USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 913 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 16 THR OG1 : rot -160:sc= -0.0897 USER MOD Set 1.2: A 29 ASN : amide:sc= -7.94! C(o=-8.6!,f=-10!) USER MOD Set 1.3: C 125 DT C7 :methyl 150:sc= -0.579 (180deg=-0.544) USER MOD Set 2.1: A 12 THR OG1 : rot -114:sc= 0.0126 USER MOD Set 2.2: A 14 THR OG1 : rot 14:sc= 0.919 USER MOD Single : A 1 LYS N :NH3+ -126:sc=-0.00708 (180deg=-0.288) USER MOD Single : A 1 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.117) USER MOD Single : A 5 THR OG1 : rot -165:sc= -0.178! USER MOD Single : A 8 SER OG : rot 78:sc= 1.19 USER MOD Single : A 9 ASN : amide:sc= -3.11! C(o=-3.1!,f=-4.9!) USER MOD Single : A 11 GLN : amide:sc= -0.054 K(o=-0.054,f=-2.1!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -135:sc= 1.08 USER MOD Single : A 21 SER OG : rot 122:sc= -0.205 USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ -120:sc= -4.18! (180deg=-7.44!) USER MOD Single : A 38 HIS : no HE2:sc= -5.54! C(o=-5.5!,f=-8.5!) USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 41 ASN : amide:sc= -1.4 K(o=-1.4,f=-6.3!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 150:sc= -1.05 (180deg=-3.98!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -2.58! C(o=-2.6!,f=-3.5!) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.335 USER MOD Single : A 55 ASN : amide:sc= -1.96 K(o=-2,f=-7!) USER MOD Single : A 57 LYS NZ :NH3+ 170:sc= 1.12 (180deg=0.698!) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot -73:sc= 0.0248 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ -163:sc= -0.112 (180deg=-0.836) USER MOD Single : A 64 LYS NZ :NH3+ 154:sc= -0.154 (180deg=-0.926) USER MOD Single : B 101 DG O5' : rot 180:sc= -0.391 USER MOD Single : B 102 DT C7 :methyl -30:sc= -1.36 (180deg=-1.91!) USER MOD Single : B 103 DT C7 :methyl -30:sc= -1.69 (180deg=-2.21!) USER MOD Single : B 109 DT C7 :methyl 150:sc= -2.66! (180deg=-2.66!) USER MOD Single : B 115 DT C7 :methyl -30:sc= -1.29 (180deg=-2.14!) USER MOD Single : B 116 DT C7 :methyl 150:sc= -0.706 (180deg=-0.706) USER MOD Single : B 116 DT O3' : rot 180:sc= 0 USER MOD Single : C 117 DA O5' : rot 79:sc= -2.16! USER MOD Single : C 119 DT C7 :methyl -30:sc= -1.43! (180deg=-1.59!) USER MOD Single : C 121 DT C7 :methyl -30:sc= -1.15 (180deg=-1.16) USER MOD Single : C 122 DT C7 :methyl 150:sc= -1.07 (180deg=-1.07) USER MOD Single : C 123 DT C7 :methyl -30:sc= -1.41 (180deg=-5.09!) USER MOD Single : C 127 DT C7 :methyl -30:sc= -1.3 (180deg=-1.59!) USER MOD Single : C 132 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG B 101 18.958 22.056 9.004 1.00 0.00 O ATOM 2 C5' DG B 101 19.473 21.593 10.255 1.00 0.00 C ATOM 3 C4' DG B 101 18.433 20.773 11.022 1.00 0.00 C ATOM 4 O4' DG B 101 17.375 21.642 11.488 1.00 0.00 O ATOM 5 C3' DG B 101 17.801 19.681 10.151 1.00 0.00 C ATOM 6 O3' DG B 101 17.876 18.412 10.810 1.00 0.00 O ATOM 7 C2' DG B 101 16.356 20.090 9.971 1.00 0.00 C ATOM 8 C1' DG B 101 16.117 21.299 10.866 1.00 0.00 C ATOM 9 N9 DG B 101 15.589 22.442 10.089 1.00 0.00 N ATOM 10 C8 DG B 101 16.050 22.984 8.922 1.00 0.00 C ATOM 11 N7 DG B 101 15.366 23.995 8.474 1.00 0.00 N ATOM 12 C5 DG B 101 14.357 24.144 9.423 1.00 0.00 C ATOM 13 C6 DG B 101 13.294 25.086 9.483 1.00 0.00 C ATOM 14 O6 DG B 101 13.029 25.988 8.691 1.00 0.00 O ATOM 15 N1 DG B 101 12.501 24.889 10.606 1.00 0.00 N ATOM 16 C2 DG B 101 12.703 23.907 11.555 1.00 0.00 C ATOM 17 N2 DG B 101 11.833 23.873 12.563 1.00 0.00 N ATOM 18 N3 DG B 101 13.700 23.020 11.502 1.00 0.00 N ATOM 19 C4 DG B 101 14.486 23.196 10.414 1.00 0.00 C ATOM 0 H5' DG B 101 19.783 22.445 10.859 1.00 0.00 H new ATOM 0 H5'' DG B 101 20.361 20.985 10.081 1.00 0.00 H new ATOM 0 H4' DG B 101 18.951 20.299 11.856 1.00 0.00 H new ATOM 0 H3' DG B 101 18.316 19.580 9.196 1.00 0.00 H new ATOM 0 H2' DG B 101 16.153 20.336 8.929 1.00 0.00 H new ATOM 0 H2'' DG B 101 15.688 19.272 10.242 1.00 0.00 H new ATOM 0 HO5' DG B 101 19.646 22.577 8.540 1.00 0.00 H new ATOM 0 H1' DG B 101 15.372 21.059 11.624 1.00 0.00 H new ATOM 0 H8 DG B 101 16.920 22.600 8.409 1.00 0.00 H new ATOM 0 H1 DG B 101 11.709 25.518 10.740 1.00 0.00 H new ATOM 0 H21 DG B 101 11.929 23.170 13.296 1.00 0.00 H new ATOM 0 H22 DG B 101 11.071 24.550 12.602 1.00 0.00 H new ATOM 32 P DT B 102 17.228 17.096 10.145 1.00 0.00 P ATOM 33 OP1 DT B 102 17.929 15.910 10.688 1.00 0.00 O ATOM 34 OP2 DT B 102 17.153 17.301 8.681 1.00 0.00 O ATOM 35 O5' DT B 102 15.726 17.104 10.730 1.00 0.00 O ATOM 36 C5' DT B 102 15.504 17.017 12.140 1.00 0.00 C ATOM 37 C4' DT B 102 14.012 17.042 12.495 1.00 0.00 C ATOM 38 O4' DT B 102 13.444 18.355 12.265 1.00 0.00 O ATOM 39 C3' DT B 102 13.208 16.031 11.667 1.00 0.00 C ATOM 40 O3' DT B 102 12.571 15.083 12.524 1.00 0.00 O ATOM 41 C2' DT B 102 12.152 16.844 10.952 1.00 0.00 C ATOM 42 C1' DT B 102 12.182 18.235 11.573 1.00 0.00 C ATOM 43 N1 DT B 102 12.015 19.316 10.558 1.00 0.00 N ATOM 44 C2 DT B 102 10.954 20.203 10.709 1.00 0.00 C ATOM 45 O2 DT B 102 10.152 20.107 11.635 1.00 0.00 O ATOM 46 N3 DT B 102 10.853 21.202 9.758 1.00 0.00 N ATOM 47 C4 DT B 102 11.703 21.394 8.685 1.00 0.00 C ATOM 48 O4 DT B 102 11.524 22.324 7.905 1.00 0.00 O ATOM 49 C5 DT B 102 12.773 20.426 8.602 1.00 0.00 C ATOM 50 C7 DT B 102 13.770 20.525 7.442 1.00 0.00 C ATOM 51 C6 DT B 102 12.893 19.438 9.522 1.00 0.00 C ATOM 0 H5' DT B 102 16.008 17.846 12.637 1.00 0.00 H new ATOM 0 H5'' DT B 102 15.951 16.098 12.520 1.00 0.00 H new ATOM 0 H4' DT B 102 13.948 16.780 13.551 1.00 0.00 H new ATOM 0 H3' DT B 102 13.849 15.481 10.978 1.00 0.00 H new ATOM 0 H2' DT B 102 12.358 16.892 9.883 1.00 0.00 H new ATOM 0 H2'' DT B 102 11.168 16.389 11.067 1.00 0.00 H new ATOM 0 H1' DT B 102 11.344 18.354 12.260 1.00 0.00 H new ATOM 0 H3 DT B 102 10.079 21.859 9.858 1.00 0.00 H new ATOM 0 H71 DT B 102 13.274 20.954 6.571 1.00 0.00 H new ATOM 0 H72 DT B 102 14.605 21.162 7.734 1.00 0.00 H new ATOM 0 H73 DT B 102 14.141 19.530 7.195 1.00 0.00 H new ATOM 0 H6 DT B 102 13.704 18.730 9.432 1.00 0.00 H new ATOM 64 P DT B 103 11.658 13.905 11.918 1.00 0.00 P ATOM 65 OP1 DT B 103 11.620 12.796 12.899 1.00 0.00 O ATOM 66 OP2 DT B 103 12.084 13.651 10.525 1.00 0.00 O ATOM 67 O5' DT B 103 10.207 14.604 11.888 1.00 0.00 O ATOM 68 C5' DT B 103 9.624 15.067 13.105 1.00 0.00 C ATOM 69 C4' DT B 103 8.251 15.715 12.894 1.00 0.00 C ATOM 70 O4' DT B 103 8.384 16.992 12.226 1.00 0.00 O ATOM 71 C3' DT B 103 7.309 14.839 12.058 1.00 0.00 C ATOM 72 O3' DT B 103 6.161 14.506 12.826 1.00 0.00 O ATOM 73 C2' DT B 103 6.889 15.698 10.884 1.00 0.00 C ATOM 74 C1' DT B 103 7.401 17.106 11.176 1.00 0.00 C ATOM 75 N1 DT B 103 7.990 17.738 9.967 1.00 0.00 N ATOM 76 C2 DT B 103 7.439 18.926 9.505 1.00 0.00 C ATOM 77 O2 DT B 103 6.462 19.444 10.039 1.00 0.00 O ATOM 78 N3 DT B 103 8.053 19.490 8.405 1.00 0.00 N ATOM 79 C4 DT B 103 9.150 18.985 7.732 1.00 0.00 C ATOM 80 O4 DT B 103 9.615 19.574 6.760 1.00 0.00 O ATOM 81 C5 DT B 103 9.654 17.747 8.280 1.00 0.00 C ATOM 82 C7 DT B 103 10.871 17.085 7.624 1.00 0.00 C ATOM 83 C6 DT B 103 9.068 17.177 9.356 1.00 0.00 C ATOM 0 H5' DT B 103 10.294 15.789 13.572 1.00 0.00 H new ATOM 0 H5'' DT B 103 9.524 14.230 13.797 1.00 0.00 H new ATOM 0 H4' DT B 103 7.823 15.843 13.888 1.00 0.00 H new ATOM 0 H3' DT B 103 7.791 13.914 11.741 1.00 0.00 H new ATOM 0 H2' DT B 103 7.310 15.317 9.954 1.00 0.00 H new ATOM 0 H2'' DT B 103 5.805 15.695 10.768 1.00 0.00 H new ATOM 0 H1' DT B 103 6.575 17.747 11.484 1.00 0.00 H new ATOM 0 H3 DT B 103 7.659 20.363 8.055 1.00 0.00 H new ATOM 0 H71 DT B 103 10.885 17.322 6.560 1.00 0.00 H new ATOM 0 H72 DT B 103 11.783 17.457 8.091 1.00 0.00 H new ATOM 0 H73 DT B 103 10.812 16.004 7.754 1.00 0.00 H new ATOM 0 H6 DT B 103 9.467 16.250 9.742 1.00 0.00 H new ATOM 96 P DG B 104 5.079 13.441 12.304 1.00 0.00 P ATOM 97 OP1 DG B 104 4.376 12.880 13.478 1.00 0.00 O ATOM 98 OP2 DG B 104 5.747 12.536 11.342 1.00 0.00 O ATOM 99 O5' DG B 104 4.041 14.362 11.488 1.00 0.00 O ATOM 100 C5' DG B 104 3.343 15.417 12.147 1.00 0.00 C ATOM 101 C4' DG B 104 2.377 16.139 11.204 1.00 0.00 C ATOM 102 O4' DG B 104 3.117 16.898 10.217 1.00 0.00 O ATOM 103 C3' DG B 104 1.485 15.143 10.455 1.00 0.00 C ATOM 104 O3' DG B 104 0.117 15.541 10.542 1.00 0.00 O ATOM 105 C2' DG B 104 1.932 15.208 9.015 1.00 0.00 C ATOM 106 C1' DG B 104 2.778 16.466 8.877 1.00 0.00 C ATOM 107 N9 DG B 104 4.001 16.228 8.076 1.00 0.00 N ATOM 108 C8 DG B 104 4.926 15.225 8.170 1.00 0.00 C ATOM 109 N7 DG B 104 5.903 15.292 7.312 1.00 0.00 N ATOM 110 C5 DG B 104 5.607 16.439 6.575 1.00 0.00 C ATOM 111 C6 DG B 104 6.312 17.039 5.492 1.00 0.00 C ATOM 112 O6 DG B 104 7.359 16.670 4.958 1.00 0.00 O ATOM 113 N1 DG B 104 5.672 18.186 5.042 1.00 0.00 N ATOM 114 C2 DG B 104 4.500 18.697 5.562 1.00 0.00 C ATOM 115 N2 DG B 104 4.044 19.814 4.998 1.00 0.00 N ATOM 116 N3 DG B 104 3.835 18.136 6.578 1.00 0.00 N ATOM 117 C4 DG B 104 4.442 17.015 7.034 1.00 0.00 C ATOM 0 H5' DG B 104 4.061 16.132 12.548 1.00 0.00 H new ATOM 0 H5'' DG B 104 2.789 15.012 12.994 1.00 0.00 H new ATOM 0 H4' DG B 104 1.760 16.798 11.815 1.00 0.00 H new ATOM 0 H3' DG B 104 1.568 14.140 10.873 1.00 0.00 H new ATOM 0 H2' DG B 104 2.509 14.322 8.748 1.00 0.00 H new ATOM 0 H2'' DG B 104 1.074 15.243 8.344 1.00 0.00 H new ATOM 0 H1' DG B 104 2.216 17.235 8.347 1.00 0.00 H new ATOM 0 H8 DG B 104 4.851 14.435 8.903 1.00 0.00 H new ATOM 0 H1 DG B 104 6.102 18.690 4.266 1.00 0.00 H new ATOM 0 H21 DG B 104 3.182 20.241 5.337 1.00 0.00 H new ATOM 0 H22 DG B 104 4.557 20.242 4.227 1.00 0.00 H new ATOM 129 P DC B 105 -1.047 14.643 9.884 1.00 0.00 P ATOM 130 OP1 DC B 105 -2.308 14.931 10.603 1.00 0.00 O ATOM 131 OP2 DC B 105 -0.556 13.249 9.799 1.00 0.00 O ATOM 132 O5' DC B 105 -1.186 15.218 8.379 1.00 0.00 O ATOM 133 C5' DC B 105 -1.533 16.588 8.152 1.00 0.00 C ATOM 134 C4' DC B 105 -1.614 16.931 6.654 1.00 0.00 C ATOM 135 O4' DC B 105 -0.306 16.957 6.024 1.00 0.00 O ATOM 136 C3' DC B 105 -2.481 15.925 5.885 1.00 0.00 C ATOM 137 O3' DC B 105 -3.569 16.609 5.263 1.00 0.00 O ATOM 138 C2' DC B 105 -1.571 15.313 4.843 1.00 0.00 C ATOM 139 C1' DC B 105 -0.340 16.200 4.788 1.00 0.00 C ATOM 140 N1 DC B 105 0.914 15.418 4.612 1.00 0.00 N ATOM 141 C2 DC B 105 1.703 15.668 3.490 1.00 0.00 C ATOM 142 O2 DC B 105 1.319 16.461 2.633 1.00 0.00 O ATOM 143 N3 DC B 105 2.889 15.010 3.372 1.00 0.00 N ATOM 144 C4 DC B 105 3.290 14.144 4.312 1.00 0.00 C ATOM 145 N4 DC B 105 4.463 13.527 4.173 1.00 0.00 N ATOM 146 C5 DC B 105 2.482 13.883 5.462 1.00 0.00 C ATOM 147 C6 DC B 105 1.309 14.539 5.565 1.00 0.00 C ATOM 0 H5' DC B 105 -0.794 17.231 8.630 1.00 0.00 H new ATOM 0 H5'' DC B 105 -2.493 16.800 8.623 1.00 0.00 H new ATOM 0 H4' DC B 105 -2.062 17.924 6.610 1.00 0.00 H new ATOM 0 H3' DC B 105 -2.904 15.161 6.537 1.00 0.00 H new ATOM 0 H2' DC B 105 -1.303 14.291 5.111 1.00 0.00 H new ATOM 0 H2'' DC B 105 -2.064 15.269 3.872 1.00 0.00 H new ATOM 0 H1' DC B 105 -0.402 16.860 3.923 1.00 0.00 H new ATOM 0 H41 DC B 105 4.779 12.866 4.882 1.00 0.00 H new ATOM 0 H42 DC B 105 5.045 13.716 3.357 1.00 0.00 H new ATOM 0 H5 DC B 105 2.800 13.185 6.222 1.00 0.00 H new ATOM 0 H6 DC B 105 0.674 14.361 6.420 1.00 0.00 H new ATOM 159 P DA B 106 -4.660 15.824 4.381 1.00 0.00 P ATOM 160 OP1 DA B 106 -5.961 16.515 4.539 1.00 0.00 O ATOM 161 OP2 DA B 106 -4.552 14.380 4.690 1.00 0.00 O ATOM 162 O5' DA B 106 -4.147 16.058 2.868 1.00 0.00 O ATOM 163 C5' DA B 106 -4.034 17.388 2.347 1.00 0.00 C ATOM 164 C4' DA B 106 -3.530 17.409 0.895 1.00 0.00 C ATOM 165 O4' DA B 106 -2.131 17.040 0.808 1.00 0.00 O ATOM 166 C3' DA B 106 -4.330 16.450 0.009 1.00 0.00 C ATOM 167 O3' DA B 106 -4.930 17.156 -1.070 1.00 0.00 O ATOM 168 C2' DA B 106 -3.321 15.456 -0.535 1.00 0.00 C ATOM 169 C1' DA B 106 -1.942 15.996 -0.178 1.00 0.00 C ATOM 170 N9 DA B 106 -1.082 14.935 0.357 1.00 0.00 N ATOM 171 C8 DA B 106 -1.320 14.150 1.421 1.00 0.00 C ATOM 172 N7 DA B 106 -0.373 13.321 1.731 1.00 0.00 N ATOM 173 C5 DA B 106 0.592 13.576 0.759 1.00 0.00 C ATOM 174 C6 DA B 106 1.853 13.024 0.507 1.00 0.00 C ATOM 175 N6 DA B 106 2.380 12.049 1.248 1.00 0.00 N ATOM 176 N1 DA B 106 2.541 13.502 -0.541 1.00 0.00 N ATOM 177 C2 DA B 106 2.021 14.465 -1.302 1.00 0.00 C ATOM 178 N3 DA B 106 0.837 15.062 -1.150 1.00 0.00 N ATOM 179 C4 DA B 106 0.169 14.560 -0.090 1.00 0.00 C ATOM 0 H5' DA B 106 -3.353 17.964 2.973 1.00 0.00 H new ATOM 0 H5'' DA B 106 -5.006 17.879 2.398 1.00 0.00 H new ATOM 0 H4' DA B 106 -3.661 18.433 0.545 1.00 0.00 H new ATOM 0 H3' DA B 106 -5.128 15.963 0.570 1.00 0.00 H new ATOM 0 H2' DA B 106 -3.475 14.469 -0.099 1.00 0.00 H new ATOM 0 H2'' DA B 106 -3.427 15.348 -1.614 1.00 0.00 H new ATOM 0 H1' DA B 106 -1.449 16.388 -1.068 1.00 0.00 H new ATOM 0 H8 DA B 106 -2.241 14.206 1.982 1.00 0.00 H new ATOM 0 H61 DA B 106 3.304 11.680 1.023 1.00 0.00 H new ATOM 0 H62 DA B 106 1.859 11.672 2.040 1.00 0.00 H new ATOM 0 H2 DA B 106 2.624 14.799 -2.133 1.00 0.00 H new ATOM 191 P DG B 107 -5.823 16.367 -2.140 1.00 0.00 P ATOM 192 OP1 DG B 107 -6.758 17.327 -2.769 1.00 0.00 O ATOM 193 OP2 DG B 107 -6.338 15.134 -1.505 1.00 0.00 O ATOM 194 O5' DG B 107 -4.709 15.961 -3.222 1.00 0.00 O ATOM 195 C5' DG B 107 -3.961 16.976 -3.887 1.00 0.00 C ATOM 196 C4' DG B 107 -2.945 16.384 -4.862 1.00 0.00 C ATOM 197 O4' DG B 107 -1.847 15.735 -4.170 1.00 0.00 O ATOM 198 C3' DG B 107 -3.590 15.350 -5.787 1.00 0.00 C ATOM 199 O3' DG B 107 -3.459 15.765 -7.149 1.00 0.00 O ATOM 200 C2' DG B 107 -2.829 14.067 -5.541 1.00 0.00 C ATOM 201 C1' DG B 107 -1.569 14.462 -4.794 1.00 0.00 C ATOM 202 N9 DG B 107 -1.157 13.444 -3.799 1.00 0.00 N ATOM 203 C8 DG B 107 -1.828 12.970 -2.698 1.00 0.00 C ATOM 204 N7 DG B 107 -1.190 12.099 -2.004 1.00 0.00 N ATOM 205 C5 DG B 107 0.012 11.958 -2.669 1.00 0.00 C ATOM 206 C6 DG B 107 1.111 11.130 -2.354 1.00 0.00 C ATOM 207 O6 DG B 107 1.225 10.358 -1.409 1.00 0.00 O ATOM 208 N1 DG B 107 2.138 11.270 -3.270 1.00 0.00 N ATOM 209 C2 DG B 107 2.115 12.110 -4.363 1.00 0.00 C ATOM 210 N2 DG B 107 3.212 12.105 -5.127 1.00 0.00 N ATOM 211 N3 DG B 107 1.071 12.902 -4.669 1.00 0.00 N ATOM 212 C4 DG B 107 0.055 12.772 -3.775 1.00 0.00 C ATOM 0 H5' DG B 107 -3.443 17.588 -3.149 1.00 0.00 H new ATOM 0 H5'' DG B 107 -4.642 17.635 -4.426 1.00 0.00 H new ATOM 0 H4' DG B 107 -2.568 17.224 -5.445 1.00 0.00 H new ATOM 0 H3' DG B 107 -4.655 15.227 -5.593 1.00 0.00 H new ATOM 0 H2' DG B 107 -3.425 13.366 -4.956 1.00 0.00 H