USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 913 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 16 THR OG1 : rot -150:sc= 0.132 USER MOD Set 1.2: A 29 ASN : amide:sc= -5.98! C(o=-6.9!,f=-7.8!) USER MOD Set 1.3: C 125 DT C7 :methyl 150:sc= -1.1 (180deg=-0.721) USER MOD Set 2.1: A 12 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 14 THR OG1 : rot -154:sc= 0.815 USER MOD Single : A 1 LYS N :NH3+ -116:sc= 1.18 (180deg=0.0992) USER MOD Single : A 1 LYS NZ :NH3+ -149:sc= 1.19 (180deg=0.48) USER MOD Single : A 5 THR OG1 : rot -170:sc= 0.826 USER MOD Single : A 8 SER OG : rot 79:sc= 0.272 USER MOD Single : A 9 ASN :FLIP amide:sc= -1.57 F(o=-2.3!,f=-1.6) USER MOD Single : A 11 GLN : amide:sc= -0.0875 K(o=-0.088,f=-1.8!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -132:sc= 0.882 USER MOD Single : A 21 SER OG : rot 180:sc= -0.418 USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HE2:sc= -5.37! C(o=-5.4!,f=-10!) USER MOD Single : A 39 GLN : amide:sc= -0.0427 K(o=-0.043,f=-2.2!) USER MOD Single : A 41 ASN : amide:sc= -0.674! C(o=-0.67!,f=-5.8!) USER MOD Single : A 45 THR OG1 : rot -33:sc= 0.273 USER MOD Single : A 46 MET CE :methyl 166:sc= -0.809 (180deg=-1.68!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN :FLIP amide:sc= -0.0368 F(o=-0.94,f=-0.037) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.421 USER MOD Single : A 55 ASN :FLIP amide:sc= -0.0234 F(o=-1.7!,f=-0.023) USER MOD Single : A 57 LYS NZ :NH3+ -136:sc= -3.35! (180deg=-5.92!) USER MOD Single : A 59 SER OG : rot 62:sc= 0.163 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.108) USER MOD Single : B 101 DG O5' : rot 180:sc= -0.569 USER MOD Single : B 102 DT C7 :methyl -30:sc= -0.952 (180deg=-1.29) USER MOD Single : B 103 DT C7 :methyl -30:sc= -0.981 (180deg=-1.65!) USER MOD Single : B 109 DT C7 :methyl 150:sc= -2.52! (180deg=-2.52!) USER MOD Single : B 115 DT C7 :methyl -30:sc= 0 (180deg=-0.168) USER MOD Single : B 116 DT C7 :methyl 150:sc= -0.497 (180deg=-0.497) USER MOD Single : B 116 DT O3' : rot 180:sc= 0 USER MOD Single : C 117 DA O5' : rot 31:sc= -0.356 USER MOD Single : C 119 DT C7 :methyl -30:sc= -0.365 (180deg=-1.34) USER MOD Single : C 121 DT C7 :methyl 150:sc= -0.542 (180deg=-0.542) USER MOD Single : C 122 DT C7 :methyl 150:sc= -0.56 (180deg=-0.56) USER MOD Single : C 123 DT C7 :methyl -30:sc= -1.13 (180deg=-5.3!) USER MOD Single : C 127 DT C7 :methyl -30:sc= -0.408 (180deg=-0.746) USER MOD Single : C 132 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG B 101 19.184 23.468 8.068 1.00 0.00 O ATOM 2 C5' DG B 101 19.651 23.139 9.377 1.00 0.00 C ATOM 3 C4' DG B 101 18.611 22.332 10.160 1.00 0.00 C ATOM 4 O4' DG B 101 17.486 23.173 10.498 1.00 0.00 O ATOM 5 C3' DG B 101 18.081 21.141 9.356 1.00 0.00 C ATOM 6 O3' DG B 101 18.083 19.958 10.162 1.00 0.00 O ATOM 7 C2' DG B 101 16.669 21.518 8.966 1.00 0.00 C ATOM 8 C1' DG B 101 16.299 22.744 9.796 1.00 0.00 C ATOM 9 N9 DG B 101 15.783 23.835 8.943 1.00 0.00 N ATOM 10 C8 DG B 101 16.308 24.363 7.797 1.00 0.00 C ATOM 11 N7 DG B 101 15.623 25.334 7.272 1.00 0.00 N ATOM 12 C5 DG B 101 14.542 25.468 8.142 1.00 0.00 C ATOM 13 C6 DG B 101 13.446 26.371 8.100 1.00 0.00 C ATOM 14 O6 DG B 101 13.208 27.245 7.269 1.00 0.00 O ATOM 15 N1 DG B 101 12.585 26.174 9.172 1.00 0.00 N ATOM 16 C2 DG B 101 12.750 25.224 10.159 1.00 0.00 C ATOM 17 N2 DG B 101 11.809 25.182 11.102 1.00 0.00 N ATOM 18 N3 DG B 101 13.778 24.374 10.200 1.00 0.00 N ATOM 19 C4 DG B 101 14.632 24.553 9.166 1.00 0.00 C ATOM 0 H5' DG B 101 19.887 24.054 9.920 1.00 0.00 H new ATOM 0 H5'' DG B 101 20.575 22.566 9.301 1.00 0.00 H new ATOM 0 H4' DG B 101 19.109 21.962 11.056 1.00 0.00 H new ATOM 0 H3' DG B 101 18.698 20.930 8.482 1.00 0.00 H new ATOM 0 H2' DG B 101 16.607 21.739 7.900 1.00 0.00 H new ATOM 0 H2'' DG B 101 15.981 20.696 9.161 1.00 0.00 H new ATOM 0 HO5' DG B 101 19.870 23.984 7.596 1.00 0.00 H new ATOM 0 H1' DG B 101 15.507 22.487 10.499 1.00 0.00 H new ATOM 0 H8 DG B 101 17.226 23.999 7.359 1.00 0.00 H new ATOM 0 H1 DG B 101 11.766 26.779 9.235 1.00 0.00 H new ATOM 0 H21 DG B 101 11.875 24.501 11.859 1.00 0.00 H new ATOM 0 H22 DG B 101 11.023 25.831 11.067 1.00 0.00 H new ATOM 32 P DT B 102 17.525 18.554 9.602 1.00 0.00 P ATOM 33 OP1 DT B 102 18.286 17.461 10.250 1.00 0.00 O ATOM 34 OP2 DT B 102 17.468 18.635 8.124 1.00 0.00 O ATOM 35 O5' DT B 102 16.013 18.522 10.165 1.00 0.00 O ATOM 36 C5' DT B 102 15.783 18.568 11.575 1.00 0.00 C ATOM 37 C4' DT B 102 14.290 18.530 11.940 1.00 0.00 C ATOM 38 O4' DT B 102 13.636 19.764 11.557 1.00 0.00 O ATOM 39 C3' DT B 102 13.548 17.377 11.251 1.00 0.00 C ATOM 40 O3' DT B 102 12.987 16.507 12.239 1.00 0.00 O ATOM 41 C2' DT B 102 12.443 18.019 10.444 1.00 0.00 C ATOM 42 C1' DT B 102 12.410 19.490 10.838 1.00 0.00 C ATOM 43 N1 DT B 102 12.271 20.388 9.651 1.00 0.00 N ATOM 44 C2 DT B 102 11.186 21.262 9.605 1.00 0.00 C ATOM 45 O2 DT B 102 10.333 21.291 10.489 1.00 0.00 O ATOM 46 N3 DT B 102 11.125 22.105 8.507 1.00 0.00 N ATOM 47 C4 DT B 102 12.035 22.150 7.466 1.00 0.00 C ATOM 48 O4 DT B 102 11.882 22.936 6.534 1.00 0.00 O ATOM 49 C5 DT B 102 13.126 21.207 7.592 1.00 0.00 C ATOM 50 C7 DT B 102 14.190 21.151 6.490 1.00 0.00 C ATOM 51 C6 DT B 102 13.207 20.374 8.659 1.00 0.00 C ATOM 0 H5' DT B 102 16.228 19.476 11.981 1.00 0.00 H new ATOM 0 H5'' DT B 102 16.289 17.726 12.048 1.00 0.00 H new ATOM 0 H4' DT B 102 14.249 18.388 13.020 1.00 0.00 H new ATOM 0 H3' DT B 102 14.213 16.786 10.621 1.00 0.00 H new ATOM 0 H2' DT B 102 12.630 17.909 9.376 1.00 0.00 H new ATOM 0 H2'' DT B 102 11.485 17.541 10.651 1.00 0.00 H new ATOM 0 H1' DT B 102 11.539 19.687 11.462 1.00 0.00 H new ATOM 0 H3 DT B 102 10.337 22.751 8.462 1.00 0.00 H new ATOM 0 H71 DT B 102 13.741 21.429 5.536 1.00 0.00 H new ATOM 0 H72 DT B 102 14.996 21.845 6.727 1.00 0.00 H new ATOM 0 H73 DT B 102 14.590 20.139 6.422 1.00 0.00 H new ATOM 0 H6 DT B 102 14.034 19.682 8.725 1.00 0.00 H new ATOM 64 P DT B 103 12.147 15.202 11.820 1.00 0.00 P ATOM 65 OP1 DT B 103 12.207 14.233 12.939 1.00 0.00 O ATOM 66 OP2 DT B 103 12.571 14.791 10.463 1.00 0.00 O ATOM 67 O5' DT B 103 10.640 15.766 11.725 1.00 0.00 O ATOM 68 C5' DT B 103 10.005 16.307 12.888 1.00 0.00 C ATOM 69 C4' DT B 103 8.579 16.790 12.597 1.00 0.00 C ATOM 70 O4' DT B 103 8.587 17.986 11.782 1.00 0.00 O ATOM 71 C3' DT B 103 7.753 15.720 11.863 1.00 0.00 C ATOM 72 O3' DT B 103 6.650 15.309 12.672 1.00 0.00 O ATOM 73 C2' DT B 103 7.254 16.393 10.602 1.00 0.00 C ATOM 74 C1' DT B 103 7.595 17.874 10.743 1.00 0.00 C ATOM 75 N1 DT B 103 8.083 18.454 9.460 1.00 0.00 N ATOM 76 C2 DT B 103 7.373 19.509 8.901 1.00 0.00 C ATOM 77 O2 DT B 103 6.354 19.958 9.421 1.00 0.00 O ATOM 78 N3 DT B 103 7.876 20.025 7.723 1.00 0.00 N ATOM 79 C4 DT B 103 9.008 19.589 7.061 1.00 0.00 C ATOM 80 O4 DT B 103 9.361 20.118 6.013 1.00 0.00 O ATOM 81 C5 DT B 103 9.684 18.492 7.709 1.00 0.00 C ATOM 82 C7 DT B 103 10.951 17.921 7.069 1.00 0.00 C ATOM 83 C6 DT B 103 9.210 17.971 8.864 1.00 0.00 C ATOM 0 H5' DT B 103 10.598 17.138 13.270 1.00 0.00 H new ATOM 0 H5'' DT B 103 9.977 15.549 13.671 1.00 0.00 H new ATOM 0 H4' DT B 103 8.125 17.000 13.566 1.00 0.00 H new ATOM 0 H3' DT B 103 8.343 14.830 11.643 1.00 0.00 H new ATOM 0 H2' DT B 103 7.730 15.967 9.719 1.00 0.00 H new ATOM 0 H2'' DT B 103 6.180 16.251 10.484 1.00 0.00 H new ATOM 0 H1' DT B 103 6.702 18.441 11.005 1.00 0.00 H new ATOM 0 H3 DT B 103 7.364 20.800 7.302 1.00 0.00 H new ATOM 0 H71 DT B 103 10.898 18.041 5.987 1.00 0.00 H new ATOM 0 H72 DT B 103 11.823 18.452 7.451 1.00 0.00 H new ATOM 0 H73 DT B 103 11.036 16.862 7.312 1.00 0.00 H new ATOM 0 H6 DT B 103 9.739 17.150 9.326 1.00 0.00 H new ATOM 96 P DG B 104 5.667 14.117 12.214 1.00 0.00 P ATOM 97 OP1 DG B 104 5.048 13.535 13.427 1.00 0.00 O ATOM 98 OP2 DG B 104 6.415 13.245 11.281 1.00 0.00 O ATOM 99 O5' DG B 104 4.512 14.868 11.377 1.00 0.00 O ATOM 100 C5' DG B 104 3.709 15.869 12.006 1.00 0.00 C ATOM 101 C4' DG B 104 2.665 16.469 11.052 1.00 0.00 C ATOM 102 O4' DG B 104 3.316 17.265 10.025 1.00 0.00 O ATOM 103 C3' DG B 104 1.856 15.368 10.346 1.00 0.00 C ATOM 104 O3' DG B 104 0.451 15.640 10.446 1.00 0.00 O ATOM 105 C2' DG B 104 2.280 15.424 8.903 1.00 0.00 C ATOM 106 C1' DG B 104 2.998 16.748 8.708 1.00 0.00 C ATOM 107 N9 DG B 104 4.213 16.593 7.875 1.00 0.00 N ATOM 108 C8 DG B 104 5.246 15.705 8.002 1.00 0.00 C ATOM 109 N7 DG B 104 6.188 15.822 7.113 1.00 0.00 N ATOM 110 C5 DG B 104 5.751 16.881 6.316 1.00 0.00 C ATOM 111 C6 DG B 104 6.361 17.477 5.174 1.00 0.00 C ATOM 112 O6 DG B 104 7.427 17.181 4.630 1.00 0.00 O ATOM 113 N1 DG B 104 5.588 18.514 4.667 1.00 0.00 N ATOM 114 C2 DG B 104 4.383 18.931 5.188 1.00 0.00 C ATOM 115 N2 DG B 104 3.787 19.942 4.555 1.00 0.00 N ATOM 116 N3 DG B 104 3.806 18.375 6.263 1.00 0.00 N ATOM 117 C4 DG B 104 4.543 17.359 6.774 1.00 0.00 C ATOM 0 H5' DG B 104 4.353 16.664 12.382 1.00 0.00 H new ATOM 0 H5'' DG B 104 3.202 15.435 12.868 1.00 0.00 H new ATOM 0 H4' DG B 104 2.000 17.087 11.655 1.00 0.00 H new ATOM 0 H3' DG B 104 2.034 14.390 10.792 1.00 0.00 H new ATOM 0 H2' DG B 104 2.937 14.589 8.660 1.00 0.00 H new ATOM 0 H2'' DG B 104 1.416 15.352 8.243 1.00 0.00 H new ATOM 0 H1' DG B 104 2.358 17.449 8.172 1.00 0.00 H new ATOM 0 H8 DG B 104 5.277 14.961 8.784 1.00 0.00 H new ATOM 0 H1 DG B 104 5.940 19.005 3.845 1.00 0.00 H new ATOM 0 H21 DG B 104 2.892 20.298 4.891 1.00 0.00 H new ATOM 0 H22 DG B 104 4.226 20.360 3.735 1.00 0.00 H new ATOM 129 P DC B 105 -0.651 14.638 9.817 1.00 0.00 P ATOM 130 OP1 DC B 105 -1.911 14.816 10.572 1.00 0.00 O ATOM 131 OP2 DC B 105 -0.042 13.290 9.721 1.00 0.00 O ATOM 132 O5' DC B 105 -0.890 15.185 8.315 1.00 0.00 O ATOM 133 C5' DC B 105 -1.369 16.517 8.096 1.00 0.00 C ATOM 134 C4' DC B 105 -1.533 16.847 6.602 1.00 0.00 C ATOM 135 O4' DC B 105 -0.248 16.972 5.939 1.00 0.00 O ATOM 136 C3' DC B 105 -2.330 15.773 5.849 1.00 0.00 C ATOM 137 O3' DC B 105 -3.444 16.387 5.198 1.00 0.00 O ATOM 138 C2' DC B 105 -1.380 15.180 4.841 1.00 0.00 C ATOM 139 C1' DC B 105 -0.222 16.155 4.739 1.00 0.00 C ATOM 140 N1 DC B 105 1.089 15.463 4.598 1.00 0.00 N ATOM 141 C2 DC B 105 1.861 15.729 3.469 1.00 0.00 C ATOM 142 O2 DC B 105 1.422 16.458 2.583 1.00 0.00 O ATOM 143 N3 DC B 105 3.092 15.157 3.378 1.00 0.00 N ATOM 144 C4 DC B 105 3.553 14.359 4.348 1.00 0.00 C ATOM 145 N4 DC B 105 4.770 13.827 4.231 1.00 0.00 N ATOM 146 C5 DC B 105 2.764 14.079 5.506 1.00 0.00 C ATOM 147 C6 DC B 105 1.544 14.648 5.583 1.00 0.00 C ATOM 0 H5' DC B 105 -0.676 17.227 8.548 1.00 0.00 H new ATOM 0 H5'' DC B 105 -2.328 16.642 8.600 1.00 0.00 H new ATOM 0 H4' DC B 105 -2.073 17.793 6.575 1.00 0.00 H new ATOM 0 H3' DC B 105 -2.718 15.001 6.514 1.00 0.00 H new ATOM 0 H2' DC B 105 -1.036 14.196 5.160 1.00 0.00 H new ATOM 0 H2'' DC B 105 -1.867 15.049 3.875 1.00 0.00 H new ATOM 0 H1' DC B 105 -0.333 16.766 3.843 1.00 0.00 H new ATOM 0 H41 DC B 105 5.133 13.217 4.964 1.00 0.00 H new ATOM 0 H42 DC B 105 5.338 14.030 3.409 1.00 0.00 H new ATOM 0 H5 DC B 105 3.132 13.435 6.291 1.00 0.00 H new ATOM 0 H6 DC B 105 0.919 14.452 6.442 1.00 0.00 H new ATOM 159 P DA B 106 -4.486 15.535 4.319 1.00 0.00 P ATOM 160 OP1 DA B 106 -5.831 16.135 4.480 1.00 0.00 O ATOM 161 OP2 DA B 106 -4.280 14.099 4.611 1.00 0.00 O ATOM 162 O5' DA B 106 -3.982 15.819 2.816 1.00 0.00 O ATOM 163 C5' DA B 106 -3.959 17.165 2.325 1.00 0.00 C ATOM 164 C4' DA B 106 -3.452 17.262 0.878 1.00 0.00 C ATOM 165 O4' DA B 106 -2.029 17.000 0.790 1.00 0.00 O ATOM 166 C3' DA B 106 -4.180 16.272 -0.032 1.00 0.00 C ATOM 167 O3' DA B 106 -4.885 16.966 -1.049 1.00 0.00 O ATOM 168 C2' DA B 106 -3.096 15.419 -0.663 1.00 0.00 C ATOM 169 C1' DA B 106 -1.755 15.969 -0.191 1.00 0.00 C ATOM 170 N9 DA B 106 -0.936 14.907 0.406 1.00 0.00 N ATOM 171 C8 DA B 106 -1.254 14.122 1.448 1.00 0.00 C ATOM 172 N7 DA B 106 -0.327 13.297 1.835 1.00 0.00 N ATOM 173 C5 DA B 106 0.708 13.556 0.940 1.00 0.00 C ATOM 174 C6 DA B 106 1.988 13.012 0.787 1.00 0.00 C ATOM 175 N6 DA B 106 2.473 12.053 1.577 1.00 0.00 N ATOM 176 N1 DA B 106 2.750 13.493 -0.208 1.00 0.00 N ATOM 177 C2 DA B 106 2.284 14.454 -1.007 1.00 0.00 C ATOM 178 N3 DA B 106 1.089 15.040 -0.949 1.00 0.00 N ATOM 179 C4 DA B 106 0.345 14.537 0.058 1.00 0.00 C ATOM 0 H5' DA B 106 -3.323 17.771 2.970 1.00 0.00 H new ATOM 0 H5'' DA B 106 -4.963 17.585 2.382 1.00 0.00 H new ATOM 0 H4' DA B 106 -3.653 18.282 0.551 1.00 0.00 H new ATOM 0 H3' DA B 106 -4.901 15.675 0.527 1.00 0.00 H new ATOM 0 H2' DA B 106 -3.208 14.375 -0.369 1.00 0.00 H new ATOM 0 H2'' DA B 106 -3.164 15.453 -1.750 1.00 0.00 H new ATOM 0 H1' DA B 106 -1.198 16.376 -1.035 1.00 0.00 H new ATOM 0 H8 DA B 106 -2.218 14.173 1.933 1.00 0.00 H new ATOM 0 H61 DA B 106 3.414 11.691 1.421 1.00 0.00 H new ATOM 0 H62 DA B 106 1.903 11.681 2.337 1.00 0.00 H new ATOM 0 H2 DA B 106 2.949 14.795 -1.787 1.00 0.00 H new ATOM 191 P DG B 107 -5.738 16.156 -2.137 1.00 0.00 P ATOM 192 OP1 DG B 107 -6.758 17.065 -2.706 1.00 0.00 O ATOM 193 OP2 DG B 107 -6.141 14.861 -1.545 1.00 0.00 O ATOM 194 O5' DG B 107 -4.621 15.878 -3.252 1.00 0.00 O ATOM 195 C5' DG B 107 -3.962 16.968 -3.888 1.00 0.00 C ATOM 196 C4' DG B 107 -2.928 16.478 -4.896 1.00 0.00 C ATOM 197 O4' DG B 107 -1.792 15.869 -4.223 1.00 0.00 O ATOM 198 C3' DG B 107 -3.522 15.434 -5.845 1.00 0.00 C ATOM 199 O3' DG B 107 -3.407 15.885 -7.197 1.00 0.00 O ATOM 200 C2' DG B 107 -2.712 14.183 -5.624 1.00 0.00 C ATOM 201 C1' DG B 107 -1.487 14.593 -4.833 1.00 0.00 C ATOM 202 N9 DG B 107 -1.105 13.566 -3.828 1.00 0.00 N ATOM 203 C8 DG B 107 -1.797 13.086 -2.740 1.00 0.00 C ATOM 204 N7 DG B 107 -1.167 12.219 -2.033 1.00 0.00 N ATOM 205 C5 DG B 107 0.047 12.083 -2.677 1.00 0.00 C ATOM 206 C6 DG B 107 1.145 11.258 -2.344 1.00 0.00 C ATOM 207 O6 DG B 107 1.252 10.496 -1.391 1.00 0.00 O ATOM 208 N1 DG B 107 2.182 11.399 -3.251 1.00 0.00 N ATOM 209 C2 DG B 107 2.169 12.239 -4.342 1.00 0.00 C ATOM 210 N2 DG B 107 3.263 12.217 -5.106 1.00 0.00 N ATOM 211 N3 DG B 107 1.133 13.030 -4.658 1.00 0.00 N ATOM 212 C4 DG B 107 0.105 12.898 -3.781 1.00 0.00 C ATOM 0 H5' DG B 107 -3.475 17.590 -3.137 1.00 0.00 H new ATOM 0 H5'' DG B 107 -4.697 17.595 -4.393 1.00 0.00 H new ATOM 0 H4' DG B 107 -2.608 17.353 -5.462 1.00 0.00 H new ATOM 0 H3' DG B 107 -4.581 15.258 -5.657 