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 -159:sc= 0.153 USER MOD Set 1.2: A 29 ASN : amide:sc= -6.73! C(o=-7.1!,f=-10!) USER MOD Set 1.3: C 125 DT C7 :methyl 150:sc= -0.522 (180deg=-0.309) USER MOD Set 2.1: A 12 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 14 THR OG1 : rot -152:sc= 1.28 USER MOD Single : A 1 LYS N :NH3+ -147:sc= -0.0489 (180deg=-0.767) USER MOD Single : A 1 LYS NZ :NH3+ 153:sc= -0.0977 (180deg=-0.707) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.00377 USER MOD Single : A 8 SER OG : rot 78:sc= -0.0534 USER MOD Single : A 9 ASN : amide:sc= -3.15! C(o=-3.2!,f=-5.2!) USER MOD Single : A 11 GLN : amide:sc= -0.371 X(o=-0.37,f=0) USER MOD Single : A 13 SER OG : rot 9:sc= 0.234 USER MOD Single : A 15 THR OG1 : rot -134:sc= 0.433 USER MOD Single : A 21 SER OG : rot 180:sc= -0.629 USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HD1:sc= -9.49! C(o=-9.5!,f=-8.3!) USER MOD Single : A 39 GLN : amide:sc= -0.0936 K(o=-0.094,f=-2.6!) USER MOD Single : A 41 ASN : amide:sc= -1.25 K(o=-1.3,f=-6.9!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl -166:sc= -1.6 (180deg=-2.02) USER MOD Single : A 48 LYS NZ :NH3+ -165:sc= -0.0232 (180deg=-0.327) USER MOD Single : A 52 GLN : amide:sc= -2.29! C(o=-2.3!,f=-5.4!) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.126 USER MOD Single : A 55 ASN : amide:sc= -0.517 X(o=-0.52,f=-0.02) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 143:sc= -0.031 (180deg=-0.252) USER MOD Single : A 64 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0828) USER MOD Single : B 101 DG O5' : rot 180:sc=-0.00635 USER MOD Single : B 102 DT C7 :methyl -30:sc= -1.12 (180deg=-1.74!) USER MOD Single : B 103 DT C7 :methyl -30:sc= -1.46 (180deg=-2.28!) USER MOD Single : B 109 DT C7 :methyl 150:sc= -2.93! (180deg=-2.93!) USER MOD Single : B 115 DT C7 :methyl -30:sc= -0.289 (180deg=-0.785) USER MOD Single : B 116 DT C7 :methyl 150:sc= -1.31 (180deg=-1.31) USER MOD Single : B 116 DT O3' : rot 180:sc= 0 USER MOD Single : C 117 DA O5' : rot 28:sc= -0.295 USER MOD Single : C 119 DT C7 :methyl -30:sc= -0.353 (180deg=-1.11) USER MOD Single : C 121 DT C7 :methyl 150:sc= -0.0882 (180deg=-0.0882) USER MOD Single : C 122 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : C 123 DT C7 :methyl -30:sc= -0.425 (180deg=-2.44) USER MOD Single : C 127 DT C7 :methyl -30:sc= -1.4 (180deg=-1.94!) USER MOD Single : C 132 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG B 101 19.634 25.004 2.210 1.00 0.00 O ATOM 2 C5' DG B 101 20.362 24.979 3.440 1.00 0.00 C ATOM 3 C4' DG B 101 19.559 24.309 4.561 1.00 0.00 C ATOM 4 O4' DG B 101 18.453 25.151 4.951 1.00 0.00 O ATOM 5 C3' DG B 101 18.991 22.950 4.132 1.00 0.00 C ATOM 6 O3' DG B 101 19.290 21.946 5.113 1.00 0.00 O ATOM 7 C2' DG B 101 17.498 23.160 4.024 1.00 0.00 C ATOM 8 C1' DG B 101 17.194 24.491 4.702 1.00 0.00 C ATOM 9 N9 DG B 101 16.330 25.343 3.862 1.00 0.00 N ATOM 10 C8 DG B 101 16.478 25.702 2.552 1.00 0.00 C ATOM 11 N7 DG B 101 15.561 26.496 2.090 1.00 0.00 N ATOM 12 C5 DG B 101 14.722 26.686 3.187 1.00 0.00 C ATOM 13 C6 DG B 101 13.539 27.461 3.303 1.00 0.00 C ATOM 14 O6 DG B 101 12.986 28.143 2.443 1.00 0.00 O ATOM 15 N1 DG B 101 13.002 27.383 4.581 1.00 0.00 N ATOM 16 C2 DG B 101 13.531 26.649 5.622 1.00 0.00 C ATOM 17 N2 DG B 101 12.876 26.716 6.784 1.00 0.00 N ATOM 18 N3 DG B 101 14.643 25.915 5.517 1.00 0.00 N ATOM 19 C4 DG B 101 15.184 25.981 4.276 1.00 0.00 C ATOM 0 H5' DG B 101 20.616 25.998 3.733 1.00 0.00 H new ATOM 0 H5'' DG B 101 21.301 24.445 3.296 1.00 0.00 H new ATOM 0 H4' DG B 101 20.247 24.158 5.393 1.00 0.00 H