new ATOM 0 H2'' DG B 107 -2.586 13.572 -6.481 1.00 0.00 H new ATOM 0 H1' DG B 107 -0.728 14.537 -5.484 1.00 0.00 H new ATOM 0 H8 DG B 107 -2.820 13.306 -2.435 1.00 0.00 H new ATOM 0 H1 DG B 107 2.977 10.708 -3.126 1.00 0.00 H new ATOM 0 H21 DG B 107 3.262 12.703 -5.952 1.00 0.00 H new ATOM 0 H22 DG B 107 3.999 11.503 -4.885 1.00 0.00 H new ATOM 224 P DA B 108 -4.047 14.872 -8.348 1.00 0.00 P ATOM 225 OP1 DA B 108 -4.523 15.786 -9.410 1.00 0.00 O ATOM 226 OP2 DA B 108 -4.970 13.870 -7.769 1.00 0.00 O ATOM 227 O5' DA B 108 -2.737 14.102 -8.894 1.00 0.00 O ATOM 228 C5' DA B 108 -1.634 14.867 -9.395 1.00 0.00 C ATOM 229 C4' DA B 108 -0.465 13.994 -9.877 1.00 0.00 C ATOM 230 O4' DA B 108 0.214 13.361 -8.760 1.00 0.00 O ATOM 231 C3' DA B 108 -0.924 12.883 -10.832 1.00 0.00 C ATOM 232 O3' DA B 108 -0.178 12.939 -12.056 1.00 0.00 O ATOM 233 C2' DA B 108 -0.657 11.588 -10.102 1.00 0.00 C ATOM 234 C1' DA B 108 0.283 11.928 -8.960 1.00 0.00 C ATOM 235 N9 DA B 108 -0.074 11.205 -7.720 1.00 0.00 N ATOM 236 C8 DA B 108 -1.258 11.198 -7.039 1.00 0.00 C ATOM 237 N7 DA B 108 -1.246 10.553 -5.915 1.00 0.00 N ATOM 238 C5 DA B 108 0.061 10.083 -5.838 1.00 0.00 C ATOM 239 C6 DA B 108 0.729 9.321 -4.880 1.00 0.00 C ATOM 240 N6 DA B 108 0.169 8.955 -3.737 1.00 0.00 N ATOM 241 N1 DA B 108 2.014 9.016 -5.108 1.00 0.00 N ATOM 242 C2 DA B 108 2.617 9.444 -6.211 1.00 0.00 C ATOM 243 N3 DA B 108 2.081 10.182 -7.186 1.00 0.00 N ATOM 244 C4 DA B 108 0.783 10.466 -6.930 1.00 0.00 C ATOM 0 H5' DA B 108 -1.280 15.538 -8.613 1.00 0.00 H new ATOM 0 H5'' DA B 108 -1.977 15.492 -10.220 1.00 0.00 H new ATOM 0 H4' DA B 108 0.211 14.669 -10.403 1.00 0.00 H new ATOM 0 H3' DA B 108 -1.976 12.983 -11.098 1.00 0.00 H new ATOM 0 H2' DA B 108 -1.584 11.155 -9.726 1.00 0.00 H new ATOM 0 H2'' DA B 108 -0.208 10.851 -10.769 1.00 0.00 H new ATOM 0 H1' DA B 108 1.298 11.619 -9.210 1.00 0.00 H new ATOM 0 H8 DA B 108 -2.142 11.695 -7.411 1.00 0.00 H new ATOM 0 H61 DA B 108 0.697 8.397 -3.066 1.00 0.00 H new ATOM 0 H62 DA B 108 -0.790 9.231 -3.528 1.00 0.00 H new ATOM 0 H2 DA B 108 3.653 9.165 -6.333 1.00 0.00 H new ATOM 256 P DT B 109 -0.446 11.888 -13.250 1.00 0.00 P ATOM 257 OP1 DT B 109 -0.244 12.585 -14.541 1.00 0.00 O ATOM 258 OP2 DT B 109 -1.726 11.198 -12.977 1.00 0.00 O ATOM 259 O5' DT B 109 0.754 10.825 -13.053 1.00 0.00 O ATOM 260 C5' DT B 109 2.108 11.289 -13.138 1.00 0.00 C ATOM 261 C4' DT B 109 3.151 10.182 -12.928 1.00 0.00 C ATOM 262 O4' DT B 109 3.150 9.724 -11.553 1.00 0.00 O ATOM 263 C3' DT B 109 2.917 8.968 -13.837 1.00 0.00 C ATOM 264 O3' DT B 109 4.058 8.769 -14.671 1.00 0.00 O ATOM 265 C2' DT B 109 2.750 7.789 -12.910 1.00 0.00 C ATOM 266 C1' DT B 109 3.062 8.286 -11.505 1.00 0.00 C ATOM 267 N1 DT B 109 2.019 7.857 -10.541 1.00 0.00 N ATOM 268 C2 DT B 109 2.394 7.063 -9.466 1.00 0.00 C ATOM 269 O2 DT B 109 3.551 6.685 -9.302 1.00 0.00 O ATOM 270 N3 DT B 109 1.387 6.727 -8.584 1.00 0.00 N ATOM 271 C4 DT B 109 0.065 7.113 -8.673 1.00 0.00 C ATOM 272 O4 DT B 109 -0.745 6.765 -7.824 1.00 0.00 O ATOM 273 C5 DT B 109 -0.234 7.936 -9.818 1.00 0.00 C ATOM 274 C7 DT B 109 -1.670 8.436 -10.013 1.00 0.00 C ATOM 275 C6 DT B 109 0.733 8.272 -10.699 1.00 0.00 C ATOM 0 H5' DT B 109 2.263 12.069 -12.393 1.00 0.00 H new ATOM 0 H5'' DT B 109 2.266 11.745 -14.115 1.00 0.00 H new ATOM 0 H4' DT B 109 4.113 10.628 -13.182 1.00 0.00 H new ATOM 0 H3' DT B 109 2.047 9.102 -14.480 1.00 0.00 H new ATOM 0 H2' DT B 109 1.735 7.395 -12.964 1.00 0.00 H new ATOM 0 H2'' DT B 109 3.422 6.978 -13.191 1.00 0.00 H new ATOM 0 H1' DT B 109 4.006 7.860 -11.164 1.00 0.00 H new ATOM 0 H3 DT B 109 1.644 6.138 -7.792 1.00 0.00 H new ATOM 0 H71 DT B 109 -1.654 9.396 -10.530 1.00 0.00 H new ATOM 0 H72 DT B 109 -2.229 7.713 -10.607 1.00 0.00 H new ATOM 0 H73 DT B 109 -2.149 8.555 -9.041 1.00 0.00 H new ATOM 0 H6 DT B 109 0.479 8.886 -11.551 1.00 0.00 H new ATOM 288 P DA B 110 4.068 7.681 -15.858 1.00 0.00 P ATOM 289 OP1 DA B 110 5.152 8.033 -16.802 1.00 0.00 O ATOM 290 OP2 DA B 110 2.683 7.517 -16.351 1.00 0.00 O ATOM 291 O5' DA B 110 4.491 6.335 -15.087 1.00 0.00 O ATOM 292 C5' DA B 110 5.742 6.272 -14.405 1.00 0.00 C ATOM 293 C4' DA B 110 5.964 4.916 -13.732 1.00 0.00 C ATOM 294 O4' DA B 110 5.011 4.742 -12.651 1.00 0.00 O ATOM 295 C3' DA B 110 5.762 3.749 -14.699 1.00 0.00 C ATOM 296 O3' DA B 110 6.828 2.812 -14.525 1.00 0.00 O ATOM 297 C2' DA B 110 4.445 3.123 -14.321 1.00 0.00 C ATOM 298 C1' DA B 110 4.102 3.643 -12.931 1.00 0.00 C ATOM 299 N9 DA B 110 2.686 4.084 -12.849 1.00 0.00 N ATOM 300 C8 DA B 110 1.979 4.894 -13.693 1.00 0.00 C ATOM 301 N7 DA B 110 0.737 5.088 -13.362 1.00 0.00 N ATOM 302 C5 DA B 110 0.598 4.343 -12.194 1.00 0.00 C ATOM 303 C6 DA B 110 -0.484 4.127 -11.330 1.00 0.00 C ATOM 304 N6 DA B 110 -1.684 4.677 -11.512 1.00 0.00 N ATOM 305 N1 DA B 110 -0.279 3.337 -10.263 1.00 0.00 N ATOM 306 C2 DA B 110 0.920 2.793 -10.056 1.00 0.00 C ATOM 307 N3 DA B 110 2.011 2.930 -10.809 1.00 0.00 N ATOM 308 C4 DA B 110 1.776 3.727 -11.872 1.00 0.00 C ATOM 0 H5' DA B 110 5.785 7.060 -13.653 1.00 0.00 H new ATOM 0 H5'' DA B 110 6.550 6.462 -15.112 1.00 0.00 H new ATOM 0 H4' DA B 110 6.993 4.913 -13.371 1.00 0.00 H new ATOM 0 H3' DA B 110 5.759 4.068 -15.741 1.00 0.00 H new ATOM 0 H2' DA B 110 3.669 3.390 -15.038 1.00 0.00 H new ATOM 0 H2'' DA B 110 4.518 2.035 -14.321 1.00 0.00 H new ATOM 0 H1' DA B 110 4.216 2.851 -12.191 1.00 0.00 H new ATOM 0 H8 DA B 110 2.420 5.341 -14.572 1.00 0.00 H new ATOM 0 H61 DA B 110 -2.438 4.486 -10.852 1.00 0.00 H new ATOM 0 H62 DA B 110 -1.849 5.289 -12.311 1.00 0.00 H new ATOM 0 H2 DA B 110 1.019 2.171 -9.179 1.00 0.00 H new ATOM 320 P DA B 111 6.923 1.460 -15.389 1.00 0.00 P ATOM 321 OP1 DA B 111 8.351 1.103 -15.544 1.00 0.00 O ATOM 322 OP2 DA B 111 6.060 1.606 -16.582 1.00 0.00 O ATOM 323 O5' DA B 111 6.239 0.400 -14.390 1.00 0.00 O ATOM 324 C5' DA B 111 6.824 0.189 -13.103 1.00 0.00 C ATOM 325 C4' DA B 111 5.952 -0.676 -12.192 1.00 0.00 C ATOM 326 O4' DA B 111 4.685 -0.026 -11.938 1.00 0.00 O ATOM 327 C3' DA B 111 5.665 -2.054 -12.800 1.00 0.00 C ATOM 328 O3' DA B 111 6.168 -3.068 -11.934 1.00 0.00 O ATOM 329 C2' DA B 111 4.156 -2.154 -12.891 1.00 0.00 C ATOM 330 C1' DA B 111 3.595 -0.946 -12.152 1.00 0.00 C ATOM 331 N9 DA B 111 2.512 -0.306 -12.922 1.00 0.00 N ATOM 332 C8 DA B 111 2.544 0.217 -14.179 1.00 0.00 C ATOM 333 N7 DA B 111 1.430 0.753 -14.583 1.00 0.00 N ATOM 334 C5 DA B 111 0.580 0.566 -13.495 1.00 0.00 C ATOM 335 C6 DA B 111 -0.759 0.905 -13.266 1.00 0.00 C ATOM 336 N6 DA B 111 -1.513 1.547 -14.158 1.00 0.00 N ATOM 337 N1 DA B 111 -1.286 0.565 -12.078 1.00 0.00 N ATOM 338 C2 DA B 111 -0.544 -0.069 -11.169 1.00 0.00 C ATOM 339 N3 DA B 111 0.727 -0.431 -11.284 1.00 0.00 N ATOM 340 C4 DA B 111 1.230 -0.080 -12.482 1.00 0.00 C ATOM 0 H5' DA B 111 6.997 1.153 -12.625 1.00 0.00 H new ATOM 0 H5'' DA B 111 7.798 -0.286 -13.225 1.00 0.00 H new ATOM 0 H4' DA B 111 6.511 -0.808 -11.266 1.00 0.00 H new ATOM 0 H3' DA B 111 6.136 -2.179 -13.775 1.00 0.00 H new ATOM 0 H2' DA B 111 3.830 -2.158 -13.931 1.00 0.00 H new ATOM 0 H2'' DA B 111 3.801 -3.082 -12.442 1.00 0.00 H new ATOM 0 H1' DA B 111 3.163 -1.255 -11.200 1.00 0.00 H new ATOM 0 H8 DA B 111 3.430 0.189 -14.796 1.00 0.00 H new ATOM 0 H61 DA B 111 -2.484 1.769 -13.939 1.00 0.00 H new ATOM 0 H62 DA B 111 -1.119 1.816 -15.060 1.00 0.00 H new ATOM 0 H2 DA B 111 -1.031 -0.315 -10.237 1.00 0.00 H new ATOM 352 P DA B 112 6.057 -4.627 -12.308 1.00 0.00 P ATOM 353 OP1 DA B 112 7.110 -5.358 -11.566 1.00 0.00 O ATOM 354 OP2 DA B 112 5.970 -4.746 -13.780 1.00 0.00 O ATOM 355 O5' DA B 112 4.631 -5.017 -11.677 1.00 0.00 O ATOM 356 C5' DA B 112 4.419 -4.859 -10.278 1.00 0.00 C ATOM 357 C4' DA B 112 2.978 -5.165 -9.864 1.00 0.00 C ATOM 358 O4' DA B 112 2.070 -4.186 -10.446 1.00 0.00 O ATOM 359 C3' DA B 112 2.514 -6.549 -10.326 1.00 0.00 C ATOM 360 O3' DA B 112 1.992 -7.255 -9.196 1.00 0.00 O ATOM 361 C2' DA B 112 1.440 -6.306 -11.350 1.00 0.00 C ATOM 362 C1' DA B 112 1.022 -4.856 -11.191 1.00 0.00 C ATOM 363 N9 DA B 112 0.779 -4.218 -12.504 1.00 0.00 N ATOM 364 C8 DA B 112 1.576 -4.185 -13.614 1.00 0.00 C ATOM 365 N7 DA B 112 1.087 -3.536 -14.627 1.00 0.00 N ATOM 366 C5 DA B 112 -0.148 -3.100 -14.155 1.00 0.00 C ATOM 367 C6 DA B 112 -1.176 -2.354 -14.743 1.00 0.00 C ATOM 368 N6 DA B 112 -1.121 -1.900 -15.995 1.00 0.00 N ATOM 369 N1 DA B 112 -2.264 -2.104 -13.997 1.00 0.00 N ATOM 370 C2 DA B 112 -2.339 -2.559 -12.747 1.00 0.00 C ATOM 371 N3 DA B 112 -1.424 -3.272 -12.095 1.00 0.00 N ATOM 372 C4 DA B 112 -0.345 -3.507 -12.866 1.00 0.00 C ATOM 0 H5' DA B 112 4.667 -3.838 -9.990 1.00 0.00 H new ATOM 0 H5'' DA B 112 5.097 -5.517 -9.735 1.00 0.00 H new ATOM 0 H4' DA B 112 2.961 -5.129 -8.775 1.00 0.00 H new ATOM 0 H3' DA B 112 3.321 -7.144 -10.753 1.00 0.00 H new ATOM 0 H2' DA B 112 1.812 -6.495 -12.357 1.00 0.00 H new ATOM 0 H2'' DA B 112 0.594 -6.974 -11.192 1.00 0.00 H new ATOM 0 H1' DA B 112 0.078 -4.785 -10.650 1.00 0.00 H new ATOM 0 H8 DA B 112 2.543 -4.664 -13.646 1.00 0.00 H new ATOM 0 H61 DA B 112 -1.898 -1.360 -16.376 1.00 0.00 H new ATOM 0 H62 DA B 112 -0.302 -2.092 -16.572 1.00 0.00 H new ATOM 0 H2 DA B 112 -3.242 -2.323 -12.203 1.00 0.00 H new ATOM 384 P DC B 113 1.410 -8.749 -9.302 1.00 0.00 P ATOM 385 OP1 DC B 113 1.732 -9.458 -8.042 1.00 0.00 O ATOM 386 OP2 DC B 113 1.833 -9.323 -10.599 1.00 0.00 O ATOM 387 O5' DC B 113 -0.184 -8.510 -9.354 1.00 0.00 O ATOM 388 C5' DC B 113 -0.832 -7.848 -8.259 1.00 0.00 C ATOM 389 C4' DC B 113 -2.346 -7.702 -8.466 1.00 0.00 C ATOM 390 O4' DC B 113 -2.645 -6.733 -9.502 1.00 0.00 O ATOM 391 C3' DC B 113 -2.995 -9.033 -8.866 1.00 0.00 C ATOM 392 O3' DC B 113 -4.048 -9.356 -7.954 1.00 0.00 O ATOM 393 C2' DC B 113 -3.557 -8.814 -10.250 1.00 0.00 C ATOM 394 C1' DC B 113 -3.516 -7.314 -10.504 1.00 0.00 C ATOM 395 N1 DC B 113 -3.024 -6.976 -11.868 1.00 0.00 N ATOM 396 C2 DC B 113 -3.830 -6.186 -12.690 1.00 0.00 C ATOM 397 O2 DC B 113 -4.960 -5.868 -12.325 1.00 0.00 O ATOM 398 N3 DC B 113 -3.331 -5.783 -13.889 1.00 0.00 N ATOM 399 C4 DC B 113 -2.096 -6.130 -14.273 1.00 0.00 C ATOM 400 N4 DC B 113 -1.641 -5.707 -15.452 1.00 0.00 N ATOM 401 C5 DC B 113 -1.266 -6.943 -13.433 1.00 0.00 C ATOM 402 C6 DC B 113 -1.778 -7.344 -12.252 1.00 0.00 C ATOM 0 H5' DC B 113 -0.391 -6.860 -8.125 1.00 0.00 H new ATOM 0 H5'' DC B 113 -0.647 -8.407 -7.342 1.00 0.00 H new ATOM 0 H4' DC B 113 -2.751 -7.368 -7.511 1.00 0.00 H new ATOM 0 H3' DC B 113 -2.279 -9.855 -8.847 1.00 0.00 H new ATOM 0 H2' DC B 113 -2.969 -9.349 -10.996 1.00 0.00 H new ATOM 0 H2'' DC B 113 -4.578 -9.191 -10.318 1.00 0.00 H new ATOM 0 H1' DC B 113 -4.528 -6.914 -10.439 1.00 0.00 H new ATOM 0 H41 DC B 113 -0.702 -5.963 -15.758 1.00 0.00 H new ATOM 0 H42 DC B 113 -2.231 -5.127 -16.048 1.00 0.00 H new ATOM 0 H5 DC B 113 -0.268 -7.224 -13.735 1.00 0.00 H new ATOM 0 H6 DC B 113 -1.185 -7.969 -11.601 1.00 0.00 H new ATOM 414 P DA B 114 -4.918 -10.703 -8.118 1.00 0.00 P ATOM 415 OP1 DA B 114 -5.472 -11.061 -6.793 1.00 0.00 O ATOM 416 OP2 DA B 114 -4.104 -11.688 -8.867 1.00 0.00 O ATOM 417 O5' DA B 114 -6.137 -10.227 -9.063 1.00 0.00 O ATOM 418 C5' DA B 114 -7.003 -9.179 -8.616 1.00 0.00 C ATOM 419 C4' DA B 114 -8.114 -8.837 -9.622 1.00 0.00 C ATOM 420 O4' DA B 114 -7.572 -8.167 -10.790 1.00 0.00 O ATOM 421 C3' DA B 114 -8.872 -10.077 -10.103 1.00 0.00 C ATOM 422 O3' DA B 114 -10.259 -9.959 -9.777 1.00 0.00 O ATOM 423 C2' DA B 114 -8.711 -10.105 -11.603 1.00 0.00 C ATOM 424 C1' DA B 114 -8.039 -8.805 -12.005 1.00 0.00 C ATOM 425 N9 DA B 114 -6.924 -9.049 -12.931 1.00 0.00 N ATOM 426 C8 DA B 114 -5.806 -9.769 -12.709 1.00 0.00 C ATOM 427 N7 DA B 114 -4.949 -9.787 -13.684 1.00 0.00 N ATOM 428 C5 DA B 114 -5.565 -9.001 -14.654 1.00 0.00 C ATOM 429 C6 DA B 114 -5.181 -8.615 -15.940 1.00 0.00 C ATOM 430 N6 DA B 114 -4.018 -8.971 -16.486 1.00 0.00 N ATOM 431 N1 DA B 114 -6.028 -7.836 -16.636 1.00 0.00 N ATOM 432 C2 DA B 114 -7.187 -7.457 -16.094 1.00 0.00 C ATOM 433 N3 DA B 114 -7.646 -7.764 -14.880 1.00 0.00 N ATOM 434 C4 DA B 114 -6.774 -8.547 -14.208 1.00 0.00 C ATOM 0 H5' DA B 114 -6.410 -8.285 -8.422 1.00 0.00 H new ATOM 0 H5'' DA B 114 -7.457 -9.472 -7.669 1.00 0.00 H new ATOM 0 H4' DA B 114 -8.803 -8.182 -9.089 1.00 0.00 H new ATOM 0 H3' DA B 114 -8.490 -10.984 -9.634 1.00 0.00 H new ATOM 0 H2' DA B 114 -8.109 -10.960 -11.910 1.00 0.00 H new ATOM 0 H2'' DA B 114 -9.680 -10.205 -12.092 1.00 0.00 H new ATOM 0 H1' DA B 114 -8.745 -8.160 -12.528 1.00 0.00 H new ATOM 0 H8 DA B 114 -5.635 -10.296 -11.782 1.00 0.00 H new ATOM 0 H61 DA B 114 -3.782 -8.664 -17.430 1.00 0.00 H new ATOM 0 H62 DA B 114 -3.364 -9.551 -15.960 1.00 0.00 H new ATOM 0 H2 DA B 114 -7.823 -6.834 -16.705 1.00 0.00 H new ATOM 446 P DT B 115 -11.300 -11.123 -10.166 1.00 0.00 P ATOM 447 OP1 DT B 115 -12.458 -11.036 -9.248 1.00 0.00 O ATOM 448 OP2 DT B 115 -10.552 -12.392 -10.298 1.00 0.00 O ATOM 449 O5' DT B 115 -11.784 -10.663 -11.634 1.00 0.00 O ATOM 450 C5' DT B 115 -12.428 -9.400 -11.820 1.00 0.00 C ATOM 451 C4' DT B 115 -12.778 -9.140 -13.291 1.00 0.00 C ATOM 452 O4' DT B 115 -11.574 -8.903 -14.059 1.00 0.00 O ATOM 453 C3' DT B 115 -13.522 -10.324 -13.927 1.00 0.00 C ATOM 454 O3' DT B 115 -14.811 -9.922 -14.393 1.00 0.00 O ATOM 455 C2' DT B 115 -12.673 -10.743 -15.111 1.00 0.00 C ATOM 456 C1' DT B 115 -11.599 -9.668 -15.281 1.00 0.00 C ATOM 457 N1 DT B 115 -10.258 -10.257 -15.573 1.00 0.00 N ATOM 458 C2 DT B 115 -9.614 -9.885 -16.747 1.00 0.00 C ATOM 459 O2 DT B 115 -10.114 -9.095 -17.544 1.00 0.00 O ATOM 460 N3 DT B 115 -8.373 -10.453 -16.969 1.00 0.00 N ATOM 461 C4 DT B 115 -7.726 -11.348 -16.137 1.00 0.00 C ATOM 462 O4 DT B 115 -6.617 -11.789 -16.434 1.00 0.00 O ATOM 463 C5 DT B 115 -8.465 -11.681 -14.943 1.00 0.00 C ATOM 464 C7 DT B 115 -7.864 -12.684 -13.950 1.00 0.00 C ATOM 465 C6 DT B 115 -9.680 -11.134 -14.703 1.00 0.00 C ATOM 0 H5' DT B 115 -11.777 -8.605 -11.457 1.00 0.00 H new ATOM 0 H5'' DT B 115 -13.337 -9.366 -11.220 1.00 0.00 H new ATOM 0 H4' DT B 115 -13.427 -8.264 -13.307 1.00 0.00 H new ATOM 0 H3' DT B 115 -13.669 -11.129 -13.207 1.00 0.00 H new ATOM 0 H2' DT B 115 -12.220 -11.719 -14.937 1.00 0.00 H new ATOM 0 H2'' DT B 115 -13.280 -10.830 -16.012 1.00 0.00 H new ATOM 0 H1' DT B 115 -11.837 -9.034 -16.135 1.00 0.00 H new ATOM 0 H3 DT B 115 -7.890 -10.187 -17.827 1.00 0.00 H new ATOM 0 H71 DT B 115 -7.236 -13.396 -14.487 1.00 0.00 H new ATOM 0 H72 DT B 115 -7.261 -12.151 -13.215 1.00 