USER MOD reduce.3.24.130724 H: found=0, std=0, add=462, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 468 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 Set 1.1: A 8 G O2' : rot -108:sc= -7.4! USER MOD Set 1.2: C 28 ASN :FLIP amide:sc= -33.1! C(o=-85!,f=-78!) USER MOD Set 1.3: C 32 LYS NZ :NH3+ 152:sc= -7.21! (180deg=-9.11!) USER MOD Set 1.4: C 34 LYS NZ :NH3+ -130:sc= -9.54! (180deg=-15.4!) USER MOD Set 1.5: C 36 ASN :FLIP amide:sc= -20.7! C(o=-89!,f=-78!) USER MOD Set 2.1: B 20 G O2' : rot -144:sc= -9.7! USER MOD Set 2.2: D 40 ASN :FLIP amide:sc= -32! C(o=-73!,f=-71!) USER MOD Set 2.3: D 44 LYS NZ :NH3+ 146:sc= -8.03! (180deg=-9.36!) USER MOD Set 2.4: D 46 LYS NZ :NH3+ -159:sc= -1.78! (180deg=-3.41!) USER MOD Set 2.5: D 48 ASN :FLIP amide:sc= -19! C(o=-73!,f=-71!) USER MOD Set 3.1: B 13 G O2' : rot -156:sc= -3.48! USER MOD Set 3.2: B 24 A O2' : rot 46:sc= -0.59! USER MOD Set 4.1: A 1 G O2' : rot 179:sc= 0.32 USER MOD Set 4.2: A 12 A O2' : rot 39:sc= -0.685! USER MOD Single : A 1 G O5' : rot -5:sc= 0.149! USER MOD Single : A 2 G O2' : rot -76:sc= -9.08! USER MOD Single : A 3 A O2' : rot -20:sc= 0.227 USER MOD Single : A 4 G O2' : rot -144:sc= -1.54! USER MOD Single : A 5 G O2' : rot 82:sc= -0.0608! USER MOD Single : A 6 A O2' : rot -112:sc= -9.03! USER MOD Single : A 7 G O2' : rot 12:sc= -2.71! USER MOD Single : A 9 A O2' : rot -85:sc= -0.169! USER MOD Single : A 10 G O2' : rot 160:sc= -1.32! USER MOD Single : A 11 G O2' : rot 50:sc= -11.2! USER MOD Single : A 12 A O3' : rot 25:sc= -2.2! USER MOD Single : B 13 G O5' : rot 180:sc= 0 USER MOD Single : B 14 G O2' : rot 18:sc= 0.527 USER MOD Single : B 15 A O2' : rot -14:sc= 0.203 USER MOD Single : B 16 G O2' : rot -143:sc= 0.489 USER MOD Single : B 17 G O2' : rot 9:sc= 0.453 USER MOD Single : B 18 A O2' : rot -43:sc= -12.4! USER MOD Single : B 19 G O2' : rot 10:sc= -4.01! USER MOD Single : B 21 A O2' : rot -91:sc= -0.363! USER MOD Single : B 22 G O2' : rot -80:sc= 0.223! USER MOD Single : B 23 G O2' : rot 52:sc= -11.4! USER MOD Single : B 24 A O3' : rot 16:sc= -1.28! USER MOD Single : C 26 GLN :FLIP amide:sc= -27.5! C(o=-35!,f=-27!) USER MOD Single : C 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 31 SER OG : rot 76:sc= 0.466 USER MOD Single : C 35 THR OG1 : rot -70:sc= 0.0359 USER MOD Single : D 38 GLN :FLIP amide:sc= -28.4! C(o=-35!,f=-28!) USER MOD Single : D 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 43 SER OG : rot 76:sc= 1.06 USER MOD Single : D 47 THR OG1 : rot 3:sc= 0.264 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -10.169 -1.049 -6.900 1.00 0.00 O ATOM 2 C5' G A 1 -8.897 -0.924 -6.262 1.00 0.00 C ATOM 3 C4' G A 1 -8.441 0.531 -6.197 1.00 0.00 C ATOM 4 O4' G A 1 -7.330 0.640 -5.328 1.00 0.00 O ATOM 5 C3' G A 1 -7.994 1.120 -7.549 1.00 0.00 C ATOM 6 O3' G A 1 -8.801 2.256 -7.882 1.00 0.00 O ATOM 7 C2' G A 1 -6.551 1.558 -7.315 1.00 0.00 C ATOM 8 O2' G A 1 -6.261 2.803 -7.961 1.00 0.00 O ATOM 9 C1' G A 1 -6.521 1.686 -5.827 1.00 0.00 C ATOM 10 N9 G A 1 -5.219 1.556 -5.193 1.00 0.00 N ATOM 11 C8 G A 1 -3.973 1.508 -5.722 1.00 0.00 C ATOM 12 N7 G A 1 -3.024 1.407 -4.824 1.00 0.00 N ATOM 13 C5 G A 1 -3.730 1.396 -3.623 1.00 0.00 C ATOM 14 C6 G A 1 -3.287 1.316 -2.276 1.00 0.00 C ATOM 15 O6 G A 1 -2.133 1.232 -1.862 1.00 0.00 O ATOM 16 N1 G A 1 -4.381 1.347 -1.392 1.00 0.00 N ATOM 17 C2 G A 1 -5.681 1.434 -1.776 1.00 0.00 C ATOM 18 N2 G A 1 -6.587 1.447 -0.835 1.00 0.00 N ATOM 19 N3 G A 1 -6.068 1.509 -3.015 1.00 0.00 N ATOM 20 C4 G A 1 -5.061 1.485 -3.871 1.00 0.00 C ATOM 0 H5' G A 1 -8.158 -1.514 -6.804 1.00 0.00 H new ATOM 0 H5'' G A 1 -8.953 -1.333 -5.253 1.00 0.00 H new ATOM 0 H4' G A 1 -9.314 1.086 -5.853 1.00 0.00 H new ATOM 0 H3' G A 1 -8.088 0.405 -8.367 1.00 0.00 H new ATOM 0 H2' G A 1 -5.807 0.871 -7.718 1.00 0.00 H new ATOM 0 HO2' G A 1 -5.333 3.058 -7.778 1.00 0.00 H new ATOM 0 HO5' G A 1 -10.527 -0.157 -7.093 1.00 0.00 H new ATOM 0 H1' G A 1 -6.856 2.698 -5.598 1.00 0.00 H new ATOM 0 H8 G A 1 -3.780 1.549 -6.784 1.00 0.00 H new ATOM 0 H1 G A 1 -4.184 1.301 -0.392 1.00 0.00 H new ATOM 0 H21 G A 1 -7.575 1.511 -1.079 1.00 0.00 H new ATOM 0 H22 G A 1 -6.306 1.393 0.144 1.00 0.00 H new ATOM 33 P G A 2 -10.402 2.207 -7.705 1.00 0.00 P ATOM 34 OP1 G A 2 -10.848 0.805 -7.854 1.00 0.00 O ATOM 35 OP2 G A 2 -10.995 3.265 -8.554 1.00 0.00 O ATOM 36 O5' G A 2 -10.579 2.637 -6.166 1.00 0.00 O ATOM 37 C5' G A 2 -9.908 3.802 -5.690 1.00 0.00 C ATOM 38 C4' G A 2 -10.174 4.065 -4.209 1.00 0.00 C ATOM 39 O4' G A 2 -9.139 3.471 -3.424 1.00 0.00 O ATOM 40 C3' G A 2 -10.246 5.548 -3.863 1.00 0.00 C ATOM 41 O3' G A 2 -11.483 5.799 -3.184 1.00 0.00 O ATOM 42 C2' G A 2 -9.047 5.809 -2.955 1.00 0.00 C ATOM 43 O2' G A 2 -9.405 6.607 -1.823 1.00 0.00 O ATOM 44 C1' G A 2 -8.583 4.432 -2.526 1.00 0.00 C ATOM 45 N9 G A 2 -7.126 4.275 -2.580 1.00 0.00 N ATOM 46 C8 G A 2 -6.307 4.169 -3.676 1.00 0.00 C ATOM 47 N7 G A 2 -5.064 3.987 -3.385 1.00 0.00 N ATOM 48 C5 G A 2 -5.047 3.989 -2.006 1.00 0.00 C ATOM 49 C6 G A 2 -3.957 3.856 -1.139 1.00 0.00 C ATOM 50 O6 G A 2 -2.798 3.613 -1.426 1.00 0.00 O ATOM 51 N1 G A 2 -4.320 3.976 0.165 1.00 0.00 N ATOM 52 C2 G A 2 -5.623 4.142 0.609 1.00 0.00 C ATOM 53 N2 G A 2 -5.810 4.190 1.919 1.00 0.00 N ATOM 54 N3 G A 2 -6.669 4.244 -0.209 1.00 0.00 N ATOM 55 C4 G A 2 -6.299 4.171 -1.502 1.00 0.00 C ATOM 0 H5' G A 2 -10.229 4.666 -6.273 1.00 0.00 H new ATOM 0 H5'' G A 2 -8.835 3.690 -5.849 1.00 0.00 H new ATOM 0 H4' G A 2 -11.147 3.625 -3.988 1.00 0.00 H new ATOM 0 H3' G A 2 -10.214 6.199 -4.737 1.00 0.00 H new ATOM 0 H2' G A 2 -8.265 6.368 -3.469 1.00 0.00 H new ATOM 0 HO2' G A 2 -9.502 7.542 -2.099 1.00 0.00 H new ATOM 0 H1' G A 2 -8.907 4.292 -1.495 1.00 0.00 H new ATOM 0 H8 G A 2 -6.671 4.232 -4.691 1.00 0.00 H new ATOM 0 H1 G A 2 -3.581 3.941 0.867 1.00 0.00 H new ATOM 0 H21 G A 2 -6.750 4.311 2.296 1.00 0.00 H new ATOM 0 H22 G A 2 -5.014 4.106 2.551 1.00 0.00 H new ATOM 67 P A A 3 -11.791 7.201 -2.460 1.00 0.00 P ATOM 68 OP1 A A 3 -13.182 7.596 -2.777 1.00 0.00 O ATOM 69 OP2 A A 3 -10.675 8.134 -2.734 1.00 0.00 O ATOM 70 O5' A A 3 -11.730 6.760 -0.922 1.00 0.00 O ATOM 71 C5' A A 3 -11.187 5.480 -0.600 1.00 0.00 C ATOM 72 C4' A A 3 -11.937 4.802 0.540 1.00 0.00 C ATOM 73 O4' A A 3 -12.464 3.537 0.107 1.00 0.00 O ATOM 74 C3' A A 3 -11.060 4.526 1.756 1.00 0.00 C ATOM 75 O3' A A 3 -11.263 5.560 2.723 1.00 0.00 O ATOM 76 C2' A A 3 -11.605 3.211 2.269 1.00 0.00 C ATOM 77 O2' A A 3 -12.761 3.404 3.093 1.00 0.00 O ATOM 78 C1' A A 3 -11.956 2.518 0.974 1.00 0.00 C ATOM 79 N9 A A 3 -10.817 1.922 0.278 1.00 0.00 N ATOM 80 C8 A A 3 -9.539 1.733 0.717 1.00 0.00 C ATOM 81 N7 A A 3 -8.743 1.289 -0.188 1.00 0.00 N ATOM 82 C5 A A 3 -9.533 1.169 -1.315 1.00 0.00 C ATOM 83 C6 A A 3 -9.262 0.748 -2.623 1.00 0.00 C ATOM 84 N6 A A 3 -8.072 0.371 -3.040 1.00 0.00 N ATOM 85 N1 A A 3 -10.267 0.736 -3.481 1.00 0.00 N ATOM 86 C2 A A 3 -11.451 1.120 -3.075 1.00 0.00 C ATOM 87 N3 A A 3 -11.843 1.548 -1.887 1.00 0.00 N ATOM 88 C4 A A 3 -10.804 1.544 -1.039 1.00 0.00 C ATOM 0 H5' A A 3 -10.138 5.592 -0.326 1.00 0.00 H new ATOM 0 H5'' A A 3 -11.219 4.842 -1.483 1.00 0.00 H new ATOM 0 H4' A A 3 -12.727 5.497 0.824 1.00 0.00 H new ATOM 0 H3' A A 3 -9.992 4.491 1.540 1.00 0.00 H new ATOM 0 H2' A A 3 -10.913 2.656 2.902 1.00 0.00 H new ATOM 0 HO2' A A 3 -12.782 4.329 3.416 1.00 0.00 H new ATOM 0 H1' A A 3 -12.650 1.712 1.211 1.00 0.00 H new ATOM 0 H8 A A 3 -9.226 1.938 1.730 1.00 0.00 H new ATOM 0 H61 A A 3 -7.941 0.075 -4.007 1.00 0.00 H new ATOM 0 H62 A A 3 -7.281 0.375 -2.396 1.00 0.00 H new ATOM 0 H2 A A 3 -12.226 1.081 -3.826 1.00 0.00 H new ATOM 100 P G A 4 -10.033 6.442 3.259 1.00 0.00 P ATOM 101 OP1 G A 4 -10.579 7.608 3.989 1.00 0.00 O ATOM 102 OP2 G A 4 -9.085 6.646 2.141 1.00 0.00 O ATOM 103 O5' G A 4 -9.354 5.453 4.324 1.00 0.00 O ATOM 104 C5' G A 4 -8.352 4.529 3.902 1.00 0.00 C ATOM 105 C4' G A 4 -8.033 3.510 4.975 1.00 0.00 C ATOM 106 O4' G A 4 -7.897 2.225 4.362 1.00 0.00 O ATOM 107 C3' G A 4 -6.754 3.809 5.740 1.00 0.00 C ATOM 108 O3' G A 4 -7.086 4.329 7.038 1.00 0.00 O ATOM 109 C2' G A 4 -6.080 2.457 5.880 1.00 0.00 C ATOM 110 O2' G A 4 -6.352 1.862 7.153 1.00 0.00 O ATOM 111 C1' G A 4 -6.657 1.637 4.747 1.00 0.00 C ATOM 112 N9 G A 4 -5.799 1.570 3.562 1.00 0.00 N ATOM 113 C8 G A 4 -6.151 1.432 2.251 1.00 0.00 C ATOM 114 N7 G A 4 -5.138 1.318 1.443 1.00 0.00 N ATOM 115 C5 G A 4 -4.037 1.389 2.288 1.00 0.00 C ATOM 116 C6 G A 4 -2.658 1.319 1.987 1.00 0.00 C ATOM 117 O6 G A 4 -2.148 1.164 0.886 1.00 0.00 O ATOM 118 N1 G A 4 -1.871 1.434 3.145 1.00 0.00 N ATOM 119 C2 G A 4 -2.374 1.592 4.413 1.00 0.00 C ATOM 120 N2 G A 4 -1.496 1.683 5.406 1.00 0.00 N ATOM 121 N3 G A 4 -3.674 1.655 4.687 1.00 0.00 N ATOM 122 C4 G A 4 -4.437 1.545 3.582 1.00 0.00 C ATOM 0 H5' G A 4 -7.445 5.073 3.638 1.00 0.00 H new ATOM 0 H5'' G A 4 -8.689 4.015 3.002 1.00 0.00 H new ATOM 0 H4' G A 4 -8.853 3.542 5.692 1.00 0.00 H new ATOM 0 H3' G A 4 -6.119 4.543 5.243 1.00 0.00 H new ATOM 0 H2' G A 4 -4.994 2.528 5.828 1.00 0.00 H new ATOM 0 HO2' G A 4 -5.561 1.372 7.461 1.00 0.00 H new ATOM 0 H1' G A 4 -6.766 0.618 5.118 1.00 0.00 H new ATOM 0 H8 G A 4 -7.177 1.419 1.915 1.00 0.00 H new ATOM 0 H1 G A 4 -0.857 1.398 3.037 1.00 0.00 H new ATOM 0 H21 G A 4 -1.822 1.801 6.365 1.00 0.00 H new ATOM 0 H22 G A 4 -0.496 1.635 5.209 1.00 0.00 H new ATOM 134 P G A 5 -6.625 5.812 7.485 1.00 0.00 P ATOM 135 OP1 G A 5 -7.722 6.421 8.271 1.00 0.00 O ATOM 136 OP2 G A 5 -6.093 6.512 6.295 1.00 0.00 O ATOM 137 O5' G A 5 -5.397 5.509 8.484 1.00 0.00 O ATOM 138 C5' G A 5 -4.576 4.367 8.252 1.00 0.00 C ATOM 139 C4' G A 5 -3.196 4.735 7.775 1.00 0.00 C ATOM 140 O4' G A 5 -2.962 4.081 6.554 1.00 0.00 O ATOM 141 C3' G A 5 -2.951 6.237 7.556 1.00 0.00 C ATOM 142 O3' G A 5 -1.902 6.695 8.425 1.00 0.00 O ATOM 143 C2' G A 5 -2.511 6.345 6.113 1.00 0.00 C ATOM 144 O2' G A 5 -1.384 7.216 5.970 1.00 0.00 O ATOM 145 C1' G A 5 -2.154 4.920 5.779 1.00 0.00 C ATOM 146 N9 G A 5 -2.365 4.572 4.413 1.00 0.00 N ATOM 147 C8 G A 5 -3.494 4.495 3.669 1.00 0.00 C ATOM 148 N7 G A 5 -3.290 4.062 2.473 1.00 0.00 N ATOM 149 C5 G A 5 -1.933 3.901 2.441 1.00 0.00 C ATOM 150 C6 G A 5 -1.111 3.522 1.393 1.00 0.00 C ATOM 151 O6 G A 5 -1.418 3.193 0.258 1.00 0.00 O ATOM 152 N1 G A 5 0.210 3.585 1.770 1.00 0.00 N ATOM 153 C2 G A 5 0.670 3.910 3.052 1.00 0.00 C ATOM 154 N2 G A 5 1.963 3.930 3.275 1.00 0.00 N ATOM 155 N3 G A 5 -0.120 4.224 4.022 1.00 0.00 N ATOM 156 C4 G A 5 -1.387 4.218 3.636 1.00 0.00 C ATOM 0 H5' G A 5 -5.053 3.725 7.512 1.00 0.00 H new ATOM 0 H5'' G A 5 -4.496 3.788 9.172 1.00 0.00 H new ATOM 0 H4' G A 5 -2.519 4.429 8.572 1.00 0.00 H new ATOM 0 H3' G A 5 -3.835 6.839 7.768 1.00 0.00 H new ATOM 0 H2' G A 5 -3.271 6.769 5.457 1.00 0.00 H new ATOM 0 HO2' G A 5 -0.562 6.724 6.177 1.00 0.00 H new ATOM 0 H1' G A 5 -1.089 4.807 5.981 1.00 0.00 H new ATOM 0 H8 G A 5 -4.470 4.770 4.042 1.00 0.00 H new ATOM 0 H1 G A 5 0.911 3.378 1.059 1.00 0.00 H new ATOM 0 H21 G A 5 2.317 4.164 4.202 1.00 0.00 H new ATOM 0 H22 G A 5 2.614 3.711 2.521 1.00 0.00 H new ATOM 168 P A A 6 -0.447 5.989 8.447 1.00 0.00 P ATOM 169 OP1 A A 6 0.216 6.343 9.722 1.00 0.00 O ATOM 170 OP2 A A 6 0.228 6.281 7.162 1.00 0.00 O ATOM 171 O5' A A 6 -0.797 4.418 8.483 1.00 0.00 O ATOM 172 C5' A A 6 -0.495 3.615 9.634 1.00 0.00 C ATOM 173 C4' A A 6 0.786 2.820 9.442 1.00 0.00 C ATOM 174 O4' A A 6 0.657 1.537 10.049 1.00 0.00 O ATOM 175 C3' A A 6 1.139 2.615 7.989 1.00 0.00 C ATOM 176 O3' A A 6 2.557 2.718 7.808 1.00 0.00 O ATOM 177 C2' A A 6 0.691 1.204 7.692 1.00 0.00 C ATOM 178 O2' A A 6 1.643 0.593 6.836 1.00 0.00 O ATOM 179 C1' A A 6 0.647 0.520 9.048 1.00 0.00 C ATOM 180 N9 A A 6 -0.568 -0.238 9.307 1.00 0.00 N ATOM 181 C8 A A 6 -0.779 -1.126 10.301 1.00 0.00 C ATOM 182 N7 A A 6 -2.022 -1.487 10.444 1.00 0.00 N ATOM 183 C5 A A 6 -2.677 -0.792 9.443 1.00 0.00 C ATOM 184 C6 A A 6 -4.016 -0.741 9.049 1.00 0.00 C ATOM 185 N6 A A 6 -4.983 -1.418 9.669 1.00 0.00 N ATOM 186 N1 A A 6 -4.312 0.041 7.998 1.00 0.00 N ATOM 187 C2 A A 6 -3.334 0.716 7.399 1.00 0.00 C ATOM 188 N3 A A 6 -2.051 0.759 7.688 1.00 0.00 N ATOM 189 C4 A A 6 -1.791 -0.034 8.736 1.00 0.00 C ATOM 0 H5' A A 6 -1.322 2.932 9.829 1.00 0.00 H new ATOM 0 H5'' A A 6 -0.398 4.256 10.510 1.00 0.00 H new ATOM 0 H4' A A 6 1.581 3.403 9.908 1.00 0.00 H new ATOM 0 H3' A A 6 0.672 3.354 7.338 1.00 0.00 H new ATOM 0 H2' A A 6 -0.276 1.149 7.192 1.00 0.00 H new ATOM 0 HO2' A A 6 1.243 0.446 5.954 1.00 0.00 H new ATOM 0 H1' A A 6 1.497 -0.163 9.062 1.00 0.00 H new ATOM 0 H8 A A 6 0.016 -1.505 10.925 1.00 0.00 H new ATOM 0 H61 A A 6 -5.946 -1.346 9.341 1.00 0.00 H new ATOM 0 H62 A A 6 -4.759 -2.007 10.471 1.00 0.00 H new ATOM 0 H2 A A 6 -3.637 1.315 6.553 1.00 0.00 H new ATOM 201 P G A 7 3.591 2.212 8.943 1.00 0.00 P ATOM 202 OP1 G A 7 2.872 1.344 9.897 1.00 0.00 O ATOM 203 OP2 G A 7 4.340 3.388 9.440 1.00 0.00 O ATOM 204 O5' G A 7 4.605 1.291 8.108 1.00 0.00 O ATOM 205 C5' G A 7 5.819 1.847 7.616 1.00 0.00 C ATOM 206 C4' G A 7 5.619 2.511 6.265 1.00 0.00 C ATOM 207 O4' G A 7 4.834 1.674 5.400 1.00 0.00 O ATOM 208 C3' G A 7 4.899 3.868 6.346 1.00 0.00 C ATOM 209 O3' G A 7 5.714 4.917 5.797 1.00 0.00 O ATOM 210 C2' G A 7 3.684 3.695 5.454 1.00 0.00 C ATOM 211 O2' G A 7 3.423 4.881 4.696 1.00 0.00 O ATOM 212 C1' G A 7 4.097 2.555 4.572 1.00 0.00 C ATOM 213 N9 G A 7 2.959 1.889 3.954 1.00 0.00 N ATOM 214 C8 G A 7 1.720 1.629 4.470 1.00 0.00 C ATOM 215 N7 G A 7 0.830 1.323 3.574 1.00 0.00 N ATOM 216 C5 G A 7 1.540 1.382 2.383 1.00 0.00 C ATOM 217 C6 G A 7 1.111 1.169 1.060 1.00 0.00 C ATOM 218 O6 G A 7 -0.015 0.920 0.673 1.00 0.00 O ATOM 219 N1 G A 7 2.157 1.334 0.155 1.00 0.00 N ATOM 220 C2 G A 7 3.446 1.660 0.498 1.00 0.00 C ATOM 221 N2 G A 7 4.337 1.755 -0.480 1.00 0.00 N ATOM 222 N3 G A 7 3.830 1.868 1.735 1.00 0.00 N ATOM 223 C4 G A 7 2.837 1.712 2.616 1.00 0.00 C ATOM 0 H5' G A 7 6.571 1.063 7.529 1.00 0.00 H new ATOM 0 H5'' G A 7 6.201 2.578 8.329 1.00 0.00 H new ATOM 0 H4' G A 7 6.625 2.668 5.877 1.00 0.00 H new ATOM 0 H3' G A 7 4.663 4.136 7.376 1.00 0.00 H new ATOM 0 H2' G A 7 2.760 3.507 6.001 1.00 0.00 H new ATOM 0 HO2' G A 7 4.187 5.490 4.768 1.00 0.00 H new ATOM 0 H1' G A 7 4.697 2.912 3.735 1.00 0.00 H new ATOM 0 H8 G A 7 1.501 1.674 5.527 1.00 0.00 H new ATOM 0 H1 G A 7 1.950 1.203 -0.835 1.00 0.00 H new ATOM 0 H21 G A 7 5.305 1.995 -0.266 1.00 0.00 H new ATOM 0 H22 G A 7 4.054 1.588 -1.446 1.00 0.00 H new ATOM 235 P G A 8 7.296 5.029 6.092 1.00 0.00 P ATOM 236 OP1 G A 8 7.769 3.741 6.645 1.00 0.00 O ATOM 237 OP2 G A 8 7.540 6.285 6.836 1.00 0.00 O ATOM 238 O5' G A 8 7.907 5.196 4.609 1.00 0.00 O ATOM 239 C5' G A 8 7.761 4.149 3.644 1.00 0.00 C ATOM 240 C4' G A 8 7.744 4.684 2.213 1.00 0.00 C ATOM 241 O4' G A 8 6.604 4.163 1.528 1.00 0.00 O ATOM 242 C3' G A 8 7.683 6.213 2.125 1.00 0.00 C ATOM 243 O3' G A 8 8.763 6.703 1.316 1.00 0.00 O ATOM 244 C2' G A 8 6.370 6.508 1.423 1.00 0.00 C ATOM 245 O2' G A 8 6.502 7.579 0.486 1.00 0.00 O ATOM 246 C1' G A 8 6.033 5.201 0.742 1.00 0.00 C ATOM 247 N9 G A 8 4.600 4.969 0.648 1.00 0.00 N ATOM 248 C8 G A 8 3.632 5.091 1.606 1.00 0.00 C ATOM 249 N7 G A 8 2.465 4.807 1.203 1.00 0.00 N ATOM 250 C5 G A 8 2.644 4.490 -0.097 1.00 0.00 C ATOM 251 C6 G A 8 1.684 4.120 -0.991 1.00 0.00 C ATOM 252 O6 G A 8 0.508 3.913 -0.765 1.00 0.00 O ATOM 253 N1 G A 8 2.192 3.909 -2.204 1.00 0.00 N ATOM 254 C2 G A 8 3.536 4.012 -2.542 1.00 0.00 C ATOM 255 N2 G A 8 3.872 3.746 -3.792 1.00 0.00 N ATOM 256 N3 G A 8 4.476 4.357 -1.672 1.00 0.00 N ATOM 257 C4 G A 8 3.942 4.584 -0.466 1.00 0.00 C ATOM 0 H5' G A 8 6.837 3.604 3.838 1.00 0.00 H new ATOM 0 H5'' G A 8 8.579 3.438 3.755 1.00 0.00 H new ATOM 0 H4' G A 8 8.682 4.363 1.760 1.00 0.00 H new ATOM 0 H3' G A 8 7.757 6.681 3.107 1.00 0.00 H new ATOM 0 H2' G A 8 5.588 6.837 2.108 1.00 0.00 H new ATOM 0 HO2' G A 8 6.048 8.375 0.833 1.00 0.00 H new ATOM 0 H1' G A 8 6.424 5.228 -0.275 1.00 0.00 H new ATOM 0 H8 G A 8 3.844 5.402 2.618 1.00 0.00 H new ATOM 0 H1 G A 8 1.541 3.651 -2.946 1.00 0.00 H new ATOM 0 H21 G A 8 4.848 3.810 -4.082 1.00 0.00 H new ATOM 0 H22 G A 8 3.156 3.477 -4.466 1.00 0.00 H new ATOM 269 P A A 9 10.280 6.210 1.548 1.00 0.00 P ATOM 270 OP1 A A 9 10.250 4.925 2.281 1.00 0.00 O ATOM 271 OP2 A A 9 11.057 7.349 2.088 1.00 0.00 O ATOM 272 O5' A A 9 10.792 5.922 0.045 1.00 0.00 O ATOM 273 C5' A A 9 9.937 5.286 -0.913 1.00 0.00 C ATOM 274 C4' A A 9 10.634 4.106 -1.590 1.00 0.00 C ATOM 275 O4' A A 9 10.869 3.064 -0.629 1.00 0.00 O ATOM 276 C3' A