new ATOM 0 H3' DG B 101 19.422 22.607 3.192 1.00 0.00 H new ATOM 0 H2' DG B 101 17.184 23.176 2.980 1.00 0.00 H new ATOM 0 H2'' DG B 101 16.957 22.347 4.507 1.00 0.00 H new ATOM 0 HO5' DG B 101 20.175 25.439 1.518 1.00 0.00 H new ATOM 0 H1' DG B 101 16.656 24.312 5.633 1.00 0.00 H new ATOM 0 H8 DG B 101 17.299 25.350 1.945 1.00 0.00 H new ATOM 0 H1 DG B 101 12.148 27.910 4.765 1.00 0.00 H new ATOM 0 H21 DG B 101 13.217 26.196 7.592 1.00 0.00 H new ATOM 0 H22 DG B 101 12.035 27.287 6.863 1.00 0.00 H new ATOM 32 P DT B 102 18.771 20.428 4.928 1.00 0.00 P ATOM 33 OP1 DT B 102 19.741 19.525 5.588 1.00 0.00 O ATOM 34 OP2 DT B 102 18.430 20.226 3.503 1.00 0.00 O ATOM 35 O5' DT B 102 17.402 20.408 5.785 1.00 0.00 O ATOM 36 C5' DT B 102 17.440 20.635 7.196 1.00 0.00 C ATOM 37 C4' DT B 102 16.049 20.583 7.850 1.00 0.00 C ATOM 38 O4' DT B 102 15.257 21.735 7.473 1.00 0.00 O ATOM 39 C3' DT B 102 15.256 19.327 7.461 1.00 0.00 C ATOM 40 O3' DT B 102 15.046 18.495 8.605 1.00 0.00 O ATOM 41 C2' DT B 102 13.928 19.821 6.941 1.00 0.00 C ATOM 42 C1' DT B 102 13.912 21.331 7.129 1.00 0.00 C ATOM 43 N1 DT B 102 13.442 22.037 5.902 1.00 0.00 N ATOM 44 C2 DT B 102 12.314 22.843 5.998 1.00 0.00 C ATOM 45 O2 DT B 102 11.683 22.958 7.047 1.00 0.00 O ATOM 46 N3 DT B 102 11.939 23.510 4.846 1.00 0.00 N ATOM 47 C4 DT B 102 12.578 23.444 3.622 1.00 0.00 C ATOM 48 O4 DT B 102 12.157 24.084 2.661 1.00 0.00 O ATOM 49 C5 DT B 102 13.739 22.581 3.610 1.00 0.00 C ATOM 50 C7 DT B 102 14.532 22.431 2.307 1.00 0.00 C ATOM 51 C6 DT B 102 14.125 21.917 4.729 1.00 0.00 C ATOM 0 H5' DT B 102 17.891 21.608 7.390 1.00 0.00 H new ATOM 0 H5'' DT B 102 18.083 19.888 7.662 1.00 0.00 H new ATOM 0 H4' DT B 102 16.231 20.570 8.925 1.00 0.00 H new ATOM 0 H3' DT B 102 15.791 18.736 6.718 1.00 0.00 H new ATOM 0 H2' DT B 102 13.805 19.562 5.889 1.00 0.00 H new ATOM 0 H2'' DT B 102 13.104 19.356 7.483 1.00 0.00 H new ATOM 0 H1' DT B 102 13.212 21.599 7.921 1.00 0.00 H new ATOM 0 H3 DT B 102 11.114 24.106 4.905 1.00 0.00 H new ATOM 0 H71 DT B 102 13.862 22.556 1.457 1.00 0.00 H new ATOM 0 H72 DT B 102 15.314 23.190 2.267 1.00 0.00 H new ATOM 0 H73 DT B 102 14.986 21.441 2.269 1.00 0.00 H new ATOM 0 H6 DT B 102 14.995 21.278 4.689 1.00 0.00 H new ATOM 64 P DT B 103 14.236 17.106 8.478 1.00 0.00 P ATOM 65 OP1 DT B 103 14.665 16.216 9.580 1.00 0.00 O ATOM 66 OP2 DT B 103 14.326 16.644 7.076 1.00 0.00 O ATOM 67 O5' DT B 103 12.715 17.564 8.760 1.00 0.00 O ATOM 68 C5' DT B 103 12.379 18.163 10.015 1.00 0.00 C ATOM 69 C4' DT B 103 10.895 18.548 10.112 1.00 0.00 C ATOM 70 O4' DT B 103 10.608 19.676 9.250 1.00 0.00 O ATOM 71 C3' DT B 103 9.958 17.399 9.714 1.00 0.00 C ATOM 72 O3' DT B 103 9.106 17.061 10.808 1.00 0.00 O ATOM 73 C2' DT B 103 9.125 17.928 8.565 1.00 0.00 C ATOM 74 C1' DT B 103 9.412 19.426 8.481 1.00 0.00 C ATOM 75 N1 DT B 103 9.575 19.877 7.070 1.00 0.00 N ATOM 76 C2 DT B 103 8.709 20.848 6.582 1.00 0.00 C ATOM 77 O2 DT B 103 7.827 21.347 7.277 1.00 0.00 O ATOM 78 N3 DT B 103 8.901 21.225 5.267 1.00 0.00 N ATOM 79 C4 DT B 103 9.861 20.728 4.407 1.00 0.00 C ATOM 80 O4 DT B 103 9.932 21.126 3.250 1.00 0.00 O ATOM 81 C5 DT B 103 10.715 19.725 4.997 1.00 0.00 C ATOM 82 C7 DT B 103 11.802 19.079 4.134 1.00 0.00 C ATOM 83 C6 DT B 103 10.549 19.343 6.284 1.00 0.00 C ATOM 0 H5' DT B 103 12.991 19.053 10.163 1.00 0.00 H new ATOM 0 H5'' DT B 103 12.623 17.470 10.820 1.00 0.00 H new ATOM 0 H4' DT B 103 10.716 18.799 11.157 1.00 0.00 H new ATOM 0 H3' DT B 103 10.516 16.504 9.436 1.00 0.00 H new ATOM 0 H2' DT B 103 9.388 17.429 7.632 1.00 0.00 H new ATOM 0 H2'' DT B 103 8.064 17.744 8.737 