USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=30 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 180:sc= -0.0953 USER MOD Set 1.2: A 29 ASN : amide:sc= -5.69! C(o=-5.8!,f=-4.9!) USER MOD Single : A 1 LYS N :NH3+ -161:sc= -0.0164 (180deg=-0.358) USER MOD Single : A 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot -63:sc= -2.54! USER MOD Single : A 8 SER OG : rot 83:sc= 0.426 USER MOD Single : A 9 ASN : amide:sc= -4.06! C(o=-4.1!,f=-3.4!) USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 43:sc= 1.01 USER MOD Single : A 14 THR OG1 : rot 58:sc= 0.559 USER MOD Single : A 15 THR OG1 : rot -134:sc= 1.19 USER MOD Single : A 21 SER OG : rot -170:sc= 0 USER MOD Single : A 23 MET CE :methyl 177:sc= 0 (180deg=-0.00308) 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+ 167:sc=-0.000641 (180deg=-0.394) USER MOD Single : A 38 HIS : no HD1:sc= -6.16! C(o=-6.2!,f=-11!) USER MOD Single : A 39 GLN : amide:sc= -0.0376 K(o=-0.038,f=-2!) USER MOD Single : A 41 ASN : amide:sc= -1.08 K(o=-1.1,f=-7.5!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 165:sc= -2.17 (180deg=-3.12!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -1.4! X(o=-1.4!,f=-1) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.484 USER MOD Single : A 55 ASN : amide:sc=-0.000249 X(o=-0.00025,f=-0.24) USER MOD Single : A 57 LYS NZ :NH3+ -130:sc= 0.361 (180deg=0) USER MOD Single : A 59 SER OG : rot 8:sc= 0.959 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+ -160:sc= -1.17 (180deg=-1.76) USER MOD Single : B 101 DG O5' : rot 180:sc= -0.291 USER MOD Single : B 102 DT C7 :methyl -30:sc= -1.32 (180deg=-2.5!) USER MOD Single : B 103 DT C7 :methyl -30:sc= -1.44 (180deg=-2.22!) USER MOD Single : B 109 DT C7 :methyl 150:sc= -2.41! (180deg=-2.41!) USER MOD Single : B 115 DT C7 :methyl -30:sc= -0.577 (180deg=-1) USER MOD Single : B 116 DT C7 :methyl 150:sc= -0.625 (180deg=-0.625) USER MOD Single : B 116 DT O3' : rot 180:sc= 0 USER MOD Single : C 117 DA O5' : rot 79:sc= -1.76! USER MOD Single : C 119 DT C7 :methyl -30:sc= -1.15 (180deg=-1.54!) USER MOD Single : C 121 DT C7 :methyl 150:sc= -0.928 (180deg=-0.928) USER MOD Single : C 122 DT C7 :methyl 150:sc= -0.685 (180deg=-0.685) USER MOD Single : C 123 DT C7 :methyl -30:sc= -2.14 (180deg=-6.28!) USER MOD Single : C 125 DT C7 :methyl 150:sc= -1.42 (180deg=-1.42) USER MOD Single : C 127 DT C7 :methyl -30:sc= -1.28 (180deg=-1.69!) USER MOD Single : C 132 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG B 101 20.047 25.135 5.132 1.00 0.00 O ATOM 2 C5' DG B 101 20.575 25.091 6.462 1.00 0.00 C ATOM 3 C4' DG B 101 19.593 24.426 7.433 1.00 0.00 C ATOM 4 O4' DG B 101 18.445 25.281 7.651 1.00 0.00 O ATOM 5 C3' DG B 101 19.084 23.082 6.897 1.00 0.00 C ATOM 6 O3' DG B 101 19.196 22.065 7.898 1.00 0.00 O ATOM 7 C2' DG B 101 17.635 23.311 6.549 1.00 0.00 C ATOM 8 C1' DG B 101 17.246 24.657 7.144 1.00 0.00 C ATOM 9 N9 DG B 101 16.598 25.519 6.136 1.00 0.00 N ATOM 10 C8 DG B 101 17.038 25.872 4.892 1.00 0.00 C ATOM 11 N7 DG B 101 16.261 26.687 4.243 1.00 0.00 N ATOM 12 C5 DG B 101 15.208 26.899 5.131 1.00 0.00 C ATOM 13 C6 DG B 101 14.043 27.702 4.989 1.00 0.00 C ATOM 14 O6 DG B 101 13.703 28.390 4.030 1.00 0.00 O ATOM 15 N1 DG B 101 13.242 27.638 6.121 1.00 0.00 N ATOM 16 C2 DG B 101 13.517 26.891 7.247 1.00 0.00 C ATOM 17 N2 DG B 101 12.622 26.959 8.233 1.00 0.00 N ATOM 18 N3 DG B 101 14.609 26.135 7.384 1.00 0.00 N ATOM 19 C4 DG B 101 15.407 26.187 6.292 1.00 0.00 C ATOM 0 H5' DG B 101 20.795 26.103 6.801 1.00 0.00 H new ATOM 0 H5'' DG B 101 21.517 24.543 6.463 1.00 0.00 H new ATOM 0 H4' DG B 101 20.135 24.260 8.364 1.00 0.00 H new ATOM 0 H3' DG B 101 19.664 22.748 6.036 1.00 0.00 H new ATOM 0 H2' DG B 101 17.492 23.311 5.468 1.00 0.00 H new ATOM 0 H2'' DG B 101 17.010 22.515 6.953 1.00 0.00 H new ATOM 0 HO5' DG B 101 20.695 25.566 4.537 1.00 0.00 H new ATOM 0 H1' DG B 101 16.525 24.510 7.949 1.00 0.00 H new ATOM 0 H8 DG B 101 17.964 25.501 4.478 1.00 0.00 H new ATOM 0 H1 DG B 101 12.382 28.187 6.120 1.00 0.00 H new ATOM 0 H21 DG B 101 12.769 26.429 9.092 1.00 0.00 H new ATOM 0 H22 DG B 101 11.791 27.541 8.128 1.00 0.00 H new ATOM 32 P DT B 102 18.730 20.551 7.595 1.00 0.00 P ATOM 33 OP1 DT B 102 19.597 19.640 8.373 1.00 0.00 O ATOM 34 OP2 DT B 102 18.619 20.387 6.129 1.00 0.00 O ATOM 35 O5' DT B 102 17.242 20.487 8.224 1.00 0.00 O ATOM 36 C5' DT B 102 17.040 20.735 9.619 1.00 0.00 C ATOM 37 C4' DT B 102 15.563 20.631 10.037 1.00 0.00 C ATOM 38 O4' DT B 102 14.795 21.744 9.515 1.00 0.00 O ATOM 39 C3' DT B 102 14.903 19.336 9.545 1.00 0.00 C ATOM 40 O3' DT B 102 14.412 18.583 10.661 1.00 0.00 O ATOM 41 C2' DT B 102 13.757 19.771 8.663 1.00 0.00 C ATOM 42 C1' DT B 102 13.580 21.266 8.887 1.00 0.00 C ATOM 43 N1 DT B 102 13.313 22.004 7.616 1.00 0.00 N ATOM 44 C2 DT B 102 12.143 22.752 7.520 1.00 0.00 C ATOM 45 O2 DT B 102 11.313 22.784 8.425 1.00 0.00 O ATOM 46 N3 DT B 102 11.965 23.460 6.345 1.00 0.00 N ATOM 47 C4 DT B 102 12.834 23.483 5.269 1.00 0.00 C ATOM 48 O4 DT B 102 12.572 24.145 4.268 1.00 0.00 O ATOM 49 C5 DT B 102 14.021 22.676 5.452 1.00 0.00 C ATOM 50 C7 DT B 102 15.064 22.629 4.330 1.00 0.00 C ATOM 51 C6 DT B 102 14.217 21.977 6.596 1.00 0.00 C ATOM 0 H5' DT B 102 17.413 21.730 9.864 1.00 0.00 H new ATOM 0 H5'' DT B 102 17.628 20.023 10.198 1.00 0.00 H new ATOM 0 H4' DT B 102 15.563 20.641 11.127 1.00 0.00 H new ATOM 0 H3' DT B 102 15.606 18.701 9.006 1.00 0.00 H new ATOM 0 H2' DT B 102 13.972 19.559 7.616 1.00 0.00 H new ATOM 0 H2'' DT B 102 12.845 19.230 8.917 1.00 0.00 H new ATOM 0 H1' DT B 102 12.710 21.443 9.520 1.00 0.00 H new ATOM 0 H3 DT B 102 11.114 24.017 6.265 1.00 0.00 H new ATOM 0 H71 DT B 102 14.570 22.767 3.368 1.00 0.00 H new ATOM 0 H72 DT B 102 15.795 23.423 4.480 1.00 0.00 H new ATOM 0 H73 DT B 102 15.569 21.663 4.343 1.00 0.00 H new ATOM 0 H6 DT B 102 15.113 21.383 6.703 1.00 0.00 H new ATOM 64 P DT B 103 13.665 17.169 10.458 1.00 0.00 P ATOM 65 OP1 DT B 103 13.818 16.389 11.706 1.00 0.00 O ATOM 66 OP2 DT B 103 14.109 16.591 9.170 1.00 0.00 O ATOM 67 O5' DT B 103 12.110 17.588 10.314 1.00 0.00 O ATOM 68 C5' DT B 103 11.454 18.261 11.394 1.00 0.00 C ATOM 69 C4' DT B 103 9.980 18.586 11.095 1.00 0.00 C ATOM 70 O4' DT B 103 9.870 19.636 10.104 1.00 0.00 O ATOM 71 C3' DT B 103 9.206 17.363 10.574 1.00 0.00 C ATOM 72 O3' DT B 103 8.132 17.042 11.459 1.00 0.00 O ATOM 73 C2' DT B 103 8.653 17.775 9.226 1.00 0.00 C ATOM 74 C1' DT B 103 8.882 19.278 9.115 1.00 0.00 C ATOM 75 N1 DT B 103 9.333 19.667 7.753 1.00 0.00 N ATOM 76 C2 DT B 103 8.557 20.560 7.028 1.00 0.00 C ATOM 77 O2 DT B 103 7.495 21.002 7.461 1.00 0.00 O ATOM 78 N3 DT B 103 9.046 20.922 5.788 1.00 0.00 N ATOM 79 C4 DT B 103 10.225 20.476 5.217 1.00 0.00 C ATOM 80 O4 DT B 103 10.570 20.863 4.105 1.00 0.00 O ATOM 81 C5 DT B 103 10.964 19.550 6.039 1.00 0.00 C ATOM 82 C7 DT B 103 12.288 18.985 5.513 1.00 0.00 C ATOM 83 C6 DT B 103 10.501 19.182 7.255 1.00 0.00 C ATOM 0 H5' DT B 103 11.986 19.186 11.615 1.00 0.00 H new ATOM 0 H5'' DT B 103 11.509 17.640 12.288 1.00 0.00 H new ATOM 0 H4' DT B 103 9.547 18.907 12.042 1.00 0.00 H new ATOM 0 H3' DT B 103 9.847 16.484 10.503 1.00 0.00 H new ATOM 0 H2' DT B 103 9.158 17.244 8.419 1.00 0.00 H new ATOM 0 H2'' DT B 103 7.592 17.536 9.151 1.00 0.00 H new ATOM 0 H1' DT B 103 7.947 19.810 9.291 1.00 0.00 H new ATOM 0 H3 DT B 103 8.487 21.578 5.243 1.00 0.00 H new ATOM 0 H71 DT B 103 12.254 18.930 4.425 1.00 0.00 H new ATOM 0 H72 DT B 103 13.108 19.635 5.818 1.00 0.00 H new ATOM 0 H73 DT B 103 12.446 17.987 5.922 1.00 0.00 H new ATOM 0 H6 DT B 103 11.075 18.484 7.846 1.00 0.00 H new ATOM 96 P DG B 104 7.167 15.792 11.155 1.00 0.00 P ATOM 97 OP1 DG B 104 6.611 15.318 12.442 1.00 0.00 O ATOM 98 OP2 DG B 104 7.902 14.850 10.284 1.00 0.00 O ATOM 99 O5' DG B 104 5.959 16.423 10.293 1.00 0.00 O ATOM 100 C5' DG B 104 5.139 17.461 10.841 1.00 0.00 C ATOM 101 C4' DG B 104 4.030 17.881 9.870 1.00 0.00 C ATOM 102 O4' DG B 104 4.574 18.594 8.735 1.00 0.00 O ATOM 103 C3' DG B 104 3.271 16.653 9.348 1.00 0.00 C ATOM 104 O3' DG B 104 1.872 16.764 9.627 1.00 0.00 O ATOM 105 C2' DG B 104 3.497 16.645 7.855 1.00 0.00 C ATOM 106 C1' DG B 104 4.191 17.951 7.497 1.00 0.00 C ATOM 107 N9 DG B 104 5.374 17.722 6.638 1.00 0.00 N ATOM 108 C8 DG B 104 6.417 16.860 6.814 1.00 0.00 C ATOM 109 N7 DG B 104 7.329 16.895 5.889 1.00 0.00 N ATOM 110 C5 DG B 104 6.854 17.866 5.009 1.00 0.00 C ATOM 111 C6 DG B 104 7.419 18.351 3.796 1.00 0.00 C ATOM 112 O6 DG B 104 8.474 18.018 3.258 1.00 0.00 O ATOM 113 N1 DG B 104 6.621 19.328 3.216 1.00 0.00 N ATOM 114 C2 DG B 104 5.428 19.786 3.734 1.00 0.00 C ATOM 115 N2 DG B 104 4.805 20.736 3.032 1.00 0.00 N ATOM 116 N3 DG B 104 4.893 19.334 4.876 1.00 0.00 N ATOM 117 C4 DG B 104 5.657 18.378 5.457 1.00 0.00 C ATOM 0 H5' DG B 104 5.758 18.325 11.081 1.00 0.00 H new ATOM 0 H5'' DG B 104 4.694 17.118 11.775 1.00 0.00 H new ATOM 0 H4' DG B 104 3.351 18.533 10.421 1.00 0.00 H new ATOM 0 H3' DG B 104 3.621 15.737 9.824 1.00 0.00 H new ATOM 0 H2' DG B 104 4.109 15.792 7.563 1.00 0.00 H new ATOM 0 H2'' DG B 104 2.550 16.554 7.323 1.00 0.00 H new ATOM 0 H1' DG B 104 3.512 18.586 6.927 1.00 0.00 H new ATOM 0 H8 DG B 104 6.480 16.195 7.663 1.00 0.00 H new ATOM 0 H1 DG B 104 6.942 19.739 2.339 1.00 0.00 H new ATOM 0 H21 DG B 104 3.918 21.116 3.363 1.00 0.00 H new ATOM 0 H22 DG B 104 5.216 21.082 2.165 1.00 0.00 H new ATOM 129 P DC B 105 0.846 15.601 9.182 1.00 0.00 P ATOM 130 OP1 DC B 105 -0.334 15.657 10.075 1.00 0.00 O ATOM 131 OP2 DC B 105 1.612 14.340 9.055 1.00 0.00 O ATOM 132 O5' DC B 105 0.378 16.055 7.709 1.00 0.00 O ATOM 133 C5' DC B 105 -0.278 17.310 7.529 1.00 0.00 C ATOM 134 C4' DC B 105 -0.649 17.574 6.064 1.00 0.00 C ATOM 135 O4' DC B 105 0.530 17.808 5.249 1.00 0.00 O ATOM 136 C3' DC B 105 -1.414 16.405 5.435 1.00 0.00 C ATOM 137 O3' DC B 105 -2.684 16.873 4.986 1.00 0.00 O ATOM 138 C2' DC B 105 -0.578 15.927 4.274 1.00 0.00 C ATOM 139 C1' DC B 105 0.499 16.973 4.061 1.00 0.00 C ATOM 140 N1 DC B 105 1.835 16.358 3.815 1.00 0.00 N ATOM 141 C2 DC B 105 2.487 16.636 2.614 1.00 0.00 C ATOM 142 O2 DC B 105 1.935 17.324 1.757 1.00 0.00 O ATOM 143 N3 DC B 105 3.738 16.131 2.424 1.00 0.00 N ATOM 144 C4 DC B 105 4.330 15.386 3.366 1.00 0.00 C ATOM 145 N4 DC B 105 5.561 14.917 3.153 1.00 0.00 N ATOM 146 C5 DC B 105 3.664 15.094 4.597 1.00 0.00 C ATOM 147 C6 DC B 105 2.425 15.596 4.773 1.00 0.00 C ATOM 0 H5' DC B 105 0.371 18.110 7.886 1.00 0.00 H new ATOM 0 H5'' DC B 105 -1.181 17.335 8.139 1.00 0.00 H new ATOM 0 H4' DC B 105 -1.284 18.460 6.083 1.00 0.00 H new ATOM 0 H3' DC B 105 -1.585 15.593 6.142 1.00 0.00 H new ATOM 0 H2' DC B 105 -0.137 14.954 4.488 1.00 0.00 H new ATOM 0 H2'' DC B 105 -1.188 15.810 3.378 1.00 0.00 H new ATOM 0 H1' DC B 105 0.268 17.563 3.174 1.00 0.00 H new ATOM 0 H41 DC B 105 6.020 14.349 3.865 1.00 0.00 H new ATOM 0 H42 DC B 105 6.042 15.127 2.279 1.00 0.00 H new ATOM 0 H5 DC B 105 4.137 14.492 5.359 1.00 0.00 H new ATOM 0 H6 DC B 105 1.893 15.389 5.690 1.00 0.00 H new ATOM 159 P DA B 106 -3.750 15.906 4.274 1.00 0.00 P ATOM 160 OP1 DA B 106 -5.104 16.470 4.476 1.00 0.00 O ATOM 161 OP2 DA B 106 -3.459 14.511 4.672 1.00 0.00 O ATOM 162 O5' DA B 106 -3.351 16.093 2.725 1.00 0.00 O ATOM 163 C5' DA B 106 -3.426 17.403 2.153 1.00 0.00 C ATOM 164 C4' DA B 106 -3.020 17.440 0.679 1.00 0.00 C ATOM 165 O4' DA B 106 -1.617 17.119 0.506 1.00 0.00 O ATOM 166 C3' DA B 106 -3.832 16.466 -0.167 1.00 0.00 C ATOM 167 O3' DA B 106 -4.526 17.198 -1.163 1.00 0.00 O ATOM 168 C2' DA B 106 -2.832 15.529 -0.812 1.00 0.00 C ATOM 169 C1' DA B 106 -1.445 16.053 -0.461 1.00 0.00 C ATOM 170 N9 DA B 106 -0.609 14.990 0.104 1.00 0.00 N ATOM 171 C8 DA B 106 -0.832 14.288 1.225 1.00 0.00 C ATOM 172 N7 DA B 106 0.095 13.439 1.551 1.00 0.00 N ATOM 173 C5 DA B 106 1.028 13.593 0.524 1.00 0.00 C ATOM 174 C6 DA B 106 2.259 12.983 0.256 1.00 0.00 C ATOM 175 N6 DA B 106 2.800 12.051 1.043 1.00 0.00 N ATOM 176 N1 DA B 106 2.915 13.375 -0.851 1.00 0.00 N ATOM 177 C2 DA B 106 2.392 14.311 -1.644 1.00 0.00 C ATOM 178 N3 DA B 106 1.237 14.950 -1.482 1.00 0.00 N ATOM 179 C4 DA B 106 0.602 14.537 -0.367 1.00 0.00 C ATOM 0 H5' DA B 106 -2.782 18.077 2.718 1.00 0.00 H new ATOM 0 H5'' DA B 106 -4.445 17.778 2.252 1.00 0.00 H new ATOM 0 H4' DA B 106 -3.216 18.459 0.345 1.00 0.00 H new ATOM 0 H3' DA B 106 -4.559 15.911 0.426 1.00 0.00 H new ATOM 0 H2' DA B 106 -2.964 14.511 -0.445 1.00 0.00 H new ATOM 0 H2'' DA B 106 -2.972 15.499 -1.893 1.00 0.00 H new ATOM 0 H1' DA B 106 -0.945 16.417 -1.358 1.00 0.00 H new ATOM 0 H8 DA B 106 -1.725 14.420 1.818 1.00 0.00 H new ATOM 0 H61 DA B 106 3.701 11.639 0.800 1.00 0.00 H new ATOM 0 H62 DA B 106 2.313 11.751 1.887 1.00 0.00 H new ATOM 0 H2 DA B 106 2.971 14.580 -2.515 1.00 0.00 H new ATOM 191 P DG B 107 -5.474 16.469 -2.222 1.00 0.00 P ATOM 192 OP1 DG B 107 -6.391 17.469 -2.813 1.00 0.00 O ATOM 193 OP2 DG B 107 -6.003 15.228 -1.612 1.00 0.00 O ATOM 194 O5' DG B 107 -4.372 16.078 -3.307 1.00 0.00 O ATOM 195 C5' DG B 107 -3.608 17.111 -3.920 1.00 0.00 C ATOM 196 C4' DG B 107 -2.579 16.534 -4.875 1.00 0.00 C ATOM 197 O4' DG B 107 -1.530 15.833 -4.150 1.00 0.00 O ATOM 198 C3' DG B 107 -3.216 15.533 -5.835 1.00 0.00 C ATOM 199 O3' DG B 107 -3.029 15.983 -7.178 1.00 0.00 O ATOM 200 C2' DG B 107 -2.516 14.223 -5.587 1.00 0.00 C ATOM 201 C1' DG B 107 -1.280 14.553 -4.776 1.00 0.00 C ATOM 202 N9 DG B 107 -0.957 13.484 -3.790 1.00 0.00 N ATOM 203 C8 DG B 107 -1.699 12.983 -2.745 1.00 0.00 C ATOM 204 N7 DG B 107 -1.126 12.047 -2.067 1.00 0.00 N ATOM 205 C5 DG B 107 0.102 11.892 -2.692 1.00 0.00 C ATOM 206 C6 DG B 107 1.162 11.005 -2.382 1.00 0.00 C ATOM 207 O6 DG B 107 1.209 10.171 -1.484 1.00 0.00 O ATOM 208 N1 DG B 107 2.230 11.160 -3.254 1.00 0.00 N ATOM 209 C2 DG B 107 2.276 12.060 -4.298 1.00 0.00 C ATOM 210 N2 DG B 107 3.395 12.061 -5.027 1.00 0.00 N ATOM 211 N3 DG B 107 1.273 12.903 -4.594 1.00 0.00 N ATOM 212 C4 DG B 107 0.221 12.763 -3.750 1.00 0.00 C ATOM 0 H5' DG B 107 -3.107 17.701 -3.153 1.00 0.00 H new ATOM 0 H5'' DG B 107 -4.271 17.787 -4.460 1.00 0.00 H new ATOM 0 H4' DG B 107 -2.163 17.376 -5.429 1.00 0.00 H new