A 9 9.838 3.478 -2.737 1.00 0.00 C ATOM 277 O3' A A 9 10.289 4.000 -3.996 1.00 0.00 O ATOM 278 C2' A A 9 10.199 2.010 -2.625 1.00 0.00 C ATOM 279 O2' A A 9 11.450 1.725 -3.261 1.00 0.00 O ATOM 280 C1' A A 9 10.307 1.842 -1.125 1.00 0.00 C ATOM 281 N9 A A 9 9.019 1.645 -0.438 1.00 0.00 N ATOM 282 C8 A A 9 7.753 1.648 -0.961 1.00 0.00 C ATOM 283 N7 A A 9 6.817 1.496 -0.073 1.00 0.00 N ATOM 284 C5 A A 9 7.508 1.382 1.123 1.00 0.00 C ATOM 285 C6 A A 9 7.083 1.205 2.442 1.00 0.00 C ATOM 286 N6 A A 9 5.810 1.111 2.779 1.00 0.00 N ATOM 287 N1 A A 9 8.019 1.131 3.388 1.00 0.00 N ATOM 288 C2 A A 9 9.288 1.226 3.041 1.00 0.00 C ATOM 289 N3 A A 9 9.822 1.399 1.841 1.00 0.00 N ATOM 290 C4 A A 9 8.851 1.469 0.911 1.00 0.00 C ATOM 0 H5' A A 9 9.632 6.011 -1.667 1.00 0.00 H new ATOM 0 H5'' A A 9 9.030 4.939 -0.419 1.00 0.00 H new ATOM 0 H4' A A 9 11.555 4.518 -2.001 1.00 0.00 H new ATOM 0 H3' A A 9 8.767 3.672 -2.683 1.00 0.00 H new ATOM 0 H2' A A 9 9.483 1.343 -3.105 1.00 0.00 H new ATOM 0 HO2' A A 9 11.304 1.575 -4.218 1.00 0.00 H new ATOM 0 H1' A A 9 10.903 0.950 -0.933 1.00 0.00 H new ATOM 0 H8 A A 9 7.551 1.766 -2.015 1.00 0.00 H new ATOM 0 H61 A A 9 5.549 0.982 3.757 1.00 0.00 H new ATOM 0 H62 A A 9 5.087 1.167 2.062 1.00 0.00 H new ATOM 0 H2 A A 9 9.995 1.152 3.854 1.00 0.00 H new ATOM 302 P G A 10 10.043 3.188 -5.374 1.00 0.00 P ATOM 303 OP1 G A 10 10.734 1.884 -5.286 1.00 0.00 O ATOM 304 OP2 G A 10 10.343 4.095 -6.503 1.00 0.00 O ATOM 305 O5' G A 10 8.455 2.912 -5.355 1.00 0.00 O ATOM 306 C5' G A 10 7.955 1.589 -5.147 1.00 0.00 C ATOM 307 C4' G A 10 6.884 1.207 -6.167 1.00 0.00 C ATOM 308 O4' G A 10 5.918 0.372 -5.535 1.00 0.00 O ATOM 309 C3' G A 10 6.118 2.381 -6.753 1.00 0.00 C ATOM 310 O3' G A 10 6.749 2.823 -7.961 1.00 0.00 O ATOM 311 C2' G A 10 4.758 1.795 -7.068 1.00 0.00 C ATOM 312 O2' G A 10 4.737 1.255 -8.394 1.00 0.00 O ATOM 313 C1' G A 10 4.607 0.710 -6.009 1.00 0.00 C ATOM 314 N9 G A 10 3.780 1.075 -4.838 1.00 0.00 N ATOM 315 C8 G A 10 4.134 1.175 -3.514 1.00 0.00 C ATOM 316 N7 G A 10 3.129 1.288 -2.701 1.00 0.00 N ATOM 317 C5 G A 10 2.031 1.271 -3.535 1.00 0.00 C ATOM 318 C6 G A 10 0.659 1.349 -3.215 1.00 0.00 C ATOM 319 O6 G A 10 0.136 1.456 -2.109 1.00 0.00 O ATOM 320 N1 G A 10 -0.122 1.286 -4.352 1.00 0.00 N ATOM 321 C2 G A 10 0.348 1.178 -5.638 1.00 0.00 C ATOM 322 N2 G A 10 -0.569 1.146 -6.604 1.00 0.00 N ATOM 323 N3 G A 10 1.640 1.109 -5.941 1.00 0.00 N ATOM 324 C4 G A 10 2.418 1.155 -4.844 1.00 0.00 C ATOM 0 H5' G A 10 7.540 1.514 -4.142 1.00 0.00 H new ATOM 0 H5'' G A 10 8.779 0.878 -5.205 1.00 0.00 H new ATOM 0 H4' G A 10 7.422 0.718 -6.979 1.00 0.00 H new ATOM 0 H3' G A 10 6.071 3.239 -6.082 1.00 0.00 H new ATOM 0 H2' G A 10 3.946 2.522 -7.044 1.00 0.00 H new ATOM 0 HO2' G A 10 4.001 0.613 -8.474 1.00 0.00 H new ATOM 0 H1' G A 10 4.089 -0.116 -6.496 1.00 0.00 H new ATOM 0 H8 G A 10 5.161 1.161 -3.179 1.00 0.00 H new ATOM 0 H1 G A 10 -1.134 1.323 -4.226 1.00 0.00 H new ATOM 0 H21 G A 10 -0.280 1.067 -7.579 1.00 0.00 H new ATOM 0 H22 G A 10 -1.560 1.201 -6.368 1.00 0.00 H new ATOM 336 P G A 11 6.078 3.965 -8.883 1.00 0.00 P ATOM 337 OP1 G A 11 6.606 3.815 -10.257 1.00 0.00 O ATOM 338 OP2 G A 11 6.200 5.266 -8.188 1.00 0.00 O ATOM 339 O5' G A 11 4.522 3.553 -8.898 1.00 0.00 O ATOM 340 C5' G A 11 3.684 3.967 -9.978 1.00 0.00 C ATOM 341 C4' G A 11 2.313 4.399 -9.500 1.00 0.00 C ATOM 342 O4' G A 11 2.010 3.758 -8.286 1.00 0.00 O ATOM 343 C3' G A 11 2.148 5.892 -9.228 1.00 0.00 C ATOM 344 O3' G A 11 1.600 6.625 -10.341 1.00 0.00 O ATOM 345 C2' G A 11 1.168 5.929 -8.090 1.00 0.00 C ATOM 346 O2' G A 11 -0.014 6.606 -8.456 1.00 0.00 O ATOM 347 C1' G A 11 0.920 4.476 -7.789 1.00 0.00 C ATOM 348 N9 G A 11 0.796 4.259 -6.389 1.00 0.00 N ATOM 349 C8 G A 11 1.768 4.275 -5.461 1.00 0.00 C ATOM 350 N7 G A 11 1.342 4.181 -4.264 1.00 0.00 N ATOM 351 C5 G A 11 -0.021 4.109 -4.413 1.00 0.00 C ATOM 352 C6 G A 11 -0.984 4.014 -3.433 1.00 0.00 C ATOM 353 O6 G A 11 -0.817 3.859 -2.249 1.00 0.00 O ATOM 354 N1 G A 11 -2.235 4.006 -3.961 1.00 0.00 N ATOM 355 C2 G A 11 -2.536 4.046 -5.299 1.00 0.00 C ATOM 356 N2 G A 11 -3.828 4.012 -5.624 1.00 0.00 N ATOM 357 N3 G A 11 -1.607 4.117 -6.244 1.00 0.00 N ATOM 358 C4 G A 11 -0.369 4.153 -5.711 1.00 0.00 C ATOM 0 H5' G A 11 3.578 3.148 -10.689 1.00 0.00 H new ATOM 0 H5'' G A 11 4.159 4.792 -10.510 1.00 0.00 H new ATOM 0 H4' G A 11 1.653 4.130 -10.325 1.00 0.00 H new ATOM 0 H3' G A 11 3.113 6.356 -9.026 1.00 0.00 H new ATOM 0 H2' G A 11 1.541 6.472 -7.221 1.00 0.00 H new ATOM 0 HO2' G A 11 -0.347 6.248 -9.305 1.00 0.00 H new ATOM 0 H1' G A 11 -0.011 4.151 -8.254 1.00 0.00 H new ATOM 0 H8 G A 11 2.816 4.360 -5.708 1.00 0.00 H new ATOM 0 H1 G A 11 -3.017 3.967 -3.308 1.00 0.00 H new ATOM 0 H21 G A 11 -4.108 4.039 -6.604 1.00 0.00 H new ATOM 0 H22 G A 11 -4.537 3.959 -4.892 1.00 0.00 H new ATOM 370 P A A 12 1.414 6.014 -11.821 1.00 0.00 P ATOM 371 OP1 A A 12 2.113 4.713 -11.913 1.00 0.00 O ATOM 372 OP2 A A 12 1.722 7.082 -12.798 1.00 0.00 O ATOM 373 O5' A A 12 -0.168 5.745 -11.860 1.00 0.00 O ATOM 374 C5' A A 12 -0.671 4.417 -11.784 1.00 0.00 C ATOM 375 C4' A A 12 -1.410 4.153 -10.476 1.00 0.00 C ATOM 376 O4' A A 12 -1.059 5.090 -9.503 1.00 0.00 O ATOM 377 C3' A A 12 -2.925 4.190 -10.569 1.00 0.00 C ATOM 378 O3' A A 12 -3.461 2.935 -11.004 1.00 0.00 O ATOM 379 C2' A A 12 -3.342 4.508 -9.136 1.00 0.00 C ATOM 380 O2' A A 12 -3.766 3.333 -8.436 1.00 0.00 O ATOM 381 C1' A A 12 -2.097 5.102 -8.522 1.00 0.00 C ATOM 382 N9 A A 12 -2.278 6.478 -8.195 1.00 0.00 N ATOM 383 C8 A A 12 -1.964 7.502 -8.971 1.00 0.00 C ATOM 384 N7 A A 12 -2.450 8.650 -8.577 1.00 0.00 N ATOM 385 C5 A A 12 -3.121 8.301 -7.408 1.00 0.00 C ATOM 386 C6 A A 12 -3.859 9.022 -6.466 1.00 0.00 C ATOM 387 N6 A A 12 -4.086 10.332 -6.554 1.00 0.00 N ATOM 388 N1 A A 12 -4.353 8.323 -5.421 1.00 0.00 N ATOM 389 C2 A A 12 -4.114 7.015 -5.354 1.00 0.00 C ATOM 390 N3 A A 12 -3.467 6.256 -6.177 1.00 0.00 N ATOM 391 C4 A A 12 -2.994 6.969 -7.183 1.00 0.00 C ATOM 0 H5' A A 12 0.154 3.712 -11.881 1.00 0.00 H new ATOM 0 H5'' A A 12 -1.344 4.237 -12.622 1.00 0.00 H new ATOM 0 H4' A A 12 -1.104 3.139 -10.217 1.00 0.00 H new ATOM 0 H3' A A 12 -3.291 4.914 -11.297 1.00 0.00 H new ATOM 0 H2' A A 12 -4.195 5.185 -9.090 1.00 0.00 H new ATOM 0 HO2' A A 12 -3.188 2.580 -8.680 1.00 0.00 H new ATOM 0 HO3' A A 12 -2.833 2.216 -10.781 1.00 0.00 H new ATOM 0 H1' A A 12 -1.865 4.520 -7.630 1.00 0.00 H new ATOM 0 H8 A A 12 -1.356 7.398 -9.858 1.00 0.00 H new ATOM 0 H61 A A 12 -4.633 10.804 -5.834 1.00 0.00 H new ATOM 0 H62 A A 12 -3.713 10.862 -7.341 1.00 0.00 H new ATOM 0 H2 A A 12 -4.519 6.515 -4.486 1.00 0.00 H new TER 404 A A 12 ATOM 405 O5' G B 13 -10.253 0.848 7.118 1.00 0.00 O ATOM 406 C5' G B 13 -8.970 0.784 6.490 1.00 0.00 C ATOM 407 C4' G B 13 -8.547 -0.656 6.235 1.00 0.00 C ATOM 408 O4' G B 13 -7.428 -0.662 5.377 1.00 0.00 O ATOM 409 C3' G B 13 -8.139 -1.439 7.494 1.00 0.00 C ATOM 410 O3' G B 13 -9.006 -2.588 7.669 1.00 0.00 O ATOM 411 C2' G B 13 -6.694 -1.855 7.228 1.00 0.00 C ATOM 412 O2' G B 13 -6.419 -3.179 7.702 1.00 0.00 O ATOM 413 C1' G B 13 -6.639 -1.769 5.741 1.00 0.00 C ATOM 414 N9 G B 13 -5.336 -1.577 5.136 1.00 0.00 N ATOM 415 C8 G B 13 -4.097 -1.472 5.679 1.00 0.00 C ATOM 416 N7 G B 13 -3.146 -1.347 4.784 1.00 0.00 N ATOM 417 C5 G B 13 -3.845 -1.379 3.578 1.00 0.00 C ATOM 418 C6 G B 13 -3.397 -1.298 2.235 1.00 0.00 C ATOM 419 O6 G B 13 -2.246 -1.177 1.825 1.00 0.00 O ATOM 420 N1 G B 13 -4.481 -1.378 1.345 1.00 0.00 N ATOM 421 C2 G B 13 -5.783 -1.510 1.717 1.00 0.00 C ATOM 422 N2 G B 13 -6.676 -1.567 0.758 1.00 0.00 N ATOM 423 N3 G B 13 -6.179 -1.586 2.955 1.00 0.00 N ATOM 424 C4 G B 13 -5.173 -1.515 3.817 1.00 0.00 C ATOM 0 H5' G B 13 -8.230 1.276 7.121 1.00 0.00 H new ATOM 0 H5'' G B 13 -8.998 1.329 5.547 1.00 0.00 H new ATOM 0 H4' G B 13 -9.425 -1.142 5.810 1.00 0.00 H new ATOM 0 H3' G B 13 -8.226 -0.855 8.410 1.00 0.00 H new ATOM 0 H2' G B 13 -5.952 -1.241 7.738 1.00 0.00 H new ATOM 0 HO2' G B 13 -5.459 -3.271 7.876 1.00 0.00 H new ATOM 0 HO5' G B 13 -10.496 1.785 7.270 1.00 0.00 H new ATOM 0 H1' G B 13 -6.979 -2.739 5.379 1.00 0.00 H new ATOM 0 H8 G B 13 -3.912 -1.490 6.743 1.00 0.00 H new ATOM 0 H1 G B 13 -4.277 -1.334 0.347 1.00 0.00 H new