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 -160:sc= -0.0851 USER MOD Set 1.2: C 125 DT C7 :methyl 150:sc= -0.912 (180deg=-0.912) USER MOD Single : A 1 LYS N :NH3+ -163:sc=-0.00937 (180deg=-0.287) USER MOD Single : A 1 LYS NZ :NH3+ 163:sc= -0.0405 (180deg=-0.369) USER MOD Single : A 5 THR OG1 : rot 170:sc= 1.12 USER MOD Single : A 8 SER OG : rot 78:sc= 0.579 USER MOD Single : A 9 ASN : amide:sc= -2.25! C(o=-2.3!,f=-2.9!) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.027) 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 -161:sc= -0.183 USER MOD Single : A 15 THR OG1 : rot -129:sc= 0.862 USER MOD Single : A 21 SER OG : rot -112:sc= -0.367 USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN :FLIP amide:sc= -0.874 F(o=-3.4!,f=-0.87) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HE2:sc= -4.59! C(o=-4.6!,f=-8.7!) USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 41 ASN : amide:sc=-0.00767! C(o=-0.0077!,f=-9.2!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.00522 USER MOD Single : A 46 MET CE :methyl 174:sc= -0.458 (180deg=-0.577) USER MOD Single : A 48 LYS NZ :NH3+ 141:sc= -0.814 (180deg=-2.87!) USER MOD Single : A 52 GLN : amide:sc= -3.96! C(o=-4!,f=-6.1!) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.147 USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 LYS NZ :NH3+ -151:sc= 0.313 (180deg=-0.021) USER MOD Single : A 59 SER OG : rot 40:sc= 0.694 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 172:sc= -0.659 (180deg=-0.976) USER MOD Single : A 63 LYS NZ :NH3+ 134:sc= -0.197 (180deg=-1.17!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 101 DG O5' : rot 180:sc= -0.0522 USER MOD Single : B 102 DT C7 :methyl -30:sc= -0.282 (180deg=-0.866) USER MOD Single : B 103 DT C7 :methyl -30:sc= -1.25 (180deg=-1.69!) USER MOD Single : B 109 DT C7 :methyl -30:sc= -2.53! (180deg=-2.86!) USER MOD Single : B 115 DT C7 :methyl -30:sc= -0.534 (180deg=-0.844) USER MOD Single : B 116 DT C7 :methyl 150:sc= -0.119 (180deg=-0.119) USER MOD Single : B 116 DT O3' : rot 180:sc= 0 USER MOD Single : C 117 DA O5' : rot 81:sc= -2.31! USER MOD Single : C 119 DT C7 :methyl -30:sc= -0.748 (180deg=-1.4!) USER MOD Single : C 121 DT C7 :methyl 150:sc= -0.45 (180deg=-0.45) USER MOD Single : C 122 DT C7 :methyl 150:sc= -1.09 (180deg=-1.09) USER MOD Single : C 123 DT C7 :methyl -30:sc= -1.72 (180deg=-4.15!) USER MOD Single : C 127 DT C7 :methyl -30:sc= -1.37 (180deg=-1.8!) USER MOD Single : C 132 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG B 101 18.518 25.661 6.545 1.00 0.00 O ATOM 2 C5' DG B 101 19.096 25.463 7.839 1.00 0.00 C ATOM 3 C4' DG B 101 18.219 24.562 8.716 1.00 0.00 C ATOM 4 O4' DG B 101 17.007 25.263 9.084 1.00 0.00 O ATOM 5 C3' DG B 101 17.813 23.270 7.993 1.00 0.00 C ATOM 6 O3' DG B 101 18.066 22.125 8.817 1.00 0.00 O ATOM 7 C2' DG B 101 16.333 23.400 7.728 1.00 0.00 C ATOM 8 C1' DG B 101 15.848 24.601 8.531 1.00 0.00 C ATOM 9 N9 DG B 101 15.061 25.525 7.689 1.00 0.00 N ATOM 10 C8 DG B 101 15.358 26.042 6.459 1.00 0.00 C ATOM 11 N7 DG B 101 14.446 26.815 5.951 1.00 0.00 N ATOM 12 C5 DG B 101 13.451 26.818 6.926 1.00 0.00 C ATOM 13 C6 DG B 101 12.197 27.486 6.946 1.00 0.00 C ATOM 14 O6 DG B 101 11.709 28.215 6.086 1.00 0.00 O ATOM 15 N1 DG B 101 11.500 27.227 8.118 1.00 0.00 N ATOM 16 C2 DG B 101 11.948 26.423 9.145 1.00 0.00 C ATOM 17 N2 DG B 101 11.137 26.298 10.196 1.00 0.00 N ATOM 18 N3 DG B 101 13.125 25.791 9.129 1.00 0.00 N ATOM 19 C4 DG B 101 13.821 26.033 7.995 1.00 0.00 C ATOM 0 H5' DG B 101 19.232 26.427 8.329 1.00 0.00 H new ATOM 0 H5'' DG B 101 20.085 25.017 7.732 1.00 0.00 H new ATOM 0 H4' DG B 101 18.809 24.305 9.595 1.00 0.00 H new ATOM 0 H3' DG B 101 18.383 23.134 7.074 1.00 0.00 H new ATOM 0 H2' DG B 101 16.141 23.543 6.665 1.00 0.00 H new ATOM 0 H2'' DG B 101 15.805 22.495 8.028 1.00 0.00 H new ATOM 0 HO5' DG B 101 19.101 26.241 6.012 1.00 0.00 H new ATOM 0 H1' DG B 101 15.188 24.269 9.333 1.00 0.00 H new ATOM 0 H8 DG B 101 16.283 25.824 5.947 1.00 0.00 H new ATOM 0 H1 DG B 101 10.586 27.665 8.228 1.00 0.00 H new ATOM 0 H21 DG B 101 11.413 25.716 10.987 1.00 0.00 H new ATOM 0 H22 DG B 101 10.240 26.784 10.209 1.00 0.00 H new ATOM 32 P DT B 102 17.713 20.640 8.293 1.00 0.00 P ATOM 33 OP1 DT B 102 18.637 19.690 8.952 1.00 0.00 O ATOM 34 OP2 DT B 102 17.627 20.678 6.815 1.00 0.00 O ATOM 35 O5' DT B 102 16.229 20.387 8.882 1.00 0.00 O ATOM 36 C5' DT B 102 16.007 20.417 10.295 1.00 0.00 C ATOM 37 C4' DT B 102 14.541 20.159 10.679 1.00 0.00 C ATOM 38 O4' DT B 102 13.702 21.285 10.319 1.00 0.00 O ATOM 39 C3' DT B 102 13.962 18.910 10.001 1.00 0.00 C ATOM 40 O3' DT B 102 13.555 17.961 10.996 1.00 0.00 O ATOM 41 C2' DT B 102 12.759 19.390 9.222 1.00 0.00 C ATOM 42 C1' DT B 102 12.495 20.821 9.671 1.00 0.00 C ATOM 43 N1 DT B 102 12.117 21.712 8.534 1.00 0.00 N ATOM 44 C2 DT B 102 10.883 22.358 8.582 1.00 0.00 C ATOM 45 O2 DT B 102 10.110 22.218 9.527 1.00 0.00 O ATOM 46 N3 DT B 102 10.576 23.174 7.506 1.00 0.00 N ATOM 47 C4 DT B 102 11.376 23.397 6.402 1.00 0.00 C ATOM 48 O4 DT B 102 11.004 24.144 5.499 1.00 0.00 O ATOM 49 C5 DT B 102 12.637 22.688 6.434 1.00 0.00 C ATOM 50 C7 DT B 102 13.606 22.844 5.259 1.00 0.00 C ATOM 51 C6 DT B 102 12.961 21.887 7.478 1.00 0.00 C ATOM 0 H5' DT B 102 16.313 21.388 10.685 1.00 0.00 H new ATOM 0 H5'' DT B 102 16.639 19.668 10.772 1.00 0.00 H new ATOM 0 H4' DT B 102 14.544 20.009 11.759 1.00 0.00 H new ATOM 0 H3' DT B 102 14.692 18.422 9.356 1.00 0.00 H new ATOM 0 H2' DT B 102 12.950 19.349 8.150 1.00 0.00 H new ATOM 0 H2'' DT B 102 11.893 18.757 9.416 1.00 0.00 H new ATOM 0 H1' DT B 102 11.647 20.846 10.355 1.00 0.00 H new ATOM 0 H3 DT B 102 9.677 23.654 7.531 1.00 0.00 H new ATOM 0 H71 DT B 102 13.042 23.029 4.345 1.00 0.00 H new ATOM 0 H72 DT B 102 14.275 23.683 5.448 1.00 0.00 H new ATOM 0 H73 DT B 102 14.191 21.931 5.146 1.00 0.00 H new ATOM 0 H6 DT B 102 13.912 21.375 7.473 1.00 0.00 H new ATOM 64 P DT B 103 12.903 16.540 10.597 1.00 0.00 P ATOM 65 OP1 DT B 103 13.160 15.587 11.700 1.00 0.00 O ATOM 66 OP2 DT B 103 13.318 16.205 9.217 1.00 0.00 O ATOM 67 O5' DT B 103 11.327 16.882 10.583 1.00 0.00 O ATOM 68 C5' DT B 103 10.703 17.358 11.779 1.00 0.00 C ATOM 69 C4' DT B 103 9.216 17.682 11.587 1.00 0.00 C ATOM 70 O4' DT B 103 9.060 18.850 10.751 1.00 0.00 O ATOM 71 C3' DT B 103 8.432 16.530 10.943 1.00 0.00 C ATOM 72 O3' DT B 103 7.396 16.114 11.834 1.00 0.00 O ATOM 73 C2' DT B 103 7.832 17.105 9.676 1.00 0.00 C ATOM 74 C1' DT B 103 8.051 18.616 9.748 1.00 0.00 C ATOM 75 N1 DT B 103 8.468 19.186 8.437 1.00 0.00 N ATOM 76 C2 DT B 103 7.677 20.177 7.867 1.00 0.00 C ATOM 77 O2 DT B 103 6.640 20.568 8.398 1.00 0.00 O ATOM 78 N3 DT B 103 8.126 20.703 6.671 1.00 0.00 N ATOM 79 C4 DT B 103 9.278 20.332 5.999 1.00 0.00 C ATOM 80 O4 DT B 103 9.585 20.871 4.938 1.00 0.00 O ATOM 81 C5 DT B 103 10.037 19.294 6.660 1.00 0.00 C ATOM 82 C7 DT B 103 11.332 18.794 6.007 1.00 0.00 C ATOM 83 C6 DT B 103 9.614 18.765 7.834 1.00 0.00 C ATOM 0 H5' DT B 103 11.223 18.252 12.123 1.00 0.00 H new ATOM 0 H5'' DT B 103 10.808 16.607 12.562 1.00 0.00 H new ATOM 0 H4' DT B 103 8.815 17.857 12.585 1.00 0.00 H new ATOM 0 H3' DT B 103 9.061 15.666 10.730 1.00 0.00 H new ATOM 0 H2' DT B 103 8.311 16.684 8.792 1.00 0.00 H new ATOM 0 H2'' DT B 103 6.770 16.868 9.606 1.00 0.00 H new ATOM 0 H1' DT B 103 7.116 19.112 10.007 1.00 0.00 H new ATOM 0 H3 DT B 103 7.556 21.433 6.243 1.00 0.00 H new ATOM 0 H71 DT B 103 11.253 18.888 4.924 1.00 0.00 H new ATOM 0 H72 DT B 103 12.172 19.390 6.362 1.00 0.00 H new ATOM 0 H73 DT B 103 11.492 17.748 6.270 1.00 0.00 H new ATOM 0 H6 DT B 103 10.201 17.989 8.303 1.00 0.00 H new ATOM 96 P DG B 104 6.430 14.867 11.511 1.00 0.00 P ATOM 97 OP1 DG B 104 5.914 14.341 12.795 1.00 0.00 O ATOM 98 OP2 DG B 104 7.137 13.965 10.577 1.00 0.00 O ATOM 99 O5' DG B 104 5.204 15.548 10.719 1.00 0.00 O ATOM 100 C5' DG B 104 4.417 16.558 11.349 1.00 0.00 C ATOM 101 C4' DG B 104 3.305 17.075 10.434 1.00 0.00 C ATOM 102 O4' DG B 104 3.874 17.830 9.334 1.00 0.00 O ATOM 103 C3' DG B 104 2.489 15.923 9.841 1.00 0.00 C ATOM 104 O3' DG B 104 1.099 16.162 10.066 1.00 0.00 O ATOM 105 C2' DG B 104 2.778 15.942 8.361 1.00 0.00 C ATOM 106 C1' DG B 104 3.476 17.263 8.065 1.00 0.00 C ATOM 107 N9 DG B 104 4.643 17.080 7.172 1.00 0.00 N ATOM 108 C8 DG B 104 5.674 16.186 7.258 1.00 0.00 C ATOM 109 N7 DG B 104 6.556 16.264 6.306 1.00 0.00 N ATOM 110 C5 DG B 104 6.074 17.300 5.508 1.00 0.00 C ATOM 111 C6 DG B 104 6.610 17.856 4.311 1.00 0.00 C ATOM 112 O6 DG B 104 7.634 17.535 3.710 1.00 0.00 O ATOM 113 N1 DG B 104 5.815 18.887 3.828 1.00 0.00 N ATOM 114 C2 DG B 104 4.650 19.331 4.417 1.00 0.00 C ATOM 115 N2 DG B 104 4.034 20.349 3.814 1.00 0.00 N ATOM 116 N3 DG B 104 4.143 18.812 5.539 1.00 0.00 N ATOM 117 C4 DG B 104 4.904 17.804 6.028 1.00 0.00 C ATOM 0 H5' DG B 104 5.060 17.388 11.642 1.00 0.00 H new ATOM 0 H5'' DG B 104 3.977 16.157 12.262 1.00 0.00 H new ATOM 0 H4' DG B 104 2.656 17.706 11.041 1.00 0.00 H new ATOM 0 H3' DG B 104 2.745 14.963 10.290 1.00 0.00 H new ATOM 0 H2' DG B 104 3.410 15.100 8.080 1.00 0.00 H new ATOM 0 H2'' DG B 104 1.856 15.855 7.786 1.00 0.00 H new ATOM 0 H1' DG B 104 2.797 17.934 7.539 1.00 0.00 H new ATOM 0 H8 DG B 104 5.750 15.466 8.060 1.00 0.00 H new ATOM 0 H1 DG B 104 6.116 19.352 2.971 1.00 0.00 H new ATOM 0 H21 DG B 104 3.168 20.722 4.201 1.00 0.00 H new ATOM 0 H22 DG B 104 4.429 20.754 2.965 1.00 0.00 H new ATOM 129 P DC B 105 -0.038 15.135 9.565 1.00 0.00 P ATOM 130 OP1 DC B 105 -1.233 15.327 10.418 1.00 0.00 O ATOM 131 OP2 DC B 105 0.571 13.791 9.447 1.00 0.00 O ATOM 132 O5' DC B 105 -0.395 15.657 8.084 1.00 0.00 O ATOM 133 C5' DC B 105 -0.894 16.982 7.901 1.00 0.00 C ATOM 134 C4' DC B 105 -1.180 17.305 6.431 1.00 0.00 C ATOM 135 O4' DC B 105 0.039 17.437 5.660 1.00 0.00 O ATOM 136 C3' DC B 105 -2.030 16.222 5.763 1.00 0.00 C ATOM 137 O3' DC B 105 -3.229 16.818 5.276 1.00 0.00 O ATOM 138 C2' DC B 105 -1.202 15.679 4.625 1.00 0.00 C ATOM 139 C1' DC B 105 -0.035 16.635 4.453 1.00 0.00 C ATOM 140 N1 DC B 105 1.251 15.922 4.231 1.00 0.00 N ATOM 141 C2 DC B 105 1.965 16.185 3.065 1.00 0.00 C ATOM 142 O2 DC B 105 1.490 16.926 2.206 1.00 0.00 O ATOM 143 N3 DC B 105 3.185 15.605 2.910 1.00 0.00 N ATOM 144 C4 DC B 105 3.690 14.801 3.854 1.00 0.00 C ATOM 145 N4 DC B 105 4.896 14.262 3.677 1.00 0.00 N ATOM 146 C5 DC B 105 2.958 14.522 5.049 1.00 0.00 C ATOM 147 C6 DC B 105 1.749 15.100 5.188 1.00 0.00 C ATOM 0 H5' DC B 105 -0.170 17.696 8.292 1.00 0.00 H new ATOM 0 H5'' DC B 105 -1.809 17.105 8.481 1.00 0.00 H new ATOM 0 H4' DC B 105 -1.721 18.251 6.442 1.00 0.00 H new ATOM 0 H3' DC B 105 -2.304 15.423 6.451 1.00 0.00 H new ATOM 0 H2' DC B 105 -0.850 14.672 4.847 1.00 0.00 H new ATOM 0 H2'' DC B 105 -1.792 15.617 3.710 1.00 0.00 H new ATOM 0 H1' DC B 105 -0.198 17.253 3.570 1.00 0.00 H new ATOM 0 H41 DC B 105 5.290 13.648 4.390 1.00 0.00 H new ATOM 0 H42 DC B 105 5.425 14.463 2.828 1.00 0.00 H new ATOM 0 H5 DC B 105 3.359 13.872 5.812 1.00 0.00 H new ATOM 0 H6 DC B 105 1.167 14.906 6.076 1.00 0.00 H new ATOM 159 P DA B 106 -4.356 15.965 4.517 1.00 0.00 P ATOM 160 OP1 DA B 106 -5.664 16.620 4.736 1.00 0.00 O ATOM 161 OP2 DA B 106 -4.173 14.540 4.872 1.00 0.00 O ATOM 162 O5' DA B 106 -3.945 16.155 2.971 1.00 0.00 O ATOM 163 C5' DA B 106 -3.908 17.472 2.408 1.00 0.00 C ATOM 164 C4' DA B 106 -3.499 17.464 0.930 1.00 0.00 C ATOM 165 O4' DA B 106 -2.095 17.120 0.774 1.00 0.00 O ATOM 166 C3' DA B 106 -4.321 16.456 0.124 1.00 0.00 C ATOM 167 O3' DA B 106 -4.990 17.121 -0.938 1.00 0.00 O ATOM 168 C2' DA B 106 -3.327 15.468 -0.448 1.00 0.00 C ATOM 169 C1' DA B 106 -1.939 16.026 -0.166 1.00 0.00 C ATOM 170 N9 DA B 106 -1.057 14.987 0.380 1.00 0.00 N ATOM 171 C8 DA B 106 -1.265 14.224 1.466 1.00 0.00 C ATOM 172 N7 DA B 106 -0.310 13.402 1.767 1.00 0.00 N ATOM 173 C5 DA B 106 0.629 13.642 0.766 1.00 0.00 C ATOM 174 C6 DA B 106 1.883 13.087 0.496 1.00 0.00 C ATOM 175 N6 DA B 106 2.438 12.140 1.249 1.00 0.00 N ATOM 176 N1 DA B 106 2.542 13.544 -0.579 1.00 0.00 N ATOM 177 C2 DA B 106 2.002 14.489 -1.346 1.00 0.00 C ATOM 178 N3 DA B 106 0.821 15.086 -1.178 1.00 0.00 N ATOM 179 C4 DA B 106 0.182 14.606 -0.090 1.00 0.00 C ATOM 0 H5' DA B 106 -3.207 18.086 2.973 1.00 0.00 H new ATOM 0 H5'' DA B 106 -4.890 17.935 2.508 1.00 0.00 H new ATOM 0 H4' DA B 106 -3.682 18.472 0.557 1.00 0.00 H new ATOM 0 H3' DA B 106 -5.070 15.964 0.745 1.00 0.00 H new ATOM 0 H2' DA B 106 -3.450 14.487 0.011 1.00 0.00 H new ATOM 0 H2'' DA B 106 -3.482 15.340 -1.519 1.00 0.00 H new ATOM 0 H1' DA B 106 -1.477 16.380 -1.088 1.00 0.00 H new ATOM 0 H8 DA B 106 -2.170 14.292 2.051 1.00 0.00 H new ATOM 0 H61 DA B 106 3.357 11.769 1.007 1.00 0.00 H new ATOM 0 H62 DA B 106 1.944 11.785 2.068 1.00 0.00 H new ATOM 0 H2 DA B 106 2.584 14.807 -2.198 1.00 0.00 H new ATOM 191 P DG B 107 -5.926 16.300 -1.945 1.00 0.00 P ATOM 192 OP1 DG B 107 -6.895 17.236 -2.560 1.00 0.00 O ATOM 193 OP2 DG B 107 -6.399 15.079 -1.258 1.00 0.00 O ATOM 194 O5' DG B 107 -4.852 15.876 -3.057 1.00 0.00 O ATOM 195 C5' DG B 107 -4.140 16.877 -3.773 1.00 0.00 C ATOM 196 C4' DG B 107 -3.148 16.263 -4.753 1.00 0.00 C ATOM 197 O4' DG B 107 -2.032 15.642 -4.059 1.00 0.00 O ATOM 198 C3' DG B 107 -3.809 15.195 -5.624 1.00 0.00 C ATOM 199 O3' DG B 107 -3.738 15.598 -6.990 1.00 0.00 O ATOM 200 C2' DG B 107 -3.011 13.932 -5.391 1.00 0.00 C ATOM 201 C1' DG B 107 -1.759 14.344 -4.634 1.00 0.00 C ATOM 202 N9 DG B 107 -1.370 13.343 -3.598 1.00 0.00 N ATOM 203 C8 DG B 107 -2.066 12.883 -2.501 1.00 0.00 C ATOM 204 N7 DG B 107 -1.448 12.009 -1.785 1.00 0.00 N ATOM 205 C5 DG B 107 -0.234 11.852 -2.431 1.00 0.00 C ATOM 206 C6 DG B 107 0.857 11.015 -2.093 1.00 0.00 C ATOM 207 O6 DG B 107 0.949 10.235 -1.152 1.00 0.00 O ATOM 208 N1 DG B 107 1.898 11.145 -2.996 1.00 0.00 N ATOM 209 C2 DG B 107 1.898 11.974 -4.091 1.00 0.00 C ATOM 210 N2 DG B 107 3.003 11.942 -4.839 1.00 0.00 N ATOM 211 N3 DG B 107 0.867 12.773 -4.420 1.00 0.00 N ATOM 212 C4 DG B 107 -0.165 12.659 -3.544 1.00 0.00 