USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=32 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 -130:sc= -2.25! USER MOD Set 1.2: A 29 ASN : amide:sc= -8.89! C(o=-14!,f=-17!) USER MOD Set 1.3: C 125 DT C7 :methyl 150:sc= -3.31! (180deg=-1.08) USER MOD Set 2.1: A 12 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 14 THR OG1 : rot 10:sc= 0.92 USER MOD Single : A 1 LYS N :NH3+ 152:sc= 0.372 (180deg=-0.0999) USER MOD Single : A 1 LYS NZ :NH3+ 160:sc= -0.0122 (180deg=-0.313) USER MOD Single : A 5 THR OG1 : rot -172:sc= 0.782 USER MOD Single : A 8 SER OG : rot 75:sc= 0.379 USER MOD Single : A 9 ASN : amide:sc= -2.56 X(o=-2.6,f=-2.7!) USER MOD Single : A 11 GLN : amide:sc= -3.36! C(o=-3.4!,f=-3.6!) USER MOD Single : A 13 SER OG : rot 180:sc= 0.00183 USER MOD Single : A 15 THR OG1 : rot -139:sc= 1.5 USER MOD Single : A 21 SER OG : rot 180:sc= -0.366 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 HD1:sc= -6.46! C(o=-6.5!,f=-14!) USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 41 ASN : amide:sc= -0.749 K(o=-0.75,f=-2.5!) USER MOD Single : A 45 THR OG1 : rot -40:sc= 0.0791 USER MOD Single : A 46 MET CE :methyl 139:sc= -0.471 (180deg=-3.3!) USER MOD Single : A 48 LYS NZ :NH3+ 163:sc= -0.0141 (180deg=-0.313) USER MOD Single : A 52 GLN :FLIP amide:sc= -0.044 F(o=-1.2!,f=-0.044) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.163 USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 57 LYS NZ :NH3+ -148:sc= -0.127 (180deg=-0.922) USER MOD Single : A 59 SER OG : rot 180:sc= 0 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+ 161:sc= -0.135 (180deg=-0.762) USER MOD Single : B 101 DG O5' : rot 180:sc=-0.000437 USER MOD Single : B 102 DT C7 :methyl -30:sc= -1.4 (180deg=-2.09!) USER MOD Single : B 103 DT C7 :methyl -30:sc= -0.951 (180deg=-1.91!) USER MOD Single : B 109 DT C7 :methyl -30:sc= -1.11 (180deg=-1.3) USER MOD Single : B 115 DT C7 :methyl -30:sc= -0.354 (180deg=-0.967) USER MOD Single : B 116 DT C7 :methyl 150:sc= -0.213 (180deg=-0.213) USER MOD Single : B 116 DT O3' : rot 180:sc= 0 USER MOD Single : C 117 DA O5' : rot 80:sc= -2.33! USER MOD Single : C 119 DT C7 :methyl -30:sc= -0.548 (180deg=-0.898) USER MOD Single : C 121 DT C7 :methyl 150:sc= -0.554 (180deg=-0.554) USER MOD Single : C 122 DT C7 :methyl 150:sc= -1.06 (180deg=-1.06) USER MOD Single : C 123 DT C7 :methyl -30:sc= -1.64! (180deg=-2.62!) USER MOD Single : C 127 DT C7 :methyl -30:sc= -0.514 (180deg=-0.56) USER MOD Single : C 132 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG B 101 20.190 18.975 9.181 1.00 0.00 O ATOM 2 C5' DG B 101 20.577 18.326 10.394 1.00 0.00 C ATOM 3 C4' DG B 101 19.399 17.592 11.041 1.00 0.00 C ATOM 4 O4' DG B 101 18.439 18.550 11.552 1.00 0.00 O ATOM 5 C3' DG B 101 18.666 16.690 10.038 1.00 0.00 C ATOM 6 O3' DG B 101 18.422 15.401 10.612 1.00 0.00 O ATOM 7 C2' DG B 101 17.362 17.387 9.754 1.00 0.00 C ATOM 8 C1' DG B 101 17.181 18.425 10.851 1.00 0.00 C ATOM 9 N9 DG B 101 16.743 19.722 10.295 1.00 0.00 N ATOM 10 C8 DG B 101 17.276 20.451 9.268 1.00 0.00 C ATOM 11 N7 DG B 101 16.659 21.563 9.002 1.00 0.00 N ATOM 12 C5 DG B 101 15.622 21.582 9.933 1.00 0.00 C ATOM 13 C6 DG B 101 14.602 22.549 10.142 1.00 0.00 C ATOM 14 O6 DG B 101 14.406 23.596 9.529 1.00 0.00 O ATOM 15 N1 DG B 101 13.760 22.183 11.184 1.00 0.00 N ATOM 16 C2 DG B 101 13.881 21.033 11.935 1.00 0.00 C ATOM 17 N2 DG B 101 12.978 20.861 12.901 1.00 0.00 N ATOM 18 N3 DG B 101 14.837 20.121 11.742 1.00 0.00 N ATOM 19 C4 DG B 101 15.669 20.460 10.729 1.00 0.00 C ATOM 0 H5' DG B 101 20.974 19.064 11.091 1.00 0.00 H new ATOM 0 H5'' DG B 101 21.379 17.617 10.188 1.00 0.00 H new ATOM 0 H4' DG B 101 19.810 16.979 11.843 1.00 0.00 H new ATOM 0 H3' DG B 101 19.251 16.533 9.132 1.00 0.00 H new ATOM 0 H2' DG B 101 17.380 17.859 8.772 1.00 0.00 H new ATOM 0 H2'' DG B 101 16.535 16.677 9.751 1.00 0.00 H new ATOM 0 HO5' DG B 101 20.964 19.435 8.795 1.00 0.00 H new ATOM 0 H1' DG B 101 16.400 18.107 11.542 1.00 0.00 H new ATOM 0 H8 DG B 101 18.147 20.126 8.718 1.00 0.00 H new ATOM 0 H1 DG B 101 12.992 22.814 11.412 1.00 0.00 H new ATOM 0 H21 DG B 101 13.014 20.030 13.491 1.00 0.00 H new ATOM 0 H22 DG B 101 12.251 21.561 13.050 1.00 0.00 H new ATOM 32 P DT B 102 17.663 14.242 9.781 1.00 0.00 P ATOM 33 OP1 DT B 102 18.232 12.939 10.190 1.00 0.00 O ATOM 34 OP2 DT B 102 17.662 14.628 8.352 1.00 0.00 O ATOM 35 O5' DT B 102 16.143 14.323 10.327 1.00 0.00 O ATOM 36 C5' DT B 102 15.872 14.114 11.717 1.00 0.00 C ATOM 37 C4' DT B 102 14.378 14.225 12.068 1.00 0.00 C ATOM 38 O4' DT B 102 13.923 15.599 11.961 1.00 0.00 O ATOM 39 C3' DT B 102 13.488 13.371 11.155 1.00 0.00 C ATOM 40 O3' DT B 102 12.768 12.414 11.939 1.00 0.00 O ATOM 41 C2' DT B 102 12.521 14.327 10.501 1.00 0.00 C ATOM 42 C1' DT B 102 12.697 15.669 11.192 1.00 0.00 C ATOM 43 N1 DT B 102 12.748 16.791 10.216 1.00 0.00 N ATOM 44 C2 DT B 102 11.792 17.796 10.311 1.00 0.00 C ATOM 45 O2 DT B 102 10.889 17.763 11.144 1.00 0.00 O ATOM 46 N3 DT B 102 11.911 18.836 9.408 1.00 0.00 N ATOM 47 C4 DT B 102 12.882 18.960 8.431 1.00 0.00 C ATOM 48 O4 DT B 102 12.896 19.934 7.682 1.00 0.00 O ATOM 49 C5 DT B 102 13.831 17.868 8.402 1.00 0.00 C ATOM 50 C7 DT B 102 14.957 17.892 7.362 1.00 0.00 C ATOM 51 C6 DT B 102 13.733 16.840 9.278 1.00 0.00 C ATOM 0 H5' DT B 102 16.431 14.843 12.303 1.00 0.00 H new ATOM 0 H5'' DT B 102 16.234 13.128 12.007 1.00 0.00 H new ATOM 0 H4' DT B 102 14.290 13.862 13.092 1.00 0.00 H new ATOM 0 H3' DT B 102 14.076 12.827 10.416 1.00 0.00 H new ATOM 0 H2' DT B 102 12.724 14.412 9.433 1.00 0.00 H new ATOM 0 H2'' DT B 102 11.496 13.971 10.603 1.00 0.00 H new ATOM 0 H1' DT B 102 11.843 15.867 11.840 1.00 0.00 H new ATOM 0 H3 DT B 102 11.218 19.582 9.468 1.00 0.00 H new ATOM 0 H71 DT B 102 14.618 18.420 6.471 1.00 0.00 H new ATOM 0 H72 DT B 102 15.826 18.403 7.778 1.00 0.00 H new ATOM 0 H73 DT B 102 15.229 16.870 7.097 1.00 0.00 H new ATOM 0 H6 DT B 102 14.455 16.038 9.231 1.00 0.00 H new ATOM 64 P DT B 103 11.748 11.372 11.256 1.00 0.00 P ATOM 65 OP1 DT B 103 11.631 10.189 12.138 1.00 0.00 O ATOM 66 OP2 DT B 103 12.140 11.202 9.839 1.00 0.00 O ATOM 67 O5' DT B 103 10.344 12.170 11.297 1.00 0.00 O ATOM 68 C5' DT B 103 9.782 12.561 12.556 1.00 0.00 C ATOM 69 C4' DT B 103 8.450 13.307 12.399 1.00 0.00 C ATOM 70 O4' DT B 103 8.667 14.621 11.840 1.00 0.00 O ATOM 71 C3' DT B 103 7.466 12.559 11.485 1.00 0.00 C ATOM 72 O3' DT B 103 6.276 12.242 12.205 1.00 0.00 O ATOM 73 C2' DT B 103 7.140 13.528 10.367 1.00 0.00 C ATOM 74 C1' DT B 103 7.708 14.880 10.796 1.00 0.00 C ATOM 75 N1 DT B 103 8.342 15.607 9.662 1.00 0.00 N ATOM 76 C2 DT B 103 7.847 16.859 9.323 1.00 0.00 C ATOM 77 O2 DT B 103 6.898 17.367 9.917 1.00 0.00 O ATOM 78 N3 DT B 103 8.482 17.502 8.278 1.00 0.00 N ATOM 79 C4 DT B 103 9.551 17.012 7.549 1.00 0.00 C ATOM 80 O4 DT B 103 10.045 17.671 6.638 1.00 0.00 O ATOM 81 C5 DT B 103 9.995 15.703 7.966 1.00 0.00 C ATOM 82 C7 DT B 103 11.156 15.041 7.216 1.00 0.00 C ATOM 83 C6 DT B 103 9.390 15.057 8.989 1.00 0.00 C ATOM 0 H5' DT B 103 10.491 13.198 13.085 1.00 0.00 H new ATOM 0 H5'' DT B 103 9.628 11.675 13.172 1.00 0.00 H new ATOM 0 H4' DT B 103 8.020 13.378 13.398 1.00 0.00 H new ATOM 0 H3' DT B 103 7.888 11.626 11.112 1.00 0.00 H new ATOM 0 H2' DT B 103 7.583 13.200 9.426 1.00 0.00 H new ATOM 0 H2'' DT B 103 6.064 13.591 10.208 1.00 0.00 H new ATOM 0 H1' DT B 103 6.904 15.524 11.151 1.00 0.00 H new ATOM 0 H3 DT B 103 8.130 18.424 8.020 1.00 0.00 H new ATOM 0 H71 DT B 103 11.158 15.377 6.179 1.00 0.00 H new ATOM 0 H72 DT B 103 12.099 15.317 7.688 1.00 0.00 H new ATOM 0 H73 DT B 103 11.038 13.958 7.247 1.00 0.00 H new ATOM 0 H6 DT B 103 9.747 14.080 9.279 1.00 0.00 H new ATOM 96 P DG B 104 5.092 11.381 11.533 1.00 0.00 P ATOM 97 OP1 DG B 104 4.326 10.725 12.615 1.00 0.00 O ATOM 98 OP2 DG B 104 5.680 10.563 10.449 1.00 0.00 O ATOM 99 O5' DG B 104 4.152 12.503 10.859 1.00 0.00 O ATOM 100 C5' DG B 104 3.549 13.515 11.668 1.00 0.00 C ATOM 101 C4' DG B 104 2.693 14.483 10.839 1.00 0.00 C ATOM 102 O4' DG B 104 3.535 15.290 9.976 1.00 0.00 O ATOM 103 C3' DG B 104 1.703 13.727 9.947 1.00 0.00 C ATOM 104 O3' DG B 104 0.379 14.233 10.129 1.00 0.00 O ATOM 105 C2' DG B 104 2.146 13.987 8.530 1.00 0.00 C ATOM 106 C1' DG B 104 3.152 15.124 8.590 1.00 0.00 C ATOM 107 N9 DG B 104 4.330 14.855 7.735 1.00 0.00 N ATOM 108 C8 DG B 104 5.122 13.743 7.667 1.00 0.00 C ATOM 109 N7 DG B 104 6.094 13.807 6.806 1.00 0.00 N ATOM 110 C5 DG B 104 5.941 15.074 6.245 1.00 0.00 C ATOM 111 C6 DG B 104 6.710 15.728 5.237 1.00 0.00 C ATOM 112 O6 DG B 104 7.699 15.312 4.636 1.00 0.00 O ATOM 113 N1 DG B 104 6.216 16.996 4.965 1.00 0.00 N ATOM 114 C2 DG B 104 5.123 17.570 5.579 1.00 0.00 C ATOM 115 N2 DG B 104 4.809 18.805 5.186 1.00 0.00 N ATOM 116 N3 DG B 104 4.400 16.962 6.524 1.00 0.00 N ATOM 117 C4 DG B 104 4.863 15.722 6.806 1.00 0.00 C ATOM 0 H5' DG B 104 4.327 14.074 12.188 1.00 0.00 H new ATOM 0 H5'' DG B 104 2.929 13.046 12.432 1.00 0.00 H new ATOM 0 H4' DG B 104 2.149 15.111 11.544 1.00 0.00 H new ATOM 0 H3' DG B 104 1.689 12.664 10.187 1.00 0.00 H new ATOM 0 H2' DG B 104 2.596 13.095 8.095 1.00 0.00 H new ATOM 0 H2'' DG B 104 1.296 14.254 7.902 1.00 0.00 H new ATOM 0 H1' DG B 104 2.704 16.041 8.207 1.00 0.00 H new ATOM 0 H8 DG B 104 4.952 12.873 8.284 1.00 0.00 H new ATOM 0 H1 DG B 104 6.699 17.546 4.255 1.00 0.00 H new ATOM 0 H21 DG B 104 4.011 19.285 5.602 1.00 0.00 H new ATOM 0 H22 DG B 104 5.367 19.269 4.470 1.00 0.00 H new ATOM 129 P DC B 105 -0.853 13.551 9.351 1.00 0.00 P ATOM 130 OP1 DC B 105 -2.088 13.802 10.129 1.00 0.00 O ATOM 131 OP2 DC B 105 -0.453 12.167 9.030 1.00 0.00 O ATOM 132 O5' DC B 105 -0.959 14.363 7.960 1.00 0.00 O ATOM 133 C5' DC B 105 -1.226 15.767 7.950 1.00 0.00 C ATOM 134 C4' DC B 105 -1.286 16.338 6.524 1.00 0.00 C ATOM 135 O4' DC B 105 0.028 16.369 5.909 1.00 0.00 O ATOM 136 C3' DC B 105 -2.210 15.509 5.620 1.00 0.00 C ATOM 137 O3' DC B 105 -3.287 16.322 5.133 1.00 0.00 O ATOM 138 C2' DC B 105 -1.348 15.051 4.469 1.00 0.00 C ATOM 139 C1' DC B 105 -0.035 15.807 4.577 1.00 0.00 C ATOM 140 N1 DC B 105 1.143 14.934 4.303 1.00 0.00 N ATOM 141 C2 DC B 105 1.982 15.268 3.242 1.00 0.00 C ATOM 142 O2 DC B 105 1.730 16.246 2.543 1.00 0.00 O ATOM 143 N3 DC B 105 3.073 14.488 3.008 1.00 0.00 N ATOM 144 C4 DC B 105 3.337 13.426 3.778 1.00 0.00 C ATOM 145 N4 DC B 105 4.403 12.672 3.508 1.00 0.00 N ATOM 146 C5 DC B 105 2.482 13.082 4.872 1.00 0.00 C ATOM 147 C6 DC B 105 1.402 13.861 5.092 1.00 0.00 C ATOM 0 H5' DC B 105 -0.452 16.286 8.515 1.00 0.00 H new ATOM 0 H5'' DC B 105 -2.172 15.959 8.456 1.00 0.00 H new ATOM 0 H4' DC B 105 -1.676 17.351 6.621 1.00 0.00 H new ATOM 0 H3' DC B 105 -2.651 14.669 6.157 1.00 0.00 H new ATOM 0 H2' DC B 105 -1.180 13.975 4.516 1.00 0.00 H new ATOM 0 H2'' DC B 105 -1.835 15.256 3.516 1.00 0.00 H new ATOM 0 H1' DC B 105 0.000 16.594 3.823 1.00 0.00 H new ATOM 0 H41 DC B 105 4.614 11.860 4.088 1.00 0.00 H new ATOM 0 H42 DC B 105 5.008 12.907 2.721 1.00 0.00 H new ATOM 0 H5 DC B 105 2.693 12.229 5.500 1.00 0.00 H new ATOM 0 H6 DC B 105 0.734 13.627 5.908 1.00 0.00 H new ATOM 159 P DA B 106 -4.418 15.714 4.158 1.00 0.00 P ATOM 160 OP1 DA B 106 -5.654 16.507 4.340 1.00 0.00 O ATOM 161 OP2 DA B 106 -4.453 14.247 4.352 1.00 0.00 O ATOM 162 O5' DA B 106 -3.853 16.007 2.673 1.00 0.00 O ATOM 163 C5' DA B 106 -3.646 17.353 2.229 1.00 0.00 C ATOM 164 C4' DA B 106 -3.106 17.414 0.793 1.00 0.00 C ATOM 165 O4' DA B 106 -1.733 16.958 0.721 1.00 0.00 O ATOM 166 C3' DA B 106 -3.939 16.553 -0.161 1.00 0.00 C ATOM 167 O3' DA B 106 -4.491 17.357 -1.194 1.00 0.00 O ATOM 168 C2' DA B 106 -2.975 15.547 -0.759 1.00 0.00 C ATOM 169 C1' DA B 106 -1.580 15.971 -0.331 1.00 0.00 C ATOM 170 N9 DA B 106 -0.808 14.824 0.149 1.00 0.00 N ATOM 171 C8 DA B 106 -1.085 14.029 1.195 1.00 0.00 C ATOM 172 N7 DA B 106 -0.199 13.121 1.459 1.00 0.00 N ATOM 173 C5 DA B 106 0.759 13.331 0.469 1.00 0.00 C ATOM 174 C6 DA B 106 1.967 12.692 0.170 1.00 0.00 C ATOM 175 N6 DA B 106 2.449 11.673 0.879 1.00 0.00 N ATOM 176 N1 DA B 106 2.660 13.146 -0.886 1.00 0.00 N ATOM 177 C2 DA B 106 2.197 14.165 -1.607 1.00 0.00 C ATOM 178 N3 DA B 106 1.069 14.844 -1.406 1.00 0.00 N ATOM 179 C4 DA B 106 0.394 14.366 -0.340 1.00 0.00 C ATOM 0 H5' DA B 106 -2.946 17.851 2.900 1.00 0.00 H new ATOM 0 H5'' DA B 106 -4.587 17.901 2.285 1.00 0.00 H new ATOM 0 H4' DA B 106 -3.166 18.460 0.493 1.00 0.00 H new ATOM 0 H3' DA B 106 -4.765 16.068 0.359 1.00 0.00 H new ATOM 0 H2' DA B 106 -3.199 14.540 -0.407 1.00 0.00 H new ATOM 0 H2'' DA B 106 -3.058 15.530 -1.846 1.00 0.00 H new ATOM 0 H1' DA B 106 -1.036 16.390 -1.177 1.00 0.00 H new ATOM 0 H8 DA B 106 -1.987 14.139 1.778 1.00 0.00 H new ATOM 0 H61 DA B 106 3.336 11.243 0.616 1.00 0.00 H new ATOM 0 H62 DA B 106 1.931 11.322 1.685 1.00 0.00 H new ATOM 0 H2 DA B 106 2.802 14.475 -2.446 1.00 0.00 H new ATOM 191 P DG B 107 -5.406 16.687 -2.324 1.00 0.00 P ATOM 192 OP1 DG B 107 -6.243 17.741 -2.939 1.00 0.00 O ATOM 193 OP2 DG B 107 -6.034 15.469 -1.762 1.00 0.00 O ATOM 194 O5' DG B 107 -4.285 16.241 -3.380 1.00 0.00 O ATOM 195 C5' DG B 107 -3.436 17.218 -3.973 1.00 0.00 C ATOM 196 C4' DG B 107 -2.448 16.578 -4.941 1.00 0.00 C ATOM 197 O4' DG B 107 -1.436 15.800 -4.248 1.00 0.00 O ATOM 198 C3' DG B 107 -3.155 15.649 -5.927 1.00 0.00 C ATOM 199 O3' DG B 107 -2.923 16.117 -7.256 1.00 0.00 O ATOM 200 C2' DG B 107 -2.548 14.284 -5.693 1.00 0.00 C ATOM 201 C1' DG B 107 -1.276 14.522 -4.906 1.00 0.00 C ATOM 202 N9 DG B 107 -1.000 13.433 -3.936 1.00 0.00 N ATOM 203 C8 DG B 107 -1.749 12.985 -2.877 1.00 0.00 C ATOM 204 N7 DG B 107 -1.226 12.022 -2.204 1.00 0.00 N ATOM 205 C5 DG B 107 -0.028 11.786 -2.848 1.00 0.00 C ATOM 206 C6 DG B 107 0.966 10.836 -2.545 1.00 0.00 C ATOM 207 O6 DG B 107 0.956 10.003 -1.648 1.00 0.00 O ATOM 208 N1 DG B 107 2.032 10.913 -3.427 1.00 0.00 N ATOM 209 C2 DG B 107 2.125 11.796 -4.480 1.00 0.00 C ATOM 210 N2 DG B 107 3.233 11.710 -5.220 1.00 0.00 N ATOM 211 N3 DG B 107 1.179 12.702 -4.773 1.00 0.00 N ATOM 212 C4 DG