USER MOD reduce.3.24.130724 H: found=0, std=0, add=512, rem=0, adj=16 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 37 LYS NZ :NH3+ -139:sc= 0.497 (180deg=0) USER MOD Set 1.2: B 498 U O3' : rot 150:sc= 0.789 USER MOD Set 2.1: A 28 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: B 494 A O2' : rot 158:sc= 0.697 USER MOD Single : A 1 ALA N :NH3+ 132:sc= 0.0174 (180deg=0) USER MOD Single : A 2 THR OG1 : rot -9:sc= 0.261 USER MOD Single : A 5 SER OG : rot 3:sc= 1.02 USER MOD Single : A 7 GLN : amide:sc=-0.000444 X(o=-0.00044,f=-0.42) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc=-0.000316 X(o=-0.00032,f=0) USER MOD Single : A 12 GLN : amide:sc= -0.0218 K(o=-0.022,f=-1.8) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= -0.105 X(o=-0.11,f=-0.33) USER MOD Single : A 25 GLN : amide:sc= -1.09 K(o=-1.1,f=-4!) 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 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 178:sc= -1.95! (180deg=-2.4!) USER MOD Single : A 52 GLN : amide:sc= -0.179 K(o=-0.18,f=-1.1) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot -21:sc= 0.695 USER MOD Single : B 493 A O2' : rot -21:sc= 0.434 USER MOD Single : B 495 C O2' : rot -65:sc= 0.888 USER MOD Single : B 496 A O2' : rot -29:sc= 0.397 USER MOD Single : B 497 G O2' : rot -19:sc= -0.0319 USER MOD Single : B 498 U O2' : rot -12:sc= 0.358 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 56.269 2.996 -14.847 1.00 0.00 N ATOM 2 CA ALA A 1 55.320 1.959 -14.481 1.00 0.00 C ATOM 3 C ALA A 1 54.651 1.417 -15.746 1.00 0.00 C ATOM 4 O ALA A 1 54.281 2.184 -16.634 1.00 0.00 O ATOM 5 CB ALA A 1 54.307 2.522 -13.482 1.00 0.00 C ATOM 0 H1 ALA A 1 56.125 3.828 -14.240 1.00 0.00 H new ATOM 0 H2 ALA A 1 57.238 2.640 -14.722 1.00 0.00 H new ATOM 0 H3 ALA A 1 56.124 3.264 -15.841 1.00 0.00 H new ATOM 0 HA ALA A 1 55.830 1.127 -13.994 1.00 0.00 H new ATOM 0 HB1 ALA A 1 53.595 1.743 -13.208 1.00 0.00 H new ATOM 0 HB2 ALA A 1 54.829 2.867 -12.590 1.00 0.00 H new ATOM 0 HB3 ALA A 1 53.774 3.357 -13.936 1.00 0.00 H new ATOM 11 N THR A 2 54.515 0.100 -15.788 1.00 0.00 N ATOM 12 CA THR A 2 53.896 -0.553 -16.929 1.00 0.00 C ATOM 13 C THR A 2 53.224 -1.857 -16.497 1.00 0.00 C ATOM 14 O THR A 2 53.808 -2.646 -15.756 1.00 0.00 O ATOM 15 CB THR A 2 54.972 -0.750 -17.999 1.00 0.00 C ATOM 16 OG1 THR A 2 55.289 0.573 -18.421 1.00 0.00 O ATOM 17 CG2 THR A 2 54.425 -1.422 -19.261 1.00 0.00 C ATOM 0 H THR A 2 54.823 -0.533 -15.050 1.00 0.00 H new ATOM 0 HA THR A 2 53.101 0.060 -17.354 1.00 0.00 H new ATOM 0 HB THR A 2 55.785 -1.350 -17.590 1.00 0.00 H new ATOM 0 HG1 THR A 2 54.644 1.202 -18.036 1.00 0.00 H new ATOM 0 HG21 THR A 2 55.228 -1.539 -19.988 1.00 0.00 H new ATOM 0 HG22 THR A 2 54.022 -2.402 -19.006 1.00 0.00 H new ATOM 0 HG23 THR A 2 53.635 -0.805 -19.689 1.00 0.00 H new ATOM 25 N VAL A 3 52.003 -2.044 -16.979 1.00 0.00 N ATOM 26 CA VAL A 3 51.244 -3.239 -16.652 1.00 0.00 C ATOM 27 C VAL A 3 49.951 -3.257 -17.470 1.00 0.00 C ATOM 28 O VAL A 3 49.212 -2.273 -17.491 1.00 0.00 O ATOM 29 CB VAL A 3 50.997 -3.305 -15.144 1.00 0.00 C ATOM 30 CG1 VAL A 3 50.320 -2.028 -14.641 1.00 0.00 C ATOM 31 CG2 VAL A 3 50.174 -4.542 -14.777 1.00 0.00 C ATOM 0 H VAL A 3 51.521 -1.388 -17.593 1.00 0.00 H new ATOM 0 HA VAL A 3 51.808 -4.134 -16.916 1.00 0.00 H new ATOM 0 HB VAL A 3 51.965 -3.387 -14.650 1.00 0.00 H new ATOM 0 HG11 VAL A 3 50.156 -2.102 -13.566 1.00 0.00 H new ATOM 0 HG12 VAL A 3 50.958 -1.170 -14.853 1.00 0.00 H new ATOM 0 HG13 VAL A 3 49.362 -1.901 -15.146 1.00 0.00 H new ATOM 0 HG21 VAL A 3 50.013 -4.565 -13.699 1.00 0.00 H new ATOM 0 HG22 VAL A 3 49.212 -4.503 -15.287 1.00 0.00 H new ATOM 0 HG23 VAL A 3 50.711 -5.440 -15.083 1.00 0.00 H new ATOM 41 N VAL A 4 49.718 -4.385 -18.124 1.00 0.00 N ATOM 42 CA VAL A 4 48.528 -4.543 -18.942 1.00 0.00 C ATOM 43 C VAL A 4 47.973 -5.958 -18.759 1.00 0.00 C ATOM 44 O VAL A 4 48.486 -6.910 -19.346 1.00 0.00 O ATOM 45 CB VAL A 4 48.847 -4.211 -20.401 1.00 0.00 C ATOM 46 CG1 VAL A 4 49.209 -2.733 -20.560 1.00 0.00 C ATOM 47 CG2 VAL A 4 49.964 -5.109 -20.936 1.00 0.00 C ATOM 0 H VAL A 4 50.333 -5.198 -18.104 1.00 0.00 H new ATOM 0 HA VAL A 4 47.753 -3.845 -18.626 1.00 0.00 H new ATOM 0 HB VAL A 4 47.951 -4.402 -20.992 1.00 0.00 H new ATOM 0 HG11 VAL A 4 49.431 -2.523 -21.606 1.00 0.00 H new ATOM 0 HG12 VAL A 4 48.371 -2.116 -20.237 1.00 0.00 H new ATOM 0 HG13 VAL A 4 50.083 -2.505 -19.951 1.00 0.00 H new ATOM 0 HG21 VAL A 4 50.171 -4.852 -21.975 1.00 0.00 H new ATOM 0 HG22 VAL A 4 50.865 -4.964 -20.340 1.00 0.00 H new ATOM 0 HG23 VAL A 4 49.653 -6.152 -20.875 1.00 0.00 H new ATOM 57 N SER A 5 46.933 -6.050 -17.943 1.00 0.00 N ATOM 58 CA SER A 5 46.303 -7.332 -17.676 1.00 0.00 C ATOM 59 C SER A 5 44.783 -7.203 -17.798 1.00 0.00 C ATOM 60 O SER A 5 44.139 -6.584 -16.954 1.00 0.00 O ATOM 61 CB SER A 5 46.682 -7.852 -16.288 1.00 0.00 C ATOM 62 OG SER A 5 45.992 -7.159 -15.251 1.00 0.00 O ATOM 0 H SER A 5 46.511 -5.258 -17.458 1.00 0.00 H new ATOM 0 HA SER A 5 46.661 -8.050 -18.414 1.00 0.00 H new ATOM 0 HB2 SER A 5 46.456 -8.916 -16.225 1.00 0.00 H new ATOM 0 HB3 SER A 5 47.757 -7.746 -16.142 1.00 0.00 H new ATOM 0 HG SER A 5 45.377 -6.507 -15.647 1.00 0.00 H new ATOM 68 N GLY A 6 44.255 -7.800 -18.856 1.00 0.00 N ATOM 69 CA GLY A 6 42.823 -7.761 -19.100 1.00 0.00 C ATOM 70 C GLY A 6 42.479 -8.397 -20.449 1.00 0.00 C ATOM 71 O GLY A 6 42.587 -7.751 -21.490 1.00 0.00 O ATOM 0 H GLY A 6 44.793 -8.313 -19.554 1.00 0.00 H new ATOM 0 HA2 GLY A 6 42.300 -8.288 -18.302 1.00 0.00 H new ATOM 0 HA3 GLY A 6 42.475 -6.728 -19.082 1.00 0.00 H new ATOM 75 N GLN A 7 42.070 -9.656 -20.386 1.00 0.00 N ATOM 76 CA GLN A 7 41.708 -10.386 -21.589 1.00 0.00 C ATOM 77 C GLN A 7 40.684 -11.474 -21.261 1.00 0.00 C ATOM 78 O GLN A 7 40.635 -11.967 -20.136 1.00 0.00 O ATOM 79 CB GLN A 7 42.947 -10.983 -22.260 1.00 0.00 C ATOM 80 CG GLN A 7 43.280 -10.241 -23.556 1.00 0.00 C ATOM 81 CD GLN A 7 43.996 -11.161 -24.547 1.00 0.00 C ATOM 82 OE1 GLN A 7 44.617 -12.146 -24.181 1.00 0.00 O ATOM 83 NE2 GLN A 7 43.876 -10.786 -25.817 1.00 0.00 N ATOM 0 H GLN A 7 41.981 -10.189 -19.521 1.00 0.00 H new ATOM 0 HA GLN A 7 41.254 -9.688 -22.293 1.00 0.00 H new ATOM 0 HB2 GLN A 7 43.796 -10.930 -21.578 1.00 0.00 H new ATOM 0 HB3 GLN A 7 42.776 -12.038 -22.474 1.00 0.00 H new ATOM 0 HG2 GLN A 7 42.364 -9.859 -24.006 1.00 0.00 H new ATOM 0 HG3 GLN A 7 43.910 -9.379 -23.334 1.00 0.00 H new ATOM 0 HE21 GLN A 7 43.341 -9.950 -26.054 1.00 0.00 H new ATOM 0 HE22 GLN A 7 44.319 -11.334 -26.555 1.00 0.00 H new ATOM 92 N LYS A 8 39.891 -11.816 -22.266 1.00 0.00 N ATOM 93 CA LYS A 8 38.870 -12.837 -22.099 1.00 0.00 C ATOM 94 C LYS A 8 38.844 -13.733 -23.339 1.00 0.00 C ATOM 95 O LYS A 8 39.029 -13.257 -24.458 1.00 0.00 O ATOM 96 CB LYS A 8 37.519 -12.196 -21.775 1.00 0.00 C ATOM 97 CG LYS A 8 37.166 -12.381 -20.297 1.00 0.00 C ATOM 98 CD LYS A 8 36.623 -11.083 -19.697 1.00 0.00 C ATOM 99 CE LYS A 8 37.702 -10.359 -18.890 1.00 0.00 C ATOM 100 NZ LYS A 8 37.405 -10.435 -17.442 1.00 0.00 N ATOM 0 H LYS A 8 39.935 -11.405 -23.198 1.00 0.00 H new ATOM 0 HA LYS A 8 39.106 -13.476 -21.248 1.00 0.00 H new ATOM 0 HB2 LYS A 8 37.549 -11.133 -22.015 1.00 0.00 H new ATOM 0 HB3 LYS A 8 36.742 -12.641 -22.397 1.00 0.00 H new ATOM 0 HG2 LYS A 8 36.424 -13.172 -20.193 1.00 0.00 H new ATOM 0 HG3 LYS A 8 38.051 -12.699 -19.745 1.00 0.00 H new ATOM 0 HD2 LYS A 8 36.262 -10.433 -20.494 1.00 0.00 H new ATOM 0 HD3 LYS A 8 35.770 -11.304 -19.055 1.00 0.00 H new ATOM 0 HE2 LYS A 8 38.676 -10.805 -19.091 1.00 0.00 H new ATOM 0 HE3 LYS A 8 37.759 -9.316 -19.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 38.147 -9.939 -16.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 36.485 -9.988 -17.