C ATOM 0 H5' DG B 107 -3.609 17.520 -3.071 1.00 0.00 H new ATOM 0 H5'' DG B 107 -4.844 17.509 -4.314 1.00 0.00 H new ATOM 0 H4' DG B 107 -2.790 17.082 -5.377 1.00 0.00 H new ATOM 0 H3' DG B 107 -4.860 15.043 -5.380 1.00 0.00 H new ATOM 0 H2' DG B 107 -3.590 13.208 -4.818 1.00 0.00 H new ATOM 0 H2'' DG B 107 -2.753 13.456 -6.337 1.00 0.00 H new ATOM 0 H1' DG B 107 -0.905 14.394 -5.309 1.00 0.00 H new ATOM 0 H8 DG B 107 -3.059 13.231 -2.259 1.00 0.00 H new ATOM 0 H1 DG B 107 2.732 10.580 -2.835 1.00 0.00 H new ATOM 0 H21 DG B 107 3.075 12.531 -5.669 1.00 0.00 H new ATOM 0 H22 DG B 107 3.776 11.328 -4.581 1.00 0.00 H new ATOM 224 P DA B 108 -4.340 14.701 -8.179 1.00 0.00 P ATOM 225 OP1 DA B 108 -4.840 15.607 -9.238 1.00 0.00 O ATOM 226 OP2 DA B 108 -5.238 13.683 -7.590 1.00 0.00 O ATOM 227 O5' DA B 108 -3.021 13.963 -8.725 1.00 0.00 O ATOM 228 C5' DA B 108 -1.948 14.761 -9.227 1.00 0.00 C ATOM 229 C4' DA B 108 -0.760 13.924 -9.713 1.00 0.00 C ATOM 230 O4' DA B 108 -0.063 13.305 -8.596 1.00 0.00 O ATOM 231 C3' DA B 108 -1.203 12.810 -10.664 1.00 0.00 C ATOM 232 O3' DA B 108 -0.454 12.905 -11.885 1.00 0.00 O ATOM 233 C2' DA B 108 -0.907 11.517 -9.937 1.00 0.00 C ATOM 234 C1' DA B 108 0.025 11.870 -8.788 1.00 0.00 C ATOM 235 N9 DA B 108 -0.325 11.141 -7.543 1.00 0.00 N ATOM 236 C8 DA B 108 -1.514 11.109 -6.868 1.00 0.00 C ATOM 237 N7 DA B 108 -1.501 10.451 -5.751 1.00 0.00 N ATOM 238 C5 DA B 108 -0.191 9.995 -5.667 1.00 0.00 C ATOM 239 C6 DA B 108 0.475 9.226 -4.711 1.00 0.00 C ATOM 240 N6 DA B 108 -0.102 8.814 -3.588 1.00 0.00 N ATOM 241 N1 DA B 108 1.766 8.936 -4.930 1.00 0.00 N ATOM 242 C2 DA B 108 2.376 9.385 -6.024 1.00 0.00 C ATOM 243 N3 DA B 108 1.842 10.132 -6.997 1.00 0.00 N ATOM 244 C4 DA B 108 0.538 10.401 -6.751 1.00 0.00 C ATOM 0 H5' DA B 108 -1.611 15.441 -8.445 1.00 0.00 H new ATOM 0 H5'' DA B 108 -2.313 15.376 -10.049 1.00 0.00 H new ATOM 0 H4' DA B 108 -0.097 14.612 -10.238 1.00 0.00 H new ATOM 0 H3' DA B 108 -2.259 12.874 -10.928 1.00 0.00 H new ATOM 0 H2' DA B 108 -1.825 11.062 -9.566 1.00 0.00 H new ATOM 0 H2'' DA B 108 -0.441 10.794 -10.606 1.00 0.00 H new ATOM 0 H1' DA B 108 1.045 11.571 -9.030 1.00 0.00 H new ATOM 0 H8 DA B 108 -2.402 11.598 -7.240 1.00 0.00 H new ATOM 0 H61 DA B 108 0.426 8.253 -2.919 1.00 0.00 H new ATOM 0 H62 DA B 108 -1.073 9.058 -3.394 1.00 0.00 H new ATOM 0 H2 DA B 108 3.416 9.117 -6.139 1.00 0.00 H new ATOM 256 P DT B 109 -0.673 11.878 -13.107 1.00 0.00 P ATOM 257 OP1 DT B 109 -0.473 12.621 -14.372 1.00 0.00 O ATOM 258 OP2 DT B 109 -1.936 11.143 -12.875 1.00 0.00 O ATOM 259 O5' DT B 109 0.554 10.849 -12.925 1.00 0.00 O ATOM 260 C5' DT B 109 1.898 11.343 -12.978 1.00 0.00 C ATOM 261 C4' DT B 109 2.944 10.240 -12.775 1.00 0.00 C ATOM 262 O4' DT B 109 2.912 9.746 -11.412 1.00 0.00 O ATOM 263 C3' DT B 109 2.731 9.049 -13.721 1.00 0.00 C ATOM 264 O3' DT B 109 3.884 8.866 -14.545 1.00 0.00 O ATOM 265 C2' DT B 109 2.545 7.845 -12.828 1.00 0.00 C ATOM 266 C1' DT B 109 2.847 8.305 -11.407 1.00 0.00 C ATOM 267 N1 DT B 109 1.816 7.820 -10.454 1.00 0.00 N ATOM 268 C2 DT B 109 2.211 6.993 -9.411 1.00 0.00 C ATOM 269 O2 DT B 109 3.375 6.620 -9.278 1.00 0.00 O ATOM 270 N3 DT B 109 1.218 6.611 -8.529 1.00 0.00 N ATOM 271 C4 DT B 109 -0.112 6.983 -8.594 1.00 0.00 C ATOM 272 O4 DT B 109 -0.911 6.590 -7.756 1.00 0.00 O ATOM 273 C5 DT B 109 -0.432 7.845 -9.708 1.00 0.00 C ATOM 274 C7 DT B 109 -1.873 8.345 -9.864 1.00 0.00 C ATOM 275 C6 DT B 109 0.523 8.224 -10.587 1.00 0.00 C ATOM 0 H5' DT B 109 2.030 12.108 -12.213 1.00 0.00 H new ATOM 0 H5'' DT B 109 2.066 11.824 -13.942 1.00 0.00 H new ATOM 0 H4' DT B 109 3.910 10.695 -12.995 1.00 0.00 H new ATOM 0 H3' DT B 109 1.875 9.205 -14.377 1.00 0.00 H new ATOM 0 H2' DT B 109 1.528 7.461 -12.903 1.00 0.00 H new ATOM 0 H2'' DT B 109 3.214 7.036 -13.124 1.00 0.00 H new ATOM 0 H1' DT B 109 3.799 7.889 -11.076 1.00 0.00 H new ATOM 0 H3 DT B 109 1.491 5.999 -7.760 1.00 0.00 H new ATOM 0 H71 DT B 109 -2.561 7.606 -9.454 1.00 0.00 H new ATOM 0 H72 DT B 109 -1.991 9.287 -9.328 1.00 0.00 H new ATOM 0 H73 DT B 109 -2.093 8.498 -10.921 1.00 0.00 H new ATOM 0 H6 DT B 109 0.253 8.863 -11.415 1.00 0.00 H new ATOM 288 P DA B 110 3.899 7.808 -15.760 1.00 0.00 P ATOM 289 OP1 DA B 110 4.991 8.181 -16.687 1.00 0.00 O ATOM 290 OP2 DA B 110 2.515 7.666 -16.268 1.00 0.00 O ATOM 291 O5' DA B 110 4.310 6.434 -15.023 1.00 0.00 O ATOM 292 C5' DA B 110 5.554 6.341 -14.332 1.00 0.00 C ATOM 293 C4' DA B 110 5.773 4.963 -13.694 1.00 0.00 C ATOM 294 O4' DA B 110 4.845 4.778 -12.587 1.00 0.00 O ATOM 295 C3' DA B 110 5.537 3.814 -14.679 1.00 0.00 C ATOM 296 O3' DA B 110 6.635 2.901 -14.611 1.00 0.00 O ATOM 297 C2' DA B 110 4.273 3.128 -14.227 1.00 0.00 C ATOM 298 C1' DA B 110 3.952 3.662 -12.842 1.00 0.00 C ATOM 299 N9 DA B 110 2.531 4.071 -12.741 1.00 0.00 N ATOM 300 C8 DA B 110 1.808 4.890 -13.560 1.00 0.00 C ATOM 301 N7 DA B 110 0.575 5.082 -13.201 1.00 0.00 N ATOM 302 C5 DA B 110 0.461 4.324 -12.038 1.00 0.00 C ATOM 303 C6 DA B 110 -0.605 4.097 -11.156 1.00 0.00 C ATOM 304 N6 DA B 110 -1.804 4.655 -11.312 1.00 0.00 N ATOM 305 N1 DA B 110 -0.382 3.289 -10.102 1.00 0.00 N ATOM 306 C2 DA B 110 0.822 2.739 -9.928 1.00 0.00 C ATOM 307 N3 DA B 110 1.898 2.891 -10.700 1.00 0.00 N ATOM 308 C4 DA B 110 1.643 3.703 -11.748 1.00 0.00 C ATOM 0 H5' DA B 110 5.593 7.106 -13.557 1.00 0.00 H new ATOM 0 H5'' DA B 110 6.368 6.549 -15.027 1.00 0.00 H new ATOM 0 H4' DA B 110 6.811 4.940 -13.362 1.00 0.00 H new ATOM 0 H3' DA B 110 5.450 4.170 -15.706 1.00 0.00 H new ATOM 0 H2' DA B 110 3.455 3.331 -14.918 1.00 0.00 H new ATOM 0 H2'' DA B 110 4.408 2.047 -14.202 1.00 0.00 H new ATOM 0 H1' DA B 110 4.100 2.885 -12.092 1.00 0.00 H new ATOM 0 H8 DA B 110 2.231 5.345 -14.443 1.00 0.00 H new ATOM 0 H61 DA B 110 -2.549 4.459 -10.643 1.00 0.00 H new ATOM 0 H62 DA B 110 -1.978 5.278 -12.100 1.00 0.00 H new ATOM 0 H2 DA B 110 0.937 2.099 -9.065 1.00 0.00 H new ATOM 320 P DA B 111 6.699 1.577 -15.525 1.00 0.00 P ATOM 321 OP1 DA B 111 8.119 1.253 -15.783 1.00 0.00 O ATOM 322 OP2 DA B 111 5.756 1.743 -16.654 1.00 0.00 O ATOM 323 O5' DA B 111 6.097 0.469 -14.522 1.00 0.00 O ATOM 324 C5' DA B 111 6.762 0.221 -13.280 1.00 0.00 C ATOM 325 C4' DA B 111 6.047 -0.829 -12.426 1.00 0.00 C ATOM 326 O4' DA B 111 4.787 -0.312 -11.943 1.00 0.00 O ATOM 327 C3' DA B 111 5.767 -2.119 -13.205 1.00 0.00 C ATOM 328 O3' DA B 111 6.417 -3.213 -12.561 1.00 0.00 O ATOM 329 C2' DA B 111 4.265 -2.311 -13.153 1.00 0.00 C ATOM 330 C1' DA B 111 3.714 -1.235 -12.224 1.00 0.00 C ATOM 331 N9 DA B 111 2.574 -0.537 -12.845 1.00 0.00 N ATOM 332 C8 DA B 111 2.518 0.121 -14.035 1.00 0.00 C ATOM 333 N7 DA B 111 1.368 0.653 -14.321 1.00 0.00 N ATOM 334 C5 DA B 111 0.585 0.316 -13.221 1.00 0.00 C ATOM 335 C6 DA B 111 -0.749 0.576 -12.891 1.00 0.00 C ATOM 336 N6 DA B 111 -1.567 1.282 -13.672 1.00 0.00 N ATOM 337 N1 DA B 111 -1.204 0.094 -11.723 1.00 0.00 N ATOM 338 C2 DA B 111 -0.394 -0.602 -10.923 1.00 0.00 C ATOM 339 N3 DA B 111 0.882 -0.905 -11.140 1.00 0.00 N ATOM 340 C4 DA B 111 1.310 -0.410 -12.317 1.00 0.00 C ATOM 0 H5' DA B 111 6.833 1.153 -12.719 1.00 0.00 H new ATOM 0 H5'' DA B 111 7.781 -0.111 -13.478 1.00 0.00 H new ATOM 0 H4' DA B 111 6.714 -1.058 -11.595 1.00 0.00 H new ATOM 0 H3' DA B 111 6.131 -2.065 -14.231 1.00 0.00 H new ATOM 0 H2' DA B 111 3.829 -2.222 -14.148 1.00 0.00 H new ATOM 0 H2'' DA B 111 4.015 -3.306 -12.783 1.00 0.00 H new ATOM 0 H1' DA B 111 3.348 -1.685 -11.301 1.00 0.00 H new ATOM 0 H8 DA B 111 3.370 0.196 -14.695 1.00 0.00 H new ATOM 0 H61 DA B 111 -2.532 1.444 -13.385 1.00 0.00 H new ATOM 0 H62 DA B 111 -1.227 1.661 -14.556 1.00 0.00 H new ATOM 0 H2 DA B 111 -0.822 -0.958 -9.998 1.00 0.00 H new ATOM 352 P DA B 112 6.325 -4.715 -13.126 1.00 0.00 P ATOM 353 OP1 DA B 112 7.472 -5.487 -12.596 1.00 0.00 O ATOM 354 OP2 DA B 112 6.083 -4.653 -14.585 1.00 0.00 O ATOM 355 O5' DA B 112 4.986 -5.237 -12.414 1.00 0.00 O ATOM 356 C5' DA B 112 4.906 -5.260 -10.995 1.00 0.00 C ATOM 357 C4' DA B 112 3.519 -5.681 -10.514 1.00 0.00 C ATOM 358 O4' DA B 112 2.547 -4.682 -10.928 1.00 0.00 O ATOM 359 C3' DA B 112 3.070 -7.017 -11.112 1.00 0.00 C ATOM 360 O3' DA B 112 2.568 -7.864 -10.068 1.00 0.00 O ATOM 361 C2' DA B 112 1.990 -6.684 -12.102 1.00 0.00 C ATOM 362 C1' DA B 112 1.518 -5.284 -11.752 1.00 0.00 C ATOM 363 N9 DA B 112 1.237 -4.487 -12.973 1.00 0.00 N ATOM 364 C8 DA B 112 1.993 -4.304 -14.099 1.00 0.00 C ATOM 365 N7 DA B 112 1.449 -3.555 -15.014 1.00 0.00 N ATOM 366 C5 DA B 112 0.222 -3.211 -14.450 1.00 0.00 C ATOM 367 C6 DA B 112 -0.849 -2.428 -14.904 1.00 0.00 C ATOM 368 N6 DA B 112 -0.853 -1.803 -16.082 1.00 0.00 N ATOM 369 N1 DA B 112 -1.911 -2.302 -14.090 1.00 0.00 N ATOM 370 C2 DA B 112 -1.922 -2.905 -12.901 1.00 0.00 C ATOM 371 N3 DA B 112 -0.965 -3.662 -12.378 1.00 0.00 N ATOM 372 C4 DA B 112 0.085 -3.774 -13.212 1.00 0.00 C ATOM 0 H5' DA B 112 5.143 -4.272 -10.601 1.00 0.00 H new ATOM 0 H5'' DA B 112 5.653 -5.948 -10.600 1.00 0.00 H new ATOM 0 H4' DA B 112 3.578 -5.780 -9.430 1.00 0.00 H new ATOM 0 H3' DA B 112 3.889 -7.549 -11.597 1.00 0.00 H new ATOM 0 H2' DA B 112 2.371 -6.724 -13.123 1.00 0.00 H new ATOM 0 H2'' DA B 112 1.170 -7.399 -12.040 1.00 0.00 H new ATOM 0 H1' DA B 112 0.576 -5.318 -11.204 1.00 0.00 H new ATOM 0 H8 DA B 112 2.970 -4.749 -14.220 1.00 0.00 H new ATOM 0 H61 DA B 112 -1.661 -1.246 -16.361 1.00 0.00 H new ATOM 0 H62 DA B 112 -0.048 -1.882 -16.704 1.00 0.00 H new ATOM 0 H2 DA B 112 -2.806 -2.762 -12.297 1.00 0.00 H new ATOM 384 P DC B 113 2.015 -9.344 -10.378 1.00 0.00 P ATOM 385 OP1 DC B 113 2.360 -10.215 -9.232 1.00 0.00 O ATOM 386 OP2 DC B 113 2.451 -9.719 -11.742 1.00 0.00 O ATOM 387 O5' DC B 113 0.407 -9.151 -10.399 1.00 0.00 O ATOM 388 C5' DC B 113 -0.272 -8.721 -9.206 1.00 0.00 C ATOM 389 C4' DC B 113 -1.797 -8.583 -9.387 1.00 0.00 C ATOM 390 O4' DC B 113 -2.139 -7.445 -10.209 1.00 0.00 O ATOM 391 C3' DC B 113 -2.415 -9.832 -10.026 1.00 0.00 C ATOM 392 O3' DC B 113 -3.398 -10.420 -9.178 1.00 0.00 O ATOM 393 C2' DC B 113 -3.091 -9.353 -11.285 1.00 0.00 C ATOM 394 C1' DC B 113 -3.033 -7.836 -11.276 1.00 0.00 C ATOM 395 N1 DC B 113 -2.533 -7.302 -12.564 1.00 0.00 N ATOM 396 C2 DC B 113 -3.339 -6.426 -13.285 1.00 0.00 C ATOM 397 O2 DC B 113 -4.482 -6.183 -12.903 1.00 0.00 O ATOM 398 N3 DC B 113 -2.826 -5.857 -14.409 1.00 0.00 N ATOM 399 C4 DC B 113 -1.577 -6.134 -14.809 1.00 0.00 C ATOM 400 N4 DC B 113 -1.096 -5.541 -15.899 1.00 0.00 N ATOM 401 C5 DC B 113 -0.753 -7.042 -14.073 1.00 0.00 C ATOM 402 C6 DC B 113 -1.278 -7.603 -12.968 1.00 0.00 C ATOM 0 H5' DC B 113 0.137 -7.762 -8.889 1.00 0.00 H new ATOM 0 H5'' DC B 113 -0.071 -9.433 -8.406 1.00 0.00 H new ATOM 0 H4' DC B 113 -2.201 -8.448 -8.383 1.00 0.00 H new ATOM 0 H3' DC B 113 -1.647 -10.584 -10.210 1.00 0.00 H new ATOM 0 H2' DC B 113 -2.589 -9.752 -12.167 1.00 0.00 H new ATOM 0 H2'' DC B 113 -4.124 -9.698 -11.322 1.00 0.00 H new ATOM 0 H1' DC B 113 -4.035 -7.434 -11.126 1.00 0.00 H new ATOM 0 H41 DC B 113 -0.147 -5.744 -16.213 1.00 0.00 H new ATOM 0 H42 DC B 113 -1.676 -4.884 -16.420 1.00 0.00 H new ATOM 0 H5 DC B 113 0.253 -7.269 -14.392 1.00 0.00 H new ATOM 0 H6 DC B 113 -0.688 -8.304 -12.396 1.00 0.00 H new ATOM 414 P DA B 114 -4.099 -11.801 -9.619 1.00 0.00 P ATOM 415 OP1 DA B 114 -4.689 -12.427 -8.414 1.00 0.00 O ATOM 416 OP2 DA B 114 -3.139 -12.562 -10.448 1.00 0.00 O ATOM 417 O5' DA B 114 -5.309 -11.305 -10.570 1.00 0.00 O ATOM 418 C5' DA B 114 -6.358 -10.484 -10.050 1.00 0.00 C ATOM 419 C4' DA B 114 -7.405 -10.125 -11.122 1.00 0.00 C ATOM 420 O4' DA B 114 -6.861 -9.196 -12.100 1.00 0.00 O ATOM 421 C3' DA B 114 -7.893 -11.366 -11.882 1.00 0.00 C ATOM 422 O3' DA B 114 -9.324 -11.418 -11.883 1.00 0.00 O ATOM 423 C2' DA B 114 -7.387 -11.194 -13.292 1.00 0.00 C ATOM 424 C1' DA B 114 -7.003 -9.735 -13.438 1.00 0.00 C ATOM 425 N9 DA B 114 -5.762 -9.578 -14.213 1.00 0.00 N ATOM 426 C8 DA B 114 -4.546 -10.100 -13.950 1.00 0.00 C ATOM 427 N7 DA B 114 -3.598 -9.747 -14.762 1.00 0.00 N ATOM 428 C5 DA B 114 -4.253 -8.909 -15.660 1.00 0.00 C ATOM 429 C6 DA B 114 -3.815 -8.198 -16.779 1.00 0.00 C ATOM 430 N6 DA B 114 -2.548 -8.194 -17.188 1.00 0.00 N ATOM 431 N1 DA B 114 -4.726 -7.473 -17.448 1.00 0.00 N ATOM 432 C2 DA B 114 -5.994 -7.446 -17.040 1.00 0.00 C ATOM 433 N3 DA B 114 -6.514 -8.079 -15.988 1.00 0.00 N ATOM 434 C4 DA B 114 -5.576 -8.801 -15.338 1.00 0.00 C ATOM 0 H5' DA B 114 -5.931 -9.568 -9.641 1.00 0.00 H new ATOM 0 H5'' DA B 114 -6.848 -11.003 -9.226 1.00 0.00 H new ATOM 0 H4' DA B 114 -8.238 -9.669 -10.588 1.00 0.00 H new ATOM 0 H3' DA B 114 -7.533 -12.287 -11.424 1.00 0.00 H new ATOM 0 H2' DA B 114 -6.530 -11.841 -13.478 1.00 0.00 H new ATOM 0 H2'' DA B 114 -8.155 -11.467 -14.016 1.00 0.00 H new ATOM 0 H1' DA B 114 -7.772 -9.194 -13.989 1.00 0.00 H new ATOM 0 H8 DA B 114 -4.373 -10.767 -13.119 1.00 0.00 H new ATOM 0 H61 DA B 114 -2.280 -7.657 -18.013 1.00 0.00 H new ATOM 0 H62 DA B 114 -1.845 -8.728 -16.676 1.00 0.00 H new ATOM 0 H2 DA B 114 -6.675 -6.846 -17.625 1.00 0.00 H new ATOM 446 P DT B 115 -10.105 -12.624 -12.615 1.00 0.00 P ATOM 447 OP1 DT B 115 -11.440 -12.761 -11.990 1.00 0.00 O ATOM 448 OP2 DT B 115 -9.197 -13.790 -12.683 1.00 0.00 O ATOM 449 O5' DT B 115 -10.303 -12.049 -14.110 1.00 0.00 O ATOM 450 C5' DT B 115 -11.072 -10.861 -14.321 1.00 0.00 C ATOM 451 C4' DT B 115 -11.098 -10.431 -15.794 1.00 0.00 C ATOM 452 O4' DT B 115 -9.801 -9.931 -16.201 1.00 0.00 O ATOM 453 C3' DT B 115 -11.472 -11.586 -16.732 1.00 0.00 C ATOM 454 O3' DT B 115 -12.715 -11.332 -17.383 1.00 0.00 O ATOM 455 C2' DT B 115 -10.370 -11.642 -17.769 1.00 0.00 C ATOM 456 C1' DT B 115 -9.454 -10.452 -17.502 1.00 0.00 C ATOM 457 N1 DT B 115 -8.019 -10.851 -17.563 1.00 0.00 N ATOM 458 C2 DT B 115 -7.197 -10.227 -18.490 1.00 0.00 C ATOM 459 O2 DT B 115 -7.615 -9.362 -19.255 1.00 0.00 O ATOM 460 N3 DT B 115 -5.877 -10.636 -18.506 1.00 0.00 N ATOM 461 C4 DT B 115 -5.309 -11.597 -17.693 1.00 0.00 C ATOM 462 O4 DT B 115 -4.114 -11.875 -17.793 1.00 0.00 O ATOM 463 C5 DT B 115 -6.236 -12.196 -16.758 