ATOM 0 H21 G B 13 -7.665 -1.666 0.987 1.00 0.00 H new ATOM 0 H22 G B 13 -6.381 -1.513 -0.217 1.00 0.00 H new ATOM 437 P G B 14 -8.861 -3.977 6.840 1.00 0.00 P ATOM 438 OP1 G B 14 -9.079 -5.092 7.789 1.00 0.00 O ATOM 439 OP2 G B 14 -7.630 -3.949 6.029 1.00 0.00 O ATOM 440 O5' G B 14 -10.124 -3.934 5.835 1.00 0.00 O ATOM 441 C5' G B 14 -10.040 -3.236 4.588 1.00 0.00 C ATOM 442 C4' G B 14 -10.414 -4.111 3.405 1.00 0.00 C ATOM 443 O4' G B 14 -9.508 -3.824 2.345 1.00 0.00 O ATOM 444 C3' G B 14 -10.343 -5.617 3.688 1.00 0.00 C ATOM 445 O3' G B 14 -11.371 -6.358 3.001 1.00 0.00 O ATOM 446 C2' G B 14 -9.004 -6.037 3.108 1.00 0.00 C ATOM 447 O2' G B 14 -9.101 -7.311 2.460 1.00 0.00 O ATOM 448 C1' G B 14 -8.660 -4.946 2.116 1.00 0.00 C ATOM 449 N9 G B 14 -7.271 -4.509 2.265 1.00 0.00 N ATOM 450 C8 G B 14 -6.548 -4.286 3.408 1.00 0.00 C ATOM 451 N7 G B 14 -5.304 -4.014 3.199 1.00 0.00 N ATOM 452 C5 G B 14 -5.189 -4.071 1.828 1.00 0.00 C ATOM 453 C6 G B 14 -4.058 -3.890 1.026 1.00 0.00 C ATOM 454 O6 G B 14 -2.930 -3.580 1.373 1.00 0.00 O ATOM 455 N1 G B 14 -4.337 -4.085 -0.289 1.00 0.00 N ATOM 456 C2 G B 14 -5.597 -4.363 -0.793 1.00 0.00 C ATOM 457 N2 G B 14 -5.710 -4.456 -2.094 1.00 0.00 N ATOM 458 N3 G B 14 -6.671 -4.519 -0.042 1.00 0.00 N ATOM 459 C4 G B 14 -6.389 -4.370 1.254 1.00 0.00 C ATOM 0 H5' G B 14 -9.025 -2.862 4.452 1.00 0.00 H new ATOM 0 H5'' G B 14 -10.699 -2.368 4.616 1.00 0.00 H new ATOM 0 H4' G B 14 -11.451 -3.883 3.160 1.00 0.00 H new ATOM 0 H3' G B 14 -10.468 -5.812 4.753 1.00 0.00 H new ATOM 0 H2' G B 14 -8.239 -6.151 3.876 1.00 0.00 H new ATOM 0 HO2' G B 14 -10.042 -7.512 2.273 1.00 0.00 H new ATOM 0 H1' G B 14 -8.799 -5.346 1.112 1.00 0.00 H new ATOM 0 H8 G B 14 -6.981 -4.334 4.396 1.00 0.00 H new ATOM 0 H1 G B 14 -3.564 -4.022 -0.952 1.00 0.00 H new ATOM 0 H21 G B 14 -6.617 -4.659 -2.514 1.00 0.00 H new ATOM 0 H22 G B 14 -4.891 -4.325 -2.688 1.00 0.00 H new ATOM 471 P A B 15 -12.815 -5.747 2.624 1.00 0.00 P ATOM 472 OP1 A B 15 -12.885 -4.351 3.110 1.00 0.00 O ATOM 473 OP2 A B 15 -13.850 -6.722 3.034 1.00 0.00 O ATOM 474 O5' A B 15 -12.757 -5.723 1.016 1.00 0.00 O ATOM 475 C5' A B 15 -11.702 -5.036 0.333 1.00 0.00 C ATOM 476 C4' A B 15 -12.190 -4.432 -0.974 1.00 0.00 C ATOM 477 O4' A B 15 -12.627 -3.086 -0.748 1.00 0.00 O ATOM 478 C3' A B 15 -11.128 -4.385 -2.076 1.00 0.00 C ATOM 479 O3' A B 15 -11.317 -5.503 -2.949 1.00 0.00 O ATOM 480 C2' A B 15 -11.469 -3.091 -2.790 1.00 0.00 C ATOM 481 O2' A B 15 -12.543 -3.275 -3.721 1.00 0.00 O ATOM 482 C1' A B 15 -11.894 -2.230 -1.619 1.00 0.00 C ATOM 483 N9 A B 15 -10.783 -1.720 -0.819 1.00 0.00 N ATOM 484 C8 A B 15 -9.476 -1.562 -1.168 1.00 0.00 C ATOM 485 N7 A B 15 -8.719 -1.183 -0.192 1.00 0.00 N ATOM 486 C5 A B 15 -9.581 -1.082 0.887 1.00 0.00 C ATOM 487 C6 A B 15 -9.389 -0.728 2.231 1.00 0.00 C ATOM 488 N6 A B 15 -8.216 -0.408 2.746 1.00 0.00 N ATOM 489 N1 A B 15 -10.455 -0.727 3.023 1.00 0.00 N ATOM 490 C2 A B 15 -11.622 -1.056 2.519 1.00 0.00 C ATOM 491 N3 A B 15 -11.942 -1.412 1.287 1.00 0.00 N ATOM 492 C4 A B 15 -10.844 -1.402 0.512 1.00 0.00 C ATOM 0 H5' A B 15 -10.884 -5.728 0.133 1.00 0.00 H new ATOM 0 H5'' A B 15 -11.304 -4.249 0.973 1.00 0.00 H new ATOM 0 H4' A B 15 -12.996 -5.083 -1.312 1.00 0.00 H new ATOM 0 H3' A B 15 -10.098 -4.425 -1.722 1.00 0.00 H new ATOM 0 H2' A B 15 -10.658 -2.675 -3.388 1.00 0.00 H new ATOM 0 HO2' A B 15 -12.685 -4.233 -3.872 1.00 0.00 H new ATOM 0 H1' A B 15 -12.441 -1.377 -2.020 1.00 0.00 H new ATOM 0 H8 A B 15 -9.107 -1.737 -2.168 1.00 0.00 H new ATOM 0 H61 A B 15 -8.143 -0.159 3.733 1.00 0.00 H new ATOM 0 H62 A B 15 -7.383 -0.409 2.157 1.00 0.00 H new ATOM 0 H2 A B 15 -12.446 -1.032 3.217 1.00 0.00 H new ATOM 504 P G B 16 -10.070 -6.373 -3.463 1.00 0.00 P ATOM 505 OP1 G B 16 -10.593 -7.529 -4.226 1.00 0.00 O ATOM 506 OP2 G B 16 -9.153 -6.592 -2.322 1.00 0.00 O ATOM 507 O5' G B 16 -9.362 -5.368 -4.494 1.00 0.00 O ATOM 508 C5' G B 16 -8.278 -4.551 -4.060 1.00 0.00 C ATOM 509 C4' G B 16 -7.873 -3.539 -5.113 1.00 0.00 C ATOM 510 O4' G B 16 -7.724 -2.261 -4.488 1.00 0.00 O ATOM 511 C3' G B 16 -6.562 -3.877 -5.814 1.00 0.00 C ATOM 512 O3' G B 16 -6.835 -4.400 -7.124 1.00 0.00 O ATOM 513 C2' G B 16 -5.848 -2.545 -5.930 1.00 0.00 C ATOM 514 O2' G B 16 -6.031 -1.964 -7.226 1.00 0.00 O ATOM 515 C1' G B 16 -6.468 -1.690 -4.845 1.00 0.00 C ATOM 516 N9 G B 16 -5.656 -1.588 -3.635 1.00 0.00 N ATOM 517 C8 G B 16 -6.052 -1.445 -2.339 1.00 0.00 C ATOM 518 N7 G B 16 -5.067 -1.319 -1.499 1.00 0.00 N ATOM 519 C5 G B 16 -3.940 -1.387 -2.309 1.00 0.00 C ATOM 520 C6 G B 16 -2.573 -1.308 -1.968 1.00 0.00 C ATOM 521 O6 G B 16 -2.101 -1.145 -0.849 1.00 0.00 O ATOM 522 N1 G B 16 -1.751 -1.425 -3.104 1.00 0.00 N ATOM 523 C2 G B 16 -2.222 -1.592 -4.385 1.00 0.00 C ATOM 524 N2 G B 16 -1.327 -1.681 -5.356 1.00 0.00 N ATOM 525 N3 G B 16 -3.509 -1.664 -4.692 1.00 0.00 N ATOM 526 C4 G B 16 -4.300 -1.554 -3.612 1.00 0.00 C ATOM 0 H5' G B 16 -7.423 -5.182 -3.816 1.00 0.00 H new ATOM 0 H5'' G B 16 -8.561 -4.029 -3.146 1.00 0.00 H new ATOM 0 H4' G B 16 -8.658 -3.544 -5.870 1.00 0.00 H new ATOM 0 H3' G B 16 -5.975 -4.623 -5.278 1.00 0.00 H new ATOM 0 H2' G B 16 -4.769 -2.643 -5.810 1.00 0.00 H new ATOM 0 HO2' G B 16 -5.205 -1.515 -7.503 1.00 0.00 H new ATOM 0 H1' G B 16 -6.562 -0.683 -5.252 1.00 0.00 H new ATOM 0 H8 G B 16 -7.089 -1.437 -2.037 1.00 0.00 H new ATOM 0 H1 G B 16 -0.741 -1.383 -2.969 1.00 0.00 H new ATOM 0 H21 G B 16 -1.632 -1.805 -6.321 1.00 0.00 H new ATOM 0 H22 G B 16 -0.332 -1.625 -5.139 1.00 0.00 H new ATOM 538 P G B 17 -6.353 -5.884 -7.546 1.00 0.00 P ATOM 539 OP1 G B 17 -7.420 -6.501 -8.365 1.00 0.00 O ATOM 540 OP2 G B 17 -5.863 -6.574 -6.332 1.00 0.00 O ATOM 541 O5' G B 17 -5.089 -5.590 -8.503 1.00 0.00 O ATOM 542 C5' G B 17 -4.289 -4.433 -8.271 1.00 0.00 C ATOM 543 C4' G B 17 -2.912 -4.768 -7.761 1.00 0.00 C ATOM 544 O4' G B 17 -2.747 -4.142 -6.520 1.00 0.00 O ATOM 545 C3' G B 17 -2.611 -6.271 -7.571 1.00 0.00 C ATOM 546 O3' G B 17 -1.508 -6.681 -8.401 1.00 0.00 O ATOM 547 C2' G B 17 -2.213 -6.390 -6.116 1.00 0.00 C ATOM 548 O2' G B 17 -1.056 -7.219 -5.955 1.00 0.00 O ATOM 549 C1' G B 17 -1.921 -4.960 -5.749 1.00 0.00 C ATOM 550 N9 G B 17 -2.179 -4.637 -4.393 1.00 0.00 N ATOM 551 C8 G B 17 -3.330 -4.603 -3.692 1.00 0.00 C ATOM 552 N7 G B 17 -3.186 -4.149 -2.492 1.00 0.00 N ATOM 553 C5 G B 17 -1.838 -3.930 -2.420 1.00 0.00 C ATOM 554 C6 G B 17 -1.065 -3.507 -1.354 1.00 0.00 C ATOM 555 O6 G B 17 -1.420 -3.182 -0.231 1.00 0.00 O ATOM 556 N1 G B 17 0.267 -3.521 -1.695 1.00 0.00 N ATOM 557 C2 G B 17 0.775 -3.841 -2.957 1.00 0.00 C ATOM 558 N2 G B 17 2.071 -3.819 -3.142 1.00 0.00 N ATOM 559 N3 G B 17 0.030 -4.196 -3.943 1.00 0.00 N ATOM 560 C4 G B 17 -1.244 -4.235 -3.593 1.00 0.00 C ATOM 0 H5' G B 17 -4.791 -3.788 -7.550 1.00 0.00 H new ATOM 0 H5'' G B 17 -4.200 -3.866 -9.198 1.00 0.00 H new ATOM 0 H4' G B 17 -2.222 -4.420 -8.530 1.00 0.00 H new ATOM 0 H3' G B 17 -3.464 -6.894 -7.839 1.00 0.00 H new ATOM 0 H2' G B 17 -2.976 -6.855 -5.491 1.00 0.00 H new ATOM 0 HO2' G B 17 -0.678 -7.427 -6.835 1.00 0.00 H new ATOM 0 H1' G B 17 -0.856 -4.810 -5.925 1.00 0.00 H new ATOM 0 H8 G B 17 -4.279 -4.924 -4.095 1.00 0.00 H new ATOM 0 H1 G B 17 0.939 -3.278 -0.967 1.00 0.00 H new ATOM 0 H21 G B 17 2.460 -4.050 -4.056 1.00 0.00 H new ATOM 0 H22 G B 17 2.692 -3.571 -2.372 1.00 0.00 H new ATOM 572 P A B 18 -1.240 -6.013 -9.849 1.00 0.00 P ATOM 573 OP1 A B 18 -2.460 -5.280 -10.255 1.00 0.00 O ATOM 574 OP2 A B 18 -0.668 -7.048 -10.739 1.00 0.00 O ATOM 575 O5' A B 18 -0.086 -4.935 -9.519 1.00 0.00 O ATOM 576 C5' A B 18 -0.145 -3.595 -10.029 1.00 0.00 C ATOM 577 C4' A B 18 1.051 -2.781 -9.560 1.00 0.00 C ATOM 578 O4' A B 18 0.944 -1.433 -10.018 1.00 0.00 O ATOM 579 C3' A B 18 1.222 -2.744 -8.056 1.00 0.00 C ATOM 580 O3' A B 18 2.620 -2.769 -7.772 1.00 0.00 O ATOM 581 C2' A B 18 0.636 -1.408 -7.658 1.00 0.00 C ATOM 582 O2' A B 18 1.362 -0.852 -6.577 1.00 0.00 O ATOM 583 C1' A B 18 0.758 -0.553 -8.910 1.00 0.00 C ATOM 584 N9 A B 18 -0.432 0.223 -9.230 1.00 0.00 N ATOM 585 C8 A B 18 -0.585 1.125 -10.222 1.00 0.00 C ATOM 586 N7 A B 18 -1.812 1.526 -10.395 1.00 0.00 N ATOM 587 C5 A B 18 -2.514 0.847 -9.415 1.00 0.00 C ATOM 588 C6 A B 18 -3.863 0.836 -9.049 1.00 0.00 C ATOM 589 N6 A B 