0.00 H new ATOM 0 H73 DT B 115 -8.667 -13.219 -13.442 1.00 0.00 H new ATOM 0 H6 DT B 115 -10.206 -11.399 -13.798 1.00 0.00 H new ATOM 478 P DT B 116 -15.868 -11.015 -14.927 1.00 0.00 P ATOM 479 OP1 DT B 116 -17.227 -10.449 -14.785 1.00 0.00 O ATOM 480 OP2 DT B 116 -15.541 -12.317 -14.302 1.00 0.00 O ATOM 481 O5' DT B 116 -15.520 -11.105 -16.498 1.00 0.00 O ATOM 482 C5' DT B 116 -15.624 -9.946 -17.325 1.00 0.00 C ATOM 483 C4' DT B 116 -15.039 -10.186 -18.722 1.00 0.00 C ATOM 484 O4' DT B 116 -13.606 -10.375 -18.647 1.00 0.00 O ATOM 485 C3' DT B 116 -15.642 -11.423 -19.403 1.00 0.00 C ATOM 486 O3' DT B 116 -16.415 -11.038 -20.544 1.00 0.00 O ATOM 487 C2' DT B 116 -14.465 -12.278 -19.825 1.00 0.00 C ATOM 488 C1' DT B 116 -13.202 -11.503 -19.454 1.00 0.00 C ATOM 489 N1 DT B 116 -12.237 -12.364 -18.718 1.00 0.00 N ATOM 490 C2 DT B 116 -10.970 -12.546 -19.256 1.00 0.00 C ATOM 491 O2 DT B 116 -10.640 -12.047 -20.329 1.00 0.00 O ATOM 492 N3 DT B 116 -10.099 -13.322 -18.516 1.00 0.00 N ATOM 493 C4 DT B 116 -10.374 -13.927 -17.304 1.00 0.00 C ATOM 494 O4 DT B 116 -9.514 -14.592 -16.729 1.00 0.00 O ATOM 495 C5 DT B 116 -11.717 -13.691 -16.820 1.00 0.00 C ATOM 496 C7 DT B 116 -12.160 -14.333 -15.501 1.00 0.00 C ATOM 497 C6 DT B 116 -12.587 -12.932 -17.526 1.00 0.00 C ATOM 0 H5' DT B 116 -15.103 -9.114 -16.851 1.00 0.00 H new ATOM 0 H5'' DT B 116 -16.671 -9.657 -17.415 1.00 0.00 H new ATOM 0 H4' DT B 116 -15.284 -9.302 -19.311 1.00 0.00 H new ATOM 0 H3' DT B 116 -16.310 -11.964 -18.732 1.00 0.00 H new ATOM 0 H2' DT B 116 -14.488 -13.244 -19.321 1.00 0.00 H new ATOM 0 H2'' DT B 116 -14.496 -12.477 -20.896 1.00 0.00 H new ATOM 0 HO3' DT B 116 -16.792 -11.837 -20.969 1.00 0.00 H new ATOM 0 H1' DT B 116 -12.692 -11.163 -20.356 1.00 0.00 H new ATOM 0 H3 DT B 116 -9.165 -13.462 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0.00 H new ATOM 542 P DA C 118 -0.838 -10.539 -25.430 1.00 0.00 P ATOM 543 OP1 DA C 118 -0.194 -10.232 -26.728 1.00 0.00 O ATOM 544 OP2 DA C 118 -0.022 -10.562 -24.195 1.00 0.00 O ATOM 545 O5' DA C 118 -2.045 -9.492 -25.217 1.00 0.00 O ATOM 546 C5' DA C 118 -3.053 -9.356 -26.220 1.00 0.00 C ATOM 547 C4' DA C 118 -4.120 -8.316 -25.852 1.00 0.00 C ATOM 548 O4' DA C 118 -4.944 -8.808 -24.762 1.00 0.00 O ATOM 549 C3' DA C 118 -3.511 -6.978 -25.409 1.00 0.00 C ATOM 550 O3' DA C 118 -4.030 -5.912 -26.209 1.00 0.00 O ATOM 551 C2' DA C 118 -3.933 -6.783 -23.975 1.00 0.00 C ATOM 552 C1' DA C 118 -4.926 -7.885 -23.646 1.00 0.00 C ATOM 553 N9 DA C 118 -4.571 -8.575 -22.392 1.00 0.00 N ATOM 554 C8 DA C 118 -3.385 -9.126 -22.038 1.00 0.00 C ATOM 555 N7 DA C 118 -3.366 -9.709 -20.876 1.00 0.00 N ATOM 556 C5 DA C 118 -4.667 -9.522 -20.413 1.00 0.00 C ATOM 557 C6 DA C 118 -5.317 -9.901 -19.232 1.00 0.00 C ATOM 558 N6 DA C 118 -4.724 -10.599 -18.265 1.00 0.00 N ATOM 559 N1 DA C 118 -6.607 -9.550 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ATOM 0 H3 DT C 121 -4.505 -2.235 -14.217 1.00 0.00 H new ATOM 0 H71 DT C 121 -4.584 1.625 -16.873 1.00 0.00 H new ATOM 0 H72 DT C 121 -5.818 0.915 -17.942 1.00 0.00 H new ATOM 0 H73 DT C 121 -6.275 2.169 -16.765 1.00 0.00 H new ATOM 0 H6 DT C 121 -7.915 0.802 -15.705 1.00 0.00 H new ATOM 671 P DT C 122 -11.434 1.183 -10.966 1.00 0.00 P ATOM 672 OP1 DT C 122 -12.690 1.005 -10.204 1.00 0.00 O ATOM 673 OP2 DT C 122 -11.025 2.533 -11.412 1.00 0.00 O ATOM 674 O5' DT C 122 -10.233 0.549 -10.108 1.00 0.00 O ATOM 675 C5' DT C 122 -10.313 -0.799 -9.644 1.00 0.00 C ATOM 676 C4' DT C 122 -9.069 -1.197 -8.851 1.00 0.00 C ATOM 677 O4' DT C 122 -7.916 -1.334 -9.714 1.00 0.00 O ATOM 678 C3' DT C 122 -8.738 -0.158 -7.769 1.00 0.00 C ATOM 679 O3' DT C 122 -8.920 -0.701 -6.472 1.00 0.00 O ATOM 680 C2' DT C 122 -7.275 0.173 -7.967 1.00 0.00 C ATOM 681 C1' DT C 122 -6.771 -0.692 -9.115 1.00 0.00 C ATOM 682 N1 DT C 122 -6.037 0.125 -10.122 1.00 0.00 N ATOM 683 C2 DT C 122 -4.709 -0.189 -10.384 1.00 0.00 C ATOM 684 O2 DT C 122 -4.121 -1.088 -9.787 1.00 0.00 O ATOM 685 N3 DT C 122 -4.084 0.572 -11.355 1.00 0.00 N ATOM 686 C4 DT C 122 -4.657 1.599 -12.080 1.00 0.00 C ATOM 687 O4 DT C 122 -4.006 2.205 -12.929 1.00 0.00 O ATOM 688 C5 DT C 122 -6.039 1.859 -11.746 1.00 0.00 C ATOM 689 C7 DT C 122 -6.786 2.972 -12.490 1.00 0.00 C ATOM 690 C6 DT C 122 -6.674 1.131 -10.796 1.00 0.00 C ATOM 0 H5' DT C 122 -10.433 -1.470 -10.494 1.00 0.00 H new ATOM 0 H5'' DT C 122 -11.197 -0.917 -9.018 1.00 0.00 H new ATOM 0 H4' DT C 122 -9.295 -2.155 -8.383 1.00 0.00 H new ATOM 0 H3' DT C 122 -9.385 0.715 -7.852 1.00 0.00 H new ATOM 0 H2' DT C 122 -7.147 1.231 -8.197 1.00 0.00 H new ATOM 0 H2'' DT C 122 -6.709 -0.026 -7.057 1.00 0.00 H new ATOM 0 H1' DT C 122 -6.069 -1.437 -8.740 1.00 0.00 H new ATOM 0 H3 DT C 122 -3.108 0.354 -11.555 1.00 0.00 H new ATOM 0 H71 DT C 122 -7.846 2.723 -12.549 1.00 0.00 H new ATOM 0 H72 DT C 122 -6.664 3.913 -11.954 1.00 0.00 H new ATOM 0 H73 DT C 122 -6.381 3.072 -13.497 1.00 0.00 H new ATOM 0 H6 DT C 122 -7.706 1.350 -10.566 1.00 0.00 H new ATOM 703 P DT C 123 -8.735 0.216 -5.165 1.00 0.00 P ATOM 704 OP1 DT C 123 -9.491 -0.399 -4.052 1.00 0.00 O ATOM 705 OP2 DT C 123 -8.978 1.624 -5.541 1.00 0.00 O ATOM 706 O5' DT C 123 -7.168 0.057 -4.869 1.00 0.00 O ATOM 707 C5' DT C 123 -6.616 -1.224 -4.606 1.00 0.00 C ATOM 708 C4' DT C 123 -5.109 -1.148 -4.376 1.00 0.00 C ATOM 709 O4' DT C 123 -4.431 -0.774 -5.608 1.00 0.00 O ATOM 710 C3' DT C 123 -4.734 -0.104 -3.318 1.00 0.00 C ATOM 711 O3' DT C 123 -3.893 -0.733 -2.344 1.00 0.00 O ATOM 712 C2' DT C 123 -4.005 0.985 -4.051 1.00 0.00 C ATOM 713 C1' DT C 123 -3.583 0.381 -5.382 1.00 0.00 C ATOM 714 N1 DT C 123 -3.663 1.363 -6.517 1.00 0.00 N ATOM 715 C2 DT C 123 -2.512 1.564 -7.279 1.00 0.00 C ATOM 716 O2 DT C 123 -1.467 0.959 -7.049 1.00 0.00 O ATOM 717 N3 DT C 123 -2.609 2.478 -8.314 1.00 0.00 N ATOM 718 C4 DT C 123 -3.735 3.202 -8.658 1.00 0.00 C ATOM 719 O4 DT C 123 -3.706 3.996 -9.597 1.00 0.00 O ATOM 720 C5 DT C 123 -4.886 2.938 -7.825 1.00 0.00 C ATOM 721 C7 DT C 123 -6.188 3.699 -8.101 1.00 0.00 C ATOM 722 C6 DT C 123 -4.823 2.047 -6.805 1.00 0.00 C ATOM 0 H5' DT C 123 -6.824 -1.890 -5.444 1.00 0.00 H new ATOM 0 H5'' DT C 123 -7.098 -1.656 -3.729 1.00 0.00 H new ATOM 0 H4' DT C 123 -4.801 -2.136 -4.034 1.00 0.00 H new ATOM 0 H3' DT C 123 -5.599 0.308 -2.798 1.00 0.00 H new ATOM 0 H2' DT C 123 -4.648 1.852 -4.202 1.00 0.00 H new ATOM 0 H2'' DT C 123 -3.138 1.325 -3.484 1.00 0.00 H new ATOM 0 H1' DT C 123 -2.534 0.090 -5.341 1.00 0.00 H new ATOM 0 H3 DT C 123 -1.771 2.632 -8.875 1.00 0.00 H new ATOM 0 H71 DT C 123 -5.955 4.679 -8.517 1.00 0.00 H new ATOM 0 H72 DT C 123 -6.794 3.137 -8.812 1.00 0.00 H new ATOM 0 H73 DT C 123 -6.742 3.822 -7.170 1.00 0.00 H new ATOM 0 H6 DT C 123 -5.703 1.870 -6.204 1.00 0.00 H new ATOM 735 P DA C 124 -3.287 0.041 -1.064 1.00 0.00 P ATOM 736 OP1 DA C 124 -3.403 -0.849 0.111 1.00 0.00 O ATOM 737 OP2 DA C 124 -3.882 1.396 -1.023 1.00 0.00 O ATOM 738 O5' DA C 124 -1.720 0.193 -1.435 1.00 0.00 O ATOM 739 C5' DA C 124 -0.947 -0.998 -1.658 1.00 0.00 C ATOM 740 C4' DA C 124 0.562 -0.748 -1.809 1.00 0.00 C ATOM 741 O4' DA C 124 0.824 -0.048 -3.047 1.00 0.00 O ATOM 742 C3' DA C 124 1.120 0.113 -0.668 1.00 0.00 C ATOM 743 O3' DA C 124 2.365 -0.409 -0.188 1.00 0.00 O ATOM 744 C2' DA C 124 1.343 1.477 -1.266 1.00 0.00 C ATOM 745 C1' DA C 124 1.238 1.310 -2.777 1.00 0.00 C ATOM 746 N9 DA C 124 0.279 2.261 -3.342 1.00 0.00 N ATOM 747 C8 DA C 124 -0.990 2.496 -2.956 1.00 0.00 C ATOM 748 N7 DA C 124 -1.631 3.383 -3.651 1.00 0.00 N ATOM 749 C5 DA C 124 -0.687 3.771 -4.594 1.00 0.00 C ATOM 750 C6 DA C 124 -0.726 4.690 -5.641 1.00 0.00 C ATOM 751 N6 DA C 124 -1.805 5.423 -5.915 1.00 0.00 N ATOM 752 N1 DA C 124 0.392 4.830 -6.382 1.00 0.00 N ATOM 753 C2 DA C 124 1.479 4.103 -6.100 1.00 0.00 C ATOM 754 N3 DA C 124 1.612 3.207 -5.130 1.00 0.00 N ATOM 755 C4 DA C 124 0.482 3.093 -4.413 1.00 0.00 C ATOM 0 H5' DA C 124 -1.314 -1.493 -2.557 1.00 0.00 H new ATOM 0 H5'' DA C 124 -1.109 -1.684 -0.827 1.00 0.00 H new ATOM 0 H4' DA C 124 1.046 -1.725 -1.793 1.00 0.00 H new ATOM 0 H3' DA C 124 0.434 0.134 0.178 1.00 0.00 H new ATOM 0 H2' DA C 124 0.600 2.186 -0.902 1.00 0.00 H new ATOM 0 H2'' DA C 124 2.321 1.868 -0.986 1.00 0.00 H new ATOM 0 H1' DA C 124 2.204 1.510 -3.241 1.00 0.00 H new ATOM 0 H8 DA C 124 -1.443 1.980 -2.123 1.00 0.00 H new ATOM 0 H61 DA C 124 -1.789 6.084 -6.692 1.00 0.00 H new ATOM 0 H62 DA C 124 -2.647 5.323 -5.348 1.00 0.00 H new ATOM 0 H2 DA C 124 2.342 4.262 -6.730 1.00 0.00 H new ATOM 767 P DT C 125 3.147 0.331 1.018 1.00 0.00 P ATOM 768 OP1 DT C 125 4.013 -0.667 1.685 1.00 0.00 O ATOM 769 OP2 DT C 125 2.159 1.097 1.810 1.00 0.00 O ATOM 770 O5' DT C 125 4.096 1.380 0.239 1.00 0.00 O ATOM 771 C5' DT C 125 5.088 0.882 -0.659 1.00 0.00 C ATOM 772 C4' DT C 125 5.800 1.977 -1.467 1.00 0.00 C ATOM 773 O4' DT C 125 4.906 2.559 -2.455 1.00 0.00 O ATOM 774 C3' DT C 125 6.328 3.135 -0.602 1.00 0.00 C ATOM 775 O3' DT C 125 7.724 3.337 -0.875 1.00 0.00 O ATOM 776 C2' DT C 125 5.540 4.341 -1.027 1.00 0.00 C ATOM 777 C1' DT C 125 5.037 3.998 -2.418 1.00 0.00 C ATOM 778 N1 DT C 125 3.768 4.699 -2.790 1.00 0.00 N ATOM 779 C2 DT C 125 3.745 5.388 -4.002 1.00 0.00 C ATOM 780 O2 DT C 125 4.730 5.450 -4.735 1.00 0.00 O ATOM 781 N3 DT C 125 2.553 5.998 -4.336 1.00 0.00 N ATOM 782 C4 DT C 125 1.394 5.981 -3.586 1.00 0.00 C ATOM 783 O4 DT C 125 0.369 6.501 -4.007 1.00 0.00 O ATOM 784 C5 DT C 125 1.502 5.257 -2.347 1.00 0.00 C ATOM 785 C7 DT C 125 0.286 5.205 -1.422 1.00 0.00 C ATOM 786 C6 DT C 125 2.656 4.648 -1.991 1.00 0.00 C ATOM 0 H5' DT C 125 4.620 0.181 -1.350 1.00 0.00 H new ATOM 0 H5'' DT C 125 5.831 0.322 -0.091 1.00 0.00 H new ATOM 0 H4' DT C 125 6.644 1.472 -1.936 1.00 0.00 H new ATOM 0 H3' DT C 125 6.221 2.938 0.465 1.00 0.00 H new ATOM 0 H2' DT C 125 4.714 4.536 -0.343 1.00 0.00 H new ATOM 0 H2'' DT C 125 6.161 5.236 -1.040 1.00 0.00 H new ATOM 0 H1' DT C 125 5.746 4.350 -3.167 1.00 0.00 H new ATOM 0 H3 DT C 125 2.526 6.509 -5.219 1.00 0.00 H new ATOM 0 H71 DT C 125 0.297 4.272 -0.858 1.00 0.00 H new ATOM 0 H72 DT C 125 0.318 6.047 -0.731 1.00 0.00 H new ATOM 0 H73 DT C 125 -0.626 5.259 -2.017 1.00 0.00 H new ATOM 0 H6 DT C 125 2.702 4.109 -1.056 1.00 0.00 H new ATOM 799 P DC C 126 8.586 4.496 -0.155 1.00 0.00 P ATOM 800 OP1 DC C 126 9.962 3.993 0.050 1.00 0.00 O ATOM 801 OP2 DC C 126 7.806 5.000 0.998 1.00 0.00 O ATOM 802 O5' DC C 126 8.631 5.660 -1.283 1.00 0.00 O ATOM 803 C5' DC C 126 9.227 5.370 -2.560 1.00 0.00 C ATOM 804 C4' DC C 126 9.210 6.557 -3.548 1.00 0.00 C ATOM 805 O4' DC C 126 7.861 6.832 -4.005 1.00 0.00 O ATOM 806 C3' DC C 126 9.777 7.847 -2.938 1.00 0.00 C ATOM 807 O3' DC C 126 10.912 8.303 -3.679 1.00 0.00 O ATOM 808 C2' DC C 126 8.669 8.873 -3.032 1.00 0.00 C ATOM 809 C1' DC C 126 7.513 8.220 -3.783 1.00 0.00 C ATOM 810 N1 DC C 126 6.260 8.315 -2.993 1.00 0.00 N ATOM 811 C2 DC C 126 5.155 8.970 -3.546 1.00 0.00 C ATOM 812 O2 DC C 126 5.242 9.536 -4.637 1.00 0.00 O ATOM 813 N3 DC C 126 3.999 8.985 -2.834 1.00 0.00 N ATOM 814 C4 DC C 126 3.918 8.394 -1.637 1.00 0.00 C ATOM 815 N4 DC C 126 2.761 8.404 -0.988 1.00 0.00 N ATOM 816 C5 DC C 126 5.046 7.732 -1.063 1.00 0.00 C ATOM 817 C6 DC C 126 6.187 7.721 -1.773 1.00 0.00 C ATOM 0 H5' DC C 126 8.702 4.528 -3.011 1.00 0.00 H new ATOM 0 H5'' DC C 126 10.259 5.056 -2.404 1.00 0.00 H new ATOM 0 H4' DC C 126 9.845 6.256 -4.381 1.00 0.00 H new ATOM 0 H3' DC C 126 10.101 7.682 -1.910 1.00 0.00 H new ATOM 0 H2' DC C 126 8.352 9.190 -2.038 1.00 0.00 H new ATOM 0 H2'' DC C 126 9.014 9.765 -3.556 1.00 0.00 H new ATOM 0 H1' DC C 126 7.345 8.728 -4.733 1.00 0.00 H new ATOM 0 H41 DC C 126 2.685 7.957 -0.074 1.00 0.00 H new ATOM 0 H42 DC C 126 1.948 8.859 -1.403 1.00 0.00 H new ATOM 0 H5 DC C 126 4.984 7.258 -0.095 1.00 0.00 H new ATOM 0 H6 DC C 126 7.060 7.232 -1.367 1.00 0.00 H new ATOM 829 P DT C 127 11.834 9.499 -3.114 1.00 0.00 P ATOM 830 OP1 DT C 127 13.100 9.510 -3.881 1.00 0.00 O ATOM 831 OP2 DT C 127 11.864 9.402 -1.638 1.00 0.00 O ATOM 832 O5' DT C 127 10.988 10.811 -3.513 1.00 0.00 O ATOM 833 C5' DT C 127 10.823 11.181 -4.883 1.00 0.00 C ATOM 834 C4' DT C 127 9.969 12.446 -5.031 1.00 0.00 C ATOM 835 O4' DT C 127 8.597 12.149 -4.677 1.00 0.00 O ATOM 836 C3' DT C 127 10.451 13.591 -4.124 1.00 0.00 C ATOM 837 O3' DT C 127 10.884 14.709 -4.911 1.00 0.00 O ATOM 838 C2' DT C 127 9.252 13.978 -3.286 1.00 0.00 C ATOM 839 C1' DT C 127 8.067 13.173 -3.812 1.00 0.00 C ATOM 840 N1 DT C 127 7.264 12.586 -2.690 1.00 0.00 N ATOM 841 C2 DT C 127 5.925 12.950 -2.596 1.00 0.00 C ATOM 842 O2 DT C 127 5.400 13.709 -3.406 1.00 0.00 O ATOM 843 N3 DT C 127 5.214 12.407 -1.544 1.00 0.00 N ATOM 844 C4 DT C 127 5.706 11.544 -0.584 1.00 0.00 C ATOM 845 O4 DT C 127 4.975 11.122 0.309 1.00 0.00 O ATOM 846 C5 DT C 127 7.103 11.212 -0.748 1.00 0.00 C ATOM 847 C7 DT C 127 7.756 10.265 0.266 1.00 0.00 C ATOM 848 C6 DT C 127 7.829 11.730 -1.773 1.00 0.00 C ATOM 0 H5' DT C 127 10.355 10.361 -5.427 1.00 0.00 H new ATOM 0 H5'' DT C 127 11.801 11.347 -5.335 1.00 0.00 H new ATOM 0 H4' DT C 127 10.055 12.765 -6.070 1.00 0.00 H new ATOM 0 H3' DT C 127 11.297 13.285 -3.509 1.00 0.00 H new ATOM 0 H2' DT C 127 9.430 13.760 -2.233 1.00 0.00 H new ATOM 0 H2'' DT C 127 9.057 15.048 -3.362 1.00 0.00 H new ATOM 0 H1' DT C 127 7.384 13.818 -4.365 1.00 0.00 H new ATOM 0 H3 DT C 127 4.231 12.668 -1.469 1.00 0.00 H new ATOM 0 H71 DT C 127 7.268 10.376 1.234 1.00 0.00 H new ATOM 0 H72 DT C 127 7.651 9.236 -0.078 1.00 0.00 H new ATOM 0 H73 DT C 127 8.814 10.509 0.363 1.00 0.00 H new ATOM 0 H6 DT C 127 8.871 11.464 -1.870 1.00 0.00 H new ATOM 861 P DG C 128 11.524 16.020 -4.216 1.00 0.00 P ATOM 862 OP1 DG C 128 12.397 16.686 -5.209 1.00 0.00 O ATOM 863 OP2 DG C 128 12.079 15.619 -2.904 1.00 0.00 O ATOM 864 O5' DG C 128 10.257 16.982 -3.944 1.00 0.00 O ATOM 865 C5' DG C 128 9.480 17.475 -5.039 1.00 0.00 C ATOM 866 C4' DG C 128 8.323 18.370 -4.579 1.00 0.00 C ATOM 867 O4' DG C 128 7.314 17.577 -3.914 1.00 0.00 O ATOM 868 C3' DG C 128 8.787 19.467 -3.607 1.00 0.00 C ATOM 869 O3' DG C 128 8.506 20.750 -4.170 1.00 0.00 O ATOM 870 C2' DG C 128 7.986 19.259 -2.339 1.00 0.00 C ATOM 871 C1' DG C 128 7.002 18.126 -2.614 1.00 0.00 C ATOM 872 N9 DG C 128 7.096 17.090 -1.575 1.00 0.00 N ATOM 873 C8 DG C 128 8.184 16.379 -1.192 1.00 0.00 C ATOM 874 N7 DG C 128 7.983 15.527 -0.233 1.00 0.00 N ATOM 875 C5 DG C 128 6.629 15.687 0.055 1.00 0.00 C ATOM 876 C6 DG C 128 5.818 