1.00 0.00 C ATOM 464 C7 DT B 115 -5.735 -13.294 -15.813 1.00 0.00 C ATOM 465 C6 DT B 115 -7.533 -11.809 -16.724 1.00 0.00 C ATOM 0 H5' DT B 115 -10.659 -10.053 -13.717 1.00 0.00 H new ATOM 0 H5'' DT B 115 -12.093 -11.027 -13.976 1.00 0.00 H new ATOM 0 H4' DT B 115 -11.856 -9.651 -15.870 1.00 0.00 H new ATOM 0 H3' DT B 115 -11.576 -12.519 -16.179 1.00 0.00 H new ATOM 0 H2' DT B 115 -9.818 -12.579 -17.696 1.00 0.00 H new ATOM 0 H2'' DT B 115 -10.784 -11.593 -18.776 1.00 0.00 H new ATOM 0 H1' DT B 115 -9.590 -9.686 -18.266 1.00 0.00 H new ATOM 0 H3 DT B 115 -5.263 -10.184 -19.184 1.00 0.00 H new ATOM 0 H71 DT B 115 -4.924 -13.844 -16.291 1.00 0.00 H new ATOM 0 H72 DT B 115 -5.372 -12.842 -14.890 1.00 0.00 H new ATOM 0 H73 DT B 115 -6.552 -13.978 -15.585 1.00 0.00 H new ATOM 0 H6 DT B 115 -8.201 -12.272 -16.013 1.00 0.00 H new ATOM 478 P DT B 116 -13.417 -12.487 -18.253 1.00 0.00 P ATOM 479 OP1 DT B 116 -14.851 -12.154 -18.400 1.00 0.00 O ATOM 480 OP2 DT B 116 -13.017 -13.796 -17.689 1.00 0.00 O ATOM 481 O5' DT B 116 -12.705 -12.316 -19.686 1.00 0.00 O ATOM 482 C5' DT B 116 -12.944 -11.146 -20.468 1.00 0.00 C ATOM 483 C4' DT B 116 -12.085 -11.112 -21.734 1.00 0.00 C ATOM 484 O4' DT B 116 -10.682 -11.058 -21.388 1.00 0.00 O ATOM 485 C3' DT B 116 -12.306 -12.342 -22.627 1.00 0.00 C ATOM 486 O3' DT B 116 -12.965 -11.974 -23.841 1.00 0.00 O ATOM 487 C2' DT B 116 -10.924 -12.887 -22.924 1.00 0.00 C ATOM 488 C1' DT B 116 -9.928 -12.001 -22.177 1.00 0.00 C ATOM 489 N1 DT B 116 -9.034 -12.820 -21.314 1.00 0.00 N ATOM 490 C2 DT B 116 -7.668 -12.764 -21.545 1.00 0.00 C ATOM 491 O2 DT B 116 -7.184 -12.071 -22.436 1.00 0.00 O ATOM 492 N3 DT B 116 -6.879 -13.533 -20.717 1.00 0.00 N ATOM 493 C4 DT B 116 -7.317 -14.346 -19.692 1.00 0.00 C ATOM 494 O4 DT B 116 -6.510 -14.986 -19.018 1.00 0.00 O ATOM 495 C5 DT B 116 -8.757 -14.347 -19.520 1.00 0.00 C ATOM 496 C7 DT B 116 -9.382 -15.221 -18.431 1.00 0.00 C ATOM 497 C6 DT B 116 -9.552 -13.598 -20.319 1.00 0.00 C ATOM 0 H5' DT B 116 -12.737 -10.261 -19.867 1.00 0.00 H new ATOM 0 H5'' DT B 116 -13.998 -11.105 -20.744 1.00 0.00 H new ATOM 0 H4' DT B 116 -12.386 -10.221 -22.284 1.00 0.00 H new ATOM 0 H3' DT B 116 -12.937 -13.082 -22.135 1.00 0.00 H new ATOM 0 H2' DT B 116 -10.839 -13.924 -22.598 1.00 0.00 H new ATOM 0 H2'' DT B 116 -10.725 -12.873 -23.996 1.00 0.00 H new ATOM 0 HO3' DT B 116 -13.095 -12.770 -24.397 1.00 0.00 H new ATOM 0 H1' DT B 116 -9.291 -11.472 -22.886 1.00 0.00 H new ATOM 0 H3 DT B 116 -5.872 -13.498 -20.878 1.00 0.00 H new ATOM 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1.00 0.00 H new ATOM 0 H2' DG C 120 -7.761 0.382 -18.646 1.00 0.00 H new ATOM 0 H2'' DG C 120 -8.978 -0.017 -17.450 1.00 0.00 H new ATOM 0 H1' DG C 120 -8.666 -2.292 -17.701 1.00 0.00 H new ATOM 0 H8 DG C 120 -5.853 -0.529 -19.674 1.00 0.00 H new ATOM 0 H1 DG C 120 -4.017 -4.889 -15.359 1.00 0.00 H new ATOM 0 H21 DG C 120 -7.424 -5.376 -14.868 1.00 0.00 H new ATOM 0 H22 DG C 120 -5.771 -5.817 -14.427 1.00 0.00 H new ATOM 639 P DT C 121 -11.304 1.182 -17.828 1.00 0.00 P ATOM 640 OP1 DT C 121 -12.774 1.339 -17.768 1.00 0.00 O ATOM 641 OP2 DT C 121 -10.452 2.338 -18.186 1.00 0.00 O ATOM 642 O5' DT C 121 -10.803 0.611 -16.410 1.00 0.00 O ATOM 643 C5' DT C 121 -11.373 -0.584 -15.872 1.00 0.00 C ATOM 644 C4' DT C 121 -10.629 -1.053 -14.619 1.00 0.00 C ATOM 645 O4' DT C 121 -9.318 -1.567 -14.948 1.00 0.00 O ATOM 646 C3' DT C 121 -10.450 0.088 -13.607 1.00 0.00 C ATOM 647 O3' DT C 121 -11.267 -0.131 -12.452 1.00 0.00 O ATOM 648 C2' DT C 121 -8.974 0.070 -13.247 1.00 0.00 C ATOM 649 C1' DT C 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3.627 -8.047 1.00 0.00 C ATOM 722 C6 DT C 123 -4.952 2.053 -6.568 1.00 0.00 C ATOM 0 H5' DT C 123 -7.097 -1.745 -5.111 1.00 0.00 H new ATOM 0 H5'' DT C 123 -7.467 -1.352 -3.444 1.00 0.00 H new ATOM 0 H4' DT C 123 -5.178 -1.984 -3.589 1.00 0.00 H new ATOM 0 H3' DT C 123 -5.935 0.476 -2.449 1.00 0.00 H new ATOM 0 H2' DT C 123 -5.013 1.970 -3.964 1.00 0.00 H new ATOM 0 H2'' DT C 123 -3.525 1.566 -3.131 1.00 0.00 H new ATOM 0 H1' DT C 123 -2.777 0.188 -4.842 1.00 0.00 H new ATOM 0 H3 DT C 123 -1.781 2.456 -8.501 1.00 0.00 H new ATOM 0 H71 DT C 123 -5.947 4.573 -8.516 1.00 0.00 H new ATOM 0 H72 DT C 123 -6.792 3.024 -8.750 1.00 0.00 H new ATOM 0 H73 DT C 123 -6.818 3.821 -7.159 1.00 0.00 H new ATOM 0 H6 DT C 123 -5.866 1.928 -6.006 1.00 0.00 H new ATOM 735 P DA C 124 -3.625 0.333 -0.718 1.00 0.00 P ATOM 736 OP1 DA C 124 -3.840 -0.462 0.511 1.00 0.00 O ATOM 737 OP2 DA C 124 -4.156 1.712 -0.804 1.00 0.00 O ATOM 738 O5' DA C 124 -2.033 0.387 -1.011 1.00 0.00 O ATOM 739 C5' DA C 124 -1.317 -0.853 -1.102 1.00 0.00 C ATOM 740 C4' DA C 124 0.192 -0.698 -1.382 1.00 0.00 C ATOM 741 O4' DA C 124 0.404 -0.049 -2.663 1.00 0.00 O ATOM 742 C3' DA C 124 0.879 0.164 -0.318 1.00 0.00 C ATOM 743 O3' DA C 124 2.147 -0.395 0.055 1.00 0.00 O ATOM 744 C2' DA C 124 1.084 1.507 -0.970 1.00 0.00 C ATOM 745 C1' DA C 124 0.920 1.290 -2.468 1.00 0.00 C ATOM 746 N9 DA C 124 0.015 2.285 -3.055 1.00 0.00 N ATOM 747 C8 DA C 124 -1.250 2.566 -2.689 1.00 0.00 C ATOM 748 N7 DA C 124 -1.865 3.441 -3.424 1.00 0.00 N ATOM 749 C5 DA C 124 -0.908 3.773 -4.377 1.00 0.00 C ATOM 750 C6 DA C 124 -0.922 4.654 -5.461 1.00 0.00 C ATOM 751 N6 DA C 124 -1.988 5.386 -5.783 1.00 0.00 N ATOM 752 N1 DA C 124 0.201 4.747 -6.200 1.00 0.00 N ATOM 753 C2 DA C 124 1.271 4.013 -5.886 1.00 0.00 C ATOM 754 N3 DA C 124 1.385 3.144 -4.881 1.00 0.00 N ATOM 755 C4 DA C 124 0.246 3.076 -4.162 1.00 0.00 C ATOM 0 H5' DA C 124 -1.761 -1.458 -1.893 1.00 0.00 H new ATOM 0 H5'' DA C 124 -1.447 -1.403 -0.170 1.00 0.00 H new ATOM 0 H4' DA C 124 0.616 -1.702 -1.375 1.00 0.00 H new ATOM 0 H3' DA C 124 0.280 0.228 0.591 1.00 0.00 H new ATOM 0 H2' DA C 124 0.358 2.232 -0.601 1.00 0.00 H new ATOM 0 H2'' DA C 124 2.074 1.902 -0.741 1.00 0.00 H new ATOM 0 H1' DA C 124 1.882 1.406 -2.967 1.00 0.00 H new ATOM 0 H8 DA C 124 -1.722 2.094 -1.840 1.00 0.00 H new ATOM 0 H61 DA C 124 -1.951 6.016 -6.584 1.00 0.00 H new ATOM 0 H62 DA C 124 -2.841 5.316 -5.228 1.00 0.00 H new ATOM 0 H2 DA C 124 2.140 4.137 -6.515 1.00 0.00 H new ATOM 767 P DT C 125 3.072 0.329 1.166 1.00 0.00 P ATOM 768 OP1 DT C 125 3.957 -0.693 1.768 1.00 0.00 O ATOM 769 OP2 DT C 125 2.196 1.146 2.034 1.00 0.00 O ATOM 770 O5' DT C 125 3.983 1.329 0.282 1.00 0.00 O ATOM 771 C5' DT C 125 4.924 0.778 -0.645 1.00 0.00 C ATOM 772 C4' DT C 125 5.668 1.843 -1.471 1.00 0.00 C ATOM 773 O4' DT C 125 4.756 2.466 -2.410 1.00 0.00 O ATOM 774 C3' DT C 125 6.275 2.965 -0.611 1.00 0.00 C ATOM 775 O3' DT C 125 7.664 3.145 -0.939 1.00 0.00 O ATOM 776 C2' DT C 125 5.506 4.207 -0.989 1.00 0.00 C ATOM 777 C1' DT C 125 4.915 3.899 -2.359 1.00 0.00 C ATOM 778 N1 DT C 125 3.621 4.610 -2.637 1.00 0.00 N ATOM 779 C2 DT C 125 3.516 5.299 -3.845 1.00 0.00 C ATOM 780 O2 DT C 125 4.452 5.364 -4.640 1.00 0.00 O ATOM 781 N3 DT C 125 2.301 5.902 -4.105 1.00 0.00 N ATOM 782 C4 DT C 125 1.189 5.879 -3.282 1.00 0.00 C ATOM 783 O4 DT C 125 0.125 6.357 -3.652 1.00 0.00 O ATOM 784 C5 DT C 125 1.385 5.166 -2.046 1.00 0.00 C ATOM 785 C7 DT C 125 0.248 5.158 -1.020 1.00 0.00 C ATOM 786 C6 DT C 125 2.564 4.561 -1.764 1.00 0.00 C ATOM 0 H5' DT C 125 4.401 0.103 -1.323 1.00 0.00 H new ATOM 0 H5'' DT C 125 5.653 0.179 -0.098 1.00 0.00 H new ATOM 0 H4' DT C 125 6.478 1.316 -1.976 1.00 0.00 H new ATOM 0 H3' DT C 125 6.212 2.740 0.454 1.00 0.00 H new ATOM 0 H2' DT C 125 4.724 4.425 -0.261 1.00 0.00 H new ATOM 0 H2'' DT C 125 6.158 5.080 -1.027 1.00 0.00 H new ATOM 0 H1' DT C 125 5.585 4.264 -3.138 1.00 0.00 H new ATOM 0 H3 DT C 125 2.216 6.411 -4.985 1.00 0.00 H new ATOM 0 H71 DT C 125 0.282 4.232 -0.446 1.00 0.00 H new ATOM 0 H72 DT C 125 0.360 6.007 -0.346 1.00 0.00 H new ATOM 0 H73 DT C 125 -0.709 5.229 -1.537 1.00 0.00 H new ATOM 0 H6 DT C 125 2.674 4.028 -0.831 1.00 0.00 H new ATOM 799 P DC C 126 8.565 4.260 -0.194 1.00 0.00 P ATOM 800 OP1 DC C 126 9.939 3.727 -0.064 1.00 0.00 O ATOM 801 OP2 DC C 126 7.834 4.712 1.010 1.00 0.00 O ATOM 802 O5' DC C 126 8.599 5.485 -1.255 1.00 0.00 O ATOM 803 C5' DC C 126 9.151 5.277 -2.562 1.00 0.00 C ATOM 804 C4' DC C 126 9.073 6.521 -3.469 1.00 0.00 C ATOM 805 O4' DC C 126 7.702 6.778 -3.873 1.00 0.00 O ATOM 806 C3' DC C 126 9.615 7.786 -2.784 1.00 0.00 C ATOM 807 O3' DC C 126 10.781 8.262 -3.455 1.00 0.00 O ATOM 808 C2' DC C 126 8.517 8.822 -2.904 1.00 0.00 C ATOM 809 C1' DC C 126 7.345 8.157 -3.617 1.00 0.00 C ATOM 810 N1 DC C 126 6.117 8.238 -2.781 1.00 0.00 N ATOM 811 C2 DC C 126 4.997 8.900 -3.288 1.00 0.00 C ATOM 812 O2 DC C 126 5.038 9.438 -4.394 1.00 0.00 O ATOM 813 N3 DC C 126 3.877 8.948 -2.518 1.00 0.00 N ATOM 814 C4 DC C 126 3.847 8.378 -1.309 1.00 0.00 C ATOM 815 N4 DC C 126 2.735 8.450 -0.585 1.00 0.00 N ATOM 816 C5 DC C 126 4.991 7.700 -0.785 1.00 0.00 C ATOM 817 C6 DC C 126 6.096 7.655 -1.552 1.00 0.00 C ATOM 0 H5' DC C 126 8.624 4.453 -3.043 1.00 0.00 H new ATOM 0 H5'' DC C 126 10.193 4.974 -2.463 1.00 0.00 H new ATOM 0 H4' DC C 126 9.694 6.300 -4.337 1.00 0.00 H new ATOM 0 H3' DC C 126 9.886 7.583 -1.748 1.00 0.00 H new ATOM 0 H2' DC C 126 8.216 9.179 -1.919 1.00 0.00 H new ATOM 0 H2'' DC C 126 8.866 9.689 -3.464 1.00 0.00 H new ATOM 0 H1' DC C 126 7.135 8.667 -4.557 1.00 0.00 H new ATOM 0 H41 DC C 126 2.699 8.019 0.339 1.00 0.00 H new ATOM 0 H42 DC C 126 1.917 8.936 -0.953 1.00 0.00 H new ATOM 0 H5 DC C 126 4.969 7.240 0.192 1.00 0.00 H new ATOM 0 H6 DC C 126 6.978 7.149 -1.187 1.00 0.00 H new ATOM 829 P DT C 127 11.651 9.470 -2.841 1.00 0.00 P ATOM 830 OP1 DT C 127 13.006 9.411 -3.433 1.00 0.00 O ATOM 831 OP2 DT C 127 11.487 9.463 -1.370 1.00 0.00 O ATOM 832 O5' DT C 127 10.897 10.766 -3.429 1.00 0.00 O ATOM 833 C5' DT C 127 10.796 10.949 -4.841 1.00 0.00 C ATOM 834 C4' DT C 127 9.929 12.157 -5.212 1.00 0.00 C ATOM 835 O4' DT C 127 8.539 11.899 -4.886 1.00 0.00 O ATOM 836 C3' DT C 127 10.359 13.437 -4.477 1.00 0.00 C ATOM 837 O3' DT C 127 10.716 14.451 -5.422 1.00 0.00 O ATOM 838 C2' DT C 127 9.150 13.871 -3.679 1.00 0.00 C ATOM 839 C1' DT C 127 7.983 13.017 -4.162 1.00 0.00 C ATOM 840 N1 DT C 127 7.127 12.563 -3.023 1.00 0.00 N ATOM 841 C2 DT C 127 5.790 12.944 -3.024 1.00 0.00 C ATOM 842 O2 DT C 127 5.305 13.616 -3.931 1.00 0.00 O ATOM 843 N3 DT C 127 5.033 12.523 -1.949 1.00 0.00 N ATOM 844 C4 DT C 127 5.479 11.762 -0.885 1.00 0.00 C ATOM 845 O4 DT C 127 4.715 11.449 0.022 1.00 0.00 O ATOM 846 C5 DT C 127 6.875 11.405 -0.959 1.00 0.00 C ATOM 847 C7 DT C 127 7.480 10.570 0.175 1.00 0.00 C ATOM 848 C6 DT C 127 7.645 11.803 -2.002 1.00 0.00 C ATOM 0 H5' DT C 127 10.375 10.051 -5.292 1.00 0.00 H new ATOM 0 H5'' DT C 127 11.794 11.079 -5.260 1.00 0.00 H new ATOM 0 H4' DT C 127 10.057 12.308 -6.284 1.00 0.00 H new ATOM 0 H3' DT C 127 11.226 13.267 -3.839 1.00 0.00 H new ATOM 0 H2' DT C 127 9.319 13.729 -2.611 1.00 0.00 H new ATOM 0 H2'' DT C 127 8.945 14.931 -3.831 1.00 0.00 H new ATOM 0 H1' DT C 127 7.331 13.601 -4.812 1.00 0.00 H new ATOM 0 H3 DT C 127 4.051 12.800 -1.939 1.00 0.00 H new ATOM 0 H71 DT C 127 6.958 10.789 1.106 1.00 0.00 H new ATOM 0 H72 DT C 127 7.377 9.510 -0.058 1.00 0.00 H new ATOM 0 H73 DT C 127 8.536 10.816 0.285 1.00 0.00 H new ATOM 0 H6 DT C 127 8.686 11.517 -2.031 1.00 0.00 H new ATOM 861 P DG C 128 11.216 15.907 -4.943 1.00 0.00 P ATOM 862 OP1 DG C 128 12.038 16.488 -6.029 1.00 0.00 O ATOM 863 OP2 DG C 128 11.782 15.778 -3.582 1.00 0.00 O ATOM 864 O5' DG C 128 9.848 16.757 -4.843 1.00 0.00 O ATOM 865 C5' DG C 128 9.056 16.994 -6.010 1.00 0.00 C ATOM 866 C4' DG C 128 7.802 17.818 -5.696 1.00 0.00 C ATOM 867 O4' DG C 128 6.948 17.098 -4.784 1.00 0.00 O ATOM 868 C3' DG C 128 8.132 19.183 -5.067 1.00 0.00 C ATOM 869 O3' DG C 128 7.623 20.237 -5.891 1.00 0.00 O ATOM 870 C2' DG C 128 7.441 19.191 -3.723 1.00 0.00 C ATOM 871 C1' DG C 128 6.614 17.915 -3.646 1.00 0.00 C ATOM 872 N9 DG C 128 6.887 17.198 -2.397 1.00 0.00 N ATOM 873 C8 DG C 128 8.066 16.715 -1.942 1.00 0.00 C ATOM 874 N7 DG C 128 8.016 16.123 -0.786 1.00 0.00 N ATOM 875 C5 DG C 128 6.669 16.227 -0.441 1.00 0.00 C ATOM 876 C6 DG C 128 5.984 15.767 0.713 1.00 0.00 C ATOM 877 O6 DG C 128 6.442 15.169 1.683 1.00 0.00 O ATOM 878 N1 DG C 128 4.631 16.079 0.658 1.00 0.00 N ATOM 879 C2 DG C 128 4.013 16.749 -0.376 1.00 0.00 C ATOM 880 N2 DG C 128 2.703 16.957 -0.248 1.00 0.00 N ATOM 881 N3 DG C 128 4.654 17.181 -1.461 1.00 0.00 N ATOM 882 C4 DG C 128 5.972 16.886 -1.426 1.00 0.00 C ATOM 0 H5' DG C 128 8.763 16.040 -6.449 1.00 0.00 H new ATOM 0 H5'' DG C 128 9.656 17.517 -6.755 1.00 0.00 H new ATOM 0 H4' DG C 128 7.301 17.989 -6.649 1.00 0.00 H new ATOM 0 H3' DG C 128 9.207 19.335 -4.968 1.00 0.00 H new ATOM 0 H2' DG C 128 8.170 19.229 -2.914 1.00 0.00 H new ATOM 0 H2'' DG C 128 6.805 20.070 -3.620 1.00 0.00 H new ATOM 0 H1' DG C 128 5.551 18.156 -3.659 1.00 0.00 H new ATOM 0 H8 DG C 128 8.985 16.814 -2.501 1.00 0.00 H new ATOM 0 H1 DG C 128 4.050 15.790 1.444 1.00 0.00 H new ATOM 0 H21 DG C 128 2.190 17.448 -0.981 1.00 0.00 H new ATOM 0 H22 DG C 128 2.213 16.626 0.583 1.00 0.00 H new ATOM 894 P DC C 129 8.010 21.778 -5.628 1.00 0.00 P ATOM 895 OP1 DC C 129 7.833 22.515 -6.901 1.00 0.00 O ATOM 896 OP2 DC C 129 9.318 21.815 -4.936 1.00 0.00 O ATOM 897 O5' DC C 129 6.877 22.288 -4.595 1.00 0.00 O ATOM 898 C5' DC C 129 5.498 22.247 -4.966 1.00 0.00 C ATOM 899 C4' DC C 129 4.567 22.770 -3.861 1.00 0.00 C ATOM 900 O4' DC C 129 4.529 21.845 -2.743 1.00 0.00 O ATOM 901 C3' DC C 129 5.025 24.132 -3.321 1.00 0.00 C ATOM 902 O3' DC C 129 3.924 25.047 -3.323 1.00 0.00 O ATOM 903 C2' DC C 129 5.473 23.880 -1.905 1.00 0.00 C ATOM 904 C1' DC C 129 4.946 22.505 -1.525 1.00 0.00 C ATOM 905 N1 DC C 129 5.957 21.680 -0.796 1.00 0.00 N ATOM 906 C2 DC C 129 5.583 21.126 0.428 1.00 0.00 C ATOM 907 O2 DC C 129 4.468 21.360 0.894 1.00 0.00 O ATOM 908 N3 DC C 129 6.471 20.331 1.081 1.00 0.00 N ATOM 909 C4 DC C 129 7.680 20.085 0.567 1.00 0.00 C ATOM 910 N4 DC C 129 8.518 19.288 1.229 1.00 0.00 N ATOM 911 C5 DC C 129 8.078 20.650 -0.686 1.00 0.00 C ATOM 912 C6 DC