18 -4.799 1.552 -9.673 1.00 0.00 N ATOM 590 N1 A B 18 -4.207 0.055 -8.009 1.00 0.00 N ATOM 591 C2 A B 18 -3.264 -0.655 -7.394 1.00 0.00 C ATOM 592 N3 A B 18 -1.981 -0.736 -7.658 1.00 0.00 N ATOM 593 C4 A B 18 -1.673 0.056 -8.694 1.00 0.00 C ATOM 0 H5' A B 18 -1.067 -3.117 -9.699 1.00 0.00 H new ATOM 0 H5'' A B 18 -0.170 -3.617 -11.118 1.00 0.00 H new ATOM 0 H4' A B 18 1.920 -3.284 -9.983 1.00 0.00 H new ATOM 0 H3' A B 18 0.749 -3.574 -7.532 1.00 0.00 H new ATOM 0 H2' A B 18 -0.397 -1.483 -7.318 1.00 0.00 H new ATOM 0 HO2' A B 18 1.559 -1.553 -5.921 1.00 0.00 H new ATOM 0 H1' A B 18 1.580 0.139 -8.725 1.00 0.00 H new ATOM 0 H8 A B 18 0.239 1.484 -10.821 1.00 0.00 H new ATOM 0 H61 A B 18 -5.769 1.505 -9.362 1.00 0.00 H new ATOM 0 H62 A B 18 -4.545 2.147 -10.461 1.00 0.00 H new ATOM 0 H2 A B 18 -3.603 -1.249 -6.558 1.00 0.00 H new ATOM 605 P G B 19 3.621 -1.825 -8.613 1.00 0.00 P ATOM 606 OP1 G B 19 3.637 -0.507 -7.957 1.00 0.00 O ATOM 607 OP2 G B 19 3.291 -1.924 -10.052 1.00 0.00 O ATOM 608 O5' G B 19 5.050 -2.522 -8.395 1.00 0.00 O ATOM 609 C5' G B 19 5.998 -1.961 -7.491 1.00 0.00 C ATOM 610 C4' G B 19 5.809 -2.521 -6.089 1.00 0.00 C ATOM 611 O4' G B 19 5.000 -1.646 -5.288 1.00 0.00 O ATOM 612 C3' G B 19 5.126 -3.898 -6.068 1.00 0.00 C ATOM 613 O3' G B 19 5.972 -4.879 -5.449 1.00 0.00 O ATOM 614 C2' G B 19 3.906 -3.691 -5.190 1.00 0.00 C ATOM 615 O2' G B 19 3.680 -4.825 -4.345 1.00 0.00 O ATOM 616 C1' G B 19 4.286 -2.479 -4.394 1.00 0.00 C ATOM 617 N9 G B 19 3.128 -1.800 -3.824 1.00 0.00 N ATOM 618 C8 G B 19 1.904 -1.553 -4.383 1.00 0.00 C ATOM 619 N7 G B 19 0.982 -1.250 -3.518 1.00 0.00 N ATOM 620 C5 G B 19 1.651 -1.297 -2.304 1.00 0.00 C ATOM 621 C6 G B 19 1.172 -1.084 -0.997 1.00 0.00 C ATOM 622 O6 G B 19 0.029 -0.841 -0.653 1.00 0.00 O ATOM 623 N1 G B 19 2.181 -1.237 -0.053 1.00 0.00 N ATOM 624 C2 G B 19 3.490 -1.550 -0.347 1.00 0.00 C ATOM 625 N2 G B 19 4.345 -1.636 0.666 1.00 0.00 N ATOM 626 N3 G B 19 3.923 -1.758 -1.572 1.00 0.00 N ATOM 627 C4 G B 19 2.959 -1.615 -2.491 1.00 0.00 C ATOM 0 H5' G B 19 5.890 -0.877 -7.471 1.00 0.00 H new ATOM 0 H5'' G B 19 7.009 -2.174 -7.839 1.00 0.00 H new ATOM 0 H4' G B 19 6.819 -2.614 -5.689 1.00 0.00 H new ATOM 0 H3' G B 19 4.894 -4.250 -7.073 1.00 0.00 H new ATOM 0 H2' G B 19 2.978 -3.568 -5.749 1.00 0.00 H new ATOM 0 HO2' G B 19 4.448 -5.431 -4.399 1.00 0.00 H new ATOM 0 H1' G B 19 4.893 -2.754 -3.531 1.00 0.00 H new ATOM 0 H8 G B 19 1.720 -1.605 -5.446 1.00 0.00 H new ATOM 0 H1 G B 19 1.934 -1.108 0.928 1.00 0.00 H new ATOM 0 H21 G B 19 5.323 -1.866 0.490 1.00 0.00 H new ATOM 0 H22 G B 19 4.023 -1.472 1.620 1.00 0.00 H new ATOM 639 P G B 20 7.547 -4.983 -5.770 1.00 0.00 P ATOM 640 OP1 G B 20 7.981 -3.732 -6.432 1.00 0.00 O ATOM 641 OP2 G B 20 7.802 -6.288 -6.421 1.00 0.00 O ATOM 642 O5' G B 20 8.190 -5.023 -4.293 1.00 0.00 O ATOM 643 C5' G B 20 7.930 -3.965 -3.364 1.00 0.00 C ATOM 644 C4' G B 20 7.857 -4.474 -1.925 1.00 0.00 C ATOM 645 O4' G B 20 6.695 -3.931 -1.286 1.00 0.00 O ATOM 646 C3' G B 20 7.777 -6.002 -1.818 1.00 0.00 C ATOM 647 O3' G B 20 8.818 -6.516 -0.975 1.00 0.00 O ATOM 648 C2' G B 20 6.444 -6.270 -1.140 1.00 0.00 C ATOM 649 O2' G B 20 6.550 -7.317 -0.176 1.00 0.00 O ATOM 650 C1' G B 20 6.103 -4.948 -0.485 1.00 0.00 C ATOM 651 N9 G B 20 4.664 -4.721 -0.418 1.00 0.00 N ATOM 652 C8 G B 20 3.727 -4.871 -1.398 1.00 0.00 C ATOM 653 N7 G B 20 2.541 -4.623 -1.030 1.00 0.00 N ATOM 654 C5 G B 20 2.668 -4.304 0.274 1.00 0.00 C ATOM 655 C6 G B 20 1.665 -3.970 1.136 1.00 0.00 C ATOM 656 O6 G B 20 0.492 -3.805 0.869 1.00 0.00 O ATOM 657 N1 G B 20 2.122 -3.749 2.368 1.00 0.00 N ATOM 658 C2 G B 20 3.457 -3.807 2.751 1.00 0.00 C ATOM 659 N2 G B 20 3.736 -3.540 4.016 1.00 0.00 N ATOM 660 N3 G B 20 4.442 -4.117 1.912 1.00 0.00 N ATOM 661 C4 G B 20 3.958 -4.358 0.684 1.00 0.00 C ATOM 0 H5' G B 20 6.991 -3.476 -3.624 1.00 0.00 H new ATOM 0 H5'' G B 20 8.714 -3.212 -3.443 1.00 0.00 H new ATOM 0 H4' G B 20 8.780 -4.152 -1.443 1.00 0.00 H new ATOM 0 H3' G B 20 7.878 -6.471 -2.797 1.00 0.00 H new ATOM 0 H2' G B 20 5.677 -6.603 -1.839 1.00 0.00 H new ATOM 0 HO2' G B 20 5.726 -7.847 -0.177 1.00 0.00 H new ATOM 0 H1' G B 20 6.476 -4.945 0.539 1.00 0.00 H new ATOM 0 H8 G B 20 3.976 -5.176 -2.404 1.00 0.00 H new ATOM 0 H1 G B 20 1.437 -3.519 3.088 1.00 0.00 H new ATOM 0 H21 G B 20 4.702 -3.570 4.343 1.00 0.00 H new ATOM 0 H22 G B 20 2.985 -3.304 4.665 1.00 0.00 H new ATOM 673 P A B 21 10.338 -5.994 -1.059 1.00 0.00 P ATOM 674 OP1 A B 21 10.352 -4.675 -1.729 1.00 0.00 O ATOM 675 OP2 A B 21 11.180 -7.096 -1.576 1.00 0.00 O ATOM 676 O5' A B 21 10.693 -5.774 0.496 1.00 0.00 O ATOM 677 C5' A B 21 9.829 -4.997 1.332 1.00 0.00 C ATOM 678 C4' A B 21 10.589 -3.889 2.033 1.00 0.00 C ATOM 679 O4' A B 21 10.885 -2.838 1.101 1.00 0.00 O ATOM 680 C3' A B 21 9.817 -3.259 3.190 1.00 0.00 C ATOM 681 O3' A B 21 10.251 -3.825 4.436 1.00 0.00 O ATOM 682 C2' A B 21 10.218 -1.803 3.101 1.00 0.00 C ATOM 683 O2' A B 21 11.473 -1.558 3.747 1.00 0.00 O ATOM 684 C1' A B 21 10.339 -1.616 1.606 1.00 0.00 C ATOM 685 N9 A B 21 9.066 -1.393 0.901 1.00 0.00 N ATOM 686 C8 A B 21 7.788 -1.356 1.399 1.00 0.00 C ATOM 687 N7 A B 21 6.872 -1.203 0.487 1.00 0.00 N ATOM 688 C5 A B 21 7.594 -1.129 -0.698 1.00 0.00 C ATOM 689 C6 A B 21 7.207 -0.970 -2.034 1.00 0.00 C ATOM 690 N6 A B 21 5.944 -0.854 -2.412 1.00 0.00 N ATOM 691 N1 A B 21 8.172 -0.937 -2.957 1.00 0.00 N ATOM 692 C2 A B 21 9.430 -1.054 -2.574 1.00 0.00 C ATOM 693 N3 A B 21 9.925 -1.213 -1.359 1.00 0.00 N ATOM 694 C4 A B 21 8.928 -1.242 -0.453 1.00 0.00 C ATOM 0 H5' A B 21 9.359 -5.644 2.073 1.00 0.00 H new ATOM 0 H5'' A B 21 9.028 -4.567 0.731 1.00 0.00 H new ATOM 0 H4' A B 21 11.490 -4.355 2.432 1.00 0.00 H new ATOM 0 H3' A B 21 8.739 -3.415 3.138 1.00 0.00 H new ATOM 0 H2' A B 21 9.517 -1.125 3.588 1.00 0.00 H new ATOM 0 HO2' A B 21 11.317 -1.311 4.682 1.00 0.00 H new ATOM 0 H1' A B 21 10.945 -0.726 1.437 1.00 0.00 H new ATOM 0 H8 A B 21 7.563 -1.446 2.451 1.00 0.00 H new ATOM 0 H61 A B 21 5.716 -0.740 -3.400 1.00 0.00 H new ATOM 0 H62 A B 21 5.199 -0.879 -1.716 1.00 0.00 H new ATOM 0 H2 A B 21 10.160 -1.014 -3.369 1.00 0.00 H new ATOM 706 P G B 22 10.069 -3.032 5.835 1.00 0.00 P ATOM 707 OP1 G B 22 10.578 -1.653 5.676 1.00 0.00 O ATOM 708 OP2 G B 22 10.599 -3.886 6.921 1.00 0.00 O ATOM 709 O5' G B 22 8.471 -2.952 5.994 1.00 0.00 O ATOM 710 C5' G B 22 7.751 -1.832 5.477 1.00 0.00 C ATOM 711 C4' G B 22 6.605 -1.428 6.391 1.00 0.00 C ATOM 712 O4' G B 22 5.768 -0.473 5.732 1.00 0.00 O ATOM 713 C3' G B 22 5.697 -2.568 6.785 1.00 0.00 C ATOM 714 O3' G B 22 6.214 -3.232 7.940 1.00 0.00 O ATOM 715 C2' G B 22 4.409 -1.841 7.133 1.00 0.00 C ATOM 716 O2' G B 22 4.439 -1.341 8.475 1.00 0.00 O ATOM 717 C1' G B 22 4.403 -0.706 6.125 1.00 0.00 C ATOM 718 N9 G B 22 3.603 -0.978 4.911 1.00 0.00 N ATOM 719 C8 G B 22 3.993 -0.999 3.599 1.00 0.00 C ATOM 720 N7 G B 22 3.010 -1.078 2.752 1.00 0.00 N ATOM 721 C5 G B 22 1.886 -1.125 3.555 1.00 0.00 C ATOM 722 C6 G B 22 0.522 -1.203 3.197 1.00 0.00 C ATOM 723 O6 G B 22 0.028 -1.260 2.074 1.00 0.00 O ATOM 724 N1 G B 22 -0.289 -1.212 4.318 1.00 0.00 N ATOM 725 C2 G B 22 0.149 -1.172 5.616 1.00 0.00 C ATOM 726 N2 G B 22 -0.791 -1.199 6.561 1.00 0.00 N ATOM 727 N3 G B 22 1.430 -1.107 5.952 1.00 0.00 N ATOM 728 C4 G B 22 2.239 -1.078 4.876 1.00 0.00 C ATOM 0 H5' G B 22 7.360 -2.076 4.489 1.00 0.00 H new ATOM 0 H5'' G B 22 8.431 -0.989 5.352 1.00 0.00 H new ATOM 0 H4' G B 22 7.088 -1.034 7.285 1.00 0.00 H new ATOM 0 H3' G B 22 5.582 -3.331 6.015 1.00 0.00 H new ATOM 0 H2' G B 22 3.523 -2.474 7.088 1.00 0.00 H new ATOM 0 HO2' G B 22 4.235 -2.068 9.100 1.00 0.00 H new ATOM 0 H1' G B 22 3.942 0.156 6.607 1.00 0.00 H new ATOM 0 H8 G B 22 5.028 -0.954 3.294 1.00 0.00 H new ATOM 0 H1 G B 22 -1.297 -1.252 4.166 1.00 0.00 H new ATOM 0 H21 G B 22 -0.525 -1.172 7.545 1.00 0.00 H new ATOM 0 H22 G B 22 -1.776 -1.247 6.300 1.00 0.00 H new ATOM 740 P G B 23 5.310 -4.287 8.752 1.00 0.00 P ATOM 741 OP1 G B 23 6.046 -4.691 9.970 1.00 0.00 O ATOM 742 OP2 G B 23 4.831 -5.318 7.803 1.00 0.00 O ATOM 743 O5' G B 23 4.049 -3.394 9.198 1.00 0.00 O ATOM 744 C5' G B 23 3.176 -3.839 10.237 1.00 0.00 C ATOM 745 C4' G B 23 1.835 -4.273 9.690 1.00 0.00 C ATOM 746 O4' G B 23 1.579 -3.606 