B 107 0.132 12.639 -3.913 1.00 0.00 C ATOM 0 H5' DG B 107 -2.891 17.751 -3.194 1.00 0.00 H new ATOM 0 H5'' DG B 107 -4.040 17.956 -4.501 1.00 0.00 H new ATOM 0 H4' DG B 107 -1.976 17.403 -5.474 1.00 0.00 H new ATOM 0 H3' DG B 107 -4.236 15.614 -5.789 1.00 0.00 H new ATOM 0 H2' DG B 107 -3.234 13.641 -5.141 1.00 0.00 H new ATOM 0 H2'' DG B 107 -2.334 13.785 -6.638 1.00 0.00 H new ATOM 0 H1' DG B 107 -0.412 14.530 -5.571 1.00 0.00 H new ATOM 0 H8 DG B 107 -2.709 13.411 -2.627 1.00 0.00 H new ATOM 0 H1 DG B 107 2.808 10.266 -3.286 1.00 0.00 H new ATOM 0 H21 DG B 107 3.365 12.335 -6.015 1.00 0.00 H new ATOM 0 H22 DG B 107 3.947 11.019 -4.990 1.00 0.00 H new ATOM 224 P DA B 108 -3.524 15.372 -8.546 1.00 0.00 P ATOM 225 OP1 DA B 108 -3.850 16.391 -9.568 1.00 0.00 O ATOM 226 OP2 DA B 108 -4.561 14.418 -8.093 1.00 0.00 O ATOM 227 O5' DA B 108 -2.251 14.531 -9.055 1.00 0.00 O ATOM 228 C5' DA B 108 -1.065 15.245 -9.421 1.00 0.00 C ATOM 229 C4' DA B 108 0.057 14.317 -9.883 1.00 0.00 C ATOM 230 O4' DA B 108 0.585 13.561 -8.765 1.00 0.00 O ATOM 231 C3' DA B 108 -0.421 13.318 -10.943 1.00 0.00 C ATOM 232 O3' DA B 108 0.330 13.475 -12.149 1.00 0.00 O ATOM 233 C2' DA B 108 -0.190 11.950 -10.356 1.00 0.00 C ATOM 234 C1' DA B 108 0.595 12.148 -9.069 1.00 0.00 C ATOM 235 N9 DA B 108 0.014 11.351 -7.968 1.00 0.00 N ATOM 236 C8 DA B 108 -1.279 11.303 -7.519 1.00 0.00 C ATOM 237 N7 DA B 108 -1.519 10.396 -6.627 1.00 0.00 N ATOM 238 C5 DA B 108 -0.277 9.794 -6.453 1.00 0.00 C ATOM 239 C6 DA B 108 0.150 8.754 -5.637 1.00 0.00 C ATOM 240 N6 DA B 108 -0.685 8.065 -4.871 1.00 0.00 N ATOM 241 N1 DA B 108 1.449 8.408 -5.689 1.00 0.00 N ATOM 242 C2 DA B 108 2.282 9.048 -6.510 1.00 0.00 C ATOM 243 N3 DA B 108 1.974 10.046 -7.340 1.00 0.00 N ATOM 244 C4 DA B 108 0.663 10.369 -7.254 1.00 0.00 C ATOM 0 H5' DA B 108 -0.720 15.831 -8.569 1.00 0.00 H new ATOM 0 H5'' DA B 108 -1.301 15.950 -10.218 1.00 0.00 H new ATOM 0 H4' DA B 108 0.827 14.956 -10.315 1.00 0.00 H new ATOM 0 H3' DA B 108 -1.470 13.473 -11.194 1.00 0.00 H new ATOM 0 H2' DA B 108 -1.138 11.450 -10.157 1.00 0.00 H new ATOM 0 H2'' DA B 108 0.363 11.319 -11.052 1.00 0.00 H new ATOM 0 H1' DA B 108 1.622 11.803 -9.191 1.00 0.00 H new ATOM 0 H8 DA B 108 -2.043 11.974 -7.883 1.00 0.00 H new ATOM 0 H61 DA B 108 -0.333 7.308 -4.285 1.00 0.00 H new ATOM 0 H62 DA B 108 -1.679 8.292 -4.868 1.00 0.00 H new ATOM 0 H2 DA B 108 3.313 8.725 -6.502 1.00 0.00 H new ATOM 256 P DT B 109 0.029 12.546 -13.427 1.00 0.00 P ATOM 257 OP1 DT B 109 0.469 13.266 -14.644 1.00 0.00 O ATOM 258 OP2 DT B 109 -1.362 12.052 -13.323 1.00 0.00 O ATOM 259 O5' DT B 109 1.028 11.303 -13.184 1.00 0.00 O ATOM 260 C5' DT B 109 2.437 11.539 -13.108 1.00 0.00 C ATOM 261 C4' DT B 109 3.240 10.259 -12.842 1.00 0.00 C ATOM 262 O4' DT B 109 3.024 9.800 -11.487 1.00 0.00 O ATOM 263 C3' DT B 109 2.857 9.119 -13.799 1.00 0.00 C ATOM 264 O3' DT B 109 3.961 8.759 -14.626 1.00 0.00 O ATOM 265 C2' DT B 109 2.517 7.943 -12.908 1.00 0.00 C ATOM 266 C1' DT B 109 2.791 8.377 -11.471 1.00 0.00 C ATOM 267 N1 DT B 109 1.652 8.030 -10.580 1.00 0.00 N ATOM 268 C2 DT B 109 1.883 7.185 -9.501 1.00 0.00 C ATOM 269 O2 DT B 109 2.992 6.704 -9.274 1.00 0.00 O ATOM 270 N3 DT B 109 0.792 6.912 -8.699 1.00 0.00 N ATOM 271 C4 DT B 109 -0.491 7.401 -8.874 1.00 0.00 C ATOM 272 O4 DT B 109 -1.388 7.098 -8.095 1.00 0.00 O ATOM 273 C5 DT B 109 -0.640 8.266 -10.021 1.00 0.00 C ATOM 274 C7 DT B 109 -2.026 8.841 -10.341 1.00 0.00 C ATOM 275 C6 DT B 109 0.416 8.547 -10.818 1.00 0.00 C ATOM 0 H5' DT B 109 2.638 12.260 -12.316 1.00 0.00 H new ATOM 0 H5'' DT B 109 2.777 11.988 -14.041 1.00 0.00 H new ATOM 0 H4' DT B 109 4.288 10.514 -13.002 1.00 0.00 H new ATOM 0 H3' DT B 109 2.034 9.415 -14.449 1.00 0.00 H new ATOM 0 H2' DT B 109 1.473 7.655 -13.031 1.00 0.00 H new ATOM 0 H2'' DT B 109 3.120 7.074 -13.170 1.00 0.00 H new ATOM 0 H1' DT B 109 3.663 7.855 -11.077 1.00 0.00 H new ATOM 0 H3 DT B 109 0.946 6.292 -7.904 1.00 0.00 H new ATOM 0 H71 DT B 109 -2.795 8.144 -10.007 1.00 0.00 H new ATOM 0 H72 DT B 109 -2.152 9.794 -9.827 1.00 0.00 H new ATOM 0 H73 DT B 109 -2.117 8.994 -11.416 1.00 0.00 H new ATOM 0 H6 DT B 109 0.274 9.200 -11.667 1.00 0.00 H new ATOM 288 P DA B 110 3.812 7.609 -15.748 1.00 0.00 P ATOM 289 OP1 DA B 110 4.833 7.844 -16.792 1.00 0.00 O ATOM 290 OP2 DA B 110 2.383 7.510 -16.123 1.00 0.00 O ATOM 291 O5' DA B 110 4.212 6.280 -14.933 1.00 0.00 O ATOM 292 C5' DA B 110 5.502 6.164 -14.340 1.00 0.00 C ATOM 293 C4' DA B 110 5.680 4.836 -13.598 1.00 0.00 C ATOM 294 O4' DA B 110 4.692 4.739 -12.531 1.00 0.00 O ATOM 295 C3' DA B 110 5.471 3.622 -14.504 1.00 0.00 C ATOM 296 O3' DA B 110 6.475 2.642 -14.208 1.00 0.00 O ATOM 297 C2' DA B 110 4.102 3.096 -14.174 1.00 0.00 C ATOM 298 C1' DA B 110 3.734 3.681 -12.819 1.00 0.00 C ATOM 299 N9 DA B 110 2.336 4.189 -12.806 1.00 0.00 N ATOM 300 C8 DA B 110 1.701 5.005 -13.702 1.00 0.00 C ATOM 301 N7 DA B 110 0.457 5.261 -13.434 1.00 0.00 N ATOM 302 C5 DA B 110 0.236 4.558 -12.253 1.00 0.00 C ATOM 303 C6 DA B 110 -0.894 4.411 -11.438 1.00 0.00 C ATOM 304 N6 DA B 110 -2.071 4.972 -11.716 1.00 0.00 N ATOM 305 N1 DA B 110 -0.772 3.646 -10.340 1.00 0.00 N ATOM 306 C2 DA B 110 0.390 3.057 -10.060 1.00 0.00 C ATOM 307 N3 DA B 110 1.521 3.128 -10.764 1.00 0.00 N ATOM 308 C4 DA B 110 1.370 3.903 -11.859 1.00 0.00 C ATOM 0 H5' DA B 110 5.656 6.990 -13.646 1.00 0.00 H new ATOM 0 H5'' DA B 110 6.265 6.251 -15.114 1.00 0.00 H new ATOM 0 H4' DA B 110 6.702 4.829 -13.219 1.00 0.00 H new ATOM 0 H3' DA B 110 5.548 3.871 -15.562 1.00 0.00 H new ATOM 0 H2' DA B 110 3.379 3.391 -14.934 1.00 0.00 H new ATOM 0 H2'' DA B 110 4.102 2.007 -14.140 1.00 0.00 H new ATOM 0 H1' DA B 110 3.779 2.911 -12.048 1.00 0.00 H new ATOM 0 H8 DA B 110 2.200 5.408 -14.571 1.00 0.00 H new ATOM 0 H61 DA B 110 -2.863 4.833 -11.088 1.00 0.00 H new ATOM 0 H62 DA B 110 -2.179 5.540 -12.556 1.00 0.00 H new ATOM 0 H2 DA B 110 0.419 2.455 -9.164 1.00 0.00 H new ATOM 320 P DA B 111 6.561 1.226 -14.976 1.00 0.00 P ATOM 321 OP1 DA B 111 7.988 0.848 -15.099 1.00 0.00 O ATOM 322 OP2 DA B 111 5.706 1.296 -16.182 1.00 0.00 O ATOM 323 O5' DA B 111 5.862 0.229 -13.915 1.00 0.00 O ATOM 324 C5' DA B 111 6.443 0.099 -12.612 1.00 0.00 C ATOM 325 C4' DA B 111 5.659 -0.833 -11.679 1.00 0.00 C ATOM 326 O4' DA B 111 4.370 -0.252 -11.370 1.00 0.00 O ATOM 327 C3' DA B 111 5.421 -2.223 -12.284 1.00 0.00 C ATOM 328 O3' DA B 111 5.928 -3.227 -11.402 1.00 0.00 O ATOM 329 C2' DA B 111 3.921 -2.365 -12.409 1.00 0.00 C ATOM 330 C1' DA B 111 3.303 -1.163 -11.703 1.00 0.00 C ATOM 331 N9 DA B 111 2.307 -0.508 -12.570 1.00 0.00 N ATOM 332 C8 DA B 111 2.461 -0.028 -13.833 1.00 0.00 C ATOM 333 N7 DA B 111 1.399 0.504 -14.357 1.00 0.00 N ATOM 334 C5 DA B 111 0.449 0.363 -13.349 1.00 0.00 C ATOM 335 C6 DA B 111 -0.900 0.722 -13.260 1.00 0.00 C ATOM 336 N6 DA B 111 -1.559 1.329 -14.249 1.00 0.00 N ATOM 337 N1 DA B 111 -1.542 0.432 -12.117 1.00 0.00 N ATOM 338 C2 DA B 111 -0.896 -0.175 -11.118 1.00 0.00 C ATOM 339 N3 DA B 111 0.375 -0.555 -11.099 1.00 0.00 N ATOM 340 C4 DA B 111 0.994 -0.252 -12.256 1.00 0.00 C ATOM 0 H5' DA B 111 6.510 1.086 -12.153 1.00 0.00 H new ATOM 0 H5'' DA B 111 7.462 -0.275 -12.713 1.00 0.00 H new ATOM 0 H4' DA B 111 6.267 -0.950 -10.782 1.00 0.00 H new ATOM 0 H3' DA B 111 5.921 -2.336 -13.246 1.00 0.00 H new ATOM 0 H2' DA B 111 3.622 -2.394 -13.457 1.00 0.00 H new ATOM 0 H2'' DA B 111 3.582 -3.296 -11.955 1.00 0.00 H new ATOM 0 H1' DA B 111 2.785 -1.481 -10.798 1.00 0.00 H new ATOM 0 H8 DA B 111 3.400 -0.085 -14.363 1.00 0.00 H new ATOM 0 H61 DA B 111 -2.543 1.570 -14.133 1.00 0.00 H new ATOM 0 H62 DA B 111 -1.078 1.552 -15.120 1.00 0.00 H new ATOM 0 H2 DA B 111 -1.472 -0.379 -10.227 1.00 0.00 H new ATOM 352 P DA B 112 5.827 -4.796 -11.758 1.00 0.00 P ATOM 353 OP1 DA B 112 6.895 -5.508 -11.020 1.00 0.00 O ATOM 354 OP2 DA B 112 5.729 -4.933 -13.228 1.00 0.00 O ATOM 355 O5' DA B 112 4.408 -5.208 -11.117 1.00 0.00 O ATOM 356 C5' DA B 112 4.182 -5.051 -9.716 1.00 0.00 C ATOM 357 C4' DA B 112 2.738 -5.389 -9.326 1.00 0.00 C ATOM 358 O4' DA B 112 1.831 -4.456 -9.979 1.00 0.00 O ATOM 359 C3' DA B 112 2.330 -6.801 -9.766 1.00 0.00 C ATOM 360 O3' DA B 112 1.690 -7.488 -8.676 1.00 0.00 O ATOM 361 C2' DA B 112 1.372 -6.607 -10.910 1.00 0.00 C ATOM 362 C1' DA B 112 0.882 -5.170 -10.810 1.00 0.00 C ATOM 363 N9 DA B 112 0.733 -4.550 -12.151 1.00 0.00 N ATOM 364 C8 DA B 112 1.609 -4.519 -13.202 1.00 0.00 C ATOM 365 N7 DA B 112 1.178 -3.904 -14.263 1.00 0.00 N ATOM 366 C5 DA B 112 -0.096 -3.488 -13.892 1.00 0.00 C ATOM 367 C6 DA B 112 -1.095 -2.778 -14.570 1.00 0.00 C ATOM 368 N6 DA B 112 -0.956 -2.336 -15.822 1.00 0.00 N ATOM 369 N1 DA B 112 -2.239 -2.538 -13.909 1.00 0.00 N ATOM 370 C2 DA B 112 -2.394 -2.969 -12.658 1.00 0.00 C ATOM 371 N3 DA B 112 -1.516 -3.648 -11.927 1.00 0.00 N ATOM 372 C4 DA B 112 -0.379 -3.876 -12.612 1.00 0.00 C ATOM 0 H5' DA B 112 4.405 -4.024 -9.426 1.00 0.00 H new ATOM 0 H5'' DA B 112 4.867 -5.695 -9.164 1.00 0.00 H new ATOM 0 H4' DA B 112 2.680 -5.324 -8.239 1.00 0.00 H new ATOM 0 H3' DA B 112 3.188 -7.403 -10.065 1.00 0.00 H new ATOM 0 H2' DA B 112 1.865 -6.785 -11.866 1.00 0.00 H new ATOM 0 H2'' DA B 112 0.540 -7.308 -10.845 1.00 0.00 H new ATOM 0 H1' DA B 112 -0.111 -5.131 -10.362 1.00 0.00 H new ATOM 0 H8 DA B 112 2.588 -4.973 -13.153 1.00 0.00 H new ATOM 0 H61 DA B 112 -1.716 -1.823 -16.269 1.00 0.00 H new ATOM 0 H62 DA B 112 -0.090 -2.511 -16.331 1.00 0.00 H new ATOM 0 H2 DA B 112 -3.338 -2.741 -12.185 1.00 0.00 H new ATOM 384 P DC B 113 1.147 -9.001 -8.830 1.00 0.00 P ATOM 385 OP1 DC B 113 1.334 -9.687 -7.531 1.00 0.00 O ATOM 386 OP2 DC B 113 1.739 -9.580 -10.056 1.00 0.00 O ATOM 387 O5' DC B 113 -0.444 -8.815 -9.073 1.00 0.00 O ATOM 388 C5' DC B 113 -1.242 -8.174 -8.068 1.00 0.00 C ATOM 389 C4' DC B 113 -2.733 -8.070 -8.441 1.00 0.00 C ATOM 390 O4' DC B 113 -2.941 -7.098 -9.495 1.00 0.00 O ATOM 391 C3' DC B 113 -3.334 -9.400 -8.910 1.00 0.00 C ATOM 392 O3' DC B 113 -4.468 -9.730 -8.097 1.00 0.00 O ATOM 393 C2' DC B 113 -3.772 -9.177 -10.337 1.00 0.00 C ATOM 394 C1' DC B 113 -3.705 -7.678 -10.583 1.00 0.00 C ATOM 395 N1 DC B 113 -3.068 -7.351 -11.884 1.00 0.00 N ATOM 396 C2 DC B 113 -3.791 -6.606 -12.815 1.00 0.00 C ATOM 397 O2 DC B 113 -4.969 -6.322 -12.600 1.00 0.00 O ATOM 398 N3 DC B 113 -3.163 -6.211 -13.953 1.00 0.00 N ATOM 399 C4 DC B 113 -1.882 -6.527 -14.178 1.00 0.00 C ATOM 400 N4 DC B 113 -1.302 -6.109 -15.303 1.00 0.00 N ATOM 401 C5 DC B 113 -1.137 -7.297 -13.229 1.00 0.00 C ATOM 402 C6 DC B 113 -1.776 -7.691 -12.107 1.00 0.00 C ATOM 0 H5' DC B 113 -0.850 -7.173 -7.888 1.00 0.00 H new ATOM 0 H5'' DC B 113 -1.147 -8.726 -7.133 1.00 0.00 H new ATOM 0 H4' DC B 113 -3.234 -7.764 -7.523 1.00 0.00 H new ATOM 0 H3' DC B 113 -2.617 -10.217 -8.835 1.00 0.00 H new ATOM 0 H2' DC B 113 -3.123 -9.713 -11.030 1.00 0.00 H new ATOM 0 H2'' DC B 113 -4.784 -9.551 -10.495 1.00 0.00 H new ATOM 0 H1' DC B 113 -4.716 -7.272 -10.623 1.00 0.00 H new ATOM 0 H41 DC B 113 -0.327 -6.341 -15.490 1.00 0.00 H new ATOM 0 H42 DC B 113 -1.834 -5.557 -15.976 1.00 0.00 H new ATOM 0 H5 DC B 113 -0.103 -7.553 -13.404 1.00 0.00 H new ATOM 0 H6 DC B 113 -1.249 -8.286 -11.376 1.00 0.00 H new ATOM 414 P DA B 114 -5.320 -11.077 -8.343 1.00 0.00 P ATOM 415 OP1 DA B 114 -5.995 -11.435 -7.074 1.00 0.00 O ATOM 416 OP2 DA B 114 -4.449 -12.063 -9.020 1.00 0.00 O ATOM 417 O5' DA B 114 -6.447 -10.587 -9.395 1.00 0.00 O ATOM 418 C5' DA B 114 -7.361 -9.542 -9.030 1.00 0.00 C ATOM 419 C4' DA B 114 -8.357 -9.194 -10.151 1.00 0.00 C ATOM 420 O4' DA B 114 -7.695 -8.510 -11.248 1.00 0.00 O ATOM 421 C3' DA B 114 -9.055 -10.430 -10.730 1.00 0.00 C ATOM 422 O3' DA B 114 -10.473 -10.316 -10.573 1.00 0.00 O ATOM 423 C2' DA B 114 -8.696 -10.460 -12.195 1.00 0.00 C ATOM 424 C1' DA B 114 -8.036 -9.130 -12.514 1.00 0.00 C ATOM 425 N9 DA B 114 -6.840 -9.310 -13.353 1.00 0.00 N ATOM 426 C8 DA B 114 -5.716 -9.998 -13.062 1.00 0.00 C ATOM 427 N7 DA B 114 -4.773 -9.934 -13.952 1.00 0.00 N ATOM 428 C5 DA B 114 -5.331 -9.128 -14.939 1.00 0.00 C ATOM 429 C6 DA B 114 -4.847 -8.666 -16.167 1.00 0.00 C ATOM 430 N6 DA B 114 -3.620 -8.934 -16.613 1.00 0.00 N ATOM 431 N1 DA B 114 -5.664 -7.894 -16.902 1.00 0.00 N ATOM 432 C2 DA B 114 -6.883 -7.588 -16.456 1.00 0.00 C ATOM 433 N3 DA B 114 -7.437 -7.967 -15.304 1.00 0.00 N ATOM 434 C4 DA B 114 -6.596 -8.744 -14.588 1.00 0.00 C ATOM 0 H5' DA B 114 -6.795 -8.649 -8.764 1.00 0.00 H new ATOM 0 H5'' DA B 114 -7.914 -9.845 -8.141 1.00 0.00 H new ATOM 0 H4' DA B 114 -9.102 -8.548 -9.685 1.00 0.00 H new ATOM 0 H3' DA B 114 -8.742 -11.342 -10.221 1.00 0.00 H new ATOM 0 H2' DA B 114 -8.020 -11.288 -12.410 1.00 0.00 H new ATOM 0 H2'' DA B 114 -9.585 -10.607 -12.808 1.00 0.00 H new ATOM 0 H1' DA B 114 -8.716 -8.497 -13.083 1.00 0.00 H new ATOM 0 H8 DA B 114 -5.608 -10.565 -12.149 1.00 0.00 H new ATOM 0 H61 DA B 114 -3.316 -8.572 -17.517 1.00 0.00 H new ATOM 0 H62 DA B 114 -2.985 -9.501 -16.050 1.00 0.00 H new ATOM 0 H2 DA B 114 -7.488 -6.965 -17.098 1.00 0.00 H new ATOM 446 P DT B 115 -11.464 -11.476 -11.093 1.00 0.00 P ATOM 447 OP1 DT B 115 -12.721 -11.400 -10.313 1.00 0.00 O ATOM 448 OP2 DT B 115 -10.704 -12.744 -11.150 1.00 0.00 O ATOM 449 O5' DT B 115 -11.777 -11.007 -12.609 1.00 0.00 O ATOM 450 C5' DT B 115 -12.433 -9.752 -12.841 1.00 0.00 C ATOM 451 C4' DT B 115 -12.641 -9.444 -14.334 1.00 0.00 C ATOM 452 O4' DT B 115 -11.370 -9.145 -14.963 1.00 0.00 O ATOM 453 C3' DT B 115 -13.285 -10.612 -15.101 1.00 0.00 C ATOM 454 O3' DT B 115 -14.534 -10.223 -15.673 1.00 0.00 O ATOM 455 C2' DT B 115 -12.326 -10.937 -16.225 1.00 0.00 C ATOM 456 C1' DT B 115 -11.266 -9.837 -16.223 1.00 0.00 C ATOM 457 N1 DT B 115 -9.902 -10.399 -16.426 1.00 0.00 N ATOM 458 C2 DT B 115 -9.170 -9.975 -17.526 1.00 0.00 C ATOM 459 O2 DT B 115 -9.600 -9.138 -18.316 1.00 0.00 O ATOM 460 N3 DT B 115 -7.923 -10.549 -17.680 1.00 0.00 N ATOM 461 C4 DT B 115 -7.349 -11.493 -16.850 1.00 0.00 C ATOM 462 O4 DT B 115 -6.229 -11.940 -17.087 1.00 0.00 O ATOM 463 C5 DT B 115 -8.181 -11.872 -15.733 1.00 0.00 C ATOM 464 C7 DT B 115 -7.678 -12.938 -14.756 1.00 0.00 C ATOM 465 C6 DT B 115 -9.401 -11.320 -15.560 1.00 0.00 C ATOM 0 H5' DT B 115 -11.844 -8.953 -12.390 1.00 0.00 H new ATOM 0 H5'' DT B 115 -13.401 -9.757 -12.339 1.00 0.00 H new ATOM 0 H4' DT B 115 -13.315 -8.589 -14.377 1.00 0.00 H new ATOM 0 H3' DT B 115 -13.468 -11.455 -14.435 1.00 0.00 H new ATOM 0 H2' DT B 115 -11.870 -11.915 -16.075 1.00 0.00 H new ATOM 0 H2'' DT B 115 -12.847 -10.972 -17.182 1.00 0.00 H new ATOM 0 H1' DT B 115 -11.434 -9.145 -17.048 1.00 0.00 H new ATOM 0 H3 DT B 115 -7.373 -10.247 -18.484 1.00 0.00 H new ATOM 0 H71 DT B 115 -7.026 -13.635 -15.282 1.00 0.00 H new ATOM 0 H72 DT B 115 -7.122 -12.459 -13.950 1.00 0.00 H new ATOM 0 H73 DT B 115 -8.527 -13.479 -14.339 1.00 0.00 H new ATOM 0 H6 DT B 115 -9.996 -11.618 -14.710 1.00 0.00 H new ATOM 478 P DT B 116 -15.477 -11.313 -16.394 1.00 0.00 P ATOM 479 OP1 DT B 116 -16.867 -10.806 -16.377 1.00 0.00 O ATOM 480 OP2 DT B 116 -15.173 -12.641 -15.818 1.00 0.00 O ATOM 481 O5' DT B 116 -14.955 -11.294 -17.919 1.00 0.00 O ATOM 482 C5' DT B 116 -15.008 -10.094 -18.692 1.00 0.00 C ATOM 483 C4' DT B 116 -14.284 -10.249 -20.035 1.00 0.00 C ATOM 484 O4' DT B 116 -12.861 -10.420 -19.829 1.00 0.00 O ATOM 485 C3' DT B 116 -14.793 -11.459 -20.832 1.00 0.00 C ATOM 486 O3' DT B 116 -15.510 -11.032 -21.994 1.00 0.00 O ATOM 487 C2' DT B 116 -13.557 -12.239 -21.231 1.00 0.00 C ATOM 488 C1' DT B 116 -12.357 -11.495 -20.651 1.00 0.00 C ATOM 489 N1 DT B 116 -11.497 -12.418 -19.859 1.00 0.00 N ATOM 490 C2 DT B 116 -10.182 -12.605 -20.265 1.00 0.00 C ATOM 491 O2 DT B 116 -9.718 -12.039 -21.253 1.00 0.00 O ATOM 492 N3 DT B 116 -9.422 -13.464 -19.496 1.00 0.00 N ATOM 493 C4 DT B 116 -9.848 -14.145 -18.373 1.00 0.00 C ATOM 494 O4 DT B 116 -9.081 -14.890 -17.767 1.00 0.00 O ATOM 495 C5 DT B 116 -11.227 -13.893 -18.018 1.00 0.00 C ATOM 496 C7 DT B 116 -11.818 -14.605 -16.795 1.00 0.00 C ATOM 497 C6 DT B 116 -11.993 -13.052 -18.756 1.00 0.00 C ATOM 0 H5' DT B 116 -14.556 -9.278 -18.128 1.00 0.00 H new ATOM 0 H5'' DT B 116 -16.048 -9.822 -18.869 1.00 0.00 H new ATOM 0 H4' DT B 116 -14.487 -9.339 -20.599 1.00 0.00 H new ATOM 0 H3' DT B 116 -15.479 -12.066 -20.241 1.00 0.00 H new ATOM 0 H2' DT B 116 -13.602 -13.258 -20.846 1.00 0.00 H new ATOM 0 H2'' DT B 116 -13.479 -12.311 -22.316 1.00 0.00 H new ATOM 0 HO3' DT B 116 -15.825 -11.816 -22.490 1.00 0.00 H new ATOM 0 H1' DT B 116 -11.737 -11.092 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H73 DT C 122 -6.553 3.165 -13.869 1.00 0.00 H new ATOM 0 H6 DT C 122 -7.844 1.437 -10.918 1.00 0.00 H new ATOM 703 P DT C 123 -8.791 0.634 -5.522 1.00 0.00 P ATOM 704 OP1 DT C 123 -9.640 0.178 -4.400 1.00 0.00 O ATOM 705 OP2 DT C 123 -8.879 2.033 -5.996 1.00 0.00 O ATOM 706 O5' DT C 123 -7.255 0.351 -5.138 1.00 0.00 O ATOM 707 C5' DT C 123 -6.833 -0.958 -4.764 1.00 0.00 C ATOM 708 C4' DT C 123 -5.337 -1.001 -4.442 1.00 0.00 C ATOM 709 O4' DT C 123 -4.558 -0.580 -5.595 1.00 0.00 O ATOM 710 C3' DT C 123 -4.970 -0.062 -3.287 1.00 0.00 C ATOM 711 O3' DT C 123 -4.153 -0.775 -2.343 1.00 0.00 O ATOM 712 C2' DT C 123 -4.218 1.079 -3.911 1.00 0.00 C ATOM 713 C1' DT C 123 -3.734 0.566 -5.254 1.00 0.00 C ATOM 714 N1 DT C 123 -3.792 1.617 -6.323 1.00 0.00 N ATOM 715 C2 DT C 123 -2.607 1.934 -6.982 1.00 0.00 C ATOM 716 O2 DT C 123 -1.537 1.405 -6.686 1.00 0.00 O ATOM 717 N3 DT C 123 -2.695 2.879 -7.988 1.00 0.00 N ATOM 718 C4 DT C 123 -3.841 3.533 -8.392 1.00 0.00 C ATOM 719 O4 DT C 123 -3.802 4.359 -9.302 1.00 0.00 O ATOM 720 C5 DT C 123 -5.029 3.156 -7.661 1.00 0.00 C ATOM 721 C7 DT C 123 -6.352 3.834 -8.024 1.00 0.00 C ATOM 722 C6 DT C 123 -4.976 2.227 -6.668 1.00 0.00 C ATOM 0 H5' DT C 123 -7.051 -1.655 -5.573 1.00 0.00 H new ATOM 0 H5'' DT C 123 -7.402 -1.289 -3.895 1.00 0.00 H new ATOM 0 H4' DT C 123 -5.113 -2.031 -4.165 1.00 0.00 H new ATOM 0 H3' DT C 123 -5.843 0.305 -2.748 1.00 0.00 H new ATOM 0 H2' DT C 123 -4.860 1.951 -4.033 1.00 0.00 H new ATOM 0 H2'' DT C 123 -3.381 1.386 -3.284 1.00 0.00 H new ATOM 0 H1' DT C 123 -2.684 0.283 -5.184 1.00 0.00 H new ATOM 0 H3 DT C 123 -1.832 3.115 -8.477 1.00 0.00 H new ATOM 0 H71 DT C 123 -6.156 4.841 -8.392 1.00 0.00 H new ATOM 0 H72 DT C 123 -6.856 3.257 -8.799 1.00 0.00 H new ATOM 0 H73 DT C 123 -6.988 3.888 -7.140 1.00 0.00 H new ATOM 0 H6 DT C 123 -5.881 1.963 -6.141 1.00 0.00 H new ATOM 735 P DA C 124 -3.585 -0.086 -0.998 1.00 0.00 P ATOM 736 OP1 DA C 124 -3.675 -1.075 0.099 1.00 0.00 O ATOM 737 OP2 DA C 124 -4.234 1.236 -0.852 1.00 0.00 O ATOM 738 O5' DA C 124 -2.018 0.159 -1.327 1.00 0.00 O ATOM 739 C5' DA C 124 -1.203 -0.980 -1.633 1.00 0.00 C ATOM 740 C4' DA C 124 0.281 -0.656 -1.880 1.00 0.00 C ATOM 741 O4' DA C 124 0.429 0.092 -3.114 1.00 0.00 O ATOM 742 C3' DA C 124 0.888 0.188 -0.750 1.00 0.00 C ATOM 743 O3' DA C 124 2.150 -0.340 -0.343 1.00 0.00 O ATOM 744 C2' DA C 124 1.100 1.558 -1.339 1.00 0.00 C ATOM 745 C1' DA C 124 0.929 1.422 -2.843 1.00 0.00 C ATOM 746 N9 DA C 124 0.020 2.450 -3.367 1.00 0.00 N ATOM 747 C8 DA C 124 -1.219 2.769 -2.937 1.00 0.00 C ATOM 748 N7 DA C 124 -1.813 3.716 -3.597 1.00 0.00 N ATOM 749 C5 DA C 124 -0.867 4.059 -4.561 1.00 0.00 C ATOM 750 C6 DA C 124 -0.864 5.005 -5.588 1.00 0.00 C ATOM 751 N6 DA C 124 -1.890 5.824 -5.818 1.00 0.00 N ATOM 752 N1 DA C 124 0.236 5.082 -6.358 1.00 0.00 N ATOM 753 C2 DA C 124 1.274 4.274 -6.129 1.00 0.00 C ATOM 754 N3 DA C 124 1.371 3.343 -5.185 1.00 0.00 N ATOM 755 C4 DA C 124 0.254 3.291 -4.431 1.00 0.00 C ATOM 0 H5' DA C 124 -1.606 -1.472 -2.518 1.00 0.00 H new ATOM 0 H5'' DA C 124 -1.274 -1.693 -0.812 1.00 0.00 H new ATOM 0 H4' DA C 124 0.803 -1.612 -1.931 1.00 0.00 H new ATOM 0 H3' DA C 124 0.235 0.198 0.123 1.00 0.00 H new ATOM 0 H2' DA C 124 0.382 2.269 -0.931 1.00 0.00 H new ATOM 0 H2'' DA C 124 2.094 1.934 -1.096 1.00 0.00 H new ATOM 0 H1' DA C 124 1.886 1.568 -3.344 1.00 0.00 H new ATOM 0 H8 DA C 124 -1.685 2.270 -2.100 1.00 0.00 H new ATOM 0 H61 DA C 124 -1.842 6.500 -6.581 1.00 0.00 H new ATOM 0 H62 DA C 124 -2.723 5.775 -5.231 1.00 0.00 H new ATOM 0 H2 DA C 124 2.127 4.389 -6.781 1.00 0.00 H new ATOM 767 P DT C 125 2.998 0.367 0.835 1.00 0.00 P ATOM 768 OP1 DT C 125 3.908 -0.630 1.436 1.00 0.00 O ATOM 769 OP2 DT C 125 2.065 1.132 1.691 1.00 0.00 O ATOM 770 O5' DT C 125 3.884 1.407 -0.011 1.00 0.00 O ATOM 771 C5' DT C 125 4.768 0.905 -1.010 1.00 0.00 C ATOM 772 C4' DT C 125 5.511 2.013 -1.757 1.00 0.00 C ATOM 773 O4' DT C 125 4.586 2.782 -2.580 1.00 0.00 O ATOM 774 C3' DT C 125 6.207 3.012 -0.820 1.00 0.00 C ATOM 775 O3' DT C 125 7.595 3.097 -1.165 1.00 0.00 O ATOM 776 C2' DT C 125 5.527 4.327 -1.048 1.00 0.00 C ATOM 777 C1' DT C 125 4.852 4.191 -2.398 1.00 0.00 C ATOM 778 N1 DT C 125 3.626 5.038 -2.505 1.00 0.00 N ATOM 779 C2 DT C 125 3.598 6.010 -3.500 1.00 0.00 C ATOM 780 O2 DT C 125 4.515 6.142 -4.307 1.00 0.00 O ATOM 781 N3 DT C 125 2.480 6.818 -3.536 1.00 0.00 N ATOM 782 C4 DT C 125 1.401 6.744 -2.678 1.00 0.00 C ATOM 783 O4 DT C 125 0.479 7.547 -2.751 1.00 0.00 O ATOM 784 C5 DT C 125 1.506 5.709 -1.690 1.00 0.00 C ATOM 785 C7 DT C 125 0.373 5.528 -0.695 1.00 0.00 C ATOM 786 C6 DT C 125 2.585 4.902 -1.629 1.00 0.00 C ATOM 0 H5' DT C 125 4.200 0.309 -1.725 1.00 0.00 H new ATOM 0 H5'' DT C 125 5.493 0.238 -0.544 1.00 0.00 H new ATOM 0 H4' DT C 125 6.263 1.502 -2.358 1.00 0.00 H new ATOM 0 H3' DT C 125 6.143 2.713 0.226 1.00 0.00 H new ATOM 0 H2' DT C 125 4.801 4.537 -0.263 1.00 0.00 H new ATOM 0 H2'' DT C 125 6.244 5.148 -1.046 1.00 0.00 H new ATOM 0 H1' DT C 125 5.496 4.558 -3.197 1.00 0.00 H new ATOM 0 H3 DT C 125 2.448 7.534 -4.262 1.00 0.00 H new ATOM 0 H71 DT C 125 0.313 4.481 -0.399 1.00 0.00 H new ATOM 0 H72 DT C 125 0.560 6.144 0.185 1.00 0.00 H new ATOM 0 H73 DT C 125 -0.568 5.830 -1.156 1.00 0.00 H new ATOM 0 H6 DT C 125 2.628 4.132 -0.873 1.00 0.00 H new ATOM 799 P DC C 126 8.613 4.060 -0.377 1.00 0.00 P ATOM 800 OP1 DC C 126 9.937 3.399 -0.337 1.00 0.00 O ATOM 801 OP2 DC C 126 7.966 4.500 0.879 1.00 0.00 O ATOM 802 O5' DC C 126 8.714 5.331 -1.371 1.00 0.00 O ATOM 803 C5' DC C 126 9.199 5.122 -2.707 1.00 0.00 C ATOM 804 C4' DC C 126 9.086 6.358 -3.613 1.00 0.00 C ATOM 805 O4' DC C 126 7.710 6.624 -3.966 1.00 0.00 O ATOM 806 C3' DC C 126 9.669 7.614 -2.951 1.00 0.00 C ATOM 807 O3' DC C 126 10.862 8.046 -3.610 1.00 0.00 O ATOM 808 C2' DC C 126 8.591 8.676 -3.089 1.00 0.00 C ATOM 809 C1' DC C 126 7.395 8.023 -3.789 1.00 0.00 C ATOM 810 N1 DC C 126 6.164 8.168 -2.970 1.00 0.00 N ATOM 811 C2 DC C 126 5.050 8.782 -3.541 1.00 0.00 C ATOM 812 O2 DC C 126 5.112 9.246 -4.679 1.00 0.00 O ATOM 813 N3 DC C 126 3.911 8.858 -2.803 1.00 0.00 N ATOM 814 C4 DC C 126 3.860 8.357 -1.563 1.00 0.00 C ATOM 815 N4 DC C 126 2.727 8.428 -0.876 1.00 0.00 N ATOM 816 C5 DC C 126 5.000 7.736 -0.972 1.00 0.00 C ATOM 817 C6 DC C 126 6.123 7.666 -1.705 1.00 0.00 C ATOM 0 H5' DC C 126 8.644 4.300 -3.160 1.00 0.00 H new ATOM 0 H5'' DC C 126 10.243 4.813 -2.659 1.00 0.00 H new ATOM 0 H4' DC C 126 9.662 6.129 -4.510 1.00 0.00 H new ATOM 0 H3' DC C 126 9.938 7.421 -1.913 1.00 0.00 H new ATOM 0 H2' DC C 126 8.301 9.059 -2.110 1.00 0.00 H new ATOM 0 H2'' DC C 126 8.959 9.524 -3.667 1.00 0.00 H new ATOM 0 H1' DC C 126 7.211 8.505 -4.749 1.00 0.00 H new ATOM 0 H41 DC C 126 2.679 8.049 0.070 1.00 0.00 H new ATOM 0 H42 DC C 126 1.904 8.862 -1.294 1.00 0.00 H new ATOM 0 H5 DC C 126 4.961 7.336 0.030 1.00 0.00 H new ATOM 0 H6 DC C 126 7.005 7.205 -1.286 1.00 0.00 H new ATOM 829 P DT C 127 11.787 9.185 -2.942 1.00 0.00 P ATOM 830 OP1 DT C 127 13.098 9.176 -3.629 1.00 0.00 O ATOM 831 OP2 DT C 127 11.727 9.022 -1.471 1.00 0.00 O ATOM 832 O5' DT C 127 11.031 10.557 -3.321 1.00 0.00 O ATOM 833 C5' DT C 127 11.010 11.026 -4.668 1.00 0.00 C ATOM 834 C4' DT C 127 10.238 12.343 -4.797 1.00 0.00 C ATOM 835 O4' DT C 127 8.826 12.109 -4.587 1.00 0.00 O ATOM 836 C3' DT C 127 10.702 13.388 -3.770 1.00 0.00 C ATOM 837 O3' DT C 127 11.334 14.493 -4.419 1.00 0.00 O ATOM 838 C2' DT C 127 9.444 13.862 -3.069 1.00 0.00 C ATOM 839 C1' DT C 127 8.273 13.097 -3.690 1.00 0.00 C ATOM 840 N1 DT C 127 7.429 12.453 -2.634 1.00 0.00 N ATOM 841 C2 DT C 127 6.074 12.762 -2.604 1.00 0.00 C ATOM 842 O2 DT C 127 5.560 13.521 -3.423 1.00 0.00 O ATOM 843 N3 DT C 127 5.334 12.168 -1.598 1.00 0.00 N ATOM 844 C4 DT C 127 5.815 11.308 -0.629 1.00 0.00 C ATOM 845 O4 DT C 127 5.061 10.832 0.218 1.00 0.00 O ATOM 846 C5 DT C 127 7.231 11.043 -0.727 1.00 0.00 C ATOM 847 C7 DT C 127 7.890 10.145 0.326 1.00 0.00 C ATOM 848 C6 DT C 127 7.980 11.605 -1.705 1.00 0.00 C ATOM 0 H5' DT C 127 10.553 10.272 -5.309 1.00 0.00 H new ATOM 0 H5'' DT C 127 12.032 11.167 -5.020 1.00 0.00 H new ATOM 0 H4' DT C 127 10.428 12.725 -5.800 1.00 0.00 H new ATOM 0 H3' DT C 127 11.426 12.961 -3.076 1.00 0.00 H new ATOM 0 H2' DT C 127 9.504 13.672 -1.997 1.00 0.00 H new ATOM 0 H2'' DT C 127 9.313 14.937 -3.195 1.00 0.00 H new ATOM 0 H1' DT C 127 7.623 13.781 -4.235 1.00 0.00 H new ATOM 0 H3 DT C 127 4.338 12.385 -1.568 1.00 0.00 H new ATOM 0 H71 DT C 127 7.358 10.243 1.272 1.00 0.00 H new ATOM 0 H72 DT C 127 7.852 9.107 -0.006 1.00 0.00 H new ATOM 0 H73 DT C 127 8.929 10.445 0.461 1.00 0.00 H new ATOM 0 H6 DT C 127 9.035 11.381 -1.756 1.00 0.00 H new ATOM 861 P DG C 128 12.051 15.643 -3.550 1.00 0.00 P ATOM 862 OP1 DG C 128 13.079 16.291 -4.396 1.00 0.00 O ATOM 863 OP2 DG C 128 12.433 15.064 -2.242 1.00 0.00 O ATOM 864 O5' DG C 128 10.861 16.697 -3.306 1.00 0.00 O ATOM 865 C5' DG C 128 10.243 17.347 -4.417 1.00 0.00 C ATOM 866 C4' DG C 128 9.135 18.309 -3.977 1.00 0.00 C ATOM 867 O4' DG C 128 7.998 17.568 -3.491 1.00 0.00 O ATOM 868 C3' DG C 128 9.600 19.265 -2.871 1.00 0.00 C ATOM 869 O3' DG C 128 9.462 20.615 -3.319 1.00 0.00 O ATOM 870 C2' DG C 128 8.683 19.004 -1.695 1.00 0.00 C ATOM 871 C1' DG C 128 7.634 17.998 -2.165 1.00 0.00 C ATOM 872 N9 DG C 128 7.564 16.847 -1.253 1.00 0.00 N ATOM 873 C8 DG C 128 8.565 16.028 -0.850 1.00 0.00 C ATOM 874 N7 DG C 128 8.216 15.088 -0.024 1.00 0.00 N ATOM 875 C5 DG C 128 6.848 15.303 0.137 1.00 0.00 C ATOM 876 C6 DG C 128 5.899 14.595 0.923 1.00 0.00 C ATOM 877 O6 DG C 128 6.086 13.621 1.647 1.00 0.00 O ATOM 878 N1 DG C 128 4.627 15.140 0.800 1.00 0.00 N ATOM 879 C2 DG C 128 4.306 16.230 0.017 1.00 0.00 C ATOM 880 N2 DG C 128 3.025 16.601 0.017 1.00 0.00 N ATOM 881 N3 DG C 128 5.196 16.898 -0.722 1.00 0.00 N ATOM 882 C4 DG C 128 6.441 16.381 -0.613 1.00 0.00 C ATOM 0 H5' DG C 128 9.826 16.597 -5.089 1.00 0.00 H new ATOM 0 H5'' DG C 128 10.997 17.896 -4.981 1.00 0.00 H new ATOM 0 H4' DG C 128 8.865 18.899 -4.853 1.00 0.00 H new ATOM 0 H3' DG C 128 10.645 19.110 -2.603 1.00 0.00 H new ATOM 0 H2' DG C 128 9.244 18.609 -0.848 1.00 0.00 H new ATOM 0 H2'' DG C 128 8.210 19.928 -1.362 1.00 0.00 H new ATOM 0 H1' DG C 128 6.649 18.465 -2.173 1.00 0.00 H new ATOM 0 H8 DG C 128 9.582 16.148 -1.192 1.00 0.00 H new ATOM 0 H1 DG C 128 3.873 14.701 1.329 1.00 0.00 H new ATOM 0 H21 DG C 128 2.725 17.400 -0.542 1.00 0.00 H new ATOM 0 H22 DG C 128 2.345 16.086 0.576 1.00 0.00 H new ATOM 894 P DC C 129 10.093 21.849 -2.500 1.00 0.00 P ATOM 895 OP1 DC C 129 10.314 22.961 -3.452 1.00 0.00 O ATOM 896 OP2 DC C 129 11.228 21.335 -1.700 1.00 0.00 O ATOM 897 O5' DC C 129 8.927 22.291 -1.480 1.00 0.00 O ATOM 898 C5' DC C 129 7.653 22.725 -1.964 1.00 0.00 C ATOM 899 C4' DC C 129 6.709 23.093 -0.812 1.00 0.00 C ATOM 900 O4' DC C 129 6.333 21.923 -0.046 1.00 0.00 O ATOM 901 C3' DC C 129 7.368 24.094 0.146 1.00 0.00 C ATOM 902 O3' DC C 129 6.564 25.275 0.249 1.00 0.00 O ATOM 903 C2' DC C 129 7.457 23.392 1.479 1.00 0.00 C ATOM 904 C1' DC C 129 6.673 22.095 1.353 1.00 0.00 C ATOM 905 N1 DC C 129 7.457 20.923 1.842 1.00 0.00 N ATOM 906 C2 DC C 129 6.932 20.174 2.896 1.00 0.00 C ATOM 907 O2 DC C 129 5.872 20.510 3.420 1.00 0.00 O ATOM 908 N3 DC C 129 7.618 19.077 3.320 1.00 0.00 N ATOM 909 C4 DC C 129 8.772 18.721 2.742 1.00 0.00 C ATOM 910 N4 DC C 129 9.413 17.632 3.178 1.00 0.00 N ATOM 911 C5 DC C 129 9.320 19.485 1.663 1.00 0.00 C ATOM 912 C6 DC C 129 8.635 20.572 1.247 