C 129 7.194 21.435 -1.331 1.00 0.00 C ATOM 0 H5' DC C 129 5.223 21.221 -5.211 1.00 0.00 H new ATOM 0 H5'' DC C 129 5.352 22.840 -5.869 1.00 0.00 H new ATOM 0 H4' DC C 129 3.581 22.871 -4.314 1.00 0.00 H new ATOM 0 H3' DC C 129 5.822 24.562 -3.928 1.00 0.00 H new ATOM 0 H2' DC C 129 6.560 23.913 -1.830 1.00 0.00 H new ATOM 0 H2'' DC C 129 5.083 24.644 -1.233 1.00 0.00 H new ATOM 0 H1' DC C 129 4.109 22.623 -0.837 1.00 0.00 H new ATOM 0 H41 DC C 129 9.444 19.092 0.848 1.00 0.00 H new ATOM 0 H42 DC C 129 8.234 18.874 2.117 1.00 0.00 H new ATOM 0 H5 DC C 129 9.056 20.453 -1.101 1.00 0.00 H new ATOM 0 H6 DC C 129 7.463 21.876 -2.280 1.00 0.00 H new ATOM 924 P DA C 130 4.096 26.564 -2.810 1.00 0.00 P ATOM 925 OP1 DA C 130 3.159 27.417 -3.570 1.00 0.00 O ATOM 926 OP2 DA C 130 5.543 26.885 -2.803 1.00 0.00 O ATOM 927 O5' DA C 130 3.593 26.508 -1.277 1.00 0.00 O ATOM 928 C5' DA C 130 2.255 26.102 -0.962 1.00 0.00 C ATOM 929 C4' DA C 130 1.995 26.123 0.551 1.00 0.00 C ATOM 930 O4' DA C 130 2.715 25.060 1.227 1.00 0.00 O ATOM 931 C3' DA C 130 2.431 27.459 1.164 1.00 0.00 C ATOM 932 O3' DA C 130 1.325 28.109 1.789 1.00 0.00 O ATOM 933 C2' DA C 130 3.471 27.111 2.204 1.00 0.00 C ATOM 934 C1' DA C 130 3.510 25.593 2.313 1.00 0.00 C ATOM 935 N9 DA C 130 4.890 25.081 2.252 1.00 0.00 N ATOM 936 C8 DA C 130 5.815 25.283 1.291 1.00 0.00 C ATOM 937 N7 DA C 130 6.952 24.679 1.470 1.00 0.00 N ATOM 938 C5 DA C 130 6.760 24.008 2.677 1.00 0.00 C ATOM 939 C6 DA C 130 7.586 23.171 3.439 1.00 0.00 C ATOM 940 N6 DA C 130 8.825 22.842 3.075 1.00 0.00 N ATOM 941 N1 DA C 130 7.079 22.679 4.584 1.00 0.00 N ATOM 942 C2 DA C 130 5.836 22.989 4.956 1.00 0.00 C ATOM 943 N3 DA C 130 4.973 23.768 4.306 1.00 0.00 N ATOM 944 C4 DA C 130 5.506 24.248 3.164 1.00 0.00 C ATOM 0 H5' DA C 130 2.080 25.098 -1.347 1.00 0.00 H new ATOM 0 H5'' DA C 130 1.547 26.763 -1.462 1.00 0.00 H new ATOM 0 H4' DA C 130 0.923 25.982 0.686 1.00 0.00 H new ATOM 0 H3' DA C 130 2.820 28.136 0.403 1.00 0.00 H new ATOM 0 H2' DA C 130 4.447 27.501 1.917 1.00 0.00 H new ATOM 0 H2'' DA C 130 3.219 27.559 3.165 1.00 0.00 H new ATOM 0 H1' DA C 130 3.106 25.279 3.276 1.00 0.00 H new ATOM 0 H8 DA C 130 5.623 25.906 0.430 1.00 0.00 H new ATOM 0 H61 DA C 130 9.385 22.228 3.667 1.00 0.00 H new ATOM 0 H62 DA C 130 9.214 23.204 2.204 1.00 0.00 H new ATOM 0 H2 DA C 130 5.492 22.562 5.886 1.00 0.00 H new ATOM 956 P DA C 131 1.520 29.545 2.488 1.00 0.00 P ATOM 957 OP1 DA C 131 0.206 30.228 2.513 1.00 0.00 O ATOM 958 OP2 DA C 131 2.685 30.208 1.862 1.00 0.00 O ATOM 959 O5' DA C 131 1.915 29.154 3.997 1.00 0.00 O ATOM 960 C5' DA C 131 0.972 28.494 4.840 1.00 0.00 C ATOM 961 C4' DA C 131 1.554 28.216 6.231 1.00 0.00 C ATOM 962 O4' DA C 131 2.573 27.186 6.167 1.00 0.00 O ATOM 963 C3' DA C 131 2.190 29.471 6.839 1.00 0.00 C ATOM 964 O3' DA C 131 1.529 29.844 8.049 1.00 0.00 O ATOM 965 C2' DA C 131 3.619 29.097 7.146 1.00 0.00 C ATOM 966 C1' DA C 131 3.771 27.616 6.855 1.00 0.00 C ATOM 967 N9 DA C 131 4.980 27.354 6.053 1.00 0.00 N ATOM 968 C8 DA C 131 5.329 27.881 4.858 1.00 0.00 C ATOM 969 N7 DA C 131 6.472 27.481 4.382 1.00 0.00 N ATOM 970 C5 DA C 131 6.927 26.604 5.364 1.00 0.00 C ATOM 971 C6 DA C 131 8.089 25.829 5.484 1.00 0.00 C ATOM 972 N6 DA C 131 9.047 25.802 4.557 1.00 0.00 N ATOM 973 N1 DA C 131 8.220 25.074 6.592 1.00 0.00 N ATOM 974 C2 DA C 131 7.263 25.079 7.522 1.00 0.00 C ATOM 975 N3 DA C 131 6.128 25.773 7.504 1.00 0.00 N ATOM 976 C4 DA C 131 6.024 26.520 6.387 1.00 0.00 C ATOM 0 H5' DA C 131 0.666 27.555 4.379 1.00 0.00 H new ATOM 0 H5'' DA C 131 0.077 29.108 4.936 1.00 0.00 H new ATOM 0 H4' DA C 131 0.723 27.889 6.856 1.00 0.00 H new ATOM 0 H3' DA C 131 2.117 30.315 6.154 1.00 0.00 H new ATOM 0 H2' DA C 131 4.308 29.681 6.536 1.00 0.00 H new ATOM 0 H2'' DA C 131 3.856 29.310 8.188 1.00 0.00 H new ATOM 0 H1' DA C 131 3.892 27.055 7.782 1.00 0.00 H new ATOM 0 H8 DA C 131 4.701 28.586 4.334 1.00 0.00 H new ATOM 0 H61 DA C 131 9.873 25.220 4.694 1.00 0.00 H new ATOM 0 H62 DA C 131 8.954 26.363 3.711 1.00 0.00 H new ATOM 0 H2 DA C 131 7.428 24.450 8.384 1.00 0.00 H new ATOM 988 P DC C 132 2.026 31.137 8.868 1.00 0.00 P ATOM 989 OP1 DC C 132 0.894 31.639 9.679 1.00 0.00 O ATOM 990 OP2 DC C 132 2.720 32.043 7.927 1.00 0.00 O ATOM 991 O5' DC C 132 3.125 30.507 9.863 1.00 0.00 O ATOM 992 C5' DC C 132 2.763 29.462 10.769 1.00 0.00 C ATOM 993 C4' DC C 132 3.950 29.004 11.623 1.00 0.00 C ATOM 994 O4' DC C 132 4.910 28.266 10.831 1.00 0.00 O ATOM 995 C3' DC C 132 4.677 30.186 12.278 1.00 0.00 C ATOM 996 O3' DC C 132 4.523 30.150 13.700 1.00 0.00 O ATOM 997 C2' DC C 132 6.137 30.023 11.899 1.00 0.00 C ATOM 998 C1' DC C 132 6.248 28.737 11.096 1.00 0.00 C ATOM 999 N1 DC C 132 6.994 28.954 9.827 1.00 0.00 N ATOM 1000 C2 DC C 132 8.200 28.282 9.638 1.00 0.00 C ATOM 1001 O2 DC C 132 8.622 27.522 10.507 1.00 0.00 O ATOM 1002 N3 DC C 132 8.880 28.488 8.477 1.00 0.00 N ATOM 1003 C4 DC C 132 8.396 29.307 7.534 1.00 0.00 C ATOM 1004 N4 DC C 132 9.075 29.470 6.397 1.00 0.00 N ATOM 1005 C5 DC C 132 7.158 29.995 7.724 1.00 0.00 C ATOM 1006 C6 DC C 132 6.501 29.789 8.879 1.00 0.00 C ATOM 0 H5' DC C 132 2.373 28.614 10.206 1.00 0.00 H new ATOM 0 H5'' DC C 132 1.961 29.809 11.420 1.00 0.00 H new ATOM 0 H4' DC C 132 3.534 28.363 12.400 1.00 0.00 H new ATOM 0 H3' DC C 132 4.274 31.141 11.942 1.00 0.00 H new ATOM 0 H2' DC C 132 6.480 30.875 11.312 1.00 0.00 H new ATOM 0 H2'' DC C 132 6.764 29.977 12.790 1.00 0.00 H new ATOM 0 HO3' DC C 132 4.995 30.910 14.099 1.00 0.00 H new ATOM 0 H1' DC C 132 6.806 27.993 11.664 1.00 0.00 H new ATOM 0 H41 DC C 132 8.715 30.091 5.673 1.00 0.00 H new ATOM 0 H42 DC C 132 9.954 28.973 6.252 1.00 0.00 H new ATOM 0 H5 DC C 132 6.764 30.657 6.967 1.00 0.00 H new ATOM 0 H6 DC C 132 5.564 30.297 9.055 1.00 0.00 H new TER 1019 DC C 132 ATOM 1020 N LYS A 1 -3.853 13.411 11.204 1.00 0.00 N ATOM 1021 CA LYS A 1 -4.840 13.049 12.259 1.00 0.00 C ATOM 1022 C LYS A 1 -5.444 11.678 11.930 1.00 0.00 C ATOM 1023 O LYS A 1 -6.472 11.575 11.289 1.00 0.00 O ATOM 1024 CB LYS A 1 -5.942 14.115 12.312 1.00 0.00 C ATOM 1025 CG LYS A 1 -5.361 15.429 12.853 1.00 0.00 C ATOM 1026 CD LYS A 1 -6.463 16.493 12.906 1.00 0.00 C ATOM 1027 CE LYS A 1 -5.894 17.811 13.447 1.00 0.00 C ATOM 1028 NZ LYS A 1 -4.871 18.352 12.506 1.00 0.00 N ATOM 0 H1 LYS A 1 -3.239 14.175 11.551 1.00 0.00 H new ATOM 0 H2 LYS A 1 -3.273 12.580 10.971 1.00 0.00 H new ATOM 0 H3 LYS A 1 -4.357 13.731 10.352 1.00 0.00 H new ATOM 0 HA LYS A 1 -4.348 13.001 13.231 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -6.358 14.272 11.317 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -6.759 13.777 12.950 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -4.944 15.272 13.848 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -4.544 15.768 12.215 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -6.878 16.648 11.910 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -7.279 16.151 13.542 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -6.697 18.536 13.579 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -5.447 17.648 14.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -4.702 19.356 12.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -3.983 17.821 12.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -5.213 18.256 11.529 1.00 0.00 H new ATOM 1044 N ARG A 2 -4.805 10.625 12.372 1.00 0.00 N ATOM 1045 CA ARG A 2 -5.324 9.247 12.102 1.00 0.00 C ATOM 1046 C ARG A 2 -6.127 8.758 13.307 1.00 0.00 C ATOM 1047 O ARG A 2 -6.684 7.678 13.300 1.00 0.00 O ATOM 1048 CB ARG A 2 -4.158 8.296 11.857 1.00 0.00 C ATOM 1049 CG ARG A 2 -3.359 8.770 10.635 1.00 0.00 C ATOM 1050 CD ARG A 2 -2.586 7.593 10.052 1.00 0.00 C ATOM 1051 NE ARG A 2 -1.600 8.087 9.048 1.00 0.00 N ATOM 1052 CZ ARG A 2 -0.657 7.298 8.606 1.00 0.00 C ATOM 1053 NH1 ARG A 2 -0.583 6.065 9.028 1.00 0.00 N ATOM 1054 NH2 ARG A 2 0.212 7.742 7.739 1.00 0.00 N ATOM 0 H ARG A 2 -3.940 10.659 12.912 1.00 0.00 H new ATOM 0 HA ARG A 2 -5.964 9.272 11.220 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -3.513 8.261 12.735 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -4.528 7.284 11.692 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -4.032 9.185 9.885 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -2.671 9.565 10.922 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -2.071 7.054 10.847 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -3.274 6.889 9.584 1.00 0.00 H new ATOM 0 HE ARG A 2 -1.662 9.045 8.705 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -1.262 5.716 9.704 1.00 0.00 H new ATOM 0 HH12 ARG A 2 0.154 5.451 8.682 1.00 0.00 H new ATOM 0 HH21 ARG A 2 0.155 8.705 7.407 1.00 0.00 H new ATOM 0 HH22 ARG A 2 0.948 7.126 7.394 1.00 0.00 H new ATOM 1068 N ALA A 3 -6.178 9.542 14.345 1.00 0.00 N ATOM 1069 CA ALA A 3 -6.926 9.123 15.562 1.00 0.00 C ATOM 1070 C ALA A 3 -8.434 9.207 15.317 1.00 0.00 C ATOM 1071 O ALA A 3 -8.988 10.273 15.135 1.00 0.00 O ATOM 1072 CB ALA A 3 -6.550 10.040 16.726 1.00 0.00 C ATOM 0 H ALA A 3 -5.733 10.458 14.404 1.00 0.00 H new ATOM 0 HA ALA A 3 -6.665 8.092 15.800 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -7.096 9.736 17.619 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -5.479 9.969 16.914 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -6.807 11.069 16.476 1.00 0.00 H new ATOM 1078 N GLY A 4 -9.103 8.086 15.331 1.00 0.00 N ATOM 1079 CA GLY A 4 -10.578 8.088 15.122 1.00 0.00 C ATOM 1080 C GLY A 4 -10.903 8.187 13.632 1.00 0.00 C ATOM 1081 O GLY A 4 -12.034 7.999 13.228 1.00 0.00 O ATOM 0 H GLY A 4 -8.689 7.166 15.479 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.012 7.178 15.536 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.026 8.926 15.655 1.00 0.00 H new ATOM 1085 N THR A 5 -9.942 8.499 12.807 1.00 0.00 N ATOM 1086 CA THR A 5 -10.252 8.623 11.359 1.00 0.00 C ATOM 1087 C THR A 5 -10.552 7.250 10.766 1.00 0.00 C ATOM 1088 O THR A 5 -9.690 6.400 10.661 1.00 0.00 O ATOM 1089 CB THR A 5 -9.076 9.238 10.609 1.00 0.00 C ATOM 1090 OG1 THR A 5 -8.597 10.370 11.324 1.00 0.00 O ATOM 1091 CG2 THR A 5 -9.535 9.668 9.209 1.00 0.00 C ATOM 0 H THR A 5 -8.971 8.671 13.069 1.00 0.00 H new ATOM 0 HA THR A 5 -11.124 9.269 11.255 1.00 0.00 H new ATOM 0 HB THR A 5 -8.275 8.504 10.519 1.00 0.00 H new ATOM 0 HG1 THR A 5 -7.748 10.668 10.935 1.00 0.00 H new ATOM 0 HG21 THR A 5 -8.696 10.108 8.670 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.901 8.798 8.663 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.335 10.403 9.298 1.00 0.00 H new ATOM 1099 N VAL A 6 -11.772 7.051 10.348 1.00 0.00 N ATOM 1100 CA VAL A 6 -12.180 5.763 9.712 1.00 0.00 C ATOM 1101 C VAL A 6 -12.680 6.104 8.313 1.00 0.00 C ATOM 1102 O VAL A 6 -13.326 7.115 8.118 1.00 0.00 O ATOM 1103 CB VAL A 6 -13.310 5.114 10.519 1.00 0.00 C ATOM 1104 CG1 VAL A 6 -12.808 4.741 11.916 1.00 0.00 C ATOM 1105 CG2 VAL A 6 -14.473 6.099 10.645 1.00 0.00 C ATOM 0 H VAL A 6 -12.520 7.741 10.422 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.345 5.064 9.675 1.00 0.00 H new ATOM 0 HB VAL A 6 -13.644 4.212 10.006 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -13.617 4.281 12.483 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -11.980 4.038 11.829 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -12.469 5.639 12.432 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -15.278 5.640 11.219 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -14.133 7.000 11.155 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -14.838 6.360 9.652 1.00 0.00 H new ATOM 1115 N CYS A 7 -12.397 5.300 7.330 1.00 0.00 N ATOM 1116 CA CYS A 7 -12.873 5.632 5.961 1.00 0.00 C ATOM 1117 C CYS A 7 -14.389 5.755 5.957 1.00 0.00 C ATOM 1118 O CYS A 7 -15.108 4.814 6.229 1.00 0.00 O ATOM 1119 CB CYS A 7 -12.453 4.519 5.014 1.00 0.00 C ATOM 1120 SG CYS A 7 -12.823 4.995 3.310 1.00 0.00 S ATOM 0 H CYS A 7 -11.862 4.435 7.413 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.439 6.579 5.641 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -11.387 4.319 5.122 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -12.977 3.597 5.266 1.00 0.00 H new ATOM 1125 N SER A 8 -14.876 6.916 5.641 1.00 0.00 N ATOM 1126 CA SER A 8 -16.340 7.126 5.605 1.00 0.00 C ATOM 1127 C SER A 8 -16.974 6.182 4.587 1.00 0.00 C ATOM 1128 O SER A 8 -18.064 5.684 4.789 1.00 0.00 O ATOM 1129 CB SER A 8 -16.633 8.570 5.205 1.00 0.00 C ATOM 1130 OG SER A 8 -16.128 9.446 6.206 1.00 0.00 O ATOM 0 H SER A 8 -14.316 7.735 5.404 1.00 0.00 H new ATOM 0 HA SER A 8 -16.757 6.924 6.592 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.172 8.794 4.243 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.707 8.716 5.086 1.00 0.00 H new ATOM 0 HG SER A 8 -15.158 9.539 6.100 1.00 0.00 H new ATOM 1136 N ASN A 9 -16.327 5.960 3.466 1.00 0.00 N ATOM 1137 CA ASN A 9 -16.945 5.082 2.436 1.00 0.00 C ATOM 1138 C ASN A 9 -16.756 3.593 2.759 1.00 0.00 C ATOM 1139 O ASN A 9 -17.651 2.814 2.499 1.00 0.00 O ATOM 1140 CB ASN A 9 -16.322 5.395 1.074 1.00 0.00 C ATOM 1141 CG ASN A 9 -16.752 6.797 0.636 1.00 0.00 C ATOM 1142 OD1 ASN A 9 -17.731 7.325 1.124 1.00 0.00 O ATOM 1143 ND2 ASN A 9 -16.059 7.426 -0.273 1.00 0.00 N ATOM 0 H ASN A 9 -15.413 6.344 3.227 1.00 0.00 H new ATOM 0 HA ASN A 9 -18.017 5.281 2.422 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -15.235 5.337 1.136 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -16.639 4.657 0.337 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -16.340 8.360 -0.573 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -15.237 6.984 -0.684 1.00 0.00 H new ATOM 1150 N CYS A 10 -15.614 3.152 3.294 1.00 0.00 N ATOM 1151 CA CYS A 10 -15.455 1.672 3.571 1.00 0.00 C ATOM 1152 C CYS A 10 -14.987 1.375 5.010 1.00 0.00 C ATOM 1153 O CYS A 10 -14.596 0.267 5.307 1.00 0.00 O ATOM 1154 CB CYS A 10 -14.509 1.021 2.542 1.00 0.00 C ATOM 1155 SG CYS A 10 -12.773 1.308 2.973 1.00 0.00 S ATOM 0 H CYS A 10 -14.815 3.736 3.541 1.00 0.00 H new ATOM 0 HA CYS A 10 -16.446 1.229 3.470 