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+ -131:sc= 1.26 (180deg=-0.324) USER MOD Set 1.2: B 495 C O2' : rot -37:sc= 1.67 USER MOD Set 1.3: B 498 U O3' : rot 26:sc= 0.205 USER MOD Set 2.1: A 19 SER OG : rot -74:sc= -0.0349 USER MOD Set 2.2: A 20 GLN : amide:sc= -0.955 K(o=-0.99,f=-3.6!) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0.2) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=-0.0031) USER MOD Single : A 25 GLN : amide:sc= -0.273 K(o=-0.27,f=-1.8) USER MOD Single : A 28 TYR OH : rot 165:sc= 0.25 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+ -173:sc= -2.41! (180deg=-2.74!) USER MOD Single : A 42 LYS NZ :NH3+ 156:sc= -0.683! (180deg=-2.27!) USER MOD Single : A 52 GLN : amide:sc= -0.003 X(o=-0.003,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 59:sc= 0.0138 USER MOD Single : B 493 A O2' : rot -31:sc= 0.452 USER MOD Single : B 494 A O2' : rot -163:sc= -2.36 USER MOD Single : B 496 A O2' : rot -22:sc= 0.334 USER MOD Single : B 497 G O2' : rot -33:sc= -0.16 USER MOD Single : B 498 U O2' : rot -44:sc= 0.321 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 59.179 -48.741 -39.329 1.00 0.00 N ATOM 2 CA ALA A 1 57.769 -48.994 -39.089 1.00 0.00 C ATOM 3 C ALA A 1 56.963 -47.740 -39.433 1.00 0.00 C ATOM 4 O ALA A 1 57.073 -46.721 -38.752 1.00 0.00 O ATOM 5 CB ALA A 1 57.570 -49.435 -37.637 1.00 0.00 C ATOM 0 H1 ALA A 1 59.729 -49.592 -39.096 1.00 0.00 H new ATOM 0 H2 ALA A 1 59.323 -48.499 -40.330 1.00 0.00 H new ATOM 0 H3 ALA A 1 59.496 -47.950 -38.733 1.00 0.00 H new ATOM 0 HA ALA A 1 57.410 -49.801 -39.728 1.00 0.00 H new ATOM 0 HB1 ALA A 1 56.512 -49.625 -37.456 1.00 0.00 H new ATOM 0 HB2 ALA A 1 58.139 -50.346 -37.452 1.00 0.00 H new ATOM 0 HB3 ALA A 1 57.917 -48.648 -36.967 1.00 0.00 H new ATOM 11 N THR A 2 56.171 -47.855 -40.489 1.00 0.00 N ATOM 12 CA THR A 2 55.348 -46.743 -40.932 1.00 0.00 C ATOM 13 C THR A 2 53.922 -47.217 -41.220 1.00 0.00 C ATOM 14 O THR A 2 53.714 -48.101 -42.051 1.00 0.00 O ATOM 15 CB THR A 2 56.031 -46.101 -42.141 1.00 0.00 C ATOM 16 OG1 THR A 2 57.124 -45.379 -41.579 1.00 0.00 O ATOM 17 CG2 THR A 2 55.168 -45.020 -42.795 1.00 0.00 C ATOM 0 H THR A 2 56.082 -48.702 -41.051 1.00 0.00 H new ATOM 0 HA THR A 2 55.254 -45.986 -40.154 1.00 0.00 H new ATOM 0 HB THR A 2 56.267 -46.871 -42.876 1.00 0.00 H new ATOM 0 HG1 THR A 2 57.623 -44.932 -42.294 1.00 0.00 H new ATOM 0 HG21 THR A 2 55.699 -44.597 -43.648 1.00 0.00 H new ATOM 0 HG22 THR A 2 54.230 -45.459 -43.134 1.00 0.00 H new ATOM 0 HG23 THR A 2 54.960 -44.233 -42.070 1.00 0.00 H new ATOM 25 N VAL A 3 52.978 -46.609 -40.519 1.00 0.00 N ATOM 26 CA VAL A 3 51.577 -46.958 -40.690 1.00 0.00 C ATOM 27 C VAL A 3 50.717 -45.708 -40.491 1.00 0.00 C ATOM 28 O VAL A 3 50.786 -45.062 -39.446 1.00 0.00 O ATOM 29 CB VAL A 3 51.202 -48.098 -39.742 1.00 0.00 C ATOM 30 CG1 VAL A 3 51.252 -47.637 -38.284 1.00 0.00 C ATOM 31 CG2 VAL A 3 49.828 -48.671 -40.090 1.00 0.00 C ATOM 0 H VAL A 3 53.154 -45.877 -39.831 1.00 0.00 H new ATOM 0 HA VAL A 3 51.395 -47.321 -41.701 1.00 0.00 H new ATOM 0 HB VAL A 3 51.937 -48.893 -39.867 1.00 0.00 H new ATOM 0 HG11 VAL A 3 50.981 -48.466 -37.631 1.00 0.00 H new ATOM 0 HG12 VAL A 3 52.260 -47.300 -38.043 1.00 0.00 H new ATOM 0 HG13 VAL A 3 50.550 -46.816 -38.138 1.00 0.00 H new ATOM 0 HG21 VAL A 3 49.586 -49.480 -39.401 1.00 0.00 H new ATOM 0 HG22 VAL A 3 49.075 -47.887 -40.008 1.00 0.00 H new ATOM 0 HG23 VAL A 3 49.842 -49.055 -41.110 1.00 0.00 H new ATOM 41 N VAL A 4 49.926 -45.404 -41.510 1.00 0.00 N ATOM 42 CA VAL A 4 49.053 -44.244 -41.461 1.00 0.00 C ATOM 43 C VAL A 4 47.928 -44.499 -40.456 1.00 0.00 C ATOM 44 O VAL A 4 47.810 -45.599 -39.917 1.00 0.00 O ATOM 45 CB VAL A 4 48.538 -43.916 -42.863 1.00 0.00 C ATOM 46 CG1 VAL A 4 49.698 -43.635 -43.821 1.00 0.00 C ATOM 47 CG2 VAL A 4 47.647 -45.039 -43.397 1.00 0.00 C ATOM 0 H VAL A 4 49.872 -45.942 -42.375 1.00 0.00 H new ATOM 0 HA VAL A 4 49.603 -43.368 -41.118 1.00 0.00 H new ATOM 0 HB VAL A 4 47.933 -43.012 -42.794 1.00 0.00 H new ATOM 0 HG11 VAL A 4 49.305 -43.405 -44.811 1.00 0.00 H new ATOM 0 HG12 VAL A 4 50.276 -42.787 -43.454 1.00 0.00 H new ATOM 0 HG13 VAL A 4 50.341 -44.513 -43.881 1.00 0.00 H new ATOM 0 HG21 VAL A 4 47.294 -44.780 -44.395 1.00 0.00 H new ATOM 0 HG22 VAL A 4 48.218 -45.966 -43.443 1.00 0.00 H new ATOM 0 HG23 VAL A 4 46.792 -45.172 -42.734 1.00 0.00 H new ATOM 57 N SER A 5 47.130 -43.465 -40.233 1.00 0.00 N ATOM 58 CA SER A 5 46.019 -43.564 -39.302 1.00 0.00 C ATOM 59 C SER A 5 45.130 -42.325 -39.415 1.00 0.00 C ATOM 60 O SER A 5 45.584 -41.269 -39.854 1.00 0.00 O ATOM 61 CB SER A 5 46.517 -43.731 -37.865 1.00 0.00 C ATOM 62 OG SER A 5 47.264 -42.601 -37.424 1.00 0.00 O ATOM 0 H SER A 5 47.231 -42.554 -40.681 1.00 0.00 H new ATOM 0 HA SER A 5 45.435 -44.447 -39.560 1.00 0.00 H new ATOM 0 HB2 SER A 5 45.666 -43.884 -37.202 1.00 0.00 H new ATOM 0 HB3 SER A 5 47.138 -44.624 -37.798 1.00 0.00 H new ATOM 0 HG SER A 5 47.563 -42.746 -36.502 1.00 0.00 H new ATOM 68 N GLY A 6 43.880 -42.493 -39.011 1.00 0.00 N ATOM 69 CA GLY A 6 42.922 -41.401 -39.062 1.00 0.00 C ATOM 70 C GLY A 6 42.776 -40.737 -37.691 1.00 0.00 C ATOM 71 O GLY A 6 43.269 -41.256 -36.690 1.00 0.00 O ATOM 0 H GLY A 6 43.508 -43.370 -38.646 1.00 0.00 H new ATOM 0 HA2 GLY A 6 43.245 -40.662 -39.795 1.00 0.00 H new ATOM 0 HA3 GLY A 6 41.954 -41.777 -39.393 1.00 0.00 H new ATOM 75 N GLN A 7 42.095 -39.601 -37.689 1.00 0.00 N ATOM 76 CA GLN A 7 41.877 -38.860 -36.457 1.00 0.00 C ATOM 77 C GLN A 7 40.665 -37.939 -36.600 1.00 0.00 C ATOM 78 O GLN A 7 40.815 -36.728 -36.751 1.00 0.00 O ATOM 79 CB GLN A 7 43.126 -38.068 -36.066 1.00 0.00 C ATOM 80 CG GLN A 7 43.027 -37.567 -34.624 1.00 0.00 C ATOM 81 CD GLN A 7 44.417 -37.351 -34.021 1.00 0.00 C ATOM 82 OE1 GLN A 7 45.104 -38.282 -33.634 1.00 0.00 O ATOM 83 NE2 GLN A 7 44.790 -36.076 -33.964 1.00 0.00 N ATOM 0 H GLN A 7 41.686 -39.175 -38.521 1.00 0.00 H new ATOM 0 HA GLN A 7 41.674 -39.572 -35.657 1.00 0.00 H new ATOM 0 HB2 GLN A 7 44.009 -38.697 -36.177 1.00 0.00 H new ATOM 0 HB3 GLN A 7 43.251 -37.222 -36.741 1.00 0.00 H new ATOM 0 HG2 GLN A 7 42.466 -36.633 -34.598 1.00 0.00 H new ATOM 0 HG3 GLN A 7 42.474 -38.288 -34.022 1.00 0.00 H new ATOM 0 HE21 GLN A 7 44.165 -35.346 -34.306 1.00 0.00 H new ATOM 0 HE22 GLN A 7 45.701 -35.828 -33.578 1.00 0.00 H new ATOM 92 N LYS A 8 39.489 -38.548 -36.547 1.00 0.00 N ATOM 93 CA LYS A 8 38.251 -37.797 -36.669 1.00 0.00 C ATOM 94 C LYS A 8 37.064 -38.741 -36.465 1.00 0.00 C ATOM 95 O LYS A 8 37.246 -39.947 -36.308 1.00 0.00 O ATOM 96 CB LYS A 8 38.212 -37.037 -37.996 1.00 0.00 C ATOM 97 CG LYS A 8 38.454 -35.542 -37.780 1.00 0.00 C ATOM 98 CD LYS A 8 37.129 -34.783 -37.670 1.00 0.00 C ATOM 99 CE LYS A 8 37.308 -33.481 -36.888 1.00 0.00 C ATOM 100 NZ LYS A 8 36.539 -33.526 -35.624 1.00 0.00 N ATOM 0 H LYS A 8 39.368 -39.553 -36.421 1.00 0.00 H new ATOM 0 HA LYS A 8 38.190 -37.035 -35.892 1.00 0.00 H new ATOM 0 HB2 LYS A 8 38.969 -37.438 -38.671 1.00 0.00 H new ATOM 0 HB3 LYS A 8 37.245 -37.187 -38.476 1.00 0.00 H new ATOM 0 HG2 LYS A 8 39.040 -35.392 -36.873 1.00 0.00 H new ATOM 0 HG3 LYS A 8 39.039 -35.141 -38.608 1.00 0.00 H new ATOM 0 HD2 LYS A 8 36.748 -34.563 -38.667 1.00 0.00 H new ATOM 0 HD3 LYS A 8 36.387 -35.409 -37.176 1.00 0.00 H new ATOM 0 HE2 LYS A 8 38.365 -33.322 -36.672 1.00 0.00 H new ATOM 0 HE3 LYS A 8 36.975 -32.638 -37.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 36.671 -32.634 -35.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 35.529 -33.656 -35.