USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=34 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 -170:sc= 0.154 USER MOD Set 1.2: A 29 ASN : amide:sc= -5.04! C(o=-5.7!,f=-8.1!) USER MOD Set 1.3: C 125 DT C7 :methyl -30:sc= -0.837 (180deg=-1.23) USER MOD Single : A 1 LYS N :NH3+ -166:sc= -0.258 (180deg=-0.679) USER MOD Single : A 1 LYS NZ :NH3+ 148:sc= -0.0881 (180deg=-0.827) USER MOD Single : A 5 THR OG1 : rot 43:sc= -1.61! USER MOD Single : A 8 SER OG : rot 81:sc= 0.594 USER MOD Single : A 9 ASN : amide:sc= -3.22! C(o=-3.2!,f=-2.6!) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 60:sc= 0.538 USER MOD Single : A 15 THR OG1 : rot -137:sc= 1.1 USER MOD Single : A 21 SER OG : rot 160:sc= 0.486 USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 150:sc= -1.42 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= -0.979 (180deg=-0.979) USER MOD Single : A 38 HIS : no HE2:sc= -6.33! C(o=-6.3!,f=-10!) USER MOD Single : A 39 GLN : amide:sc= -0.0663 K(o=-0.066,f=-2.2!) USER MOD Single : A 41 ASN : amide:sc= -1.43 X(o=-1.4,f=-1.3!) USER MOD Single : A 45 THR OG1 : rot 11:sc= 0.541! USER MOD Single : A 46 MET CE :methyl 166:sc= 0 (180deg=-0.12) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.172 USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 57 LYS NZ :NH3+ 160:sc= -0.082 (180deg=-0.497) USER MOD Single : A 59 SER OG : rot 18:sc= 0.321! USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -126:sc= -0.853 (180deg=-2.91!) USER MOD Single : A 63 LYS NZ :NH3+ -148:sc= -0.286 (180deg=-1.27!) USER MOD Single : A 64 LYS NZ :NH3+ 146:sc= -0.15 (180deg=-0.895) USER MOD Single : B 101 DG O5' : rot 180:sc= -0.4 USER MOD Single : B 102 DT C7 :methyl -30:sc= -0.603 (180deg=-1.72!) USER MOD Single : B 103 DT C7 :methyl -30:sc= -1.39! (180deg=-1.85!) USER MOD Single : B 109 DT C7 :methyl -30:sc= -0.712 (180deg=-1.22) USER MOD Single : B 115 DT C7 :methyl -30:sc= -0.188 (180deg=-0.292) USER MOD Single : B 116 DT C7 :methyl 150:sc= -0.777 (180deg=-0.777) USER MOD Single : B 116 DT O3' : rot 180:sc= 0 USER MOD Single : C 117 DA O5' : rot 30:sc= 0.0591 USER MOD Single : C 119 DT C7 :methyl -30:sc= -0.564 (180deg=-1.34!) USER MOD Single : C 121 DT C7 :methyl 150:sc= -0.153 (180deg=-0.153) USER MOD Single : C 122 DT C7 :methyl 150:sc= -0.928 (180deg=-0.928) USER MOD Single : C 123 DT C7 :methyl -30:sc= -1.15 (180deg=-3.4!) USER MOD Single : C 127 DT C7 :methyl -30:sc= -1.52 (180deg=-1.56!) USER MOD Single : C 132 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG B 101 18.472 25.494 5.024 1.00 0.00 O ATOM 2 C5' DG B 101 19.145 25.264 6.264 1.00 0.00 C ATOM 3 C4' DG B 101 18.310 24.387 7.205 1.00 0.00 C ATOM 4 O4' DG B 101 17.156 25.123 7.682 1.00 0.00 O ATOM 5 C3' DG B 101 17.803 23.119 6.505 1.00 0.00 C ATOM 6 O3' DG B 101 18.075 21.960 7.304 1.00 0.00 O ATOM 7 C2' DG B 101 16.314 23.309 6.355 1.00 0.00 C ATOM 8 C1' DG B 101 15.934 24.520 7.199 1.00 0.00 C ATOM 9 N9 DG B 101 15.146 25.489 6.409 1.00 0.00 N ATOM 10 C8 DG B 101 15.439 26.051 5.199 1.00 0.00 C ATOM 11 N7 DG B 101 14.545 26.875 4.740 1.00 0.00 N ATOM 12 C5 DG B 101 13.565 26.867 5.731 1.00 0.00 C ATOM 13 C6 DG B 101 12.334 27.575 5.796 1.00 0.00 C ATOM 14 O6 DG B 101 11.858 28.355 4.974 1.00 0.00 O ATOM 15 N1 DG B 101 11.642 27.285 6.964 1.00 0.00 N ATOM 16 C2 DG B 101 12.074 26.424 7.950 1.00 0.00 C ATOM 17 N2 DG B 101 11.266 26.285 9.002 1.00 0.00 N ATOM 18 N3 DG B 101 13.231 25.754 7.893 1.00 0.00 N ATOM 19 C4 DG B 101 13.925 26.023 6.759 1.00 0.00 C ATOM 0 H5' DG B 101 19.356 26.218 6.747 1.00 0.00 H new ATOM 0 H5'' DG B 101 20.105 24.784 6.074 1.00 0.00 H new ATOM 0 H4' DG B 101 18.960 24.104 8.033 1.00 0.00 H new ATOM 0 H3' DG B 101 18.294 22.968 5.544 1.00 0.00 H new ATOM 0 H2' DG B 101 16.049 23.468 5.310 1.00 0.00 H new ATOM 0 H2'' DG B 101 15.776 22.422 6.689 1.00 0.00 H new ATOM 0 HO5' DG B 101 19.030 26.057 4.448 1.00 0.00 H new ATOM 0 H1' DG B 101 15.310 24.211 8.037 1.00 0.00 H new ATOM 0 H8 DG B 101 16.349 25.827 4.662 1.00 0.00 H new ATOM 0 H1 DG B 101 10.743 27.746 7.104 1.00 0.00 H new ATOM 0 H21 DG B 101 11.527 25.663 9.767 1.00 0.00 H new ATOM 0 H22 DG B 101 10.387 26.801 9.042 1.00 0.00 H new ATOM 32 P DT B 102 17.647 20.487 6.802 1.00 0.00 P ATOM 33 OP1 DT B 102 18.652 19.523 7.305 1.00 0.00 O ATOM 34 OP2 DT B 102 17.360 20.559 5.353 1.00 0.00 O ATOM 35 O5' DT B 102 16.255 20.209 7.578 1.00 0.00 O ATOM 36 C5' DT B 102 16.211 20.204 9.009 1.00 0.00 C ATOM 37 C4' DT B 102 14.802 19.921 9.559 1.00 0.00 C ATOM 38 O4' DT B 102 13.919 21.047 9.319 1.00 0.00 O ATOM 39 C3' DT B 102 14.156 18.681 8.923 1.00 0.00 C ATOM 40 O3' DT B 102 13.856 17.700 9.926 1.00 0.00 O ATOM 41 C2' DT B 102 12.880 19.167 8.281 1.00 0.00 C ATOM 42 C1' DT B 102 12.660 20.591 8.766 1.00 0.00 C ATOM 43 N1 DT B 102 12.196 21.491 7.669 1.00 0.00 N ATOM 44 C2 DT B 102 10.968 22.132 7.813 1.00 0.00 C ATOM 45 O2 DT B 102 10.256 21.963 8.802 1.00 0.00 O ATOM 46 N3 DT B 102 10.592 22.974 6.781 1.00 0.00 N ATOM 47 C4 DT B 102 11.320 23.225 5.631 1.00 0.00 C ATOM 48 O4 DT B 102 10.889 23.988 4.771 1.00 0.00 O ATOM 49 C5 DT B 102 12.579 22.515 5.563 1.00 0.00 C ATOM 50 C7 DT B 102 13.468 22.706 4.328 1.00 0.00 C ATOM 51 C6 DT B 102 12.968 21.689 6.565 1.00 0.00 C ATOM 0 H5' DT B 102 16.555 21.168 9.382 1.00 0.00 H new ATOM 0 H5'' DT B 102 16.902 19.451 9.387 1.00 0.00 H new ATOM 0 H4' DT B 102 14.931 19.747 10.627 1.00 0.00 H new ATOM 0 H3' DT B 102 14.823 18.212 8.200 1.00 0.00 H new ATOM 0 H2' DT B 102 12.958 19.136 7.194 1.00 0.00 H new ATOM 0 H2'' DT B 102 12.040 18.530 8.559 1.00 0.00 H new ATOM 0 H1' DT B 102 11.872 20.612 9.519 1.00 0.00 H new ATOM 0 H3 DT B 102 9.697 23.453 6.877 1.00 0.00 H new ATOM 0 H71 DT B 102 12.844 22.916 3.459 1.00 0.00 H new ATOM 0 H72 DT B 102 14.149 23.540 4.495 1.00 0.00 H new ATOM 0 H73 DT B 102 14.044 21.798 4.150 1.00 0.00 H new ATOM 0 H6 DT B 102 13.914 21.175 6.486 1.00 0.00 H new ATOM 64 P DT B 103 13.169 16.289 9.539 1.00 0.00 P ATOM 65 OP1 DT B 103 13.522 15.300 10.580 1.00 0.00 O ATOM 66 OP2 DT B 103 13.464 16.004 8.118 1.00 0.00 O ATOM 67 O5' DT B 103 11.591 16.615 9.671 1.00 0.00 O ATOM 68 C5' DT B 103 11.060 17.047 10.928 1.00 0.00 C ATOM 69 C4' DT B 103 9.551 17.325 10.881 1.00 0.00 C ATOM 70 O4' DT B 103 9.285 18.519 10.111 1.00 0.00 O ATOM 71 C3' DT B 103 8.745 16.174 10.262 1.00 0.00 C ATOM 72 O3' DT B 103 7.793 15.694 11.210 1.00 0.00 O ATOM 73 C2' DT B 103 8.016 16.774 9.080 1.00 0.00 C ATOM 74 C1' DT B 103 8.213 18.286 9.175 1.00 0.00 C ATOM 75 N1 DT B 103 8.531 18.883 7.850 1.00 0.00 N ATOM 76 C2 DT B 103 7.681 19.856 7.342 1.00 0.00 C ATOM 77 O2 DT B 103 6.670 20.216 7.939 1.00 0.00 O ATOM 78 N3 DT B 103 8.037 20.394 6.120 1.00 0.00 N ATOM 79 C4 DT B 103 9.146 20.048 5.371 1.00 0.00 C ATOM 80 O4 DT B 103 9.372 20.593 4.296 1.00 0.00 O ATOM 81 C5 DT B 103 9.968 19.027 5.970 1.00 0.00 C ATOM 82 C7 DT B 103 11.207 18.540 5.211 1.00 0.00 C ATOM 83 C6 DT B 103 9.643 18.489 7.169 1.00 0.00 C ATOM 0 H5' DT B 103 11.580 17.951 11.244 1.00 0.00 H new ATOM 0 H5'' DT B 103 11.260 16.285 11.681 1.00 0.00 H new ATOM 0 H4' DT B 103 9.237 17.445 11.918 1.00 0.00 H new ATOM 0 H3' DT B 103 9.386 15.343 9.968 1.00 0.00 H new ATOM 0 H2' DT B 103 8.414 16.389 8.141 1.00 0.00 H new ATOM 0 H2'' DT B 103 6.957 16.518 9.106 1.00 0.00 H new ATOM 0 H1' DT B 103 7.292 18.761 9.513 1.00 0.00 H new ATOM 0 H3 DT B 103 7.425 21.113 5.735 1.00 0.00 H new ATOM 0 H71 DT B 103 11.034 18.626 4.138 1.00 0.00 H new ATOM 0 H72 DT B 103 12.067 19.149 5.490 1.00 0.00 H new ATOM 0 H73 DT B 103 11.403 17.498 5.464 1.00 0.00 H new ATOM 0 H6 DT B 103 10.281 17.729 7.596 1.00 0.00 H new ATOM 96 P DG B 104 6.849 14.423 10.909 1.00 0.00 P ATOM 97 OP1 DG B 104 6.430 13.842 12.204 1.00 0.00 O ATOM 98 OP2 DG B 104 7.524 13.572 9.904 1.00 0.00 O ATOM 99 O5' DG B 104 5.556 15.094 10.218 1.00 0.00 O ATOM 100 C5' DG B 104 4.783 16.061 10.930 1.00 0.00 C ATOM 101 C4' DG B 104 3.595 16.583 10.110 1.00 0.00 C ATOM 102 O4' DG B 104 4.067 17.391 8.994 1.00 0.00 O ATOM 103 C3' DG B 104 2.759 15.436 9.530 1.00 0.00 C ATOM 104 O3' DG B 104 1.371 15.653 9.818 1.00 0.00 O ATOM 105 C2' DG B 104 2.983 15.485 8.040 1.00 0.00 C ATOM 106 C1' DG B 104 3.616 16.831 7.735 1.00 0.00 C ATOM 107 N9 DG B 104 4.728 16.705 6.761 1.00 0.00 N ATOM 108 C8 DG B 104 5.804 15.863 6.780 1.00 0.00 C ATOM 109 N7 DG B 104 6.629 15.995 5.783 1.00 0.00 N ATOM 110 C5 DG B 104 6.057 17.014 5.024 1.00 0.00 C ATOM 111 C6 DG B 104 6.501 17.602 3.804 1.00 0.00 C ATOM 112 O6 DG B 104 7.509 17.340 3.150 1.00 0.00 O ATOM 113 N1 DG B 104 5.632 18.594 3.373 1.00 0.00 N ATOM 114 C2 DG B 104 4.481 18.980 4.025 1.00 0.00 C ATOM 115 N2 DG B 104 3.782 19.963 3.454 1.00 0.00 N ATOM 116 N3 DG B 104 4.059 18.431 5.172 1.00 0.00 N ATOM 117 C4 DG B 104 4.893 17.458 5.613 1.00 0.00 C ATOM 0 H5' DG B 104 5.423 16.898 11.210 1.00 0.00 H new ATOM 0 H5'' DG B 104 4.415 15.617 11.855 1.00 0.00 H new ATOM 0 H4' DG B 104 2.981 17.176 10.788 1.00 0.00 H new ATOM 0 H3' DG B 104 3.042 14.472 9.953 1.00 0.00 H new ATOM 0 H2' DG B 104 3.633 14.671 7.720 1.00 0.00 H new ATOM 0 H2'' DG B 104 2.041 15.370 7.504 1.00 0.00 H new ATOM 0 H1' DG B 104 2.887 17.493 7.268 1.00 0.00 H new ATOM 0 H8 DG B 104 5.958 15.139 7.567 1.00 0.00 H new ATOM 0 H1 DG B 104 5.864 19.076 2.504 1.00 0.00 H new ATOM 0 H21 DG B 104 2.920 20.294 3.887 1.00 0.00 H new ATOM 0 H22 DG B 104 4.110 20.383 2.584 1.00 0.00 H new ATOM 129 P DC B 105 0.237 14.610 9.334 1.00 0.00 P ATOM 130 OP1 DC B 105 -0.929 14.760 10.234 1.00 0.00 O ATOM 131 OP2 DC B 105 0.868 13.283 9.165 1.00 0.00 O ATOM 132 O5' DC B 105 -0.185 15.161 7.876 1.00 0.00 O ATOM 133 C5' DC B 105 -0.727 16.475 7.739 1.00 0.00 C ATOM 134 C4' DC B 105 -1.069 16.824 6.284 1.00 0.00 C ATOM 135 O4' DC B 105 0.136 17.008 5.500 1.00 0.00 O ATOM 136 C3' DC B 105 -1.909 15.736 5.603 1.00 0.00 C ATOM 137 O3' DC B 105 -3.077 16.338 5.042 1.00 0.00 O ATOM 138 C2' DC B 105 -1.037 15.171 4.508 1.00 0.00 C ATOM 139 C1' DC B 105 0.103 16.168 4.321 1.00 0.00 C ATOM 140 N1 DC B 105 1.432 15.519 4.100 1.00 0.00 N ATOM 141 C2 DC B 105 2.182 15.921 2.996 1.00 0.00 C ATOM 142 O2 DC B 105 1.718 16.740 2.206 1.00 0.00 O ATOM 143 N3 DC B 105 3.423 15.393 2.823 1.00 0.00 N ATOM 144 C4 DC B 105 3.921 14.507 3.693 1.00 0.00 C ATOM 145 N4 DC B 105 5.139 14.006 3.490 1.00 0.00 N ATOM 146 C5 DC B 105 3.160 14.087 4.828 1.00 0.00 C ATOM 147 C6 DC B 105 1.929 14.615 4.988 1.00 0.00 C ATOM 0 H5' DC B 105 -0.011 17.201 8.124 1.00 0.00 H new ATOM 0 H5'' DC B 105 -1.626 16.559 8.350 1.00 0.00 H new ATOM 0 H4' DC B 105 -1.647 17.747 6.326 1.00 0.00 H new ATOM 0 H3' DC B 105 -2.226 14.957 6.297 1.00 0.00 H new ATOM 0 H2' DC B 105 -0.654 14.188 4.782 1.00 0.00 H new ATOM 0 H2'' DC B 105 -1.602 15.047 3.584 1.00 0.00 H new ATOM 0 H1' DC B 105 -0.085 16.749 3.418 1.00 0.00 H new ATOM 0 H41 DC B 105 5.528 13.330 4.147 1.00 0.00 H new ATOM 0 H42 DC B 105 5.682 14.299 2.678 1.00 0.00 H new ATOM 0 H5 DC B 105 3.557 13.372 5.533 1.00 0.00 H new ATOM 0 H6 DC B 105 1.328 14.316 5.834 1.00 0.00 H new ATOM 159 P DA B 106 -4.195 15.496 4.245 1.00 0.00 P ATOM 160 OP1 DA B 106 -5.517 16.102 4.523 1.00 0.00 O ATOM 161 OP2 DA B 106 -3.972 14.058 4.516 1.00 0.00 O ATOM 162 O5' DA B 106 -3.827 15.779 2.699 1.00 0.00 O ATOM 163 C5' DA B 106 -3.844 17.126 2.216 1.00 0.00 C ATOM 164 C4' DA B 106 -3.500 17.239 0.724 1.00 0.00 C ATOM 165 O4' DA B 106 -2.097 16.944 0.486 1.00 0.00 O ATOM 166 C3' DA B 106 -4.331 16.275 -0.127 1.00 0.00 C ATOM 167 O3' DA B 106 -4.964 17.001 -1.176 1.00 0.00 O ATOM 168 C2' DA B 106 -3.348 15.293 -0.723 1.00 0.00 C ATOM 169 C1' DA B 106 -1.956 15.844 -0.448 1.00 0.00 C ATOM 170 N9 DA B 106 -1.078 14.807 0.106 1.00 0.00 N ATOM 171 C8 DA B 106 -1.284 14.062 1.202 1.00 0.00 C ATOM 172 N7 DA B 106 -0.308 13.276 1.541 1.00 0.00 N ATOM 173 C5 DA B 106 0.639 13.517 0.549 1.00 0.00 C ATOM 174 C6 DA B 106 1.914 12.993 0.307 1.00 0.00 C ATOM 175 N6 DA B 106 2.483 12.066 1.078 1.00 0.00 N ATOM 176 N1 DA B 106 2.573 13.451 -0.769 1.00 0.00 N ATOM 177 C2 DA B 106 2.015 14.364 -1.562 1.00 0.00 C ATOM 178 N3 DA B 106 0.817 14.928 -1.423 1.00 0.00 N ATOM 179 C4 DA B 106 0.177 14.451 -0.335 1.00 0.00 C ATOM 0 H5' DA B 106 -3.134 17.720 2.792 1.00 0.00 H new ATOM 0 H5'' DA B 106 -4.832 17.554 2.388 1.00 0.00 H new ATOM 0 H4' DA B 106 -3.725 18.266 0.438 1.00 0.00 H new ATOM 0 H3' DA B 106 -5.098 15.773 0.462 1.00 0.00 H new ATOM 0 H2' DA B 106 -3.468 14.306 -0.276 1.00 0.00 H new ATOM 0 H2'' DA B 106 -3.515 15.181 -1.794 1.00 0.00 H new ATOM 0 H1' DA B 106 -1.500 16.186 -1.377 1.00 0.00 H new ATOM 0 H8 DA B 106 -2.203 14.113 1.767 1.00 0.00 H new ATOM 0 H61 DA B 106 3.416 11.719 0.855 1.00 0.00 H new ATOM 0 H62 DA B 106 1.985 11.704 1.891 1.00 0.00 H new ATOM 0 H2 DA B 106 2.599 14.682 -2.413 1.00 0.00 H new ATOM 191 P DG B 107 -5.910 16.274 -2.248 1.00 0.00 P ATOM 192 OP1 DG B 107 -6.829 17.282 -2.825 1.00 0.00 O ATOM 193 OP2 DG B 107 -6.446 15.035 -1.641 1.00 0.00 O ATOM 194 O5' DG B 107 -4.826 15.876 -3.361 1.00 0.00 O ATOM 195 C5' DG B 107 -4.069 16.902 -3.995 1.00 0.00 C ATOM 196 C4' DG B 107 -3.033 16.339 -4.967 1.00 0.00 C ATOM 197 O4' DG B 107 -1.958 15.672 -4.251 1.00 0.00 O ATOM 198 C3' DG B 107 -3.641 15.323 -5.938 1.00 0.00 C ATOM 199 O3' DG B 107 -3.453 15.795 -7.282 1.00 0.00 O ATOM 200 C2' DG B 107 -2.887 14.036 -5.703 1.00 0.00 C ATOM 201 C1' DG B 107 -1.667 14.402 -4.880 1.00 0.00 C ATOM 202 N9 DG B 107 -1.318 13.347 -3.888 1.00 0.00 N ATOM 203 C8 DG B 107 -2.045 12.836 -2.839 1.00 0.00 C ATOM 204 N7 DG B 107 -1.448 11.927 -2.150 1.00 0.00 N ATOM 205 C5 DG B 107 -0.218 11.799 -2.768 1.00 0.00 C ATOM 206 C6 DG B 107 0.860 10.945 -2.443 1.00 0.00 C ATOM 207 O6 DG B 107 0.924 10.124 -1.536 1.00 0.00 O ATOM 208 N1 DG B 107 1.925 11.116 -3.313 1.00 0.00 N ATOM 209 C2 DG B 107 1.949 12.003 -4.368 1.00 0.00 C ATOM 210 N2 DG B 107 3.066 12.017 -5.096 1.00 0.00 N ATOM 211 N3 DG B 107 0.929 12.816 -4.678 1.00 0.00 N ATOM 212 C4 DG B 107 -0.121 12.660 -3.836 1.00 0.00 C ATOM 0 H5' DG B 107 -3.565 17.501 -3.236 1.00 0.00 H new ATOM 0 H5'' DG B 107 -4.743 17.569 -4.532 1.00 0.00 H new ATOM 0 H4' DG B 107 -2.653 17.193 -5.527 1.00 0.00 H new ATOM 0 H3' DG B 107 -4.711 15.178 -5.786 1.00 0.00 H new ATOM 0 H2' DG B 107 -3.508 13.312 -5.176 1.00 0.00 H new ATOM 0 H2'' DG B 107 -2.595 13.578 -6.648 1.00 0.00 H new ATOM 0 H1' DG B 107 -0.786 14.484 -5.517 1.00 0.00 H new ATOM 0 H8 DG B 107 -3.045 13.173 -2.609 1.00 0.00 H new ATOM 0 H1 DG B 107 2.754 10.542 -3.161 1.00 0.00 H new ATOM 0 H21 