1.00 0.00 C ATOM 0 H5' DC C 129 7.203 21.936 -2.566 1.00 0.00 H new ATOM 0 H5'' DC C 129 7.785 23.588 -2.617 1.00 0.00 H new ATOM 0 H4' DC C 129 5.824 23.539 -1.266 1.00 0.00 H new ATOM 0 H3' DC C 129 8.353 24.404 -0.204 1.00 0.00 H new ATOM 0 H2' DC C 129 8.496 23.191 1.740 1.00 0.00 H new ATOM 0 H2'' DC C 129 7.045 24.016 2.272 1.00 0.00 H new ATOM 0 H1' DC C 129 5.776 22.152 1.970 1.00 0.00 H new ATOM 0 H41 DC C 129 10.293 17.351 2.746 1.00 0.00 H new ATOM 0 H42 DC C 129 9.022 17.082 3.943 1.00 0.00 H new ATOM 0 H5 DC C 129 10.252 19.201 1.196 1.00 0.00 H new ATOM 0 H6 DC C 129 9.023 21.170 0.435 1.00 0.00 H new ATOM 924 P DA C 130 7.010 26.525 1.169 1.00 0.00 P ATOM 925 OP1 DA C 130 6.362 27.741 0.628 1.00 0.00 O ATOM 926 OP2 DA C 130 8.482 26.484 1.315 1.00 0.00 O ATOM 927 O5' DA C 130 6.353 26.214 2.612 1.00 0.00 O ATOM 928 C5' DA C 130 4.933 26.081 2.739 1.00 0.00 C ATOM 929 C4' DA C 130 4.492 25.788 4.181 1.00 0.00 C ATOM 930 O4' DA C 130 4.886 24.448 4.575 1.00 0.00 O ATOM 931 C3' DA C 130 5.124 26.773 5.177 1.00 0.00 C ATOM 932 O3' DA C 130 4.127 27.314 6.048 1.00 0.00 O ATOM 933 C2' DA C 130 6.097 25.953 5.987 1.00 0.00 C ATOM 934 C1' DA C 130 5.732 24.499 5.746 1.00 0.00 C ATOM 935 N9 DA C 130 6.925 23.657 5.581 1.00 0.00 N ATOM 936 C8 DA C 130 7.964 23.818 4.732 1.00 0.00 C ATOM 937 N7 DA C 130 8.867 22.884 4.770 1.00 0.00 N ATOM 938 C5 DA C 130 8.374 22.020 5.744 1.00 0.00 C ATOM 939 C6 DA C 130 8.852 20.819 6.276 1.00 0.00 C ATOM 940 N6 DA C 130 9.987 20.247 5.878 1.00 0.00 N ATOM 941 N1 DA C 130 8.112 20.228 7.231 1.00 0.00 N ATOM 942 C2 DA C 130 6.971 20.785 7.637 1.00 0.00 C ATOM 943 N3 DA C 130 6.431 21.914 7.198 1.00 0.00 N ATOM 944 C4 DA C 130 7.192 22.484 6.243 1.00 0.00 C ATOM 0 H5' DA C 130 4.588 25.278 2.088 1.00 0.00 H new ATOM 0 H5'' DA C 130 4.454 26.998 2.396 1.00 0.00 H new ATOM 0 H4' DA C 130 3.407 25.891 4.202 1.00 0.00 H new ATOM 0 H3' DA C 130 5.603 27.606 4.662 1.00 0.00 H new ATOM 0 H2' DA C 130 7.124 26.152 5.680 1.00 0.00 H new ATOM 0 H2'' DA C 130 6.027 26.201 7.046 1.00 0.00 H new ATOM 0 H1' DA C 130 5.202 24.103 6.612 1.00 0.00 H new ATOM 0 H8 DA C 130 8.039 24.666 4.067 1.00 0.00 H new ATOM 0 H61 DA C 130 10.291 19.369 6.299 1.00 0.00 H new ATOM 0 H62 DA C 130 10.552 20.687 5.152 1.00 0.00 H new ATOM 0 H2 DA C 130 6.427 20.259 8.408 1.00 0.00 H new ATOM 956 P DA C 131 4.524 28.378 7.191 1.00 0.00 P ATOM 957 OP1 DA C 131 3.322 29.178 7.513 1.00 0.00 O ATOM 958 OP2 DA C 131 5.773 29.057 6.778 1.00 0.00 O ATOM 959 O5' DA C 131 4.859 27.438 8.462 1.00 0.00 O ATOM 960 C5' DA C 131 3.813 26.721 9.126 1.00 0.00 C ATOM 961 C4' DA C 131 4.333 25.887 10.308 1.00 0.00 C ATOM 962 O4' DA C 131 5.106 24.753 9.852 1.00 0.00 O ATOM 963 C3' DA C 131 5.220 26.715 11.247 1.00 0.00 C ATOM 964 O3' DA C 131 4.603 26.878 12.525 1.00 0.00 O ATOM 965 C2' DA C 131 6.493 25.918 11.409 1.00 0.00 C ATOM 966 C1' DA C 131 6.307 24.618 10.645 1.00 0.00 C ATOM 967 N9 DA C 131 7.471 24.312 9.796 1.00 0.00 N ATOM 968 C8 DA C 131 8.001 25.047 8.794 1.00 0.00 C ATOM 969 N7 DA C 131 9.003 24.500 8.170 1.00 0.00 N ATOM 970 C5 DA C 131 9.154 23.283 8.833 1.00 0.00 C ATOM 971 C6 DA C 131 10.045 22.214 8.671 1.00 0.00 C ATOM 972 N6 DA C 131 10.970 22.174 7.711 1.00 0.00 N ATOM 973 N1 DA C 131 9.918 21.170 9.508 1.00 0.00 N ATOM 974 C2 DA C 131 8.967 21.170 10.443 1.00 0.00 C ATOM 975 N3 DA C 131 8.072 22.127 10.676 1.00 0.00 N ATOM 976 C4 DA C 131 8.227 23.162 9.828 1.00 0.00 C ATOM 0 H5' DA C 131 3.317 26.064 8.412 1.00 0.00 H new ATOM 0 H5'' DA C 131 3.063 27.427 9.485 1.00 0.00 H new ATOM 0 H4' DA C 131 3.449 25.547 10.847 1.00 0.00 H new ATOM 0 H3' DA C 131 5.395 27.711 10.840 1.00 0.00 H new ATOM 0 H2' DA C 131 7.347 26.474 11.022 1.00 0.00 H new ATOM 0 H2'' DA C 131 6.692 25.721 12.462 1.00 0.00 H new ATOM 0 H1' DA C 131 6.215 23.786 11.343 1.00 0.00 H new ATOM 0 H8 DA C 131 7.619 26.022 8.529 1.00 0.00 H new ATOM 0 H61 DA C 131 11.594 21.371 7.638 1.00 0.00 H new ATOM 0 H62 DA C 131 11.053 22.947 7.050 1.00 0.00 H new ATOM 0 H2 DA C 131 8.918 20.299 11.080 1.00 0.00 H new ATOM 988 P DC C 132 5.339 27.728 13.682 1.00 0.00 P ATOM 989 OP1 DC C 132 4.303 28.230 14.611 1.00 0.00 O ATOM 990 OP2 DC C 132 6.267 28.681 13.033 1.00 0.00 O ATOM 991 O5' DC C 132 6.221 26.623 14.462 1.00 0.00 O ATOM 992 C5' DC C 132 5.600 25.466 15.030 1.00 0.00 C ATOM 993 C4' DC C 132 6.626 24.458 15.570 1.00 0.00 C ATOM 994 O4' DC C 132 7.365 23.834 14.495 1.00 0.00 O ATOM 995 C3' DC C 132 7.642 25.109 16.519 1.00 0.00 C ATOM 996 O3' DC C 132 7.430 24.669 17.864 1.00 0.00 O ATOM 997 C2' DC C 132 9.004 24.665 16.025 1.00 0.00 C ATOM 998 C1' DC C 132 8.765 23.742 14.844 1.00 0.00 C ATOM 999 N1 DC C 132 9.632 24.121 13.698 1.00 0.00 N ATOM 1000 C2 DC C 132 10.651 23.253 13.317 1.00 0.00 C ATOM 1001 O2 DC C 132 10.813 22.193 13.916 1.00 0.00 O ATOM 1002 N3 DC C 132 11.449 23.614 12.275 1.00 0.00 N ATOM 1003 C4 DC C 132 11.254 24.772 11.629 1.00 0.00 C ATOM 1004 N4 DC C 132 12.048 25.091 10.608 1.00 0.00 N ATOM 1005 C5 DC C 132 10.208 25.661 12.019 1.00 0.00 C ATOM 1006 C6 DC C 132 9.430 25.296 13.054 1.00 0.00 C ATOM 0 H5' DC C 132 4.981 24.981 14.275 1.00 0.00 H new ATOM 0 H5'' DC C 132 4.936 25.773 15.838 1.00 0.00 H new ATOM 0 H4' DC C 132 6.047 23.714 16.117 1.00 0.00 H new ATOM 0 H3' DC C 132 7.548 26.195 16.523 1.00 0.00 H new ATOM 0 H2' DC C 132 9.606 25.524 15.728 1.00 0.00 H new ATOM 0 H2'' DC C 132 9.552 24.149 16.814 1.00 0.00 H new ATOM 0 HO3' DC C 132 8.088 25.093 18.454 1.00 0.00 H new ATOM 0 H1' DC C 132 9.017 22.714 15.104 1.00 0.00 H new ATOM 0 H41 DC C 132 11.909 25.970 10.109 1.00 0.00 H new ATOM 0 H42 DC C 132 12.795 24.457 10.325 1.00 0.00 H new ATOM 0 H5 DC C 132 10.047 26.595 11.501 1.00 0.00 H new ATOM 0 H6 DC C 132 8.633 25.949 13.376 1.00 0.00 H new TER 1019 DC C 132 ATOM 1020 N LYS A 1 -4.871 13.680 10.999 1.00 0.00 N ATOM 1021 CA LYS A 1 -5.642 13.179 12.170 1.00 0.00 C ATOM 1022 C LYS A 1 -6.069 11.736 11.916 1.00 0.00 C ATOM 1023 O LYS A 1 -7.096 11.486 11.321 1.00 0.00 O ATOM 1024 CB LYS A 1 -6.882 14.053 12.378 1.00 0.00 C ATOM 1025 CG LYS A 1 -7.690 13.526 13.569 1.00 0.00 C ATOM 1026 CD LYS A 1 -8.902 14.422 13.803 1.00 0.00 C ATOM 1027 CE LYS A 1 -9.610 13.974 15.081 1.00 0.00 C ATOM 1028 NZ LYS A 1 -8.799 14.393 16.258 1.00 0.00 N ATOM 0 H1 LYS A 1 -4.983 14.711 10.925 1.00 0.00 H new ATOM 0 H2 LYS A 1 -3.865 13.448 11.121 1.00 0.00 H new ATOM 0 H3 LYS A 1 -5.227 13.231 10.131 1.00 0.00 H new ATOM 0 HA LYS A 1 -5.018 13.221 13.062 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -6.585 15.086 12.556 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -7.497 14.049 11.478 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -8.013 12.503 13.378 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -7.066 13.501 14.462 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -8.590 15.463 13.890 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -9.583 14.363 12.954 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -10.606 14.415 15.134 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -9.740 12.892 15.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -9.400 14.407 17.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -8.018 13.721 16.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -8.412 15.344 16.092 1.00 0.00 H new ATOM 1044 N ARG A 2 -5.292 10.783 12.362 1.00 0.00 N ATOM 1045 CA ARG A 2 -5.655 9.347 12.145 1.00 0.00 C ATOM 1046 C ARG A 2 -6.289 8.763 13.410 1.00 0.00 C ATOM 1047 O ARG A 2 -6.662 7.608 13.447 1.00 0.00 O ATOM 1048 CB ARG A 2 -4.392 8.550 11.813 1.00 0.00 C ATOM 1049 CG ARG A 2 -3.820 9.020 10.466 1.00 0.00 C ATOM 1050 CD ARG A 2 -3.035 10.342 10.610 1.00 0.00 C ATOM 1051 NE ARG A 2 -1.854 10.316 9.687 1.00 0.00 N ATOM 1052 CZ ARG A 2 -0.912 9.422 9.808 1.00 0.00 C ATOM 1053 NH1 ARG A 2 -0.948 8.559 10.787 1.00 0.00 N ATOM 1054 NH2 ARG A 2 0.079 9.400 8.959 1.00 0.00 N ATOM 0 H ARG A 2 -4.420 10.936 12.868 1.00 0.00 H new ATOM 0 HA ARG A 2 -6.368 9.285 11.323 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -3.650 8.683 12.600 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -4.623 7.486 11.769 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -3.164 8.250 10.060 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -4.633 9.155 9.752 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -3.679 11.189 10.373 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -2.704 10.472 11.640 1.00 0.00 H new ATOM 0 HE ARG A 2 -1.785 11.014 8.947 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -1.714 8.583 11.460 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -0.210 7.861 10.879 1.00 0.00 H new ATOM 0 HH21 ARG A 2 0.117 10.082 8.201 1.00 0.00 H new ATOM 0 HH22 ARG A 2 0.816 8.701 9.053 1.00 0.00 H new ATOM 1068 N ALA A 3 -6.411 9.538 14.447 1.00 0.00 N ATOM 1069 CA ALA A 3 -7.014 8.997 15.696 1.00 0.00 C ATOM 1070 C ALA A 3 -8.534 8.906 15.546 1.00 0.00 C ATOM 1071 O ALA A 3 -9.220 9.903 15.445 1.00 0.00 O ATOM 1072 CB ALA A 3 -6.666 9.914 16.870 1.00 0.00 C ATOM 0 H ALA A 3 -6.122 10.516 14.486 1.00 0.00 H new ATOM 0 HA ALA A 3 -6.616 8.000 15.883 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -7.108 9.518 17.784 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -5.583 9.966 16.983 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -7.059 10.913 16.680 1.00 0.00 H new ATOM 1078 N GLY A 4 -9.064 7.711 15.541 1.00 0.00 N ATOM 1079 CA GLY A 4 -10.539 7.542 15.415 1.00 0.00 C ATOM 1080 C GLY A 4 -10.962 7.643 13.947 1.00 0.00 C ATOM 1081 O GLY A 4 -12.097 7.375 13.606 1.00 0.00 O ATOM 0 H GLY A 4 -8.535 6.842 15.619 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.837 6.575 15.821 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.051 8.305 16.001 1.00 0.00 H new ATOM 1085 N THR A 5 -10.078 8.048 13.076 1.00 0.00 N ATOM 1086 CA THR A 5 -10.474 8.179 11.644 1.00 0.00 C ATOM 1087 C THR A 5 -10.788 6.807 11.060 1.00 0.00 C ATOM 1088 O THR A 5 -9.936 5.946 10.969 1.00 0.00 O ATOM 1089 CB THR A 5 -9.341 8.807 10.841 1.00 0.00 C ATOM 1090 OG1 THR A 5 -8.832 9.928 11.547 1.00 0.00 O ATOM 1091 CG2 THR A 5 -9.869 9.261 9.473 1.00 0.00 C ATOM 0 H THR A 5 -9.111 8.291 13.289 1.00 0.00 H new ATOM 0 HA THR A 5 -11.358 8.814 11.589 1.00 0.00 H new ATOM 0 HB THR A 5 -8.548 8.074 10.696 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.190 10.407 10.982 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.057 9.710 8.900 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.263 8.401 8.931 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.662 9.995 9.615 1.00 0.00 H new ATOM 1099 N VAL A 6 -12.005 6.619 10.624 1.00 0.00 N ATOM 1100 CA VAL A 6 -12.411 5.331 9.992 1.00 0.00 C ATOM 1101 C VAL A 6 -12.846 5.669 8.572 1.00 0.00 C ATOM 1102 O VAL A 6 -13.515 6.658 8.350 1.00 0.00 O ATOM 1103 CB VAL A 6 -13.579 4.715 10.771 1.00 0.00 C ATOM 1104 CG1 VAL A 6 -13.044 4.009 12.019 1.00 0.00 C ATOM 1105 CG2 VAL A 6 -14.551 5.820 11.191 1.00 0.00 C ATOM 0 H VAL A 6 -12.747 7.316 10.681 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.594 4.610 9.992 1.00 0.00 H new ATOM 0 HB VAL A 6 -14.097 3.994 10.138 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -13.874 3.571 12.573 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -12.350 3.222 11.723 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -12.526 4.730 12.651 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -15.382 5.383 11.745 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -14.032 6.540 11.824 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -14.933 6.325 10.304 1.00 0.00 H new ATOM 1115 N CYS A 7 -12.476 4.889 7.603 1.00 0.00 N ATOM 1116 CA CYS A 7 -12.882 5.220 6.217 1.00 0.00 C ATOM 1117 C CYS A 7 -14.399 5.247 6.110 1.00 0.00 C ATOM 1118 O CYS A 7 -15.072 4.264 6.347 1.00 0.00 O ATOM 1119 CB CYS A 7 -12.300 4.168 5.281 1.00 0.00 C ATOM 1120 SG CYS A 7 -12.774 4.533 3.574 1.00 0.00 S ATOM 0 H CYS A 7 -11.915 4.044 7.709 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.507 6.205 5.941 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -11.214 4.150 5.370 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -12.659 3.178 5.564 1.00 0.00 H new ATOM 1125 N SER A 8 -14.938 6.374 5.750 1.00 0.00 N ATOM 1126 CA SER A 8 -16.412 6.489 5.618 1.00 0.00 C ATOM 1127 C SER A 8 -16.929 5.501 4.574 1.00 0.00 C ATOM 1128 O SER A 8 -17.989 4.928 4.727 1.00 0.00 O ATOM 1129 CB SER A 8 -16.781 7.907 5.182 1.00 0.00 C ATOM 1130 OG SER A 8 -16.401 8.827 6.198 1.00 0.00 O ATOM 0 H SER A 8 -14.417 7.226 5.540 1.00 0.00 H new ATOM 0 HA SER A 8 -16.866 6.266 6.584 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.279 8.154 4.246 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.853 7.975 4.997 1.00 0.00 H new ATOM 0 HG SER A 8 -15.429 8.952 6.179 1.00 0.00 H new ATOM 1136 N ASN A 9 -16.221 5.333 3.482 1.00 0.00 N ATOM 1137 CA ASN A 9 -16.731 4.423 2.419 1.00 0.00 C ATOM 1138 C ASN A 9 -16.543 2.939 2.755 1.00 0.00 C ATOM 1139 O ASN A 9 -17.409 2.146 2.442 1.00 0.00 O ATOM 1140 CB ASN A 9 -16.001 4.731 1.111 1.00 0.00 C ATOM 1141 CG ASN A 9 -16.459 6.089 0.580 1.00 0.00 C ATOM 1142 OD1 ASN A 9 -17.474 6.607 1.001 1.00 0.00 O ATOM 1143 ND2 ASN A 9 -15.759 6.685 -0.345 1.00 0.00 N ATOM 0 H ASN A 9 -15.326 5.781 3.286 1.00 0.00 H new ATOM 0 HA ASN A 9 -17.803 4.600 2.331 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -14.924 4.738 1.276 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -16.206 3.953 0.376 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -16.064 7.586 -0.715 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -14.907 6.251 -0.699 1.00 0.00 H new ATOM 1150 N CYS A 10 -15.434 2.522 3.348 1.00 0.00 N ATOM 1151 CA CYS A 10 -15.264 1.049 3.628 1.00 0.00 C ATOM 1152 C CYS A 10 -14.865 0.787 5.083 1.00 0.00 C ATOM 1153 O CYS A 10 -14.527 -0.324 5.440 1.00 0.00 O ATOM 1154 CB CYS A 10 -14.228 0.439 2.667 1.00 0.00 C ATOM 1155 SG CYS A 10 -12.543 0.847 3.195 1.00 0.00 S ATOM 0 H CYS A 10 -14.662 3.120 3.642 1.00 