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 36.875 -34.319 -35.041 1.00 0.00 H new ATOM 114 N GLN A 9 35.876 -38.157 -36.476 1.00 0.00 N ATOM 115 CA GLN A 9 34.659 -38.931 -36.295 1.00 0.00 C ATOM 116 C GLN A 9 33.445 -38.133 -36.775 1.00 0.00 C ATOM 117 O GLN A 9 33.355 -36.930 -36.533 1.00 0.00 O ATOM 118 CB GLN A 9 34.493 -39.358 -34.836 1.00 0.00 C ATOM 119 CG GLN A 9 34.614 -40.877 -34.691 1.00 0.00 C ATOM 120 CD GLN A 9 35.473 -41.246 -33.480 1.00 0.00 C ATOM 121 OE1 GLN A 9 36.681 -41.077 -33.467 1.00 0.00 O ATOM 122 NE2 GLN A 9 34.783 -41.759 -32.464 1.00 0.00 N ATOM 0 H GLN A 9 35.729 -37.156 -36.607 1.00 0.00 H new ATOM 0 HA GLN A 9 34.735 -39.836 -36.898 1.00 0.00 H new ATOM 0 HB2 GLN A 9 35.250 -38.869 -34.222 1.00 0.00 H new ATOM 0 HB3 GLN A 9 33.522 -39.030 -34.466 1.00 0.00 H new ATOM 0 HG2 GLN A 9 33.622 -41.316 -34.585 1.00 0.00 H new ATOM 0 HG3 GLN A 9 35.054 -41.298 -35.595 1.00 0.00 H new ATOM 0 HE21 GLN A 9 33.772 -41.874 -32.540 1.00 0.00 H new ATOM 0 HE22 GLN A 9 35.265 -42.037 -31.609 1.00 0.00 H new ATOM 131 N ASP A 10 32.542 -38.834 -37.444 1.00 0.00 N ATOM 132 CA ASP A 10 31.337 -38.206 -37.958 1.00 0.00 C ATOM 133 C ASP A 10 30.202 -38.386 -36.949 1.00 0.00 C ATOM 134 O ASP A 10 29.619 -39.464 -36.851 1.00 0.00 O ATOM 135 CB ASP A 10 30.904 -38.846 -39.278 1.00 0.00 C ATOM 136 CG ASP A 10 31.382 -38.120 -40.538 1.00 0.00 C ATOM 137 OD1 ASP A 10 32.579 -37.765 -40.567 1.00 0.00 O ATOM 138 OD2 ASP A 10 30.537 -37.936 -41.441 1.00 0.00 O ATOM 0 H ASP A 10 32.621 -39.831 -37.642 1.00 0.00 H new ATOM 0 HA ASP A 10 31.551 -37.150 -38.122 1.00 0.00 H new ATOM 0 HB2 ASP A 10 31.274 -39.871 -39.306 1.00 0.00 H new ATOM 0 HB3 ASP A 10 29.815 -38.899 -39.299 1.00 0.00 H new ATOM 143 N ARG A 11 29.922 -37.313 -36.223 1.00 0.00 N ATOM 144 CA ARG A 11 28.866 -37.340 -35.225 1.00 0.00 C ATOM 145 C ARG A 11 28.752 -35.977 -34.538 1.00 0.00 C ATOM 146 O ARG A 11 27.677 -35.381 -34.512 1.00 0.00 O ATOM 147 CB ARG A 11 29.133 -38.415 -34.171 1.00 0.00 C ATOM 148 CG ARG A 11 27.843 -39.145 -33.793 1.00 0.00 C ATOM 149 CD ARG A 11 28.146 -40.444 -33.042 1.00 0.00 C ATOM 150 NE ARG A 11 27.009 -41.382 -33.173 1.00 0.00 N ATOM 151 CZ ARG A 11 26.830 -42.204 -34.215 1.00 0.00 C ATOM 152 NH1 ARG A 11 27.713 -42.210 -35.224 1.00 0.00 N ATOM 153 NH2 ARG A 11 25.769 -43.022 -34.250 1.00 0.00 N ATOM 0 H ARG A 11 30.408 -36.420 -36.306 1.00 0.00 H new ATOM 0 HA ARG A 11 27.931 -37.573 -35.735 1.00 0.00 H new ATOM 0 HB2 ARG A 11 29.861 -39.130 -34.553 1.00 0.00 H new ATOM 0 HB3 ARG A 11 29.570 -37.958 -33.283 1.00 0.00 H new ATOM 0 HG2 ARG A 11 27.224 -38.498 -33.172 1.00 0.00 H new ATOM 0 HG3 ARG A 11 27.270 -39.367 -34.693 1.00 0.00 H new ATOM 0 HD2 ARG A 11 29.052 -40.901 -33.440 1.00 0.00 H new ATOM 0 HD3 ARG A 11 28.332 -40.230 -31.990 1.00 0.00 H new ATOM 0 HE ARG A 11 26.318 -41.404 -32.423 1.00 0.00 H new ATOM 0 HH11 ARG A 11 28.521 -41.588 -35.198 1.00 0.00 H new ATOM 0 HH12 ARG A 11 27.576 -42.836 -36.017 1.00 0.00 H new ATOM 0 HH21 ARG A 11 25.097 -43.019 -33.483 1.00 0.00 H new ATOM 0 HH22 ARG A 11 25.633 -43.648 -35.044 1.00 0.00 H new ATOM 167 N GLN A 12 29.875 -35.527 -33.998 1.00 0.00 N ATOM 168 CA GLN A 12 29.914 -34.246 -33.312 1.00 0.00 C ATOM 169 C GLN A 12 29.036 -34.288 -32.059 1.00 0.00 C ATOM 170 O GLN A 12 27.915 -34.793 -32.100 1.00 0.00 O ATOM 171 CB GLN A 12 29.484 -33.112 -34.245 1.00 0.00 C ATOM 172 CG GLN A 12 30.692 -32.509 -34.967 1.00 0.00 C ATOM 173 CD GLN A 12 30.381 -32.269 -36.446 1.00 0.00 C ATOM 174 OE1 GLN A 12 29.398 -31.642 -36.806 1.00 0.00 O ATOM 175 NE2 GLN A 12 31.272 -32.799 -37.279 1.00 0.00 N ATOM 0 H GLN A 12 30.764 -36.026 -34.021 1.00 0.00 H new ATOM 0 HA GLN A 12 30.942 -34.051 -33.005 1.00 0.00 H new ATOM 0 HB2 GLN A 12 28.769 -33.489 -34.977 1.00 0.00 H new ATOM 0 HB3 GLN A 12 28.975 -32.338 -33.672 1.00 0.00 H new ATOM 0 HG2 GLN A 12 30.972 -31.568 -34.493 1.00 0.00 H new ATOM 0 HG3 GLN A 12 31.547 -33.179 -34.875 1.00 0.00 H new ATOM 0 HE21 GLN A 12 32.073 -33.312 -36.910 1.00 0.00 H new ATOM 0 HE22 GLN A 12 31.155 -32.692 -38.287 1.00 0.00 H new ATOM 184 N GLY A 13 29.580 -33.752 -30.977 1.00 0.00 N ATOM 185 CA GLY A 13 28.860 -33.721 -29.715 1.00 0.00 C ATOM 186 C GLY A 13 27.631 -32.814 -29.806 1.00 0.00 C ATOM 187 O GLY A 13 27.748 -31.637 -30.143 1.00 0.00 O ATOM 0 H GLY A 13 30.511 -33.336 -30.948 1.00 0.00 H new ATOM 0 HA2 GLY A 13 28.552 -34.731 -29.443 1.00 0.00 H new ATOM 0 HA3 GLY A 13 29.521 -33.366 -28.924 1.00 0.00 H new ATOM 191 N GLY A 14 26.481 -33.396 -29.499 1.00 0.00 N ATOM 192 CA GLY A 14 25.232 -32.655 -29.542 1.00 0.00 C ATOM 193 C GLY A 14 25.373 -31.303 -28.839 1.00 0.00 C ATOM 194 O GLY A 14 26.118 -31.179 -27.868 1.00 0.00 O ATOM 0 H GLY A 14 26.388 -34.373 -29.219 1.00 0.00 H new ATOM 0 HA2 GLY A 14 24.932 -32.501 -30.578 1.00 0.00 H new ATOM 0 HA3 GLY A 14 24.443 -33.237 -29.065 1.00 0.00 H new ATOM 198 N GLU A 15 24.644 -30.324 -29.356 1.00 0.00 N ATOM 199 CA GLU A 15 24.678 -28.987 -28.791 1.00 0.00 C ATOM 200 C GLU A 15 23.938 -28.958 -27.452 1.00 0.00 C ATOM 201 O GLU A 15 22.794 -29.400 -27.361 1.00 0.00 O ATOM 202 CB GLU A 15 24.089 -27.965 -29.765 1.00 0.00 C ATOM 203 CG GLU A 15 24.968 -26.715 -29.847 1.00 0.00 C ATOM 204 CD GLU A 15 25.458 -26.483 -31.278 1.00 0.00 C ATOM 205 OE1 GLU A 15 26.612 -26.021 -31.414 1.00 0.00 O ATOM 206 OE2 GLU A 15 24.668 -26.771 -32.202 1.00 0.00 O ATOM 0 H GLU A 15 24.026 -30.431 -30.161 1.00 0.00 H new ATOM 0 HA GLU A 15 25.719 -28.714 -28.615 1.00 0.00 H new ATOM 0 HB2 GLU A 15 23.994 -28.413 -30.754 1.00 0.00 H new ATOM 0 HB3 GLU A 15 23.085 -27.687 -29.443 1.00 0.00 H new ATOM 0 HG2 GLU A 15 24.404 -25.847 -29.506 1.00 0.00 H new ATOM 0 HG3 GLU A 15 25.823 -26.822 -29.179 1.00 0.00 H new ATOM 213 N ARG A 16 24.622 -28.434 -26.445 1.00 0.00 N ATOM 214 CA ARG A 16 24.043 -28.341 -25.116 1.00 0.00 C ATOM 215 C ARG A 16 24.564 -27.095 -24.396 1.00 0.00 C ATOM 216 O ARG A 16 25.557 -26.503 -24.813 1.00 0.00 O ATOM 217 CB ARG A 16 24.379 -29.580 -24.282 1.00 0.00 C ATOM 218 CG ARG A 16 23.266 -30.624 -24.380 1.00 0.00 C ATOM 219 CD ARG A 16 22.527 -30.764 -23.047 1.00 0.00 C ATOM 220 NE ARG A 16 21.306 -31.581 -23.230 1.00 0.00 N ATOM 221 CZ ARG A 16 20.124 -31.088 -23.626 1.00 0.00 C ATOM 222 NH1 ARG A 16 19.998 -29.779 -23.884 1.00 0.00 N ATOM 223 NH2 ARG A 16 19.070 -31.902 -23.764 1.00 0.00 N ATOM 0 H ARG A 16 25.572 -28.070 -26.523 1.00 0.00 H new ATOM 0 HA ARG A 16 22.961 -28.274 -25.229 1.00 0.00 H new ATOM 0 HB2 ARG A 16 25.319 -30.011 -24.627 1.00 0.00 H new ATOM 0 HB3 ARG A 16 24.523 -29.294 -23.240 1.00 0.00 H new ATOM 0 HG2 ARG A 16 22.562 -30.338 -25.162 1.00 0.00 H new ATOM 0 HG3 ARG A 16 23.689 -31.586 -24.668 1.00 0.00 H new ATOM 0 HD2 ARG A 16 23.179 -31.229 -22.307 1.00 0.00 H new ATOM 0 HD3 ARG A 16 22.262 -29.779 -22.663 1.00 0.00 H new ATOM 0 HE ARG A 16 21.368 -32.582 -23.043 1.00 0.00 H new ATOM 0 HH11 ARG A 16 20.801 -29.159 -23.779 1.00 0.00 H new ATOM 0 HH12 ARG A 16 19.099 -29.403 -24.185 1.00 0.00 H new ATOM 0 HH21 ARG A 16 19.166 -32.898 -23.568 1.00 0.00 H new ATOM 0 HH22 ARG A 16 18.171 -31.526 -24.065 1.00 0.00 H new ATOM 237 N ARG A 17 23.868 -26.734 -23.329 1.00 0.00 N ATOM 238 CA ARG A 17 24.247 -25.569 -22.547 1.00 0.00 C ATOM 239 C ARG A 17 24.498 -25.965 -21.091 1.00 0.00 C ATOM 240 O ARG A 17 23.572 -25.994 -20.282 1.00 0.00 O ATOM 241 CB ARG A 17 23.157 -24.495 -22.595 1.00 0.00 C ATOM 242 CG ARG A 17 23.317 -23.607 -23.830 1.00 0.00 C ATOM 243 CD ARG A 17 24.485 -22.633 -23.658 1.00 0.00 C ATOM 244 NE ARG A 17 24.168 -21.646 -22.601 1.00 0.00 N ATOM 245 CZ ARG A 17 25.027 -20.716 -22.162 1.00 0.00 C ATOM 246 NH1 ARG A 17 26.258 -20.640 -22.685 1.00 0.00 N ATOM 247 NH2 ARG A 17 24.653 -19.862 -21.199 1.00 0.00 N ATOM 0 H ARG A 17 23.043 -27.227 -22.987 1.00 0.00 H new ATOM 0 HA ARG A 17 25.161 -25.163 -22.980 1.00 0.00 H new ATOM 0 HB2 ARG A 17 22.175 -24.968 -22.608 1.00 0.00 H new ATOM 0 HB3 ARG A 17 23.204 -23.883 -21.694 1.00 0.00 H new ATOM 0 HG2 ARG A 17 23.484 -24.228 -24.710 1.00 0.00 H new ATOM 0 HG3 ARG A 17 22.396 -23.050 -24.003 1.00 0.00 H new ATOM 0 HD2 ARG A 17 25.391 -23.180 -23.396 1.00 0.00 H new ATOM 0 HD3 ARG A 17 24.683 -22.120 -24.599 1.00 0.00 H new ATOM 0 HE