1.00 0.00 H new ATOM 0 H2' DG B 107 -3.292 13.437 -5.081 1.00 0.00 H new ATOM 0 H2'' DG B 107 -2.426 13.734 -6.575 1.00 0.00 H new ATOM 0 H1' DG B 107 -0.620 14.683 -5.487 1.00 0.00 H new ATOM 0 H8 DG B 107 -2.797 13.415 -2.498 1.00 0.00 H new ATOM 0 H1 DG B 107 3.020 10.837 -3.099 1.00 0.00 H new ATOM 0 H21 DG B 107 3.321 12.814 -5.931 1.00 0.00 H new ATOM 0 H22 DG B 107 4.041 11.603 -4.865 1.00 0.00 H new ATOM 224 P DA B 108 -3.945 14.999 -8.426 1.00 0.00 P ATOM 225 OP1 DA B 108 -4.468 15.919 -9.460 1.00 0.00 O ATOM 226 OP2 DA B 108 -4.820 13.940 -7.880 1.00 0.00 O ATOM 227 O5' DA B 108 -2.615 14.293 -9.009 1.00 0.00 O ATOM 228 C5' DA B 108 -1.536 15.099 -9.498 1.00 0.00 C ATOM 229 C4' DA B 108 -0.366 14.257 -10.019 1.00 0.00 C ATOM 230 O4' DA B 108 0.334 13.593 -8.937 1.00 0.00 O ATOM 231 C3' DA B 108 -0.853 13.182 -10.993 1.00 0.00 C ATOM 232 O3' DA B 108 -0.072 13.227 -12.189 1.00 0.00 O ATOM 233 C2' DA B 108 -0.638 11.872 -10.273 1.00 0.00 C ATOM 234 C1' DA B 108 0.339 12.160 -9.143 1.00 0.00 C ATOM 235 N9 DA B 108 -0.038 11.461 -7.899 1.00 0.00 N ATOM 236 C8 DA B 108 -1.221 11.501 -7.221 1.00 0.00 C ATOM 237 N7 DA B 108 -1.232 10.875 -6.089 1.00 0.00 N ATOM 238 C5 DA B 108 0.055 10.359 -6.002 1.00 0.00 C ATOM 239 C6 DA B 108 0.688 9.590 -5.031 1.00 0.00 C ATOM 240 N6 DA B 108 0.109 9.258 -3.889 1.00 0.00 N ATOM 241 N1 DA B 108 1.959 9.234 -5.249 1.00 0.00 N ATOM 242 C2 DA B 108 2.582 9.617 -6.354 1.00 0.00 C ATOM 243 N3 DA B 108 2.082 10.361 -7.345 1.00 0.00 N ATOM 244 C4 DA B 108 0.793 10.700 -7.098 1.00 0.00 C ATOM 0 H5' DA B 108 -1.183 15.752 -8.699 1.00 0.00 H new ATOM 0 H5'' DA B 108 -1.901 15.743 -10.298 1.00 0.00 H new ATOM 0 H4' DA B 108 0.309 14.946 -10.526 1.00 0.00 H new ATOM 0 H3' DA B 108 -1.896 13.320 -11.279 1.00 0.00 H new ATOM 0 H2' DA B 108 -1.579 11.484 -9.884 1.00 0.00 H new ATOM 0 H2'' DA B 108 -0.238 11.118 -10.950 1.00 0.00 H new ATOM 0 H1' DA B 108 1.332 11.800 -9.410 1.00 0.00 H new ATOM 0 H8 DA B 108 -2.088 12.019 -7.603 1.00 0.00 H new ATOM 0 H61 DA B 108 0.614 8.692 -3.207 1.00 0.00 H new ATOM 0 H62 DA B 108 -0.842 9.568 -3.690 1.00 0.00 H new ATOM 0 H2 DA B 108 3.606 9.292 -6.466 1.00 0.00 H new ATOM 256 P DT B 109 -0.342 12.215 -13.412 1.00 0.00 P ATOM 257 OP1 DT B 109 -0.062 12.925 -14.680 1.00 0.00 O ATOM 258 OP2 DT B 109 -1.657 11.575 -13.200 1.00 0.00 O ATOM 259 O5' DT B 109 0.802 11.107 -13.190 1.00 0.00 O ATOM 260 C5' DT B 109 2.173 11.508 -13.212 1.00 0.00 C ATOM 261 C4' DT B 109 3.124 10.333 -12.987 1.00 0.00 C ATOM 262 O4' DT B 109 3.022 9.862 -11.622 1.00 0.00 O ATOM 263 C3' DT B 109 2.811 9.156 -13.920 1.00 0.00 C ATOM 264 O3' DT B 109 3.935 8.867 -14.742 1.00 0.00 O ATOM 265 C2' DT B 109 2.552 7.974 -13.015 1.00 0.00 C ATOM 266 C1' DT B 109 2.849 8.429 -11.592 1.00 0.00 C ATOM 267 N1 DT B 109 1.750 8.042 -10.666 1.00 0.00 N ATOM 268 C2 DT B 109 2.048 7.214 -9.592 1.00 0.00 C ATOM 269 O2 DT B 109 3.178 6.765 -9.407 1.00 0.00 O ATOM 270 N3 DT B 109 0.999 6.920 -8.740 1.00 0.00 N ATOM 271 C4 DT B 109 -0.301 7.374 -8.864 1.00 0.00 C ATOM 272 O4 DT B 109 -1.159 7.047 -8.050 1.00 0.00 O ATOM 273 C5 DT B 109 -0.521 8.226 -10.008 1.00 0.00 C ATOM 274 C7 DT B 109 -1.920 8.808 -10.237 1.00 0.00 C ATOM 275 C6 DT B 109 0.490 8.523 -10.858 1.00 0.00 C ATOM 0 H5' DT B 109 2.341 12.261 -12.443 1.00 0.00 H new ATOM 0 H5'' DT B 109 2.397 11.976 -14.171 1.00 0.00 H new ATOM 0 H4' DT B 109 4.130 10.696 -13.197 1.00 0.00 H new ATOM 0 H3' DT B 109 1.964 9.381 -14.568 1.00 0.00 H new ATOM 0 H2' DT B 109 1.519 7.639 -13.105 1.00 0.00 H new ATOM 0 H2'' DT B 109 3.186 7.131 -13.291 1.00 0.00 H new ATOM 0 H1' DT B 109 3.754 7.947 -11.222 1.00 0.00 H new ATOM 0 H3 DT B 109 1.203 6.312 -7.947 1.00 0.00 H new ATOM 0 H71 DT B 109 -1.836 9.771 -10.741 1.00 0.00 H new ATOM 0 H72 DT B 109 -2.502 8.124 -10.855 1.00 0.00 H new ATOM 0 H73 DT B 109 -2.419 8.943 -9.278 1.00 0.00 H new ATOM 0 H6 DT B 109 0.293 9.157 -11.710 1.00 0.00 H new ATOM 288 P DA B 110 3.865 7.720 -15.868 1.00 0.00 P ATOM 289 OP1 DA B 110 4.909 7.995 -16.879 1.00 0.00 O ATOM 290 OP2 DA B 110 2.453 7.567 -16.286 1.00 0.00 O ATOM 291 O5' DA B 110 4.291 6.410 -15.038 1.00 0.00 O ATOM 292 C5' DA B 110 5.567 6.353 -14.408 1.00 0.00 C ATOM 293 C4' DA B 110 5.795 5.034 -13.668 1.00 0.00 C ATOM 294 O4' DA B 110 4.840 4.911 -12.572 1.00 0.00 O ATOM 295 C3' DA B 110 5.595 3.813 -14.573 1.00 0.00 C ATOM 296 O3' DA B 110 6.663 2.881 -14.357 1.00 0.00 O ATOM 297 C2' DA B 110 4.287 3.199 -14.157 1.00 0.00 C ATOM 298 C1' DA B 110 3.942 3.791 -12.803 1.00 0.00 C ATOM 299 N9 DA B 110 2.517 4.203 -12.747 1.00 0.00 N ATOM 300 C8 DA B 110 1.810 4.992 -13.610 1.00 0.00 C ATOM 301 N7 DA B 110 0.570 5.196 -13.283 1.00 0.00 N ATOM 302 C5 DA B 110 0.432 4.480 -12.097 1.00 0.00 C ATOM 303 C6 DA B 110 -0.652 4.281 -11.232 1.00 0.00 C ATOM 304 N6 DA B 110 -1.853 4.822 -11.433 1.00 0.00 N ATOM 305 N1 DA B 110 -0.448 3.511 -10.151 1.00 0.00 N ATOM 306 C2 DA B 110 0.749 2.969 -9.929 1.00 0.00 C ATOM 307 N3 DA B 110 1.843 3.095 -10.682 1.00 0.00 N ATOM 308 C4 DA B 110 1.610 3.871 -11.761 1.00 0.00 C ATOM 0 H5' DA B 110 5.659 7.181 -13.705 1.00 0.00 H new ATOM 0 H5'' DA B 110 6.346 6.484 -15.159 1.00 0.00 H new ATOM 0 H4' DA B 110 6.825 5.054 -13.312 1.00 0.00 H new ATOM 0 H3' DA B 110 5.589 4.085 -15.629 1.00 0.00 H new ATOM 0 H2' DA B 110 3.507 3.418 -14.886 1.00 0.00 H new ATOM 0 H2'' DA B 110 4.370 2.114 -14.096 1.00 0.00 H new ATOM 0 H1' DA B 110 4.072 3.048 -12.017 1.00 0.00 H new ATOM 0 H8 DA B 110 2.251 5.416 -14.500 1.00 0.00 H new ATOM 0 H61 DA B 110 -2.609 4.645 -10.772 1.00 0.00 H new ATOM 0 H62 DA B 110 -2.016 5.413 -12.248 1.00 0.00 H new ATOM 0 H2 DA B 110 0.844 2.361 -9.042 1.00 0.00 H new ATOM 320 P DA B 111 6.754 1.482 -15.155 1.00 0.00 P ATOM 321 OP1 DA B 111 8.183 1.123 -15.305 1.00 0.00 O ATOM 322 OP2 DA B 111 5.884 1.572 -16.348 1.00 0.00 O ATOM 323 O5' DA B 111 6.076 0.458 -14.106 1.00 0.00 O ATOM 324 C5' DA B 111 6.671 0.306 -12.814 1.00 0.00 C ATOM 325 C4' DA B 111 5.912 -0.669 -11.900 1.00 0.00 C ATOM 326 O4' DA B 111 4.651 -0.090 -11.494 1.00 0.00 O ATOM 327 C3' DA B 111 5.622 -2.019 -12.576 1.00 0.00 C ATOM 328 O3' DA B 111 6.222 -3.087 -11.841 1.00 0.00 O ATOM 329 C2' DA B 111 4.120 -2.184 -12.534 1.00 0.00 C ATOM 330 C1' DA B 111 3.567 -1.013 -11.727 1.00 0.00 C ATOM 331 N9 DA B 111 2.470 -0.366 -12.460 1.00 0.00 N ATOM 332 C8 DA B 111 2.478 0.147 -13.720 1.00 0.00 C ATOM 333 N7 DA B 111 1.339 0.600 -14.139 1.00 0.00 N ATOM 334 C5 DA B 111 0.494 0.368 -13.058 1.00 0.00 C ATOM 335 C6 DA B 111 -0.864 0.615 -12.854 1.00 0.00 C ATOM 336 N6 DA B 111 -1.644 1.159 -13.784 1.00 0.00 N ATOM 337 N1 DA B 111 -1.386 0.263 -11.667 1.00 0.00 N ATOM 338 C2 DA B 111 -0.617 -0.303 -10.735 1.00 0.00 C ATOM 339 N3 DA B 111 0.680 -0.583 -10.828 1.00 0.00 N ATOM 340 C4 DA B 111 1.174 -0.217 -12.028 1.00 0.00 C ATOM 0 H5' DA B 111 6.722 1.281 -12.329 1.00 0.00 H new ATOM 0 H5'' DA B 111 7.696 -0.044 -12.934 1.00 0.00 H new ATOM 0 H4' DA B 111 6.558 -0.848 -11.041 1.00 0.00 H new ATOM 0 H3' DA B 111 6.020 -2.041 -13.591 1.00 0.00 H new ATOM 0 H2' DA B 111 3.704 -2.189 -13.541 1.00 0.00 H new ATOM 0 H2'' DA B 111 3.849 -3.133 -12.072 1.00 0.00 H new ATOM 0 H1' DA B 111 3.163 -1.357 -10.775 1.00 0.00 H new ATOM 0 H8 DA B 111 3.370 0.175 -14.328 1.00 0.00 H new ATOM 0 H61 DA B 111 -2.632 1.321 -13.590 1.00 0.00 H new ATOM 0 H62 DA B 111 -1.254 1.414 -14.691 1.00 0.00 H new ATOM 0 H2 DA B 111 -1.100 -0.562 -9.804 1.00 0.00 H new ATOM 352 P DA B 112 6.096 -4.614 -12.342 1.00 0.00 P ATOM 353 OP1 DA B 112 7.228 -5.384 -11.776 1.00 0.00 O ATOM 354 OP2 DA B 112 5.869 -4.602 -13.805 1.00 0.00 O ATOM 355 O5' DA B 112 4.737 -5.108 -11.625 1.00 0.00 O ATOM 356 C5' DA B 112 4.620 -5.099 -10.202 1.00 0.00 C ATOM 357 C4' DA B 112 3.229 -5.539 -9.737 1.00 0.00 C ATOM 358 O4' DA B 112 2.245 -4.562 -10.178 1.00 0.00 O ATOM 359 C3' DA B 112 2.814 -6.897 -10.322 1.00 0.00 C ATOM 360 O3' DA B 112 2.303 -7.743 -9.282 1.00 0.00 O ATOM 361 C2' DA B 112 1.739 -6.604 -11.322 1.00 0.00 C ATOM 362 C1' DA B 112 1.265 -5.184 -11.046 1.00 0.00 C ATOM 363 N9 DA B 112 1.070 -4.431 -12.308 1.00 0.00 N ATOM 364 C8 DA B 112 1.889 -4.327 -13.396 1.00 0.00 C ATOM 365 N7 DA B 112 1.409 -3.635 -14.384 1.00 0.00 N ATOM 366 C5 DA B 112 0.160 -3.240 -13.916 1.00 0.00 C ATOM 367 C6 DA B 112 -0.865 -2.480 -14.485 1.00 0.00 C ATOM 368 N6 DA B 112 -0.798 -1.975 -15.716 1.00 0.00 N ATOM 369 N1 DA B 112 -1.970 -2.280 -13.745 1.00 0.00 N ATOM 370 C2 DA B 112 -2.059 -2.801 -12.519 1.00 0.00 C ATOM 371 N3 DA B 112 -1.147 -3.534 -11.891 1.00 0.00 N ATOM 372 C4 DA B 112 -0.054 -3.716 -12.654 1.00 0.00 C ATOM 0 H5' DA B 112 4.827 -4.096 -9.828 1.00 0.00 H new ATOM 0 H5'' DA B 112 5.372 -5.761 -9.772 1.00 0.00 H new ATOM 0 H4' DA B 112 3.271 -5.621 -8.651 1.00 0.00 H new ATOM 0 H3' DA B 112 3.658 -7.412 -10.782 1.00 0.00 H new ATOM 0 H2' DA B 112 2.121 -6.694 -12.339 1.00 0.00 H new ATOM 0 H2'' DA B 112 0.917 -7.313 -11.226 1.00 0.00 H new ATOM 0 H1' DA B 112 0.293 -5.189 -10.553 1.00 0.00 H new ATOM 0 H8 DA B 112 2.865 -4.787 -13.432 1.00 0.00 H new ATOM 0 H61 DA B 112 -1.575 -1.426 -16.085 1.00 0.00 H new ATOM 0 H62 DA B 112 0.030 -2.137 -16.289 1.00 0.00 H new ATOM 0 H2 DA B 112 -2.973 -2.605 -11.979 1.00 0.00 H new ATOM 384 P DC B 113 1.779 -9.246 -9.580 1.00 0.00 P ATOM 385 OP1 DC B 113 2.115 -10.090 -8.413 1.00 0.00 O ATOM 386 OP2 DC B 113 2.252 -9.638 -10.928 1.00 0.00 O ATOM 387 O5' DC B 113 0.166 -9.098 -9.645 1.00 0.00 O ATOM 388 C5' DC B 113 -0.546 -8.611 -8.498 1.00 0.00 C ATOM 389 C4' DC B 113 -2.071 -8.523 -8.704 1.00 0.00 C ATOM 390 O4' DC B 113 -2.417 -7.455 -9.623 1.00 0.00 O ATOM 391 C3' DC B 113 -2.664 -9.824 -9.259 1.00 0.00 C ATOM 392 O3' DC B 113 -3.756 -10.242 -8.434 1.00 0.00 O ATOM 393 C2' DC B 113 -3.187 -9.483 -10.632 1.00 0.00 C ATOM 394 C1' DC B 113 -3.206 -7.966 -10.725 1.00 0.00 C ATOM 395 N1 DC B 113 -2.661 -7.478 -12.018 1.00 0.00 N ATOM 396 C2 DC B 113 -3.457 -6.654 -12.816 1.00 0.00 C ATOM 397 O2 DC B 113 -4.626 -6.424 -12.502 1.00 0.00 O ATOM 398 N3 DC B 113 -2.907 -6.124 -13.942 1.00 0.00 N ATOM 399 C4 DC B 113 -1.637 -6.383 -14.276 1.00 0.00 C ATOM 400 N4 DC B 113 -1.134 -5.844 -15.385 1.00 0.00 N ATOM 401 C5 DC B 113 -0.819 -7.230 -13.462 1.00 0.00 C ATOM 402 C6 DC B 113 -1.378 -7.756 -12.355 1.00 0.00 C ATOM 0 H5' DC B 113 -0.166 -7.623 -8.239 1.00 0.00 H new ATOM 0 H5'' DC B 113 -0.340 -9.264 -7.650 1.00 0.00 H new ATOM 0 H4' DC B 113 -2.489 -8.329 -7.716 1.00 0.00 H new ATOM 0 H3' DC B 113 -1.924 -10.624 -9.288 1.00 0.00 H new ATOM 0 H2' DC B 113 -2.550 -9.911 -11.406 1.00 0.00 H new ATOM 0 H2'' DC B 113 -4.186 -9.893 -10.779 1.00 0.00 H new ATOM 0 H1' DC B 113 -4.236 -7.613 -10.671 1.00 0.00 H new ATOM 0 H41 DC B 113 -0.168 -6.033 -15.651 1.00 0.00 H new ATOM 0 H42 DC B 113 -1.715 -5.242 -15.968 1.00 0.00 H new ATOM 0 H5 DC B 113 0.207 -7.439 -13.725 1.00 0.00 H new ATOM 0 H6 DC B 113 -0.794 -8.411 -11.725 1.00 0.00 H new ATOM 414 P DA B 114 -4.592 -11.582 -8.755 1.00 0.00 P ATOM 415 OP1 DA B 114 -5.213 -12.059 -7.500 1.00 0.00 O ATOM 416 OP2 DA B 114 -3.732 -12.488 -9.546 1.00 0.00 O ATOM 417 O5' DA B 114 -5.759 -11.021 -9.714 1.00 0.00 O ATOM 418 C5' DA B 114 -6.657 -10.021 -9.234 1.00 0.00 C ATOM 419 C4' DA B 114 -7.683 -9.600 -10.295 1.00 0.00 C ATOM 420 O4' DA B 114 -7.048 -8.837 -11.352 1.00 0.00 O ATOM 421 C3' DA B 114 -8.387 -10.794 -10.946 1.00 0.00 C ATOM 422 O3' DA B 114 -9.793 -10.694 -10.715 1.00 0.00 O ATOM 423 C2' DA B 114 -8.096 -10.699 -12.425 1.00 0.00 C ATOM 424 C1' DA B 114 -7.419 -9.360 -12.653 1.00 0.00 C ATOM 425 N9 DA B 114 -6.239 -9.498 -13.524 1.00 0.00 N ATOM 426 C8 DA B 114 -5.120 -10.228 -13.317 1.00 0.00 C ATOM 427 N7 DA B 114 -4.200 -10.112 -14.227 1.00 0.00 N ATOM 428 C5 DA B 114 -4.771 -9.223 -15.131 1.00 0.00 C ATOM 429 C6 DA B 114 -4.316 -8.676 -16.333 1.00 0.00 C ATOM 430 N6 DA B 114 -3.115 -8.935 -16.840 1.00 0.00 N ATOM 431 N1 DA B 114 -5.137 -7.833 -16.978 1.00 0.00 N ATOM 432 C2 DA B 114 -6.335 -7.543 -16.471 1.00 0.00 C ATOM 433 N3 DA B 114 -6.862 -8.002 -15.340 1.00 0.00 N ATOM 434 C4 DA B 114 -6.016 -8.845 -14.715 1.00 0.00 C ATOM 0 H5' DA B 114 -6.088 -9.148 -8.916 1.00 0.00 H new ATOM 0 H5'' DA B 114 -7.180 -10.398 -8.355 1.00 0.00 H new ATOM 0 H4' DA B 114 -8.422 -8.997 -9.767 1.00 0.00 H new ATOM 0 H3' DA B 114 -8.042 -11.744 -10.538 1.00 0.00 H new ATOM 0 H2' DA B 114 -7.452 -11.518 -12.746 1.00 0.00 H new ATOM 0 H2'' DA B 114 -9.016 -10.771 -13.005 1.00 0.00 H new ATOM 0 H1' DA B 114 -8.099 -8.675 -13.160 1.00 0.00 H new ATOM 0 H8 DA B 114 -4.999 -10.865 -12.453 1.00 0.00 H new ATOM 0 H61 DA B 114 -2.831 -8.509 -17.722 1.00 0.00 H new ATOM 0 H62 DA B 114 -2.477 -9.560 -16.347 1.00 0.00 H new ATOM 0 H2 DA B 114 -6.945 -6.859 -17.042 1.00 0.00 H new ATOM 446 P DT B 115 -10.824 -11.796 -11.270 1.00 0.00 P ATOM 447 OP1 DT B 115 -12.042 -11.768 -10.428 1.00 0.00 O ATOM 448 OP2 DT B 115 -10.085 -13.060 -11.462 1.00 0.00 O ATOM 449 O5' DT B 115 -11.186 -11.190 -12.717 1.00 0.00 O ATOM 450 C5' DT B 115 -11.786 -9.897 -12.803 1.00 0.00 C ATOM 451 C4' DT B 115 -11.863 -9.376 -14.241 1.00 0.00 C ATOM 452 O4' DT B 115 -10.535 -9.104 -14.759 1.00 0.00 O ATOM 453 C3' DT B 115 -12.535 -10.384 -15.184 1.00 0.00 C ATOM 454 O3' DT B 115 -13.764 -9.863 -15.687 1.00 0.00 O ATOM 455 C2' DT B 115 -11.568 -10.567 -16.331 1.00 0.00 C ATOM 456 C1' DT B 115 -10.453 -9.547 -16.127 1.00 0.00 C ATOM 457 N1 DT B 115 -9.115 -10.122 -16.460 1.00 0.00 N ATOM 458 C2 DT B 115 -8.377 -9.518 -17.470 1.00 0.00 C ATOM 459 O2 DT B 115 -8.781 -8.519 -18.061 1.00 0.00 O ATOM 460 N3 DT B 115 -7.161 -10.100 -17.768 1.00 0.00 N ATOM 461 C4 DT B 115 -6.619 -11.214 -17.159 1.00 0.00 C ATOM 462 O4 DT B 115 -5.528 -11.656 -17.515 1.00 0.00 O ATOM 463 C5 DT B 115 -7.447 -11.775 -16.119 1.00 0.00 C ATOM 464 C7 DT B 115 -6.958 -13.016 -15.371 1.00 0.00 C ATOM 465 C6 DT B 115 -8.642 -11.222 -15.808 1.00 0.00 C ATOM 0 H5' DT B 115 -11.214 -9.195 -12.196 1.00 0.00 H new ATOM 0 H5'' DT B 115 -12.790 -9.938 -12.381 1.00 0.00 H new ATOM 0 H4' DT B 115 -12.458 -8.463 -14.205 1.00 0.00 H new ATOM 0 H3' DT B 115 -12.759 -11.318 -14.668 1.00 0.00 H new ATOM 0 H2' DT B 115 -11.168 -11.581 -16.343 1.00 0.00 H new ATOM 0 H2'' DT B 115 -12.067 -10.410 -17.287 1.00 0.00 H new ATOM 0 H1' DT B 115 -10.575 -8.699 -16.801 1.00 0.00 H new ATOM 0 H3 DT B 115 -6.611 -9.665 -18.509 1.00 0.00 H new ATOM 0 H71 DT B 115 -6.332 -13.616 -16.032 1.00 0.00 H new ATOM 0 H72 DT B 115 -6.378 -12.711 -14.500 1.00 0.00 H new ATOM 0 H73 DT B 115 -7.815 -13.607 -15.048 1.00 0.00 H new ATOM 0 H6 DT B 115 -9.237 -11.664 -15.022 1.00 0.00 H new ATOM 478 P DT B 116 -14.706 -10.763 -16.634 1.00 0.00 P ATOM 479 OP1 DT B 116 -16.091 -10.250 -16.531 1.00 0.00 O ATOM 480 OP2 DT B 116 -14.424 -12.188 -16.349 1.00 0.00 O ATOM 481 O5' DT B 116 -14.151 -10.427 -18.108 1.00 0.00 O ATOM 482 C5' DT B 116 -14.175 -9.091 -18.607 1.00 0.00 C ATOM 483 C4' DT B 116 -13.498 -8.984 -19.977 1.00 0.00 C ATOM 484 O4' DT B 116 -12.079 -9.253 -19.867 1.00 0.00 O ATOM 485 C3' DT B 116 -14.089 -9.971 -20.992 1.00 0.00 C ATOM 486 O3' DT B 116 -14.811 -9.275 -22.012 1.00 0.00 O ATOM 487 C2' DT B 116 -12.905 -10.703 -21.588 1.00 0.00 C ATOM 488 C1' DT B 116 -11.653 -10.146 -20.919 1.00 0.00 C ATOM 489 N1 DT B 116 -10.813 -11.250 -20.381 1.00 0.00 N ATOM 490 C2 DT B 116 -9.544 -11.435 -20.916 1.00 0.00 C ATOM 491 O2 DT B 116 -9.099 -10.715 -21.806 1.00 0.00 O ATOM 492 N3 DT B 116 -8.809 -12.477 -20.388 1.00 0.00 N ATOM 493 C4 DT B 116 -9.217 -13.341 -19.389 1.00 0.00 C ATOM 494 O4 DT B 116 -8.474 -14.238 -18.993 1.00 0.00 O ATOM 495 C5 DT B 116 -10.549 -13.077 -18.892 1.00 0.00 C ATOM 496 C7 DT B 116 -11.122 -13.970 -17.788 1.00 0.00 C ATOM 497 C6 DT B 116 -11.290 -12.060 -19.395 1.00 0.00 C ATOM 0 H5' DT B 116 -13.673 -8.430 -17.901 1.00 0.00 H new ATOM 0 H5'' DT B 116 -15.207 -8.750 -18.684 1.00 0.00 H new ATOM 0 H4' DT B 116 -13.671 -7.966 -20.327 1.00 0.00 H new ATOM 0 H3' DT B 116 -14.792 -10.657 -20.520 1.00 0.00 H new ATOM 0 H2' DT B 116 -12.989 -11.776 -21.416 1.00 0.00 H new ATOM 0 H2'' DT B 116 -12.864 -10.555 -22.667 1.00 0.00 H new ATOM 0 HO3' DT B 116 -15.179 -9.921 -22.651 1.00 0.00 H new ATOM 0 H1' DT B 116 -11.042 -9.604 -21.641 1.00 0.00 H new ATOM 0 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ATOM 0 H3 DT C 121 -4.092 -2.192 -14.064 1.00 0.00 H new ATOM 0 H71 DT C 121 -6.066 1.461 -17.495 1.00 0.00 H new ATOM 0 H72 DT C 121 -4.971 2.227 -16.320 1.00 0.00 H new ATOM 0 H73 DT C 121 -4.342 1.021 -17.467 1.00 0.00 H new ATOM 0 H6 DT C 121 -7.543 0.654 -15.810 1.00 0.00 H new ATOM 671 P DT C 122 -11.345 1.016 -11.358 1.00 0.00 P ATOM 672 OP1 DT C 122 -12.651 0.867 -10.676 1.00 0.00 O ATOM 673 OP2 DT C 122 -10.900 2.348 -11.819 1.00 0.00 O ATOM 674 O5' DT C 122 -10.209 0.406 -10.396 1.00 0.00 O ATOM 675 C5' DT C 122 -10.344 -0.921 -9.888 1.00 0.00 C ATOM 676 C4' DT C 122 -9.165 -1.319 -8.994 1.00 0.00 C ATOM 677 O4' DT C 122 -7.970 -1.494 -9.791 1.00 0.00 O ATOM 678 C3' DT C 122 -8.871 -0.259 -7.921 1.00 0.00 C ATOM 679 O3' DT C 122 -9.099 -0.766 -6.611 1.00 0.00 O ATOM 680 C2' DT C 122 -7.400 0.057 -8.059 1.00 0.00 C ATOM 681 C1' DT C 122 -6.850 -0.831 -9.170 1.00 0.00 C ATOM 682 N1 DT C 122 -6.085 -0.022 -10.162 1.00 0.00 N ATOM 683 C2 DT C 122 -4.747 -0.332 -10.370 1.00 0.00 C ATOM 684 O2 DT C 122 -4.190 -1.250 -9.772 1.00 0.00 O ATOM 685 N3 DT C 122 -4.076 0.451 -11.291 1.00 0.00 N ATOM 686 C4 DT C 122 -4.614 1.500 -12.016 1.00 0.00 C ATOM 687 O4 DT C 122 -3.925 2.132 -12.810 1.00 0.00 O ATOM 688 C5 DT C 122 -6.007 1.754 -11.740 1.00 0.00 C ATOM 689 C7 DT C 122 -6.711 2.897 -12.474 1.00 0.00 C ATOM 690 C6 DT C 122 -6.687 1.004 -10.842 1.00 0.00 C ATOM 0 H5' DT C 122 -10.420 -1.621 -10.720 1.00 0.00 H new ATOM 0 H5'' DT C 122 -11.271 -0.999 -9.320 1.00 0.00 H new ATOM 0 H4' DT C 122 -9.444 -2.252 -8.503 1.00 0.00 H new ATOM 0 H3' DT C 122 -9.516 0.609 -8.057 1.00 0.00 H new ATOM 0 H2' DT C 122 -7.254 1.110 -8.300 1.00 0.00 H new ATOM 0 H2'' DT C 122 -6.877 -0.131 -7.122 1.00 0.00 H new ATOM 0 H1' DT C 122 -6.158 -1.568 -8.763 1.00 0.00 H new ATOM 0 H3 DT C 122 -3.092 0.235 -11.451 1.00 0.00 H new ATOM 0 H71 DT C 122 -7.767 2.656 -12.594 1.00 0.00 H new ATOM 0 H72 DT C 122 -6.611 3.816 -11.897 1.00 0.00 H new ATOM 0 H73 DT C 122 -6.257 3.034 -13.455 1.00 0.00 H new ATOM 0 H6 DT C 122 -7.729 1.219 -10.657 1.00 0.00 H new ATOM 703 P DT C 123 -8.913 0.193 -5.329 1.00 0.00 P ATOM 704 OP1 DT C 123 -9.719 -0.354 -4.214 1.00 0.00 O ATOM 705 OP2 DT C 123 -9.102 1.592 -5.765 1.00 0.00 O ATOM 706 O5' DT C 123 -7.358 -0.002 -4.982 1.00 0.00 O ATOM 707 C5' DT C 123 -6.843 -1.286 -4.655 1.00 0.00 C ATOM 708 C4' DT C 123 -5.341 -1.233 -4.387 1.00 0.00 C ATOM 709 O4' DT C 123 -4.620 -0.875 -5.600 1.00 0.00 O ATOM 710 C3' DT C 123 -4.970 -0.195 -3.322 1.00 0.00 C ATOM 711 O3' DT C 123 -4.206 -0.840 -2.295 1.00 0.00 O ATOM 712 C2' DT C 123 -4.157 0.852 -4.023 1.00 0.00 C ATOM 713 C1' DT C 123 -3.728 0.240 -5.340 1.00 0.00 C ATOM 714 N1 DT C 123 -3.740 1.243 -6.453 1.00 0.00 N ATOM 715 C2 DT C 123 -2.545 1.481 -7.128 1.00 0.00 C ATOM 716 O2 DT C 123 -1.507 0.889 -6.842 1.00 0.00 O ATOM 717 N3 DT C 123 -2.588 2.420 -8.142 1.00 0.00 N ATOM 718 C4 DT C 123 -3.702 3.134 -8.542 1.00 0.00 C ATOM 719 O4 DT C 123 -3.624 3.952 -9.456 1.00 0.00 O ATOM 720 C5 DT C 123 -4.902 2.829 -7.794 1.00 0.00 C ATOM 721 C7 DT C 123 -6.201 3.564 -8.142 1.00 0.00 C ATOM 722 C6 DT C 123 -4.889 1.913 -6.795 1.00 0.00 C ATOM 0 H5' DT C 123 -7.044 -1.979 -5.472 1.00 0.00 H new ATOM 0 H5'' DT C 123 -7.358 -1.673 -3.775 1.00 0.00 H new ATOM 0 H4' DT C 123 -5.065 -2.227 -4.036 1.00 0.00 H new ATOM 0 H3' DT C 123 -5.845 0.256 -2.854 1.00 0.00 H new ATOM 0 H2' DT C 123 -4.744 1.756 -4.186 1.00 0.00 H new ATOM 0 H2'' DT C 123 -3.291 1.137 -3.426 1.00 0.00 H new ATOM 0 H1' DT C 123 -2.697 -0.108 -5.280 1.00 0.00 H new ATOM 0 H3 DT C 123 -1.717 2.603 -8.641 1.00 0.00 H new ATOM 0 H71 DT C 123 -5.966 4.557 -8.524 1.00 0.00 H new ATOM 0 H72 DT C 123 -6.745 3.002 -8.902 1.00 0.00 H new ATOM 0 H73 DT C 123 -6.818 3.656 -7.248 1.00 0.00 H new ATOM 0 H6 DT C 123 -5.802 1.706 -6.256 1.00 0.00 H new ATOM 735 P DA C 124 -3.611 -0.050 -1.023 1.00 0.00 P ATOM 736 OP1 DA C 124 -3.658 -0.953 0.147 1.00 0.00 O ATOM 737 OP2 DA C 124 -4.257 1.279 -0.958 1.00 0.00 O ATOM 738 O5' DA C 124 -2.059 0.158 -1.442 1.00 0.00 O ATOM 739 C5' DA C 124 -1.274 -1.018 -1.686 1.00 0.00 C ATOM 740 C4' DA C 124 0.190 -0.747 -2.079 1.00 0.00 C ATOM 741 O4' DA C 124 0.248 0.016 -3.312 1.00 0.00 O ATOM 742 C3' DA C 124 0.937 0.053 -1.009 1.00 0.00 C ATOM 743 O3' DA C 124 2.235 -0.494 -0.785 1.00 0.00 O ATOM 744 C2' DA C 124 1.073 1.445 -1.574 1.00 0.00 C ATOM 745 C1' DA C 124 0.822 1.323 -3.070 1.00 0.00 C ATOM 746 N9 DA C 124 -0.074 2.383 -3.537 1.00 0.00 N ATOM 747 C8 DA C 124 -1.306 2.683 -3.087 1.00 0.00 C ATOM 748 N7 DA C 124 -1.916 3.638 -3.717 1.00 0.00 N ATOM 749 C5 DA C 124 -0.987 4.008 -4.684 1.00 0.00 C ATOM 750 C6 DA C 124 -1.007 4.975 -5.688 1.00 0.00 C ATOM 751 N6 DA C 124 -2.053 5.771 -5.903 1.00 0.00 N ATOM 752 N1 DA C 124 0.088 5.082 -6.468 1.00 0.00 N ATOM 753 C2 DA C 124 1.137 4.279 -6.264 1.00 0.00 C ATOM 754 N3 DA C 124 1.252 3.329 -5.342 1.00 0.00 N ATOM 755 C4 DA C 124 0.142 3.249 -4.581 1.00 0.00 C ATOM 0 H5' DA C 124 -1.748 -1.596 -2.480 1.00 0.00 H new ATOM 0 H5'' DA C 124 -1.286 -1.638 -0.790 1.00 0.00 H new ATOM 0 H4' DA C 124 0.663 -1.722 -2.196 1.00 0.00 H new ATOM 0 H3' DA C 124 0.405 0.036 -0.058 1.00 0.00 H new ATOM 0 H2' DA C 124 0.355 2.124 -1.113 1.00 0.00 H new ATOM 0 H2'' DA C 124 2.066 1.849 -1.378 1.00 0.00 H new ATOM 0 H1' DA C 124 1.756 1.432 -3.621 1.00 0.00 H new ATOM 0 H8 DA C 124 -1.757 2.162 -2.255 1.00 0.00 H new ATOM 0 H61 DA C 124 -2.021 6.464 -6.650 1.00 0.00 H new ATOM 0 H62 DA C 124 -2.886 5.687 -5.320 1.00 0.00 H new ATOM 0 H2 DA C 124 1.984 4.417 -6.920 1.00 0.00 H new ATOM 767 P DT C 125 3.213 0.178 0.299 1.00 0.00 P ATOM 768 OP1 DT C 125 4.181 -0.844 0.755 1.00 0.00 O ATOM 769 OP2 DT C 125 2.387 0.912 1.286 1.00 0.00 O ATOM 770 O5' DT C 125 3.994 1.254 -0.611 1.00 0.00 O ATOM 771 C5' DT C 125 4.879 0.812 -1.641 1.00 0.00 C ATOM 772 C4' DT C 125 5.521 1.981 -2.398 1.00 0.00 C ATOM 773 O4' DT C 125 4.545 2.663 -3.224 1.00 0.00 O ATOM 774 C3' DT C 125 6.138 3.022 -1.448 1.00 0.00 C ATOM 775 O3' DT C 125 7.542 3.158 -1.688 1.00 0.00 O ATOM 776 C2' DT C 125 5.429 4.318 -1.774 1.00 0.00 C ATOM 777 C1' DT C 125 4.736 4.087 -3.110 1.00 0.00 C ATOM 778 N1 DT C 125 3.446 4.833 -3.260 1.00 0.00 N ATOM 779 C2 DT C 125 3.289 5.619 -4.402 1.00 0.00 C ATOM 780 O2 DT C 125 4.175 5.722 -5.247 1.00 0.00 O ATOM 781 N3 DT C 125 2.083 6.273 -4.536 1.00 0.00 N ATOM 782 C4 DT C 125 1.027 6.219 -3.649 1.00 0.00 C ATOM 783 O4 DT C 125 -0.035 6.775 -3.904 1.00 0.00 O ATOM 784 C5 DT C 125 1.272 5.400 -2.488 1.00 0.00 C ATOM 785 C7 DT C 125 0.219 5.338 -1.386 1.00 0.00 C ATOM 786 C6 DT C 125 2.441 4.739 -2.331 1.00 0.00 C ATOM 0 H5' DT C 125 4.331 0.185 -2.344 1.00 0.00 H new ATOM 0 H5'' DT C 125 5.661 0.192 -1.203 1.00 0.00 H new ATOM 0 H4' DT C 125 6.307 1.543 -3.013 1.00 0.00 H new ATOM 0 H3' DT C 125 6.022 2.735 -0.403 1.00 0.00 H new ATOM 0 H2' DT C 125 4.707 4.575 -0.998 1.00 0.00 H new ATOM 0 H2'' DT C 125 6.136 5.145 -1.838 1.00 0.00 H new ATOM 0 H1' DT C 125 5.358 4.477 -3.916 1.00 0.00 H new ATOM 0 H3 DT C 125 1.960 6.850 -5.368 1.00 0.00 H new ATOM 0 H71 DT C 125 0.262 4.365 -0.896 1.00 0.00 H new ATOM 0 H72 DT C 125 0.412 6.122 -0.654 1.00 0.00 H new ATOM 0 H73 DT C 125 -0.770 5.483 -1.820 1.00 0.00 H new ATOM 0 H6 DT C 125 2.587 4.124 -1.455 1.00 0.00 H new ATOM 799 P DC C 126 8.434 4.190 -0.824 1.00 0.00 P ATOM 800 OP1 DC C 126 9.791 3.622 -0.656 1.00 0.00 O ATOM 801 OP2 DC C 126 7.650 4.577 0.370 1.00 0.00 O ATOM 802 O5' DC C 126 8.539 5.478 -1.797 1.00 0.00 O ATOM 803 C5' DC C 126 9.140 5.343 -3.091 1.00 0.00 C ATOM 804 C4' DC C 126 9.162 6.658 -3.890 1.00 0.00 C ATOM 805 O4' DC C 126 7.822 7.021 -4.316 1.00 0.00 O ATOM 806 C3' DC C 126 9.735 7.833 -3.077 1.00 0.00 C ATOM 807 O3' DC C 126 10.923 8.342 -3.683 1.00 0.00 O ATOM 808 C2' DC C 126 8.676 8.910 -3.102 1.00 0.00 C ATOM 809 C1' DC C 126 7.509 8.379 -3.926 1.00 0.00 C ATOM 810 N1 DC C 126 6.256 8.424 -3.131 1.00 0.00 N ATOM 811 C2 DC C 126 5.184 9.177 -3.608 1.00 0.00 C ATOM 812 O2 DC C 126 5.295 9.818 -4.654 1.00 0.00 O ATOM 813 N3 DC C 126 4.037 9.194 -2.882 1.00 0.00 N ATOM 814 C4 DC C 126 3.937 8.506 -1.737 1.00 0.00 C ATOM 815 N4 DC C 126 2.793 8.530 -1.062 1.00 0.00 N ATOM 816 C5 DC C 126 5.032 7.736 -1.243 1.00 0.00 C ATOM 817 C6 DC C 126 6.163 7.724 -1.969 1.00 0.00 C ATOM 0 H5' DC C 126 8.596 4.589 -3.660 1.00 0.00 H new ATOM 0 H5'' DC C 126 10.161 4.979 -2.974 1.00 0.00 H new ATOM 0 H4' DC C 126 9.806 6.477 -4.750 1.00 0.00 H new ATOM 0 H3' DC C 126 9.986 7.513 -2.066 1.00 0.00 H new ATOM 0 H2' DC C 126 8.352 9.154 -2.090 1.00 0.00 H new ATOM 0 H2'' DC C 126 9.070 9.827 -3.540 1.00 0.00 H new ATOM 0 H1' DC C 126 7.357 8.994 -4.813 1.00 0.00 H new ATOM 0 H41 DC C 126 2.705 8.010 -0.189 1.00 0.00 H new ATOM 0 H42 DC C 126 2.003 9.068 -1.417 1.00 0.00 H new ATOM 0 H5 DC C 126 4.955 7.183 -0.319 1.00 0.00 H new ATOM 0 H6 DC C 126 7.010 7.150 -1.624 1.00 0.00 H new ATOM 829 P DT C 127 11.838 9.411 -2.896 1.00 0.00 P ATOM 830 OP1 DT C 127 13.189 9.394 -3.497 1.00 0.00 O ATOM 831 OP2 DT C 127 11.671 9.184 -1.442 1.00 0.00 O ATOM 832 O5' DT C 127 11.145 10.814 -3.268 1.00 0.00 O ATOM 833 C5' DT C 127 11.050 11.229 -4.629 1.00 0.00 C ATOM 834 C4' DT C 127 10.167 12.470 -4.789 1.00 0.00 C ATOM 835 O4' DT C 127 8.781 12.139 -4.532 1.00 0.00 O ATOM 836 C3' DT C 127 10.567 13.598 -3.831 1.00 0.00 C ATOM 837 O3' DT C 127 11.072 14.703 -4.582 1.00 0.00 O ATOM 838 C2' DT C 127 9.295 13.988 -3.102 1.00 0.00 C ATOM 839 C1' DT C 127 8.168 13.159 -3.717 1.00 0.00 C ATOM 840 N1 DT C 127 7.293 12.557 -2.664 1.00 0.00 N ATOM 841 C2 DT C 127 5.944 12.892 -2.669 1.00 0.00 C ATOM 842 O2 DT C 127 5.460 13.640 -3.517 1.00 0.00 O ATOM 843 N3 DT C 127 5.169 12.333 -1.671 1.00 0.00 N ATOM 844 C4 DT C 127 5.609 11.477 -0.680 1.00 0.00 C ATOM 845 O4 DT C 127 4.827 11.039 0.161 1.00 0.00 O ATOM 846 C5 DT C 127 7.022 11.176 -0.745 1.00 0.00 C ATOM 847 C7 DT C 127 7.628 10.247 0.311 1.00 0.00 C ATOM 848 C6 DT C 127 7.806 11.709 -1.713 1.00 0.00 C ATOM 0 H5' DT C 127 10.643 10.415 -5.229 1.00 0.00 H new ATOM 0 H5'' DT C 127 12.047 11.441 -5.014 1.00 0.00 H new ATOM 0 H4' DT C 127 10.302 12.813 -5.815 1.00 0.00 H new ATOM 0 H3' DT C 127 11.345 13.290 -3.132 1.00 0.00 H new ATOM 0 H2' DT C 127 9.384 13.789 -2.034 1.00 0.00 H new ATOM 0 H2'' DT C 127 9.096 15.054 -3.212 1.00 0.00 H new ATOM 0 H1' DT C 127 7.522 13.794 -4.323 1.00 0.00 H new ATOM 0 H3 DT C 127 4.178 12.575 -1.665 1.00 0.00 H new ATOM 0 H71 DT C 127 7.073 10.346 1.244 1.00 0.00 H new ATOM 0 H72 DT C 127 7.572 9.215 -0.037 1.00 0.00 H new ATOM 0 H73 DT C 127 8.671 10.517 0.478 1.00 0.00 H new ATOM 0 H6 DT C 127 8.857 11.462 -1.737 1.00 0.00 H new ATOM 861 P DG C 128 11.605 16.042 -3.869 1.00 0.00 P ATOM 862 OP1 DG C 128 12.559 16.701 -4.790 1.00 0.00 O ATOM 863 OP2 DG C 128 12.024 15.700 -2.491 1.00 0.00 O ATOM 864 O5' DG C 128 10.278 16.945 -3.784 1.00 0.00 O ATOM 865 C5' DG C 128 9.598 17.310 -4.984 1.00 0.00 C ATOM 866 C4' DG C 128 8.362 18.166 -4.708 1.00 0.00 C ATOM 867 O4' DG C 128 7.393 17.419 -3.942 1.00 0.00 O ATOM 868 C3' DG C 128 8.716 19.437 -3.930 1.00 0.00 C ATOM 869 O3' DG C 128 8.350 20.582 -4.692 1.00 0.00 O ATOM 870 C2' DG C 128 7.906 19.372 -2.650 1.00 0.00 C ATOM 871 C1' DG C 128 7.011 18.140 -2.754 1.00 0.00 C ATOM 872 N9 DG C 128 7.152 17.285 -1.565 1.00 0.00 N ATOM 873 C8 DG C 128 8.275 16.720 -1.064 1.00 0.00 C ATOM 874 N7 DG C 128 8.109 16.003 0.007 1.00 0.00 N ATOM 875 C5 DG C 128 6.739 16.104 0.243 1.00 0.00 C ATOM 876 C6 DG C 128 5.948 15.532 1.276 1.00 0.00 C ATOM 877 O6 DG C 128 6.310 14.809 2.203 1.00 0.00 O ATOM 878 N1 DG C 128 4.611 15.881 1.145 1.00 0.00 N ATOM 879 C2 DG C 128 4.094 16.681 0.145 1.00 0.00 C ATOM 880 N2 DG C 128 2.781 16.901 0.182 1.00 0.00 N ATOM 881 N3 DG C 128 4.836 17.220 -0.828 1.00 0.00 N ATOM 882 C4 DG C 128 6.143 16.890 -0.717 1.00 0.00 C ATOM 0 H5' DG C 128 9.302 16.409 -5.520 1.00 0.00 H new ATOM 0 H5'' DG C 128 10.280 17.858 -5.634 1.00 0.00 H new ATOM 0 H4' DG C 128 7.946 18.445 -5.676 1.00 0.00 H new ATOM 0 H3' DG C 128 9.784 19.508 -3.722 1.00 0.00 H new ATOM 0 H2' DG C 128 8.561 19.301 -1.782 1.00 0.00 H new ATOM 0 H2'' DG C 128 7.308 20.275 -2.525 