ATOM 0 H3' DG B 107 -4.290 15.426 -5.680 1.00 0.00 H new ATOM 0 H2' DG B 107 -3.163 13.532 -5.047 1.00 0.00 H new ATOM 0 H2'' DG B 107 -2.248 13.741 -6.527 1.00 0.00 H new ATOM 0 H1' DG B 107 -0.398 14.611 -5.414 1.00 0.00 H new ATOM 0 H8 DG B 107 -2.688 13.347 -2.510 1.00 0.00 H new ATOM 0 H1 DG B 107 3.044 10.562 -3.112 1.00 0.00 H new ATOM 0 H21 DG B 107 3.491 12.704 -5.813 1.00 0.00 H new ATOM 0 H22 DG B 107 4.154 11.419 -4.797 1.00 0.00 H new ATOM 224 P DA B 108 -3.589 15.144 -8.425 1.00 0.00 P ATOM 225 OP1 DA B 108 -4.012 16.100 -9.473 1.00 0.00 O ATOM 226 OP2 DA B 108 -4.549 14.144 -7.907 1.00 0.00 O ATOM 227 O5' DA B 108 -2.281 14.364 -8.953 1.00 0.00 O ATOM 228 C5' DA B 108 -1.144 15.122 -9.391 1.00 0.00 C ATOM 229 C4' DA B 108 0.016 14.235 -9.862 1.00 0.00 C ATOM 230 O4' DA B 108 0.636 13.545 -8.746 1.00 0.00 O ATOM 231 C3' DA B 108 -0.458 13.178 -10.866 1.00 0.00 C ATOM 232 O3' DA B 108 0.335 13.242 -12.057 1.00 0.00 O ATOM 233 C2' DA B 108 -0.262 11.853 -10.171 1.00 0.00 C ATOM 234 C1' DA B 108 0.640 12.117 -8.978 1.00 0.00 C ATOM 235 N9 DA B 108 0.187 11.386 -7.777 1.00 0.00 N ATOM 236 C8 DA B 108 -1.030 11.422 -7.156 1.00 0.00 C ATOM 237 N7 DA B 108 -1.111 10.745 -6.056 1.00 0.00 N ATOM 238 C5 DA B 108 0.163 10.201 -5.930 1.00 0.00 C ATOM 239 C6 DA B 108 0.736 9.372 -4.969 1.00 0.00 C ATOM 240 N6 DA B 108 0.087 8.983 -3.885 1.00 0.00 N ATOM 241 N1 DA B 108 2.015 9.003 -5.142 1.00 0.00 N ATOM 242 C2 DA B 108 2.699 9.430 -6.201 1.00 0.00 C ATOM 243 N3 DA B 108 2.254 10.230 -7.173 1.00 0.00 N ATOM 244 C4 DA B 108 0.961 10.579 -6.970 1.00 0.00 C ATOM 0 H5' DA B 108 -0.801 15.758 -8.575 1.00 0.00 H new ATOM 0 H5'' DA B 108 -1.445 15.782 -10.205 1.00 0.00 H new ATOM 0 H4' DA B 108 0.738 14.899 -10.338 1.00 0.00 H new ATOM 0 H3' DA B 108 -1.496 13.328 -11.163 1.00 0.00 H new ATOM 0 H2' DA B 108 -1.218 11.439 -9.850 1.00 0.00 H new ATOM 0 H2'' DA B 108 0.190 11.125 -10.845 1.00 0.00 H new ATOM 0 H1' DA B 108 1.649 11.761 -9.188 1.00 0.00 H new ATOM 0 H8 DA B 108 -1.866 11.977 -7.556 1.00 0.00 H new ATOM 0 H61 DA B 108 0.546 8.375 -3.207 1.00 0.00 H new ATOM 0 H62 DA B 108 -0.872 9.291 -3.727 1.00 0.00 H new ATOM 0 H2 DA B 108 3.722 9.094 -6.283 1.00 0.00 H new ATOM 256 P DT B 109 0.071 12.247 -13.297 1.00 0.00 P ATOM 257 OP1 DT B 109 0.362 12.978 -14.550 1.00 0.00 O ATOM 258 OP2 DT B 109 -1.251 11.606 -13.105 1.00 0.00 O ATOM 259 O5' DT B 109 1.211 11.131 -13.090 1.00 0.00 O ATOM 260 C5' DT B 109 2.586 11.522 -13.100 1.00 0.00 C ATOM 261 C4' DT B 109 3.533 10.338 -12.883 1.00 0.00 C ATOM 262 O4' DT B 109 3.410 9.834 -11.532 1.00 0.00 O ATOM 263 C3' DT B 109 3.256 9.180 -13.851 1.00 0.00 C ATOM 264 O3' DT B 109 4.421 8.918 -14.633 1.00 0.00 O ATOM 265 C2' DT B 109 2.939 7.984 -12.980 1.00 0.00 C ATOM 266 C1' DT B 109 3.215 8.404 -11.537 1.00 0.00 C ATOM 267 N1 DT B 109 2.096 8.020 -10.634 1.00 0.00 N ATOM 268 C2 DT B 109 2.363 7.166 -9.571 1.00 0.00 C ATOM 269 O2 DT B 109 3.483 6.701 -9.374 1.00 0.00 O ATOM 270 N3 DT B 109 1.296 6.867 -8.745 1.00 0.00 N ATOM 271 C4 DT B 109 0.004 7.338 -8.884 1.00 0.00 C ATOM 272 O4 DT B 109 -0.870 7.007 -8.091 1.00 0.00 O ATOM 273 C5 DT B 109 -0.187 8.215 -10.014 1.00 0.00 C ATOM 274 C7 DT B 109 -1.581 8.800 -10.263 1.00 0.00 C ATOM 275 C6 DT B 109 0.846 8.521 -10.838 1.00 0.00 C ATOM 0 H5' DT B 109 2.755 12.266 -12.321 1.00 0.00 H new ATOM 0 H5'' DT B 109 2.818 11.999 -14.052 1.00 0.00 H new ATOM 0 H4' DT B 109 4.540 10.714 -13.066 1.00 0.00 H new ATOM 0 H3' DT B 109 2.438 9.408 -14.535 1.00 0.00 H new ATOM 0 H2' DT B 109 1.899 7.681 -13.102 1.00 0.00 H new ATOM 0 H2'' DT B 109 3.555 7.129 -13.258 1.00 0.00 H new ATOM 0 H1' DT B 109 4.103 7.894 -11.165 1.00 0.00 H new ATOM 0 H3 DT B 109 1.479 6.241 -7.961 1.00 0.00 H new ATOM 0 H71 DT B 109 -1.486 9.774 -10.743 1.00 0.00 H new ATOM 0 H72 DT B 109 -2.147 8.130 -10.910 1.00 0.00 H new ATOM 0 H73 DT B 109 -2.103 8.913 -9.313 1.00 0.00 H new ATOM 0 H6 DT B 109 0.673 9.179 -11.677 1.00 0.00 H new ATOM 288 P DA B 110 4.418 7.837 -15.824 1.00 0.00 P ATOM 289 OP1 DA B 110 5.560 8.126 -16.719 1.00 0.00 O ATOM 290 OP2 DA B 110 3.048 7.754 -16.374 1.00 0.00 O ATOM 291 O5' DA B 110 4.724 6.474 -15.030 1.00 0.00 O ATOM 292 C5' DA B 110 5.933 6.334 -14.288 1.00 0.00 C ATOM 293 C4' DA B 110 6.013 4.976 -13.593 1.00 0.00 C ATOM 294 O4' DA B 110 5.016 4.904 -12.529 1.00 0.00 O ATOM 295 C3' DA B 110 5.732 3.820 -14.559 1.00 0.00 C ATOM 296 O3' DA B 110 6.761 2.837 -14.431 1.00 0.00 O ATOM 297 C2' DA B 110 4.407 3.240 -14.143 1.00 0.00 C ATOM 298 C1' DA B 110 4.077 3.825 -12.782 1.00 0.00 C ATOM 299 N9 DA B 110 2.666 4.285 -12.722 1.00 0.00 N ATOM 300 C8 DA B 110 1.976 5.090 -13.586 1.00 0.00 C ATOM 301 N7 DA B 110 0.734 5.307 -13.269 1.00 0.00 N ATOM 302 C5 DA B 110 0.577 4.581 -12.089 1.00 0.00 C ATOM 303 C6 DA B 110 -0.517 4.386 -11.234 1.00 0.00 C ATOM 304 N6 DA B 110 -1.717 4.926 -11.450 1.00 0.00 N ATOM 305 N1 DA B 110 -0.331 3.605 -10.155 1.00 0.00 N ATOM 306 C2 DA B 110 0.861 3.048 -9.929 1.00 0.00 C ATOM 307 N3 DA B 110 1.961 3.171 -10.671 1.00 0.00 N ATOM 308 C4 DA B 110 1.745 3.959 -11.746 1.00 0.00 C ATOM 0 H5' DA B 110 5.998 7.128 -13.544 1.00 0.00 H new ATOM 0 H5'' DA B 110 6.786 6.452 -14.956 1.00 0.00 H new ATOM 0 H4' DA B 110 7.025 4.882 -13.200 1.00 0.00 H new ATOM 0 H3' DA B 110 5.708 4.152 -15.597 1.00 0.00 H new ATOM 0 H2' DA B 110 3.632 3.488 -14.868 1.00 0.00 H new ATOM 0 H2'' DA B 110 4.460 2.152 -14.093 1.00 0.00 H new ATOM 0 H1' DA B 110 4.175 3.066 -12.006 1.00 0.00 H new ATOM 0 H8 DA B 110 2.431 5.515 -14.469 1.00 0.00 H new ATOM 0 H61 DA B 110 -2.480 4.752 -10.796 1.00 0.00 H new ATOM 0 H62 DA B 110 -1.872 5.513 -12.270 1.00 0.00 H new ATOM 0 H2 DA B 110 0.943 2.429 -9.047 1.00 0.00 H new ATOM 320 P DA B 111 6.761 1.491 -15.312 1.00 0.00 P ATOM 321 OP1 DA B 111 8.163 1.074 -15.531 1.00 0.00 O ATOM 322 OP2 DA B 111 5.853 1.686 -16.464 1.00 0.00 O ATOM 323 O5' DA B 111 6.072 0.451 -14.292 1.00 0.00 O ATOM 324 C5' DA B 111 6.696 0.198 -13.031 1.00 0.00 C ATOM 325 C4' DA B 111 5.864 -0.721 -12.128 1.00 0.00 C ATOM 326 O4' DA B 111 4.627 -0.068 -11.753 1.00 0.00 O ATOM 327 C3' DA B 111 5.509 -2.054 -12.807 1.00 0.00 C ATOM 328 O3' DA B 111 6.040 -3.149 -12.057 1.00 0.00 O ATOM 329 C2' DA B 111 3.999 -2.129 -12.790 1.00 0.00 C ATOM 330 C1' DA B 111 3.504 -0.947 -11.970 1.00 0.00 C ATOM 331 N9 DA B 111 2.408 -0.254 -12.671 1.00 0.00 N ATOM 332 C8 DA B 111 2.418 0.344 -13.894 1.00 0.00 C ATOM 333 N7 DA B 111 1.296 0.893 -14.252 1.00 0.00 N ATOM 334 C5 DA B 111 0.461 0.632 -13.168 1.00 0.00 C ATOM 335 C6 DA B 111 -0.877 0.943 -12.904 1.00 0.00 C ATOM 336 N6 DA B 111 -1.646 1.637 -13.743 1.00 0.00 N ATOM 337 N1 DA B 111 -1.390 0.527 -11.735 1.00 0.00 N ATOM 338 C2 DA B 111 -0.634 -0.152 -10.872 1.00 0.00 C ATOM 339 N3 DA B 111 0.641 -0.496 -11.021 1.00 0.00 N ATOM 340 C4 DA B 111 1.128 -0.068 -12.202 1.00 0.00 C ATOM 0 H5' DA B 111 6.866 1.145 -12.519 1.00 0.00 H new ATOM 0 H5'' DA B 111 7.674 -0.254 -13.199 1.00 0.00 H new ATOM 0 H4' DA B 111 6.480 -0.929 -11.253 1.00 0.00 H new ATOM 0 H3' DA B 111 5.918 -2.107 -13.816 1.00 0.00 H new ATOM 0 H2' DA B 111 3.600 -2.090 -13.803 1.00 0.00 H new ATOM 0 H2'' DA B 111 3.665 -3.069 -12.352 1.00 0.00 H new ATOM 0 H1' DA B 111 3.105 -1.282 -11.013 1.00 0.00 H new ATOM 0 H8 DA B 111 3.296 0.361 -14.522 1.00 0.00 H new ATOM 0 H61 DA B 111 -2.616 1.836 -13.500 1.00 0.00 H new ATOM 0 H62 DA B 111 -1.264 1.969 -14.628 1.00 0.00 H new ATOM 0 H2 DA B 111 -1.110 -0.456 -9.951 1.00 0.00 H new ATOM 352 P DA B 112 5.830 -4.675 -12.538 1.00 0.00 P ATOM 353 OP1 DA B 112 6.896 -5.505 -11.936 1.00 0.00 O ATOM 354 OP2 DA B 112 5.636 -4.673 -14.006 1.00 0.00 O ATOM 355 O5' DA B 112 4.429 -5.067 -11.841 1.00 0.00 O ATOM 356 C5' DA B 112 4.295 -5.022 -10.419 1.00 0.00 C ATOM 357 C4' DA B 112 2.885 -5.409 -9.956 1.00 0.00 C ATOM 358 O4' DA B 112 1.944 -4.412 -10.433 1.00 0.00 O ATOM 359 C3' DA B 112 2.429 -6.762 -10.515 1.00 0.00 C ATOM 360 O3' DA B 112 1.800 -7.535 -9.480 1.00 0.00 O ATOM 361 C2' DA B 112 1.445 -6.438 -11.602 1.00 0.00 C ATOM 362 C1' DA B 112 0.985 -5.014 -11.335 1.00 0.00 C ATOM 363 N9 DA B 112 0.849 -4.251 -12.597 1.00 0.00 N ATOM 364 C8 DA B 112 1.700 -4.154 -13.667 1.00 0.00 C ATOM 365 N7 DA B 112 1.256 -3.448 -14.660 1.00 0.00 N ATOM 366 C5 DA B 112 0.004 -3.037 -14.218 1.00 0.00 C ATOM 367 C6 DA B 112 -0.996 -2.255 -14.802 1.00 0.00 C ATOM 368 N6 DA B 112 -0.891 -1.739 -16.027 1.00 0.00 N ATOM 369 N1 DA B 112 -2.111 -2.041 -14.084 1.00 0.00 N ATOM 370 C2 DA B 112 -2.235 -2.570 -12.864 1.00 0.00 C ATOM 371 N3 DA B 112 -1.354 -3.324 -12.225 1.00 0.00 N ATOM 372 C4 DA B 112 -0.249 -3.518 -12.965 1.00 0.00 C ATOM 0 H5' DA B 112 4.528 -4.018 -10.066 1.00 0.00 H new ATOM 0 H5'' DA B 112 5.022 -5.696 -9.966 1.00 0.00 H new ATOM 0 H4' DA B 112 2.914 -5.471 -8.868 1.00 0.00 H new ATOM 0 H3' DA B 112 3.265 -7.350 -10.894 1.00 0.00 H new ATOM 0 H2' DA B 112 1.908 -6.521 -12.585 1.00 0.00 H new ATOM 0 H2'' DA B 112 0.603 -7.130 -11.586 1.00 0.00 H new ATOM 0 H1' DA B 112 -0.004 -5.007 -10.877 1.00 0.00 H new ATOM 0 H8 DA B 112 2.669 -4.631 -13.682 1.00 0.00 H new ATOM 0 H61 DA B 112 -1.649 -1.174 -16.409 1.00 0.00 H new ATOM 0 H62 DA B 112 -0.052 -1.909 -16.582 1.00 0.00 H new ATOM 0 H2 DA B 112 -3.156 -2.359 -12.341 1.00 0.00 H new ATOM 384 P DC B 113 1.217 -9.011 -9.772 1.00 0.00 P ATOM 385 OP1 DC B 113 1.427 -9.830 -8.558 1.00 0.00 O ATOM 386 OP2 DC B 113 1.765 -9.469 -11.068 1.00 0.00 O ATOM 387 O5' DC B 113 -0.380 -8.794 -9.959 1.00 0.00 O ATOM 388 C5' DC B 113 -1.169 -8.268 -8.881 1.00 0.00 C ATOM 389 C4' DC B 113 -2.661 -8.131 -9.240 1.00 0.00 C ATOM 390 O4' DC B 113 -2.884 -7.060 -10.187 1.00 0.00 O ATOM 391 C3' DC B 113 -3.229 -9.424 -9.847 1.00 0.00 C ATOM 392 O3' DC B 113 -4.371 -9.870 -9.104 1.00 0.00 O ATOM 393 C2' DC B 113 -3.655 -9.056 -11.251 1.00 0.00 C ATOM 394 C1' DC B 113 -3.652 -7.535 -11.316 1.00 0.00 C ATOM 395 N1 DC B 113 -3.074 -7.012 -12.582 1.00 0.00 N ATOM 396 C2 DC B 113 -3.847 -6.152 -13.362 1.00 0.00 C ATOM 397 O2 DC B 113 -5.012 -5.915 -13.047 1.00 0.00 O ATOM 398 N3 DC B 113 -3.278 -5.588 -14.461 1.00 0.00 N ATOM 399 C4 DC B 113 -2.007 -5.848 -14.787 1.00 0.00 C ATOM 400 N4 DC B 113 -1.490 -5.282 -15.880 1.00 0.00 N ATOM 401 C5 DC B 113 -1.208 -6.732 -13.987 1.00 0.00 C ATOM 402 C6 DC B 113 -1.789 -7.291 -12.907 1.00 0.00 C ATOM 0 H5' DC B 113 -0.778 -7.291 -8.595 1.00 0.00 H new ATOM 0 H5'' DC B 113 -1.068 -8.919 -8.013 1.00 0.00 H new ATOM 0 H4' DC B 113 -3.172 -7.913 -8.302 1.00 0.00 H new ATOM 0 H3' DC B 113 -2.493 -10.227 -9.831 1.00 0.00 H new ATOM 0 H2' DC B 113 -2.971 -9.478 -11.988 1.00 0.00 H new ATOM 0 H2'' DC B 113 -4.646 -9.452 -11.473 1.00 0.00 H new ATOM 0 H1' DC B 113 -4.681 -7.178 -11.285 1.00 0.00 H new ATOM 0 H41 DC B 113 -0.522 -5.470 -16.143 1.00 0.00 H new ATOM 0 H42 DC B 113 -2.063 -4.662 -16.453 1.00 0.00 H new ATOM 0 H5 DC B 113 -0.179 -6.941 -14.241 1.00 0.00 H new ATOM 0 H6 DC B 113 -1.221 -7.972 -12.291 1.00 0.00 H new ATOM 414 P DA B 114 -5.163 -11.211 -9.527 1.00 0.00 P ATOM 415 OP1 DA B 114 -5.859 -11.733 -8.329 1.00 0.00 O ATOM 416 OP2 DA B 114 -4.232 -12.084 -10.276 1.00 0.00 O ATOM 417 O5' DA B 114 -6.280 -10.657 -10.554 1.00 0.00 O ATOM 418 C5' DA B 114 -7.258 -9.712 -10.112 1.00 0.00 C ATOM 419 C4' DA B 114 -8.217 -9.285 -11.234 1.00 0.00 C ATOM 420 O4' DA B 114 -7.531 -8.454 -12.209 1.00 0.00 O ATOM 421 C3' DA B 114 -8.820 -10.479 -11.988 1.00 0.00 C ATOM 422 O3' DA B 114 -10.251 -10.428 -11.939 1.00 0.00 O ATOM 423 C2' DA B 114 -8.345 -10.347 -13.414 1.00 0.00 C ATOM 424 C1' DA B 114 -7.764 -8.954 -13.550 1.00 0.00 C ATOM 425 N9 DA B 114 -6.528 -8.970 -14.348 1.00 0.00 N ATOM 426 C8 DA B 114 -5.387 -9.653 -14.113 1.00 0.00 C ATOM 427 N7 DA B 114 -4.430 -9.453 -14.970 1.00 0.00 N ATOM 428 C5 DA B 114 -4.999 -8.550 -15.865 1.00 0.00 C ATOM 429 C6 DA B 114 -4.514 -7.927 -17.021 1.00 0.00 C ATOM 430 N6 DA B 114 -3.278 -8.105 -17.480 1.00 0.00 N ATOM 431 N1 DA B 114 -5.346 -7.095 -17.674 1.00 0.00 N ATOM 432 C2 DA B 114 -6.580 -6.887 -17.217 1.00 0.00 C ATOM 433 N3 DA B 114 -7.135 -7.421 -16.130 1.00 0.00 N ATOM 434 C4 DA B 114 -6.279 -8.252 -15.498 1.00 0.00 C ATOM 0 H5' DA B 114 -6.753 -8.831 -9.716 1.00 0.00 H new ATOM 0 H5'' DA B 114 -7.833 -10.145 -9.293 1.00 0.00 H new ATOM 0 H4' DA B 114 -9.019 -8.734 -10.742 1.00 0.00 H new ATOM 0 H3' DA B 114 -8.513 -11.427 -11.546 1.00 0.00 H new ATOM 0 H2' DA B 114 -7.595 -11.104 -13.644 1.00 0.00 H new ATOM 0 H2'' DA B 114 -9.169 -10.493 -14.112 1.00 0.00 H new ATOM 0 H1' DA B 114 -8.456 -8.298 -14.079 1.00 0.00 H new ATOM 0 H8 DA B 114 -5.277 -10.320 -13.271 1.00 0.00 H new ATOM 0 H61 DA B 114 -2.975 -7.626 -18.328 1.00 0.00 H new ATOM 0 H62 DA B 114 -2.633 -8.720 -16.984 1.00 0.00 H new ATOM 0 H2 DA B 114 -7.198 -6.212 -17.790 1.00 0.00 H new ATOM 446 P DT B 115 -11.144 -11.565 -12.652 1.00 0.00 P ATOM 447 OP1 DT B 115 -12.458 -11.625 -11.972 1.00 0.00 O ATOM 448 OP2 DT B 115 -10.319 -12.786 -12.779 1.00 0.00 O ATOM 449 O5' DT B 115 -11.364 -10.949 -14.128 1.00 0.00 O ATOM 450 C5' DT B 115 -12.084 -9.721 -14.283 1.00 0.00 C ATOM 451 C4' DT B 115 -12.171 -9.261 -15.742 1.00 0.00 C ATOM 452 O4' DT B 115 -10.871 -8.838 -16.219 1.00 0.00 O ATOM 453 C3' DT B 115 -12.678 -10.368 -16.677 1.00 0.00 C ATOM 454 O3' DT B 115 -13.930 -9.993 -17.248 1.00 0.00 O ATOM 455 C2' DT B 115 -11.640 -10.481 -17.774 1.00 0.00 C ATOM 456 C1' DT B 115 -10.649 -9.346 -17.549 1.00 0.00 C ATOM 457 N1 DT B 115 -9.243 -9.802 -17.731 1.00 0.00 N ATOM 458 C2 DT B 115 -8.475 -9.191 -18.712 1.00 0.00 C ATOM 459 O2 DT B 115 -8.922 -8.296 -19.427 1.00 0.00 O ATOM 460 N3 DT B 115 -7.178 -9.644 -18.841 1.00 0.00 N ATOM 461 C4 DT B 115 -6.582 -10.638 -18.089 1.00 0.00 C ATOM 462 O4 DT B 115 -5.417 -10.965 -18.295 1.00 0.00 O ATOM 463 C5 DT B 115 -7.448 -11.219 -17.089 1.00 0.00 C ATOM 464 C7 DT B 115 -6.897 -12.331 -16.190 1.00 0.00 C ATOM 465 C6 DT B 115 -8.726 -10.790 -16.945 1.00 0.00 C ATOM 0 H5' DT B 115 -11.600 -8.945 -13.691 1.00 0.00 H new ATOM 0 H5'' DT B 115 -13.091 -9.844 -13.885 1.00 0.00 H new ATOM 0 H4' DT B 115 -12.880 -8.433 -15.758 1.00 0.00 H new ATOM 0 H3' DT