 ARG A 17 26.557 -23.927 -25.713 1.00 0.00 H new ATOM 0 HH12 ARG A 17 28.163 -24.635 -25.917 1.00 0.00 H new ATOM 0 HH21 ARG A 17 28.113 -26.342 -22.806 1.00 0.00 H new ATOM 0 HH22 ARG A 17 29.046 -26.006 -24.268 1.00 0.00 H new ATOM 261 N ARG A 18 24.953 -26.056 -19.409 1.00 0.00 N ATOM 262 CA ARG A 18 25.850 -26.216 -18.277 1.00 0.00 C ATOM 263 C ARG A 18 27.130 -25.407 -18.495 1.00 0.00 C ATOM 264 O ARG A 18 28.204 -25.977 -18.687 1.00 0.00 O ATOM 265 CB ARG A 18 26.215 -27.687 -18.067 1.00 0.00 C ATOM 266 CG ARG A 18 24.958 -28.550 -17.931 1.00 0.00 C ATOM 267 CD ARG A 18 24.916 -29.630 -19.014 1.00 0.00 C ATOM 268 NE ARG A 18 23.512 -30.015 -19.288 1.00 0.00 N ATOM 269 CZ ARG A 18 23.153 -31.142 -19.917 1.00 0.00 C ATOM 270 NH1 ARG A 18 24.089 -32.003 -20.340 1.00 0.00 N ATOM 271 NH2 ARG A 18 21.856 -31.410 -20.124 1.00 0.00 N ATOM 0 H ARG A 18 25.102 -26.720 -20.169 1.00 0.00 H new ATOM 0 HA ARG A 18 25.332 -25.851 -17.390 1.00 0.00 H new ATOM 0 HB2 ARG A 18 26.814 -28.040 -18.906 1.00 0.00 H new ATOM 0 HB3 ARG A 18 26.829 -27.789 -17.172 1.00 0.00 H new ATOM 0 HG2 ARG A 18 24.937 -29.016 -16.946 1.00 0.00 H new ATOM 0 HG3 ARG A 18 24.071 -27.921 -18.005 1.00 0.00 H new ATOM 0 HD2 ARG A 18 25.386 -29.261 -19.926 1.00 0.00 H new ATOM 0 HD3 ARG A 18 25.485 -30.502 -18.692 1.00 0.00 H new ATOM 0 HE ARG A 18 22.773 -29.383 -18.979 1.00 0.00 H new ATOM 0 HH11 ARG A 18 25.076 -31.801 -20.183 1.00 0.00 H new ATOM 0 HH12 ARG A 18 23.814 -32.861 -20.819 1.00 0.00 H new ATOM 0 HH21 ARG A 18 21.142 -30.756 -19.803 1.00 0.00 H new ATOM 0 HH22 ARG A 18 21.583 -32.268 -20.603 1.00 0.00 H new ATOM 285 N SER A 19 26.974 -24.092 -18.459 1.00 0.00 N ATOM 286 CA SER A 19 28.104 -23.198 -18.650 1.00 0.00 C ATOM 287 C SER A 19 29.046 -23.767 -19.714 1.00 0.00 C ATOM 288 O SER A 19 28.603 -24.435 -20.647 1.00 0.00 O ATOM 289 CB SER A 19 28.859 -22.977 -17.339 1.00 0.00 C ATOM 290 OG SER A 19 29.358 -21.646 -17.228 1.00 0.00 O ATOM 0 H SER A 19 26.082 -23.624 -18.300 1.00 0.00 H new ATOM 0 HA SER A 19 27.724 -22.233 -18.986 1.00 0.00 H new ATOM 0 HB2 SER A 19 28.197 -23.187 -16.499 1.00 0.00 H new ATOM 0 HB3 SER A 19 29.688 -23.682 -17.275 1.00 0.00 H new ATOM 0 HG SER A 19 29.832 -21.544 -16.377 1.00 0.00 H new ATOM 296 N GLN A 20 30.328 -23.481 -19.538 1.00 0.00 N ATOM 297 CA GLN A 20 31.335 -23.954 -20.471 1.00 0.00 C ATOM 298 C GLN A 20 31.946 -25.265 -19.973 1.00 0.00 C ATOM 299 O GLN A 20 33.161 -25.450 -20.033 1.00 0.00 O ATOM 300 CB GLN A 20 32.416 -22.895 -20.696 1.00 0.00 C ATOM 301 CG GLN A 20 32.258 -22.229 -22.065 1.00 0.00 C ATOM 302 CD GLN A 20 32.729 -23.159 -23.184 1.00 0.00 C ATOM 303 OE1 GLN A 20 33.657 -23.937 -23.031 1.00 0.00 O ATOM 304 NE2 GLN A 20 32.041 -23.037 -24.315 1.00 0.00 N ATOM 0 H GLN A 20 30.692 -22.927 -18.762 1.00 0.00 H new ATOM 0 HA GLN A 20 30.853 -24.142 -21.430 1.00 0.00 H new ATOM 0 HB2 GLN A 20 32.359 -22.140 -19.912 1.00 0.00 H new ATOM 0 HB3 GLN A 20 33.401 -23.355 -20.624 1.00 0.00 H new ATOM 0 HG2 GLN A 20 31.214 -21.962 -22.225 1.00 0.00 H new ATOM 0 HG3 GLN A 20 32.832 -21.303 -22.091 1.00 0.00 H new ATOM 0 HE21 GLN A 20 31.275 -22.366 -24.376 1.00 0.00 H new ATOM 0 HE22 GLN A 20 32.279 -23.614 -25.121 1.00 0.00 H new ATOM 313 N LEU A 21 31.076 -26.141 -19.491 1.00 0.00 N ATOM 314 CA LEU A 21 31.516 -27.429 -18.983 1.00 0.00 C ATOM 315 C LEU A 21 32.626 -27.976 -19.881 1.00 0.00 C ATOM 316 O LEU A 21 32.352 -28.552 -20.933 1.00 0.00 O ATOM 317 CB LEU A 21 30.326 -28.379 -18.830 1.00 0.00 C ATOM 318 CG LEU A 21 30.300 -29.220 -17.552 1.00 0.00 C ATOM 319 CD1 LEU A 21 29.520 -30.519 -17.768 1.00 0.00 C ATOM 320 CD2 LEU A 21 31.717 -29.482 -17.039 1.00 0.00 C ATOM 0 H LEU A 21 30.069 -25.984 -19.442 1.00 0.00 H new ATOM 0 HA LEU A 21 31.939 -27.319 -17.984 1.00 0.00 H new ATOM 0 HB2 LEU A 21 29.409 -27.791 -18.873 1.00 0.00 H new ATOM 0 HB3 LEU A 21 30.313 -29.054 -19.686 1.00 0.00 H new ATOM 0 HG LEU A 21 29.778 -28.654 -16.781 1.00 0.00 H new ATOM 0 HD11 LEU A 21 29.516 -31.099 -16.845 1.00 0.00 H new ATOM 0 HD12 LEU A 21 28.495 -30.284 -18.053 1.00 0.00 H new ATOM 0 HD13 LEU A 21 29.993 -31.100 -18.560 1.00 0.00 H new ATOM 0 HD21 LEU A 21 31.670 -30.082 -16.130 1.00 0.00 H new ATOM 0 HD22 LEU A 21 32.286 -30.019 -17.799 1.00 0.00 H new ATOM 0 HD23 LEU A 21 32.207 -28.533 -16.822 1.00 0.00 H new ATOM 332 N ASP A 22 33.858 -27.775 -19.434 1.00 0.00 N ATOM 333 CA ASP A 22 35.011 -28.241 -20.185 1.00 0.00 C ATOM 334 C ASP A 22 35.168 -29.750 -19.987 1.00 0.00 C ATOM 335 O ASP A 22 34.794 -30.285 -18.945 1.00 0.00 O ATOM 336 CB ASP A 22 36.295 -27.565 -19.699 1.00 0.00 C ATOM 337 CG ASP A 22 37.154 -26.940 -20.800 1.00 0.00 C ATOM 338 OD1 ASP A 22 37.569 -27.703 -21.698 1.00 0.00 O ATOM 339 OD2 ASP A 22 37.376 -25.712 -20.719 1.00 0.00 O ATOM 0 H ASP A 22 34.082 -27.296 -18.562 1.00 0.00 H new ATOM 0 HA ASP A 22 34.850 -27.997 -21.235 1.00 0.00 H new ATOM 0 HB2 ASP A 22 36.030 -26.789 -18.981 1.00 0.00 H new ATOM 0 HB3 ASP A 22 36.895 -28.301 -19.165 1.00 0.00 H new ATOM 344 N ARG A 23 35.722 -30.394 -21.004 1.00 0.00 N ATOM 345 CA ARG A 23 35.932 -31.831 -20.955 1.00 0.00 C ATOM 346 C ARG A 23 36.941 -32.182 -19.859 1.00 0.00 C ATOM 347 O ARG A 23 37.111 -33.352 -19.519 1.00 0.00 O ATOM 348 CB ARG A 23 36.444 -32.359 -22.297 1.00 0.00 C ATOM 349 CG ARG A 23 35.291 -32.545 -23.287 1.00 0.00 C ATOM 350 CD ARG A 23 34.294 -33.586 -22.776 1.00 0.00 C ATOM 351 NE ARG A 23 34.256 -34.746 -23.695 1.00 0.00 N ATOM 352 CZ ARG A 23 33.346 -35.728 -23.630 1.00 0.00 C ATOM 353 NH1 ARG A 23 32.393 -35.697 -22.689 1.00 0.00 N ATOM 354 NH2 ARG A 23 33.390 -36.741 -24.506 1.00 0.00 N ATOM 0 H ARG A 23 36.032 -29.947 -21.867 1.00 0.00 H new ATOM 0 HA ARG A 23 34.973 -32.299 -20.735 1.00 0.00 H new ATOM 0 HB2 ARG A 23 37.175 -31.664 -22.711 1.00 0.00 H new ATOM 0 HB3 ARG A 23 36.956 -33.309 -22.147 1.00 0.00 H new ATOM 0 HG2 ARG A 23 34.782 -31.594 -23.441 1.00 