1.00 0.00 H new ATOM 0 H1' DG C 128 5.965 18.443 -2.811 1.00 0.00 H new ATOM 0 H8 DG C 128 9.243 16.856 -1.523 1.00 0.00 H new ATOM 0 H1 DG C 128 3.960 15.518 1.841 1.00 0.00 H new ATOM 0 H21 DG C 128 2.341 17.484 -0.530 1.00 0.00 H new ATOM 0 H22 DG C 128 2.215 16.486 0.922 1.00 0.00 H new ATOM 894 P DC C 129 8.816 22.055 -4.251 1.00 0.00 P ATOM 895 OP1 DC C 129 8.817 22.915 -5.453 1.00 0.00 O ATOM 896 OP2 DC C 129 10.048 21.926 -3.440 1.00 0.00 O ATOM 897 O5' DC C 129 7.627 22.538 -3.287 1.00 0.00 O ATOM 898 C5' DC C 129 6.292 22.634 -3.777 1.00 0.00 C ATOM 899 C4' DC C 129 5.332 23.115 -2.685 1.00 0.00 C ATOM 900 O4' DC C 129 5.146 22.094 -1.677 1.00 0.00 O ATOM 901 C3' DC C 129 5.871 24.374 -1.995 1.00 0.00 C ATOM 902 O3' DC C 129 4.932 25.444 -2.114 1.00 0.00 O ATOM 903 C2' DC C 129 6.055 24.000 -0.544 1.00 0.00 C ATOM 904 C1' DC C 129 5.453 22.612 -0.362 1.00 0.00 C ATOM 905 N1 DC C 129 6.376 21.683 0.363 1.00 0.00 N ATOM 906 C2 DC C 129 5.894 21.052 1.512 1.00 0.00 C ATOM 907 O2 DC C 129 4.748 21.276 1.904 1.00 0.00 O ATOM 908 N3 DC C 129 6.711 20.186 2.170 1.00 0.00 N ATOM 909 C4 DC C 129 7.952 19.940 1.732 1.00 0.00 C ATOM 910 N4 DC C 129 8.724 19.086 2.408 1.00 0.00 N ATOM 911 C5 DC C 129 8.459 20.583 0.557 1.00 0.00 C ATOM 912 C6 DC C 129 7.644 21.440 -0.094 1.00 0.00 C ATOM 0 H5' DC C 129 5.967 21.662 -4.147 1.00 0.00 H new ATOM 0 H5'' DC C 129 6.261 23.323 -4.621 1.00 0.00 H new ATOM 0 H4' DC C 129 4.382 23.337 -3.170 1.00 0.00 H new ATOM 0 H3' DC C 129 6.805 24.711 -2.445 1.00 0.00 H new ATOM 0 H2' DC C 129 7.112 24.000 -0.277 1.00 0.00 H new ATOM 0 H2'' DC C 129 5.562 24.723 0.106 1.00 0.00 H new ATOM 0 H1' DC C 129 4.554 22.688 0.250 1.00 0.00 H new ATOM 0 H41 DC C 129 9.671 18.890 2.085 1.00 0.00 H new ATOM 0 H42 DC C 129 8.366 18.630 3.247 1.00 0.00 H new ATOM 0 H5 DC C 129 9.461 20.389 0.203 1.00 0.00 H new ATOM 0 H6 DC C 129 7.996 21.939 -0.985 1.00 0.00 H new ATOM 924 P DA C 130 5.283 26.907 -1.544 1.00 0.00 P ATOM 925 OP1 DA C 130 4.480 27.893 -2.298 1.00 0.00 O ATOM 926 OP2 DA C 130 6.756 27.041 -1.503 1.00 0.00 O ATOM 927 O5' DA C 130 4.748 26.886 -0.022 1.00 0.00 O ATOM 928 C5' DA C 130 3.361 26.689 0.267 1.00 0.00 C ATOM 929 C4' DA C 130 3.090 26.706 1.779 1.00 0.00 C ATOM 930 O4' DA C 130 3.621 25.523 2.429 1.00 0.00 O ATOM 931 C3' DA C 130 3.727 27.937 2.437 1.00 0.00 C ATOM 932 O3' DA C 130 2.738 28.714 3.113 1.00 0.00 O ATOM 933 C2' DA C 130 4.738 27.394 3.420 1.00 0.00 C ATOM 934 C1' DA C 130 4.487 25.898 3.528 1.00 0.00 C ATOM 935 N9 DA C 130 5.741 25.128 3.492 1.00 0.00 N ATOM 936 C8 DA C 130 6.699 25.126 2.538 1.00 0.00 C ATOM 937 N7 DA C 130 7.701 24.329 2.755 1.00 0.00 N ATOM 938 C5 DA C 130 7.373 23.741 3.975 1.00 0.00 C ATOM 939 C6 DA C 130 8.020 22.792 4.772 1.00 0.00 C ATOM 940 N6 DA C 130 9.193 22.247 4.445 1.00 0.00 N ATOM 941 N1 DA C 130 7.418 22.429 5.919 1.00 0.00 N ATOM 942 C2 DA C 130 6.248 22.972 6.262 1.00 0.00 C ATOM 943 N3 DA C 130 5.552 23.881 5.579 1.00 0.00 N ATOM 944 C4 DA C 130 6.181 24.221 4.435 1.00 0.00 C ATOM 0 H5' DA C 130 3.033 25.737 -0.151 1.00 0.00 H new ATOM 0 H5'' DA C 130 2.774 27.469 -0.217 1.00 0.00 H new ATOM 0 H4' DA C 130 2.007 26.734 1.900 1.00 0.00 H new ATOM 0 H3' DA C 130 4.192 28.592 1.700 1.00 0.00 H new ATOM 0 H2' DA C 130 5.754 27.592 3.078 1.00 0.00 H new ATOM 0 H2'' DA C 130 4.629 27.875 4.392 1.00 0.00 H new ATOM 0 H1' DA C 130 4.017 25.672 4.485 1.00 0.00 H new ATOM 0 H8 DA C 130 6.635 25.745 1.655 1.00 0.00 H new ATOM 0 H61 DA C 130 9.625 21.558 5.061 1.00 0.00 H new ATOM 0 H62 DA C 130 9.658 22.519 3.579 1.00 0.00 H new ATOM 0 H2 DA C 130 5.818 22.638 7.195 1.00 0.00 H new ATOM 956 P DA C 131 3.146 30.063 3.888 1.00 0.00 P ATOM 957 OP1 DA C 131 1.958 30.944 3.929 1.00 0.00 O ATOM 958 OP2 DA C 131 4.416 30.562 3.314 1.00 0.00 O ATOM 959 O5' DA C 131 3.441 29.535 5.383 1.00 0.00 O ATOM 960 C5' DA C 131 2.392 28.921 6.136 1.00 0.00 C ATOM 961 C4' DA C 131 2.856 28.483 7.532 1.00 0.00 C ATOM 962 O4' DA C 131 3.755 27.350 7.452 1.00 0.00 O ATOM 963 C3' DA C 131 3.582 29.616 8.267 1.00 0.00 C ATOM 964 O3' DA C 131 2.929 29.919 9.503 1.00 0.00 O ATOM 965 C2' DA C 131 4.973 29.096 8.538 1.00 0.00 C ATOM 966 C1' DA C 131 4.970 27.616 8.191 1.00 0.00 C ATOM 967 N9 DA C 131 6.156 27.240 7.406 1.00 0.00 N ATOM 968 C8 DA C 131 6.601 27.782 6.254 1.00 0.00 C ATOM 969 N7 DA C 131 7.669 27.232 5.752 1.00 0.00 N ATOM 970 C5 DA C 131 7.961 26.226 6.673 1.00 0.00 C ATOM 971 C6 DA C 131 8.980 25.263 6.741 1.00 0.00 C ATOM 972 N6 DA C 131 9.938 25.151 5.820 1.00 0.00 N ATOM 973 N1 DA C 131 8.974 24.424 7.795 1.00 0.00 N ATOM 974 C2 DA C 131 8.020 24.526 8.724 1.00 0.00 C ATOM 975 N3 DA C 131 7.013 25.397 8.751 1.00 0.00 N ATOM 976 C4 DA C 131 7.046 26.224 7.687 1.00 0.00 C ATOM 0 H5' DA C 131 2.017 28.054 5.592 1.00 0.00 H new ATOM 0 H5'' DA C 131 1.561 29.620 6.234 1.00 0.00 H new ATOM 0 H4' DA C 131 1.957 28.208 8.083 1.00 0.00 H new ATOM 0 H3' DA C 131 3.591 30.531 7.675 1.00 0.00 H new ATOM 0 H2' DA C 131 5.709 29.631 7.938 1.00 0.00 H new ATOM 0 H2'' DA C 131 5.244 29.247 9.583 1.00 0.00 H new ATOM 0 H1' DA C 131 5.005 27.019 9.103 1.00 0.00 H new ATOM 0 H8 DA C 131 6.105 28.616 5.780 1.00 0.00 H new ATOM 0 H61 DA C 131 10.656 24.433 5.916 1.00 0.00 H new ATOM 0 H62 DA C 131 9.952 25.783 5.020 1.00 0.00 H new ATOM 0 H2 DA C 131 8.071 23.825 9.544 1.00 0.00 H new ATOM 988 P DC C 132 3.498 31.077 10.470 1.00 0.00 P ATOM 989 OP1 DC C 132 2.380 31.580 11.296 1.00 0.00 O ATOM 990 OP2 DC C 132 4.291 32.019 9.648 1.00 0.00 O ATOM 991 O5' DC C 132 4.514 30.271 11.432 1.00 0.00 O ATOM 992 C5' DC C 132 4.037 29.179 12.226 1.00 0.00 C ATOM 993 C4' DC C 132 5.161 28.478 13.003 1.00 0.00 C ATOM 994 O4' DC C 132 6.018 27.724 12.115 1.00 0.00 O ATOM 995 C3' DC C 132 6.039 29.468 13.780 1.00 0.00 C ATOM 996 O3' DC C 132 5.821 29.342 15.188 1.00 0.00 O ATOM 997 C2' DC C 132 7.467 29.092 13.440 1.00 0.00 C ATOM 998 C1' DC C 132 7.402 27.915 12.482 1.00 0.00 C ATOM 999 N1 DC C 132 8.248 28.160 11.283 1.00 0.00 N ATOM 1000 C2 DC C 132 9.355 27.344 11.069 1.00 0.00 C ATOM 1001 O2 DC C 132 9.614 26.440 11.859 1.00 0.00 O ATOM 1002 N3 DC C 132 10.131 27.581 9.974 1.00 0.00 N ATOM 1003 C4 DC C 132 9.832 28.571 9.122 1.00 0.00 C ATOM 1004 N4 DC C 132 10.606 28.773 8.057 1.00 0.00 N ATOM 1005 C5 DC C 132 8.695 29.407 9.338 1.00 0.00 C ATOM 1006 C6 DC C 132 7.940 29.164 10.427 1.00 0.00 C ATOM 0 H5' DC C 132 3.541 28.455 11.580 1.00 0.00 H new ATOM 0 H5'' DC C 132 3.288 29.545 12.929 1.00 0.00 H new ATOM 0 H4' DC C 132 4.664 27.812 13.708 1.00 0.00 H new ATOM 0 H3' DC C 132 5.810 30.500 13.513 1.00 0.00 H new ATOM 0 H2' DC C 132 7.988 29.933 12.983 1.00 0.00 H new ATOM 0 H2'' DC C 132 8.020 28.826 14.341 1.00 0.00 H new ATOM 0 HO3' DC C 132 6.391 29.980 15.666 1.00 0.00 H new ATOM 0 H1' DC C 132 7.788 27.015 12.961 1.00 0.00 H new ATOM 0 H41 DC C 132 10.387 29.524 7.402 1.00 0.00 H new ATOM 0 H42 DC C 132 11.418 28.177 7.896 1.00 0.00 H new ATOM 0 H5 DC C 132 8.449 30.205 8.653 1.00 0.00 H new ATOM 0 H6 DC C 132 7.074 29.780 10.621 1.00 0.00 H new TER 1019 DC C 132 ATOM 1020 N LYS A 1 -4.125 13.385 10.264 1.00 0.00 N ATOM 1021 CA LYS A 1 -4.796 12.859 11.487 1.00 0.00 C ATOM 1022 C LYS A 1 -5.281 11.429 11.229 1.00 0.00 C ATOM 1023 O LYS A 1 -6.322 11.221 10.641 1.00 0.00 O ATOM 1024 CB LYS A 1 -6.000 13.739 11.826 1.00 0.00 C ATOM 1025 CG LYS A 1 -6.579 13.305 13.172 1.00 0.00 C ATOM 1026 CD LYS A 1 -7.837 14.121 13.473 1.00 0.00 C ATOM 1027 CE LYS A 1 -8.422 13.678 14.816 1.00 0.00 C ATOM 1028 NZ LYS A 1 -9.144 12.387 14.634 1.00 0.00 N ATOM 0 H1 LYS A 1 -3.122 13.566 10.469 1.00 0.00 H new ATOM 0 H2 LYS A 1 -4.201 12.686 9.498 1.00 0.00 H new ATOM 0 H3 LYS A 1 -4.583 14.271 9.970 1.00 0.00 H new ATOM 0 HA LYS A 1 -4.089 12.865 12.317 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -5.700 14.786 11.867 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -6.758 13.655 11.047 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -6.819 12.242 13.151 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -5.841 13.450 13.961 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -7.596 15.184 13.502 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -8.572 13.982 12.680 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -7.627 13.563 15.552 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -9.103 14.438 15.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -9.936 12.334 15.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -9.510 12.328 13.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -8.491 11.596 14.806 1.00 0.00 H new ATOM 1044 N ARG A 2 -4.539 10.442 11.666 1.00 0.00 N ATOM 1045 CA ARG A 2 -4.964 9.025 11.447 1.00 0.00 C ATOM 1046 C ARG A 2 -5.616 8.476 12.720 1.00 0.00 C ATOM 1047 O ARG A 2 -6.205 7.413 12.715 1.00 0.00 O ATOM 1048 CB ARG A 2 -3.740 8.179 11.106 1.00 0.00 C ATOM 1049 CG ARG A 2 -4.190 6.741 10.798 1.00 0.00 C ATOM 1050 CD ARG A 2 -3.145 6.045 9.931 1.00 0.00 C ATOM 1051 NE ARG A 2 -1.882 5.859 10.701 1.00 0.00 N ATOM 1052 CZ ARG A 2 -0.974 5.019 10.276 1.00 0.00 C ATOM 1053 NH1 ARG A 2 -1.178 4.327 9.188 1.00 0.00 N ATOM 1054 NH2 ARG A 2 0.139 4.869 10.941 1.00 0.00 N ATOM 0 H ARG A 2 -3.657 10.556 12.165 1.00 0.00 H new ATOM 0 HA ARG A 2 -5.682 8.987 10.628 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -3.219 8.602 10.247 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -3.037 8.182 11.939 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -4.332 6.188 11.727 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -5.151 6.753 10.285 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -3.523 5.078 9.598 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -2.951 6.637 9.036 1.00 0.00 H new ATOM 0 HE ARG A 2 -1.726 6.387 11.560 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -2.047 4.441 8.667 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -0.468 3.673 8.859 1.00 0.00 H new ATOM 0 HH21 ARG A 2 0.301 5.407 11.792 1.00 0.00 H new ATOM 0 HH22 ARG A 2 0.847 4.214 10.609 1.00 0.00 H new ATOM 1068 N ALA A 3 -5.508 9.184 13.813 1.00 0.00 N ATOM 1069 CA ALA A 3 -6.109 8.691 15.088 1.00 0.00 C ATOM 1070 C ALA A 3 -7.638 8.763 15.030 1.00 0.00 C ATOM 1071 O ALA A 3 -8.216 9.821 14.873 1.00 0.00 O ATOM 1072 CB ALA A 3 -5.615 9.559 16.247 1.00 0.00 C ATOM 0 H ALA A 3 -5.030 10.082 13.879 1.00 0.00 H new ATOM 0 HA ALA A 3 -5.809 7.653 15.235 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -6.051 9.203 17.180 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -4.528 9.500 16.309 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -5.913 10.594 16.079 1.00 0.00 H new ATOM 1078 N GLY A 4 -8.296 7.645 15.171 1.00 0.00 N ATOM 1079 CA GLY A 4 -9.785 7.641 15.142 1.00 0.00 C ATOM 1080 C GLY A 4 -10.280 7.707 13.699 1.00 0.00 C ATOM 1081 O GLY A 4 -11.431 7.440 13.419 1.00 0.00 O ATOM 0 H GLY A 4 -7.864 6.731 15.306 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.164 6.740 15.624 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -10.170 8.490 15.706 1.00 0.00 H new ATOM 1085 N THR A 5 -9.432 8.079 12.782 1.00 0.00 N ATOM 1086 CA THR A 5 -9.881 8.184 11.366 1.00 0.00 C ATOM 1087 C THR A 5 -10.316 6.823 10.839 1.00 0.00 C ATOM 1088 O THR A 5 -9.532 5.898 10.752 1.00 0.00 O ATOM 1089 CB THR A 5 -8.739 8.702 10.490 1.00 0.00 C ATOM 1090 OG1 THR A 5 -8.043 9.725 11.187 1.00 0.00 O ATOM 1091 CG2 THR A 5 -9.309 9.266 9.179 1.00 0.00 C ATOM 0 H THR A 5 -8.454 8.314 12.950 1.00 0.00 H new ATOM 0 HA THR A 5 -10.723 8.875 11.331 1.00 0.00 H new ATOM 0 HB THR A 5 -8.055 7.885 10.260 1.00 0.00 H new ATOM 0 HG1 THR A 5 -7.421 10.172 10.576 1.00 0.00 H new ATOM 0 HG21 THR A 5 -8.494 9.634 8.557 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.845 8.480 8.647 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.993 10.084 9.402 1.00 0.00 H new ATOM 1099 N VAL A 6 -11.552 6.722 10.434 1.00 0.00 N ATOM 1100 CA VAL A 6 -12.070 5.459 9.838 1.00 0.00 C ATOM 1101 C VAL A 6 -12.561 5.826 8.448 1.00 0.00 C ATOM 1102 O VAL A 6 -13.129 6.883 8.251 1.00 0.00 O ATOM 1103 CB VAL A 6 -13.226 4.901 10.669 1.00 0.00 C ATOM 1104 CG1 VAL A 6 -12.700 4.450 12.031 1.00 0.00 C ATOM 1105 CG2 VAL A 6 -14.290 5.986 10.859 1.00 0.00 C ATOM 0 H VAL A 6 -12.237 7.476 10.492 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.296 4.692 9.808 1.00 0.00 H new ATOM 0 HB VAL A 6 -13.670 4.050 10.153 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -13.523 4.052 12.625 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -11.945 3.676 11.891 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -12.256 5.300 12.549 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -15.114 5.588 11.451 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -13.851 6.840 11.375 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -14.663 6.304 9.886 1.00 0.00 H new ATOM 1115 N CYS A 7 -12.345 5.001 7.479 1.00 0.00 N ATOM 1116 CA CYS A 7 -12.798 5.353 6.114 1.00 0.00 C ATOM 1117 C CYS A 7 -14.314 5.484 6.075 1.00 0.00 C ATOM 1118 O CYS A 7 -15.041 4.544 6.313 1.00 0.00 O ATOM 1119 CB CYS A 7 -12.343 4.266 5.162 1.00 0.00 C ATOM 1120 SG CYS A 7 -12.825 4.686 3.472 1.00 0.00 S ATOM 0 H CYS A 7 -11.876 4.100 7.568 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.369 6.310 5.819 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -11.261 4.148 5.222 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -12.784 3.311 5.449 1.00 0.00 H new ATOM 1125 N SER A 8 -14.797 6.648 5.776 1.00 0.00 N ATOM 1126 CA SER A 8 -16.263 6.842 5.718 1.00 0.00 C ATOM 1127 C SER A 8 -16.872 5.916 4.662 1.00 0.00 C ATOM 1128 O SER A 8 -17.942 5.372 4.849 1.00 0.00 O ATOM 1129 CB SER A 8 -16.566 8.290 5.348 1.00 0.00 C ATOM 1130 OG SER A 8 -16.215 9.135 6.434 1.00 0.00 O ATOM 0 H SER A 8 -14.239 7.476 5.569 1.00 0.00 H new ATOM 0 HA SER A 8 -16.693 6.609 6.692 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.008 8.574 4.456 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.624 8.403 5.111 1.00 0.00 H new ATOM 0 HG SER A 8 -15.245 9.273 6.441 1.00 0.00 H new ATOM 1136 N ASN A 9 -16.220 5.751 3.534 1.00 0.00 N ATOM 1137 CA ASN A 9 -16.809 4.881 2.477 1.00 0.00 C ATOM 1138 C ASN A 9 -16.695 3.396 2.838 1.00 0.00 C ATOM 1139 O ASN A 9 -17.599 2.636 