8.475 1.00 0.00 O ATOM 747 C3' G B 23 1.704 -5.760 9.382 1.00 0.00 C ATOM 748 O3' G B 23 1.108 -6.518 10.452 1.00 0.00 O ATOM 749 C2' G B 23 0.783 -5.789 8.193 1.00 0.00 C ATOM 750 O2' G B 23 -0.403 -6.490 8.486 1.00 0.00 O ATOM 751 C1' G B 23 0.523 -4.326 7.908 1.00 0.00 C ATOM 752 N9 G B 23 0.468 -4.082 6.502 1.00 0.00 N ATOM 753 C8 G B 23 1.491 -4.060 5.627 1.00 0.00 C ATOM 754 N7 G B 23 1.129 -3.983 4.407 1.00 0.00 N ATOM 755 C5 G B 23 -0.242 -3.964 4.478 1.00 0.00 C ATOM 756 C6 G B 23 -1.151 -3.910 3.443 1.00 0.00 C ATOM 757 O6 G B 23 -0.925 -3.765 2.265 1.00 0.00 O ATOM 758 N1 G B 23 -2.430 -3.944 3.897 1.00 0.00 N ATOM 759 C2 G B 23 -2.807 -3.990 5.217 1.00 0.00 C ATOM 760 N2 G B 23 -4.117 -3.994 5.464 1.00 0.00 N ATOM 761 N3 G B 23 -1.932 -4.028 6.218 1.00 0.00 N ATOM 762 C4 G B 23 -0.663 -4.019 5.758 1.00 0.00 C ATOM 0 H5' G B 23 3.032 -3.037 10.960 1.00 0.00 H new ATOM 0 H5'' G B 23 3.638 -4.670 10.770 1.00 0.00 H new ATOM 0 H4' G B 23 1.132 -4.029 10.487 1.00 0.00 H new ATOM 0 H3' G B 23 2.684 -6.208 9.221 1.00 0.00 H new ATOM 0 H2' G B 23 1.209 -6.307 7.334 1.00 0.00 H new ATOM 0 HO2' G B 23 -0.803 -6.129 9.305 1.00 0.00 H new ATOM 0 H1' G B 23 -0.435 -4.023 8.329 1.00 0.00 H new ATOM 0 H8 G B 23 2.526 -4.104 5.932 1.00 0.00 H new ATOM 0 H1 G B 23 -3.174 -3.935 3.199 1.00 0.00 H new ATOM 0 H21 G B 23 -4.455 -4.027 6.426 1.00 0.00 H new ATOM 0 H22 G B 23 -4.782 -3.964 4.691 1.00 0.00 H new ATOM 774 P A B 24 0.869 -5.946 11.939 1.00 0.00 P ATOM 775 OP1 A B 24 1.555 -4.644 12.088 1.00 0.00 O ATOM 776 OP2 A B 24 1.150 -7.036 12.900 1.00 0.00 O ATOM 777 O5' A B 24 -0.717 -5.689 11.930 1.00 0.00 O ATOM 778 C5' A B 24 -1.227 -4.363 11.848 1.00 0.00 C ATOM 779 C4' A B 24 -1.915 -4.090 10.514 1.00 0.00 C ATOM 780 O4' A B 24 -1.494 -4.992 9.532 1.00 0.00 O ATOM 781 C3' A B 24 -3.428 -4.172 10.544 1.00 0.00 C ATOM 782 O3' A B 24 -4.009 -2.945 10.994 1.00 0.00 O ATOM 783 C2' A B 24 -3.777 -4.463 9.088 1.00 0.00 C ATOM 784 O2' A B 24 -4.193 -3.280 8.398 1.00 0.00 O ATOM 785 C1' A B 24 -2.494 -5.020 8.511 1.00 0.00 C ATOM 786 N9 A B 24 -2.632 -6.400 8.169 1.00 0.00 N ATOM 787 C8 A B 24 -2.342 -7.426 8.955 1.00 0.00 C ATOM 788 N7 A B 24 -2.797 -8.579 8.533 1.00 0.00 N ATOM 789 C5 A B 24 -3.417 -8.230 7.336 1.00 0.00 C ATOM 790 C6 A B 24 -4.101 -8.953 6.353 1.00 0.00 C ATOM 791 N6 A B 24 -4.322 -10.266 6.424 1.00 0.00 N ATOM 792 N1 A B 24 -4.549 -8.253 5.289 1.00 0.00 N ATOM 793 C2 A B 24 -4.317 -6.939 5.241 1.00 0.00 C ATOM 794 N3 A B 24 -3.721 -6.185 6.101 1.00 0.00 N ATOM 795 C4 A B 24 -3.292 -6.896 7.123 1.00 0.00 C ATOM 0 H5' A B 24 -0.411 -3.653 11.986 1.00 0.00 H new ATOM 0 H5'' A B 24 -1.935 -4.197 12.660 1.00 0.00 H new ATOM 0 H4' A B 24 -1.627 -3.063 10.290 1.00 0.00 H new ATOM 0 H3' A B 24 -3.808 -4.926 11.234 1.00 0.00 H new ATOM 0 H2' A B 24 -4.614 -5.154 8.991 1.00 0.00 H new ATOM 0 HO2' A B 24 -3.572 -2.549 8.599 1.00 0.00 H new ATOM 0 HO3' A B 24 -3.338 -2.232 10.954 1.00 0.00 H new ATOM 0 H1' A B 24 -2.243 -4.426 7.632 1.00 0.00 H new ATOM 0 H8 A B 24 -1.777 -7.320 9.869 1.00 0.00 H new ATOM 0 H61 A B 24 -4.828 -10.739 5.675 1.00 0.00 H new ATOM 0 H62 A B 24 -3.985 -10.797 7.227 1.00 0.00 H new ATOM 0 H2 A B 24 -4.680 -6.436 4.357 1.00 0.00 H new TER 808 A B 24 ATOM 809 N GLY C 25 -7.430 10.378 -1.329 1.00 0.00 N ATOM 810 CA GLY C 25 -6.053 10.137 -0.812 1.00 0.00 C ATOM 811 C GLY C 25 -5.869 8.684 -0.469 1.00 0.00 C ATOM 812 O GLY C 25 -6.816 7.955 -0.174 1.00 0.00 O ATOM 0 HA2 GLY C 25 -5.319 10.436 -1.560 1.00 0.00 H new ATOM 0 HA3 GLY C 25 -5.877 10.751 0.071 1.00 0.00 H new ATOM 818 N GLN C 26 -4.618 8.275 -0.563 1.00 0.00 N ATOM 819 CA GLN C 26 -4.240 6.956 -0.332 1.00 0.00 C ATOM 820 C GLN C 26 -3.295 6.760 0.893 1.00 0.00 C ATOM 821 O GLN C 26 -3.682 6.064 1.812 1.00 0.00 O ATOM 822 CB GLN C 26 -3.765 6.467 -1.688 1.00 0.00 C ATOM 823 CG GLN C 26 -2.993 7.503 -2.383 1.00 0.00 C ATOM 824 CD GLN C 26 -3.946 8.574 -2.806 1.00 0.00 C ATOM 825 OE1 GLN C 26 -3.578 9.776 -2.673 1.00 0.00 O flip ATOM 826 NE2 GLN C 26 -5.060 8.297 -3.253 1.00 0.00 N flip ATOM 0 H GLN C 26 -3.843 8.890 -0.810 1.00 0.00 H new ATOM 0 HA GLN C 26 -5.058 6.324 0.014 1.00 0.00 H new ATOM 0 HB2 GLN C 26 -3.151 5.575 -1.562 1.00 0.00 H new ATOM 0 HB3 GLN C 26 -4.623 6.180 -2.295 1.00 0.00 H new ATOM 0 HG2 GLN C 26 -2.225 7.912 -1.727 1.00 0.00 H new ATOM 0 HG3 GLN C 26 -2.482 7.082 -3.249 1.00 0.00 H new ATOM 0 HE21 GLN C 26 -5.341 7.322 -3.354 1.00 0.00 H new ATOM 0 HE22 GLN C 26 -5.701 9.043 -3.522 1.00 0.00 H new ATOM 835 N TRP C 27 -2.062 7.298 0.903 1.00 0.00 N ATOM 836 CA TRP C 27 -1.089 7.046 2.024 1.00 0.00 C ATOM 837 C TRP C 27 -0.288 8.238 2.416 1.00 0.00 C ATOM 838 O TRP C 27 -0.082 8.594 3.576 1.00 0.00 O ATOM 839 CB TRP C 27 -0.053 6.098 1.477 1.00 0.00 C ATOM 840 CG TRP C 27 -0.368 5.989 0.088 1.00 0.00 C ATOM 841 CD1 TRP C 27 -1.465 5.566 -0.397 1.00 0.00 C ATOM 842 CD2 TRP C 27 0.365 6.400 -0.987 1.00 0.00 C ATOM 843 NE1 TRP C 27 -1.481 5.839 -1.702 1.00 0.00 N ATOM 844 CE2 TRP C 27 -0.387 6.308 -2.107 1.00 0.00 C ATOM 845 CE3 TRP C 27 1.554 6.852 -1.080 1.00 0.00 C ATOM 846 CZ2 TRP C 27 0.026 6.685 -3.287 1.00 0.00 C ATOM 847 CZ3 TRP C 27 2.033 7.244 -2.284 1.00 0.00 C ATOM 848 CH2 TRP C 27 1.236 7.166 -3.388 1.00 0.00 C ATOM 0 H TRP C 27 -1.703 7.905 0.166 1.00 0.00 H new ATOM 0 HA TRP C 27 -1.674 6.703 2.877 1.00 0.00 H new ATOM 0 HB2 TRP C 27 0.956 6.483 1.626 1.00 0.00 H new ATOM 0 HB3 TRP C 27 -0.101 5.128 1.972 1.00 0.00 H new ATOM 0 HD1 TRP C 27 -2.250 5.070 0.154 1.00 0.00 H new ATOM 0 HE1 TRP C 27 -2.290 5.685 -2.304 1.00 0.00 H new ATOM 0 HE3 TRP C 27 2.177 6.922 -0.201 1.00 0.00 H new ATOM 0 HZ2 TRP C 27 -0.614 6.602 -4.153 1.00 0.00 H new ATOM 0 HZ3 TRP C 27 3.043 7.617 -2.370 1.00 0.00 H new ATOM 0 HH2 TRP C 27 1.605 7.502 -4.346 1.00 0.00 H new ATOM 859 N ASN C 28 0.238 8.725 1.359 1.00 0.00 N ATOM 860 CA ASN C 28 1.177 9.798 1.306 1.00 0.00 C ATOM 861 C ASN C 28 0.794 10.507 0.052 1.00 0.00 C ATOM 862 O ASN C 28 1.562 10.834 -0.859 1.00 0.00 O ATOM 863 CB ASN C 28 2.444 9.051 1.095 1.00 0.00 C ATOM 864 CG ASN C 28 2.707 9.077 -0.380 1.00 0.00 C ATOM 865 OD1 ASN C 28 1.630 8.960 -1.127 1.00 0.00 O flip ATOM 866 ND2 ASN C 28 3.830 9.210 -0.854 1.00 0.00 N flip ATOM 0 H ASN C 28 0.012 8.363 0.433 1.00 0.00 H new ATOM 0 HA ASN C 28 1.232 10.490 2.146 1.00 0.00 H new ATOM 0 HB2 ASN C 28 3.264 9.513 1.644 1.00 0.00 H new ATOM 0 HB3 ASN C 28 2.356 8.026 1.456 1.00 0.00 H new ATOM 0 HD21 ASN C 28 4.637 9.297 -0.237 1.00 0.00 H new ATOM 0 HD22 ASN C 28 3.957 9.233 -1.866 1.00 0.00 H new ATOM 873 N LYS C 29 -0.427 10.377 -0.042 1.00 0.00 N ATOM 874 CA LYS C 29 -1.157 10.509 -1.164 1.00 0.00 C ATOM 875 C LYS C 29 -0.881 11.550 -2.131 1.00 0.00 C ATOM 876 O LYS C 29 -0.915 12.753 -1.872 1.00 0.00 O ATOM 877 CB LYS C 29 -2.410 10.948 -0.577 1.00 0.00 C ATOM 878 CG LYS C 29 -2.985 9.881 0.239 1.00 0.00 C ATOM 879 CD LYS C 29 -2.668 10.001 1.689 1.00 0.00 C ATOM 880 CE LYS C 29 -3.546 8.986 2.406 1.00 0.00 C ATOM 881 NZ LYS C 29 -4.213 9.626 3.575 1.00 0.00 N ATOM 0 H LYS C 29 -1.003 10.148 0.768 1.00 0.00 H new ATOM 0 HA LYS C 29 -1.028 9.588 -1.733 1.00 0.00 H new ATOM 0 HB2 LYS C 29 -2.243 11.834 0.035 1.00 0.00 H new ATOM 0 HB3 LYS C 29 -3.109 11.231 -1.364 1.00 0.00 H new ATOM 0 HG2 LYS C 29 -4.068 9.881 0.111 1.00 0.00 H new ATOM 0 HG3 LYS C 29 -2.621 8.920 -0.125 1.00 0.00 H new ATOM 0 HD2 LYS C 29 -1.613 9.801 1.874 1.00 0.00 H new ATOM 0 HD3 LYS C 29 -2.869 11.010 2.048 1.00 0.00 H new ATOM 0 HE2 LYS C 29 -4.296 8.592 1.720 1.00 0.00 H new ATOM 0 HE3 LYS C 29 -2.943 8.141 2.738 1.00 0.00 H new ATOM 0 HZ1 LYS C 29 -4.811 8.926 4.059 1.00 0.00 H new ATOM 0 HZ2 LYS C 29 -3.492 9.981 4.235 1.00 0.00 H new ATOM 0 HZ3 LYS C 29 -4.803 10.418 3.248 1.00 0.00 H new ATOM 895 N PRO C 30 -0.700 11.022 -3.326 1.00 0.00 N ATOM 896 CA PRO C 30 -0.464 11.728 -4.522 1.00 0.00 C ATOM 897 C PRO C 30 -0.088 13.099 -4.137 1.00 0.00 C ATOM 898 O PRO C 30 -0.448 14.147 -4.674 1.00 0.00 O ATOM 899 CB PRO C 30 -1.760 11.338 -5.159 1.00 0.00 C ATOM 900 CG PRO C 30 -1.771 9.823 -4.844 1.00 0.00 C ATOM 901 CD PRO C 30 -0.763 9.637 -3.725 1.00 0.00 C ATOM 0 HA PRO C 30 0.344 11.553 -5.232 1.00 0.00 H new ATOM 0 HB2 PRO C 30 -2.612 11.860 -4.723 