0.00 H new ATOM 0 HG3 ARG A 23 35.684 -32.857 -24.255 1.00 0.00 H new ATOM 0 HD2 ARG A 23 34.578 -33.913 -21.776 1.00 0.00 H new ATOM 0 HD3 ARG A 23 33.302 -33.142 -22.696 1.00 0.00 H new ATOM 0 HE ARG A 23 34.967 -34.801 -24.424 1.00 0.00 H new ATOM 0 HH11 ARG A 23 32.360 -34.926 -22.022 1.00 0.00 H new ATOM 0 HH12 ARG A 23 31.701 -36.444 -22.640 1.00 0.00 H new ATOM 0 HH21 ARG A 23 34.116 -36.765 -25.222 1.00 0.00 H new ATOM 0 HH22 ARG A 23 32.698 -37.488 -24.457 1.00 0.00 H new ATOM 368 N ASP A 24 37.582 -31.148 -19.337 1.00 0.00 N ATOM 369 CA ASP A 24 38.570 -31.332 -18.287 1.00 0.00 C ATOM 370 C ASP A 24 38.195 -30.466 -17.082 1.00 0.00 C ATOM 371 O ASP A 24 39.062 -30.068 -16.305 1.00 0.00 O ATOM 372 CB ASP A 24 39.962 -30.910 -18.758 1.00 0.00 C ATOM 373 CG ASP A 24 40.015 -29.575 -19.503 1.00 0.00 C ATOM 374 OD1 ASP A 24 40.050 -29.623 -20.752 1.00 0.00 O ATOM 375 OD2 ASP A 24 40.019 -28.536 -18.808 1.00 0.00 O ATOM 0 H ASP A 24 37.437 -30.179 -19.621 1.00 0.00 H new ATOM 0 HA ASP A 24 38.586 -32.389 -18.022 1.00 0.00 H new ATOM 0 HB2 ASP A 24 40.620 -30.852 -17.891 1.00 0.00 H new ATOM 0 HB3 ASP A 24 40.360 -31.688 -19.409 1.00 0.00 H new ATOM 380 N GLN A 25 36.903 -30.197 -16.966 1.00 0.00 N ATOM 381 CA GLN A 25 36.403 -29.384 -15.871 1.00 0.00 C ATOM 382 C GLN A 25 35.502 -30.220 -14.958 1.00 0.00 C ATOM 383 O GLN A 25 34.462 -30.713 -15.391 1.00 0.00 O ATOM 384 CB GLN A 25 35.663 -28.153 -16.394 1.00 0.00 C ATOM 385 CG GLN A 25 36.497 -26.886 -16.198 1.00 0.00 C ATOM 386 CD GLN A 25 35.692 -25.637 -16.561 1.00 0.00 C ATOM 387 OE1 GLN A 25 34.783 -25.667 -17.373 1.00 0.00 O ATOM 388 NE2 GLN A 25 36.075 -24.539 -15.914 1.00 0.00 N ATOM 0 H GLN A 25 36.187 -30.528 -17.613 1.00 0.00 H new ATOM 0 HA GLN A 25 37.254 -29.033 -15.287 1.00 0.00 H new ATOM 0 HB2 GLN A 25 35.436 -28.283 -17.452 1.00 0.00 H new ATOM 0 HB3 GLN A 25 34.710 -28.049 -15.875 1.00 0.00 H new ATOM 0 HG2 GLN A 25 36.828 -26.821 -15.161 1.00 0.00 H new ATOM 0 HG3 GLN A 25 37.393 -26.937 -16.816 1.00 0.00 H new ATOM 0 HE21 GLN A 25 36.845 -24.583 -15.246 1.00 0.00 H new ATOM 0 HE22 GLN A 25 35.599 -23.653 -16.086 1.00 0.00 H new ATOM 397 N CYS A 26 35.934 -30.351 -13.713 1.00 0.00 N ATOM 398 CA CYS A 26 35.179 -31.117 -12.735 1.00 0.00 C ATOM 399 C CYS A 26 33.767 -30.534 -12.655 1.00 0.00 C ATOM 400 O CYS A 26 33.596 -29.318 -12.600 1.00 0.00 O ATOM 401 CB CYS A 26 35.870 -31.131 -11.370 1.00 0.00 C ATOM 402 SG CYS A 26 35.039 -32.325 -10.261 1.00 0.00 S ATOM 0 H CYS A 26 36.797 -29.940 -13.358 1.00 0.00 H new ATOM 0 HA CYS A 26 35.123 -32.159 -13.050 1.00 0.00 H new ATOM 0 HB2 CYS A 26 36.920 -31.401 -11.487 1.00 0.00 H new ATOM 0 HB3 CYS A 26 35.844 -30.134 -10.930 1.00 0.00 H new ATOM 407 N ALA A 27 32.791 -31.430 -12.650 1.00 0.00 N ATOM 408 CA ALA A 27 31.398 -31.020 -12.577 1.00 0.00 C ATOM 409 C ALA A 27 30.896 -31.188 -11.141 1.00 0.00 C ATOM 410 O ALA A 27 29.692 -31.276 -10.907 1.00 0.00 O ATOM 411 CB ALA A 27 30.575 -31.828 -13.581 1.00 0.00 C ATOM 0 H ALA A 27 32.937 -32.439 -12.695 1.00 0.00 H new ATOM 0 HA ALA A 27 31.293 -29.968 -12.842 1.00 0.00 H new ATOM 0 HB1 ALA A 27 29.531 -31.521 -13.526 1.00 0.00 H new ATOM 0 HB2 ALA A 27 30.953 -31.651 -14.588 1.00 0.00 H new ATOM 0 HB3 ALA A 27 30.654 -32.889 -13.346 1.00 0.00 H new ATOM 417 N TYR A 28 31.846 -31.229 -10.217 1.00 0.00 N ATOM 418 CA TYR A 28 31.515 -31.385 -8.811 1.00 0.00 C ATOM 419 C TYR A 28 32.052 -30.213 -7.988 1.00 0.00 C ATOM 420 O TYR A 28 31.305 -29.576 -7.246 1.00 0.00 O ATOM 421 CB TYR A 28 32.206 -32.672 -8.356 1.00 0.00 C ATOM 422 CG TYR A 28 31.749 -33.171 -6.984 1.00 0.00 C ATOM 423 CD1 TYR A 28 30.848 -34.213 -6.894 1.00 0.00 C ATOM 424 CD2 TYR A 28 32.238 -32.581 -5.836 1.00 0.00 C ATOM 425 CE1 TYR A 28 30.418 -34.684 -5.603 1.00 0.00 C ATOM 426 CE2 TYR A 28 31.808 -33.052 -4.545 1.00 0.00 C ATOM 427 CZ TYR A 28 30.919 -34.080 -4.492 1.00 0.00 C ATOM 428 OH TYR A 28 30.513 -34.524 -3.272 1.00 0.00 O ATOM 0 H TYR A 28 32.844 -31.157 -10.415 1.00 0.00 H new ATOM 0 HA TYR A 28 30.434 -31.419 -8.672 1.00 0.00 H new ATOM 0 HB2 TYR A 28 32.022 -33.452 -9.095 1.00 0.00 H new ATOM 0 HB3 TYR A 28 33.283 -32.505 -8.330 1.00 0.00 H new ATOM 0 HD1 TYR A 28 30.466 -34.675 -7.792 1.00 0.00 H new ATOM 0 HD2 TYR A 28 32.943 -31.766 -5.906 1.00 0.00 H new ATOM 0 HE1 TYR A 28 29.714 -35.498 -5.519 1.00 0.00 H new ATOM 0 HE2 TYR A 28 32.183 -32.599 -3.639 1.00 0.00 H new ATOM 0 HH TYR A 28 30.953 -34.001 -2.570 1.00 0.00 H new ATOM 438 N CYS A 29 33.344 -29.963 -8.145 1.00 0.00 N ATOM 439 CA CYS A 29 33.990 -28.878 -7.426 1.00 0.00 C ATOM 440 C CYS A 29 34.329 -27.772 -8.427 1.00 0.00 C ATOM 441 O CYS A 29 34.627 -26.646 -8.035 1.00 0.00 O ATOM 442 CB CYS A 29 35.228 -29.362 -6.669 1.00 0.00 C ATOM 443 SG CYS A 29 36.500 -29.939 -7.851 1.00 0.00 S ATOM 0 H CYS A 29 33.961 -30.494 -8.760 1.00 0.00 H new ATOM 0 HA CYS A 29 33.312 -28.485 -6.669 1.00 0.00 H new ATOM 0 HB2 CYS A 29 35.629 -28.554 -6.057 1.00 0.00 H new ATOM 0 HB3 CYS A 29 34.956 -30.171 -5.991 1.00 0.00 H new ATOM 448 N LYS A 30 34.271 -28.133 -9.701 1.00 0.00 N ATOM 449 CA LYS A 30 34.568 -27.185 -10.762 1.00 0.00 C ATOM 450 C LYS A 30 36.045 -27.302 -11.145 1.00 0.00 C ATOM 451 O LYS A 30 36.419 -27.012 -12.280 1.00 0.00 O ATOM 452 CB LYS A 30 34.149 -25.772 -10.350 1.00 0.00 C ATOM 453 CG LYS A 30 32.793 -25.786 -9.643 1.00 0.00 C ATOM 454 CD LYS A 30 31.777 -24.917 -10.389 1.00 0.00 C ATOM 455 CE LYS A 30 31.252 -25.635 -11.635 1.00 0.00 C ATOM 456 NZ LYS A 30 31.330 -24.746 -12.815 1.00 0.00 N ATOM 0 H LYS A 30 34.023 -29.069 -10.022 1.00 0.00 H new ATOM 0 HA LYS A 30 33.987 -27.417 -11.655 1.00 0.00 H new ATOM 0 HB2 LYS A 30 34.903 -25.343 -9.690 1.00 0.00 H new ATOM 0 HB3 LYS A 30 34.097 -25.133 -11.231 1.00 0.00 H new ATOM 0 HG2 LYS A 30 32.423 -26.809 -9.578 1.00 0.00 H new ATOM 0 HG3 LYS A 30 32.907 -25.423 -8.622 1.00 0.00 H new ATOM 0 HD2 LYS A 30 30.946 -24.674 -9.727 1.00 0.00 H new ATOM 0 HD3 LYS A 30 32.241 -23.974 -10.677 1.00 0.00 H new ATOM 0 HE2 LYS A 30 31.834 -26.539 -11.814 1.00 0.00 H new ATOM 0 HE3 LYS A 30 30.220 -25.947 -11.