B 115 -12.820 -11.308 -16.144 1.00 0.00 H new ATOM 0 H2' DT B 115 -11.138 -11.448 -17.735 1.00 0.00 H new ATOM 0 H2'' DT B 115 -12.104 -10.402 -18.757 1.00 0.00 H new ATOM 0 H1' DT B 115 -10.806 -8.558 -18.286 1.00 0.00 H new ATOM 0 H3 DT B 115 -6.605 -9.203 -19.560 1.00 0.00 H new ATOM 0 H71 DT B 115 -6.137 -12.894 -16.732 1.00 0.00 H new ATOM 0 H72 DT B 115 -6.454 -11.891 -15.297 1.00 0.00 H new ATOM 0 H73 DT B 115 -7.707 -13.000 -15.901 1.00 0.00 H new ATOM 0 H6 DT B 115 -9.351 -11.242 -16.189 1.00 0.00 H new ATOM 478 P DT B 116 -14.789 -11.048 -18.102 1.00 0.00 P ATOM 479 OP1 DT B 116 -16.206 -10.621 -18.074 1.00 0.00 O ATOM 480 OP2 DT B 116 -14.418 -12.411 -17.658 1.00 0.00 O ATOM 481 O5' DT B 116 -14.226 -10.831 -19.594 1.00 0.00 O ATOM 482 C5' DT B 116 -14.331 -9.556 -20.230 1.00 0.00 C ATOM 483 C4' DT B 116 -13.590 -9.531 -21.572 1.00 0.00 C ATOM 484 O4' DT B 116 -12.159 -9.630 -21.365 1.00 0.00 O ATOM 485 C3' DT B 116 -14.014 -10.689 -22.488 1.00 0.00 C ATOM 486 O3' DT B 116 -14.742 -10.197 -23.616 1.00 0.00 O ATOM 487 C2' DT B 116 -12.727 -11.353 -22.935 1.00 0.00 C ATOM 488 C1' DT B 116 -11.581 -10.575 -22.294 1.00 0.00 C ATOM 489 N1 DT B 116 -10.630 -11.491 -21.602 1.00 0.00 N ATOM 490 C2 DT B 116 -9.309 -11.514 -22.033 1.00 0.00 C ATOM 491 O2 DT B 116 -8.916 -10.821 -22.968 1.00 0.00 O ATOM 492 N3 DT B 116 -8.458 -12.358 -21.345 1.00 0.00 N ATOM 493 C4 DT B 116 -8.800 -13.171 -20.281 1.00 0.00 C ATOM 494 O4 DT B 116 -7.955 -13.885 -19.744 1.00 0.00 O ATOM 495 C5 DT B 116 -10.193 -13.086 -19.899 1.00 0.00 C ATOM 496 C7 DT B 116 -10.692 -13.940 -18.728 1.00 0.00 C ATOM 497 C6 DT B 116 -11.047 -12.265 -20.560 1.00 0.00 C ATOM 0 H5' DT B 116 -13.923 -8.787 -19.574 1.00 0.00 H new ATOM 0 H5'' DT B 116 -15.382 -9.314 -20.390 1.00 0.00 H new ATOM 0 H4' DT B 116 -13.847 -8.585 -22.048 1.00 0.00 H new ATOM 0 H3' DT B 116 -14.668 -11.390 -21.970 1.00 0.00 H new ATOM 0 H2' DT B 116 -12.704 -12.398 -22.626 1.00 0.00 H new ATOM 0 H2'' DT B 116 -12.643 -11.340 -24.022 1.00 0.00 H new ATOM 0 HO3' DT B 116 -15.003 -10.948 -24.190 1.00 0.00 H new ATOM 0 H1' DT B 116 -11.009 -10.050 -23.060 1.00 0.00 H new ATOM 0 H3 DT B 116 -7.485 -12.383 -21.651 1.00 0.00 H new ATOM 0 H71 DT B 116 -11.516 -13.429 -18.230 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1.00 0.00 H new ATOM 0 H72 DT C 121 -5.453 2.726 -16.408 1.00 0.00 H new ATOM 0 H73 DT C 121 -4.830 1.568 -17.607 1.00 0.00 H new ATOM 0 H6 DT C 121 -7.904 0.963 -15.761 1.00 0.00 H new ATOM 671 P DT C 122 -11.474 0.750 -11.056 1.00 0.00 P ATOM 672 OP1 DT C 122 -12.710 0.435 -10.302 1.00 0.00 O ATOM 673 OP2 DT C 122 -11.209 2.140 -11.483 1.00 0.00 O ATOM 674 O5' DT C 122 -10.219 0.250 -10.179 1.00 0.00 O ATOM 675 C5' DT C 122 -10.161 -1.106 -9.732 1.00 0.00 C ATOM 676 C4' DT C 122 -8.898 -1.396 -8.914 1.00 0.00 C ATOM 677 O4' DT C 122 -7.728 -1.393 -9.761 1.00 0.00 O ATOM 678 C3' DT C 122 -8.682 -0.357 -7.801 1.00 0.00 C ATOM 679 O3' DT C 122 -8.797 -0.950 -6.517 1.00 0.00 O ATOM 680 C2' DT C 122 -7.264 0.132 -7.977 1.00 0.00 C ATOM 681 C1' DT C 122 -6.660 -0.662 -9.128 1.00 0.00 C ATOM 682 N1 DT C 122 -5.983 0.239 -10.102 1.00 0.00 N ATOM 683 C2 DT C 122 -4.628 0.051 -10.336 1.00 0.00 C ATOM 684 O2 DT C 122 -3.978 -0.810 -9.748 1.00 0.00 O ATOM 685 N3 DT C 122 -4.049 0.888 -11.268 1.00 0.00 N ATOM 686 C4 DT C 122 -4.688 1.885 -11.979 1.00 0.00 C ATOM 687 O4 DT C 122 -4.069 2.571 -12.789 1.00 0.00 O ATOM 688 C5 DT C 122 -6.096 2.017 -11.675 1.00 0.00 C ATOM 689 C7 DT C 122 -6.916 3.088 -12.400 1.00 0.00 C ATOM 690 C6 DT C 122 -6.689 1.208 -10.764 1.00 0.00 C ATOM 0 H5' DT C 122 -10.193 -1.772 -10.594 1.00 0.00 H new ATOM 0 H5'' DT C 122 -11.041 -1.325 -9.127 1.00 0.00 H new ATOM 0 H4' DT C 122 -9.041 -2.379 -8.465 1.00 0.00 H new ATOM 0 H3' DT C 122 -9.424 0.439 -7.868 1.00 0.00 H new ATOM 0 H2' DT C 122 -7.248 1.200 -8.195 1.00 0.00 H new ATOM 0 H2'' DT C 122 -6.689 -0.015 -7.063 1.00 0.00 H new ATOM 0 H1' DT C 122 -5.901 -1.349 -8.753 1.00 0.00 H new ATOM 0 H3 DT C 122 -3.054 0.758 -11.449 1.00 0.00 H new ATOM 0 H71 DT C 122 -7.949 2.753 -12.496 1.00 0.00 H new ATOM 0 H72 DT C 122 -6.887 4.016 -11.830 1.00 0.00 H new ATOM 0 H73 DT C 122 -6.496 3.258 -13.392 1.00 0.00 H new ATOM 0 H6 DT C 122 -7.742 1.330 -10.555 1.00 0.00 H new ATOM 703 P DT C 123 -8.663 -0.059 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C6 DT C 123 -4.697 2.054 -6.652 1.00 0.00 C ATOM 0 H5' DT C 123 -6.597 -2.030 -5.506 1.00 0.00 H new ATOM 0 H5'' DT C 123 -6.919 -1.869 -3.790 1.00 0.00 H new ATOM 0 H4' DT C 123 -4.591 -2.194 -4.105 1.00 0.00 H new ATOM 0 H3' DT C 123 -5.589 0.160 -2.762 1.00 0.00 H new ATOM 0 H2' DT C 123 -4.592 1.803 -3.999 1.00 0.00 H new ATOM 0 H2'' DT C 123 -3.110 1.254 -3.243 1.00 0.00 H new ATOM 0 H1' DT C 123 -2.392 0.157 -5.139 1.00 0.00 H new ATOM 0 H3 DT C 123 -1.555 2.998 -8.433 1.00 0.00 H new ATOM 0 H71 DT C 123 -5.949 4.586 -8.440 1.00 0.00 H new ATOM 0 H72 DT C 123 -6.584 2.967 -8.817 1.00 0.00 H new ATOM 0 H73 DT C 123 -6.756 3.630 -7.175 1.00 0.00 H new ATOM 0 H6 DT C 123 -5.600 1.777 -6.129 1.00 0.00 H new ATOM 735 P DA C 124 -3.404 -0.198 -0.887 1.00 0.00 P ATOM 736 OP1 DA C 124 -3.446 -1.211 0.191 1.00 0.00 O ATOM 737 OP2 DA C 124 -4.127 1.084 -0.723 1.00 0.00 O ATOM 738 O5' DA C 124 -1.856 0.132 -1.213 1.00 0.00 O ATOM 739 C5' DA C 124 -0.982 -0.958 -1.538 1.00 0.00 C ATOM 740 C4' DA C 124 0.478 -0.544 -1.770 1.00 0.00 C ATOM 741 O4' DA C 124 0.593 0.216 -2.997 1.00 0.00 O ATOM 742 C3' DA C 124 1.020 0.328 -0.631 1.00 0.00 C ATOM 743 O3' DA C 124 2.301 -0.155 -0.210 1.00 0.00 O ATOM 744 C2' DA C 124 1.163 1.711 -1.212 1.00 0.00 C ATOM 745 C1' DA C 124 1.053 1.561 -2.725 1.00 0.00 C ATOM 746 N9 DA C 124 0.136 2.552 -3.306 1.00 0.00 N ATOM 747 C8 DA C 124 -1.121 2.853 -2.925 1.00 0.00 C ATOM 748 N7 DA C 124 -1.714 3.774 -3.622 1.00 0.00 N ATOM 749 C5 DA C 124 -0.748 4.118 -4.563 1.00 0.00 C ATOM 750 C6 DA C 124 -0.737 5.043 -5.610 1.00 0.00 C ATOM 751 N6 DA C 124 -1.776 5.833 -5.886 1.00 0.00 N ATOM 752 N1 DA C 124 0.384 5.129 -6.350 1.00 0.00 N ATOM 753 C2 DA C 124 1.434 4.349 -6.071 1.00 0.00 C ATOM 754 N3 DA C 124 1.524 3.442 -5.101 1.00 0.00 N ATOM 755 C4 DA C 124 0.386 3.379 -4.380 1.00 0.00 C ATOM 0 H5' DA C 124 -1.355 -1.453 -2.435 1.00 0.00 H new ATOM 0 H5'' DA C 124 -1.017 -1.690 -0.731 1.00 0.00 H new ATOM 0 H4' DA C 124 1.058 -1.466 -1.822 1.00 0.00 H new ATOM 0 H3' DA C 124 0.359 0.316 0.236 1.00 0.00 H new ATOM 0 H2' DA C 124 0.386 2.374 -0.831 1.00 0.00 H new ATOM 0 H2'' DA C 124 2.121 2.151 -0.935 1.00 0.00 H new ATOM 0 H1' DA C 124 2.026 1.736 -3.183 1.00 0.00 H new ATOM 0 H8 DA C 124 -1.604 2.360 -2.094 1.00 0.00 H new ATOM 0 H61 DA C 124 -1.722 6.494 -6.661 1.00 0.00 H new ATOM 0 H62 DA C 124 -2.624 5.776 -5.322 1.00 0.00 H new ATOM 0 H2 DA C 124 2.303 4.468 -6.701 1.00 0.00 H new ATOM 767 P DT C 125 3.125 0.564 0.979 1.00 0.00 P ATOM 768 OP1 DT C 125 3.934 -0.466 1.667 1.00 0.00 O ATOM 769 OP2 DT C 125 2.183 1.402 1.755 1.00 0.00 O ATOM 770 O5' DT C 125 4.127 1.541 0.174 1.00 0.00 O ATOM 771 C5' DT C 125 5.057 0.974 -0.749 1.00 0.00 C ATOM 772 C4' DT C 125 5.826 2.021 -1.564 1.00 0.00 C ATOM 773 O4' DT C 125 4.932 2.676 -2.506 1.00 0.00 O ATOM 774 C3' DT C 125 6.452 3.126 -0.699 1.00 0.00 C ATOM 775 O3' DT C 125 7.839 3.257 -1.028 1.00 0.00 O ATOM 776 C2' DT C 125 5.736 4.394 -1.068 1.00 0.00 C ATOM 777 C1' DT C 125 5.085 4.112 -2.411 1.00 0.00 C ATOM 778 N1 DT C 125 3.784 4.827 -2.602 1.00 0.00 N ATOM 779 C2 DT C 125 3.615 5.561 -3.774 1.00 0.00 C ATOM 780 O2 DT C 125 4.512 5.673 -4.606 1.00 0.00 O ATOM 781 N3 DT C 125 2.380 6.159 -3.949 1.00 0.00 N ATOM 782 C4 DT C 125 1.309 6.084 -3.075 1.00 0.00 C ATOM 783 O4 DT C 125 0.225 6.577 -3.359 1.00 0.00 O ATOM 784 C5 DT C 125 1.575 5.320 -1.886 1.00 0.00 C ATOM 785 C7 DT C 125 0.476 5.200 -0.830 1.00 0.00 C ATOM 786 C6 DT C 125 2.773 4.727 -1.686 1.00 0.00 C ATOM 0 H5' DT C 125 4.522 0.314 -1.432 1.00 0.00 H new ATOM 0 H5'' DT C 125 5.769 0.356 -0.202 1.00 0.00 H new ATOM 0 H4' DT C 125 6.623 1.473 -2.067 1.00 0.00 H new ATOM 0 H3' DT C 125 6.365 2.904 0.365 1.00 0.00 H new ATOM 0 H2' DT C 125 4.991 4.657 -0.317 1.00 0.00 H new ATOM 0 H2'' DT C 125 6.430 5.232 -1.136 1.00 0.00 H new ATOM 0 H1' DT C 125 5.718 4.493 -3.212 1.00 0.00 H new ATOM 0 H3 DT C 125 2.246 6.705 -4.800 1.00 0.00 H new ATOM 0 H71 DT C 125 0.575 4.248 -0.308 1.00 0.00 H new ATOM 0 H72 DT C 125 0.568 6.017 -0.115 1.00 0.00 H new ATOM 0 H73 DT C 125 -0.500 5.249 -1.313 1.00 0.00 H new ATOM 0 H6 DT C 125 2.936 4.160 -0.781 1.00 0.00 H new ATOM 799 P DC C 126 8.784 4.334 -0.294 1.00 0.00 P ATOM 800 OP1 DC C 126 10.142 3.758 -0.169 1.00 0.00 O ATOM 801 OP2 DC C 126 8.077 4.830 0.909 1.00 0.00 O ATOM 802 O5' DC C 126 8.835 5.531 -1.382 1.00 0.00 O ATOM 803 C5' DC C 126 9.356 5.272 -2.693 1.00 0.00 C ATOM 804 C4' DC C 126 9.339 6.504 -3.615 1.00 0.00 C ATOM 805 O4' DC C 126 7.985 6.847 -4.014 1.00 0.00 O ATOM 806 C3' DC C 126 9.965 7.731 -2.940 1.00 0.00 C ATOM 807 O3' DC C 126 11.134 8.141 -3.632 1.00 0.00 O ATOM 808 C2' DC C 126 8.928 8.827 -3.027 1.00 0.00 C ATOM 809 C1' DC C 126 7.710 8.241 -3.738 1.00 0.00 C ATOM 810 N1 DC C 126 6.506 8.375 -2.881 1.00 0.00 N ATOM 811 C2 DC C 126 5.409 9.095 -3.357 1.00 0.00 C ATOM 812 O2 DC C 126 5.450 9.638 -4.462 1.00 0.00 O ATOM 813 N3 DC C 126 4.312 9.188 -2.560 1.00 0.00 N ATOM 814 C4 DC C 126 4.284 8.604 -1.355 1.00 0.00 C ATOM 815 N4 DC C 126 3.206 8.733 -0.592 1.00 0.00 N ATOM 816 C5 DC C 126 5.404 7.864 -0.870 1.00 0.00 C ATOM 817 C6 DC C 126 6.484 7.778 -1.661 1.00 0.00 C ATOM 0 H5' DC C 126 8.775 4.474 -3.155 1.00 0.00 H new ATOM 0 H5'' DC C 126 10.380 4.909 -2.603 1.00 0.00 H new ATOM 0 H4' DC C 126 9.927 6.234 -4.492 1.00 0.00 H new ATOM 0 H3' DC C 126 10.247 7.507 -1.911 1.00 0.00 H new ATOM 0 H2' DC C 126 8.659 9.182 -2.032 1.00 0.00 H new ATOM 0 H2'' DC C 126 9.319 9.684 -3.576 1.00 0.00 H new ATOM 0 H1' DC C 126 7.518 8.775 -4.669 1.00 0.00 H new ATOM 0 H41 DC C 126 3.176 8.292 0.327 1.00 0.00 H new ATOM 0 H42 DC C 126 2.408 9.274 -0.925 1.00 0.00 H new ATOM 0 H5 DC C 126 5.383 7.390 0.100 1.00 0.00 H new ATOM 0 H6 DC C 126 7.349 7.226 -1.323 1.00 0.00 H new ATOM 829 P DT C 127 12.063 9.298 -3.021 1.00 0.00 P ATOM 830 OP1 DT C 127 13.418 9.167 -3.600 1.00 0.00 O ATOM 831 OP2 DT C 127 11.880 9.311 -1.551 1.00 0.00 O ATOM 832 O5' DT C 127 11.379 10.618 -3.625 1.00 0.00 O ATOM 833 C5' DT C 127 11.296 10.790 -5.036 1.00 0.00 C ATOM 834 C4' DT C 127 10.501 12.038 -5.405 1.00 0.00 C ATOM 835 O4' DT C 127 9.101 11.847 -5.085 1.00 0.00 O ATOM 836 C3' DT C 127 10.993 13.280 -4.649 1.00 0.00 C ATOM 837 O3' DT C 127 11.529 14.230 -5.575 1.00 0.00 O ATOM 838 C2' DT C 127 9.773 13.840 -3.944 1.00 0.00 C ATOM 839 C1' DT C 127 8.581 13.004 -4.402 1.00 0.00 C ATOM 840 N1 DT C 127 7.705 12.616 -3.248 1.00 0.00 N ATOM 841 C2 DT C 127 6.382 13.044 -3.271 1.00 0.00 C ATOM 842 O2 DT C 127 5.927 13.695 -4.210 1.00 0.00 O ATOM 843 N3 DT C 127 5.600 12.686 -2.189 1.00 0.00 N ATOM 844 C4 DT C 127 6.007 11.948 -1.096 1.00 0.00 C ATOM 845 O4 DT C 127 5.224 11.701 -0.183 1.00 0.00 O ATOM 846 C5 DT C 127 7.390 11.535 -1.144 1.00 0.00 C ATOM 847 C7 DT C 127 7.941 10.692 0.011 1.00 0.00 C ATOM 848 C6 DT C 127 8.187 11.870 -2.193 1.00 0.00 C ATOM 0 H5' DT C 127 10.826 9.914 -5.483 1.00 0.00 H new ATOM 0 H5'' DT C 127 12.300 10.861 -5.454 1.00 0.00 H new ATOM 0 H4' DT C 127 10.640 12.196 -6.474 1.00 0.00 H new ATOM 0 H3' DT C 127 11.784 13.044 -3.938 1.00 0.00 H new ATOM 0 H2' DT C 127 9.892 13.785 -2.862 1.00 0.00 H new ATOM 0 H2'' DT C 127 9.629 14.891 -4.196 1.00 0.00 H new ATOM 0 H1' DT C 127 7.950 13.585 -5.075 1.00 0.00 H new ATOM 0 H3 DT C 127 4.629 12.997 -2.199 1.00 0.00 H new ATOM 0 H71 DT C 127 7.413 10.945 0.930 1.00 0.00 H new ATOM 0 H72 DT C 127 7.799 9.634 -0.210 1.00 0.00 H new ATOM 0 H73 DT C 127 9.004 10.897 0.136 1.00 0.00 H new ATOM 0 H6 DT C 127 9.217 11.546 -2.200 1.00 0.00 H new ATOM 861 P DG C 128 12.127 15.640 -5.078 1.00 0.00 P ATOM 862 OP1 DG C 128 13.095 16.115 -6.092 1.00 0.00 O ATOM 863 OP2 DG C 128 12.547 15.494 -3.667 1.00 0.00 O ATOM 864 O5' DG C 128 10.840 16.602 -5.120 1.00 0.00 O ATOM 865 C5' DG C 128 10.153 16.816 -6.354 1.00 0.00 C ATOM 866 C4' DG C 128 8.957 17.753 -6.182 1.00 0.00 C ATOM 867 O4' DG C 128 7.964 17.136 -5.335 1.00 0.00 O ATOM 868 C3' DG C 128 9.355 19.094 -5.554 1.00 0.00 C ATOM 869 O3' DG C 128 9.022 20.161 -6.439 1.00 0.00 O ATOM 870 C2' DG C 128 8.550 19.208 -4.279 1.00 0.00 C ATOM 871 C1' DG C 128 7.650 17.981 -4.208 1.00 0.00 C ATOM 872 N9 DG C 128 7.856 17.260 -2.945 1.00 0.00 N ATOM 873 C8 DG C 128 9.007 16.745 -2.449 1.00 0.00 C ATOM 874 N7 DG C 128 8.902 16.156 -1.296 1.00 0.00 N ATOM 875 C5 DG C 128 7.547 16.297 -0.993 1.00 0.00 C ATOM 876 C6 DG C 128 6.816 15.855 0.143 1.00 0.00 C ATOM 877 O6 DG C 128 7.229 15.243 1.123 1.00 0.00 O ATOM 878 N1 DG C 128 5.473 16.203 0.049 1.00 0.00 N ATOM 879 C2 DG C 128 4.902 16.889 -1.003 1.00 0.00 C ATOM 880 N2 DG C 128 3.594 17.135 -0.906 1.00 0.00 N ATOM 881 N3 DG C 128 5.588 17.305 -2.072 1.00 0.00 N ATOM 882 C4 DG C 128 6.899 16.974 -2.000 1.00 0.00 C ATOM 0 H5' DG C 128 9.812 15.860 -6.751 1.00 0.00 H new ATOM 0 H5'' DG C 128 10.842 17.237 -7.086 1.00 0.00 H new ATOM 0 H4' DG C 128 8.558 17.940 -7.179 1.00 0.00 H new ATOM 0 H3' DG C 128 10.426 19.147 -5.359 1.00 0.00 H new ATOM 0 H2' DG C 128 9.208 19.254 -3.411 1.00 0.00 H new ATOM 0 H2'' DG C 128 7.956 20.122 -4.278 1.00 0.00 H new ATOM 0 H1' DG C 128 6.602 18.280 -4.244 1.00 0.00 H new ATOM 0 H8 DG C 128 9.947 16.819 -2.976 1.00 0.00 H new ATOM 0 H1 DG C 128 4.862 15.930 0.818 1.00 0.00 H new ATOM 0 H21 DG C 128 3.113 17.638 -1.651 1.00 0.00 H new ATOM 0 H22 DG C 128 3.075 16.820 -0.086 1.00 0.00 H new ATOM 894 P DC C 129 9.510 21.667 -6.155 1.00 0.00 P ATOM 895 OP1 DC C 129 9.529 22.399 -7.442 1.00 0.00 O ATOM 896 OP2 DC C 129 10.733 21.604 -5.324 1.00 0.00 O ATOM 897 O5' DC C 129 8.317 22.268 -5.254 1.00 0.00 O ATOM 898 C5' DC C 129 6.983 22.328 -5.763 1.00 0.00 C ATOM 899 C4' DC C 129 6.011 22.933 -4.744 1.00 0.00 C ATOM 900 O4' DC C 129 5.824 22.044 -3.615 1.00 0.00 O ATOM 901 C3' DC C 129 6.525 