USER MOD reduce.3.24.130724 H: found=0, std=0, add=512, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 509 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 34 HIS HE2 : A 34 HIS NE2 : A 57 ZNZN :(H bumps) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 GLN : amide:sc= -0.428 K(o=-0.43,f=-3!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= -0.0108 X(o=-0.011,f=-0.48) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 25 GLN : amide:sc= -0.798 K(o=-0.8,f=-3!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ -152:sc= -0.054 (180deg=-0.446) USER MOD Single : A 37 LYS NZ :NH3+ -157:sc= -0.0301 (180deg=-0.302) USER MOD Single : A 41 LYS NZ :NH3+ -116:sc= 0.166 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ -137:sc= -1.86! (180deg=-3.3!) USER MOD Single : A 52 GLN : amide:sc=-0.00155 X(o=-0.0016,f=-0.35) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= -0.482 USER MOD Single : B 493 A O2' : rot -29:sc= 0.458 USER MOD Single : B 494 A O2' : rot 81:sc= -1.79! USER MOD Single : B 495 C O2' : rot -22:sc= 0.473 USER MOD Single : B 496 A O2' : rot -15:sc= 0.399 USER MOD Single : B 497 G O2' : rot -27:sc= -0.276! USER MOD Single : B 498 U O2' : rot -24:sc= 0.373 USER MOD Single : B 498 U O3' : rot 180:sc= 0.344 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 27.679 -70.022 -22.270 1.00 0.00 N ATOM 2 CA ALA A 1 28.886 -70.056 -23.077 1.00 0.00 C ATOM 3 C ALA A 1 29.191 -68.648 -23.592 1.00 0.00 C ATOM 4 O ALA A 1 28.533 -68.164 -24.513 1.00 0.00 O ATOM 5 CB ALA A 1 28.713 -71.066 -24.212 1.00 0.00 C ATOM 0 H1 ALA A 1 27.469 -70.978 -21.919 1.00 0.00 H new ATOM 0 H2 ALA A 1 27.818 -69.380 -21.464 1.00 0.00 H new ATOM 0 H3 ALA A 1 26.884 -69.684 -22.849 1.00 0.00 H new ATOM 0 HA ALA A 1 29.738 -70.380 -22.479 1.00 0.00 H new ATOM 0 HB1 ALA A 1 29.619 -71.091 -24.818 1.00 0.00 H new ATOM 0 HB2 ALA A 1 28.528 -72.055 -23.794 1.00 0.00 H new ATOM 0 HB3 ALA A 1 27.868 -70.772 -24.835 1.00 0.00 H new ATOM 11 N THR A 2 30.186 -68.028 -22.974 1.00 0.00 N ATOM 12 CA THR A 2 30.585 -66.685 -23.358 1.00 0.00 C ATOM 13 C THR A 2 29.460 -65.691 -23.066 1.00 0.00 C ATOM 14 O THR A 2 29.543 -64.918 -22.112 1.00 0.00 O ATOM 15 CB THR A 2 30.999 -66.718 -24.832 1.00 0.00 C ATOM 16 OG1 THR A 2 32.120 -67.596 -24.858 1.00 0.00 O ATOM 17 CG2 THR A 2 31.562 -65.378 -25.311 1.00 0.00 C ATOM 0 H THR A 2 30.728 -68.432 -22.210 1.00 0.00 H new ATOM 0 HA THR A 2 31.439 -66.343 -22.773 1.00 0.00 H new ATOM 0 HB THR A 2 30.140 -66.991 -25.445 1.00 0.00 H new ATOM 0 HG1 THR A 2 32.451 -67.676 -25.777 1.00 0.00 H new ATOM 0 HG21 THR A 2 31.840 -65.455 -26.362 1.00 0.00 H new ATOM 0 HG22 THR A 2 30.806 -64.602 -25.192 1.00 0.00 H new ATOM 0 HG23 THR A 2 32.442 -65.121 -24.721 1.00 0.00 H new ATOM 25 N VAL A 3 28.435 -65.741 -23.903 1.00 0.00 N ATOM 26 CA VAL A 3 27.295 -64.854 -23.746 1.00 0.00 C ATOM 27 C VAL A 3 27.750 -63.407 -23.942 1.00 0.00 C ATOM 28 O VAL A 3 28.192 -62.757 -22.995 1.00 0.00 O ATOM 29 CB VAL A 3 26.630 -65.093 -22.388 1.00 0.00 C ATOM 30 CG1 VAL A 3 25.568 -64.028 -22.103 1.00 0.00 C ATOM 31 CG2 VAL A 3 26.032 -66.499 -22.309 1.00 0.00 C ATOM 0 H VAL A 3 28.370 -66.383 -24.693 1.00 0.00 H new ATOM 0 HA VAL A 3 26.540 -65.063 -24.504 1.00 0.00 H new ATOM 0 HB VAL A 3 27.399 -65.014 -21.620 1.00 0.00 H new ATOM 0 HG11 VAL A 3 25.111 -64.221 -21.132 1.00 0.00 H new ATOM 0 HG12 VAL A 3 26.034 -63.043 -22.095 1.00 0.00 H new ATOM 0 HG13 VAL A 3 24.802 -64.061 -22.878 1.00 0.00 H new ATOM 0 HG21 VAL A 3 25.566 -66.642 -21.334 1.00 0.00 H new ATOM 0 HG22 VAL A 3 25.282 -66.620 -23.091 1.00 0.00 H new ATOM 0 HG23 VAL A 3 26.821 -67.238 -22.446 1.00 0.00 H new ATOM 41 N VAL A 4 27.625 -62.944 -25.177 1.00 0.00 N ATOM 42 CA VAL A 4 28.018 -61.585 -25.510 1.00 0.00 C ATOM 43 C VAL A 4 26.789 -60.676 -25.456 1.00 0.00 C ATOM 44 O VAL A 4 25.783 -60.945 -26.110 1.00 0.00 O ATOM 45 CB VAL A 4 28.719 -61.561 -26.870 1.00 0.00 C ATOM 46 CG1 VAL A 4 29.916 -62.514 -26.886 1.00 0.00 C ATOM 47 CG2 VAL A 4 27.740 -61.892 -27.997 1.00 0.00 C ATOM 0 H VAL A 4 27.257 -63.486 -25.959 1.00 0.00 H new ATOM 0 HA VAL A 4 28.736 -61.206 -24.782 1.00 0.00 H new ATOM 0 HB VAL A 4 29.092 -60.551 -27.037 1.00 0.00 H new ATOM 0 HG11 VAL A 4 30.397 -62.478 -27.864 1.00 0.00 H new ATOM 0 HG12 VAL A 4 30.630 -62.214 -26.119 1.00 0.00 H new ATOM 0 HG13 VAL A 4 29.575 -63.530 -26.686 1.00 0.00 H new ATOM 0 HG21 VAL A 4 28.264 -61.868 -28.953 1.00 0.00 H new ATOM 0 HG22 VAL A 4 27.323 -62.886 -27.836 1.00 0.00 H new ATOM 0 HG23 VAL A 4 26.934 -61.158 -28.006 1.00 0.00 H new ATOM 57 N SER A 5 26.910 -59.617 -24.668 1.00 0.00 N ATOM 58 CA SER A 5 25.822 -58.666 -24.519 1.00 0.00 C ATOM 59 C SER A 5 26.294 -57.451 -23.718 1.00 0.00 C ATOM 60 O SER A 5 27.243 -57.546 -22.942 1.00 0.00 O ATOM 61 CB SER A 5 24.615 -59.314 -23.837 1.00 0.00 C ATOM 62 OG SER A 5 24.957 -59.892 -22.580 1.00 0.00 O ATOM 0 H SER A 5 27.746 -59.397 -24.126 1.00 0.00 H new ATOM 0 HA SER A 5 25.514 -58.340 -25.513 1.00 0.00 H new ATOM 0 HB2 SER A 5 23.836 -58.566 -23.692 1.00 0.00 H new ATOM 0 HB3 SER A 5 24.200 -60.083 -24.489 1.00 0.00 H new ATOM 0 HG SER A 5 24.159 -60.293 -22.177 1.00 0.00 H new ATOM 68 N GLY A 6 25.610 -56.338 -23.936 1.00 0.00 N ATOM 69 CA GLY A 6 25.948 -55.105 -23.245 1.00 0.00 C ATOM 70 C GLY A 6 24.724 -54.196 -23.114 1.00 0.00 C ATOM 71 O GLY A 6 23.590 -54.671 -23.121 1.00 0.00 O ATOM 0 H GLY A 6 24.823 -56.264 -24.581 1.00 0.00 H new ATOM 0 HA2 GLY A 6 26.342 -55.335 -22.255 1.00 0.00 H new ATOM 0 HA3 GLY A 6 26.736 -54.584 -23.789 1.00 0.00 H new ATOM 75 N GLN A 7 24.996 -52.904 -22.999 1.00 0.00 N ATOM 76 CA GLN A 7 23.931 -51.925 -22.868 1.00 0.00 C ATOM 77 C GLN A 7 24.505 -50.506 -22.914 1.00 0.00 C ATOM 78 O GLN A 7 25.567 -50.244 -22.352 1.00 0.00 O ATOM 79 CB GLN A 7 23.134 -52.151 -21.582 1.00 0.00 C ATOM 80 CG GLN A 7 21.631 -52.022 -21.839 1.00 0.00 C ATOM 81 CD GLN A 7 20.862 -53.174 -21.188 1.00 0.00 C ATOM 82 OE1 GLN A 7 21.429 -54.061 -20.571 1.00 0.00 O ATOM 83 NE2 GLN A 7 19.545 -53.109 -21.356 1.00 0.00 N ATOM 0 H GLN A 7 25.938 -52.513 -22.994 1.00 0.00 H new ATOM 0 HA GLN A 7 23.247 -52.047 -23.708 1.00 0.00 H new ATOM 0 HB2 GLN A 7 23.355 -53.141 -21.182 1.00 0.00 H new ATOM 0 HB3 GLN A 7 23.441 -51.427 -20.827 1.00 0.00 H new ATOM 0 HG2 GLN A 7 21.271 -51.071 -21.445 1.00 0.00 H new ATOM 0 HG3 GLN A 7 21.441 -52.014 -22.912 1.00 0.00 H new ATOM 0 HE21 GLN A 7 19.136 -52.338 -21.884 1.00 0.00 H new ATOM 0 HE22 GLN A 7 18.944 -53.830 -20.957 1.00 0.00 H new ATOM 92 N LYS A 8 23.779 -49.630 -23.592 1.00 0.00 N ATOM 93 CA LYS A 8 24.202 -48.246 -23.720 1.00 0.00 C ATOM 94 C LYS A 8 23.543 -47.412 -22.620 1.00 0.00 C ATOM 95 O LYS A 8 22.356 -47.572 -22.342 1.00 0.00 O ATOM 96 CB LYS A 8 23.926 -47.730 -25.133 1.00 0.00 C ATOM 97 CG LYS A 8 25.150 -47.010 -25.704 1.00 0.00 C ATOM 98 CD LYS A 8 25.761 -47.801 -26.861 1.00 0.00 C ATOM 99 CE LYS A 8 26.408 -49.094 -26.361 1.00 0.00 C ATOM 100 NZ LYS A 8 25.809 -50.268 -27.035 1.00 0.00 N ATOM 0 H LYS A 8 22.900 -49.852 -24.059 1.00 0.00 H new ATOM 0 HA LYS A 8 25.280 -48.162 -23.581 1.00 0.00 H new ATOM 0 HB2 LYS A 8 23.655 -48.563 -25.781 1.00 0.00 H new ATOM 0 HB3 LYS A 8 23.075 -47.049 -25.115 1.00 0.00 H new ATOM 0 HG2 LYS A 8 24.864 -46.017 -26.049 1.00 0.00 H new ATOM 0 HG3 LYS A 8 25.894 -46.873 -24.920 1.00 0.00 H new ATOM 0 HD2 LYS A 8 24.988 -48.036 -27.593 1.00 0.00 H new ATOM 0 HD3 LYS A 8 26.507 -47.190 -27.370 1.00 0.00 H new ATOM 0 HE2 LYS A 8 27.481 -49.067 -26.550 1.00 0.00 H new ATOM 0 HE3 LYS A 8 26.276 -49.180 -25.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 26.260 -51.137 -26.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 24.789 -50.301 -26.