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 30.970 -25.248 -13.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 30.755 -23.896 -12.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 32.319 -24.469 -12.976 1.00 0.00 H new ATOM 470 N GLU A 31 36.843 -27.727 -10.177 1.00 0.00 N ATOM 471 CA GLU A 31 38.269 -27.886 -10.399 1.00 0.00 C ATOM 472 C GLU A 31 38.526 -28.532 -11.762 1.00 0.00 C ATOM 473 O GLU A 31 37.943 -29.567 -12.081 1.00 0.00 O ATOM 474 CB GLU A 31 38.912 -28.702 -9.276 1.00 0.00 C ATOM 475 CG GLU A 31 38.734 -28.009 -7.923 1.00 0.00 C ATOM 476 CD GLU A 31 39.886 -27.039 -7.648 1.00 0.00 C ATOM 477 OE1 GLU A 31 41.036 -27.524 -7.597 1.00 0.00 O ATOM 478 OE2 GLU A 31 39.589 -25.834 -7.496 1.00 0.00 O ATOM 0 H GLU A 31 36.529 -27.966 -9.237 1.00 0.00 H new ATOM 0 HA GLU A 31 38.729 -26.898 -10.395 1.00 0.00 H new ATOM 0 HB2 GLU A 31 38.465 -29.695 -9.241 1.00 0.00 H new ATOM 0 HB3 GLU A 31 39.974 -28.838 -9.482 1.00 0.00 H new ATOM 0 HG2 GLU A 31 37.788 -27.469 -7.909 1.00 0.00 H new ATOM 0 HG3 GLU A 31 38.686 -28.756 -7.131 1.00 0.00 H new ATOM 485 N LYS A 32 39.400 -27.896 -12.528 1.00 0.00 N ATOM 486 CA LYS A 32 39.741 -28.396 -13.850 1.00 0.00 C ATOM 487 C LYS A 32 41.006 -29.251 -13.755 1.00 0.00 C ATOM 488 O LYS A 32 41.967 -28.873 -13.086 1.00 0.00 O ATOM 489 CB LYS A 32 39.851 -27.242 -14.847 1.00 0.00 C ATOM 490 CG LYS A 32 41.019 -26.320 -14.492 1.00 0.00 C ATOM 491 CD LYS A 32 42.192 -26.527 -15.454 1.00 0.00 C ATOM 492 CE LYS A 32 43.449 -25.818 -14.945 1.00 0.00 C ATOM 493 NZ LYS A 32 43.888 -24.785 -15.910 1.00 0.00 N ATOM 0 H LYS A 32 39.883 -27.039 -12.259 1.00 0.00 H new ATOM 0 HA LYS A 32 38.948 -29.040 -14.231 1.00 0.00 H new ATOM 0 HB2 LYS A 32 39.988 -27.638 -15.853 1.00 0.00 H new ATOM 0 HB3 LYS A 32 38.922 -26.672 -14.853 1.00 0.00 H new ATOM 0 HG2 LYS A 32 40.692 -25.281 -14.530 1.00 0.00 H new ATOM 0 HG3 LYS A 32 41.343 -26.515 -13.470 1.00 0.00 H new ATOM 0 HD2 LYS A 32 42.391 -27.593 -15.566 1.00 0.00 H new ATOM 0 HD3 LYS A 32 41.929 -26.146 -16.441 1.00 0.00 H new ATOM 0 HE2 LYS A 32 43.248 -25.358 -13.977 1.00 0.00 H new ATOM 0 HE3 LYS A 32 44.247 -26.545 -14.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 44.742 -24.314 -15.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 44.100 -25.232 -16.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 43.131 -24.083 -16.035 1.00 0.00 H new ATOM 507 N GLY A 33 40.966 -30.387 -14.436 1.00 0.00 N ATOM 508 CA GLY A 33 42.097 -31.298 -14.438 1.00 0.00 C ATOM 509 C GLY A 33 41.650 -32.729 -14.133 1.00 0.00 C ATOM 510 O GLY A 33 42.069 -33.670 -14.804 1.00 0.00 O ATOM 0 H GLY A 33 40.168 -30.697 -14.990 1.00 0.00 H new ATOM 0 HA2 GLY A 33 42.592 -31.267 -15.409 1.00 0.00 H new ATOM 0 HA3 GLY A 33 42.829 -30.976 -13.697 1.00 0.00 H new ATOM 514 N HIS A 34 40.804 -32.848 -13.121 1.00 0.00 N ATOM 515 CA HIS A 34 40.295 -34.148 -12.718 1.00 0.00 C ATOM 516 C HIS A 34 38.797 -34.228 -13.021 1.00 0.00 C ATOM 517 O HIS A 34 38.121 -33.204 -13.105 1.00 0.00 O ATOM 518 CB HIS A 34 40.618 -34.428 -11.250 1.00 0.00 C ATOM 519 CG HIS A 34 39.825 -33.591 -10.275 1.00 0.00 C ATOM 520 ND1 HIS A 34 40.381 -32.548 -9.556 1.00 0.00 N ATOM 521 CD2 HIS A 34 38.512 -33.654 -9.910 1.00 0.00 C ATOM 522 CE1 HIS A 34 39.436 -32.014 -8.794 1.00 0.00 C ATOM 523 NE2 HIS A 34 38.279 -32.702 -9.015 1.00 0.00 N ATOM 0 H HIS A 34 40.458 -32.065 -12.567 1.00 0.00 H new ATOM 0 HA HIS A 34 40.790 -34.930 -13.293 1.00 0.00 H new ATOM 0 HB2 HIS A 34 40.432 -35.482 -11.043 1.00 0.00 H new ATOM 0 HB3 HIS A 34 41.681 -34.253 -11.083 1.00 0.00 H new ATOM 0 HD1 HIS A 34 41.353 -32.242 -9.604 1.00 0.00 H new ATOM 0 HD2 HIS A 34 37.785 -34.359 -10.286 1.00 0.00 H new ATOM 0 HE1 HIS A 34 39.561 -31.181 -8.118 1.00 0.00 H new ATOM 531 N TRP A 35 38.323 -35.455 -13.178 1.00 0.00 N ATOM 532 CA TRP A 35 36.918 -35.683 -13.470 1.00 0.00 C ATOM 533 C TRP A 35 36.168 -35.775 -12.140 1.00 0.00 C ATOM 534 O TRP A 35 36.762 -36.085 -11.108 1.00 0.00 O ATOM 535 CB TRP A 35 36.735 -36.923 -14.347 1.00 0.00 C ATOM 536 CG TRP A 35 36.696 -36.624 -15.848 1.00 0.00 C ATOM 537 CD1 TRP A 35 37.411 -35.716 -16.526 1.00 0.00 C ATOM 538 CD2 TRP A 35 35.867 -37.276 -16.833 1.00 0.00 C ATOM 539 NE1 TRP A 35 37.105 -35.734 -17.872 1.00 0.00 N ATOM 540 CE2 TRP A 35 36.136 -36.713 -18.065 1.00 0.00 C ATOM 541 CE3 TRP A 35 34.921 -38.306 -16.689 1.00 0.00 C ATOM 542 CZ2 TRP A 35 35.501 -37.116 -19.246 1.00 0.00 C ATOM 543 CZ3 TRP A 35 34.296 -38.696 -17.879 1.00 0.00 C ATOM 544 CH2 TRP A 35 34.555 -38.140 -19.126 1.00 0.00 C ATOM 0 H TRP A 35 38.887 -36.302 -13.109 1.00 0.00 H new ATOM 0 HA TRP A 35 36.504 -34.856 -14.046 1.00 0.00 H new ATOM 0 HB2 TRP A 35 37.549 -37.620 -14.147 1.00 0.00 H new ATOM 0 HB3 TRP A 35 35.809 -37.423 -14.062 1.00 0.00 H new ATOM 0 HD1 TRP A 35 38.136 -35.053 -16.076 1.00 0.00 H new ATOM 0 HE1 TRP A 35 37.514 -35.139 -18.592 1.00 0.00 H new ATOM 0 HE3 TRP A 35 34.695 -38.760 -15.736 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 35.729 -36.661 -20.198 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 33.560 -39.485 -17.824 1.00 0.00 H new ATOM 0 HH2 TRP A 35 34.028 -38.497 -19.999 1.00 0.00 H new ATOM 555 N ALA A 36 34.874 -35.501 -12.207 1.00 0.00 N ATOM 556 CA ALA A 36 34.036 -35.550 -11.020 1.00 0.00 C ATOM 557 C ALA A 36 34.101 -36.952 -10.412 1.00 0.00 C ATOM 558 O ALA A 36 34.113 -37.102 -9.191 1.00 0.00 O ATOM 559 CB ALA A 36 32.608 -35.139 -11.387 1.00 0.00 C ATOM 0 H ALA A 36 34.385 -35.244 -13.064 1.00 0.00 H new ATOM 0 HA ALA A 36 34.395 -34.848 -10.267 1.00 0.00 H new ATOM 0 HB1 ALA A 36 31.979 -35.175 -10.498 1.00 0.00 H new ATOM 0 HB2 ALA A 36 32.613 -34.125 -11.787 1.00 0.00 H new ATOM 0 HB3 ALA A 