1.00 0.00 H new ATOM 0 H1' DT B 103 8.572 19.992 8.883 1.00 0.00 H new ATOM 0 H3 DT B 103 8.274 21.939 4.896 1.00 0.00 H new ATOM 0 H71 DT B 103 11.477 19.059 3.094 1.00 0.00 H new ATOM 0 H72 DT B 103 12.722 19.657 4.215 1.00 0.00 H new ATOM 0 H73 DT B 103 11.982 18.060 4.478 1.00 0.00 H new ATOM 0 H6 DT B 103 11.207 18.594 6.699 1.00 0.00 H new ATOM 96 P DG B 104 8.182 15.750 10.751 1.00 0.00 P ATOM 97 OP1 DG B 104 7.871 15.347 12.140 1.00 0.00 O ATOM 98 OP2 DG B 104 8.806 14.779 9.823 1.00 0.00 O ATOM 99 O5' DG B 104 6.830 16.301 10.079 1.00 0.00 O ATOM 100 C5' DG B 104 6.078 17.338 10.712 1.00 0.00 C ATOM 101 C4' DG B 104 4.841 17.711 9.897 1.00 0.00 C ATOM 102 O4' DG B 104 5.230 18.392 8.679 1.00 0.00 O ATOM 103 C3' DG B 104 4.030 16.470 9.506 1.00 0.00 C ATOM 104 O3' DG B 104 2.660 16.634 9.879 1.00 0.00 O ATOM 105 C2' DG B 104 4.146 16.374 8.004 1.00 0.00 C ATOM 106 C1' DG B 104 4.716 17.701 7.517 1.00 0.00 C ATOM 107 N9 DG B 104 5.781 17.505 6.504 1.00 0.00 N ATOM 108 C8 DG B 104 6.874 16.686 6.545 1.00 0.00 C ATOM 109 N7 DG B 104 7.643 16.736 5.498 1.00 0.00 N ATOM 110 C5 DG B 104 7.009 17.666 4.676 1.00 0.00 C ATOM 111 C6 DG B 104 7.378 18.146 3.386 1.00 0.00 C ATOM 112 O6 DG B 104 8.355 17.839 2.705 1.00 0.00 O ATOM 113 N1 DG B 104 6.467 19.080 2.909 1.00 0.00 N ATOM 114 C2 DG B 104 5.341 19.503 3.582 1.00 0.00 C ATOM 115 N2 DG B 104 4.596 20.420 2.958 1.00 0.00 N ATOM 116 N3 DG B 104 4.988 19.056 4.795 1.00 0.00 N ATOM 117 C4 DG B 104 5.865 18.142 5.281 1.00 0.00 C ATOM 0 H5' DG B 104 6.708 18.218 10.842 1.00 0.00 H new ATOM 0 H5'' DG B 104 5.775 17.013 11.707 1.00 0.00 H new ATOM 0 H4' DG B 104 4.229 18.361 10.523 1.00 0.00 H new ATOM 0 H3' DG B 104 4.397 15.573 10.005 1.00 0.00 H new ATOM 0 H2' DG B 104 4.796 15.547 7.719 1.00 0.00 H new ATOM 0 H2'' DG B 104 3.172 16.184 7.553 1.00 0.00 H new ATOM 0 H1' DG B 104 3.937 18.286 7.027 1.00 0.00 H new ATOM 0 H8 DG B 104 7.084 16.043 7.387 1.00 0.00 H new ATOM 0 H1 DG B 104 6.645 19.484 1.990 1.00 0.00 H new ATOM 0 H21 DG B 104 3.749 20.776 3.401 1.00 0.00 H new ATOM 0 H22 DG B 104 4.874 20.764 2.039 1.00 0.00 H new ATOM 129 P DC B 105 1.570 15.482 9.589 1.00 0.00 P ATOM 130 OP1 DC B 105 0.458 15.637 10.553 1.00 0.00 O ATOM 131 OP2 DC B 105 2.283 14.190 9.485 1.00 0.00 O ATOM 132 O5' DC B 105 1.030 15.880 8.125 1.00 0.00 O ATOM 133 C5' DC B 105 0.417 17.156 7.940 1.00 0.00 C ATOM 134 C4' DC B 105 -0.050 17.402 6.502 1.00 0.00 C ATOM 135 O4' DC B 105 1.083 17.577 5.611 1.00 0.00 O ATOM 136 C3' DC B 105 -0.896 16.253 5.950 1.00 0.00 C ATOM 137 O3' DC B 105 -2.127 16.797 5.490 1.00 0.00 O ATOM 138 C2' DC B 105 -0.120 15.675 4.796 1.00 0.00 C ATOM 139 C1' DC B 105 0.975 16.682 4.476 1.00 0.00 C ATOM 140 N1 DC B 105 2.287 16.033 4.188 1.00 0.00 N ATOM 141 C2 DC B 105 2.920 16.338 2.985 1.00 0.00 C ATOM 142 O2 DC B 105 2.377 17.094 2.181 1.00 0.00 O ATOM 143 N3 DC B 105 4.140 15.790 2.737 1.00 0.00 N ATOM 144 C4 DC B 105 4.724 14.977 3.627 1.00 0.00 C ATOM 145 N4 DC B 105 5.912 14.445 3.345 1.00 0.00 N ATOM 146 C5 DC B 105 4.081 14.662 4.864 1.00 0.00 C ATOM 147 C6 DC B 105 2.871 15.207 5.097 1.00 0.00 C ATOM 0 H5' DC B 105 1.124 17.935 8.223 1.00 0.00 H new ATOM 0 H5'' DC B 105 -0.437 17.242 8.612 1.00 0.00 H new ATOM 0 H4' DC B 105 -0.658 18.306 6.543 1.00 0.00 H new ATOM 0 H3' DC B 105 -1.103 15.486 6.696 1.00 0.00 H new ATOM 0 H2' DC B 105 0.306 14.707 5.059 1.00 0.00 H new ATOM 0 H2'' DC B 105 -0.766 15.515 3.933 1.00 0.00 H new ATOM 0 H1' DC B 105 0.709 17.225 3.569 1.00 0.00 H new ATOM 0 H41 DC B 105 6.365 13.825 4.016 1.00 0.00 H new ATOM 0 H42 DC B 105 6.369 14.658 2.458 