15.029 1.018 1.00 0.00 C ATOM 877 O6 DG C 128 6.141 14.155 1.818 1.00 0.00 O ATOM 878 N1 DG C 128 4.508 15.489 0.979 1.00 0.00 N ATOM 879 C2 DG C 128 4.033 16.460 0.122 1.00 0.00 C ATOM 880 N2 DG C 128 2.740 16.764 0.234 1.00 0.00 N ATOM 881 N3 DG C 128 4.794 17.081 -0.787 1.00 0.00 N ATOM 882 C4 DG C 128 6.076 16.646 -0.763 1.00 0.00 C ATOM 0 H5' DG C 128 9.082 16.634 -5.606 1.00 0.00 H new ATOM 0 H5'' DG C 128 10.125 18.038 -5.714 1.00 0.00 H new ATOM 0 H4' DG C 128 7.918 18.843 -5.474 1.00 0.00 H new ATOM 0 H3' DG C 128 9.858 19.418 -3.410 1.00 0.00 H new ATOM 0 H2' DG C 128 8.642 19.007 -1.506 1.00 0.00 H new ATOM 0 H2'' DG C 128 7.457 20.171 -2.063 1.00 0.00 H new ATOM 0 H1' DG C 128 5.980 18.504 -2.600 1.00 0.00 H new ATOM 0 H8 DG C 128 9.152 16.512 -1.653 1.00 0.00 H new ATOM 0 H1 DG C 128 3.845 15.076 1.636 1.00 0.00 H new ATOM 0 H21 DG C 128 2.329 17.474 -0.372 1.00 0.00 H new ATOM 0 H22 DG C 128 2.162 16.286 0.925 1.00 0.00 H new ATOM 894 P DC C 129 9.072 22.115 -3.525 1.00 0.00 P ATOM 895 OP1 DC C 129 9.157 23.132 -4.596 1.00 0.00 O ATOM 896 OP2 DC C 129 10.279 21.781 -2.734 1.00 0.00 O ATOM 897 O5' DC C 129 7.915 22.565 -2.499 1.00 0.00 O ATOM 898 C5' DC C 129 6.595 22.830 -2.984 1.00 0.00 C ATOM 899 C4' DC C 129 5.664 23.340 -1.877 1.00 0.00 C ATOM 900 O4' DC C 129 5.392 22.293 -0.910 1.00 0.00 O ATOM 901 C3' DC C 129 6.296 24.515 -1.122 1.00 0.00 C ATOM 902 O3' DC C 129 5.333 25.567 -0.983 1.00 0.00 O ATOM 903 C2' DC C 129 6.677 23.968 0.230 1.00 0.00 C ATOM 904 C1' DC C 129 5.893 22.671 0.395 1.00 0.00 C ATOM 905 N1 DC C 129 6.713 21.568 0.987 1.00 0.00 N ATOM 906 C2 DC C 129 6.211 20.923 2.117 1.00 0.00 C ATOM 907 O2 DC C 129 5.145 21.291 2.610 1.00 0.00 O ATOM 908 N3 DC C 129 6.919 19.892 2.649 1.00 0.00 N ATOM 909 C4 DC C 129 8.075 19.497 2.105 1.00 0.00 C ATOM 910 N4 DC C 129 8.746 18.486 2.661 1.00 0.00 N ATOM 911 C5 DC C 129 8.602 20.148 0.943 1.00 0.00 C ATOM 912 C6 DC C 129 7.895 21.171 0.418 1.00 0.00 C ATOM 0 H5' DC C 129 6.179 21.920 -3.416 1.00 0.00 H new ATOM 0 H5'' DC C 129 6.645 23.569 -3.784 1.00 0.00 H new ATOM 0 H4' DC C 129 4.741 23.659 -2.362 1.00 0.00 H new ATOM 0 H3' DC C 129 7.161 24.926 -1.643 1.00 0.00 H new ATOM 0 H2' DC C 129 7.750 23.785 0.289 1.00 0.00 H new ATOM 0 H2'' DC C 129 6.430 24.676 1.021 1.00 0.00 H new ATOM 0 H1' DC C 129 5.075 22.839 1.096 1.00 0.00 H new ATOM 0 H41 DC C 129 9.629 18.176 2.255 1.00 0.00 H new ATOM 0 H42 DC C 129 8.376 18.024 3.492 1.00 0.00 H new ATOM 0 H5 DC C 129 9.535 19.831 0.501 1.00 0.00 H new ATOM 0 H6 DC C 129 8.264 21.682 -0.459 1.00 0.00 H new ATOM 924 P DA C 130 5.684 26.949 -0.232 1.00 0.00 P ATOM 925 OP1 DA C 130 4.955 28.038 -0.920 1.00 0.00 O ATOM 926 OP2 DA C 130 7.156 27.029 -0.093 1.00 0.00 O ATOM 927 O5' DA C 130 5.052 26.778 1.243 1.00 0.00 O ATOM 928 C5' DA C 130 3.646 26.557 1.412 1.00 0.00 C ATOM 929 C4' DA C 130 3.241 26.473 2.893 1.00 0.00 C ATOM 930 O4' DA C 130 3.741 25.249 3.493 1.00 0.00 O ATOM 931 C3' DA C 130 3.804 27.658 3.695 1.00 0.00 C ATOM 932 O3' DA C 130 2.760 28.305 4.431 1.00 0.00 O ATOM 933 C2' DA C 130 4.800 27.059 4.655 1.00 0.00 C ATOM 934 C1' DA C 130 4.579 25.551 4.632 1.00 0.00 C ATOM 935 N9 DA C 130 5.853 24.817 4.570 1.00 0.00 N ATOM 936 C8 DA C 130 6.888 24.992 3.719 1.00 0.00 C ATOM 937 N7 DA C 130 7.904 24.202 3.903 1.00 0.00 N ATOM 938 C5 DA C 130 7.500 23.423 4.983 1.00 0.00 C ATOM 939 C6 DA C 130 8.117 22.383 5.685 1.00 0.00 C ATOM 940 N6 DA C 130 9.344 21.946 5.405 1.00 0.00 N ATOM 941 N1 DA C 130 7.430 21.831 6.701 1.00 0.00 N ATOM 942 C2 DA C 130 6.210 22.277 7.008 1.00 0.00 C ATOM 943 N3 DA C 130 5.539 23.255 6.409 1.00 0.00 N ATOM 944 C4 DA C 130 6.250 23.788 5.396 1.00 0.00 C ATOM 0 H5' DA C 130 3.363 25.633 0.907 1.00 0.00 H new ATOM 0 H5'' DA C 130 3.093 27.365 0.932 1.00 0.00 H new ATOM 0 H4' DA C 130 2.152 26.493 2.925 1.00 0.00 H new ATOM 0 H3' DA C 130 4.256 28.403 3.040 1.00 0.00 H new ATOM 0 H2' DA C 130 5.820 27.305 4.358 1.00 0.00 H new ATOM 0 H2'' DA C 130 4.656 27.456 5.660 1.00 0.00 H new ATOM 0 H1' DA C 130 4.091 25.232 5.553 1.00 0.00 H new ATOM 0 H8 DA C 130 6.872 25.738 2.938 1.00 0.00 H new ATOM 0 H61 DA C 130 9.750 21.183 5.947 1.00 0.00 H new ATOM 0 H62 DA C 130 9.877 22.374 4.648 1.00 0.00 H new ATOM 0 H2 DA C 130 5.714 21.789 7.834 1.00 0.00 H new ATOM 956 P DA C 131 3.074 29.585 5.361 1.00 0.00 P ATOM 957 OP1 DA C 131 1.824 30.365 5.496 1.00 0.00 O ATOM 958 OP2 DA C 131 4.296 30.242 4.843 1.00 0.00 O ATOM 959 O5' DA C 131 3.419 28.939 6.801 1.00 0.00 O ATOM 960 C5' DA C 131 2.400 28.275 7.555 1.00 0.00 C ATOM 961 C4' DA C 131 2.915 27.726 8.896 1.00 0.00 C ATOM 962 O4' DA C 131 3.797 26.593 8.697 1.00 0.00 O ATOM 963 C3' DA C 131 3.686 28.789 9.693 1.00 0.00 C ATOM 964 O3' DA C 131 3.052 29.041 10.950 1.00 0.00 O ATOM 965 C2' DA C 131 5.054 28.198 9.941 1.00 0.00 C ATOM 966 C1' DA C 131 5.006 26.752 9.478 1.00 0.00 C ATOM 967 N9 DA C 131 6.199 26.409 8.691 1.00 0.00 N ATOM 968 C8 DA C 131 6.670 27.017 7.583 1.00 0.00 C ATOM 969 N7 DA C 131 7.754 26.506 7.082 1.00 0.00 N ATOM 970 C5 DA C 131 8.030 25.453 7.951 1.00 0.00 C ATOM 971 C6 DA C 131 9.053 24.500 7.988 1.00 0.00 C ATOM 972 N6 DA C 131 10.029 24.449 7.082 1.00 0.00 N ATOM 973 N1 DA C 131 9.027 23.599 8.987 1.00 0.00 N ATOM 974 C2 DA C 131 8.049 23.637 9.896 1.00 0.00 C ATOM 975 N3 DA C 131 7.034 24.497 9.951 1.00 0.00 N ATOM 976 C4 DA C 131 7.089 25.386 8.937 1.00 0.00 C ATOM 0 H5' DA C 131 1.993 27.455 6.964 1.00 0.00 H new ATOM 0 H5'' DA C 131 1.581 28.970 7.742 1.00 0.00 H new ATOM 0 H4' DA C 131 2.031 27.421 9.455 1.00 0.00 H new ATOM 0 H3' DA C 131 3.727 29.732 9.148 1.00 0.00 H new ATOM 0 H2' DA C 131 5.818 28.752 9.395 1.00 0.00 H new ATOM 0 H2'' DA C 131 5.313 28.256 10.998 1.00 0.00 H new ATOM 0 H1' DA C 131 4.997 26.076 10.333 1.00 0.00 H new ATOM 0 H8 DA C 131 6.179 27.872 7.142 1.00 0.00 H new ATOM 0 H61 DA C 131 10.753 23.734 7.152 1.00 0.00 H new ATOM 0 H62 DA C 131 10.052 25.125 6.318 1.00 0.00 H new ATOM 0 H2 DA C 131 8.086 22.887 10.672 1.00 0.00 H new ATOM 988 P DC C 132 3.671 30.122 11.972 1.00 0.00 P ATOM 989 OP1 DC C 132 2.583 30.606 12.850 1.00 0.00 O ATOM 990 OP2 DC C 132 4.475 31.089 11.191 1.00 0.00 O ATOM 991 O5' DC C 132 4.680 29.233 12.866 1.00 0.00 O ATOM 992 C5' DC C 132 4.200 28.104 13.602 1.00 0.00 C ATOM 993 C4' DC C 132 5.330 27.362 14.329 1.00 0.00 C ATOM 994 O4' DC C 132 6.180 26.656 13.396 1.00 0.00 O ATOM 995 C3' DC C 132 6.215 28.312 15.146 1.00 0.00 C ATOM 996 O3' DC C 132 6.017 28.111 16.547 1.00 0.00 O ATOM 997 C2' DC C 132 7.642 27.968 14.761 1.00 0.00 C ATOM 998 C1' DC C 132 7.567 26.826 13.763 1.00 0.00 C ATOM 999 N1 DC C 132 8.405 27.103 12.566 1.00 0.00 N ATOM 1000 C2 DC C 132 9.506 26.285 12.321 1.00 0.00 C ATOM 1001 O2 DC C 132 9.783 25.380 13.104 1.00 0.00 O ATOM 1002 N3 DC C 132 10.255 26.523 11.210 1.00 0.00 N ATOM 1003 C4 DC C 132 9.943 27.520 10.372 1.00 0.00 C ATOM 1004 N4 DC C 132 10.707 27.737 9.300 1.00 0.00 N ATOM 1005 C5 DC C 132 8.813 28.361 10.620 1.00 0.00 C ATOM 1006 C6 DC C 132 8.081 28.114 11.724 1.00 0.00 C ATOM 0 H5' DC C 132 3.695 27.417 12.922 1.00 0.00 H new ATOM 0 H5'' DC C 132 3.459 28.435 14.329 1.00 0.00 H new ATOM 0 H4' DC C 132 4.839 26.658 15.001 1.00 0.00 H new ATOM 0 H3' DC C 132 5.977 29.356 14.941 1.00 0.00 H new ATOM 0 H2' DC C 132 8.142 28.831 14.323 1.00 0.00 H new ATOM 0 H2'' DC C 132 8.219 27.677 15.639 1.00 0.00 H new ATOM 0 HO3' DC C 132 6.592 28.725 17.050 1.00 0.00 H new ATOM 0 H1' DC C 132 7.954 25.911 14.211 1.00 0.00 H new ATOM 0 H41 DC C 132 10.478 28.494 8.655 1.00 0.00 H new ATOM 0 H42 DC C 132 11.520 27.146 9.125 1.00 0.00 H new ATOM 0 H5 DC C 132 8.556 29.165 9.947 1.00 0.00 H new ATOM 0 H6 DC C 132 7.222 28.732 11.941 1.00 0.00 H new TER 1019 DC C 132 ATOM 1020 N LYS A 1 -5.454 14.095 11.218 1.00 0.00 N ATOM 1021 CA LYS A 1 -6.192 13.476 12.355 1.00 0.00 C ATOM 1022 C LYS A 1 -6.543 12.022 12.010 1.00 0.00 C ATOM 1023 O LYS A 1 -7.566 11.751 11.418 1.00 0.00 O ATOM 1024 CB LYS A 1 -7.478 14.267 12.633 1.00 0.00 C ATOM 1025 CG LYS A 1 -7.128 15.638 13.228 1.00 0.00 C ATOM 1026 CD LYS A 1 -8.419 16.418 13.509 1.00 0.00 C ATOM 1027 CE LYS A 1 -8.085 17.790 14.104 1.00 0.00 C ATOM 1028 NZ LYS A 1 -7.500 18.671 13.053 1.00 0.00 N ATOM 0 H1 LYS A 1 -4.557 14.493 11.562 1.00 0.00 H new ATOM 0 H2 LYS A 1 -5.258 13.372 10.496 1.00 0.00 H new ATOM 0 H3 LYS A 1 -6.031 14.853 10.801 1.00 0.00 H new ATOM 0 HA LYS A 1 -5.562 13.494 13.244 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -8.044 14.395 11.710 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -8.114 13.713 13.323 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -6.559 15.512 14.149 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -6.496 16.196 12.537 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -8.987 16.541 12.587 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -9.049 15.857 14.199 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -8.986 18.247 14.514 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -7.381 17.677 14.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -7.449 19.647 13.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -6.544 18.339 12.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -8.099 18.642 12.203 1.00 0.00 H new ATOM 1044 N ARG A 2 -5.700 11.087 12.381 1.00 0.00 N ATOM 1045 CA ARG A 2 -5.980 9.644 12.083 1.00 0.00 C ATOM 1046 C ARG A 2 -6.655 8.996 13.295 1.00 0.00 C ATOM 1047 O ARG A 2 -7.124 7.877 13.236 1.00 0.00 O ATOM 1048 CB ARG A 2 -4.665 8.905 11.804 1.00 0.00 C ATOM 1049 CG ARG A 2 -4.028 9.424 10.505 1.00 0.00 C ATOM 1050 CD ARG A 2 -3.337 10.778 10.741 1.00 0.00 C ATOM 1051 NE ARG A 2 -2.349 11.049 9.644 1.00 0.00 N ATOM 1052 CZ ARG A 2 -1.328 10.264 9.420 1.00 0.00 C ATOM 1053 NH1 ARG A 2 -1.071 9.263 10.217 1.00 0.00 N ATOM 1054 NH2 ARG A 2 -0.535 10.508 8.413 1.00 0.00 N ATOM 0 H ARG A 2 -4.827 11.261 12.879 1.00 0.00 H new ATOM 0 HA ARG A 2 -6.631 9.582 11.211 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -3.976 9.047 12.637 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -4.852 7.834 11.723 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -3.302 8.699 10.135 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -4.793 9.530 9.736 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -4.081 11.574 10.776 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -2.829 10.773 11.706 1.00 0.00 H new ATOM 0 HE ARG A 2 -2.478 11.872 9.055 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -1.669 9.087 11.024 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -0.272 8.657 10.033 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -0.713 11.308 7.806 1.00 0.00 H new ATOM 0 HH22 ARG A 2 0.263 9.899 8.233 1.00 0.00 H new ATOM 1068 N ALA A 3 -6.686 9.691 14.396 1.00 0.00 N ATOM 1069 CA ALA A 3 -7.306 9.121 15.625 1.00 0.00 C ATOM 1070 C ALA A 3 -8.817 8.962 15.432 1.00 0.00 C ATOM 1071 O ALA A 3 -9.546 9.928 15.330 1.00 0.00 O ATOM 1072 CB ALA A 3 -7.044 10.065 16.800 1.00 0.00 C ATOM 0 H ALA A 3 -6.308 10.633 14.499 1.00 0.00 H new ATOM 0 HA ALA A 3 -6.870 8.142 15.825 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -7.495 9.655 17.704 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -5.969 10.173 16.947 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -7.481 11.041 16.587 1.00 0.00 H new ATOM 1078 N GLY A 4 -9.295 7.745 15.402 1.00 0.00 N ATOM 1079 CA GLY A 4 -10.761 7.517 15.238 1.00 0.00 C ATOM 1080 C GLY A 4 -11.147 7.583 13.759 1.00 0.00 C ATOM 1081 O GLY A 4 -12.254 7.248 13.386 1.00 0.00 O ATOM 0 H GLY A 4 -8.732 6.898 15.484 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.033 6.545 15.649 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.318 8.267 15.800 1.00 0.00 H new ATOM 1085 N THR A 5 -10.257 8.026 12.915 1.00 0.00 N ATOM 1086 CA THR A 5 -10.597 8.126 11.468 1.00 0.00 C ATOM 1087 C THR A 5 -10.885 6.741 10.898 1.00 0.00 C ATOM 1088 O THR A 5 -10.040 5.867 10.896 1.00 0.00 O ATOM 1089 CB THR A 5 -9.433 8.741 10.701 1.00 0.00 C ATOM 1090 OG1 THR A 5 -8.995 9.909 11.376 1.00 0.00 O ATOM 1091 CG2 THR A 5 -9.880 9.110 9.280 1.00 0.00 C ATOM 0 H THR A 5 -9.313 8.322 13.163 1.00 0.00 H new ATOM 0 HA THR A 5 -11.481 8.755 11.364 1.00 0.00 H new ATOM 0 HB THR A 5 -8.618 8.020 10.643 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.425 10.437 10.779 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.043 9.549 8.738 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.219 8.213 8.761 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.697 9.830 9.331 1.00 0.00 H new ATOM 1099 N VAL A 6 -12.068 6.558 10.382 1.00 0.00 N ATOM 1100 CA VAL A 6 -12.457 5.260 9.755 1.00 0.00 C ATOM 1101 C VAL A 6 -12.813 5.570 8.307 1.00 0.00 C ATOM 1102 O VAL A 6 -13.394 6.599 8.024 1.00 0.00 O ATOM 1103 CB VAL A 6 -13.676 4.670 10.474 1.00 0.00 C ATOM 1104 CG1 VAL A 6 -13.292 4.263 11.897 1.00 0.00 C ATOM 1105 CG2 VAL A 6 -14.795 5.715 10.528 1.00 0.00 C ATOM 0 H VAL A 6 -12.799 7.269 10.368 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.647 4.534 9.820 1.00 0.00 H new ATOM 0 HB VAL A 6 -14.022 3.792 9.929 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -14.162 3.845 12.403 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -12.499 3.516 11.860 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -12.941 5.138 12.443 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -15.661 5.295 11.039 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -14.446 6.594 11.069 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -15.075 6.000 9.514 1.00 0.00 H new ATOM 1115 N CYS A 7 -12.476 4.726 7.381 1.00 0.00 N ATOM 1116 CA CYS A 7 -12.813 5.039 5.969 1.00 0.00 C ATOM 1117 C CYS A 7 -14.321 5.109 5.801 1.00 0.00 C ATOM 1118 O CYS A 7 -15.032 4.144 5.997 1.00 0.00 O ATOM 1119 CB CYS A 7 -12.248 3.960 5.058 1.00 0.00 C ATOM 1120 SG CYS A 7 -12.686 4.332 3.341 1.00 0.00 S ATOM 0 H CYS A 7 -11.988 3.844 7.535 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.378 6.003 5.703 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -11.165 3.909 5.165 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -12.643 2.985 5.343 1.00 0.00 H new ATOM 1125 N SER A 8 -14.810 6.251 5.434 1.00 0.00 N ATOM 1126 CA SER A 8 -16.266 6.405 5.241 1.00 0.00 C ATOM 1127 C SER A 8 -16.731 5.432 4.160 1.00 0.00 C ATOM 1128 O SER A 8 -17.796 4.853 4.251 1.00 0.00 O ATOM 1129 CB SER A 8 -16.573 7.836 4.798 1.00 0.00 