36 32.214 -35.823 -12.138 1.00 0.00 H new ATOM 565 N LYS A 37 34.142 -37.943 -11.291 1.00 0.00 N ATOM 566 CA LYS A 37 34.207 -39.327 -10.856 1.00 0.00 C ATOM 567 C LYS A 37 35.525 -39.565 -10.117 1.00 0.00 C ATOM 568 O LYS A 37 35.699 -40.593 -9.465 1.00 0.00 O ATOM 569 CB LYS A 37 33.985 -40.272 -12.039 1.00 0.00 C ATOM 570 CG LYS A 37 32.582 -40.100 -12.622 1.00 0.00 C ATOM 571 CD LYS A 37 32.535 -40.560 -14.081 1.00 0.00 C ATOM 572 CE LYS A 37 31.345 -39.936 -14.813 1.00 0.00 C ATOM 573 NZ LYS A 37 31.439 -40.195 -16.268 1.00 0.00 N ATOM 0 H LYS A 37 34.131 -37.814 -12.303 1.00 0.00 H new ATOM 0 HA LYS A 37 33.404 -39.542 -10.151 1.00 0.00 H new ATOM 0 HB2 LYS A 37 34.730 -40.076 -12.810 1.00 0.00 H new ATOM 0 HB3 LYS A 37 34.125 -41.304 -11.716 1.00 0.00 H new ATOM 0 HG2 LYS A 37 31.866 -40.674 -12.033 1.00 0.00 H new ATOM 0 HG3 LYS A 37 32.283 -39.054 -12.557 1.00 0.00 H new ATOM 0 HD2 LYS A 37 33.462 -40.283 -14.584 1.00 0.00 H new ATOM 0 HD3 LYS A 37 32.463 -41.647 -14.122 1.00 0.00 H new ATOM 0 HE2 LYS A 37 30.414 -40.348 -14.423 1.00 0.00 H new ATOM 0 HE3 LYS A 37 31.320 -38.862 -14.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 30.483 -40.280 -16.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 31.938 -39.408 -16.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 31.962 -41.079 -16.430 1.00 0.00 H new ATOM 587 N ASP A 38 36.421 -38.596 -10.245 1.00 0.00 N ATOM 588 CA ASP A 38 37.719 -38.687 -9.597 1.00 0.00 C ATOM 589 C ASP A 38 37.936 -37.448 -8.726 1.00 0.00 C ATOM 590 O ASP A 38 39.073 -37.105 -8.403 1.00 0.00 O ATOM 591 CB ASP A 38 38.846 -38.743 -10.630 1.00 0.00 C ATOM 592 CG ASP A 38 39.918 -39.802 -10.360 1.00 0.00 C ATOM 593 OD1 ASP A 38 41.046 -39.391 -10.012 1.00 0.00 O ATOM 594 OD2 ASP A 38 39.584 -40.997 -10.507 1.00 0.00 O ATOM 0 H ASP A 38 36.274 -37.745 -10.787 1.00 0.00 H new ATOM 0 HA ASP A 38 37.735 -39.597 -8.997 1.00 0.00 H new ATOM 0 HB2 ASP A 38 38.410 -38.931 -11.611 1.00 0.00 H new ATOM 0 HB3 ASP A 38 39.326 -37.765 -10.676 1.00 0.00 H new ATOM 599 N CYS A 39 36.831 -36.811 -8.372 1.00 0.00 N ATOM 600 CA CYS A 39 36.887 -35.618 -7.544 1.00 0.00 C ATOM 601 C CYS A 39 37.425 -36.012 -6.167 1.00 0.00 C ATOM 602 O CYS A 39 36.926 -36.950 -5.548 1.00 0.00 O ATOM 603 CB CYS A 39 35.523 -34.930 -7.449 1.00 0.00 C ATOM 604 SG CYS A 39 35.693 -33.320 -6.598 1.00 0.00 S ATOM 0 H CYS A 39 35.891 -37.098 -8.643 1.00 0.00 H new ATOM 0 HA CYS A 39 37.557 -34.889 -7.999 1.00 0.00 H new ATOM 0 HB2 CYS A 39 35.111 -34.781 -8.447 1.00 0.00 H new ATOM 0 HB3 CYS A 39 34.823 -35.565 -6.907 1.00 0.00 H new ATOM 609 N PRO A 40 38.462 -35.258 -5.717 1.00 0.00 N ATOM 610 CA PRO A 40 39.073 -35.519 -4.425 1.00 0.00 C ATOM 611 C PRO A 40 38.176 -35.029 -3.286 1.00 0.00 C ATOM 612 O PRO A 40 38.530 -35.156 -2.114 1.00 0.00 O ATOM 613 CB PRO A 40 40.415 -34.807 -4.473 1.00 0.00 C ATOM 614 CG PRO A 40 40.310 -33.793 -5.600 1.00 0.00 C ATOM 615 CD PRO A 40 39.079 -34.138 -6.424 1.00 0.00 C ATOM 0 HA PRO A 40 39.209 -36.583 -4.231 1.00 0.00 H new ATOM 0 HB2 PRO A 40 40.630 -34.315 -3.524 1.00 0.00 H new ATOM 0 HB3 PRO A 40 41.225 -35.513 -4.657 1.00 0.00 H new ATOM 0 HG2 PRO A 40 40.230 -32.783 -5.198 1.00 0.00 H new ATOM 0 HG3 PRO A 40 41.205 -33.819 -6.222 1.00 0.00 H new ATOM 0 HD2 PRO A 40 38.398 -33.290 -6.493 1.00 0.00 H new ATOM 0 HD3 PRO A 40 39.349 -34.414 -7.443 1.00 0.00 H new ATOM 623 N LYS A 41 37.034 -34.478 -3.669 1.00 0.00 N ATOM 624 CA LYS A 41 36.084 -33.969 -2.695 1.00 0.00 C ATOM 625 C LYS A 41 34.992 -35.013 -2.460 1.00 0.00 C ATOM 626 O LYS A 41 34.281 -34.959 -1.457 1.00 0.00 O ATOM 627 CB LYS A 41 35.548 -32.604 -3.132 1.00 0.00 C ATOM 628 CG LYS A 41 35.239 -31.722 -1.921 1.00 0.00 C ATOM 629 CD LYS A 41 34.082 -30.766 -2.219 1.00 0.00 C ATOM 630 CE LYS A 41 33.037 -30.804 -1.102 1.00 0.00 C ATOM 631 NZ LYS A 41 32.577 -29.436 -0.776 1.00 0.00 N ATOM 0 H LYS A 41 36.745 -34.373 -4.642 1.00 0.00 H new ATOM 0 HA LYS A 41 36.575 -33.800 -1.736 1.00 0.00 H new ATOM 0 HB2 LYS A 41 36.281 -32.109 -3.769 1.00 0.00 H new ATOM 0 HB3 LYS A 41 34.646 -32.738 -3.728 1.00 0.00 H new ATOM 0 HG2 LYS A 41 34.986 -32.348 -1.065 1.00 0.00 H new ATOM 0 HG3 LYS A 41 36.126 -31.151 -1.647 1.00 0.00 H new ATOM 0 HD2 LYS A 41 34.464 -29.751 -2.330 1.00 0.00 H new ATOM 0 HD3 LYS A 41 33.617 -31.037 -3.167 1.00 0.00 H new ATOM 0 HE2 LYS A 41 32.189 -31.415 -1.410 1.00 0.00 H new ATOM 0 HE3 LYS A 41 33.462 -31.272 -0.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 31.868 -29.480 -0.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 33.386 -28.863 -0.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 32.153 -29.002 -1.621 1.00 0.00 H new ATOM 645 N LYS A 42 34.889 -35.939 -3.402 1.00 0.00 N ATOM 646 CA LYS A 42 33.895 -36.994 -3.310 1.00 0.00 C ATOM 647 C LYS A 42 34.094 -37.764 -2.003 1.00 0.00 C ATOM 648 O LYS A 42 35.203 -37.819 -1.473 1.00 0.00 O ATOM 649 CB LYS A 42 33.936 -37.879 -4.558 1.00 0.00 C ATOM 650 CG LYS A 42 32.845 -37.476 -5.552 1.00 0.00 C ATOM 651 CD LYS A 42 32.271 -38.702 -6.264 1.00 0.00 C ATOM 652 CE LYS A 42 32.392 -38.561 -7.782 1.00 0.00 C ATOM 653 NZ LYS A 42 31.371 -39.388 -8.463 1.00 0.00 N ATOM 0 H LYS A 42 35.478 -35.980 -4.233 1.00 0.00 H new ATOM 0 HA LYS A 42 32.891 -36.570 -3.281 1.00 0.00 H new ATOM 0 HB2 LYS A 42 34.914 -37.799 -5.033 1.00 0.00 H new ATOM 0 HB3 LYS A 42 33.805 -38.923 -4.272 1.00 0.00 H new ATOM 0 HG2 LYS A 42 32.048 -36.949 -5.028 1.00 0.00 H new ATOM 0 HG3 LYS A 42 33.256 -36.783 -6.287 1.00 0.00 H new ATOM 0 HD2 LYS A 42 32.798 -39.598 -5.935 1.00 0.00 H new ATOM 0 HD3 LYS A 42 31.224 -38.829 -5.989 1.00 0.00 H new ATOM 0 HE2 LYS A 42 32.271 -37.516 -8.067 1.00 0.00 H new ATOM 0 HE3 LYS A 42 33.388 -38.865 -8.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 31.012 -38.880 -9.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 31.797 -40.288 -8.