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -14.702 -0.051 2.494 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -14.712 1.426 1.551 1.00 0.00 H new ATOM 1160 N GLN A 11 -15.085 2.314 5.917 1.00 0.00 N ATOM 1161 CA GLN A 11 -14.729 2.041 7.356 1.00 0.00 C ATOM 1162 C GLN A 11 -13.276 1.572 7.586 1.00 0.00 C ATOM 1163 O GLN A 11 -12.869 1.408 8.719 1.00 0.00 O ATOM 1164 CB GLN A 11 -15.706 0.980 7.895 1.00 0.00 C ATOM 1165 CG GLN A 11 -15.521 0.790 9.404 1.00 0.00 C ATOM 1166 CD GLN A 11 -16.725 0.035 9.975 1.00 0.00 C ATOM 1167 OE1 GLN A 11 -17.831 0.539 9.971 1.00 0.00 O ATOM 1168 NE2 GLN A 11 -16.558 -1.163 10.468 1.00 0.00 N ATOM 0 H GLN A 11 -15.398 3.266 5.728 1.00 0.00 H new ATOM 0 HA GLN A 11 -14.811 2.989 7.888 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -16.732 1.283 7.685 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -15.542 0.033 7.381 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -14.604 0.236 9.602 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -15.420 1.759 9.894 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -15.631 -1.588 10.472 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -17.355 -1.674 10.849 1.00 0.00 H new ATOM 1177 N THR A 12 -12.470 1.356 6.582 1.00 0.00 N ATOM 1178 CA THR A 12 -11.076 0.904 6.895 1.00 0.00 C ATOM 1179 C THR A 12 -10.393 1.959 7.781 1.00 0.00 C ATOM 1180 O THR A 12 -10.697 3.132 7.682 1.00 0.00 O ATOM 1181 CB THR A 12 -10.264 0.684 5.596 1.00 0.00 C ATOM 1182 OG1 THR A 12 -9.044 0.032 5.921 1.00 0.00 O ATOM 1183 CG2 THR A 12 -9.940 2.011 4.881 1.00 0.00 C ATOM 0 H THR A 12 -12.699 1.466 5.594 1.00 0.00 H new ATOM 0 HA THR A 12 -11.119 -0.047 7.426 1.00 0.00 H new ATOM 0 HB THR A 12 -10.870 0.078 4.923 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.523 -0.113 5.104 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.369 1.806 3.975 1.00 0.00 H new ATOM 0 HG22 THR A 12 -10.868 2.519 4.618 1.00 0.00 H new ATOM 0 HG23 THR A 12 -9.353 2.647 5.543 1.00 0.00 H new ATOM 1191 N SER A 13 -9.461 1.569 8.626 1.00 0.00 N ATOM 1192 CA SER A 13 -8.743 2.576 9.488 1.00 0.00 C ATOM 1193 C SER A 13 -7.233 2.340 9.358 1.00 0.00 C ATOM 1194 O SER A 13 -6.447 2.774 10.176 1.00 0.00 O ATOM 1195 CB SER A 13 -9.187 2.440 10.950 1.00 0.00 C ATOM 1196 OG SER A 13 -8.861 1.141 11.430 1.00 0.00 O ATOM 0 H SER A 13 -9.166 0.601 8.757 1.00 0.00 H new ATOM 0 HA SER A 13 -8.986 3.586 9.159 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.697 3.198 11.561 1.00 0.00 H new ATOM 0 HB3 SER A 13 -10.261 2.610 11.032 1.00 0.00 H new ATOM 0 HG SER A 13 -9.144 1.057 12.364 1.00 0.00 H new ATOM 1202 N THR A 14 -6.832 1.651 8.317 1.00 0.00 N ATOM 1203 CA THR A 14 -5.382 1.360 8.075 1.00 0.00 C ATOM 1204 C THR A 14 -5.003 1.879 6.690 1.00 0.00 C ATOM 1205 O THR A 14 -4.466 1.168 5.879 1.00 0.00 O ATOM 1206 CB THR A 14 -5.155 -0.151 8.105 1.00 0.00 C ATOM 1207 OG1 THR A 14 -5.547 -0.707 6.857 1.00 0.00 O ATOM 1208 CG2 THR A 14 -5.985 -0.770 9.226 1.00 0.00 C ATOM 0 H THR A 14 -7.461 1.270 7.610 1.00 0.00 H new ATOM 0 HA THR A 14 -4.778 1.841 8.844 1.00 0.00 H new ATOM 0 HB THR A 14 -4.100 -0.360 8.283 1.00 0.00 H new ATOM 0 HG1 THR A 14 -5.688 -1.671 6.958 1.00 0.00 H new ATOM 0 HG21 THR A 14 -5.822 -1.848 9.247 1.00 0.00 H new ATOM 0 HG22 THR A 14 -5.685 -0.339 10.181 1.00 0.00 H new ATOM 0 HG23 THR A 14 -7.041 -0.566 9.052 1.00 0.00 H new ATOM 1216 N THR A 15 -5.352 3.086 6.394 1.00 0.00 N ATOM 1217 CA THR A 15 -5.077 3.643 5.031 1.00 0.00 C ATOM 1218 C THR A 15 -3.616 4.065 4.887 1.00 0.00 C ATOM 1219 O THR A 15 -2.968 4.436 5.845 1.00 0.00 O ATOM 1220 CB THR A 15 -5.948 4.880 4.835 1.00 0.00 C ATOM 1221 OG1 THR A 15 -5.314 5.999 5.438 1.00 0.00 O ATOM 1222 CG2 THR A 15 -7.284 4.643 5.520 1.00 0.00 C ATOM 0 H THR A 15 -5.821 3.727 7.035 1.00 0.00 H new ATOM 0 HA THR A 15 -5.294 2.873 4.291 1.00 0.00 H new ATOM 0 HB THR A 15 -6.095 5.070 3.772 1.00 0.00 H new ATOM 0 HG1 THR A 15 -5.948 6.454 6.031 1.00 0.00 H new ATOM 0 HG21 THR A 15 -7.920 5.519 5.390 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.770 3.773 5.079 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.122 4.468 6.583 1.00 0.00 H new ATOM 1230 N THR A 16 -3.105 4.049 3.682 1.00 0.00 N ATOM 1231 CA THR A 16 -1.702 4.494 3.475 1.00 0.00 C ATOM 1232 C THR A 16 -1.687 6.020 3.511 1.00 0.00 C ATOM 1233 O THR A 16 -0.808 6.633 4.084 1.00 0.00 O ATOM 1234 CB THR A 16 -1.180 4.029 2.113 1.00 0.00 C ATOM 1235 OG1 THR A 16 -1.984 4.592 1.086 1.00 0.00 O ATOM 1236 CG2 THR A 16 -1.209 2.502 2.006 1.00 0.00 C ATOM 0 H THR A 16 -3.598 3.749 2.841 1.00 0.00 H new ATOM 0 HA THR A 16 -1.067 4.070 4.253 1.00 0.00 H new ATOM 0 HB THR A 16 -0.147 4.361 2.005 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.874 4.072 0.263 1.00 0.00 H new ATOM 0 HG21 THR A 16 -0.833 2.199 1.029 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.582 2.071 2.786 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.233 2.148 2.127 1.00 0.00 H new ATOM 1244 N LEU A 17 -2.685 6.643 2.923 1.00 0.00 N ATOM 1245 CA LEU A 17 -2.763 8.138 2.949 1.00 0.00 C ATOM 1246 C LEU A 17 -4.230 8.528 3.108 1.00 0.00 C ATOM 1247 O LEU A 17 -5.096 8.014 2.428 1.00 0.00 O ATOM 1248 CB LEU A 17 -2.197 8.765 1.653 1.00 0.00 C ATOM 1249 CG LEU A 17 -1.533 10.117 1.982 1.00 0.00 C ATOM 1250 CD1 LEU A 17 -0.251 9.895 2.831 1.00 0.00 C ATOM 1251 CD2 LEU A 17 -1.200 10.859 0.669 1.00 0.00 C ATOM 0 H LEU A 17 -3.447 6.179 2.428 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.163 8.511 3.779 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.470 8.092 1.198 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.997 8.908 0.926 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.222 10.726 2.566 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.208 10.858 3.056 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.513 9.392 3.762 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.454 9.279 2.272 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -0.730 11.815 0.900 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.517 10.254 0.072 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.117 11.032 0.106 1.00 0.00 H new ATOM 1263 N TRP A 18 -4.523 9.424 4.001 1.00 0.00 N ATOM 1264 CA TRP A 18 -5.933 9.833 4.199 1.00 0.00 C ATOM 1265 C TRP A 18 -6.342 10.843 3.131 1.00 0.00 C ATOM 1266 O TRP A 18 -5.688 11.843 2.912 1.00 0.00 O ATOM 1267 CB TRP A 18 -6.062 10.464 5.589 1.00 0.00 C ATOM 1268 CG TRP A 18 -6.138 9.367 6.603 1.00 0.00 C ATOM 1269 CD1 TRP A 18 -5.177 9.059 7.498 1.00 0.00 C ATOM 1270 CD2 TRP A 18 -7.212 8.407 6.805 1.00 0.00 C ATOM 1271 NE1 TRP A 18 -5.605 7.978 8.251 1.00 0.00 N ATOM 1272 CE2 TRP A 18 -6.852 7.546 7.863 1.00 0.00 C ATOM 1273 CE3 TRP A 18 -8.455 8.211 6.182 1.00 0.00 C ATOM 1274 CZ2 TRP A 18 -7.694 6.522 8.292 1.00 0.00 C ATOM 1275 CZ3 TRP A 18 -9.304 7.178 6.608 1.00 0.00 C ATOM 1276 CH2 TRP A 18 -8.926 6.336 7.662 1.00 0.00 C ATOM 0 H TRP A 18 -3.845 9.891 4.603 1.00 0.00 H new ATOM 0 HA TRP A 18 -6.586 8.964 4.119 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -5.208 11.110 5.793 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -6.953 11.089 5.640 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.232 9.570 7.609 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -5.061 7.554 9.002 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -8.759 8.858 5.372 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -7.396 5.877 9.106 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -10.256 7.031 6.120 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -9.586 5.545 7.986 1.00 0.00 H new ATOM 1287 N ARG A 19 -7.436 10.577 2.473 1.00 0.00 N ATOM 1288 CA ARG A 19 -7.946 11.488 1.409 1.00 0.00 C ATOM 1289 C ARG A 19 -9.309 12.040 1.822 1.00 0.00 C ATOM 1290 O ARG A 19 -10.181 11.300 2.209 1.00 0.00 O ATOM 1291 CB ARG A 19 -8.124 10.675 0.110 1.00 0.00 C ATOM 1292 CG ARG A 19 -6.773 10.512 -0.623 1.00 0.00 C ATOM 1293 CD ARG A 19 -6.378 11.824 -1.316 1.00 0.00 C ATOM 1294 NE ARG A 19 -5.435 11.536 -2.451 1.00 0.00 N ATOM 1295 CZ ARG A 19 -4.317 10.873 -2.278 1.00 0.00 C ATOM 1296 NH1 ARG A 19 -3.887 10.581 -1.080 1.00 0.00 N ATOM 1297 NH2 ARG A 19 -3.596 10.547 -3.314 1.00 0.00 N ATOM 0 H ARG A 19 -8.010 9.749 2.631 1.00 0.00 H new ATOM 0 HA ARG A 19 -7.243 12.308 1.259 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -8.537 9.694 0.343 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -8.839 11.175 -0.543 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -5.999 10.221 0.088 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -6.846 9.712 -1.360 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -7.268 12.331 -1.690 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -5.905 12.496 -0.600 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.673 11.867 -3.386 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.423 10.869 -0.261 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -3.015 10.065 -0.963 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.903 10.808 -4.251 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.725 10.031 -3.187 1.00 0.00 H new ATOM 1311 N ARG A 20 -9.521 13.321 1.741 1.00 0.00 N ATOM 1312 CA ARG A 20 -10.861 13.858 2.109 1.00 0.00 C ATOM 1313 C ARG A 20 -11.763 13.706 0.876 1.00 0.00 C ATOM 1314 O ARG A 20 -11.303 13.808 -0.244 1.00 0.00 O ATOM 1315 CB ARG A 20 -10.732 15.331 2.508 1.00 0.00 C ATOM 1316 CG ARG A 20 -9.930 15.449 3.821 1.00 0.00 C ATOM 1317 CD ARG A 20 -10.735 14.874 5.001 1.00 0.00 C ATOM 1318 NE ARG A 20 -10.347 15.569 6.273 1.00 0.00 N ATOM 1319 CZ ARG A 20 -9.099 15.669 6.654 1.00 0.00 C ATOM 1320 NH1 ARG A 20 -8.154 15.028 6.022 1.00 0.00 N ATOM 1321 NH2 ARG A 20 -8.805 16.376 7.712 1.00 0.00 N ATOM 0 H ARG A 20 -8.835 14.014 1.440 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.286 13.319 2.956 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.234 15.890 1.716 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -11.721 15.771 2.635 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.984 14.916 3.725 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -9.689 16.494 4.013 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -11.802 14.999 4.819 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -10.550 13.803 5.091 1.00 0.00 H new ATOM 0 HE ARG A 20 -11.077 15.975 6.858 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -8.384 14.440 5.221 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -7.185 15.115 6.329 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -9.545 16.845 8.234 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -7.835 16.459 8.016 1.00 0.00 H new ATOM 1335 N SER A 21 -13.037 13.452 1.059 1.00 0.00 N ATOM 1336 CA SER A 21 -13.948 13.284 -0.126 1.00 0.00 C ATOM 1337 C SER A 21 -14.584 14.633 -0.492 1.00 0.00 C ATOM 1338 O SER A 21 -14.634 15.531 0.318 1.00 0.00 O ATOM 1339 CB SER A 21 -15.046 12.255 0.203 1.00 0.00 C ATOM 1340 OG SER A 21 -16.310 12.732 -0.250 1.00 0.00 O ATOM 0 H SER A 21 -13.486 13.354 1.969 1.00 0.00 H new ATOM 0 HA SER A 21 -13.367 12.925 -0.976 1.00 0.00 H new ATOM 0 HB2 SER A 21 -14.816 11.301 -0.272 1.00 0.00 H new ATOM 0 HB3 SER A 21 -15.079 12.077 1.278 1.00 0.00 H new ATOM 0 HG SER A 21 -16.880 12.931 0.522 1.00 0.00 H new ATOM 1346 N PRO A 22 -15.074 14.776 -1.706 1.00 0.00 N ATOM 1347 CA PRO A 22 -15.727 16.046 -2.134 1.00 0.00 C ATOM 1348 C PRO A 22 -16.788 16.541 -1.130 1.00 0.00 C ATOM 1349 O PRO A 22 -17.104 17.713 -1.082 1.00 0.00 O ATOM 1350 CB PRO A 22 -16.382 15.646 -3.477 1.00 0.00 C ATOM 1351 CG PRO A 22 -15.931 14.216 -3.842 1.00 0.00 C ATOM 1352 CD PRO A 22 -15.001 13.697 -2.736 1.00 0.00 C ATOM 0 HA PRO A 22 -15.021 16.873 -2.207 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -17.468 15.690 -3.396 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -16.092 16.345 -4.261 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -16.796 13.562 -3.946 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -15.414 14.216 -4.802 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -15.338 12.738 -2.342 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -13.983 13.553 -3.099 1.00 0.00 H new ATOM 1360 N MET A 23 -17.342 15.657 -0.337 1.00 0.00 N ATOM 1361 CA MET A 23 -18.385 16.075 0.653 1.00 0.00 C ATOM 1362 C MET A 23 -17.722 16.432 1.988 1.00 0.00 C ATOM 1363 O MET A 23 -18.354 16.940 2.892 1.00 0.00 O ATOM 1364 CB MET A 23 -19.366 14.918 0.861 1.00 0.00 C ATOM 1365 CG MET A 23 -20.186 14.713 -0.414 1.00 0.00 C ATOM 1366 SD MET A 23 -21.261 13.266 -0.214 1.00 0.00 S ATOM 1367 CE MET A 23 -22.196 13.426 -1.760 1.00 0.00 C ATOM 0 H MET A 23 -17.117 14.662 -0.332 1.00 0.00 H new ATOM 0 HA MET A 23 -18.917 16.949 0.276 1.00 0.00 H new ATOM 0 HB2 MET A 23 -18.823 14.006 1.108 1.00 0.00 H new ATOM 0 HB3 MET A 23 -20.027 15.133 1.701 1.00 0.00 H new ATOM 0 HG2 MET A 23 -20.786 15.599 -0.620 1.00 0.00 H new ATOM 0 HG3 MET A 23 -19.523 14.572 -1.267 1.00 0.00 H new ATOM 0 HE1 MET A 23 -22.923 12.617 -1.831 1.00 0.00 H new ATOM 0 HE2 MET A 23 -22.716 14.384 -1.773 1.00 0.00 H new ATOM 0 HE3 MET A 23 -21.511 13.373 -2.606 1.00 0.00 H new ATOM 1377 N GLY A 24 -16.455 16.153 2.120 1.00 0.00 N ATOM 1378 CA GLY A 24 -15.739 16.453 3.395 1.00 0.00 C ATOM 1379 C GLY A 24 -15.813 15.230 4.310 1.00 0.00 C ATOM 1380 O GLY A 24 -15.718 15.334 5.518 1.00 0.00 O ATOM 0 H GLY A 24 -15.879 15.727 1.394 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.699 16.708 3.191 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.189 17.317 3.885 1.00 0.00 H new ATOM 1384 N ASP A 25 -15.980 14.066 3.737 1.00 0.00 N ATOM 1385 CA ASP A 25 -16.060 12.812 4.540 1.00 0.00 C ATOM 1386 C ASP A 25 -14.707 12.067 4.468 1.00 0.00 C ATOM 1387 O ASP A 25 -14.301 11.661 3.400 1.00 0.00 O ATOM 1388 CB ASP A 25 -17.132 11.917 3.914 1.00 0.00 C ATOM 1389 CG ASP A 25 -18.485 12.627 3.960 1.00 0.00 C ATOM 1390 OD1 ASP A 25 -18.576 13.721 3.427 1.00 0.00 O ATOM 1391 OD2 ASP A 25 -19.408 12.065 4.526 1.00 0.00 O ATOM 0 H ASP A 25 -16.066 