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 37.374 -11.431 -17.146 1.00 0.00 H new ATOM 114 N GLN A 9 38.611 -15.016 -23.099 1.00 0.00 N ATOM 115 CA GLN A 9 38.558 -15.982 -24.183 1.00 0.00 C ATOM 116 C GLN A 9 37.221 -16.726 -24.164 1.00 0.00 C ATOM 117 O GLN A 9 37.159 -17.889 -23.768 1.00 0.00 O ATOM 118 CB GLN A 9 39.732 -16.961 -24.102 1.00 0.00 C ATOM 119 CG GLN A 9 40.933 -16.441 -24.894 1.00 0.00 C ATOM 120 CD GLN A 9 42.166 -17.316 -24.655 1.00 0.00 C ATOM 121 OE1 GLN A 9 42.619 -18.044 -25.522 1.00 0.00 O ATOM 122 NE2 GLN A 9 42.681 -17.202 -23.435 1.00 0.00 N ATOM 0 H GLN A 9 38.457 -15.408 -22.170 1.00 0.00 H new ATOM 0 HA GLN A 9 38.640 -15.445 -25.128 1.00 0.00 H new ATOM 0 HB2 GLN A 9 40.015 -17.110 -23.060 1.00 0.00 H new ATOM 0 HB3 GLN A 9 39.428 -17.933 -24.491 1.00 0.00 H new ATOM 0 HG2 GLN A 9 40.693 -16.426 -25.957 1.00 0.00 H new ATOM 0 HG3 GLN A 9 41.149 -15.413 -24.601 1.00 0.00 H new ATOM 0 HE21 GLN A 9 42.251 -16.573 -22.757 1.00 0.00 H new ATOM 0 HE22 GLN A 9 43.506 -17.744 -23.177 1.00 0.00 H new ATOM 131 N ASP A 10 36.184 -16.025 -24.598 1.00 0.00 N ATOM 132 CA ASP A 10 34.852 -16.604 -24.636 1.00 0.00 C ATOM 133 C ASP A 10 34.130 -16.129 -25.899 1.00 0.00 C ATOM 134 O ASP A 10 34.155 -14.944 -26.224 1.00 0.00 O ATOM 135 CB ASP A 10 34.025 -16.167 -23.426 1.00 0.00 C ATOM 136 CG ASP A 10 34.526 -16.689 -22.078 1.00 0.00 C ATOM 137 OD1 ASP A 10 35.755 -16.615 -21.862 1.00 0.00 O ATOM 138 OD2 ASP A 10 33.668 -17.152 -21.295 1.00 0.00 O ATOM 0 H ASP A 10 36.239 -15.061 -24.926 1.00 0.00 H new ATOM 0 HA ASP A 10 34.956 -17.689 -24.627 1.00 0.00 H new ATOM 0 HB2 ASP A 10 34.006 -15.078 -23.392 1.00 0.00 H new ATOM 0 HB3 ASP A 10 32.997 -16.500 -23.568 1.00 0.00 H new ATOM 143 N ARG A 11 33.503 -17.080 -26.576 1.00 0.00 N ATOM 144 CA ARG A 11 32.776 -16.773 -27.796 1.00 0.00 C ATOM 145 C ARG A 11 31.809 -17.909 -28.138 1.00 0.00 C ATOM 146 O ARG A 11 32.122 -19.080 -27.925 1.00 0.00 O ATOM 147 CB ARG A 11 33.733 -16.558 -28.970 1.00 0.00 C ATOM 148 CG ARG A 11 34.678 -17.749 -29.132 1.00 0.00 C ATOM 149 CD ARG A 11 35.311 -17.762 -30.525 1.00 0.00 C ATOM 150 NE ARG A 11 35.888 -19.096 -30.807 1.00 0.00 N ATOM 151 CZ ARG A 11 36.126 -19.566 -32.039 1.00 0.00 C ATOM 152 NH1 ARG A 11 35.836 -18.816 -33.110 1.00 0.00 N ATOM 153 NH2 ARG A 11 36.652 -20.788 -32.199 1.00 0.00 N ATOM 0 H ARG A 11 33.483 -18.063 -26.303 1.00 0.00 H new ATOM 0 HA ARG A 11 32.217 -15.853 -27.625 1.00 0.00 H new ATOM 0 HB2 ARG A 11 33.162 -16.415 -29.887 1.00 0.00 H new ATOM 0 HB3 ARG A 11 34.312 -15.649 -28.810 1.00 0.00 H new ATOM 0 HG2 ARG A 11 35.460 -17.703 -28.374 1.00 0.00 H new ATOM 0 HG3 ARG A 11 34.130 -18.677 -28.969 1.00 0.00 H new ATOM 0 HD2 ARG A 11 34.561 -17.515 -31.276 1.00 0.00 H new ATOM 0 HD3 ARG A 11 36.088 -17.000 -30.587 1.00 0.00 H new ATOM 0 HE ARG A 11 36.119 -19.695 -30.014 1.00 0.00 H new ATOM 0 HH11 ARG A 11 35.434 -17.887 -32.988 1.00 0.00 H new ATOM 0 HH12 ARG A 11 36.017 -19.174 -34.048 1.00 0.00 H new ATOM 0 HH21 ARG A 11 36.871 -21.360 -31.383 1.00 0.00 H new ATOM 0 HH22 ARG A 11 36.833 -21.146 -33.137 1.00 0.00 H new ATOM 167 N GLN A 12 30.654 -17.524 -28.661 1.00 0.00 N ATOM 168 CA GLN A 12 29.641 -18.495 -29.034 1.00 0.00 C ATOM 169 C GLN A 12 28.390 -17.785 -29.558 1.00 0.00 C ATOM 170 O GLN A 12 28.009 -16.734 -29.043 1.00 0.00 O ATOM 171 CB GLN A 12 29.298 -19.410 -27.856 1.00 0.00 C ATOM 172 CG GLN A 12 29.613 -20.871 -28.186 1.00 0.00 C ATOM 173 CD GLN A 12 28.344 -21.632 -28.571 1.00 0.00 C ATOM 174 OE1 GLN A 12 27.368 -21.069 -29.036 1.00 0.00 O ATOM 175 NE2 GLN A 12 28.412 -22.943 -28.352 1.00 0.00 N ATOM 0 H GLN A 12 30.398 -16.552 -28.835 1.00 0.00 H new ATOM 0 HA GLN A 12 30.042 -19.119 -29.833 1.00 0.00 H new ATOM 0 HB2 GLN A 12 29.863 -19.102 -26.976 1.00 0.00 H new ATOM 0 HB3 GLN A 12 28.241 -19.309 -27.608 1.00 0.00 H new ATOM 0 HG2 GLN A 12 30.331 -20.916 -29.005 1.00 0.00 H new ATOM 0 HG3 GLN A 12 30.081 -21.349 -27.325 1.00 0.00 H new ATOM 0 HE21 GLN A 12 29.260 -23.351 -27.960 1.00 0.00 H new ATOM 0 HE22 GLN A 12 27.616 -23.540 -28.576 1.00 0.00 H new ATOM 184 N GLY A 13 27.788 -18.385 -30.573 1.00 0.00 N ATOM 185 CA GLY A 13 26.590 -17.822 -31.172 1.00 0.00 C ATOM 186 C GLY A 13 25.392 -17.958 -30.230 1.00 0.00 C ATOM 187 O GLY A 13 24.829 -16.957 -29.788 1.00 0.00 O ATOM 0 H GLY A 13 28.107 -19.256 -30.997 1.00 0.00 H new ATOM 0 HA2 GLY A 13 26.756 -16.770 -31.406 1.00 0.00 H new ATOM 0 HA3 GLY A 13 26.377 -18.329 -32.113 1.00 0.00 H new ATOM 191 N GLY A 14 25.036 -19.203 -29.952 1.00 0.00 N ATOM 192 CA GLY A 14 23.915 -19.483 -29.072 1.00 0.00 C ATOM 193 C GLY A 14 23.328 -20.867 -29.353 1.00 0.00 C ATOM 194 O GLY A 14 22.390 -20.999 -30.139 1.00 0.00 O ATOM 0 H GLY A 14 25.505 -20.030 -30.321 1.00 0.00 H new ATOM 0 HA2 GLY A 14 24.241 -19.427 -28.033 1.00 0.00 H new ATOM 0 HA3 GLY A 14 23.145 -18.724 -29.206 1.00 0.00 H new ATOM 198 N GLU A 15 23.904 -21.864 -28.698 1.00 0.00 N ATOM 199 CA GLU A 15 23.449 -23.234 -28.867 1.00 0.00 C ATOM 200 C GLU A 15 23.952 -24.107 -27.716 1.00 0.00 C ATOM 201 O GLU A 15 25.136 -24.433 -27.652 1.00 0.00 O ATOM 202 CB GLU A 15 23.897 -23.795 -30.219 1.00 0.00 C ATOM 203 CG GLU A 15 22.776 -23.689 -31.255 1.00 0.00 C ATOM 204 CD GLU A 15 22.807 -24.876 -32.219 1.00 0.00 C ATOM 205 OE1 GLU A 15 23.748 -24.916 -33.042 1.00 0.00 O ATOM 206 OE2 GLU A 15 21.889 -25.718 -32.113 1.00 0.00 O ATOM 0 H GLU A 15 24.682 -21.751 -28.049 1.00 0.00 H new ATOM 0 HA GLU A 15 22.359 -23.240 -28.850 1.00 0.00 H new ATOM 0 HB2 GLU A 15 24.774 -23.251 -30.570 1.00 0.00 H new ATOM 0 HB3 GLU A 15 24.193 -24.838 -30.104 1.00 0.00 H new ATOM 0 HG2 GLU A 15 21.811 -23.652 -30.749 1.00 0.00 H new ATOM 0 HG3 GLU A 15 22.879 -22.759 -31.814 1.00 0.00 H new ATOM 213 N ARG A 16 23.027 -24.461 -26.837 1.00 0.00 N ATOM 214 CA ARG A 16 23.362 -25.289 -25.691 1.00 0.00 C ATOM 215 C ARG A 16 24.365 -24.568 -24.789 1.00 0.00 C ATOM 216 O ARG A 16 25.377 -24.057 -25.265 1.00 0.00 O ATOM 217 CB ARG A 16 23.956 -26.628 -26.135 1.00 0.00 C ATOM 218 CG ARG A 16 22.863 -27.575 -26.635 1.00 0.00 C ATOM 219 CD ARG A 16 22.516 -28.621 -25.573 1.00 0.00 C ATOM 220 NE ARG A 16 21.423 -28.123 -24.710 1.00 0.00 N ATOM 221 CZ ARG A 16 21.151 -28.604 -23.489 1.00 0.00 C ATOM 222 NH1 ARG A 16 21.892 -29.599 -22.981 1.00 0.00 N ATOM 223 NH2 ARG A 16 20.140 -28.092 -22.776 1.00 0.00 N ATOM 0 H ARG A 16 22.045 -24.190 -26.895 1.00 0.00 H new ATOM 0 HA ARG A 16 22.442 -25.477 -25.138 1.00 0.00 H new ATOM 0 HB2 ARG A 16 24.687 -26.461 -26.926 1.00 0.00 H new ATOM 0 HB3 ARG A 16 24.487 -27.088 -25.302 1.00 0.00 H new ATOM 0 HG2 ARG A 16 21.971 -27.003 -26.893 1.00 0.00 H new ATOM 0 HG3 ARG A 16 23.197 -28.073 -27.546 1.00 0.00 H new ATOM 0 HD2 ARG A 16 22.216 -29.553 -26.053 1.00 0.00 H new ATOM 0 HD3 ARG A 16 23.395 -28.843 -24.968 1.00 0.00 H new ATOM 0 HE ARG A 16 20.840 -27.366 -25.066 1.00 0.00 H new ATOM 0 HH11 ARG A 16 22.662 -29.990 -23.524 1.00 0.00 H new ATOM 0 HH12 ARG A 16 21.686 -29.965 -22.052 1.00 0.00 H new ATOM 0 HH21 ARG A 16 19.576 -27.335 -23.162 1.00 0.00 H new ATOM 0 HH22 ARG A 16 19.934 -28.459 -21.847 1.00 0.00 H new ATOM 237 N ARG A 17 24.049 -24.551 -23.503 1.00 0.00 N ATOM 238 CA ARG A 17 24.910 -23.900 -22.529 1.00 0.00 C ATOM 239 C ARG A 17 25.052 -24.772 -21.280 1.00 0.00 C ATOM 240 O ARG A 17 24.077 -25.363 -20.816 1.00 0.00 O ATOM 241 CB ARG A 17 24.353 -22.533 -22.127 1.00 0.00 C ATOM 242 CG ARG A 17 25.344 -21.417 -22.464 1.00 0.00 C ATOM 243 CD ARG A 17 25.093 -20.182 -21.597 1.00 0.00 C ATOM 244 NE ARG A 17 26.287 -19.307 -21.606 1.00 0.00 N ATOM 245 CZ ARG A 17 26.665 -18.562 -22.654 1.00 0.00 C ATOM 246 NH1 ARG A 17 25.947 -18.582 -23.785 1.00 0.00 N ATOM 247 NH2 ARG A 17 27.764 -17.798 -22.571 1.00 0.00 N ATOM 0 H ARG A 17 23.209 -24.977 -23.112 1.00 0.00 H new ATOM 0 HA ARG A 17 25.887 -23.759 -22.992 1.00 0.00 H new ATOM 0 HB2 ARG A 17 23.410 -22.355 -22.643 1.00 0.00 H new ATOM 0 HB3 ARG A 17 24.139 -22.524 -21.058 1.00 0.00 H new ATOM 0 HG2 ARG A 17 26.363 -21.772 -22.311 1.00 0.00 H new ATOM 0 HG3 ARG A 17 25.254 -21.151 -23.517 1.00 