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 30.586 -39.579 -7.808 1.00 0.00 H new ATOM 667 N PRO A 43 32.974 -38.354 -1.508 1.00 0.00 N ATOM 668 CA PRO A 43 33.013 -39.119 -0.273 1.00 0.00 C ATOM 669 C PRO A 43 33.676 -40.481 -0.492 1.00 0.00 C ATOM 670 O PRO A 43 33.070 -41.384 -1.065 1.00 0.00 O ATOM 671 CB PRO A 43 31.564 -39.229 0.170 1.00 0.00 C ATOM 672 CG PRO A 43 30.727 -38.928 -1.064 1.00 0.00 C ATOM 673 CD PRO A 43 31.644 -38.310 -2.108 1.00 0.00 C ATOM 0 HA PRO A 43 33.615 -38.639 0.499 1.00 0.00 H new ATOM 0 HB2 PRO A 43 31.348 -40.226 0.555 1.00 0.00 H new ATOM 0 HB3 PRO A 43 31.346 -38.523 0.972 1.00 0.00 H new ATOM 0 HG2 PRO A 43 30.271 -39.840 -1.448 1.00 0.00 H new ATOM 0 HG3 PRO A 43 29.914 -38.245 -0.817 1.00 0.00 H new ATOM 0 HD2 PRO A 43 31.613 -38.870 -3.043 1.00 0.00 H new ATOM 0 HD3 PRO A 43 31.348 -37.287 -2.339 1.00 0.00 H new ATOM 681 N ARG A 44 34.912 -40.584 -0.025 1.00 0.00 N ATOM 682 CA ARG A 44 35.664 -41.820 -0.163 1.00 0.00 C ATOM 683 C ARG A 44 36.847 -41.832 0.807 1.00 0.00 C ATOM 684 O ARG A 44 37.761 -41.018 0.686 1.00 0.00 O ATOM 685 CB ARG A 44 36.181 -41.993 -1.592 1.00 0.00 C ATOM 686 CG ARG A 44 35.518 -43.190 -2.274 1.00 0.00 C ATOM 687 CD ARG A 44 35.369 -42.951 -3.778 1.00 0.00 C ATOM 688 NE ARG A 44 35.763 -44.166 -4.526 1.00 0.00 N ATOM 689 CZ ARG A 44 37.023 -44.611 -4.624 1.00 0.00 C ATOM 690 NH1 ARG A 44 38.018 -43.945 -4.025 1.00 0.00 N ATOM 691 NH2 ARG A 44 37.287 -45.723 -5.324 1.00 0.00 N ATOM 0 H ARG A 44 35.411 -39.832 0.449 1.00 0.00 H new ATOM 0 HA ARG A 44 34.992 -42.646 0.069 1.00 0.00 H new ATOM 0 HB2 ARG A 44 35.983 -41.088 -2.166 1.00 0.00 H new ATOM 0 HB3 ARG A 44 37.262 -42.131 -1.577 1.00 0.00 H new ATOM 0 HG2 ARG A 44 36.113 -44.087 -2.102 1.00 0.00 H new ATOM 0 HG3 ARG A 44 34.538 -43.368 -1.832 1.00 0.00 H new ATOM 0 HD2 ARG A 44 34.337 -42.689 -4.012 1.00 0.00 H new ATOM 0 HD3 ARG A 44 35.990 -42.109 -4.084 1.00 0.00 H new ATOM 0 HE ARG A 44 35.030 -44.697 -4.996 1.00 0.00 H new ATOM 0 HH11 ARG A 44 37.817 -43.098 -3.493 1.00 0.00 H new ATOM 0 HH12 ARG A 44 38.977 -44.285 -4.100 1.00 0.00 H new ATOM 0 HH21 ARG A 44 36.529 -46.230 -5.781 1.00 0.00 H new ATOM 0 HH22 ARG A 44 38.246 -46.063 -5.399 1.00 0.00 H new ATOM 705 N GLY A 45 36.792 -42.765 1.746 1.00 0.00 N ATOM 706 CA GLY A 45 37.848 -42.894 2.735 1.00 0.00 C ATOM 707 C GLY A 45 37.966 -41.625 3.580 1.00 0.00 C ATOM 708 O GLY A 45 37.268 -40.642 3.332 1.00 0.00 O ATOM 0 H GLY A 45 36.032 -43.439 1.843 1.00 0.00 H new ATOM 0 HA2 GLY A 45 37.644 -43.748 3.381 1.00 0.00 H new ATOM 0 HA3 GLY A 45 38.796 -43.092 2.236 1.00 0.00 H new ATOM 712 N PRO A 46 38.879 -41.686 4.587 1.00 0.00 N ATOM 713 CA PRO A 46 39.664 -42.888 4.812 1.00 0.00 C ATOM 714 C PRO A 46 38.817 -43.983 5.465 1.00 0.00 C ATOM 715 O PRO A 46 37.672 -43.743 5.845 1.00 0.00 O ATOM 716 CB PRO A 46 40.828 -42.440 5.680 1.00 0.00 C ATOM 717 CG PRO A 46 40.405 -41.114 6.292 1.00 0.00 C ATOM 718 CD PRO A 46 39.185 -40.619 5.534 1.00 0.00 C ATOM 0 HA PRO A 46 40.024 -43.335 3.885 1.00 0.00 H new ATOM 0 HB2 PRO A 46 41.044 -43.176 6.454 1.00 0.00 H new ATOM 0 HB3 PRO A 46 41.736 -42.325 5.087 1.00 0.00 H new ATOM 0 HG2 PRO A 46 40.173 -41.239 7.350 1.00 0.00 H new ATOM 0 HG3 PRO A 46 41.215 -40.388 6.227 1.00 0.00 H new ATOM 0 HD2 PRO A 46 38.348 -40.435 6.208 1.00 0.00 H new ATOM 0 HD3 PRO A 46 39.392 -39.681 5.020 1.00 0.00 H new ATOM 726 N ARG A 47 39.413 -45.161 5.575 1.00 0.00 N ATOM 727 CA ARG A 47 38.729 -46.293 6.176 1.00 0.00 C ATOM 728 C ARG A 47 37.477 -46.645 5.369 1.00 0.00 C ATOM 729 O ARG A 47 36.648 -45.779 5.095 1.00 0.00 O ATOM 730 CB ARG A 47 38.328 -45.990 7.621 1.00 0.00 C ATOM 731 CG ARG A 47 38.768 -47.115 8.560 1.00 0.00 C ATOM 732 CD ARG A 47 38.862 -46.620 10.004 1.00 0.00 C ATOM 733 NE ARG A 47 40.219 -46.869 10.537 1.00 0.00 N ATOM 734 CZ ARG A 47 40.561 -46.714 11.824 1.00 0.00 C ATOM 735 NH1 ARG A 47 39.646 -46.311 12.716 1.00 0.00 N ATOM 736 NH2 ARG A 47 41.817 -46.963 12.218 1.00 0.00 N ATOM 0 H ARG A 47 40.363 -45.356 5.258 1.00 0.00 H new ATOM 0 HA ARG A 47 39.418 -47.138 6.172 1.00 0.00 H new ATOM 0 HB2 ARG A 47 38.779 -45.050 7.938 1.00 0.00 H new ATOM 0 HB3 ARG A 47 37.247 -45.862 7.683 1.00 0.00 H new ATOM 0 HG2 ARG A 47 38.059 -47.941 8.501 1.00 0.00 H new ATOM 0 HG3 ARG A 47 39.736 -47.502 8.241 1.00 0.00 H new ATOM 0 HD2 ARG A 47 38.635 -45.555 10.047 1.00 0.00 H new ATOM 0 HD3 ARG A 47 38.121 -47.129 10.621 1.00 0.00 H new ATOM 0 HE ARG A 47 40.940 -47.178 9.885 1.00 0.00 H new ATOM 0 HH11 ARG A 47 38.690 -46.122 12.416 1.00 0.00 H new ATOM 0 HH12 ARG A 47 39.906 -46.193 13.695 1.00 0.00 H new ATOM 0 HH21 ARG A 47 42.513 -47.270 11.539 1.00 0.00 H new ATOM 0 HH22 ARG A 47 42.077 -46.845 13.197 1.00 0.00 H new ATOM 750 N GLY A 48 37.380 -47.916 5.013 1.00 0.00 N ATOM 751 CA GLY A 48 36.243 -48.393 4.244 1.00 0.00 C ATOM 752 C GLY A 48 34.949 -47.715 4.698 1.00 0.00 C ATOM 753 O GLY A 48 34.867 -47.216 5.819 1.00 0.00 O ATOM 0 H GLY A 48 38.070 -48.631 5.243 1.00 0.00 H new ATOM 0 HA2 GLY A 48 36.408 -48.196 3.185 1.00 0.00 H new ATOM 0 HA3 GLY A 48 36.151 -49.473 4.357 1.00 0.00 H new ATOM 757 N PRO A 49 33.945 -47.720 3.782 1.00 0.00 N ATOM 758 CA PRO A 49 32.659 -47.111 4.077 1.00 0.00 C ATOM 759 C PRO A 49 31.843 -47.990 5.028 1.00 0.00 C ATOM 760 O PRO A 49 32.072 -49.195 5.116 1.00 0.00 O ATOM 761 CB PRO A 49 31.993 -46.922 2.724 1.00 0.00 C ATOM 762 CG PRO A 49 32.724 -47.849 1.767 1.00 0.00 C ATOM 763 CD PRO A 49 34.006 -48.302 2.444 1.00 0.00 C ATOM 0 HA PRO A 49 32.754 -46.157 4.595 1.00 0.00 H new ATOM 0 HB2 PRO A 49 30.932 -47.168 2.773 1.00 0.00 H new ATOM 0 HB3 PRO A 49 32.065 -45.885 2.395 1.00 0.00 H new ATOM 0 HG2 PRO A 49 32.101 -48.708 1.517 1.00 0.00 H new ATOM 0 HG3 PRO A 49 32.947 -47.334 0.833 1.00 0.00 H new ATOM 0 HD2 PRO A 49 34.068 -49.389 2.488 1.00 0.00 H new ATOM 0 HD3 PRO A 49 34.885 -47.954 1.901 1.00 0.00 H new ATOM 771 N ARG A 50 30.907 -47.351 