0.00 H new ATOM 0 HA CYS A 10 -16.229 0.569 3.463 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -14.351 -0.643 2.632 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -14.398 0.812 1.657 1.00 0.00 H new ATOM 1160 N GLN A 11 -14.939 1.775 5.935 1.00 0.00 N ATOM 1161 CA GLN A 11 -14.620 1.573 7.382 1.00 0.00 C ATOM 1162 C GLN A 11 -13.188 1.083 7.616 1.00 0.00 C ATOM 1163 O GLN A 11 -12.790 0.886 8.747 1.00 0.00 O ATOM 1164 CB GLN A 11 -15.613 0.579 7.996 1.00 0.00 C ATOM 1165 CG GLN A 11 -17.046 1.098 7.803 1.00 0.00 C ATOM 1166 CD GLN A 11 -17.527 0.780 6.384 1.00 0.00 C ATOM 1167 OE1 GLN A 11 -17.543 -0.365 5.978 1.00 0.00 O ATOM 1168 NE2 GLN A 11 -17.929 1.751 5.609 1.00 0.00 N ATOM 0 H GLN A 11 -15.210 2.727 5.688 1.00 0.00 H new ATOM 0 HA GLN A 11 -14.707 2.546 7.866 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -15.503 -0.398 7.526 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -15.403 0.448 9.057 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -17.711 0.637 8.534 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -17.079 2.174 7.975 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -17.916 2.713 5.948 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -18.256 1.548 4.664 1.00 0.00 H new ATOM 1177 N THR A 12 -12.391 0.895 6.602 1.00 0.00 N ATOM 1178 CA THR A 12 -11.003 0.437 6.882 1.00 0.00 C ATOM 1179 C THR A 12 -10.322 1.498 7.756 1.00 0.00 C ATOM 1180 O THR A 12 -10.523 2.679 7.552 1.00 0.00 O ATOM 1181 CB THR A 12 -10.228 0.234 5.568 1.00 0.00 C ATOM 1182 OG1 THR A 12 -9.023 -0.468 5.839 1.00 0.00 O ATOM 1183 CG2 THR A 12 -9.891 1.575 4.911 1.00 0.00 C ATOM 0 H THR A 12 -12.630 1.033 5.620 1.00 0.00 H new ATOM 0 HA THR A 12 -11.019 -0.520 7.403 1.00 0.00 H new ATOM 0 HB THR A 12 -10.856 -0.337 4.884 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.527 -0.601 5.004 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.344 1.399 3.985 1.00 0.00 H new ATOM 0 HG22 THR A 12 -10.812 2.114 4.691 1.00 0.00 H new ATOM 0 HG23 THR A 12 -9.277 2.168 5.589 1.00 0.00 H new ATOM 1191 N SER A 13 -9.506 1.097 8.707 1.00 0.00 N ATOM 1192 CA SER A 13 -8.797 2.110 9.574 1.00 0.00 C ATOM 1193 C SER A 13 -7.334 2.157 9.149 1.00 0.00 C ATOM 1194 O SER A 13 -6.581 3.022 9.544 1.00 0.00 O ATOM 1195 CB SER A 13 -8.918 1.726 11.048 1.00 0.00 C ATOM 1196 OG SER A 13 -8.728 0.325 11.183 1.00 0.00 O ATOM 0 H SER A 13 -9.299 0.122 8.922 1.00 0.00 H new ATOM 0 HA SER A 13 -9.251 3.093 9.451 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.176 2.264 11.638 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.898 2.011 11.431 1.00 0.00 H new ATOM 0 HG SER A 13 -8.803 0.074 12.127 1.00 0.00 H new ATOM 1202 N THR A 14 -6.944 1.240 8.309 1.00 0.00 N ATOM 1203 CA THR A 14 -5.547 1.220 7.799 1.00 0.00 C ATOM 1204 C THR A 14 -5.561 1.862 6.419 1.00 0.00 C ATOM 1205 O THR A 14 -6.230 1.397 5.519 1.00 0.00 O ATOM 1206 CB THR A 14 -5.069 -0.227 7.687 1.00 0.00 C ATOM 1207 OG1 THR A 14 -5.866 -0.915 6.733 1.00 0.00 O ATOM 1208 CG2 THR A 14 -5.198 -0.904 9.049 1.00 0.00 C ATOM 0 H THR A 14 -7.542 0.495 7.950 1.00 0.00 H new ATOM 0 HA THR A 14 -4.878 1.759 8.470 1.00 0.00 H new ATOM 0 HB THR A 14 -4.027 -0.248 7.367 1.00 0.00 H new ATOM 0 HG1 THR A 14 -6.434 -0.273 6.258 1.00 0.00 H new ATOM 0 HG21 THR A 14 -4.858 -1.937 8.975 1.00 0.00 H new ATOM 0 HG22 THR A 14 -4.587 -0.372 9.779 1.00 0.00 H new ATOM 0 HG23 THR A 14 -6.241 -0.887 9.367 1.00 0.00 H new ATOM 1216 N THR A 15 -4.837 2.932 6.244 1.00 0.00 N ATOM 1217 CA THR A 15 -4.826 3.616 4.917 1.00 0.00 C ATOM 1218 C THR A 15 -3.436 4.155 4.637 1.00 0.00 C ATOM 1219 O THR A 15 -2.734 4.584 5.531 1.00 0.00 O ATOM 1220 CB THR A 15 -5.811 4.785 4.947 1.00 0.00 C ATOM 1221 OG1 THR A 15 -5.211 5.898 5.596 1.00 0.00 O ATOM 1222 CG2 THR A 15 -7.052 4.371 5.716 1.00 0.00 C ATOM 0 H THR A 15 -4.253 3.363 6.960 1.00 0.00 H new ATOM 0 HA THR A 15 -5.110 2.906 4.140 1.00 0.00 H new ATOM 0 HB THR A 15 -6.080 5.060 3.927 1.00 0.00 H new ATOM 0 HG1 THR A 15 -5.871 6.335 6.174 1.00 0.00 H new ATOM 0 HG21 THR A 15 -7.758 5.201 5.741 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.515 3.515 5.226 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.775 4.100 6.735 1.00 0.00 H new ATOM 1230 N THR A 16 -3.033 4.163 3.402 1.00 0.00 N ATOM 1231 CA THR A 16 -1.693 4.702 3.087 1.00 0.00 C ATOM 1232 C THR A 16 -1.789 6.225 3.123 1.00 0.00 C ATOM 1233 O THR A 16 -0.920 6.902 3.633 1.00 0.00 O ATOM 1234 CB THR A 16 -1.242 4.255 1.700 1.00 0.00 C ATOM 1235 OG1 THR A 16 -1.835 5.093 0.717 1.00 0.00 O ATOM 1236 CG2 THR A 16 -1.660 2.808 1.444 1.00 0.00 C ATOM 0 H THR A 16 -3.570 3.822 2.605 1.00 0.00 H new ATOM 0 HA THR A 16 -0.967 4.335 3.812 1.00 0.00 H new ATOM 0 HB THR A 16 -0.156 4.326 1.645 1.00 0.00 H new ATOM 0 HG1 THR A 16 -2.251 4.540 0.023 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.331 2.505 0.450 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.203 2.160 2.191 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.745 2.726 1.507 1.00 0.00 H new ATOM 1244 N LEU A 17 -2.865 6.772 2.602 1.00 0.00 N ATOM 1245 CA LEU A 17 -3.040 8.258 2.629 1.00 0.00 C ATOM 1246 C LEU A 17 -4.536 8.560 2.831 1.00 0.00 C ATOM 1247 O LEU A 17 -5.384 8.054 2.120 1.00 0.00 O ATOM 1248 CB LEU A 17 -2.528 8.873 1.304 1.00 0.00 C ATOM 1249 CG LEU A 17 -1.907 10.258 1.554 1.00 0.00 C ATOM 1250 CD1 LEU A 17 -0.642 10.130 2.454 1.00 0.00 C ATOM 1251 CD2 LEU A 17 -1.548 10.905 0.193 1.00 0.00 C ATOM 0 H LEU A 17 -3.625 6.254 2.162 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.465 8.697 3.444 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.788 8.213 0.853 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.351 8.960 0.595 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.625 10.892 2.074 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.214 11.118 2.622 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.919 9.687 3.411 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.093 9.495 1.960 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.107 11.887 0.362 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.833 10.272 -0.333 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.451 11.011 -0.409 1.00 0.00 H new ATOM 1263 N TRP A 18 -4.871 9.379 3.791 1.00 0.00 N ATOM 1264 CA TRP A 18 -6.303 9.712 4.039 1.00 0.00 C ATOM 1265 C TRP A 18 -6.767 10.773 3.028 1.00 0.00 C ATOM 1266 O TRP A 18 -6.110 11.775 2.832 1.00 0.00 O ATOM 1267 CB TRP A 18 -6.429 10.282 5.456 1.00 0.00 C ATOM 1268 CG TRP A 18 -6.320 9.174 6.462 1.00 0.00 C ATOM 1269 CD1 TRP A 18 -5.246 8.942 7.257 1.00 0.00 C ATOM 1270 CD2 TRP A 18 -7.300 8.145 6.798 1.00 0.00 C ATOM 1271 NE1 TRP A 18 -5.508 7.839 8.051 1.00 0.00 N ATOM 1272 CE2 TRP A 18 -6.757 7.317 7.811 1.00 0.00 C ATOM 1273 CE3 TRP A 18 -8.594 7.850 6.332 1.00 0.00 C ATOM 1274 CZ2 TRP A 18 -7.469 6.240 8.341 1.00 0.00 C ATOM 1275 CZ3 TRP A 18 -9.311 6.764 6.864 1.00 0.00 C ATOM 1276 CH2 TRP A 18 -8.749 5.963 7.865 1.00 0.00 C ATOM 0 H TRP A 18 -4.209 9.835 4.419 1.00 0.00 H new ATOM 0 HA TRP A 18 -6.917 8.818 3.932 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -5.648 11.022 5.631 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.385 10.794 5.568 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.336 9.523 7.269 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -4.852 7.459 8.733 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -9.039 8.461 5.561 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -7.031 5.626 9.114 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -10.303 6.546 6.497 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -9.307 5.131 8.268 1.00 0.00 H new ATOM 1287 N ARG A 19 -7.886 10.555 2.375 1.00 0.00 N ATOM 1288 CA ARG A 19 -8.390 11.543 1.360 1.00 0.00 C ATOM 1289 C ARG A 19 -9.720 12.145 1.833 1.00 0.00 C ATOM 1290 O ARG A 19 -10.690 11.441 1.995 1.00 0.00 O ATOM 1291 CB ARG A 19 -8.653 10.811 0.024 1.00 0.00 C ATOM 1292 CG ARG A 19 -7.558 9.784 -0.255 1.00 0.00 C ATOM 1293 CD ARG A 19 -6.223 10.488 -0.465 1.00 0.00 C ATOM 1294 NE ARG A 19 -5.299 9.562 -1.182 1.00 0.00 N ATOM 1295 CZ ARG A 19 -4.180 10.001 -1.692 1.00 0.00 C ATOM 1296 NH1 ARG A 19 -3.833 11.248 -1.550 1.00 0.00 N ATOM 1297 NH2 ARG A 19 -3.397 9.186 -2.340 1.00 0.00 N ATOM 0 H ARG A 19 -8.476 9.732 2.501 1.00 0.00 H new ATOM 0 HA ARG A 19 -7.644 12.328 1.233 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -9.623 10.315 0.061 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -8.696 11.534 -0.790 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -7.483 9.085 0.578 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -7.813 9.200 -1.139 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -6.365 11.402 -1.042 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -5.795 10.780 0.494 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.544 8.576 -1.275 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.437 11.890 -1.037 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -2.957 11.583 -1.952 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.658 8.206 -2.449 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.523 9.528 -2.739 1.00 0.00 H new ATOM 1311 N ARG A 20 -9.809 13.428 2.034 1.00 0.00 N ATOM 1312 CA ARG A 20 -11.124 13.989 2.457 1.00 0.00 C ATOM 1313 C ARG A 20 -12.066 13.865 1.251 1.00 0.00 C ATOM 1314 O ARG A 20 -11.653 14.035 0.121 1.00 0.00 O ATOM 1315 CB ARG A 20 -10.952 15.457 2.860 1.00 0.00 C ATOM 1316 CG ARG A 20 -12.262 16.009 3.440 1.00 0.00 C ATOM 1317 CD ARG A 20 -12.585 15.354 4.792 1.00 0.00 C ATOM 1318 NE ARG A 20 -13.451 16.289 5.588 1.00 0.00 N ATOM 1319 CZ ARG A 20 -13.017 17.459 5.969 1.00 0.00 C ATOM 1320 NH1 ARG A 20 -11.757 17.768 5.823 1.00 0.00 N ATOM 1321 NH2 ARG A 20 -13.832 18.307 6.532 1.00 0.00 N ATOM 0 H ARG A 20 -9.050 14.101 1.928 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.530 13.455 3.316 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.154 15.547 3.597 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -10.654 16.046 1.993 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -12.182 17.089 3.565 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -13.078 15.829 2.740 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -13.097 14.404 4.638 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -11.665 15.136 5.335 1.00 0.00 H new ATOM 0 HE ARG A 20 -14.398 16.003 5.836 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -11.111 17.095 5.411 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -11.418 18.683 6.121 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -14.810 18.056 6.675 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -13.491 19.221 6.829 1.00 0.00 H new ATOM 1335 N SER A 21 -13.320 13.550 1.467 1.00 0.00 N ATOM 1336 CA SER A 21 -14.266 13.392 0.307 1.00 0.00 C ATOM 1337 C SER A 21 -14.975 14.725 0.005 1.00 0.00 C ATOM 1338 O SER A 21 -15.049 15.591 0.848 1.00 0.00 O ATOM 1339 CB SER A 21 -15.297 12.303 0.646 1.00 0.00 C ATOM 1340 OG SER A 21 -16.587 12.696 0.190 1.00 0.00 O ATOM 0 H SER A 21 -13.731 13.395 2.387 1.00 0.00 H new ATOM 0 HA SER A 21 -13.705 13.099 -0.580 1.00 0.00 H new ATOM 0 HB2 SER A 21 -15.009 11.360 0.181 1.00 0.00 H new ATOM 0 HB3 SER A 21 -15.319 12.133 1.723 1.00 0.00 H new ATOM 0 HG SER A 21 -17.238 11.997 0.408 1.00 0.00 H new ATOM 1346 N PRO A 22 -15.499 14.886 -1.198 1.00 0.00 N ATOM 1347 CA PRO A 22 -16.221 16.137 -1.578 1.00 0.00 C ATOM 1348 C PRO A 22 -17.314 16.515 -0.564 1.00 0.00 C ATOM 1349 O PRO A 22 -17.696 17.664 -0.449 1.00 0.00 O ATOM 1350 CB PRO A 22 -16.838 15.760 -2.947 1.00 0.00 C ATOM 1351 CG PRO A 22 -16.486 14.289 -3.249 1.00 0.00 C ATOM 1352 CD PRO A 22 -15.399 13.850 -2.267 1.00 0.00 C ATOM 0 HA PRO A 22 -15.568 17.009 -1.609 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -17.919 15.895 -2.926 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -16.451 16.412 -3.730 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -17.369 13.658 -3.147 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -16.136 14.184 -4.276 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -15.581 12.847 -1.880 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -14.413 13.838 -2.731 1.00 0.00 H new ATOM 1360 N MET A 23 -17.811 15.556 0.177 1.00 0.00 N ATOM 1361 CA MET A 23 -18.867 15.850 1.192 1.00 0.00 C ATOM 1362 C MET A 23 -18.203 16.086 2.553 1.00 0.00 C ATOM 1363 O MET A 23 -18.824 16.550 3.489 1.00 0.00 O ATOM 1364 CB MET A 23 -19.819 14.654 1.299 1.00 0.00 C ATOM 1365 CG MET A 23 -20.663 14.543 0.024 1.00 0.00 C ATOM 1366 SD MET A 23 -21.779 13.123 0.174 1.00 0.00 S ATOM 1367 CE MET A 23 -22.671 13.353 -1.383 1.00 0.00 C ATOM 0 H MET A 23 -17.529 14.577 0.121 1.00 0.00 H new ATOM 0 HA MET A 23 -19.426 16.737 0.892 1.00 0.00 H new ATOM 0 HB2 MET A 23 -19.249 13.737 1.449 1.00 0.00 H new ATOM 0 HB3 MET A 23 -20.469 14.772 2.166 1.00 0.00 H new ATOM 0 HG2 MET A 23 -21.236 15.457 -0.128 1.00 0.00 H new ATOM 0 HG3 MET A 23 -20.017 14.423 -0.846 1.00 0.00 H new ATOM 0 HE1 MET A 23 -23.421 12.569 -1.492 1.00 0.00 H new ATOM 0 HE2 MET A 23 -23.161 14.327 -1.381 1.00 0.00 H new ATOM 0 HE3 MET A 23 -21.969 13.302 -2.215 1.00 0.00 H new ATOM 1377 N GLY A 24 -16.939 15.770 2.662 1.00 0.00 N ATOM 1378 CA GLY A 24 -16.209 15.966 3.951 1.00 0.00 C ATOM 1379 C GLY A 24 -16.265 14.680 4.782 1.00 0.00 C ATOM 1380 O GLY A 24 -16.301 14.720 5.996 1.00 0.00 O ATOM 0 H GLY A 24 -16.376 15.381 1.906 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -15.172 16.237 3.754 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.654 16.790 4.509 1.00 0.00 H new ATOM 1384 N ASP A 25 -16.273 13.538 4.142 1.00 0.00 N ATOM 1385 CA ASP A 25 -16.329 12.237 4.880 1.00 0.00 C ATOM 1386 C ASP A 25 -14.967 11.510 4.745 1.00 0.00 C ATOM 1387 O ASP A 25 -14.620 11.070 3.668 1.00 0.00 O ATOM 1388 CB ASP A 25 -17.413 11.379 4.228 1.00 0.00 C ATOM 1389 CG ASP A 25 -18.778 12.029 4.471 1.00 0.00 C ATOM 1390 OD1 ASP A 25 -19.325 11.825 5.542 1.00 0.00 O ATOM 1391 OD2 ASP A 25 -19.249 12.722 3.585 1.00 0.00 O ATOM 0 H ASP A 25 -16.243 13.450 3.126 1.00 0.00 H new ATOM 0 HA ASP A 25 -16.546 12.406 5.935 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -17.226 11.285 3.158 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -17.396 10.372 4.644 1.00 0.00 H new ATOM 1396 N PRO A 26 -14.182 11.380 5.804 1.00 0.00 N ATOM 1397 CA PRO A 26 -12.854 10.696 5.694 1.00 0.00 C ATOM 1398 C PRO A 26 -12.918 9.332 4.979 1.00 0.00 C ATOM 1399 O PRO A 26 -13.712 8.474 5.317 1.00 0.00 O ATOM 1400 CB PRO A 26 -12.446 10.545 7.172 1.00 0.00 C ATOM 1401 CG PRO A 26 -13.286 11.539 7.987 1.00 0.00 C ATOM 1402 CD PRO A 26 -14.535 11.887 7.165 1.00 0.00 C ATOM 0 HA PRO A 26 -12.145 11.258 5.086 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -12.619 9.525 7.515 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -11.383 10.748 7.299 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -13.569 11.103 8.945 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -12.709 12.438 8.204 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -15.428 11.402 7.559 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -14.731 12.959 7.160 1.00 0.00 H new ATOM 1410 N VAL A 27 -12.052 9.130 4.014 1.00 0.00 N ATOM 1411 CA VAL A 27 -12.008 7.819 3.274 1.00 0.00 C ATOM 1412 C VAL A 27 -10.554 7.354 3.134 1.00 0.00 C ATOM 1413 O VAL A 27 -9.632 8.133 3.268 1.00 0.00 O ATOM 1414 CB VAL A 27 -12.635 7.952 1.888 1.00 0.00 C ATOM 1415 CG1 VAL A 27 -14.159 8.045 2.020 1.00 0.00 C ATOM 1416 CG2 VAL A 27 -12.071 9.197 1.206 1.00 0.00 C ATOM 0 H VAL A 27 -11.368 9.819 3.702 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.579 7.085 3.843 1.00 0.00 H new ATOM 0 HB VAL A 27 -12.397 7.078 1.282 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.605 8.140 1.030 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.538 7.145 2.504 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -14.420 8.917 2.620 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.513 9.301 0.215 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.308 10.078 1.803 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -10.989 9.102 1.113 1.00 0.00 H new ATOM 1426 N CYS A 28 -10.333 6.087 2.865 1.00 0.00 N ATOM 1427 CA CYS A 28 -8.935 5.585 2.721 1.00 0.00 C ATOM 1428 C CYS A 28 -8.410 5.860 1.298 1.00 0.00 C ATOM 1429 O CYS A 28 -9.167 6.079 0.375 1.00 0.00 O ATOM 1430 CB CYS A 28 -8.882 4.083 3.066 1.00 0.00 C ATOM 1431 SG CYS A 28 -9.712 3.060 1.813 1.00 0.00 S ATOM 0 H CYS A 28 -11.061 5.384 2.740 1.00 0.00 H new ATOM 0 HA CYS A 28 -8.286 6.116 3.418 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -7.842 3.770 3.158 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -9.351 3.918 4.036 1.00 0.00 H new ATOM 1436 N ASN A 29 -7.110 5.898 1.138 1.00 0.00 N ATOM 1437 CA ASN A 29 -6.498 6.211 -0.198 1.00 0.00 C ATOM 1438 C ASN A 29 -7.127 5.377 -1.321 1.00 0.00 C ATOM 1439 O ASN A 29 -7.251 5.839 -2.438 1.00 0.00 O ATOM 1440 CB ASN A 29 -4.992 5.906 -0.135 1.00 0.00 C ATOM 1441 CG ASN A 29 -4.324 6.269 -1.464 1.00 0.00 C ATOM 1442 OD1 ASN A 29 -4.922 6.147 -2.510 1.00 0.00 O ATOM 1443 ND2 ASN A 29 -3.096 6.715 -1.465 1.00 0.00 N ATOM 0 H ASN A 29 -6.436 5.724 1.883 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.677 7.264 -0.417 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.533 6.470 0.677 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -4.836 4.849 0.082 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.643 6.960 -2.346 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -2.590 6.819 -0.585 1.00 0.00 H new ATOM 1450 N ALA A 30 -7.518 4.166 -1.064 1.00 0.00 N ATOM 1451 CA ALA A 30 -8.118 3.353 -2.161 1.00 0.00 C ATOM 1452 C ALA A 30 -9.538 3.839 -2.494 1.00 0.00 C ATOM 1453 O ALA A 30 -9.858 4.096 -3.637 1.00 0.00 O ATOM 1454 CB ALA A 30 -8.164 1.893 -1.740 1.00 0.00 C ATOM 0 H ALA A 30 -7.452 3.705 -0.157 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.500 3.464 -3.052 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -8.602 1.297 -2.541 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -7.153 1.541 -1.537 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.770 1.793 -0.840 1.00 0.00 H new ATOM 1460 N CYS A 31 -10.395 3.957 -1.511 1.00 0.00 N ATOM 1461 CA CYS A 31 -11.795 4.412 -1.789 1.00 0.00 C ATOM 1462 C CYS A 31 -11.781 5.767 -2.485 1.00 0.00 C ATOM 1463 O CYS A 31 -12.486 5.995 -3.436 1.00 0.00 O ATOM 1464 CB CYS A 31 -12.562 4.583 -0.474 1.00 0.00 C ATOM 1465 SG CYS A 31 -13.039 2.984 0.202 1.00 0.00 S ATOM 0 H CYS A 31 -10.189 3.759 -0.532 1.00 0.00 H new ATOM 0 HA CYS A 31 -12.271 3.662 -2.420 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -11.943 5.117 0.246 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -13.451 5.191 -0.643 1.00 0.00 H new ATOM 1470 N GLY A 32 -11.005 6.678 -1.996 1.00 0.00 N ATOM 1471 CA GLY A 32 -10.988 8.029 -2.610 1.00 0.00 C ATOM 1472 C GLY A 32 -10.717 7.933 -4.110 1.00 0.00 C ATOM 1473 O GLY A 32 -11.415 8.520 -4.913 1.00 0.00 O ATOM 0 H GLY A 32 -10.381 6.551 -1.199 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.943 8.525 -2.438 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.221 8.641 -2.135 1.00 0.00 H new ATOM 1477 N LEU A 33 -9.703 7.219 -4.495 1.00 0.00 N ATOM 1478 CA LEU A 33 -9.381 7.109 -5.943 1.00 0.00 C ATOM 1479 C LEU A 33 -10.439 6.278 -6.673 1.00 0.00 C ATOM 1480 O LEU A 33 -10.933 6.668 -7.710 1.00 0.00 O ATOM 1481 CB LEU A 33 -8.020 6.436 -6.096 1.00 0.00 C ATOM 1482 CG LEU A 33 -6.952 7.235 -5.335 1.00 0.00 C ATOM 1483 CD1 LEU A 33 -5.698 6.372 -5.167 1.00 0.00 C ATOM 1484 CD2 LEU A 33 -6.593 8.515 -6.107 1.00 0.00 C ATOM 0 H LEU A 33 -9.081 6.705 -3.871 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.364 8.108 -6.378 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -8.064 5.416 -5.714 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.754 6.370 -7.151 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.345 7.512 -4.357 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.938 6.936 -4.627 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.948 5.472 -4.606 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.314 6.093 -6.148 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.835 9.072 -5.556 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.205 8.250 -7.091 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -7.484 9.132 -6.222 1.00 0.00 H new ATOM 1496 N TYR A 34 -10.795 5.139 -6.154 1.00 0.00 N ATOM 1497 CA TYR A 34 -11.819 4.305 -6.847 1.00 0.00 C ATOM 1498 C TYR A 34 -13.119 5.087 -6.957 1.00 0.00 C ATOM 1499 O TYR A 34 -13.782 5.082 -7.975 1.00 0.00 O ATOM 1500 CB TYR A 34 -12.080 3.037 -6.032 1.00 0.00 C ATOM 1501 CG TYR A 34 -13.173 2.224 -6.684 1.00 0.00 C ATOM 1502 CD1 TYR A 34 -14.515 2.509 -6.411 1.00 0.00 C ATOM 1503 CD2 TYR A 34 -12.843 1.183 -7.556 1.00 0.00 C ATOM 1504 CE1 TYR A 34 -15.526 1.753 -7.012 1.00 0.00 C ATOM 1505 CE2 TYR A 34 -13.855 0.426 -8.159 1.00 0.00 C ATOM 1506 CZ TYR A 34 -15.198 0.711 -7.887 1.00 0.00 C ATOM 1507 OH TYR A 34 -16.197 -0.035 -8.480 1.00 0.00 O ATOM 0 H TYR A 34 -10.426 4.749 -5.287 1.00 0.00 H new ATOM 0 HA TYR A 34 -11.455 4.043 -7.840 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -11.167 2.445 -5.961 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -12.369 3.301 -5.015 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -14.770 3.313 -5.736 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -11.807 0.962 -7.765 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -16.562 1.973 -6.801 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -13.599 -0.378 -8.834 1.00 0.00 H new ATOM 0 HH TYR A 34 -15.796 -0.717 -9.059 1.00 0.00 H new ATOM 1517 N TYR A 35 -13.498 5.738 -5.902 1.00 0.00 N ATOM 1518 CA TYR A 35 -14.767 6.502 -5.908 1.00 0.00 C ATOM 1519 C TYR A 35 -14.705 7.668 -6.903 1.00 0.00 C ATOM 1520 O TYR A 35 -15.609 7.897 -7.658 1.00 0.00 O ATOM 1521 CB TYR A 35 -15.023 7.052 -4.501 1.00 0.00 C ATOM 1522 CG TYR A 35 -16.487 7.353 -4.358 1.00 0.00 C ATOM 1523 CD1 TYR A 35 -16.975 8.597 -4.745 1.00 0.00 C ATOM 1524 CD2 TYR A 35 -17.355 6.377 -3.859 1.00 0.00 C ATOM 1525 CE1 TYR A 35 -18.340 8.879 -4.634 1.00 0.00 C ATOM 1526 CE2 TYR A 35 -18.720 6.649 -3.743 1.00 0.00 C ATOM 1527 CZ TYR A 35 -19.216 7.903 -4.132 1.00 0.00 C ATOM 1528 OH TYR A 35 -20.564 8.176 -4.020 1.00 0.00 O ATOM 0 H TYR A 35 -12.977 5.774 -5.026 1.00 0.00 H new ATOM 0 HA TYR A 35 -15.574 5.835 -6.211 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -14.712 6.326 -3.750 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -14.434 7.954 -4.336 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -16.299 9.345 -5.131 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -16.970 5.412 -3.563 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -18.720 9.845 -4.934 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -19.391 5.897 -3.355 1.00 0.00 H new ATOM 0 HH TYR A 35 -21.027 7.393 -3.656 1.00 0.00 H new ATOM 1538 N LYS A 36 -13.662 8.426 -6.894 1.00 0.00 N ATOM 1539 CA LYS A 36 -13.595 9.592 -7.823 1.00 0.00 C ATOM 1540 C LYS A 36 -13.718 9.143 -9.285 1.00 0.00 C ATOM 1541 O LYS A 36 -14.401 9.766 -10.072 1.00 0.00 O ATOM 1542 CB LYS A 36 -12.241 10.271 -7.621 1.00 0.00 C ATOM 1543 CG LYS A 36 -12.098 11.481 -8.545 1.00 0.00 C ATOM 1544 CD LYS A 36 -10.761 12.182 -8.263 1.00 0.00 C ATOM 1545 CE LYS A 36 -9.596 11.403 -8.895 1.00 0.00 C ATOM 1546 NZ LYS A 36 -8.384 12.269 -8.905 1.00 0.00 N ATOM 0 H LYS A 36 -12.850 8.299 -6.290 1.00 0.00 H new ATOM 0 HA LYS A 36 -14.418 10.273 -7.609 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.138 10.586 -6.583 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.439 9.560 -7.819 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -12.143 11.164 -9.587 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -12.925 12.173 -8.387 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -10.785 13.196 -8.661 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.608 12.265 -7.187 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -9.403 10.491 -8.330 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -9.852 11.101 -9.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -7.590 11.750 -9.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -8.575 13.127 -9.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -8.140 12.536 -7.930 1.00 0.00 H new ATOM 1560 N LEU A 37 -13.054 8.095 -9.663 1.00 0.00 N ATOM 1561 CA LEU A 37 -13.126 7.644 -11.084 1.00 0.00 C ATOM 1562 C LEU A 37 -14.508 7.067 -11.431 1.00 0.00 C ATOM 1563 O LEU A 37 -15.005 7.281 -12.519 1.00 0.00 O ATOM 1564 CB LEU A 37 -12.051 6.566 -11.312 1.00 0.00 C ATOM 1565 CG LEU A 37 -10.720 7.214 -11.708 1.00 0.00 C ATOM 1566 CD1 LEU A 37 -10.286 8.220 -10.641 1.00 0.00 C ATOM 1567 CD2 LEU A 37 -9.658 6.123 -11.838 1.00 0.00 C ATOM 0 H LEU A 37 -12.463 7.528 -9.055 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.956 8.506 -11.729 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.920 5.976 -10.405 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.375 5.880 -12.094 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.840 7.736 -12.657 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.339 8.674 -10.933 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -11.045 8.996 -10.542 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -10.164 7.708 -9.687 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.706 6.573 -12.120 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.547 5.608 -10.884 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.962 5.409 -12.603 1.00 0.00 H new ATOM 1579 N HIS A 38 -15.112 6.304 -10.549 1.00 0.00 N ATOM 1580 CA HIS A 38 -16.439 5.678 -10.876 1.00 0.00 C ATOM 1581 C HIS A 38 -17.548 6.164 -9.932 1.00 0.00 C ATOM 1582 O HIS A 38 -18.669 5.718 -10.030 1.00 0.00 O ATOM 1583 CB HIS A 38 -16.290 4.159 -10.757 1.00 0.00 C ATOM 1584 CG HIS A 38 -15.149 3.709 -11.628 1.00 0.00 C ATOM 1585 ND1 HIS A 38 -15.338 3.221 -12.913 1.00 0.00 N ATOM 1586 CD2 HIS A 38 -13.794 3.676 -11.411 1.00 0.00 C ATOM 1587 CE1 HIS A 38 -14.125 2.919 -13.414 1.00 0.00 C ATOM 1588 NE2 HIS A 38 -13.149 3.177 -12.539 1.00 0.00 N ATOM 0 H HIS A 38 -14.748 6.087 -9.621 1.00 0.00 H new ATOM 0 HA HIS A 38 -16.725 5.966 -11.887 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -16.105 3.879 -9.720 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -17.213 3.665 -11.061 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -13.302 3.990 -10.502 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -13.961 2.517 -14.403 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -12.147 3.038 -12.669 1.00 0.00 H new ATOM 1596 N GLN A 39 -17.264 7.083 -9.042 1.00 0.00 N ATOM 1597 CA GLN A 39 -18.301 7.626 -8.098 1.00 0.00 C ATOM 1598 C GLN A 39 -19.365 6.590 -7.706 1.00 0.00 C ATOM 1599 O GLN A 39 -20.540 6.889 -7.625 1.00 0.00 O ATOM 1600 CB GLN A 39 -18.926 8.882 -8.711 1.00 0.00 C ATOM 1601 CG GLN A 39 -19.720 8.529 -9.978 1.00 0.00 C ATOM 1602 CD GLN A 39 -20.443 9.778 -10.480 1.00 0.00 C ATOM 1603 OE1 GLN A 39 -20.357 10.828 -9.874 1.00 0.00 O ATOM 1604 NE2 GLN A 39 -21.157 9.712 -11.571 1.00 0.00 N ATOM 0 H GLN A 39 -16.337 7.491 -8.925 1.00 0.00 H new ATOM 0 HA GLN A 39 -17.804 7.886 -7.164 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -19.584 9.359 -7.984 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -18.144 9.602 -8.954 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -19.049 8.148 -10.748 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -20.440 7.739 -9.763 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -21.230 8.831 -12.080 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -21.642 10.541 -11.914 1.00 0.00 H new ATOM 1613 N VAL A 40 -18.953 5.383 -7.412 1.00 0.00 N ATOM 1614 CA VAL A 40 -19.911 4.326 -6.976 1.00 0.00 C ATOM 1615 C VAL A 40 -19.274 3.520 -5.842 1.00 0.00 C ATOM 1616 O VAL A 40 -18.068 3.428 -5.736 1.00 0.00 O ATOM 1617 CB VAL A 40 -20.218 3.376 -8.135 1.00 0.00 C