24.273 -4.208 1.00 0.00 C ATOM 902 O3' DC C 129 5.558 25.296 -4.437 1.00 0.00 O ATOM 903 C2' DC C 129 6.721 24.079 -2.727 1.00 0.00 C ATOM 904 C1' DC C 129 6.121 22.729 -2.373 1.00 0.00 C ATOM 905 N1 DC C 129 7.053 21.919 -1.539 1.00 0.00 N ATOM 906 C2 DC C 129 6.628 21.514 -0.270 1.00 0.00 C ATOM 907 O2 DC C 129 5.515 21.838 0.143 1.00 0.00 O ATOM 908 N3 DC C 129 7.471 20.757 0.483 1.00 0.00 N ATOM 909 C4 DC C 129 8.679 20.410 0.023 1.00 0.00 C ATOM 910 N4 DC C 129 9.483 19.675 0.789 1.00 0.00 N ATOM 911 C5 DC C 129 9.121 20.823 -1.274 1.00 0.00 C ATOM 912 C6 DC C 129 8.283 21.571 -2.015 1.00 0.00 C ATOM 0 H5' DC C 129 6.651 21.325 -6.031 1.00 0.00 H new ATOM 0 H5'' DC C 129 6.969 22.923 -6.676 1.00 0.00 H new ATOM 0 H4' DC C 129 5.066 23.083 -5.266 1.00 0.00 H new ATOM 0 H3' DC C 129 7.449 24.572 -4.702 1.00 0.00 H new ATOM 0 H2' DC C 129 7.780 24.110 -2.471 1.00 0.00 H new ATOM 0 H2'' DC C 129 6.234 24.877 -2.166 1.00 0.00 H new ATOM 0 H1' DC C 129 5.215 22.871 -1.784 1.00 0.00 H new ATOM 0 H41 DC C 129 10.406 19.405 0.448 1.00 0.00 H new ATOM 0 H42 DC C 129 9.176 19.382 1.717 1.00 0.00 H new ATOM 0 H5 DC C 129 10.096 20.543 -1.646 1.00 0.00 H new ATOM 0 H6 DC C 129 8.588 21.899 -2.998 1.00 0.00 H new ATOM 924 P DA C 130 5.849 26.808 -3.976 1.00 0.00 P ATOM 925 OP1 DA C 130 5.034 27.708 -4.820 1.00 0.00 O ATOM 926 OP2 DA C 130 7.317 26.991 -3.911 1.00 0.00 O ATOM 927 O5' DA C 130 5.270 26.873 -2.469 1.00 0.00 O ATOM 928 C5' DA C 130 3.884 26.629 -2.201 1.00 0.00 C ATOM 929 C4' DA C 130 3.560 26.744 -0.701 1.00 0.00 C ATOM 930 O4' DA C 130 4.111 25.641 0.054 1.00 0.00 O ATOM 931 C3' DA C 130 4.115 28.052 -0.117 1.00 0.00 C ATOM 932 O3' DA C 130 3.074 28.837 0.462 1.00 0.00 O ATOM 933 C2' DA C 130 5.081 27.628 0.966 1.00 0.00 C ATOM 934 C1' DA C 130 4.898 26.130 1.163 1.00 0.00 C ATOM 935 N9 DA C 130 6.183 25.424 1.231 1.00 0.00 N ATOM 936 C8 DA C 130 7.198 25.440 0.339 1.00 0.00 C ATOM 937 N7 DA C 130 8.218 24.696 0.641 1.00 0.00 N ATOM 938 C5 DA C 130 7.841 24.130 1.855 1.00 0.00 C ATOM 939 C6 DA C 130 8.477 23.236 2.719 1.00 0.00 C ATOM 940 N6 DA C 130 9.691 22.742 2.482 1.00 0.00 N ATOM 941 N1 DA C 130 7.820 22.881 3.837 1.00 0.00 N ATOM 942 C2 DA C 130 6.608 23.378 4.090 1.00 0.00 C ATOM 943 N3 DA C 130 5.918 24.231 3.338 1.00 0.00 N ATOM 944 C4 DA C 130 6.602 24.567 2.225 1.00 0.00 C ATOM 0 H5' DA C 130 3.616 25.634 -2.555 1.00 0.00 H new ATOM 0 H5'' DA C 130 3.276 27.341 -2.759 1.00 0.00 H new ATOM 0 H4' DA C 130 2.473 26.728 -0.618 1.00 0.00 H new ATOM 0 H3' DA C 130 4.586 28.658 -0.891 1.00 0.00 H new ATOM 0 H2' DA C 130 6.107 27.857 0.679 1.00 0.00 H new ATOM 0 H2'' DA C 130 4.882 28.166 1.893 1.00 0.00 H new ATOM 0 H1' DA C 130 4.395 25.946 2.112 1.00 0.00 H new ATOM 0 H8 DA C 130 7.163 26.032 -0.564 1.00 0.00 H new ATOM 0 H61 DA C 130 10.115 22.091 3.143 1.00 0.00 H new ATOM 0 H62 DA C 130 10.197 23.014 1.639 1.00 0.00 H new ATOM 0 H2 DA C 130 6.136 23.052 5.005 1.00 0.00 H new ATOM 956 P DA C 131 3.404 30.296 1.055 1.00 0.00 P ATOM 957 OP1 DA C 131 2.155 31.092 1.036 1.00 0.00 O ATOM 958 OP2 DA C 131 4.615 30.811 0.377 1.00 0.00 O ATOM 959 O5' DA C 131 3.778 29.976 2.589 1.00 0.00 O ATOM 960 C5' DA C 131 2.795 29.440 3.473 1.00 0.00 C ATOM 961 C4' DA C 131 3.355 29.187 4.880 1.00 0.00 C ATOM 962 O4' DA C 131 4.278 28.067 4.879 1.00 0.00 O ATOM 963 C3' DA C 131 4.095 30.410 5.432 1.00 0.00 C ATOM 964 O3' DA C 131 3.442 30.914 6.598 1.00 0.00 O ATOM 965 C2' DA C 131 5.472 29.914 5.813 1.00 0.00 C ATOM 966 C1' DA C 131 5.491 28.411 5.588 1.00 0.00 C ATOM 967 N9 DA C 131 6.685 27.993 4.832 1.00 0.00 N ATOM 968 C8 DA C 131 7.081 28.389 3.603 1.00 0.00 C ATOM 969 N7 DA C 131 8.187 27.857 3.172 1.00 0.00 N ATOM 970 C5 DA C 131 8.562 27.023 4.224 1.00 0.00 C ATOM 971 C6 DA C 131 9.652 26.162 4.410 1.00 0.00 C ATOM 972 N6 DA C 131 10.616 26.000 3.502 1.00 0.00 N ATOM 973 N1 DA C 131 9.714 25.482 5.571 1.00 0.00 N ATOM 974 C2 DA C 131 8.761 25.641 6.493 1.00 0.00 C ATOM 975 N3 DA C 131 7.690 26.431 6.415 1.00 0.00 N ATOM 976 C4 DA C 131 7.654 27.097 5.243 1.00 0.00 C ATOM 0 H5' DA C 131 2.412 28.506 3.063 1.00 0.00 H new ATOM 0 H5'' DA C 131 1.953 30.129 3.538 1.00 0.00 H new ATOM 0 H4' DA C 131 2.496 28.969 5.514 1.00 0.00 H new ATOM 0 H3' DA C 131 4.126 31.214 4.696 1.00 0.00 H new ATOM 0 H2' DA C 131 6.237 30.402 5.209 1.00 0.00 H new ATOM 0 H2'' DA C 131 5.690 30.149 6.855 1.00 0.00 H new ATOM 0 H1' DA C 131 5.537 27.889 6.544 1.00 0.00 H new ATOM 0 H8 DA C 131 6.517 29.100 3.017 1.00 0.00 H new ATOM 0 H61 DA C 131 11.389 25.360 3.687 1.00 0.00 H new ATOM 0 H62 DA C 131 10.580 26.516 2.623 1.00 0.00 H new ATOM 0 H2 DA C 131 8.870 25.067 7.401 1.00 0.00 H new ATOM 988 P DC C 132 3.992 32.243 7.322 1.00 0.00 P ATOM 989 OP1 DC C 132 2.872 32.857 8.071 1.00 0.00 O ATOM 990 OP2 DC C 132 4.734 33.042 6.323 1.00 0.00 O ATOM 991 O5' DC C 132 5.050 31.659 8.390 1.00 0.00 O ATOM 992 C5' DC C 132 4.668 30.621 9.295 1.00 0.00 C ATOM 993 C4' DC C 132 5.872 30.042 10.050 1.00 0.00 C ATOM 994 O4' DC C 132 6.711 29.259 9.171 1.00 0.00 O ATOM 995 C3' DC C 132 6.745 31.134 10.681 1.00 0.00 C ATOM 996 O3' DC C 132 6.625 31.114 12.106 1.00 0.00 O ATOM 997 C2' DC C 132 8.166 30.810 10.258 1.00 0.00 C ATOM 998 C1' DC C 132 8.102 29.530 9.444 1.00 0.00 C ATOM 999 N1 DC C 132 8.879 29.657 8.181 1.00 0.00 N ATOM 1000 C2 DC C 132 10.029 28.889 8.028 1.00 0.00 C ATOM 1001 O2 DC C 132 10.390 28.141 8.932 1.00 0.00 O ATOM 1002 N3 DC C 132 10.727 28.993 6.863 1.00 0.00 N ATOM 1003 C4 DC C 132 10.316 29.811 5.886 1.00 0.00 C ATOM 1004 N4 DC C 132 11.015 29.879 4.752 1.00 0.00 N ATOM 1005 C5 DC C 132 9.135 30.603 6.042 1.00 0.00 C ATOM 1006 C6 DC C 132 8.457 30.494 7.200 1.00 0.00 C ATOM 0 H5' DC C 132 4.170 29.824 8.743 1.00 0.00 H new ATOM 0 H5'' DC C 132 3.946 31.013 10.011 1.00 0.00 H new ATOM 0 H4' DC C 132 5.454 29.415 10.838 1.00 0.00 H new ATOM 0 H3' DC C 132 6.445 32.130 10.356 1.00 0.00 H new ATOM 0 H2' DC C 132 8.588 31.623 9.667 1.00 0.00 H new ATOM 0 H2'' DC C 132 8.809 30.682 11.129 1.00 0.00 H new ATOM 0 HO3' DC C 132 7.190 31.816 12.492 1.00 0.00 H new ATOM 0 H1' DC C 132 8.547 28.706 10.002 1.00 0.00 H new ATOM 0 H41 DC C 132 10.710 30.499 4.002 1.00 0.00 H new ATOM 0 H42 DC C 132 11.854 29.311 4.635 1.00 0.00 H new ATOM 0 H5 DC C 132 8.799 31.265 5.258 1.00 0.00 H new ATOM 0 H6 DC C 132 7.564 31.082 7.350 1.00 0.00 H new TER 1019 DC C 132 ATOM 1020 N LYS A 1 -6.728 15.137 11.676 1.00 0.00 N ATOM 1021 CA LYS A 1 -7.385 14.396 12.788 1.00 0.00 C ATOM 1022 C LYS A 1 -7.514 12.923 12.402 1.00 0.00 C ATOM 1023 O LYS A 1 -8.597 12.409 12.209 1.00 0.00 O ATOM 1024 CB LYS A 1 -8.767 14.996 13.044 1.00 0.00 C ATOM 1025 CG LYS A 1 -8.596 16.385 13.662 1.00 0.00 C ATOM 1026 CD LYS A 1 -9.969 17.017 13.923 1.00 0.00 C ATOM 1027 CE LYS A 1 -10.654 17.378 12.594 1.00 0.00 C ATOM 1028 NZ LYS A 1 -11.610 18.498 12.821 1.00 0.00 N ATOM 0 H1 LYS A 1 -6.348 16.036 12.035 1.00 0.00 H new ATOM 0 H2 LYS A 1 -5.952 14.564 11.288 1.00 0.00 H new ATOM 0 H3 LYS A 1 -7.424 15.329 10.928 1.00 0.00 H new ATOM 0 HA LYS A 1 -6.787 14.476 13.696 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -9.327 15.064 12.111 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -9.339 14.353 13.713 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -8.038 16.310 14.595 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -8.015 17.020 12.993 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -10.595 16.324 14.485 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -9.854 17.912 14.535 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -9.908 17.666 11.854 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -11.180 16.511 12.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -12.075 18.745 11.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -12.328 18.206 13.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -11.095 19.326 13.183 1.00 0.00 H new ATOM 1044 N ARG A 2 -6.404 12.240 12.311 1.00 0.00 N ATOM 1045 CA ARG A 2 -6.437 10.792 11.960 1.00 0.00 C ATOM 1046 C ARG A 2 -7.131 10.036 13.092 1.00 0.00 C ATOM 1047 O ARG A 2 -7.839 9.074 12.874 1.00 0.00 O ATOM 1048 CB ARG A 2 -5.004 10.263 11.777 1.00 0.00 C ATOM 1049 CG ARG A 2 -4.412 10.751 10.439 1.00 0.00 C ATOM 1050 CD ARG A 2 -3.822 12.158 10.594 1.00 0.00 C ATOM 1051 NE ARG A 2 -3.206 12.566 9.301 1.00 0.00 N ATOM 1052 CZ ARG A 2 -2.889 13.815 9.084 1.00 0.00 C ATOM 1053 NH1 ARG A 2 -3.050 14.707 10.023 1.00 0.00 N ATOM 1054 NH2 ARG A 2 -2.401 14.170 7.929 1.00 0.00 N ATOM 0 H ARG A 2 -5.472 12.625 12.466 1.00 0.00 H new ATOM 0 HA ARG A 2 -6.981 10.647 11.026 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -4.378 10.601 12.603 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -5.007 9.173 11.804 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -3.638 10.061 10.104 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -5.187 10.758 9.673 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -4.601 12.864 10.880 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -3.075 12.169 11.388 1.00 0.00 H new ATOM 0 HE ARG A 2 -3.030 11.866 8.580 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -3.425 14.430 10.930 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -2.801 15.681 9.849 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -2.267 13.473 7.196 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -2.153 15.144 7.758 1.00 0.00 H new ATOM 1068 N ALA A 3 -6.922 10.469 14.302 1.00 0.00 N ATOM 1069 CA ALA A 3 -7.554 9.796 15.473 1.00 0.00 C ATOM 1070 C ALA A 3 -9.065 9.636 15.249 1.00 0.00 C ATOM 1071 O ALA A 3 -9.788 10.605 15.128 1.00 0.00 O ATOM 1072 CB ALA A 3 -7.329 10.668 16.711 1.00 0.00 C ATOM 0 H ALA A 3 -6.334 11.269 14.534 1.00 0.00 H new ATOM 0 HA ALA A 3 -7.110 8.809 15.605 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -7.785 10.192 17.579 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -6.259 10.787 16.882 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -7.783 11.647 16.554 1.00 0.00 H new ATOM 1078 N GLY A 4 -9.553 8.421 15.221 1.00 0.00 N ATOM 1079 CA GLY A 4 -11.023 8.201 15.038 1.00 0.00 C ATOM 1080 C GLY A 4 -11.397 8.202 13.552 1.00 0.00 C ATOM 1081 O GLY A 4 -12.514 7.890 13.190 1.00 0.00 O ATOM 0 H GLY A 4 -8.998 7.571 15.317 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.311 7.251 15.489 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.579 8.982 15.557 1.00 0.00 H new ATOM 1085 N THR A 5 -10.493 8.566 12.688 1.00 0.00 N ATOM 1086 CA THR A 5 -10.835 8.597 11.237 1.00 0.00 C ATOM 1087 C THR A 5 -11.028 7.178 10.707 1.00 0.00 C ATOM 1088 O THR A 5 -10.101 6.396 10.635 1.00 0.00 O ATOM 1089 CB THR A 5 -9.712 9.269 10.455 1.00 0.00 C ATOM 1090 OG1 THR A 5 -9.333 10.467 11.113 1.00 0.00 O ATOM 1091 CG2 THR A 5 -10.191 9.594 9.035 1.00 0.00 C ATOM 0 H THR A 5 -9.539 8.842 12.919 1.00 0.00 H new ATOM 0 HA THR A 5 -11.761 9.159 11.112 1.00 0.00 H new ATOM 0 HB THR A 5 -8.857 8.595 10.399 1.00 0.00 H new ATOM 0 HG1 THR A 5 -10.089 11.090 11.119 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.385 10.074 8.480 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.481 8.673 8.529 1.00 0.00 H new ATOM 0 HG23 THR A 5 -11.048 10.266 9.085 1.00 0.00 H new ATOM 1099 N VAL A 6 -12.228 6.863 10.303 1.00 0.00 N ATOM 1100 CA VAL A 6 -12.530 5.516 9.730 1.00 0.00 C ATOM 1101 C VAL A 6 -13.004 5.744 8.303 1.00 0.00 C ATOM 1102 O VAL A 6 -13.687 6.710 8.023 1.00 0.00 O ATOM 1103 CB VAL A 6 -13.621 4.826 10.549 1.00 0.00 C ATOM 1104 CG1 VAL A 6 -13.095 4.547 11.957 1.00 0.00 C ATOM 1105 CG2 VAL A 6 -14.850 5.731 10.631 1.00 0.00 C ATOM 0 H VAL A 6 -13.029 7.493 10.346 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.649 4.874 9.751 1.00 0.00 H new ATOM 0 HB VAL A 6 -13.898 3.887 10.070 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -13.870 4.055 12.544 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -12.220 3.900 11.897 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -12.819 5.487 12.435 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -15.627 5.238 11.215 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -14.578 6.672 11.110 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -15.223 5.930 9.626 1.00 0.00 H new ATOM 1115 N CYS A 7 -12.637 4.902 7.385 1.00 0.00 N ATOM 1116 CA CYS A 7 -13.059 5.127 5.981 1.00 0.00 C ATOM 1117 C CYS A 7 -14.572 5.137 5.857 1.00 0.00 C ATOM 1118 O CYS A 7 -15.247 4.167 6.136 1.00 0.00 O ATOM 1119 CB CYS A 7 -12.466 4.022 5.117 1.00 0.00 C ATOM 1120 SG CYS A 7 -12.876 4.298 3.376 1.00 0.00 S ATOM 0 H CYS A 7 -12.066 4.072 7.544 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.698 6.100 5.648 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -11.384 3.994 5.243 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -12.850 3.054 5.439 1.00 0.00 H new ATOM 1125 N SER A 8 -15.102 6.237 5.422 1.00 0.00 N ATOM 1126 CA SER A 8 -16.565 6.343 5.249 1.00 0.00 C ATOM 1127 C SER A 8 -17.034 5.291 4.249 1.00 0.00 C ATOM 1128 O SER A 8 -18.085 4.702 4.405 1.00 0.00 O ATOM 1129 CB SER A 8 -16.913 7.733 4.719 1.00 0.00 C ATOM 1130 OG SER A 8 -16.644 8.700 5.726 1.00 0.00 O ATOM 0 H SER A 8 -14.576 7.076 5.177 1.00 0.00 H new ATOM 0 HA SER A 8 -17.058 6.182 6.208 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.329 7.950 3.824 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.964 7.773 4.432 1.00 0.00 H new ATOM 0 HG SER A 8 -15.691 8.927 5.716 1.00 0.00 H new ATOM 1136 N ASN A 9 -16.286 5.070 3.194 1.00 0.00 N ATOM 1137 CA ASN A 9 -16.740 4.081 2.183 1.00 0.00 C ATOM 1138 C ASN A 9 -16.527 2.642 2.659 1.00 0.00 C ATOM 1139 O ASN A 9 -17.357 1.799 2.385 1.00 0.00 O ATOM 1140 CB ASN A 9 -15.980 4.311 0.875 1.00 0.00 C ATOM 1141 CG ASN A 9 -16.454 5.625 0.252 1.00 0.00 C ATOM 1142 OD1 ASN A 9 -17.550 6.075 0.525 1.00 0.00 O ATOM 1143 ND2 ASN A 9 -15.676 6.266 -0.574 1.00 0.00 N ATOM 0 H ASN A 9 -15.396 5.527 2.996 1.00 0.00 H new ATOM 0 HA ASN A 9 -17.810 4.222 2.028 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -14.907 4.349 1.064 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -16.154 3.483 0.187 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -15.987 