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 25.957 -50.192 -28.062 1.00 0.00 H new ATOM 114 N GLN A 9 24.342 -46.539 -22.024 1.00 0.00 N ATOM 115 CA GLN A 9 23.852 -45.679 -20.960 1.00 0.00 C ATOM 116 C GLN A 9 23.538 -44.286 -21.507 1.00 0.00 C ATOM 117 O GLN A 9 24.323 -43.722 -22.268 1.00 0.00 O ATOM 118 CB GLN A 9 24.856 -45.603 -19.809 1.00 0.00 C ATOM 119 CG GLN A 9 24.429 -46.506 -18.649 1.00 0.00 C ATOM 120 CD GLN A 9 24.338 -47.966 -19.095 1.00 0.00 C ATOM 121 OE1 GLN A 9 25.133 -48.452 -19.883 1.00 0.00 O ATOM 122 NE2 GLN A 9 23.327 -48.637 -18.549 1.00 0.00 N ATOM 0 H GLN A 9 25.326 -46.409 -22.258 1.00 0.00 H new ATOM 0 HA GLN A 9 22.931 -46.110 -20.566 1.00 0.00 H new ATOM 0 HB2 GLN A 9 25.843 -45.901 -20.162 1.00 0.00 H new ATOM 0 HB3 GLN A 9 24.939 -44.573 -19.462 1.00 0.00 H new ATOM 0 HG2 GLN A 9 25.144 -46.416 -17.831 1.00 0.00 H new ATOM 0 HG3 GLN A 9 23.463 -46.178 -18.265 1.00 0.00 H new ATOM 0 HE21 GLN A 9 22.698 -48.169 -17.896 1.00 0.00 H new ATOM 0 HE22 GLN A 9 23.181 -49.619 -18.783 1.00 0.00 H new ATOM 131 N ASP A 10 22.388 -43.770 -21.098 1.00 0.00 N ATOM 132 CA ASP A 10 21.960 -42.452 -21.538 1.00 0.00 C ATOM 133 C ASP A 10 21.733 -42.473 -23.051 1.00 0.00 C ATOM 134 O ASP A 10 22.071 -43.448 -23.720 1.00 0.00 O ATOM 135 CB ASP A 10 23.027 -41.398 -21.235 1.00 0.00 C ATOM 136 CG ASP A 10 22.736 -40.515 -20.019 1.00 0.00 C ATOM 137 OD1 ASP A 10 23.058 -40.968 -18.900 1.00 0.00 O ATOM 138 OD2 ASP A 10 22.198 -39.408 -20.237 1.00 0.00 O ATOM 0 H ASP A 10 21.739 -44.240 -20.467 1.00 0.00 H new ATOM 0 HA ASP A 10 21.042 -42.200 -21.007 1.00 0.00 H new ATOM 0 HB2 ASP A 10 23.981 -41.902 -21.079 1.00 0.00 H new ATOM 0 HB3 ASP A 10 23.144 -40.759 -22.110 1.00 0.00 H new ATOM 143 N ARG A 11 21.162 -41.385 -23.546 1.00 0.00 N ATOM 144 CA ARG A 11 20.885 -41.266 -24.968 1.00 0.00 C ATOM 145 C ARG A 11 21.502 -39.981 -25.523 1.00 0.00 C ATOM 146 O ARG A 11 20.807 -39.161 -26.119 1.00 0.00 O ATOM 147 CB ARG A 11 19.379 -41.257 -25.237 1.00 0.00 C ATOM 148 CG ARG A 11 18.693 -40.116 -24.483 1.00 0.00 C ATOM 149 CD ARG A 11 17.175 -40.303 -24.466 1.00 0.00 C ATOM 150 NE ARG A 11 16.608 -39.726 -23.228 1.00 0.00 N ATOM 151 CZ ARG A 11 15.366 -39.971 -22.785 1.00 0.00 C ATOM 152 NH1 ARG A 11 14.558 -40.785 -23.476 1.00 0.00 N ATOM 153 NH2 ARG A 11 14.936 -39.403 -21.650 1.00 0.00 N ATOM 0 H ARG A 11 20.883 -40.578 -22.988 1.00 0.00 H new ATOM 0 HA ARG A 11 21.326 -42.130 -25.465 1.00 0.00 H new ATOM 0 HB2 ARG A 11 19.198 -41.151 -26.307 1.00 0.00 H new ATOM 0 HB3 ARG A 11 18.946 -42.210 -24.933 1.00 0.00 H new ATOM 0 HG2 ARG A 11 19.069 -40.073 -23.461 1.00 0.00 H new ATOM 0 HG3 ARG A 11 18.940 -39.164 -24.953 1.00 0.00 H new ATOM 0 HD2 ARG A 11 16.731 -39.822 -25.338 1.00 0.00 H new ATOM 0 HD3 ARG A 11 16.930 -41.363 -24.528 1.00 0.00 H new ATOM 0 HE ARG A 11 17.198 -39.103 -22.677 1.00 0.00 H new ATOM 0 HH11 ARG A 11 14.887 -41.218 -24.339 1.00 0.00 H new ATOM 0 HH12 ARG A 11 13.613 -40.972 -23.140 1.00 0.00 H new ATOM 0 HH21 ARG A 11 15.553 -38.785 -21.123 1.00 0.00 H new ATOM 0 HH22 ARG A 11 13.992 -39.589 -21.313 1.00 0.00 H new ATOM 167 N GLN A 12 22.803 -39.846 -25.308 1.00 0.00 N ATOM 168 CA GLN A 12 23.522 -38.675 -25.780 1.00 0.00 C ATOM 169 C GLN A 12 23.184 -37.460 -24.913 1.00 0.00 C ATOM 170 O GLN A 12 24.074 -36.843 -24.330 1.00 0.00 O ATOM 171 CB GLN A 12 23.217 -38.401 -27.253 1.00 0.00 C ATOM 172 CG GLN A 12 24.468 -38.579 -28.115 1.00 0.00 C ATOM 173 CD GLN A 12 24.140 -39.327 -29.410 1.00 0.00 C ATOM 174 OE1 GLN A 12 24.232 -40.540 -29.496 1.00 0.00 O ATOM 175 NE2 GLN A 12 23.753 -38.537 -30.407 1.00 0.00 N ATOM 0 H GLN A 12 23.377 -40.528 -24.813 1.00 0.00 H new ATOM 0 HA GLN A 12 24.591 -38.870 -25.696 1.00 0.00 H new ATOM 0 HB2 GLN A 12 22.434 -39.077 -27.598 1.00 0.00 H new ATOM 0 HB3 GLN A 12 22.835 -37.387 -27.366 1.00 0.00 H new ATOM 0 HG2 GLN A 12 24.893 -37.603 -28.352 1.00 0.00 H new ATOM 0 HG3 GLN A 12 25.225 -39.129 -27.555 1.00 0.00 H new ATOM 0 HE21 GLN A 12 23.698 -37.528 -30.266 1.00 0.00 H new ATOM 0 HE22 GLN A 12 23.511 -38.940 -31.312 1.00 0.00 H new ATOM 184 N GLY A 13 21.897 -37.153 -24.857 1.00 0.00 N ATOM 185 CA GLY A 13 21.430 -36.023 -24.073 1.00 0.00 C ATOM 186 C GLY A 13 21.357 -34.756 -24.926 1.00 0.00 C ATOM 187 O GLY A 13 20.393 -34.553 -25.662 1.00 0.00 O ATOM 0 H GLY A 13 21.162 -37.668 -25.342 1.00 0.00 H new ATOM 0 HA2 GLY A 13 20.446 -36.245 -23.660 1.00 0.00 H new ATOM 0 HA3 GLY A 13 22.100 -35.859 -23.229 1.00 0.00 H new ATOM 191 N GLY A 14 22.390 -33.936 -24.800 1.00 0.00 N ATOM 192 CA GLY A 14 22.455 -32.693 -25.550 1.00 0.00 C ATOM 193 C GLY A 14 23.228 -31.624 -24.775 1.00 0.00 C ATOM 194 O GLY A 14 23.526 -31.801 -23.595 1.00 0.00 O ATOM 0 H GLY A 14 23.189 -34.108 -24.190 1.00 0.00 H new ATOM 0 HA2 GLY A 14 22.937 -32.869 -26.512 1.00 0.00 H new ATOM 0 HA3 GLY A 14 21.446 -32.337 -25.759 1.00 0.00 H new ATOM 198 N GLU A 15 23.531 -30.537 -25.470 1.00 0.00 N ATOM 199 CA GLU A 15 24.263 -29.440 -24.862 1.00 0.00 C ATOM 200 C GLU A 15 23.512 -28.915 -23.637 1.00 0.00 C ATOM 201 O GLU A 15 24.059 -28.883 -22.536 1.00 0.00 O ATOM 202 CB GLU A 15 24.513 -28.320 -25.874 1.00 0.00 C ATOM 203 CG GLU A 15 25.948 -28.367 -26.402 1.00 0.00 C ATOM 204 CD GLU A 15 26.038 -27.757 -27.802 1.00 0.00 C ATOM 205 OE1 GLU A 15 25.534 -28.412 -28.740 1.00 0.00 O ATOM 206 OE2 GLU A 15 26.608 -26.649 -27.902 1.00 0.00 O ATOM 0 H GLU A 15 23.282 -30.393 -26.449 1.00 0.00 H new ATOM 0 HA GLU A 15 25.234 -29.813 -24.536 1.00 0.00 H new ATOM 0 HB2 GLU A 15 23.813 -28.413 -26.704 1.00 0.00 H new ATOM 0 HB3 GLU A 15 24.326 -27.354 -25.406 1.00 0.00 H new ATOM 0 HG2 GLU A 15 26.607 -27.826 -25.723 1.00 0.00 H new ATOM 0 HG3 GLU A 15 26.296 -29.400 -26.428 1.00 0.00 H new ATOM 213 N ARG A 16 22.271 -28.515 -23.870 1.00 0.00 N ATOM 214 CA ARG A 16 21.439 -27.992 -22.800 1.00 0.00 C ATOM 215 C ARG A 16 21.931 -26.608 -22.372 1.00 0.00 C ATOM 216 O ARG A 16 21.194 -25.628 -22.462 1.00 0.00 O ATOM 217 CB ARG A 16 21.450 -28.926 -21.588 1.00 0.00 C ATOM 218 CG ARG A 16 20.308 -28.591 -20.626 1.00 0.00 C ATOM 219 CD ARG A 16 19.233 -29.681 -20.650 1.00 0.00 C ATOM 220 NE ARG A 16 18.722 -29.916 -19.280 1.00 0.00 N ATOM 221 CZ ARG A 16 17.938 -30.948 -18.939 1.00 0.00 C ATOM 222 NH1 ARG A 16 17.572 -31.846 -19.863 1.00 0.00 N ATOM 223 NH2 ARG A 16 17.522 -31.081 -17.672 1.00 0.00 N ATOM 0 H ARG A 16 21.821 -28.543 -24.785 1.00 0.00 H new ATOM 0 HA ARG A 16 20.420 -27.918 -23.179 1.00 0.00 H new ATOM 0 HB2 ARG A 16 21.358 -29.960 -21.921 1.00 0.00 H new ATOM 0 HB3 ARG A 16 22.404 -28.842 -21.068 1.00 0.00 H new ATOM 0 HG2 ARG A 16 20.700 -28.484 -19.614 1.00 0.00 H new ATOM 0 HG3 ARG A 16 19.866 -27.633 -20.900 1.00 0.00 H new ATOM 0 HD2 ARG A 16 18.415 -29.383 -21.306 1.00 0.00 H new ATOM 0 HD3 ARG A 16 19.647 -30.604 -21.056 1.00 0.00 H new ATOM 0 HE ARG A 16 18.983 -29.252 -18.551 1.00 0.00 H new ATOM 0 HH11 ARG A 16 17.890 -31.745 -20.827 1.00 0.00 H new ATOM 0 HH12 ARG A 16 16.975 -32.631 -19.603 1.00 0.00 H new ATOM 0 HH21 ARG A 16 17.802 -30.397 -16.969 1.00 0.00 H new ATOM 0 HH22 ARG A 16 16.925 -31.866 -17.411 1.00 0.00 H new ATOM 237 N ARG A 17 23.174 -26.573 -21.916 1.00 0.00 N ATOM 238 CA ARG A 17 23.774 -25.325 -21.473 1.00 0.00 C ATOM 239 C ARG A 17 25.218 -25.559 -21.025 1.00 0.00 C ATOM 240 O ARG A 17 26.141 -24.929 -21.539 1.00 0.00 O ATOM 241 CB ARG A 17 22.981 -24.713 -20.317 1.00 0.00 C ATOM 242 CG ARG A 17 22.213 -23.471 -20.776 1.00 0.00 C ATOM 243 CD ARG A 17 23.100 -22.225 -20.717 1.00 0.00 C ATOM 244 NE ARG A 17 22.279 -21.034 -20.407 1.00 0.00 N ATOM 245 CZ ARG A 17 21.941 -20.656 -19.167 1.00 0.00 C ATOM 246 NH1 ARG A 17 22.352 -21.373 -18.112 1.00 0.00 N ATOM 247 NH2 ARG A 17 21.191 -19.561 -18.980 1.00 0.00 N ATOM 0 H ARG A 17 23.783 -27.388 -21.843 1.00 0.00 H new ATOM 0 HA ARG A 17 23.760 -24.633 -22.315 1.00 0.00 H new ATOM 0 HB2 ARG A 17 22.283 -25.450 -19.919 1.00 0.00 H new ATOM 0 HB3 ARG A 17 23.659 -24.447 -19.507 1.00 0.00 H new ATOM 0 HG2 ARG A 17 21.853 -23.617 -21.794 1.00 0.00 H new ATOM 0 HG3 ARG A 17 21.336 -23.328 -20.145 1.00 0.00 H new ATOM 0 HD2 ARG A 17 23.871 -22.353 -19.957 1.00 