2.548 1.00 0.00 O ATOM 1140 CB ASN A 9 -16.079 5.115 1.149 1.00 0.00 C ATOM 1141 CG ASN A 9 -16.423 6.497 0.595 1.00 0.00 C ATOM 1142 OD1 ASN A 9 -17.309 7.236 1.203 1.00 0.00 O flip ATOM 1143 ND2 ASN A 9 -15.878 6.908 -0.410 1.00 0.00 N flip ATOM 0 H ASN A 9 -15.321 6.175 3.306 1.00 0.00 H new ATOM 0 HA ASN A 9 -17.864 5.141 2.389 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -15.002 5.032 1.298 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -16.361 4.346 0.430 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -15.185 6.331 -0.887 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -16.114 7.830 -0.777 1.00 0.00 H new ATOM 1150 N CYS A 10 -15.595 2.945 3.424 1.00 0.00 N ATOM 1151 CA CYS A 10 -15.474 1.474 3.730 1.00 0.00 C ATOM 1152 C CYS A 10 -14.966 1.208 5.159 1.00 0.00 C ATOM 1153 O CYS A 10 -14.576 0.104 5.483 1.00 0.00 O ATOM 1154 CB CYS A 10 -14.561 0.805 2.686 1.00 0.00 C ATOM 1155 SG CYS A 10 -12.814 1.026 3.107 1.00 0.00 S ATOM 0 H CYS A 10 -14.797 3.518 3.696 1.00 0.00 H new ATOM 0 HA CYS A 10 -16.471 1.038 3.674 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -14.792 -0.259 2.626 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -14.757 1.230 1.702 1.00 0.00 H new ATOM 1160 N GLN A 11 -15.019 2.179 6.035 1.00 0.00 N ATOM 1161 CA GLN A 11 -14.603 1.964 7.461 1.00 0.00 C ATOM 1162 C GLN A 11 -13.207 1.332 7.622 1.00 0.00 C ATOM 1163 O GLN A 11 -12.742 1.163 8.731 1.00 0.00 O ATOM 1164 CB GLN A 11 -15.658 1.078 8.139 1.00 0.00 C ATOM 1165 CG GLN A 11 -15.270 0.805 9.599 1.00 0.00 C ATOM 1166 CD GLN A 11 -16.498 0.329 10.380 1.00 0.00 C ATOM 1167 OE1 GLN A 11 -17.610 0.714 10.081 1.00 0.00 O ATOM 1168 NE2 GLN A 11 -16.342 -0.503 11.373 1.00 0.00 N ATOM 0 H GLN A 11 -15.336 3.125 5.823 1.00 0.00 H new ATOM 0 HA GLN A 11 -14.535 2.945 7.931 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -16.632 1.567 8.100 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -15.752 0.136 7.599 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -14.485 0.050 9.641 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -14.867 1.710 10.053 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -15.408 -0.827 11.625 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -17.154 -0.829 11.897 1.00 0.00 H new ATOM 1177 N THR A 12 -12.500 1.003 6.575 1.00 0.00 N ATOM 1178 CA THR A 12 -11.144 0.414 6.807 1.00 0.00 C ATOM 1179 C THR A 12 -10.330 1.412 7.644 1.00 0.00 C ATOM 1180 O THR A 12 -10.474 2.607 7.480 1.00 0.00 O ATOM 1181 CB THR A 12 -10.428 0.136 5.479 1.00 0.00 C ATOM 1182 OG1 THR A 12 -9.232 -0.584 5.740 1.00 0.00 O ATOM 1183 CG2 THR A 12 -10.088 1.445 4.775 1.00 0.00 C ATOM 0 H THR A 12 -12.786 1.110 5.602 1.00 0.00 H new ATOM 0 HA THR A 12 -11.244 -0.536 7.331 1.00 0.00 H new ATOM 0 HB THR A 12 -11.084 -0.448 4.834 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.769 -0.767 4.896 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.580 1.231 3.834 1.00 0.00 H new ATOM 0 HG22 THR A 12 -11.005 1.999 4.575 1.00 0.00 H new ATOM 0 HG23 THR A 12 -9.435 2.042 5.412 1.00 0.00 H new ATOM 1191 N SER A 13 -9.471 0.942 8.534 1.00 0.00 N ATOM 1192 CA SER A 13 -8.647 1.896 9.372 1.00 0.00 C ATOM 1193 C SER A 13 -7.200 1.866 8.883 1.00 0.00 C ATOM 1194 O SER A 13 -6.387 2.691 9.254 1.00 0.00 O ATOM 1195 CB SER A 13 -8.720 1.507 10.850 1.00 0.00 C ATOM 1196 OG SER A 13 -8.091 0.244 11.030 1.00 0.00 O ATOM 0 H SER A 13 -9.305 -0.048 8.716 1.00 0.00 H new ATOM 0 HA SER A 13 -9.044 2.906 9.269 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.228 2.263 11.463 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.759 1.459 11.176 1.00 0.00 H new ATOM 0 HG SER A 13 -8.133 -0.010 11.975 1.00 0.00 H new ATOM 1202 N THR A 14 -6.881 0.939 8.023 1.00 0.00 N ATOM 1203 CA THR A 14 -5.501 0.867 7.468 1.00 0.00 C ATOM 1204 C THR A 14 -5.525 1.545 6.107 1.00 0.00 C ATOM 1205 O THR A 14 -6.239 1.131 5.215 1.00 0.00 O ATOM 1206 CB THR A 14 -5.094 -0.595 7.298 1.00 0.00 C ATOM 1207 OG1 THR A 14 -5.917 -1.203 6.312 1.00 0.00 O ATOM 1208 CG2 THR A 14 -5.262 -1.324 8.630 1.00 0.00 C ATOM 0 H THR A 14 -7.522 0.224 7.679 1.00 0.00 H new ATOM 0 HA THR A 14 -4.790 1.354 8.135 1.00 0.00 H new ATOM 0 HB THR A 14 -4.052 -0.652 6.983 1.00 0.00 H new ATOM 0 HG1 THR A 14 -5.965 -2.168 6.476 1.00 0.00 H new ATOM 0 HG21 THR A 14 -4.972 -2.368 8.512 1.00 0.00 H new ATOM 0 HG22 THR A 14 -4.630 -0.855 9.384 1.00 0.00 H new ATOM 0 HG23 THR A 14 -6.304 -1.270 8.946 1.00 0.00 H new ATOM 1216 N THR A 15 -4.764 2.587 5.932 1.00 0.00 N ATOM 1217 CA THR A 15 -4.768 3.291 4.614 1.00 0.00 C ATOM 1218 C THR A 15 -3.375 3.814 4.315 1.00 0.00 C ATOM 1219 O THR A 15 -2.635 4.180 5.205 1.00 0.00 O ATOM 1220 CB THR A 15 -5.714 4.495 4.674 1.00 0.00 C ATOM 1221 OG1 THR A 15 -5.036 5.593 5.265 1.00 0.00 O ATOM 1222 CG2 THR A 15 -6.926 4.157 5.529 1.00 0.00 C ATOM 0 H THR A 15 -4.142 2.982 6.637 1.00 0.00 H new ATOM 0 HA THR A 15 -5.090 2.590 3.844 1.00 0.00 H new ATOM 0 HB THR A 15 -6.035 4.747 3.663 1.00 0.00 H new ATOM 0 HG1 THR A 15 -5.605 5.996 5.954 1.00 0.00 H new ATOM 0 HG21 THR A 15 -7.595 5.017 5.568 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.452 3.307 5.094 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.600 3.905 6.538 1.00 0.00 H new ATOM 1230 N THR A 16 -3.019 3.885 3.069 1.00 0.00 N ATOM 1231 CA THR A 16 -1.684 4.422 2.722 1.00 0.00 C ATOM 1232 C THR A 16 -1.755 5.948 2.818 1.00 0.00 C ATOM 1233 O THR A 16 -0.841 6.595 3.289 1.00 0.00 O ATOM 1234 CB THR A 16 -1.302 4.004 1.299 1.00 0.00 C ATOM 1235 OG1 THR A 16 -2.134 4.685 0.369 1.00 0.00 O ATOM 1236 CG2 THR A 16 -1.459 2.487 1.108 1.00 0.00 C ATOM 0 H THR A 16 -3.594 3.595 2.278 1.00 0.00 H new ATOM 0 HA THR A 16 -0.929 4.032 3.405 1.00 0.00 H new ATOM 0 HB THR A 16 -0.257 4.266 1.131 1.00 0.00 H new ATOM 0 HG1 THR A 16 -2.254 4.130 -0.430 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.181 2.218 0.089 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.812 1.963 1.811 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.496 2.203 1.288 1.00 0.00 H new ATOM 1244 N LEU A 17 -2.855 6.531 2.393 1.00 0.00 N ATOM 1245 CA LEU A 17 -3.003 8.019 2.483 1.00 0.00 C ATOM 1246 C LEU A 17 -4.488 8.353 2.709 1.00 0.00 C ATOM 1247 O LEU A 17 -5.356 7.863 2.014 1.00 0.00 O ATOM 1248 CB LEU A 17 -2.499 8.689 1.181 1.00 0.00 C ATOM 1249 CG LEU A 17 -1.879 10.064 1.487 1.00 0.00 C ATOM 1250 CD1 LEU A 17 -0.427 9.891 1.957 1.00 0.00 C ATOM 1251 CD2 LEU A 17 -1.895 10.918 0.215 1.00 0.00 C ATOM 0 H LEU A 17 -3.653 6.041 1.989 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.407 8.398 3.314 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.760 8.049 0.699 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.326 8.804 0.481 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.457 10.551 2.272 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.005 10.869 2.172 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.407 9.280 2.859 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.153 9.402 1.174 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.457 11.893 0.426 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -1.317 10.421 -0.564 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.923 11.048 -0.123 1.00 0.00 H new ATOM 1263 N TRP A 18 -4.785 9.189 3.667 1.00 0.00 N ATOM 1264 CA TRP A 18 -6.203 9.567 3.930 1.00 0.00 C ATOM 1265 C TRP A 18 -6.621 10.652 2.924 1.00 0.00 C ATOM 1266 O TRP A 18 -5.925 11.631 2.741 1.00 0.00 O ATOM 1267 CB TRP A 18 -6.300 10.134 5.348 1.00 0.00 C ATOM 1268 CG TRP A 18 -6.160 9.018 6.340 1.00 0.00 C ATOM 1269 CD1 TRP A 18 -5.066 8.790 7.101 1.00 0.00 C ATOM 1270 CD2 TRP A 18 -7.120 7.975 6.682 1.00 0.00 C ATOM 1271 NE1 TRP A 18 -5.293 7.674 7.889 1.00 0.00 N ATOM 1272 CE2 TRP A 18 -6.545 7.138 7.669 1.00 0.00 C ATOM 1273 CE3 TRP A 18 -8.422 7.674 6.240 1.00 0.00 C ATOM 1274 CZ2 TRP A 18 -7.234 6.045 8.197 1.00 0.00 C ATOM 1275 CZ3 TRP A 18 -9.116 6.574 6.771 1.00 0.00 C ATOM 1276 CH2 TRP A 18 -8.524 5.765 7.744 1.00 0.00 C ATOM 0 H TRP A 18 -4.101 9.629 4.283 1.00 0.00 H new ATOM 0 HA TRP A 18 -6.853 8.698 3.829 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -5.520 10.878 5.508 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.256 10.640 5.485 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.162 9.382 7.095 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -4.617 7.294 8.552 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -8.890 8.292 5.488 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -6.773 5.422 8.949 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -10.115 6.352 6.424 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -9.065 4.922 8.146 1.00 0.00 H new ATOM 1287 N ARG A 19 -7.743 10.485 2.262 1.00 0.00 N ATOM 1288 CA ARG A 19 -8.198 11.505 1.254 1.00 0.00 C ATOM 1289 C ARG A 19 -9.509 12.148 1.726 1.00 0.00 C ATOM 1290 O ARG A 19 -10.493 11.467 1.910 1.00 0.00 O ATOM 1291 CB ARG A 19 -8.472 10.804 -0.097 1.00 0.00 C ATOM 1292 CG ARG A 19 -7.374 9.790 -0.420 1.00 0.00 C ATOM 1293 CD ARG A 19 -6.090 10.515 -0.806 1.00 0.00 C ATOM 1294 NE ARG A 19 -5.055 9.501 -1.140 1.00 0.00 N ATOM 1295 CZ ARG A 19 -3.961 9.838 -1.767 1.00 0.00 C ATOM 1296 NH1 ARG A 19 -3.751 11.070 -2.139 1.00 0.00 N ATOM 1297 NH2 ARG A 19 -3.070 8.927 -2.016 1.00 0.00 N ATOM 0 H ARG A 19 -8.366 9.685 2.375 1.00 0.00 H new ATOM 0 HA ARG A 19 -7.422 12.263 1.143 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -9.438 10.300 -0.060 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -8.530 11.548 -0.892 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -7.194 9.150 0.443 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -7.695 9.142 -1.236 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -6.267 11.170 -1.659 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -5.750 11.146 0.015 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.202 8.527 -0.875 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.448 11.788 -1.941 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -2.890 11.315 -2.628 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.230 7.963 -1.722 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.210 9.175 -2.505 1.00 0.00 H new ATOM 1311 N ARG A 20 -9.567 13.439 1.904 1.00 0.00 N ATOM 1312 CA ARG A 20 -10.865 14.037 2.329 1.00 0.00 C ATOM 1313 C ARG A 20 -11.822 13.902 1.139 1.00 0.00 C ATOM 1314 O ARG A 20 -11.420 14.054 0.004 1.00 0.00 O ATOM 1315 CB ARG A 20 -10.669 15.516 2.692 1.00 0.00 C ATOM 1316 CG ARG A 20 -11.951 16.077 3.336 1.00 0.00 C ATOM 1317 CD ARG A 20 -12.138 15.548 4.783 1.00 0.00 C ATOM 1318 NE ARG A 20 -12.370 16.695 5.729 1.00 0.00 N ATOM 1319 CZ ARG A 20 -11.533 17.699 5.816 1.00 0.00 C ATOM 1320 NH1 ARG A 20 -10.412 17.684 5.148 1.00 0.00 N ATOM 1321 NH2 ARG A 20 -11.808 18.709 6.597 1.00 0.00 N ATOM 0 H ARG A 20 -8.794 14.092 1.778 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.264 13.531 3.209 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -9.831 15.622 3.381 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -10.421 16.088 1.798 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -11.907 17.166 3.348 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -12.815 15.800 2.732 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -12.982 14.860 4.820 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -11.255 14.987 5.090 1.00 0.00 H new ATOM 0 HE ARG A 20 -13.202 16.691 6.319 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -10.183 16.887 4.554 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -9.765 18.469 5.220 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -12.673 18.715 7.138 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -11.158 19.492 6.666 1.00 0.00 H new ATOM 1335 N SER A 21 -13.077 13.604 1.372 1.00 0.00 N ATOM 1336 CA SER A 21 -14.031 13.446 0.220 1.00 0.00 C ATOM 1337 C SER A 21 -14.688 14.798 -0.096 1.00 0.00 C ATOM 1338 O SER A 21 -14.739 15.671 0.741 1.00 0.00 O ATOM 1339 CB SER A 21 -15.105 12.405 0.580 1.00 0.00 C ATOM 1340 OG SER A 21 -16.375 12.825 0.091 1.00 0.00 O ATOM 0 H SER A 21 -13.483 13.464 2.297 1.00 0.00 H new ATOM 0 HA SER A 21 -13.486 13.104 -0.660 1.00 0.00 H new ATOM 0 HB2 SER A 21 -14.843 11.437 0.152 1.00 0.00 H new ATOM 0 HB3 SER A 21 -15.148 12.274 1.661 1.00 0.00 H new ATOM 0 HG SER A 21 -17.052 12.156 0.323 1.00 0.00 H new ATOM 1346 N PRO A 22 -15.182 14.976 -1.304 1.00 0.00 N ATOM 1347 CA PRO A 22 -15.837 16.258 -1.687 1.00 0.00 C ATOM 1348 C PRO A 22 -16.911 16.697 -0.675 1.00 0.00 C ATOM 1349 O PRO A 22 -17.267 17.856 -0.597 1.00 0.00 O ATOM 1350 CB PRO A 22 -16.463 15.916 -3.060 1.00 0.00 C ATOM 1351 CG PRO A 22 -16.097 14.460 -3.419 1.00 0.00 C ATOM 1352 CD PRO A 22 -15.115 13.932 -2.367 1.00 0.00 C ATOM 0 HA PRO A 22 -15.140 17.096 -1.715 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -17.546 16.036 -3.022 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -16.093 16.599 -3.825 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -16.993 13.840 -3.446 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -15.649 14.416 -4.412 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -15.411 12.952 -1.992 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -14.107 13.828 -2.770 1.00 0.00 H new ATOM 1360 N MET A 23 -17.432 15.773 0.095 1.00 0.00 N ATOM 1361 CA MET A 23 -18.486 16.120 1.095 1.00 0.00 C ATOM 1362 C MET A 23 -17.830 16.339 2.465 1.00 0.00 C ATOM 1363 O MET A 23 -18.434 16.850 3.387 1.00 0.00 O ATOM 1364 CB MET A 23 -19.494 14.965 1.168 1.00 0.00 C ATOM 1365 CG MET A 23 -20.740 15.402 1.937 1.00 0.00 C ATOM 1366 SD MET A 23 -21.680 16.588 0.944 1.00 0.00 S ATOM 1367 CE MET A 23 -22.389 17.527 2.319 1.00 0.00 C ATOM 0 H MET A 23 -17.170 14.788 0.072 1.00 0.00 H new ATOM 0 HA MET A 23 -19.003 17.034 0.801 1.00 0.00 H new ATOM 0 HB2 MET A 23 -19.770 14.649 0.162 1.00 0.00 H new ATOM 0 HB3 MET A 23 -19.038 14.105 1.658 1.00 0.00 H new ATOM 0 HG2 MET A 23 -21.359 14.535 2.169 1.00 0.00 H new ATOM 0 HG3 MET A 23 -20.454 15.853 2.887 1.00 0.00 H new ATOM 0 HE1 MET A 23 -23.018 18.326 1.928 1.00 0.00 H new ATOM 0 HE2 MET A 23 -22.990 16.864 2.941 1.00 0.00 H new ATOM 0 HE3 MET A 23 -21.586 17.957 2.918 1.00 0.00 H new ATOM 1377 N GLY A 24 -16.585 