1.00 0.00 H new ATOM 0 H5 DC B 105 4.549 14.010 5.587 1.00 0.00 H new ATOM 0 H6 DC B 105 2.357 14.984 6.020 1.00 0.00 H new ATOM 159 P DA B 106 -3.289 15.905 4.838 1.00 0.00 P ATOM 160 OP1 DA B 106 -4.594 16.501 5.203 1.00 0.00 O ATOM 161 OP2 DA B 106 -3.011 14.482 5.141 1.00 0.00 O ATOM 162 O5' DA B 106 -3.039 16.146 3.266 1.00 0.00 O ATOM 163 C5' DA B 106 -3.097 17.480 2.750 1.00 0.00 C ATOM 164 C4' DA B 106 -2.837 17.538 1.242 1.00 0.00 C ATOM 165 O4' DA B 106 -1.452 17.236 0.935 1.00 0.00 O ATOM 166 C3' DA B 106 -3.717 16.542 0.486 1.00 0.00 C ATOM 167 O3' DA B 106 -4.515 17.229 -0.465 1.00 0.00 O ATOM 168 C2' DA B 106 -2.773 15.605 -0.232 1.00 0.00 C ATOM 169 C1' DA B 106 -1.361 16.139 -0.009 1.00 0.00 C ATOM 170 N9 DA B 106 -0.488 15.082 0.509 1.00 0.00 N ATOM 171 C8 DA B 106 -0.677 14.322 1.601 1.00 0.00 C ATOM 172 N7 DA B 106 0.243 13.439 1.839 1.00 0.00 N ATOM 173 C5 DA B 106 1.132 13.631 0.785 1.00 0.00 C ATOM 174 C6 DA B 106 2.332 13.007 0.434 1.00 0.00 C ATOM 175 N6 DA B 106 2.854 11.997 1.128 1.00 0.00 N ATOM 176 N1 DA B 106 2.955 13.445 -0.673 1.00 0.00 N ATOM 177 C2 DA B 106 2.428 14.437 -1.393 1.00 0.00 C ATOM 178 N3 DA B 106 1.295 15.094 -1.149 1.00 0.00 N ATOM 179 C4 DA B 106 0.695 14.634 -0.034 1.00 0.00 C ATOM 0 H5' DA B 106 -2.362 18.098 3.266 1.00 0.00 H new ATOM 0 H5'' DA B 106 -4.077 17.906 2.963 1.00 0.00 H new ATOM 0 H4' DA B 106 -3.074 18.554 0.927 1.00 0.00 H new ATOM 0 H3' DA B 106 -4.381 16.005 1.164 1.00 0.00 H new ATOM 0 H2' DA B 106 -2.868 14.591 0.155 1.00 0.00 H new ATOM 0 H2'' DA B 106 -3.006 15.563 -1.296 1.00 0.00 H new ATOM 0 H1' DA B 106 -0.931 16.484 -0.949 1.00 0.00 H new ATOM 0 H8 DA B 106 -1.540 14.439 2.240 1.00 0.00 H new ATOM 0 H61 DA B 106 3.734 11.575 0.831 1.00 0.00 H new ATOM 0 H62 DA B 106 2.374 11.646 1.957 1.00 0.00 H new ATOM 0 H2 DA B 106 2.981 14.741 -2.270 1.00 0.00 H new ATOM 191 P DG B 107 -5.537 16.426 -1.402 1.00 0.00 P ATOM 192 OP1 DG B 107 -6.554 17.373 -1.910 1.00 0.00 O ATOM 193 OP2 DG B 107 -5.951 15.190 -0.701 1.00 0.00 O ATOM 194 O5' DG B 107 -4.561 16.024 -2.608 1.00 0.00 O ATOM 195 C5' DG B 107 -3.914 17.044 -3.361 1.00 0.00 C ATOM 196 C4' DG B 107 -2.984 16.458 -4.420 1.00 0.00 C ATOM 197 O4' DG B 107 -1.813 15.839 -3.811 1.00 0.00 O ATOM 198 C3' DG B 107 -3.687 15.390 -5.259 1.00 0.00 C ATOM 199 O3' DG B 107 -3.678 15.796 -6.626 1.00 0.00 O ATOM 200 C2' DG B 107 -2.880 14.129 -5.076 1.00 0.00 C ATOM 201 C1' DG B 107 -1.578 14.546 -4.420 1.00 0.00 C ATOM 202 N9 DG B 107 -1.096 13.536 -3.437 1.00 0.00 N ATOM 203 C8 DG B 107 -1.682 13.085 -2.280 1.00 0.00 C ATOM 204 N7 DG B 107 -0.994 12.219 -1.616 1.00 0.00 N ATOM 205 C5 DG B 107 0.153 12.059 -2.377 1.00 0.00 C ATOM 206 C6 DG B 107 1.271 11.225 -2.142 1.00 0.00 C ATOM 207 O6 DG B 107 1.463 10.475 -1.193 1.00 0.00 O ATOM 208 N1 DG B 107 2.219 11.341 -3.148 1.00 0.00 N ATOM 209 C2 DG B 107 2.110 12.164 -4.245 1.00 0.00 C ATOM 210 N2 DG B 107 3.139 12.140 -5.097 1.00 0.00 N ATOM 211 N3 DG B 107 1.052 12.962 -4.473 1.00 0.00 N ATOM 212 C4 DG B 107 0.111 12.856 -3.497 1.00 0.00 C ATOM 0 H5' DG B 107 -3.343 17.686 -2.690 1.00 0.00 H new ATOM 0 H5'' DG B 107 -4.663 17.673 -3.842 1.00 0.00 H new ATOM 0 H4' DG B 107 -2.684 17.292 -5.055 1.00 0.00 H new ATOM 0 H3' DG B 107 -4.724 15.238 -4.960 1.00 0.00 H new ATOM 0 H2' DG B 107 -3.416 13.412 -4.454 1.00 0.00 H new ATOM 0 H2'' DG B 107 -2.694 13.644 -6.034 1.00 0.00 H new ATOM 0 H1' DG B 107 -0.781 14.615 -5.160 1.00 0.00 H new ATOM 0 H8 DG B 107 -2.650 13.431 -1.949 1.00 0.00 H new ATOM 0 H1 DG B 107 3.062 10.772 -3.068 1.00 0.00 H new ATOM 0 H21 DG B 107 3.124 12.726 -5.932 1.00 0.00 H new ATOM 0 H22 DG B 107 3.940 11.536 -4.913 1.00 0.00 H new ATOM 224 P DA B 108 -4.335 14.903 -7.788 1.00 0.00 P ATOM 225 OP1 DA B 108 -4.895 15.810 -8.815 1.00 0.00 O ATOM 226 OP2 DA B 108 -5.198 13.878 -7.157 1.00 0.00 O ATOM 227 O5' DA B 108 -3.039 14.174 -8.408 1.00 0.00 O ATOM 228 C5' DA B 108 -1.997 14.983 -8.960 1.00 0.00 C ATOM 229 C4' DA B 108 -0.821 14.163 -9.515 1.00 0.00 C ATOM 230 O4' DA B 108 -0.060 13.541 -8.444 1.00 0.00 O ATOM 231 C3' DA B 108 -1.293 13.049 -10.453 1.00 0.00 C ATOM 232 O3' DA B 108 -0.596 13.146 -11.699 1.00 0.00 O ATOM 233 C2' DA B 108 -0.951 11.758 -9.754 1.00 0.00 C ATOM 234 C1' DA B 108 0.041 12.111 -8.665 1.00 0.00 C ATOM 235 N9 DA B 108 -0.227 11.358 -7.422 1.00 0.00 N ATOM 236 C8 DA B 108 -1.358 11.342 -6.656 1.00 0.00 C ATOM 237 N7 DA B 108 -1.265 10.685 -5.545 1.00 0.00 N ATOM 238 C5 DA B 108 0.040 10.207 -5.571 1.00 0.00 C ATOM 239 C6 DA B 108 0.770 9.429 -4.675 1.00 0.00 C ATOM 240 N6 DA B 108 0.292 9.053 -3.502 1.00 0.00 N ATOM 241 N1 DA B 108 2.029 9.115 -5.000 1.00 0.00 N ATOM 242 C2 DA B 108 2.555 9.550 -6.139 1.00 0.00 C ATOM 243 N3 DA B 108 1.957 10.308 -7.062 1.00 0.00 N ATOM 244 C4 DA B 108 0.683 10.601 -6.708 1.00 0.00 C ATOM 0 H5' DA B 108 -1.627 15.662 -8.191 1.00 0.00 H new ATOM 0 H5'' DA B 108 -2.410 15.600 -9.758 1.00 0.00 H new ATOM 0 H4' DA B 108 -0.198 14.868 -10.065 1.00 0.00 H new ATOM 0 H3' DA B 108 -2.360 13.113 -10.668 1.00 0.00 H new ATOM 0 H2' DA B 108 -1.844 11.297 -9.332 1.00 0.00 H new ATOM 0 H2'' DA B 108 -0.522 11.040 -10.453 1.00 0.00 H new ATOM 0 H1' DA B 108 1.051 11.840 -8.971 1.00 0.00 H new ATOM 0 H8 DA B 108 -2.266 11.843 -6.957 1.00 0.00 H new ATOM 0 H61 DA B 108 0.863 8.483 -2.878 1.00 0.00 H new ATOM 0 H62 DA B 108 -0.648 9.333 -3.221 1.00 0.00 H new ATOM 0 H2 DA B 108 3.576 9.260 -6.341 1.00 0.00 H new ATOM 256 P DT B 109 -0.865 12.116 -12.906 1.00 0.00 P ATOM 257 OP1 DT B 109 -0.731 12.854 -14.181 1.00 0.00 O ATOM 258 OP2 DT B 109 -2.113 11.376 -12.611 1.00 0.00 O ATOM 259 O5' DT B 109 0.366 11.079 -12.793 1.00 0.00 O ATOM 260 C5' DT B 109 1.709 11.561 -12.913 1.00 0.00 C ATOM 261 C4' DT B 109 2.753 10.445 -12.781 1.00 0.00 C ATOM 262 O4' DT B 109 2.814 9.960 -11.416 1.00 0.00 O ATOM 263 C3' DT B 109 2.434 9.251 -13.696 1.00 0.00 C ATOM 264 O3' DT B 109 3.498 9.035 -14.617 1.00 0.00 O ATOM 265 C2' DT B 109 2.315 8.051 -12.781 1.00 0.00 C ATOM 266 C1' DT B 109 2.708 8.520 -11.383 1.00 0.00 C ATOM 267 N1 DT B 109 1.703 8.086 -10.377 1.00 0.00 N ATOM 268 C2 DT B 109 2.115 7.270 -9.331 1.00 0.00 C ATOM 269 O2 DT B 109 3.276 6.881 -9.224 1.00 0.00 O ATOM 270 N3 DT B 109 1.139 6.917 -8.419 1.00 0.00 N ATOM 271 C4 DT B 109 -0.187 7.301 -8.454 1.00 0.00 C ATOM 272 O4 DT B 109 -0.966 6.936 -7.581 1.00 0.00 O ATOM 273 C5 DT B 109 -0.526 8.145 -9.573 1.00 0.00 C ATOM 274 C7 DT B 109 -1.969 8.635 -9.712 1.00 0.00 C ATOM 275 C6 DT B 109 0.411 8.501 -10.482 1.00 0.00 C ATOM 0 H5' DT B 109 1.890 12.315 -12.147 1.00 0.00 H new ATOM 0 H5'' DT B 109 1.829 12.053 -13.878 1.00 0.00 H new ATOM 0 H4' DT B 109 3.709 10.878 -13.075 1.00 0.00 H new ATOM 0 H3' DT B 109 1.524 9.425 -14.270 1.00 0.00 H new ATOM 0 H2' DT B 109 1.297 7.661 -12.786 1.00 0.00 H new ATOM 0 H2'' DT B 109 2.967 7.244 -13.115 1.00 0.00 H new ATOM 0 H1' DT B 109 3.661 8.079 -11.092 1.00 0.00 H new ATOM 0 H3 DT B 109 1.425 6.316 -7.646 1.00 0.00 H new ATOM 0 H71 DT B 109 -1.978 9.605 -10.209 1.00 0.00 H new ATOM 0 H72 DT B 109 -2.541 7.920 -10.303 1.00 0.00 H new ATOM 0 H73 DT B 109 -2.418 8.730 -8.723 1.00 0.00 H new ATOM 0 H6 DT B 109 0.126 9.131 -11.312 1.00 0.00 H new ATOM 