0.00 H new ATOM 0 HD3 ARG A 17 23.611 -22.087 -21.670 1.00 0.00 H new ATOM 0 HE ARG A 17 21.949 -20.465 -21.187 1.00 0.00 H new ATOM 0 HH11 ARG A 17 22.922 -22.207 -18.253 1.00 0.00 H new ATOM 0 HH12 ARG A 17 22.094 -21.085 -17.168 1.00 0.00 H new ATOM 0 HH21 ARG A 17 20.877 -19.015 -19.782 1.00 0.00 H new ATOM 0 HH22 ARG A 17 20.934 -19.274 -18.036 1.00 0.00 H new ATOM 261 N ARG A 18 25.368 -26.468 -20.073 1.00 0.00 N ATOM 262 CA ARG A 18 26.683 -26.793 -19.549 1.00 0.00 C ATOM 263 C ARG A 18 27.522 -25.523 -19.393 1.00 0.00 C ATOM 264 O ARG A 18 28.481 -25.313 -20.133 1.00 0.00 O ATOM 265 CB ARG A 18 27.417 -27.770 -20.471 1.00 0.00 C ATOM 266 CG ARG A 18 26.827 -29.177 -20.360 1.00 0.00 C ATOM 267 CD ARG A 18 27.684 -30.192 -21.120 1.00 0.00 C ATOM 268 NE ARG A 18 26.821 -31.061 -21.951 1.00 0.00 N ATOM 269 CZ ARG A 18 27.283 -31.918 -22.872 1.00 0.00 C ATOM 270 NH1 ARG A 18 28.601 -32.026 -23.085 1.00 0.00 N ATOM 271 NH2 ARG A 18 26.426 -32.667 -23.579 1.00 0.00 N ATOM 0 H ARG A 18 24.600 -26.990 -19.651 1.00 0.00 H new ATOM 0 HA ARG A 18 26.545 -27.263 -18.575 1.00 0.00 H new ATOM 0 HB2 ARG A 18 27.349 -27.423 -21.502 1.00 0.00 H new ATOM 0 HB3 ARG A 18 28.476 -27.794 -20.212 1.00 0.00 H new ATOM 0 HG2 ARG A 18 26.760 -29.465 -19.311 1.00 0.00 H new ATOM 0 HG3 ARG A 18 25.812 -29.182 -20.758 1.00 0.00 H new ATOM 0 HD2 ARG A 18 28.405 -29.672 -21.750 1.00 0.00 H new ATOM 0 HD3 ARG A 18 28.255 -30.798 -20.416 1.00 0.00 H new ATOM 0 HE ARG A 18 25.812 -31.004 -21.814 1.00 0.00 H new ATOM 0 HH11 ARG A 18 29.253 -31.456 -22.546 1.00 0.00 H new ATOM 0 HH12 ARG A 18 28.953 -32.678 -23.786 1.00 0.00 H new ATOM 0 HH21 ARG A 18 25.422 -32.585 -23.416 1.00 0.00 H new ATOM 0 HH22 ARG A 18 26.777 -33.319 -24.280 1.00 0.00 H new ATOM 285 N SER A 19 27.129 -24.709 -18.424 1.00 0.00 N ATOM 286 CA SER A 19 27.832 -23.465 -18.161 1.00 0.00 C ATOM 287 C SER A 19 29.343 -23.686 -18.261 1.00 0.00 C ATOM 288 O SER A 19 29.973 -24.132 -17.303 1.00 0.00 O ATOM 289 CB SER A 19 27.468 -22.907 -16.784 1.00 0.00 C ATOM 290 OG SER A 19 26.425 -21.938 -16.859 1.00 0.00 O ATOM 0 H SER A 19 26.333 -24.887 -17.812 1.00 0.00 H new ATOM 0 HA SER A 19 27.527 -22.735 -18.911 1.00 0.00 H new ATOM 0 HB2 SER A 19 27.158 -23.724 -16.132 1.00 0.00 H new ATOM 0 HB3 SER A 19 28.351 -22.455 -16.331 1.00 0.00 H new ATOM 0 HG SER A 19 26.221 -21.607 -15.959 1.00 0.00 H new ATOM 296 N GLN A 20 29.880 -23.364 -19.428 1.00 0.00 N ATOM 297 CA GLN A 20 31.304 -23.523 -19.666 1.00 0.00 C ATOM 298 C GLN A 20 31.812 -24.808 -19.011 1.00 0.00 C ATOM 299 O GLN A 20 32.764 -24.779 -18.232 1.00 0.00 O ATOM 300 CB GLN A 20 32.083 -22.306 -19.162 1.00 0.00 C ATOM 301 CG GLN A 20 33.151 -21.881 -20.171 1.00 0.00 C ATOM 302 CD GLN A 20 33.719 -20.504 -19.823 1.00 0.00 C ATOM 303 OE1 GLN A 20 33.437 -19.933 -18.781 1.00 0.00 O ATOM 304 NE2 GLN A 20 34.532 -20.004 -20.748 1.00 0.00 N ATOM 0 H GLN A 20 29.354 -22.993 -20.220 1.00 0.00 H new ATOM 0 HA GLN A 20 31.466 -23.598 -20.741 1.00 0.00 H new ATOM 0 HB2 GLN A 20 31.396 -21.479 -18.984 1.00 0.00 H new ATOM 0 HB3 GLN A 20 32.553 -22.541 -18.207 1.00 0.00 H new ATOM 0 HG2 GLN A 20 33.955 -22.617 -20.186 1.00 0.00 H new ATOM 0 HG3 GLN A 20 32.721 -21.858 -21.172 1.00 0.00 H new ATOM 0 HE21 GLN A 20 34.726 -20.534 -21.597 1.00 0.00 H new ATOM 0 HE22 GLN A 20 34.962 -19.090 -20.608 1.00 0.00 H new ATOM 313 N LEU A 21 31.154 -25.907 -19.349 1.00 0.00 N ATOM 314 CA LEU A 21 31.527 -27.201 -18.804 1.00 0.00 C ATOM 315 C LEU A 21 32.584 -27.844 -19.704 1.00 0.00 C ATOM 316 O LEU A 21 32.250 -28.529 -20.670 1.00 0.00 O ATOM 317 CB LEU A 21 30.287 -28.072 -18.593 1.00 0.00 C ATOM 318 CG LEU A 21 30.328 -29.020 -17.394 1.00 0.00 C ATOM 319 CD1 LEU A 21 29.411 -30.225 -17.615 1.00 0.00 C ATOM 320 CD2 LEU A 21 31.764 -29.442 -17.078 1.00 0.00 C ATOM 0 H LEU A 21 30.364 -25.928 -19.994 1.00 0.00 H new ATOM 0 HA LEU A 21 31.977 -27.083 -17.818 1.00 0.00 H new ATOM 0 HB2 LEU A 21 29.422 -27.417 -18.484 1.00 0.00 H new ATOM 0 HB3 LEU A 21 30.126 -28.664 -19.494 1.00 0.00 H new ATOM 0 HG LEU A 21 29.951 -28.485 -16.523 1.00 0.00 H new ATOM 0 HD11 LEU A 21 29.459 -30.883 -16.747 1.00 0.00 H new ATOM 0 HD12 LEU A 21 28.386 -29.882 -17.753 1.00 0.00 H new ATOM 0 HD13 LEU A 21 29.734 -30.770 -18.502 1.00 0.00 H new ATOM 0 HD21 LEU A 21 31.765 -30.116 -16.221 1.00 0.00 H new ATOM 0 HD22 LEU A 21 32.192 -29.952 -17.941 1.00 0.00 H new ATOM 0 HD23 LEU A 21 32.360 -28.559 -16.846 1.00 0.00 H new ATOM 332 N ASP A 22 33.839 -27.601 -19.355 1.00 0.00 N ATOM 333 CA ASP A 22 34.947 -28.148 -20.119 1.00 0.00 C ATOM 334 C ASP A 22 34.932 -29.674 -20.011 1.00 0.00 C ATOM 335 O ASP A 22 34.523 -30.224 -18.989 1.00 0.00 O ATOM 336 CB ASP A 22 36.289 -27.649 -19.578 1.00 0.00 C ATOM 337 CG ASP A 22 37.226 -27.050 -20.627 1.00 0.00 C ATOM 338 OD1 ASP A 22 38.135 -26.298 -20.214 1.00 0.00 O ATOM 339 OD2 ASP A 22 37.014 -27.358 -21.821 1.00 0.00 O ATOM 0 H ASP A 22 34.113 -27.033 -18.553 1.00 0.00 H new ATOM 0 HA ASP A 22 34.833 -27.827 -21.154 1.00 0.00 H new ATOM 0 HB2 ASP A 22 36.098 -26.898 -18.812 1.00 0.00 H new ATOM 0 HB3 ASP A 22 36.798 -28.480 -19.090 1.00 0.00 H new ATOM 344 N ARG A 23 35.385 -30.316 -21.078 1.00 0.00 N ATOM 345 CA ARG A 23 35.428 -31.767 -21.116 1.00 0.00 C ATOM 346 C ARG A 23 36.453 -32.294 -20.109 1.00 0.00 C ATOM 347 O ARG A 23 36.541 -33.500 -19.881 1.00 0.00 O ATOM 348 CB ARG A 23 35.792 -32.271 -22.514 1.00 0.00 C ATOM 349 CG ARG A 23 34.537 -32.489 -23.362 1.00 0.00 C ATOM 350 CD ARG A 23 33.546 -33.410 -22.648 1.00 0.00 C ATOM 351 NE ARG A 23 32.986 -34.391 -23.605 1.00 0.00 N ATOM 352 CZ ARG A 23 31.868 -35.096 -23.390 1.00 0.00 C ATOM 353 NH1 ARG A 23 31.181 -34.933 -22.251 1.00 0.00 N ATOM 354 NH2 ARG A 23 31.435 -35.964 -24.315 1.00 0.00 N ATOM 0 H ARG A 23 35.726 -29.857 -21.923 1.00 0.00 H new ATOM 0 HA ARG A 23 34.435 -32.135 -20.856 1.00 0.00 H new ATOM 0 HB2 ARG A 23 36.447 -31.551 -23.005 1.00 0.00 H new ATOM 0 HB3 ARG A 23 36.348 -33.205 -22.434 1.00 0.00 H new ATOM 0 HG2 ARG A 23 34.063 -31.530 -23.569 1.00 0.00 H new ATOM 0 HG3 ARG A 23 34.814 -32.922 -24.323 1.00 0.00 H new ATOM 0 HD2 ARG A 23 34.045 -33.931 -21.831 1.00 0.00 H new ATOM 0 HD3 ARG A 23 32.742 -32.821 -22.207 1.00 0.00 H new ATOM 0 HE ARG A 23 33.483 -34.539 -24.483 1.00 0.00 H new ATOM 0 HH11 ARG A 23 31.510 -34.272 -21.547 1.00 0.00 H new ATOM 0 HH12 ARG A 23 30.329 -35.470 -22.088 1.00 0.00 H new ATOM 0 HH21 ARG A 23 31.957 -36.087 -25.183 1.00 0.00 H new ATOM 0 HH22 ARG A 23 30.583 -36.501 -24.151 1.00 0.00 H new ATOM 368 N ASP A 24 37.200 -31.365 -19.533 1.00 0.00 N ATOM 369 CA ASP A 24 38.215 -31.720 -18.555 1.00 0.00 C ATOM 370 C ASP A 24 38.011 -30.886 -17.289 1.00 0.00 C ATOM 371 O ASP A 24 38.958 -30.646 -16.541 1.00 0.00 O ATOM 372 CB ASP A 24 39.619 -31.433 -19.090 1.00 0.00 C ATOM 373 CG ASP A 24 39.988 -29.950 -19.176 1.00 0.00 C ATOM 374 OD1 ASP A 24 39.076 -29.156 -19.491 1.00 0.00 O ATOM 375 OD2 ASP A 24 41.174 -29.644 -18.924 1.00 0.00 O ATOM 0 H ASP A 24 37.123 -30.366 -19.724 1.00 0.00 H new ATOM 0 HA ASP A 24 38.121 -32.785 -18.342 1.00 0.00 H new ATOM 0 HB2 ASP A 24 40.345 -31.936 -18.451 1.00 0.00 H new ATOM 0 HB3 ASP A 24 39.710 -31.873 -20.083 1.00 0.00 H new ATOM 380 N GLN A 25 36.771 -30.467 -17.087 1.00 0.00 N ATOM 381 CA GLN A 25 36.431 -29.665 -15.925 1.00 0.00 C ATOM 382 C GLN A 25 35.524 -30.456 -14.980 1.00 0.00 C ATOM 383 O GLN A 25 34.431 -30.867 -15.363 1.00 0.00 O ATOM 384 CB GLN A 25 35.773 -28.347 -16.341 1.00 0.00 C ATOM 385 CG GLN A 25 36.726 -27.169 -16.136 1.00 0.00 C ATOM 386 CD GLN A 25 36.496 -26.505 -14.777 1.00 0.00 C ATOM 387 OE1 GLN A 25 36.179 -27.149 -13.790 1.00 0.00 O ATOM 388 NE2 GLN A 25 36.672 -25.187 -14.782 1.00 0.00 N ATOM 0 H GLN A 25 35.988 -30.668 -17.710 1.00 0.00 H new ATOM 0 HA GLN A 25 37.352 -29.422 -15.395 1.00 0.00 H new ATOM 0 HB2 GLN A 25 35.475 -28.400 -17.388 1.00 0.00 H new ATOM 0 HB3 GLN A 25 34.865 -28.190 -15.759 1.00 0.00 H new ATOM 0 HG2 GLN A 25 37.757 -27.515 -16.205 1.00 0.00 H new ATOM 0 HG3 GLN A 25 36.581 -26.437 -16.931 1.00 0.00 H new ATOM 0 HE21 GLN A 25 36.937 -24.711 -15.644 1.00 0.00 H new ATOM 0 HE22 GLN A 25 36.542 -24.652 -13.924 1.00 0.00 H new ATOM 397 N CYS A 26 36.014 -30.647 -13.763 1.00 0.00 N ATOM 398 CA CYS A 26 35.262 -31.382 -12.761 1.00 0.00 C ATOM 399 C CYS A 26 33.896 -30.714 -12.599 1.00 0.00 C ATOM 400 O CYS A 26 33.813 -29.502 -12.407 1.00 0.00 O ATOM 401 CB CYS A 26 36.019 -31.464 -11.433 1.00 0.00 C ATOM 402 SG CYS A 26 34.993 -32.317 -10.180 1.00 0.00 S ATOM 0 H CYS A 26 36.922 -30.305 -13.449 1.00 0.00 H new ATOM 0 HA CYS A 26 35.124 -32.412 -13.090 1.00 0.00 H new ATOM 0 HB2 CYS A 26 36.958 -32.000 -11.572 1.00 0.00 H new ATOM 0 HB3 CYS A 26 36.272 -30.462 -11.087 1.00 0.00 H new ATOM 407 N ALA A 27 32.858 -31.534 -12.683 1.00 0.00 N ATOM 408 CA ALA A 27 31.499 -31.036 -12.549 1.00 0.00 C ATOM 409 C ALA A 27 30.998 -31.312 -11.130 1.00 0.00 C ATOM 410 O ALA A 27 29.820 -31.600 -10.929 1.00 0.00 O ATOM 411 CB ALA A 27 30.611 -31.680 -13.616 1.00 0.00 C ATOM 0 H ALA A 27 32.931 -32.539 -12.842 1.00 0.00 H new ATOM 0 HA ALA A 27 31.468 -29.958 -12.707 1.00 0.00 H new ATOM 0 HB1 ALA A 27 29.592 -31.306 -13.515 1.00 0.00 H new ATOM 0 HB2 ALA A 27 30.993 -31.431 -14.606 1.00 0.00 H new ATOM 0 HB3 ALA A 27 30.615 -32.762 -13.488 1.00 0.00 H new ATOM 417 N TYR A 28 31.919 -31.212 -10.182 1.00 0.00 N ATOM 418 CA TYR A 28 31.585 -31.447 -8.787 1.00 0.00 C ATOM 419 C TYR A 28 32.073 -30.296 -7.906 1.00 0.00 C ATOM 420 O TYR A 28 31.305 -29.741 -7.122 1.00 0.00 O ATOM 421 CB TYR A 28 32.321 -32.727 -8.387 1.00 0.00 C ATOM 422 CG TYR A 28 31.725 -33.433 -7.167 1.00 0.00 C ATOM 423 CD1 TYR A 28 30.662 -34.298 -7.322 1.00 0.00 C ATOM 424 CD2 TYR A 28 32.251 -33.202 -5.913 1.00 0.00 C ATOM 425 CE1 TYR A 28 30.100 -34.962 -6.174 1.00 0.00 C ATOM 426 CE2 TYR A 28 31.689 -33.866 -4.765 1.00 0.00 C ATOM 427 CZ TYR A 28 30.642 -34.713 -4.952 1.00 0.00 C ATOM 428 OH TYR A 28 30.113 -35.340 -3.867 1.00 0.00 O ATOM 0 H TYR A 28 32.896 -30.972 -10.352 1.00 0.00 H new ATOM 0 HA TYR A 28 30.506 -31.528 -8.659 1.00 0.00 H new ATOM 0 HB2 TYR A 28 32.315 -33.416 -9.231 1.00 0.00 H new ATOM 0 HB3 TYR A 28 33.364 -32.485 -8.180 1.00 0.00 H new ATOM 0 HD1 TYR A 28 30.251 -34.478 -8.304 1.00 0.00 H new ATOM 0 HD2 TYR A 28 33.083 -32.524 -5.792 1.00 0.00 H new ATOM 0 HE1 TYR A 28 29.268 -35.642 -6.281 1.00 0.00 H new ATOM 0 HE2 TYR A 28 32.091 -33.695 -3.777 1.00 0.00 H new ATOM 0 HH TYR A 28 30.601 -35.068 -3.062 1.00 0.00 H new ATOM 438 N CYS A 29 33.348 -29.971 -8.063 1.00 0.00 N ATOM 439 CA CYS A 29 33.948 -28.897 -7.291 1.00 0.00 C ATOM 440 C CYS A 29 34.228 -27.725 -8.235 1.00 0.00 C ATOM 441 O CYS A 29 34.350 -26.584 -7.794 1.00 0.00 O ATOM 442 CB CYS A 29 35.213 -29.359 -6.564 1.00 0.00 C ATOM 443 SG CYS A 29 36.480 -29.873 -7.780 1.00 0.00 S ATOM 0 H CYS A 29 33.982 -30.433 -8.714 1.00 0.00 H new ATOM 0 HA CYS A 29 33.257 -28.578 -6.511 1.00 0.00 H new ATOM 0 HB2 CYS A 29 35.600 -28.552 -5.942 1.00 0.00 H new ATOM 0 HB3 CYS A 29 34.977 -30.190 -5.899 1.00 0.00 H new ATOM 448 N LYS A 30 34.323 -28.050 -9.516 1.00 0.00 N ATOM 449 CA LYS A 30 34.587 -27.039 -10.526 1.00 0.00 C ATOM 450 C LYS A 30 36.098 -26.899 -10.720 1.00 0.00 C ATOM 451 O LYS A 30 36.582 -25.841 -11.120 1.00 0.00 O ATOM 452 CB LYS A 30 33.889 -25.725 -10.165 1.00 0.00 C ATOM 453 CG LYS A 30 32.485 -25.984 -9.617 1.00 0.00 C ATOM 454 CD LYS A 30 31.451 -25.104 -10.322 1.00 0.00 C ATOM 455 CE LYS A 30 31.059 -25.697 -11.677 1.00 0.00 C ATOM 456 NZ LYS A 30 31.271 -24.708 -12.758 1.00 0.00 N ATOM 0 H LYS A 30 34.222 -28.998 -9.878 1.00 0.00 H new ATOM 0 HA LYS A 30 34.169 -27.342 -11.486 1.00 0.00 H new ATOM 0 HB2 LYS A 30 34.479 -25.187 -9.423 1.00 0.00 H new ATOM 0 HB3 LYS A 30 33.827 -25.087 -11.047 1.00 0.00 H new ATOM 0 HG2 LYS A 30 32.226 -27.034 -9.751 1.00 0.00 H new ATOM 0 HG3 LYS A 30 32.467 -25.786 -8.545 1.00 0.00 H new ATOM 0 HD2 LYS A 30 30.565 -25.004 -9.695 1.00 0.00 H new ATOM 0 HD3 LYS A 30 31.856 -24.102 -10.463 1.00 0.00 H new ATOM 0 HE2 LYS A 30 31.650 -26.591 -11.874 1.00 0.00 H new ATOM 0 HE3 LYS A 30 30.013 -26.004 -11.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 31.000 -25.127 -13.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 30.688 -23.866 -12.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 32.274 -24.435 -12.787 1.00 0.00 H new ATOM 470 N GLU A 31 36.803 -27.982 -10.426 1.00 0.00 N ATOM 471 CA GLU A 31 38.249 -27.995 -10.563 1.00 0.00 C ATOM 472 C GLU A 31 38.652 -28.626 -11.896 1.00 0.00 C ATOM 473 O GLU A 31 38.333 -29.785 -12.159 1.00 0.00 O ATOM 474 CB GLU A 31 38.905 -28.726 -9.389 1.00 0.00 C ATOM 475 CG GLU A 31 38.705 -27.955 -8.082 1.00 0.00 C ATOM 476 CD GLU A 31 39.802 -26.905 -7.894 1.00 0.00 C ATOM 477 OE1 GLU A 31 39.490 -25.714 -8.103 1.00 0.00 O ATOM 478 OE2 GLU A 31 40.929 -27.319 -7.542 1.00 0.00 O ATOM 0 H GLU A 31 36.399 -28.857 -10.093 1.00 0.00 H new ATOM 0 HA GLU A 31 38.604 -26.964 -10.551 1.00 0.00 H new ATOM 0 HB2 GLU A 31 38.480 -29.725 -9.295 1.00 0.00 H new ATOM 0 HB3 GLU A 31 39.970 -28.850 -9.583 1.00 0.00 H new ATOM 0 HG2 GLU A 31 37.729 -27.470 -8.087 1.00 0.00 H new ATOM 0 HG3 GLU A 31 38.712 -28.649 -7.241 1.00 0.00 H new ATOM 485 N LYS A 32 39.345 -27.838 -12.704 1.00 0.00 N ATOM 486 CA LYS A 32 39.794 -28.305 -14.004 1.00 0.00 C ATOM 487 C LYS A 32 41.054 -29.155 -13.828 1.00 0.00 C ATOM 488 O LYS A 32 42.006 -28.733 -13.174 1.00 0.00 O ATOM 489 CB LYS A 32 39.976 -27.128 -14.964 1.00 0.00 C ATOM 490 CG LYS A 32 41.112 -26.215 -14.502 1.00 0.00 C ATOM 491 CD LYS A 32 40.601 -24.799 -14.226 1.00 0.00 C ATOM 492 CE LYS A 32 41.032 -23.835 -15.332 1.00 0.00 C ATOM 493 NZ LYS A 32 42.502 -23.669 -15.330 1.00 0.00 N ATOM 0 H LYS A 32 39.607 -26.877 -12.483 1.00 0.00 H new ATOM 0 HA LYS A 32 39.038 -28.944 -14.460 1.00 0.00 H new ATOM 0 HB2 LYS A 32 40.189 -27.501 -15.966 1.00 0.00 H new ATOM 0 HB3 LYS A 32 39.049 -26.558 -15.026 1.00 0.00 H new ATOM 0 HG2 LYS A 32 41.567 -26.623 -13.600 1.00 0.00 H new ATOM 0 HG3 LYS A 32 41.890 -26.182 -15.265 1.00 0.00 H new ATOM 0 HD2 LYS A 32 39.514 -24.809 -14.151 1.00 0.00 H new ATOM 0 HD3 LYS A 32 40.983 -24.451 -13.266 1.00 0.00 H new ATOM 0 HE2 LYS A 32 40.704 -24.213 -16.300 1.00 0.00 H new ATOM 0 HE3 LYS A 32 40.551 -22.868 -15.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 42.746 -22.731 -15.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 42.860 -23.756 -14.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 42.935 -24.404 -15.925 1.00 0.00 H new ATOM 507 N GLY A 33 41.019 -30.339 -14.423 1.00 0.00 N ATOM 508 CA GLY A 33 42.147 -31.252 -14.341 1.00 0.00 C ATOM 509 C GLY A 33 41.676 -32.679 -14.056 1.00 0.00 C ATOM 510 O GLY A 33 42.110 -33.623 -14.714 1.00 0.00 O ATOM 0 H GLY A 33 40.227 -30.687 -14.964 1.00 0.00 H new ATOM 0 HA2 GLY A 33 42.707 -31.230 -15.276 1.00 0.00 H new ATOM 0 HA3 GLY A 33 42.827 -30.926 -13.554 1.00 0.00 H new ATOM 514 N HIS A 34 40.794 -32.793 -13.073 1.00 0.00 N ATOM 515 CA HIS A 34 40.259 -34.089 -12.693 1.00 0.00 C ATOM 516 C HIS A 34 38.764 -34.142 -13.013 1.00 0.00 C ATOM 517 O HIS A 34 38.105 -33.107 -13.087 1.00 0.00 O ATOM 518 CB HIS A 34 40.563 -34.393 -11.224 1.00 0.00 C ATOM 519 CG HIS A 34 39.786 -33.541 -10.249 1.00 0.00 C ATOM 520 ND1 HIS A 34 40.360 -32.497 -9.542 1.00 0.00 N ATOM 521 CD2 HIS A 34 38.477 -33.588 -9.870 1.00 0.00 C ATOM 522 CE1 HIS A 34 39.428 -31.950 -8.776 1.00 0.00 C ATOM 523 NE2 HIS A 34 38.262 -32.627 -8.980 1.00 0.00 N ATOM 0 H HIS A 34 40.437 -32.008 -12.528 1.00 0.00 H new ATOM 0 HA HIS A 34 40.747 -34.872 -13.274 1.00 0.00 H new ATOM 0 HB2 HIS A 34 40.345 -35.443 -11.028 1.00 0.00 H new ATOM 0 HB3 HIS A 34 41.629 -34.250 -11.047 1.00 0.00 H new ATOM 0 HD1 HIS A 34 41.334 -32.200 -9.601 1.00 0.00 H new ATOM 0 HD2 HIS A 34 37.740 -34.289 -10.233 1.00 0.00 H new