13.931 2.730 1.00 0.00 H new ATOM 0 HA ASP A 25 -16.298 13.048 5.577 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -16.868 11.683 2.883 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -17.189 10.970 4.451 1.00 0.00 H new ATOM 1396 N PRO A 26 -13.996 11.874 5.561 1.00 0.00 N ATOM 1397 CA PRO A 26 -12.686 11.153 5.490 1.00 0.00 C ATOM 1398 C PRO A 26 -12.774 9.812 4.728 1.00 0.00 C ATOM 1399 O PRO A 26 -13.571 8.956 5.062 1.00 0.00 O ATOM 1400 CB PRO A 26 -12.361 10.937 6.980 1.00 0.00 C ATOM 1401 CG PRO A 26 -13.224 11.914 7.796 1.00 0.00 C ATOM 1402 CD PRO A 26 -14.412 12.339 6.921 1.00 0.00 C ATOM 0 HA PRO A 26 -11.926 11.708 4.940 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -12.570 9.908 7.271 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -11.302 11.113 7.169 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -13.576 11.439 8.712 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -12.638 12.784 8.093 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -15.342 11.870 7.243 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -14.572 13.417 6.950 1.00 0.00 H new ATOM 1410 N VAL A 27 -11.933 9.618 3.728 1.00 0.00 N ATOM 1411 CA VAL A 27 -11.937 8.316 2.961 1.00 0.00 C ATOM 1412 C VAL A 27 -10.507 7.781 2.843 1.00 0.00 C ATOM 1413 O VAL A 27 -9.548 8.514 2.974 1.00 0.00 O ATOM 1414 CB VAL A 27 -12.542 8.486 1.557 1.00 0.00 C ATOM 1415 CG1 VAL A 27 -14.064 8.570 1.666 1.00 0.00 C ATOM 1416 CG2 VAL A 27 -11.995 9.751 0.885 1.00 0.00 C ATOM 0 H VAL A 27 -11.246 10.302 3.410 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.556 7.607 3.510 1.00 0.00 H new ATOM 0 HB VAL A 27 -12.267 7.626 0.947 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.494 8.691 0.672 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.447 7.656 2.119 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -14.338 9.424 2.286 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.434 9.855 -0.107 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.250 10.623 1.488 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -10.911 9.676 0.796 1.00 0.00 H new ATOM 1426 N CYS A 28 -10.355 6.499 2.590 1.00 0.00 N ATOM 1427 CA CYS A 28 -8.987 5.920 2.460 1.00 0.00 C ATOM 1428 C CYS A 28 -8.458 6.169 1.044 1.00 0.00 C ATOM 1429 O CYS A 28 -9.214 6.355 0.111 1.00 0.00 O ATOM 1430 CB CYS A 28 -9.007 4.416 2.821 1.00 0.00 C ATOM 1431 SG CYS A 28 -9.851 3.406 1.565 1.00 0.00 S ATOM 0 H CYS A 28 -11.120 5.835 2.469 1.00 0.00 H new ATOM 0 HA CYS A 28 -8.309 6.409 3.160 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -7.983 4.061 2.939 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -9.504 4.283 3.782 1.00 0.00 H new ATOM 1436 N ASN A 29 -7.162 6.229 0.890 1.00 0.00 N ATOM 1437 CA ASN A 29 -6.575 6.531 -0.450 1.00 0.00 C ATOM 1438 C ASN A 29 -7.177 5.637 -1.534 1.00 0.00 C ATOM 1439 O ASN A 29 -7.279 6.033 -2.678 1.00 0.00 O ATOM 1440 CB ASN A 29 -5.057 6.337 -0.401 1.00 0.00 C ATOM 1441 CG ASN A 29 -4.459 6.664 -1.770 1.00 0.00 C ATOM 1442 OD1 ASN A 29 -4.105 7.893 -2.037 1.00 0.00 O flip ATOM 1443 ND2 ASN A 29 -4.323 5.796 -2.611 1.00 0.00 N flip ATOM 0 H ASN A 29 -6.482 6.082 1.636 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.807 7.566 -0.699 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.621 6.982 0.362 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -4.819 5.310 -0.124 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -4.599 4.836 -2.403 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -3.933 6.028 -3.524 1.00 0.00 H new ATOM 1450 N ALA A 30 -7.581 4.449 -1.206 1.00 0.00 N ATOM 1451 CA ALA A 30 -8.175 3.571 -2.252 1.00 0.00 C ATOM 1452 C ALA A 30 -9.576 4.077 -2.640 1.00 0.00 C ATOM 1453 O ALA A 30 -9.861 4.293 -3.802 1.00 0.00 O ATOM 1454 CB ALA A 30 -8.257 2.149 -1.721 1.00 0.00 C ATOM 0 H ALA A 30 -7.529 4.047 -0.270 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.546 3.590 -3.142 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -8.691 1.501 -2.482 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -7.257 1.796 -1.471 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.882 2.129 -0.828 1.00 0.00 H new ATOM 1460 N CYS A 31 -10.456 4.265 -1.684 1.00 0.00 N ATOM 1461 CA CYS A 31 -11.835 4.751 -2.026 1.00 0.00 C ATOM 1462 C CYS A 31 -11.742 6.086 -2.749 1.00 0.00 C ATOM 1463 O CYS A 31 -12.439 6.336 -3.694 1.00 0.00 O ATOM 1464 CB CYS A 31 -12.667 4.980 -0.758 1.00 0.00 C ATOM 1465 SG CYS A 31 -13.187 3.412 -0.049 1.00 0.00 S ATOM 0 H CYS A 31 -10.283 4.105 -0.691 1.00 0.00 H new ATOM 0 HA CYS A 31 -12.306 3.992 -2.651 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -12.081 5.538 -0.028 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -13.542 5.586 -0.995 1.00 0.00 H new ATOM 1470 N GLY A 32 -10.904 6.959 -2.297 1.00 0.00 N ATOM 1471 CA GLY A 32 -10.817 8.279 -2.965 1.00 0.00 C ATOM 1472 C GLY A 32 -10.546 8.086 -4.454 1.00 0.00 C ATOM 1473 O GLY A 32 -11.195 8.676 -5.295 1.00 0.00 O ATOM 0 H GLY A 32 -10.279 6.822 -1.502 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.746 8.831 -2.823 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.022 8.873 -2.515 1.00 0.00 H new ATOM 1477 N LEU A 33 -9.586 7.274 -4.790 1.00 0.00 N ATOM 1478 CA LEU A 33 -9.267 7.053 -6.227 1.00 0.00 C ATOM 1479 C LEU A 33 -10.381 6.263 -6.919 1.00 0.00 C ATOM 1480 O LEU A 33 -10.894 6.671 -7.941 1.00 0.00 O ATOM 1481 CB LEU A 33 -7.956 6.279 -6.324 1.00 0.00 C ATOM 1482 CG LEU A 33 -6.834 7.099 -5.669 1.00 0.00 C ATOM 1483 CD1 LEU A 33 -5.573 6.233 -5.536 1.00 0.00 C ATOM 1484 CD2 LEU A 33 -6.528 8.352 -6.520 1.00 0.00 C ATOM 0 H LEU A 33 -9.007 6.753 -4.131 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.176 8.019 -6.724 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -8.053 5.313 -5.829 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.714 6.079 -7.368 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.156 7.418 -4.678 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.778 6.816 -5.071 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.793 5.362 -4.918 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.251 5.904 -6.524 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.731 8.927 -6.048 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.212 8.046 -7.517 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -7.424 8.968 -6.596 1.00 0.00 H new ATOM 1496 N TYR A 34 -10.765 5.140 -6.383 1.00 0.00 N ATOM 1497 CA TYR A 34 -11.844 4.351 -7.039 1.00 0.00 C ATOM 1498 C TYR A 34 -13.118 5.186 -7.113 1.00 0.00 C ATOM 1499 O TYR A 34 -13.802 5.205 -8.116 1.00 0.00 O ATOM 1500 CB TYR A 34 -12.124 3.073 -6.243 1.00 0.00 C ATOM 1501 CG TYR A 34 -13.317 2.364 -6.842 1.00 0.00 C ATOM 1502 CD1 TYR A 34 -14.606 2.755 -6.476 1.00 0.00 C ATOM 1503 CD2 TYR A 34 -13.134 1.328 -7.765 1.00 0.00 C ATOM 1504 CE1 TYR A 34 -15.716 2.114 -7.030 1.00 0.00 C ATOM 1505 CE2 TYR A 34 -14.247 0.683 -8.319 1.00 0.00 C ATOM 1506 CZ TYR A 34 -15.538 1.077 -7.952 1.00 0.00 C ATOM 1507 OH TYR A 34 -16.636 0.444 -8.501 1.00 0.00 O ATOM 0 H TYR A 34 -10.383 4.737 -5.527 1.00 0.00 H new ATOM 0 HA TYR A 34 -11.520 4.083 -8.045 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -11.251 2.420 -6.262 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -12.318 3.316 -5.198 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -14.745 3.554 -5.763 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -12.137 1.027 -8.049 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -16.713 2.419 -6.747 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -14.108 -0.119 -9.029 1.00 0.00 H new ATOM 0 HH TYR A 34 -16.336 -0.251 -9.123 1.00 0.00 H new ATOM 1517 N TYR A 35 -13.455 5.859 -6.054 1.00 0.00 N ATOM 1518 CA TYR A 35 -14.696 6.672 -6.061 1.00 0.00 C ATOM 1519 C TYR A 35 -14.599 7.765 -7.128 1.00 0.00 C ATOM 1520 O TYR A 35 -15.507 7.990 -7.879 1.00 0.00 O ATOM 1521 CB TYR A 35 -14.916 7.322 -4.687 1.00 0.00 C ATOM 1522 CG TYR A 35 -16.362 7.725 -4.578 1.00 0.00 C ATOM 1523 CD1 TYR A 35 -16.774 8.968 -5.058 1.00 0.00 C ATOM 1524 CD2 TYR A 35 -17.292 6.841 -4.021 1.00 0.00 C ATOM 1525 CE1 TYR A 35 -18.125 9.335 -4.980 1.00 0.00 C ATOM 1526 CE2 TYR A 35 -18.640 7.201 -3.939 1.00 0.00 C ATOM 1527 CZ TYR A 35 -19.058 8.450 -4.419 1.00 0.00 C ATOM 1528 OH TYR A 35 -20.389 8.808 -4.342 1.00 0.00 O ATOM 0 H TYR A 35 -12.924 5.881 -5.183 1.00 0.00 H new ATOM 0 HA TYR A 35 -15.537 6.017 -6.286 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -14.656 6.624 -3.891 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -14.270 8.192 -4.571 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -16.053 9.647 -5.489 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -16.968 5.879 -3.654 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -18.447 10.297 -5.351 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -19.357 6.519 -3.507 1.00 0.00 H new ATOM 0 HH TYR A 35 -20.900 8.081 -3.928 1.00 0.00 H new ATOM 1538 N LYS A 36 -13.515 8.461 -7.200 1.00 0.00 N ATOM 1539 CA LYS A 36 -13.418 9.538 -8.222 1.00 0.00 C ATOM 1540 C LYS A 36 -13.579 8.953 -9.627 1.00 0.00 C ATOM 1541 O LYS A 36 -14.240 9.525 -10.470 1.00 0.00 O ATOM 1542 CB LYS A 36 -12.045 10.203 -8.098 1.00 0.00 C ATOM 1543 CG LYS A 36 -11.889 11.300 -9.155 1.00 0.00 C ATOM 1544 CD LYS A 36 -10.549 12.021 -8.954 1.00 0.00 C ATOM 1545 CE LYS A 36 -9.393 11.169 -9.499 1.00 0.00 C ATOM 1546 NZ LYS A 36 -8.162 12.004 -9.587 1.00 0.00 N ATOM 0 H LYS A 36 -12.695 8.339 -6.606 1.00 0.00 H new ATOM 0 HA LYS A 36 -14.209 10.269 -8.058 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -11.928 10.629 -7.102 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.260 9.457 -8.219 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.934 10.866 -10.154 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -12.711 12.011 -9.080 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -10.568 12.985 -9.461 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.393 12.222 -7.894 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -9.219 10.313 -8.847 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -9.649 10.775 -10.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -7.378 11.429 -9.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -8.332 12.807 -10.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -7.915 12.360 -8.641 1.00 0.00 H new ATOM 1560 N LEU A 37 -12.976 7.834 -9.897 1.00 0.00 N ATOM 1561 CA LEU A 37 -13.094 7.241 -11.260 1.00 0.00 C ATOM 1562 C LEU A 37 -14.504 6.680 -11.511 1.00 0.00 C ATOM 1563 O LEU A 37 -15.048 6.848 -12.585 1.00 0.00 O ATOM 1564 CB LEU A 37 -12.047 6.119 -11.404 1.00 0.00 C ATOM 1565 CG LEU A 37 -10.724 6.690 -11.935 1.00 0.00 C ATOM 1566 CD1 LEU A 37 -10.192 7.770 -10.985 1.00 0.00 C ATOM 1567 CD2 LEU A 37 -9.700 5.559 -12.043 1.00 0.00 C ATOM 0 H LEU A 37 -12.407 7.303 -9.238 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.916 8.022 -11.999 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.883 5.639 -10.439 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.418 5.351 -12.083 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.894 7.136 -12.915 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.254 8.166 -11.373 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.921 8.576 -10.906 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -10.022 7.336 -10.000 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.757 5.956 -12.420 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.541 5.117 -11.059 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -10.071 4.796 -12.727 1.00 0.00 H new ATOM 1579 N HIS A 38 -15.085 5.986 -10.558 1.00 0.00 N ATOM 1580 CA HIS A 38 -16.444 5.378 -10.783 1.00 0.00 C ATOM 1581 C HIS A 38 -17.530 6.049 -9.923 1.00 0.00 C ATOM 1582 O HIS A 38 -18.689 5.720 -10.039 1.00 0.00 O ATOM 1583 CB HIS A 38 -16.375 3.888 -10.437 1.00 0.00 C ATOM 1584 CG HIS A 38 -15.392 3.202 -11.346 1.00 0.00 C ATOM 1585 ND1 HIS A 38 -15.790 2.537 -12.495 1.00 0.00 N ATOM 1586 CD2 HIS A 38 -14.026 3.065 -11.288 1.00 0.00 C ATOM 1587 CE1 HIS A 38 -14.686 2.033 -13.076 1.00 0.00 C ATOM 1588 NE2 HIS A 38 -13.583 2.324 -12.382 1.00 0.00 N ATOM 0 H HIS A 38 -14.681 5.813 -9.637 1.00 0.00 H new ATOM 0 HA HIS A 38 -16.715 5.527 -11.828 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -16.074 3.760 -9.397 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -17.360 3.434 -10.542 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -16.746 2.446 -12.838 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -13.392 3.470 -10.513 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -14.691 1.462 -13.993 1.00 0.00 H new ATOM 1596 N GLN A 39 -17.189 6.984 -9.076 1.00 0.00 N ATOM 1597 CA GLN A 39 -18.204 7.683 -8.212 1.00 0.00 C ATOM 1598 C GLN A 39 -19.306 6.747 -7.707 1.00 0.00 C ATOM 1599 O GLN A 39 -20.470 7.093 -7.680 1.00 0.00 O ATOM 1600 CB GLN A 39 -18.778 8.908 -8.935 1.00 0.00 C ATOM 1601 CG GLN A 39 -19.594 8.493 -10.168 1.00 0.00 C ATOM 1602 CD GLN A 39 -20.144 9.748 -10.850 1.00 0.00 C ATOM 1603 OE1 GLN A 39 -19.440 10.726 -11.000 1.00 0.00 O ATOM 1604 NE2 GLN A 39 -21.380 9.763 -11.270 1.00 0.00 N ATOM 0 H GLN A 39 -16.230 7.304 -8.939 1.00 0.00 H new ATOM 0 HA GLN A 39 -17.681 8.028 -7.320 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -19.410 9.474 -8.251 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -17.966 9.568 -9.239 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -18.968 7.932 -10.862 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -20.412 7.836 -9.874 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -21.971 8.942 -11.144 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -21.754 10.596 -11.724 1.00 0.00 H new ATOM 1613 N VAL A 40 -18.933 5.584 -7.244 1.00 0.00 N ATOM 1614 CA VAL A 40 -19.919 4.633 -6.667 1.00 0.00 C ATOM 1615 C VAL A 40 -19.252 3.912 -5.497 1.00 0.00 C ATOM 1616 O VAL A 40 -18.041 3.832 -5.417 1.00 0.00 O ATOM 1617 CB VAL A 40 -20.361 3.609 -7.710 1.00 0.00 C ATOM 1618 CG1 VAL A 40 -21.243 4.290 -8.760 1.00 0.00 C ATOM 1619 CG2 VAL A 40 -19.136 2.963 -8.379 1.00 0.00 C ATOM 0 H VAL A 40 -17.969 5.250 -7.243 1.00 0.00 H new ATOM 0 HA VAL A 40 -20.801 5.180 -6.335 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.936 2.825 -7.217 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.557 3.557 -9.503 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -22.122 4.715 -8.276 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.679 5.084 -9.250 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -19.467 2.235 -9.120 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -18.540 3.733 -8.868 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -18.531 2.462 -7.624 1.00 0.00 H new ATOM 1629 N ASN A 41 -20.020 3.392 -4.583 1.00 0.00 N ATOM 1630 CA ASN A 41 -19.411 2.684 -3.416 1.00 0.00 C ATOM 1631 C ASN A 41 -19.104 1.233 -3.802 1.00 0.00 C ATOM 1632 O ASN A 41 -19.953 0.521 -4.299 1.00 0.00 O ATOM 1633 CB ASN A 41 -20.388 2.706 -2.239 1.00 0.00 C ATOM 1634 CG ASN A 41 -21.738 2.146 -2.687 1.00 0.00 C ATOM 1635 OD1 ASN A 41 -22.071 2.194 -3.855 1.00 0.00 O ATOM 1636 ND2 ASN A 41 -22.536 1.614 -1.803 1.00 0.00 N ATOM 0 H ASN A 41 -21.039 3.424 -4.590 1.00 0.00 H new ATOM 0 HA ASN A 41 -18.487 3.185 -3.128 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -19.993 2.114 -1.413 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -20.509 3.725 -1.872 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.439 1.238 -2.092 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -22.257 1.574 -0.823 1.00 0.00 H new ATOM 1643 N ARG A 42 -17.884 0.793 -3.594 1.00 0.00 N ATOM 1644 CA ARG A 42 -17.501 -0.607 -3.966 1.00 0.00 C ATOM 1645 C ARG A 42 -17.497 -1.515 -2.709 1.00 0.00 C ATOM 1646 O ARG A 42 -16.939 -1.139 -1.697 1.00 0.00 O ATOM 1647 CB ARG A 42 -16.089 -0.579 -4.553 1.00 0.00 C ATOM 1648 CG ARG A 42 -15.756 -1.941 -5.160 1.00 0.00 C ATOM 1649 CD ARG A 42 -14.334 -1.910 -5.722 1.00 0.00 C ATOM 1650 NE ARG A 42 -13.978 -3.256 -6.247 1.00 0.00 N ATOM 1651 CZ ARG A 42 -12.958 -3.390 -7.047 1.00 0.00 C ATOM 1652 NH1 ARG A 42 -12.254 -2.343 -7.386 1.00 0.00 N ATOM 1653 NH2 ARG A 42 -12.642 -4.568 -7.511 1.00 0.00 N ATOM 0 H ARG A 42 -17.134 1.347 -3.180 1.00 0.00 H new ATOM 0 HA ARG A 42 -18.217 -0.999 -4.688 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -16.017 0.197 -5.315 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -15.367 -0.330 -3.776 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -15.843 -2.720 -4.403 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -16.466 -2.183 -5.950 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -14.262 -1.167 -6.517 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.630 -1.614 -4.944 1.00 0.00 H new ATOM 0 HE ARG A 42 -14.531 -4.071 -5.982 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -12.503 -1.422 -7.025 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -11.455 -2.446 -8.012 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -13.193 -5.385 -7.248 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -11.844 -4.672 -8.137 1.00 0.00 H new ATOM 1667 N PRO A 43 -18.087 -2.705 -2.749 1.00 0.00 N ATOM 1668 CA PRO A 43 -18.077 -3.602 -1.551 1.00 0.00 C ATOM 1669 C PRO A 43 -16.662 -3.801 -0.969 1.00 0.00 C ATOM 1670 O PRO A 43 -15.672 -3.722 -1.670 1.00 0.00 O ATOM 1671 CB PRO A 43 -18.650 -4.922 -2.106 1.00 0.00 C ATOM 1672 CG PRO A 43 -19.210 -4.657 -3.517 1.00 0.00 C ATOM 1673 CD PRO A 43 -18.793 -3.240 -3.954 1.00 0.00 C ATOM 0 HA PRO A 43 -18.650 -3.192 -0.719 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -17.873 -5.686 -2.144 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -19.436 -5.299 -1.451 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -18.829 -5.397 -4.220 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -20.296 -4.748 -3.516 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -18.140 -3.263 -4.826 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -19.656 -2.630 -4.219 1.00 0.00 H new ATOM 1681 N LEU A 44 -16.573 -4.059 0.310 1.00 0.00 N ATOM 1682 CA LEU A 44 -15.239 -4.265 0.958 1.00 0.00 C ATOM 1683 C LEU A 44 -14.648 -5.611 0.527 1.00 0.00 C ATOM 1684 O LEU A 44 -13.735 -6.119 1.147 1.00 0.00 O ATOM 1685 CB LEU A 44 -15.430 -4.277 2.487 1.00 0.00 C ATOM 1686 CG LEU A 44 -15.325 -2.854 3.044 1.00 0.00 C ATOM 1687 CD1 LEU A 44 -16.486 -1.994 2.522 1.00 0.00 C ATOM 1688 CD2 LEU A 44 -15.370 -2.920 4.574 1.00 0.00 C ATOM 0 H LEU A 44 -17.372 -4.137 0.939 1.00 0.00 H new ATOM 0 HA LEU A 44 -14.565 -3.462 0.660 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -16.402 -4.702 2.736 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -14.676 -4.913 2.950 1.00 0.00 H new ATOM 0 HG LEU A 44 -14.388 -2.401 2.720 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -16.401 -0.985 2.925 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -16.449 -1.955 1.433 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -17.433 -2.432 2.837 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -15.296 -1.913 4.984 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -16.309 -3.373 4.891 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -14.537 -3.521 4.937 1.00 0.00 H new ATOM 1700 N THR A 45 -15.165 -6.203 -0.506 1.00 0.00 N ATOM 1701 CA THR A 45 -14.634 -7.522 -0.940 1.00 0.00 C ATOM 1702 C THR A 45 -13.107 -7.472 -1.059 1.00 0.00 C ATOM 1703 O THR A 45 -12.449 -8.489 -0.953 1.00 0.00 O ATOM 1704 CB THR A 45 -15.243 -7.904 -2.299 1.00 0.00 C ATOM 1705 OG1 THR A 45 -15.347 -6.743 -3.111 1.00 0.00 O ATOM 1706 CG2 THR A 45 -16.632 -8.516 -2.098 1.00 0.00 C ATOM 0 H THR A 45 -15.931 -5.833 -1.069 1.00 0.00 H new ATOM 0 HA THR A 45 -14.905 -8.270 -0.194 1.00 0.00 H new ATOM 0 HB THR A 45 -14.600 -8.637 -2.787 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.734 -6.984 -3.979 1.00 0.00 H new ATOM 0 HG21 THR A 45 -17.055 -8.783 -3.066 1.00 0.00 H new ATOM 0 HG22 THR A 45 -16.550 -9.409 -1.479 1.00 0.00 H new ATOM 0 HG23 THR A 45 -17.281 -7.792 -1.606 1.00 0.00 H new ATOM 1714 N MET A 46 -12.532 -6.315 -1.301 1.00 0.00 N ATOM 1715 CA MET A 46 -11.037 -6.234 -1.452 1.00 0.00 C ATOM 1716 C MET A 46 -10.401 -5.555 -0.237 1.00 0.00 C ATOM 1717 O MET A 46 -9.195 -5.449 -0.142 1.00 0.00 O ATOM 1718 CB MET A 46 -10.702 -5.452 -2.730 1.00 0.00 C ATOM 1719 CG MET A 46 -11.155 -3.989 -2.608 1.00 0.00 C ATOM 1720 SD MET A 46 -11.505 -3.324 -4.263 1.00 0.00 S ATOM 1721 CE MET A 46 -9.800 -3.174 -4.864 1.00 0.00 C ATOM 0 H MET A 46 -13.027 -5.429 -1.400 1.00 0.00 H new ATOM 0 HA MET A 46 -10.633 -7.244 -1.522 1.00 0.00 H new ATOM 0 HB2 MET A 46 -9.628 -5.491 -2.915 1.00 0.00 H new ATOM 0 HB3 MET A 46 -11.190 -5.918 -3.586 1.00 0.00 H new ATOM 0 HG2 MET A 46 -12.045 -3.924 -1.982 1.00 0.00 H new ATOM 0 HG3 MET A 46 -10.380 -3.396 -2.123 1.00 0.00 H new ATOM 0 HE1 MET A 46 -9.809 -2.879 -5.913 1.00 0.00 H new ATOM 0 HE2 MET A 46 -9.273 -2.420 -4.279 1.00 0.00 H new ATOM 0 HE3 MET A 46 -9.292 -4.133 -4.761 1.00 0.00 H new ATOM 1731 N ARG A 47 -11.191 -5.102 0.697 1.00 0.00 N ATOM 1732 CA ARG A 47 -10.608 -4.441 1.905 1.00 0.00 C ATOM 1733 C ARG A 47 -10.168 -5.511 2.918 1.00 0.00 C ATOM 1734 O ARG A 47 -10.762 -6.565 3.018 1.00 0.00 O ATOM 1735 CB ARG A 47 -11.664 -3.504 2.537 1.00 0.00 C ATOM 1736 CG ARG A 47 -11.021 -2.173 2.965 1.00 0.00 C ATOM 1737 CD ARG A 47 -10.793 -1.254 1.747 1.00 0.00 C ATOM 1738 NE ARG A 47 -9.471 -1.556 1.129 1.00 0.00 N ATOM 1739 CZ ARG A 47 -9.185 -1.100 -0.061 1.00 0.00 C ATOM 1740 NH1 ARG A 47 -10.047 -0.355 -0.699 1.00 0.00 N ATOM 1741 NH2 ARG A 47 -8.034 -1.380 -0.608 1.00 0.00 N ATOM 0 H ARG A 47 -12.209 -5.159 0.679 1.00 0.00 H new ATOM 0 HA ARG A 47 -9.737 -3.852 1.618 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -12.464 -3.314 1.821 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -12.118 -3.989 3.401 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -11.663 -1.671 3.689 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -10.071 -2.367 3.462 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -11.588 -1.399 1.016 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -10.831 -0.209 2.056 1.00 0.00 H new ATOM 0 HE ARG A 47 -8.789 -2.120 1.636 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -10.943 -0.129 -0.268 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -9.824 0.001 -1.628 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -7.357 -1.955 -0.106 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -7.811 -1.024 -1.537 1.00 0.00 H new ATOM 1755 N LYS A 48 -9.132 -5.242 3.670 1.00 0.00 N ATOM 1756 CA LYS A 48 -8.650 -6.230 4.680 1.00 0.00 C ATOM 1757 C LYS A 48 -8.024 -5.486 5.867 1.00 0.00 C ATOM 1758 O LYS A 48 -7.887 -4.280 5.855 1.00 0.00 O ATOM 1759 CB LYS A 48 -7.647 -7.186 4.036 1.00 0.00 C ATOM 1760 CG LYS A 48 -6.579 -6.399 3.280 1.00 0.00 C ATOM 1761 CD LYS A 48 -5.622 -7.373 2.558 1.00 0.00 C ATOM 1762 CE LYS A 48 -4.498 -7.836 3.499 1.00 0.00 C ATOM 1763 NZ LYS A 48 -5.022 -8.868 4.438 1.00 0.00 N ATOM 0 H LYS A 48 -8.596 -4.375 3.627 1.00 0.00 H new ATOM 0 HA LYS A 48 -9.490 -6.820 5.047 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.179 -7.804 4.802 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -8.163 -7.861 3.353 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -7.049 -5.734 2.556 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.019 -5.771 3.973 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.180 -8.238 2.198 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -5.192 -6.885 1.683 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -3.670 -8.245 2.919 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -4.106 -6.987 4.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.303 -9.606 4.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.246 -8.424 5.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -5.883 -9.295 4.040 1.00 0.00 H new ATOM 1777 N ASP A 49 -7.689 -6.195 6.914 1.00 0.00 N ATOM 1778 CA ASP A 49 -7.128 -5.520 8.126 1.00 0.00 C ATOM 1779 C ASP A 49 -5.822 -4.783 7.807 1.00 0.00 C ATOM 1780 O ASP A 49 -5.784 -3.571 7.720 1.00 0.00 O ATOM 1781 CB ASP A 49 -6.861 -6.561 9.216 1.00 0.00 C ATOM 1782 CG ASP A 49 -6.235 -5.877 10.434 1.00 0.00 C ATOM 1783 OD1 ASP A 49 -5.164 -5.311 10.288 1.00 0.00 O ATOM 1784 OD2 ASP A 49 -6.838 -5.930 11.492 1.00 0.00 O ATOM 0 H ASP A 49 -7.779 -7.209 6.984 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.860 -4.789 8.470 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -7.792 -7.052 9.500 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -6.194 -7.336 8.838 1.00 0.00 H new ATOM 1789 N GLY A 50 -4.744 -5.505 7.668 1.00 0.00 N ATOM 1790 CA GLY A 50 -3.432 -4.848 7.397 1.00 0.00 C ATOM 1791 C GLY A 50 -3.422 -4.231 6.000 1.00 0.00 C ATOM 1792 O GLY A 50 -4.318 -4.440 5.207 1.00 0.00 O ATOM 0 H GLY A 50 -4.714 -6.523 7.730 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.244 -4.076 8.143 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.628 -5.579 7.484 1.00 0.00 H new ATOM 1796 N ILE A 51 -2.398 -3.477 5.692 1.00 0.00 N ATOM 1797 CA ILE A 51 -2.295 -2.844 4.351 1.00 0.00 C ATOM 1798 C ILE A 51 -1.501 -3.753 3.414 1.00 0.00 C ATOM 1799 O ILE A 51 -0.578 -4.431 3.819 1.00 0.00 O ATOM 1800 CB ILE A 51 -1.597 -1.495 4.488 1.00 0.00 C ATOM 1801 CG1 ILE A 51 -2.285 -0.698 5.607 1.00 0.00 C ATOM 1802 CG2 ILE A 51 -1.698 -0.735 3.161 1.00 0.00 C ATOM 1803 CD1 ILE A 51 -1.934 0.790 5.498 1.00 0.00 C ATOM 0 H ILE A 51 -1.622 -3.273 6.322 1.00 0.00 H new ATOM 0 HA ILE A 51 -3.291 -2.695 3.935 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.545 -1.636 4.734 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.365 -0.829 5.544 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.974 -1.081 6.579 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.200 0.230 3.256 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.219 -1.315 2.372 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.747 -0.579 2.910 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.429 1.340 6.298 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.855 0.917 5.585 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.268 1.173 4.534 1.00 0.00 H new ATOM 1815 N GLN A 52 -1.847 -3.753 2.163 1.00 0.00 N ATOM 1816 CA GLN A 52 -1.112 -4.596 1.184 1.00 0.00 C ATOM 1817 C GLN A 52 0.172 -3.876 0.767 1.00 0.00 C ATOM 1818 O GLN A 52 0.220 -2.669 0.704 1.00 0.00 O ATOM 1819 CB GLN A 52 -1.996 -4.828 -0.041 1.00 0.00 C ATOM 1820 CG GLN A 52 -3.270 -5.558 0.388 1.00 0.00 C ATOM 1821 CD GLN A 52 -4.241 -4.561 1.034 1.00 0.00 C ATOM 1822 OE1 GLN A 52 -4.501 -4.631 2.220 1.00 0.00 O ATOM 1823 NE2 GLN A 52 -4.790 -3.629 0.302 1.00 0.00 N ATOM 0 H GLN A 52 -2.612 -3.203 1.772 1.00 0.00 H new ATOM 0 HA GLN A 52 -0.859 -5.556 1.634 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.248 -3.876 -0.508 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.459 -5.416 -0.786 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.739 -6.031 -0.475 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -3.026 -6.353 1.093 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.574 -3.568 -0.693 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.435 -2.962 0.725 1.00 0.00 H new ATOM 1832 N THR A 53 1.218 -4.609 0.488 1.00 0.00 N ATOM 1833 CA THR A 53 2.506 -3.964 0.072 1.00 0.00 C ATOM 1834 C THR A 53 3.073 -4.712 -1.133 1.00 0.00 C ATOM 1835 O THR A 53 2.719 -5.843 -1.404 1.00 0.00 O ATOM 1836 CB THR A 53 3.505 -3.990 1.233 1.00 0.00 C ATOM 1837 OG1 THR A 53 4.833 -3.961 0.727 1.00 0.00 O ATOM 1838 CG2 THR A 53 3.292 -5.254 2.054 1.00 0.00 C ATOM 0 H THR A 53 1.239 -5.628 0.529 1.00 0.00 H new ATOM 0 HA THR A 53 2.324 -2.925 -0.201 1.00 0.00 H new ATOM 0 HB THR A 53 3.348 -3.116 1.866 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.468 -3.976 1.473 1.00 0.00 H new ATOM 0 HG21 THR A 53 4.002 -5.275 2.881 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.276 -5.265 2.448 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.446 -6.129 1.422 1.00 