288 P DA B 110 3.359 7.968 -15.815 1.00 0.00 P ATOM 289 OP1 DA B 110 4.332 8.324 -16.872 1.00 0.00 O ATOM 290 OP2 DA B 110 1.923 7.832 -16.148 1.00 0.00 O ATOM 291 O5' DA B 110 3.845 6.609 -15.100 1.00 0.00 O ATOM 292 C5' DA B 110 5.162 6.531 -14.559 1.00 0.00 C ATOM 293 C4' DA B 110 5.458 5.175 -13.916 1.00 0.00 C ATOM 294 O4' DA B 110 4.606 4.983 -12.753 1.00 0.00 O ATOM 295 C3' DA B 110 5.194 4.006 -14.863 1.00 0.00 C ATOM 296 O3' DA B 110 6.293 3.092 -14.784 1.00 0.00 O ATOM 297 C2' DA B 110 3.926 3.355 -14.373 1.00 0.00 C ATOM 298 C1' DA B 110 3.681 3.884 -12.970 1.00 0.00 C ATOM 299 N9 DA B 110 2.275 4.323 -12.798 1.00 0.00 N ATOM 300 C8 DA B 110 1.516 5.127 -13.605 1.00 0.00 C ATOM 301 N7 DA B 110 0.296 5.316 -13.205 1.00 0.00 N ATOM 302 C5 DA B 110 0.231 4.579 -12.025 1.00 0.00 C ATOM 303 C6 DA B 110 -0.799 4.365 -11.103 1.00 0.00 C ATOM 304 N6 DA B 110 -2.016 4.891 -11.241 1.00 0.00 N ATOM 305 N1 DA B 110 -0.530 3.585 -10.041 1.00 0.00 N ATOM 306 C2 DA B 110 0.684 3.048 -9.895 1.00 0.00 C ATOM 307 N3 DA B 110 1.728 3.186 -10.711 1.00 0.00 N ATOM 308 C4 DA B 110 1.428 3.973 -11.766 1.00 0.00 C ATOM 0 H5' DA B 110 5.292 7.317 -13.815 1.00 0.00 H new ATOM 0 H5'' DA B 110 5.887 6.719 -15.351 1.00 0.00 H new ATOM 0 H4' DA B 110 6.515 5.187 -13.649 1.00 0.00 H new ATOM 0 H3' DA B 110 5.091 4.323 -15.901 1.00 0.00 H new ATOM 0 H2' DA B 110 3.089 3.594 -15.029 1.00 0.00 H new ATOM 0 H2'' DA B 110 4.025 2.270 -14.366 1.00 0.00 H new ATOM 0 H1' DA B 110 3.849 3.097 -12.235 1.00 0.00 H new ATOM 0 H8 DA B 110 1.904 5.572 -14.509 1.00 0.00 H new ATOM 0 H61 DA B 110 -2.734 4.705 -10.541 1.00 0.00 H new ATOM 0 H62 DA B 110 -2.229 5.479 -12.047 1.00 0.00 H new ATOM 0 H2 DA B 110 0.836 2.435 -9.019 1.00 0.00 H new ATOM 320 P DA B 111 6.344 1.741 -15.653 1.00 0.00 P ATOM 321 OP1 DA B 111 7.756 1.472 -16.010 1.00 0.00 O ATOM 322 OP2 DA B 111 5.316 1.828 -16.713 1.00 0.00 O ATOM 323 O5' DA B 111 5.877 0.641 -14.573 1.00 0.00 O ATOM 324 C5' DA B 111 6.647 0.461 -13.378 1.00 0.00 C ATOM 325 C4' DA B 111 5.959 -0.465 -12.369 1.00 0.00 C ATOM 326 O4' DA B 111 4.690 0.099 -11.956 1.00 0.00 O ATOM 327 C3' DA B 111 5.698 -1.863 -12.944 1.00 0.00 C ATOM 328 O3' DA B 111 6.372 -2.849 -12.164 1.00 0.00 O ATOM 329 C2' DA B 111 4.201 -2.072 -12.843 1.00 0.00 C ATOM 330 C1' DA B 111 3.634 -0.877 -12.086 1.00 0.00 C ATOM 331 N9 DA B 111 2.473 -0.314 -12.806 1.00 0.00 N ATOM 332 C8 DA B 111 2.409 0.163 -14.079 1.00 0.00 C ATOM 333 N7 DA B 111 1.235 0.573 -14.457 1.00 0.00 N ATOM 334 C5 DA B 111 0.446 0.348 -13.331 1.00 0.00 C ATOM 335 C6 DA B 111 -0.911 0.565 -13.065 1.00 0.00 C ATOM 336 N6 DA B 111 -1.759 1.073 -13.959 1.00 0.00 N ATOM 337 N1 DA B 111 -1.363 0.229 -11.845 1.00 0.00 N ATOM 338 C2 DA B 111 -0.533 -0.288 -10.941 1.00 0.00 C ATOM 339 N3 DA B 111 0.764 -0.536 -11.089 1.00 0.00 N ATOM 340 C4 DA B 111 1.191 -0.191 -12.321 1.00 0.00 C ATOM 0 H5' DA B 111 6.823 1.431 -12.914 1.00 0.00 H new ATOM 0 H5'' DA B 111 7.623 0.050 -13.637 1.00 0.00 H new ATOM 0 H4' DA B 111 6.636 -0.558 -11.520 1.00 0.00 H new ATOM 0 H3' DA B 111 6.057 -1.948 -13.970 1.00 0.00 H new ATOM 0 H2' DA B 111 3.754 -2.148 -13.834 1.00 0.00 H new ATOM 0 H2'' DA B 111 3.976 -3.002 -12.320 1.00 0.00 H new ATOM 0 H1' DA B 111 3.283 -1.178 -11.099 1.00 0.00 H new ATOM 0 H8 DA B 111 3.271 0.198 -14.728 1.00 0.00 H new ATOM 0 H61 DA B 111 -2.739 1.210 -13.712 1.00 0.00 H new ATOM 0 H62 DA B 111 -1.428 1.324 -14.890 1.00 0.00 H new ATOM 0 H2 DA B 111 -0.962 -0.533 -9.981 1.00 0.00 H new ATOM 352 P DA B 112 6.333 -4.408 -12.566 1.00 0.00 P ATOM 353 OP1 DA B 112 7.484 -5.081 -11.928 1.00 