ARG A 17 23.239 -21.676 -22.181 1.00 0.00 H new ATOM 0 HH11 ARG A 17 26.542 -21.290 -23.418 1.00 0.00 H new ATOM 0 HH12 ARG A 17 26.911 -19.932 -22.350 1.00 0.00 H new ATOM 0 HH21 ARG A 17 23.716 -19.921 -20.801 1.00 0.00 H new ATOM 0 HH22 ARG A 17 25.306 -19.154 -20.864 1.00 0.00 H new ATOM 261 N ARG A 18 25.757 -26.262 -20.801 1.00 0.00 N ATOM 262 CA ARG A 18 26.142 -26.655 -19.457 1.00 0.00 C ATOM 263 C ARG A 18 27.285 -25.772 -18.952 1.00 0.00 C ATOM 264 O ARG A 18 28.409 -26.242 -18.781 1.00 0.00 O ATOM 265 CB ARG A 18 26.583 -28.119 -19.416 1.00 0.00 C ATOM 266 CG ARG A 18 25.382 -29.057 -19.558 1.00 0.00 C ATOM 267 CD ARG A 18 24.926 -29.574 -18.193 1.00 0.00 C ATOM 268 NE ARG A 18 23.653 -28.926 -17.805 1.00 0.00 N ATOM 269 CZ ARG A 18 22.449 -29.305 -18.254 1.00 0.00 C ATOM 270 NH1 ARG A 18 22.346 -30.332 -19.110 1.00 0.00 N ATOM 271 NH2 ARG A 18 21.348 -28.659 -17.848 1.00 0.00 N ATOM 0 H ARG A 18 26.523 -26.238 -21.474 1.00 0.00 H new ATOM 0 HA ARG A 18 25.271 -26.531 -18.814 1.00 0.00 H new ATOM 0 HB2 ARG A 18 27.296 -28.311 -20.218 1.00 0.00 H new ATOM 0 HB3 ARG A 18 27.098 -28.321 -18.477 1.00 0.00 H new ATOM 0 HG2 ARG A 18 24.561 -28.531 -20.044 1.00 0.00 H new ATOM 0 HG3 ARG A 18 25.646 -29.898 -20.199 1.00 0.00 H new ATOM 0 HD2 ARG A 18 24.797 -30.656 -18.229 1.00 0.00 H new ATOM 0 HD3 ARG A 18 25.691 -29.370 -17.444 1.00 0.00 H new ATOM 0 HE ARG A 18 23.695 -28.141 -17.155 1.00 0.00 H new ATOM 0 HH11 ARG A 18 23.184 -30.824 -19.419 1.00 0.00 H new ATOM 0 HH12 ARG A 18 21.430 -30.621 -19.452 1.00 0.00 H new ATOM 0 HH21 ARG A 18 21.426 -27.878 -17.197 1.00 0.00 H new ATOM 0 HH22 ARG A 18 20.432 -28.948 -18.190 1.00 0.00 H new ATOM 285 N SER A 19 26.960 -24.507 -18.729 1.00 0.00 N ATOM 286 CA SER A 19 27.946 -23.554 -18.247 1.00 0.00 C ATOM 287 C SER A 19 29.292 -23.804 -18.930 1.00 0.00 C ATOM 288 O SER A 19 29.338 -24.278 -20.064 1.00 0.00 O ATOM 289 CB SER A 19 28.097 -23.639 -16.728 1.00 0.00 C ATOM 290 OG SER A 19 28.244 -22.351 -16.134 1.00 0.00 O ATOM 0 H SER A 19 26.028 -24.120 -18.873 1.00 0.00 H new ATOM 0 HA SER A 19 27.601 -22.550 -18.494 1.00 0.00 H new ATOM 0 HB2 SER A 19 27.225 -24.137 -16.304 1.00 0.00 H new ATOM 0 HB3 SER A 19 28.964 -24.252 -16.483 1.00 0.00 H new ATOM 0 HG SER A 19 29.144 -22.008 -16.315 1.00 0.00 H new ATOM 296 N GLN A 20 30.354 -23.475 -18.211 1.00 0.00 N ATOM 297 CA GLN A 20 31.698 -23.658 -18.732 1.00 0.00 C ATOM 298 C GLN A 20 32.234 -25.039 -18.347 1.00 0.00 C ATOM 299 O GLN A 20 33.435 -25.208 -18.149 1.00 0.00 O ATOM 300 CB GLN A 20 32.632 -22.550 -18.242 1.00 0.00 C ATOM 301 CG GLN A 20 32.837 -22.637 -16.728 1.00 0.00 C ATOM 302 CD GLN A 20 31.815 -21.773 -15.986 1.00 0.00 C ATOM 303 OE1 GLN A 20 31.095 -20.980 -16.569 1.00 0.00 O ATOM 304 NE2 GLN A 20 31.794 -21.969 -14.671 1.00 0.00 N ATOM 0 H GLN A 20 30.311 -23.082 -17.271 1.00 0.00 H new ATOM 0 HA GLN A 20 31.656 -23.597 -19.819 1.00 0.00 H new ATOM 0 HB2 GLN A 20 33.594 -22.630 -18.748 1.00 0.00 H new ATOM 0 HB3 GLN A 20 32.215 -21.577 -18.501 1.00 0.00 H new ATOM 0 HG2 GLN A 20 32.746 -23.674 -16.404 1.00 0.00 H new ATOM 0 HG3 GLN A 20 33.846 -22.312 -16.475 1.00 0.00 H new ATOM 0 HE21 GLN A 20 32.425 -22.649 -14.247 1.00 0.00 H new ATOM 0 HE22 GLN A 20 31.147 -21.439 -14.087 1.00 0.00 H new ATOM 313 N LEU A 21 31.316 -25.989 -18.254 1.00 0.00 N ATOM 314 CA LEU A 21 31.680 -27.349 -17.895 1.00 0.00 C ATOM 315 C LEU A 21 32.550 -27.947 -19.003 1.00 0.00 C ATOM 316 O LEU A 21 32.052 -28.662 -19.871 1.00 0.00 O ATOM 317 CB LEU A 21 30.431 -28.175 -17.582 1.00 0.00 C ATOM 318 CG LEU A 21 30.609 -29.302 -16.563 1.00 0.00 C ATOM 319 CD1 LEU A 21 29.879 -30.569 -17.013 1.00 0.00 C ATOM 320 CD2 LEU A 21 32.092 -29.562 -16.288 1.00 0.00 C ATOM 0 H LEU A 21 30.320 -25.844 -18.421 1.00 0.00 H new ATOM 0 HA LEU A 21 32.274 -27.355 -16.981 1.00 0.00 H new ATOM 0 HB2 LEU A 21 29.656 -27.501 -17.217 1.00 0.00 H new ATOM 0 HB3 LEU A 21 30.064 -28.608 -18.512 1.00 0.00 H new ATOM 0 HG LEU A 21 30.157 -28.987 -15.623 1.00 0.00 H new ATOM 0 HD11 LEU A 21 30.022 -31.354 -16.271 1.00 0.00 H new ATOM 0 HD12 LEU A 21 28.815 -30.358 -17.118 1.00 0.00 H new ATOM 0 HD13 LEU A 21 30.280 -30.899 -17.972 1.00 0.00 H new ATOM 0 HD21 LEU A 21 32.191 -30.368 -15.560 1.00 0.00 H new ATOM 0 HD22 LEU A 21 32.589 -29.847 -17.215 1.00 0.00 H new ATOM 0 HD23 LEU A 21 32.553 -28.657 -15.892 1.00 0.00 H new ATOM 332 N ASP A 22 33.836 -27.634 -18.936 1.00 0.00 N ATOM 333 CA ASP A 22 34.780 -28.131 -19.922 1.00 0.00 C ATOM 334 C ASP A 22 34.798 -29.661 -19.878 1.00 0.00 C ATOM 335 O ASP A 22 34.426 -30.261 -18.871 1.00 0.00 O ATOM 336 CB ASP A 22 36.197 -27.633 -19.629 1.00 0.00 C ATOM 337 CG ASP A 22 36.960 -27.102 -20.844 1.00 0.00 C ATOM 338 OD1 ASP A 22 36.567 -27.479 -21.970 1.00 0.00 O ATOM 339 OD2 ASP A 22 37.919 -26.333 -20.619 1.00 0.00 O ATOM 0 H ASP A 22 34.246 -27.042 -18.214 1.00 0.00 H new ATOM 0 HA ASP A 22 34.466 -27.769 -20.901 1.00 0.00 H new ATOM 0 HB2 ASP A 22 36.141 -26.843 -18.880 1.00 0.00 H new ATOM 0 HB3 ASP A 22 36.769 -28.449 -19.188 1.00 0.00 H new ATOM 344 N ARG A 23 35.235 -30.248 -20.983 1.00 0.00 N ATOM 345 CA ARG A 23 35.306 -31.695 -21.083 1.00 0.00 C ATOM 346 C ARG A 23 36.370 -32.242 -20.128 1.00 0.00 C ATOM 347 O ARG A 23 36.484 -33.453 -19.950 1.00 0.00 O ATOM 348 CB ARG A 23 35.640 -32.133 -22.511 1.00 0.00 C ATOM 349 CG ARG A 23 34.378 -32.196 -23.374 1.00 0.00 C ATOM 350 CD ARG A 23 33.415 -33.268 -22.859 1.00 0.00 C ATOM 351 NE ARG A 23 33.352 -34.394 -23.818 1.00 0.00 N ATOM 352 CZ ARG A 23 32.455 -35.388 -23.751 1.00 0.00 C ATOM 353 NH1 ARG A 23 31.541 -35.401 -22.771 1.00 0.00 N ATOM 354 NH2 ARG A 23 32.472 -36.369 -24.664 1.00 0.00 N ATOM 0 H ARG A 23 35.543 -29.747 -21.816 1.00 0.00 H new ATOM 0 HA ARG A 23 34.329 -32.094 -20.811 1.00 0.00 H new ATOM 0 HB2 ARG A 23 36.352 -31.436 -22.952 1.00 0.00 H new ATOM 0 HB3 ARG A 23 36.121 -33.111 -22.492 1.00 0.00 H new ATOM 0 HG2 ARG A 23 33.882 -31.225 -23.371 1.00 0.00 H new ATOM 0 HG3 ARG A 23 34.650 -32.412 -24.407 1.00 0.00 H new ATOM 0 HD2 ARG A 23 33.745 -33.627 -21.884 1.00 0.00 H new ATOM 0 HD3 ARG A 23 32.422 -32.841 -22.721 1.00 0.00 H new ATOM 0 HE ARG A 23 34.033 -34.415 -24.577 1.00 0.00 H new ATOM 0 HH11 ARG A 23 31.528 -34.655 -22.076 1.00 0.00 H new ATOM 0 HH12 ARG A 23 30.859 -36.157 -22.720 1.00 0.00 H new ATOM 0 HH21 ARG A 23 33.168 -36.359 -25.410 1.00 0.00 H new ATOM 0 HH22 ARG A 23 31.789 -37.125 -24.613 1.00 0.00 H new ATOM 368 N ASP A 24 37.120 -31.321 -19.540 1.00 0.00 N ATOM 369 CA ASP A 24 38.169 -31.696 -18.608 1.00 0.00 C ATOM 370 C ASP A 24 38.012 -30.889 -17.318 1.00 0.00 C ATOM 371 O ASP A 24 38.980 -30.684 -16.587 1.00 0.00 O ATOM 372 CB ASP A 24 39.554 -31.395 -19.188 1.00 0.00 C ATOM 373 CG ASP A 24 40.405 -32.628 -19.499 1.00 0.00 C ATOM 374 OD1 ASP A 24 39.799 -33.665 -19.840 1.00 0.00 O ATOM 375 OD2 ASP A 24 41.644 -32.503 -19.389 1.00 0.00 O ATOM 0 H ASP A 24 37.022 -30.317 -19.691 1.00 0.00 H new ATOM 0 HA ASP A 24 38.082 -32.765 -18.415 1.00 0.00 H new ATOM 0 HB2 ASP A 24 39.430 -30.817 -20.104 1.00 0.00 H new ATOM 0 HB3 ASP A 24 40.097 -30.765 -18.484 1.00 0.00 H new ATOM 380 N GLN A 25 36.784 -30.453 -17.077 1.00 0.00 N ATOM 381 CA GLN A 25 36.487 -29.672 -15.888 1.00 0.00 C ATOM 382 C GLN A 25 35.567 -30.460 -14.952 1.00 0.00 C ATOM 383 O GLN A 25 34.470 -30.857 -15.343 1.00 0.00 O ATOM 384 CB GLN A 25 35.868 -28.324 -16.257 1.00 0.00 C ATOM 385 CG GLN A 25 36.319 -27.229 -15.289 1.00 0.00 C ATOM 386 CD GLN A 25 35.144 -26.716 -14.454 1.00 0.00 C ATOM 387 OE1 GLN A 25 34.272 -27.462 -14.039 1.00 0.00 O ATOM 388 NE2 GLN A 25 35.170 -25.406 -14.230 1.00 0.00 N ATOM 0 H GLN A 25 35.983 -30.626 -17.685 1.00 0.00 H new ATOM 0 HA GLN A 25 37.422 -29.473 -15.365 1.00 0.00 H new ATOM 0 HB2 GLN A 25 36.154 -28.055 -17.274 1.00 0.00 H new ATOM 0 HB3 GLN A 25 34.781 -28.403 -16.241 1.00 0.00 H