7.144 -0.990 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -14.756 5.890 -0.804 1.00 0.00 H new ATOM 1150 N CYS A 10 -15.431 2.316 3.339 1.00 0.00 N ATOM 1151 CA CYS A 10 -15.241 0.880 3.767 1.00 0.00 C ATOM 1152 C CYS A 10 -14.869 0.740 5.259 1.00 0.00 C ATOM 1153 O CYS A 10 -14.566 -0.343 5.707 1.00 0.00 O ATOM 1154 CB CYS A 10 -14.218 0.173 2.851 1.00 0.00 C ATOM 1155 SG CYS A 10 -12.512 0.610 3.274 1.00 0.00 S ATOM 0 H CYS A 10 -14.687 2.961 3.606 1.00 0.00 H new ATOM 0 HA CYS A 10 -16.204 0.382 3.656 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -14.346 -0.907 2.930 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -14.414 0.442 1.813 1.00 0.00 H new ATOM 1160 N GLN A 11 -14.958 1.790 6.042 1.00 0.00 N ATOM 1161 CA GLN A 11 -14.696 1.697 7.527 1.00 0.00 C ATOM 1162 C GLN A 11 -13.272 1.250 7.899 1.00 0.00 C ATOM 1163 O GLN A 11 -12.978 1.075 9.065 1.00 0.00 O ATOM 1164 CB GLN A 11 -15.715 0.741 8.166 1.00 0.00 C ATOM 1165 CG GLN A 11 -17.101 1.385 8.144 1.00 0.00 C ATOM 1166 CD GLN A 11 -18.119 0.420 8.755 1.00 0.00 C ATOM 1167 OE1 GLN A 11 -18.064 -0.769 8.514 1.00 0.00 O ATOM 1168 NE2 GLN A 11 -19.050 0.883 9.543 1.00 0.00 N ATOM 0 H GLN A 11 -15.204 2.724 5.715 1.00 0.00 H new ATOM 0 HA GLN A 11 -14.802 2.710 7.914 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -15.733 -0.204 7.623 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -15.424 0.514 9.192 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -17.089 2.320 8.704 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -17.384 1.630 7.120 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -19.097 1.882 9.746 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -19.731 0.246 9.956 1.00 0.00 H new ATOM 1177 N THR A 12 -12.380 1.071 6.971 1.00 0.00 N ATOM 1178 CA THR A 12 -11.000 0.651 7.371 1.00 0.00 C ATOM 1179 C THR A 12 -10.349 1.787 8.186 1.00 0.00 C ATOM 1180 O THR A 12 -10.807 2.912 8.140 1.00 0.00 O ATOM 1181 CB THR A 12 -10.173 0.357 6.105 1.00 0.00 C ATOM 1182 OG1 THR A 12 -8.917 -0.191 6.475 1.00 0.00 O ATOM 1183 CG2 THR A 12 -9.951 1.638 5.294 1.00 0.00 C ATOM 0 H THR A 12 -12.535 1.193 5.970 1.00 0.00 H new ATOM 0 HA THR A 12 -11.040 -0.250 7.983 1.00 0.00 H new ATOM 0 HB THR A 12 -10.721 -0.356 5.489 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.392 -0.379 5.669 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.365 1.408 4.404 1.00 0.00 H new ATOM 0 HG22 THR A 12 -10.915 2.052 4.997 1.00 0.00 H new ATOM 0 HG23 THR A 12 -9.415 2.366 5.903 1.00 0.00 H new ATOM 1191 N SER A 13 -9.281 1.525 8.914 1.00 0.00 N ATOM 1192 CA SER A 13 -8.610 2.627 9.703 1.00 0.00 C ATOM 1193 C SER A 13 -7.086 2.526 9.510 1.00 0.00 C ATOM 1194 O SER A 13 -6.315 3.108 10.248 1.00 0.00 O ATOM 1195 CB SER A 13 -8.974 2.495 11.193 1.00 0.00 C ATOM 1196 OG SER A 13 -7.792 2.522 11.988 1.00 0.00 O ATOM 0 H SER A 13 -8.846 0.606 8.998 1.00 0.00 H new ATOM 0 HA SER A 13 -8.952 3.599 9.349 1.00 0.00 H new ATOM 0 HB2 SER A 13 -9.638 3.308 11.487 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.515 1.564 11.363 1.00 0.00 H new ATOM 0 HG SER A 13 -7.188 3.218 11.653 1.00 0.00 H new ATOM 1202 N THR A 14 -6.657 1.790 8.519 1.00 0.00 N ATOM 1203 CA THR A 14 -5.193 1.626 8.242 1.00 0.00 C ATOM 1204 C THR A 14 -4.896 2.131 6.836 1.00 0.00 C ATOM 1205 O THR A 14 -4.319 1.458 6.031 1.00 0.00 O ATOM 1206 CB THR A 14 -4.842 0.145 8.330 1.00 0.00 C ATOM 1207 OG1 THR A 14 -5.396 -0.541 7.217 1.00 0.00 O ATOM 1208 CG2 THR A 14 -5.422 -0.418 9.620 1.00 0.00 C ATOM 0 H THR A 14 -7.268 1.285 7.877 1.00 0.00 H new ATOM 0 HA THR A 14 -4.606 2.191 8.966 1.00 0.00 H new ATOM 0 HB THR A 14 -3.760 0.017 8.324 1.00 0.00 H new ATOM 0 HG1 THR A 14 -5.052 -0.150 6.387 1.00 0.00 H new ATOM 0 HG21 THR A 14 -5.178 -1.478 9.696 1.00 0.00 H new ATOM 0 HG22 THR A 14 -4.999 0.114 10.472 1.00 0.00 H new ATOM 0 HG23 THR A 14 -6.505 -0.294 9.617 1.00 0.00 H new ATOM 1216 N THR A 15 -5.369 3.282 6.522 1.00 0.00 N ATOM 1217 CA THR A 15 -5.197 3.825 5.140 1.00 0.00 C ATOM 1218 C THR A 15 -3.774 4.321 4.885 1.00 0.00 C ATOM 1219 O THR A 15 -3.099 4.803 5.774 1.00 0.00 O ATOM 1220 CB THR A 15 -6.152 4.999 4.983 1.00 0.00 C ATOM 1221 OG1 THR A 15 -5.563 6.159 5.556 1.00 0.00 O ATOM 1222 CG2 THR A 15 -7.438 4.671 5.727 1.00 0.00 C ATOM 0 H THR A 15 -5.878 3.891 7.162 1.00 0.00 H new ATOM 0 HA THR A 15 -5.402 3.027 4.427 1.00 0.00 H new ATOM 0 HB THR A 15 -6.360 5.180 3.929 1.00 0.00 H new ATOM 0 HG1 THR A 15 -6.225 6.622 6.111 1.00 0.00 H new ATOM 0 HG21 THR A 15 -8.138 5.501 5.627 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.882 3.769 5.306 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.217 4.508 6.782 1.00 0.00 H new ATOM 1230 N THR A 16 -3.333 4.244 3.653 1.00 0.00 N ATOM 1231 CA THR A 16 -1.978 4.750 3.316 1.00 0.00 C ATOM 1232 C THR A 16 -2.048 6.279 3.298 1.00 0.00 C ATOM 1233 O THR A 16 -1.195 6.959 3.834 1.00 0.00 O ATOM 1234 CB THR A 16 -1.552 4.238 1.937 1.00 0.00 C ATOM 1235 OG1 THR A 16 -2.617 4.419 1.016 1.00 0.00 O ATOM 1236 CG2 THR A 16 -1.183 2.760 2.010 1.00 0.00 C ATOM 0 H THR A 16 -3.857 3.852 2.871 1.00 0.00 H new ATOM 0 HA THR A 16 -1.250 4.403 4.050 1.00 0.00 H new ATOM 0 HB THR A 16 -0.680 4.801 1.605 1.00 0.00 H new ATOM 0 HG1 THR A 16 -2.345 4.093 0.133 1.00 0.00 H new ATOM 0 HG21 THR A 16 -0.882 2.411 1.022 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.358 2.625 2.709 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.045 2.186 2.351 1.00 0.00 H new ATOM 1244 N LEU A 17 -3.088 6.824 2.710 1.00 0.00 N ATOM 1245 CA LEU A 17 -3.252 8.312 2.687 1.00 0.00 C ATOM 1246 C LEU A 17 -4.752 8.622 2.810 1.00 0.00 C ATOM 1247 O LEU A 17 -5.570 8.049 2.113 1.00 0.00 O ATOM 1248 CB LEU A 17 -2.684 8.907 1.377 1.00 0.00 C ATOM 1249 CG LEU A 17 -2.103 10.311 1.630 1.00 0.00 C ATOM 1250 CD1 LEU A 17 -0.767 10.213 2.403 1.00 0.00 C ATOM 1251 CD2 LEU A 17 -1.880 11.007 0.277 1.00 0.00 C ATOM 0 H LEU A 17 -3.830 6.301 2.245 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.702 8.761 3.514 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.909 8.252 0.979 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.471 8.963 0.625 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.803 10.890 2.233 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.371 11.214 2.573 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.936 9.722 3.361 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -0.051 9.634 1.820 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.469 12.003 0.443 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -1.183 10.422 -0.323 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.830 11.091 -0.250 1.00 0.00 H new ATOM 1263 N TRP A 18 -5.122 9.508 3.696 1.00 0.00 N ATOM 1264 CA TRP A 18 -6.564 9.845 3.870 1.00 0.00 C ATOM 1265 C TRP A 18 -7.008 10.820 2.777 1.00 0.00 C ATOM 1266 O TRP A 18 -6.369 11.824 2.534 1.00 0.00 O ATOM 1267 CB TRP A 18 -6.742 10.516 5.235 1.00 0.00 C ATOM 1268 CG TRP A 18 -6.690 9.489 6.324 1.00 0.00 C ATOM 1269 CD1 TRP A 18 -5.678 9.348 7.210 1.00 0.00 C ATOM 1270 CD2 TRP A 18 -7.673 8.466 6.663 1.00 0.00 C ATOM 1271 NE1 TRP A 18 -5.980 8.306 8.070 1.00 0.00 N ATOM 1272 CE2 TRP A 18 -7.197 7.738 7.777 1.00 0.00 C ATOM 1273 CE3 TRP A 18 -8.917 8.102 6.122 1.00 0.00 C ATOM 1274 CZ2 TRP A 18 -7.926 6.693 8.339 1.00 0.00 C ATOM 1275 CZ3 TRP A 18 -9.654 7.046 6.684 1.00 0.00 C ATOM 1276 CH2 TRP A 18 -9.160 6.346 7.790 1.00 0.00 C ATOM 0 H TRP A 18 -4.484 10.015 4.309 1.00 0.00 H new ATOM 0 HA TRP A 18 -7.164 8.937 3.805 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -5.960 11.260 5.388 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.695 11.044 5.268 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.782 9.949 7.241 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -5.373 7.997 8.829 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -9.309 8.637 5.269 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -7.539 6.156 9.192 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -10.609 6.773 6.259 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -9.734 5.538 8.218 1.00 0.00 H new ATOM 1287 N ARG A 19 -8.095 10.524 2.111 1.00 0.00 N ATOM 1288 CA ARG A 19 -8.595 11.419 1.019 1.00 0.00 C ATOM 1289 C ARG A 19 -9.982 11.945 1.403 1.00 0.00 C ATOM 1290 O ARG A 19 -10.886 11.173 1.615 1.00 0.00 O ATOM 1291 CB ARG A 19 -8.744 10.598 -0.283 1.00 0.00 C ATOM 1292 CG ARG A 19 -7.552 9.659 -0.492 1.00 0.00 C ATOM 1293 CD ARG A 19 -6.323 10.456 -0.919 1.00 0.00 C ATOM 1294 NE ARG A 19 -5.179 9.509 -1.100 1.00 0.00 N ATOM 1295 CZ ARG A 19 -4.065 9.877 -1.692 1.00 0.00 C ATOM 1296 NH1 ARG A 19 -3.901 11.091 -2.140 1.00 0.00 N ATOM 1297 NH2 ARG A 19 -3.103 9.014 -1.822 1.00 0.00 N ATOM 0 H ARG A 19 -8.664 9.694 2.277 1.00 0.00 H new ATOM 0 HA ARG A 19 -7.895 12.242 0.875 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -9.665 10.016 -0.244 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -8.830 11.274 -1.133 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -7.341 9.117 0.430 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -7.794 8.915 -1.251 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -6.523 10.990 -1.848 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -6.078 11.206 -0.167 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.266 8.553 -0.755 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.647 11.779 -2.034 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -3.027 11.353 -2.596 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.218 8.065 -1.467 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.233 9.286 -2.279 1.00 0.00 H new ATOM 1311 N ARG A 20 -10.198 13.223 1.477 1.00 0.00 N ATOM 1312 CA ARG A 20 -11.577 13.678 1.818 1.00 0.00 C ATOM 1313 C ARG A 20 -12.466 13.411 0.602 1.00 0.00 C ATOM 1314 O ARG A 20 -12.048 13.567 -0.528 1.00 0.00 O ATOM 1315 CB ARG A 20 -11.593 15.171 2.159 1.00 0.00 C ATOM 1316 CG ARG A 20 -10.749 15.439 3.413 1.00 0.00 C ATOM 1317 CD ARG A 20 -11.471 14.927 4.669 1.00 0.00 C ATOM 1318 NE ARG A 20 -10.812 15.494 5.877 1.00 0.00 N ATOM 1319 CZ ARG A 20 -11.406 15.419 7.036 1.00 0.00 C ATOM 1320 NH1 ARG A 20 -12.540 14.782 7.148 1.00 0.00 N ATOM 1321 NH2 ARG A 20 -10.860 15.969 8.085 1.00 0.00 N ATOM 0 H ARG A 20 -9.506 13.957 1.322 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.940 13.137 2.692 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -11.203 15.747 1.320 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -12.618 15.502 2.324 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -9.780 14.948 3.318 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -10.557 16.508 3.507 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -12.521 15.217 4.643 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -11.442 13.838 4.701 1.00 0.00 H new ATOM 0 HE ARG A 20 -9.898 15.940 5.799 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -12.961 14.343 6.329 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -13.005 14.723 8.054 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -9.969 16.458 7.999 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -11.324 15.911 8.991 1.00 0.00 H new ATOM 1335 N SER A 21 -13.689 13.007 0.821 1.00 0.00 N ATOM 1336 CA SER A 21 -14.603 12.726 -0.330 1.00 0.00 C ATOM 1337 C SER A 21 -15.367 14.010 -0.685 1.00 0.00 C ATOM 1338 O SER A 21 -15.512 14.886 0.138 1.00 0.00 O ATOM 1339 CB SER A 21 -15.581 11.609 0.068 1.00 0.00 C ATOM 1340 OG SER A 21 -15.009 10.347 -0.251 1.00 0.00 O ATOM 0 H SER A 21 -14.096 12.859 1.744 1.00 0.00 H new ATOM 0 HA SER A 21 -14.032 12.402 -1.200 1.00 0.00 H new ATOM 0 HB2 SER A 21 -15.798 11.663 1.135 1.00 0.00 H new ATOM 0 HB3 SER A 21 -16.528 11.735 -0.457 1.00 0.00 H new ATOM 0 HG SER A 21 -15.685 9.646 -0.147 1.00 0.00 H new ATOM 1346 N PRO A 22 -15.848 14.129 -1.902 1.00 0.00 N ATOM 1347 CA PRO A 22 -16.606 15.344 -2.313 1.00 0.00 C ATOM 1348 C PRO A 22 -17.715 15.730 -1.311 1.00 0.00 C ATOM 1349 O PRO A 22 -18.142 16.866 -1.262 1.00 0.00 O ATOM 1350 CB PRO A 22 -17.202 14.917 -3.673 1.00 0.00 C ATOM 1351 CG PRO A 22 -16.655 13.519 -4.038 1.00 0.00 C ATOM 1352 CD PRO A 22 -15.660 13.087 -2.955 1.00 0.00 C ATOM 0 HA PRO A 22 -15.977 16.233 -2.360 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -18.290 14.894 -3.618 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -16.937 15.640 -4.445 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -17.471 12.800 -4.111 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -16.166 13.546 -5.012 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -15.879 12.088 -2.579 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -14.636 13.070 -3.329 1.00 0.00 H new ATOM 1360 N MET A 23 -18.188 14.797 -0.518 1.00 0.00 N ATOM 1361 CA MET A 23 -19.269 15.119 0.469 1.00 0.00 C ATOM 1362 C MET A 23 -18.639 15.499 1.818 1.00 0.00 C ATOM 1363 O MET A 23 -19.303 15.971 2.718 1.00 0.00 O ATOM 1364 CB MET A 23 -20.170 13.889 0.644 1.00 0.00 C ATOM 1365 CG MET A 23 -21.477 14.289 1.337 1.00 0.00 C ATOM 1366 SD MET A 23 -22.484 15.286 0.209 1.00 0.00 S ATOM 1367 CE MET A 23 -23.299 13.918 -0.653 1.00 0.00 C ATOM 0 H MET A 23 -17.872 13.827 -0.512 1.00 0.00 H new ATOM 0 HA MET A 23 -19.863 15.958 0.105 1.00 0.00 H new ATOM 0 HB2 MET A 23 -20.386 13.445 -0.328 1.00 0.00 H new ATOM 0 HB3 MET A 23 -19.654 13.131 1.233 1.00 0.00 H new ATOM 0 HG2 MET A 23 -22.027 13.398 1.640 1.00 0.00 H new ATOM 0 HG3 MET A 23 -21.261 14.854 2.244 1.00 0.00 H new ATOM 0 HE1 MET A 23 -24.017 14.316 -1.370 1.00 0.00 H new ATOM 0 HE2 MET A 23 -22.552 13.323 -1.179 1.00 0.00 H new ATOM 0 HE3 MET A 23 -23.819 13.290 0.071 1.00 0.00 H new ATOM 1377 N GLY A 24 -17.360 15.291 1.963 1.00 0.00 N ATOM 1378 CA GLY A 24 -16.679 15.627 3.249 1.00 0.00 C ATOM 1379 C GLY A 24 -16.659 14.383 4.136 1.00 0.00 C ATOM 1380 O GLY A 24 -16.548 14.468 5.344 1.00 0.00 O ATOM 0 H GLY A 24 -16.752 14.901 1.243 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -15.662 15.971 3.059 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -17.202 16.440 3.752 1.00 0.00 H new ATOM 1384 N ASP A 25 -16.765 13.224 3.540 1.00 