DG B 107 3.149 12.650 -5.891 1.00 0.00 H new ATOM 0 H22 DG B 107 3.838 11.394 -4.858 1.00 0.00 H new ATOM 224 P DA B 108 -3.970 14.973 -8.568 1.00 0.00 P ATOM 225 OP1 DA B 108 -4.388 15.951 -9.598 1.00 0.00 O ATOM 226 OP2 DA B 108 -4.921 13.935 -8.108 1.00 0.00 O ATOM 227 O5' DA B 108 -2.626 14.244 -9.082 1.00 0.00 O ATOM 228 C5' DA B 108 -1.499 15.039 -9.473 1.00 0.00 C ATOM 229 C4' DA B 108 -0.303 14.192 -9.935 1.00 0.00 C ATOM 230 O4' DA B 108 0.291 13.504 -8.804 1.00 0.00 O ATOM 231 C3' DA B 108 -0.696 13.137 -10.978 1.00 0.00 C ATOM 232 O3' DA B 108 0.113 13.268 -12.153 1.00 0.00 O ATOM 233 C2' DA B 108 -0.436 11.805 -10.324 1.00 0.00 C ATOM 234 C1' DA B 108 0.374 12.087 -9.068 1.00 0.00 C ATOM 235 N9 DA B 108 -0.129 11.292 -7.931 1.00 0.00 N ATOM 236 C8 DA B 108 -1.404 11.192 -7.446 1.00 0.00 C ATOM 237 N7 DA B 108 -1.569 10.315 -6.513 1.00 0.00 N ATOM 238 C5 DA B 108 -0.296 9.788 -6.350 1.00 0.00 C ATOM 239 C6 DA B 108 0.198 8.808 -5.506 1.00 0.00 C ATOM 240 N6 DA B 108 -0.584 8.121 -4.698 1.00 0.00 N ATOM 241 N1 DA B 108 1.507 8.520 -5.574 1.00 0.00 N ATOM 242 C2 DA B 108 2.286 9.166 -6.440 1.00 0.00 C ATOM 243 N3 DA B 108 1.914 10.113 -7.303 1.00 0.00 N ATOM 244 C4 DA B 108 0.592 10.376 -7.198 1.00 0.00 C ATOM 0 H5' DA B 108 -1.193 15.664 -8.634 1.00 0.00 H new ATOM 0 H5'' DA B 108 -1.796 15.710 -10.279 1.00 0.00 H new ATOM 0 H4' DA B 108 0.406 14.884 -10.389 1.00 0.00 H new ATOM 0 H3' DA B 108 -1.736 13.247 -11.285 1.00 0.00 H new ATOM 0 H2' DA B 108 -1.373 11.306 -10.077 1.00 0.00 H new ATOM 0 H2'' DA B 108 0.110 11.143 -10.997 1.00 0.00 H new ATOM 0 H1' DA B 108 1.416 11.799 -9.211 1.00 0.00 H new ATOM 0 H8 DA B 108 -2.214 11.803 -7.817 1.00 0.00 H new ATOM 0 H61 DA B 108 -0.186 7.406 -4.089 1.00 0.00 H new ATOM 0 H62 DA B 108 -1.587 8.304 -4.681 1.00 0.00 H new ATOM 0 H2 DA B 108 3.331 8.894 -6.444 1.00 0.00 H new ATOM 256 P DT B 109 -0.084 12.284 -13.415 1.00 0.00 P ATOM 257 OP1 DT B 109 0.290 13.023 -14.642 1.00 0.00 O ATOM 258 OP2 DT B 109 -1.425 11.662 -13.313 1.00 0.00 O ATOM 259 O5' DT B 109 1.024 11.133 -13.164 1.00 0.00 O ATOM 260 C5' DT B 109 2.408 11.489 -13.091 1.00 0.00 C ATOM 261 C4' DT B 109 3.331 10.284 -12.849 1.00 0.00 C ATOM 262 O4' DT B 109 3.183 9.777 -11.497 1.00 0.00 O ATOM 263 C3' DT B 109 3.046 9.131 -13.824 1.00 0.00 C ATOM 264 O3' DT B 109 4.213 8.855 -14.599 1.00 0.00 O ATOM 265 C2' DT B 109 2.729 7.934 -12.952 1.00 0.00 C ATOM 266 C1' DT B 109 3.059 8.339 -11.519 1.00 0.00 C ATOM 267 N1 DT B 109 2.019 7.873 -10.561 1.00 0.00 N ATOM 268 C2 DT B 109 2.394 7.011 -9.534 1.00 0.00 C ATOM 269 O2 DT B 109 3.551 6.612 -9.404 1.00 0.00 O ATOM 270 N3 DT B 109 1.388 6.627 -8.664 1.00 0.00 N ATOM 271 C4 DT B 109 0.065 7.024 -8.727 1.00 0.00 C ATOM 272 O4 DT B 109 -0.747 6.620 -7.904 1.00 0.00 O ATOM 273 C5 DT B 109 -0.232 7.916 -9.821 1.00 0.00 C ATOM 274 C7 DT B 109 -1.668 8.414 -10.004 1.00 0.00 C ATOM 275 C6 DT B 109 0.734 8.305 -10.682 1.00 0.00 C ATOM 0 H5' DT B 109 2.548 12.213 -12.288 1.00 0.00 H new ATOM 0 H5'' DT B 109 2.699 11.981 -14.019 1.00 0.00 H new ATOM 0 H4' DT B 109 4.347 10.645 -13.009 1.00 0.00 H new ATOM 0 H3' DT B 109 2.232 9.370 -14.509 1.00 0.00 H new ATOM 0 H2' DT B 109 1.679 7.655 -13.044 1.00 0.00 H new ATOM 0 H2'' DT B 109 3.317 7.067 -13.255 1.00 0.00 H new ATOM 0 H1' DT B 109 3.991 7.870 -11.203 1.00 0.00 H new ATOM 0 H3 DT B 109 1.646 5.993 -7.908 1.00 0.00 H new ATOM 0 H71 DT B 109 -2.364 7.660 -9.636 1.00 0.00 H new ATOM 0 H72 DT B 109 -1.806 9.339 -9.445 1.00 0.00 H new ATOM 0 H73 DT B 109 -1.857 8.597 -11.062 1.00 0.00 H new ATOM 0 H6 DT B 109 0.480 8.977 -11.488 1.00 0.00 H new ATOM 288 P DA B 110 4.187 7.823 -15.836 1.00 0.00 P ATOM 289 OP1 DA B 110 5.300 8.162 -16.748 1.00 0.00 O ATOM 290 OP2 DA B 110 2.801 7.750 -16.352 1.00 0.00 O ATOM 291 O5' DA B 110 4.531 6.429 -15.115 1.00 0.00 O ATOM 292 C5' DA B 110 5.767 6.280 -14.420 1.00 0.00 C ATOM 293 C4' DA B 110 5.913 4.896 -13.790 1.00 0.00 C ATOM 294 O4' DA B 110 4.955 4.750 -12.707 1.00 0.00 O ATOM 295 C3' DA B 110 5.643 3.765 -14.784 1.00 0.00 C ATOM 296 O3' DA B 110 6.674 2.780 -14.655 1.00 0.00 O ATOM 297 C2' DA B 110 4.310 3.182 -14.393 1.00 0.00 C ATOM 298 C1' DA B 110 4.024 3.669 -12.979 1.00 0.00 C ATOM 299 N9 DA B 110 2.616 4.116 -12.829 1.00 0.00 N ATOM 300 C8 DA B 110 1.876 4.953 -13.620 1.00 0.00 C ATOM 301 N7 DA B 110 0.650 5.145 -13.228 1.00 0.00 N ATOM 302 C5 DA B 110 0.561 4.368 -12.075 1.00 0.00 C ATOM 303 C6 DA B 110 -0.483 4.131 -11.167 1.00 0.00 C ATOM 304 N6 DA B 110 -1.688 4.692 -11.276 1.00 0.00 N ATOM 305 N1 DA B 110 -0.232 3.308 -10.133 1.00 0.00 N ATOM 306 C2 DA B 110 0.972 2.753 -9.997 1.00 0.00 C ATOM 307 N3 DA B 110 2.026 2.908 -10.797 1.00 0.00 N ATOM 308 C4 DA B 110 1.748 3.737 -11.825 1.00 0.00 C ATOM 0 H5' DA B 110 5.838 7.040 -13.642 1.00 0.00 H new ATOM 0 H5'' DA B 110 6.593 6.452 -15.110 1.00 0.00 H new ATOM 0 H4' DA B 110 6.943 4.823 -13.440 1.00 0.00 H new ATOM 0 H3' DA B 110 5.631 4.112 -15.817 1.00 0.00 H new ATOM 0 H2' DA B 110 3.528 3.505 -15.080 1.00 0.00 H new ATOM 0 H2'' DA B 110 4.337 2.093 -14.430 1.00 0.00 H new ATOM 0 H1' DA B 110 4.157 2.858 -12.263 1.00 0.00 H new ATOM 0 H8 DA B 110 2.280 5.420 -14.506 1.00 0.00 H new ATOM 0 H61 DA B 110 -2.411 4.485 -10.587 1.00 0.00 H new ATOM 0 H62 DA B 110 -1.886 5.328 -12.048 1.00 0.00 H new ATOM 0 H2 DA B 110 1.108 2.106 -9.143 1.00 0.00 H new ATOM 320 P DA B 111 6.707 1.444 -15.553 1.00 0.00 P ATOM 321 OP1 DA B 111 8.121 1.083 -15.799 1.00 0.00 O ATOM 322 OP2 DA B 111 5.777 1.624 -16.691 1.00 0.00 O ATOM 323 O5' DA B 111 6.073 0.360 -14.541 1.00 0.00 O ATOM 324 C5' DA B 111 6.729 0.109 -13.294 1.00 0.00 C ATOM 325 C4' DA B 111 5.986 -0.912 -12.423 1.00 0.00 C ATOM 326 O4' DA B 111 4.751 -0.342 -11.931 1.00 0.00 O ATOM 327 C3' DA B 111 5.649 -2.201 -13.183 1.00 0.00 C ATOM 328 O3' DA B 111 6.239 -3.321 -12.526 1.00 0.00 O ATOM 329 C2' DA B 111 4.142 -2.330 -13.127 1.00 0.00 C ATOM 330 C1' DA B 111 3.631 -1.199 -12.238 1.00 0.00 C ATOM 331 N9 DA B 111 2.565 -0.447 -12.924 1.00 0.00 N ATOM 332 C8 DA B 111 2.595 0.146 -14.149 1.00 0.00 C ATOM 333 N7 DA B 111 1.491 0.725 -14.511 1.00 0.00 N ATOM 334 C5 DA B 111 0.647 0.495 -13.429 1.00 0.00 C ATOM 335 C6 DA B 111 -0.682 0.846 -13.174 1.00 0.00 C ATOM 336 N6 DA B 111 -1.432 1.529 -14.038 1.00 0.00 N ATOM 337 N1 DA B 111 -1.211 0.457 -12.001 1.00 0.00 N ATOM 338 C2 DA B 111 -0.479 -0.238 -11.132 1.00 0.00 C ATOM 339 N3 DA B 111 0.787 -0.623 -11.272 1.00 0.00 N ATOM 340 C4 DA B 111 1.292 -0.218 -12.456 1.00 0.00 C ATOM 0 H5' DA B 111 6.825 1.046 -12.745 1.00 0.00 H new ATOM 0 H5'' DA B 111 7.739 -0.252 -13.487 1.00 0.00 H new ATOM 0 H4' DA B 111 6.656 -1.161 -11.600 1.00 0.00 H new ATOM 0 H3' DA B 111 6.022 -2.170 -14.207 1.00 0.00 H new ATOM 0 H2' DA B 111 3.711 -2.260 -14.126 1.00 0.00 H new ATOM 0 H2'' DA B 111 3.853 -3.300 -12.722 1.00 0.00 H new ATOM 0 H1' DA B 111 3.204 -1.599 -11.318 1.00 0.00 H new ATOM 0 H8 DA B 111 3.475 0.135 -14.775 1.00 0.00 H new ATOM 0 H61 DA B 111 -2.397 1.760 -13.804 1.00 0.00 H new ATOM 0 H62 DA B 111 -1.041 1.820 -14.934 1.00 0.00 H new ATOM 0 H2 DA B 111 -0.967 -0.521 -10.211 1.00 0.00 H new ATOM 352 P DA B 112 6.090 -4.814 -13.111 1.00 0.00 P ATOM 353 OP1 DA B 112 7.193 -5.637 -12.565 1.00 0.00 O ATOM 354 OP2 DA B 112 5.892 -4.721 -14.575 1.00 0.00 O ATOM 355 O5' DA B 112 4.711 -5.304 -12.438 1.00 0.00 O ATOM 356 C5' DA B 112 4.594 -5.357 -11.018 1.00 0.00 C ATOM 357 C4' DA B 112 3.192 -5.776 -10.558 1.00 0.00 C ATOM 358 O4' DA B 112 2.231 -4.752 -10.919 1.00 0.00 O ATOM 359 C3' DA B 112 2.726 -7.090 -11.195 1.00 0.00 C ATOM 360 O3' DA B 112 2.245 -7.980 -10.178 1.00 0.00 O ATOM 361 C2' DA B 112 1.607 -6.720 -12.124 1.00 0.00 C ATOM 362 C1' DA B 112 1.186 -5.311 -11.746 1.00 0.00 C ATOM 363 N9 DA B 112 0.946 -4.488 -12.947 1.00 0.00 N ATOM 364 C8 DA B 112 1.734 -4.310 -14.047 1.00 0.00 C ATOM 365 N7 DA B 112 1.246 -3.520 -14.953 1.00 0.00 N ATOM 366 C5 DA B 112 0.022 -3.141 -14.411 1.00 0.00 C ATOM 367 C6 DA B 112 -0.997 -2.309 -14.876 1.00 0.00 C ATOM 368 N6 DA B 112 -0.938 -1.682 -16.049 1.00 0.00 N ATOM 369 N1 DA B 112 -2.075 -2.151 -14.087 1.00 0.00 N ATOM 370 C2 DA B 112 -2.144 -2.778 -12.910 1.00 0.00 C ATOM 371 N3 DA B 112 -1.236 -3.588 -12.380 1.00 0.00 N ATOM 372 C4 DA B 112 -0.170 -3.724 -13.191 1.00 0.00 C ATOM 0 H5' DA B 112 4.832 -4.379 -10.601 1.00 0.00 H new ATOM 0 H5'' DA B 112 5.327 -6.060 -10.622 1.00 0.00 H new ATOM 0 H4' DA B 112 3.251 -5.913 -9.478 1.00 0.00 H new ATOM 0 H3' DA B 112 3.536 -7.594 -11.722 1.00 0.00 H new ATOM 0 H2' DA B 112 1.934 -6.762 -13.163 1.00 0.00 H new ATOM 0 H2'' DA B 112 0.773 -7.415 -12.024 1.00 0.00 H new ATOM 0 H1' DA B 112 0.246 -5.330 -11.195 1.00 0.00 H new ATOM 0 H8 DA B 112 2.694 -4.792 -14.155 1.00 0.00 H new ATOM 0 H61 DA B 112 -1.708 -1.083 -16.347 1.00 0.00 H new ATOM 0 H62 DA B 112 -0.122 -1.800 -16.650 1.00 0.00 H new ATOM 0 H2 DA B 112 -3.036 -2.607 -12.326 1.00 0.00 H new ATOM 384 P DC B 113 1.683 -9.450 -10.539 1.00 0.00 P ATOM 385 OP1 DC B 113 2.047 -10.364 -9.434 1.00 0.00 O ATOM 386 OP2 DC B 113 2.096 -9.771 -11.922 1.00 0.00 O ATOM 387 O5' DC B 113 0.076 -9.259 -10.523 1.00 0.00 O ATOM 388 C5' DC B 113 -0.573 -8.824 -9.321 1.00 0.00 C ATOM 389 C4' DC B 113 -2.098 -8.690 -9.467 1.00 0.00 C ATOM 390 O4' DC B 113 -2.449 -7.557 -10.299 1.00 0.00 O ATOM 391 C3' DC B 113 -2.735 -9.942 -10.081 1.00 0.00 C ATOM 392 O3' DC B 113 -3.770 -10.432 -9.226 1.00 0.00 O ATOM 393 C2' DC B 113 -3.343 -9.489 -11.387 1.00 0.00 C ATOM 394 C1' DC B 113 -3.310 -7.969 -11.386 1.00 0.00 C ATOM 395 N1 DC B 113 -2.815 -7.411 -12.672 1.00 0.00 N ATOM 396 C2 DC B 113 -3.621 -6.504 -13.359 1.00 0.00 C ATOM 397 O2 DC B 113 -4.753 -6.252 -12.953 1.00 0.00 O ATOM 398 N3 DC B 113 -3.119 -5.913 -14.477 1.00 0.00 N ATOM 399 C4 DC B 113 -1.884 -6.193 -14.907 1.00 0.00 C ATOM 400 N4 DC B 113 -1.432 -5.591 -16.006 1.00 0.00 N ATOM 401 C5 DC B 113 -1.054 -7.125 -14.207 1.00 0.00 C ATOM 402 C6 DC B 113 -1.568 -7.711 -13.106 1.00 0.00 C ATOM 0 H5' DC B 113 -0.158 -7.862 -9.020 1.00 0.00 H new ATOM 0 H5'' DC B 113 -0.352 -9.531 -8.521 1.00 0.00 H new ATOM 0 H4' DC B 113 -2.482 -8.550 -8.456 1.00 0.00 H new ATOM 0 H3' DC B 113 -2.003 -10.738 -10.219 1.00 0.00 H new ATOM 0 H2' DC B 113 -2.782 -9.887 -12.233 1.00 0.00 H new ATOM 0 H2'' DC B 113 -4.366 -9.853 -11.484 1.00 0.00 H new ATOM 0 H1' DC B 113 -4.324 -7.589 -11.258 1.00 0.00 H new ATOM 0 H41 DC B 113 -0.493 -5.793 -16.348 1.00 0.00 H new ATOM 0 H42 DC B 113 -2.025 -4.928 -16.505 1.00 0.00 H new ATOM 0 H5 DC B 113 -0.054 -7.351 -14.547 1.00 0.00 H new ATOM 0 H6 DC B 113 -0.975 -8.431 -12.562 1.00 0.00 H new ATOM 414 P DA B 114 -4.617 -11.744 -9.617 1.00 0.00 P ATOM 415 OP1 DA B 114 -5.154 -12.337 -8.371 1.00 0.00 O ATOM 416 OP2 DA B 114 -3.800 -12.570 -10.535 1.00 0.00 O ATOM 417 O5' DA B 114 -5.850 -11.127 -10.454 1.00 0.00 O ATOM 418 C5' DA B 114 -6.741 -10.187 -9.851 1.00 0.00 C ATOM 419 C4' DA B 114 -7.838 -9.730 -10.823 1.00 0.00 C ATOM 420 O4' DA B 114 -7.283 -8.887 -11.874 1.00 0.00 O ATOM 421 C3' DA B 114 -8.529 -10.921 -11.500 1.00 0.00 C ATOM 422 O3' DA B 114 -9.947 -10.817 -11.340 1.00 0.00 O ATOM 423 C2' DA B 114 -8.162 -10.825 -12.961 1.00 0.00 C ATOM 424 C1' DA B 114 -7.619 -9.423 -13.179 1.00 0.00 C ATOM 425 N9 DA B 114 -6.453 -9.429 -14.084 1.00 0.00 N ATOM 426 C8 DA B 114 -5.301 -10.123 -13.961 1.00 0.00 C ATOM 427 N7 DA B 114 -4.412 -9.903 -14.883 1.00 0.00 N ATOM 428 C5 DA B 114 -5.039 -8.972 -15.706 1.00 0.00 C ATOM 429 C6 DA B 114 -4.640 -8.320 -16.878 1.00 0.00 C ATOM 430 N6 DA B 114 -3.446 -8.500 -17.445 1.00 0.00 N ATOM 431 N1 DA B 114 -5.511 -7.466 -17.438 1.00 0.00 N ATOM 432 C2 DA B 114 -6.704 -7.261 -16.883 1.00 0.00 C ATOM 433 N3 DA B 114 -7.182 -7.821 -15.772 1.00 0.00 N ATOM 434 C4 DA B 114 -6.287 -8.676 -15.229 1.00 0.00 C ATOM 0 H5' DA B 114 -6.176 -9.320 -9.508 1.00 0.00 H new ATOM 0 H5'' DA B 114 -7.201 -10.636 -8.971 1.00 0.00 H new ATOM 0 H4' DA B 114 -8.563 -9.174 -10.228 1.00 0.00 H new ATOM 0 H3' DA B 114 -8.219 -11.872 -11.068 1.00 0.00 H new ATOM 0 H2' DA B 114 -7.416 -11.575 -13.223 1.00 0.00 H new ATOM 0 H2'' DA B 114 -9.032 -11.006 -13.592 1.00 0.00 H new ATOM 0 H1' DA B 114 -8.367 -8.795 -13.663 1.00 0.00 H new ATOM 0 H8 DA B 114 -5.130 -10.815 -13.150 1.00 0.00 H new ATOM 0 H61 DA B 114 -3.207 -7.998 -18.300 1.00 0.00 H new ATOM 0 H62 DA B 114 -2.772 -9.139 -17.023 1.00 0.00 H new ATOM 0 H2 DA B 114 -7.356 -6.564 -17.389 1.00 0.00 H new ATOM 446 P DT B 115 -10.941 -11.928 -11.948 1.00 0.00 P ATOM 447 OP1 DT B 115 -12.179 -11.939 -11.137 1.00 0.00 O ATOM 448 OP2 DT B 115 -10.176 -13.180 -12.147 1.00 0.00 O ATOM 449 O5' DT B 115 -11.288 -11.311 -13.395 1.00 0.00 O ATOM 450 C5' DT B 115 -11.916 -10.029 -13.473 1.00 0.00 C ATOM 451 C4' DT B 115 -12.060 -9.521 -14.912 1.00 0.00 C ATOM 452 O4' DT B 115 -10.767 -9.179 -15.470 1.00 0.00 O ATOM 453 C3' DT B 115 -12.713 -10.558 -15.836 1.00 0.00 C ATOM 454 O3' DT B 115 -13.995 -10.095 -16.258 1.00 0.00 O ATOM 455 C2' DT B 115 -11.796 -10.667 -17.035 1.00 0.00 C ATOM 456 C1' DT B 115 -10.682 -9.646 -16.833 1.00 0.00 C ATOM 457 N1 DT B 115 -9.347 -10.237 -17.128 1.00 0.00 N ATOM 458 C2 DT B 115 -8.583 -9.674 -18.141 1.00 0.00 C ATOM 459 O2 DT B 115 -8.975 -8.709 -18.795 1.00 0.00 O ATOM 460 N3 DT B 115 -7.353 -10.261 -18.374 1.00 0.00 N ATOM 461 C4 DT B 115 -6.823 -11.341 -17.695 1.00 0.00 C ATOM 462 O4 DT B 115 -5.714 -11.783 -17.991 1.00 0.00 O ATOM 463 C5 DT B 115 -7.683 -11.858 -16.656 1.00 0.00 C ATOM 464 C7 DT B 115 -7.214 -13.052 -15.824 1.00 0.00 C ATOM 465 C6 DT B 115 -8.891 -11.302 -16.413 1.00 0.00 C ATOM 0 H5' DT B 115 -11.335 -9.310 -12.896 1.00 0.00 H new ATOM 0 H5'' DT B 115 -12.902 -10.085 -13.012 1.00 0.00 H new ATOM 0 H4' DT B 115 -12.700 -8.641 -14.857 1.00 0.00 H new ATOM 0 H3' DT B 115 -12.850 -11.516 -15.334 1.00 0.00 H new ATOM 0 H2' DT B 115 -11.387 -11.674 -17.118 1.00 0.00 H new ATOM 0 H2'' DT B 115 -12.341 -10.467 -17.958 1.00 0.00 H new ATOM 0 H1' DT B 115 -10.802 -8.811 -17.523 1.00 0.00 H new ATOM 0 H3 DT B 115 -6.783 -9.858 -19.118 1.00 0.00 H new ATOM 0 H71 DT B 115 -6.559 -13.681 -16.427 1.00 0.00 H new ATOM 0 H72 DT B 115 -6.670 -12.695 -14.949 1.00 0.00 H new ATOM 0 H73 DT B 115 -8.078 -13.633 -15.502 1.00 0.00 H new ATOM 0 H6 DT B 115 -9.511 -11.714 -15.631 1.00 0.00 H new ATOM 478 P DT B 116 -14.984 -11.033 -17.114 1.00 0.00 P ATOM 479 OP1 DT B 116 -16.365 -10.525 -16.947 1.00 0.00 O ATOM 480 OP2 DT B 116 -14.674 -12.447 -16.801 1.00 0.00 O ATOM 481 O5' DT B 116 -14.517 -10.736 -18.624 1.00 0.00 O ATOM 482 C5' DT B 116 -14.585 -9.413 -19.155 1.00 0.00 C ATOM 483 C4' DT B 116 -13.917 -9.329 -20.529 1.00 0.00 C ATOM 484 O4' DT B 116 -12.486 -9.504 -20.406 1.00 0.00 O ATOM 485 C3' DT B 116 -14.443 -10.403 -21.491 1.00 0.00 C ATOM 486 O3' DT B 116 -15.224 -9.810 -22.531 1.00 0.00 O ATOM 487 C2' DT B 116 -13.216 -11.076 -22.067 1.00 0.00 C ATOM 488 C1' DT B 116 -12.005 -10.434 -21.401 1.00 0.00 C ATOM 489 N1 DT B 116 -11.131 -11.471 -20.787 1.00 0.00 N ATOM 490 C2 DT B 116 -9.838 -11.607 -21.266 1.00 0.00 C ATOM 491 O2 DT B 116 -9.397 -10.896 -22.167 1.00 0.00 O ATOM 492 N3 DT B 116 -9.069 -12.586 -20.673 1.00 0.00 N ATOM 493 C4 DT B 116 -9.467 -13.434 -19.657 1.00 0.00 C ATOM 494 O4 DT B 116 -8.691 -14.271 -19.200 1.00 0.00 O ATOM 495 C5 DT B 116 -10.828 -13.229 -19.219 1.00 0.00 C ATOM 496 C7 DT B 116 -11.393 -14.126 -18.114 1.00 0.00 C ATOM 497 C6 DT B 116 -11.602 -12.273 -19.786 1.00 0.00 C ATOM 0 H5' DT B 116 -14.099 -8.719 -18.469 1.00 0.00 H new ATOM 0 H5'' DT B 116 -15.627 -9.105 -19.236 1.00 0.00 H new ATOM 0 H4' DT B 116 -14.153 -8.343 -20.930 1.00 0.00 H new ATOM 0 H3' DT B 116 -15.089 -11.116 -20.979 1.00 0.00 H new ATOM 0 H2' DT B 116 -13.238 -12.149 -21.876 1.00 0.00 H new ATOM 0 H2'' DT B 116 -13.176 -10.946 -23.148 1.00 0.00 H new ATOM 0 HO3' DT B 116 -15.549 -10.510 -23.135 1.00 0.00 H new ATOM 0 H1' DT B 116 -11.403 -9.906 -22.141 1.00 0.00 H new ATOM 0 H3 DT B 116 -8.115 -12.695 -21.017 1.00 0.00 H new ATOM 0 H71 DT B 116 -12.139 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ATOM 561 N3 DA C 118 -5.449 -7.714 -22.111 1.00 0.00 N ATOM 562 C4 DA C 118 -4.142 -8.022 -22.261 1.00 0.00 C ATOM 0 H5' DA C 118 -1.639 -8.857 -27.001 1.00 0.00 H new ATOM 0 H5'' DA C 118 -0.771 -7.449 -27.579 1.00 0.00 H new ATOM 0 H4' DA C 118 -3.074 -6.894 -27.587 1.00 0.00 H new ATOM 0 H3' DA C 118 -1.257 -5.366 -26.112 1.00 0.00 H new ATOM 0 H2' DA C 118 -1.988 -5.640 -23.913 1.00 0.00 H new ATOM 0 H2'' DA C 118 -3.388 -4.702 -24.395 1.00 0.00 H new ATOM 0 H1' DA C 118 -4.738 -6.546 -24.333 1.00 0.00 H new ATOM 0 H8 DA C 118 -1.246 -8.000 -23.622 1.00 0.00 H new ATOM 0 H61 DA C 118 -3.908 -10.487 -18.624 1.00 0.00 H new ATOM 0 H62 DA C 118 -2.413 -10.360 -19.556 1.00 0.00 H new ATOM 0 H2 DA C 118 -6.996 -8.071 -20.808 1.00 0.00 H new ATOM 574 P DT C 119 -2.896 -3.030 -26.387 1.00 0.00 P ATOM 575 OP1 DT C 119 -3.239 -2.228 -27.583 1.00 0.00 O ATOM 576 OP2 DT C 119 -1.599 -2.826 -25.704 1.00 0.00 O ATOM 577 O5' DT C 119 -4.078 -2.863 -25.302 1.00 0.00 O ATOM 578 C5' DT C 119 -5.423 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C ATOM 614 O3' DG C 120 -11.289 0.395 -18.692 1.00 0.00 O ATOM 615 C2' DG C 120 -8.930 0.070 -18.412 1.00 0.00 C ATOM 616 C1' DG C 120 -8.626 -1.423 -18.435 1.00 0.00 C ATOM 617 N9 DG C 120 -7.177 -1.698 -18.323 1.00 0.00 N ATOM 618 C8 DG C 120 -6.150 -1.155 -19.023 1.00 0.00 C ATOM 619 N7 DG C 120 -4.968 -1.583 -18.707 1.00 0.00 N ATOM 620 C5 DG C 120 -5.222 -2.503 -17.696 1.00 0.00 C ATOM 621 C6 DG C 120 -4.317 -3.302 -16.949 1.00 0.00 C ATOM 622 O6 DG C 120 -3.092 -3.349 -17.036 1.00 0.00 O ATOM 623 N1 DG C 120 -4.981 -4.096 -16.027 1.00 0.00 N ATOM 624 C2 DG C 120 -6.349 -4.121 -15.841 1.00 0.00 C ATOM 625 N2 DG C 120 -6.801 -4.969 -14.916 1.00 0.00 N ATOM 626 N3 DG C 120 -7.208 -3.367 -16.542 1.00 0.00 N ATOM 627 C4 DG C 120 -6.576 -2.584 -17.450 1.00 0.00 C ATOM 0 H5' DG C 120 -9.493 -1.599 -22.264 1.00 0.00 H new ATOM 0 H5'' DG C 120 -10.405 -0.103 -22.225 1.00 0.00 H new ATOM 0 H4' DG C 120 -11.071 -1.355 -20.350 1.00 0.00 H new ATOM 0 H3' DG C 120 -9.924 1.196 -19.986 1.00 0.00 H new ATOM 0 H2' DG C 120 -8.050 0.651 -18.689 1.00 0.00 H new ATOM 0 H2'' DG C 120 -9.223 0.392 -17.413 1.00 0.00 H new ATOM 0 H1' DG C 120 -9.082 -1.913 -17.575 1.00 0.00 H new ATOM 0 H8 DG C 120 -6.307 -0.414 -19.793 1.00 0.00 H new ATOM 0 H1 DG C 120 -4.415 -4.709 -15.440 1.00 0.00 H new ATOM 0 H21 DG C 120 -7.802 -5.035 -14.730 1.00 0.00 H new ATOM 0 H22 DG C 120 -6.146 -5.551 -14.394 1.00 0.00 H new ATOM 639 P DT C 121 -11.560 1.622 -17.685 1.00 0.00 P ATOM 640 OP1 DT C 121 -13.023 1.809 -17.566 1.00 0.00 O ATOM 641 OP2 DT C 121 -10.699 2.756 -18.091 1.00 0.00 O ATOM 642 O5' DT C 121 -11.009 1.037 -16.288 1.00 0.00 O ATOM 643 C5' DT C 121 -11.590 -0.145 -15.738 1.00 0.00 C ATOM 644 C4' DT C 121 -10.799 -0.697 -14.545 1.00 0.00 C ATOM 645 O4' DT C 121 -9.536 -1.273 -14.958 1.00 0.00 O ATOM 646 C3' DT C 121 -10.497 0.388 -13.502 1.00 0.00 C ATOM 647 O3' DT C 121 -11.258 0.161 -12.318 1.00 0.00 O ATOM 648 C2' DT C 121 -9.017 0.252 -13.202 1.00 0.00 C ATOM 649 C1' DT C 121 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H71 DT C 121 -6.482 1.706 -17.554 1.00 0.00 H new ATOM 0 H72 DT C 121 -5.299 2.470 -16.466 1.00 0.00 H new ATOM 0 H73 DT C 121 -4.755 1.299 -17.691 1.00 0.00 H new ATOM 0 H6 DT C 121 -7.785 0.840 -15.775 1.00 0.00 H new ATOM 671 P DT C 122 -11.158 1.157 -11.060 1.00 0.00 P ATOM 672 OP1 DT C 122 -12.411 1.047 -10.285 1.00 0.00 O ATOM 673 OP2 DT C 122 -10.713 2.480 -11.556 1.00 0.00 O ATOM 674 O5' DT C 122 -9.968 0.532 -10.177 1.00 0.00 O ATOM 675 C5' DT C 122 -10.072 -0.797 -9.666 1.00 0.00 C ATOM 676 C4' DT C 122 -8.833 -1.190 -8.856 1.00 0.00 C ATOM 677 O4' DT C 122 -7.684 -1.340 -9.726 1.00 0.00 O ATOM 678 C3' DT C 122 -8.493 -0.124 -7.800 1.00 0.00 C ATOM 679 O3' DT C 122 -8.676 -0.642 -6.482 1.00 0.00 O ATOM 680 C2' DT C 122 -7.042 0.230 -8.027 1.00 0.00 C ATOM 681 C1' DT C 122 -6.546 -0.638 -9.179 1.00 0.00 C ATOM 682 N1 DT C 122 -5.870 0.193 -10.221 1.00 0.00 N ATOM 683 C2 DT C 122 -4.538 -0.079 -10.508 1.00 0.00 C ATOM 684 O2 DT C 122 -3.922 -0.980 -9.944 1.00 0.00 O ATOM 685 N3 DT C 122 -3.945 0.715 -11.472 1.00 0.00 N ATOM 686 C4 DT C 122 -4.553 1.739 -12.172 1.00 0.00 C ATOM 687 O4 DT C 122 -3.922 2.387 -13.005 1.00 0.00 O ATOM 688 C5 DT C 122 -5.939 1.955 -11.822 1.00 0.00 C ATOM 689 C7 DT C 122 -6.724 3.052 -12.551 1.00 0.00 C ATOM 690 C6 DT C 122 -6.545 1.194 -10.875 1.00 0.00 C ATOM 0 H5' DT C 122 -10.203 -1.496 -10.492 1.00 0.00 H new ATOM 0 H5'' DT C 122 -10.959 -0.877 -9.037 1.00 0.00 H new ATOM 0 H4' DT C 122 -9.062 -2.134 -8.362 1.00 0.00 H new ATOM 0 H3' DT C 122 -9.142 0.747 -7.892 1.00 0.00 H new ATOM 0 H2' DT C 122 -6.936 1.288 -8.268 1.00 0.00 H new ATOM 0 H2'' DT C 122 -6.455 0.048 -7.127 1.00 0.00 H new ATOM 0 H1' DT C 122 -5.806 -1.354 -8.820 1.00 0.00 H new ATOM 0 H3 DT C 122 -2.966 0.527 -11.687 1.00 0.00 H new ATOM 0 H71 DT C 122 -7.777 2.773 -12.602 1.00 0.00 H new ATOM 0 H72 DT C 122 -6.624 3.992 -12.009 1.00 0.00 H new ATOM 0 H73 DT C 122 -6.331 3.171 -13.561 1.00 0.00 H new ATOM 0 H6 DT C 122 -7.580 1.380 -10.631 1.00 0.00 H new ATOM 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-7.853 1.00 0.00 C ATOM 722 C6 DT C 123 -4.620 2.202 -6.440 1.00 0.00 C ATOM 0 H5' DT C 123 -6.595 -1.729 -5.232 1.00 0.00 H new ATOM 0 H5'' DT C 123 -7.045 -1.447 -3.562 1.00 0.00 H new ATOM 0 H4' DT C 123 -4.734 -1.922 -3.618 1.00 0.00 H new ATOM 0 H3' DT C 123 -5.643 0.534 -2.515 1.00 0.00 H new ATOM 0 H2' DT C 123 -4.582 2.072 -3.842 1.00 0.00 H new ATOM 0 H2'' DT C 123 -3.132 1.559 -3.002 1.00 0.00 H new ATOM 0 H1' DT C 123 -2.369 0.344 -4.794 1.00 0.00 H new ATOM 0 H3 DT C 123 -1.492 2.748 -8.405 1.00 0.00 H new ATOM 0 H71 DT C 123 -5.709 4.761 -8.296 1.00 0.00 H new ATOM 0 H72 DT C 123 -6.517 3.198 -8.568 1.00 0.00 H new ATOM 0 H73 DT C 123 -6.545 3.945 -6.953 1.00 0.00 H new ATOM 0 H6 DT C 123 -5.522 2.033 -5.870 1.00 0.00 H new ATOM 735 P DA C 124 -3.415 0.350 -0.617 1.00 0.00 P ATOM 736 OP1 DA C 124 -3.568 -0.493 0.589 1.00 0.00 O ATOM 737 OP2 DA C 124 -4.009 1.705 -0.651 1.00 0.00 O ATOM 738 O5' DA C 124 -1.834 0.479 -0.949 1.00 0.00 O ATOM 739 C5' DA C 124 -1.082 -0.735 -1.095 1.00 0.00 C ATOM 740 C4' DA C 124 0.417 -0.538 -1.410 1.00 0.00 C ATOM 741 O4' DA C 124 0.570 0.162 -2.668 1.00 0.00 O ATOM 742 C3' DA C 124 1.131 0.288 -0.336 1.00 0.00 C ATOM 743 O3' DA C 124 2.418 -0.269 -0.027 1.00 0.00 O ATOM 744 C2' DA C 124 1.304 1.655 -0.946 1.00 0.00 C ATOM 745 C1' DA C 124 1.118 1.485 -2.451 1.00 0.00 C ATOM 746 N9 DA C 124 0.229 2.513 -3.013 1.00 0.00 N ATOM 747 C8 DA C 124 -0.995 2.882 -2.585 1.00 0.00 C ATOM 748 N7 DA C 124 -1.574 3.813 -3.281 1.00 0.00 N ATOM 749 C5 DA C 124 -0.637 4.087 -4.272 1.00 0.00 C ATOM 750 C6 DA C 124 -0.633 4.983 -5.344 1.00 0.00 C ATOM 751 N6 DA C 124 -1.648 5.809 -5.598 1.00 0.00 N ATOM 752 N1 DA C 124 0.456 4.997 -6.137 1.00 0.00 N ATOM 753 C2 DA C 124 1.480 4.176 -5.882 1.00 0.00 C ATOM 754 N3 DA C 124 1.574 3.292 -4.891 1.00 0.00 N ATOM 755 C4 DA C 124 0.469 3.302 -4.118 1.00 0.00 C ATOM 0 H5' DA C 124 -1.530 -1.329 -1.891 1.00 0.00 H new ATOM 0 H5'' DA C 124 -1.172 -1.314 -0.176 1.00 0.00 H new ATOM 0 H4' DA C 124 0.860 -1.533 -1.450 1.00 0.00 H new ATOM 0 H3' DA C 124 0.562 0.309 0.594 1.00 0.00 H new ATOM 0 H2' DA C 124 0.573 2.355 -0.542 1.00 0.00 H new ATOM 0 H2'' DA C 124 2.291 2.058 -0.720 1.00 0.00 H new ATOM 0 H1' DA C 124 2.077 1.600 -2.957 1.00 0.00 H new ATOM 0 H8 DA C 124 -1.463 2.433 -1.721 1.00 0.00 H new ATOM 0 H61 DA C 124 -1.600 6.446 -6.393 1.00 0.00 H new ATOM 0 H62 DA C 124 -2.472 5.804 -4.997 1.00 0.00 H new ATOM 0 H2 DA C 124 2.324 4.237 -6.554 1.00 0.00 H new ATOM 767 P DT C 125 3.373 0.425 1.082 1.00 0.00 P ATOM 768 OP1 DT C 125 4.271 -0.616 1.629 1.00 0.00 O ATOM 769 OP2 DT C 125 2.516 1.209 2.000 1.00 0.00 O ATOM 770 O5' DT C 125 4.273 1.462 0.223 1.00 0.00 O ATOM 771 C5' DT C 125 5.149 0.961 -0.791 1.00 0.00 C ATOM 772 C4' DT C 125 5.858 2.063 -1.599 1.00 0.00 C ATOM 773 O4' DT C 125 4.896 2.750 -2.444 1.00 0.00 O ATOM 774 C3' DT C 125 6.539 3.135 -0.728 1.00 0.00 C ATOM 775 O3' DT C 125 7.893 3.328 -1.163 1.00 0.00 O ATOM 776 C2' DT C 125 5.757 4.398 -0.957 1.00 0.00 C ATOM 777 C1' DT C 125 5.050 4.177 -2.283 1.00 0.00 C ATOM 778 N1 DT C 125 3.744 4.904 -2.384 1.00 0.00 N ATOM 779 C2 DT C 125 3.530 5.696 -3.509 1.00 0.00 C ATOM 780 O2 DT C 125 4.368 5.799 -4.403 1.00 0.00 O ATOM 781 N3 DT C 125 2.320 6.364 -3.566 1.00 0.00 N ATOM 782 C4 DT C 125 1.322 6.313 -2.610 1.00 0.00 C ATOM 783 O4 DT C 125 0.285 6.945 -2.739 1.00 0.00 O ATOM 784 C5 DT C 125 1.625 5.479 -1.487 1.00 0.00 C ATOM 785 C7 DT C 125 0.631 5.405 -0.340 1.00 0.00 C ATOM 786 C6 DT C 125 2.787 4.808 -1.404 1.00 0.00 C ATOM 0 H5' DT C 125 4.577 0.333 -1.474 1.00 0.00 H new ATOM 0 H5'' DT C 125 5.901 0.323 -0.326 1.00 0.00 H new ATOM 0 H4' DT C 125 6.628 1.550 -2.175 1.00 0.00 H new ATOM 0 H3' DT C 125 6.559 2.848 0.323 1.00 0.00 H new ATOM 0 H2' DT C 125 5.043 4.574 -0.152 1.00 0.00 H new ATOM 0 H2'' DT C 125 6.412 5.268 -0.998 1.00 0.00 H new ATOM 0 H1' DT C 125 5.649 4.594 -3.093 1.00 0.00 H new ATOM 0 H3 DT C 125 2.149 6.946 -4.386 1.00 0.00 H new ATOM 0 H71 DT C 125 0.093 6.350 -0.263 1.00 0.00 H new ATOM 0 H72 DT C 125 -0.078 4.598 -0.524 1.00 0.00 H new ATOM 0 H73 DT C 125 1.164 5.214 0.592 1.00 0.00 H new ATOM 0 H6 DT C 125 2.972 4.179 -0.546 1.00 0.00 H new ATOM 799 P DC C 126 8.855 4.411 -0.454 1.00 0.00 P ATOM 800 OP1 DC C 126 10.239 3.886 -0.461 1.00 0.00 O ATOM 801 OP2 DC C 126 8.230 4.825 0.821 1.00 0.00 O ATOM 802 O5' DC C 126 8.782 5.659 -1.485 1.00 0.00 O ATOM 803 C5' DC C 126 9.214 5.479 -2.843 1.00 0.00 C ATOM 804 C4' DC C 126 9.033 6.729 -3.719 1.00 0.00 C ATOM 805 O4' DC C 126 7.635 6.969 -4.004 1.00 0.00 O ATOM 806 C3' DC C 126 9.618 7.989 -3.063 1.00 0.00 C ATOM 807 O3' DC C 126 10.748 8.479 -3.782 1.00 0.00 O ATOM 808 C2' DC C 126 8.512 9.022 -3.121 1.00 0.00 C ATOM 809 C1' DC C 126 7.303 8.354 -3.769 1.00 0.00 C ATOM 810 N1 DC C 126 6.117 8.459 -2.885 1.00 0.00 N ATOM 811 C2 DC C 126 4.983 9.108 -3.365 1.00 0.00 C ATOM 812 O2 DC C 126 4.984 9.607 -4.490 1.00 0.00 O ATOM 813 N3 DC C 126 3.894 9.182 -2.558 1.00 0.00 N ATOM 814 C4 DC C 126 3.911 8.644 -1.332 1.00 0.00 C ATOM 815 N4 DC C 126 2.829 8.745 -0.570 1.00 0.00 N ATOM 816 C5 DC C 126 5.071 7.977 -0.834 1.00 0.00 C ATOM 817 C6 DC C 126 6.144 7.909 -1.638 1.00 0.00 C ATOM 0 H5' DC C 126 8.658 4.652 -3.285 1.00 0.00 H new ATOM 0 H5'' DC C 126 10.266 5.193 -2.846 1.00 0.00 H new ATOM 0 H4' DC C 126 9.574 6.529 -4.644 1.00 0.00 H new ATOM 0 H3' DC C 126 9.952 7.774 -2.048 1.00 0.00 H new ATOM 0 H2' DC C 126 8.265 9.377 -2.121 1.00 0.00 H new ATOM 0 H2'' DC C 126 8.827 9.891 -3.699 1.00 0.00 H new ATOM 0 H1' DC C 126 7.059 8.848 -4.709 1.00 0.00 H new ATOM 0 H41 DC C 126 2.825 8.341 0.366 1.00 0.00 H new ATOM 0 H42 DC C 126 2.001 9.227 -0.921 1.00 0.00 H new ATOM 0 H5 DC C 126 5.085 7.542 0.155 1.00 0.00 H new ATOM 0 H6 DC C 126 7.039 7.413 -1.293 1.00 0.00 H new ATOM 829 P DT C 127 11.638 9.673 -3.162 1.00 0.00 P ATOM 830 OP1 DT C 127 12.976 9.634 -3.790 1.00 0.00 O ATOM 831 OP2 DT C 127 11.512 9.629 -1.688 1.00 0.00 O ATOM 832 O5' DT C 127 10.873 10.986 -3.691 1.00 0.00 O ATOM 833 C5' DT C 127 10.726 11.218 -5.090 1.00 0.00 C ATOM 834 C4' DT C 127 9.909 12.479 -5.369 1.00 0.00 C ATOM 835 O4' DT C 127 8.528 12.260 -4.988 1.00 0.00 O ATOM 836 C3' DT C 127 10.421 13.698 -4.588 1.00 0.00 C ATOM 837 O3' DT C 127 10.805 14.733 -5.499 1.00 0.00 O ATOM 838 C2' DT C 127 9.266 14.153 -3.726 1.00 0.00 C ATOM 839 C1' DT C 127 8.050 13.345 -4.164 1.00 0.00 C ATOM 840 N1 DT C 127 7.274 12.838 -2.985 1.00 0.00 N ATOM 841 C2 DT C 127 5.946 13.233 -2.873 1.00 0.00 C ATOM 842 O2 DT C 127 5.414 13.959 -3.709 1.00 0.00 O ATOM 843 N3 DT C 127 5.256 12.764 -1.775 1.00 0.00 N ATOM 844 C4 DT C 127 5.756 11.947 -0.782 1.00 0.00 C ATOM 845 O4 DT C 127 5.044 11.593 0.155 1.00 0.00 O ATOM 846 C5 DT C 127 7.140 11.578 -0.962 1.00 0.00 C ATOM 847 C7 DT C 127 7.800 10.681 0.090 1.00 0.00 C ATOM 848 C6 DT C 127 7.848 12.020 -2.036 1.00 0.00 C ATOM 0 H5' DT C 127 10.240 10.359 -5.553 1.00 0.00 H new ATOM 0 H5'' DT C 127 11.710 11.313 -5.549 1.00 0.00 H new ATOM 0 H4' DT C 127 10.004 12.683 -6.436 1.00 0.00 H new ATOM 0 H3' DT C 127 11.294 13.455 -3.983 1.00 0.00 H new ATOM 0 H2' DT C 127 9.482 13.987 -2.670 1.00 0.00 H new ATOM 0 H2'' DT C 127 9.087 15.221 -3.851 1.00 0.00 H new ATOM 0 H1' DT C 127 7.362 13.974 -4.729 1.00 0.00 H new ATOM 0 H3 DT C 127 4.280 13.049 -1.689 1.00 0.00 H new ATOM 0 H71 DT C 127 7.339 10.860 1.062 1.00 0.00 H new ATOM 0 H72 DT C 127 7.666 9.635 -0.188 1.00 0.00 H new ATOM 0 H73 DT C 127 8.865 10.908 0.146 1.00 0.00 H new ATOM 0 H6 DT C 127 8.881 11.724 -2.147 1.00 0.00 H new ATOM 861 P DG C 128 11.384 16.143 -4.975 1.00 0.00 P ATOM 862 OP1 DG C 128 12.264 16.706 -6.023 1.00 0.00 O ATOM 863 OP2 DG C 128 11.899 15.953 -3.601 1.00 0.00 O ATOM 864 O5' DG C 128 10.053 17.044 -4.895 1.00 0.00 O ATOM 865 C5' DG C 128 9.287 17.271 -6.080 1.00 0.00 C ATOM 866 C4' DG C 128 8.007 18.061 -5.801 1.00 0.00 C ATOM 867 O4' DG C 128 7.130 17.306 -4.936 1.00 0.00 O ATOM 868 C3' DG C 128 8.290 19.411 -5.132 1.00 0.00 C ATOM 869 O3' DG C 128 7.798 20.464 -5.957 1.00 0.00 O ATOM 870 C2' DG C 128 7.546 19.383 -3.816 1.00 0.00 C ATOM 871 C1' DG C 128 6.746 18.087 -3.783 1.00 0.00 C ATOM 872 N9 DG C 128 7.008 17.347 -2.541 1.00 0.00 N ATOM 873 C8 DG C 128 8.194 16.906 -2.060 1.00 0.00 C ATOM 874 N7 DG C 128 8.135 16.267 -0.931 1.00 0.00 N ATOM 875 C5 DG C 128 6.775 16.289 -0.627 1.00 0.00 C ATOM 876 C6 DG C 128 6.083 15.750 0.490 1.00 0.00 C ATOM 877 O6 DG C 128 6.544 15.134 1.449 1.00 0.00 O ATOM 878 N1 DG C 128 4.719 15.997 0.410 1.00 0.00 N ATOM 879 C2 DG C 128 4.095 16.677 -0.615 1.00 0.00 C ATOM 880 N2 DG C 128 2.775 16.830 -0.502 1.00 0.00 N ATOM 881 N3 DG C 128 4.743 17.183 -1.670 1.00 0.00 N ATOM 882 C4 DG C 128 6.075 16.953 -1.610 1.00 0.00 C ATOM 0 H5' DG C 128 9.029 16.313 -6.532 1.00 0.00 H new ATOM 0 H5'' DG C 128 9.895 17.812 -6.805 1.00 0.00 H new ATOM 0 H4' DG C 128 7.537 18.241 -6.768 1.00 0.00 H new ATOM 0 H3' DG C 128 9.356 19.578 -4.981 1.00 0.00 H new ATOM 0 H2' DG C 128 8.242 19.428 -2.979 1.00 0.00 H new ATOM 0 H2'' DG C 128 6.886 20.246 -3.728 1.00 0.00 H new ATOM 0 H1' DG C 128 5.677 18.300 -3.811 1.00 0.00 H new ATOM 0 H8 DG C 128 9.126 17.074 -2.580 1.00 0.00 H new ATOM 0 H1 DG C 128 4.133 15.648 1.168 1.00 0.00 H new ATOM 0 H21 DG C 128 2.255 17.324 -1.227 1.00 0.00 H new ATOM 0 H22 DG C 128 2.286 16.453 0.310 1.00 0.00 H new ATOM 894 P DC C 129 8.114 22.007 -5.632 1.00 0.00 P ATOM 895 OP1 DC C 129 7.984 22.782 -6.885 1.00 0.00 O ATOM 896 OP2 DC C 129 9.371 22.068 -4.851 1.00 0.00 O ATOM 897 O5' DC C 129 6.899 22.413 -4.660 1.00 0.00 O ATOM 898 C5' DC C 129 5.549 22.322 -5.116 1.00 0.00 C ATOM 899 C4' DC C 129 4.560 22.757 -4.032 1.00 0.00 C ATOM 900 O4' DC C 129 4.542 21.797 -2.946 1.00 0.00 O ATOM 901 C3' DC C 129 4.938 24.123 -3.447 1.00 0.00 C ATOM 902 O3' DC C 129 3.856 25.046 -3.593 1.00 0.00 O ATOM 903 C2' DC C 129 5.209 23.883 -1.981 1.00 0.00 C ATOM 904 C1' DC C 129 4.810 22.448 -1.683 1.00 0.00 C ATOM 905 N1 DC C 129 5.877 21.725 -0.930 1.00 0.00 N ATOM 906 C2 DC C 129 5.542 21.175 0.308 1.00 0.00 C ATOM 907 O2 DC C 129 4.410 21.332 0.761 1.00 0.00 O ATOM 908 N3 DC C 129 6.486 20.474 0.986 1.00 0.00 N ATOM 909 C4 DC C 129 7.715 20.312 0.486 1.00 0.00 C ATOM 910 N4 DC C 129 8.612 19.611 1.182 1.00 0.00 N ATOM 911 C5 DC C 129 8.076 20.875 -0.781 1.00 0.00 C ATOM 912 C6 DC C 129 7.133 21.571 -1.451 1.00 0.00 C ATOM 0 H5' DC C 129 5.334 21.296 -5.416 1.00 0.00 H new ATOM 0 H5'' DC C 129 5.420 22.947 -6.000 1.00 0.00 H new ATOM 0 H4' DC C 129 3.579 22.819 -4.503 1.00 0.00 H new ATOM 0 H3' DC C 129 5.802 24.547 -3.958 1.00 0.00 H new ATOM 0 H2' DC C 129 6.262 24.046 -1.752 1.00 0.00 H new ATOM 0 H2'' DC C 129 4.638 24.578 -1.365 1.00 0.00 H new ATOM 0 H1' DC C 129 3.923 22.437 -1.050 1.00 0.00 H new ATOM 0 H41 DC C 129 9.554 19.479 0.813 1.00 0.00 H new ATOM 0 H42 DC C 129 8.356 19.207 2.083 1.00 0.00 H new ATOM 0 H5 DC C 129 9.069 20.747 -1.186 1.00 0.00 H new ATOM 0 H6 DC C 129 7.372 22.011 -2.408 1.00 0.00 H new ATOM 924 P DA C 130 3.997 26.560 -3.066 1.00 0.00 P ATOM 925 OP1 DA C 130 3.059 27.402 -3.840 1.00 0.00 O ATOM 926 OP2 DA C 130 5.436 26.900 -3.040 1.00 0.00 O ATOM 927 O5' DA C 130 3.471 26.492 -1.540 1.00 0.00 O ATOM 928 C5' DA C 130 2.137 26.067 -1.238 1.00 0.00 C ATOM 929 C4' DA C 130 1.854 26.079 0.274 1.00 0.00 C ATOM 930 O4' DA C 130 2.576 25.021 0.952 1.00 0.00 O ATOM 931 C3' DA C 130 2.258 27.415 0.913 1.00 0.00 C ATOM 932 O3' DA C 130 1.142 28.013 1.578 1.00 0.00 O ATOM 933 C2' DA C 130 3.324 27.071 1.928 1.00 0.00 C ATOM 934 C1' DA C 130 3.334 25.557 2.061 1.00 0.00 C ATOM 935 N9 DA C 130 4.704 25.020 2.071 1.00 0.00 N ATOM 936 C8 DA C 130 5.667 25.157 1.135 1.00 0.00 C ATOM 937 N7 DA C 130 6.785 24.545 1.387 1.00 0.00 N ATOM 938 C5 DA C 130 6.537 23.942 2.617 1.00 0.00 C ATOM 939 C6 DA C 130 7.319 23.136 3.447 1.00 0.00 C ATOM 940 N6 DA C 130 8.569 22.786 3.149 1.00 0.00 N ATOM 941 N1 DA C 130 6.764 22.707 4.596 1.00 0.00 N ATOM 942 C2 DA C 130 5.514 23.052 4.907 1.00 0.00 C ATOM 943 N3 DA C 130 4.688 23.810 4.190 1.00 0.00 N ATOM 944 C4 DA C 130 5.272 24.224 3.046 1.00 0.00 C ATOM 0 H5' DA C 130 1.981 25.061 -1.628 1.00 0.00 H new ATOM 0 H5'' DA C 130 1.426 26.719 -1.745 1.00 0.00 H new ATOM 0 H4' DA C 130 0.780 25.929 0.386 1.00 0.00 H new ATOM 0 H3' DA C 130 2.610 28.123 0.163 1.00 0.00 H new ATOM 0 H2' DA C 130 4.298 27.437 1.604 1.00 0.00 H new ATOM 0 H2'' DA C 130 3.110 27.542 2.888 1.00 0.00 H new ATOM 0 H1' DA C 130 2.885 25.265 3.011 1.00 0.00 H new ATOM 0 H8 DA C 130 5.518 25.737 0.236 1.00 0.00 H new ATOM 0 H61 DA C 130 9.099 22.195 3.789 1.00 0.00 H new ATOM 0 H62 DA C 130 8.996 23.109 2.281 1.00 0.00 H new ATOM 0 H2 DA C 130 5.130 22.675 5.843 1.00 0.00 H new ATOM 956 P DA C 131 1.293 29.438 2.315 1.00 0.00 P ATOM 957 OP1 DA C 131 -0.045 30.069 2.373 1.00 0.00 O ATOM 958 OP2 DA C 131 2.419 30.164 1.687 1.00 0.00 O ATOM 959 O5' DA C 131 1.728 29.048 3.820 1.00 0.00 O ATOM 960 C5' DA C 131 0.814 28.397 4.709 1.00 0.00 C ATOM 961 C4' DA C 131 1.451 28.128 6.080 1.00 0.00 C ATOM 962 O4' DA C 131 2.463 27.092 5.997 1.00 0.00 O ATOM 963 C3' DA C 131 2.113 29.393 6.642 1.00 0.00 C ATOM 964 O3' DA C 131 1.467 29.839 7.835 1.00 0.00 O ATOM 965 C2' DA C 131 3.537 29.002 6.962 1.00 0.00 C ATOM 966 C1' DA C 131 3.676 27.517 6.663 1.00 0.00 C ATOM 967 N9 DA C 131 4.865 27.253 5.834 1.00 0.00 N ATOM 968 C8 DA C 131 5.187 27.785 4.635 1.00 0.00 C ATOM 969 N7 DA C 131 6.314 27.383 4.130 1.00 0.00 N ATOM 970 C5 DA C 131 6.787 26.494 5.091 1.00 0.00 C ATOM 971 C6 DA C 131 7.947 25.714 5.171 1.00 0.00 C ATOM 972 N6 DA C 131 8.892 25.724 4.231 1.00 0.00 N ATOM 973 N1 DA C 131 8.104 24.943 6.263 1.00 0.00 N ATOM 974 C2 DA C 131 7.173 24.944 7.221 1.00 0.00 C ATOM 975 N3 DA C 131 6.041 25.646 7.243 1.00 0.00 N ATOM 976 C4 DA C 131 5.911 26.406 6.136 1.00 0.00 C ATOM 0 H5' DA C 131 0.486 27.455 4.269 1.00 0.00 H new ATOM 0 H5'' DA C 131 -0.074 29.016 4.835 1.00 0.00 H new ATOM 0 H4' DA C 131 0.645 27.806 6.739 1.00 0.00 H new ATOM 0 H3' DA C 131 2.051 30.209 5.922 1.00 0.00 H new ATOM 0 H2' DA C 131 4.239 29.582 6.363 1.00 0.00 H new ATOM 0 H2'' DA C 131 3.766 29.207 8.008 1.00 0.00 H new ATOM 0 H1' DA C 131 3.813 26.954 7.586 1.00 0.00 H new ATOM 0 H8 DA C 131 4.550 28.497 4.130 1.00 0.00 H new ATOM 0 H61 DA C 131 9.720 25.138 4.334 1.00 0.00 H new ATOM 0 H62 DA C 131 8.787 26.318 3.409 1.00 0.00 H new ATOM 0 H2 DA C 131 7.359 24.305 8.072 1.00 0.00 H new ATOM 988 P DC C 132 2.005 31.159 8.588 1.00 0.00 P ATOM 989 OP1 DC C 132 0.889 31.730 9.373 1.00 0.00 O ATOM 990 OP2 DC C 132 2.711 31.999 7.593 1.00 0.00 O ATOM 991 O5' DC C 132 3.100 30.569 9.615 1.00 0.00 O ATOM 992 C5' DC C 132 2.756 29.491 10.489 1.00 0.00 C ATOM 993 C4' DC C 132 3.972 28.937 11.247 1.00 0.00 C ATOM 994 O4' DC C 132 4.854 28.210 10.359 1.00 0.00 O ATOM 995 C3' DC C 132 4.793 30.044 11.921 1.00 0.00 C ATOM 996 O3' DC C 132 4.655 29.981 13.343 1.00 0.00 O ATOM 997 C2' DC C 132 6.233 29.777 11.526 1.00 0.00 C ATOM 998 C1' DC C 132 6.231 28.539 10.647 1.00 0.00 C ATOM 999 N1 DC C 132 6.992 28.783 9.394 1.00 0.00 N ATOM 1000 C2 DC C 132 8.188 28.096 9.189 1.00 0.00 C ATOM 1001 O2 DC C 132 8.590 27.296 10.030 1.00 0.00 O ATOM 1002 N3 DC C 132 8.881 28.336 8.041 1.00 0.00 N ATOM 1003 C4 DC C 132 8.422 29.206 7.131 1.00 0.00 C ATOM 1004 N4 DC C 132 9.113 29.413 6.009 1.00 0.00 N ATOM 1005 C5 DC C 132 7.196 29.909 7.341 1.00 0.00 C ATOM 1006 C6 DC C 132 6.523 29.667 8.480 1.00 0.00 C ATOM 0 H5' DC C 132 2.297 28.690 9.909 1.00 0.00 H new ATOM 0 H5'' DC C 132 2.010 29.833 11.206 1.00 0.00 H new ATOM 0 H4' DC C 132 3.568 28.273 12.011 1.00 0.00 H new ATOM 0 H3' DC C 132 4.459 31.034 11.611 1.00 0.00 H new ATOM 0 H2' DC C 132 6.650 30.630 10.990 1.00 0.00 H new ATOM 0 H2'' DC C 132 6.853 29.622 12.409 1.00 0.00 H new ATOM 0 HO3' DC C 132 5.187 30.693 13.755 1.00 0.00 H new ATOM 0 H1' DC C 132 6.717 27.708 11.159 1.00 0.00 H new ATOM 0 H41 DC C 132 8.769 30.074 5.313 1.00 0.00 H new ATOM 0 H42 DC C 132 9.986 28.910 5.847 1.00 0.00 H new ATOM 0 H5 DC C 132 6.822 30.611 6.610 1.00 0.00 H new ATOM 0 H6 DC C 132 5.594 30.185 8.669 1.00 0.00 H new TER 1019 DC C 132 ATOM 1020 N LYS A 1 -5.087 14.115 14.414 1.00 0.00 N ATOM 1021 CA LYS A 1 -6.467 14.141 13.850 1.00 0.00 C ATOM 1022 C LYS A 1 -6.769 12.783 13.220 1.00 0.00 C ATOM 1023 O LYS A 1 -7.897 12.467 12.900 1.00 0.00 O ATOM 1024 CB LYS A 1 -6.550 15.239 12.790 1.00 0.00 C ATOM 1025 CG LYS A 1 -6.469 16.602 13.478 1.00 0.00 C ATOM 1026 CD LYS A 1 -6.516 17.714 12.430 1.00 0.00 C ATOM 1027 CE LYS A 1 -6.493 19.074 13.131 1.00 0.00 C ATOM 1028 NZ LYS A 1 -5.334 19.138 14.068 1.00 0.00 N ATOM 0 H1 LYS A 1 -4.954 14.932 15.044 1.00 0.00 H new ATOM 0 H2 LYS A 1 -4.948 13.236 14.952 1.00 0.00 H new ATOM 0 H3 LYS A 1 -4.394 14.159 13.639 1.00 0.00 H new ATOM 0 HA LYS A 1 -7.194 14.344 14.636 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -5.737 15.131 12.072 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -7.482 15.154 12.232 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -7.296 16.715 14.179 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -5.548 16.674 14.057 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -5.666 17.627 11.753 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -7.417 17.620 11.824 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -6.421 19.873 12.393 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -7.424 19.228 13.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -4.985 20.116 14.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -5.634 18.824 15.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -4.574 18.518 13.722 1.00 0.00 H new ATOM 1044 N ARG A 2 -5.763 11.968 13.069 1.00 0.00 N ATOM 1045 CA ARG A 2 -5.984 10.617 12.486 1.00 0.00 C ATOM 1046 C ARG A 2 -6.770 9.792 13.504 1.00 0.00 C ATOM 1047 O ARG A 2 -7.564 8.947 13.162 1.00 0.00 O ATOM 1048 CB ARG A 2 -4.646 9.933 12.217 1.00 0.00 C ATOM 1049 CG ARG A 2 -3.730 10.871 11.430 1.00 0.00 C ATOM 1050 CD ARG A 2 -4.450 11.409 10.194 1.00 0.00 C ATOM 1051 NE ARG A 2 -3.433 11.909 9.226 1.00 0.00 N ATOM 1052 CZ ARG A 2 -3.788 12.229 8.015 1.00 0.00 C ATOM 1053 NH1 ARG A 2 -5.037 12.131 7.661 1.00 0.00 N ATOM 1054 NH2 ARG A 2 -2.896 12.649 7.160 1.00 0.00 N ATOM 0 H ARG A 2 -4.798 12.179 13.324 1.00 0.00 H new ATOM 0 HA ARG A 2 -6.528 10.702 11.546 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -4.174 9.656 13.159 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -4.805 9.012 11.657 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -3.416 11.700 12.065 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -2.827 10.340 11.130 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -5.053 10.624 9.737 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -5.132 12.212 10.474 1.00 0.00 H new ATOM 0 HE ARG A 2 -2.458 12.001 9.512 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -5.733 11.805 8.331 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -5.320 12.381 6.713 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -1.918 12.727 7.440 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -3.177 12.899 6.212 1.00 0.00 H new ATOM 1068 N ALA A 3 -6.516 10.035 14.759 1.00 0.00 N ATOM 1069 CA ALA A 3 -7.206 9.280 15.847 1.00 0.00 C ATOM 1070 C ALA A 3 -8.717 9.201 15.590 1.00 0.00 C ATOM 1071 O ALA A 3 -9.404 10.203 15.563 1.00 0.00 O ATOM 1072 CB ALA A 3 -6.973 10.015 17.170 1.00 0.00 C ATOM 0 H ALA A 3 -5.849 10.735 15.084 1.00 0.00 H new ATOM 0 HA ALA A 3 -6.805 8.267 15.882 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -7.470 9.477 17.977 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -5.903 10.067 17.374 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -7.379 11.024 17.102 1.00 0.00 H new ATOM 1078 N GLY A 4 -9.246 8.013 15.438 1.00 0.00 N ATOM 1079 CA GLY A 4 -10.722 7.864 15.226 1.00 0.00 C ATOM 1080 C GLY A 4 -11.083 7.995 13.744 1.00 0.00 C ATOM 1081 O GLY A 4 -12.214 7.781 13.356 1.00 0.00 O ATOM 0 H GLY A 4 -8.721 7.139 15.451 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.050 6.894 15.599 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.253 8.622 15.801 1.00 0.00 H new ATOM 1085 N THR A 5 -10.150 8.357 12.913 1.00 0.00 N ATOM 1086 CA THR A 5 -10.475 8.509 11.469 1.00 0.00 C ATOM 1087 C THR A 5 -10.776 7.144 10.863 1.00 0.00 C ATOM 1088 O THR A 5 -9.904 6.311 10.708 1.00 0.00 O ATOM 1089 CB THR A 5 -9.296 9.133 10.732 1.00 0.00 C ATOM 1090 OG1 THR A 5 -8.816 10.243 11.477 1.00 0.00 O ATOM 1091 CG2 THR A 5 -9.742 9.603 9.341 1.00 0.00 C ATOM 0 H THR A 5 -9.182 8.553 13.168 1.00 0.00 H new ATOM 0 HA THR A 5 -11.347 9.155 11.371 1.00 0.00 H new ATOM 0 HB THR A 5 -8.504 8.393 10.621 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.783 10.009 12.428 1.00 0.00 H new ATOM 0 HG21 THR A 5 -8.895 10.048 8.819 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.113 8.751 8.771 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.535 10.344 9.444 1.00 0.00 H new ATOM 1099 N VAL A 6 -12.009 6.930 10.494 1.00 0.00 N ATOM 1100 CA VAL A 6 -12.415 5.643 9.858 1.00 0.00 C ATOM 1101 C VAL A 6 -12.905 5.973 8.462 1.00 0.00 C ATOM 1102 O VAL A 6 -13.525 6.995 8.242 1.00 0.00 O ATOM 1103 CB VAL A 6 -13.542 4.982 10.656 1.00 0.00 C ATOM 1104 CG1 VAL A 6 -12.999 4.510 12.005 1.00 0.00 C ATOM 1105 CG2 VAL A 6 -14.677 5.984 10.885 1.00 0.00 C ATOM 0 H VAL A 6 -12.766 7.604 10.608 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.574 4.950 9.830 1.00 0.00 H new ATOM 0 HB VAL A 6 -13.926 4.129 10.096 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -13.800 4.039 12.575 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -12.197 3.790 11.843 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -12.612 5.364 12.561 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -15.475 5.506 11.453 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -14.299 6.842 11.441 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -15.067 6.319 9.924 1.00 0.00 H new ATOM 1115 N CYS A 7 -12.634 5.146 7.505 1.00 0.00 N ATOM 1116 CA CYS A 7 -13.087 5.449 6.132 1.00 0.00 C ATOM 1117 C CYS A 7 -14.599 5.520 6.084 1.00 0.00 C ATOM 1118 O CYS A 7 -15.295 4.550 6.308 1.00 0.00 O ATOM 1119 CB CYS A 7 -12.588 4.356 5.208 1.00 0.00 C ATOM 1120 SG CYS A 7 -12.989 4.771 3.494 1.00 