ATOM 1618 CG1 VAL A 40 -21.074 4.079 -9.199 1.00 0.00 C ATOM 1619 CG2 VAL A 40 -18.906 2.881 -8.755 1.00 0.00 C ATOM 0 H VAL A 40 -17.979 5.083 -7.457 1.00 0.00 H new ATOM 0 HA VAL A 40 -20.835 4.799 -6.643 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.780 2.524 -7.752 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.281 3.387 -10.015 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -22.013 4.406 -8.753 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.536 4.944 -9.586 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -19.126 2.204 -9.581 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -18.335 3.732 -9.126 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -18.323 2.354 -8.000 1.00 0.00 H new ATOM 1629 N ASN A 41 -20.074 2.920 -5.002 1.00 0.00 N ATOM 1630 CA ASN A 41 -19.505 2.101 -3.886 1.00 0.00 C ATOM 1631 C ASN A 41 -19.227 0.688 -4.417 1.00 0.00 C ATOM 1632 O ASN A 41 -19.894 0.232 -5.325 1.00 0.00 O ATOM 1633 CB ASN A 41 -20.505 2.033 -2.726 1.00 0.00 C ATOM 1634 CG ASN A 41 -21.814 1.402 -3.201 1.00 0.00 C ATOM 1635 OD1 ASN A 41 -21.859 0.229 -3.514 1.00 0.00 O ATOM 1636 ND2 ASN A 41 -22.894 2.132 -3.258 1.00 0.00 N ATOM 0 H ASN A 41 -21.093 2.959 -5.037 1.00 0.00 H new ATOM 0 HA ASN A 41 -18.582 2.554 -3.523 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -20.086 1.448 -1.907 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -20.694 3.034 -2.338 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.774 1.718 -3.565 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -22.858 3.117 -2.996 1.00 0.00 H new ATOM 1643 N ARG A 42 -18.239 -0.007 -3.885 1.00 0.00 N ATOM 1644 CA ARG A 42 -17.916 -1.387 -4.391 1.00 0.00 C ATOM 1645 C ARG A 42 -17.712 -2.355 -3.193 1.00 0.00 C ATOM 1646 O ARG A 42 -17.295 -1.940 -2.135 1.00 0.00 O ATOM 1647 CB ARG A 42 -16.632 -1.307 -5.251 1.00 0.00 C ATOM 1648 CG ARG A 42 -15.380 -1.031 -4.393 1.00 0.00 C ATOM 1649 CD ARG A 42 -15.501 0.311 -3.649 1.00 0.00 C ATOM 1650 NE ARG A 42 -16.111 0.077 -2.313 1.00 0.00 N ATOM 1651 CZ ARG A 42 -16.020 0.983 -1.383 1.00 0.00 C ATOM 1652 NH1 ARG A 42 -15.357 2.082 -1.605 1.00 0.00 N ATOM 1653 NH2 ARG A 42 -16.586 0.782 -0.224 1.00 0.00 N ATOM 0 H ARG A 42 -17.645 0.322 -3.124 1.00 0.00 H new ATOM 0 HA ARG A 42 -18.738 -1.767 -4.998 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -16.500 -2.243 -5.794 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -16.743 -0.519 -5.996 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -15.244 -1.838 -3.673 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -14.495 -1.019 -5.029 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -14.518 0.769 -3.538 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -16.113 1.006 -4.225 1.00 0.00 H new ATOM 0 HE ARG A 42 -16.603 -0.797 -2.125 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -14.908 2.233 -2.508 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -15.286 2.791 -0.875 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -17.098 -0.083 -0.049 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -16.517 1.490 0.507 1.00 0.00 H new ATOM 1667 N PRO A 43 -18.004 -3.637 -3.341 1.00 0.00 N ATOM 1668 CA PRO A 43 -17.822 -4.607 -2.214 1.00 0.00 C ATOM 1669 C PRO A 43 -16.467 -4.470 -1.491 1.00 0.00 C ATOM 1670 O PRO A 43 -15.485 -4.035 -2.058 1.00 0.00 O ATOM 1671 CB PRO A 43 -17.942 -5.969 -2.921 1.00 0.00 C ATOM 1672 CG PRO A 43 -18.539 -5.735 -4.322 1.00 0.00 C ATOM 1673 CD PRO A 43 -18.535 -4.221 -4.612 1.00 0.00 C ATOM 0 HA PRO A 43 -18.550 -4.448 -1.418 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -16.964 -6.444 -2.999 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -18.578 -6.641 -2.345 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -17.956 -6.266 -5.075 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -19.555 -6.127 -4.370 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -17.902 -3.975 -5.465 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -19.535 -3.851 -4.840 1.00 0.00 H new ATOM 1681 N LEU A 44 -16.423 -4.847 -0.236 1.00 0.00 N ATOM 1682 CA LEU A 44 -15.152 -4.760 0.546 1.00 0.00 C ATOM 1683 C LEU A 44 -14.217 -5.899 0.125 1.00 0.00 C ATOM 1684 O LEU A 44 -13.443 -6.404 0.915 1.00 0.00 O ATOM 1685 CB LEU A 44 -15.474 -4.881 2.048 1.00 0.00 C ATOM 1686 CG LEU A 44 -15.879 -3.513 2.605 1.00 0.00 C ATOM 1687 CD1 LEU A 44 -17.175 -3.052 1.941 1.00 0.00 C ATOM 1688 CD2 LEU A 44 -16.089 -3.619 4.117 1.00 0.00 C ATOM 0 H LEU A 44 -17.220 -5.214 0.283 1.00 0.00 H new ATOM 0 HA LEU A 44 -14.664 -3.804 0.354 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -16.280 -5.598 2.199 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -14.605 -5.260 2.586 1.00 0.00 H new ATOM 0 HG LEU A 44 -15.090 -2.790 2.397 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -17.461 -2.078 2.339 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -17.024 -2.974 0.864 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -17.965 -3.774 2.145 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -16.377 -2.645 4.513 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -16.877 -4.343 4.325 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -15.163 -3.944 4.591 1.00 0.00 H new ATOM 1700 N THR A 45 -14.282 -6.309 -1.110 1.00 0.00 N ATOM 1701 CA THR A 45 -13.398 -7.417 -1.573 1.00 0.00 C ATOM 1702 C THR A 45 -11.931 -6.965 -1.561 1.00 0.00 C ATOM 1703 O THR A 45 -11.030 -7.772 -1.680 1.00 0.00 O ATOM 1704 CB THR A 45 -13.802 -7.838 -2.994 1.00 0.00 C ATOM 1705 OG1 THR A 45 -13.151 -9.058 -3.321 1.00 0.00 O ATOM 1706 CG2 THR A 45 -13.401 -6.756 -4.007 1.00 0.00 C ATOM 0 H THR A 45 -14.908 -5.926 -1.819 1.00 0.00 H new ATOM 0 HA THR A 45 -13.509 -8.266 -0.898 1.00 0.00 H new ATOM 0 HB THR A 45 -14.883 -7.970 -3.033 1.00 0.00 H new ATOM 0 HG1 THR A 45 -12.231 -9.038 -2.985 1.00 0.00 H new ATOM 0 HG21 THR A 45 -13.694 -7.069 -5.009 1.00 0.00 H new ATOM 0 HG22 THR A 45 -13.902 -5.821 -3.758 1.00 0.00 H new ATOM 0 HG23 THR A 45 -12.321 -6.609 -3.974 1.00 0.00 H new ATOM 1714 N MET A 46 -11.677 -5.687 -1.414 1.00 0.00 N ATOM 1715 CA MET A 46 -10.259 -5.195 -1.390 1.00 0.00 C ATOM 1716 C MET A 46 -9.799 -4.972 0.054 1.00 0.00 C ATOM 1717 O MET A 46 -8.621 -4.857 0.326 1.00 0.00 O ATOM 1718 CB MET A 46 -10.163 -3.857 -2.133 1.00 0.00 C ATOM 1719 CG MET A 46 -10.358 -4.062 -3.637 1.00 0.00 C ATOM 1720 SD MET A 46 -10.448 -2.439 -4.442 1.00 0.00 S ATOM 1721 CE MET A 46 -10.166 -2.977 -6.149 1.00 0.00 C ATOM 0 H MET A 46 -12.388 -4.963 -1.310 1.00 0.00 H new ATOM 0 HA MET A 46 -9.628 -5.944 -1.869 1.00 0.00 H new ATOM 0 HB2 MET A 46 -10.918 -3.169 -1.753 1.00 0.00 H new ATOM 0 HB3 MET A 46 -9.192 -3.399 -1.946 1.00 0.00 H new ATOM 0 HG2 MET A 46 -9.532 -4.642 -4.049 1.00 0.00 H new ATOM 0 HG3 MET A 46 -11.270 -4.628 -3.826 1.00 0.00 H new ATOM 0 HE1 MET A 46 -10.830 -2.429 -6.818 1.00 0.00 H new ATOM 0 HE2 MET A 46 -9.130 -2.781 -6.426 1.00 0.00 H new ATOM 0 HE3 MET A 46 -10.368 -4.045 -6.232 1.00 0.00 H new ATOM 1731 N ARG A 47 -10.716 -4.879 0.978 1.00 0.00 N ATOM 1732 CA ARG A 47 -10.324 -4.625 2.398 1.00 0.00 C ATOM 1733 C ARG A 47 -9.880 -5.922 3.096 1.00 0.00 C ATOM 1734 O ARG A 47 -10.569 -6.922 3.084 1.00 0.00 O ATOM 1735 CB ARG A 47 -11.528 -3.998 3.140 1.00 0.00 C ATOM 1736 CG ARG A 47 -11.428 -2.465 3.124 1.00 0.00 C ATOM 1737 CD ARG A 47 -11.530 -1.937 1.690 1.00 0.00 C ATOM 1738 NE ARG A 47 -12.922 -2.083 1.184 1.00 0.00 N ATOM 1739 CZ ARG A 47 -13.313 -1.382 0.154 1.00 0.00 C ATOM 1740 NH1 ARG A 47 -12.486 -0.545 -0.413 1.00 0.00 N ATOM 1741 NH2 ARG A 47 -14.528 -1.506 -0.307 1.00 0.00 N ATOM 0 H ARG A 47 -11.719 -4.967 0.814 1.00 0.00 H new ATOM 0 HA ARG A 47 -9.476 -3.940 2.417 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -12.458 -4.313 2.668 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -11.556 -4.356 4.169 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -12.224 -2.036 3.733 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -10.483 -2.151 3.567 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -11.233 -0.889 1.659 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -10.842 -2.483 1.044 1.00 0.00 H new ATOM 0 HE ARG A 47 -13.568 -2.728 1.640 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -11.538 -0.441 -0.051 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -12.788 0.004 -1.218 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -15.179 -2.154 0.138 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -14.827 -0.955 -1.112 1.00 0.00 H new ATOM 1755 N LYS A 48 -8.728 -5.881 3.724 1.00 0.00 N ATOM 1756 CA LYS A 48 -8.194 -7.068 4.464 1.00 0.00 C ATOM 1757 C LYS A 48 -7.777 -6.600 5.859 1.00 0.00 C ATOM 1758 O LYS A 48 -8.438 -5.784 6.469 1.00 0.00 O ATOM 1759 CB LYS A 48 -6.977 -7.644 3.722 1.00 0.00 C ATOM 1760 CG LYS A 48 -6.687 -9.086 4.198 1.00 0.00 C ATOM 1761 CD LYS A 48 -7.533 -10.093 3.410 1.00 0.00 C ATOM 1762 CE LYS A 48 -7.259 -11.506 3.934 1.00 0.00 C ATOM 1763 NZ LYS A 48 -7.828 -11.649 5.306 1.00 0.00 N ATOM 0 H LYS A 48 -8.125 -5.059 3.755 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.954 -7.846 4.534 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.163 -7.639 2.648 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.105 -7.014 3.897 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.629 -9.312 4.069 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.904 -9.174 5.263 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -8.592 -9.854 3.512 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.294 -10.034 2.348 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -7.702 -12.245 3.266 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.186 -11.696 3.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -7.903 -12.658 5.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -7.206 -11.175 5.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.772 -11.214 5.337 1.00 0.00 H new ATOM 1777 N ASP A 49 -6.681 -7.090 6.363 1.00 0.00 N ATOM 1778 CA ASP A 49 -6.213 -6.654 7.710 1.00 0.00 C ATOM 1779 C ASP A 49 -5.231 -5.490 7.546 1.00 0.00 C ATOM 1780 O ASP A 49 -5.607 -4.336 7.595 1.00 0.00 O ATOM 1781 CB ASP A 49 -5.517 -7.827 8.406 1.00 0.00 C ATOM 1782 CG ASP A 49 -6.547 -8.915 8.721 1.00 0.00 C ATOM 1783 OD1 ASP A 49 -7.282 -8.747 9.680 1.00 0.00 O ATOM 1784 OD2 ASP A 49 -6.583 -9.896 7.997 1.00 0.00 O ATOM 0 H ASP A 49 -6.086 -7.776 5.900 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.061 -6.330 8.313 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -4.731 -8.229 7.767 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.038 -7.487 9.324 1.00 0.00 H new ATOM 1789 N GLY A 50 -3.971 -5.787 7.370 1.00 0.00 N ATOM 1790 CA GLY A 50 -2.953 -4.703 7.224 1.00 0.00 C ATOM 1791 C GLY A 50 -2.988 -4.116 5.809 1.00 0.00 C ATOM 1792 O GLY A 50 -3.910 -4.343 5.050 1.00 0.00 O ATOM 0 H GLY A 50 -3.601 -6.736 7.321 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.144 -3.917 7.954 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -1.960 -5.099 7.435 1.00 0.00 H new ATOM 1796 N ILE A 51 -1.983 -3.353 5.456 1.00 0.00 N ATOM 1797 CA ILE A 51 -1.929 -2.733 4.102 1.00 0.00 C ATOM 1798 C ILE A 51 -1.146 -3.633 3.137 1.00 0.00 C ATOM 1799 O ILE A 51 -0.098 -4.153 3.465 1.00 0.00 O ATOM 1800 CB ILE A 51 -1.252 -1.365 4.236 1.00 0.00 C ATOM 1801 CG1 ILE A 51 -1.979 -0.586 5.354 1.00 0.00 C ATOM 1802 CG2 ILE A 51 -1.324 -0.594 2.898 1.00 0.00 C ATOM 1803 CD1 ILE A 51 -1.696 0.912 5.244 1.00 0.00 C ATOM 0 H ILE A 51 -1.190 -3.133 6.058 1.00 0.00 H new ATOM 0 HA ILE A 51 -2.935 -2.612 3.699 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.198 -1.486 4.488 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.052 -0.764 5.288 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.654 -0.951 6.328 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -0.839 0.376 3.010 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -0.817 -1.166 2.121 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.367 -0.447 2.618 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.218 1.440 6.042 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.624 1.087 5.334 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.044 1.278 4.278 1.00 0.00 H new ATOM 1815 N GLN A 52 -1.641 -3.798 1.941 1.00 0.00 N ATOM 1816 CA GLN A 52 -0.920 -4.640 0.944 1.00 0.00 C ATOM 1817 C GLN A 52 0.316 -3.857 0.480 1.00 0.00 C ATOM 1818 O GLN A 52 0.313 -2.645 0.488 1.00 0.00 O ATOM 1819 CB GLN A 52 -1.838 -4.921 -0.257 1.00 0.00 C ATOM 1820 CG GLN A 52 -2.987 -5.836 0.167 1.00 0.00 C ATOM 1821 CD GLN A 52 -4.012 -5.935 -0.970 1.00 0.00 C ATOM 1822 OE1 GLN A 52 -4.225 -4.898 -1.745 1.00 0.00 O flip ATOM 1823 NE2 GLN A 52 -4.633 -6.964 -1.153 1.00 0.00 N flip ATOM 0 H GLN A 52 -2.514 -3.386 1.611 1.00 0.00 H new ATOM 0 HA GLN A 52 -0.626 -5.592 1.386 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.234 -3.984 -0.650 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.268 -5.388 -1.060 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -2.605 -6.827 0.413 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -3.463 -5.446 1.067 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.470 -7.772 -0.552 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.317 -7.019 -1.907 1.00 0.00 H new ATOM 1832 N THR A 53 1.386 -4.519 0.108 1.00 0.00 N ATOM 1833 CA THR A 53 2.614 -3.766 -0.330 1.00 0.00 C ATOM 1834 C THR A 53 3.238 -4.421 -1.563 1.00 0.00 C ATOM 1835 O THR A 53 3.024 -5.582 -1.849 1.00 0.00 O ATOM 1836 CB THR A 53 3.638 -3.728 0.807 1.00 0.00 C ATOM 1837 OG1 THR A 53 4.934 -3.516 0.267 1.00 0.00 O ATOM 1838 CG2 THR A 53 3.613 -5.042 1.576 1.00 0.00 C ATOM 0 H THR A 53 1.467 -5.536 0.087 1.00 0.00 H new ATOM 0 HA THR A 53 2.320 -2.748 -0.586 1.00 0.00 H new ATOM 0 HB THR A 53 3.388 -2.915 1.488 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.591 -3.490 0.994 1.00 0.00 H new ATOM 0 HG21 THR A 53 4.345 -5.005 2.383 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.619 -5.200 1.995 