15.965 2.603 1.00 0.00 N ATOM 1378 CA GLY A 24 -15.874 16.152 3.904 1.00 0.00 C ATOM 1379 C GLY A 24 -15.950 14.863 4.722 1.00 0.00 C ATOM 1380 O GLY A 24 -15.905 14.885 5.937 1.00 0.00 O ATOM 0 H GLY A 24 -16.026 15.535 1.866 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.833 16.420 3.725 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.324 16.974 4.460 1.00 0.00 H new ATOM 1384 N ASP A 25 -16.067 13.737 4.070 1.00 0.00 N ATOM 1385 CA ASP A 25 -16.148 12.434 4.791 1.00 0.00 C ATOM 1386 C ASP A 25 -14.793 11.696 4.661 1.00 0.00 C ATOM 1387 O ASP A 25 -14.446 11.255 3.587 1.00 0.00 O ATOM 1388 CB ASP A 25 -17.237 11.601 4.109 1.00 0.00 C ATOM 1389 CG ASP A 25 -18.568 12.349 4.195 1.00 0.00 C ATOM 1390 OD1 ASP A 25 -18.587 13.419 4.780 1.00 0.00 O ATOM 1391 OD2 ASP A 25 -19.547 11.840 3.673 1.00 0.00 O ATOM 0 H ASP A 25 -16.110 13.664 3.054 1.00 0.00 H new ATOM 0 HA ASP A 25 -16.375 12.587 5.846 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -16.974 11.420 3.067 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -17.322 10.627 4.590 1.00 0.00 H new ATOM 1396 N PRO A 26 -14.013 11.557 5.718 1.00 0.00 N ATOM 1397 CA PRO A 26 -12.692 10.860 5.600 1.00 0.00 C ATOM 1398 C PRO A 26 -12.799 9.494 4.889 1.00 0.00 C ATOM 1399 O PRO A 26 -13.624 8.675 5.227 1.00 0.00 O ATOM 1400 CB PRO A 26 -12.276 10.712 7.076 1.00 0.00 C ATOM 1401 CG PRO A 26 -13.114 11.707 7.897 1.00 0.00 C ATOM 1402 CD PRO A 26 -14.365 12.060 7.079 1.00 0.00 C ATOM 0 HA PRO A 26 -11.972 11.406 4.990 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -12.446 9.692 7.421 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -11.212 10.917 7.196 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -13.396 11.269 8.855 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -12.535 12.604 8.115 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -15.258 11.574 7.473 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -14.560 13.132 7.078 1.00 0.00 H new ATOM 1410 N VAL A 27 -11.944 9.253 3.920 1.00 0.00 N ATOM 1411 CA VAL A 27 -11.962 7.934 3.185 1.00 0.00 C ATOM 1412 C VAL A 27 -10.535 7.388 3.049 1.00 0.00 C ATOM 1413 O VAL A 27 -9.573 8.118 3.177 1.00 0.00 O ATOM 1414 CB VAL A 27 -12.569 8.086 1.788 1.00 0.00 C ATOM 1415 CG1 VAL A 27 -14.080 8.302 1.901 1.00 0.00 C ATOM 1416 CG2 VAL A 27 -11.906 9.263 1.064 1.00 0.00 C ATOM 0 H VAL A 27 -11.232 9.911 3.603 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.574 7.242 3.763 1.00 0.00 H new ATOM 0 HB VAL A 27 -12.392 7.178 1.212 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.508 8.410 0.904 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.534 7.446 2.400 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -14.276 9.205 2.479 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.340 9.369 0.070 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.071 10.179 1.632 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -10.835 9.079 0.975 1.00 0.00 H new ATOM 1426 N CYS A 28 -10.380 6.109 2.774 1.00 0.00 N ATOM 1427 CA CYS A 28 -9.008 5.544 2.615 1.00 0.00 C ATOM 1428 C CYS A 28 -8.511 5.803 1.185 1.00 0.00 C ATOM 1429 O CYS A 28 -9.286 6.016 0.273 1.00 0.00 O ATOM 1430 CB CYS A 28 -8.992 4.037 2.955 1.00 0.00 C ATOM 1431 SG CYS A 28 -9.865 3.042 1.712 1.00 0.00 S ATOM 0 H CYS A 28 -11.142 5.442 2.655 1.00 0.00 H new ATOM 0 HA CYS A 28 -8.332 6.038 3.313 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -7.960 3.695 3.032 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -9.453 3.882 3.931 1.00 0.00 H new ATOM 1436 N ASN A 29 -7.221 5.821 1.001 1.00 0.00 N ATOM 1437 CA ASN A 29 -6.628 6.107 -0.347 1.00 0.00 C ATOM 1438 C ASN A 29 -7.328 5.324 -1.462 1.00 0.00 C ATOM 1439 O ASN A 29 -7.636 5.871 -2.504 1.00 0.00 O ATOM 1440 CB ASN A 29 -5.152 5.699 -0.317 1.00 0.00 C ATOM 1441 CG ASN A 29 -4.493 5.967 -1.674 1.00 0.00 C ATOM 1442 OD1 ASN A 29 -5.141 5.936 -2.700 1.00 0.00 O ATOM 1443 ND2 ASN A 29 -3.211 6.208 -1.724 1.00 0.00 N ATOM 0 H ASN A 29 -6.536 5.647 1.737 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.750 7.170 -0.556 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.631 6.254 0.463 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -5.066 4.642 -0.067 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.757 6.369 -2.623 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -2.663 6.235 -0.864 1.00 0.00 H new ATOM 1450 N ALA A 30 -7.556 4.063 -1.286 1.00 0.00 N ATOM 1451 CA ALA A 30 -8.203 3.284 -2.378 1.00 0.00 C ATOM 1452 C ALA A 30 -9.623 3.810 -2.667 1.00 0.00 C ATOM 1453 O ALA A 30 -9.969 4.059 -3.804 1.00 0.00 O ATOM 1454 CB ALA A 30 -8.250 1.815 -1.989 1.00 0.00 C ATOM 0 H ALA A 30 -7.327 3.535 -0.444 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.615 3.400 -3.289 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -8.723 1.242 -2.787 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -7.236 1.448 -1.831 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.825 1.700 -1.070 1.00 0.00 H new ATOM 1460 N CYS A 31 -10.455 3.973 -1.664 1.00 0.00 N ATOM 1461 CA CYS A 31 -11.846 4.474 -1.930 1.00 0.00 C ATOM 1462 C CYS A 31 -11.790 5.802 -2.680 1.00 0.00 C ATOM 1463 O CYS A 31 -12.536 6.040 -3.593 1.00 0.00 O ATOM 1464 CB CYS A 31 -12.593 4.720 -0.611 1.00 0.00 C ATOM 1465 SG CYS A 31 -13.181 3.166 0.087 1.00 0.00 S ATOM 0 H CYS A 31 -10.237 3.784 -0.686 1.00 0.00 H new ATOM 0 HA CYS A 31 -12.363 3.718 -2.521 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -11.932 5.217 0.100 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -13.436 5.389 -0.784 1.00 0.00 H new ATOM 1470 N GLY A 32 -10.927 6.678 -2.288 1.00 0.00 N ATOM 1471 CA GLY A 32 -10.872 7.994 -2.970 1.00 0.00 C ATOM 1472 C GLY A 32 -10.652 7.808 -4.470 1.00 0.00 C ATOM 1473 O GLY A 32 -11.333 8.400 -5.285 1.00 0.00 O ATOM 0 H GLY A 32 -10.258 6.546 -1.529 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.800 8.539 -2.797 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.066 8.595 -2.550 1.00 0.00 H new ATOM 1477 N LEU A 33 -9.698 7.008 -4.845 1.00 0.00 N ATOM 1478 CA LEU A 33 -9.426 6.802 -6.291 1.00 0.00 C ATOM 1479 C LEU A 33 -10.556 6.000 -6.945 1.00 0.00 C ATOM 1480 O LEU A 33 -11.101 6.400 -7.952 1.00 0.00 O ATOM 1481 CB LEU A 33 -8.105 6.049 -6.429 1.00 0.00 C ATOM 1482 CG LEU A 33 -7.000 6.846 -5.719 1.00 0.00 C ATOM 1483 CD1 LEU A 33 -5.691 6.046 -5.741 1.00 0.00 C ATOM 1484 CD2 LEU A 33 -6.807 8.212 -6.415 1.00 0.00 C ATOM 0 H LEU A 33 -9.093 6.486 -4.211 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.365 7.768 -6.793 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -8.191 5.054 -5.993 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.856 5.915 -7.482 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.289 7.021 -4.683 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.909 6.614 -5.237 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.837 5.095 -5.228 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.396 5.860 -6.774 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.022 8.772 -5.906 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.524 8.053 -7.455 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -7.739 8.776 -6.375 1.00 0.00 H new ATOM 1496 N TYR A 34 -10.914 4.871 -6.396 1.00 0.00 N ATOM 1497 CA TYR A 34 -12.004 4.066 -7.017 1.00 0.00 C ATOM 1498 C TYR A 34 -13.287 4.898 -7.051 1.00 0.00 C ATOM 1499 O TYR A 34 -14.012 4.900 -8.024 1.00 0.00 O ATOM 1500 CB TYR A 34 -12.232 2.795 -6.196 1.00 0.00 C ATOM 1501 CG TYR A 34 -13.332 1.972 -6.821 1.00 0.00 C ATOM 1502 CD1 TYR A 34 -14.660 2.170 -6.436 1.00 0.00 C ATOM 1503 CD2 TYR A 34 -13.020 1.003 -7.785 1.00 0.00 C ATOM 1504 CE1 TYR A 34 -15.678 1.404 -7.016 1.00 0.00 C ATOM 1505 CE2 TYR A 34 -14.038 0.236 -8.363 1.00 0.00 C ATOM 1506 CZ TYR A 34 -15.367 0.437 -7.978 1.00 0.00 C ATOM 1507 OH TYR A 34 -16.371 -0.317 -8.551 1.00 0.00 O ATOM 0 H TYR A 34 -10.503 4.474 -5.551 1.00 0.00 H new ATOM 0 HA TYR A 34 -11.724 3.789 -8.033 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -11.312 2.212 -6.148 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -12.498 3.056 -5.172 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -14.901 2.914 -5.691 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -11.993 0.848 -8.082 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -16.705 1.560 -6.720 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -13.797 -0.510 -9.106 1.00 0.00 H new ATOM 0 HH TYR A 34 -15.982 -0.940 -9.200 1.00 0.00 H new ATOM 1517 N TYR A 35 -13.565 5.606 -5.991 1.00 0.00 N ATOM 1518 CA TYR A 35 -14.794 6.444 -5.948 1.00 0.00 C ATOM 1519 C TYR A 35 -14.685 7.582 -6.971 1.00 0.00 C ATOM 1520 O TYR A 35 -15.577 7.834 -7.729 1.00 0.00 O ATOM 1521 CB TYR A 35 -14.962 7.040 -4.544 1.00 0.00 C ATOM 1522 CG TYR A 35 -16.381 7.517 -4.367 1.00 0.00 C ATOM 1523 CD1 TYR A 35 -17.366 6.635 -3.903 1.00 0.00 C ATOM 1524 CD2 TYR A 35 -16.707 8.840 -4.657 1.00 0.00 C ATOM 1525 CE1 TYR A 35 -18.681 7.081 -3.734 1.00 0.00 C ATOM 1526 CE2 TYR A 35 -18.020 9.292 -4.485 1.00 0.00 C ATOM 1527 CZ TYR A 35 -19.010 8.412 -4.024 1.00 0.00 C ATOM 1528 OH TYR A 35 -20.309 8.852 -3.856 1.00 0.00 O ATOM 0 H TYR A 35 -12.990 5.639 -5.149 1.00 0.00 H new ATOM 0 HA TYR A 35 -15.657 5.823 -6.188 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -14.722 6.292 -3.789 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -14.268 7.869 -4.404 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -17.110 5.611 -3.676 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -15.946 9.517 -5.015 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -19.442 6.401 -3.381 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -18.271 10.319 -4.707 1.00 0.00 H new ATOM 0 HH TYR A 35 -20.368 9.799 -4.100 1.00 0.00 H new ATOM 1538 N LYS A 36 -13.600 8.281 -7.000 1.00 0.00 N ATOM 1539 CA LYS A 36 -13.483 9.392 -7.986 1.00 0.00 C ATOM 1540 C LYS A 36 -13.615 8.841 -9.411 1.00 0.00 C ATOM 1541 O LYS A 36 -14.251 9.434 -10.260 1.00 0.00 O ATOM 1542 CB LYS A 36 -12.116 10.054 -7.812 1.00 0.00 C ATOM 1543 CG LYS A 36 -11.949 11.200 -8.814 1.00 0.00 C ATOM 1544 CD LYS A 36 -10.709 12.028 -8.452 1.00 0.00 C ATOM 1545 CE LYS A 36 -9.433 11.206 -8.680 1.00 0.00 C ATOM 1546 NZ LYS A 36 -8.242 12.096 -8.575 1.00 0.00 N ATOM 0 H LYS A 36 -12.792 8.141 -6.394 1.00 0.00 H new ATOM 0 HA LYS A 36 -14.275 10.122 -7.819 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.015 10.433 -6.795 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.326 9.317 -7.957 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.850 10.801 -9.824 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -12.836 11.834 -8.807 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -10.679 12.934 -9.058 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.765 12.343 -7.410 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -9.367 10.405 -7.944 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -9.462 10.734 -9.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -7.378 11.539 -8.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -8.304 12.845 -9.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -8.212 12.526 -7.628 1.00 0.00 H new ATOM 1560 N LEU A 37 -13.012 7.719 -9.686 1.00 0.00 N ATOM 1561 CA LEU A 37 -13.099 7.146 -11.061 1.00 0.00 C ATOM 1562 C LEU A 37 -14.514 6.604 -11.350 1.00 0.00 C ATOM 1563 O LEU A 37 -15.018 6.768 -12.443 1.00 0.00 O ATOM 1564 CB LEU A 37 -12.049 6.021 -11.201 1.00 0.00 C ATOM 1565 CG LEU A 37 -10.713 6.592 -11.718 1.00 0.00 C ATOM 1566 CD1 LEU A 37 -10.159 7.639 -10.742 1.00 0.00 C ATOM 1567 CD2 LEU A 37 -9.701 5.452 -11.856 1.00 0.00 C ATOM 0 H LEU A 37 -12.463 7.174 -9.021 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.896 7.932 -11.788 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.896 5.536 -10.237 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.415 5.257 -11.887 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.884 7.067 -12.684 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.216 8.030 -11.124 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.875 8.455 -10.638 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -9.992 7.177 -9.769 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.754 5.849 -12.221 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.547 4.982 -10.884 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -10.080 4.712 -12.561 1.00 0.00 H new ATOM 1579 N HIS A 38 -15.152 5.940 -10.403 1.00 0.00 N ATOM 1580 CA HIS A 38 -16.527 5.368 -10.667 1.00 0.00 C ATOM 1581 C HIS A 38 -17.607 6.042 -9.804 1.00 0.00 C ATOM 1582 O HIS A 38 -18.785 5.855 -10.032 1.00 0.00 O ATOM 1583 CB HIS A 38 -16.509 3.866 -10.369 1.00 0.00 C ATOM 1584 CG HIS A 38 -15.508 3.199 -11.268 1.00 0.00 C ATOM 1585 ND1 HIS A 38 -15.883 2.542 -12.430 1.00 0.00 N ATOM 1586 CD2 HIS A 38 -14.142 3.093 -11.201 1.00 0.00 C ATOM 1587 CE1 HIS A 38 -14.763 2.075 -13.011 1.00 0.00 C ATOM 1588 NE2 HIS A 38 -13.673 2.384 -12.303 1.00 0.00 N ATOM 0 H HIS A 38 -14.786 5.770 -9.466 1.00 0.00 H new ATOM 0 HA HIS A 38 -16.773 5.553 -11.713 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -16.250 3.693 -9.324 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -17.499 3.439 -10.527 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -16.835 2.433 -12.780 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -13.524 3.498 -10.413 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -14.747 1.518 -13.936 1.00 0.00 H new ATOM 1596 N GLN A 39 -17.237 6.838 -8.840 1.00 0.00 N ATOM 1597 CA GLN A 39 -18.239 7.545 -7.982 1.00 0.00 C ATOM 1598 C GLN A 39 -19.419 6.636 -7.606 1.00 0.00 C ATOM 1599 O GLN A 39 -20.573 6.958 -7.803 1.00 0.00 O ATOM 1600 CB GLN A 39 -18.677 8.832 -8.689 1.00 0.00 C ATOM 1601 CG GLN A 39 -19.544 9.682 -7.756 1.00 0.00 C ATOM 1602 CD GLN A 39 -19.623 11.116 -8.285 1.00 0.00 C ATOM 1603 OE1 GLN A 39 -18.931 11.472 -9.220 1.00 0.00 O ATOM 1604 NE2 GLN A 39 -20.433 11.966 -7.713 1.00 0.00 N ATOM 0 H GLN A 39 -16.264 7.034 -8.603 1.00 0.00 H new ATOM 0 HA GLN A 39 -17.777 7.815 -7.032 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -17.801 9.400 -9.000 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -19.235 8.587 -9.592 