0.00 S ATOM 0 H CYS A 7 -12.118 4.273 7.614 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.689 6.413 5.816 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -11.510 4.236 5.320 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -13.044 3.403 5.477 1.00 0.00 H new ATOM 1125 N SER A 8 -15.104 6.671 5.778 1.00 0.00 N ATOM 1126 CA SER A 8 -16.565 6.840 5.691 1.00 0.00 C ATOM 1127 C SER A 8 -17.124 5.900 4.624 1.00 0.00 C ATOM 1128 O SER A 8 -18.197 5.351 4.776 1.00 0.00 O ATOM 1129 CB SER A 8 -16.884 8.287 5.315 1.00 0.00 C ATOM 1130 OG SER A 8 -16.425 9.150 6.347 1.00 0.00 O ATOM 0 H SER A 8 -14.559 7.511 5.582 1.00 0.00 H new ATOM 0 HA SER A 8 -17.019 6.604 6.654 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.405 8.544 4.370 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.958 8.410 5.172 1.00 0.00 H new ATOM 0 HG SER A 8 -15.462 9.300 6.244 1.00 0.00 H new ATOM 1136 N ASN A 9 -16.431 5.731 3.519 1.00 0.00 N ATOM 1137 CA ASN A 9 -16.978 4.852 2.448 1.00 0.00 C ATOM 1138 C ASN A 9 -16.830 3.362 2.780 1.00 0.00 C ATOM 1139 O ASN A 9 -17.720 2.597 2.465 1.00 0.00 O ATOM 1140 CB ASN A 9 -16.256 5.142 1.129 1.00 0.00 C ATOM 1141 CG ASN A 9 -16.659 6.525 0.603 1.00 0.00 C ATOM 1142 OD1 ASN A 9 -16.039 7.042 -0.305 1.00 0.00 O ATOM 1143 ND2 ASN A 9 -17.674 7.152 1.135 1.00 0.00 N ATOM 0 H ASN A 9 -15.526 6.158 3.320 1.00 0.00 H new ATOM 0 HA ASN A 9 -18.043 5.071 2.364 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -15.177 5.101 1.279 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -16.505 4.377 0.393 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -17.944 8.072 0.788 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -18.197 6.721 1.897 1.00 0.00 H new ATOM 1150 N CYS A 10 -15.728 2.905 3.371 1.00 0.00 N ATOM 1151 CA CYS A 10 -15.607 1.423 3.644 1.00 0.00 C ATOM 1152 C CYS A 10 -15.213 1.119 5.099 1.00 0.00 C ATOM 1153 O CYS A 10 -14.937 -0.015 5.430 1.00 0.00 O ATOM 1154 CB CYS A 10 -14.613 0.775 2.664 1.00 0.00 C ATOM 1155 SG CYS A 10 -12.904 1.092 3.171 1.00 0.00 S ATOM 0 H CYS A 10 -14.936 3.476 3.665 1.00 0.00 H new ATOM 0 HA CYS A 10 -16.595 0.989 3.489 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -14.789 -0.300 2.619 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -14.777 1.168 1.661 1.00 0.00 H new ATOM 1160 N GLN A 11 -15.241 2.088 5.981 1.00 0.00 N ATOM 1161 CA GLN A 11 -14.939 1.818 7.428 1.00 0.00 C ATOM 1162 C GLN A 11 -13.494 1.343 7.681 1.00 0.00 C ATOM 1163 O GLN A 11 -13.107 1.147 8.814 1.00 0.00 O ATOM 1164 CB GLN A 11 -15.928 0.760 7.947 1.00 0.00 C ATOM 1165 CG GLN A 11 -15.966 0.777 9.476 1.00 0.00 C ATOM 1166 CD GLN A 11 -17.033 -0.196 9.976 1.00 0.00 C ATOM 1167 OE1 GLN A 11 -17.174 -1.284 9.455 1.00 0.00 O ATOM 1168 NE2 GLN A 11 -17.793 0.153 10.977 1.00 0.00 N ATOM 0 H GLN A 11 -15.461 3.060 5.763 1.00 0.00 H new ATOM 0 HA GLN A 11 -15.047 2.762 7.962 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -16.924 0.956 7.549 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -15.633 -0.228 7.594 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -14.991 0.500 9.877 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -16.183 1.784 9.833 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -17.673 1.067 11.414 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -18.507 -0.488 11.323 1.00 0.00 H new ATOM 1177 N THR A 12 -12.676 1.160 6.685 1.00 0.00 N ATOM 1178 CA THR A 12 -11.284 0.705 6.993 1.00 0.00 C ATOM 1179 C THR A 12 -10.587 1.772 7.859 1.00 0.00 C ATOM 1180 O THR A 12 -10.988 2.919 7.864 1.00 0.00 O ATOM 1181 CB THR A 12 -10.504 0.459 5.684 1.00 0.00 C ATOM 1182 OG1 THR A 12 -9.315 -0.264 5.972 1.00 0.00 O ATOM 1183 CG2 THR A 12 -10.136 1.773 4.987 1.00 0.00 C ATOM 0 H THR A 12 -12.896 1.299 5.699 1.00 0.00 H new ATOM 0 HA THR A 12 -11.315 -0.234 7.545 1.00 0.00 H new ATOM 0 HB THR A 12 -11.147 -0.112 5.014 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.819 -0.423 5.142 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.588 1.557 4.070 1.00 0.00 H new ATOM 0 HG22 THR A 12 -11.045 2.324 4.746 1.00 0.00 H new ATOM 0 HG23 THR A 12 -9.513 2.374 5.649 1.00 0.00 H new ATOM 1191 N SER A 13 -9.544 1.417 8.579 1.00 0.00 N ATOM 1192 CA SER A 13 -8.816 2.430 9.425 1.00 0.00 C ATOM 1193 C SER A 13 -7.303 2.236 9.233 1.00 0.00 C ATOM 1194 O SER A 13 -6.494 2.764 9.970 1.00 0.00 O ATOM 1195 CB SER A 13 -9.192 2.244 10.899 1.00 0.00 C ATOM 1196 OG SER A 13 -10.583 1.962 10.996 1.00 0.00 O ATOM 0 H SER A 13 -9.164 0.471 8.619 1.00 0.00 H new ATOM 0 HA SER A 13 -9.097 3.439 9.123 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.613 1.430 11.334 1.00 0.00 H new ATOM 0 HB3 SER A 13 -8.951 3.144 11.464 1.00 0.00 H new ATOM 0 HG SER A 13 -10.827 1.841 11.937 1.00 0.00 H new ATOM 1202 N THR A 14 -6.929 1.475 8.234 1.00 0.00 N ATOM 1203 CA THR A 14 -5.480 1.213 7.937 1.00 0.00 C ATOM 1204 C THR A 14 -5.138 1.827 6.583 1.00 0.00 C ATOM 1205 O THR A 14 -4.619 1.179 5.707 1.00 0.00 O ATOM 1206 CB THR A 14 -5.253 -0.296 7.861 1.00 0.00 C ATOM 1207 OG1 THR A 14 -5.725 -0.777 6.610 1.00 0.00 O ATOM 1208 CG2 THR A 14 -6.010 -0.989 8.991 1.00 0.00 C ATOM 0 H THR A 14 -7.578 1.014 7.597 1.00 0.00 H new ATOM 0 HA THR A 14 -4.855 1.647 8.718 1.00 0.00 H new ATOM 0 HB THR A 14 -4.189 -0.509 7.960 1.00 0.00 H new ATOM 0 HG1 THR A 14 -5.242 -0.330 5.884 1.00 0.00 H new ATOM 0 HG21 THR A 14 -5.845 -2.065 8.933 1.00 0.00 H new ATOM 0 HG22 THR A 14 -5.650 -0.618 9.951 1.00 0.00 H new ATOM 0 HG23 THR A 14 -7.076 -0.779 8.897 1.00 0.00 H new ATOM 1216 N THR A 15 -5.503 3.046 6.385 1.00 0.00 N ATOM 1217 CA THR A 15 -5.282 3.699 5.058 1.00 0.00 C ATOM 1218 C THR A 15 -3.829 4.117 4.860 1.00 0.00 C ATOM 1219 O THR A 15 -3.148 4.510 5.785 1.00 0.00 O ATOM 1220 CB THR A 15 -6.150 4.952 5.001 1.00 0.00 C ATOM 1221 OG1 THR A 15 -5.481 6.023 5.654 1.00 0.00 O ATOM 1222 CG2 THR A 15 -7.448 4.667 5.734 1.00 0.00 C ATOM 0 H THR A 15 -5.951 3.636 7.086 1.00 0.00 H new ATOM 0 HA THR A 15 -5.538 2.984 4.276 1.00 0.00 H new ATOM 0 HB THR A 15 -6.345 5.223 3.963 1.00 0.00 H new ATOM 0 HG1 THR A 15 -6.120 6.520 6.206 1.00 0.00 H new ATOM 0 HG21 THR A 15 -8.084 5.552 5.705 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.962 3.835 5.253 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.231 4.410 6.771 1.00 0.00 H new ATOM 1230 N THR A 16 -3.368 4.086 3.635 1.00 0.00 N ATOM 1231 CA THR A 16 -1.982 4.537 3.360 1.00 0.00 C ATOM 1232 C THR A 16 -1.999 6.069 3.347 1.00 0.00 C ATOM 1233 O THR A 16 -1.104 6.720 3.849 1.00 0.00 O ATOM 1234 CB THR A 16 -1.499 4.039 1.993 1.00 0.00 C ATOM 1235 OG1 THR A 16 -2.411 4.449 0.985 1.00 0.00 O ATOM 1236 CG2 THR A 16 -1.358 2.518 1.972 1.00 0.00 C ATOM 0 H THR A 16 -3.894 3.768 2.821 1.00 0.00 H new ATOM 0 HA THR A 16 -1.310 4.142 4.122 1.00 0.00 H new ATOM 0 HB THR A 16 -0.517 4.473 1.802 1.00 0.00 H new ATOM 0 HG1 THR A 16 -2.190 4.001 0.142 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.014 2.198 0.988 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.635 2.209 2.727 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.324 2.060 2.185 1.00 0.00 H new ATOM 1244 N LEU A 17 -3.043 6.647 2.790 1.00 0.00 N ATOM 1245 CA LEU A 17 -3.166 8.142 2.753 1.00 0.00 C ATOM 1246 C LEU A 17 -4.648 8.505 2.945 1.00 0.00 C ATOM 1247 O LEU A 17 -5.513 7.972 2.276 1.00 0.00 O ATOM 1248 CB LEU A 17 -2.663 8.695 1.394 1.00 0.00 C ATOM 1249 CG LEU A 17 -2.026 10.083 1.578 1.00 0.00 C ATOM 1250 CD1 LEU A 17 -0.585 9.938 2.105 1.00 0.00 C ATOM 1251 CD2 LEU A 17 -2.000 10.802 0.224 1.00 0.00 C ATOM 0 H LEU A 17 -3.818 6.143 2.358 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.559 8.582 3.544 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.934 8.009 0.963 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.494 8.760 0.692 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.611 10.657 2.297 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.143 10.926 2.232 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.599 9.421 3.064 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.007 9.364 1.392 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.550 11.787 0.344 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -1.413 10.219 -0.486 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -3.018 10.911 -0.150 1.00 0.00 H new ATOM 1263 N TRP A 18 -4.951 9.406 3.842 1.00 0.00 N ATOM 1264 CA TRP A 18 -6.373 9.796 4.055 1.00 0.00 C ATOM 1265 C TRP A 18 -6.778 10.810 2.986 1.00 0.00 C ATOM 1266 O TRP A 18 -6.108 11.802 2.779 1.00 0.00 O ATOM 1267 CB TRP A 18 -6.512 10.448 5.433 1.00 0.00 C ATOM 1268 CG TRP A 18 -6.516 9.396 6.497 1.00 0.00 C ATOM 1269 CD1 TRP A 18 -5.517 9.186 7.383 1.00 0.00 C ATOM 1270 CD2 TRP A 18 -7.544 8.407 6.801 1.00 0.00 C ATOM 1271 NE1 TRP A 18 -5.867 8.132 8.208 1.00 0.00 N ATOM 1272 CE2 TRP A 18 -7.104 7.623 7.892 1.00 0.00 C ATOM 1273 CE3 TRP A 18 -8.803 8.117 6.244 1.00 0.00 C ATOM 1274 CZ2 TRP A 18 -7.881 6.589 8.412 1.00 0.00 C ATOM 1275 CZ3 TRP A 18 -9.585 7.073 6.766 1.00 0.00 C ATOM 1276 CH2 TRP A 18 -9.125 6.311 7.847 1.00 0.00 C ATOM 0 H TRP A 18 -4.275 9.887 4.435 1.00 0.00 H new ATOM 0 HA TRP A 18 -7.011 8.914 3.994 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -5.690 11.143 5.600 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.434 11.028 5.479 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.597 9.749 7.438 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -5.278 7.775 8.960 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -9.170 8.699 5.412 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -7.522 6.007 9.248 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -10.549 6.856 6.330 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -9.732 5.510 8.242 1.00 0.00 H new ATOM 1287 N ARG A 19 -7.865 10.565 2.302 1.00 0.00 N ATOM 1288 CA ARG A 19 -8.320 11.506 1.233 1.00 0.00 C ATOM 1289 C ARG A 19 -9.642 12.144 1.659 1.00 0.00 C ATOM 1290 O ARG A 19 -10.641 11.468 1.765 1.00 0.00 O ATOM 1291 CB ARG A 19 -8.575 10.724 -0.073 1.00 0.00 C ATOM 1292 CG ARG A 19 -7.469 9.702 -0.325 1.00 0.00 C ATOM 1293 CD ARG A 19 -6.215 10.409 -0.804 1.00 0.00 C ATOM 1294 NE ARG A 19 -5.170 9.388 -1.099 1.00 0.00 N ATOM 1295 CZ ARG A 19 -4.115 9.697 -1.799 1.00 0.00 C ATOM 1296 NH1 ARG A 19 -3.924 10.916 -2.212 1.00 0.00 N ATOM 1297 NH2 ARG A 19 -3.238 8.781 -2.081 1.00 0.00 N ATOM 0 H ARG A 19 -8.461 9.749 2.438 1.00 0.00 H new ATOM 0 HA ARG A 19 -7.553 12.265 1.077 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -9.538 10.216 -0.015 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -8.631 11.418 -0.911 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -7.258 9.148 0.590 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -7.795 8.976 -1.070 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -6.431 10.997 -1.696 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -5.860 11.104 -0.043 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.282 8.436 -0.749 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.604 11.643 -1.989 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -3.094 11.145 -2.759 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.377 7.825 -1.755 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.411 9.018 -2.629 1.00 0.00 H new ATOM 1311 N ARG A 20 -9.693 13.423 1.875 1.00 0.00 N ATOM 1312 CA ARG A 20 -11.004 14.017 2.244 1.00 0.00 C ATOM 1313 C ARG A 20 -11.902 13.861 1.015 1.00 0.00 C ATOM 1314 O ARG A 20 -11.446 13.998 -0.102 1.00 0.00 O ATOM 1315 CB ARG A 20 -10.842 15.502 2.584 1.00 0.00 C ATOM 1316 CG ARG A 20 -12.156 16.062 3.159 1.00 0.00 C ATOM 1317 CD ARG A 20 -12.242 15.775 4.662 1.00 0.00 C ATOM 1318 NE ARG A 20 -13.477 16.398 5.214 1.00 0.00 N ATOM 1319 CZ ARG A 20 -13.891 16.065 6.405 1.00 0.00 C ATOM 1320 NH1 ARG A 20 -13.228 15.179 7.096 1.00 0.00 N ATOM 1321 NH2 ARG A 20 -14.964 16.615 6.903 1.00 0.00 N ATOM 0 H ARG A 20 -8.907 14.070 1.815 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.427 13.524 3.119 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.036 15.631 3.306 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -10.561 16.059 1.690 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -12.210 17.136 2.983 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -13.006 15.612 2.646 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -12.254 14.699 4.838 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -11.363 16.171 5.170 1.00 0.00 H new ATOM 0 HE ARG A 20 -13.996 17.082 4.663 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -12.390 14.750 6.704 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -13.548 14.915 8.028 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -15.481 17.307 6.361 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -15.286 16.353 7.835 1.00 0.00 H new ATOM 1335 N SER A 21 -13.162 13.563 1.193 1.00 0.00 N ATOM 1336 CA SER A 21 -14.056 13.386 0.001 1.00 0.00 C ATOM 1337 C SER A 21 -14.712 14.739 -0.350 1.00 0.00 C ATOM 1338 O SER A 21 -14.893 15.570 0.510 1.00 0.00 O ATOM 1339 CB SER A 21 -15.126 12.339 0.330 1.00 0.00 C ATOM 1340 OG SER A 21 -16.284 12.992 0.830 1.00 0.00 O ATOM 0 H SER A 21 -13.611 13.435 2.100 1.00 0.00 H new ATOM 0 HA SER A 21 -13.477 13.044 -0.857 1.00 0.00 H new ATOM 0 HB2 SER A 21 -15.375 11.764 -0.562 1.00 0.00 H new ATOM 0 HB3 SER A 21 -14.745 11.633 1.068 1.00 0.00 H new ATOM 0 HG SER A 21 -17.059 12.399 0.740 1.00 0.00 H new ATOM 1346 N PRO A 22 -15.055 14.972 -1.605 1.00 0.00 N ATOM 1347 CA PRO A 22 -15.693 16.263 -2.009 1.00 0.00 C ATOM 1348 C PRO A 22 -16.849 16.687 -1.084 1.00 0.00 C ATOM 1349 O PRO A 22 -17.179 17.852 -0.983 1.00 0.00 O ATOM 1350 CB PRO A 22 -16.218 15.937 -3.423 1.00 0.00 C ATOM 1351 CG PRO A 22 -15.574 14.617 -3.892 1.00 0.00 C ATOM 1352 CD PRO A 22 -14.826 13.990 -2.705 1.00 0.00 C ATOM 0 HA PRO A 22 -14.997 17.100 -1.961 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -17.304 15.846 -3.412 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -15.973 16.744 -4.113 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -16.338 13.933 -4.262 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -14.887 14.803 -4.717 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -15.220 13.005 -2.455 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -13.765 13.864 -2.918 1.00 0.00 H new ATOM 1360 N MET A 23 -17.467 15.746 -0.417 1.00 0.00 N ATOM 1361 CA MET A 23 -18.604 16.085 0.493 1.00 0.00 C ATOM 1362 C MET A 23 -18.069 16.357 1.900 1.00 0.00 C ATOM 1363 O MET A 23 -18.732 16.953 