ATOM 0 HE1 HIS A 34 39.567 -31.114 -8.107 1.00 0.00 H new ATOM 531 N TRP A 35 38.273 -35.359 -13.194 1.00 0.00 N ATOM 532 CA TRP A 35 36.868 -35.561 -13.505 1.00 0.00 C ATOM 533 C TRP A 35 36.104 -35.674 -12.184 1.00 0.00 C ATOM 534 O TRP A 35 36.694 -35.962 -11.144 1.00 0.00 O ATOM 535 CB TRP A 35 36.676 -36.778 -14.413 1.00 0.00 C ATOM 536 CG TRP A 35 36.617 -36.439 -15.903 1.00 0.00 C ATOM 537 CD1 TRP A 35 37.344 -35.536 -16.574 1.00 0.00 C ATOM 538 CD2 TRP A 35 35.747 -37.039 -16.887 1.00 0.00 C ATOM 539 NE1 TRP A 35 37.010 -35.510 -17.912 1.00 0.00 N ATOM 540 CE2 TRP A 35 36.008 -36.453 -18.109 1.00 0.00 C ATOM 541 CE3 TRP A 35 34.774 -38.043 -16.748 1.00 0.00 C ATOM 542 CZ2 TRP A 35 35.337 -36.805 -19.286 1.00 0.00 C ATOM 543 CZ3 TRP A 35 34.112 -38.383 -17.935 1.00 0.00 C ATOM 544 CH2 TRP A 35 34.362 -37.803 -19.173 1.00 0.00 C ATOM 0 H TRP A 35 38.823 -36.216 -13.131 1.00 0.00 H new ATOM 0 HA TRP A 35 36.471 -34.715 -14.066 1.00 0.00 H new ATOM 0 HB2 TRP A 35 37.494 -37.478 -14.242 1.00 0.00 H new ATOM 0 HB3 TRP A 35 35.755 -37.288 -14.130 1.00 0.00 H new ATOM 0 HD1 TRP A 35 38.098 -34.907 -16.124 1.00 0.00 H new ATOM 0 HE1 TRP A 35 37.422 -34.909 -18.626 1.00 0.00 H new ATOM 0 HE3 TRP A 35 34.554 -38.515 -15.802 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 35.560 -36.332 -20.231 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 33.354 -39.150 -17.884 1.00 0.00 H new ATOM 0 HH2 TRP A 35 33.807 -38.121 -20.043 1.00 0.00 H new ATOM 555 N ALA A 36 34.802 -35.440 -12.268 1.00 0.00 N ATOM 556 CA ALA A 36 33.951 -35.512 -11.093 1.00 0.00 C ATOM 557 C ALA A 36 34.023 -36.921 -10.503 1.00 0.00 C ATOM 558 O ALA A 36 33.945 -37.094 -9.287 1.00 0.00 O ATOM 559 CB ALA A 36 32.524 -35.109 -11.470 1.00 0.00 C ATOM 0 H ALA A 36 34.316 -35.200 -13.132 1.00 0.00 H new ATOM 0 HA ALA A 36 34.294 -34.816 -10.327 1.00 0.00 H new ATOM 0 HB1 ALA A 36 31.886 -35.163 -10.588 1.00 0.00 H new ATOM 0 HB2 ALA A 36 32.524 -34.090 -11.856 1.00 0.00 H new ATOM 0 HB3 ALA A 36 32.145 -35.787 -12.235 1.00 0.00 H new ATOM 565 N LYS A 37 34.170 -37.893 -11.390 1.00 0.00 N ATOM 566 CA LYS A 37 34.253 -39.283 -10.972 1.00 0.00 C ATOM 567 C LYS A 37 35.564 -39.506 -10.216 1.00 0.00 C ATOM 568 O LYS A 37 35.768 -40.562 -9.620 1.00 0.00 O ATOM 569 CB LYS A 37 34.067 -40.215 -12.171 1.00 0.00 C ATOM 570 CG LYS A 37 32.587 -40.351 -12.536 1.00 0.00 C ATOM 571 CD LYS A 37 32.280 -39.633 -13.852 1.00 0.00 C ATOM 572 CE LYS A 37 31.163 -40.346 -14.617 1.00 0.00 C ATOM 573 NZ LYS A 37 31.645 -41.639 -15.151 1.00 0.00 N ATOM 0 H LYS A 37 34.234 -37.746 -12.397 1.00 0.00 H new ATOM 0 HA LYS A 37 33.443 -39.523 -10.283 1.00 0.00 H new ATOM 0 HB2 LYS A 37 34.622 -39.829 -13.026 1.00 0.00 H new ATOM 0 HB3 LYS A 37 34.480 -41.197 -11.940 1.00 0.00 H new ATOM 0 HG2 LYS A 37 32.325 -41.406 -12.623 1.00 0.00 H new ATOM 0 HG3 LYS A 37 31.972 -39.935 -11.738 1.00 0.00 H new ATOM 0 HD2 LYS A 37 31.987 -38.603 -13.649 1.00 0.00 H new ATOM 0 HD3 LYS A 37 33.179 -39.593 -14.467 1.00 0.00 H new ATOM 0 HE2 LYS A 37 30.311 -40.513 -13.957 1.00 0.00 H new ATOM 0 HE3 LYS A 37 30.814 -39.715 -15.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 31.055 -41.922 -15.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 32.633 -41.540 -15.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 31.586 -42.365 -14.408 1.00 0.00 H new ATOM 587 N ASP A 38 36.418 -38.494 -10.265 1.00 0.00 N ATOM 588 CA ASP A 38 37.704 -38.566 -9.593 1.00 0.00 C ATOM 589 C ASP A 38 37.876 -37.338 -8.697 1.00 0.00 C ATOM 590 O ASP A 38 38.997 -36.976 -8.345 1.00 0.00 O ATOM 591 CB ASP A 38 38.854 -38.581 -10.602 1.00 0.00 C ATOM 592 CG ASP A 38 40.050 -39.449 -10.208 1.00 0.00 C ATOM 593 OD1 ASP A 38 41.041 -38.862 -9.723 1.00 0.00 O ATOM 594 OD2 ASP A 38 39.946 -40.680 -10.402 1.00 0.00 O ATOM 0 H ASP A 38 36.244 -37.619 -10.760 1.00 0.00 H new ATOM 0 HA ASP A 38 37.727 -39.485 -9.008 1.00 0.00 H new ATOM 0 HB2 ASP A 38 38.471 -38.930 -11.561 1.00 0.00 H new ATOM 0 HB3 ASP A 38 39.200 -37.558 -10.751 1.00 0.00 H new ATOM 599 N CYS A 39 36.749 -36.733 -8.355 1.00 0.00 N ATOM 600 CA CYS A 39 36.761 -35.553 -7.506 1.00 0.00 C ATOM 601 C CYS A 39 37.209 -35.973 -6.105 1.00 0.00 C ATOM 602 O CYS A 39 36.703 -36.949 -5.554 1.00 0.00 O ATOM 603 CB CYS A 39 35.398 -34.858 -7.485 1.00 0.00 C ATOM 604 SG CYS A 39 35.529 -33.252 -6.618 1.00 0.00 S ATOM 0 H CYS A 39 35.821 -37.037 -8.650 1.00 0.00 H new ATOM 0 HA CYS A 39 37.463 -34.821 -7.906 1.00 0.00 H new ATOM 0 HB2 CYS A 39 35.044 -34.703 -8.504 1.00 0.00 H new ATOM 0 HB3 CYS A 39 34.665 -35.492 -6.986 1.00 0.00 H new ATOM 609 N PRO A 40 38.179 -35.195 -5.555 1.00 0.00 N ATOM 610 CA PRO A 40 38.702 -35.477 -4.228 1.00 0.00 C ATOM 611 C PRO A 40 37.705 -35.058 -3.146 1.00 0.00 C ATOM 612 O PRO A 40 37.974 -35.212 -1.956 1.00 0.00 O ATOM 613 CB PRO A 40 40.015 -34.714 -4.153 1.00 0.00 C ATOM 614 CG PRO A 40 39.953 -33.668 -5.254 1.00 0.00 C ATOM 615 CD PRO A 40 38.803 -34.031 -6.178 1.00 0.00 C ATOM 0 HA PRO A 40 38.864 -36.541 -4.057 1.00 0.00 H new ATOM 0 HB2 PRO A 40 40.140 -34.246 -3.176 1.00 0.00 H new ATOM 0 HB3 PRO A 40 40.864 -35.382 -4.297 1.00 0.00 H new ATOM 0 HG2 PRO A 40 39.803 -32.675 -4.829 1.00 0.00 H new ATOM 0 HG3 PRO A 40 40.892 -33.639 -5.807 1.00 0.00 H new ATOM 0 HD2 PRO A 40 38.096 -33.207 -6.273 1.00 0.00 H new ATOM 0 HD3 PRO A 40 39.160 -34.263 -7.182 1.00 0.00 H new ATOM 623 N LYS A 41 36.573 -34.538 -3.598 1.00 0.00 N ATOM 624 CA LYS A 41 35.534 -34.097 -2.684 1.00 0.00 C ATOM 625 C LYS A 41 34.490 -35.205 -2.531 1.00 0.00 C ATOM 626 O LYS A 41 33.726 -35.214 -1.568 1.00 0.00 O ATOM 627 CB LYS A 41 34.949 -32.760 -3.142 1.00 0.00 C ATOM 628 CG LYS A 41 34.209 -32.064 -1.998 1.00 0.00 C ATOM 629 CD LYS A 41 33.380 -30.888 -2.516 1.00 0.00 C ATOM 630 CE LYS A 41 31.905 -31.050 -2.141 1.00 0.00 C ATOM 631 NZ LYS A 41 31.253 -29.727 -2.017 1.00 0.00 N ATOM 0 H LYS A 41 36.353 -34.412 -4.586 1.00 0.00 H new ATOM 0 HA LYS A 41 35.951 -33.913 -1.694 1.00 0.00 H new ATOM 0 HB2 LYS A 41 35.748 -32.116 -3.508 1.00 0.00 H new ATOM 0 HB3 LYS A 41 34.266 -32.924 -3.975 1.00 0.00 H new ATOM 0 HG2 LYS A 41 33.558 -32.778 -1.494 1.00 0.00 H new ATOM 0 HG3 LYS A 41 34.927 -31.710 -1.258 1.00 0.00 H new ATOM 0 HD2 LYS A 41 33.764 -29.956 -2.101 1.00 0.00 H new ATOM 0 HD3 LYS A 41 33.478 -30.818 -3.599 1.00 0.00 H new ATOM 0 HE2 LYS A 41 31.394 -31.644 -2.899 1.00 0.00 H new ATOM 0 HE3 LYS A 41 31.821 -31.593 -1.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 30.943 -29.583 -1.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 31.929 -28.981 -2.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 30.429 -29.686 -2.650 1.00 0.00 H new ATOM 645 N LYS A 42 34.492 -36.112 -3.497 1.00 0.00 N ATOM 646 CA LYS A 42 33.554 -37.222 -3.483 1.00 0.00 C ATOM 647 C LYS A 42 33.837 -38.107 -2.267 1.00 0.00 C ATOM 648 O LYS A 42 34.877 -38.761 -2.200 1.00 0.00 O ATOM 649 CB LYS A 42 33.594 -37.975 -4.814 1.00 0.00 C ATOM 650 CG LYS A 42 32.318 -37.730 -5.622 1.00 0.00 C ATOM 651 CD LYS A 42 32.060 -38.876 -6.602 1.00 0.00 C ATOM 652 CE LYS A 42 31.429 -38.359 -7.897 1.00 0.00 C ATOM 653 NZ LYS A 42 31.320 -39.450 -8.890 1.00 0.00 N ATOM 0 H LYS A 42 35.128 -36.101 -4.294 1.00 0.00 H new ATOM 0 HA LYS A 42 32.532 -36.856 -3.381 1.00 0.00 H new ATOM 0 HB2 LYS A 42 34.461 -37.654 -5.391 1.00 0.00 H new ATOM 0 HB3 LYS A 42 33.712 -39.043 -4.628 1.00 0.00 H new ATOM 0 HG2 LYS A 42 31.469 -37.627 -4.946 1.00 0.00 H new ATOM 0 HG3 LYS A 42 32.405 -36.791 -6.169 1.00 0.00 H new ATOM 0 HD2 LYS A 42 32.998 -39.384 -6.828 1.00 0.00 H new ATOM 0 HD3 LYS A 42 31.401 -39.612 -6.141 1.00 0.00 H new ATOM 0 HE2 LYS A 42 30.441 -37.948 -7.689 1.00 0.00 H new ATOM 0 HE3 LYS A 42 32.032 -37.547 -8.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 31.606 -39.098 -9.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 31.941 -40.236 -8.