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.857 -5.863 0.902 1.00 0.00 H new ATOM 1846 N ARG A 54 4.009 -3.656 -2.296 1.00 0.00 N ATOM 1847 CA ARG A 54 4.671 -4.182 -3.536 1.00 0.00 C ATOM 1848 C ARG A 54 6.047 -3.534 -3.714 1.00 0.00 C ATOM 1849 O ARG A 54 6.357 -2.515 -3.129 1.00 0.00 O ATOM 1850 CB ARG A 54 3.823 -3.865 -4.782 1.00 0.00 C ATOM 1851 CG ARG A 54 2.443 -4.547 -4.729 1.00 0.00 C ATOM 1852 CD ARG A 54 2.573 -6.071 -4.898 1.00 0.00 C ATOM 1853 NE ARG A 54 3.419 -6.383 -6.089 1.00 0.00 N ATOM 1854 CZ ARG A 54 3.896 -7.590 -6.251 1.00 0.00 C ATOM 1855 NH1 ARG A 54 3.614 -8.524 -5.385 1.00 0.00 N ATOM 1856 NH2 ARG A 54 4.648 -7.864 -7.282 1.00 0.00 N ATOM 0 H ARG A 54 4.212 -2.678 -2.088 1.00 0.00 H new ATOM 0 HA ARG A 54 4.774 -5.262 -3.427 1.00 0.00 H new ATOM 0 HB2 ARG A 54 3.691 -2.786 -4.866 1.00 0.00 H new ATOM 0 HB3 ARG A 54 4.355 -4.192 -5.675 1.00 0.00 H new ATOM 0 HG2 ARG A 54 1.959 -4.323 -3.778 1.00 0.00 H new ATOM 0 HG3 ARG A 54 1.804 -4.144 -5.515 1.00 0.00 H new ATOM 0 HD2 ARG A 54 3.016 -6.508 -4.003 1.00 0.00 H new ATOM 0 HD3 ARG A 54 1.586 -6.518 -5.016 1.00 0.00 H new ATOM 0 HE ARG A 54 3.624 -5.656 -6.775 1.00 0.00 H new ATOM 0 HH11 ARG A 54 3.022 -8.313 -4.582 1.00 0.00 H new ATOM 0 HH12 ARG A 54 3.986 -9.465 -5.511 1.00 0.00 H new ATOM 0 HH21 ARG A 54 4.865 -7.136 -7.963 1.00 0.00 H new ATOM 0 HH22 ARG A 54 5.019 -8.806 -7.407 1.00 0.00 H new ATOM 1870 N ASN A 55 6.867 -4.140 -4.528 1.00 0.00 N ATOM 1871 CA ASN A 55 8.236 -3.606 -4.780 1.00 0.00 C ATOM 1872 C ASN A 55 8.160 -2.196 -5.375 1.00 0.00 C ATOM 1873 O ASN A 55 7.313 -1.896 -6.194 1.00 0.00 O ATOM 1874 CB ASN A 55 8.959 -4.520 -5.768 1.00 0.00 C ATOM 1875 CG ASN A 55 9.168 -5.896 -5.137 1.00 0.00 C ATOM 1876 OD1 ASN A 55 9.588 -5.999 -4.001 1.00 0.00 O ATOM 1877 ND2 ASN A 55 8.895 -6.966 -5.833 1.00 0.00 N ATOM 0 H ASN A 55 6.643 -4.995 -5.037 1.00 0.00 H new ATOM 0 HA ASN A 55 8.776 -3.566 -3.834 1.00 0.00 H new ATOM 0 HB2 ASN A 55 8.377 -4.614 -6.685 1.00 0.00 H new ATOM 0 HB3 ASN A 55 9.920 -4.086 -6.044 1.00 0.00 H new ATOM 0 HD21 ASN A 55 9.034 -7.890 -5.424 1.00 0.00 H new ATOM 0 HD22 ASN A 55 8.543 -6.878 -6.786 1.00 0.00 H new ATOM 1884 N ARG A 56 9.050 -1.335 -4.968 1.00 0.00 N ATOM 1885 CA ARG A 56 9.057 0.063 -5.496 1.00 0.00 C ATOM 1886 C ARG A 56 9.424 0.060 -6.987 1.00 0.00 C ATOM 1887 O ARG A 56 10.404 -0.530 -7.398 1.00 0.00 O ATOM 1888 CB ARG A 56 10.109 0.898 -4.721 1.00 0.00 C ATOM 1889 CG ARG A 56 9.469 1.619 -3.523 1.00 0.00 C ATOM 1890 CD ARG A 56 9.164 0.617 -2.408 1.00 0.00 C ATOM 1891 NE ARG A 56 10.387 0.369 -1.605 1.00 0.00 N ATOM 1892 CZ ARG A 56 10.283 -0.189 -0.430 1.00 0.00 C ATOM 1893 NH1 ARG A 56 9.107 -0.533 0.023 1.00 0.00 N ATOM 1894 NH2 ARG A 56 11.349 -0.405 0.290 1.00 0.00 N ATOM 0 H ARG A 56 9.780 -1.539 -4.286 1.00 0.00 H new ATOM 0 HA ARG A 56 8.065 0.497 -5.368 1.00 0.00 H new ATOM 0 HB2 ARG A 56 10.910 0.246 -4.372 1.00 0.00 H new ATOM 0 HB3 ARG A 56 10.562 1.629 -5.390 1.00 0.00 H new ATOM 0 HG2 ARG A 56 10.141 2.393 -3.153 1.00 0.00 H new ATOM 0 HG3 ARG A 56 8.551 2.117 -3.836 1.00 0.00 H new ATOM 0 HD2 ARG A 56 8.370 1.002 -1.768 1.00 0.00 H new ATOM 0 HD3 ARG A 56 8.803 -0.318 -2.836 1.00 0.00 H new ATOM 0 HE ARG A 56 11.303 0.633 -1.969 1.00 0.00 H new ATOM 0 HH11 ARG A 56 8.274 -0.365 -0.541 1.00 0.00 H new ATOM 0 HH12 ARG A 56 9.022 -0.969 0.941 1.00 0.00 H new ATOM 0 HH21 ARG A 56 12.267 -0.138 -0.065 1.00 0.00 H new ATOM 0 HH22 ARG A 56 11.265 -0.841 1.208 1.00 0.00 H new ATOM 1908 N LYS A 57 8.649 0.734 -7.791 1.00 0.00 N ATOM 1909 CA LYS A 57 8.948 0.799 -9.248 1.00 0.00 C ATOM 1910 C LYS A 57 10.374 1.307 -9.459 1.00 0.00 C ATOM 1911 O LYS A 57 11.149 1.413 -8.528 1.00 0.00 O ATOM 1912 CB LYS A 57 7.978 1.766 -9.933 1.00 0.00 C ATOM 1913 CG LYS A 57 8.031 3.154 -9.254 1.00 0.00 C ATOM 1914 CD LYS A 57 6.870 3.327 -8.253 1.00 0.00 C ATOM 1915 CE LYS A 57 5.630 3.874 -8.967 1.00 0.00 C ATOM 1916 NZ LYS A 57 5.917 5.245 -9.471 1.00 0.00 N ATOM 0 H LYS A 57 7.816 1.246 -7.499 1.00 0.00 H new ATOM 0 HA LYS A 57 8.841 -0.198 -9.674 1.00 0.00 H new ATOM 0 HB2 LYS A 57 8.233 1.860 -10.988 1.00 0.00 H new ATOM 0 HB3 LYS A 57 6.964 1.369 -9.885 1.00 0.00 H new ATOM 0 HG2 LYS A 57 8.983 3.273 -8.736 1.00 0.00 H new ATOM 0 HG3 LYS A 57 7.981 3.935 -10.012 1.00 0.00 H new ATOM 0 HD2 LYS A 57 6.637 2.370 -7.787 1.00 0.00 H new ATOM 0 HD3 LYS A 57 7.168 4.006 -7.454 1.00 0.00 H new ATOM 0 HE2 LYS A 57 5.355 3.220 -9.795 1.00 0.00 H new ATOM 0 HE3 LYS A 57 4.782 3.896 -8.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 5.045 5.811 -9.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 6.635 5.694 -8.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 6.272 5.189 -10.447 1.00 0.00 H new ATOM 1930 N VAL A 58 10.720 1.648 -10.669 1.00 0.00 N ATOM 1931 CA VAL A 58 12.084 2.175 -10.917 1.00 0.00 C ATOM 1932 C VAL A 58 12.255 3.434 -10.073 1.00 0.00 C ATOM 1933 O VAL A 58 11.335 4.213 -9.919 1.00 0.00 O ATOM 1934 CB VAL A 58 12.234 2.524 -12.398 1.00 0.00 C ATOM 1935 CG1 VAL A 58 11.877 1.299 -13.237 1.00 0.00 C ATOM 1936 CG2 VAL A 58 11.303 3.692 -12.757 1.00 0.00 C ATOM 0 H VAL A 58 10.119 1.584 -11.491 1.00 0.00 H new ATOM 0 HA VAL A 58 12.838 1.433 -10.653 1.00 0.00 H new ATOM 0 HB VAL A 58 13.263 2.820 -12.602 1.00 0.00 H new ATOM 0 HG11 VAL A 58 11.981 1.540 -14.295 1.00 0.00 H new ATOM 0 HG12 VAL A 58 12.547 0.477 -12.984 1.00 0.00 H new ATOM 0 HG13 VAL A 58 10.848 1.005 -13.032 1.00 0.00 H new ATOM 0 HG21 VAL A 58 11.415 3.935 -13.814 1.00 0.00 H new ATOM 0 HG22 VAL A 58 10.270 3.408 -12.558 1.00 0.00 H new ATOM 0 HG23 VAL A 58 11.563 4.563 -12.155 1.00 0.00 H new ATOM 1946 N SER A 59 13.403 3.642 -9.506 1.00 0.00 N ATOM 1947 CA SER A 59 13.576 4.850 -8.663 1.00 0.00 C ATOM 1948 C SER A 59 13.579 6.098 -9.544 1.00 0.00 C ATOM 1949 O SER A 59 13.975 6.063 -10.692 1.00 0.00 O ATOM 1950 CB SER A 59 14.886 4.753 -7.884 1.00 0.00 C ATOM 1951 OG SER A 59 15.981 4.921 -8.775 1.00 0.00 O ATOM 0 H SER A 59 14.220 3.037 -9.587 1.00 0.00 H new ATOM 0 HA SER A 59 12.749 4.918 -7.956 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.916 5.516 -7.106 1.00 0.00 H new ATOM 0 HB3 SER A 59 14.954 3.786 -7.385 1.00 0.00 H new ATOM 0 HG SER A 59 16.822 4.861 -8.275 1.00 0.00 H new ATOM 1957 N SER A 60 13.127 7.201 -9.013 1.00 0.00 N ATOM 1958 CA SER A 60 13.081 8.459 -9.809 1.00 0.00 C ATOM 1959 C SER A 60 13.303 9.660 -8.886 1.00 0.00 C ATOM 1960 O SER A 60 12.804 9.715 -7.780 1.00 0.00 O ATOM 1961 CB SER A 60 11.713 8.572 -10.487 1.00 0.00 C ATOM 1962 OG SER A 60 11.643 9.795 -11.208 1.00 0.00 O ATOM 0 H SER A 60 12.785 7.285 -8.056 1.00 0.00 H new ATOM 0 HA SER A 60 13.864 8.444 -10.567 1.00 0.00 H new ATOM 0 HB2 SER A 60 11.559 7.730 -11.162 1.00 0.00 H new ATOM 0 HB3 SER A 60 10.920 8.532 -9.740 1.00 0.00 H new ATOM 0 HG SER A 60 10.768 9.868 -11.644 1.00 0.00 H new ATOM 1968 N LYS A 61 14.057 10.619 -9.346 1.00 0.00 N ATOM 1969 CA LYS A 61 14.339 11.831 -8.527 1.00 0.00 C ATOM 1970 C LYS A 61 15.062 12.845 -9.410 1.00 0.00 C ATOM 1971 O LYS A 61 14.987 14.041 -9.206 1.00 0.00 O ATOM 1972 CB LYS A 61 15.234 11.450 -7.340 1.00 0.00 C ATOM 1973 CG LYS A 61 16.579 10.913 -7.849 1.00 0.00 C ATOM 1974 CD LYS A 61 17.443 10.491 -6.661 1.00 0.00 C ATOM 1975 CE LYS A 61 18.811 10.031 -7.166 1.00 0.00 C ATOM 1976 NZ LYS A 61 19.693 9.730 -6.003 1.00 0.00 N ATOM 0 H LYS A 61 14.496 10.614 -10.267 1.00 0.00 H new ATOM 0 HA LYS A 61 13.410 12.257 -8.147 1.00 0.00 H new ATOM 0 HB2 LYS A 61 15.397 12.319 -6.703 1.00 0.00 H new ATOM 0 HB3 LYS A 61 14.740 10.695 -6.728 1.00 0.00 H new ATOM 0 HG2 LYS A 61 16.416 10.064 -8.513 1.00 0.00 H new ATOM 0 HG3 LYS A 61 17.092 11.679 -8.431 1.00 0.00 H new ATOM 0 HD2 LYS A 61 17.560 11.324 -5.968 1.00 0.00 H new ATOM 0 HD3 LYS A 61 16.956 9.685 -6.111 1.00 0.00 H new ATOM 0 HE2 LYS A 61 18.701 9.145 -7.792 1.00 0.00 H new ATOM 0 HE3 LYS A 61 19.261 10.806 -7.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 20.624 9.417 -6.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 19.807 10.586 -5.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 19.264 8.977 -5.428 1.00 0.00 H new ATOM 1990 N GLY A 62 15.766 12.359 -10.397 1.00 0.00 N ATOM 1991 CA GLY A 62 16.506 13.268 -11.314 1.00 0.00 C ATOM 1992 C GLY A 62 15.504 14.117 -12.091 1.00 0.00 C ATOM 1993 O GLY A 62 15.778 15.244 -12.456 1.00 0.00 O ATOM 0 H GLY A 62 15.860 11.365 -10.607 1.00 0.00 H new ATOM 0 HA2 GLY A 62 17.180 13.908 -10.745 1.00 0.00 H new ATOM 0 HA3 GLY A 62 17.121 12.689 -12.002 1.00 0.00 H new ATOM 1997 N LYS A 63 14.344 13.581 -12.351 1.00 0.00 N ATOM 1998 CA LYS A 63 13.321 14.352 -13.108 1.00 0.00 C ATOM 1999 C LYS A 63 12.977 15.628 -12.338 1.00 0.00 C ATOM 2000 O LYS A 63 12.824 15.618 -11.132 1.00 0.00 O ATOM 2001 CB LYS A 63 12.053 13.501 -13.261 1.00 0.00 C ATOM 2002 CG LYS A 63 12.303 12.326 -14.220 1.00 0.00 C ATOM 2003 CD LYS A 63 12.218 12.790 -15.681 1.00 0.00 C ATOM 2004 CE LYS A 63 12.240 11.569 -16.602 1.00 0.00 C ATOM 2005 NZ LYS A 63 12.220 12.018 -18.024 1.00 0.00 N ATOM 0 H LYS A 63 14.061 12.642 -12.071 1.00 0.00 H new ATOM 0 HA LYS A 63 13.713 14.609 -14.092 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.743 13.123 -12.287 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.238 14.118 -13.638 1.00 0.00 H new ATOM 0 HG2 LYS A 63 13.285 11.895 -14.027 1.00 0.00 H new ATOM 0 HG3 LYS A 63 11.569 11.540 -14.040 1.00 0.00 H new ATOM 0 HD2 LYS A 63 11.305 13.363 -15.840 1.00 0.00 H new ATOM 0 HD3 LYS A 63 13.053 13.450 -15.914 1.00 0.00 H new ATOM 0 HE2 LYS A 63 13.132 10.972 -16.411 1.00 0.00 H new ATOM 0 HE3 LYS A 63 11.380 10.931 -16.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 12.235 11.188 -18.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 11.357 12.570 -18.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 13.054 12.609 -18.213 1.00 0.00 H new ATOM 2019 N LYS A 64 12.841 16.728 -13.034 1.00 0.00 N ATOM 2020 CA LYS A 64 12.490 18.016 -12.362 1.00 0.00 C ATOM 2021 C LYS A 64 11.514 18.787 -13.251 1.00 0.00 C ATOM 2022 O LYS A 64 11.448 18.568 -14.443 1.00 0.00 O ATOM 2023 CB LYS A 64 13.750 18.859 -12.152 1.00 0.00 C ATOM 2024 CG LYS A 64 14.639 18.217 -11.085 1.00 0.00 C ATOM 2025 CD LYS A 64 15.888 19.078 -10.896 1.00 0.00 C ATOM 2026 CE LYS A 64 16.791 18.454 -9.832 1.00 0.00 C ATOM 2027 NZ LYS A 64 17.119 17.054 -10.221 1.00 0.00 N ATOM 0 H LYS A 64 12.959 16.790 -14.045 1.00 0.00 H new ATOM 0 HA LYS A 64 12.035 17.807 -11.394 1.00 0.00 H new ATOM 0 HB2 LYS A 64 14.299 18.947 -13.090 1.00 0.00 H new ATOM 0 HB3 LYS A 64 13.475 19.869 -11.848 1.00 0.00 H new ATOM 0 HG2 LYS A 64 14.095 18.130 -10.144 1.00 0.00 H new ATOM 0 HG3 LYS A 64 14.919 17.207 -11.386 1.00 0.00 H new ATOM 0 HD2 LYS A 64 16.428 19.164 -11.839 1.00 0.00 H new ATOM 0 HD3 LYS A 64 15.604 20.087 -10.598 1.00 0.00 H new ATOM 0 HE2 LYS A 64 17.705 19.038 -9.727 1.00 0.00 H new ATOM 0 HE3 LYS A 64 16.292 18.467 -8.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 17.961 16.737 -9.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 16.317 16.433 -9.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 17.308 17.013 -11.243 1.00 0.00 H new ATOM 2041 N ARG A 65 10.754 19.686 -12.677 1.00 0.00 N ATOM 2042 CA ARG A 65 9.768 20.478 -13.474 1.00 0.00 C ATOM 2043 C ARG A 65 9.941 21.965 -13.166 1.00 0.00 C ATOM 2044 O ARG A 65 10.387 22.339 -12.100 1.00 0.00 O ATOM 2045 CB ARG A 65 8.355 20.042 -13.086 1.00 0.00 C ATOM 2046 CG ARG A 65 8.105 18.626 -13.603 1.00 0.00 C ATOM 2047 CD ARG A 65 6.702 18.170 -13.197 1.00 0.00 C ATOM 2048 NE ARG A 65 6.535 16.730 -13.536 1.00 0.00 N ATOM 2049 CZ ARG A 65 5.569 16.041 -12.992 1.00 0.00 C ATOM 2050 NH1 ARG A 65 4.756 16.610 -12.144 1.00 0.00 N ATOM 2051 NH2 ARG A 65 5.418 14.779 -13.295 1.00 0.00 N ATOM 0 H ARG A 65 10.775 19.907 -11.681 1.00 0.00 H new ATOM 0 HA ARG A 65 9.931 20.308 -14.538 1.00 0.00 H new ATOM 0 HB2 ARG A 65 8.237 20.072 -12.003 1.00 0.00 H new ATOM 0 HB3 ARG A 65 7.621 20.730 -13.506 1.00 0.00 H new ATOM 0 HG2 ARG A 65 8.206 18.601 -14.688 1.00 0.00 H new ATOM 0 HG3 ARG A 65 8.852 17.943 -13.198 1.00 0.00 H new ATOM 0 HD2 ARG A 65 6.552 18.323 -12.128 1.00 0.00 H new ATOM 0 HD3 ARG A 65 5.950 18.767 -13.713 1.00 0.00 H new ATOM 0 HE ARG A 65 7.175 16.282 -14.192 1.00 0.00 H new ATOM 0 HH11 ARG A 65 4.875 17.595 -11.906 1.00 0.00 H new ATOM 0 HH12 ARG A 65 4.002 16.070 -11.720 1.00 0.00 H new ATOM 0 HH21 ARG A 65 6.055 14.333 -13.956 1.00 0.00 H new ATOM 0 HH22 ARG A 65 4.664 14.239 -12.871 1.00 0.00 H new ATOM 2065 N ARG A 66 9.590 22.818 -14.090 1.00 0.00 N ATOM 2066 CA ARG A 66 9.733 24.281 -13.842 1.00 0.00 C ATOM 2067 C ARG A 66 8.810 25.046 -14.794 1.00 0.00 C ATOM 2068 O ARG A 66 8.237 26.034 -14.367 1.00 0.00 O ATOM 2069 CB ARG A 66 11.179 24.713 -14.092 1.00 0.00 C ATOM 2070 CG ARG A 66 11.376 26.126 -13.547 1.00 0.00 C ATOM 2071 CD ARG A 66 12.817 26.579 -13.787 1.00 0.00 C ATOM 2072 NE ARG A 66 13.092 27.816 -12.983 1.00 0.00 N ATOM 2073 CZ ARG A 66 12.339 28.881 -13.082 1.00 0.00 C ATOM 2074 NH1 ARG A 66 11.475 28.997 -14.053 1.00 0.00 N ATOM 2075 NH2 ARG A 66 12.496 29.863 -12.238 1.00 0.00 N ATOM 2076 OXT ARG A 66 8.696 24.631 -15.936 1.00 0.00 O ATOM 0 H ARG A 66 9.212 22.566 -15.003 1.00 0.00 H new ATOM 0 HA ARG A 66 9.465 24.498 -12.808 1.00 0.00 H new ATOM 0 HB2 ARG A 66 11.868 24.022 -13.606 1.00 0.00 H new ATOM 0 HB3 ARG A 66 11.401 24.686 -15.159 1.00 0.00 H new ATOM 0 HG2 ARG A 66 10.684 26.813 -14.034 1.00 0.00 H new ATOM 0 HG3 ARG A 66 11.151 26.149 -12.481 1.00 0.00 H new ATOM 0 HD2 ARG A 66 13.511 25.787 -13.505 1.00 0.00 H new ATOM 0 HD3 ARG A 66 12.975 26.778 -14.847 1.00 0.00 H new ATOM 0 HE ARG A 66 13.886 27.827 -12.343 1.00 0.00 H new ATOM 0 HH11 ARG A 66 11.382 28.253 -14.744 1.00 0.00 H new ATOM 0 HH12 ARG A 66 10.893 29.832 -14.121 1.00 0.00 H new ATOM 0 HH21 ARG A 66 13.203 29.798 -11.506 1.00 0.00 H new ATOM 0 HH22 ARG A 66 11.912 30.696 -12.310 1.00 0.00 H new TER 2090 ARG A 66 HETATM 2091 ZN ZN A 67 -11.997 2.853 2.225 1.00 0.00 ZN