2.725 1.00 0.00 O ATOM 1364 CB MET A 23 -19.593 14.916 0.526 1.00 0.00 C ATOM 1365 CG MET A 23 -20.864 15.341 1.262 1.00 0.00 C ATOM 1366 SD MET A 23 -22.040 13.967 1.287 1.00 0.00 S ATOM 1367 CE MET A 23 -23.406 14.859 2.067 1.00 0.00 C ATOM 0 H MET A 23 -17.233 14.754 -0.463 1.00 0.00 H new ATOM 0 HA MET A 23 -19.114 16.977 0.128 1.00 0.00 H new ATOM 0 HB2 MET A 23 -19.836 14.603 -0.489 1.00 0.00 H new ATOM 0 HB3 MET A 23 -19.141 14.058 1.024 1.00 0.00 H new ATOM 0 HG2 MET A 23 -20.622 15.644 2.281 1.00 0.00 H new ATOM 0 HG3 MET A 23 -21.310 16.205 0.769 1.00 0.00 H new ATOM 0 HE1 MET A 23 -24.258 14.190 2.184 1.00 0.00 H new ATOM 0 HE2 MET A 23 -23.092 15.221 3.046 1.00 0.00 H new ATOM 0 HE3 MET A 23 -23.692 15.705 1.442 1.00 0.00 H new ATOM 1377 N GLY A 24 -16.864 15.931 2.174 1.00 0.00 N ATOM 1378 CA GLY A 24 -16.255 16.162 3.521 1.00 0.00 C ATOM 1379 C GLY A 24 -16.337 14.883 4.357 1.00 0.00 C ATOM 1380 O GLY A 24 -16.302 14.923 5.572 1.00 0.00 O ATOM 0 H GLY A 24 -16.268 15.428 1.516 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -15.215 16.469 3.411 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.775 16.973 4.030 1.00 0.00 H new ATOM 1384 N ASP A 25 -16.446 13.747 3.720 1.00 0.00 N ATOM 1385 CA ASP A 25 -16.529 12.453 4.462 1.00 0.00 C ATOM 1386 C ASP A 25 -15.150 11.753 4.434 1.00 0.00 C ATOM 1387 O ASP A 25 -14.721 11.316 3.387 1.00 0.00 O ATOM 1388 CB ASP A 25 -17.536 11.556 3.733 1.00 0.00 C ATOM 1389 CG ASP A 25 -18.884 12.274 3.620 1.00 0.00 C ATOM 1390 OD1 ASP A 25 -18.879 13.487 3.487 1.00 0.00 O ATOM 1391 OD2 ASP A 25 -19.899 11.597 3.666 1.00 0.00 O ATOM 0 H ASP A 25 -16.482 13.659 2.704 1.00 0.00 H new ATOM 0 HA ASP A 25 -16.831 12.632 5.494 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -17.162 11.306 2.740 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -17.658 10.617 4.273 1.00 0.00 H new ATOM 1396 N PRO A 26 -14.445 11.630 5.545 1.00 0.00 N ATOM 1397 CA PRO A 26 -13.109 10.950 5.529 1.00 0.00 C ATOM 1398 C PRO A 26 -13.141 9.594 4.792 1.00 0.00 C ATOM 1399 O PRO A 26 -13.963 8.748 5.082 1.00 0.00 O ATOM 1400 CB PRO A 26 -12.843 10.766 7.034 1.00 0.00 C ATOM 1401 CG PRO A 26 -13.686 11.813 7.770 1.00 0.00 C ATOM 1402 CD PRO A 26 -14.894 12.138 6.879 1.00 0.00 C ATOM 0 HA PRO A 26 -12.342 11.515 4.999 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -13.114 9.760 7.353 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -11.784 10.897 7.257 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -14.014 11.431 8.737 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -13.099 12.711 7.964 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -15.800 11.638 7.222 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -15.109 13.206 6.857 1.00 0.00 H new ATOM 1410 N VAL A 27 -12.230 9.375 3.865 1.00 0.00 N ATOM 1411 CA VAL A 27 -12.190 8.054 3.135 1.00 0.00 C ATOM 1412 C VAL A 27 -10.747 7.558 3.025 1.00 0.00 C ATOM 1413 O VAL A 27 -9.808 8.317 3.166 1.00 0.00 O ATOM 1414 CB VAL A 27 -12.813 8.154 1.742 1.00 0.00 C ATOM 1415 CG1 VAL A 27 -14.325 8.354 1.875 1.00 0.00 C ATOM 1416 CG2 VAL A 27 -12.180 9.314 0.973 1.00 0.00 C ATOM 0 H VAL A 27 -11.517 10.047 3.582 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.779 7.341 3.712 1.00 0.00 H new ATOM 0 HB VAL A 27 -12.627 7.233 1.189 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.771 8.426 0.883 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.759 7.508 2.408 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -14.523 9.271 2.429 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.628 9.380 -0.019 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.353 10.245 1.512 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -11.108 9.144 0.876 1.00 0.00 H new ATOM 1426 N CYS A 28 -10.555 6.279 2.787 1.00 0.00 N ATOM 1427 CA CYS A 28 -9.170 5.736 2.686 1.00 0.00 C ATOM 1428 C CYS A 28 -8.590 5.954 1.285 1.00 0.00 C ATOM 1429 O CYS A 28 -9.296 6.173 0.320 1.00 0.00 O ATOM 1430 CB CYS A 28 -9.145 4.243 3.083 1.00 0.00 C ATOM 1431 SG CYS A 28 -9.949 3.178 1.850 1.00 0.00 S ATOM 0 H CYS A 28 -11.299 5.593 2.659 1.00 0.00 H new ATOM 0 HA CYS A 28 -8.537 6.281 3.386 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -8.111 3.923 3.215 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -9.642 4.118 4.045 1.00 0.00 H new ATOM 1436 N ASN A 29 -7.289 5.921 1.197 1.00 0.00 N ATOM 1437 CA ASN A 29 -6.576 6.153 -0.094 1.00 0.00 C ATOM 1438 C ASN A 29 -7.233 5.400 -1.251 1.00 0.00 C ATOM 1439 O ASN A 29 -7.425 5.945 -2.319 1.00 0.00 O ATOM 1440 CB ASN A 29 -5.141 5.647 0.069 1.00 0.00 C ATOM 1441 CG ASN A 29 -4.333 5.934 -1.194 1.00 0.00 C ATOM 1442 OD1 ASN A 29 -4.873 5.969 -2.280 1.00 0.00 O ATOM 1443 ND2 ASN A 29 -3.048 6.140 -1.093 1.00 0.00 N ATOM 0 H ASN A 29 -6.672 5.738 1.988 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.609 7.217 -0.327 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.673 6.130 0.926 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -5.146 4.576 0.270 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.495 6.331 -1.928 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -2.597 6.110 -0.179 1.00 0.00 H new ATOM 1450 N ALA A 30 -7.557 4.160 -1.072 1.00 0.00 N ATOM 1451 CA ALA A 30 -8.168 3.396 -2.195 1.00 0.00 C ATOM 1452 C ALA A 30 -9.580 3.921 -2.527 1.00 0.00 C ATOM 1453 O ALA A 30 -9.881 4.206 -3.668 1.00 0.00 O ATOM 1454 CB ALA A 30 -8.224 1.918 -1.821 1.00 0.00 C ATOM 0 H ALA A 30 -7.429 3.639 -0.205 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.553 3.527 -3.085 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -8.670 1.352 -2.639 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -7.215 1.551 -1.635 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.827 1.793 -0.922 1.00 0.00 H new ATOM 1460 N CYS A 31 -10.450 4.047 -1.554 1.00 0.00 N ATOM 1461 CA CYS A 31 -11.830 4.546 -1.865 1.00 0.00 C ATOM 1462 C CYS A 31 -11.733 5.889 -2.579 1.00 0.00 C ATOM 1463 O CYS A 31 -12.385 6.132 -3.555 1.00 0.00 O ATOM 1464 CB CYS A 31 -12.637 4.770 -0.578 1.00 0.00 C ATOM 1465 SG CYS A 31 -13.208 3.205 0.111 1.00 0.00 S ATOM 0 H CYS A 31 -10.271 3.831 -0.573 1.00 0.00 H new ATOM 0 HA CYS A 31 -12.323 3.798 -2.486 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -12.021 5.290 0.155 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -13.492 5.412 -0.789 1.00 0.00 H new ATOM 1470 N GLY A 32 -10.934 6.772 -2.085 1.00 0.00 N ATOM 1471 CA GLY A 32 -10.834 8.104 -2.731 1.00 0.00 C ATOM 1472 C GLY A 32 -10.513 7.953 -4.218 1.00 0.00 C ATOM 1473 O GLY A 32 -11.145 8.556 -5.063 1.00 0.00 O ATOM 0 H GLY A 32 -10.344 6.636 -1.264 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.772 8.646 -2.608 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.058 8.694 -2.243 1.00 0.00 H new ATOM 1477 N LEU A 33 -9.529 7.169 -4.548 1.00 0.00 N ATOM 1478 CA LEU A 33 -9.163 7.000 -5.982 1.00 0.00 C ATOM 1479 C LEU A 33 -10.251 6.217 -6.720 1.00 0.00 C ATOM 1480 O LEU A 33 -10.754 6.650 -7.735 1.00 0.00 O ATOM 1481 CB LEU A 33 -7.837 6.245 -6.057 1.00 0.00 C ATOM 1482 CG LEU A 33 -6.771 7.028 -5.279 1.00 0.00 C ATOM 1483 CD1 LEU A 33 -5.479 6.205 -5.206 1.00 0.00 C ATOM 1484 CD2 LEU A 33 -6.501 8.382 -5.966 1.00 0.00 C ATOM 0 H LEU A 33 -8.961 6.637 -3.888 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.066 7.977 -6.454 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.949 5.245 -5.639 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.531 6.124 -7.096 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.132 7.217 -4.268 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.723 6.763 -4.653 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.677 5.261 -4.698 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.117 6.006 -6.215 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.743 8.930 -5.406 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.147 8.210 -6.983 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -7.422 8.965 -5.996 1.00 0.00 H new ATOM 1496 N TYR A 34 -10.625 5.072 -6.227 1.00 0.00 N ATOM 1497 CA TYR A 34 -11.684 4.285 -6.921 1.00 0.00 C ATOM 1498 C TYR A 34 -12.971 5.105 -6.984 1.00 0.00 C ATOM 1499 O TYR A 34 -13.612 5.200 -8.011 1.00 0.00 O ATOM 1500 CB TYR A 34 -11.951 2.982 -6.157 1.00 0.00 C ATOM 1501 CG TYR A 34 -13.150 2.285 -6.761 1.00 0.00 C ATOM 1502 CD1 TYR A 34 -14.443 2.695 -6.416 1.00 0.00 C ATOM 1503 CD2 TYR A 34 -12.969 1.243 -7.674 1.00 0.00 C ATOM 1504 CE1 TYR A 34 -15.554 2.062 -6.985 1.00 0.00 C ATOM 1505 CE2 TYR A 34 -14.081 0.607 -8.241 1.00 0.00 C ATOM 1506 CZ TYR A 34 -15.373 1.018 -7.896 1.00 0.00 C ATOM 1507 OH TYR A 34 -16.469 0.395 -8.458 1.00 0.00 O ATOM 0 H TYR A 34 -10.248 4.647 -5.380 1.00 0.00 H new ATOM 0 HA TYR A 34 -11.349 4.049 -7.931 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -11.076 2.333 -6.205 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -12.132 3.195 -5.104 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -14.583 3.500 -5.710 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -11.972 0.928 -7.943 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -16.551 2.380 -6.720 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -13.941 -0.200 -8.944 1.00 0.00 H new ATOM 0 HH TYR A 34 -16.238 0.071 -9.353 1.00 0.00 H new ATOM 1517 N TYR A 35 -13.360 5.682 -5.887 1.00 0.00 N ATOM 1518 CA TYR A 35 -14.610 6.480 -5.860 1.00 0.00 C ATOM 1519 C TYR A 35 -14.511 7.639 -6.854 1.00 0.00 C ATOM 1520 O TYR A 35 -15.422 7.923 -7.583 1.00 0.00 O ATOM 1521 CB TYR A 35 -14.832 7.038 -4.446 1.00 0.00 C ATOM 1522 CG TYR A 35 -16.269 7.456 -4.303 1.00 0.00 C ATOM 1523 CD1 TYR A 35 -16.653 8.742 -4.675 1.00 0.00 C ATOM 1524 CD2 TYR A 35 -17.213 6.551 -3.806 1.00 0.00 C ATOM 1525 CE1 TYR A 35 -17.991 9.133 -4.552 1.00 0.00 C ATOM 1526 CE2 TYR A 35 -18.551 6.933 -3.680 1.00 0.00 C ATOM 1527 CZ TYR A 35 -18.942 8.229 -4.054 1.00 0.00 C ATOM 1528 OH TYR A 35 -20.262 8.615 -3.935 1.00 0.00 O ATOM 0 H TYR A 35 -12.860 5.634 -4.999 1.00 0.00 H new ATOM 0 HA TYR A 35 -15.448 5.840 -6.137 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -14.584 6.283 -3.700 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -14.173 7.888 -4.270 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -15.920 9.436 -5.058 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -16.907 5.556 -3.519 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -18.292 10.130 -4.840 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -19.281 6.235 -3.297 1.00 0.00 H new ATOM 0 HH TYR A 35 -20.789 7.871 -3.576 1.00 0.00 H new ATOM 1538 N LYS A 36 -13.426 8.333 -6.881 1.00 0.00 N ATOM 1539 CA LYS A 36 -13.322 9.476 -7.827 1.00 0.00 C ATOM 1540 C LYS A 36 -13.485 8.988 -9.271 1.00 0.00 C ATOM 1541 O LYS A 36 -14.224 9.561 -10.045 1.00 0.00 O ATOM 1542 CB LYS A 36 -11.947 10.116 -7.647 1.00 0.00 C ATOM 1543 CG LYS A 36 -11.784 11.305 -8.600 1.00 0.00 C ATOM 1544 CD LYS A 36 -10.491 12.071 -8.269 1.00 0.00 C ATOM 1545 CE LYS A 36 -9.273 11.355 -8.871 1.00 0.00 C ATOM 1546 NZ LYS A 36 -9.376 11.365 -10.358 1.00 0.00 N ATOM 0 H LYS A 36 -12.606 8.168 -6.297 1.00 0.00 H new ATOM 0 HA LYS A 36 -14.109 10.202 -7.623 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -11.825 10.448 -6.616 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.167 9.379 -7.838 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.754 10.954 -9.631 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -12.643 11.971 -8.515 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -10.553 13.087 -8.660 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.375 12.152 -7.188 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -8.354 11.850 -8.556 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -9.224 10.329 -8.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -8.551 10.880 -10.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -10.245 10.874 -10.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -9.403 12.348 -10.698 1.00 0.00 H new ATOM 1560 N LEU A 37 -12.796 7.949 -9.646 1.00 0.00 N ATOM 1561 CA LEU A 37 -12.910 7.446 -11.046 1.00 0.00 C ATOM 1562 C LEU A 37 -14.287 6.803 -11.300 1.00 0.00 C ATOM 1563 O LEU A 37 -14.851 6.961 -12.364 1.00 0.00 O ATOM 1564 CB LEU A 37 -11.797 6.414 -11.297 1.00 0.00 C ATOM 1565 CG LEU A 37 -10.486 7.127 -11.670 1.00 0.00 C ATOM 1566 CD1 LEU A 37 -10.182 8.245 -10.664 1.00 0.00 C ATOM 1567 CD2 LEU A 37 -9.341 6.112 -11.662 1.00 0.00 C ATOM 0 H LEU A 37 -12.159 7.425 -9.046 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.805 8.288 -11.730 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.647 5.805 -10.405 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.092 5.737 -12.099 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.589 7.565 -12.663 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.251 8.740 -10.941 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.995 8.971 -10.670 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -10.083 7.819 -9.666 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.409 6.612 -11.926 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.249 5.675 -10.668 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.548 5.325 -12.387 1.00 0.00 H new ATOM 1579 N HIS A 38 -14.820 6.056 -10.355 1.00 0.00 N ATOM 1580 CA HIS A 38 -16.147 5.379 -10.583 1.00 0.00 C ATOM 1581 C HIS A 38 -17.278 6.025 -9.769 1.00 0.00 C ATOM 1582 O HIS A 38 -18.432 5.876 -10.102 1.00 0.00 O ATOM 1583 CB HIS A 38 -16.027 3.909 -10.190 1.00 0.00 C ATOM 1584 CG HIS A 38 -15.087 3.224 -11.137 1.00 0.00 C ATOM 1585 ND1 HIS A 38 -15.540 2.482 -12.215 1.00 0.00 N ATOM 1586 CD2 HIS A 38 -13.717 3.168 -11.192 1.00 0.00 C ATOM 1587 CE1 HIS A 38 -14.462 2.016 -12.869 1.00 0.00 C ATOM 1588 NE2 HIS A 38 -13.323 2.405 -12.288 1.00 0.00 N ATOM 0 H HIS A 38 -14.398 5.886 -9.442 1.00 0.00 H new ATOM 0 HA HIS A 38 -16.398 5.484 -11.639 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -15.660 3.822 -9.167 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -17.006 3.431 -10.220 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -16.515 2.319 -12.467 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -13.046 3.643 -10.492 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -14.510 1.402 -13.756 1.00 0.00 H new ATOM 1596 N GLN A 39 -16.981 6.753 -8.727 1.00 0.00 N ATOM 1597 CA GLN A 39 -18.050 7.415 -7.913 1.00 0.00 C ATOM 1598 C GLN A 39 -19.185 6.431 -7.580 1.00 0.00 C ATOM 1599 O GLN A 39 -20.350 6.687 -7.778 1.00 0.00 O ATOM 1600 CB GLN A 39 -18.527 8.689 -8.634 1.00 