0.00 N ATOM 1385 CA ASP A 25 -16.757 11.948 4.313 1.00 0.00 C ATOM 1386 C ASP A 25 -15.357 11.297 4.209 1.00 0.00 C ATOM 1387 O ASP A 25 -14.970 10.868 3.142 1.00 0.00 O ATOM 1388 CB ASP A 25 -17.772 11.005 3.664 1.00 0.00 C ATOM 1389 CG ASP A 25 -19.103 11.737 3.480 1.00 0.00 C ATOM 1390 OD1 ASP A 25 -19.223 12.844 3.980 1.00 0.00 O ATOM 1391 OD2 ASP A 25 -19.979 11.179 2.840 1.00 0.00 O ATOM 0 H ASP A 25 -16.858 13.107 2.531 1.00 0.00 H new ATOM 0 HA ASP A 25 -17.001 12.136 5.358 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -17.399 10.659 2.700 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -17.914 10.122 4.287 1.00 0.00 H new ATOM 1396 N PRO A 26 -14.587 11.207 5.274 1.00 0.00 N ATOM 1397 CA PRO A 26 -13.232 10.583 5.177 1.00 0.00 C ATOM 1398 C PRO A 26 -13.246 9.202 4.486 1.00 0.00 C ATOM 1399 O PRO A 26 -14.108 8.381 4.732 1.00 0.00 O ATOM 1400 CB PRO A 26 -12.827 10.471 6.658 1.00 0.00 C ATOM 1401 CG PRO A 26 -13.710 11.445 7.453 1.00 0.00 C ATOM 1402 CD PRO A 26 -14.979 11.703 6.629 1.00 0.00 C ATOM 0 HA PRO A 26 -12.542 11.164 4.565 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -12.963 9.451 7.016 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -11.773 10.717 6.787 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -13.965 11.024 8.426 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -13.178 12.378 7.639 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -15.838 11.163 7.026 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -15.246 12.760 6.614 1.00 0.00 H new ATOM 1410 N VAL A 27 -12.270 8.941 3.647 1.00 0.00 N ATOM 1411 CA VAL A 27 -12.187 7.605 2.956 1.00 0.00 C ATOM 1412 C VAL A 27 -10.733 7.144 2.903 1.00 0.00 C ATOM 1413 O VAL A 27 -9.821 7.932 3.049 1.00 0.00 O ATOM 1414 CB VAL A 27 -12.731 7.681 1.528 1.00 0.00 C ATOM 1415 CG1 VAL A 27 -14.257 7.775 1.562 1.00 0.00 C ATOM 1416 CG2 VAL A 27 -12.127 8.897 0.827 1.00 0.00 C ATOM 0 H VAL A 27 -11.524 9.595 3.408 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.791 6.898 3.524 1.00 0.00 H new ATOM 0 HB VAL A 27 -12.456 6.783 0.975 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.641 7.829 0.543 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.665 6.894 2.057 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -14.554 8.669 2.110 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.510 8.957 -0.192 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.397 9.802 1.371 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -11.042 8.800 0.801 1.00 0.00 H new ATOM 1426 N CYS A 28 -10.496 5.875 2.681 1.00 0.00 N ATOM 1427 CA CYS A 28 -9.090 5.397 2.605 1.00 0.00 C ATOM 1428 C CYS A 28 -8.543 5.633 1.193 1.00 0.00 C ATOM 1429 O CYS A 28 -9.278 5.737 0.231 1.00 0.00 O ATOM 1430 CB CYS A 28 -8.998 3.917 3.027 1.00 0.00 C ATOM 1431 SG CYS A 28 -9.734 2.806 1.799 1.00 0.00 S ATOM 0 H CYS A 28 -11.211 5.159 2.551 1.00 0.00 H new ATOM 0 HA CYS A 28 -8.472 5.963 3.302 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -7.952 3.648 3.177 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -9.502 3.782 3.984 1.00 0.00 H new ATOM 1436 N ASN A 29 -7.252 5.756 1.086 1.00 0.00 N ATOM 1437 CA ASN A 29 -6.602 6.032 -0.228 1.00 0.00 C ATOM 1438 C ASN A 29 -7.200 5.181 -1.362 1.00 0.00 C ATOM 1439 O ASN A 29 -7.385 5.661 -2.466 1.00 0.00 O ATOM 1440 CB ASN A 29 -5.110 5.708 -0.083 1.00 0.00 C ATOM 1441 CG ASN A 29 -4.373 5.969 -1.396 1.00 0.00 C ATOM 1442 OD1 ASN A 29 -4.946 5.873 -2.463 1.00 0.00 O ATOM 1443 ND2 ASN A 29 -3.106 6.272 -1.362 1.00 0.00 N ATOM 0 H ASN A 29 -6.604 5.675 1.870 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.765 7.077 -0.491 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.676 6.316 0.711 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -4.985 4.665 0.209 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.596 6.429 -2.231 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -2.625 6.353 -0.466 1.00 0.00 H new ATOM 1450 N ALA A 30 -7.485 3.937 -1.129 1.00 0.00 N ATOM 1451 CA ALA A 30 -8.037 3.099 -2.236 1.00 0.00 C ATOM 1452 C ALA A 30 -9.489 3.486 -2.583 1.00 0.00 C ATOM 1453 O ALA A 30 -9.824 3.661 -3.738 1.00 0.00 O ATOM 1454 CB ALA A 30 -7.973 1.634 -1.836 1.00 0.00 C ATOM 0 H ALA A 30 -7.364 3.462 -0.234 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.432 3.273 -3.126 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -8.375 1.019 -2.641 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -6.937 1.353 -1.648 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.561 1.478 -0.932 1.00 0.00 H new ATOM 1460 N CYS A 31 -10.361 3.597 -1.610 1.00 0.00 N ATOM 1461 CA CYS A 31 -11.790 3.944 -1.921 1.00 0.00 C ATOM 1462 C CYS A 31 -11.867 5.270 -2.672 1.00 0.00 C ATOM 1463 O CYS A 31 -12.620 5.417 -3.600 1.00 0.00 O ATOM 1464 CB CYS A 31 -12.603 4.111 -0.632 1.00 0.00 C ATOM 1465 SG CYS A 31 -12.991 2.512 0.103 1.00 0.00 S ATOM 0 H CYS A 31 -10.151 3.464 -0.621 1.00 0.00 H new ATOM 0 HA CYS A 31 -12.193 3.131 -2.525 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -12.041 4.715 0.080 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -13.526 4.649 -0.848 1.00 0.00 H new ATOM 1470 N GLY A 32 -11.123 6.246 -2.255 1.00 0.00 N ATOM 1471 CA GLY A 32 -11.204 7.566 -2.931 1.00 0.00 C ATOM 1472 C GLY A 32 -10.928 7.410 -4.424 1.00 0.00 C ATOM 1473 O GLY A 32 -11.662 7.905 -5.256 1.00 0.00 O ATOM 0 H GLY A 32 -10.464 6.191 -1.479 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -12.192 8.000 -2.780 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.482 8.254 -2.490 1.00 0.00 H new ATOM 1477 N LEU A 33 -9.871 6.738 -4.771 1.00 0.00 N ATOM 1478 CA LEU A 33 -9.546 6.566 -6.214 1.00 0.00 C ATOM 1479 C LEU A 33 -10.605 5.691 -6.894 1.00 0.00 C ATOM 1480 O LEU A 33 -11.111 6.022 -7.945 1.00 0.00 O ATOM 1481 CB LEU A 33 -8.178 5.897 -6.324 1.00 0.00 C ATOM 1482 CG LEU A 33 -7.142 6.734 -5.562 1.00 0.00 C ATOM 1483 CD1 LEU A 33 -5.786 6.008 -5.564 1.00 0.00 C ATOM 1484 CD2 LEU A 33 -7.002 8.118 -6.225 1.00 0.00 C ATOM 0 H LEU A 33 -9.218 6.300 -4.121 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.532 7.538 -6.707 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -8.220 4.888 -5.914 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.889 5.804 -7.371 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.472 6.866 -4.532 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.053 6.605 -5.022 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.892 5.037 -5.080 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.451 5.866 -6.591 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.265 8.709 -5.681 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.677 7.995 -7.258 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -7.964 8.630 -6.205 1.00 0.00 H new ATOM 1496 N TYR A 34 -10.943 4.579 -6.314 1.00 0.00 N ATOM 1497 CA TYR A 34 -11.967 3.701 -6.944 1.00 0.00 C ATOM 1498 C TYR A 34 -13.274 4.481 -7.072 1.00 0.00 C ATOM 1499 O TYR A 34 -13.989 4.374 -8.048 1.00 0.00 O ATOM 1500 CB TYR A 34 -12.189 2.479 -6.047 1.00 0.00 C ATOM 1501 CG TYR A 34 -13.210 1.541 -6.654 1.00 0.00 C ATOM 1502 CD1 TYR A 34 -14.576 1.726 -6.411 1.00 0.00 C ATOM 1503 CD2 TYR A 34 -12.781 0.463 -7.438 1.00 0.00 C ATOM 1504 CE1 TYR A 34 -15.510 0.834 -6.954 1.00 0.00 C ATOM 1505 CE2 TYR A 34 -13.716 -0.425 -7.984 1.00 0.00 C ATOM 1506 CZ TYR A 34 -15.080 -0.239 -7.741 1.00 0.00 C ATOM 1507 OH TYR A 34 -16.004 -1.117 -8.272 1.00 0.00 O ATOM 0 H TYR A 34 -10.557 4.238 -5.433 1.00 0.00 H new ATOM 0 HA TYR A 34 -11.633 3.378 -7.930 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -11.246 1.952 -5.903 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -12.527 2.802 -5.062 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -14.910 2.556 -5.805 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -11.727 0.316 -7.622 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -16.564 0.975 -6.764 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -13.384 -1.253 -8.592 1.00 0.00 H new ATOM 0 HH TYR A 34 -15.540 -1.804 -8.794 1.00 0.00 H new ATOM 1517 N TYR A 35 -13.595 5.247 -6.069 1.00 0.00 N ATOM 1518 CA TYR A 35 -14.862 6.021 -6.086 1.00 0.00 C ATOM 1519 C TYR A 35 -14.829 7.132 -7.147 1.00 0.00 C ATOM 1520 O TYR A 35 -15.732 7.268 -7.924 1.00 0.00 O ATOM 1521 CB TYR A 35 -15.084 6.643 -4.702 1.00 0.00 C ATOM 1522 CG TYR A 35 -16.533 7.012 -4.546 1.00 0.00 C ATOM 1523 CD1 TYR A 35 -17.447 6.058 -4.088 1.00 0.00 C ATOM 1524 CD2 TYR A 35 -16.964 8.299 -4.869 1.00 0.00 C ATOM 1525 CE1 TYR A 35 -18.796 6.391 -3.952 1.00 0.00 C ATOM 1526 CE2 TYR A 35 -18.315 8.636 -4.734 1.00 0.00 C ATOM 1527 CZ TYR A 35 -19.233 7.681 -4.276 1.00 0.00 C ATOM 1528 OH TYR A 35 -20.565 8.011 -4.145 1.00 0.00 O ATOM 0 H TYR A 35 -13.027 5.370 -5.231 1.00 0.00 H new ATOM 0 HA TYR A 35 -15.678 5.342 -6.336 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -14.791 5.939 -3.924 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -14.458 7.527 -4.584 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -17.109 5.063 -3.839 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -16.256 9.034 -5.223 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -19.502 5.654 -3.597 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -18.651 9.632 -4.983 1.00 0.00 H new ATOM 0 HH TYR A 35 -20.698 8.945 -4.410 1.00 0.00 H new ATOM 1538 N LYS A 36 -13.818 7.942 -7.187 1.00 0.00 N ATOM 1539 CA LYS A 36 -13.815 9.030 -8.210 1.00 0.00 C ATOM 1540 C LYS A 36 -13.864 8.425 -9.628 1.00 0.00 C ATOM 1541 O LYS A 36 -14.538 8.933 -10.503 1.00 0.00 O ATOM 1542 CB LYS A 36 -12.582 9.926 -8.007 1.00 0.00 C ATOM 1543 CG LYS A 36 -11.337 9.295 -8.596 1.00 0.00 C ATOM 1544 CD LYS A 36 -10.159 10.207 -8.296 1.00 0.00 C ATOM 1545 CE LYS A 36 -8.897 9.652 -8.959 1.00 0.00 C ATOM 1546 NZ LYS A 36 -7.702 10.374 -8.439 1.00 0.00 N ATOM 0 H LYS A 36 -13.005 7.907 -6.572 1.00 0.00 H new ATOM 0 HA LYS A 36 -14.702 9.652 -8.092 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.755 10.896 -8.472 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -12.432 10.105 -6.942 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.172 8.306 -8.167 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -11.451 9.161 -9.672 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -10.362 11.213 -8.663 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.012 10.285 -7.219 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -8.807 8.585 -8.756 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -8.962 9.767 -10.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -6.840 9.861 -8.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -7.676 11.334 -8.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -7.755 10.431 -7.402 1.00 0.00 H new ATOM 1560 N LEU A 37 -13.156 7.344 -9.861 1.00 0.00 N ATOM 1561 CA LEU A 37 -13.162 6.706 -11.220 1.00 0.00 C ATOM 1562 C LEU A 37 -14.556 6.169 -11.593 1.00 0.00 C ATOM 1563 O LEU A 37 -14.972 6.286 -12.729 1.00 0.00 O ATOM 1564 CB LEU A 37 -12.149 5.531 -11.242 1.00 0.00 C ATOM 1565 CG LEU A 37 -10.777 5.972 -11.784 1.00 0.00 C ATOM 1566 CD1 LEU A 37 -10.213 7.148 -10.979 1.00 0.00 C ATOM 1567 CD2 LEU A 37 -9.816 4.781 -11.713 1.00 0.00 C ATOM 0 H LEU A 37 -12.573 6.875 -9.168 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.884 7.469 -11.947 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -12.031 5.133 -10.234 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.542 4.723 -11.860 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.893 6.303 -12.816 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.244 7.436 -11.386 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.898 7.993 -11.041 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -10.095 6.852 -9.937 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.839 5.079 -12.094 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.718 4.454 -10.678 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -10.207 3.962 -12.317 1.00 0.00 H new ATOM 1579 N HIS A 38 -15.259 5.541 -10.677 1.00 0.00 N ATOM 1580 CA HIS A 38 -16.602 4.954 -11.023 1.00 0.00 C ATOM 1581 C HIS A 38 -17.709 5.511 -10.121 1.00 0.00 C ATOM 1582 O HIS A 38 -18.871 5.219 -10.322 1.00 0.00 O ATOM 1583 CB HIS A 38 -16.525 3.436 -10.860 1.00 0.00 C ATOM 1584 CG HIS A 38 -15.394 2.906 -11.693 1.00 0.00 C ATOM 1585 ND1 HIS A 38 -15.554 2.572 -13.028 1.00 0.00 N ATOM 1586 CD2 HIS A 38 -14.079 2.651 -11.397 1.00 0.00 C ATOM 1587 CE1 HIS A 38 -14.365 2.137 -13.482 1.00 0.00 C ATOM 1588 NE2 HIS A 38 -13.431 2.165 -12.528 1.00 0.00 N ATOM 0 H HIS A 38 -14.965 5.409 -9.709 1.00 0.00 H new ATOM 0 HA HIS A 38 -16.846 5.221 -12.051 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -16.372 3.178 -9.812 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -17.465 2.977 -11.167 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -13.617 2.804 -10.433 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -14.187 1.806 -14.494 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -12.452 1.889 -12.611 1.00 0.00 H new ATOM 1596 N GLN A 39 -17.389 6.328 -9.159 1.00 0.00 N ATOM 1597 CA GLN A 39 -18.432 6.928 -8.275 1.00 0.00 C ATOM 1598 C GLN A 39 -19.494 5.893 -7.868 1.00 0.00 C ATOM 1599 O GLN A 39 -20.678 6.076 -8.057 1.00 0.00 O ATOM 1600 CB GLN A 39 -19.033 8.142 -8.990 1.00 0.00 C ATOM 1601 CG GLN A 39 -20.001 8.891 -8.070 1.00 0.00 C ATOM 1602 CD GLN A 39 -20.390 10.217 -8.718 1.00 0.00 C ATOM 1603 OE1 GLN A 39 -19.761 10.656 -9.661 1.00 0.00 O ATOM 1604 NE2 GLN A 39 -21.414 10.874 -8.254 1.00 0.00 N ATOM 0 H GLN A 39 -16.434 6.612 -8.942 1.00 0.00 H new ATOM 0 HA GLN A 39 -17.980 7.260 -7.341 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -18.236 8.813 -9.310 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -19.556 7.818 -9.889 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -20.890 8.287 -7.890 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -19.535 9.070 -7.101 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -21.941 10.505 -7.463 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -21.689 11.758 -8.682 1.00 0.00 H new ATOM 1613 N VAL A 40 -19.065 4.811 -7.273 1.00 0.00 N ATOM 1614 CA VAL A 40 -20.013 3.767 -6.798 1.00 0.00 C ATOM 1615 C VAL A 40 -19.396 3.095 -5.562 1.00 0.00 C ATOM 1616 O VAL A 40 -18.192 3.064 -5.402 1.00 0.00 O ATOM 1617 CB VAL A 40 -20.230 2.725 -7.888 1.00 0.00 C ATOM 1618 CG1 VAL A 40 -21.179 3.272 -8.959 1.00 0.00 C ATOM 1619 CG2 VAL A 40 -18.888 2.376 -8.519 1.00 0.00 C ATOM 0 H VAL A 40 -18.082 4.606 -7.095 1.00 0.00 H new ATOM 0 HA VAL A 40 -20.974 4.217 -6.551 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.675 1.831 -7.450 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.327 2.519 -9.733 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -22.138 3.518 -8.504 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.748 4.169 -9.403 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -19.036 1.630 -9.300 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -18.446 3.273 -8.953 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -18.221 1.975 -7.756 1.00 0.00 H new ATOM 1629 N ASN A 41 -20.206 2.567 -4.687 1.00 0.00 N ATOM 1630 CA ASN A 41 -19.658 1.907 -3.455 1.00 0.00 C ATOM 1631 C ASN A 41 -19.317 0.437 -3.738 1.00 0.00 C ATOM 1632 O ASN A 41 -20.126 -0.304 -4.261 1.00 0.00 O ATOM 1633 CB ASN A 41 -20.702 1.974 -2.336 1.00 0.00 C ATOM 1634 CG ASN A 41 -21.914 1.118 -2.714 1.00 0.00 C ATOM 1635 OD1 ASN A 41 -22.195 0.927 -3.879 1.00 0.00 O ATOM 1636 ND2 ASN A 41 -22.645 0.588 -1.771 1.00 0.00 N ATOM 0 H ASN A 41 -21.223 2.561 -4.766 1.00 0.00 H new ATOM 0 HA ASN A 41 -18.750 2.429 -3.153 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -20.270 1.619 -1.400 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -21.010 3.007 -2.173 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.452 0.013 -2.014 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -22.409 0.748 -0.792 1.00 0.00 H new ATOM 1643 N ARG A 42 -18.122 0.008 -3.391 1.00 0.00 N ATOM 1644 CA ARG A 42 -17.713 -1.418 -3.631 1.00 0.00 C ATOM 1645 C ARG A 42 -17.745 -2.198 -2.287 1.00 0.00 C ATOM 1646 O ARG A 42 -17.237 -1.712 -1.297 1.00 0.00 O ATOM 1647 CB ARG A 42 -16.284 -1.430 -4.183 1.00 0.00 C ATOM 1648 CG ARG A 42 -15.899 -2.855 -4.599 1.00 0.00 C ATOM 1649 CD ARG A 42 -14.445 -2.886 -5.104 1.00 0.00 C ATOM 1650 NE ARG A 42 -14.342 -3.834 -6.259 1.00 0.00 N ATOM 1651 CZ ARG A 42 -14.787 -5.060 -6.168 1.00 0.00 C ATOM 1652 NH1 ARG A 42 -15.223 -5.519 -5.028 1.00 0.00 N ATOM 1653 NH2 ARG A 42 -14.759 -5.841 -7.214 1.00 0.00 N ATOM 0 H ARG A 42 -17.409 0.588 -2.949 1.00 0.00 H new ATOM 0 HA ARG A 42 -18.396 -1.887 -4.340 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -16.209 -0.759 -5.039 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -15.590 -1.062 -3.428 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -16.012 -3.532 -3.752 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -16.571 -3.208 -5.381 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -14.133 -1.887 -5.409 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.776 -3.198 -4.302 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.918 -3.518 -7.131 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -15.218 -4.921 -4.202 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -15.569 -6.476 -4.962 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -14.390 -5.494 -8.100 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -15.106 -6.798 -7.145 1.00 0.00 H new ATOM 1667 N PRO A 43 -18.329 -3.393 -2.227 1.00 0.00 N ATOM 1668 CA PRO A 43 -18.376 -4.165 -0.942 1.00 0.00 C ATOM 1669 C PRO A 43 -17.017 -4.257 -0.214 1.00 0.00 C ATOM 1670 O PRO A 43 -15.963 -4.211 -0.818 1.00 0.00 O ATOM 1671 CB PRO A 43 -18.865 -5.554 -1.397 1.00 0.00 C ATOM 1672 CG PRO A 43 -19.387 -5.435 -2.841 1.00 0.00 C ATOM 1673 CD PRO A 43 -18.976 -4.059 -3.400 1.00 0.00 C ATOM 0 HA PRO A 43 -19.019 -3.682 -0.206 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -18.052 -6.278 -1.346 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -19.654 -5.914 -0.737 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -18.975 -6.233 -3.459 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -20.471 -5.543 -2.861 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -18.287 -4.155 -4.239 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -19.838 -3.496 -3.758 1.00 0.00 H new ATOM 1681 N LEU A 44 -17.060 -4.394 1.089 1.00 0.00 N ATOM 1682 CA LEU A 44 -15.811 -4.500 1.908 1.00 0.00 C ATOM 1683 C LEU A 44 -14.998 -5.732 1.488 1.00 0.00 C ATOM 1684 O LEU A 44 -13.994 -6.055 2.094 1.00 0.00 O ATOM 1685 CB LEU A 44 -16.210 -4.636 3.389 1.00 0.00 C ATOM 1686 CG LEU A 44 -16.458 -3.254 3.995 1.00 0.00 C ATOM 1687 CD1 LEU A 44 -17.713 -2.630 3.381 1.00 0.00 C ATOM 1688 CD2 LEU A 44 -16.658 -3.394 5.507 1.00 0.00 C ATOM 0 H LEU A 44 -17.924 -4.438 1.629 1.00 0.00 H new ATOM 0 HA LEU A 44 -15.200 -3.610 1.755 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -17.108 -5.247 3.477 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -15.421 -5.148 3.941 1.00 0.00 H new ATOM 0 HG LEU A 44 -15.600 -2.615 3.789 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -17.882 -1.646 3.819 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -17.580 -2.530 2.304 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -18.573 -3.269 3.583 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -16.835 -2.411 5.943 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -17.516 -4.038 5.703 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -15.766 -3.833 5.953 1.00 0.00 H new ATOM 1700 N THR A 45 -15.410 -6.420 0.468 1.00 0.00 N ATOM 1701 CA THR A 45 -14.647 -7.619 0.027 1.00 0.00 C ATOM 1702 C THR A 45 -13.230 -7.192 -0.373 1.00 0.00 C ATOM 1703 O THR A 45 -12.343 -8.009 -0.530 1.00 0.00 O ATOM 1704 CB THR A 45 -15.366 -8.253 -1.169 1.00 0.00 C ATOM 1705 OG1 THR A 45 -15.498 -7.289 -2.204 1.00 0.00 O ATOM 1706 CG2 THR A 45 -16.757 -8.735 -0.739 1.00 0.00 C ATOM 0 H THR A 45 -16.242 -6.207 -0.082 1.00 0.00 H new ATOM 0 HA THR A 45 -14.585 -8.347 0.836 1.00 0.00 H new ATOM 0 HB THR A 45 -14.787 -9.102 -1.531 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.956 -7.693 -2.971 1.00 0.00 H new ATOM 0 HG21 THR A 45 -17.266 -9.185 -1.591 1.00 0.00 H new ATOM 0 HG22 THR A 45 -16.656 -9.474 0.055 1.00 0.00 H new ATOM 0 HG23 THR A 45 -17.339 -7.888 -0.375 1.00 0.00 H new ATOM 1714 N MET A 46 -13.022 -5.911 -0.551 1.00 0.00 N ATOM 1715 CA MET A 46 -11.670 -5.402 -0.958 1.00 0.00 C ATOM 1716 C MET A 46 -10.936 -4.862 0.279 1.00 0.00 C ATOM 1717 O MET A 46 -9.773 -4.513 0.224 1.00 0.00 O ATOM 1718 CB MET A 46 -11.867 -4.276 -1.987 1.00 0.00 C ATOM 1719 CG MET A 46 -10.607 -4.084 -2.844 1.00 0.00 C ATOM 1720 SD MET A 46 -10.999 -2.947 -4.205 1.00 0.00 S ATOM 1721 CE MET A 46 -9.621 -3.348 -5.316 1.00 0.00 C ATOM 0 H MET A 46 -13.733 -5.190 -0.432 1.00 0.00 H new ATOM 0 HA MET A 46 -11.076 -6.204 -1.397 1.00 0.00 H new ATOM 0 HB2 MET A 46 -12.715 -4.511 -2.630 1.00 0.00 H new ATOM 0 HB3 MET A 46 -12.105 -3.346 -1.472 1.00 0.00 H new ATOM 0 HG2 MET A 46 -9.795 -3.683 -2.238 1.00 0.00 H new ATOM 0 HG3 MET A 46 -10.268 -5.042 -3.237 1.00 0.00 H new ATOM 0 HE1 MET A 46 -9.829 -2.953 -6.311 1.00 0.00 H new ATOM 0 HE2 MET A 46 -8.703 -2.902 -4.933 1.00 0.00 H new ATOM 0 HE3 MET A 46 -9.502 -4.430 -5.373 1.00 0.00 H new ATOM 1731 N ARG A 47 -11.618 -4.782 1.388 1.00 0.00 N ATOM 1732 CA ARG A 47 -10.984 -4.252 2.631 1.00 0.00 C ATOM 1733 C ARG A 47 -10.097 -5.319 3.285 1.00 0.00 C ATOM 1734 O ARG A 47 -10.506 -6.448 3.477 1.00 0.00 O ATOM 1735 CB ARG A 47 -12.090 -3.833 3.606 1.00 0.00 C ATOM 1736 CG ARG A 47 -11.487 -3.410 4.947 1.00 0.00 C ATOM 1737 CD ARG A 47 -12.603 -2.931 5.865 1.00 0.00 C ATOM 1738 NE ARG A 47 -12.077 -2.842 7.257 1.00 0.00 N ATOM 1739 CZ ARG A 47 -12.760 -2.238 8.187 1.00 0.00 C ATOM 1740 NH1 ARG A 47 -13.922 -1.714 7.912 1.00 0.00 N ATOM 1741 NH2 ARG A 47 -12.280 -2.165 9.397 1.00 0.00 N ATOM 0 H ARG A 47 -12.594 -5.062 1.488 1.00 0.00 H new ATOM 0 HA ARG A 47 -10.358 -3.396 2.378 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -12.664 -3.009 3.182 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -12.783 -4.660 3.757 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -10.958 -4.247 5.403 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -10.756 -2.615 4.797 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -12.969 -1.958 5.537 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -13.447 -3.620 5.824 1.00 0.00 H new ATOM 0 HE ARG A 47 -11.174 -3.258 7.483 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -14.299 -1.776 6.966 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -14.454 -1.242 8.643 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -11.373 -2.580 9.612 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -12.811 -1.693 10.129 1.00 0.00 H new ATOM 1755 N LYS A 48 -8.891 -4.953 3.653 1.00 0.00 N ATOM 1756 CA LYS A 48 -7.959 -5.914 4.329 1.00 0.00 C ATOM 1757 C LYS A 48 -7.516 -5.304 5.663 1.00 0.00 C ATOM 1758 O LYS A 48 -7.274 -4.116 5.755 1.00 0.00 O ATOM 1759 CB LYS A 48 -6.723 -6.151 3.460 1.00 0.00 C ATOM 1760 CG LYS A 48 -5.922 -7.313 4.053 1.00 0.00 C ATOM 1761 CD LYS A 48 -4.661 -7.559 3.224 1.00 0.00 C ATOM 1762 CE LYS A 48 -3.897 -8.750 3.806 1.00 0.00 C ATOM 1763 NZ LYS A 48 -2.564 -8.858 3.147 1.00 0.00 N ATOM 0 H LYS A 48 -8.508 -4.018 3.512 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.470 -6.863 4.488 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.019 -6.380 2.436 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.110 -5.250 3.421 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.650 -7.089 5.085 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.535 -8.214 4.073 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.927 -7.756 2.185 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.030 -6.670 3.228 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -3.773 -8.625 4.882 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -4.464 -9.668 3.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -2.045 -9.668 3.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -2.693 -8.996 2.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -2.023 -7.986 3.313 1.00 0.00 H new ATOM 1777 N ASP A 49 -7.423 -6.097 6.703 1.00 0.00 N ATOM 1778 CA ASP A 49 -7.012 -5.551 8.035 1.00 0.00 C ATOM 1779 C ASP A 49 -5.834 -4.582 7.873 1.00 0.00 C ATOM 1780 O ASP A 49 -6.013 -3.384 7.764 1.00 0.00 O ATOM 1781 CB ASP A 49 -6.590 -6.705 8.949 1.00 0.00 C ATOM 1782 CG ASP A 49 -7.739 -7.704 9.091 1.00 0.00 C ATOM 1783 OD1 ASP A 49 -8.867 -7.326 8.817 1.00 0.00 O ATOM 1784 OD2 ASP A 49 -7.472 -8.832 9.472 1.00 0.00 O ATOM 0 H ASP A 49 -7.614 -7.099 6.687 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.856 -5.017 8.472 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -5.712 -7.203 8.538 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -6.308 -6.320 9.929 1.00 0.00 H new ATOM 1789 N GLY A 50 -4.630 -5.093 7.867 1.00 0.00 N ATOM 1790 CA GLY A 50 -3.439 -4.206 7.721 1.00 0.00 C ATOM 1791 C GLY A 50 -3.368 -3.686 6.287 1.00 0.00 C ATOM 1792 O GLY A 50 -4.256 -3.919 5.492 1.00 0.00 O ATOM 0 H GLY A 50 -4.421 -6.087 7.957 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.505 -3.372 8.419 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.530 -4.756 7.966 1.00 0.00 H new ATOM 1796 N ILE A 51 -2.319 -2.983 5.941 1.00 0.00 N ATOM 1797 CA ILE A 51 -2.202 -2.454 4.556 1.00 0.00 C ATOM 1798 C ILE A 51 -1.466 -3.453 3.668 1.00 0.00 C ATOM 1799 O ILE A 51 -0.524 -4.105 4.076 1.00 0.00 O ATOM 1800 CB ILE A 51 -1.466 -1.114 4.576 1.00 0.00 C ATOM 1801 CG1 ILE A 51 -2.101 -0.237 5.672 1.00 0.00 C ATOM 1802 CG2 ILE A 51 -1.597 -0.439 3.200 1.00 0.00 C ATOM 1803 CD1 ILE A 51 -1.821 1.250 5.417 1.00 0.00 C ATOM 0 H ILE A 51 -1.541 -2.755 6.560 1.00 0.00 H new ATOM 0 HA ILE A 51 -3.201 -2.303 4.147 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.406 -1.257 4.788 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.177 -0.408 5.702 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.706 -0.523 6.647 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.073 0.517 3.212 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.161 -1.082 2.436 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.650 -0.272 2.975 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.280 1.847 6.205 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.745 1.422 5.412 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.239 1.539 4.453 1.00 0.00 H new ATOM 1815 N GLN A 52 -1.901 -3.561 2.450 1.00 0.00 N ATOM 1816 CA GLN A 52 -1.260 -4.496 1.491 1.00 0.00 C ATOM 1817 C GLN A 52 0.021 -3.855 0.960 1.00 0.00 C ATOM 1818 O GLN A 52 0.155 -2.651 0.953 1.00 0.00 O ATOM 1819 CB GLN A 52 -2.219 -4.736 0.326 1.00 0.00 C ATOM 1820 CG GLN A 52 -3.410 -5.564 0.803 1.00 0.00 C ATOM 1821 CD GLN A 52 -4.386 -5.763 -0.357 1.00 0.00 C ATOM 1822 OE1 GLN A 52 -5.202 -6.662 -0.333 1.00 0.00 O ATOM 1823 NE2 GLN A 52 -4.346 -4.942 -1.375 1.00 0.00 N ATOM 0 H GLN A 52 -2.687 -3.033 2.071 1.00 0.00 H new ATOM 0 HA GLN A 52 -1.026 -5.440 1.982 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.564 -3.783 -0.076 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.703 -5.255 -0.482 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.070 -6.530 1.176 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -3.909 -5.060 1.631 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -3.660 -4.187 -1.395 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.000 -5.057 -2.149 1.00 0.00 H new ATOM 1832 N THR A 53 0.980 -4.642 0.543 1.00 0.00 N ATOM 1833 CA THR A 53 2.254 -4.045 0.029 1.00 0.00 C ATOM 1834 C THR A 53 2.806 -4.851 -1.150 1.00 0.00 C ATOM 1835 O THR A 53 2.413 -5.972 -1.410 1.00 0.00 O ATOM 1836 CB THR A 53 3.300 -4.000 1.149 1.00 0.00 C ATOM 1837 OG1 THR A 53 4.601 -4.039 0.579 1.00 0.00 O ATOM 1838 CG2 THR A 53 3.113 -5.191 2.079 1.00 0.00 C ATOM 0 H THR A 53 0.940 -5.661 0.535 1.00 0.00 H new ATOM 0 HA THR A 53 2.037 -3.033 -0.314 1.00 0.00 H new ATOM 0 HB THR A 53 3.179 -3.080 1.720 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.272 -4.009 1.293 1.00 0.00 H new ATOM 0 HG21 