new ATOM 0 HG2 GLN A 25 37.095 -27.618 -14.630 1.00 0.00 H new ATOM 0 HG3 GLN A 25 36.760 -26.404 -15.848 1.00 0.00 H new ATOM 0 HE21 GLN A 25 35.930 -24.839 -14.607 1.00 0.00 H new ATOM 0 HE22 GLN A 25 34.430 -24.968 -13.681 1.00 0.00 H new ATOM 397 N CYS A 26 36.048 -30.663 -13.735 1.00 0.00 N ATOM 398 CA CYS A 26 35.283 -31.396 -12.741 1.00 0.00 C ATOM 399 C CYS A 26 33.908 -30.737 -12.610 1.00 0.00 C ATOM 400 O CYS A 26 33.813 -29.524 -12.422 1.00 0.00 O ATOM 401 CB CYS A 26 36.014 -31.461 -11.398 1.00 0.00 C ATOM 402 SG CYS A 26 34.958 -32.283 -10.149 1.00 0.00 S ATOM 0 H CYS A 26 36.958 -30.333 -13.414 1.00 0.00 H new ATOM 0 HA CYS A 26 35.161 -32.430 -13.064 1.00 0.00 H new ATOM 0 HB2 CYS A 26 36.951 -32.007 -11.511 1.00 0.00 H new ATOM 0 HB3 CYS A 26 36.270 -30.455 -11.065 1.00 0.00 H new ATOM 407 N ALA A 27 32.878 -31.563 -12.715 1.00 0.00 N ATOM 408 CA ALA A 27 31.513 -31.075 -12.611 1.00 0.00 C ATOM 409 C ALA A 27 30.992 -31.328 -11.195 1.00 0.00 C ATOM 410 O ALA A 27 29.815 -31.633 -11.008 1.00 0.00 O ATOM 411 CB ALA A 27 30.648 -31.747 -13.679 1.00 0.00 C ATOM 0 H ALA A 27 32.961 -32.568 -12.871 1.00 0.00 H new ATOM 0 HA ALA A 27 31.475 -30.000 -12.789 1.00 0.00 H new ATOM 0 HB1 ALA A 27 29.624 -31.381 -13.601 1.00 0.00 H new ATOM 0 HB2 ALA A 27 31.043 -31.513 -14.668 1.00 0.00 H new ATOM 0 HB3 ALA A 27 30.660 -32.827 -13.530 1.00 0.00 H new ATOM 417 N TYR A 28 31.894 -31.193 -10.234 1.00 0.00 N ATOM 418 CA TYR A 28 31.540 -31.403 -8.840 1.00 0.00 C ATOM 419 C TYR A 28 32.037 -30.248 -7.968 1.00 0.00 C ATOM 420 O TYR A 28 31.261 -29.648 -7.225 1.00 0.00 O ATOM 421 CB TYR A 28 32.250 -32.690 -8.415 1.00 0.00 C ATOM 422 CG TYR A 28 31.589 -33.403 -7.233 1.00 0.00 C ATOM 423 CD1 TYR A 28 30.409 -34.096 -7.417 1.00 0.00 C ATOM 424 CD2 TYR A 28 32.173 -33.354 -5.984 1.00 0.00 C ATOM 425 CE1 TYR A 28 29.787 -34.767 -6.305 1.00 0.00 C ATOM 426 CE2 TYR A 28 31.552 -34.025 -4.871 1.00 0.00 C ATOM 427 CZ TYR A 28 30.390 -34.699 -5.087 1.00 0.00 C ATOM 428 OH TYR A 28 29.803 -35.332 -4.037 1.00 0.00 O ATOM 0 H TYR A 28 32.869 -30.941 -10.393 1.00 0.00 H new ATOM 0 HA TYR A 28 30.458 -31.464 -8.723 1.00 0.00 H new ATOM 0 HB2 TYR A 28 32.284 -33.372 -9.265 1.00 0.00 H new ATOM 0 HB3 TYR A 28 33.282 -32.455 -8.154 1.00 0.00 H new ATOM 0 HD1 TYR A 28 29.952 -34.135 -8.395 1.00 0.00 H new ATOM 0 HD2 TYR A 28 33.096 -32.812 -5.841 1.00 0.00 H new ATOM 0 HE1 TYR A 28 28.863 -35.312 -6.435 1.00 0.00 H new ATOM 0 HE2 TYR A 28 31.998 -33.994 -3.888 1.00 0.00 H new ATOM 0 HH TYR A 28 30.444 -35.406 -3.300 1.00 0.00 H new ATOM 438 N CYS A 29 33.327 -29.971 -8.087 1.00 0.00 N ATOM 439 CA CYS A 29 33.937 -28.900 -7.319 1.00 0.00 C ATOM 440 C CYS A 29 34.259 -27.748 -8.273 1.00 0.00 C ATOM 441 O CYS A 29 34.463 -26.615 -7.839 1.00 0.00 O ATOM 442 CB CYS A 29 35.177 -29.380 -6.564 1.00 0.00 C ATOM 443 SG CYS A 29 36.469 -29.901 -7.751 1.00 0.00 S ATOM 0 H CYS A 29 33.967 -30.471 -8.705 1.00 0.00 H new ATOM 0 HA CYS A 29 33.240 -28.554 -6.556 1.00 0.00 H new ATOM 0 HB2 CYS A 29 35.557 -28.581 -5.927 1.00 0.00 H new ATOM 0 HB3 CYS A 29 34.915 -30.212 -5.910 1.00 0.00 H new ATOM 448 N LYS A 30 34.296 -28.078 -9.556 1.00 0.00 N ATOM 449 CA LYS A 30 34.591 -27.085 -10.576 1.00 0.00 C ATOM 450 C LYS A 30 36.104 -27.002 -10.779 1.00 0.00 C ATOM 451 O LYS A 30 36.615 -25.994 -11.263 1.00 0.00 O ATOM 452 CB LYS A 30 33.944 -25.744 -10.221 1.00 0.00 C ATOM 453 CG LYS A 30 32.559 -25.949 -9.604 1.00 0.00 C ATOM 454 CD LYS A 30 31.512 -25.080 -10.303 1.00 0.00 C ATOM 455 CE LYS A 30 30.407 -25.942 -10.918 1.00 0.00 C ATOM 456 NZ LYS A 30 29.188 -25.135 -11.145 1.00 0.00 N ATOM 0 H LYS A 30 34.127 -29.019 -9.913 1.00 0.00 H new ATOM 0 HA LYS A 30 34.157 -27.380 -11.531 1.00 0.00 H new ATOM 0 HB2 LYS A 30 34.581 -25.203 -9.521 1.00 0.00 H new ATOM 0 HB3 LYS A 30 33.859 -25.129 -11.117 1.00 0.00 H new ATOM 0 HG2 LYS A 30 32.275 -26.999 -9.680 1.00 0.00 H new ATOM 0 HG3 LYS A 30 32.590 -25.704 -8.542 1.00 0.00 H new ATOM 0 HD2 LYS A 30 31.078 -24.381 -9.588 1.00 0.00 H new ATOM 0 HD3 LYS A 30 31.989 -24.484 -11.081 1.00 0.00 H new ATOM 0 HE2 LYS A 30 30.751 -26.366 -11.861 1.00 0.00 H new ATOM 0 HE3 LYS A 30 30.179 -26.778 -10.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 28.448 -25.734 -11.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 28.852 -24.751 -10.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 29.406 -24.352 -11.793 1.00 0.00 H new ATOM 470 N GLU A 31 36.779 -28.078 -10.399 1.00 0.00 N ATOM 471 CA GLU A 31 38.224 -28.139 -10.534 1.00 0.00 C ATOM 472 C GLU A 31 38.606 -28.665 -11.919 1.00 0.00 C ATOM 473 O GLU A 31 38.199 -29.760 -12.306 1.00 0.00 O ATOM 474 CB GLU A 31 38.841 -29.001 -9.432 1.00 0.00 C ATOM 475 CG GLU A 31 40.364 -29.061 -9.569 1.00 0.00 C ATOM 476 CD GLU A 31 41.044 -28.936 -8.204 1.00 0.00 C ATOM 477 OE1 GLU A 31 41.237 -27.779 -7.771 1.00 0.00 O ATOM 478 OE2 GLU A 31 41.355 -29.998 -7.625 1.00 0.00 O ATOM 0 H GLU A 31 36.352 -28.913 -9.998 1.00 0.00 H new ATOM 0 HA GLU A 31 38.622 -27.130 -10.427 1.00 0.00 H new ATOM 0 HB2 GLU A 31 38.576 -28.594 -8.456 1.00 0.00 H new ATOM 0 HB3 GLU A 31 38.428 -30.009 -9.480 1.00 0.00 H new ATOM 0 HG2 GLU A 31 40.653 -30.001 -10.038 1.00 0.00 H new ATOM 0 HG3 GLU A 31 40.705 -28.259 -10.224 1.00 0.00 H new ATOM 485 N LYS A 32 39.383 -27.860 -12.630 1.00 0.00 N ATOM 486 CA LYS A 32 39.825 -28.231 -13.963 1.00 0.00 C ATOM 487 C LYS A 32 41.090 -29.086 -13.859 1.00 0.00 C ATOM 488 O LYS A 32 42.094 -28.648 -13.299 1.00 0.00 O ATOM 489 CB LYS A 32 39.994 -26.987 -14.837 1.00 0.00 C ATOM 490 CG LYS A 32 41.172 -26.135 -14.356 1.00 0.00 C ATOM 491 CD LYS A 32 40.760 -24.672 -14.193 1.00 0.00 C ATOM 492 CE LYS A 32 40.537 -24.326 -12.718 1.00 0.00 C ATOM 493 NZ LYS A 32 40.482 -22.860 -12.532 1.00 0.00 N ATOM 0 H LYS A 32 39.718 -26.952 -12.307 1.00 0.00 H new ATOM 0 HA LYS A 32 39.069 -28.840 -14.458 1.00 0.00 H new ATOM 0 HB2 LYS A 32 40.155 -27.285 -15.873 1.00 0.00 H new ATOM 0 HB3 LYS A 32 39.079 -26.395 -14.814 1.00 0.00 H new ATOM 0 HG2 LYS A 32 41.540 -26.521 -13.405 1.00 0.00 H new ATOM 0 HG3 LYS A 32 41.993 -26.208 -15.069 1.00 0.00 H new ATOM 0 HD2 LYS A 32 41.532 -24.025 -14.609 1.00 0.00 H new ATOM 0 HD3 LYS A 32 39.847 -24.483 -14.757 1.00 0.00 H new ATOM 0 HE2 LYS A 32 39.609 -24.778 -12.369 1.00 0.00 H new ATOM 0 HE3 LYS A 32 41.342 -24.745 -12.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 40.330 -22.643 -11.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 41.378 -22.436 -12.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 39.699 -22.468 -13.093 1.00 0.00 H new ATOM 507 N GLY A 33 40.999 -30.289 -14.405 1.00 0.00 N ATOM 508 CA GLY A 33 42.124 -31.209 -14.379 1.00 0.00 C ATOM 509 C GLY A 33 41.659 -32.635 -14.081 1.00 0.00 C ATOM 510 O GLY A 33 42.106 -33.585 -14.723 1.00 0.00 O ATOM 0 H GLY A 33 40.164 -30.648 -14.868 1.00 0.00 H new ATOM 0 HA2 GLY A 33 42.641 -31.184 -15.338 1.00 0.00 H new ATOM 0 HA3 GLY A 33 42.841 -30.891 -13.622 1.00 0.00 H new ATOM 514 N HIS A 34 40.767 -32.742 -13.107 1.00 0.00 N ATOM 515 CA HIS A 34 40.237 -34.037 -12.716 1.00 0.00 C ATOM 516 C HIS A 34 38.736 -34.086 -13.007 1.00 0.00 C ATOM 517 O HIS A 34 38.079 -33.048 -13.076 1.00 0.00 O ATOM 518 CB HIS A 34 40.567 -34.340 -11.253 1.00 0.00 C ATOM 519 CG HIS A 34 39.777 -33.519 -10.262 1.00 0.00 C ATOM 520 ND1 HIS A 34 40.338 -32.494 -9.521 1.00 0.00 N ATOM 521 CD2 HIS A 34 38.463 -33.582 -9.900 1.00 0.00 C ATOM 522 CE1 HIS A 34 39.397 -31.971 -8.750 1.00 0.00 C ATOM 523 NE2 HIS A 34 38.235 -32.647 -8.985 1.00 0.00 N ATOM 0 H HIS A 34 40.398 -31.953 -12.577 1.00 0.00 H new ATOM 0 HA HIS A 34 40.712 -34.821 -13.305 1.00 0.00 H new ATOM 0 HB2 HIS A 34 40.383 -35.397 -11.061 1.00 0.00 H new ATOM 0 HB3 HIS A 34 41.630 -34.166 -11.088 1.00 0.00 H new ATOM 0 HD1 HIS A 34 41.312 -32.192 -9.562 1.00 0.00 H new ATOM 0 HD2 HIS A 34 37.732 -34.275 -10.291 1.00 0.00 H new ATOM 0 HE1 HIS A 34 39.526 -31.153 -8.057 1.00 0.00 H new ATOM 531 N TRP A 35 38.237 -35.302 -13.171 1.00 0.00 N ATOM 532 CA TRP A 35 36.826 -35.500 -13.453 1.00 0.00 C ATOM 533 C TRP A 35 36.091 -35.643 -12.118 1.00 0.00 C ATOM 534 O TRP A 35 36.698 -35.989 -11.106 1.00 0.00 O ATOM 535 CB TRP A 35 36.614 -36.698 -14.382 1.00 0.00 C ATOM 536 CG TRP A 35 36.542 -36.329 -15.865 1.00 0.00 C ATOM 537 CD1 TRP A 35 37.269 -35.416 -16.525 1.00 0.00 C ATOM 538 CD2 TRP A 35 35.661 -36.905 -16.852 1.00 0.00 C ATOM 539 NE1 TRP A 35 36.922 -35.364 -17.860 1.00 0.00 N ATOM 540 CE2 TRP A 35 35.913 -36.297 -18.065 1.00 0.00 C ATOM 541 CE3 TRP A 35 34.683 -37.908 -16.725 1.00 0.00 C ATOM 542 CZ2 TRP A 35 35.228 -36.623 -19.242 1.00 0.00 C ATOM 543 CZ3 TRP A 35 34.008 -38.221 -17.910 1.00 0.00 C ATOM 544 CH2 TRP A 35 34.250 -37.619 -19.139 1.00 0.00 C ATOM 0 H TRP A 35 38.785 -36.160 -13.114 1.00 0.00 H new ATOM 0 HA TRP A 35 36.417 -34.642 -13.986 1.00 0.00 H new ATOM 0 HB2 TRP A 35 37.427 -37.408 -14.234 1.00 0.00 H new ATOM 0 HB3 TRP A 35 35.692 -37.206 -14.099 1.00 0.00 H new ATOM 0 HD1 TRP A 35 38.030 -34.799 -16.070 1.00 0.00 H new ATOM 0 HE1 TRP A 35 37.331 -34.753 -18.567 1.00 0.00 H new ATOM 0 HE3 TRP A 35 34.470 -38.398 -15.786 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 35.443 -36.132 -20.180 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 33.245 -38.984 -17.867 1.00 0.00 H new ATOM 0 HH2 TRP A 35 33.686 -37.918 -20.010 1.00 0.00 H new ATOM 555 N ALA A 36 34.796 -35.369 -12.159 1.00 0.00 N ATOM 556 CA ALA A 36 33.973 -35.462 -10.965 1.00 0.00 C ATOM 557 C ALA A 36 34.027 -36.892 -10.425 1.00 0.00 C ATOM 558 O ALA A 36 33.986 -37.104 -9.214 1.00 0.00 O ATOM 559 CB ALA A 36 32.546 -35.016 -11.292 1.00 0.00 C ATOM 0 H ALA A 36 34.296 -35.082 -13.000 1.00 0.00 H new ATOM 0 HA ALA A 36 34.351 -34.800 -10.186 1.00 0.00 H new ATOM 0 HB1 ALA A 36 31.929 -35.086 -10.396 1.00 0.00 H new ATOM 0 HB2 ALA A 36 32.559 -33.985 -11.644 1.00 0.00 H new ATOM 0 HB3 ALA A 36 32.133 -35.660 -12.069 1.00 0.00 H new ATOM 565 N LYS A 37 34.118 -37.837 -11.349 1.00 0.00 N ATOM 566 CA LYS A 37 34.179 -39.242 -10.980 1.00 0.00 C ATOM 567 C LYS A 37 35.486 -39.513 -10.233 1.00 0.00 C ATOM 568 O LYS A 37 35.665 -40.583 -9.654 1.00 0.00 O ATOM 569 CB LYS A 37 33.978 -40.128 -12.211 1.00 0.00 C ATOM 570 CG LYS A 37 32.492 -40.389 -12.462 1.00 0.00 C ATOM 571 CD LYS A 37 32.012 -39.662 -13.720 1.00 0.00 C ATOM 572 CE LYS A 37 30.824 -38.750 -13.406 1.00 0.00 C ATOM 573 NZ LYS A 37 29.551 -39.490 -13.551 1.00 0.00 N ATOM 0 H LYS A 37 34.151 -37.658 -12.353 1.00 0.00 H new ATOM 0 HA LYS A 37 33.366 -39.493 -10.299 1.00 0.00 H new ATOM 0 HB2 LYS A 37 34.419 -39.648 -13.085 1.00 0.00 H new ATOM 0 HB3 LYS A 37 34.499 -41.075 -12.071 1.00 0.00 H new ATOM 0 HG2 LYS A 37 32.320 -41.460 -12.569 1.00 0.00 H new ATOM 0 HG3 LYS A 37 31.911 -40.057 -11.602 1.00 0.00 H new ATOM 0 HD2 LYS A 37 32.828 -39.072 -14.137 1.00 0.00 H new ATOM 0 HD3 LYS A 37 31.725 -40.390 -14.478 1.00 0.00 H new ATOM 0 HE2 LYS A 37 30.913 -38.363 -12.391 1.00 0.00 H new ATOM 0 HE3 LYS A 37 30.830 -37.891 -14.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 28.891 -38.935 -14.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 29.732 -40.405 -14.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 29.134 -39.651 -12.612 1.00 0.00 H new ATOM 587 N ASP A 38 36.368 -38.525 -10.271 1.00 0.00 N ATOM 588 CA ASP A 38 37.654 -38.643 -9.605 1.00 0.00 C ATOM 589 C ASP A 38 37.896 -37.399 -8.748 1.00 0.00 C ATOM 590 O ASP A 38 39.042 -37.023 -8.504 1.00 0.00 O ATOM 591 CB ASP A 38 38.793 -38.746 -10.622 1.00 0.00 C ATOM 592 CG ASP A 38 39.905 -39.729 -10.249 1.00 0.00 C ATOM 593 OD1 ASP A 38 41.080 -39.310 -10.319 1.00 0.00 O ATOM 594 OD2 ASP A 38 39.554 -40.878 -9.904 1.00 0.00 O ATOM 0 H ASP A 38 36.217 -37.639 -10.753 1.00 0.00 H new ATOM 0 HA ASP A 38 37.635 -39.544 -8.992 1.00 0.00 H new ATOM 0 HB2 ASP A 38 38.375 -39.041 -11.584 1.00 0.00 H new ATOM 0 HB3 ASP A 38 39.232 -37.757 -10.755 1.00 0.00 H new ATOM 599 N CYS A 39 36.799 -36.794 -8.316 1.00 0.00 N ATOM 600 CA CYS A 39 36.878 -35.600 -7.492 1.00 0.00 C ATOM 601 C CYS A 39 37.441 -35.996 -6.126 1.00 0.00 C ATOM 602 O CYS A 39 36.955 -36.937 -5.498 1.00 0.00 O ATOM 603 CB CYS A 39 35.520 -34.906 -7.371 1.00 0.00 C ATOM 604 SG CYS A 39 35.713 -33.300 -6.515 1.00 0.00 S ATOM 0 H CYS A 39 35.851 -37.109 -8.521 1.00 0.00 H new ATOM 0 HA CYS A 39 37.542 -34.874 -7.961 1.00 0.00 H new ATOM 0 HB2 CYS A 39 35.092 -34.751 -8.361 1.00 0.00 H new ATOM 0 HB3 CYS A 39 34.826 -35.540 -6.820 1.00 0.00 H new ATOM 609 N PRO A 40 38.485 -35.239 -5.693 1.00 0.00 N ATOM 610 CA PRO A 40 39.118 -35.502 -4.412 1.00 0.00 C ATOM 611 C PRO A 40 38.242 -35.015 -3.256 1.00 0.00 C ATOM 612 O PRO A 40 38.618 -35.142 -2.092 1.00 0.00 O ATOM 613 CB PRO A 40 40.458 -34.787 -4.483 1.00 0.00 C ATOM 614 CG PRO A 40 40.331 -33.771 -5.606 1.00 0.00 C ATOM 615 CD PRO A 40 39.086 -34.118 -6.408 1.00 0.00 C ATOM 0 HA PRO A 40 39.257 -36.566 -4.222 1.00 0.00 H new ATOM 0 HB2 PRO A 40 40.689 -34.297 -3.537 1.00 0.00 H new ATOM 0 HB3 PRO A 40 41.266 -35.491 -4.683 1.00 0.00 H new ATOM 0 HG2 PRO A 40 40.256 -32.762 -5.201 1.00 0.00 H new ATOM 0 HG3 PRO A 40 41.215 -33.794 -6.244 1.00 0.00 H new ATOM 0 HD2 PRO A 40 38.402 -33.271 -6.463 1.00 0.00 H new ATOM 0 HD3 PRO A 40 39.338 -34.391 -7.433 1.00 0.00 H new ATOM 623 N LYS A 41 37.090 -34.470 -3.618 1.00 0.00 N ATOM 624 CA LYS A 41 36.157 -33.964 -2.626 1.00 0.00 C ATOM 625 C LYS A 41 35.083 -35.020 -2.358 1.00 0.00 C ATOM 626 O LYS A 41 34.397 -34.968 -1.339 1.00 0.00 O ATOM 627 CB LYS A 41 35.593 -32.611 -3.062 1.00 0.00 C ATOM 628 CG LYS A 41 34.910 -31.898 -1.892 1.00 0.00 C ATOM 629 CD LYS A 41 33.764 -31.013 -2.382 1.00 0.00 C ATOM 630 CE LYS A 41 32.735 -30.785 -1.274 1.00 0.00 C ATOM 631 NZ LYS A 41 32.564 -29.338 -1.015 1.00 0.00 N ATOM 0 H LYS A 41 36.782 -34.368 -4.585 1.00 0.00 H new ATOM 0 HA LYS A 41 36.668 -33.781 -1.681 1.00 0.00 H new ATOM 0 HB2 LYS A 41 36.397 -31.987 -3.453 1.00 0.00 H new ATOM 0 HB3 LYS A 41 34.878 -32.755 -3.872 1.00 0.00 H new ATOM 0 HG2 LYS A 41 34.528 -32.635 -1.186 1.00 0.00 H new ATOM 0 HG3 LYS A 41 35.639 -31.291 -1.356 1.00 0.00 H new ATOM 0 HD2 LYS A 41 34.159 -30.055 -2.719 1.00 0.00 H new ATOM 0 HD3 LYS A 41 33.281 -31.479 -3.241 1.00 0.00 H new ATOM 0 HE2 LYS A 41 31.780 -31.224 -1.561 1.00 0.00 H new ATOM 0 HE3 LYS A 41 33.056 -31.288 -0.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 31.954 -29.204 -0.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 33.493 -28.905 -0.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 32.125 -28.887 -1.843 1.00 0.00 H new ATOM 645 N LYS A 42 34.972 -35.956 -3.290 1.00 0.00 N ATOM 646 CA LYS A 42 33.993 -37.022 -3.166 1.00 0.00 C ATOM 647 C LYS A 42 34.148 -37.696 -1.801 1.00 0.00 C ATOM 648 O LYS A 42 35.231 -37.685 -1.219 1.00 0.00 O ATOM 649 CB LYS A 42 34.105 -37.990 -4.346 1.00 0.00 C ATOM 650 CG LYS A 42 32.858 -37.923 -5.231 1.00 0.00 C ATOM 651 CD LYS A 42 32.732 -39.178 -6.097 1.00 0.00 C ATOM 652 CE LYS A 42 32.788 -38.824 -7.584 1.00 0.00 C ATOM 653 NZ LYS A 42 31.924 -39.737 -8.367 1.00 0.00 N ATOM 0 H LYS A 42 35.544 -35.998 -4.134 1.00 0.00 H new ATOM 0 HA LYS A 42 32.982 -36.618 -3.208 1.00 0.00 H new ATOM 0 HB2 LYS A 42 34.988 -37.748 -4.937 1.00 0.00 H new ATOM 0 HB3 LYS A 42 34.238 -39.006 -3.976 1.00 0.00 H new ATOM 0 HG2 LYS A 42 31.970 -37.817 -4.607 1.00 0.00 H new ATOM 0 HG3 LYS A 42 32.907 -37.040 -5.869 1.00 0.00 H new ATOM 0 HD2 LYS A 42 33.535 -39.874 -5.854 1.00 0.00 H new ATOM 0 HD3 LYS A 42 31.793 -39.685 -5.875 1.00 0.00 H new ATOM 0 HE2 LYS A 42 32.465 -37.793 -7.731 1.00 0.00 H new ATOM 0 HE3 LYS A 42 33.816 -38.890 -7.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 31.644 -39.274 -9.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 32.446 -40.610 -8.