0.00 C ATOM 1601 CG GLN A 39 -19.628 9.407 -7.836 1.00 0.00 C ATOM 1602 CD GLN A 39 -19.835 10.810 -8.407 1.00 0.00 C ATOM 1603 OE1 GLN A 39 -19.057 11.269 -9.219 1.00 0.00 O ATOM 1604 NE2 GLN A 39 -20.865 11.512 -8.020 1.00 0.00 N ATOM 0 H GLN A 39 -16.030 6.922 -8.398 1.00 0.00 H new ATOM 0 HA GLN A 39 -17.645 7.723 -6.949 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -17.683 9.363 -8.781 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -18.903 8.430 -9.624 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -20.558 8.841 -7.887 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -19.349 9.468 -6.784 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -21.518 11.126 -7.338 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -21.017 12.447 -8.399 1.00 0.00 H new ATOM 1613 N VAL A 40 -18.828 5.306 -7.023 1.00 0.00 N ATOM 1614 CA VAL A 40 -19.835 4.300 -6.604 1.00 0.00 C ATOM 1615 C VAL A 40 -19.271 3.543 -5.405 1.00 0.00 C ATOM 1616 O VAL A 40 -18.075 3.391 -5.265 1.00 0.00 O ATOM 1617 CB VAL A 40 -20.140 3.323 -7.734 1.00 0.00 C ATOM 1618 CG1 VAL A 40 -20.924 4.043 -8.834 1.00 0.00 C ATOM 1619 CG2 VAL A 40 -18.833 2.728 -8.302 1.00 0.00 C ATOM 0 H VAL A 40 -17.861 5.040 -6.839 1.00 0.00 H new ATOM 0 HA VAL A 40 -20.766 4.804 -6.343 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.743 2.503 -7.344 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.142 3.345 -9.642 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -21.858 4.426 -8.424 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.331 4.872 -9.221 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -19.070 2.033 -9.108 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -18.205 3.531 -8.688 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -18.300 2.199 -7.512 1.00 0.00 H new ATOM 1629 N ASN A 41 -20.113 3.074 -4.536 1.00 0.00 N ATOM 1630 CA ASN A 41 -19.607 2.332 -3.340 1.00 0.00 C ATOM 1631 C ASN A 41 -19.411 0.856 -3.706 1.00 0.00 C ATOM 1632 O ASN A 41 -20.264 0.259 -4.335 1.00 0.00 O ATOM 1633 CB ASN A 41 -20.614 2.446 -2.192 1.00 0.00 C ATOM 1634 CG ASN A 41 -22.022 2.127 -2.698 1.00 0.00 C ATOM 1635 OD1 ASN A 41 -22.287 1.029 -3.144 1.00 0.00 O ATOM 1636 ND2 ASN A 41 -22.943 3.050 -2.645 1.00 0.00 N ATOM 0 H ASN A 41 -21.127 3.168 -4.595 1.00 0.00 H new ATOM 0 HA ASN A 41 -18.656 2.761 -3.024 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -20.343 1.760 -1.390 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -20.588 3.452 -1.773 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.886 2.849 -2.978 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -22.720 3.972 -2.270 1.00 0.00 H new ATOM 1643 N ARG A 42 -18.293 0.262 -3.334 1.00 0.00 N ATOM 1644 CA ARG A 42 -18.036 -1.184 -3.676 1.00 0.00 C ATOM 1645 C ARG A 42 -17.846 -2.009 -2.373 1.00 0.00 C ATOM 1646 O ARG A 42 -17.422 -1.482 -1.362 1.00 0.00 O ATOM 1647 CB ARG A 42 -16.755 -1.289 -4.550 1.00 0.00 C ATOM 1648 CG ARG A 42 -17.104 -1.442 -6.050 1.00 0.00 C ATOM 1649 CD ARG A 42 -15.900 -2.026 -6.801 1.00 0.00 C ATOM 1650 NE ARG A 42 -16.255 -2.246 -8.233 1.00 0.00 N ATOM 1651 CZ ARG A 42 -15.315 -2.488 -9.108 1.00 0.00 C ATOM 1652 NH1 ARG A 42 -14.073 -2.577 -8.718 1.00 0.00 N ATOM 1653 NH2 ARG A 42 -15.618 -2.651 -10.368 1.00 0.00 N ATOM 0 H ARG A 42 -17.547 0.717 -2.808 1.00 0.00 H new ATOM 0 HA ARG A 42 -18.888 -1.580 -4.228 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -16.141 -0.400 -4.407 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -16.160 -2.142 -4.225 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -17.970 -2.093 -6.168 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -17.374 -0.474 -6.472 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -15.050 -1.347 -6.728 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -15.596 -2.968 -6.343 1.00 0.00 H new ATOM 0 HE ARG A 42 -17.230 -2.208 -8.529 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.838 -2.458 -7.733 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -13.337 -2.766 -9.399 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -16.590 -2.589 -10.671 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -14.883 -2.840 -11.049 1.00 0.00 H new ATOM 1667 N PRO A 43 -18.159 -3.297 -2.401 1.00 0.00 N ATOM 1668 CA PRO A 43 -18.010 -4.180 -1.197 1.00 0.00 C ATOM 1669 C PRO A 43 -16.563 -4.235 -0.663 1.00 0.00 C ATOM 1670 O PRO A 43 -15.608 -4.051 -1.391 1.00 0.00 O ATOM 1671 CB PRO A 43 -18.464 -5.555 -1.735 1.00 0.00 C ATOM 1672 CG PRO A 43 -18.589 -5.453 -3.264 1.00 0.00 C ATOM 1673 CD PRO A 43 -18.678 -3.968 -3.631 1.00 0.00 C ATOM 0 HA PRO A 43 -18.587 -3.823 -0.344 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -17.744 -6.327 -1.463 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -19.419 -5.840 -1.293 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -17.729 -5.915 -3.749 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -19.475 -5.986 -3.611 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -18.075 -3.730 -4.508 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -19.701 -3.667 -3.856 1.00 0.00 H new ATOM 1681 N LEU A 44 -16.412 -4.481 0.615 1.00 0.00 N ATOM 1682 CA LEU A 44 -15.051 -4.545 1.236 1.00 0.00 C ATOM 1683 C LEU A 44 -14.252 -5.742 0.695 1.00 0.00 C ATOM 1684 O LEU A 44 -13.355 -6.234 1.350 1.00 0.00 O ATOM 1685 CB LEU A 44 -15.202 -4.716 2.757 1.00 0.00 C ATOM 1686 CG LEU A 44 -15.635 -3.392 3.407 1.00 0.00 C ATOM 1687 CD1 LEU A 44 -17.138 -3.165 3.208 1.00 0.00 C ATOM 1688 CD2 LEU A 44 -15.326 -3.436 4.910 1.00 0.00 C ATOM 0 H LEU A 44 -17.183 -4.642 1.263 1.00 0.00 H new ATOM 0 HA LEU A 44 -14.521 -3.624 0.994 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -15.938 -5.491 2.970 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -14.257 -5.047 3.187 1.00 0.00 H new ATOM 0 HG LEU A 44 -15.087 -2.575 2.937 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -17.429 -2.223 3.674 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -17.362 -3.127 2.142 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -17.693 -3.983 3.666 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -15.633 -2.498 5.372 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -15.870 -4.261 5.369 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -14.256 -3.580 5.057 1.00 0.00 H new ATOM 1700 N THR A 45 -14.559 -6.221 -0.475 1.00 0.00 N ATOM 1701 CA THR A 45 -13.791 -7.384 -1.010 1.00 0.00 C ATOM 1702 C THR A 45 -12.323 -6.991 -1.186 1.00 0.00 C ATOM 1703 O THR A 45 -11.464 -7.832 -1.364 1.00 0.00 O ATOM 1704 CB THR A 45 -14.355 -7.797 -2.371 1.00 0.00 C ATOM 1705 OG1 THR A 45 -13.358 -8.506 -3.095 1.00 0.00 O ATOM 1706 CG2 THR A 45 -14.761 -6.550 -3.154 1.00 0.00 C ATOM 0 H THR A 45 -15.299 -5.865 -1.081 1.00 0.00 H new ATOM 0 HA THR A 45 -13.874 -8.215 -0.309 1.00 0.00 H new ATOM 0 HB THR A 45 -15.227 -8.434 -2.227 1.00 0.00 H new ATOM 0 HG1 THR A 45 -12.609 -8.717 -2.499 1.00 0.00 H new ATOM 0 HG21 THR A 45 -15.163 -6.844 -4.124 1.00 0.00 H new ATOM 0 HG22 THR A 45 -15.521 -6.002 -2.597 1.00 0.00 H new ATOM 0 HG23 THR A 45 -13.889 -5.913 -3.301 1.00 0.00 H new ATOM 1714 N MET A 46 -12.029 -5.715 -1.152 1.00 0.00 N ATOM 1715 CA MET A 46 -10.612 -5.257 -1.334 1.00 0.00 C ATOM 1716 C MET A 46 -9.980 -4.921 0.023 1.00 0.00 C ATOM 1717 O MET A 46 -8.783 -4.749 0.131 1.00 0.00 O ATOM 1718 CB MET A 46 -10.605 -3.990 -2.203 1.00 0.00 C ATOM 1719 CG MET A 46 -11.003 -4.330 -3.644 1.00 0.00 C ATOM 1720 SD MET A 46 -9.604 -5.098 -4.502 1.00 0.00 S ATOM 1721 CE MET A 46 -8.815 -3.574 -5.088 1.00 0.00 C ATOM 0 H MET A 46 -12.708 -4.968 -1.006 1.00 0.00 H new ATOM 0 HA MET A 46 -10.042 -6.055 -1.810 1.00 0.00 H new ATOM 0 HB2 MET A 46 -11.297 -3.255 -1.791 1.00 0.00 H new ATOM 0 HB3 MET A 46 -9.614 -3.537 -2.190 1.00 0.00 H new ATOM 0 HG2 MET A 46 -11.858 -5.006 -3.645 1.00 0.00 H new ATOM 0 HG3 MET A 46 -11.311 -3.426 -4.169 1.00 0.00 H new ATOM 0 HE1 MET A 46 -7.804 -3.796 -5.430 1.00 0.00 H new ATOM 0 HE2 MET A 46 -9.394 -3.159 -5.913 1.00 0.00 H new ATOM 0 HE3 MET A 46 -8.772 -2.850 -4.274 1.00 0.00 H new ATOM 1731 N ARG A 47 -10.774 -4.785 1.048 1.00 0.00 N ATOM 1732 CA ARG A 47 -10.218 -4.410 2.387 1.00 0.00 C ATOM 1733 C ARG A 47 -9.679 -5.626 3.146 1.00 0.00 C ATOM 1734 O ARG A 47 -10.294 -6.673 3.206 1.00 0.00 O ATOM 1735 CB ARG A 47 -11.309 -3.735 3.211 1.00 0.00 C ATOM 1736 CG ARG A 47 -11.987 -2.646 2.370 1.00 0.00 C ATOM 1737 CD ARG A 47 -11.004 -1.532 2.038 1.00 0.00 C ATOM 1738 NE ARG A 47 -10.118 -1.944 0.913 1.00 0.00 N ATOM 1739 CZ ARG A 47 -9.378 -1.053 0.317 1.00 0.00 C ATOM 1740 NH1 ARG A 47 -9.461 0.198 0.674 1.00 0.00 N ATOM 1741 NH2 ARG A 47 -8.562 -1.407 -0.640 1.00 0.00 N ATOM 0 H ARG A 47 -11.785 -4.916 1.021 1.00 0.00 H new ATOM 0 HA ARG A 47 -9.384 -3.727 2.226 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -12.045 -4.472 3.532 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -10.880 -3.298 4.113 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -12.376 -3.080 1.449 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -12.838 -2.237 2.914 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -11.547 -0.626 1.769 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -10.403 -1.295 2.916 1.00 0.00 H new ATOM 0 HE ARG A 47 -10.091 -2.918 0.611 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -10.103 0.475 1.417 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -8.884 0.900 0.211 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -8.502 -2.385 -0.924 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -7.985 -0.705 -1.104 1.00 0.00 H new ATOM 1755 N LYS A 48 -8.527 -5.464 3.743 1.00 0.00 N ATOM 1756 CA LYS A 48 -7.891 -6.563 4.541 1.00 0.00 C ATOM 1757 C LYS A 48 -7.380 -5.985 5.865 1.00 0.00 C ATOM 1758 O LYS A 48 -7.153 -4.797 5.980 1.00 0.00 O ATOM 1759 CB LYS A 48 -6.715 -7.155 3.760 1.00 0.00 C ATOM 1760 CG LYS A 48 -7.238 -7.940 2.555 1.00 0.00 C ATOM 1761 CD LYS A 48 -6.060 -8.441 1.705 1.00 0.00 C ATOM 1762 CE LYS A 48 -5.405 -9.661 2.367 1.00 0.00 C ATOM 1763 NZ LYS A 48 -4.459 -10.296 1.405 1.00 0.00 N ATOM 0 H LYS A 48 -7.987 -4.599 3.712 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.624 -7.346 4.734 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.050 -6.358 3.426 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.130 -7.809 4.406 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -7.839 -8.784 2.893 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.889 -7.307 1.952 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.409 -8.705 0.707 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -5.325 -7.645 1.586 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.875 -9.358 3.270 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.168 -10.378 2.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.014 -11.123 1.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.978 -10.598 0.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -3.725 -9.610 1.136 1.00 0.00 H new ATOM 1777 N ASP A 49 -7.209 -6.811 6.868 1.00 0.00 N ATOM 1778 CA ASP A 49 -6.726 -6.310 8.193 1.00 0.00 C ATOM 1779 C ASP A 49 -5.605 -5.278 8.003 1.00 0.00 C ATOM 1780 O ASP A 49 -5.843 -4.087 8.007 1.00 0.00 O ATOM 1781 CB ASP A 49 -6.199 -7.490 9.018 1.00 0.00 C ATOM 1782 CG ASP A 49 -7.248 -8.602 9.054 1.00 0.00 C ATOM 1783 OD1 ASP A 49 -8.419 -8.283 9.167 1.00 0.00 O ATOM 1784 OD2 ASP A 49 -6.860 -9.756 8.969 1.00 0.00 O ATOM 0 H ASP A 49 -7.384 -7.815 6.826 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.556 -5.832 8.713 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -5.272 -7.865 8.584 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.967 -7.163 10.031 1.00 0.00 H new ATOM 1789 N GLY A 50 -4.386 -5.720 7.853 1.00 0.00 N ATOM 1790 CA GLY A 50 -3.260 -4.758 7.680 1.00 0.00 C ATOM 1791 C GLY A 50 -3.328 -4.127 6.290 1.00 0.00 C ATOM 1792 O GLY A 50 -4.274 -4.329 5.553 1.00 0.00 O ATOM 0 H GLY A 50 -4.121 -6.705 7.843 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.311 -3.983 8.444 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.307 -5.272 7.810 1.00 0.00 H new ATOM 1796 N ILE A 51 -2.327 -3.371 5.915 1.00 0.00 N ATOM 1797 CA ILE A 51 -2.330 -2.742 4.569 1.00 0.00 C ATOM 1798 C ILE A 51 -1.646 -3.677 3.575 1.00 0.00 C ATOM 1799 O ILE A 51 -0.702 -4.371 3.898 1.00 0.00 O ATOM 1800 CB ILE A 51 -1.599 -1.397 4.632 1.00 0.00 C ATOM 1801 CG1 ILE A 51 -2.252 -0.541 5.741 1.00 0.00 C ATOM 1802 CG2 ILE A 51 -1.698 -0.697 3.268 1.00 0.00 C ATOM 1803 CD1 ILE A 51 -1.980 0.954 5.524 1.00 0.00 C ATOM 0 H ILE A 51 -1.508 -3.165 6.488 1.00 0.00 H new ATOM 0 HA ILE A 51 -3.355 -2.567 4.242 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.544 -1.541 4.863 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.327 -0.719 5.755 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.866 -0.846 6.714 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.178 0.260 3.312 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.240 -1.324 2.503 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.746 -0.530 3.020 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.452 1.529 6.320 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.905 1.134 5.535 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.389 1.262 4.562 1.00 0.00 H new ATOM 1815 N GLN A 52 -2.119 -3.690 2.364 1.00 0.00 N ATOM 1816 CA GLN A 52 -1.505 -4.566 1.334 1.00 0.00 C ATOM 1817 C GLN A 52 -0.144 -3.990 0.948 1.00 0.00 C ATOM 1818 O GLN A 52 0.055 -2.796 0.971 1.00 0.00 O ATOM 1819 CB GLN A 52 -2.397 -4.609 0.093 1.00 0.00 C ATOM 1820 CG GLN A 52 -3.684 -5.374 0.402 1.00 0.00 C ATOM 1821 CD GLN A 52 -4.564 -5.411 -0.849 1.00 0.00 C ATOM 1822 OE1 GLN A 52 -4.765 -6.457 -1.433 1.00 0.00 O ATOM 1823 NE2 GLN A 52 -5.097 -4.304 -1.293 1.00 0.00 N ATOM 0 H GLN A 52 -2.908 -3.129 2.042 1.00 0.00 H new ATOM 0 HA GLN A 52 -1.391 -5.574 1.732 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.635 -3.595 -0.229 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.867 -5.089 -0.730 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.449 -6.388 0.725 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.218 -4.894 1.222 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.929 -3.425 -0.804 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.681 -4.319 -2.129 1.00 0.00 H new ATOM 1832 N THR A 53 0.806 -4.821 0.613 1.00 0.00 N ATOM 1833 CA THR A 53 2.156 -4.295 0.236 1.00 0.00 C ATOM 1834 C THR A 53 2.718 -5.084 -0.940 1.00 0.00 C ATOM 1835 O THR A 53 2.327 -6.200 -1.216 1.00 0.00 O ATOM 1836 