THR A 53 3.859 -5.154 2.873 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.115 -5.158 2.517 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.230 -6.116 1.514 1.00 0.00 H new ATOM 1846 N ARG A 54 3.730 -4.255 -1.850 1.00 0.00 N ATOM 1847 CA ARG A 54 4.371 -4.915 -3.024 1.00 0.00 C ATOM 1848 C ARG A 54 5.806 -4.407 -3.158 1.00 0.00 C ATOM 1849 O ARG A 54 6.169 -3.391 -2.599 1.00 0.00 O ATOM 1850 CB ARG A 54 3.603 -4.583 -4.310 1.00 0.00 C ATOM 1851 CG ARG A 54 2.283 -5.360 -4.370 1.00 0.00 C ATOM 1852 CD ARG A 54 1.577 -5.016 -5.687 1.00 0.00 C ATOM 1853 NE ARG A 54 0.279 -5.765 -5.799 1.00 0.00 N ATOM 1854 CZ ARG A 54 0.231 -7.072 -5.794 1.00 0.00 C ATOM 1855 NH1 ARG A 54 1.327 -7.778 -5.825 1.00 0.00 N ATOM 1856 NH2 ARG A 54 -0.927 -7.674 -5.802 1.00 0.00 N ATOM 0 H ARG A 54 4.076 -3.316 -1.654 1.00 0.00 H new ATOM 0 HA ARG A 54 4.362 -5.994 -2.873 1.00 0.00 H new ATOM 0 HB2 ARG A 54 3.403 -3.512 -4.353 1.00 0.00 H new ATOM 0 HB3 ARG A 54 4.215 -4.828 -5.178 1.00 0.00 H new ATOM 0 HG2 ARG A 54 2.471 -6.432 -4.310 1.00 0.00 H new ATOM 0 HG3 ARG A 54 1.651 -5.099 -3.521 1.00 0.00 H new ATOM 0 HD2 ARG A 54 1.390 -3.943 -5.737 1.00 0.00 H new ATOM 0 HD3 ARG A 54 2.222 -5.267 -6.529 1.00 0.00 H new ATOM 0 HE ARG A 54 -0.591 -5.238 -5.881 1.00 0.00 H new ATOM 0 HH11 ARG A 54 2.234 -7.311 -5.853 1.00 0.00 H new ATOM 0 HH12 ARG A 54 1.278 -8.797 -5.821 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -1.787 -7.125 -5.812 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -0.972 -8.693 -5.798 1.00 0.00 H new ATOM 1870 N ASN A 55 6.624 -5.100 -3.901 1.00 0.00 N ATOM 1871 CA ASN A 55 8.032 -4.649 -4.070 1.00 0.00 C ATOM 1872 C ASN A 55 8.031 -3.251 -4.697 1.00 0.00 C ATOM 1873 O ASN A 55 7.254 -2.957 -5.583 1.00 0.00 O ATOM 1874 CB ASN A 55 8.768 -5.629 -4.987 1.00 0.00 C ATOM 1875 CG ASN A 55 8.762 -7.024 -4.354 1.00 0.00 C ATOM 1876 OD1 ASN A 55 9.084 -7.177 -3.192 1.00 0.00 O ATOM 1877 ND2 ASN A 55 8.415 -8.056 -5.075 1.00 0.00 N ATOM 0 H ASN A 55 6.378 -5.957 -4.397 1.00 0.00 H new ATOM 0 HA ASN A 55 8.535 -4.616 -3.104 1.00 0.00 H new ATOM 0 HB2 ASN A 55 8.287 -5.660 -5.965 1.00 0.00 H new ATOM 0 HB3 ASN A 55 9.793 -5.295 -5.146 1.00 0.00 H new ATOM 0 HD21 ASN A 55 8.414 -8.989 -4.663 1.00 0.00 H new ATOM 0 HD22 ASN A 55 8.145 -7.929 -6.050 1.00 0.00 H new ATOM 1884 N ARG A 56 8.887 -2.383 -4.228 1.00 0.00 N ATOM 1885 CA ARG A 56 8.928 -0.993 -4.777 1.00 0.00 C ATOM 1886 C ARG A 56 9.333 -1.015 -6.250 1.00 0.00 C ATOM 1887 O ARG A 56 10.311 -1.630 -6.625 1.00 0.00 O ATOM 1888 CB ARG A 56 9.957 -0.166 -4.002 1.00 0.00 C ATOM 1889 CG ARG A 56 9.529 -0.075 -2.540 1.00 0.00 C ATOM 1890 CD ARG A 56 10.439 0.900 -1.795 1.00 0.00 C ATOM 1891 NE ARG A 56 10.166 0.807 -0.335 1.00 0.00 N ATOM 1892 CZ ARG A 56 11.030 1.270 0.522 1.00 0.00 C ATOM 1893 NH1 ARG A 56 12.154 1.784 0.105 1.00 0.00 N ATOM 1894 NH2 ARG A 56 10.775 1.208 1.800 1.00 0.00 N ATOM 0 H ARG A 56 9.561 -2.575 -3.487 1.00 0.00 H new ATOM 0 HA ARG A 56 7.936 -0.553 -4.678 1.00 0.00 H new ATOM 0 HB2 ARG A 56 10.942 -0.626 -4.077 1.00 0.00 H new ATOM 0 HB3 ARG A 56 10.038 0.832 -4.433 1.00 0.00 H new ATOM 0 HG2 ARG A 56 8.493 0.258 -2.475 1.00 0.00 H new ATOM 0 HG3 ARG A 56 9.577 -1.060 -2.075 1.00 0.00 H new ATOM 0 HD2 ARG A 56 11.484 0.667 -1.997 1.00 0.00 H new ATOM 0 HD3 ARG A 56 10.266 1.918 -2.145 1.00 0.00 H new ATOM 0 HE ARG A 56 9.301 0.380 -0.005 1.00 0.00 H new ATOM 0 HH11 ARG A 56 12.357 1.824 -0.894 1.00 0.00 H new ATOM 0 HH12 ARG A 56 12.830 2.146 0.778 1.00 0.00 H new ATOM 0 HH21 ARG A 56 9.900 0.797 2.126 1.00 0.00 H new ATOM 0 HH22 ARG A 56 11.451 1.570 2.473 1.00 0.00 H new ATOM 1908 N LYS A 57 8.591 -0.343 -7.086 1.00 0.00 N ATOM 1909 CA LYS A 57 8.933 -0.321 -8.533 1.00 0.00 C ATOM 1910 C LYS A 57 10.339 0.244 -8.718 1.00 0.00 C ATOM 1911 O LYS A 57 11.047 0.499 -7.765 1.00 0.00 O ATOM 1912 CB LYS A 57 7.931 0.547 -9.277 1.00 0.00 C ATOM 1913 CG LYS A 57 7.896 1.926 -8.645 1.00 0.00 C ATOM 1914 CD LYS A 57 6.883 2.782 -9.394 1.00 0.00 C ATOM 1915 CE LYS A 57 6.825 4.176 -8.768 1.00 0.00 C ATOM 1916 NZ LYS A 57 5.973 5.068 -9.603 1.00 0.00 N ATOM 0 H LYS A 57 7.762 0.192 -6.828 1.00 0.00 H new ATOM 0 HA LYS A 57 8.898 -1.336 -8.930 1.00 0.00 H new ATOM 0 HB2 LYS A 57 8.208 0.623 -10.328 1.00 0.00 H new ATOM 0 HB3 LYS A 57 6.941 0.092 -9.241 1.00 0.00 H new ATOM 0 HG2 LYS A 57 7.623 1.852 -7.592 1.00 0.00 H new ATOM 0 HG3 LYS A 57 8.883 2.386 -8.687 1.00 0.00 H new ATOM 0 HD2 LYS A 57 7.161 2.856 -10.445 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.899 2.315 -9.357 1.00 0.00 H new ATOM 0 HE2 LYS A 57 6.422 4.114 -7.757 1.00 0.00 H new ATOM 0 HE3 LYS A 57 7.830 4.590 -8.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 6.482 5.954 -9.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.752 4.595 -10.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 5.090 5.279 -9.096 1.00 0.00 H new ATOM 1930 N VAL A 58 10.745 0.448 -9.938 1.00 0.00 N ATOM 1931 CA VAL A 58 12.101 1.003 -10.185 1.00 0.00 C ATOM 1932 C VAL A 58 12.223 2.340 -9.449 1.00 0.00 C ATOM 1933 O VAL A 58 11.278 3.099 -9.368 1.00 0.00 O ATOM 1934 CB VAL A 58 12.291 1.199 -11.691 1.00 0.00 C ATOM 1935 CG1 VAL A 58 13.572 1.992 -11.957 1.00 0.00 C ATOM 1936 CG2 VAL A 58 12.393 -0.174 -12.360 1.00 0.00 C ATOM 0 H VAL A 58 10.195 0.254 -10.775 1.00 0.00 H new ATOM 0 HA VAL A 58 12.870 0.322 -9.819 1.00 0.00 H new ATOM 0 HB VAL A 58 11.443 1.750 -12.097 1.00 0.00 H new ATOM 0 HG11 VAL A 58 13.700 2.127 -13.031 1.00 0.00 H new ATOM 0 HG12 VAL A 58 13.503 2.967 -11.474 1.00 0.00 H new ATOM 0 HG13 VAL A 58 14.427 1.448 -11.555 1.00 0.00 H new ATOM 0 HG21 VAL A 58 12.529 -0.046 -13.434 1.00 0.00 H new ATOM 0 HG22 VAL A 58 13.244 -0.717 -11.949 1.00 0.00 H new ATOM 0 HG23 VAL A 58 11.479 -0.738 -12.174 1.00 0.00 H new ATOM 1946 N SER A 59 13.368 2.629 -8.893 1.00 0.00 N ATOM 1947 CA SER A 59 13.524 3.911 -8.148 1.00 0.00 C ATOM 1948 C SER A 59 13.746 5.057 -9.131 1.00 0.00 C ATOM 1949 O SER A 59 14.714 5.081 -9.864 1.00 0.00 O ATOM 1950 CB SER A 59 14.721 3.813 -7.205 1.00 0.00 C ATOM 1951 OG SER A 59 15.920 3.805 -7.969 1.00 0.00 O ATOM 0 H SER A 59 14.198 2.037 -8.922 1.00 0.00 H new ATOM 0 HA SER A 59 12.619 4.101 -7.571 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.723 4.655 -6.512 1.00 0.00 H new ATOM 0 HB3 SER A 59 14.652 2.906 -6.604 1.00 0.00 H new ATOM 0 HG SER A 59 15.710 3.987 -8.909 1.00 0.00 H new ATOM 1957 N SER A 60 12.856 6.009 -9.156 1.00 0.00 N ATOM 1958 CA SER A 60 13.022 7.149 -10.096 1.00 0.00 C ATOM 1959 C SER A 60 12.183 8.334 -9.624 1.00 0.00 C ATOM 1960 O SER A 60 11.152 8.175 -9.001 1.00 0.00 O ATOM 1961 CB SER A 60 12.575 6.725 -11.493 1.00 0.00 C ATOM 1962 OG SER A 60 12.803 7.791 -12.406 1.00 0.00 O ATOM 0 H SER A 60 12.024 6.046 -8.568 1.00 0.00 H new ATOM 0 HA SER A 60 14.071 7.444 -10.125 1.00 0.00 H new ATOM 0 HB2 SER A 60 13.124 5.838 -11.809 1.00 0.00 H new ATOM 0 HB3 SER A 60 11.518 6.459 -11.484 1.00 0.00 H new ATOM 0 HG SER A 60 12.518 7.520 -13.304 1.00 0.00 H new ATOM 1968 N LYS A 61 12.617 9.525 -9.926 1.00 0.00 N ATOM 1969 CA LYS A 61 11.848 10.727 -9.509 1.00 0.00 C ATOM 1970 C LYS A 61 10.716 10.961 -10.510 1.00 0.00 C ATOM 1971 O LYS A 61 10.850 10.687 -11.686 1.00 0.00 O ATOM 1972 CB LYS A 61 12.777 11.941 -9.502 1.00 0.00 C ATOM 1973 CG LYS A 61 13.832 11.779 -8.405 1.00 0.00 C ATOM 1974 CD LYS A 61 14.753 12.998 -8.409 1.00 0.00 C ATOM 1975 CE LYS A 61 15.813 12.849 -7.316 1.00 0.00 C ATOM 1976 NZ LYS A 61 16.803 13.956 -7.439 1.00 0.00 N ATOM 0 H LYS A 61 13.474 9.717 -10.445 1.00 0.00 H new ATOM 0 HA LYS A 61 11.435 10.578 -8.511 1.00 0.00 H new ATOM 0 HB2 LYS A 61 13.261 12.046 -10.473 1.00 0.00 H new ATOM 0 HB3 LYS A 61 12.201 12.851 -9.334 1.00 0.00 H new ATOM 0 HG2 LYS A 61 13.350 11.676 -7.433 1.00 0.00 H new ATOM 0 HG3 LYS A 61 14.411 10.871 -8.572 1.00 0.00 H new ATOM 0 HD2 LYS A 61 15.233 13.100 -9.382 1.00 0.00 H new ATOM 0 HD3 LYS A 61 14.172 13.905 -8.244 1.00 0.00 H new ATOM 0 HE2 LYS A 61 15.344 12.872 -6.332 1.00 0.00 H new ATOM 0 HE3 LYS A 61 16.314 11.885 -7.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 17.526 13.859 -6.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 17.257 13.913 -8.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 16.318 14.869 -7.332 1.00 0.00 H new ATOM 1990 N GLY A 62 9.600 11.468 -10.059 1.00 0.00 N ATOM 1991 CA GLY A 62 8.464 11.721 -10.994 1.00 0.00 C ATOM 1992 C GLY A 62 8.634 13.103 -11.625 1.00 0.00 C ATOM 1993 O GLY A 62 8.741 14.098 -10.936 1.00 0.00 O ATOM 0 H GLY A 62 9.425 11.718 -9.086 1.00 0.00 H new ATOM 0 HA2 GLY A 62 8.437 10.955 -11.769 1.00 0.00 H new ATOM 0 HA3 GLY A 62 7.516 11.666 -10.458 1.00 0.00 H new ATOM 1997 N LYS A 63 8.663 13.174 -12.930 1.00 0.00 N ATOM 1998 CA LYS A 63 8.832 14.491 -13.615 1.00 0.00 C ATOM 1999 C LYS A 63 7.466 14.999 -14.096 1.00 0.00 C ATOM 2000 O LYS A 63 6.881 14.454 -15.010 1.00 0.00 O ATOM 2001 CB LYS A 63 9.763 14.301 -14.817 1.00 0.00 C ATOM 2002 CG LYS A 63 11.122 13.791 -14.326 1.00 0.00 C ATOM 2003 CD LYS A 63 12.064 13.596 -15.519 1.00 0.00 C ATOM 2004 CE LYS A 63 13.424 13.086 -15.030 1.00 0.00 C ATOM 2005 NZ LYS A 63 14.228 14.233 -14.522 1.00 0.00 N ATOM 0 H LYS A 63 8.576 12.372 -13.555 1.00 0.00 H new ATOM 0 HA LYS A 63 9.259 15.219 -12.925 1.00 0.00 H new ATOM 0 HB2 LYS A 63 9.328 13.592 -15.521 1.00 0.00 H new ATOM 0 HB3 LYS A 63 9.886 15.244 -15.350 1.00 0.00 H new ATOM 0 HG2 LYS A 63 11.555 14.501 -13.621 1.00 0.00 H new ATOM 0 HG3 LYS A 63 10.996 12.849 -13.792 1.00 0.00 H new ATOM 0 HD2 LYS A 63 11.631 12.886 -16.223 1.00 0.00 H new ATOM 0 HD3 LYS A 63 12.189 14.538 -16.053 1.00 0.00 H new ATOM 0 HE2 LYS A 63 13.286 12.347 -14.241 1.00 0.00 H new ATOM 0 HE3 LYS A 63 13.952 12.589 -15.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 15.152 13.889 -14.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 14.370 14.923 -15.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 13.724 14.688 -13.734 1.00 0.00 H new ATOM 2019 N LYS A 64 6.950 16.038 -13.487 1.00 0.00 N ATOM 2020 CA LYS A 64 5.622 16.568 -13.919 1.00 0.00 C ATOM 2021 C LYS A 64 5.757 17.172 -15.316 1.00 0.00 C ATOM 2022 O LYS A 64 4.864 17.076 -16.135 1.00 0.00 O ATOM 2023 CB LYS A 64 5.137 17.643 -12.940 1.00 0.00 C ATOM 2024 CG LYS A 64 3.654 17.933 -13.205 1.00 0.00 C ATOM 2025 CD LYS A 64 3.193 19.137 -12.374 1.00 0.00 C ATOM 2026 CE LYS A 64 3.437 18.878 -10.884 1.00 0.00 C ATOM 2027 NZ LYS A 64 3.111 17.462 -10.561 1.00 0.00 N ATOM 0 H LYS A 64 7.389 16.539 -12.714 1.00 0.00 H new ATOM 0 HA LYS A 64 4.897 15.754 -13.934 1.00 0.00 H new ATOM 0 HB2 LYS A 64 5.276 17.306 -11.913 1.00 0.00 H new ATOM 0 HB3 LYS A 64 5.725 18.553 -13.060 1.00 0.00 H new ATOM 0 HG2 LYS A 64 3.499 18.133 -14.265 1.00 0.00 H new ATOM 0 HG3 LYS A 64 3.054 17.058 -12.954 1.00 0.00 H new ATOM 0 HD2 LYS A 64 3.731 20.032 -12.688 1.00 0.00 H new ATOM 0 HD3 LYS A 64 2.134 19.324 -12.549 1.00 0.00 H new ATOM 0 HE2 LYS A 64 4.477 19.088 -10.634 1.00 0.00 H new ATOM 0 HE3 LYS A 64 2.823 19.549 -10.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.946 17.368 -9.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 2.254 17.177 -11.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 3.904 16.850 -10.842 1.00 0.00 H new ATOM 2041 N ARG A 65 6.870 17.794 -15.598 1.00 0.00 N ATOM 2042 CA ARG A 65 7.065 18.401 -16.943 1.00 0.00 C ATOM 2043 C ARG A 65 6.954 17.323 -18.013 1.00 0.00 C ATOM 2044 O ARG A 65 7.380 16.201 -17.822 1.00 0.00 O ATOM 2045 CB ARG A 65 8.451 19.035 -17.023 1.00 0.00 C ATOM 2046 CG ARG A 65 8.485 20.286 -16.155 1.00 0.00 C ATOM 2047 CD ARG A 65 9.871 20.916 -16.236 1.00 0.00 C ATOM 2048 NE ARG A 65 9.896 22.146 -15.406 1.00 0.00 N ATOM 2049 CZ ARG A 65 11.031 22.660 -15.031 1.00 0.00 C ATOM 2050 NH1 ARG A 65 12.150 22.042 -15.292 1.00 0.00 N ATOM 2051 NH2 ARG A 65 11.043 23.785 -14.375 1.00 0.00 N ATOM 0 H ARG A 65 7.652 17.907 -14.953 1.00 0.00 H new ATOM 0 HA ARG A 65 6.301 19.161 -17.104 1.00 0.00 H new ATOM 0 HB2 ARG A 65 9.208 18.326 -16.688 1.00 0.00 H new ATOM 0 HB3 ARG A 65 8.688 19.289 -18.056 1.00 0.00 H new ATOM 0 HG2 ARG A 65 7.730 20.996 -16.491 1.00 0.00 H new ATOM 0 HG3 ARG A 65 8.248 20.033 -15.122 1.00 0.00 H new ATOM 0 HD2 ARG A 65 10.625 20.211 -15.886 1.00 0.00 H new ATOM 0 HD3 ARG A 65 10.115 21.156 -17.271 1.00 0.00 H new ATOM 0 HE ARG A 65 9.021 22.590 -15.129 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.137 21.153 -15.792 1.00 0.00 H new ATOM 0 HH12 ARG A 65 13.038 22.448 -14.996 1.00 0.00 H new ATOM 0 HH21 ARG A 65 10.166 24.258 -14.158 1.00 0.00 H new ATOM 0 HH22 ARG A 65 11.930 24.193 -14.078 1.00 0.00 H new ATOM 2065 N ARG A 66 6.378 17.658 -19.139 1.00 0.00 N ATOM 2066 CA ARG A 66 6.220 16.665 -20.243 1.00 0.00 C ATOM 2067 C ARG A 66 6.760 17.265 -21.545 1.00 0.00 C ATOM 2068 O ARG A 66 6.084 17.147 -22.554 1.00 0.00 O ATOM 2069 CB ARG A 66 4.733 16.337 -20.413 1.00 0.00 C ATOM 2070 CG ARG A 66 4.575 15.026 -21.206 1.00 0.00 C ATOM 2071 CD ARG A 66 4.678 13.813 -20.256 1.00 0.00 C ATOM 2072 NE ARG A 66 5.380 12.686 -20.944 1.00 0.00 N ATOM 2073 CZ ARG A 66 5.075 12.344 -22.168 1.00 0.00 C ATOM 2074 NH1 ARG A 66 4.036 12.861 -22.762 1.00 0.00 N ATOM 2075 NH2 ARG A 66 5.786 11.438 -22.782 1.00 0.00 N ATOM 2076 OXT ARG A 66 7.840 17.831 -21.511 1.00 0.00 O ATOM 0 H ARG A 66 6.007 18.586 -19.342 1.00 0.00 H new ATOM 0 HA ARG A 66 6.772 15.756 -20.004 1.00 0.00 H new ATOM 0 HB2 ARG A 66 4.258 16.241 -19.436 1.00 0.00 H new ATOM 0 HB3 ARG A 66 4.229 17.151 -20.934 1.00 0.00 H new ATOM 0 HG2 ARG A 66 3.613 15.016 -21.718 1.00 0.00 H new ATOM 0 HG3 ARG A 66 5.345 14.962 -21.974 1.00 0.00 H new ATOM 0 HD2 ARG A 66 5.220 14.093 -19.352 1.00 0.00 H new ATOM 0 HD3 ARG A 66 3.682 13.497 -19.946 1.00 0.00 H new ATOM 0 HE ARG A 66 6.111 12.175 -20.449 1.00 0.00 H new ATOM 0 HH11 ARG A 66 3.453 13.539 -22.271 1.00 0.00 H new ATOM 0 HH12 ARG A 66 3.806 12.588 -23.717 1.00 0.00 H new ATOM 0 HH21 ARG A 66 6.575 11.001 -22.307 1.00 0.00 H new ATOM 0 HH22 ARG A 66 5.552 11.167 -23.737 1.00 0.00 H new TER 2090 ARG A 66 HETATM 2091 ZN ZN A 67 -12.014 2.553 2.160 1.00 0.00 ZN