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -20.544 9.255 -7.685 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -19.124 9.678 -6.750 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -21.014 11.669 -6.929 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -20.485 12.927 -8.050 1.00 0.00 H new ATOM 1613 N VAL A 40 -19.112 5.512 -7.012 1.00 0.00 N ATOM 1614 CA VAL A 40 -20.153 4.563 -6.541 1.00 0.00 C ATOM 1615 C VAL A 40 -19.591 3.839 -5.314 1.00 0.00 C ATOM 1616 O VAL A 40 -18.393 3.704 -5.165 1.00 0.00 O ATOM 1617 CB VAL A 40 -20.493 3.540 -7.621 1.00 0.00 C ATOM 1618 CG1 VAL A 40 -21.345 4.190 -8.708 1.00 0.00 C ATOM 1619 CG2 VAL A 40 -19.210 2.987 -8.231 1.00 0.00 C ATOM 0 H VAL A 40 -18.155 5.209 -6.831 1.00 0.00 H new ATOM 0 HA VAL A 40 -21.066 5.108 -6.299 1.00 0.00 H new ATOM 0 HB VAL A 40 -21.057 2.723 -7.171 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.582 3.452 -9.474 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -22.269 4.568 -8.269 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.793 5.015 -9.158 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -19.459 2.257 -9.001 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -18.637 3.802 -8.674 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -18.616 2.506 -7.454 1.00 0.00 H new ATOM 1629 N ASN A 41 -20.430 3.377 -4.434 1.00 0.00 N ATOM 1630 CA ASN A 41 -19.914 2.670 -3.217 1.00 0.00 C ATOM 1631 C ASN A 41 -19.640 1.201 -3.554 1.00 0.00 C ATOM 1632 O ASN A 41 -20.503 0.488 -4.024 1.00 0.00 O ATOM 1633 CB ASN A 41 -20.944 2.770 -2.089 1.00 0.00 C ATOM 1634 CG ASN A 41 -22.345 2.515 -2.649 1.00 0.00 C ATOM 1635 OD1 ASN A 41 -22.495 2.097 -3.780 1.00 0.00 O ATOM 1636 ND2 ASN A 41 -23.387 2.757 -1.901 1.00 0.00 N ATOM 0 H ASN A 41 -21.445 3.454 -4.497 1.00 0.00 H new ATOM 0 HA ASN A 41 -18.985 3.138 -2.890 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -20.716 2.044 -1.309 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -20.899 3.757 -1.629 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -24.326 2.595 -2.266 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -23.263 3.108 -0.951 1.00 0.00 H new ATOM 1643 N ARG A 42 -18.427 0.749 -3.332 1.00 0.00 N ATOM 1644 CA ARG A 42 -18.066 -0.669 -3.654 1.00 0.00 C ATOM 1645 C ARG A 42 -18.150 -1.540 -2.378 1.00 0.00 C ATOM 1646 O ARG A 42 -17.619 -1.158 -1.353 1.00 0.00 O ATOM 1647 CB ARG A 42 -16.626 -0.697 -4.177 1.00 0.00 C ATOM 1648 CG ARG A 42 -16.258 -2.114 -4.642 1.00 0.00 C ATOM 1649 CD ARG A 42 -14.786 -2.153 -5.079 1.00 0.00 C ATOM 1650 NE ARG A 42 -14.589 -3.212 -6.123 1.00 0.00 N ATOM 1651 CZ ARG A 42 -15.004 -4.439 -5.943 1.00 0.00 C ATOM 1652 NH1 ARG A 42 -15.460 -4.826 -4.784 1.00 0.00 N ATOM 1653 NH2 ARG A 42 -14.905 -5.301 -6.917 1.00 0.00 N ATOM 0 H ARG A 42 -17.668 1.305 -2.939 1.00 0.00 H new ATOM 0 HA ARG A 42 -18.756 -1.060 -4.402 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -16.518 0.005 -5.004 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -15.940 -0.374 -3.394 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -16.426 -2.827 -3.834 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -16.901 -2.413 -5.470 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -14.490 -1.181 -5.474 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -14.148 -2.355 -4.219 1.00 0.00 H new ATOM 0 HE ARG A 42 -14.120 -2.969 -6.995 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -15.496 -4.169 -4.005 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -15.781 -5.786 -4.657 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -14.506 -5.016 -7.811 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -15.227 -6.260 -6.784 1.00 0.00 H new ATOM 1667 N PRO A 43 -18.787 -2.703 -2.413 1.00 0.00 N ATOM 1668 CA PRO A 43 -18.866 -3.564 -1.196 1.00 0.00 C ATOM 1669 C PRO A 43 -17.495 -3.749 -0.517 1.00 0.00 C ATOM 1670 O PRO A 43 -16.460 -3.697 -1.152 1.00 0.00 O ATOM 1671 CB PRO A 43 -19.416 -4.891 -1.752 1.00 0.00 C ATOM 1672 CG PRO A 43 -19.956 -4.629 -3.171 1.00 0.00 C ATOM 1673 CD PRO A 43 -19.463 -3.243 -3.632 1.00 0.00 C ATOM 0 HA PRO A 43 -19.489 -3.133 -0.413 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -18.631 -5.647 -1.777 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -20.208 -5.274 -1.108 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -19.610 -5.402 -3.857 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -21.045 -4.664 -3.175 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -18.775 -3.319 -4.474 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -20.289 -2.607 -3.951 1.00 0.00 H new ATOM 1681 N LEU A 44 -17.498 -3.946 0.772 1.00 0.00 N ATOM 1682 CA LEU A 44 -16.219 -4.113 1.527 1.00 0.00 C ATOM 1683 C LEU A 44 -15.490 -5.406 1.135 1.00 0.00 C ATOM 1684 O LEU A 44 -14.349 -5.600 1.493 1.00 0.00 O ATOM 1685 CB LEU A 44 -16.532 -4.133 3.039 1.00 0.00 C ATOM 1686 CG LEU A 44 -16.453 -2.716 3.617 1.00 0.00 C ATOM 1687 CD1 LEU A 44 -17.602 -1.859 3.082 1.00 0.00 C ATOM 1688 CD2 LEU A 44 -16.525 -2.783 5.140 1.00 0.00 C ATOM 0 H LEU A 44 -18.341 -3.999 1.343 1.00 0.00 H new ATOM 0 HA LEU A 44 -15.563 -3.278 1.281 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -17.527 -4.546 3.206 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -15.826 -4.784 3.555 1.00 0.00 H new ATOM 0 HG LEU A 44 -15.509 -2.262 3.316 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -17.533 -0.855 3.501 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -17.539 -1.804 1.995 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -18.554 -2.307 3.368 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -16.469 -1.775 5.552 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -17.465 -3.246 5.440 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -15.692 -3.376 5.518 1.00 0.00 H new ATOM 1700 N THR A 45 -16.128 -6.293 0.437 1.00 0.00 N ATOM 1701 CA THR A 45 -15.442 -7.567 0.064 1.00 0.00 C ATOM 1702 C THR A 45 -14.032 -7.280 -0.477 1.00 0.00 C ATOM 1703 O THR A 45 -13.236 -8.182 -0.647 1.00 0.00 O ATOM 1704 CB THR A 45 -16.255 -8.293 -1.014 1.00 0.00 C ATOM 1705 OG1 THR A 45 -15.686 -9.573 -1.252 1.00 0.00 O ATOM 1706 CG2 THR A 45 -16.241 -7.475 -2.308 1.00 0.00 C ATOM 0 H THR A 45 -17.089 -6.199 0.107 1.00 0.00 H new ATOM 0 HA THR A 45 -15.362 -8.192 0.954 1.00 0.00 H new ATOM 0 HB THR A 45 -17.284 -8.410 -0.675 1.00 0.00 H new ATOM 0 HG1 THR A 45 -14.714 -9.526 -1.133 1.00 0.00 H new ATOM 0 HG21 THR A 45 -16.820 -7.993 -3.072 1.00 0.00 H new ATOM 0 HG22 THR A 45 -16.680 -6.494 -2.123 1.00 0.00 H new ATOM 0 HG23 THR A 45 -15.213 -7.354 -2.651 1.00 0.00 H new ATOM 1714 N MET A 46 -13.726 -6.040 -0.790 1.00 0.00 N ATOM 1715 CA MET A 46 -12.375 -5.719 -1.370 1.00 0.00 C ATOM 1716 C MET A 46 -11.378 -5.204 -0.308 1.00 0.00 C ATOM 1717 O MET A 46 -10.193 -5.135 -0.570 1.00 0.00 O ATOM 1718 CB MET A 46 -12.556 -4.654 -2.457 1.00 0.00 C ATOM 1719 CG MET A 46 -11.250 -4.481 -3.243 1.00 0.00 C ATOM 1720 SD MET A 46 -11.556 -3.435 -4.692 1.00 0.00 S ATOM 1721 CE MET A 46 -9.848 -3.347 -5.294 1.00 0.00 C ATOM 0 H MET A 46 -14.348 -5.240 -0.671 1.00 0.00 H new ATOM 0 HA MET A 46 -11.957 -6.638 -1.780 1.00 0.00 H new ATOM 0 HB2 MET A 46 -13.361 -4.945 -3.132 1.00 0.00 H new ATOM 0 HB3 MET A 46 -12.846 -3.706 -2.004 1.00 0.00 H new ATOM 0 HG2 MET A 46 -10.488 -4.029 -2.609 1.00 0.00 H new ATOM 0 HG3 MET A 46 -10.869 -5.453 -3.556 1.00 0.00 H new ATOM 0 HE1 MET A 46 -9.841 -2.958 -6.312 1.00 0.00 H new ATOM 0 HE2 MET A 46 -9.269 -2.686 -4.649 1.00 0.00 H new ATOM 0 HE3 MET A 46 -9.406 -4.344 -5.283 1.00 0.00 H new ATOM 1731 N ARG A 47 -11.814 -4.829 0.872 1.00 0.00 N ATOM 1732 CA ARG A 47 -10.829 -4.314 1.881 1.00 0.00 C ATOM 1733 C ARG A 47 -10.055 -5.474 2.513 1.00 0.00 C ATOM 1734 O ARG A 47 -10.552 -6.573 2.659 1.00 0.00 O ATOM 1735 CB ARG A 47 -11.551 -3.528 2.991 1.00 0.00 C ATOM 1736 CG ARG A 47 -12.692 -2.690 2.408 1.00 0.00 C ATOM 1737 CD ARG A 47 -12.169 -1.677 1.391 1.00 0.00 C ATOM 1738 NE ARG A 47 -13.325 -0.976 0.768 1.00 0.00 N ATOM 1739 CZ ARG A 47 -13.132 0.066 0.004 1.00 0.00 C ATOM 1740 NH1 ARG A 47 -11.919 0.501 -0.220 1.00 0.00 N ATOM 1741 NH2 ARG A 47 -14.152 0.665 -0.549 1.00 0.00 N ATOM 0 H ARG A 47 -12.787 -4.855 1.177 1.00 0.00 H new ATOM 0 HA ARG A 47 -10.134 -3.652 1.364 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -11.945 -4.220 3.735 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -10.841 -2.878 3.504 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -13.421 -3.345 1.931 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -13.211 -2.168 3.212 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -11.511 -0.958 1.880 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -11.578 -2.181 0.627 1.00 0.00 H new ATOM 0 HE ARG A 47 -14.273 -1.311 0.939 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -11.121 0.026 0.202 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -11.771 1.315 -0.817 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -15.097 0.319 -0.384 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -14.003 1.479 -1.146 1.00 0.00 H new ATOM 1755 N LYS A 48 -8.832 -5.210 2.897 1.00 0.00 N ATOM 1756 CA LYS A 48 -7.970 -6.251 3.540 1.00 0.00 C ATOM 1757 C LYS A 48 -7.480 -5.714 4.887 1.00 0.00 C ATOM 1758 O LYS A 48 -7.195 -4.540 5.020 1.00 0.00 O ATOM 1759 CB LYS A 48 -6.758 -6.532 2.650 1.00 0.00 C ATOM 1760 CG LYS A 48 -6.003 -7.742 3.198 1.00 0.00 C ATOM 1761 CD LYS A 48 -4.789 -8.029 2.314 1.00 0.00 C ATOM 1762 CE LYS A 48 -4.078 -9.281 2.825 1.00 0.00 C ATOM 1763 NZ LYS A 48 -2.760 -9.415 2.148 1.00 0.00 N ATOM 0 H LYS A 48 -8.385 -4.299 2.790 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.541 -7.169 3.680 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.080 -6.722 1.626 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.103 -5.661 2.622 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.683 -7.551 4.222 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.660 -8.612 3.226 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.103 -8.171 1.280 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.107 -7.179 2.326 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -3.940 -9.218 3.904 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -4.689 -10.163 2.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -2.276 -10.267 2.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -2.904 -9.493 1.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -2.178 -8.578 2.353 1.00 0.00 H new ATOM 1777 N ASP A 49 -7.394 -6.551 5.889 1.00 0.00 N ATOM 1778 CA ASP A 49 -6.935 -6.074 7.231 1.00 0.00 C ATOM 1779 C ASP A 49 -5.742 -5.117 7.084 1.00 0.00 C ATOM 1780 O ASP A 49 -5.903 -3.913 7.065 1.00 0.00 O ATOM 1781 CB ASP A 49 -6.524 -7.280 8.078 1.00 0.00 C ATOM 1782 CG ASP A 49 -7.748 -8.158 8.339 1.00 0.00 C ATOM 1783 OD1 ASP A 49 -8.784 -7.610 8.676 1.00 0.00 O ATOM 1784 OD2 ASP A 49 -7.629 -9.365 8.196 1.00 0.00 O ATOM 0 H ASP A 49 -7.621 -7.544 5.837 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.751 -5.539 7.716 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -5.754 -7.854 7.563 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -6.094 -6.946 9.022 1.00 0.00 H new ATOM 1789 N GLY A 50 -4.549 -5.636 6.997 1.00 0.00 N ATOM 1790 CA GLY A 50 -3.355 -4.745 6.872 1.00 0.00 C ATOM 1791 C GLY A 50 -3.298 -4.129 5.470 1.00 0.00 C ATOM 1792 O GLY A 50 -4.198 -4.292 4.671 1.00 0.00 O ATOM 0 H GLY A 50 -4.346 -6.636 7.007 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.401 -3.956 7.622 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.446 -5.314 7.064 1.00 0.00 H new ATOM 1796 N ILE A 51 -2.232 -3.430 5.161 1.00 0.00 N ATOM 1797 CA ILE A 51 -2.092 -2.810 3.813 1.00 0.00 C ATOM 1798 C ILE A 51 -1.339 -3.765 2.874 1.00 0.00 C ATOM 1799 O ILE A 51 -0.411 -4.443 3.266 1.00 0.00 O ATOM 1800 CB ILE A 51 -1.334 -1.487 3.956 1.00 0.00 C ATOM 1801 CG1 ILE A 51 -2.093 -0.606 4.968 1.00 0.00 C ATOM 1802 CG2 ILE A 51 -1.250 -0.775 2.593 1.00 0.00 C ATOM 1803 CD1 ILE A 51 -1.644 0.852 4.857 1.00 0.00 C ATOM 0 H ILE A 51 -1.449 -3.263 5.793 1.00 0.00 H new ATOM 0 HA ILE A 51 -3.076 -2.618 3.386 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.319 -1.672 4.306 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.166 -0.676 4.787 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.916 -0.970 5.980 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -0.709 0.165 2.706 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -0.725 -1.412 1.881 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.256 -0.573 2.226 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.191 1.457 5.579 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.576 0.920 5.062 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -1.845 1.219 3.850 1.00 0.00 H new ATOM 1815 N GLN A 52 -1.725 -3.792 1.630 1.00 0.00 N ATOM 1816 CA GLN A 52 -1.031 -4.668 0.640 1.00 0.00 C ATOM 1817 C GLN A 52 0.261 -3.972 0.181 1.00 0.00 C ATOM 1818 O GLN A 52 0.363 -2.764 0.213 1.00 0.00 O ATOM 1819 CB GLN A 52 -1.949 -4.909 -0.565 1.00 0.00 C ATOM 1820 CG GLN A 52 -3.037 -5.918 -0.198 1.00 0.00 C ATOM 1821 CD GLN A 52 -4.071 -5.982 -1.326 1.00 0.00 C ATOM 1822 OE1 GLN A 52 -4.439 -4.880 -1.923 1.00 0.00 O flip ATOM 1823 NE2 GLN A 52 -4.554 -7.045 -1.662 1.00 0.00 N flip ATOM 0 H GLN A 52 -2.496 -3.242 1.252 1.00 0.00 H new ATOM 0 HA GLN A 52 -0.789 -5.627 1.098 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.404 -3.970 -0.880 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.366 -5.280 -1.408 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -2.597 -6.902 -0.037 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -3.518 -5.627 0.736 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.267 -7.906 -1.196 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.247 -7.077 -2.410 1.00 0.00 H new ATOM 1832 N THR A 53 1.269 -4.714 -0.207 1.00 0.00 N ATOM 1833 CA THR A 53 2.556 -4.066 -0.634 1.00 0.00 C ATOM 1834 C THR A 53 3.154 -4.777 -1.848 1.00 0.00 C ATOM 1835 O THR A 53 2.830 -5.906 -2.154 1.00 0.00 O ATOM 1836 CB THR A 53 3.563 -4.125 0.514 1.00 0.00 C ATOM 1837 OG1 THR A 53 4.882 -4.085 -0.014 1.00 0.00 O ATOM 1838 CG2 THR A 53 3.362 -5.418 1.297 1.00 0.00 C ATOM 0 H THR A 53 1.261 -5.733 -0.248 1.00 0.00 