5.716 1.00 0.00 N ATOM 772 CA ARG A 50 30.055 -48.058 6.657 1.00 0.00 C ATOM 773 C ARG A 50 28.756 -47.284 6.883 1.00 0.00 C ATOM 774 O ARG A 50 28.713 -46.359 7.694 1.00 0.00 O ATOM 775 CB ARG A 50 30.764 -48.258 7.998 1.00 0.00 C ATOM 776 CG ARG A 50 30.200 -49.472 8.740 1.00 0.00 C ATOM 777 CD ARG A 50 31.031 -50.724 8.453 1.00 0.00 C ATOM 778 NE ARG A 50 30.960 -51.654 9.601 1.00 0.00 N ATOM 779 CZ ARG A 50 31.783 -52.696 9.776 1.00 0.00 C ATOM 780 NH1 ARG A 50 32.745 -52.948 8.879 1.00 0.00 N ATOM 781 NH2 ARG A 50 31.644 -53.487 10.849 1.00 0.00 N ATOM 0 H ARG A 50 30.720 -46.351 5.640 1.00 0.00 H new ATOM 0 HA ARG A 50 29.828 -49.035 6.230 1.00 0.00 H new ATOM 0 HB2 ARG A 50 31.833 -48.393 7.832 1.00 0.00 H new ATOM 0 HB3 ARG A 50 30.647 -47.365 8.612 1.00 0.00 H new ATOM 0 HG2 ARG A 50 30.190 -49.275 9.812 1.00 0.00 H new ATOM 0 HG3 ARG A 50 29.166 -49.640 8.437 1.00 0.00 H new ATOM 0 HD2 ARG A 50 30.663 -51.216 7.553 1.00 0.00 H new ATOM 0 HD3 ARG A 50 32.068 -50.446 8.263 1.00 0.00 H new ATOM 0 HE ARG A 50 30.239 -51.491 10.304 1.00 0.00 H new ATOM 0 HH11 ARG A 50 32.851 -52.346 8.062 1.00 0.00 H new ATOM 0 HH12 ARG A 50 33.372 -53.742 9.013 1.00 0.00 H new ATOM 0 HH21 ARG A 50 30.911 -53.295 11.532 1.00 0.00 H new ATOM 0 HH22 ARG A 50 32.271 -54.281 10.982 1.00 0.00 H new ATOM 795 N PRO A 51 27.701 -47.699 6.133 1.00 0.00 N ATOM 796 CA PRO A 51 26.404 -47.054 6.244 1.00 0.00 C ATOM 797 C PRO A 51 25.693 -47.469 7.533 1.00 0.00 C ATOM 798 O PRO A 51 25.842 -48.601 7.992 1.00 0.00 O ATOM 799 CB PRO A 51 25.650 -47.469 4.991 1.00 0.00 C ATOM 800 CG PRO A 51 26.371 -48.695 4.457 1.00 0.00 C ATOM 801 CD PRO A 51 27.715 -48.790 5.162 1.00 0.00 C ATOM 0 HA PRO A 51 26.479 -45.968 6.308 1.00 0.00 H new ATOM 0 HB2 PRO A 51 24.609 -47.697 5.219 1.00 0.00 H new ATOM 0 HB3 PRO A 51 25.646 -46.666 4.254 1.00 0.00 H new ATOM 0 HG2 PRO A 51 25.781 -49.594 4.638 1.00 0.00 H new ATOM 0 HG3 PRO A 51 26.510 -48.616 3.379 1.00 0.00 H new ATOM 0 HD2 PRO A 51 27.838 -49.756 5.653 1.00 0.00 H new ATOM 0 HD3 PRO A 51 28.540 -48.683 4.458 1.00 0.00 H new ATOM 809 N GLN A 52 24.936 -46.531 8.083 1.00 0.00 N ATOM 810 CA GLN A 52 24.203 -46.784 9.311 1.00 0.00 C ATOM 811 C GLN A 52 23.156 -45.692 9.540 1.00 0.00 C ATOM 812 O GLN A 52 23.403 -44.521 9.253 1.00 0.00 O ATOM 813 CB GLN A 52 25.154 -46.891 10.505 1.00 0.00 C ATOM 814 CG GLN A 52 24.506 -47.667 11.654 1.00 0.00 C ATOM 815 CD GLN A 52 24.799 -47.001 12.999 1.00 0.00 C ATOM 816 OE1 GLN A 52 24.822 -45.788 13.129 1.00 0.00 O ATOM 817 NE2 GLN A 52 25.021 -47.859 13.991 1.00 0.00 N ATOM 0 H GLN A 52 24.815 -45.594 7.700 1.00 0.00 H new ATOM 0 HA GLN A 52 23.687 -47.739 9.212 1.00 0.00 H new ATOM 0 HB2 GLN A 52 26.074 -47.389 10.198 1.00 0.00 H new ATOM 0 HB3 GLN A 52 25.430 -45.893 10.845 1.00 0.00 H new ATOM 0 HG2 GLN A 52 23.429 -47.722 11.498 1.00 0.00 H new ATOM 0 HG3 GLN A 52 24.879 -48.691 11.662 1.00 0.00 H new ATOM 0 HE21 GLN A 52 24.987 -48.863 13.814 1.00 0.00 H new ATOM 0 HE22 GLN A 52 25.225 -47.513 14.928 1.00 0.00 H new ATOM 826 N THR A 53 22.010 -46.114 10.054 1.00 0.00 N ATOM 827 CA THR A 53 20.925 -45.186 10.324 1.00 0.00 C ATOM 828 C THR A 53 21.314 -44.221 11.445 1.00 0.00 C ATOM 829 O THR A 53 21.455 -44.627 12.598 1.00 0.00 O ATOM 830 CB THR A 53 19.670 -46.005 10.635 1.00 0.00 C ATOM 831 OG1 THR A 53 18.654 -45.024 10.827 1.00 0.00 O ATOM 832 CG2 THR A 53 19.757 -46.719 11.986 1.00 0.00 C ATOM 0 H THR A 53 21.809 -47.086 10.291 1.00 0.00 H new ATOM 0 HA THR A 53 20.716 -44.559 9.457 1.00 0.00 H new ATOM 0 HB THR A 53 19.511 -46.739 9.845 1.00 0.00 H new ATOM 0 HG1 THR A 53 17.805 -45.468 11.032 1.00 0.00 H new ATOM 0 HG21 THR A 53 18.842 -47.285 12.158 1.00 0.00 H new ATOM 0 HG22 THR A 53 20.609 -47.399 11.984 1.00 0.00 H new ATOM 0 HG23 THR A 53 19.882 -45.982 12.780 1.00 0.00 H new ATOM 840 N SER A 54 21.479 -42.962 11.067 1.00 0.00 N ATOM 841 CA SER A 54 21.851 -41.936 12.027 1.00 0.00 C ATOM 842 C SER A 54 21.224 -40.597 11.629 1.00 0.00 C ATOM 843 O SER A 54 21.471 -40.092 10.536 1.00 0.00 O ATOM 844 CB SER A 54 23.371 -41.801 12.129 1.00 0.00 C ATOM 845 OG SER A 54 23.944 -41.297 10.924 1.00 0.00 O ATOM 0 H SER A 54 21.362 -42.629 10.110 1.00 0.00 H new ATOM 0 HA SER A 54 21.474 -42.231 13.006 1.00 0.00 H new ATOM 0 HB2 SER A 54 23.621 -41.136 12.956 1.00 0.00 H new ATOM 0 HB3 SER A 54 23.807 -42.773 12.359 1.00 0.00 H new ATOM 0 HG SER A 54 23.292 -40.726 10.466 1.00 0.00 H new ATOM 851 N LEU A 55 20.425 -40.060 12.541 1.00 0.00 N ATOM 852 CA LEU A 55 19.762 -38.790 12.299 1.00 0.00 C ATOM 853 C LEU A 55 19.615 -38.037 13.623 1.00 0.00 C ATOM 854 O LEU A 55 20.196 -36.968 13.801 1.00 0.00 O ATOM 855 CB LEU A 55 18.438 -39.009 11.566 1.00 0.00 C ATOM 856 CG LEU A 55 18.054 -37.940 10.540 1.00 0.00 C ATOM 857 CD1 LEU A 55 17.935 -36.565 11.200 1.00 0.00 C ATOM 858 CD2 LEU A 55 19.037 -37.929 9.366 1.00 0.00 C ATOM 0 H LEU A 55 20.222 -40.481 13.448 1.00 0.00 H new ATOM 0 HA LEU A 55 20.364 -38.164 11.641 1.00 0.00 H new ATOM 0 HB2 LEU A 55 18.482 -39.972 11.058 1.00 0.00 H new ATOM 0 HB3 LEU A 55 17.642 -39.075 12.307 1.00 0.00 H new ATOM 0 HG LEU A 55 17.073 -38.190 10.137 1.00 0.00 H new ATOM 0 HD11 LEU A 55 17.661 -35.824 10.449 1.00 0.00 H new ATOM 0 HD12 LEU A 55 17.168 -36.598 11.974 1.00 0.00 H new ATOM 0 HD13 LEU A 55 18.891 -36.292 11.648 1.00 0.00 H new ATOM 0 HD21 LEU A 55 18.742 -37.161 8.651 1.00 0.00 H new ATOM 0 HD22 LEU A 55 20.041 -37.716 9.734 1.00 0.00 H new ATOM 0 HD23 LEU A 55 19.029 -38.903 8.876 1.00 0.00 H new ATOM 870 N LEU A 56 18.834 -38.625 14.518 1.00 0.00 N ATOM 871 CA LEU A 56 18.603 -38.022 15.820 1.00 0.00 C ATOM 872 C LEU A 56 17.923 -36.665 15.636 1.00 0.00 C ATOM 873 O LEU A 56 17.311 -36.409 14.600 1.00 0.00 O ATOM 874 CB LEU A 56 19.907 -37.954 16.617 1.00 0.00 C ATOM 875 CG LEU A 56 19.824 -37.261 17.979 1.00 0.00 C ATOM 876 CD1 LEU A 56 19.322 -38.224 19.056 1.00 0.00 C