0.00 H new ATOM 0 HD2 ARG A 17 24.228 -19.635 -21.971 1.00 0.00 H new ATOM 0 HD3 ARG A 17 24.862 -20.485 -20.576 1.00 0.00 H new ATOM 0 HE ARG A 17 26.858 -19.269 -20.762 1.00 0.00 H new ATOM 0 HH11 ARG A 17 25.112 -19.164 -23.849 1.00 0.00 H new ATOM 0 HH12 ARG A 17 26.235 -18.015 -24.582 1.00 0.00 H new ATOM 0 HH21 ARG A 17 28.312 -17.784 -21.711 1.00 0.00 H new ATOM 0 HH22 ARG A 17 28.052 -17.231 -23.368 1.00 0.00 H new ATOM 261 N ARG A 18 26.274 -24.826 -20.770 1.00 0.00 N ATOM 262 CA ARG A 18 26.556 -25.615 -19.584 1.00 0.00 C ATOM 263 C ARG A 18 27.806 -25.085 -18.878 1.00 0.00 C ATOM 264 O ARG A 18 28.721 -25.848 -18.572 1.00 0.00 O ATOM 265 CB ARG A 18 26.767 -27.088 -19.941 1.00 0.00 C ATOM 266 CG ARG A 18 27.756 -27.237 -21.098 1.00 0.00 C ATOM 267 CD ARG A 18 27.802 -28.682 -21.598 1.00 0.00 C ATOM 268 NE ARG A 18 28.491 -28.744 -22.906 1.00 0.00 N ATOM 269 CZ ARG A 18 27.888 -28.536 -24.084 1.00 0.00 C ATOM 270 NH1 ARG A 18 26.579 -28.254 -24.125 1.00 0.00 N ATOM 271 NH2 ARG A 18 28.593 -28.612 -25.221 1.00 0.00 N ATOM 0 H ARG A 18 27.080 -24.336 -21.157 1.00 0.00 H new ATOM 0 HA ARG A 18 25.697 -25.533 -18.919 1.00 0.00 H new ATOM 0 HB2 ARG A 18 27.138 -27.627 -19.069 1.00 0.00 H new ATOM 0 HB3 ARG A 18 25.813 -27.540 -20.213 1.00 0.00 H new ATOM 0 HG2 ARG A 18 27.468 -26.575 -21.915 1.00 0.00 H new ATOM 0 HG3 ARG A 18 28.750 -26.929 -20.773 1.00 0.00 H new ATOM 0 HD2 ARG A 18 28.322 -29.309 -20.874 1.00 0.00 H new ATOM 0 HD3 ARG A 18 26.790 -29.075 -21.692 1.00 0.00 H new ATOM 0 HE ARG A 18 29.488 -28.959 -22.911 1.00 0.00 H new ATOM 0 HH11 ARG A 18 26.042 -28.198 -23.260 1.00 0.00 H new ATOM 0 HH12 ARG A 18 26.119 -28.096 -25.022 1.00 0.00 H new ATOM 0 HH21 ARG A 18 29.589 -28.828 -25.190 1.00 0.00 H new ATOM 0 HH22 ARG A 18 28.133 -28.454 -26.118 1.00 0.00 H new ATOM 285 N SER A 19 27.803 -23.782 -18.639 1.00 0.00 N ATOM 286 CA SER A 19 28.925 -23.141 -17.975 1.00 0.00 C ATOM 287 C SER A 19 30.240 -23.590 -18.617 1.00 0.00 C ATOM 288 O SER A 19 31.233 -23.803 -17.924 1.00 0.00 O ATOM 289 CB SER A 19 28.932 -23.456 -16.477 1.00 0.00 C ATOM 290 OG SER A 19 28.705 -22.292 -15.686 1.00 0.00 O ATOM 0 H SER A 19 27.042 -23.153 -18.893 1.00 0.00 H new ATOM 0 HA SER A 19 28.820 -22.062 -18.092 1.00 0.00 H new ATOM 0 HB2 SER A 19 28.164 -24.198 -16.259 1.00 0.00 H new ATOM 0 HB3 SER A 19 29.890 -23.899 -16.204 1.00 0.00 H new ATOM 0 HG SER A 19 28.715 -22.535 -14.737 1.00 0.00 H new ATOM 296 N GLN A 20 30.203 -23.719 -19.936 1.00 0.00 N ATOM 297 CA GLN A 20 31.379 -24.138 -20.679 1.00 0.00 C ATOM 298 C GLN A 20 32.034 -25.343 -20.001 1.00 0.00 C ATOM 299 O GLN A 20 33.256 -25.404 -19.880 1.00 0.00 O ATOM 300 CB GLN A 20 32.373 -22.986 -20.827 1.00 0.00 C ATOM 301 CG GLN A 20 33.488 -23.346 -21.811 1.00 0.00 C ATOM 302 CD GLN A 20 33.538 -22.350 -22.972 1.00 0.00 C ATOM 303 OE1 GLN A 20 33.358 -21.155 -22.806 1.00 0.00 O ATOM 304 NE2 GLN A 20 33.793 -22.906 -24.152 1.00 0.00 N ATOM 0 H GLN A 20 29.378 -23.541 -20.508 1.00 0.00 H new ATOM 0 HA GLN A 20 31.065 -24.435 -21.680 1.00 0.00 H new ATOM 0 HB2 GLN A 20 31.852 -22.094 -21.173 1.00 0.00 H new ATOM 0 HB3 GLN A 20 32.804 -22.746 -19.855 1.00 0.00 H new ATOM 0 HG2 GLN A 20 34.447 -23.354 -21.293 1.00 0.00 H new ATOM 0 HG3 GLN A 20 33.326 -24.352 -22.197 1.00 0.00 H new ATOM 0 HE21 GLN A 20 33.934 -23.914 -24.221 1.00 0.00 H new ATOM 0 HE22 GLN A 20 33.848 -22.325 -24.988 1.00 0.00 H new ATOM 313 N LEU A 21 31.191 -26.274 -19.577 1.00 0.00 N ATOM 314 CA LEU A 21 31.673 -27.474 -18.915 1.00 0.00 C ATOM 315 C LEU A 21 32.872 -28.030 -19.685 1.00 0.00 C ATOM 316 O LEU A 21 32.704 -28.754 -20.664 1.00 0.00 O ATOM 317 CB LEU A 21 30.534 -28.482 -18.739 1.00 0.00 C ATOM 318 CG LEU A 21 30.403 -29.109 -17.349 1.00 0.00 C ATOM 319 CD1 LEU A 21 29.404 -30.267 -17.362 1.00 0.00 C ATOM 320 CD2 LEU A 21 31.770 -29.536 -16.809 1.00 0.00 C ATOM 0 H LEU A 21 30.178 -26.221 -19.679 1.00 0.00 H new ATOM 0 HA LEU A 21 32.021 -27.241 -17.909 1.00 0.00 H new ATOM 0 HB2 LEU A 21 29.595 -27.985 -18.982 1.00 0.00 H new ATOM 0 HB3 LEU A 21 30.668 -29.283 -19.466 1.00 0.00 H new ATOM 0 HG LEU A 21 30.010 -28.353 -16.669 1.00 0.00 H new ATOM 0 HD11 LEU A 21 29.330 -30.695 -16.362 1.00 0.00 H new ATOM 0 HD12 LEU A 21 28.426 -29.900 -17.673 1.00 0.00 H new ATOM 0 HD13 LEU A 21 29.743 -31.032 -18.060 1.00 0.00 H new ATOM 0 HD21 LEU A 21 31.649 -29.978 -15.820 1.00 0.00 H new ATOM 0 HD22 LEU A 21 32.214 -30.269 -17.482 1.00 0.00 H new ATOM 0 HD23 LEU A 21 32.422 -28.665 -16.739 1.00 0.00 H new ATOM 332 N ASP A 22 34.056 -27.670 -19.212 1.00 0.00 N ATOM 333 CA ASP A 22 35.283 -28.123 -19.845 1.00 0.00 C ATOM 334 C ASP A 22 35.305 -29.653 -19.869 1.00 0.00 C ATOM 335 O ASP A 22 35.022 -30.297 -18.860 1.00 0.00 O ATOM 336 CB ASP A 22 36.512 -27.646 -19.066 1.00 0.00 C ATOM 337 CG ASP A 22 37.423 -26.681 -19.826 1.00 0.00 C ATOM 338 OD1 ASP A 22 38.272 -26.054 -19.156 1.00 0.00 O ATOM 339 OD2 ASP A 22 37.251 -26.590 -21.062 1.00 0.00 O ATOM 0 H ASP A 22 34.192 -27.070 -18.398 1.00 0.00 H new ATOM 0 HA ASP A 22 35.313 -27.714 -20.855 1.00 0.00 H new ATOM 0 HB2 ASP A 22 36.177 -27.160 -18.150 1.00 0.00 H new ATOM 0 HB3 ASP A 22 37.097 -28.517 -18.770 1.00 0.00 H new ATOM 344 N ARG A 23 35.642 -30.189 -21.032 1.00 0.00 N ATOM 345 CA ARG A 23 35.703 -31.632 -21.202 1.00 0.00 C ATOM 346 C ARG A 23 36.775 -32.228 -20.287 1.00 0.00 C ATOM 347 O ARG A 23 36.845 -33.444 -20.118 1.00 0.00 O ATOM 348 CB ARG A 23 36.017 -32.002 -22.653 1.00 0.00 C ATOM 349 CG ARG A 23 35.533 -33.418 -22.973 1.00 0.00 C ATOM 350 CD ARG A 23 34.058 -33.590 -22.606 1.00 0.00 C ATOM 351 NE ARG A 23 33.353 -34.326 -23.679 1.00 0.00 N ATOM 352 CZ ARG A 23 32.171 -34.937 -23.518 1.00 0.00 C ATOM 353 NH1 ARG A 23 31.555 -34.904 -22.328 1.00 0.00 N ATOM 354 NH2 ARG A 23 31.604 -35.582 -24.548 1.00 0.00 N ATOM 0 H ARG A 23 35.876 -29.651 -21.866 1.00 0.00 H new ATOM 0 HA ARG A 23 34.727 -32.040 -20.938 1.00 0.00 H new ATOM 0 HB2 ARG A 23 35.539 -31.290 -23.326 1.00 0.00 H new ATOM 0 HB3 ARG A 23 37.091 -31.933 -22.826 1.00 0.00 H new ATOM 0 HG2 ARG A 23 35.673 -33.623 -24.034 1.00 0.00 H new ATOM 0 HG3 ARG A 23 36.134 -34.144 -22.426 1.00 0.00 H new ATOM 0 HD2 ARG A 23 33.970 -34.131 -21.664 1.00 0.00 H new ATOM 0 HD3 ARG A 23 33.595 -32.614 -22.458 1.00 0.00 H new ATOM 0 HE ARG A 23 33.794 -34.371 -24.598 1.00 0.00 H new ATOM 0 HH11 ARG A 23 31.986 -34.414 -21.544 1.00 0.00 H new ATOM 0 HH12 ARG A 23 30.655 -35.369 -22.206 1.00 0.00 H new ATOM 0 HH21 ARG A 23 32.072 -35.608 -25.454 1.00 0.00 H new ATOM 0 HH22 ARG A 23 30.704 -36.047 -24.426 1.00 0.00 H new ATOM 368 N ASP A 24 37.582 -31.344 -19.720 1.00 0.00 N ATOM 369 CA ASP A 24 38.647 -31.768 -18.825 1.00 0.00 C ATOM 370 C ASP A 24 38.497 -31.048 -17.484 1.00 0.00 C ATOM 371 O ASP A 24 39.491 -30.746 -16.824 1.00 0.00 O ATOM 372 CB ASP A 24 40.021 -31.418 -19.401 1.00 0.00 C ATOM 373 CG ASP A 24 40.242 -29.931 -19.685 1.00 0.00 C ATOM 374 OD1 ASP A 24 39.581 -29.117 -19.005 1.00 0.00 O ATOM 375 OD2 ASP A 24 41.068 -29.641 -20.579 1.00 0.00 O ATOM 0 H ASP A 24 37.521 -30.336 -19.862 1.00 0.00 H new ATOM 0 HA ASP A 24 38.574 -32.848 -18.700 1.00 0.00 H new ATOM 0 HB2 ASP A 24 40.788 -31.758 -18.705 1.00 0.00 H new ATOM 0 HB3 ASP A 24 40.163 -31.975 -20.327 1.00 0.00 H new ATOM 380 N GLN A 25 37.249 -30.795 -17.119 1.00 0.00 N ATOM 381 CA GLN A 25 36.958 -30.116 -15.869 1.00 0.00 C ATOM 382 C GLN A 25 36.179 -31.042 -14.931 1.00 0.00 C ATOM 383 O GLN A 25 35.972 -32.214 -15.242 1.00 0.00 O ATOM 384 CB GLN A 25 36.189 -28.816 -16.116 1.00 0.00 C ATOM 385 CG GLN A 25 37.106 -27.600 -15.961 1.00 0.00 C ATOM 386 CD GLN A 25 36.295 -26.337 -15.665 1.00 0.00 C ATOM 387 OE1 GLN A 25 35.803 -25.662 -16.553 1.00 0.00 O ATOM 388 NE2 GLN A 25 36.185 -26.058 -14.369 1.00 0.00 N ATOM 0 H GLN A 25 36.427 -31.048 -17.668 1.00 0.00 H new ATOM 0 HA GLN A 25 37.903 -29.856 -15.392 1.00 0.00 H new ATOM 0 