C ATOM 1130 OG SER A 8 -16.154 8.743 5.809 1.00 0.00 O ATOM 0 H SER A 8 -14.258 7.091 5.258 1.00 0.00 H new ATOM 0 HA SER A 8 -16.785 6.195 6.177 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.061 8.056 3.861 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.641 7.950 4.612 1.00 0.00 H new ATOM 0 HG SER A 8 -15.181 8.853 5.767 1.00 0.00 H new ATOM 1136 N ASN A 9 -15.959 5.272 3.112 1.00 0.00 N ATOM 1137 CA ASN A 9 -16.391 4.363 2.014 1.00 0.00 C ATOM 1138 C ASN A 9 -16.283 2.884 2.399 1.00 0.00 C ATOM 1139 O ASN A 9 -17.142 2.110 2.026 1.00 0.00 O ATOM 1140 CB ASN A 9 -15.507 4.619 0.793 1.00 0.00 C ATOM 1141 CG ASN A 9 -15.900 5.943 0.133 1.00 0.00 C ATOM 1142 OD1 ASN A 9 -15.318 6.335 -0.858 1.00 0.00 O ATOM 1143 ND2 ASN A 9 -16.866 6.654 0.645 1.00 0.00 N ATOM 0 H ASN A 9 -15.057 5.729 2.973 1.00 0.00 H new ATOM 0 HA ASN A 9 -17.439 4.573 1.802 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -14.459 4.649 1.092 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -15.612 3.802 0.079 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -17.132 7.539 0.213 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -17.355 6.325 1.477 1.00 0.00 H new ATOM 1150 N CYS A 10 -15.243 2.446 3.102 1.00 0.00 N ATOM 1151 CA CYS A 10 -15.154 0.976 3.429 1.00 0.00 C ATOM 1152 C CYS A 10 -14.824 0.721 4.908 1.00 0.00 C ATOM 1153 O CYS A 10 -14.548 -0.396 5.289 1.00 0.00 O ATOM 1154 CB CYS A 10 -14.140 0.273 2.504 1.00 0.00 C ATOM 1155 SG CYS A 10 -12.432 0.653 2.974 1.00 0.00 S ATOM 0 H CYS A 10 -14.479 3.025 3.451 1.00 0.00 H new ATOM 0 HA CYS A 10 -16.141 0.548 3.252 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -14.297 -0.805 2.543 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -14.312 0.583 1.473 1.00 0.00 H new ATOM 1160 N GLN A 11 -14.913 1.715 5.756 1.00 0.00 N ATOM 1161 CA GLN A 11 -14.683 1.495 7.223 1.00 0.00 C ATOM 1162 C GLN A 11 -13.253 1.032 7.560 1.00 0.00 C ATOM 1163 O GLN A 11 -12.937 0.837 8.716 1.00 0.00 O ATOM 1164 CB GLN A 11 -15.693 0.449 7.722 1.00 0.00 C ATOM 1165 CG GLN A 11 -15.819 0.506 9.249 1.00 0.00 C ATOM 1166 CD GLN A 11 -16.999 -0.361 9.691 1.00 0.00 C ATOM 1167 OE1 GLN A 11 -17.804 -0.771 8.877 1.00 0.00 O ATOM 1168 NE2 GLN A 11 -17.139 -0.658 10.953 1.00 0.00 N ATOM 0 H GLN A 11 -15.136 2.676 5.497 1.00 0.00 H new ATOM 0 HA GLN A 11 -14.819 2.455 7.722 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -16.666 0.628 7.264 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -15.375 -0.547 7.415 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -14.899 0.153 9.715 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -15.967 1.535 9.575 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -16.464 -0.314 11.636 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -17.924 -1.234 11.257 1.00 0.00 H new ATOM 1177 N THR A 12 -12.376 0.848 6.612 1.00 0.00 N ATOM 1178 CA THR A 12 -11.004 0.397 7.005 1.00 0.00 C ATOM 1179 C THR A 12 -10.353 1.480 7.874 1.00 0.00 C ATOM 1180 O THR A 12 -10.604 2.654 7.681 1.00 0.00 O ATOM 1181 CB THR A 12 -10.140 0.122 5.760 1.00 0.00 C ATOM 1182 OG1 THR A 12 -8.912 -0.459 6.172 1.00 0.00 O ATOM 1183 CG2 THR A 12 -9.849 1.414 4.988 1.00 0.00 C ATOM 0 H THR A 12 -12.537 0.984 5.614 1.00 0.00 H new ATOM 0 HA THR A 12 -11.081 -0.532 7.570 1.00 0.00 H new ATOM 0 HB THR A 12 -10.686 -0.555 5.102 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.177 0.160 5.981 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.237 1.186 4.115 1.00 0.00 H new ATOM 0 HG22 THR A 12 -10.788 1.865 4.666 1.00 0.00 H new ATOM 0 HG23 THR A 12 -9.315 2.111 5.634 1.00 0.00 H new ATOM 1191 N SER A 13 -9.502 1.104 8.811 1.00 0.00 N ATOM 1192 CA SER A 13 -8.816 2.136 9.673 1.00 0.00 C ATOM 1193 C SER A 13 -7.345 2.193 9.271 1.00 0.00 C ATOM 1194 O SER A 13 -6.602 3.057 9.691 1.00 0.00 O ATOM 1195 CB SER A 13 -8.950 1.773 11.153 1.00 0.00 C ATOM 1196 OG SER A 13 -8.212 0.588 11.413 1.00 0.00 O ATOM 0 H SER A 13 -9.254 0.136 9.015 1.00 0.00 H new ATOM 0 HA SER A 13 -9.281 3.111 9.526 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.581 2.589 11.774 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.999 1.626 11.410 1.00 0.00 H new ATOM 0 HG SER A 13 -8.294 0.353 12.361 1.00 0.00 H new ATOM 1202 N THR A 14 -6.934 1.285 8.429 1.00 0.00 N ATOM 1203 CA THR A 14 -5.525 1.269 7.945 1.00 0.00 C ATOM 1204 C THR A 14 -5.512 1.828 6.528 1.00 0.00 C ATOM 1205 O THR A 14 -6.175 1.316 5.647 1.00 0.00 O ATOM 1206 CB THR A 14 -5.013 -0.170 7.935 1.00 0.00 C ATOM 1207 OG1 THR A 14 -5.740 -0.929 6.979 1.00 0.00 O ATOM 1208 CG2 THR A 14 -5.199 -0.775 9.323 1.00 0.00 C ATOM 0 H THR A 14 -7.523 0.543 8.051 1.00 0.00 H new ATOM 0 HA THR A 14 -4.886 1.868 8.594 1.00 0.00 H new ATOM 0 HB THR A 14 -3.956 -0.182 7.669 1.00 0.00 H new ATOM 0 HG1 THR A 14 -6.245 -0.324 6.397 1.00 0.00 H new ATOM 0 HG21 THR A 14 -4.836 -1.803 9.324 1.00 0.00 H new ATOM 0 HG22 THR A 14 -4.638 -0.191 10.053 1.00 0.00 H new ATOM 0 HG23 THR A 14 -6.257 -0.764 9.586 1.00 0.00 H new ATOM 1216 N THR A 15 -4.772 2.876 6.299 1.00 0.00 N ATOM 1217 CA THR A 15 -4.735 3.472 4.932 1.00 0.00 C ATOM 1218 C THR A 15 -3.341 4.014 4.653 1.00 0.00 C ATOM 1219 O THR A 15 -2.670 4.508 5.537 1.00 0.00 O ATOM 1220 CB THR A 15 -5.726 4.638 4.870 1.00 0.00 C ATOM 1221 OG1 THR A 15 -5.122 5.795 5.435 1.00 0.00 O ATOM 1222 CG2 THR A 15 -6.971 4.288 5.672 1.00 0.00 C ATOM 0 H THR A 15 -4.193 3.345 6.995 1.00 0.00 H new ATOM 0 HA THR A 15 -4.994 2.710 4.197 1.00 0.00 H new ATOM 0 HB THR A 15 -5.999 4.829 3.832 1.00 0.00 H new ATOM 0 HG1 THR A 15 -5.758 6.235 6.037 1.00 0.00 H new ATOM 0 HG21 THR A 15 -7.677 5.117 5.628 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.434 3.395 5.253 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.695 4.101 6.710 1.00 0.00 H new ATOM 1230 N THR A 16 -2.906 3.964 3.426 1.00 0.00 N ATOM 1231 CA THR A 16 -1.568 4.520 3.117 1.00 0.00 C ATOM 1232 C THR A 16 -1.688 6.041 3.140 1.00 0.00 C ATOM 1233 O THR A 16 -0.835 6.733 3.659 1.00 0.00 O ATOM 1234 CB THR A 16 -1.101 4.060 1.735 1.00 0.00 C ATOM 1235 OG1 THR A 16 -1.947 4.620 0.741 1.00 0.00 O ATOM 1236 CG2 THR A 16 -1.132 2.530 1.631 1.00 0.00 C ATOM 0 H THR A 16 -3.414 3.567 2.635 1.00 0.00 H new ATOM 0 HA THR A 16 -0.839 4.174 3.850 1.00 0.00 H new ATOM 0 HB THR A 16 -0.075 4.397 1.584 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.867 4.101 -0.086 1.00 0.00 H new ATOM 0 HG21 THR A 16 -0.796 2.226 0.640 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.473 2.101 2.385 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.150 2.175 1.794 1.00 0.00 H new ATOM 1244 N LEU A 17 -2.765 6.570 2.608 1.00 0.00 N ATOM 1245 CA LEU A 17 -2.960 8.053 2.633 1.00 0.00 C ATOM 1246 C LEU A 17 -4.454 8.346 2.810 1.00 0.00 C ATOM 1247 O LEU A 17 -5.285 7.818 2.097 1.00 0.00 O ATOM 1248 CB LEU A 17 -2.437 8.693 1.326 1.00 0.00 C ATOM 1249 CG LEU A 17 -1.867 10.092 1.617 1.00 0.00 C ATOM 1250 CD1 LEU A 17 -0.456 9.971 2.251 1.00 0.00 C ATOM 1251 CD2 LEU A 17 -1.795 10.903 0.307 1.00 0.00 C ATOM 0 H LEU A 17 -3.513 6.041 2.160 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.398 8.482 3.462 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.666 8.061 0.885 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.245 8.765 0.598 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.521 10.607 2.320 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.061 10.967 2.453 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.523 9.411 3.184 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.209 9.450 1.562 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.391 11.894 0.514 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -1.148 10.389 -0.404 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.795 11.000 -0.116 1.00 0.00 H new ATOM 1263 N TRP A 18 -4.801 9.190 3.744 1.00 0.00 N ATOM 1264 CA TRP A 18 -6.234 9.530 3.966 1.00 0.00 C ATOM 1265 C TRP A 18 -6.664 10.590 2.948 1.00 0.00 C ATOM 1266 O TRP A 18 -6.003 11.596 2.785 1.00 0.00 O ATOM 1267 CB TRP A 18 -6.385 10.125 5.369 1.00 0.00 C ATOM 1268 CG TRP A 18 -6.288 9.048 6.403 1.00 0.00 C ATOM 1269 CD1 TRP A 18 -5.238 8.855 7.233 1.00 0.00 C ATOM 1270 CD2 TRP A 18 -7.266 8.023 6.737 1.00 0.00 C ATOM 1271 NE1 TRP A 18 -5.511 7.777 8.056 1.00 0.00 N ATOM 1272 CE2 TRP A 18 -6.748 7.232 7.790 1.00 0.00 C ATOM 1273 CE3 TRP A 18 -8.540 7.706 6.236 1.00 0.00 C ATOM 1274 CZ2 TRP A 18 -7.469 6.164 8.326 1.00 0.00 C ATOM 1275 CZ3 TRP A 18 -9.266 6.632 6.773 1.00 0.00 C ATOM 1276 CH2 TRP A 18 -8.732 5.865 7.815 1.00 0.00 C ATOM 0 H TRP A 18 -4.146 9.662 4.368 1.00 0.00 H new ATOM 0 HA TRP A 18 -6.846 8.635 3.859 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -5.611 10.873 5.539 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.345 10.635 5.454 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.334 9.446 7.251 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -4.874 7.428 8.772 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -8.963 8.292 5.433 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -7.053 5.574 9.129 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -10.244 6.396 6.380 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -9.298 5.041 8.224 1.00 0.00 H new ATOM 1287 N ARG A 19 -7.762 10.379 2.265 1.00 0.00 N ATOM 1288 CA ARG A 19 -8.237 11.382 1.259 1.00 0.00 C ATOM 1289 C ARG A 19 -9.549 11.994 1.762 1.00 0.00 C ATOM 1290 O ARG A 19 -10.548 11.315 1.860 1.00 0.00 O ATOM 1291 CB ARG A 19 -8.507 10.682 -0.092 1.00 0.00 C ATOM 1292 CG ARG A 19 -7.424 9.644 -0.386 1.00 0.00 C ATOM 1293 CD ARG A 19 -6.098 10.341 -0.665 1.00 0.00 C ATOM 1294 NE ARG A 19 -5.157 9.350 -1.252 1.00 0.00 N ATOM 1295 CZ ARG A 19 -4.051 9.742 -1.817 1.00 0.00 C ATOM 1296 NH1 ARG A 19 -3.710 10.995 -1.800 1.00 0.00 N ATOM 1297 NH2 ARG A 19 -3.279 8.874 -2.393 1.00 0.00 N ATOM 0 H ARG A 19 -8.352 9.553 2.361 1.00 0.00 H new ATOM 0 HA ARG A 19 -7.477 12.152 1.125 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -9.484 10.199 -0.069 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -8.536 11.422 -0.892 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -7.317 8.967 0.462 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -7.713 9.037 -1.244 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -6.246 11.175 -1.351 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -5.687 10.754 0.256 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.380 8.355 -1.212 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.310 11.681 -1.342 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -2.842 11.293 -2.245 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.539 7.888 -2.403 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.412 9.178 -2.836 1.00 0.00 H new ATOM 1311 N ARG A 20 -9.585 13.253 2.085 1.00 0.00 N ATOM 1312 CA ARG A 20 -10.873 13.829 2.566 1.00 0.00 C ATOM 1313 C ARG A 20 -11.766 14.097 1.347 1.00 0.00 C ATOM 1314 O ARG A 20 -11.782 15.191 0.823 1.00 0.00 O ATOM 1315 CB ARG A 20 -10.608 15.156 3.287 1.00 0.00 C ATOM 1316 CG ARG A 20 -11.882 15.617 4.019 1.00 0.00 C ATOM 1317 CD ARG A 20 -11.990 14.944 5.393 1.00 0.00 C ATOM 1318 NE ARG A 20 -13.041 15.636 6.195 1.00 0.00 N ATOM 1319 CZ ARG A 20 -13.513 15.072 7.272 1.00 0.00 C ATOM 1320 NH1 ARG A 20 -13.086 13.895 7.628 1.00 0.00 N ATOM 1321 NH2 ARG A 20 -14.415 15.683 7.992 1.00 0.00 N ATOM 0 H ARG A 20 -8.797 13.900 2.040 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.356 13.135 3.253 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -9.792 15.036 3.999 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -10.296 15.914 2.569 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -11.867 16.700 4.139 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -12.760 15.375 3.420 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -12.240 13.889 5.276 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -11.032 14.989 5.910 1.00 0.00 H new ATOM 0 HE ARG A 20 -13.390 16.548 5.901 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -12.383 13.416 7.065 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -13.454 13.452 8.470 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -14.752 16.604 7.713 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -14.782 15.239 8.834 1.00 0.00 H new ATOM 1335 N SER A 21 -12.451 13.086 0.859 1.00 0.00 N ATOM 1336 CA SER A 21 -13.308 13.226 -0.370 1.00 0.00 C ATOM 1337 C SER A 21 -13.916 14.642 -0.524 1.00 0.00 C ATOM 1338 O SER A 21 -14.054 15.378 0.432 1.00 0.00 O ATOM 1339 CB SER A 21 -14.435 12.178 -0.304 1.00 0.00 C ATOM 1340 OG SER A 21 -15.663 12.761 -0.730 1.00 0.00 O ATOM 0 H SER A 21 -12.453 12.151 1.268 1.00 0.00 H new ATOM 0 HA SER A 21 -12.673 13.065 -1.241 1.00 0.00 H new ATOM 0 HB2 SER A 21 -14.188 11.325 -0.936 1.00 0.00 H new ATOM 0 HB3 SER A 21 -14.535 11.802 0.714 1.00 0.00 H new ATOM 0 HG SER A 21 -16.018 12.256 -1.492 1.00 0.00 H new ATOM 1346 N PRO A 22 -14.273 15.015 -1.750 1.00 0.00 N ATOM 1347 CA PRO A 22 -14.856 16.366 -2.037 1.00 0.00 C ATOM 1348 C PRO A 22 -16.088 16.716 -1.183 1.00 0.00 C ATOM 1349 O PRO A 22 -16.486 17.861 -1.103 1.00 0.00 O ATOM 1350 CB PRO A 22 -15.259 16.245 -3.529 1.00 0.00 C ATOM 1351 CG PRO A 22 -14.964 14.811 -4.005 1.00 0.00 C ATOM 1352 CD PRO A 22 -14.118 14.117 -2.936 1.00 0.00 C ATOM 0 HA PRO A 22 -14.146 17.161 -1.808 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -16.317 16.475 -3.654 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -14.703 16.965 -4.130 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -15.894 14.266 -4.167 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -14.434 14.828 -4.957 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -14.477 13.109 -2.729 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -13.075 14.028 -3.241 1.00 0.00 H new ATOM 1360 N MET A 23 -16.703 15.744 -0.558 1.00 0.00 N ATOM 1361 CA MET A 23 -17.915 16.034 0.269 1.00 0.00 C ATOM 1362 C MET A 23 -17.499 16.242 1.720 1.00 0.00 C ATOM 1363 O MET A 23 -18.240 16.781 2.519 1.00 0.00 O ATOM 1364 CB MET A 23 -18.883 14.855 0.180 1.00 0.00 C ATOM 1365 CG MET A 23 -19.471 14.776 -1.231 1.00 0.00 C ATOM 1366 SD MET A 23 -20.616 13.377 -1.327 1.00 0.00 S ATOM 1367 CE MET A 23 -21.094 13.583 -3.060 1.00 0.00 C ATOM 0 H MET A 23 -16.420 14.764 -0.584 1.00 0.00 H new ATOM 0 HA MET A 23 -18.404 16.935 -0.102 1.00 0.00 H new ATOM 0 HB2 MET A 23 -18.364 13.927 0.421 1.00 0.00 H