1.00 0.00 H new ATOM 0 HB3 PRO C 30 -1.775 11.541 -6.230 1.00 0.00 H new ATOM 0 HG2 PRO C 30 -2.764 9.493 -4.538 1.00 0.00 H new ATOM 0 HG3 PRO C 30 -1.497 9.237 -5.721 1.00 0.00 H new ATOM 0 HD2 PRO C 30 -1.115 8.976 -2.933 1.00 0.00 H new ATOM 0 HD3 PRO C 30 0.194 9.243 -4.068 1.00 0.00 H new ATOM 909 N SER C 31 0.759 12.919 -3.156 1.00 0.00 N ATOM 910 CA SER C 31 1.489 13.888 -2.438 1.00 0.00 C ATOM 911 C SER C 31 2.877 13.398 -2.622 1.00 0.00 C ATOM 912 O SER C 31 3.745 13.513 -1.759 1.00 0.00 O ATOM 913 CB SER C 31 1.148 13.823 -0.968 1.00 0.00 C ATOM 914 OG SER C 31 0.176 14.808 -0.648 1.00 0.00 O ATOM 0 H SER C 31 0.964 11.979 -2.817 1.00 0.00 H new ATOM 0 HA SER C 31 1.304 14.911 -2.766 1.00 0.00 H new ATOM 0 HB2 SER C 31 0.769 12.832 -0.718 1.00 0.00 H new ATOM 0 HB3 SER C 31 2.046 13.980 -0.371 1.00 0.00 H new ATOM 0 HG SER C 31 -0.703 14.517 -0.970 1.00 0.00 H new ATOM 920 N LYS C 32 2.980 12.745 -3.761 1.00 0.00 N ATOM 921 CA LYS C 32 4.144 12.024 -4.188 1.00 0.00 C ATOM 922 C LYS C 32 5.394 12.843 -4.000 1.00 0.00 C ATOM 923 O LYS C 32 5.804 13.644 -4.839 1.00 0.00 O ATOM 924 CB LYS C 32 3.963 11.783 -5.683 1.00 0.00 C ATOM 925 CG LYS C 32 2.544 11.290 -5.894 1.00 0.00 C ATOM 926 CD LYS C 32 2.529 10.108 -6.837 1.00 0.00 C ATOM 927 CE LYS C 32 2.972 8.864 -6.078 1.00 0.00 C ATOM 928 NZ LYS C 32 4.158 8.261 -6.750 1.00 0.00 N ATOM 0 H LYS C 32 2.218 12.705 -4.438 1.00 0.00 H new ATOM 0 HA LYS C 32 4.248 11.105 -3.611 1.00 0.00 H new ATOM 0 HB2 LYS C 32 4.138 12.701 -6.244 1.00 0.00 H new ATOM 0 HB3 LYS C 32 4.682 11.048 -6.043 1.00 0.00 H new ATOM 0 HG2 LYS C 32 2.106 11.005 -4.938 1.00 0.00 H new ATOM 0 HG3 LYS C 32 1.930 12.094 -6.299 1.00 0.00 H new ATOM 0 HD2 LYS C 32 1.528 9.964 -7.245 1.00 0.00 H new ATOM 0 HD3 LYS C 32 3.194 10.291 -7.681 1.00 0.00 H new ATOM 0 HE2 LYS C 32 3.218 9.123 -5.048 1.00 0.00 H new ATOM 0 HE3 LYS C 32 2.157 8.141 -6.039 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 4.734 7.753 -6.048 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 3.840 7.596 -7.484 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 4.729 9.013 -7.187 1.00 0.00 H new ATOM 942 N PRO C 33 6.001 12.581 -2.877 1.00 0.00 N ATOM 943 CA PRO C 33 7.268 13.202 -2.433 1.00 0.00 C ATOM 944 C PRO C 33 8.414 12.433 -3.024 1.00 0.00 C ATOM 945 O PRO C 33 9.280 12.968 -3.718 1.00 0.00 O ATOM 946 CB PRO C 33 7.269 13.008 -0.919 1.00 0.00 C ATOM 947 CG PRO C 33 6.206 12.000 -0.598 1.00 0.00 C ATOM 948 CD PRO C 33 5.510 11.609 -1.893 1.00 0.00 C ATOM 0 HA PRO C 33 7.359 14.248 -2.727 1.00 0.00 H new ATOM 0 HB2 PRO C 33 8.244 12.661 -0.577 1.00 0.00 H new ATOM 0 HB3 PRO C 33 7.070 13.951 -0.411 1.00 0.00 H new ATOM 0 HG2 PRO C 33 6.646 11.123 -0.124 1.00 0.00 H new ATOM 0 HG3 PRO C 33 5.488 12.417 0.108 1.00 0.00 H new ATOM 0 HD2 PRO C 33 5.757 10.588 -2.185 1.00 0.00 H new ATOM 0 HD3 PRO C 33 4.426 11.658 -1.792 1.00 0.00 H new ATOM 956 N LYS C 34 8.352 11.143 -2.767 1.00 0.00 N ATOM 957 CA LYS C 34 9.314 10.218 -3.285 1.00 0.00 C ATOM 958 C LYS C 34 8.714 9.683 -4.549 1.00 0.00 C ATOM 959 O LYS C 34 9.393 9.324 -5.510 1.00 0.00 O ATOM 960 CB LYS C 34 9.584 9.072 -2.301 1.00 0.00 C ATOM 961 CG LYS C 34 8.375 8.804 -1.369 1.00 0.00 C ATOM 962 CD LYS C 34 7.621 7.539 -1.797 1.00 0.00 C ATOM 963 CE LYS C 34 6.137 7.861 -1.993 1.00 0.00 C ATOM 964 NZ LYS C 34 5.324 6.631 -1.779 1.00 0.00 N ATOM 0 H LYS C 34 7.628 10.714 -2.191 1.00 0.00 H new ATOM 0 HA LYS C 34 10.273 10.708 -3.455 1.00 0.00 H new ATOM 0 HB2 LYS C 34 9.819 8.165 -2.858 1.00 0.00 H new ATOM 0 HB3 LYS C 34 10.460 9.312 -1.698 1.00 0.00 H new ATOM 0 HG2 LYS C 34 8.721 8.695 -0.341 1.00 0.00 H new ATOM 0 HG3 LYS C 34 7.699 9.659 -1.389 1.00 0.00 H new ATOM 0 HD2 LYS C 34 8.043 7.149 -2.723 1.00 0.00 H new ATOM 0 HD3 LYS C 34 7.737 6.762 -1.041 1.00 0.00 H new ATOM 0 HE2 LYS C 34 5.828 8.639 -1.294 1.00 0.00 H new ATOM 0 HE3 LYS C 34 5.969 8.250 -2.997 1.00 0.00 H new ATOM 0 HZ1 LYS C 34 4.669 6.504 -2.577 1.00 0.00 H new ATOM 0 HZ2 LYS C 34 5.954 5.806 -1.714 1.00 0.00 H new ATOM 0 HZ3 LYS C 34 4.781 6.723 -0.897 1.00 0.00 H new ATOM 978 N THR C 35 7.400 9.668 -4.505 1.00 0.00 N ATOM 979 CA THR C 35 6.596 9.217 -5.607 1.00 0.00 C ATOM 980 C THR C 35 6.845 7.768 -5.805 1.00 0.00 C ATOM 981 O THR C 35 6.387 7.138 -6.757 1.00 0.00 O ATOM 982 CB THR C 35 6.928 10.018 -6.844 1.00 0.00 C ATOM 983 OG1 THR C 35 8.162 9.569 -7.388 1.00 0.00 O ATOM 984 CG2 THR C 35 7.031 11.499 -6.464 1.00 0.00 C ATOM 0 H THR C 35 6.860 9.972 -3.695 1.00 0.00 H new ATOM 0 HA THR C 35 5.536 9.365 -5.400 1.00 0.00 H new ATOM 0 HB THR C 35 6.146 9.887 -7.592 1.00 0.00 H new ATOM 0 HG1 THR C 35 8.897 9.837 -6.797 1.00 0.00 H new ATOM 0 HG21 THR C 35 7.271 12.086 -7.350 1.00 0.00 H new ATOM 0 HG22 THR C 35 6.080 11.836 -6.052 1.00 0.00 H new ATOM 0 HG23 THR C 35 7.816 11.630 -5.719 1.00 0.00 H new ATOM 992 N ASN C 36 7.545 7.255 -4.838 1.00 0.00 N ATOM 993 CA ASN C 36 7.850 5.852 -4.814 1.00 0.00 C ATOM 994 C ASN C 36 8.238 5.381 -6.211 1.00 0.00 C ATOM 995 O ASN C 36 7.629 4.450 -6.697 1.00 0.00 O ATOM 996 CB ASN C 36 6.597 5.134 -4.314 1.00 0.00 C ATOM 997 CG ASN C 36 5.388 5.600 -5.125 1.00 0.00 C ATOM 998 OD1 ASN C 36 4.637 6.560 -4.657 1.00 0.00 O flip ATOM 999 ND2 ASN C 36 5.125 5.092 -6.214 1.00 0.00 N flip ATOM 1000 OXT ASN C 36 9.142 5.971 -6.779 1.00 0.00 O ATOM 0 H ASN C 36 7.918 7.787 -4.052 1.00 0.00 H new ATOM 0 HA ASN C 36 8.693 5.637 -4.157 1.00 0.00 H new ATOM 0 HB2 ASN C 36 6.720 4.055 -4.410 1.00 0.00 H new ATOM 0 HB3 ASN C 36 6.442 5.344 -3.256 1.00 0.00 H new ATOM 0 HD21 ASN C 36 5.710 4.342 -6.582 1.00 0.00 H new ATOM 0 HD22 ASN C 36 4.322 5.421 -6.749 1.00 0.00 H new TER 1007 ASN C 36 ATOM 1008 N GLY D 37 -7.183 -10.607 1.261 1.00 0.00 N ATOM 1009 CA GLY D 37 -5.808 -10.317 0.760 1.00 0.00 C ATOM 1010 C GLY D 37 -5.683 -8.866 0.382 1.00 0.00 C ATOM 1011 O GLY D 37 -6.655 -8.193 0.035 1.00 0.00 O ATOM 0 HA2 GLY D 37 -5.075 -10.564 1.528 1.00 0.00 H new ATOM 0 HA3 GLY D 37 -5.589 -10.945 -0.104 1.00 0.00 H new ATOM 1017 N GLN D 38 -4.457 -8.396 0.503 1.00 0.00 N ATOM 1018 CA GLN D 38 -4.134 -7.066 0.244 1.00 0.00 C ATOM 1019 C GLN D 38 -3.144 -6.851 -0.945 1.00 0.00 C ATOM 1020 O GLN D 38 -3.530 -6.218 -1.909 1.00 0.00 O ATOM 1021 CB GLN D 38 -3.750 -6.509 1.599 1.00 0.00 C ATOM 1022 CG GLN D 38 -2.975 -7.493 2.367 1.00 0.00 C ATOM 1023 CD GLN D 38 -3.903 -8.596 2.772 1.00 0.00 C ATOM 1024 OE1 GLN D 38 -3.458 -9.780 2.757 1.00 0.00 O flip ATOM 1025 NE2 GLN D 38 -5.071 -8.362 3.083 1.00 0.00 N flip ATOM 0 H GLN D 38 -3.662 -8.966 0.792 1.00 0.00 H new ATOM 0 HA GLN D 38 -4.968 -6.494 -0.163 1.00 0.00 H new ATOM 0 HB2 GLN D 38 -3.165 -5.599 1.470 1.00 0.00 H new ATOM 0 HB3 GLN D 38 -4.648 -6.235 2.152 1.00 0.00 H new ATOM 0 HG2 GLN D 38 -2.155 -7.886 1.766 1.00 0.00 H new ATOM 0 HG3 GLN D 38 -2.531 -7.026 3.246 1.00 0.00 H new ATOM 0 HE21 GLN D 38 -5.414 -7.402 3.090 1.00 0.00 H new ATOM 0 HE22 GLN D 38 -5.695 -9.129 3.334 1.00 0.00 H new ATOM 1034 N TRP D 39 -1.878 -7.300 -0.869 1.00 0.00 N ATOM 1035 CA TRP D 39 -0.860 -7.029 -1.946 1.00 0.00 C ATOM 1036 C TRP D 39 -0.010 -8.203 -2.270 1.00 0.00 C ATOM 1037 O TRP D 39 0.260 -8.580 -3.410 1.00 0.00 O ATOM 1038 CB TRP D 39 0.114 -6.040 -1.368 1.00 0.00 C ATOM 1039 CG TRP D 39 -0.280 -5.921 0.000 1.00 0.00 C ATOM 1040 CD1 TRP D 39 -1.418 -5.541 0.418 1.00 0.00 C ATOM 1041 CD2 TRP D 39 0.409 -6.288 1.120 1.00 0.00 C ATOM 1042 NE1 TRP D 39 -1.494 -5.787 1.724 1.00 0.00 N ATOM 1043 CE2 TRP D 39 -0.405 -6.207 2.196 1.00 0.00 C ATOM 1044 CE3 TRP D 39 1.608 -6.693 1.283 1.00 0.00 C ATOM 1045 CZ2 TRP D 39 -0.043 -6.546 3.402 1.00 0.00 C ATOM 1046 CZ3 TRP D 39 2.035 -7.048 2.520 1.00 0.00 C ATOM 1047 CH2 TRP D 39 1.175 -6.979 3.578 1.00 0.00 C ATOM 0 H TRP D 39 -1.520 -7.849 -0.087 1.00 0.00 H new ATOM 0 HA TRP D 39 -1.408 -6.714 -2.834 1.00 0.00 H new ATOM 0 HB2 TRP D 39 1.141 -6.393 -1.458 1.00 0.00 H new ATOM 0 HB3 TRP D 39 0.061 -5.081 -1.883 1.00 0.00 H new ATOM 0 HD1 TRP D 39 -2.194 -5.093 -0.185 1.00 0.00 H new ATOM 0 HE1 TRP D 39 -2.339 -5.651 2.279 1.00 0.00 H new ATOM 0 HE3 TRP D 39 2.280 -6.753 0.439 1.00 0.00 H new ATOM 0 HZ2 TRP D 39 -0.731 -6.471 4.231 1.00 0.00 H new ATOM 0 HZ3 TRP D 39 3.051 -7.384 2.668 1.00 0.00 H new