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 31.074 -39.969 -7.815 1.00 0.00 H new ATOM 667 N PRO A 43 33.019 -38.280 -1.317 1.00 0.00 N ATOM 668 CA PRO A 43 33.020 -38.957 -0.031 1.00 0.00 C ATOM 669 C PRO A 43 33.723 -40.312 -0.125 1.00 0.00 C ATOM 670 O PRO A 43 33.295 -41.187 -0.876 1.00 0.00 O ATOM 671 CB PRO A 43 31.553 -39.074 0.351 1.00 0.00 C ATOM 672 CG PRO A 43 30.770 -38.881 -0.936 1.00 0.00 C ATOM 673 CD PRO A 43 31.719 -38.313 -1.978 1.00 0.00 C ATOM 0 HA PRO A 43 33.575 -38.411 0.732 1.00 0.00 H new ATOM 0 HB2 PRO A 43 31.341 -40.047 0.794 1.00 0.00 H new ATOM 0 HB3 PRO A 43 31.281 -38.321 1.090 1.00 0.00 H new ATOM 0 HG2 PRO A 43 30.354 -39.829 -1.275 1.00 0.00 H new ATOM 0 HG3 PRO A 43 29.931 -38.204 -0.775 1.00 0.00 H new ATOM 0 HD2 PRO A 43 31.745 -38.937 -2.872 1.00 0.00 H new ATOM 0 HD3 PRO A 43 31.410 -37.317 -2.294 1.00 0.00 H new ATOM 681 N ARG A 44 34.791 -40.444 0.649 1.00 0.00 N ATOM 682 CA ARG A 44 35.558 -41.677 0.662 1.00 0.00 C ATOM 683 C ARG A 44 34.890 -42.708 1.574 1.00 0.00 C ATOM 684 O ARG A 44 35.313 -42.900 2.713 1.00 0.00 O ATOM 685 CB ARG A 44 36.989 -41.431 1.145 1.00 0.00 C ATOM 686 CG ARG A 44 37.987 -42.286 0.361 1.00 0.00 C ATOM 687 CD ARG A 44 38.737 -43.243 1.291 1.00 0.00 C ATOM 688 NE ARG A 44 39.986 -43.703 0.644 1.00 0.00 N ATOM 689 CZ ARG A 44 40.044 -44.695 -0.255 1.00 0.00 C ATOM 690 NH1 ARG A 44 38.926 -45.337 -0.618 1.00 0.00 N ATOM 691 NH2 ARG A 44 41.222 -45.045 -0.791 1.00 0.00 N ATOM 0 H ARG A 44 35.143 -39.717 1.272 1.00 0.00 H new ATOM 0 HA ARG A 44 35.592 -42.057 -0.359 1.00 0.00 H new ATOM 0 HB2 ARG A 44 37.239 -40.376 1.030 1.00 0.00 H new ATOM 0 HB3 ARG A 44 37.063 -41.662 2.208 1.00 0.00 H new ATOM 0 HG2 ARG A 44 37.461 -42.855 -0.405 1.00 0.00 H new ATOM 0 HG3 ARG A 44 38.699 -41.641 -0.154 1.00 0.00 H new ATOM 0 HD2 ARG A 44 38.968 -42.743 2.232 1.00 0.00 H new ATOM 0 HD3 ARG A 44 38.106 -44.099 1.532 1.00 0.00 H new ATOM 0 HE ARG A 44 40.857 -43.236 0.898 1.00 0.00 H new ATOM 0 HH11 ARG A 44 38.030 -45.071 -0.210 1.00 0.00 H new ATOM 0 HH12 ARG A 44 38.971 -46.092 -1.302 1.00 0.00 H new ATOM 0 HH21 ARG A 44 42.073 -44.556 -0.514 1.00 0.00 H new ATOM 0 HH22 ARG A 44 41.267 -45.800 -1.475 1.00 0.00 H new ATOM 705 N GLY A 45 33.857 -43.343 1.039 1.00 0.00 N ATOM 706 CA GLY A 45 33.127 -44.349 1.791 1.00 0.00 C ATOM 707 C GLY A 45 31.901 -43.740 2.475 1.00 0.00 C ATOM 708 O GLY A 45 31.682 -42.532 2.402 1.00 0.00 O ATOM 0 H GLY A 45 33.509 -43.180 0.094 1.00 0.00 H new ATOM 0 HA2 GLY A 45 32.814 -45.151 1.123 1.00 0.00 H new ATOM 0 HA3 GLY A 45 33.782 -44.795 2.540 1.00 0.00 H new ATOM 712 N PRO A 46 31.114 -44.627 3.140 1.00 0.00 N ATOM 713 CA PRO A 46 31.446 -46.041 3.178 1.00 0.00 C ATOM 714 C PRO A 46 31.131 -46.713 1.840 1.00 0.00 C ATOM 715 O PRO A 46 30.568 -46.087 0.944 1.00 0.00 O ATOM 716 CB PRO A 46 30.634 -46.606 4.332 1.00 0.00 C ATOM 717 CG PRO A 46 29.532 -45.593 4.601 1.00 0.00 C ATOM 718 CD PRO A 46 29.892 -44.308 3.874 1.00 0.00 C ATOM 0 HA PRO A 46 32.510 -46.219 3.333 1.00 0.00 H new ATOM 0 HB2 PRO A 46 30.216 -47.579 4.076 1.00 0.00 H new ATOM 0 HB3 PRO A 46 31.257 -46.749 5.215 1.00 0.00 H new ATOM 0 HG2 PRO A 46 28.571 -45.972 4.252 1.00 0.00 H new ATOM 0 HG3 PRO A 46 29.434 -45.411 5.671 1.00 0.00 H new ATOM 0 HD2 PRO A 46 29.094 -43.998 3.199 1.00 0.00 H new ATOM 0 HD3 PRO A 46 30.053 -43.489 4.574 1.00 0.00 H new ATOM 726 N ARG A 47 31.508 -47.980 1.747 1.00 0.00 N ATOM 727 CA ARG A 47 31.273 -48.744 0.534 1.00 0.00 C ATOM 728 C ARG A 47 30.029 -49.621 0.692 1.00 0.00 C ATOM 729 O ARG A 47 30.080 -50.666 1.339 1.00 0.00 O ATOM 730 CB ARG A 47 32.474 -49.631 0.200 1.00 0.00 C ATOM 731 CG ARG A 47 33.603 -48.811 -0.429 1.00 0.00 C ATOM 732 CD ARG A 47 33.226 -48.352 -1.840 1.00 0.00 C ATOM 733 NE ARG A 47 33.787 -49.286 -2.842 1.00 0.00 N ATOM 734 CZ ARG A 47 33.345 -49.390 -4.102 1.00 0.00 C ATOM 735 NH1 ARG A 47 32.334 -48.618 -4.523 1.00 0.00 N ATOM 736 NH2 ARG A 47 33.915 -50.265 -4.943 1.00 0.00 N ATOM 0 H ARG A 47 31.975 -48.497 2.492 1.00 0.00 H new ATOM 0 HA ARG A 47 31.122 -48.035 -0.280 1.00 0.00 H new ATOM 0 HB2 ARG A 47 32.834 -50.118 1.106 1.00 0.00 H new ATOM 0 HB3 ARG A 47 32.168 -50.421 -0.486 1.00 0.00 H new ATOM 0 HG2 ARG A 47 33.818 -47.943 0.194 1.00 0.00 H new ATOM 0 HG3 ARG A 47 34.514 -49.409 -0.468 1.00 0.00 H new ATOM 0 HD2 ARG A 47 32.141 -48.307 -1.939 1.00 0.00 H new ATOM 0 HD3 ARG A 47 33.604 -47.345 -2.017 1.00 0.00 H new ATOM 0 HE ARG A 47 34.559 -49.888 -2.555 1.00 0.00 H new ATOM 0 HH11 ARG A 47 31.901 -47.951 -3.884 1.00 0.00 H new ATOM 0 HH12 ARG A 47 31.997 -48.697 -5.483 1.00 0.00 H new ATOM 0 HH21 ARG A 47 34.686 -50.852 -4.623 1.00 0.00 H new ATOM 0 HH22 ARG A 47 33.578 -50.344 -5.902 1.00 0.00 H new ATOM 750 N GLY A 48 28.941 -49.163 0.090 1.00 0.00 N ATOM 751 CA GLY A 48 27.686 -49.893 0.155 1.00 0.00 C ATOM 752 C GLY A 48 26.534 -48.966 0.549 1.00 0.00 C ATOM 753 O GLY A 48 26.498 -48.453 1.666 1.00 0.00 O ATOM 0 H GLY A 48 28.903 -48.295 -0.445 1.00 0.00 H new ATOM 0 HA2 GLY A 48 27.476 -50.350 -0.812 1.00 0.00 H new ATOM 0 HA3 GLY A 48 27.769 -50.704 0.879 1.00 0.00 H new ATOM 757 N PRO A 49 25.594 -48.775 -0.416 1.00 0.00 N ATOM 758 CA PRO A 49 24.443 -47.920 -0.181 1.00 0.00 C ATOM 759 C PRO A 49 23.422 -48.611 0.724 1.00 0.00 C ATOM 760 O PRO A 49 23.266 -49.830 0.672 1.00 0.00 O ATOM 761 CB PRO A 49 23.896 -47.609 -1.565 1.00 0.00 C ATOM 762 CG PRO A 49 24.472 -48.669 -2.489 1.00 0.00 C ATOM 763 CD PRO A 49 25.603 -49.366 -1.751 1.00 0.00 C ATOM 0 HA PRO A 49 24.701 -47.002 0.347 1.00 0.00 H new ATOM 0 HB2 PRO A 49 22.806 -47.637 -1.570 1.00 0.00 H new ATOM 0 HB3 PRO A 49 24.190 -46.610 -1.886 1.00 0.00 H new ATOM 0 HG2 PRO A 49 23.702 -49.387 -2.773 1.00 0.00 H new ATOM 0 HG3 PRO A 49 24.840 -48.215 -3.409 1.00 0.00 H new ATOM 0 HD2 PRO A 49 25.443 -50.443 -1.708 1.00 0.00 H new ATOM 0 HD3 PRO A 49 26.559 -49.205 -2.249 1.00 0.00 H new ATOM 771 N ARG A 50 22.754 -47.803 1.534 1.00 0.00 N ATOM 772 CA ARG A 50 21.752 -48.322 2.450 1.00 0.00 C ATOM 773 C ARG A 50 20.424 -48.533 1.719 1.00 0.00 C ATOM 774 O ARG A 50 19.805 -47.574 1.260 1.00 0.00 O ATOM 775 CB ARG A 50 21.533 -47.367 3.625 1.00 0.00 C ATOM 776 CG ARG A 50 20.984 -48.113 4.842 1.00 0.00 C ATOM 777 CD ARG A 50 19.505 -48.456 4.653 1.00 0.00 C ATOM 778 NE ARG A 50 18.721 -47.974 5.813 1.00 0.00 N ATOM 779 CZ ARG A 50 17.518 -48.452 6.157 1.00 0.00 C ATOM 780 NH1 ARG A 50 16.953 -49.428 5.434 1.00 0.00 N ATOM 781 NH2 ARG A 50 16.880 -47.954 7.226 1.00 0.00 N ATOM 0 H ARG A 50 22.887 -46.793 1.575 1.00 0.00 H new ATOM 0 HA ARG A 50 22.115 -49.275 2.834 1.00 0.00 H new ATOM 0 HB2 ARG A 50 22.474 -46.883 3.885 1.00 0.00 H new ATOM 0 HB3 ARG A 50 20.839 -46.579 3.333 1.00 0.00 H new ATOM 0 HG2 ARG A 50 21.556 -49.027 5.001 1.00 0.00 H new ATOM 0 HG3 ARG A 50 21.108 -47.500 5.735 1.00 0.00 H new ATOM 0 HD2 ARG A 50 19.132 -48.000 3.736 1.00 0.00 H new ATOM 0 HD3 ARG A 50 19.384 -49.534 4.545 1.00 0.00 H new ATOM 0 HE ARG A 50 19.122 -47.232 6.386 1.00 0.00 H new ATOM 0 HH11 ARG A 50 17.439 -49.807 4.621 1.00 0.00 H new ATOM 0 HH12 ARG A 50 16.037 -49.792 5.696 1.00 0.00 H new ATOM 0 HH21 ARG A 50 17.311 -47.211 7.777 1.00 0.00 H new ATOM 0 HH22 ARG A 50 15.964 -48.318 7.488 1.00 0.00 H new ATOM 795 N PRO A 51 20.015 -49.826 1.633 1.00 0.00 N ATOM 796 CA PRO A 51 18.771 -50.176 0.967 1.00 0.00 C ATOM 797 C PRO A 51 17.564 -49.816 1.836 1.00 0.00 C ATOM 798 O PRO A 51 17.532 -50.132 3.023 1.00 0.00 O ATOM 799 CB PRO A 51 18.879 -51.666 0.690 1.00 0.00 C ATOM 800 CG PRO A 51 19.966 -52.186 1.618 1.00 0.00 C ATOM 801 CD PRO A 51 20.722 -50.987 2.167 1.00 0.00 C ATOM 0 HA PRO A 51 18.619 -49.622 0.041 1.00 0.00 H new ATOM 0 HB2 PRO A 51 17.930 -52.168 0.880 1.00 0.00 H new ATOM 0 HB3 PRO A 51 19.135 -51.852 -0.353 1.00 0.00 H new ATOM 0 HG2 PRO A 51 19.529 -52.767 2.430 