new ATOM 0 HB3 MET A 23 -19.682 14.972 0.912 1.00 0.00 H new ATOM 0 HG2 MET A 23 -19.991 15.703 -1.473 1.00 0.00 H new ATOM 0 HG3 MET A 23 -18.673 14.658 -1.964 1.00 0.00 H new ATOM 0 HE1 MET A 23 -21.810 12.808 -3.335 1.00 0.00 H new ATOM 0 HE2 MET A 23 -21.550 14.564 -3.198 1.00 0.00 H new ATOM 0 HE3 MET A 23 -20.211 13.501 -3.693 1.00 0.00 H new ATOM 1377 N GLY A 24 -16.313 15.819 2.070 1.00 0.00 N ATOM 1378 CA GLY A 24 -15.831 15.991 3.472 1.00 0.00 C ATOM 1379 C GLY A 24 -15.959 14.674 4.243 1.00 0.00 C ATOM 1380 O GLY A 24 -15.910 14.660 5.457 1.00 0.00 O ATOM 0 H GLY A 24 -15.654 15.359 1.442 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.791 16.319 3.469 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.409 16.769 3.970 1.00 0.00 H new ATOM 1384 N ASP A 25 -16.117 13.559 3.567 1.00 0.00 N ATOM 1385 CA ASP A 25 -16.243 12.254 4.283 1.00 0.00 C ATOM 1386 C ASP A 25 -14.872 11.531 4.279 1.00 0.00 C ATOM 1387 O ASP A 25 -14.331 11.276 3.222 1.00 0.00 O ATOM 1388 CB ASP A 25 -17.253 11.389 3.526 1.00 0.00 C ATOM 1389 CG ASP A 25 -18.538 12.188 3.310 1.00 0.00 C ATOM 1390 OD1 ASP A 25 -18.683 13.220 3.944 1.00 0.00 O ATOM 1391 OD2 ASP A 25 -19.357 11.754 2.517 1.00 0.00 O ATOM 0 H ASP A 25 -16.164 13.500 2.550 1.00 0.00 H new ATOM 0 HA ASP A 25 -16.568 12.420 5.310 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -16.838 11.079 2.567 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -17.466 10.481 4.089 1.00 0.00 H new ATOM 1396 N PRO A 26 -14.295 11.195 5.425 1.00 0.00 N ATOM 1397 CA PRO A 26 -12.970 10.498 5.427 1.00 0.00 C ATOM 1398 C PRO A 26 -12.986 9.174 4.637 1.00 0.00 C ATOM 1399 O PRO A 26 -13.870 8.361 4.801 1.00 0.00 O ATOM 1400 CB PRO A 26 -12.719 10.242 6.934 1.00 0.00 C ATOM 1401 CG PRO A 26 -13.867 10.878 7.743 1.00 0.00 C ATOM 1402 CD PRO A 26 -14.893 11.474 6.765 1.00 0.00 C ATOM 0 HA PRO A 26 -12.194 11.089 4.941 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -12.666 9.171 7.131 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -11.763 10.669 7.235 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -14.341 10.129 8.377 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -13.479 11.655 8.402 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -15.871 11.006 6.874 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -15.031 12.543 6.929 1.00 0.00 H new ATOM 1410 N VAL A 27 -11.992 8.945 3.810 1.00 0.00 N ATOM 1411 CA VAL A 27 -11.929 7.649 3.043 1.00 0.00 C ATOM 1412 C VAL A 27 -10.482 7.162 2.958 1.00 0.00 C ATOM 1413 O VAL A 27 -9.552 7.928 3.122 1.00 0.00 O ATOM 1414 CB VAL A 27 -12.471 7.819 1.622 1.00 0.00 C ATOM 1415 CG1 VAL A 27 -13.991 7.976 1.666 1.00 0.00 C ATOM 1416 CG2 VAL A 27 -11.814 9.039 0.966 1.00 0.00 C ATOM 0 H VAL A 27 -11.224 9.592 3.631 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.543 6.921 3.573 1.00 0.00 H new ATOM 0 HB VAL A 27 -12.234 6.936 1.028 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.374 8.097 0.653 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.435 7.089 2.118 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -14.249 8.854 2.258 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.200 9.160 -0.046 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.040 9.932 1.550 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -10.734 8.894 0.928 1.00 0.00 H new ATOM 1426 N CYS A 28 -10.273 5.898 2.674 1.00 0.00 N ATOM 1427 CA CYS A 28 -8.880 5.386 2.545 1.00 0.00 C ATOM 1428 C CYS A 28 -8.368 5.653 1.119 1.00 0.00 C ATOM 1429 O CYS A 28 -9.134 5.795 0.187 1.00 0.00 O ATOM 1430 CB CYS A 28 -8.825 3.886 2.894 1.00 0.00 C ATOM 1431 SG CYS A 28 -9.613 2.868 1.615 1.00 0.00 S ATOM 0 H CYS A 28 -11.007 5.205 2.527 1.00 0.00 H new ATOM 0 HA CYS A 28 -8.231 5.908 3.248 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -7.786 3.579 3.015 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -9.321 3.717 3.850 1.00 0.00 H new ATOM 1436 N ASN A 29 -7.078 5.755 0.962 1.00 0.00 N ATOM 1437 CA ASN A 29 -6.474 6.053 -0.378 1.00 0.00 C ATOM 1438 C ASN A 29 -7.111 5.217 -1.493 1.00 0.00 C ATOM 1439 O ASN A 29 -7.279 5.686 -2.601 1.00 0.00 O ATOM 1440 CB ASN A 29 -4.982 5.711 -0.315 1.00 0.00 C ATOM 1441 CG ASN A 29 -4.307 6.044 -1.648 1.00 0.00 C ATOM 1442 OD1 ASN A 29 -4.934 6.016 -2.689 1.00 0.00 O ATOM 1443 ND2 ASN A 29 -3.036 6.334 -1.662 1.00 0.00 N ATOM 0 H ASN A 29 -6.400 5.643 1.716 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.643 7.106 -0.603 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.507 6.270 0.491 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -4.853 4.653 -0.088 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.569 6.537 -2.546 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -2.509 6.358 -0.789 1.00 0.00 H new ATOM 1450 N ALA A 30 -7.439 3.992 -1.240 1.00 0.00 N ATOM 1451 CA ALA A 30 -8.027 3.165 -2.330 1.00 0.00 C ATOM 1452 C ALA A 30 -9.452 3.629 -2.681 1.00 0.00 C ATOM 1453 O ALA A 30 -9.787 3.792 -3.839 1.00 0.00 O ATOM 1454 CB ALA A 30 -8.032 1.704 -1.891 1.00 0.00 C ATOM 0 H ALA A 30 -7.330 3.525 -0.340 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.421 3.280 -3.229 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -8.461 1.088 -2.682 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -7.010 1.380 -1.692 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.629 1.598 -0.985 1.00 0.00 H new ATOM 1460 N CYS A 31 -10.300 3.817 -1.705 1.00 0.00 N ATOM 1461 CA CYS A 31 -11.705 4.239 -2.006 1.00 0.00 C ATOM 1462 C CYS A 31 -11.727 5.588 -2.717 1.00 0.00 C ATOM 1463 O CYS A 31 -12.497 5.800 -3.620 1.00 0.00 O ATOM 1464 CB CYS A 31 -12.503 4.391 -0.711 1.00 0.00 C ATOM 1465 SG CYS A 31 -12.934 2.776 -0.038 1.00 0.00 S ATOM 0 H CYS A 31 -10.085 3.698 -0.715 1.00 0.00 H new ATOM 0 HA CYS A 31 -12.144 3.471 -2.642 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -11.918 4.951 0.019 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -13.410 4.965 -0.901 1.00 0.00 H new ATOM 1470 N GLY A 32 -10.923 6.515 -2.301 1.00 0.00 N ATOM 1471 CA GLY A 32 -10.962 7.846 -2.957 1.00 0.00 C ATOM 1472 C GLY A 32 -10.690 7.693 -4.450 1.00 0.00 C ATOM 1473 O GLY A 32 -11.436 8.172 -5.281 1.00 0.00 O ATOM 0 H GLY A 32 -10.247 6.414 -1.544 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.936 8.310 -2.801 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.219 8.505 -2.508 1.00 0.00 H new ATOM 1477 N LEU A 33 -9.631 7.026 -4.796 1.00 0.00 N ATOM 1478 CA LEU A 33 -9.311 6.838 -6.233 1.00 0.00 C ATOM 1479 C LEU A 33 -10.399 5.998 -6.899 1.00 0.00 C ATOM 1480 O LEU A 33 -10.888 6.326 -7.960 1.00 0.00 O ATOM 1481 CB LEU A 33 -7.970 6.122 -6.339 1.00 0.00 C ATOM 1482 CG LEU A 33 -6.874 7.018 -5.742 1.00 0.00 C ATOM 1483 CD1 LEU A 33 -5.590 6.198 -5.542 1.00 0.00 C ATOM 1484 CD2 LEU A 33 -6.605 8.224 -6.674 1.00 0.00 C ATOM 0 H LEU A 33 -8.971 6.601 -4.144 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.259 7.805 -6.734 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -8.009 5.171 -5.808 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.745 5.897 -7.382 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.206 7.397 -4.776 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.814 6.835 -5.118 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.790 5.369 -4.863 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.255 5.807 -6.503 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.827 8.852 -6.241 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.280 7.864 -7.650 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -7.519 8.806 -6.788 1.00 0.00 H new ATOM 1496 N TYR A 34 -10.779 4.911 -6.292 1.00 0.00 N ATOM 1497 CA TYR A 34 -11.827 4.050 -6.901 1.00 0.00 C ATOM 1498 C TYR A 34 -13.116 4.854 -7.064 1.00 0.00 C ATOM 1499 O TYR A 34 -13.799 4.763 -8.064 1.00 0.00 O ATOM 1500 CB TYR A 34 -12.093 2.859 -5.974 1.00 0.00 C ATOM 1501 CG TYR A 34 -13.146 1.964 -6.577 1.00 0.00 C ATOM 1502 CD1 TYR A 34 -14.498 2.320 -6.507 1.00 0.00 C ATOM 1503 CD2 TYR A 34 -12.767 0.778 -7.216 1.00 0.00 C ATOM 1504 CE1 TYR A 34 -15.468 1.492 -7.080 1.00 0.00 C ATOM 1505 CE2 TYR A 34 -13.737 -0.053 -7.785 1.00 0.00 C ATOM 1506 CZ TYR A 34 -15.089 0.305 -7.717 1.00 0.00 C ATOM 1507 OH TYR A 34 -16.049 -0.511 -8.281 1.00 0.00 O ATOM 0 H TYR A 34 -10.409 4.581 -5.400 1.00 0.00 H new ATOM 0 HA TYR A 34 -11.491 3.697 -7.876 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -11.172 2.297 -5.817 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -12.421 3.214 -4.997 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -14.792 3.233 -6.011 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -11.724 0.504 -7.270 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -16.511 1.769 -7.031 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -13.444 -0.969 -8.276 1.00 0.00 H new ATOM 0 HH TYR A 34 -15.618 -1.294 -8.684 1.00 0.00 H new ATOM 1517 N TYR A 35 -13.462 5.616 -6.067 1.00 0.00 N ATOM 1518 CA TYR A 35 -14.718 6.412 -6.120 1.00 0.00 C ATOM 1519 C TYR A 35 -14.609 7.537 -7.160 1.00 0.00 C ATOM 1520 O TYR A 35 -15.496 7.747 -7.944 1.00 0.00 O ATOM 1521 CB TYR A 35 -14.981 7.010 -4.731 1.00 0.00 C ATOM 1522 CG TYR A 35 -16.433 7.407 -4.618 1.00 0.00 C ATOM 1523 CD1 TYR A 35 -16.854 8.631 -5.136 1.00 0.00 C ATOM 1524 CD2 TYR A 35 -17.354 6.549 -3.999 1.00 0.00 C ATOM 1525 CE1 TYR A 35 -18.200 9.007 -5.038 1.00 0.00 C ATOM 1526 CE2 TYR A 35 -18.699 6.922 -3.900 1.00 0.00 C ATOM 1527 CZ TYR A 35 -19.124 8.152 -4.420 1.00 0.00 C ATOM 1528 OH TYR A 35 -20.451 8.523 -4.323 1.00 0.00 O ATOM 0 H TYR A 35 -12.922 5.723 -5.208 1.00 0.00 H new ATOM 0 HA TYR A 35 -15.542 5.761 -6.412 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -14.731 6.284 -3.958 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -14.342 7.879 -4.571 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -16.143 9.289 -5.613 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -17.025 5.601 -3.599 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -18.526 9.956 -5.438 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -19.409 6.263 -3.423 1.00 0.00 H new ATOM 0 HH TYR A 35 -20.956 7.817 -3.868 1.00 0.00 H new ATOM 1538 N LYS A 36 -13.545 8.272 -7.177 1.00 0.00 N ATOM 1539 CA LYS A 36 -13.433 9.380 -8.175 1.00 0.00 C ATOM 1540 C LYS A 36 -13.515 8.824 -9.602 1.00 0.00 C ATOM 1541 O LYS A 36 -14.140 9.405 -10.466 1.00 0.00 O ATOM 1542 CB LYS A 36 -12.086 10.074 -7.976 1.00 0.00 C ATOM 1543 CG LYS A 36 -11.916 11.210 -8.985 1.00 0.00 C ATOM 1544 CD LYS A 36 -10.619 11.970 -8.676 1.00 0.00 C ATOM 1545 CE LYS A 36 -9.415 11.021 -8.761 1.00 0.00 C ATOM 1546 NZ LYS A 36 -9.226 10.359 -7.440 1.00 0.00 N ATOM 0 H LYS A 36 -12.747 8.163 -6.551 1.00 0.00 H new ATOM 0 HA LYS A 36 -14.251 10.086 -8.031 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.019 10.467 -6.962 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.277 9.352 -8.092 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.885 10.810 -9.999 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -12.769 11.887 -8.935 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -10.494 12.792 -9.381 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.675 12.410 -7.680 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -9.579 10.273 -9.537 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -8.518 11.575 -9.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -8.283 10.590 -7.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -9.952 10.696 -6.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -9.311 9.329 -7.553 1.00 0.00 H new ATOM 1560 N LEU A 37 -12.882 7.720 -9.860 1.00 0.00 N ATOM 1561 CA LEU A 37 -12.911 7.139 -11.236 1.00 0.00 C ATOM 1562 C LEU A 37 -14.305 6.582 -11.588 1.00 0.00 C ATOM 1563 O LEU A 37 -14.745 6.709 -12.714 1.00 0.00 O ATOM 1564 CB LEU A 37 -11.852 6.021 -11.318 1.00 0.00 C ATOM 1565 CG LEU A 37 -10.492 6.588 -11.769 1.00 0.00 C ATOM 1566 CD1 LEU A 37 -10.044 7.731 -10.847 1.00 0.00 C ATOM 1567 CD2 LEU A 37 -9.448 5.470 -11.720 1.00 0.00 C ATOM 0 H LEU A 37 -12.342 7.188 -9.178 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.688 7.925 -11.957 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.747 5.542 -10.345 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.181 5.253 -12.018 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.592 6.976 -12.783 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.082 8.115 -11.185 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.784 8.531 -10.874 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -9.948 7.359 -9.827 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.481 5.861 -12.037 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.369 5.090 -10.701 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.749 4.662 -12.386 1.00 0.00 H new ATOM 1579 N HIS A 38 -14.987 5.934 -10.665 1.00 0.00 N ATOM 1580 CA HIS A 38 -16.334 5.337 -10.994 1.00 0.00 C ATOM 1581 C HIS A 38 -17.458 5.934 -10.137 1.00 0.00 C ATOM 1582 O HIS A 38 -18.604 5.560 -10.283 1.00 0.00 O ATOM 1583 CB HIS A 38 -16.262 3.830 -10.751 1.00 0.00 C ATOM 1584 CG HIS A 38 -15.210 3.246 -11.649 1.00 0.00 C ATOM 1585 ND1 HIS A 38 -15.519 2.687 -12.876 1.00 0.00 N ATOM 1586 CD2 HIS A 38 -13.846 3.154 -11.527 1.00 0.00 C ATOM 1587 CE1 HIS A 38 -14.368 2.289 -13.442 1.00 0.00 C ATOM 1588 NE2 HIS A 38 -13.315 2.550 -12.663 1.00 0.00 N ATOM 0 H HIS A 38 -14.674 5.792 -9.705 1.00 0.00 H new ATOM 0 HA HIS A 38 -16.564 5.561 -12.035 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -16.023 3.627 -9.707 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -17.229 3.368 -10.952 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -16.452 2.594 -13.278 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -13.272 3.498 -10.679 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -14.302 1.815 -14.410 1.00 0.00 H new ATOM 1596 N GLN A 39 -17.165 6.859 -9.264 1.00 0.00 N ATOM 1597 CA GLN A 39 -18.215 7.498 -8.407 1.00 0.00 C ATOM 1598 C GLN A 39 -19.314 6.517 -7.963 1.00 0.00 C ATOM 1599 O GLN A 39 -20.478 6.856 -7.908 1.00 0.00 O ATOM 1600 CB GLN A 39 -18.792 8.726 -9.123 1.00 0.00 C ATOM 1601 CG GLN A 39 -19.608 8.308 -10.356 1.00 0.00 C ATOM 1602 CD GLN A 39 -20.240 9.549 -10.990 1.00 0.00 C ATOM 1603 OE1 GLN A 39 -19.696 10.633 -10.908 1.00 0.00 O ATOM 1604 NE2 GLN A 39 -21.374 9.436 -11.627 1.00 0.00 N ATOM 0 H GLN A 39 -16.221 7.209 -9.103 1.00 0.00 H new ATOM 0 HA