ATOM 877 CD2 LEU A 56 21.167 -36.629 18.354 1.00 0.00 C ATOM 0 H LEU A 56 18.354 -39.512 14.367 1.00 0.00 H new ATOM 0 HA LEU A 56 17.927 -38.639 16.411 1.00 0.00 H new ATOM 0 HB2 LEU A 56 20.270 -38.970 16.770 1.00 0.00 H new ATOM 0 HB3 LEU A 56 20.653 -37.437 16.013 1.00 0.00 H new ATOM 0 HG LEU A 56 19.096 -36.453 17.908 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.273 -37.705 20.013 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.329 -38.585 18.787 1.00 0.00 H new ATOM 0 HD13 LEU A 56 20.006 -39.069 19.136 1.00 0.00 H new ATOM 0 HD21 LEU A 56 21.082 -36.143 19.326 1.00 0.00 H new ATOM 0 HD22 LEU A 56 21.933 -37.403 18.401 1.00 0.00 H new ATOM 0 HD23 LEU A 56 21.444 -35.890 17.602 1.00 0.00 H new TER 889 LEU A 56 ATOM 890 P A B 493 22.055 -32.073 -7.060 1.00 0.00 P ATOM 891 OP1 A B 493 22.722 -31.775 -8.349 1.00 0.00 O ATOM 892 OP2 A B 493 22.159 -33.454 -6.541 1.00 0.00 O ATOM 893 O5' A B 493 22.652 -31.081 -5.955 1.00 0.00 O ATOM 894 C5' A B 493 23.113 -29.786 -6.333 1.00 0.00 C ATOM 895 C4' A B 493 23.218 -28.897 -5.115 1.00 0.00 C ATOM 896 O4' A B 493 22.468 -29.505 -4.048 1.00 0.00 O ATOM 897 C3' A B 493 24.601 -28.872 -4.470 1.00 0.00 C ATOM 898 O3' A B 493 25.346 -27.770 -4.984 1.00 0.00 O ATOM 899 C2' A B 493 24.348 -28.726 -2.995 1.00 0.00 C ATOM 900 O2' A B 493 24.077 -27.348 -2.861 1.00 0.00 O ATOM 901 C1' A B 493 23.145 -29.650 -2.820 1.00 0.00 C ATOM 902 N9 A B 493 23.517 -31.060 -2.578 1.00 0.00 N ATOM 903 C8 A B 493 24.078 -31.922 -3.452 1.00 0.00 C ATOM 904 N7 A B 493 24.288 -33.123 -2.924 1.00 0.00 N ATOM 905 C5 A B 493 23.829 -33.003 -1.640 1.00 0.00 C ATOM 906 C6 A B 493 23.777 -33.928 -0.576 1.00 0.00 C ATOM 907 N6 A B 493 24.211 -35.212 -0.651 1.00 0.00 N ATOM 908 N1 A B 493 23.253 -33.497 0.604 1.00 0.00 N ATOM 909 C2 A B 493 22.817 -32.219 0.687 1.00 0.00 C ATOM 910 N3 A B 493 22.819 -31.258 -0.255 1.00 0.00 N ATOM 911 C4 A B 493 23.354 -31.752 -1.407 1.00 0.00 C ATOM 0 H5' A B 493 22.428 -29.345 -7.057 1.00 0.00 H new ATOM 0 H5'' A B 493 24.085 -29.865 -6.820 1.00 0.00 H new ATOM 0 H4' A B 493 22.906 -27.914 -5.469 1.00 0.00 H new ATOM 0 H3' A B 493 25.182 -29.770 -4.678 1.00 0.00 H new ATOM 0 H2' A B 493 25.115 -28.986 -2.266 1.00 0.00 H new ATOM 0 HO2' A B 493 24.516 -26.856 -3.586 1.00 0.00 H new ATOM 0 H1' A B 493 22.550 -29.388 -1.945 1.00 0.00 H new ATOM 0 H8 A B 493 24.329 -31.664 -4.470 1.00 0.00 H new ATOM 0 H61 A B 493 24.140 -35.823 0.163 1.00 0.00 H new ATOM 0 H62 A B 493 24.608 -35.566 -1.521 1.00 0.00 H new ATOM 0 H2 A B 493 22.410 -31.929 1.644 1.00 0.00 H new ATOM 923 P A B 494 26.168 -27.929 -6.349 1.00 0.00 P ATOM 924 OP1 A B 494 27.184 -26.857 -6.445 1.00 0.00 O ATOM 925 OP2 A B 494 25.228 -28.083 -7.482 1.00 0.00 O ATOM 926 O5' A B 494 26.933 -29.319 -6.149 1.00 0.00 O ATOM 927 C5' A B 494 27.643 -29.905 -7.237 1.00 0.00 C ATOM 928 C4' A B 494 27.904 -31.368 -6.960 1.00 0.00 C ATOM 929 O4' A B 494 29.126 -31.352 -6.200 1.00 0.00 O ATOM 930 C3' A B 494 26.895 -32.022 -6.020 1.00 0.00 C ATOM 931 O3' A B 494 26.177 -33.034 -6.723 1.00 0.00 O ATOM 932 C2' A B 494 27.714 -32.603 -4.901 1.00 0.00 C ATOM 933 O2' A B 494 28.052 -33.879 -5.394 1.00 0.00 O ATOM 934 C1' A B 494 28.861 -31.599 -4.837 1.00 0.00 C ATOM 935 N9 A B 494 28.514 -30.351 -4.125 1.00 0.00 N ATOM 936 C8 A B 494 27.620 -30.199 -3.126 1.00 0.00 C ATOM 937 N7 A B 494 27.539 -28.944 -2.696 1.00 0.00 N ATOM 938 C5 A B 494 28.439 -28.271 -3.478 1.00 0.00 C ATOM 939 C6 A B 494 28.815 -26.912 -3.511 1.00 0.00 C ATOM 940 N6 A B 494 28.302 -25.951 -2.699 1.00 0.00 N ATOM 941 N1 A B 494 29.758 -26.544 -4.421 1.00 0.00 N ATOM 942 C2 A B 494 30.275 -27.493 -5.234 1.00 0.00 C ATOM 943 N3 A B 494 29.992 -28.808 -5.289 1.00 0.00 N ATOM 944 C4 A B 494 29.046 -29.110 -4.358 1.00 0.00 C ATOM 0 H5' A B 494 28.587 -29.382 -7.389 1.00 0.00 H new ATOM 0 H5'' A B 494 27.068 -29.798 -8.157 1.00 0.00 H new ATOM 0 H4' A B 494 27.889 -31.910 -7.906 1.00 0.00 H new ATOM 0 H3' A B 494 26.156 -31.319 -5.636 1.00 0.00 H new ATOM 0 H2' A B 494 27.291 -32.735 -3.905 1.00 0.00 H new ATOM 0 HO2' A B 494 28.968 -34.101 -5.126 1.00 0.00 H new ATOM 0 H1' A B 494 29.712 -31.984 -4.276 1.00 0.00 H new ATOM 0 H8 A B 494 27.033 -31.010 -2.720 1.00 0.00 H new ATOM 0 H61 A B 494 28.625 -24.987 -2.783 1.00 0.00 H new ATOM 0 H62 A B 494 27.594 -26.194 -2.006 1.00 0.00 H new ATOM 0 H2 A B 494 31.019 -27.148 -5.937 1.00 0.00 H new ATOM 956 P C B 495 25.592 -32.732 -8.182 1.00 0.00 P ATOM 957 OP1 C B 495 25.507 -31.270 -8.392 1.00 0.00 O ATOM 958 OP2 C B 495 24.362 -33.525 -8.399 1.00 0.00 O ATOM 959 O5' C B 495 26.728 -33.306 -9.151 1.00 0.00 O ATOM 960 C5' C B 495 26.789 -32.879 -10.510 1.00 0.00 C ATOM 961 C4' C B 495 27.686 -33.801 -11.305 1.00 0.00 C ATOM 962 O4' C B 495 28.676 -34.391 -10.441 1.00 0.00 O ATOM 963 C3' C B 495 27.028 -35.111 -11.726 1.00 0.00 C ATOM 964 O3' C B 495 26.321 -34.917 -12.949 1.00 0.00 O ATOM 965 C2' C B 495 28.159 -36.089 -11.891 1.00 0.00 C ATOM 966 O2' C B 495 28.702 -35.725 -13.141 1.00 0.00 O ATOM 967 C1' C B 495 29.015 -35.739 -10.677 1.00 0.00 C ATOM 968 N1 C B 495 28.730 -36.577 -9.494 1.00 0.00 N ATOM 969 C2 C B 495 29.122 -37.914 -9.536 1.00 0.00 C ATOM 970 O2 C B 495 29.686 -38.333 -10.553 1.00 0.00 O ATOM 971 N3 C B 495 28.873 -38.697 -8.472 1.00 0.00 N ATOM 972 C4 C B 495 28.271 -38.234 -7.395 1.00 0.00 C ATOM 973 N4 C B 495 28.034 -39.022 -6.354 1.00 0.00 N ATOM 974 C5 C B 495 27.853 -36.852 -7.325 1.00 0.00 C ATOM 975 C6 C B 495 28.109 -36.084 -8.394 1.00 0.00 C ATOM 0 H5' C B 495 27.167 -31.858 -10.562 1.00 0.00 H new ATOM 0 H5'' C B 495 25.788 -32.871 -10.942 1.00 0.00 H new ATOM 0 H4' C B 495 28.012 -33.164 -12.127 1.00 0.00 H new ATOM 0 H3' C B 495 26.303 -35.474 -10.997 1.00 0.00 H new ATOM 0 H2' C B 495 27.976 -37.163 -11.909 1.00 0.00 H new ATOM 0 HO2' C B 495 27.985 -35.411 -13.730 1.00 0.00 H new ATOM 0 H1' C B 495 30.076 -35.909 -10.861 1.00 