HB2 GLN A 25 35.760 -28.827 -17.118 1.00 0.00 H new ATOM 0 HB3 GLN A 25 35.358 -28.742 -15.414 1.00 0.00 H new ATOM 0 HG2 GLN A 25 37.818 -27.777 -15.155 1.00 0.00 H new ATOM 0 HG3 GLN A 25 37.686 -27.459 -16.873 1.00 0.00 H new ATOM 0 HE21 GLN A 25 36.623 -26.667 -13.677 1.00 0.00 H new ATOM 0 HE22 GLN A 25 35.663 -25.235 -14.067 1.00 0.00 H new ATOM 397 N CYS A 26 35.770 -30.481 -13.803 1.00 0.00 N ATOM 398 CA CYS A 26 35.019 -31.242 -12.818 1.00 0.00 C ATOM 399 C CYS A 26 33.614 -30.645 -12.719 1.00 0.00 C ATOM 400 O CYS A 26 33.438 -29.437 -12.859 1.00 0.00 O ATOM 401 CB CYS A 26 35.726 -31.265 -11.462 1.00 0.00 C ATOM 402 SG CYS A 26 34.724 -32.199 -10.249 1.00 0.00 S ATOM 0 H CYS A 26 35.944 -29.509 -13.549 1.00 0.00 H new ATOM 0 HA CYS A 26 34.949 -32.283 -13.135 1.00 0.00 H new ATOM 0 HB2 CYS A 26 36.710 -31.724 -11.563 1.00 0.00 H new ATOM 0 HB3 CYS A 26 35.884 -30.246 -11.108 1.00 0.00 H new ATOM 407 N ALA A 27 32.649 -31.521 -12.479 1.00 0.00 N ATOM 408 CA ALA A 27 31.265 -31.096 -12.360 1.00 0.00 C ATOM 409 C ALA A 27 30.790 -31.320 -10.922 1.00 0.00 C ATOM 410 O ALA A 27 29.666 -31.766 -10.700 1.00 0.00 O ATOM 411 CB ALA A 27 30.410 -31.849 -13.381 1.00 0.00 C ATOM 0 H ALA A 27 32.799 -32.523 -12.364 1.00 0.00 H new ATOM 0 HA ALA A 27 31.169 -30.032 -12.577 1.00 0.00 H new ATOM 0 HB1 ALA A 27 29.372 -31.530 -13.292 1.00 0.00 H new ATOM 0 HB2 ALA A 27 30.771 -31.634 -14.387 1.00 0.00 H new ATOM 0 HB3 ALA A 27 30.478 -32.920 -13.193 1.00 0.00 H new ATOM 417 N TYR A 28 31.669 -30.999 -9.985 1.00 0.00 N ATOM 418 CA TYR A 28 31.353 -31.159 -8.576 1.00 0.00 C ATOM 419 C TYR A 28 31.946 -30.017 -7.749 1.00 0.00 C ATOM 420 O TYR A 28 31.223 -29.327 -7.029 1.00 0.00 O ATOM 421 CB TYR A 28 32.003 -32.476 -8.145 1.00 0.00 C ATOM 422 CG TYR A 28 31.219 -33.236 -7.076 1.00 0.00 C ATOM 423 CD1 TYR A 28 30.199 -34.091 -7.445 1.00 0.00 C ATOM 424 CD2 TYR A 28 31.529 -33.068 -5.741 1.00 0.00 C ATOM 425 CE1 TYR A 28 29.459 -34.807 -6.437 1.00 0.00 C ATOM 426 CE2 TYR A 28 30.790 -33.784 -4.734 1.00 0.00 C ATOM 427 CZ TYR A 28 29.792 -34.618 -5.131 1.00 0.00 C ATOM 428 OH TYR A 28 29.094 -35.294 -4.180 1.00 0.00 O ATOM 0 H TYR A 28 32.600 -30.629 -10.174 1.00 0.00 H new ATOM 0 HA TYR A 28 30.274 -31.155 -8.421 1.00 0.00 H new ATOM 0 HB2 TYR A 28 32.118 -33.116 -9.020 1.00 0.00 H new ATOM 0 HB3 TYR A 28 33.004 -32.269 -7.768 1.00 0.00 H new ATOM 0 HD1 TYR A 28 29.956 -34.223 -8.489 1.00 0.00 H new ATOM 0 HD2 TYR A 28 32.326 -32.399 -5.452 1.00 0.00 H new ATOM 0 HE1 TYR A 28 28.659 -35.478 -6.712 1.00 0.00 H new ATOM 0 HE2 TYR A 28 31.023 -33.661 -3.687 1.00 0.00 H new ATOM 0 HH TYR A 28 29.441 -35.062 -3.293 1.00 0.00 H new ATOM 438 N CYS A 29 33.254 -29.852 -7.877 1.00 0.00 N ATOM 439 CA CYS A 29 33.950 -28.804 -7.150 1.00 0.00 C ATOM 440 C CYS A 29 34.191 -27.634 -8.106 1.00 0.00 C ATOM 441 O CYS A 29 34.346 -26.494 -7.670 1.00 0.00 O ATOM 442 CB CYS A 29 35.255 -29.315 -6.534 1.00 0.00 C ATOM 443 SG CYS A 29 36.409 -29.835 -7.856 1.00 0.00 S ATOM 0 H CYS A 29 33.850 -30.426 -8.473 1.00 0.00 H new ATOM 0 HA CYS A 29 33.336 -28.468 -6.314 1.00 0.00 H new ATOM 0 HB2 CYS A 29 35.712 -28.532 -5.928 1.00 0.00 H new ATOM 0 HB3 CYS A 29 35.049 -30.154 -5.869 1.00 0.00 H new ATOM 448 N LYS A 30 34.214 -27.956 -9.391 1.00 0.00 N ATOM 449 CA LYS A 30 34.433 -26.945 -10.411 1.00 0.00 C ATOM 450 C LYS A 30 35.932 -26.822 -10.689 1.00 0.00 C ATOM 451 O LYS A 30 36.403 -25.773 -11.127 1.00 0.00 O ATOM 452 CB LYS A 30 33.772 -25.625 -10.009 1.00 0.00 C ATOM 453 CG LYS A 30 32.415 -25.871 -9.346 1.00 0.00 C ATOM 454 CD LYS A 30 31.306 -25.098 -10.064 1.00 0.00 C ATOM 455 CE LYS A 30 30.930 -25.777 -11.383 1.00 0.00 C ATOM 456 NZ LYS A 30 31.062 -24.827 -12.510 1.00 0.00 N ATOM 0 H LYS A 30 34.085 -28.902 -9.749 1.00 0.00 H new ATOM 0 HA LYS A 30 33.958 -27.240 -11.347 1.00 0.00 H new ATOM 0 HB2 LYS A 30 34.423 -25.082 -9.323 1.00 0.00 H new ATOM 0 HB3 LYS A 30 33.642 -24.996 -10.890 1.00 0.00 H new ATOM 0 HG2 LYS A 30 32.188 -26.937 -9.359 1.00 0.00 H new ATOM 0 HG3 LYS A 30 32.457 -25.567 -8.300 1.00 0.00 H new ATOM 0 HD2 LYS A 30 30.428 -25.033 -9.421 1.00 0.00 H new ATOM 0 HD3 LYS A 30 31.636 -24.077 -10.257 1.00 0.00 H new ATOM 0 HE2 LYS A 30 31.573 -26.641 -11.551 1.00 0.00 H new ATOM 0 HE3 LYS A 30 29.906 -26.147 -11.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 30.803 -25.303 -13.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 30.430 -24.015 -12.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 32.045 -24.494 -12.570 1.00 0.00 H new ATOM 470 N GLU A 31 36.641 -27.909 -10.423 1.00 0.00 N ATOM 471 CA GLU A 31 38.078 -27.936 -10.638 1.00 0.00 C ATOM 472 C GLU A 31 38.390 -28.281 -12.096 1.00 0.00 C ATOM 473 O GLU A 31 37.513 -28.728 -12.832 1.00 0.00 O ATOM 474 CB GLU A 31 38.757 -28.922 -9.685 1.00 0.00 C ATOM 475 CG GLU A 31 40.273 -28.927 -9.889 1.00 0.00 C ATOM 476 CD GLU A 31 40.979 -29.649 -8.739 1.00 0.00 C ATOM 477 OE1 GLU A 31 40.543 -29.443 -7.586 1.00 0.00 O ATOM 478 OE2 GLU A 31 41.939 -30.391 -9.039 1.00 0.00 O ATOM 0 H GLU A 31 36.247 -28.777 -10.061 1.00 0.00 H new ATOM 0 HA GLU A 31 38.476 -26.944 -10.426 1.00 0.00 H new ATOM 0 HB2 GLU A 31 38.526 -28.654 -8.654 1.00 0.00 H new ATOM 0 HB3 GLU A 31 38.361 -29.924 -9.850 1.00 0.00 H new ATOM 0 HG2 GLU A 31 40.515 -29.416 -10.833 1.00 0.00 H new ATOM 0 HG3 GLU A 31 40.638 -27.902 -9.958 1.00 0.00 H new ATOM 485 N LYS A 32 39.642 -28.060 -12.468 1.00 0.00 N ATOM 486 CA LYS A 32 40.080 -28.342 -13.824 1.00 0.00 C ATOM 487 C LYS A 32 41.303 -29.262 -13.780 1.00 0.00 C ATOM 488 O LYS A 32 42.326 -28.912 -13.193 1.00 0.00 O ATOM 489 CB LYS A 32 40.318 -27.040 -14.592 1.00 0.00 C ATOM 490 CG LYS A 32 41.281 -26.124 -13.833 1.00 0.00 C ATOM 491 CD LYS A 32 42.128 -25.296 -14.802 1.00 0.00 C ATOM 492 CE LYS A 32 43.535 -25.881 -14.936 1.00 0.00 C ATOM 493 NZ LYS A 32 44.479 -25.170 -14.047 1.00 0.00 N ATOM 0 H LYS A 32 40.367 -27.689 -11.854 1.00 0.00 H new ATOM 0 HA LYS A 32 39.301 -28.872 -14.373 1.00 0.00 H new ATOM 0 HB2 LYS A 32 40.725 -27.264 -15.578 1.00 0.00 H new ATOM 0 HB3 LYS A 32 39.369 -26.527 -14.748 1.00 0.00 H new ATOM 0 HG2 LYS A 32 40.717 -25.460 -13.178 1.00 0.00 H new ATOM 0 HG3 LYS A 32 41.932 -26.723 -13.196 1.00 0.00 H new ATOM 0 HD2 LYS A 32 41.647 -25.269 -15.780 1.00 0.00 H new ATOM 0 HD3 LYS A 32 42.190 -24.267 -14.449 1.00 0.00 H new ATOM 0 HE2 LYS A 32 43.519 -26.942 -14.686 1.00 0.00 H new ATOM 0 HE3 LYS A 32 43.871 -25.802 -15.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 45.429 -25.580 -14.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 44.506 -24.163 -14.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 44.166 -25.267 -13.060 1.00 0.00 H new ATOM 507 N GLY A 33 41.155 -30.419 -14.408 1.00 0.00 N ATOM 508 CA GLY A 33 42.235 -31.391 -14.448 1.00 0.00 C ATOM 509 C GLY A 33 41.721 -32.794 -14.117 1.00 0.00 C ATOM 510 O GLY A 33 42.166 -33.777 -14.708 1.00 0.00 O ATOM 0 H GLY A 33 40.305 -30.705 -14.893 1.00 0.00 H new ATOM 0 HA2 GLY A 33 42.693 -31.391 -15.437 1.00 0.00 H new ATOM 0 HA3 GLY A 33 43.011 -31.107 -13.738 1.00 0.00 H new ATOM 514 N HIS A 34 40.791 -32.843 -13.175 1.00 0.00 N ATOM 515 CA HIS A 34 40.212 -34.109 -12.760 1.00 0.00 C ATOM 516 C HIS A 34 38.720 -34.128 -13.101 1.00 0.00 C ATOM 517 O HIS A 34 38.099 -33.076 -13.238 1.00 0.00 O ATOM 518 CB HIS A 34 40.485 -34.371 -11.277 1.00 0.00 C ATOM 519 CG HIS A 34 39.648 -33.532 -10.342 1.00 0.00 C ATOM 520 ND1 HIS A 34 40.191 -32.574 -9.503 1.00 0.00 N ATOM 521 CD2 HIS A 34 38.301 -33.517 -10.121 1.00 0.00 C ATOM 522 CE1 HIS A 34 39.207 -32.015 -8.813 1.00 0.00 C ATOM 523 NE2 HIS A 34 38.037 -32.601 -9.197 1.00 0.00 N ATOM 0 H HIS A 34 40.424 -32.026 -12.687 1.00 0.00 H new ATOM 0 HA HIS A 34 40.684 -34.925 -13.307 1.00 0.00 H new ATOM 0 HB2 HIS A 34 40.303 -35.425 -11.065 1.00 0.00 H new ATOM 0 HB3 HIS A 34 41.539 -34.182 -11.073 1.00 0.00 H new ATOM 0 HD1 