H new ATOM 0 HA THR A 53 2.342 -3.031 -0.901 1.00 0.00 H new ATOM 0 HB THR A 53 3.413 -3.274 1.178 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.530 -4.121 0.721 1.00 0.00 H new ATOM 0 HG21 THR A 53 4.079 -5.462 2.117 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.349 -5.446 1.699 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.514 -6.271 0.636 1.00 0.00 H new ATOM 1846 N ARG A 54 4.048 -4.103 -2.525 1.00 0.00 N ATOM 1847 CA ARG A 54 4.726 -4.688 -3.721 1.00 0.00 C ATOM 1848 C ARG A 54 6.165 -4.182 -3.757 1.00 0.00 C ATOM 1849 O ARG A 54 6.547 -3.307 -3.005 1.00 0.00 O ATOM 1850 CB ARG A 54 4.024 -4.255 -5.020 1.00 0.00 C ATOM 1851 CG ARG A 54 2.592 -4.810 -5.105 1.00 0.00 C ATOM 1852 CD ARG A 54 2.596 -6.333 -5.318 1.00 0.00 C ATOM 1853 NE ARG A 54 3.542 -6.683 -6.421 1.00 0.00 N ATOM 1854 CZ ARG A 54 3.887 -7.927 -6.622 1.00 0.00 C ATOM 1855 NH1 ARG A 54 3.372 -8.875 -5.888 1.00 0.00 N ATOM 1856 NH2 ARG A 54 4.740 -8.224 -7.565 1.00 0.00 N ATOM 0 H ARG A 54 4.342 -3.154 -2.295 1.00 0.00 H new ATOM 0 HA ARG A 54 4.690 -5.775 -3.648 1.00 0.00 H new ATOM 0 HB2 ARG A 54 3.996 -3.167 -5.073 1.00 0.00 H new ATOM 0 HB3 ARG A 54 4.600 -4.602 -5.878 1.00 0.00 H new ATOM 0 HG2 ARG A 54 2.051 -4.570 -4.189 1.00 0.00 H new ATOM 0 HG3 ARG A 54 2.060 -4.327 -5.925 1.00 0.00 H new ATOM 0 HD2 ARG A 54 2.891 -6.838 -4.398 1.00 0.00 H new ATOM 0 HD3 ARG A 54 1.592 -6.679 -5.563 1.00 0.00 H new ATOM 0 HE ARG A 54 3.920 -5.948 -7.019 1.00 0.00 H new ATOM 0 HH11 ARG A 54 2.699 -8.645 -5.156 1.00 0.00 H new ATOM 0 HH12 ARG A 54 3.642 -9.846 -6.046 1.00 0.00 H new ATOM 0 HH21 ARG A 54 5.137 -7.485 -8.145 1.00 0.00 H new ATOM 0 HH22 ARG A 54 5.009 -9.195 -7.722 1.00 0.00 H new ATOM 1870 N ASN A 55 6.959 -4.721 -4.631 1.00 0.00 N ATOM 1871 CA ASN A 55 8.369 -4.261 -4.720 1.00 0.00 C ATOM 1872 C ASN A 55 8.363 -2.768 -5.053 1.00 0.00 C ATOM 1873 O ASN A 55 7.557 -2.297 -5.829 1.00 0.00 O ATOM 1874 CB ASN A 55 9.102 -5.038 -5.814 1.00 0.00 C ATOM 1875 CG ASN A 55 9.287 -6.490 -5.374 1.00 0.00 C ATOM 1876 OD1 ASN A 55 8.919 -6.849 -4.173 1.00 0.00 O flip ATOM 1877 ND2 ASN A 55 9.763 -7.309 -6.134 1.00 0.00 N flip ATOM 0 H ASN A 55 6.696 -5.457 -5.286 1.00 0.00 H new ATOM 0 HA ASN A 55 8.882 -4.432 -3.774 1.00 0.00 H new ATOM 0 HB2 ASN A 55 8.535 -4.999 -6.744 1.00 0.00 H new ATOM 0 HB3 ASN A 55 10.072 -4.581 -6.012 1.00 0.00 H new ATOM 0 HD21 ASN A 55 10.050 -7.028 -7.072 1.00 0.00 H new ATOM 0 HD22 ASN A 55 9.876 -8.278 -5.835 1.00 0.00 H new ATOM 1884 N ARG A 56 9.241 -2.019 -4.449 1.00 0.00 N ATOM 1885 CA ARG A 56 9.269 -0.549 -4.702 1.00 0.00 C ATOM 1886 C ARG A 56 9.438 -0.272 -6.188 1.00 0.00 C ATOM 1887 O ARG A 56 10.356 -0.752 -6.824 1.00 0.00 O ATOM 1888 CB ARG A 56 10.454 0.082 -3.965 1.00 0.00 C ATOM 1889 CG ARG A 56 10.312 -0.099 -2.449 1.00 0.00 C ATOM 1890 CD ARG A 56 9.302 0.911 -1.886 1.00 0.00 C ATOM 1891 NE ARG A 56 9.407 0.949 -0.388 1.00 0.00 N ATOM 1892 CZ ARG A 56 9.252 -0.125 0.339 1.00 0.00 C ATOM 1893 NH1 ARG A 56 8.834 -1.240 -0.199 1.00 0.00 N ATOM 1894 NH2 ARG A 56 9.471 -0.071 1.623 1.00 0.00 N ATOM 0 H ARG A 56 9.942 -2.359 -3.790 1.00 0.00 H new ATOM 0 HA ARG A 56 8.329 -0.125 -4.348 1.00 0.00 H new ATOM 0 HB2 ARG A 56 11.384 -0.374 -4.305 1.00 0.00 H new ATOM 0 HB3 ARG A 56 10.514 1.144 -4.205 1.00 0.00 H new ATOM 0 HG2 ARG A 56 9.985 -1.114 -2.226 1.00 0.00 H new ATOM 0 HG3 ARG A 56 11.280 0.037 -1.967 1.00 0.00 H new ATOM 0 HD2 ARG A 56 9.494 1.901 -2.299 1.00 0.00 H new ATOM 0 HD3 ARG A 56 8.291 0.633 -2.183 1.00 0.00 H new ATOM 0 HE ARG A 56 9.605 1.837 0.074 1.00 0.00 H new ATOM 0 HH11 ARG A 56 8.625 -1.278 -1.197 1.00 0.00 H new ATOM 0 HH12 ARG A 56 8.717 -2.072 0.379 1.00 0.00 H new ATOM 0 HH21 ARG A 56 9.762 0.806 2.054 1.00 0.00 H new ATOM 0 HH22 ARG A 56 9.352 -0.906 2.196 1.00 0.00 H new ATOM 1908 N LYS A 57 8.561 0.514 -6.745 1.00 0.00 N ATOM 1909 CA LYS A 57 8.665 0.845 -8.186 1.00 0.00 C ATOM 1910 C LYS A 57 10.102 1.242 -8.509 1.00 0.00 C ATOM 1911 O LYS A 57 10.895 1.505 -7.627 1.00 0.00 O ATOM 1912 CB LYS A 57 7.728 2.014 -8.498 1.00 0.00 C ATOM 1913 CG LYS A 57 7.943 2.478 -9.942 1.00 0.00 C ATOM 1914 CD LYS A 57 6.718 3.259 -10.426 1.00 0.00 C ATOM 1915 CE LYS A 57 6.421 4.419 -9.472 1.00 0.00 C ATOM 1916 NZ LYS A 57 5.720 3.901 -8.261 1.00 0.00 N ATOM 0 H LYS A 57 7.773 0.942 -6.258 1.00 0.00 H new ATOM 0 HA LYS A 57 8.385 -0.020 -8.787 1.00 0.00 H new ATOM 0 HB2 LYS A 57 6.691 1.710 -8.354 1.00 0.00 H new ATOM 0 HB3 LYS A 57 7.917 2.838 -7.809 1.00 0.00 H new ATOM 0 HG2 LYS A 57 8.832 3.105 -10.003 1.00 0.00 H new ATOM 0 HG3 LYS A 57 8.115 1.617 -10.588 1.00 0.00 H new ATOM 0 HD2 LYS A 57 6.895 3.641 -11.431 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.855 2.596 -10.484 1.00 0.00 H new ATOM 0 HE2 LYS A 57 7.349 4.914 -9.184 1.00 0.00 H new ATOM 0 HE3 LYS A 57 5.803 5.165 -9.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 4.928 4.532 -8.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.356 2.946 -8.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 6.386 3.864 -7.463 1.00 0.00 H new ATOM 1930 N VAL A 58 10.447 1.289 -9.764 1.00 0.00 N ATOM 1931 CA VAL A 58 11.833 1.669 -10.135 1.00 0.00 C ATOM 1932 C VAL A 58 12.187 2.969 -9.412 1.00 0.00 C ATOM 1933 O VAL A 58 11.443 3.927 -9.451 1.00 0.00 O ATOM 1934 CB VAL A 58 11.893 1.887 -11.648 1.00 0.00 C ATOM 1935 CG1 VAL A 58 13.260 2.448 -12.039 1.00 0.00 C ATOM 1936 CG2 VAL A 58 11.662 0.552 -12.357 1.00 0.00 C ATOM 0 H VAL A 58 9.828 1.080 -10.547 1.00 0.00 H new ATOM 0 HA VAL A 58 12.537 0.887 -9.852 1.00 0.00 H new ATOM 0 HB VAL A 58 11.121 2.598 -11.943 1.00 0.00 H new ATOM 0 HG11 VAL A 58 13.296 2.601 -13.118 1.00 0.00 H new ATOM 0 HG12 VAL A 58 13.421 3.399 -11.532 1.00 0.00 H new ATOM 0 HG13 VAL A 58 14.039 1.744 -11.746 1.00 0.00 H new ATOM 0 HG21 VAL A 58 11.704 0.701 -13.436 1.00 0.00 H new ATOM 0 HG22 VAL A 58 12.434 -0.157 -12.059 1.00 0.00 H new ATOM 0 HG23 VAL A 58 10.683 0.159 -12.083 1.00 0.00 H new ATOM 1946 N SER A 59 13.310 3.018 -8.746 1.00 0.00 N ATOM 1947 CA SER A 59 13.680 4.273 -8.025 1.00 0.00 C ATOM 1948 C SER A 59 14.313 5.240 -9.024 1.00 0.00 C ATOM 1949 O SER A 59 15.430 5.688 -8.858 1.00 0.00 O ATOM 1950 CB SER A 59 14.666 3.957 -6.897 1.00 0.00 C ATOM 1951 OG SER A 59 15.793 3.276 -7.432 1.00 0.00 O ATOM 0 H SER A 59 13.981 2.254 -8.669 1.00 0.00 H new ATOM 0 HA SER A 59 12.791 4.726 -7.587 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.983 4.878 -6.407 1.00 0.00 H new ATOM 0 HB3 SER A 59 14.182 3.342 -6.138 1.00 0.00 H new ATOM 0 HG SER A 59 16.250 3.856 -8.077 1.00 0.00 H new ATOM 1957 N SER A 60 13.601 5.546 -10.073 1.00 0.00 N ATOM 1958 CA SER A 60 14.140 6.467 -11.114 1.00 0.00 C ATOM 1959 C SER A 60 14.460 7.834 -10.504 1.00 0.00 C ATOM 1960 O SER A 60 15.476 8.428 -10.806 1.00 0.00 O ATOM 1961 CB SER A 60 13.108 6.626 -12.229 1.00 0.00 C ATOM 1962 OG SER A 60 13.689 7.346 -13.308 1.00 0.00 O ATOM 0 H SER A 60 12.661 5.195 -10.255 1.00 0.00 H new ATOM 0 HA SER A 60 15.059 6.046 -11.521 1.00 0.00 H new ATOM 0 HB2 SER A 60 12.770 5.647 -12.570 1.00 0.00 H new ATOM 0 HB3 SER A 60 12.230 7.154 -11.855 1.00 0.00 H new ATOM 0 HG SER A 60 13.030 7.448 -14.026 1.00 0.00 H new ATOM 1968 N LYS A 61 13.626 8.340 -9.646 1.00 0.00 N ATOM 1969 CA LYS A 61 13.931 9.665 -9.037 1.00 0.00 C ATOM 1970 C LYS A 61 15.109 9.512 -8.077 1.00 0.00 C ATOM 1971 O LYS A 61 15.202 8.550 -7.341 1.00 0.00 O ATOM 1972 CB LYS A 61 12.710 10.189 -8.284 1.00 0.00 C ATOM 1973 CG LYS A 61 11.623 10.577 -9.289 1.00 0.00 C ATOM 1974 CD LYS A 61 10.403 11.101 -8.533 1.00 0.00 C ATOM 1975 CE LYS A 61 9.308 11.497 -9.523 1.00 0.00 C ATOM 1976 NZ LYS A 61 8.321 12.374 -8.832 1.00 0.00 N ATOM 0 H LYS A 61 12.756 7.903 -9.341 1.00 0.00 H new ATOM 0 HA LYS A 61 14.187 10.377 -9.822 1.00 0.00 H new ATOM 0 HB2 LYS A 61 12.335 9.426 -7.602 1.00 0.00 H new ATOM 0 HB3 LYS A 61 12.985 11.052 -7.678 1.00 0.00 H new ATOM 0 HG2 LYS A 61 11.998 11.340 -9.972 1.00 0.00 H new ATOM 0 HG3 LYS A 61 11.347 9.714 -9.895 1.00 0.00 H new ATOM 0 HD2 LYS A 61 10.030 10.336 -7.852 1.00 0.00 H new ATOM 0 HD3 LYS A 61 10.683 11.961 -7.924 1.00 0.00 H new ATOM 0 HE2 LYS A 61 9.743 12.019 -10.376 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.813 10.607 -9.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 7.572 12.648 -9.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 7.900 11.860 -8.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.801 13.227 -8.481 1.00 0.00 H new ATOM 1990 N GLY A 62 16.019 10.449 -8.086 1.00 0.00 N ATOM 1991 CA GLY A 62 17.201 10.349 -7.183 1.00 0.00 C ATOM 1992 C GLY A 62 16.823 10.793 -5.771 1.00 0.00 C ATOM 1993 O GLY A 62 15.966 11.633 -5.575 1.00 0.00 O ATOM 0 H GLY A 62 15.995 11.278 -8.679 1.00 0.00 H new ATOM 0 HA2 GLY A 62 17.568 9.323 -7.164 1.00 0.00 H new ATOM 0 HA3 GLY A 62 18.012 10.970 -7.563 1.00 0.00 H new ATOM 1997 N LYS A 63 17.466 10.233 -4.783 1.00 0.00 N ATOM 1998 CA LYS A 63 17.173 10.608 -3.369 1.00 0.00 C ATOM 1999 C LYS A 63 18.162 11.686 -2.925 1.00 0.00 C ATOM 2000 O LYS A 63 18.143 12.137 -1.796 1.00 0.00 O ATOM 2001 CB LYS A 63 17.342 9.377 -2.479 1.00 0.00 C ATOM 2002 CG LYS A 63 16.361 8.292 -2.918 1.00 0.00 C ATOM 2003 CD LYS A 63 16.531 7.062 -2.027 1.00 0.00 C ATOM 2004 CE LYS A 63 15.549 5.975 -2.463 1.00 0.00 C ATOM 2005 NZ LYS A 63 15.736 4.771 -1.606 1.00 0.00 N ATOM 0 H LYS A 63 18.190 9.524 -4.896 1.00 0.00 H new ATOM 0 HA LYS A 63 16.153 10.984 -3.289 1.00 0.00 H new ATOM 0 HB2 LYS A 63 18.365 9.006 -2.544 1.00 0.00 H new ATOM 0 HB3 LYS A 63 17.165 9.642 -1.437 1.00 0.00 H new ATOM 0 HG2 LYS A 63 15.338 8.663 -2.853 1.00 0.00 H new ATOM 0 HG3 LYS A 63 16.538 8.027 -3.960 1.00 0.00 H new ATOM 0 HD2 LYS A 63 17.554 6.691 -2.093 1.00 0.00 H new ATOM 0 HD3 LYS A 63 16.356 7.328 -0.985 1.00 0.00 H new ATOM 0 HE2 LYS A 63 14.525 6.339 -2.380 1.00 0.00 H new ATOM 0 HE3 LYS A 63 15.713 5.719 -3.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 15.069 4.029 -1.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 16.710 4.421 -1.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 15.559 5.021 -0.612 1.00 0.00 H new ATOM 2019 N LYS A 64 19.039 12.088 -3.802 1.00 0.00 N ATOM 2020 CA LYS A 64 20.045 13.119 -3.436 1.00 0.00 C ATOM 2021 C LYS A 64 19.354 14.464 -3.214 1.00 0.00 C ATOM 2022 O LYS A 64 18.426 14.825 -3.911 1.00 0.00 O ATOM 2023 CB LYS A 64 21.070 13.244 -4.566 1.00 0.00 C ATOM 2024 CG LYS A 64 22.243 14.113 -4.109 1.00 0.00 C ATOM 2025 CD LYS A 64 23.279 14.195 -5.230 1.00 0.00 C ATOM 2026 CE LYS A 64 24.451 15.071 -4.789 1.00 0.00 C ATOM 2027 NZ LYS A 64 24.031 16.503 -4.801 1.00 0.00 N ATOM 0 H LYS A 64 19.101 11.744 -4.760 1.00 0.00 H new ATOM 0 HA LYS A 64 20.549 12.825 -2.515 1.00 0.00 H new ATOM 0 HB2 LYS A 64 21.429 12.256 -4.855 1.00 0.00 H new ATOM 0 HB3 LYS A 64 20.602 13.683 -5.447 1.00 0.00 H new ATOM 0 HG2 LYS A 64 21.891 15.112 -3.850 1.00 0.00 H new ATOM 0 HG3 LYS A 64 22.695 13.691 -3.211 1.00 0.00 H new ATOM 0 HD2 LYS A 64 23.635 13.196 -5.483 1.00 0.00 H new ATOM 0 HD3 LYS A 64 22.823 14.608 -6.130 1.00 0.00 H new ATOM 0 HE2 LYS A 64 24.777 14.785 -3.789 1.00 0.00 H new ATOM 0 HE3 LYS A 64 25.300 14.924 -5.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 24.867 17.111 -4.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 23.567 16.721 -5.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 23.366 16.676 -4.021 1.00 0.00 H new ATOM 2041 N ARG A 65 19.801 15.204 -2.240 1.00 0.00 N ATOM 2042 CA ARG A 65 19.182 16.528 -1.951 1.00 0.00 C ATOM 2043 C ARG A 65 19.338 17.432 -3.176 1.00 0.00 C ATOM 2044 O ARG A 65 20.329 17.378 -3.878 1.00 0.00 O ATOM 2045 CB ARG A 65 19.894 17.173 -0.753 1.00 0.00 C ATOM 2046 CG ARG A 65 19.887 16.224 0.458 1.00 0.00 C ATOM 2047 CD ARG A 65 18.539 16.289 1.188 1.00 0.00 C ATOM 2048 NE ARG A 65 18.427 17.599 1.887 1.00 0.00 N ATOM 2049 CZ ARG A 65 17.271 18.008 2.329 1.00 0.00 C ATOM 2050 NH1 ARG A 65 16.211 17.260 2.181 1.00 0.00 N ATOM 2051 NH2 ARG A 65 17.175 19.165 2.923 1.00 0.00 N ATOM 0 H ARG A 65 20.574 14.947 -1.627 1.00 0.00 H new ATOM 0 HA ARG A 65 18.125 16.397 -1.720 1.00 0.00 H new ATOM 0 HB2 ARG A 65 20.921 17.419 -1.023 1.00 0.00 H new ATOM 0 HB3 ARG A 65 19.401 18.109 -0.491 1.00 0.00 H new ATOM 0 HG2 ARG A 65 20.079 15.203 0.128 1.00 0.00 H new ATOM 0 HG3 ARG A 65 20.691 16.494 1.143 1.00 0.00 H new ATOM 0 HD2 ARG A 65 17.721 16.170 0.478 1.00 0.00 H new ATOM 0 HD3 ARG A 65 18.460 15.472 1.905 1.00 0.00 H new ATOM 0 HE ARG A 65 19.257 18.177 2.020 1.00 0.00 H new ATOM 0 HH11 ARG A 65 16.287 16.354 1.719 1.00 0.00 H new ATOM 0 HH12 ARG A 65 15.307 17.582 2.528 1.00 0.00 H new ATOM 0 HH21 ARG A 65 18.004 19.748 3.041 1.00 0.00 H new ATOM 0 HH22 ARG A 65 16.271 19.487 3.270 1.00 0.00 H new ATOM 2065 N ARG A 66 18.368 18.258 -3.443 1.00 0.00 N ATOM 2066 CA ARG A 66 18.468 19.158 -4.625 1.00 0.00 C ATOM 2067 C ARG A 66 19.616 20.151 -4.419 1.00 0.00 C ATOM 2068 O ARG A 66 20.021 20.771 -5.391 1.00 0.00 O ATOM 2069 CB ARG A 66 17.155 19.924 -4.797 1.00 0.00 C ATOM 2070 CG ARG A 66 16.052 18.954 -5.219 1.00 0.00 C ATOM 2071 CD ARG A 66 14.740 19.720 -5.390 1.00 0.00 C ATOM 2072 NE ARG A 66 14.924 20.762 -6.439 1.00 0.00 N ATOM 2073 CZ ARG A 66 13.887 21.374 -6.946 1.00 0.00 C ATOM 2074 NH1 ARG A 66 12.684 21.075 -6.534 1.00 0.00 N ATOM 2075 NH2 ARG A 66 14.056 22.285 -7.865 1.00 0.00 N ATOM 2076 OXT ARG A 66 20.072 20.273 -3.294 1.00 0.00 O ATOM 0 H ARG A 66 17.512 18.350 -2.896 1.00 0.00 H new ATOM 0 HA ARG A 66 18.660 18.562 -5.517 1.00 0.00 H new ATOM 0 HB2 ARG A 66 16.884 20.416 -3.863 1.00 0.00 H new ATOM 0 HB3 ARG A 66 17.273 20.706 -5.547 1.00 0.00 H new ATOM 0 HG2 ARG A 66 16.323 18.462 -6.153 1.00 0.00 H new ATOM 0 HG3 ARG A 66 15.934 18.172 -4.469 1.00 0.00 H new ATOM 0 HD2 ARG A 66 13.939 19.037 -5.673 1.00 0.00 H new ATOM 0 HD3 ARG A 66 14.447 20.182 -4.447 1.00 0.00 H new ATOM 0 HE ARG A 66 15.862 20.998 -6.762 1.00 0.00 H new ATOM 0 HH11 ARG A 66 12.553 20.363 -5.816 1.00 0.00 H new ATOM 0 HH12 ARG A 66 11.875 21.554 -6.931 1.00 0.00 H new ATOM 0 HH21 ARG A 66 14.996 22.518 -8.186 1.00 0.00 H new ATOM 0 HH22 ARG A 66 13.248 22.764 -8.263 1.00 0.00 H new TER 2090 ARG A 66 HETATM 2091 ZN ZN A 67 -12.152 2.978 2.114 1.00 0.00 ZN