CB THR A 53 3.111 -4.398 1.423 1.00 0.00 C ATOM 1837 OG1 THR A 53 4.447 -4.502 0.947 1.00 0.00 O ATOM 1838 CG2 THR A 53 2.759 -5.626 2.243 1.00 0.00 C ATOM 0 H THR A 53 0.710 -5.836 0.583 1.00 0.00 H new ATOM 0 HA THR A 53 2.053 -3.249 -0.051 1.00 0.00 H new ATOM 0 HB THR A 53 3.021 -3.509 2.047 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.061 -4.566 1.708 1.00 0.00 H new ATOM 0 HG21 THR A 53 3.438 -5.704 3.092 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.734 -5.540 2.605 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.851 -6.517 1.622 1.00 0.00 H new ATOM 1846 N ARG A 54 3.639 -4.487 -1.628 1.00 0.00 N ATOM 1847 CA ARG A 54 4.269 -5.146 -2.801 1.00 0.00 C ATOM 1848 C ARG A 54 5.687 -4.615 -2.993 1.00 0.00 C ATOM 1849 O ARG A 54 6.051 -3.584 -2.463 1.00 0.00 O ATOM 1850 CB ARG A 54 3.440 -4.864 -4.053 1.00 0.00 C ATOM 1851 CG ARG A 54 4.122 -5.522 -5.252 1.00 0.00 C ATOM 1852 CD ARG A 54 3.146 -5.639 -6.415 1.00 0.00 C ATOM 1853 NE ARG A 54 2.135 -6.695 -6.112 1.00 0.00 N ATOM 1854 CZ ARG A 54 1.084 -6.829 -6.874 1.00 0.00 C ATOM 1855 NH1 ARG A 54 0.936 -6.057 -7.915 1.00 0.00 N ATOM 1856 NH2 ARG A 54 0.187 -7.739 -6.601 1.00 0.00 N ATOM 0 H ARG A 54 3.991 -3.551 -1.425 1.00 0.00 H new ATOM 0 HA ARG A 54 4.310 -6.222 -2.629 1.00 0.00 H new ATOM 0 HB2 ARG A 54 2.429 -5.254 -3.932 1.00 0.00 H new ATOM 0 HB3 ARG A 54 3.350 -3.789 -4.212 1.00 0.00 H new ATOM 0 HG2 ARG A 54 4.989 -4.935 -5.554 1.00 0.00 H new ATOM 0 HG3 ARG A 54 4.488 -6.511 -4.974 1.00 0.00 H new ATOM 0 HD2 ARG A 54 2.650 -4.683 -6.585 1.00 0.00 H new ATOM 0 HD3 ARG A 54 3.683 -5.887 -7.331 1.00 0.00 H new ATOM 0 HE ARG A 54 2.266 -7.311 -5.310 1.00 0.00 H new ATOM 0 HH11 ARG A 54 1.640 -5.352 -8.131 1.00 0.00 H new ATOM 0 HH12 ARG A 54 0.116 -6.159 -8.513 1.00 0.00 H new ATOM 0 HH21 ARG A 54 0.307 -8.347 -5.791 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -0.634 -7.842 -7.198 1.00 0.00 H new ATOM 1870 N ASN A 55 6.495 -5.306 -3.753 1.00 0.00 N ATOM 1871 CA ASN A 55 7.887 -4.824 -3.973 1.00 0.00 C ATOM 1872 C ASN A 55 7.832 -3.347 -4.377 1.00 0.00 C ATOM 1873 O ASN A 55 7.040 -2.938 -5.203 1.00 0.00 O ATOM 1874 CB ASN A 55 8.556 -5.661 -5.069 1.00 0.00 C ATOM 1875 CG ASN A 55 8.709 -7.105 -4.581 1.00 0.00 C ATOM 1876 OD1 ASN A 55 9.388 -7.359 -3.606 1.00 0.00 O ATOM 1877 ND2 ASN A 55 8.097 -8.068 -5.218 1.00 0.00 N ATOM 0 H ASN A 55 6.253 -6.176 -4.227 1.00 0.00 H new ATOM 0 HA ASN A 55 8.474 -4.928 -3.060 1.00 0.00 H new ATOM 0 HB2 ASN A 55 7.957 -5.634 -5.979 1.00 0.00 H new ATOM 0 HB3 ASN A 55 9.532 -5.243 -5.317 1.00 0.00 H new ATOM 0 HD21 ASN A 55 8.190 -9.032 -4.897 1.00 0.00 H new ATOM 0 HD22 ASN A 55 7.527 -7.856 -6.037 1.00 0.00 H new ATOM 1884 N ARG A 56 8.652 -2.545 -3.759 1.00 0.00 N ATOM 1885 CA ARG A 56 8.660 -1.077 -4.033 1.00 0.00 C ATOM 1886 C ARG A 56 8.954 -0.786 -5.509 1.00 0.00 C ATOM 1887 O ARG A 56 9.879 -1.315 -6.092 1.00 0.00 O ATOM 1888 CB ARG A 56 9.737 -0.447 -3.150 1.00 0.00 C ATOM 1889 CG ARG A 56 9.959 1.025 -3.514 1.00 0.00 C ATOM 1890 CD ARG A 56 10.938 1.628 -2.512 1.00 0.00 C ATOM 1891 NE ARG A 56 11.441 2.922 -3.042 1.00 0.00 N ATOM 1892 CZ ARG A 56 12.225 3.663 -2.311 1.00 0.00 C ATOM 1893 NH1 ARG A 56 12.598 3.249 -1.132 1.00 0.00 N ATOM 1894 NH2 ARG A 56 12.644 4.815 -2.761 1.00 0.00 N ATOM 0 H ARG A 56 9.331 -2.849 -3.061 1.00 0.00 H new ATOM 0 HA ARG A 56 7.679 -0.657 -3.811 1.00 0.00 H new ATOM 0 HB2 ARG A 56 9.445 -0.526 -2.103 1.00 0.00 H new ATOM 0 HB3 ARG A 56 10.671 -0.997 -3.262 1.00 0.00 H new ATOM 0 HG2 ARG A 56 10.353 1.110 -4.527 1.00 0.00 H new ATOM 0 HG3 ARG A 56 9.014 1.567 -3.493 1.00 0.00 H new ATOM 0 HD2 ARG A 56 10.446 1.781 -1.551 1.00 0.00 H new ATOM 0 HD3 ARG A 56 11.769 0.944 -2.340 1.00 0.00 H new ATOM 0 HE ARG A 56 11.173 3.230 -3.977 1.00 0.00 H new ATOM 0 HH11 ARG A 56 12.276 2.346 -0.783 1.00 0.00 H new ATOM 0 HH12 ARG A 56 13.212 3.828 -0.559 1.00 0.00 H new ATOM 0 HH21 ARG A 56 12.358 5.136 -3.686 1.00 0.00 H new ATOM 0 HH22 ARG A 56 13.258 5.394 -2.188 1.00 0.00 H new ATOM 1908 N LYS A 57 8.156 0.060 -6.108 1.00 0.00 N ATOM 1909 CA LYS A 57 8.350 0.412 -7.546 1.00 0.00 C ATOM 1910 C LYS A 57 9.776 0.923 -7.772 1.00 0.00 C ATOM 1911 O LYS A 57 10.435 1.370 -6.855 1.00 0.00 O ATOM 1912 CB LYS A 57 7.349 1.505 -7.929 1.00 0.00 C ATOM 1913 CG LYS A 57 7.531 1.883 -9.407 1.00 0.00 C ATOM 1914 CD LYS A 57 6.268 2.577 -9.942 1.00 0.00 C ATOM 1915 CE LYS A 57 6.072 3.946 -9.279 1.00 0.00 C ATOM 1916 NZ LYS A 57 7.201 4.847 -9.641 1.00 0.00 N ATOM 0 H LYS A 57 7.370 0.527 -5.656 1.00 0.00 H new ATOM 0 HA LYS A 57 8.190 -0.473 -8.162 1.00 0.00 H new ATOM 0 HB2 LYS A 57 6.331 1.155 -7.756 1.00 0.00 H new ATOM 0 HB3 LYS A 57 7.496 2.382 -7.299 1.00 0.00 H new ATOM 0 HG2 LYS A 57 8.391 2.544 -9.517 1.00 0.00 H new ATOM 0 HG3 LYS A 57 7.739 0.989 -9.995 1.00 0.00 H new ATOM 0 HD2 LYS A 57 6.346 2.700 -11.022 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.397 1.950 -9.754 1.00 0.00 H new ATOM 0 HE2 LYS A 57 5.127 4.384 -9.601 1.00 0.00 H new ATOM 0 HE3 LYS A 57 6.018 3.832 -8.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 6.918 5.836 -9.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 8.025 4.628 -9.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 7.450 4.707 -10.641 1.00 0.00 H new ATOM 1930 N VAL A 58 10.262 0.844 -8.989 1.00 0.00 N ATOM 1931 CA VAL A 58 11.656 1.307 -9.275 1.00 0.00 C ATOM 1932 C VAL A 58 11.919 2.640 -8.577 1.00 0.00 C ATOM 1933 O VAL A 58 11.048 3.482 -8.472 1.00 0.00 O ATOM 1934 CB VAL A 58 11.864 1.466 -10.791 1.00 0.00 C ATOM 1935 CG1 VAL A 58 10.833 2.435 -11.380 1.00 0.00 C ATOM 1936 CG2 VAL A 58 13.278 2.002 -11.056 1.00 0.00 C ATOM 0 H VAL A 58 9.754 0.479 -9.795 1.00 0.00 H new ATOM 0 HA VAL A 58 12.355 0.561 -8.897 1.00 0.00 H new ATOM 0 HB VAL A 58 11.739 0.493 -11.266 1.00 0.00 H new ATOM 0 HG11 VAL A 58 10.998 2.533 -12.453 1.00 0.00 H new ATOM 0 HG12 VAL A 58 9.829 2.051 -11.201 1.00 0.00 H new ATOM 0 HG13 VAL A 58 10.938 3.411 -10.906 1.00 0.00 H new ATOM 0 HG21 VAL A 58 13.429 2.116 -12.130 1.00 0.00 H new ATOM 0 HG22 VAL A 58 13.398 2.969 -10.568 1.00 0.00 H new ATOM 0 HG23 VAL A 58 14.013 1.302 -10.659 1.00 0.00 H new ATOM 1946 N SER A 59 13.113 2.837 -8.089 1.00 0.00 N ATOM 1947 CA SER A 59 13.417 4.113 -7.390 1.00 0.00 C ATOM 1948 C SER A 59 13.570 5.225 -8.427 1.00 0.00 C ATOM 1949 O SER A 59 14.346 5.116 -9.357 1.00 0.00 O ATOM 1950 CB SER A 59 14.709 3.956 -6.587 1.00 0.00 C ATOM 1951 OG SER A 59 15.798 3.766 -7.483 1.00 0.00 O ATOM 0 H SER A 59 13.885 2.173 -8.144 1.00 0.00 H new ATOM 0 HA SER A 59 12.607 4.369 -6.707 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.879 4.840 -5.972 1.00 0.00 H new ATOM 0 HB3 SER A 59 14.628 3.107 -5.909 1.00 0.00 H new ATOM 0 HG SER A 59 15.537 4.058 -8.381 1.00 0.00 H new ATOM 1957 N SER A 60 12.823 6.292 -8.281 1.00 0.00 N ATOM 1958 CA SER A 60 12.899 7.420 -9.262 1.00 0.00 C ATOM 1959 C SER A 60 13.053 8.745 -8.509 1.00 0.00 C ATOM 1960 O SER A 60 12.279 9.070 -7.630 1.00 0.00 O ATOM 1961 CB SER A 60 11.612 7.443 -10.090 1.00 0.00 C ATOM 1962 OG SER A 60 11.699 8.461 -11.076 1.00 0.00 O ATOM 0 H SER A 60 12.159 6.431 -7.519 1.00 0.00 H new ATOM 0 HA SER A 60 13.757 7.283 -9.920 1.00 0.00 H new ATOM 0 HB2 SER A 60 11.456 6.475 -10.565 1.00 0.00 H new ATOM 0 HB3 SER A 60 10.754 7.622 -9.442 1.00 0.00 H new ATOM 0 HG SER A 60 10.875 8.474 -11.607 1.00 0.00 H new ATOM 1968 N LYS A 61 14.053 9.514 -8.860 1.00 0.00 N ATOM 1969 CA LYS A 61 14.287 10.831 -8.187 1.00 0.00 C ATOM 1970 C LYS A 61 14.665 11.872 -9.244 1.00 0.00 C ATOM 1971 O LYS A 61 15.399 11.590 -10.172 1.00 0.00 O ATOM 1972 CB LYS A 61 15.422 10.686 -7.167 1.00 0.00 C ATOM 1973 CG LYS A 61 15.728 12.046 -6.534 1.00 0.00 C ATOM 1974 CD LYS A 61 16.671 11.862 -5.337 1.00 0.00 C ATOM 1975 CE LYS A 61 18.028 11.308 -5.801 1.00 0.00 C ATOM 1976 NZ LYS A 61 17.965 9.819 -5.848 1.00 0.00 N ATOM 0 H LYS A 61 14.725 9.284 -9.592 1.00 0.00 H new ATOM 0 HA LYS A 61 13.382 11.151 -7.670 1.00 0.00 H new ATOM 0 HB2 LYS A 61 15.140 9.970 -6.395 1.00 0.00 H new ATOM 0 HB3 LYS A 61 16.314 10.293 -7.655 1.00 0.00 H new ATOM 0 HG2 LYS A 61 16.186 12.706 -7.271 1.00 0.00 H new ATOM 0 HG3 LYS A 61 14.803 12.523 -6.210 1.00 0.00 H new ATOM 0 HD2 LYS A 61 16.815 12.816 -4.830 1.00 0.00 H new ATOM 0 HD3 LYS A 61 16.222 11.181 -4.614 1.00 0.00 H new ATOM 0 HE2 LYS A 61 18.277 11.704 -6.786 1.00 0.00 H new ATOM 0 HE3 LYS A 61 18.816 11.628 -5.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 18.742 9.421 -5.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 17.055 9.498 -5.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 18.054 9.499 -6.833 1.00 0.00 H new ATOM 1990 N GLY A 62 14.165 13.069 -9.117 1.00 0.00 N ATOM 1991 CA GLY A 62 14.488 14.123 -10.119 1.00 0.00 C ATOM 1992 C GLY A 62 15.987 14.429 -10.090 1.00 0.00 C ATOM 1993 O GLY A 62 16.650 14.249 -9.088 1.00 0.00 O ATOM 0 H GLY A 62 13.546 13.364 -8.362 1.00 0.00 H new ATOM 0 HA2 GLY A 62 14.195 13.792 -11.115 1.00 0.00 H new ATOM 0 HA3 GLY A 62 13.919 15.028 -9.904 1.00 0.00 H new ATOM 1997 N LYS A 63 16.522 14.898 -11.185 1.00 0.00 N ATOM 1998 CA LYS A 63 17.974 15.228 -11.230 1.00 0.00 C ATOM 1999 C LYS A 63 18.192 16.575 -10.539 1.00 0.00 C ATOM 2000 O LYS A 63 17.255 17.311 -10.296 1.00 0.00 O ATOM 2001 CB LYS A 63 18.436 15.304 -12.684 1.00 0.00 C ATOM 2002 CG LYS A 63 17.688 16.437 -13.382 1.00 0.00 C ATOM 2003 CD LYS A 63 17.910 16.378 -14.903 1.00 0.00 C ATOM 2004 CE LYS A 63 19.251 17.021 -15.265 1.00 0.00 C ATOM 2005 NZ LYS A 63 19.245 18.450 -14.841 1.00 0.00 N ATOM 0 H LYS A 63 16.013 15.067 -12.053 1.00 0.00 H new ATOM 0 HA LYS A 63 18.550 14.457 -10.719 1.00 0.00 H new ATOM 0 HB2 LYS A 63 19.511 15.478 -12.729 1.00 0.00 H new ATOM 0 HB3 LYS A 63 18.245 14.358 -13.190 1.00 0.00 H new ATOM 0 HG2 LYS A 63 16.623 16.366 -13.162 1.00 0.00 H new ATOM 0 HG3 LYS A 63 18.030 17.397 -12.996 1.00 0.00 H new ATOM 0 HD2 LYS A 63 17.892 15.342 -15.241 1.00 0.00 H new ATOM 0 HD3 LYS A 63 17.100 16.895 -15.417 1.00 0.00 H new ATOM 0 HE2 LYS A 63 20.066 16.488 -14.775 1.00 0.00 H new ATOM 0 HE3 LYS A 63 19.423 16.950 -16.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 19.826 19.009 -15.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 18.269 18.810 -14.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 19.635 18.529 -13.880 1.00 0.00 H new ATOM 2019 N LYS A 64 19.407 16.904 -10.203 1.00 0.00 N ATOM 2020 CA LYS A 64 19.649 18.202 -9.512 1.00 0.00 C ATOM 2021 C LYS A 64 19.054 19.345 -10.339 1.00 0.00 C ATOM 2022 O LYS A 64 19.242 19.421 -11.538 1.00 0.00 O ATOM 2023 CB LYS A 64 21.155 18.424 -9.346 1.00 0.00 C ATOM 2024 CG LYS A 64 21.743 17.325 -8.462 1.00 0.00 C ATOM 2025 CD LYS A 64 23.247 17.550 -8.298 1.00 0.00 C ATOM 2026 CE LYS A 64 23.829 16.448 -7.413 1.00 0.00 C ATOM 2027 NZ LYS A 64 23.496 15.122 -8.003 1.00 0.00 N ATOM 0 H LYS A 64 20.237 16.337 -10.375 1.00 0.00 H new ATOM 0 HA LYS A 64 19.175 18.180 -8.531 1.00 0.00 H new ATOM 0 HB2 LYS A 64 21.643 18.420 -10.321 1.00 0.00 H new ATOM 0 HB3 LYS A 64 21.341 19.401 -8.901 1.00 0.00 H new ATOM 0 HG2 LYS A 64 21.256 17.329 -7.487 1.00 0.00 H new ATOM 0 HG3 LYS A 64 21.557 16.348 -8.907 1.00 0.00 H new ATOM 0 HD2 LYS A 64 23.735 17.546 -9.272 1.00 0.00 H new ATOM 0 HD3 LYS A 64 23.434 18.527 -7.852 1.00 0.00 H new ATOM 0 HE2 LYS A 64 24.910 16.563 -7.332 1.00 0.00 H new ATOM 0 HE3 LYS A 64 23.424 16.523 -6.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 24.274 14.456 -7.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 22.622 14.760 -7.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 23.359 15.223 -9.029 1.00 0.00 H new ATOM 2041 N ARG A 65 18.334 20.238 -9.697 1.00 0.00 N ATOM 2042 CA ARG A 65 17.710 21.399 -10.412 1.00 0.00 C ATOM 2043 C ARG A 65 18.305 22.707 -9.885 1.00 0.00 C ATOM 2044 O ARG A 65 17.779 23.778 -10.114 1.00 0.00 O ATOM 2045 CB ARG A 65 16.195 21.395 -10.177 1.00 0.00 C ATOM 2046 CG ARG A 65 15.547 20.236 -10.943 1.00 0.00 C ATOM 2047 CD ARG A 65 14.035 20.250 -10.694 1.00 0.00 C ATOM 2048 NE ARG A 65 13.775 20.134 -9.232 1.00 0.00 N ATOM 2049 CZ ARG A 65 12.594 20.416 -8.748 1.00 0.00 C ATOM 2050 NH1 ARG A 65 11.632 20.800 -9.543 1.00 0.00 N ATOM 2051 NH2 ARG A 65 12.378 20.317 -7.466 1.00 0.00 N ATOM 0 H ARG A 65 18.150 20.210 -8.694 1.00 0.00 H new ATOM 0 HA ARG A 65 17.911 21.314 -11.480 1.00 0.00 H new ATOM 0 HB2 ARG A 65 15.984 21.300 -9.112 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.766 22.342 -10.504 1.00 0.00 H new ATOM 0 HG2 ARG A 65 15.753 20.329 -12.009 1.00 0.00 H new ATOM 0 HG3 ARG A 65 15.972 19.287 -10.618 1.00 0.00 H new ATOM 0 HD2 ARG A 65 13.600 21.172 -11.080 1.00 0.00 H new ATOM 0 HD3 ARG A 65 13.560 19.426 -11.226 1.00 0.00 H new ATOM 0 HE ARG A 65 14.522 19.833 -8.606 1.00 0.00 H new ATOM 0 HH11 ARG A 65 11.801 20.881 -10.546 1.00 0.00 H new ATOM 0 HH12 ARG A 65 10.712 21.019 -9.161 1.00 0.00 H new ATOM 0 HH21 ARG A 65 13.130 20.020 -6.844 1.00 0.00 H new ATOM 0 HH22 ARG A 65 11.457 20.536 -7.085 1.00 0.00 H new ATOM 2065 N ARG A 66 19.397 22.624 -9.183 1.00 0.00 N ATOM 2066 CA ARG A 66 20.037 23.858 -8.631 1.00 0.00 C ATOM 2067 C ARG A 66 20.793 24.591 -9.743 1.00 0.00 C ATOM 2068 O ARG A 66 20.460 24.382 -10.897 1.00 0.00 O ATOM 2069 CB ARG A 66 21.020 23.470 -7.520 1.00 0.00 C ATOM 2070 CG ARG A 66 22.057 22.497 -8.082 1.00 0.00 C ATOM 2071 CD ARG A 66 22.999 22.030 -6.968 1.00 0.00 C ATOM 2072 NE ARG A 66 23.795 23.187 -6.468 1.00 0.00 N ATOM 2073 CZ ARG A 66 24.467 23.082 -5.355 1.00 0.00 C ATOM 2074 NH1 ARG A 66 24.442 21.964 -4.681 1.00 0.00 N ATOM 2075 NH2 ARG A 66 25.168 24.092 -4.915 1.00 0.00 N ATOM 2076 OXT ARG A 66 21.693 25.349 -9.419 1.00 0.00 O ATOM 0 H ARG A 66 19.880 21.753 -8.964 1.00 0.00 H new ATOM 0 HA ARG A 66 19.265 24.513 -8.226 1.00 0.00 H new ATOM 0 HB2 ARG A 66 21.513 24.359 -7.128 1.00 0.00 H new ATOM 0 HB3 ARG A 66 20.485 23.010 -6.689 1.00 0.00 H new ATOM 0 HG2 ARG A 66 21.556 21.638 -8.529 1.00 0.00 H new ATOM 0 HG3 ARG A 66 22.629 22.981 -8.874 1.00 0.00 H new ATOM 0 HD2 ARG A 66 22.424 21.591 -6.152 1.00 0.00 H new ATOM 0 HD3 ARG A 66 23.665 21.253 -7.343 1.00 0.00 H new ATOM 0 HE ARG A 66 23.814 24.060 -6.996 1.00 0.00 H new ATOM 0 HH11 ARG A 66 23.897 21.173 -5.025 1.00 0.00 H new ATOM 0 HH12 ARG A 66 24.967 21.881 -3.811 1.00 0.00 H new ATOM 0 HH21 ARG A 66 25.191 24.965 -5.442 1.00 0.00 H new ATOM 0 HH22 ARG A 66 25.693 24.008 -4.044 1.00 0.00 H new TER 2090 ARG A 66 HETATM 2091 ZN ZN A 67 -12.249 3.058 2.177 1.00 0.00 ZN