HIS A 34 41.181 -32.338 -9.428 1.00 0.00 H new ATOM 0 HD2 HIS A 34 37.573 -34.144 -10.614 1.00 0.00 H new ATOM 0 HE1 HIS A 34 39.313 -31.233 -8.076 1.00 0.00 H new ATOM 531 N TRP A 35 38.190 -35.335 -13.225 1.00 0.00 N ATOM 532 CA TRP A 35 36.784 -35.505 -13.548 1.00 0.00 C ATOM 533 C TRP A 35 36.017 -35.683 -12.236 1.00 0.00 C ATOM 534 O TRP A 35 36.616 -35.934 -11.192 1.00 0.00 O ATOM 535 CB TRP A 35 36.581 -36.667 -14.522 1.00 0.00 C ATOM 536 CG TRP A 35 36.597 -36.255 -15.995 1.00 0.00 C ATOM 537 CD1 TRP A 35 37.405 -35.370 -16.595 1.00 0.00 C ATOM 538 CD2 TRP A 35 35.730 -36.750 -17.037 1.00 0.00 C ATOM 539 NE1 TRP A 35 37.124 -35.259 -17.942 1.00 0.00 N ATOM 540 CE2 TRP A 35 36.072 -36.126 -18.218 1.00 0.00 C ATOM 541 CE3 TRP A 35 34.690 -37.695 -16.982 1.00 0.00 C ATOM 542 CZ2 TRP A 35 35.425 -36.377 -19.434 1.00 0.00 C ATOM 543 CZ3 TRP A 35 34.053 -37.935 -18.205 1.00 0.00 C ATOM 544 CH2 TRP A 35 34.385 -37.315 -19.403 1.00 0.00 C ATOM 0 H TRP A 35 38.709 -36.205 -13.108 1.00 0.00 H new ATOM 0 HA TRP A 35 36.397 -34.625 -14.062 1.00 0.00 H new ATOM 0 HB2 TRP A 35 37.362 -37.409 -14.354 1.00 0.00 H new ATOM 0 HB3 TRP A 35 35.630 -37.151 -14.301 1.00 0.00 H new ATOM 0 HD1 TRP A 35 38.179 -34.813 -16.088 1.00 0.00 H new ATOM 0 HE1 TRP A 35 37.600 -34.653 -18.611 1.00 0.00 H new ATOM 0 HE3 TRP A 35 34.405 -38.196 -16.068 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 35.712 -35.875 -20.346 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 33.246 -38.653 -18.218 1.00 0.00 H new ATOM 0 HH2 TRP A 35 33.844 -37.555 -20.306 1.00 0.00 H new ATOM 555 N ALA A 36 34.703 -35.547 -12.333 1.00 0.00 N ATOM 556 CA ALA A 36 33.847 -35.690 -11.167 1.00 0.00 C ATOM 557 C ALA A 36 34.085 -37.060 -10.530 1.00 0.00 C ATOM 558 O ALA A 36 34.181 -37.173 -9.308 1.00 0.00 O ATOM 559 CB ALA A 36 32.387 -35.483 -11.576 1.00 0.00 C ATOM 0 H ALA A 36 34.210 -35.339 -13.201 1.00 0.00 H new ATOM 0 HA ALA A 36 34.087 -34.933 -10.420 1.00 0.00 H new ATOM 0 HB1 ALA A 36 31.745 -35.590 -10.701 1.00 0.00 H new ATOM 0 HB2 ALA A 36 32.265 -34.484 -11.995 1.00 0.00 H new ATOM 0 HB3 ALA A 36 32.109 -36.227 -12.323 1.00 0.00 H new ATOM 565 N LYS A 37 34.175 -38.068 -11.386 1.00 0.00 N ATOM 566 CA LYS A 37 34.400 -39.426 -10.922 1.00 0.00 C ATOM 567 C LYS A 37 35.763 -39.505 -10.232 1.00 0.00 C ATOM 568 O LYS A 37 36.062 -40.485 -9.549 1.00 0.00 O ATOM 569 CB LYS A 37 34.234 -40.420 -12.073 1.00 0.00 C ATOM 570 CG LYS A 37 32.788 -40.448 -12.570 1.00 0.00 C ATOM 571 CD LYS A 37 32.561 -39.397 -13.658 1.00 0.00 C ATOM 572 CE LYS A 37 31.861 -40.007 -14.873 1.00 0.00 C ATOM 573 NZ LYS A 37 30.391 -39.919 -14.723 1.00 0.00 N ATOM 0 H LYS A 37 34.096 -37.971 -12.398 1.00 0.00 H new ATOM 0 HA LYS A 37 33.651 -39.705 -10.181 1.00 0.00 H new ATOM 0 HB2 LYS A 37 34.899 -40.147 -12.893 1.00 0.00 H new ATOM 0 HB3 LYS A 37 34.528 -41.416 -11.743 1.00 0.00 H new ATOM 0 HG2 LYS A 37 32.553 -41.438 -12.961 1.00 0.00 H new ATOM 0 HG3 LYS A 37 32.110 -40.266 -11.736 1.00 0.00 H new ATOM 0 HD2 LYS A 37 31.959 -38.580 -13.259 1.00 0.00 H new ATOM 0 HD3 LYS A 37 33.517 -38.970 -13.961 1.00 0.00 H new ATOM 0 HE2 LYS A 37 32.172 -39.486 -15.779 1.00 0.00 H new ATOM 0 HE3 LYS A 37 32.159 -41.049 -14.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 29.955 -40.804 -15.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 30.153 -39.767 -13.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 30.031 -39.124 -15.289 1.00 0.00 H new ATOM 587 N ASP A 38 36.554 -38.461 -10.434 1.00 0.00 N ATOM 588 CA ASP A 38 37.878 -38.401 -9.840 1.00 0.00 C ATOM 589 C ASP A 38 37.982 -37.151 -8.962 1.00 0.00 C ATOM 590 O ASP A 38 39.081 -36.672 -8.687 1.00 0.00 O ATOM 591 CB ASP A 38 38.962 -38.313 -10.916 1.00 0.00 C ATOM 592 CG ASP A 38 40.172 -39.222 -10.692 1.00 0.00 C ATOM 593 OD1 ASP A 38 40.253 -40.245 -11.406 1.00 0.00 O ATOM 594 OD2 ASP A 38 40.988 -38.875 -9.810 1.00 0.00 O ATOM 0 H ASP A 38 36.303 -37.651 -11.000 1.00 0.00 H new ATOM 0 HA ASP A 38 38.025 -39.308 -9.253 1.00 0.00 H new ATOM 0 HB2 ASP A 38 38.516 -38.558 -11.880 1.00 0.00 H new ATOM 0 HB3 ASP A 38 39.308 -37.281 -10.978 1.00 0.00 H new ATOM 599 N CYS A 39 36.823 -36.661 -8.547 1.00 0.00 N ATOM 600 CA CYS A 39 36.771 -35.477 -7.707 1.00 0.00 C ATOM 601 C CYS A 39 37.266 -35.856 -6.310 1.00 0.00 C ATOM 602 O CYS A 39 36.680 -36.713 -5.651 1.00 0.00 O ATOM 603 CB CYS A 39 35.365 -34.873 -7.669 1.00 0.00 C ATOM 604 SG CYS A 39 35.394 -33.276 -6.775 1.00 0.00 S ATOM 0 H CYS A 39 35.914 -37.062 -8.777 1.00 0.00 H new ATOM 0 HA CYS A 39 37.418 -34.704 -8.123 1.00 0.00 H new ATOM 0 HB2 CYS A 39 34.997 -34.724 -8.684 1.00 0.00 H new ATOM 0 HB3 CYS A 39 34.677 -35.562 -7.178 1.00 0.00 H new ATOM 609 N PRO A 40 38.370 -35.182 -5.890 1.00 0.00 N ATOM 610 CA PRO A 40 38.952 -35.439 -4.583 1.00 0.00 C ATOM 611 C PRO A 40 38.104 -34.816 -3.473 1.00 0.00 C ATOM 612 O PRO A 40 38.437 -34.930 -2.294 1.00 0.00 O ATOM 613 CB PRO A 40 40.355 -34.861 -4.656 1.00 0.00 C ATOM 614 CG PRO A 40 40.347 -33.895 -5.829 1.00 0.00 C ATOM 615 CD PRO A 40 39.091 -34.160 -6.643 1.00 0.00 C ATOM 0 HA PRO A 40 38.986 -36.501 -4.339 1.00 0.00 H new ATOM 0 HB2 PRO A 40 40.615 -34.349 -3.730 1.00 0.00 H new ATOM 0 HB3 PRO A 40 41.095 -35.648 -4.803 1.00 0.00 H new ATOM 0 HG2 PRO A 40 40.362 -32.864 -5.475 1.00 0.00 H new ATOM 0 HG3 PRO A 40 41.236 -34.034 -6.444 1.00 0.00 H new ATOM 0 HD2 PRO A 40 38.493 -33.255 -6.755 1.00 0.00 H new ATOM 0 HD3 PRO A 40 39.336 -34.507 -7.647 1.00 0.00 H new ATOM 623 N LYS A 41 37.026 -34.168 -3.889 1.00 0.00 N ATOM 624 CA LYS A 41 36.128 -33.525 -2.944 1.00 0.00 C ATOM 625 C LYS A 41 34.991 -34.486 -2.592 1.00 0.00 C ATOM 626 O LYS A 41 34.324 -34.318 -1.572 1.00 0.00 O ATOM 627 CB LYS A 41 35.649 -32.179 -3.491 1.00 0.00 C ATOM 628 CG LYS A 41 35.051 -31.315 -2.378 1.00 0.00 C ATOM 629 CD LYS A 41 33.648 -30.833 -2.752 1.00 0.00 C ATOM 630 CE LYS A 41 32.587 -31.503 -1.875 1.00 0.00 C ATOM 631 NZ LYS A 41 31.425 -30.604 -1.692 1.00 0.00 N ATOM 0 H LYS A 41 36.754 -34.074 -4.868 1.00 0.00 H new ATOM 0 HA LYS A 41 36.652 -33.297 -2.016 1.00 0.00 H new ATOM 0 HB2 LYS A 41 36.484 -31.654 -3.955 1.00 0.00 H new ATOM 0 HB3 LYS A 41 34.903 -32.343 -4.269 1.00 0.00 H new ATOM 0 HG2 LYS A 41 35.008 -31.888 -1.452 1.00 0.00 H new ATOM 0 HG3 LYS A 41 35.697 -30.457 -2.192 1.00 0.00 H new ATOM 0 HD2 LYS A 41 33.589 -29.751 -2.638 1.00 0.00 H new ATOM 0 HD3 LYS A 41 33.451 -31.054 -3.801 1.00 0.00 H new ATOM 0 HE2 LYS A 41 32.263 -32.437 -2.334 1.00 0.00 H new ATOM 0 HE3 LYS A 41 33.015 -31.756 -0.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 30.714 -31.073 -1.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 31.736 -29.724 -1.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 31.008 -30.383 -2.619 1.00 0.00 H new ATOM 645 N LYS A 42 34.804 -35.473 -3.457 1.00 0.00 N ATOM 646 CA LYS A 42 33.759 -36.461 -3.250 1.00 0.00 C ATOM 647 C LYS A 42 34.058 -37.254 -1.976 1.00 0.00 C ATOM 648 O LYS A 42 35.023 -38.014 -1.927 1.00 0.00 O ATOM 649 CB LYS A 42 33.595 -37.336 -4.495 1.00 0.00 C ATOM 650 CG LYS A 42 32.483 -36.798 -5.400 1.00 0.00 C ATOM 651 CD LYS A 42 32.122 -37.814 -6.485 1.00 0.00 C ATOM 652 CE LYS A 42 31.811 -37.114 -7.809 1.00 0.00 C ATOM 653 NZ LYS A 42 31.736 -38.099 -8.911 1.00 0.00 N ATOM 0 H LYS A 42 35.359 -35.609 -4.302 1.00 0.00 H new ATOM 0 HA LYS A 42 32.796 -35.972 -3.103 1.00 0.00 H new ATOM 0 HB2 LYS A 42 34.534 -37.369 -5.047 1.00 0.00 H new ATOM 0 HB3 LYS A 42 33.364 -38.359 -4.197 1.00 0.00 H new ATOM 0 HG2 LYS A 42 31.601 -36.570 -4.802 1.00 0.00 H new ATOM 0 HG3 LYS A 42 32.805 -35.865 -5.863 1.00 0.00 H new ATOM 0 HD2 LYS A 42 32.947 -38.512 -6.624 1.00 0.00 H new ATOM 0 HD3 LYS A 42 31.259 -38.400 -6.168 1.00 0.00 H new ATOM 0 HE2 LYS A 42 30.866 -36.576 -7.730 1.00 0.00 H new ATOM 0 HE3 LYS A 42 32.582 -36.375 -8.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 31.491 -37.611 -9.