1.00 0.00 H new ATOM 0 HG3 PRO A 51 20.642 -52.850 1.080 1.00 0.00 H new ATOM 0 HD2 PRO A 51 20.722 -50.984 3.257 1.00 0.00 H new ATOM 0 HD3 PRO A 51 21.764 -50.997 1.849 1.00 0.00 H new ATOM 809 N GLN A 52 16.600 -49.158 1.208 1.00 0.00 N ATOM 810 CA GLN A 52 15.394 -48.750 1.909 1.00 0.00 C ATOM 811 C GLN A 52 14.312 -49.822 1.769 1.00 0.00 C ATOM 812 O GLN A 52 13.871 -50.124 0.661 1.00 0.00 O ATOM 813 CB GLN A 52 14.895 -47.397 1.399 1.00 0.00 C ATOM 814 CG GLN A 52 14.492 -46.487 2.562 1.00 0.00 C ATOM 815 CD GLN A 52 15.536 -45.393 2.788 1.00 0.00 C ATOM 816 OE1 GLN A 52 16.637 -45.637 3.255 1.00 0.00 O ATOM 817 NE2 GLN A 52 15.132 -44.176 2.434 1.00 0.00 N ATOM 0 H GLN A 52 16.630 -48.898 0.222 1.00 0.00 H new ATOM 0 HA GLN A 52 15.632 -48.637 2.967 1.00 0.00 H new ATOM 0 HB2 GLN A 52 15.676 -46.916 0.810 1.00 0.00 H new ATOM 0 HB3 GLN A 52 14.042 -47.546 0.737 1.00 0.00 H new ATOM 0 HG2 GLN A 52 13.523 -46.033 2.354 1.00 0.00 H new ATOM 0 HG3 GLN A 52 14.378 -47.080 3.470 1.00 0.00 H new ATOM 0 HE21 GLN A 52 14.197 -44.041 2.049 1.00 0.00 H new ATOM 0 HE22 GLN A 52 15.757 -43.378 2.547 1.00 0.00 H new ATOM 826 N THR A 53 13.915 -50.369 2.908 1.00 0.00 N ATOM 827 CA THR A 53 12.892 -51.401 2.927 1.00 0.00 C ATOM 828 C THR A 53 11.653 -50.911 3.678 1.00 0.00 C ATOM 829 O THR A 53 11.768 -50.257 4.714 1.00 0.00 O ATOM 830 CB THR A 53 13.507 -52.665 3.530 1.00 0.00 C ATOM 831 OG1 THR A 53 12.425 -53.591 3.574 1.00 0.00 O ATOM 832 CG2 THR A 53 13.901 -52.482 4.998 1.00 0.00 C ATOM 0 H THR A 53 14.283 -50.117 3.825 1.00 0.00 H new ATOM 0 HA THR A 53 12.550 -51.637 1.919 1.00 0.00 H new ATOM 0 HB THR A 53 14.385 -52.952 2.952 1.00 0.00 H new ATOM 0 HG1 THR A 53 12.736 -54.440 3.951 1.00 0.00 H new ATOM 0 HG21 THR A 53 14.332 -53.408 5.377 1.00 0.00 H new ATOM 0 HG22 THR A 53 14.634 -51.680 5.081 1.00 0.00 H new ATOM 0 HG23 THR A 53 13.017 -52.227 5.583 1.00 0.00 H new ATOM 840 N SER A 54 10.496 -51.245 3.126 1.00 0.00 N ATOM 841 CA SER A 54 9.236 -50.847 3.732 1.00 0.00 C ATOM 842 C SER A 54 8.068 -51.492 2.983 1.00 0.00 C ATOM 843 O SER A 54 8.144 -51.705 1.773 1.00 0.00 O ATOM 844 CB SER A 54 9.085 -49.324 3.738 1.00 0.00 C ATOM 845 OG SER A 54 9.097 -48.792 5.061 1.00 0.00 O ATOM 0 H SER A 54 10.404 -51.786 2.266 1.00 0.00 H new ATOM 0 HA SER A 54 9.231 -51.191 4.766 1.00 0.00 H new ATOM 0 HB2 SER A 54 9.894 -48.877 3.160 1.00 0.00 H new ATOM 0 HB3 SER A 54 8.152 -49.050 3.245 1.00 0.00 H new ATOM 0 HG SER A 54 9.939 -49.032 5.502 1.00 0.00 H new ATOM 851 N LEU A 55 7.016 -51.785 3.732 1.00 0.00 N ATOM 852 CA LEU A 55 5.834 -52.402 3.153 1.00 0.00 C ATOM 853 C LEU A 55 4.925 -51.313 2.577 1.00 0.00 C ATOM 854 O LEU A 55 4.727 -51.243 1.365 1.00 0.00 O ATOM 855 CB LEU A 55 5.141 -53.300 4.180 1.00 0.00 C ATOM 856 CG LEU A 55 5.067 -54.788 3.827 1.00 0.00 C ATOM 857 CD1 LEU A 55 4.777 -55.631 5.070 1.00 0.00 C ATOM 858 CD2 LEU A 55 4.047 -55.037 2.715 1.00 0.00 C ATOM 0 H LEU A 55 6.957 -51.607 4.735 1.00 0.00 H new ATOM 0 HA LEU A 55 6.112 -53.056 2.327 1.00 0.00 H new ATOM 0 HB2 LEU A 55 5.661 -53.198 5.132 1.00 0.00 H new ATOM 0 HB3 LEU A 55 4.126 -52.931 4.330 1.00 0.00 H new ATOM 0 HG LEU A 55 6.040 -55.099 3.446 1.00 0.00 H new ATOM 0 HD11 LEU A 55 4.729 -56.684 4.792 1.00 0.00 H new ATOM 0 HD12 LEU A 55 5.571 -55.484 5.802 1.00 0.00 H new ATOM 0 HD13 LEU A 55 3.824 -55.326 5.502 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.014 -56.102 2.483 1.00 0.00 H new ATOM 0 HD22 LEU A 55 3.062 -54.707 3.044 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.337 -54.481 1.824 1.00 0.00 H new ATOM 870 N LEU A 56 4.399 -50.492 3.473 1.00 0.00 N ATOM 871 CA LEU A 56 3.517 -49.410 3.068 1.00 0.00 C ATOM 872 C LEU A 56 2.423 -49.964 2.153 1.00 0.00 C ATOM 873 O LEU A 56 2.348 -49.602 0.980 1.00 0.00 O ATOM 874 CB LEU A 56 4.321 -48.267 2.444 1.00 0.00 C ATOM 875 CG LEU A 56 3.855 -46.852 2.790 1.00 0.00 C ATOM 876 CD1 LEU A 56 5.021 -45.863 2.737 1.00 0.00 C ATOM 877 CD2 LEU A 56 2.696 -46.421 1.888 1.00 0.00 C ATOM 0 H LEU A 56 4.566 -50.554 4.477 1.00 0.00 H new ATOM 0 HA LEU A 56 3.019 -48.980 3.937 1.00 0.00 H new ATOM 0 HB2 LEU A 56 5.361 -48.371 2.752 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.296 -48.381 1.360 1.00 0.00 H new ATOM 0 HG LEU A 56 3.482 -46.855 3.814 1.00 0.00 H new ATOM 0 HD11 LEU A 56 4.663 -44.864 2.987 1.00 0.00 H new ATOM 0 HD12 LEU A 56 5.786 -46.164 3.453 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.446 -45.855 1.733 1.00 0.00 H new ATOM 0 HD21 LEU A 56 2.383 -45.411 2.155 1.00 0.00 H new ATOM 0 HD22 LEU A 56 3.019 -46.438 0.847 1.00 0.00 H new ATOM 0 HD23 LEU A 56 1.859 -47.106 2.019 1.00 0.00 H new TER 889 LEU A 56 ATOM 890 P A B 493 21.022 -33.939 -2.441 1.00 0.00 P ATOM 891 OP1 A B 493 19.836 -34.352 -3.224 1.00 0.00 O ATOM 892 OP2 A B 493 21.840 -35.008 -1.824 1.00 0.00 O ATOM 893 O5' A B 493 21.972 -33.079 -3.399 1.00 0.00 O ATOM 894 C5' A B 493 21.501 -31.857 -3.961 1.00 0.00 C ATOM 895 C4' A B 493 22.158 -30.681 -3.274 1.00 0.00 C ATOM 896 O4' A B 493 22.916 -31.191 -2.160 1.00 0.00 O ATOM 897 C3' A B 493 23.340 -30.086 -4.035 1.00 0.00 C ATOM 898 O3' A B 493 22.869 -29.075 -4.924 1.00 0.00 O ATOM 899 C2' A B 493 24.244 -29.514 -2.979 1.00 0.00 C ATOM 900 O2' A B 493 23.597 -28.308 -2.636 1.00 0.00 O ATOM 901 C1' A B 493 24.180 -30.614 -1.923 1.00 0.00 C ATOM 902 N9 A B 493 25.257 -31.617 -2.053 1.00 0.00 N ATOM 903 C8 A B 493 25.314 -32.653 -2.917 1.00 0.00 C ATOM 904 N7 A B 493 26.421 -33.375 -2.780 1.00 0.00 N ATOM 905 C5 A B 493 27.097 -32.752 -1.766 1.00 0.00 C ATOM 906 C6 A B 493 28.337 -33.036 -1.157 1.00 0.00 C ATOM 907 N6 A B 493 29.144 -34.072 -1.501 1.00 0.00 N ATOM 908 N1 A B 493 28.746 -32.212 -0.153 1.00 0.00 N ATOM 909 C2 A B 493 27.948 -31.177 0.196 1.00 0.00 C ATOM 910 N3 A B 493 26.756 -30.814 -0.313 1.00 0.00 N ATOM 911 C4 A B 493 26.406 -31.676 -1.307 1.00 0.00 C ATOM 0 H5' A B 493 20.418 -31.792 -3.854 1.00 0.00 H new ATOM 0 H5'' A B 493 21.718 -31.832 -5.029 1.00 0.00 H new ATOM 0 H4' A B 493 21.340 -29.980 -3.104 1.00 0.00 H new ATOM 0 H3' A B 493 23.869 -30.821 -4.642 1.00 0.00 H new ATOM 0 H2' A B 493 25.286 -29.281 -3.199 1.00 0.00 H new ATOM 0 HO2' A B 493 23.120 -27.959 -3.418 1.00 0.00 H new ATOM 0 H1' A B 493 24.314 -30.223 -0.914 1.00 0.00 H new ATOM 0 H8 A B 493 24.543 -32.871 -3.641 1.00 0.00 H new ATOM 0 H61 A B 493 30.029 -34.213 -1.013 1.00 0.00 H new ATOM 0 H62 A B 493 28.866 -34.709 -2.247 1.00 0.00 H new ATOM 0 H2 A B 493 28.320 -30.554 0.996 1.00 0.00 H new ATOM 923 P A B 494 22.839 -29.347 -6.500 1.00 0.00 P ATOM 924 OP1 A B 494 21.747 -28.565 -7.121 1.00 0.00 O ATOM 925 OP2 A B 494 22.865 -30.806 -6.755 1.00 0.00 O ATOM 926 O5' A B 494 24.231 -28.734 -6.998 1.00 0.00 O ATOM 927 C5' A B 494 24.682 -28.977 -8.329 1.00 0.00 C ATOM 928 C4' A B 494 25.917 -29.848 -8.309 1.00 0.00 C ATOM 929 O4' A B 494 26.692 -29.315 -7.223 1.00 0.00 O ATOM 930 C3' A B 494 25.744 -31.173 -7.571 1.00 0.00 C ATOM 931 O3' A B 494 25.191 -32.141 -8.461 1.00 0.00 O ATOM 932 C2' A B 494 27.125 -31.561 -7.122 1.00 0.00 C ATOM 933 O2' A B 494 27.642 -32.229 -8.252 1.00 0.00 O ATOM 934 C1' A B 494 27.729 -30.188 -6.840 1.00 0.00 C ATOM 935 N9 A B 494 28.101 -29.989 -5.423 1.00 0.00 N ATOM 936 C8 A B 494 27.574 -30.605 -4.343 1.00 0.00 C ATOM 937 N7 A B 494 28.127 -30.202 -3.204 1.00 0.00 N ATOM 938 C5 A B 494 29.057 -29.278 -3.598 1.00 0.00 C ATOM 939 C6 A B 494 29.967 -28.493 -2.858 1.00 0.00 C ATOM 940 N6 A B 494 30.087 -28.524 -1.506 1.00 0.00 N ATOM 941 N1 A B 494 30.776 -27.649 -3.555 1.00 0.00 N ATOM 942 C2 A B 494 30.663 -27.611 -4.901 1.00 0.00 C ATOM 943 N3 A B 494 29.837 -28.309 -5.704 1.00 0.00 N ATOM 944 C4 A B 494 29.057 -29.131 -4.948 1.00 0.00 C ATOM 0 H5' A B 494 24.902 -28.032 -8.825 1.00 0.00 H new ATOM 0 H5'' A B 494 23.894 -29.463 -8.905 1.00 0.00 H new ATOM 0 H4' A B 494 26.248 -29.915 -9.346 1.00 0.00 