0.00 H new ATOM 1846 N ARG A 54 3.936 -4.072 -1.870 1.00 0.00 N ATOM 1847 CA ARG A 54 4.523 -4.719 -3.086 1.00 0.00 C ATOM 1848 C ARG A 54 5.930 -4.171 -3.338 1.00 0.00 C ATOM 1849 O ARG A 54 6.319 -3.152 -2.804 1.00 0.00 O ATOM 1850 CB ARG A 54 3.618 -4.431 -4.303 1.00 0.00 C ATOM 1851 CG ARG A 54 3.763 -5.553 -5.359 1.00 0.00 C ATOM 1852 CD ARG A 54 2.818 -6.726 -5.029 1.00 0.00 C ATOM 1853 NE ARG A 54 3.469 -8.021 -5.411 1.00 0.00 N ATOM 1854 CZ ARG A 54 3.978 -8.205 -6.602 1.00 0.00 C ATOM 1855 NH1 ARG A 54 3.777 -7.334 -7.553 1.00 0.00 N ATOM 1856 NH2 ARG A 54 4.651 -9.296 -6.854 1.00 0.00 N ATOM 0 H ARG A 54 4.264 -3.124 -1.685 1.00 0.00 H new ATOM 0 HA ARG A 54 4.588 -5.796 -2.931 1.00 0.00 H new ATOM 0 HB2 ARG A 54 2.579 -4.356 -3.982 1.00 0.00 H new ATOM 0 HB3 ARG A 54 3.885 -3.471 -4.744 1.00 0.00 H new ATOM 0 HG2 ARG A 54 3.534 -5.161 -6.350 1.00 0.00 H new ATOM 0 HG3 ARG A 54 4.794 -5.905 -5.386 1.00 0.00 H new ATOM 0 HD2 ARG A 54 2.581 -6.727 -3.965 1.00 0.00 H new ATOM 0 HD3 ARG A 54 1.876 -6.609 -5.565 1.00 0.00 H new ATOM 0 HE ARG A 54 3.516 -8.776 -4.727 1.00 0.00 H new ATOM 0 HH11 ARG A 54 3.218 -6.500 -7.371 1.00 0.00 H new ATOM 0 HH12 ARG A 54 4.178 -7.487 -8.478 1.00 0.00 H new ATOM 0 HH21 ARG A 54 4.777 -9.998 -6.124 1.00 0.00 H new ATOM 0 HH22 ARG A 54 5.051 -9.446 -7.780 1.00 0.00 H new ATOM 1870 N ASN A 55 6.696 -4.850 -4.145 1.00 0.00 N ATOM 1871 CA ASN A 55 8.079 -4.379 -4.430 1.00 0.00 C ATOM 1872 C ASN A 55 8.028 -2.979 -5.044 1.00 0.00 C ATOM 1873 O ASN A 55 7.201 -2.683 -5.885 1.00 0.00 O ATOM 1874 CB ASN A 55 8.759 -5.336 -5.411 1.00 0.00 C ATOM 1875 CG ASN A 55 10.228 -4.940 -5.571 1.00 0.00 C ATOM 1876 OD1 ASN A 55 10.611 -4.376 -6.576 1.00 0.00 O ATOM 1877 ND2 ASN A 55 11.074 -5.215 -4.616 1.00 0.00 N ATOM 0 H ASN A 55 6.424 -5.711 -4.620 1.00 0.00 H new ATOM 0 HA ASN A 55 8.645 -4.350 -3.499 1.00 0.00 H new ATOM 0 HB2 ASN A 55 8.685 -6.361 -5.047 1.00 0.00 H new ATOM 0 HB3 ASN A 55 8.255 -5.303 -6.377 1.00 0.00 H new ATOM 0 HD21 ASN A 55 12.056 -4.956 -4.714 1.00 0.00 H new ATOM 0 HD22 ASN A 55 10.753 -5.689 -3.771 1.00 0.00 H new ATOM 1884 N ARG A 56 8.912 -2.119 -4.627 1.00 0.00 N ATOM 1885 CA ARG A 56 8.936 -0.732 -5.173 1.00 0.00 C ATOM 1886 C ARG A 56 9.277 -0.764 -6.662 1.00 0.00 C ATOM 1887 O ARG A 56 10.205 -1.425 -7.083 1.00 0.00 O ATOM 1888 CB ARG A 56 10.004 0.080 -4.433 1.00 0.00 C ATOM 1889 CG ARG A 56 9.474 0.501 -3.060 1.00 0.00 C ATOM 1890 CD ARG A 56 10.591 1.177 -2.269 1.00 0.00 C ATOM 1891 NE ARG A 56 11.204 2.249 -3.102 1.00 0.00 N ATOM 1892 CZ ARG A 56 12.007 3.123 -2.560 1.00 0.00 C ATOM 1893 NH1 ARG A 56 12.302 3.041 -1.292 1.00 0.00 N ATOM 1894 NH2 ARG A 56 12.522 4.075 -3.289 1.00 0.00 N ATOM 0 H ARG A 56 9.625 -2.317 -3.926 1.00 0.00 H new ATOM 0 HA ARG A 56 7.956 -0.275 -5.037 1.00 0.00 H new ATOM 0 HB2 ARG A 56 10.910 -0.514 -4.317 1.00 0.00 H new ATOM 0 HB3 ARG A 56 10.273 0.961 -5.015 1.00 0.00 H new ATOM 0 HG2 ARG A 56 8.632 1.183 -3.177 1.00 0.00 H new ATOM 0 HG3 ARG A 56 9.105 -0.370 -2.518 1.00 0.00 H new ATOM 0 HD2 ARG A 56 10.194 1.600 -1.346 1.00 0.00 H new ATOM 0 HD3 ARG A 56 11.346 0.444 -1.985 1.00 0.00 H new ATOM 0 HE ARG A 56 10.995 2.300 -4.099 1.00 0.00 H new ATOM 0 HH11 ARG A 56 11.905 2.293 -0.723 1.00 0.00 H new ATOM 0 HH12 ARG A 56 12.930 3.725 -0.869 1.00 0.00 H new ATOM 0 HH21 ARG A 56 12.297 4.136 -4.282 1.00 0.00 H new ATOM 0 HH22 ARG A 56 13.150 4.759 -2.866 1.00 0.00 H new ATOM 1908 N LYS A 57 8.530 -0.059 -7.463 1.00 0.00 N ATOM 1909 CA LYS A 57 8.808 -0.054 -8.921 1.00 0.00 C ATOM 1910 C LYS A 57 10.130 0.660 -9.209 1.00 0.00 C ATOM 1911 O LYS A 57 10.875 1.002 -8.312 1.00 0.00 O ATOM 1912 CB LYS A 57 7.679 0.643 -9.651 1.00 0.00 C ATOM 1913 CG LYS A 57 7.491 2.027 -9.075 1.00 0.00 C ATOM 1914 CD LYS A 57 6.299 2.667 -9.773 1.00 0.00 C ATOM 1915 CE LYS A 57 6.163 4.137 -9.365 1.00 0.00 C ATOM 1916 NZ LYS A 57 6.888 4.986 -10.352 1.00 0.00 N ATOM 0 H LYS A 57 7.739 0.514 -7.169 1.00 0.00 H new ATOM 0 HA LYS A 57 8.885 -1.084 -9.269 1.00 0.00 H new ATOM 0 HB2 LYS A 57 7.904 0.707 -10.716 1.00 0.00 H new ATOM 0 HB3 LYS A 57 6.758 0.068 -9.554 1.00 0.00 H new ATOM 0 HG2 LYS A 57 7.319 1.973 -8.000 1.00 0.00 H new ATOM 0 HG3 LYS A 57 8.388 2.628 -9.225 1.00 0.00 H new ATOM 0 HD2 LYS A 57 6.421 2.593 -10.854 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.387 2.127 -9.517 1.00 0.00 H new ATOM 0 HE2 LYS A 57 5.111 4.421 -9.326 1.00 0.00 H new ATOM 0 HE3 LYS A 57 6.572 4.289 -8.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 7.228 5.850 -9.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 7.698 4.458 -10.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 6.245 5.243 -11.127 1.00 0.00 H new ATOM 1930 N VAL A 58 10.427 0.874 -10.460 1.00 0.00 N ATOM 1931 CA VAL A 58 11.701 1.552 -10.833 1.00 0.00 C ATOM 1932 C VAL A 58 11.826 2.880 -10.082 1.00 0.00 C ATOM 1933 O VAL A 58 10.854 3.574 -9.863 1.00 0.00 O ATOM 1934 CB VAL A 58 11.688 1.825 -12.339 1.00 0.00 C ATOM 1935 CG1 VAL A 58 10.563 2.806 -12.669 1.00 0.00 C ATOM 1936 CG2 VAL A 58 13.028 2.428 -12.770 1.00 0.00 C ATOM 0 H VAL A 58 9.837 0.606 -11.247 1.00 0.00 H new ATOM 0 HA VAL A 58 12.545 0.914 -10.571 1.00 0.00 H new ATOM 0 HB VAL A 58 11.527 0.888 -12.871 1.00 0.00 H new ATOM 0 HG11 VAL A 58 10.553 3.001 -13.741 1.00 0.00 H new ATOM 0 HG12 VAL A 58 9.607 2.377 -12.369 1.00 0.00 H new ATOM 0 HG13 VAL A 58 10.726 3.740 -12.132 1.00 0.00 H new ATOM 0 HG21 VAL A 58 13.012 2.620 -13.843 1.00 0.00 H new ATOM 0 HG22 VAL A 58 13.194 3.364 -12.236 1.00 0.00 H new ATOM 0 HG23 VAL A 58 13.832 1.730 -12.538 1.00 0.00 H new ATOM 1946 N SER A 59 13.021 3.252 -9.704 1.00 0.00 N ATOM 1947 CA SER A 59 13.195 4.552 -8.991 1.00 0.00 C ATOM 1948 C SER A 59 13.265 5.663 -10.042 1.00 0.00 C ATOM 1949 O SER A 59 14.287 5.888 -10.659 1.00 0.00 O ATOM 1950 CB SER A 59 14.484 4.524 -8.165 1.00 0.00 C ATOM 1951 OG SER A 59 15.576 4.162 -9.001 1.00 0.00 O ATOM 0 H SER A 59 13.877 2.718 -9.856 1.00 0.00 H new ATOM 0 HA SER A 59 12.359 4.729 -8.314 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.663 5.502 -7.718 1.00 0.00 H new ATOM 0 HB3 SER A 59 14.388 3.812 -7.346 1.00 0.00 H new ATOM 0 HG SER A 59 15.477 4.595 -9.875 1.00 0.00 H new ATOM 1957 N SER A 60 12.169 6.347 -10.261 1.00 0.00 N ATOM 1958 CA SER A 60 12.132 7.438 -11.287 1.00 0.00 C ATOM 1959 C SER A 60 12.185 8.802 -10.594 1.00 0.00 C ATOM 1960 O SER A 60 11.333 9.132 -9.792 1.00 0.00 O ATOM 1961 CB SER A 60 10.831 7.312 -12.090 1.00 0.00 C ATOM 1962 OG SER A 60 10.983 6.297 -13.075 1.00 0.00 O ATOM 0 H SER A 60 11.289 6.195 -9.768 1.00 0.00 H new ATOM 0 HA SER A 60 12.989 7.350 -11.954 1.00 0.00 H new ATOM 0 HB2 SER A 60 10.002 7.069 -11.425 1.00 0.00 H new ATOM 0 HB3 SER A 60 10.590 8.263 -12.565 1.00 0.00 H new ATOM 0 HG SER A 60 10.153 6.213 -13.589 1.00 0.00 H new ATOM 1968 N LYS A 61 13.186 9.596 -10.899 1.00 0.00 N ATOM 1969 CA LYS A 61 13.322 10.950 -10.268 1.00 0.00 C ATOM 1970 C LYS A 61 13.492 12.014 -11.370 1.00 0.00 C ATOM 1971 O LYS A 61 13.460 13.200 -11.113 1.00 0.00 O ATOM 1972 CB LYS A 61 14.553 10.936 -9.333 1.00 0.00 C ATOM 1973 CG LYS A 61 14.288 11.757 -8.062 1.00 0.00 C ATOM 1974 CD LYS A 61 14.104 13.233 -8.426 1.00 0.00 C ATOM 1975 CE LYS A 61 14.259 14.097 -7.175 1.00 0.00 C ATOM 1976 NZ LYS A 61 13.166 13.777 -6.214 1.00 0.00 N ATOM 0 H LYS A 61 13.922 9.361 -11.565 1.00 0.00 H new ATOM 0 HA LYS A 61 12.431 11.192 -9.688 1.00 0.00 H new ATOM 0 HB2 LYS A 61 14.797 9.909 -9.062 1.00 0.00 H new ATOM 0 HB3 LYS A 61 15.418 11.341 -9.858 1.00 0.00 H new ATOM 0 HG2 LYS A 61 13.397 11.384 -7.556 1.00 0.00 H new ATOM 0 HG3 LYS A 61 15.120 11.646 -7.366 1.00 0.00 H new ATOM 0 HD2 LYS A 61 14.839 13.527 -9.175 1.00 0.00 H new ATOM 0 HD3 LYS A 61 13.119 13.388 -8.867 1.00 0.00 H new ATOM 0 HE2 LYS A 61 15.229 13.916 -6.713 1.00 0.00 H new ATOM 0 HE3 LYS A 61 14.225 15.153 -7.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 13.345 14.261 -5.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 12.256 14.096 -6.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 13.133 12.750 -6.055 1.00 0.00 H new ATOM 1990 N GLY A 62 13.682 11.601 -12.595 1.00 0.00 N ATOM 1991 CA GLY A 62 13.864 12.594 -13.697 1.00 0.00 C ATOM 1992 C GLY A 62 12.519 13.234 -14.059 1.00 0.00 C ATOM 1993 O GLY A 62 11.476 12.623 -13.938 1.00 0.00 O ATOM 0 H GLY A 62 13.719 10.623 -12.881 1.00 0.00 H new ATOM 0 HA2 GLY A 62 14.571 13.365 -13.389 1.00 0.00 H new ATOM 0 HA3 GLY A 62 14.289 12.103 -14.572 1.00 0.00 H new ATOM 1997 N LYS A 63 12.538 14.465 -14.504 1.00 0.00 N ATOM 1998 CA LYS A 63 11.264 15.148 -14.874 1.00 0.00 C ATOM 1999 C LYS A 63 10.579 14.360 -15.990 1.00 0.00 C ATOM 2000 O LYS A 63 9.413 14.033 -15.908 1.00 0.00 O ATOM 2001 CB LYS A 63 11.574 16.563 -15.378 1.00 0.00 C ATOM 2002 CG LYS A 63 12.289 17.371 -14.286 1.00 0.00 C ATOM 2003 CD LYS A 63 11.327 17.696 -13.136 1.00 0.00 C ATOM 2004 CE LYS A 63 11.924 18.812 -12.275 1.00 0.00 C ATOM 2005 NZ LYS A 63 12.083 20.042 -13.099 1.00 0.00 N ATOM 0 H LYS A 63 13.381 15.026 -14.627 1.00 0.00 H new ATOM 0 HA LYS A 63 10.611 15.203 -14.003 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.199 16.510 -16.269 1.00 0.00 H new ATOM 0 HB3 LYS A 63 10.650 17.065 -15.666 1.00 0.00 H new ATOM 0 HG2 LYS A 63 13.140 16.806 -13.906 1.00 0.00 H new ATOM 0 HG3 LYS A 63 12.683 18.295 -14.709 1.00 0.00 H new ATOM 0 HD2 LYS A 63 10.360 18.005 -13.532 1.00 0.00 H new ATOM 0 HD3 LYS A 63 11.154 16.807 -12.530 1.00 0.00 H new ATOM 0 HE2 LYS A 63 11.276 19.014 -11.422 1.00 0.00 H new ATOM 0 HE3 LYS A 63 12.889 18.501 -11.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 11.727 20.863 -12.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 13.089 20.183 -13.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 11.544 19.940 -13.983 1.00 0.00 H new ATOM 2019 N LYS A 64 11.301 14.040 -17.034 1.00 0.00 N ATOM 2020 CA LYS A 64 10.700 13.258 -18.155 1.00 0.00 C ATOM 2021 C LYS A 64 11.801 12.444 -18.836 1.00 0.00 C ATOM 2022 O LYS A 64 12.088 11.329 -18.453 1.00 0.00 O ATOM 2023 CB LYS A 64 10.059 14.199 -19.186 1.00 0.00 C ATOM 2024 CG LYS A 64 8.807 14.857 -18.593 1.00 0.00 C ATOM 2025 CD LYS A 64 8.110 15.719 -19.657 1.00 0.00 C ATOM 2026 CE LYS A 64 7.400 14.833 -20.692 1.00 0.00 C ATOM 2027 NZ LYS A 64 6.342 15.626 -21.379 1.00 0.00 N ATOM 0 H LYS A 64 12.283 14.287 -17.158 1.00 0.00 H new ATOM 0 HA LYS A 64 9.930 12.598 -17.756 1.00 0.00 H new ATOM 0 HB2 LYS A 64 10.775 14.965 -19.485 1.00 0.00 H new ATOM 0 HB3 LYS A 64 9.795 13.641 -20.084 1.00 0.00 H new ATOM 0 HG2 LYS A 64 8.122 14.091 -18.228 1.00 0.00 H new ATOM 0 HG3 LYS A 64 9.081 15.473 -17.737 1.00 0.00 H new ATOM 0 HD2 LYS A 64 7.387 16.381 -19.180 1.00 0.00 H new ATOM 0 HD3 LYS A 64 8.843 16.354 -20.155 1.00 0.00 H new ATOM 0 HE2 LYS A 64 8.119 14.458 -21.420 1.00 0.00 H new ATOM 0 HE3 LYS A 64 6.959 13.965 -20.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 5.860 15.028 -22.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 5.651 15.963 -20.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 6.775 16.441 -21.858 1.00 0.00 H new ATOM 2041 N ARG A 65 12.425 12.996 -19.846 1.00 0.00 N ATOM 2042 CA ARG A 65 13.510 12.259 -20.556 1.00 0.00 C ATOM 2043 C ARG A 65 14.569 13.251 -21.041 1.00 0.00 C ATOM 2044 O ARG A 65 14.276 14.397 -21.323 1.00 0.00 O ATOM 2045 CB ARG A 65 12.914 11.513 -21.750 1.00 0.00 C ATOM 2046 CG ARG A 65 13.989 10.649 -22.407 1.00 0.00 C ATOM 2047 CD ARG A 65 13.372 9.875 -23.573 1.00 0.00 C ATOM 2048 NE ARG A 65 14.397 8.978 -24.174 1.00 0.00 N ATOM 2049 CZ ARG A 65 14.029 8.017 -24.977 1.00 0.00 C ATOM 2050 NH1 ARG A 65 12.769 7.874 -25.286 1.00 0.00 N ATOM 2051 NH2 ARG A 65 14.921 7.207 -25.475 1.00 0.00 N ATOM 0 H ARG A 65 12.228 13.928 -20.209 1.00 0.00 H new ATOM 0 HA ARG A 65 13.974 11.544 -19.877 1.00 0.00 H new ATOM 0 HB2 ARG A 65 12.082 10.889 -21.423 1.00 0.00 H new ATOM 0 HB3 ARG A 65 12.514 12.224 -22.472 1.00 0.00 H new ATOM 0 HG2 ARG A 65 14.807 11.275 -22.763 1.00 0.00 H new ATOM 0 HG3 ARG A 65 14.411 9.957 -21.679 1.00 0.00 H new ATOM 0 HD2 ARG A 65 12.521 9.290 -23.225 1.00 0.00 H new ATOM 0 HD3 ARG A 65 12.995 10.569 -24.325 1.00 0.00 H new ATOM 0 HE ARG A 65 15.385 9.114 -23.959 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.074 8.513 -24.900 1.00 0.00 H new ATOM 0 HH12 ARG A 65 12.480 7.124 -25.913 1.00 0.00 H new ATOM 0 HH21 ARG A 65 15.906 7.324 -25.237 1.00 0.00 H new ATOM 0 HH22 ARG A 65 14.634 6.456 -26.103 1.00 0.00 H new ATOM 2065 N ARG A 66 15.798 12.824 -21.139 1.00 0.00 N ATOM 2066 CA ARG A 66 16.871 13.747 -21.607 1.00 0.00 C ATOM 2067 C ARG A 66 16.553 14.204 -23.031 1.00 0.00 C ATOM 2068 O ARG A 66 16.706 15.384 -23.303 1.00 0.00 O ATOM 2069 CB ARG A 66 18.222 13.016 -21.589 1.00 0.00 C ATOM 2070 CG ARG A 66 19.372 14.005 -21.877 1.00 0.00 C ATOM 2071 CD ARG A 66 19.815 14.709 -20.581 1.00 0.00 C ATOM 2072 NE ARG A 66 20.285 16.098 -20.897 1.00 0.00 N ATOM 2073 CZ ARG A 66 21.153 16.325 -21.849 1.00 0.00 C ATOM 2074 NH1 ARG A 66 21.768 15.337 -22.436 1.00 0.00 N ATOM 2075 NH2 ARG A 66 21.443 17.554 -22.179 1.00 0.00 N ATOM 2076 OXT ARG A 66 16.161 13.366 -23.827 1.00 0.00 O ATOM 0 H ARG A 66 16.106 11.877 -20.916 1.00 0.00 H new ATOM 0 HA ARG A 66 16.924 14.613 -20.948 1.00 0.00 H new ATOM 0 HB2 ARG A 66 18.374 12.544 -20.619 1.00 0.00 H new ATOM 0 HB3 ARG A 66 18.222 12.221 -22.334 1.00 0.00 H new ATOM 0 HG2 ARG A 66 20.216 13.473 -22.315 1.00 0.00 H new ATOM 0 HG3 ARG A 66 19.048 14.746 -22.608 1.00 0.00 H new ATOM 0 HD2 ARG A 66 18.986 14.747 -19.874 1.00 0.00 H new ATOM 0 HD3 ARG A 66 20.615 14.143 -20.103 1.00 0.00 H new ATOM 0 HE ARG A 66 19.920 16.883 -20.358 1.00 0.00 H new ATOM 0 HH11 ARG A 66 21.574 14.376 -22.154 1.00 0.00 H new ATOM 0 HH12 ARG A 66 22.443 15.525 -23.177 1.00 0.00 H new ATOM 0 HH21 ARG A 66 20.994 18.332 -21.695 1.00 0.00 H new ATOM 0 HH22 ARG A 66 22.119 17.737 -22.921 1.00 0.00 H new TER 2090 ARG A 66 HETATM 2091 ZN ZN A 67 -12.142 3.277 1.967 1.00 0.00 ZN