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 32.657 -38.570 -9.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 31.007 -38.809 -8.693 1.00 0.00 H new ATOM 667 N PRO A 43 33.189 -37.044 -0.952 1.00 0.00 N ATOM 668 CA PRO A 43 33.350 -37.730 0.319 1.00 0.00 C ATOM 669 C PRO A 43 32.920 -39.195 0.208 1.00 0.00 C ATOM 670 O PRO A 43 33.670 -40.095 0.584 1.00 0.00 O ATOM 671 CB PRO A 43 32.507 -36.938 1.304 1.00 0.00 C ATOM 672 CG PRO A 43 31.542 -36.118 0.462 1.00 0.00 C ATOM 673 CD PRO A 43 32.034 -36.151 -0.975 1.00 0.00 C ATOM 0 HA PRO A 43 34.389 -37.770 0.647 1.00 0.00 H new ATOM 0 HB2 PRO A 43 31.968 -37.602 1.980 1.00 0.00 H new ATOM 0 HB3 PRO A 43 33.131 -36.293 1.922 1.00 0.00 H new ATOM 0 HG2 PRO A 43 30.534 -36.527 0.530 1.00 0.00 H new ATOM 0 HG3 PRO A 43 31.495 -35.092 0.826 1.00 0.00 H new ATOM 0 HD2 PRO A 43 31.261 -36.520 -1.649 1.00 0.00 H new ATOM 0 HD3 PRO A 43 32.310 -35.155 -1.322 1.00 0.00 H new ATOM 681 N ARG A 44 31.716 -39.388 -0.309 1.00 0.00 N ATOM 682 CA ARG A 44 31.178 -40.728 -0.472 1.00 0.00 C ATOM 683 C ARG A 44 29.739 -40.663 -0.986 1.00 0.00 C ATOM 684 O ARG A 44 29.039 -39.677 -0.762 1.00 0.00 O ATOM 685 CB ARG A 44 31.206 -41.498 0.849 1.00 0.00 C ATOM 686 CG ARG A 44 31.614 -42.957 0.625 1.00 0.00 C ATOM 687 CD ARG A 44 33.136 -43.097 0.565 1.00 0.00 C ATOM 688 NE ARG A 44 33.722 -42.829 1.897 1.00 0.00 N ATOM 689 CZ ARG A 44 35.029 -42.630 2.116 1.00 0.00 C ATOM 690 NH1 ARG A 44 35.894 -42.668 1.093 1.00 0.00 N ATOM 691 NH2 ARG A 44 35.471 -42.394 3.359 1.00 0.00 N ATOM 0 H ARG A 44 31.098 -38.639 -0.621 1.00 0.00 H new ATOM 0 HA ARG A 44 31.803 -41.250 -1.196 1.00 0.00 H new ATOM 0 HB2 ARG A 44 31.905 -41.022 1.537 1.00 0.00 H new ATOM 0 HB3 ARG A 44 30.223 -41.459 1.318 1.00 0.00 H new ATOM 0 HG2 ARG A 44 31.220 -43.576 1.430 1.00 0.00 H new ATOM 0 HG3 ARG A 44 31.175 -43.323 -0.303 1.00 0.00 H new ATOM 0 HD2 ARG A 44 33.404 -44.101 0.236 1.00 0.00 H new ATOM 0 HD3 ARG A 44 33.545 -42.401 -0.168 1.00 0.00 H new ATOM 0 HE ARG A 44 33.092 -42.794 2.698 1.00 0.00 H new ATOM 0 HH11 ARG A 44 35.558 -42.848 0.147 1.00 0.00 H new ATOM 0 HH12 ARG A 44 36.889 -42.516 1.260 1.00 0.00 H new ATOM 0 HH21 ARG A 44 34.813 -42.366 4.138 1.00 0.00 H new ATOM 0 HH22 ARG A 44 36.466 -42.242 3.526 1.00 0.00 H new ATOM 705 N GLY A 45 29.338 -41.727 -1.668 1.00 0.00 N ATOM 706 CA GLY A 45 27.995 -41.803 -2.215 1.00 0.00 C ATOM 707 C GLY A 45 28.031 -42.058 -3.724 1.00 0.00 C ATOM 708 O GLY A 45 29.104 -42.095 -4.325 1.00 0.00 O ATOM 0 H GLY A 45 29.921 -42.543 -1.854 1.00 0.00 H new ATOM 0 HA2 GLY A 45 27.442 -42.602 -1.721 1.00 0.00 H new ATOM 0 HA3 GLY A 45 27.463 -40.874 -2.012 1.00 0.00 H new ATOM 712 N PRO A 46 26.815 -42.232 -4.307 1.00 0.00 N ATOM 713 CA PRO A 46 25.594 -42.173 -3.522 1.00 0.00 C ATOM 714 C PRO A 46 25.415 -43.443 -2.690 1.00 0.00 C ATOM 715 O PRO A 46 25.184 -43.372 -1.483 1.00 0.00 O ATOM 716 CB PRO A 46 24.483 -41.966 -4.539 1.00 0.00 C ATOM 717 CG PRO A 46 25.064 -42.382 -5.881 1.00 0.00 C ATOM 718 CD PRO A 46 26.571 -42.488 -5.724 1.00 0.00 C ATOM 0 HA PRO A 46 25.602 -41.365 -2.791 1.00 0.00 H new ATOM 0 HB2 PRO A 46 23.608 -42.566 -4.289 1.00 0.00 H new ATOM 0 HB3 PRO A 46 24.160 -40.925 -4.559 1.00 0.00 H new ATOM 0 HG2 PRO A 46 24.645 -43.337 -6.199 1.00 0.00 H new ATOM 0 HG3 PRO A 46 24.811 -41.652 -6.649 1.00 0.00 H new ATOM 0 HD2 PRO A 46 26.931 -43.475 -6.016 1.00 0.00 H new ATOM 0 HD3 PRO A 46 27.087 -41.762 -6.352 1.00 0.00 H new ATOM 726 N ARG A 47 25.526 -44.577 -3.367 1.00 0.00 N ATOM 727 CA ARG A 47 25.380 -45.861 -2.705 1.00 0.00 C ATOM 728 C ARG A 47 23.975 -45.997 -2.113 1.00 0.00 C ATOM 729 O ARG A 47 23.724 -45.556 -0.993 1.00 0.00 O ATOM 730 CB ARG A 47 26.413 -46.028 -1.589 1.00 0.00 C ATOM 731 CG ARG A 47 27.334 -47.218 -1.866 1.00 0.00 C ATOM 732 CD ARG A 47 28.636 -46.762 -2.524 1.00 0.00 C ATOM 733 NE ARG A 47 28.625 -47.110 -3.963 1.00 0.00 N ATOM 734 CZ ARG A 47 28.702 -48.363 -4.433 1.00 0.00 C ATOM 735 NH1 ARG A 47 28.795 -49.393 -3.582 1.00 0.00 N ATOM 736 NH2 ARG A 47 28.685 -48.585 -5.755 1.00 0.00 N ATOM 0 H ARG A 47 25.715 -44.632 -4.368 1.00 0.00 H new ATOM 0 HA ARG A 47 25.541 -46.638 -3.452 1.00 0.00 H new ATOM 0 HB2 ARG A 47 27.006 -45.118 -1.499 1.00 0.00 H new ATOM 0 HB3 ARG A 47 25.904 -46.172 -0.636 1.00 0.00 H new ATOM 0 HG2 ARG A 47 27.556 -47.735 -0.933 1.00 0.00 H new ATOM 0 HG3 ARG A 47 26.826 -47.933 -2.514 1.00 0.00 H new ATOM 0 HD2 ARG A 47 28.757 -45.686 -2.403 1.00 0.00 H new ATOM 0 HD3 ARG A 47 29.486 -47.236 -2.033 1.00 0.00 H new ATOM 0 HE ARG A 47 28.554 -46.349 -4.639 1.00 0.00 H new ATOM 0 HH11 ARG A 47 28.807 -49.224 -2.576 1.00 0.00 H new ATOM 0 HH12 ARG A 47 28.854 -50.346 -3.940 1.00 0.00 H new ATOM 0 HH21 ARG A 47 28.614 -47.801 -6.403 1.00 0.00 H new ATOM 0 HH22 ARG A 47 28.744 -49.538 -6.113 1.00 0.00 H new ATOM 750 N GLY A 48 23.096 -46.608 -2.894 1.00 0.00 N ATOM 751 CA GLY A 48 21.723 -46.807 -2.462 1.00 0.00 C ATOM 752 C GLY A 48 20.812 -45.701 -3.001 1.00 0.00 C ATOM 753 O GLY A 48 21.279 -44.611 -3.327 1.00 0.00 O ATOM 0 H GLY A 48 23.308 -46.972 -3.823 1.00 0.00 H new ATOM 0 HA2 GLY A 48 21.366 -47.777 -2.808 1.00 0.00 H new ATOM 0 HA3 GLY A 48 21.679 -46.821 -1.373 1.00 0.00 H new ATOM 757 N PRO A 49 19.495 -46.030 -3.081 1.00 0.00 N ATOM 758 CA PRO A 49 18.515 -45.079 -3.577 1.00 0.00 C ATOM 759 C PRO A 49 18.219 -44.003 -2.530 1.00 0.00 C ATOM 760 O PRO A 49 18.813 -43.998 -1.454 1.00 0.00 O ATOM 761 CB PRO A 49 17.297 -45.916 -3.930 1.00 0.00 C ATOM 762 CG PRO A 49 17.467 -47.232 -3.190 1.00 0.00 C ATOM 763 CD PRO A 49 18.906 -47.312 -2.705 1.00 0.00 C ATOM 0 HA PRO A 49 18.867 -44.527 -4.449 1.00 0.00 H new ATOM 0 HB2 PRO A 49 16.378 -45.414 -3.628 1.00 0.00 H new ATOM 0 HB3 PRO A 49 17.233 -46.078 -5.006 1.00 0.00 H new ATOM 0 HG2 PRO A 49 16.777 -47.288 -2.348 1.00 0.00 H new ATOM 0 HG3 PRO A 49 17.238 -48.071 -3.847 1.00 0.00 H new ATOM 0 HD2 PRO A 49 18.953 -47.468 -1.627 1.00 0.00 H new ATOM 0 HD3 PRO A 49 19.435 -48.143 -3.171 1.00 0.00 H new ATOM 771 N ARG A 50 17.299 -43.116 -2.883 1.00 0.00 N ATOM 772 CA ARG A 50 16.917 -42.037 -1.988 1.00 0.00 C ATOM 773 C ARG A 50 18.117 -41.131 -1.705 1.00 0.00 C ATOM 774 O ARG A 50 19.230 -41.614 -1.507 1.00 0.00 O ATOM 775 CB ARG A 50 16.377 -42.584 -0.666 1.00 0.00 C ATOM 776 CG ARG A 50 14.952 -42.091 -0.408 1.00 0.00 C ATOM 777 CD ARG A 50 14.758 -41.718 1.063 1.00 0.00 C ATOM 778 NE ARG A 50 14.432 -40.280 1.183 1.00 0.00 N ATOM 779 CZ ARG A 50 13.841 -39.729 2.253 1.00 0.00 C ATOM 780 NH1 ARG A 50 13.510 -40.494 3.302 1.00 0.00 N ATOM 781 NH2 ARG A 50 13.584 -38.415 2.273 1.00 0.00 N ATOM 0 H ARG A 50 16.807 -43.123 -3.777 1.00 0.00 H new ATOM 0 HA ARG A 50 16.132 -41.462 -2.479 1.00 0.00 H new ATOM 0 HB2 ARG A 50 16.390 -43.674 -0.687 1.00 0.00 H new ATOM 0 HB3 ARG A 50 17.027 -42.273 0.152 1.00 0.00 H new ATOM 0 HG2 ARG A 50 14.744 -41.225 -1.037 1.00 0.00 H new ATOM 0 HG3 ARG A 50 14.239 -42.867 -0.687 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.958 -42.318 1.496 1.00 0.00 H new ATOM 0 HD3 ARG A 50 15.664 -41.942 1.626 1.00 0.00 H new ATOM 0 HE ARG A 50 14.672 -39.669 0.402 1.00 0.00 H new ATOM 0 HH11 ARG A 50 13.708 -41.495 3.286 1.00 0.00 H new ATOM 0 HH12 ARG A 50 13.060 -40.076 4.116 1.00 0.00 H new ATOM 0 HH21 ARG A 50 13.838 -37.833 1.474 1.00 0.00 H new ATOM 0 HH22 ARG A 50 13.134 -37.996 3.087 1.00 0.00 H new ATOM 795 N PRO A 51 17.842 -39.799 -1.696 1.00 0.00 N ATOM 796 CA PRO A 51 18.886 -38.821 -1.440 1.00 0.00 C ATOM 797 C PRO A 51 19.258 -38.791 0.044 1.00 0.00 C ATOM 798 O PRO A 51 18.651 -39.490 0.854 1.00 0.00 O ATOM 799 CB PRO A 51 18.319 -37.502 -1.937 1.00 0.00 C ATOM 800 CG PRO A 51 16.814 -37.701 -2.023 1.00 0.00 C ATOM 801 CD PRO A 51 16.535 -39.191 -1.925 1.00 0.00 C ATOM 0 HA PRO A 51 19.818 -39.057 -1.953 1.00 0.00 H new ATOM 0 HB2 PRO A 51 18.567 -36.689 -1.255 1.00 0.00 H new ATOM 0 HB3 PRO A 51 18.735 -37.240 -2.910 1.00 0.00 H new ATOM 0 HG2 PRO A 51 16.311 -37.165 -1.218 1.00 0.00 H new ATOM 0 HG3 PRO A 51 16.429 -37.301 -2.961 1.00 0.00 H new ATOM 0 HD2 PRO A 51 15.847 -39.412 -1.109 1.00 0.00 H new ATOM 0 HD3 PRO A 51 16.077 -39.569 -2.839 1.00 0.00 H new ATOM 809 N GLN A 52 20.253 -37.974 0.355 1.00 0.00 N ATOM 810 CA GLN A 52 20.714 -37.844 1.727 1.00 0.00 C ATOM 811 C GLN A 52 19.800 -36.895 2.505 1.00 0.00 C ATOM 812 O GLN A 52 19.506 -35.793 2.044 1.00 0.00 O ATOM 813 CB GLN A 52 22.166 -37.367 1.775 1.00 0.00 C ATOM 814 CG GLN A 52 23.123 -38.546 1.969 1.00 0.00 C ATOM 815 CD GLN A 52 24.020 -38.328 3.190 1.00 0.00 C ATOM 816 OE1 GLN A 52 24.329 -37.213 3.574 1.00 0.00 O ATOM 817 NE2 GLN A 52 24.419 -39.455 3.775 1.00 0.00 N ATOM 0 H GLN A 52 20.753 -37.395 -0.320 1.00 0.00 H new ATOM 0 HA GLN A 52 20.673 -38.826 2.198 1.00 0.00 H new ATOM 0 HB2 GLN A 52 22.411 -36.843 0.851 1.00 0.00 H new ATOM 0 HB3 GLN A 52 22.292 -36.654 2.590 1.00 0.00 H new ATOM 0 HG2 GLN A 52 22.552 -39.466 2.092 1.00 0.00 H new ATOM 0 HG3 GLN A 52 23.739 -38.670 1.078 1.00 0.00 H new ATOM 0 HE21 GLN A 52 24.123 -40.356 3.401 1.00 0.00 H new ATOM 0 HE22 GLN A 52 25.021 -39.417 4.597 1.00 0.00 H new ATOM 826 N THR A 53 19.375 -37.357 3.672 1.00 0.00 N ATOM 827 CA THR A 53 18.500 -36.563 4.518 1.00 0.00 C ATOM 828 C THR A 53 19.057 -35.148 4.681 1.00 0.00 C ATOM 829 O THR A 53 20.047 -34.942 5.380 1.00 0.00 O ATOM 830 CB THR A 53 18.328 -37.304 5.846 1.00 0.00 C ATOM 831 OG1 THR A 53 17.490 -38.410 5.520 1.00 0.00 O ATOM 832 CG2 THR A 53 17.510 -36.503 6.861 1.00 0.00 C ATOM 0 H THR A 53 19.620 -38.271 4.052 1.00 0.00 H new ATOM 0 HA THR A 53 17.516 -36.442 4.066 1.00 0.00 H new ATOM 0 HB THR A 53 19.308 -37.529 6.266 1.00 0.00 H new ATOM 0 HG1 THR A 53 17.328 -38.946 6.324 1.00 0.00 H new ATOM 0 HG21 THR A 53 17.418 -37.073 7.785 1.00 0.00 H new ATOM 0 HG22 THR A 53 18.011 -35.557 7.067 1.00 0.00 H new ATOM 0 HG23 THR A 53 16.518 -36.307 6.455 1.00 0.00 H new ATOM 840 N SER A 54 18.395 -34.207 4.022 1.00 0.00 N ATOM 841 CA SER A 54 18.811 -32.816 4.084 1.00 0.00 C ATOM 842 C SER A 54 17.647 -31.904 3.693 1.00 0.00 C ATOM 843 O SER A 54 17.006 -32.117 2.666 1.00 0.00 O ATOM 844 CB SER A 54 20.015 -32.560 3.175 1.00 0.00 C ATOM 845 OG SER A 54 21.093 -33.449 3.455 1.00 0.00 O ATOM 0 H SER A 54 17.574 -34.381 3.443 1.00 0.00 H new ATOM 0 HA SER A 54 19.110 -32.594 5.108 1.00 0.00 H new ATOM 0 HB2 SER A 54 19.714 -32.672 2.134 1.00 0.00 H new ATOM 0 HB3 SER A 54 20.352 -31.531 3.300 1.00 0.00 H new ATOM 0 HG SER A 54 20.997 -33.804 4.363 1.00 0.00 H new ATOM 851 N LEU A 55 17.409 -30.907 4.534 1.00 0.00 N ATOM 852 CA LEU A 55 16.333 -29.963 4.289 1.00 0.00 C ATOM 853 C LEU A 55 16.871 -28.786 3.470 1.00 0.00 C ATOM 854 O LEU A 55 16.437 -28.564 2.340 1.00 0.00 O ATOM 855 CB LEU A 55 15.677 -29.544 5.606 1.00 0.00 C ATOM 856 CG LEU A 55 14.151 -29.636 5.653 1.00 0.00 C ATOM 857 CD1 LEU A 55 13.699 -30.988 6.210 1.00 0.00 C ATOM 858 CD2 LEU A 55 13.555 -28.466 6.438 1.00 0.00 C ATOM 0 H LEU A 55 17.943 -30.733 5.385 1.00 0.00 H new ATOM 0 HA LEU A 55 15.543 -30.430 3.700 1.00 0.00 H new ATOM 0 HB2 LEU A 55 16.083 -30.164 6.405 1.00 0.00 H new ATOM 0 HB3 LEU A 55 15.966 -28.516 5.822 1.00 0.00 H new ATOM 0 HG LEU A 55 13.774 -29.566 4.633 1.00 0.00 H new ATOM 0 HD11 LEU A 55 12.610 -31.027 6.232 1.00 0.00 H new ATOM 0 HD12 LEU A 55 14.077 -31.788 5.574 1.00 0.00 H new ATOM 0 HD13 LEU A 55 14.087 -31.113 7.221 1.00 0.00 H new ATOM 0 HD21 LEU A 55 12.469 -28.556 6.456 1.00 0.00 H new ATOM 0 HD22 LEU A 55 13.937 -28.480 7.459 1.00 0.00 H new ATOM 0 HD23 LEU A 55 13.834 -27.527 5.959 1.00 0.00 H new ATOM 870 N LEU A 56 17.806 -28.066 4.070 1.00 0.00 N ATOM 871 CA LEU A 56 18.405 -26.919 3.411 1.00 0.00 C ATOM 872 C LEU A 56 19.659 -27.368 2.658 1.00 0.00 C ATOM 873 O LEU A 56 19.891 -28.564 2.488 1.00 0.00 O ATOM 874 CB LEU A 56 18.661 -25.795 4.417 1.00 0.00 C ATOM 875 CG LEU A 56 18.453 -24.371 3.899 1.00 0.00 C ATOM 876 CD1 LEU A 56 16.988 -23.950 4.026 1.00 0.00 C ATOM 877 CD2 LEU A 56 19.394 -23.389 4.600 1.00 0.00 C ATOM 0 H LEU A 56 18.164 -28.255 5.006 1.00 0.00 H new ATOM 0 HA LEU A 56 17.720 -26.503 2.672 1.00 0.00 H new ATOM 0 HB2 LEU A 56 18.007 -25.947 5.276 1.00 0.00 H new ATOM 0 HB3 LEU A 56 19.686 -25.883 4.777 1.00 0.00 H new ATOM 0 HG LEU A 56 18.702 -24.354 2.838 1.00 0.00 H new ATOM 0 HD11 LEU A 56 16.868 -22.934 3.651 1.00 0.00 H new ATOM 0 HD12 LEU A 56 16.363 -24.628 3.445 1.00 0.00 H new ATOM 0 HD13 LEU A 56 16.688 -23.988 5.073 1.00 0.00 H new ATOM 0 HD21 LEU A 56 19.225 -22.384 4.213 1.00 0.00 H new ATOM 0 HD22 LEU A 56 19.200 -23.402 5.673 1.00 0.00 H new ATOM 0 HD23 LEU A 56 20.428 -23.680 4.415 1.00 0.00 H new TER 889 LEU A 56 ATOM 890 P A B 493 21.353 -31.594 -6.794 1.00 0.00 P ATOM 891 OP1 A B 493 21.272 -32.892 -6.086 1.00 0.00 O ATOM 892 OP2 A B 493 20.222 -31.224 -7.673 1.00 0.00 O ATOM 893 O5' A B 493 21.524 -30.443 -5.695 1.00 0.00 O ATOM 894 C5' A B 493 22.263 -29.264 -6.007 1.00 0.00 C ATOM 895 C4' A B 493 22.613 -28.520 -4.739 1.00 0.00 C ATOM 896 O4' A B 493 21.839 -29.116 -3.668 1.00 0.00 O ATOM 897 C3' A B 493 24.030 -28.770 -4.232 1.00 0.00 C ATOM 898 O3' A B 493 24.879 -27.701 -4.646 1.00 0.00 O ATOM 899 C2' A B 493 23.912 -28.832 -2.735 1.00 0.00 C ATOM 900 O2' A B 493 23.862 -27.471 -2.371 1.00 0.00 O ATOM 901 C1' A B 493 22.602 -29.599 -2.584 1.00 0.00 C ATOM 902 N9 A B 493 22.765 -31.066 -2.660 1.00 0.00 N ATOM 903 C8 A B 493 23.093 -31.799 -3.743 1.00 0.00 C ATOM 904 N7 A B 493 23.161 -33.101 -3.481 1.00 0.00 N ATOM 905 C5 A B 493 22.856 -33.183 -2.148 1.00 0.00 C ATOM 906 C6 A B 493 22.761 -34.290 -1.278 1.00 0.00 C ATOM 907 N6 A B 493 22.976 -35.579 -1.646 1.00 0.00 N ATOM 908 N1 A B 493 22.431 -34.039 0.019 1.00 0.00 N ATOM 909 C2 A B 493 22.216 -32.759 0.394 1.00 0.00 C ATOM 910 N3 A B 493 22.278 -31.636 -0.345 1.00 0.00 N ATOM 911 C4 A B 493 22.611 -31.953 -1.627 1.00 0.00 C ATOM 0 H5' A B 493 21.677 -28.622 -6.665 1.00 0.00 H new ATOM 0 H5'' A B 493 23.173 -29.528 -6.546 1.00 0.00 H new ATOM 0 H4' A B 493 22.452 -27.467 -4.968 1.00 0.00 H new ATOM 0 H3' A B 493 24.464 -29.689 -4.626 1.00 0.00 H new ATOM 0 H2' A B 493 24.684 -29.309 -2.131 1.00 0.00 H new ATOM 0 HO2' A B 493 24.239 -26.925 -3.093 1.00 0.00 H new ATOM 0 H1' A B 493 22.146 -29.442 -1.606 1.00 0.00 H new ATOM 0 H8 A B 493 23.280 -31.375 -4.718 1.00 0.00 H new ATOM 0 H61 A B 493 22.888 -36.327 -0.958 1.00 0.00 H new ATOM 0 H62 A B 493 23.225 -35.799 -2.610 1.00 0.00 H new ATOM 0 H2 A B 493 21.958 -32.617 1.433 1.00 0.00 H new ATOM 923 P A B 494 25.518 -27.709 -6.113 1.00 0.00 P ATOM 924 OP1 A B 494 26.483 -26.594 -6.242 1.00 0.00 O ATOM 925 OP2 A B 494 24.442 -27.803 -7.125 1.00 0.00 O ATOM 926 O5' A B 494 26.342 -29.081 -6.138 1.00 0.00 O ATOM 927 C5' A B 494 26.955 -29.522 -7.348 1.00 0.00 C ATOM 928 C4' A B 494 27.071 -31.029 -7.351 1.00 0.00 C ATOM 929 O4' A B 494 28.327 -31.299 -6.650 1.00 0.00 O ATOM 930 C3' A B 494 26.022 -31.745 -6.504 1.00 0.00 C ATOM 931 O3' A B 494 25.178 -32.521 -7.352 1.00 0.00 O ATOM 932 C2' A B 494 26.802 -32.615 -5.558 1.00 0.00 C ATOM 933 O2' A B 494 26.998 -33.793 -6.307 1.00 0.00 O ATOM 934 C1' A B 494 28.049 -31.759 -5.347 1.00 0.00 C ATOM 935 N9 A B 494 27.837 -30.629 -4.416 1.00 0.00 N ATOM 936 C8 A B 494 26.985 -30.578 -3.370 1.00 0.00 C ATOM 937 N7 A B 494 27.032 -29.416 -2.728 1.00 0.00 N ATOM 938 C5 A B 494 27.972 -28.696 -3.417 1.00 0.00 C ATOM 939 C6 A B 494 28.472 -27.391 -3.229 1.00 0.00 C ATOM 940 N6 A B 494 28.071 -26.547 -2.244 1.00 0.00 N ATOM 941 N1 A B 494 29.423 -26.954 -4.099 1.00 0.00 N ATOM 942 C2 A B 494 29.829 -27.788 -5.084 1.00 0.00 C ATOM 943 N3 A B 494 29.424 -29.042 -5.354 1.00 0.00 N ATOM 944 C4 A B 494 28.476 -29.419 -4.452 1.00 0.00 C ATOM 0 H5' A B 494 27.943 -29.073 -7.449 1.00 0.00 H new ATOM 0 H5'' A B 494 26.366 -29.193 -8.204 1.00 0.00 H new ATOM 0 H4' A B 