GLN A 39 -17.735 7.823 -7.484 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -19.425 9.288 -8.436 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -17.982 9.390 -9.426 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -18.965 7.804 -11.078 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -20.383 7.597 -10.069 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -21.831 8.527 -11.697 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -21.802 10.257 -12.055 1.00 0.00 H new ATOM 1613 N VAL A 40 -18.938 5.320 -7.579 1.00 0.00 N ATOM 1614 CA VAL A 40 -19.930 4.329 -7.070 1.00 0.00 C ATOM 1615 C VAL A 40 -19.325 3.616 -5.858 1.00 0.00 C ATOM 1616 O VAL A 40 -18.122 3.536 -5.711 1.00 0.00 O ATOM 1617 CB VAL A 40 -20.275 3.302 -8.146 1.00 0.00 C ATOM 1618 CG1 VAL A 40 -21.110 3.962 -9.251 1.00 0.00 C ATOM 1619 CG2 VAL A 40 -18.993 2.707 -8.737 1.00 0.00 C ATOM 0 H VAL A 40 -17.974 4.987 -7.598 1.00 0.00 H new ATOM 0 HA VAL A 40 -20.846 4.850 -6.791 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.858 2.499 -7.695 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.352 3.223 -10.015 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -22.032 4.357 -8.824 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.540 4.775 -9.701 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -19.251 1.976 -9.503 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -18.394 3.502 -9.181 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -18.421 2.219 -7.948 1.00 0.00 H new ATOM 1629 N ASN A 41 -20.148 3.109 -4.984 1.00 0.00 N ATOM 1630 CA ASN A 41 -19.619 2.415 -3.767 1.00 0.00 C ATOM 1631 C ASN A 41 -19.288 0.955 -4.096 1.00 0.00 C ATOM 1632 O ASN A 41 -20.077 0.255 -4.700 1.00 0.00 O ATOM 1633 CB ASN A 41 -20.675 2.461 -2.659 1.00 0.00 C ATOM 1634 CG ASN A 41 -22.014 1.960 -3.203 1.00 0.00 C ATOM 1635 OD1 ASN A 41 -22.108 1.554 -4.344 1.00 0.00 O ATOM 1636 ND2 ASN A 41 -23.064 1.974 -2.428 1.00 0.00 N ATOM 0 H ASN A 41 -21.165 3.143 -5.056 1.00 0.00 H new ATOM 0 HA ASN A 41 -18.712 2.919 -3.434 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -20.360 1.845 -1.817 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -20.781 3.480 -2.286 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.963 1.644 -2.781 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -22.986 2.315 -1.470 1.00 0.00 H new ATOM 1643 N ARG A 42 -18.113 0.491 -3.717 1.00 0.00 N ATOM 1644 CA ARG A 42 -17.713 -0.924 -4.021 1.00 0.00 C ATOM 1645 C ARG A 42 -17.801 -1.801 -2.749 1.00 0.00 C ATOM 1646 O ARG A 42 -17.575 -1.319 -1.656 1.00 0.00 O ATOM 1647 CB ARG A 42 -16.259 -0.930 -4.515 1.00 0.00 C ATOM 1648 CG ARG A 42 -15.340 -0.321 -3.443 1.00 0.00 C ATOM 1649 CD ARG A 42 -13.882 -0.239 -3.963 1.00 0.00 C ATOM 1650 NE ARG A 42 -12.934 -0.787 -2.936 1.00 0.00 N ATOM 1651 CZ ARG A 42 -13.023 -0.443 -1.677 1.00 0.00 C ATOM 1652 NH1 ARG A 42 -13.877 0.469 -1.304 1.00 0.00 N ATOM 1653 NH2 ARG A 42 -12.235 -0.992 -0.794 1.00 0.00 N ATOM 0 H ARG A 42 -17.415 1.034 -3.210 1.00 0.00 H new ATOM 0 HA ARG A 42 -18.386 -1.325 -4.779 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -15.946 -1.950 -4.738 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -16.178 -0.362 -5.442 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -15.694 0.675 -3.175 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -15.376 -0.927 -2.537 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -13.787 -0.801 -4.892 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.626 0.796 -4.189 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.206 -1.440 -3.226 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -14.479 0.917 -1.995 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -13.943 0.734 -0.321 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.550 -1.689 -1.085 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -12.304 -0.724 0.188 1.00 0.00 H new ATOM 1667 N PRO A 43 -18.090 -3.086 -2.883 1.00 0.00 N ATOM 1668 CA PRO A 43 -18.151 -3.998 -1.699 1.00 0.00 C ATOM 1669 C PRO A 43 -16.792 -4.120 -0.986 1.00 0.00 C ATOM 1670 O PRO A 43 -15.747 -3.953 -1.583 1.00 0.00 O ATOM 1671 CB PRO A 43 -18.567 -5.343 -2.329 1.00 0.00 C ATOM 1672 CG PRO A 43 -18.418 -5.218 -3.851 1.00 0.00 C ATOM 1673 CD PRO A 43 -18.387 -3.725 -4.202 1.00 0.00 C ATOM 0 HA PRO A 43 -18.834 -3.641 -0.929 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -17.942 -6.151 -1.950 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -19.596 -5.586 -2.065 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -17.504 -5.708 -4.186 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -19.248 -5.712 -4.357 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -17.621 -3.499 -4.944 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -19.338 -3.385 -4.612 1.00 0.00 H new ATOM 1681 N LEU A 44 -16.811 -4.411 0.284 1.00 0.00 N ATOM 1682 CA LEU A 44 -15.538 -4.553 1.053 1.00 0.00 C ATOM 1683 C LEU A 44 -14.730 -5.757 0.538 1.00 0.00 C ATOM 1684 O LEU A 44 -13.845 -6.247 1.213 1.00 0.00 O ATOM 1685 CB LEU A 44 -15.885 -4.752 2.542 1.00 0.00 C ATOM 1686 CG LEU A 44 -15.936 -3.398 3.253 1.00 0.00 C ATOM 1687 CD1 LEU A 44 -17.027 -2.520 2.629 1.00 0.00 C ATOM 1688 CD2 LEU A 44 -16.239 -3.607 4.744 1.00 0.00 C ATOM 0 H LEU A 44 -17.660 -4.558 0.829 1.00 0.00 H new ATOM 0 HA LEU A 44 -14.932 -3.656 0.925 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -16.846 -5.258 2.635 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -15.141 -5.393 3.015 1.00 0.00 H new ATOM 0 HG LEU A 44 -14.971 -2.904 3.144 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -17.057 -1.558 3.141 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -16.808 -2.363 1.573 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -17.993 -3.014 2.729 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -16.275 -2.641 5.247 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -17.201 -4.108 4.853 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -15.457 -4.221 5.192 1.00 0.00 H new ATOM 1700 N THR A 45 -15.011 -6.236 -0.642 1.00 0.00 N ATOM 1701 CA THR A 45 -14.240 -7.398 -1.169 1.00 0.00 C ATOM 1702 C THR A 45 -12.773 -6.991 -1.355 1.00 0.00 C ATOM 1703 O THR A 45 -11.900 -7.829 -1.466 1.00 0.00 O ATOM 1704 CB THR A 45 -14.836 -7.847 -2.512 1.00 0.00 C ATOM 1705 OG1 THR A 45 -14.254 -9.085 -2.896 1.00 0.00 O ATOM 1706 CG2 THR A 45 -14.558 -6.797 -3.590 1.00 0.00 C ATOM 0 H THR A 45 -15.737 -5.876 -1.262 1.00 0.00 H new ATOM 0 HA THR A 45 -14.297 -8.226 -0.463 1.00 0.00 H new ATOM 0 HB THR A 45 -15.914 -7.965 -2.401 1.00 0.00 H new ATOM 0 HG1 THR A 45 -14.634 -9.374 -3.752 1.00 0.00 H new ATOM 0 HG21 THR A 45 -14.985 -7.126 -4.537 1.00 0.00 H new ATOM 0 HG22 THR A 45 -15.009 -5.848 -3.299 1.00 0.00 H new ATOM 0 HG23 THR A 45 -13.482 -6.668 -3.703 1.00 0.00 H new ATOM 1714 N MET A 46 -12.497 -5.709 -1.400 1.00 0.00 N ATOM 1715 CA MET A 46 -11.081 -5.245 -1.588 1.00 0.00 C ATOM 1716 C MET A 46 -10.496 -4.817 -0.240 1.00 0.00 C ATOM 1717 O MET A 46 -9.323 -4.520 -0.128 1.00 0.00 O ATOM 1718 CB MET A 46 -11.058 -4.054 -2.548 1.00 0.00 C ATOM 1719 CG MET A 46 -11.570 -4.497 -3.920 1.00 0.00 C ATOM 1720 SD MET A 46 -11.285 -3.182 -5.136 1.00 0.00 S ATOM 1721 CE MET A 46 -9.483 -3.337 -5.260 1.00 0.00 C ATOM 0 H MET A 46 -13.188 -4.964 -1.315 1.00 0.00 H new ATOM 0 HA MET A 46 -10.487 -6.061 -2.000 1.00 0.00 H new ATOM 0 HB2 MET A 46 -11.679 -3.247 -2.159 1.00 0.00 H new ATOM 0 HB3 MET A 46 -10.044 -3.662 -2.635 1.00 0.00 H new ATOM 0 HG2 MET A 46 -11.061 -5.409 -4.231 1.00 0.00 H new ATOM 0 HG3 MET A 46 -12.634 -4.729 -3.864 1.00 0.00 H new ATOM 0 HE1 MET A 46 -9.161 -3.046 -6.260 1.00 0.00 H new ATOM 0 HE2 MET A 46 -9.010 -2.688 -4.523 1.00 0.00 H new ATOM 0 HE3 MET A 46 -9.193 -4.371 -5.072 1.00 0.00 H new ATOM 1731 N ARG A 47 -11.307 -4.773 0.778 1.00 0.00 N ATOM 1732 CA ARG A 47 -10.808 -4.355 2.119 1.00 0.00 C ATOM 1733 C ARG A 47 -10.118 -5.527 2.824 1.00 0.00 C ATOM 1734 O ARG A 47 -10.651 -6.615 2.916 1.00 0.00 O ATOM 1735 CB ARG A 47 -11.986 -3.856 2.960 1.00 0.00 C ATOM 1736 CG ARG A 47 -11.528 -3.562 4.391 1.00 0.00 C ATOM 1737 CD ARG A 47 -12.687 -2.935 5.156 1.00 0.00 C ATOM 1738 NE ARG A 47 -12.272 -2.656 6.573 1.00 0.00 N ATOM 1739 CZ ARG A 47 -11.888 -3.612 7.377 1.00 0.00 C ATOM 1740 NH1 ARG A 47 -12.002 -4.861 7.021 1.00 0.00 N ATOM 1741 NH2 ARG A 47 -11.431 -3.317 8.564 1.00 0.00 N ATOM 0 H ARG A 47 -12.299 -5.009 0.740 1.00 0.00 H new ATOM 0 HA ARG A 47 -10.080 -3.553 1.997 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -12.406 -2.955 2.513 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -12.778 -4.605 2.971 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -11.205 -4.481 4.881 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -10.672 -2.887 4.383 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -12.997 -2.010 4.670 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -13.547 -3.605 5.145 1.00 0.00 H new ATOM 0 HE ARG A 47 -12.290 -1.696 6.916 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -12.393 -5.098 6.109 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -11.700 -5.601 7.654 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -11.375 -2.343 8.861 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -11.130 -4.061 9.194 1.00 0.00 H new ATOM 1755 N LYS A 48 -8.936 -5.294 3.336 1.00 0.00 N ATOM 1756 CA LYS A 48 -8.179 -6.359 4.064 1.00 0.00 C ATOM 1757 C LYS A 48 -7.685 -5.769 5.390 1.00 0.00 C ATOM 1758 O LYS A 48 -7.462 -4.579 5.492 1.00 0.00 O ATOM 1759 CB LYS A 48 -6.988 -6.805 3.215 1.00 0.00 C ATOM 1760 CG LYS A 48 -6.320 -8.027 3.859 1.00 0.00 C ATOM 1761 CD LYS A 48 -5.095 -8.463 3.030 1.00 0.00 C ATOM 1762 CE LYS A 48 -5.527 -9.375 1.874 1.00 0.00 C ATOM 1763 NZ LYS A 48 -4.368 -9.597 0.963 1.00 0.00 N ATOM 0 H LYS A 48 -8.455 -4.396 3.280 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.817 -7.222 4.254 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.320 -7.050 2.206 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.269 -5.991 3.125 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -6.013 -7.788 4.877 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.034 -8.848 3.926 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.583 -7.585 2.637 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.384 -8.987 3.669 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.887 -10.328 2.262 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.353 -8.921 1.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.657 -10.215 0.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.044 -8.684 0.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -3.593 -10.047 1.491 1.00 0.00 H new ATOM 1777 N ASP A 49 -7.545 -6.576 6.411 1.00 0.00 N ATOM 1778 CA ASP A 49 -7.100 -6.044 7.737 1.00 0.00 C ATOM 1779 C ASP A 49 -5.976 -5.011 7.565 1.00 0.00 C ATOM 1780 O ASP A 49 -6.217 -3.820 7.535 1.00 0.00 O ATOM 1781 CB ASP A 49 -6.606 -7.200 8.614 1.00 0.00 C ATOM 1782 CG ASP A 49 -6.354 -6.691 10.034 1.00 0.00 C ATOM 1783 OD1 ASP A 49 -6.112 -5.505 10.185 1.00 0.00 O ATOM 1784 OD2 ASP A 49 -6.407 -7.498 10.949 1.00 0.00 O ATOM 0 H ASP A 49 -7.719 -7.581 6.385 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.948 -5.554 8.215 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -7.345 -8.001 8.629 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.690 -7.620 8.199 1.00 0.00 H new ATOM 1789 N GLY A 50 -4.751 -5.452 7.481 1.00 0.00 N ATOM 1790 CA GLY A 50 -3.613 -4.495 7.347 1.00 0.00 C ATOM 1791 C GLY A 50 -3.532 -3.925 5.928 1.00 0.00 C ATOM 1792 O GLY A 50 -4.392 -4.149 5.098 1.00 0.00 O ATOM 0 H GLY A 50 -4.487 -6.437 7.499 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.733 -3.681 8.062 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.679 -5.000 7.593 1.00 0.00 H new ATOM 1796 N ILE A 51 -2.483 -3.191 5.653 1.00 0.00 N ATOM 1797 CA ILE A 51 -2.294 -2.594 4.305 1.00 0.00 C ATOM 1798 C ILE A 51 -1.500 -3.563 3.429 1.00 0.00 C ATOM 1799 O ILE A 51 -0.563 -4.195 3.873 1.00 0.00 O ATOM 1800 CB ILE A 51 -1.519 -1.284 4.447 1.00 0.00 C ATOM 1801 CG1 ILE A 51 -2.254 -0.380 5.448 1.00 0.00 C ATOM 1802 CG2 ILE A 51 -1.415 -0.580 3.085 1.00 0.00 C ATOM 1803 CD1 ILE A 51 -1.726 1.051 5.351 1.00 0.00 C ATOM 0 H ILE A 51 -1.740 -2.980 6.320 1.00 0.00 H new ATOM 0 HA ILE A 51 -3.263 -2.401 3.845 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.511 -1.492 4.807 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.325 -0.395 5.245 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.116 -0.759 6.461 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -0.861 0.352 3.198 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -0.895 -1.228 2.379 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.415 -0.364 2.710 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.254 1.683 6.065 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.660 1.061 5.577 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -1.887 1.431 4.342 1.00 0.00 H new ATOM 1815 N GLN A 52 -1.857 -3.662 2.183 1.00 0.00 N ATOM 1816 CA GLN A 52 -1.112 -4.565 1.265 1.00 0.00 C ATOM 1817 C GLN A 52 0.160 -3.846 0.809 1.00 0.00 C ATOM 1818 O GLN A 52 0.216 -2.634 0.791 1.00 0.00 O ATOM 1819 CB GLN A 52 -1.991 -4.913 0.061 1.00 0.00 C ATOM 1820 CG GLN A 52 -3.259 -5.629 0.544 1.00 0.00 C ATOM 1821 CD GLN A 52 -4.278 -4.595 1.038 1.00 0.00 C ATOM 1822 OE1 GLN A 52 -4.625 -4.573 2.203 1.00 0.00 O ATOM 1823 NE2 GLN A 52 -4.770 -3.729 0.193 1.00 0.00 N ATOM 0 H GLN A 52 -2.634 -3.156 1.758 1.00 0.00 H new ATOM 0 HA GLN A 52 -0.846 -5.491 1.775 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.257 -4.007 -0.483 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.442 -5.551 -0.632 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.687 -6.218 -0.267 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -3.013 -6.324 1.347 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.479 -3.748 -0.784 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.446 -3.034 0.510 1.00 0.00 H new ATOM 1832 N THR A 53 1.197 -4.573 0.472 1.00 0.00 N ATOM 1833 CA THR A 53 2.475 -3.909 0.045 1.00 0.00 C ATOM 1834 C THR A 53 3.082 -4.633 -1.158 1.00 0.00 C ATOM 1835 O THR A 53 2.743 -5.759 -1.468 1.00 0.00 O ATOM 1836 CB THR A 53 3.469 -3.925 1.206 1.00 0.00 C ATOM 1837 OG1 THR A 53 4.794 -3.846 0.698 1.00 0.00 O ATOM 1838 CG2 THR A 53 3.296 -5.213 2.002 1.00 0.00 C ATOM 0 H