ATOM 0 HH2 TRP D 39 1.503 -7.283 4.561 1.00 0.00 H new ATOM 1058 N ASN D 40 0.478 -8.651 -1.175 1.00 0.00 N ATOM 1059 CA ASN D 40 1.439 -9.696 -1.053 1.00 0.00 C ATOM 1060 C ASN D 40 1.011 -10.389 0.200 1.00 0.00 C ATOM 1061 O ASN D 40 1.740 -10.676 1.155 1.00 0.00 O ATOM 1062 CB ASN D 40 2.675 -8.907 -0.804 1.00 0.00 C ATOM 1063 CG ASN D 40 2.886 -8.889 0.681 1.00 0.00 C ATOM 1064 OD1 ASN D 40 1.778 -8.803 1.387 1.00 0.00 O flip ATOM 1065 ND2 ASN D 40 4.001 -8.949 1.200 1.00 0.00 N flip ATOM 0 H ASN D 40 0.199 -8.273 -0.270 1.00 0.00 H new ATOM 0 HA ASN D 40 1.554 -10.407 -1.871 1.00 0.00 H new ATOM 0 HB2 ASN D 40 3.529 -9.357 -1.310 1.00 0.00 H new ATOM 0 HB3 ASN D 40 2.572 -7.894 -1.192 1.00 0.00 H new ATOM 0 HD21 ASN D 40 4.833 -9.015 0.614 1.00 0.00 H new ATOM 0 HD22 ASN D 40 4.092 -8.933 2.216 1.00 0.00 H new ATOM 1072 N LYS D 41 -0.218 -10.292 0.232 1.00 0.00 N ATOM 1073 CA LYS D 41 -1.005 -10.421 1.323 1.00 0.00 C ATOM 1074 C LYS D 41 -0.758 -11.430 2.332 1.00 0.00 C ATOM 1075 O LYS D 41 -0.789 -12.641 2.110 1.00 0.00 O ATOM 1076 CB LYS D 41 -2.206 -10.924 0.679 1.00 0.00 C ATOM 1077 CG LYS D 41 -2.737 -9.918 -0.240 1.00 0.00 C ATOM 1078 CD LYS D 41 -2.291 -10.096 -1.648 1.00 0.00 C ATOM 1079 CE LYS D 41 -3.113 -9.122 -2.474 1.00 0.00 C ATOM 1080 NZ LYS D 41 -3.624 -9.796 -3.701 1.00 0.00 N ATOM 0 H LYS D 41 -0.759 -10.096 -0.611 1.00 0.00 H new ATOM 0 HA LYS D 41 -0.932 -9.482 1.872 1.00 0.00 H new ATOM 0 HB2 LYS D 41 -1.981 -11.842 0.136 1.00 0.00 H new ATOM 0 HB3 LYS D 41 -2.955 -11.174 1.431 1.00 0.00 H new ATOM 0 HG2 LYS D 41 -3.826 -9.948 -0.207 1.00 0.00 H new ATOM 0 HG3 LYS D 41 -2.435 -8.929 0.105 1.00 0.00 H new ATOM 0 HD2 LYS D 41 -1.225 -9.890 -1.749 1.00 0.00 H new ATOM 0 HD3 LYS D 41 -2.451 -11.122 -1.981 1.00 0.00 H new ATOM 0 HE2 LYS D 41 -3.947 -8.745 -1.882 1.00 0.00 H new ATOM 0 HE3 LYS D 41 -2.503 -8.262 -2.749 1.00 0.00 H new ATOM 0 HZ1 LYS D 41 -4.185 -9.122 -4.259 1.00 0.00 H new ATOM 0 HZ2 LYS D 41 -2.822 -10.135 -4.271 1.00 0.00 H new ATOM 0 HZ3 LYS D 41 -4.222 -10.603 -3.430 1.00 0.00 H new ATOM 1094 N PRO D 42 -0.621 -10.865 3.519 1.00 0.00 N ATOM 1095 CA PRO D 42 -0.432 -11.538 4.747 1.00 0.00 C ATOM 1096 C PRO D 42 -0.051 -12.919 4.411 1.00 0.00 C ATOM 1097 O PRO D 42 -0.445 -13.953 4.949 1.00 0.00 O ATOM 1098 CB PRO D 42 -1.751 -11.126 5.318 1.00 0.00 C ATOM 1099 CG PRO D 42 -1.730 -9.614 4.972 1.00 0.00 C ATOM 1100 CD PRO D 42 -0.689 -9.469 3.875 1.00 0.00 C ATOM 0 HA PRO D 42 0.348 -11.346 5.484 1.00 0.00 H new ATOM 0 HB2 PRO D 42 -2.588 -11.649 4.855 1.00 0.00 H new ATOM 0 HB3 PRO D 42 -1.816 -11.308 6.391 1.00 0.00 H new ATOM 0 HG2 PRO D 42 -2.709 -9.274 4.633 1.00 0.00 H new ATOM 0 HG3 PRO D 42 -1.469 -9.014 5.844 1.00 0.00 H new ATOM 0 HD2 PRO D 42 -1.015 -8.831 3.054 1.00 0.00 H new ATOM 0 HD3 PRO D 42 0.260 -9.069 4.232 1.00 0.00 H new ATOM 1108 N SER D 43 0.831 -12.762 3.460 1.00 0.00 N ATOM 1109 CA SER D 43 1.577 -13.744 2.784 1.00 0.00 C ATOM 1110 C SER D 43 2.955 -13.232 2.947 1.00 0.00 C ATOM 1111 O SER D 43 3.826 -13.397 2.098 1.00 0.00 O ATOM 1112 CB SER D 43 1.245 -13.728 1.311 1.00 0.00 C ATOM 1113 OG SER D 43 0.189 -14.639 1.038 1.00 0.00 O ATOM 0 H SER D 43 1.056 -11.829 3.115 1.00 0.00 H new ATOM 0 HA SER D 43 1.403 -14.755 3.153 1.00 0.00 H new ATOM 0 HB2 SER D 43 0.956 -12.722 1.006 1.00 0.00 H new ATOM 0 HB3 SER D 43 2.127 -13.996 0.729 1.00 0.00 H new ATOM 0 HG SER D 43 -0.660 -14.255 1.341 1.00 0.00 H new ATOM 1119 N LYS D 44 3.051 -12.509 4.049 1.00 0.00 N ATOM 1120 CA LYS D 44 4.213 -11.757 4.434 1.00 0.00 C ATOM 1121 C LYS D 44 5.450 -12.606 4.283 1.00 0.00 C ATOM 1122 O LYS D 44 5.875 -13.338 5.176 1.00 0.00 O ATOM 1123 CB LYS D 44 4.014 -11.430 5.913 1.00 0.00 C ATOM 1124 CG LYS D 44 2.588 -10.932 6.080 1.00 0.00 C ATOM 1125 CD LYS D 44 2.578 -9.622 6.830 1.00 0.00 C ATOM 1126 CE LYS D 44 3.304 -8.583 5.986 1.00 0.00 C ATOM 1127 NZ LYS D 44 4.660 -8.339 6.555 1.00 0.00 N ATOM 0 H LYS D 44 2.287 -12.432 4.720 1.00 0.00 H new ATOM 0 HA LYS D 44 4.334 -10.864 3.820 1.00 0.00 H new ATOM 0 HB2 LYS D 44 4.187 -12.313 6.528 1.00 0.00 H new ATOM 0 HB3 LYS D 44 4.726 -10.671 6.238 1.00 0.00 H new ATOM 0 HG2 LYS D 44 2.123 -10.803 5.103 1.00 0.00 H new ATOM 0 HG3 LYS D 44 1.997 -11.673 6.619 1.00 0.00 H new ATOM 0 HD2 LYS D 44 1.554 -9.304 7.026 1.00 0.00 H new ATOM 0 HD3 LYS D 44 3.067 -9.735 7.798 1.00 0.00 H new ATOM 0 HE2 LYS D 44 3.387 -8.930 4.956 1.00 0.00 H new ATOM 0 HE3 LYS D 44 2.734 -7.654 5.965 1.00 0.00 H new ATOM 0 HZ1 LYS D 44 5.329 -8.140 5.784 1.00 0.00 H new ATOM 0 HZ2 LYS D 44 4.624 -7.525 7.201 1.00 0.00 H new ATOM 0 HZ3 LYS D 44 4.974 -9.182 7.077 1.00 0.00 H new ATOM 1141 N PRO D 45 6.001 -12.490 3.098 1.00 0.00 N ATOM 1142 CA PRO D 45 7.223 -13.213 2.655 1.00 0.00 C ATOM 1143 C PRO D 45 8.466 -12.528 3.161 1.00 0.00 C ATOM 1144 O PRO D 45 9.284 -13.112 3.871 1.00 0.00 O ATOM 1145 CB PRO D 45 7.194 -13.101 1.124 1.00 0.00 C ATOM 1146 CG PRO D 45 5.972 -12.318 0.765 1.00 0.00 C ATOM 1147 CD PRO D 45 5.494 -11.620 2.026 1.00 0.00 C ATOM 0 HA PRO D 45 7.239 -14.239 3.023 1.00 0.00 H new ATOM 0 HB2 PRO D 45 8.092 -12.604 0.757 1.00 0.00 H new ATOM 0 HB3 PRO D 45 7.167 -14.090 0.666 1.00 0.00 H new ATOM 0 HG2 PRO D 45 6.198 -11.590 -0.015 1.00 0.00 H new ATOM 0 HG3 PRO D 45 5.196 -12.975 0.373 1.00 0.00 H new ATOM 0 HD2 PRO D 45 5.894 -10.609 2.104 1.00 0.00 H new ATOM 0 HD3 PRO D 45 4.408 -11.536 2.054 1.00 0.00 H new ATOM 1155 N LYS D 46 8.574 -11.260 2.801 1.00 0.00 N ATOM 1156 CA LYS D 46 9.689 -10.464 3.231 1.00 0.00 C ATOM 1157 C LYS D 46 9.234 -9.779 4.466 1.00 0.00 C ATOM 1158 O LYS D 46 9.980 -9.170 5.234 1.00 0.00 O ATOM 1159 CB LYS D 46 10.073 -9.480 2.146 1.00 0.00 C ATOM 1160 CG LYS D 46 9.160 -8.250 2.141 1.00 0.00 C ATOM 1161 CD LYS D 46 7.712 -8.653 1.870 1.00 0.00 C ATOM 1162 CE LYS D 46 7.603 -9.413 0.542 1.00 0.00 C ATOM 1163 NZ LYS D 46 8.427 -8.741 -0.501 1.00 0.00 N ATOM 0 H LYS D 46 7.900 -10.769 2.213 1.00 0.00 H new ATOM 0 HA LYS D 46 10.579 -11.062 3.428 1.00 0.00 H new ATOM 0 HB2 LYS D 46 11.106 -9.165 2.291 1.00 0.00 H new ATOM 0 HB3 LYS D 46 10.024 -9.973 1.175 1.00 0.00 H new ATOM 0 HG2 LYS D 46 9.226 -7.738 3.101 1.00 0.00 H new ATOM 0 HG3 LYS D 46 9.495 -7.545 1.380 1.00 0.00 H new ATOM 0 HD2 LYS D 46 7.344 -9.278 2.684 1.00 0.00 H new ATOM 0 HD3 LYS D 46 7.081 -7.765 1.840 1.00 0.00 H new ATOM 0 HE2 LYS D 46 7.938 -10.442 0.674 1.00 0.00 H new ATOM 0 HE3 LYS D 46 6.562 -9.455 0.223 1.00 0.00 H new ATOM 0 HZ1 LYS D 46 8.089 -9.020 -1.444 1.00 0.00 H new ATOM 0 HZ2 LYS D 46 8.346 -7.709 -0.396 1.00 0.00 H new ATOM 0 HZ3 LYS D 46 9.422 -9.023 -0.393 1.00 0.00 H new ATOM 1177 N THR D 47 7.957 -9.947 4.608 1.00 0.00 N ATOM 1178 CA THR D 47 7.202 -9.441 5.704 1.00 0.00 C ATOM 1179 C THR D 47 7.447 -7.985 5.871 1.00 0.00 C ATOM 1180 O THR D 47 7.703 -7.474 6.961 1.00 0.00 O ATOM 1181 CB THR D 47 7.513 -10.243 6.935 1.00 0.00 C ATOM 1182 OG1 THR D 47 8.859 -10.017 7.335 1.00 0.00 O ATOM 1183 CG2 THR D 47 7.299 -11.715 6.581 1.00 0.00 C ATOM 0 H THR D 47 7.391 -10.462 3.934 1.00 0.00 H new ATOM 0 HA THR D 47 6.134 -9.548 5.512 1.00 0.00 H new ATOM 0 HB THR D 47 6.868 -9.953 7.764 1.00 0.00 H new ATOM 0 HG1 THR D 47 9.270 -9.355 6.741 1.00 0.00 H new ATOM 0 HG21 THR D 47 7.515 -12.334 7.452 1.00 0.00 H new ATOM 0 HG22 THR D 47 6.264 -11.869 6.274 1.00 0.00 H new ATOM 0 HG23 THR D 47 7.965 -11.993 5.764 1.00 0.00 H new ATOM 1191 N ASN D 48 7.315 -7.349 4.737 1.00 0.00 N ATOM 1192 CA ASN D 48 7.460 -5.920 4.620 1.00 0.00 C ATOM 1193 C ASN D 48 7.694 -5.294 5.987 1.00 0.00 C ATOM 1194 O ASN D 48 6.722 -4.966 6.638 1.00 0.00 O ATOM 1195 CB ASN D 48 6.182 -5.365 4.003 1.00 0.00 C ATOM 1196 CG ASN D 48 5.538 -6.420 3.111 1.00 0.00 C ATOM 1197 OD1 ASN D 48 5.126 -7.542 3.637 1.00 0.00 O flip ATOM 1198 ND2 ASN D 48 5.404 -6.219 1.905 1.00 0.00 N flip ATOM 1199 OXT ASN D 48 8.844 -5.167 6.368 1.00 0.00 O ATOM 0 H ASN D 48 7.101 -7.815 3.855 1.00 0.00 H new ATOM 0 HA ASN D 48 8.319 -5.684 3.992 1.00 0.00 H new ATOM 0 HB2 ASN D 48 5.488 -5.067 4.789 1.00 0.00 H new ATOM 0 HB3 ASN D 48 6.407 -4.471 3.421 1.00 0.00 H new ATOM 0 HD21 ASN D 48 5.726 -5.342 1.495 1.00 0.00 H new ATOM 0 HD22 ASN D 48 4.971 -6.929 1.315 1.00 0.00 H new TER 1206 ASN D 48