0.00 H new ATOM 0 H41 C B 495 27.567 -38.649 -5.528 1.00 0.00 H new ATOM 0 H42 C B 495 28.319 -40.001 -6.380 1.00 0.00 H new ATOM 0 H5 C B 495 27.357 -36.456 -6.451 1.00 0.00 H new ATOM 0 H6 C B 495 27.813 -35.046 -8.378 1.00 0.00 H new ATOM 987 P A B 496 24.722 -34.969 -12.967 1.00 0.00 P ATOM 988 OP1 A B 496 24.203 -34.782 -11.594 1.00 0.00 O ATOM 989 OP2 A B 496 24.271 -36.164 -13.712 1.00 0.00 O ATOM 990 O5' A B 496 24.330 -33.675 -13.823 1.00 0.00 O ATOM 991 C5' A B 496 23.814 -33.825 -15.144 1.00 0.00 C ATOM 992 C4' A B 496 24.716 -33.128 -16.137 1.00 0.00 C ATOM 993 O4' A B 496 25.034 -31.803 -15.679 1.00 0.00 O ATOM 994 C3' A B 496 26.156 -33.636 -16.145 1.00 0.00 C ATOM 995 O3' A B 496 26.248 -34.784 -16.986 1.00 0.00 O ATOM 996 C2' A B 496 26.976 -32.494 -16.677 1.00 0.00 C ATOM 997 O2' A B 496 26.736 -32.560 -18.066 1.00 0.00 O ATOM 998 C1' A B 496 26.328 -31.317 -15.955 1.00 0.00 C ATOM 999 N9 A B 496 27.029 -30.930 -14.713 1.00 0.00 N ATOM 1000 C8 A B 496 27.096 -31.626 -13.559 1.00 0.00 C ATOM 1001 N7 A B 496 27.807 -31.002 -12.625 1.00 0.00 N ATOM 1002 C5 A B 496 28.209 -29.845 -13.234 1.00 0.00 C ATOM 1003 C6 A B 496 28.989 -28.765 -12.770 1.00 0.00 C ATOM 1004 N6 A B 496 29.523 -28.682 -11.523 1.00 0.00 N ATOM 1005 N1 A B 496 29.218 -27.740 -13.634 1.00 0.00 N ATOM 1006 C2 A B 496 28.690 -27.814 -14.877 1.00 0.00 C ATOM 1007 N3 A B 496 27.938 -28.787 -15.424 1.00 0.00 N ATOM 1008 C4 A B 496 27.745 -29.779 -14.510 1.00 0.00 C ATOM 0 H5' A B 496 22.808 -33.408 -15.199 1.00 0.00 H new ATOM 0 H5'' A B 496 23.734 -34.883 -15.394 1.00 0.00 H new ATOM 0 H4' A B 496 24.169 -33.251 -17.072 1.00 0.00 H new ATOM 0 H3' A B 496 26.506 -33.938 -15.158 1.00 0.00 H new ATOM 0 H2' A B 496 28.055 -32.461 -16.528 1.00 0.00 H new ATOM 0 HO2' A B 496 26.604 -33.494 -18.331 1.00 0.00 H new ATOM 0 H1' A B 496 26.348 -30.407 -16.555 1.00 0.00 H new ATOM 0 H8 A B 496 26.623 -32.586 -13.410 1.00 0.00 H new ATOM 0 H61 A B 496 30.078 -27.868 -11.259 1.00 0.00 H new ATOM 0 H62 A B 496 29.369 -29.434 -10.851 1.00 0.00 H new ATOM 0 H2 A B 496 28.902 -26.974 -15.522 1.00 0.00 H new ATOM 1020 P G B 497 26.643 -36.203 -16.361 1.00 0.00 P ATOM 1021 OP1 G B 497 25.417 -36.987 -16.092 1.00 0.00 O ATOM 1022 OP2 G B 497 27.588 -36.008 -15.239 1.00 0.00 O ATOM 1023 O5' G B 497 27.433 -36.915 -17.555 1.00 0.00 O ATOM 1024 C5' G B 497 27.137 -36.575 -18.909 1.00 0.00 C ATOM 1025 C4' G B 497 28.400 -36.600 -19.739 1.00 0.00 C ATOM 1026 O4' G B 497 29.141 -35.452 -19.222 1.00 0.00 O ATOM 1027 C3' G B 497 29.415 -37.657 -19.311 1.00 0.00 C ATOM 1028 O3' G B 497 29.231 -38.835 -20.092 1.00 0.00 O ATOM 1029 C2' G B 497 30.762 -37.036 -19.559 1.00 0.00 C ATOM 1030 O2' G B 497 30.900 -37.141 -20.958 1.00 0.00 O ATOM 1031 C1' G B 497 30.527 -35.625 -19.028 1.00 0.00 C ATOM 1032 N9 G B 497 30.891 -35.463 -17.605 1.00 0.00 N ATOM 1033 C8 G B 497 30.330 -36.074 -16.541 1.00 0.00 C ATOM 1034 N7 G B 497 30.886 -35.713 -15.389 1.00 0.00 N ATOM 1035 C5 G B 497 31.854 -34.819 -15.758 1.00 0.00 C ATOM 1036 C6 G B 497 32.787 -34.083 -14.997 1.00 0.00 C ATOM 1037 O6 G B 497 32.896 -34.122 -13.772 1.00 0.00 O ATOM 1038 N1 G B 497 33.637 -33.260 -15.670 1.00 0.00 N ATOM 1039 C2 G B 497 33.540 -33.196 -17.018 1.00 0.00 C ATOM 1040 N2 G B 497 34.434 -32.353 -17.528 1.00 0.00 N ATOM 1041 N3 G B 497 32.696 -33.848 -17.840 1.00 0.00 N ATOM 1042 C4 G B 497 31.876 -34.651 -17.107 1.00 0.00 C ATOM 0 H5' G B 497 26.684 -35.585 -18.953 1.00 0.00 H new ATOM 0 H5'' G B 497 26.410 -37.277 -19.318 1.00 0.00 H new ATOM 0 H4' G B 497 28.103 -36.697 -20.783 1.00 0.00 H new ATOM 0 H3' G B 497 29.308 -37.950 -18.267 1.00 0.00 H new ATOM 0 H2' G B 497 31.663 -37.450 -19.105 1.00 0.00 H new ATOM 0 HO2' G B 497 30.270 -37.809 -21.300 1.00 0.00 H new ATOM 0 H1' G B 497 31.148 -34.887 -19.537 1.00 0.00 H new ATOM 0 H8 G B 497 29.517 -36.780 -16.617 1.00 0.00 H new ATOM 0 H1 G B 497 34.331 -32.704 -15.170 1.00 0.00 H new ATOM 0 H21 G B 497 34.477 -32.204 -18.536 1.00 0.00 H new ATOM 0 H22 G B 497 35.076 -31.856 -16.911 1.00 0.00 H new ATOM 1054 P U B 498 28.572 -40.136 -19.433 1.00 0.00 P ATOM 1055 OP1 U B 498 27.117 -40.152 -19.709 1.00 0.00 O ATOM 1056 OP2 U B 498 28.999 -40.250 -18.021 1.00 0.00 O ATOM 1057 O5' U B 498 29.244 -41.335 -20.252 1.00 0.00 O ATOM 1058 C5' U B 498 30.334 -42.060 -19.687 1.00 0.00 C ATOM 1059 C4' U B 498 29.888 -43.453 -19.305 1.00 0.00 C ATOM 1060 O4' U B 498 30.895 -44.344 -19.851 1.00 0.00 O ATOM 1061 C3' U B 498 30.039 -43.780 -17.822 1.00 0.00 C ATOM 1062 O3' U B 498 28.777 -43.593 -17.164 1.00 0.00 O ATOM 1063 C2' U B 498 30.480 -45.217 -17.774 1.00 0.00 C ATOM 1064 O2' U B 498 29.276 -45.918 -17.987 1.00 0.00 O ATOM 1065 C1' U B 498 31.471 -45.248 -18.935 1.00 0.00 C ATOM 1066 N1 U B 498 32.837 -44.827 -18.556 1.00 0.00 N ATOM 1067 C2 U B 498 33.744 -45.824 -18.371 1.00 0.00 C ATOM 1068 O2 U B 498 33.484 -47.010 -18.499 1.00 0.00 O ATOM 1069 N3 U B 498 35.017 -45.434 -18.018 1.00 0.00 N ATOM 1070 C4 U B 498 35.392 -44.125 -17.851 1.00 0.00 C ATOM 1071 O4 U B 498 36.557 -43.894 -17.534 1.00 0.00 O ATOM 1072 C5 U B 498 34.405 -43.125 -18.058 1.00 0.00 C ATOM 1073 C6 U B 498 33.178 -43.525 -18.400 1.00 0.00 C ATOM 0 H5' U B 498 30.713 -41.537 -18.809 1.00 0.00 H new ATOM 0 H5'' U B 498 31.154 -42.116 -20.403 1.00 0.00 H new ATOM 0 H4' U B 498 28.852 -43.542 -19.632 1.00 0.00 H new ATOM 0 H3' U B 498 30.759 -43.137 -17.316 1.00 0.00 H new ATOM 0 H2' U B 498 30.951 -45.631 -16.882 1.00 0.00 H new ATOM 0 HO2' U B 498 28.521 -45.369 -17.690 1.00 0.00 H new ATOM 0 HO3' U B 498 28.870 -43.804 -16.212 1.00 0.00 H new ATOM 0 H1' U B 498 31.614 -46.255 -19.326 1.00 0.00 H new ATOM 0 H3 U B 498 35.720 -46.159 -17.873 1.00 0.00 H new ATOM 0 H5 U B 498 34.639 -42.077 -17.943 1.00 0.00 H new ATOM 0 H6 U B 498 32.419 -42.773 -18.560 1.00 0.00 H new TER 1084 U B 498 HETATM 1085 ZN ZN A 57 36.449 -32.154 -8.434 1.00 0.00 ZN