494 26.977 -31.371 -8.382 1.00 0.00 H new ATOM 0 H3' A B 494 25.376 -31.058 -5.957 1.00 0.00 H new ATOM 0 H2' A B 494 26.389 -32.902 -4.591 1.00 0.00 H new ATOM 0 HO2' A B 494 27.768 -34.283 -5.951 1.00 0.00 H new ATOM 0 H1' A B 494 28.860 -32.322 -4.886 1.00 0.00 H new ATOM 0 H8 A B 494 26.336 -31.393 -3.086 1.00 0.00 H new ATOM 0 H61 A B 494 28.480 -25.616 -2.172 1.00 0.00 H new ATOM 0 H62 A B 494 27.360 -26.844 -1.576 1.00 0.00 H new ATOM 0 H2 A B 494 30.584 -27.391 -5.746 1.00 0.00 H new ATOM 956 P C B 495 24.475 -31.842 -8.619 1.00 0.00 P ATOM 957 OP1 C B 495 24.535 -30.369 -8.492 1.00 0.00 O ATOM 958 OP2 C B 495 23.145 -32.455 -8.838 1.00 0.00 O ATOM 959 O5' C B 495 25.424 -32.274 -9.832 1.00 0.00 O ATOM 960 C5' C B 495 26.270 -33.415 -9.703 1.00 0.00 C ATOM 961 C4' C B 495 27.174 -33.530 -10.911 1.00 0.00 C ATOM 962 O4' C B 495 28.441 -33.950 -10.313 1.00 0.00 O ATOM 963 C3' C B 495 26.892 -34.741 -11.796 1.00 0.00 C ATOM 964 O3' C B 495 26.166 -34.324 -12.950 1.00 0.00 O ATOM 965 C2' C B 495 28.243 -35.288 -12.162 1.00 0.00 C ATOM 966 O2' C B 495 28.666 -34.414 -13.184 1.00 0.00 O ATOM 967 C1' C B 495 28.977 -35.146 -10.832 1.00 0.00 C ATOM 968 N1 C B 495 28.749 -36.277 -9.908 1.00 0.00 N ATOM 969 C2 C B 495 29.415 -37.474 -10.171 1.00 0.00 C ATOM 970 O2 C B 495 30.159 -37.531 -11.156 1.00 0.00 O ATOM 971 N3 C B 495 29.223 -38.517 -9.346 1.00 0.00 N ATOM 972 C4 C B 495 28.425 -38.439 -8.300 1.00 0.00 C ATOM 973 N4 C B 495 28.249 -39.480 -7.497 1.00 0.00 N ATOM 974 C5 C B 495 27.723 -37.210 -8.004 1.00 0.00 C ATOM 975 C6 C B 495 27.924 -36.179 -8.837 1.00 0.00 C ATOM 0 H5' C B 495 25.665 -34.317 -9.604 1.00 0.00 H new ATOM 0 H5'' C B 495 26.870 -33.332 -8.797 1.00 0.00 H new ATOM 0 H4' C B 495 27.097 -32.608 -11.487 1.00 0.00 H new ATOM 0 H3' C B 495 26.288 -35.500 -11.299 1.00 0.00 H new ATOM 0 H2' C B 495 28.355 -36.307 -12.531 1.00 0.00 H new ATOM 0 HO2' C B 495 28.077 -34.510 -13.961 1.00 0.00 H new ATOM 0 H1' C B 495 30.059 -35.136 -10.962 1.00 0.00 H new ATOM 0 H41 C B 495 27.628 -39.403 -6.691 1.00 0.00 H new ATOM 0 H42 C B 495 28.735 -40.357 -7.685 1.00 0.00 H new ATOM 0 H5 C B 495 27.066 -37.126 -7.151 1.00 0.00 H new ATOM 0 H6 C B 495 27.415 -35.245 -8.650 1.00 0.00 H new ATOM 987 P A B 496 24.580 -34.121 -12.868 1.00 0.00 P ATOM 988 OP1 A B 496 24.168 -33.988 -11.453 1.00 0.00 O ATOM 989 OP2 A B 496 23.903 -35.153 -13.684 1.00 0.00 O ATOM 990 O5' A B 496 24.362 -32.706 -13.581 1.00 0.00 O ATOM 991 C5' A B 496 23.689 -32.636 -14.837 1.00 0.00 C ATOM 992 C4' A B 496 24.635 -32.137 -15.907 1.00 0.00 C ATOM 993 O4' A B 496 25.110 -30.821 -15.569 1.00 0.00 O ATOM 994 C3' A B 496 25.986 -32.845 -15.934 1.00 0.00 C ATOM 995 O3' A B 496 25.902 -33.993 -16.777 1.00 0.00 O ATOM 996 C2' A B 496 26.955 -31.831 -16.475 1.00 0.00 C ATOM 997 O2' A B 496 26.695 -31.862 -17.861 1.00 0.00 O ATOM 998 C1' A B 496 26.486 -30.574 -15.749 1.00 0.00 C ATOM 999 N9 A B 496 27.163 -30.355 -14.453 1.00 0.00 N ATOM 1000 C8 A B 496 27.052 -31.101 -13.334 1.00 0.00 C ATOM 1001 N7 A B 496 27.794 -30.638 -12.333 1.00 0.00 N ATOM 1002 C5 A B 496 28.406 -29.534 -12.862 1.00 0.00 C ATOM 1003 C6 A B 496 29.315 -28.611 -12.302 1.00 0.00 C ATOM 1004 N6 A B 496 29.780 -28.666 -11.027 1.00 0.00 N ATOM 1005 N1 A B 496 29.752 -27.599 -13.101 1.00 0.00 N ATOM 1006 C2 A B 496 29.294 -27.536 -14.371 1.00 0.00 C ATOM 1007 N3 A B 496 28.434 -28.354 -15.005 1.00 0.00 N ATOM 1008 C4 A B 496 28.035 -29.342 -14.155 1.00 0.00 C ATOM 0 H5' A B 496 22.830 -31.970 -14.761 1.00 0.00 H new ATOM 0 H5'' A B 496 23.307 -33.620 -15.109 1.00 0.00 H new ATOM 0 H4' A B 496 24.052 -32.256 -16.820 1.00 0.00 H new ATOM 0 H3' A B 496 26.302 -33.197 -14.952 1.00 0.00 H new ATOM 0 H2' A B 496 28.029 -31.952 -16.336 1.00 0.00 H new ATOM 0 HO2' A B 496 26.382 -32.755 -18.115 1.00 0.00 H new ATOM 0 H1' A B 496 26.711 -29.668 -16.312 1.00 0.00 H new ATOM 0 H8 A B 496 26.428 -31.979 -13.260 1.00 0.00 H new ATOM 0 H61 A B 496 30.437 -27.961 -10.693 1.00 0.00 H new ATOM 0 H62 A B 496 29.472 -29.412 -10.404 1.00 0.00 H new ATOM 0 H2 A B 496 29.671 -26.713 -14.960 1.00 0.00 H new ATOM 1020 P G B 497 26.214 -35.445 -16.184 1.00 0.00 P ATOM 1021 OP1 G B 497 24.960 -36.227 -16.096 1.00 0.00 O ATOM 1022 OP2 G B 497 27.026 -35.319 -14.954 1.00 0.00 O ATOM 1023 O5' G B 497 27.131 -36.107 -17.316 1.00 0.00 O ATOM 1024 C5' G B 497 26.759 -36.000 -18.688 1.00 0.00 C ATOM 1025 C4' G B 497 27.990 -36.050 -19.565 1.00 0.00 C ATOM 1026 O4' G B 497 28.807 -34.978 -19.061 1.00 0.00 O ATOM 1027 C3' G B 497 28.952 -37.188 -19.236 1.00 0.00 C ATOM 1028 O3' G B 497 28.667 -38.306 -20.074 1.00 0.00 O ATOM 1029 C2' G B 497 30.325 -36.635 -19.502 1.00 0.00 C ATOM 1030 O2' G B 497 30.418 -36.697 -20.907 1.00 0.00 O ATOM 1031 C1' G B 497 30.185 -35.234 -18.914 1.00 0.00 C ATOM 1032 N9 G B 497 30.597 -35.144 -17.498 1.00 0.00 N ATOM 1033 C8 G B 497 30.050 -35.785 -16.443 1.00 0.00 C ATOM 1034 N7 G B 497 30.652 -35.490 -15.296 1.00 0.00 N ATOM 1035 C5 G B 497 31.636 -34.609 -15.657 1.00 0.00 C ATOM 1036 C6 G B 497 32.613 -33.934 -14.895 1.00 0.00 C ATOM 1037 O6 G B 497 32.758 -34.031 -13.678 1.00 0.00 O ATOM 1038 N1 G B 497 33.466 -33.109 -15.560 1.00 0.00 N ATOM 1039 C2 G B 497 33.329 -32.983 -16.899 1.00 0.00 C ATOM 1040 N2 G B 497 34.233 -32.145 -17.401 1.00 0.00 N ATOM 1041 N3 G B 497 32.442 -33.574 -17.721 1.00 0.00 N ATOM 1042 C4 G B 497 31.620 -34.383 -16.997 1.00 0.00 C ATOM 0 H5' G B 497 26.221 -35.067 -18.855 1.00 0.00 H new ATOM 0 H5'' G B 497 26.081 -36.811 -18.953 1.00 0.00 H new ATOM 0 H4' G B 497 27.644 -36.079 -20.598 1.00 0.00 H new ATOM 0 H3' G B 497 28.865 -37.534 -18.206 1.00 0.00 H new ATOM 0 H2' G B 497 31.213 -37.114 -19.091 1.00 0.00 H new ATOM 0 HO2' G B 497 29.756 -37.333 -21.251 1.00 0.00 H new ATOM 0 H1' G B 497 30.832 -34.514 -19.414 1.00 0.00 H new ATOM 0 H8 G B 497 29.214 -36.464 -16.523 1.00 0.00 H new ATOM 0 H1 G B 497 34.193 -32.597 -15.060 1.00 0.00 H new ATOM 0 H21 G B 497 34.249 -31.953 -18.403 1.00 0.00 H new ATOM 0 H22 G B 497 34.909 -31.695 -16.784 1.00 0.00 H new ATOM 1054 P U B 498 27.703 -39.472 -19.552 1.00 0.00 P ATOM 1055 OP1 U B 498 27.220 -40.271 -20.700 1.00 0.00 O ATOM 1056 OP2 U B 498 26.686 -38.905 -18.638 1.00 0.00 O ATOM 1057 O5' U B 498 28.686 -40.392 -18.688 1.00 0.00 O ATOM 1058 C5' U B 498 28.154 -41.437 -17.876 1.00 0.00 C ATOM 1059 C4' U B 498 29.057 -42.649 -17.932 1.00 0.00 C ATOM 1060 O4' U B 498 29.623 -42.735 -19.275 1.00 0.00 O ATOM 1061 C3' U B 498 30.435 -42.437 -17.312 1.00 0.00 C ATOM 1062 O3' U B 498 30.343 -42.591 -15.886 1.00 0.00 O ATOM 1063 C2' U B 498 31.314 -43.490 -17.927 1.00 0.00 C ATOM 1064 O2' U B 498 30.962 -44.648 -17.204 1.00 0.00 O ATOM 1065 C1' U B 498 30.834 -43.450 -19.374 1.00 0.00 C ATOM 1066 N1 U B 498 31.778 -42.774 -20.290 1.00 0.00 N ATOM 1067 C2 U B 498 32.158 -43.477 -21.391 1.00 0.00 C ATOM 1068 O2 U B 498 31.763 -44.605 -21.644 1.00 0.00 O ATOM 1069 N3 U B 498 33.038 -42.850 -22.245 1.00 0.00 N ATOM 1070 C4 U B 498 33.528 -41.587 -22.036 1.00 0.00 C ATOM 1071 O4 U B 498 34.309 -41.125 -22.866 1.00 0.00 O ATOM 1072 C5 U B 498 33.100 -40.896 -20.871 1.00 0.00 C ATOM 1073 C6 U B 498 32.247 -41.523 -20.057 1.00 0.00 C ATOM 0 H5' U B 498 27.154 -41.702 -18.220 1.00 0.00 H new ATOM 0 H5'' U B 498 28.056 -41.094 -16.846 1.00 0.00 H new ATOM 0 H4' U B 498 28.437 -43.437 -17.506 1.00 0.00 H new ATOM 0 H3' U B 498 30.837 -41.441 -17.498 1.00 0.00 H new ATOM 0 H2' U B 498 32.400 -43.401 -17.902 1.00 0.00 H new ATOM 0 HO2' U B 498 30.430 -44.395 -16.421 1.00 0.00 H new ATOM 0 HO3' U B 498 31.194 -42.931 -15.538 1.00 0.00 H new ATOM 0 H1' U B 498 30.734 -44.449 -19.799 1.00 0.00 H new ATOM 0 H3 U B 498 33.342 -43.353 -23.079 1.00 0.00 H new ATOM 0 H5 U B 498 33.452 -39.899 -20.651 1.00 0.00 H new ATOM 0 H6 U B 498 31.914 -41.008 -19.168 1.00 0.00 H new TER 1084 U B 498 HETATM 1085 ZN ZN A 57 36.254 -32.040 -8.517 1.00 0.00 ZN