H new ATOM 0 H3' A B 494 25.066 -31.101 -6.720 1.00 0.00 H new ATOM 0 H2' A B 494 27.273 -32.208 -6.257 1.00 0.00 H new ATOM 0 HO2' A B 494 28.428 -32.753 -7.991 1.00 0.00 H new ATOM 0 H1' A B 494 28.666 -30.033 -7.374 1.00 0.00 H new ATOM 0 H8 A B 494 26.789 -31.344 -4.399 1.00 0.00 H new ATOM 0 H61 A B 494 30.770 -27.926 -1.041 1.00 0.00 H new ATOM 0 H62 A B 494 29.495 -29.146 -0.956 1.00 0.00 H new ATOM 0 H2 A B 494 31.328 -26.925 -5.403 1.00 0.00 H new ATOM 956 P C B 495 25.206 -33.691 -8.065 1.00 0.00 P ATOM 957 OP1 C B 495 23.889 -34.296 -8.367 1.00 0.00 O ATOM 958 OP2 C B 495 25.732 -33.849 -6.691 1.00 0.00 O ATOM 959 O5' C B 495 26.278 -34.310 -9.079 1.00 0.00 O ATOM 960 C5' C B 495 26.493 -33.700 -10.350 1.00 0.00 C ATOM 961 C4' C B 495 27.558 -34.453 -11.115 1.00 0.00 C ATOM 962 O4' C B 495 28.598 -34.890 -10.224 1.00 0.00 O ATOM 963 C3' C B 495 27.136 -35.841 -11.583 1.00 0.00 C ATOM 964 O3' C B 495 26.460 -35.734 -12.835 1.00 0.00 O ATOM 965 C2' C B 495 28.413 -36.623 -11.712 1.00 0.00 C ATOM 966 O2' C B 495 28.942 -36.155 -12.932 1.00 0.00 O ATOM 967 C1' C B 495 29.154 -36.165 -10.458 1.00 0.00 C ATOM 968 N1 C B 495 28.953 -37.056 -9.297 1.00 0.00 N ATOM 969 C2 C B 495 29.564 -38.308 -9.327 1.00 0.00 C ATOM 970 O2 C B 495 30.239 -38.613 -10.316 1.00 0.00 O ATOM 971 N3 C B 495 29.396 -39.137 -8.282 1.00 0.00 N ATOM 972 C4 C B 495 28.673 -38.796 -7.233 1.00 0.00 C ATOM 973 N4 C B 495 28.519 -39.628 -6.212 1.00 0.00 N ATOM 974 C5 C B 495 28.029 -37.503 -7.177 1.00 0.00 C ATOM 975 C6 C B 495 28.206 -36.688 -8.227 1.00 0.00 C ATOM 0 H5' C B 495 26.796 -32.661 -10.217 1.00 0.00 H new ATOM 0 H5'' C B 495 25.564 -33.691 -10.919 1.00 0.00 H new ATOM 0 H4' C B 495 27.809 -33.754 -11.913 1.00 0.00 H new ATOM 0 H3' C B 495 26.449 -36.331 -10.892 1.00 0.00 H new ATOM 0 H2' C B 495 28.403 -37.712 -11.751 1.00 0.00 H new ATOM 0 HO2' C B 495 28.211 -35.992 -13.564 1.00 0.00 H new ATOM 0 H1' C B 495 30.235 -36.166 -10.597 1.00 0.00 H new ATOM 0 H41 C B 495 27.957 -39.350 -5.408 1.00 0.00 H new ATOM 0 H42 C B 495 28.963 -40.546 -6.231 1.00 0.00 H new ATOM 0 H5 C B 495 27.432 -37.207 -6.327 1.00 0.00 H new ATOM 0 H6 C B 495 27.741 -35.713 -8.220 1.00 0.00 H new ATOM 987 P A B 496 24.861 -35.684 -12.879 1.00 0.00 P ATOM 988 OP1 A B 496 24.328 -35.578 -11.502 1.00 0.00 O ATOM 989 OP2 A B 496 24.350 -36.784 -13.725 1.00 0.00 O ATOM 990 O5' A B 496 24.566 -34.303 -13.630 1.00 0.00 O ATOM 991 C5' A B 496 23.733 -34.285 -14.788 1.00 0.00 C ATOM 992 C4' A B 496 24.528 -33.836 -15.993 1.00 0.00 C ATOM 993 O4' A B 496 24.853 -32.471 -15.701 1.00 0.00 O ATOM 994 C3' A B 496 25.965 -34.347 -16.027 1.00 0.00 C ATOM 995 O3' A B 496 26.018 -35.568 -16.763 1.00 0.00 O ATOM 996 C2' A B 496 26.757 -33.261 -16.700 1.00 0.00 C ATOM 997 O2' A B 496 26.451 -33.454 -18.063 1.00 0.00 O ATOM 998 C1' A B 496 26.140 -32.021 -16.060 1.00 0.00 C ATOM 999 N9 A B 496 26.886 -31.535 -14.880 1.00 0.00 N ATOM 1000 C8 A B 496 27.181 -32.223 -13.756 1.00 0.00 C ATOM 1001 N7 A B 496 27.866 -31.500 -12.877 1.00 0.00 N ATOM 1002 C5 A B 496 28.006 -30.284 -13.490 1.00 0.00 C ATOM 1003 C6 A B 496 28.638 -29.093 -13.071 1.00 0.00 C ATOM 1004 N6 A B 496 29.270 -28.935 -11.881 1.00 0.00 N ATOM 1005 N1 A B 496 28.605 -28.033 -13.926 1.00 0.00 N ATOM 1006 C2 A B 496 27.978 -28.182 -15.114 1.00 0.00 C ATOM 1007 N3 A B 496 27.348 -29.262 -15.612 1.00 0.00 N ATOM 1008 C4 A B 496 27.415 -30.283 -14.713 1.00 0.00 C ATOM 0 H5' A B 496 22.889 -33.613 -14.628 1.00 0.00 H new ATOM 0 H5'' A B 496 23.321 -35.278 -14.964 1.00 0.00 H new ATOM 0 H4' A B 496 23.951 -34.124 -16.872 1.00 0.00 H new ATOM 0 H3' A B 496 26.363 -34.559 -15.035 1.00 0.00 H new ATOM 0 H2' A B 496 27.842 -33.217 -16.606 1.00 0.00 H new ATOM 0 HO2' A B 496 26.153 -34.377 -18.204 1.00 0.00 H new ATOM 0 H1' A B 496 26.144 -31.165 -16.735 1.00 0.00 H new ATOM 0 H8 A B 496 26.891 -33.250 -13.590 1.00 0.00 H new ATOM 0 H61 A B 496 29.704 -28.042 -11.649 1.00 0.00 H new ATOM 0 H62 A B 496 29.311 -29.709 -11.218 1.00 0.00 H new ATOM 0 H2 A B 496 27.983 -27.312 -15.754 1.00 0.00 H new ATOM 1020 P G B 497 26.690 -36.865 -16.112 1.00 0.00 P ATOM 1021 OP1 G B 497 25.636 -37.819 -15.700 1.00 0.00 O ATOM 1022 OP2 G B 497 27.679 -36.455 -15.090 1.00 0.00 O ATOM 1023 O5' G B 497 27.487 -37.511 -17.340 1.00 0.00 O ATOM 1024 C5' G B 497 27.062 -37.260 -18.678 1.00 0.00 C ATOM 1025 C4' G B 497 28.260 -37.022 -19.569 1.00 0.00 C ATOM 1026 O4' G B 497 28.849 -35.816 -18.991 1.00 0.00 O ATOM 1027 C3' G B 497 29.452 -37.929 -19.275 1.00 0.00 C ATOM 1028 O3' G B 497 29.400 -39.072 -20.126 1.00 0.00 O ATOM 1029 C2' G B 497 30.668 -37.089 -19.555 1.00 0.00 C ATOM 1030 O2' G B 497 30.724 -37.083 -20.963 1.00 0.00 O ATOM 1031 C1' G B 497 30.256 -35.769 -18.909 1.00 0.00 C ATOM 1032 N9 G B 497 30.705 -35.633 -17.508 1.00 0.00 N ATOM 1033 C8 G B 497 30.245 -36.303 -16.431 1.00 0.00 C ATOM 1034 N7 G B 497 30.860 -35.950 -15.306 1.00 0.00 N ATOM 1035 C5 G B 497 31.758 -34.998 -15.707 1.00 0.00 C ATOM 1036 C6 G B 497 32.702 -34.240 -14.983 1.00 0.00 C ATOM 1037 O6 G B 497 32.895 -34.311 -13.771 1.00 0.00 O ATOM 1038 N1 G B 497 33.465 -33.355 -15.684 1.00 0.00 N ATOM 1039 C2 G B 497 33.275 -33.256 -17.018 1.00 0.00 C ATOM 1040 N2 G B 497 34.093 -32.353 -17.556 1.00 0.00 N ATOM 1041 N3 G B 497 32.411 -33.923 -17.806 1.00 0.00 N ATOM 1042 C4 G B 497 31.681 -34.788 -17.048 1.00 0.00 C ATOM 0 H5' G B 497 26.404 -36.392 -18.702 1.00 0.00 H new ATOM 0 H5'' G B 497 26.486 -38.107 -19.049 1.00 0.00 H new ATOM 0 H4' G B 497 27.917 -37.087 -20.601 1.00 0.00 H new ATOM 0 H3' G B 497 29.461 -38.298 -18.249 1.00 0.00 H new ATOM 0 H2' G B 497 31.651 -37.383 -19.186 1.00 0.00 H new ATOM 0 HO2' G B 497 30.392 -37.939 -21.307 1.00 0.00 H new ATOM 0 H1' G B 497 30.707 -34.910 -19.406 1.00 0.00 H new ATOM 0 H8 G B 497 29.462 -37.046 -16.478 1.00 0.00 H new ATOM 0 H1 G B 497 34.164 -32.780 -15.212 1.00 0.00 H new ATOM 0 H21 G B 497 34.062 -32.170 -18.559 1.00 0.00 H new ATOM 0 H22 G B 497 34.750 -31.844 -16.965 1.00 0.00 H new ATOM 1054 P U B 498 28.692 -40.415 -19.619 1.00 0.00 P ATOM 1055 OP1 U B 498 29.003 -41.523 -20.549 1.00 0.00 O ATOM 1056 OP2 U B 498 27.266 -40.147 -19.327 1.00 0.00 O ATOM 1057 O5' U B 498 29.434 -40.711 -18.233 1.00 0.00 O ATOM 1058 C5' U B 498 28.699 -41.237 -17.129 1.00 0.00 C ATOM 1059 C4' U B 498 29.340 -42.517 -16.642 1.00 0.00 C ATOM 1060 O4' U B 498 30.090 -43.085 -17.751 1.00 0.00 O ATOM 1061 C3' U B 498 30.607 -42.313 -15.818 1.00 0.00 C ATOM 1062 O3' U B 498 30.247 -42.014 -14.460 1.00 0.00 O ATOM 1063 C2' U B 498 31.359 -43.612 -15.917 1.00 0.00 C ATOM 1064 O2' U B 498 30.680 -44.435 -14.995 1.00 0.00 O ATOM 1065 C1' U B 498 31.139 -43.954 -17.388 1.00 0.00 C ATOM 1066 N1 U B 498 32.334 -43.732 -18.230 1.00 0.00 N ATOM 1067 C2 U B 498 33.060 -44.837 -18.548 1.00 0.00 C ATOM 1068 O2 U B 498 32.775 -45.965 -18.180 1.00 0.00 O ATOM 1069 N3 U B 498 34.174 -44.632 -19.333 1.00 0.00 N ATOM 1070 C4 U B 498 34.564 -43.399 -19.789 1.00 0.00 C ATOM 1071 O4 U B 498 35.577 -43.335 -20.484 1.00 0.00 O ATOM 1072 C5 U B 498 33.769 -42.279 -19.427 1.00 0.00 C ATOM 1073 C6 U B 498 32.695 -42.501 -18.666 1.00 0.00 C ATOM 0 H5' U B 498 27.668 -41.428 -17.426 1.00 0.00 H new ATOM 0 H5'' U B 498 28.668 -40.506 -16.321 1.00 0.00 H new ATOM 0 H4' U B 498 28.518 -43.043 -16.157 1.00 0.00 H new ATOM 0 H3' U B 498 31.218 -41.484 -16.175 1.00 0.00 H new ATOM 0 H2' U B 498 32.423 -43.665 -15.686 1.00 0.00 H new ATOM 0 HO2' U B 498 30.509 -43.932 -14.171 1.00 0.00 H new ATOM 0 HO3' U B 498 29.367 -42.397 -14.263 1.00 0.00 H new ATOM 0 H1' U B 498 30.917 -45.011 -17.534 1.00 0.00 H new ATOM 0 H3 U B 498 34.739 -45.442 -19.589 1.00 0.00 H new ATOM 0 H5 U B 498 34.025 -41.283 -19.756 1.00 0.00 H new ATOM 0 H6 U B 498 32.083 -41.657 -18.384 1.00 0.00 H new TER 1084 U B 498 HETATM 1085 ZN ZN A 57 36.417 -32.124 -8.365 1.00 0.00 ZN