THR A 53 1.217 -5.593 0.473 1.00 0.00 H new ATOM 0 HA THR A 53 2.257 -2.880 -0.241 1.00 0.00 H new ATOM 0 HB THR A 53 3.284 -3.071 1.858 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.431 -3.855 1.443 1.00 0.00 H new ATOM 0 HG21 THR A 53 4.004 -5.227 2.831 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.280 -5.266 2.392 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.480 -6.069 1.353 1.00 0.00 H new ATOM 1846 N ARG A 54 3.977 -3.972 -1.839 1.00 0.00 N ATOM 1847 CA ARG A 54 4.628 -4.579 -3.039 1.00 0.00 C ATOM 1848 C ARG A 54 6.047 -4.025 -3.200 1.00 0.00 C ATOM 1849 O ARG A 54 6.376 -2.972 -2.691 1.00 0.00 O ATOM 1850 CB ARG A 54 3.795 -4.249 -4.289 1.00 0.00 C ATOM 1851 CG ARG A 54 4.094 -5.267 -5.408 1.00 0.00 C ATOM 1852 CD ARG A 54 3.264 -6.551 -5.198 1.00 0.00 C ATOM 1853 NE ARG A 54 4.089 -7.745 -5.564 1.00 0.00 N ATOM 1854 CZ ARG A 54 4.730 -7.805 -6.700 1.00 0.00 C ATOM 1855 NH1 ARG A 54 4.555 -6.886 -7.608 1.00 0.00 N ATOM 1856 NH2 ARG A 54 5.520 -8.814 -6.944 1.00 0.00 N ATOM 0 H ARG A 54 4.290 -3.027 -1.614 1.00 0.00 H new ATOM 0 HA ARG A 54 4.684 -5.660 -2.913 1.00 0.00 H new ATOM 0 HB2 ARG A 54 2.733 -4.268 -4.044 1.00 0.00 H new ATOM 0 HB3 ARG A 54 4.025 -3.241 -4.633 1.00 0.00 H new ATOM 0 HG2 ARG A 54 3.861 -4.830 -6.379 1.00 0.00 H new ATOM 0 HG3 ARG A 54 5.157 -5.509 -5.414 1.00 0.00 H new ATOM 0 HD2 ARG A 54 2.942 -6.623 -4.159 1.00 0.00 H new ATOM 0 HD3 ARG A 54 2.362 -6.518 -5.809 1.00 0.00 H new ATOM 0 HE ARG A 54 4.152 -8.528 -4.913 1.00 0.00 H new ATOM 0 HH11 ARG A 54 3.913 -6.112 -7.434 1.00 0.00 H new ATOM 0 HH12 ARG A 54 5.060 -6.940 -8.493 1.00 0.00 H new ATOM 0 HH21 ARG A 54 5.635 -9.552 -6.249 1.00 0.00 H new ATOM 0 HH22 ARG A 54 6.023 -8.865 -7.830 1.00 0.00 H new ATOM 1870 N ASN A 55 6.887 -4.729 -3.910 1.00 0.00 N ATOM 1871 CA ASN A 55 8.282 -4.246 -4.107 1.00 0.00 C ATOM 1872 C ASN A 55 8.248 -2.844 -4.717 1.00 0.00 C ATOM 1873 O ASN A 55 7.445 -2.549 -5.579 1.00 0.00 O ATOM 1874 CB ASN A 55 9.017 -5.198 -5.055 1.00 0.00 C ATOM 1875 CG ASN A 55 8.363 -5.144 -6.437 1.00 0.00 C ATOM 1876 OD1 ASN A 55 7.228 -4.727 -6.567 1.00 0.00 O ATOM 1877 ND2 ASN A 55 9.034 -5.546 -7.482 1.00 0.00 N ATOM 0 H ASN A 55 6.667 -5.617 -4.361 1.00 0.00 H new ATOM 0 HA ASN A 55 8.800 -4.214 -3.149 1.00 0.00 H new ATOM 0 HB2 ASN A 55 10.068 -4.918 -5.127 1.00 0.00 H new ATOM 0 HB3 ASN A 55 8.984 -6.215 -4.664 1.00 0.00 H new ATOM 0 HD21 ASN A 55 8.606 -5.510 -8.407 1.00 0.00 H new ATOM 0 HD22 ASN A 55 9.986 -5.896 -7.373 1.00 0.00 H new ATOM 1884 N ARG A 56 9.112 -1.977 -4.270 1.00 0.00 N ATOM 1885 CA ARG A 56 9.127 -0.587 -4.813 1.00 0.00 C ATOM 1886 C ARG A 56 9.512 -0.594 -6.292 1.00 0.00 C ATOM 1887 O ARG A 56 10.527 -1.135 -6.684 1.00 0.00 O ATOM 1888 CB ARG A 56 10.140 0.257 -4.020 1.00 0.00 C ATOM 1889 CG ARG A 56 9.502 0.708 -2.704 1.00 0.00 C ATOM 1890 CD ARG A 56 10.563 1.311 -1.786 1.00 0.00 C ATOM 1891 NE ARG A 56 11.318 2.365 -2.514 1.00 0.00 N ATOM 1892 CZ ARG A 56 12.063 3.203 -1.849 1.00 0.00 C ATOM 1893 NH1 ARG A 56 12.167 3.093 -0.552 1.00 0.00 N ATOM 1894 NH2 ARG A 56 12.708 4.146 -2.477 1.00 0.00 N ATOM 0 H ARG A 56 9.810 -2.169 -3.551 1.00 0.00 H new ATOM 0 HA ARG A 56 8.130 -0.158 -4.715 1.00 0.00 H new ATOM 0 HB2 ARG A 56 11.039 -0.326 -3.821 1.00 0.00 H new ATOM 0 HB3 ARG A 56 10.446 1.124 -4.605 1.00 0.00 H new ATOM 0 HG2 ARG A 56 8.721 1.443 -2.902 1.00 0.00 H new ATOM 0 HG3 ARG A 56 9.024 -0.140 -2.213 1.00 0.00 H new ATOM 0 HD2 ARG A 56 10.092 1.735 -0.899 1.00 0.00 H new ATOM 0 HD3 ARG A 56 11.245 0.533 -1.443 1.00 0.00 H new ATOM 0 HE ARG A 56 11.253 2.432 -3.530 1.00 0.00 H new ATOM 0 HH11 ARG A 56 11.666 2.352 -0.061 1.00 0.00 H new ATOM 0 HH12 ARG A 56 12.749 3.748 -0.030 1.00 0.00 H new ATOM 0 HH21 ARG A 56 12.630 4.229 -3.491 1.00 0.00 H new ATOM 0 HH22 ARG A 56 13.290 4.801 -1.955 1.00 0.00 H new ATOM 1908 N LYS A 57 8.703 0.021 -7.110 1.00 0.00 N ATOM 1909 CA LYS A 57 8.999 0.076 -8.564 1.00 0.00 C ATOM 1910 C LYS A 57 10.274 0.888 -8.793 1.00 0.00 C ATOM 1911 O LYS A 57 10.700 1.644 -7.942 1.00 0.00 O ATOM 1912 CB LYS A 57 7.831 0.722 -9.291 1.00 0.00 C ATOM 1913 CG LYS A 57 7.604 2.115 -8.733 1.00 0.00 C ATOM 1914 CD LYS A 57 6.353 2.697 -9.376 1.00 0.00 C ATOM 1915 CE LYS A 57 6.227 4.180 -9.022 1.00 0.00 C ATOM 1916 NZ LYS A 57 5.021 4.750 -9.688 1.00 0.00 N ATOM 0 H LYS A 57 7.843 0.491 -6.828 1.00 0.00 H new ATOM 0 HA LYS A 57 9.146 -0.933 -8.949 1.00 0.00 H new ATOM 0 HB2 LYS A 57 8.037 0.775 -10.360 1.00 0.00 H new ATOM 0 HB3 LYS A 57 6.932 0.118 -9.169 1.00 0.00 H new ATOM 0 HG2 LYS A 57 7.489 2.075 -7.650 1.00 0.00 H new ATOM 0 HG3 LYS A 57 8.466 2.750 -8.939 1.00 0.00 H new ATOM 0 HD2 LYS A 57 6.400 2.575 -10.458 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.471 2.156 -9.032 1.00 0.00 H new ATOM 0 HE2 LYS A 57 6.150 4.302 -7.942 1.00 0.00 H new ATOM 0 HE3 LYS A 57 7.120 4.718 -9.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 4.838 5.704 -9.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.183 4.802 -10.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 4.199 4.142 -9.498 1.00 0.00 H new ATOM 1930 N VAL A 58 10.895 0.728 -9.927 1.00 0.00 N ATOM 1931 CA VAL A 58 12.151 1.479 -10.205 1.00 0.00 C ATOM 1932 C VAL A 58 11.979 2.952 -9.821 1.00 0.00 C ATOM 1933 O VAL A 58 10.879 3.452 -9.683 1.00 0.00 O ATOM 1934 CB VAL A 58 12.480 1.374 -11.695 1.00 0.00 C ATOM 1935 CG1 VAL A 58 11.387 2.071 -12.507 1.00 0.00 C ATOM 1936 CG2 VAL A 58 13.831 2.043 -11.977 1.00 0.00 C ATOM 0 H VAL A 58 10.587 0.108 -10.676 1.00 0.00 H new ATOM 0 HA VAL A 58 12.963 1.053 -9.616 1.00 0.00 H new ATOM 0 HB VAL A 58 12.533 0.323 -11.979 1.00 0.00 H new ATOM 0 HG11 VAL A 58 11.620 1.997 -13.569 1.00 0.00 H new ATOM 0 HG12 VAL A 58 10.427 1.592 -12.312 1.00 0.00 H new ATOM 0 HG13 VAL A 58 11.334 3.121 -12.219 1.00 0.00 H new ATOM 0 HG21 VAL A 58 14.061 1.965 -13.040 1.00 0.00 H new ATOM 0 HG22 VAL A 58 13.783 3.094 -11.692 1.00 0.00 H new ATOM 0 HG23 VAL A 58 14.611 1.546 -11.400 1.00 0.00 H new ATOM 1946 N SER A 59 13.072 3.652 -9.684 1.00 0.00 N ATOM 1947 CA SER A 59 13.001 5.107 -9.347 1.00 0.00 C ATOM 1948 C SER A 59 13.017 5.901 -10.651 1.00 0.00 C ATOM 1949 O SER A 59 13.984 5.869 -11.387 1.00 0.00 O ATOM 1950 CB SER A 59 14.191 5.508 -8.476 1.00 0.00 C ATOM 1951 OG SER A 59 14.406 6.909 -8.597 1.00 0.00 O ATOM 0 H SER A 59 14.016 3.280 -9.791 1.00 0.00 H new ATOM 0 HA SER A 59 12.087 5.315 -8.790 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.001 5.245 -7.435 1.00 0.00 H new ATOM 0 HB3 SER A 59 15.083 4.963 -8.784 1.00 0.00 H new ATOM 0 HG SER A 59 15.167 7.172 -8.039 1.00 0.00 H new ATOM 1957 N SER A 60 11.951 6.601 -10.953 1.00 0.00 N ATOM 1958 CA SER A 60 11.894 7.392 -12.225 1.00 0.00 C ATOM 1959 C SER A 60 11.546 8.845 -11.914 1.00 0.00 C ATOM 1960 O SER A 60 10.446 9.157 -11.503 1.00 0.00 O ATOM 1961 CB SER A 60 10.813 6.806 -13.132 1.00 0.00 C ATOM 1962 OG SER A 60 10.845 7.470 -14.390 1.00 0.00 O ATOM 0 H SER A 60 11.114 6.660 -10.372 1.00 0.00 H new ATOM 0 HA SER A 60 12.864 7.348 -12.721 1.00 0.00 H new ATOM 0 HB2 SER A 60 10.976 5.737 -13.268 1.00 0.00 H new ATOM 0 HB3 SER A 60 9.832 6.923 -12.671 1.00 0.00 H new ATOM 0 HG SER A 60 10.482 8.375 -14.291 1.00 0.00 H new ATOM 1968 N LYS A 61 12.470 9.741 -12.119 1.00 0.00 N ATOM 1969 CA LYS A 61 12.184 11.175 -11.848 1.00 0.00 C ATOM 1970 C LYS A 61 11.189 11.683 -12.895 1.00 0.00 C ATOM 1971 O LYS A 61 10.311 12.469 -12.604 1.00 0.00 O ATOM 1972 CB LYS A 61 13.487 11.976 -11.918 1.00 0.00 C ATOM 1973 CG LYS A 61 14.377 11.581 -10.736 1.00 0.00 C ATOM 1974 CD LYS A 61 15.690 12.366 -10.779 1.00 0.00 C ATOM 1975 CE LYS A 61 16.564 11.944 -9.594 1.00 0.00 C ATOM 1976 NZ LYS A 61 17.751 12.840 -9.495 1.00 0.00 N ATOM 0 H LYS A 61 13.410 9.542 -12.462 1.00 0.00 H new ATOM 0 HA LYS A 61 11.755 11.294 -10.853 1.00 0.00 H new ATOM 0 HB2 LYS A 61 14.001 11.779 -12.859 1.00 0.00 H new ATOM 0 HB3 LYS A 61 13.274 13.045 -11.889 1.00 0.00 H new ATOM 0 HG2 LYS A 61 13.857 11.778 -9.798 1.00 0.00 H new ATOM 0 HG3 LYS A 61 14.583 10.511 -10.768 1.00 0.00 H new ATOM 0 HD2 LYS A 61 16.211 12.176 -11.717 1.00 0.00 H new ATOM 0 HD3 LYS A 61 15.490 13.437 -10.736 1.00 0.00 H new ATOM 0 HE2 LYS A 61 15.986 11.988 -8.671 1.00 0.00 H new ATOM 0 HE3 LYS A 61 16.887 10.910 -9.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 18.340 12.548 -8.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 18.308 12.777 -10.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 17.435 13.821 -9.356 1.00 0.00 H new ATOM 1990 N GLY A 62 11.320 11.222 -14.116 1.00 0.00 N ATOM 1991 CA GLY A 62 10.385 11.652 -15.205 1.00 0.00 C ATOM 1992 C GLY A 62 10.011 10.429 -16.047 1.00 0.00 C ATOM 1993 O GLY A 62 10.664 9.406 -15.985 1.00 0.00 O ATOM 0 H GLY A 62 12.040 10.561 -14.407 1.00 0.00 H new ATOM 0 HA2 GLY A 62 9.490 12.103 -14.777 1.00 0.00 H new ATOM 0 HA3 GLY A 62 10.857 12.410 -15.830 1.00 0.00 H new ATOM 1997 N LYS A 63 8.968 10.514 -16.829 1.00 0.00 N ATOM 1998 CA LYS A 63 8.578 9.337 -17.657 1.00 0.00 C ATOM 1999 C LYS A 63 9.726 8.974 -18.607 1.00 0.00 C ATOM 2000 O LYS A 63 10.011 7.815 -18.833 1.00 0.00 O ATOM 2001 CB LYS A 63 7.299 9.645 -18.449 1.00 0.00 C ATOM 2002 CG LYS A 63 7.596 10.666 -19.539 1.00 0.00 C ATOM 2003 CD LYS A 63 6.284 11.121 -20.187 1.00 0.00 C ATOM 2004 CE LYS A 63 6.588 11.880 -21.483 1.00 0.00 C ATOM 2005 NZ LYS A 63 7.838 12.675 -21.315 1.00 0.00 N ATOM 0 H LYS A 63 8.375 11.338 -16.930 1.00 0.00 H new ATOM 0 HA LYS A 63 8.378 8.488 -17.003 1.00 0.00 H new ATOM 0 HB2 LYS A 63 6.907 8.730 -18.893 1.00 0.00 H new ATOM 0 HB3 LYS A 63 6.530 10.029 -17.779 1.00 0.00 H new ATOM 0 HG2 LYS A 63 8.121 11.523 -19.116 1.00 0.00 H new ATOM 0 HG3 LYS A 63 8.253 10.229 -20.291 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.652 10.258 -20.398 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.730 11.761 -19.500 1.00 0.00 H new ATOM 0 HE2 LYS A 63 6.700 11.178 -22.310 1.00 0.00 H new ATOM 0 HE3 LYS A 63 5.757 12.539 -21.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.893 13.398 -22.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.832 13.138 -20.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 8.662 12.044 -21.383 1.00 0.00 H new ATOM 2019 N LYS A 64 10.388 9.955 -19.165 1.00 0.00 N ATOM 2020 CA LYS A 64 11.519 9.662 -20.098 1.00 0.00 C ATOM 2021 C LYS A 64 12.265 10.968 -20.399 1.00 0.00 C ATOM 2022 O LYS A 64 11.726 11.861 -21.022 1.00 0.00 O ATOM 2023 CB LYS A 64 10.952 9.060 -21.401 1.00 0.00 C ATOM 2024 CG LYS A 64 11.981 8.140 -22.083 1.00 0.00 C ATOM 2025 CD LYS A 64 13.087 8.974 -22.738 1.00 0.00 C ATOM 2026 CE LYS A 64 14.000 8.050 -23.549 1.00 0.00 C ATOM 2027 NZ LYS A 64 13.209 7.389 -24.626 1.00 0.00 N ATOM 0 H LYS A 64 10.195 10.945 -19.016 1.00 0.00 H new ATOM 0 HA LYS A 64 12.210 8.950 -19.647 1.00 0.00 H new ATOM 0 HB2 LYS A 64 10.046 8.496 -21.180 1.00 0.00 H new ATOM 0 HB3 LYS A 64 10.669 9.862 -22.083 1.00 0.00 H new ATOM 0 HG2 LYS A 64 12.415 7.461 -21.349 1.00 0.00 H new ATOM 0 HG3 LYS A 64 11.487 7.524 -22.834 1.00 0.00 H new ATOM 0 HD2 LYS A 64 12.651 9.734 -23.386 1.00 0.00 H new ATOM 0 HD3 LYS A 64 13.664 9.498 -21.976 1.00 0.00 H new ATOM 0 HE2 LYS A 64 14.820 8.622 -23.984 1.00 0.00 H new ATOM 0 HE3 LYS A 64 14.446 7.299 -22.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 13.839 7.134 -25.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 12.760 6.530 -24.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 12.475 8.042 -24.968 1.00 0.00 H new ATOM 2041 N ARG A 65 13.500 11.090 -19.963 1.00 0.00 N ATOM 2042 CA ARG A 65 14.279 12.343 -20.226 1.00 0.00 C ATOM 2043 C ARG A 65 15.378 12.070 -21.251 1.00 0.00 C ATOM 2044 O ARG A 65 16.161 11.152 -21.106 1.00 0.00 O ATOM 2045 CB ARG A 65 14.929 12.832 -18.930 1.00 0.00 C ATOM 2046 CG ARG A 65 15.558 14.204 -19.180 1.00 0.00 C ATOM 2047 CD ARG A 65 16.084 14.782 -17.867 1.00 0.00 C ATOM 2048 NE ARG A 65 17.314 14.051 -17.451 1.00 0.00 N ATOM 2049 CZ ARG A 65 18.090 14.558 -16.533 1.00 0.00 C ATOM 2050 NH1 ARG A 65 17.794 15.710 -15.996 1.00 0.00 N ATOM 2051 NH2 ARG A 65 19.161 13.918 -16.153 1.00 0.00 N ATOM 0 H ARG A 65 14.001 10.374 -19.436 1.00 0.00 H new ATOM 0 HA ARG A 65 13.597 13.102 -20.610 1.00 0.00 H new ATOM 0 HB2 ARG A 65 14.185 12.897 -18.136 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.688 12.124 -18.598 1.00 0.00 H new ATOM 0 HG2 ARG A 65 16.371 14.115 -19.900 1.00 0.00 H new ATOM 0 HG3 ARG A 65 14.820 14.878 -19.615 1.00 0.00 H new ATOM 0 HD2 ARG A 65 16.304 15.843 -17.988 1.00 0.00 H new ATOM 0 HD3 ARG A 65 15.322 14.701 -17.092 1.00 0.00 H new ATOM 0 HE ARG A 65 17.549 13.157 -17.883 1.00 0.00 H new ATOM 0 HH11 ARG A 65 16.958 16.212 -16.294 1.00 0.00 H new ATOM 0 HH12 ARG A 65 18.399 16.109 -15.278 1.00 0.00 H new ATOM 0 HH21 ARG A 65 19.394 13.019 -16.574 1.00 0.00 H new ATOM 0 HH22 ARG A 65 19.766 14.317 -15.435 1.00 0.00 H new ATOM 2065 N ARG A 66 15.452 12.869 -22.279 1.00 0.00 N ATOM 2066 CA ARG A 66 16.513 12.661 -23.302 1.00 0.00 C ATOM 2067 C ARG A 66 17.865 13.052 -22.705 1.00 0.00 C ATOM 2068 O ARG A 66 18.830 13.093 -23.449 1.00 0.00 O ATOM 2069 CB ARG A 66 16.222 13.528 -24.531 1.00 0.00 C ATOM 2070 CG ARG A 66 16.306 15.014 -24.154 1.00 0.00 C ATOM 2071 CD ARG A 66 15.772 15.880 -25.313 1.00 0.00 C ATOM 2072 NE ARG A 66 16.496 17.193 -25.364 1.00 0.00 N ATOM 2073 CZ ARG A 66 16.706 17.910 -24.287 1.00 0.00 C ATOM 2074 NH1 ARG A 66 16.167 17.582 -23.146 1.00 0.00 N ATOM 2075 NH2 ARG A 66 17.421 18.998 -24.371 1.00 0.00 N ATOM 2076 OXT ARG A 66 17.912 13.305 -21.511 1.00 0.00 O ATOM 0 H ARG A 66 14.825 13.655 -22.454 1.00 0.00 H new ATOM 0 HA ARG A 66 16.533 11.613 -23.602 1.00 0.00 H new ATOM 0 HB2 ARG A 66 16.937 13.304 -25.323 1.00 0.00 H new ATOM 0 HB3 ARG A 66 15.231 13.299 -24.922 1.00 0.00 H new ATOM 0 HG2 ARG A 66 15.726 15.202 -23.251 1.00 0.00 H new ATOM 0 HG3 ARG A 66 17.338 15.284 -23.932 1.00 0.00 H new ATOM 0 HD2 ARG A 66 15.898 15.351 -26.258 1.00 0.00 H new ATOM 0 HD3 ARG A 66 14.703 16.052 -25.184 1.00 0.00 H new ATOM 0 HE ARG A 66 16.834 17.538 -26.262 1.00 0.00 H new ATOM 0 HH11 ARG A 66 15.572 16.756 -23.082 1.00 0.00 H new ATOM 0 HH12 ARG A 66 16.341 18.151 -22.318 1.00 0.00 H new ATOM 0 HH21 ARG A 66 17.811 19.284 -25.269 1.00 0.00 H new ATOM 0 HH22 ARG A 66 17.590 19.563 -23.539 1.00 0.00 H new TER 2090 ARG A 66 HETATM 2091 ZN ZN A 67 -11.898 2.655 1.994 1.00 0.00 ZN