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 30.336 -39.784 -8.932 1.00 0.00 H new ATOM 667 N PRO A 43 32.869 -38.101 -1.313 1.00 0.00 N ATOM 668 CA PRO A 43 33.002 -38.894 -0.103 1.00 0.00 C ATOM 669 C PRO A 43 32.757 -40.377 -0.391 1.00 0.00 C ATOM 670 O PRO A 43 31.849 -40.981 0.179 1.00 0.00 O ATOM 671 CB PRO A 43 31.996 -38.303 0.869 1.00 0.00 C ATOM 672 CG PRO A 43 31.015 -37.508 0.022 1.00 0.00 C ATOM 673 CD PRO A 43 31.624 -37.339 -1.360 1.00 0.00 C ATOM 0 HA PRO A 43 34.008 -38.857 0.316 1.00 0.00 H new ATOM 0 HB2 PRO A 43 31.484 -39.088 1.426 1.00 0.00 H new ATOM 0 HB3 PRO A 43 32.489 -37.662 1.600 1.00 0.00 H new ATOM 0 HG2 PRO A 43 30.059 -38.027 -0.043 1.00 0.00 H new ATOM 0 HG3 PRO A 43 30.820 -36.536 0.475 1.00 0.00 H new ATOM 0 HD2 PRO A 43 30.958 -37.717 -2.135 1.00 0.00 H new ATOM 0 HD3 PRO A 43 31.811 -36.289 -1.585 1.00 0.00 H new ATOM 681 N ARG A 44 33.582 -40.920 -1.274 1.00 0.00 N ATOM 682 CA ARG A 44 33.465 -42.321 -1.644 1.00 0.00 C ATOM 683 C ARG A 44 34.848 -42.914 -1.918 1.00 0.00 C ATOM 684 O ARG A 44 35.685 -42.279 -2.558 1.00 0.00 O ATOM 685 CB ARG A 44 32.589 -42.491 -2.887 1.00 0.00 C ATOM 686 CG ARG A 44 31.106 -42.515 -2.514 1.00 0.00 C ATOM 687 CD ARG A 44 30.325 -41.461 -3.302 1.00 0.00 C ATOM 688 NE ARG A 44 28.952 -41.942 -3.567 1.00 0.00 N ATOM 689 CZ ARG A 44 27.928 -41.800 -2.714 1.00 0.00 C ATOM 690 NH1 ARG A 44 28.118 -41.191 -1.535 1.00 0.00 N ATOM 691 NH2 ARG A 44 26.715 -42.268 -3.039 1.00 0.00 N ATOM 0 H ARG A 44 34.334 -40.416 -1.744 1.00 0.00 H new ATOM 0 HA ARG A 44 32.999 -42.847 -0.811 1.00 0.00 H new ATOM 0 HB2 ARG A 44 32.779 -41.675 -3.584 1.00 0.00 H new ATOM 0 HB3 ARG A 44 32.854 -43.416 -3.399 1.00 0.00 H new ATOM 0 HG2 ARG A 44 30.693 -43.504 -2.714 1.00 0.00 H new ATOM 0 HG3 ARG A 44 30.993 -42.333 -1.445 1.00 0.00 H new ATOM 0 HD2 ARG A 44 30.290 -40.527 -2.741 1.00 0.00 H new ATOM 0 HD3 ARG A 44 30.833 -41.248 -4.243 1.00 0.00 H new ATOM 0 HE ARG A 44 28.773 -42.411 -4.455 1.00 0.00 H new ATOM 0 HH11 ARG A 44 29.042 -40.836 -1.287 1.00 0.00 H new ATOM 0 HH12 ARG A 44 27.339 -41.083 -0.886 1.00 0.00 H new ATOM 0 HH21 ARG A 44 26.571 -42.732 -3.936 1.00 0.00 H new ATOM 0 HH22 ARG A 44 25.936 -42.160 -2.390 1.00 0.00 H new ATOM 705 N GLY A 45 35.047 -44.126 -1.419 1.00 0.00 N ATOM 706 CA GLY A 45 36.315 -44.812 -1.601 1.00 0.00 C ATOM 707 C GLY A 45 37.108 -44.855 -0.295 1.00 0.00 C ATOM 708 O GLY A 45 36.640 -44.374 0.736 1.00 0.00 O ATOM 0 H GLY A 45 34.351 -44.650 -0.889 1.00 0.00 H new ATOM 0 HA2 GLY A 45 36.136 -45.827 -1.955 1.00 0.00 H new ATOM 0 HA3 GLY A 45 36.900 -44.305 -2.369 1.00 0.00 H new ATOM 712 N PRO A 46 38.327 -45.451 -0.382 1.00 0.00 N ATOM 713 CA PRO A 46 38.805 -45.996 -1.641 1.00 0.00 C ATOM 714 C PRO A 46 38.100 -47.312 -1.973 1.00 0.00 C ATOM 715 O PRO A 46 38.373 -47.924 -3.005 1.00 0.00 O ATOM 716 CB PRO A 46 40.305 -46.158 -1.455 1.00 0.00 C ATOM 717 CG PRO A 46 40.544 -46.138 0.045 1.00 0.00 C ATOM 718 CD PRO A 46 39.278 -45.623 0.712 1.00 0.00 C ATOM 0 HA PRO A 46 38.589 -45.346 -2.489 1.00 0.00 H new ATOM 0 HB2 PRO A 46 40.654 -47.093 -1.894 1.00 0.00 H new ATOM 0 HB3 PRO A 46 40.849 -45.352 -1.948 1.00 0.00 H new ATOM 0 HG2 PRO A 46 40.786 -47.137 0.406 1.00 0.00 H new ATOM 0 HG3 PRO A 46 41.391 -45.497 0.288 1.00 0.00 H new ATOM 0 HD2 PRO A 46 38.905 -46.330 1.453 1.00 0.00 H new ATOM 0 HD3 PRO A 46 39.459 -44.682 1.231 1.00 0.00 H new ATOM 726 N ARG A 47 37.204 -47.708 -1.080 1.00 0.00 N ATOM 727 CA ARG A 47 36.456 -48.940 -1.266 1.00 0.00 C ATOM 728 C ARG A 47 35.534 -48.824 -2.481 1.00 0.00 C ATOM 729 O ARG A 47 34.361 -48.479 -2.343 1.00 0.00 O ATOM 730 CB ARG A 47 35.620 -49.268 -0.028 1.00 0.00 C ATOM 731 CG ARG A 47 35.914 -50.683 0.474 1.00 0.00 C ATOM 732 CD ARG A 47 36.479 -50.654 1.895 1.00 0.00 C ATOM 733 NE ARG A 47 36.664 -52.035 2.395 1.00 0.00 N ATOM 734 CZ ARG A 47 37.758 -52.775 2.169 1.00 0.00 C ATOM 735 NH1 ARG A 47 38.771 -52.271 1.452 1.00 0.00 N ATOM 736 NH2 ARG A 47 37.839 -54.019 2.661 1.00 0.00 N ATOM 0 H ARG A 47 36.979 -47.197 -0.226 1.00 0.00 H new ATOM 0 HA ARG A 47 37.175 -49.743 -1.428 1.00 0.00 H new ATOM 0 HB2 ARG A 47 35.834 -48.547 0.761 1.00 0.00 H new ATOM 0 HB3 ARG A 47 34.560 -49.176 -0.266 1.00 0.00 H new ATOM 0 HG2 ARG A 47 35.000 -51.277 0.454 1.00 0.00 H new ATOM 0 HG3 ARG A 47 36.625 -51.169 -0.194 1.00 0.00 H new ATOM 0 HD2 ARG A 47 37.431 -50.124 1.906 1.00 0.00 H new ATOM 0 HD3 ARG A 47 35.803 -50.108 2.553 1.00 0.00 H new ATOM 0 HE ARG A 47 35.912 -52.449 2.946 1.00 0.00 H new ATOM 0 HH11 ARG A 47 38.710 -51.324 1.078 1.00 0.00 H new ATOM 0 HH12 ARG A 47 39.604 -52.834 1.280 1.00 0.00 H new ATOM 0 HH21 ARG A 47 37.068 -54.403 3.207 1.00 0.00 H new ATOM 0 HH22 ARG A 47 38.672 -54.582 2.489 1.00 0.00 H new ATOM 750 N GLY A 48 36.099 -49.117 -3.643 1.00 0.00 N ATOM 751 CA GLY A 48 35.341 -49.049 -4.882 1.00 0.00 C ATOM 752 C GLY A 48 35.962 -49.948 -5.953 1.00 0.00 C ATOM 753 O GLY A 48 36.911 -49.550 -6.628 1.00 0.00 O ATOM 0 H GLY A 48 37.072 -49.402 -3.753 1.00 0.00 H new ATOM 0 HA2 GLY A 48 34.310 -49.353 -4.699 1.00 0.00 H new ATOM 0 HA3 GLY A 48 35.311 -48.019 -5.239 1.00 0.00 H new ATOM 757 N PRO A 49 35.386 -51.173 -6.081 1.00 0.00 N ATOM 758 CA PRO A 49 35.873 -52.131 -7.059 1.00 0.00 C ATOM 759 C PRO A 49 35.436 -51.740 -8.472 1.00 0.00 C ATOM 760 O PRO A 49 34.453 -51.020 -8.645 1.00 0.00 O ATOM 761 CB PRO A 49 35.311 -53.470 -6.612 1.00 0.00 C ATOM 762 CG PRO A 49 34.159 -53.147 -5.675 1.00 0.00 C ATOM 763 CD PRO A 49 34.261 -51.678 -5.299 1.00 0.00 C ATOM 0 HA PRO A 49 36.961 -52.168 -7.107 1.00 0.00 H new ATOM 0 HB2 PRO A 49 34.968 -54.054 -7.466 1.00 0.00 H new ATOM 0 HB3 PRO A 49 36.072 -54.063 -6.105 1.00 0.00 H new ATOM 0 HG2 PRO A 49 33.204 -53.351 -6.159 1.00 0.00 H new ATOM 0 HG3 PRO A 49 34.205 -53.773 -4.784 1.00 0.00 H new ATOM 0 HD2 PRO A 49 33.341 -51.143 -5.537 1.00 0.00 H new ATOM 0 HD3 PRO A 49 34.434 -51.554 -4.230 1.00 0.00 H new ATOM 771 N ARG A 50 36.186 -52.232 -9.447 1.00 0.00 N ATOM 772 CA ARG A 50 35.888 -51.944 -10.840 1.00 0.00 C ATOM 773 C ARG A 50 36.247 -53.145 -11.718 1.00 0.00 C ATOM 774 O ARG A 50 37.177 -53.888 -11.410 1.00 0.00 O ATOM 775 CB ARG A 50 36.661 -50.717 -11.325 1.00 0.00 C ATOM 776 CG ARG A 50 36.117 -49.438 -10.685 1.00 0.00 C ATOM 777 CD ARG A 50 34.765 -49.054 -11.291 1.00 0.00 C ATOM 778 NE ARG A 50 34.478 -47.627 -11.023 1.00 0.00 N ATOM 779 CZ ARG A 50 33.443 -46.958 -11.547 1.00 0.00 C ATOM 780 NH1 ARG A 50 32.590 -47.583 -12.370 1.00 0.00 N ATOM 781 NH2 ARG A 50 33.261 -45.664 -11.250 1.00 0.00 N ATOM 0 H ARG A 50 37.000 -52.829 -9.300 1.00 0.00 H new ATOM 0 HA ARG A 50 34.820 -51.740 -10.916 1.00 0.00 H new ATOM 0 HB2 ARG A 50 37.718 -50.829 -11.082 1.00 0.00 H new ATOM 0 HB3 ARG A 50 36.590 -50.644 -12.410 1.00 0.00 H new ATOM 0 HG2 ARG A 50 36.010 -49.582 -9.610 1.00 0.00 H new ATOM 0 HG3 ARG A 50 36.828 -48.624 -10.828 1.00 0.00 H new ATOM 0 HD2 ARG A 50 34.774 -49.236 -12.366 1.00 0.00 H new ATOM 0 HD3 ARG A 50 33.977 -49.678 -10.868 1.00 0.00 H new ATOM 0 HE ARG A 50 35.108 -47.121 -10.400 1.00 0.00 H new ATOM 0 HH11 ARG A 50 32.729 -48.568 -12.597 1.00 0.00 H new ATOM 0 HH12 ARG A 50 31.801 -47.074 -12.769 1.00 0.00 H new ATOM 0 HH21 ARG A 50 33.911 -45.188 -10.624 1.00 0.00 H new ATOM 0 HH22 ARG A 50 32.472 -45.155 -11.649 1.00 0.00 H new ATOM 795 N PRO A 51 35.470 -53.301 -12.823 1.00 0.00 N ATOM 796 CA PRO A 51 35.696 -54.398 -13.748 1.00 0.00 C ATOM 797 C PRO A 51 36.933 -54.141 -14.612 1.00 0.00 C ATOM 798 O PRO A 51 36.905 -53.296 -15.506 1.00 0.00 O ATOM 799 CB PRO A 51 34.414 -54.497 -14.560 1.00 0.00 C ATOM 800 CG PRO A 51 33.702 -53.167 -14.382 1.00 0.00 C ATOM 801 CD PRO A 51 34.359 -52.439 -13.219 1.00 0.00 C ATOM 0 HA PRO A 51 35.905 -55.340 -13.241 1.00 0.00 H new ATOM 0 HB2 PRO A 51 34.632 -54.685 -15.611 1.00 0.00 H new ATOM 0 HB3 PRO A 51 33.793 -55.322 -14.210 1.00 0.00 H new ATOM 0 HG2 PRO A 51 33.771 -52.572 -15.293 1.00 0.00 H new ATOM 0 HG3 PRO A 51 32.642 -53.325 -14.184 1.00 0.00 H new ATOM 0 HD2 PRO A 51 34.711 -51.452 -13.518 1.00 0.00 H new ATOM 0 HD3 PRO A 51 33.659 -52.293 -12.397 1.00 0.00 H new ATOM 809 N GLN A 52 37.987 -54.885 -14.315 1.00 0.00 N ATOM 810 CA GLN A 52 39.231 -54.748 -15.053 1.00 0.00 C ATOM 811 C GLN A 52 39.043 -55.206 -16.501 1.00 0.00 C ATOM 812 O GLN A 52 38.268 -56.123 -16.770 1.00 0.00 O ATOM 813 CB GLN A 52 40.360 -55.527 -14.374 1.00 0.00 C ATOM 814 CG GLN A 52 41.670 -55.381 -15.150 1.00 0.00 C ATOM 815 CD GLN A 52 42.865 -55.296 -14.198 1.00 0.00 C ATOM 816 OE1 GLN A 52 42.876 -55.870 -13.121 1.00 0.00 O ATOM 817 NE2 GLN A 52 43.868 -54.551 -14.653 1.00 0.00 N ATOM 0 H GLN A 52 38.006 -55.585 -13.573 1.00 0.00 H new ATOM 0 HA GLN A 52 39.513 -53.695 -15.059 1.00 0.00 H new ATOM 0 HB2 GLN A 52 40.495 -55.165 -13.355 1.00 0.00 H new ATOM 0 HB3 GLN A 52 40.089 -56.581 -14.305 1.00 0.00 H new ATOM 0 HG2 GLN A 52 41.795 -56.230 -15.822 1.00 0.00 H new ATOM 0 HG3 GLN A 52 41.631 -54.486 -15.771 1.00 0.00 H new ATOM 0 HE21 GLN A 52 43.794 -54.098 -15.564 1.00 0.00 H new ATOM 0 HE22 GLN A 52 44.711 -54.433 -14.091 1.00 0.00 H new ATOM 826 N THR A 53 39.765 -54.547 -17.395 1.00 0.00 N ATOM 827 CA THR A 53 39.687 -54.875 -18.808 1.00 0.00 C ATOM 828 C THR A 53 41.067 -55.262 -19.343 1.00 0.00 C ATOM 829 O THR A 53 42.081 -55.012 -18.693 1.00 0.00 O ATOM 830 CB THR A 53 39.066 -53.682 -19.536 1.00 0.00 C ATOM 831 OG1 THR A 53 39.881 -52.578 -19.153 1.00 0.00 O ATOM 832 CG2 THR A 53 37.678 -53.325 -18.999 1.00 0.00 C ATOM 0 H THR A 53 40.407 -53.787 -17.168 1.00 0.00 H new ATOM 0 HA THR A 53 39.052 -55.745 -18.978 1.00 0.00 H new ATOM 0 HB THR A 53 38.997 -53.904 -20.601 1.00 0.00 H new ATOM 0 HG1 THR A 53 39.549 -51.762 -19.582 1.00 0.00 H new ATOM 0 HG21 THR A 53 37.283 -52.472 -19.550 1.00 0.00 H new ATOM 0 HG22 THR A 53 37.010 -54.177 -19.122 1.00 0.00 H new ATOM 0 HG23 THR A 53 37.751 -53.071 -17.942 1.00 0.00 H new ATOM 840 N SER A 54 41.062 -55.865 -20.522 1.00 0.00 N ATOM 841 CA SER A 54 42.301 -56.289 -21.152 1.00 0.00 C ATOM 842 C SER A 54 42.200 -56.125 -22.670 1.00 0.00 C ATOM 843 O SER A 54 42.995 -55.407 -23.274 1.00 0.00 O ATOM 844 CB SER A 54 42.632 -57.739 -20.796 1.00 0.00 C ATOM 845 OG SER A 54 41.587 -58.633 -21.172 1.00 0.00 O ATOM 0 H SER A 54 40.219 -56.070 -21.058 1.00 0.00 H new ATOM 0 HA SER A 54 43.107 -55.658 -20.778 1.00 0.00 H new ATOM 0 HB2 SER A 54 43.557 -58.032 -21.293 1.00 0.00 H new ATOM 0 HB3 SER A 54 42.808 -57.818 -19.723 1.00 0.00 H new ATOM 0 HG SER A 54 41.837 -59.549 -20.930 1.00 0.00 H new ATOM 851 N LEU A 55 41.214 -56.802 -23.242 1.00 0.00 N ATOM 852 CA LEU A 55 40.999 -56.740 -24.676 1.00 0.00 C ATOM 853 C LEU A 55 39.641 -56.093 -24.957 1.00 0.00 C ATOM 854 O LEU A 55 39.503 -55.314 -25.899 1.00 0.00 O ATOM 855 CB LEU A 55 41.160 -58.126 -25.303 1.00 0.00 C ATOM 856 CG LEU A 55 40.170 -59.194 -24.833 1.00 0.00 C ATOM 857 CD1 LEU A 55 39.360 -59.746 -26.006 1.00 0.00 C ATOM 858 CD2 LEU A 55 40.886 -60.303 -24.059 1.00 0.00 C ATOM 0 H LEU A 55 40.556 -57.396 -22.737 1.00 0.00 H new ATOM 0 HA LEU A 55 41.756 -56.112 -25.147 1.00 0.00 H new ATOM 0 HB2 LEU A 55 41.070 -58.026 -26.385 1.00 0.00 H new ATOM 0 HB3 LEU A 55 42.170 -58.480 -25.099 1.00 0.00 H new ATOM 0 HG LEU A 55 39.464 -58.726 -24.147 1.00 0.00 H new ATOM 0 HD11 LEU A 55 38.664 -60.503 -25.644 1.00 0.00 H new ATOM 0 HD12 LEU A 55 38.802 -58.936 -26.476 1.00 0.00 H new ATOM 0 HD13 LEU A 55 40.035 -60.193 -26.736 1.00 0.00 H new ATOM 0 HD21 LEU A 55 40.160 -61.049 -23.736 1.00 0.00 H new ATOM 0 HD22 LEU A 55 41.629 -60.774 -24.702 1.00 0.00 H new ATOM 0 HD23 LEU A 55 41.380 -59.877 -23.186 1.00 0.00 H new ATOM 870 N LEU A 56 38.673 -56.439 -24.121 1.00 0.00 N ATOM 871 CA LEU A 56 37.330 -55.902 -24.267 1.00 0.00 C ATOM 872 C LEU A 56 36.963 -55.855 -25.752 1.00 0.00 C ATOM 873 O LEU A 56 36.326 -56.773 -26.267 1.00 0.00 O ATOM 874 CB LEU A 56 37.215 -54.549 -23.561 1.00 0.00 C ATOM 875 CG LEU A 56 35.803 -54.125 -23.151 1.00 0.00 C ATOM 876 CD1 LEU A 56 35.847 -53.107 -22.010 1.00 0.00 C ATOM 877 CD2 LEU A 56 35.016 -53.604 -24.355 1.00 0.00 C ATOM 0 H LEU A 56 38.792 -57.085 -23.340 1.00 0.00 H new ATOM 0 HA LEU A 56 36.604 -56.552 -23.780 1.00 0.00 H new ATOM 0 HB2 LEU A 56 37.840 -54.573 -22.668 1.00 0.00 H new ATOM 0 HB3 LEU A 56 37.627 -53.783 -24.218 1.00 0.00 H new ATOM 0 HG LEU A 56 35.276 -55.004 -22.778 1.00 0.00 H new ATOM 0 HD11 LEU A 56 34.831 -52.822 -21.737 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.344 -53.549 -21.147 1.00 0.00 H new ATOM 0 HD13 LEU A 56 36.398 -52.223 -22.332 1.00 0.00 H new ATOM 0 HD21 LEU A 56 34.016 -53.309 -24.036 1.00 0.00 H new ATOM 0 HD22 LEU A 56 35.530 -52.742 -24.780 1.00 0.00 H new ATOM 0 HD23 LEU A 56 34.940 -54.389 -25.108 1.00 0.00 H new TER 889 LEU A 56 ATOM 890 P A B 493 20.556 -31.748 -5.939 1.00 0.00 P ATOM 891 OP1 A B 493 19.886 -31.096 -7.086 1.00 0.00 O ATOM 892 OP2 A B 493 21.155 -33.083 -6.165 1.00 0.00 O ATOM 893 O5' A B 493 21.712 -30.770 -5.421 1.00 0.00 O ATOM 894 C5' A B 493 21.436 -29.823 -4.390 1.00 0.00 C ATOM 895 C4' A B 493 22.104 -30.249 -3.102 1.00 0.00 C ATOM 896 O4' A B 493 21.725 -31.631 -2.861 1.00 0.00 O ATOM 897 C3' A B 493 23.570 -30.645 -3.252 1.00 0.00 C ATOM 898 O3' A B 493 24.380 -29.471 -3.259 1.00 0.00 O ATOM 899 C2' A B 493 23.869 -31.516 -2.064 1.00 0.00 C ATOM 900 O2' A B 493 24.090 -30.575 -1.038 1.00 0.00 O ATOM 901 C1' A B 493 22.570 -32.308 -1.957 1.00 0.00 C ATOM 902 N9 A B 493 22.715 -33.732 -2.327 1.00 0.00 N ATOM 903 C8 A B 493 23.242 -34.234 -3.463 1.00 0.00 C ATOM 904 N7 A B 493 23.228 -35.562 -3.491 1.00 0.00 N ATOM 905 C5 A B 493 22.655 -35.911 -2.297 1.00 0.00 C ATOM 906 C6 A B 493 22.363 -37.171 -1.733 1.00 0.00 C ATOM 907 N6 A B 493 22.622 -38.361 -2.333 1.00 0.00 N ATOM 908 N1 A B 493 21.780 -37.186 -0.503 1.00 0.00 N ATOM 909 C2 A B 493 21.518 -36.005 0.101 1.00 0.00 C ATOM 910 N3 A B 493 21.752 -34.756 -0.340 1.00 0.00 N ATOM 911 C4 A B 493 22.334 -34.809 -1.571 1.00 0.00 C ATOM 0 H5' A B 493 20.360 -29.740 -4.240 1.00 0.00 H new ATOM 0 H5'' A B 493 21.794 -28.837 -4.686 1.00 0.00 H new ATOM 0 H4' A B 493 21.878 -29.434 -2.414 1.00 0.00 H new ATOM 0 H3' A B 493 23.774 -31.175 -4.182 1.00 0.00 H new ATOM 0 H2' A B 493 24.714 -32.204 -2.071 1.00 0.00 H new ATOM 0 HO2' A B 493 24.446 -29.747 -1.424 1.00 0.00 H new ATOM 0 H1' A B 493 22.197 -32.346 -0.934 1.00 0.00 H new ATOM 0 H8 A B 493 23.633 -33.622 -4.263 1.00 0.00 H new ATOM 0 H61 A B 493 22.382 -39.233 -1.861 1.00 0.00 H new ATOM 0 H62 A B 493 23.057 -38.383 -3.255 1.00 0.00 H new ATOM 0 H2 A B 493 21.056 -36.074 1.075 1.00 0.00 H new ATOM 923 P A B 494 24.932 -28.889 -4.643 1.00 0.00 P ATOM 924 OP1 A B 494 26.068 -27.978 -4.382 1.00 0.00 O ATOM 925 OP2 A B 494 23.806 -28.363 -5.446 1.00 0.00 O ATOM 926 O5' A B 494 25.501 -30.190 -5.381 1.00 0.00 O ATOM 927 C5' A B 494 25.911 -30.114 -6.744 1.00 0.00 C ATOM 928 C4' A B 494 26.023 -31.503 -7.331 1.00 0.00 C ATOM 929 O4' A B 494 27.401 -31.851 -7.317 1.00 0.00 O ATOM 930 C3' A B 494 25.344 -32.592 -6.506 1.00 0.00 C ATOM 931 O3' A B 494 24.519 -33.386 -7.357 1.00 0.00 O ATOM 932 C2' A B 494 26.466 -33.401 -5.915 1.00 0.00 C ATOM 933 O2' A B 494 26.523 -34.522 -6.768 1.00 0.00 O ATOM 934 C1' A B 494 27.624 -32.417 -6.046 1.00 0.00 C ATOM 935 N9 A B 494 27.639 -31.379 -4.993 1.00 0.00 N ATOM 936 C8 A B 494 27.022 -31.420 -3.794 1.00 0.00 C ATOM 937 N7 A B 494 27.231 -30.323 -3.072 1.00 0.00 N ATOM 938 C5 A B 494 28.026 -29.550 -3.873 1.00 0.00 C ATOM 939 C6 A B 494 28.589 -28.271 -3.676 1.00 0.00 C ATOM 940 N6 A B 494 28.422 -27.520 -2.557 1.00 0.00 N ATOM 941 N1 A B 494 29.352 -27.760 -4.682 1.00 0.00 N ATOM 942 C2 A B 494 29.524 -28.501 -5.801 1.00 0.00 C ATOM 943 N3 A B 494 29.039 -29.721 -6.093 1.00 0.00 N ATOM 944 C4 A B 494 28.288 -30.175 -5.051 1.00 0.00 C ATOM 0 H5' A B 494 26.871 -29.602 -6.815 1.00 0.00 H new ATOM 0 H5'' A B 494 25.193 -29.526 -7.316 1.00 0.00 H new ATOM 0 H4' A B 494 25.552 -31.461 -8.313 1.00 0.00 H new ATOM 0 H3' A B 494 24.700 -32.192 -5.723 1.00 0.00 H new ATOM 0 H2' A B 494 26.415 -33.768 -4.890 1.00 0.00 H new ATOM 0 HO2' A B 494 27.025 -34.292 -7.577 1.00 0.00 H new ATOM 0 H1' A B 494 28.592 -32.906 -5.935 1.00 0.00 H new ATOM 0 H8 A B 494 26.423 -32.253 -3.457 1.00 0.00 H new ATOM 0 H61 A B 494 28.862 -26.602 -2.488 1.00 0.00 H new ATOM 0 H62 A B 494 27.857 -27.874 -1.785 1.00 0.00 H new ATOM 0 H2 A B 494 30.137 -28.049 -6.567 1.00 0.00 H new ATOM 956 P C B 495 24.998 -33.726 -8.845 1.00 0.00 P ATOM 957 OP1 C B 495 24.427 -32.740 -9.790 1.00 0.00 O ATOM 958 OP2 C B 495 24.764 -35.159 -9.129 1.00 0.00 O ATOM 959 O5' C B 495 26.580 -33.487 -8.778 1.00 0.00 O ATOM 960 C5' C B 495 27.241 -32.794 -9.833 1.00 0.00 C ATOM 961 C4' C B 495 28.001 -33.773 -10.701 1.00 0.00 C ATOM 962 O4' C B 495 28.762 -34.681 -9.896 1.00 0.00 O ATOM 963 C3' C B 495 27.137 -34.868 -11.319 1.00 0.00 C ATOM 964 O3' C B 495 26.490 -34.362 -12.484 1.00 0.00 O ATOM 965 C2' C B 495 28.091 -35.982 -11.658 1.00 0.00 C ATOM 966 O2' C B 495 28.685 -35.526 -12.852 1.00 0.00 O ATOM 967 C1' C B 495 28.994 -35.966 -10.428 1.00 0.00 C ATOM 968 N1 C B 495 28.667 -37.019 -9.444 1.00 0.00 N ATOM 969 C2 C B 495 28.995 -38.334 -9.769 1.00 0.00 C ATOM 970 O2 C B 495 29.539 -38.557 -10.857 1.00 0.00 O ATOM 971 N3 C B 495 28.707 -39.310 -8.889 1.00 0.00 N ATOM 972 C4 C B 495 28.127 -39.055 -7.734 1.00 0.00 C ATOM 973 N4 C B 495 27.852 -40.032 -6.879 1.00 0.00 N ATOM 974 C5 C B 495 27.777 -37.701 -7.372 1.00 0.00 C ATOM 975 C6 C B 495 28.070 -36.738 -8.259 1.00 0.00 C ATOM 0 H5' C B 495 27.926 -32.054 -9.419 1.00 0.00 H new ATOM 0 H5'' C B 495 26.512 -32.252 -10.435 1.00 0.00 H new ATOM 0 H4' C B 495 28.511 -33.104 -11.394 1.00 0.00 H new ATOM 0 H3' C B 495 26.352 -35.218 -10.649 1.00 0.00 H new ATOM 0 H2' C B 495 27.733 -36.997 -11.832 1.00 0.00 H new ATOM 0 HO2' C B 495 28.098 -34.868 -13.279 1.00 0.00 H new ATOM 0 H1' C B 495 30.035 -36.167 -10.681 1.00 0.00 H new ATOM 0 H41 C B 495 27.403 -39.819 -5.988 1.00 0.00 H new ATOM 0 H42 C B 495 28.090 -40.996 -7.112 1.00 0.00 H new ATOM 0 H5 C B 495 27.301 -37.474 -6.430 1.00 0.00 H new ATOM 0 H6 C B 495 27.824 -35.713 -8.023 1.00 0.00 H new ATOM 987 P A B 496 24.925 -34.618 -12.705 1.00 0.00 P ATOM 988 OP1 A B 496 24.212 -34.488 -11.414 1.00 0.00 O ATOM 989 OP2 A B 496 24.728 -35.868 -13.471 1.00 0.00 O ATOM 990 O5' A B 496 24.488 -33.393 -13.636 1.00 0.00 O ATOM 991 C5' A B 496 23.931 -33.641 -14.925 1.00 0.00 C ATOM 992 C4' A B 496 24.696 -32.872 -15.979 1.00 0.00 C ATOM 993 O4' A B 496 24.989 -31.544 -15.506 1.00 0.00 O ATOM 994 C3' A B 496 26.146 -33.315 -16.155 1.00 0.00 C ATOM 995 O3' A B 496 26.200 -34.406 -17.070 1.00 0.00 O ATOM 996 C2' A B 496 26.867 -32.109 -16.689 1.00 0.00 C ATOM 997 O2' A B 496 26.494 -32.102 -18.050 1.00 0.00 O ATOM 998 C1' A B 496 26.250 -31.006 -15.835 1.00 0.00 C ATOM 999 N9 A B 496 27.032 -30.696 -14.619 1.00 0.00 N ATOM 1000 C8 A B 496 27.155 -31.453 -13.509 1.00 0.00 C ATOM 1001 N7 A B 496 27.932 -30.891 -12.589 1.00 0.00 N ATOM 1002 C5 A B 496 28.317 -29.708 -13.161 1.00 0.00 C ATOM 1003 C6 A B 496 29.143 -28.666 -12.689 1.00 0.00 C ATOM 1004 N6 A B 496 29.751 -28.658 -11.475 1.00 0.00 N ATOM 1005 N1 A B 496 29.337 -27.599 -13.512 1.00 0.00 N ATOM 1006 C2 A B 496 28.735 -27.600 -14.722 1.00 0.00 C ATOM 1007 N3 A B 496 27.933 -28.532 -15.271 1.00 0.00 N ATOM 1008 C4 A B 496 27.778 -29.569 -14.401 1.00 0.00 C ATOM 0 H5' A B 496 22.882 -33.346 -14.939 1.00 0.00 H new ATOM 0 H5'' A B 496 23.966 -34.708 -15.145 1.00 0.00 H new ATOM 0 H4' A B 496 24.068 -32.992 -16.862 1.00 0.00 H new ATOM 0 H3' A B 496 26.601 -33.659 -15.226 1.00 0.00 H new ATOM 0 H2' A B 496 27.954 -32.039 -16.642 1.00 0.00 H new ATOM 0 HO2' A B 496 26.099 -32.967 -18.285 1.00 0.00 H new ATOM 0 H1' A B 496 26.208 -30.053 -16.363 1.00 0.00 H new ATOM 0 H8 A B 496 26.674 -32.412 -13.382 1.00 0.00 H new ATOM 0 H61 A B 496 30.335 -27.868 -11.202 1.00 0.00 H new ATOM 0 H62 A B 496 29.624 -29.442 -10.836 1.00 0.00 H new ATOM 0 H2 A B 496 28.924 -26.731 -15.335 1.00 0.00 H new ATOM 1020 P G B 497 25.817 -35.881 -16.582 1.00 0.00 P ATOM 1021 OP1 G B 497 24.372 -36.118 -16.797 1.00 0.00 O ATOM 1022 OP2 G B 497 26.351 -36.109 -15.221 1.00 0.00 O ATOM 1023 O5' G B 497 26.627 -36.817 -17.595 1.00 0.00 O ATOM 1024 C5' G B 497 26.451 -36.667 -19.001 1.00 0.00 C ATOM 1025 C4' G B 497 27.789 -36.460 -19.674 1.00 0.00 C ATOM 1026 O4' G B 497 28.514 -35.403 -19.019 1.00 0.00 O ATOM 1027 C3' G B 497 28.822 -37.541 -19.370 1.00 0.00 C ATOM 1028 O3' G B 497 28.622 -38.648 -20.246 1.00 0.00 O ATOM 1029 C2' G B 497 30.158 -36.890 -19.599 1.00 0.00 C ATOM 1030 O2' G B 497 30.269 -36.898 -21.004 1.00 0.00 O ATOM 1031 C1' G B 497 29.918 -35.521 -18.968 1.00 0.00 C ATOM 1032 N9 G B 497 30.413 -35.417 -17.579 1.00 0.00 N ATOM 1033 C8 G B 497 29.959 -36.082 -16.496 1.00 0.00 C ATOM 1034 N7 G B 497 30.618 -35.766 -15.386 1.00 0.00 N ATOM 1035 C5 G B 497 31.542 -34.845 -15.804 1.00 0.00 C ATOM 1036 C6 G B 497 32.536 -34.133 -15.101 1.00 0.00 C ATOM 1037 O6 G B 497 32.760 -34.225 -13.895 1.00 0.00 O ATOM 1038 N1 G B 497 33.313 -33.272 -15.814 1.00 0.00 N ATOM 1039 C2 G B 497 33.089 -33.150 -17.141 1.00 0.00 C ATOM 1040 N2 G B 497 33.925 -32.275 -17.694 1.00 0.00 N ATOM 1041 N3 G B 497 32.176 -33.774 -17.910 1.00 0.00 N ATOM 1042 C4 G B 497 31.434 -34.618 -17.140 1.00 0.00 C ATOM 0 H5' G B 497 25.798 -35.819 -19.205 1.00 0.00 H new ATOM 0 H5'' G B 497 25.962 -37.551 -19.410 1.00 0.00 H new ATOM 0 H4' G B 497 27.507 -36.354 -20.722 1.00 0.00 H new ATOM 0 H3' G B 497 28.747 -37.925 -18.353 1.00 0.00 H new ATOM 0 H2' G B 497 31.072 -37.323 -19.192 1.00 0.00 H new ATOM 0 HO2' G B 497 29.741 -37.638 -21.370 1.00 0.00 H new ATOM 0 H1' G B 497 30.455 -34.729 -19.490 1.00 0.00 H new ATOM 0 H8 G B 497 29.148 -36.794 -16.528 1.00 0.00 H new ATOM 0 H1 G B 497 34.047 -32.731 -15.357 1.00 0.00 H new ATOM 0 H21 G B 497 33.872 -32.081 -18.694 1.00 0.00 H new ATOM 0 H22 G B 497 34.619 -31.799 -17.118 1.00 0.00 H new ATOM 1054 P U B 498 28.712 -40.142 -19.681 1.00 0.00 P ATOM 1055 OP1 U B 498 27.353 -40.719 -19.577 1.00 0.00 O ATOM 1056 OP2 U B 498 29.559 -40.166 -18.467 1.00 0.00 O ATOM 1057 O5' U B 498 29.491 -40.920 -20.842 1.00 0.00 O ATOM 1058 C5' U B 498 28.909 -42.074 -21.443 1.00 0.00 C ATOM 1059 C4' U B 498 29.812 -42.606 -22.533 1.00 0.00 C ATOM 1060 O4' U B 498 30.904 -41.642 -22.643 1.00 0.00 O ATOM 1061 C3' U B 498 30.682 -43.787 -22.110 1.00 0.00 C ATOM 1062 O3' U B 498 29.985 -45.011 -22.390 1.00 0.00 O ATOM 1063 C2' U B 498 31.938 -43.667 -22.927 1.00 0.00 C ATOM 1064 O2' U B 498 31.529 -44.127 -24.196 1.00 0.00 O ATOM 1065 C1' U B 498 32.199 -42.166 -22.827 1.00 0.00 C ATOM 1066 N1 U B 498 33.090 -41.798 -21.707 1.00 0.00 N ATOM 1067 C2 U B 498 34.360 -41.440 -22.038 1.00 0.00 C ATOM 1068 O2 U B 498 34.779 -41.412 -23.184 1.00 0.00 O ATOM 1069 N3 U B 498 35.191 -41.095 -20.995 1.00 0.00 N ATOM 1070 C4 U B 498 34.801 -41.099 -19.680 1.00 0.00 C ATOM 1071 O4 U B 498 35.629 -40.772 -18.831 1.00 0.00 O ATOM 1072 C5 U B 498 33.464 -41.481 -19.389 1.00 0.00 C ATOM 1073 C6 U B 498 32.675 -41.810 -20.415 1.00 0.00 C ATOM 0 H5' U B 498 27.933 -41.823 -21.859 1.00 0.00 H new ATOM 0 H5'' U B 498 28.746 -42.843 -20.688 1.00 0.00 H new ATOM 0 H4' U B 498 29.155 -42.823 -23.375 1.00 0.00 H new ATOM 0 H3' U B 498 30.912 -43.788 -21.045 1.00 0.00 H new ATOM 0 H2' U B 498 32.841 -44.213 -22.652 1.00 0.00 H new ATOM 0 HO2' U B 498 30.753 -44.717 -24.096 1.00 0.00 H new ATOM 0 HO3' U B 498 30.540 -45.772 -22.122 1.00 0.00 H new ATOM 0 H1' U B 498 32.718 -41.780 -23.704 1.00 0.00 H new ATOM 0 H3 U B 498 36.149 -40.821 -21.213 1.00 0.00 H new ATOM 0 H5 U B 498 33.098 -41.505 -18.373 1.00 0.00 H new ATOM 0 H6 U B 498 31.656 -42.100 -20.206 1.00 0.00 H new TER 1084 U B 498 HETATM 1085 ZN ZN A 57 36.436 -32.095 -8.391 1.00 0.00 ZN