0.00 O ATOM 354 OP2 DA B 112 6.133 -4.508 -14.030 1.00 0.00 O ATOM 355 O5' DA B 112 4.990 -4.906 -11.834 1.00 0.00 O ATOM 356 C5' DA B 112 4.880 -4.791 -10.418 1.00 0.00 C ATOM 357 C4' DA B 112 3.508 -5.229 -9.903 1.00 0.00 C ATOM 358 O4' DA B 112 2.495 -4.315 -10.394 1.00 0.00 O ATOM 359 C3' DA B 112 3.118 -6.637 -10.382 1.00 0.00 C ATOM 360 O3' DA B 112 2.599 -7.409 -9.285 1.00 0.00 O ATOM 361 C2' DA B 112 2.055 -6.427 -11.419 1.00 0.00 C ATOM 362 C1' DA B 112 1.517 -5.027 -11.186 1.00 0.00 C ATOM 363 N9 DA B 112 1.238 -4.339 -12.463 1.00 0.00 N ATOM 364 C8 DA B 112 2.023 -4.209 -13.576 1.00 0.00 C ATOM 365 N7 DA B 112 1.478 -3.559 -14.560 1.00 0.00 N ATOM 366 C5 DA B 112 0.221 -3.228 -14.061 1.00 0.00 C ATOM 367 C6 DA B 112 -0.862 -2.535 -14.608 1.00 0.00 C ATOM 368 N6 DA B 112 -0.854 -2.032 -15.843 1.00 0.00 N ATOM 369 N1 DA B 112 -1.955 -2.389 -13.838 1.00 0.00 N ATOM 370 C2 DA B 112 -1.979 -2.896 -12.604 1.00 0.00 C ATOM 371 N3 DA B 112 -1.010 -3.567 -11.994 1.00 0.00 N ATOM 372 C4 DA B 112 0.069 -3.697 -12.787 1.00 0.00 C ATOM 0 H5' DA B 112 5.062 -3.757 -10.125 1.00 0.00 H new ATOM 0 H5'' DA B 112 5.653 -5.397 -9.946 1.00 0.00 H new ATOM 0 H4' DA B 112 3.569 -5.230 -8.815 1.00 0.00 H new ATOM 0 H3' DA B 112 3.973 -7.181 -10.783 1.00 0.00 H new ATOM 0 H2' DA B 112 2.465 -6.526 -12.424 1.00 0.00 H new ATOM 0 H2'' DA B 112 1.264 -7.170 -11.323 1.00 0.00 H new ATOM 0 H1' DA B 112 0.566 -5.067 -10.655 1.00 0.00 H new ATOM 0 H8 DA B 112 3.022 -4.616 -13.632 1.00 0.00 H new ATOM 0 H61 DA B 112 -1.671 -1.534 -16.196 1.00 0.00 H new ATOM 0 H62 DA B 112 -0.031 -2.146 -16.435 1.00 0.00 H new ATOM 0 H2 DA B 112 -2.887 -2.744 -12.039 1.00 0.00 H new ATOM 384 P DC B 113 2.108 -8.933 -9.493 1.00 0.00 P ATOM 385 OP1 DC B 113 2.433 -9.692 -8.265 1.00 0.00 O ATOM 386 OP2 DC B 113 2.618 -9.403 -10.802 1.00 0.00 O ATOM 387 O5' DC B 113 0.491 -8.814 -9.602 1.00 0.00 O ATOM 388 C5' DC B 113 -0.270 -8.306 -8.493 1.00 0.00 C ATOM 389 C4' DC B 113 -1.790 -8.260 -8.764 1.00 0.00 C ATOM 390 O4' DC B 113 -2.119 -7.222 -9.716 1.00 0.00 O ATOM 391 C3' DC B 113 -2.327 -9.593 -9.311 1.00 0.00 C ATOM 392 O3' DC B 113 -3.385 -10.102 -8.492 1.00 0.00 O ATOM 393 C2' DC B 113 -2.891 -9.269 -10.675 1.00 0.00 C ATOM 394 C1' DC B 113 -2.931 -7.756 -10.786 1.00 0.00 C ATOM 395 N1 DC B 113 -2.425 -7.277 -12.094 1.00 0.00 N ATOM 396 C2 DC B 113 -3.260 -6.489 -12.881 1.00 0.00 C ATOM 397 O2 DC B 113 -4.418 -6.279 -12.528 1.00 0.00 O ATOM 398 N3 DC B 113 -2.757 -5.961 -14.028 1.00 0.00 N ATOM 399 C4 DC B 113 -1.488 -6.192 -14.392 1.00 0.00 C ATOM 400 N4 DC B 113 -1.026 -5.654 -15.520 1.00 0.00 N ATOM 401 C5 DC B 113 -0.628 -7.007 -13.584 1.00 0.00 C ATOM 402 C6 DC B 113 -1.146 -7.530 -12.456 1.00 0.00 C ATOM 0 H5' DC B 113 0.079 -7.302 -8.251 1.00 0.00 H new ATOM 0 H5'' DC B 113 -0.083 -8.928 -7.618 1.00 0.00 H new ATOM 0 H4' DC B 113 -2.258 -8.054 -7.801 1.00 0.00 H new ATOM 0 H3' DC B 113 -1.537 -10.344 -9.337 1.00 0.00 H new ATOM 0 H2' DC B 113 -2.270 -9.698 -11.462 1.00 0.00 H new ATOM 0 H2'' DC B 113 -3.889 -9.691 -10.791 1.00 0.00 H new ATOM 0 H1' DC B 113 -3.964 -7.418 -10.709 1.00 0.00 H new ATOM 0 H41 DC B 113 -0.062 -5.822 -15.808 1.00 0.00 H new ATOM 0 H42 DC B 113 -1.636 -5.074 -16.096 1.00 0.00 H new ATOM 0 H5 DC B 113 0.397 -7.194 -13.869 1.00 0.00 H new ATOM 0 H6 DC B 113 -0.531 -8.161 -11.831 1.00 0.00 H new ATOM 414 P DA B 114 -4.082 -11.513 -8.853 1.00 0.00 P ATOM 415 OP1 DA B 114 -4.686 -12.061 -7.619 1.00 0.00 O ATOM 416 OP2 DA B 114 -3.109 -12.325 -9.619 1.00 0.00 O ATOM 417 O5' DA B 114 -5.278 -11.086 -9.855 1.00 0.00 O ATOM 418 C5' DA B 114 -6.337 -10.222 -9.429 1.00 0.00 C ATOM 419 C4' DA B 114 -7.353 -9.961 -10.553 1.00 0.00 C ATOM 420 O4' DA B 114 -6.778 -9.113 -11.581 1.00 0.00 O ATOM 421 C3' DA B 114 -7.831 -11.256 -11.222 1.00 0.00 C ATOM 422 O3' DA B 114 -9.252 -11.368 -11.107 1.00 0.00 O ATOM 423 C2' DA B 114 -7.446 -11.127 -12.678 1.00 0.00 C ATOM 424 C1' DA B 114 -6.994 -9.689 -12.890 1.00 0.00 C ATOM 425 N9 DA B 114 -5.770 -9.614 -13.714 1.00 0.00 N ATOM 426 C8 DA B 114 -4.553 -10.150 -13.468 1.00 0.00 C ATOM 427 N7 DA B 114 -3.641 -9.904 -14.359 1.00 0.00 N ATOM 428 C5 DA B 114 -4.321 -9.126 -15.293 1.00 0.00 C ATOM 429 C6 DA B 114 -3.926 -8.527 -16.495 1.00 0.00 C ATOM 430 N6 DA B 114 -2.691 -8.616 -16.988 1.00 0.00 N ATOM 431 N1 DA B 114 -4.854 -7.827 -17.168 1.00 0.00 N ATOM 432 C2 DA B 114 -6.094 -7.721 -16.691 1.00 0.00 C ATOM 433 N3 DA B 114 -6.571 -8.247 -15.566 1.00 0.00 N ATOM 434 C4 DA B 114 -5.621 -8.943 -14.910 1.00 0.00 C ATOM 0 H5' DA B 114 -5.918 -9.274 -9.091 1.00 0.00 H new ATOM 0 H5'' DA B 114 -6.847 -10.667 -8.575 1.00 0.00 H new ATOM 0 H4' DA B 114 -8.204 -9.470 -10.081 1.00 0.00 H new ATOM 0 H3' DA B 114 -7.388 -12.138 -10.759 1.00 0.00 H new ATOM 0 H2' DA B 114 -6.647 -11.824 -12.929 1.00 0.00 H new ATOM 0 H2'' DA B 114 -8.291 -11.365 -13.324 1.00 0.00 H new ATOM 0 H1' DA B 114 -7.757 -9.134 -13.435 1.00 0.00 H new ATOM 0 H8 DA B 114 -4.353 -10.744 -12.588 1.00 0.00 H new ATOM 0 H61 DA B 114 -2.460 -8.158 -17.870 1.00 0.00 H new ATOM 0 H62 DA B 114 -1.977 -9.142 -16.484 1.00 0.00 H new ATOM 0 H2 DA B 114 -6.789 -7.144 -17.284 1.00 0.00 H new ATOM 446 P DT B 115 -10.050 -12.628 -11.717 1.00 0.00 P ATOM 447 OP1 DT B 115 -11.322 -12.773 -10.974 1.00 0.00 O ATOM 448 OP2 DT B 115 -9.116 -13.771 -11.812 1.00 0.00 O ATOM 449 O5' DT B 115 -10.389 -12.130 -13.210 1.00 0.00 O ATOM 450 C5' DT B 115 -11.177 -10.957 -13.408 1.00 0.00 C ATOM 451 C4' DT B 115 -11.229 -10.539 -14.881 1.00 0.00 C ATOM 452 O4' DT B 115 -9.935 -10.050 -15.309 1.00 0.00 O ATOM 453 C3' DT B 115 -11.616 -11.705 -15.803 1.00 0.00 C ATOM 454 O3' DT B 115 -12.860 -11.441 -16.452 1.00 0.00 O ATOM 455 C2' DT B 115 -10.516 -11.779 -16.841 1.00 0.00 C ATOM 456 C1' DT B 115 -9.640 -10.547 -16.629 1.00 0.00 C ATOM 457 N1 DT B 115 -8.186 -10.853 -16.796 1.00 0.00 N ATOM 458 C2 DT B 115 -7.476 -10.150 -17.763 1.00 0.00 C ATOM 459 O2 DT B 115 -8.007 -9.297 -18.470 1.00 0.00 O ATOM 460 N3 DT B 115 -6.136 -10.460 -17.882 1.00 0.00 N ATOM 461 C4 DT B 115 -5.443 -11.395 -17.141 1.00 0.00 C ATOM 462 O4 DT B 115 -4.242 -11.581 -17.334 1.00 0.00 O ATOM 463 C5 DT B 115 -6.251 -12.082 -16.162 1.00 0.00 C ATOM 464 C7 DT B 115 -5.601 -13.158 -15.289 1.00 0.00 C ATOM 465 C6 DT B 115 -7.570 -11.794 -16.021 1.00 0.00 C ATOM 0 H5' DT B 115 -10.766 -10.140 -12.814 1.00 0.00 H new ATOM 0 H5'' DT B 115 -12.190 -11.136 -13.046 1.00 0.00 H new ATOM 0 H4' DT B 115 -11.987 -9.760 -14.955 1.00 0.00 H new ATOM 0 H3' DT B 115 -11.727 -12.634 -15.243 1.00 0.00 H new ATOM 0 H2' DT B 115 -9.934 -12.694 -16.726 1.00 0.00 H new ATOM 0 H2'' DT B 115 -10.933 -11.791 -17.848 1.00 0.00 H new ATOM 0 H1' DT B 115 -9.860 -9.791 -17.383 1.00 0.00 H new ATOM 0 H3 DT B 115 -5.606 -9.947 -18.587 1.00 0.00 H new ATOM 0 H71 DT B 115 -4.789 -13.632 -15.840 1.00 0.00 H new ATOM 0 H72 DT B 115 -5.205 -12.701 -14.382 1.00 0.00 H new ATOM 0 H73 DT B 115 -6.345 -13.909 -15.022 1.00 0.00 H new ATOM 0 H6 DT B 115 -8.147 -12.323 -15.277 1.00 0.00 H new ATOM 478 P DT B 116 -13.560 -12.563 -17.369 1.00 0.00 P ATOM 479 OP1 DT B 116 -15.013 -12.284 -17.414 1.00 0.00 O ATOM 480 OP2 DT B 116 -13.078 -13.891 -16.925 1.00 0.00 O ATOM 481 O5' DT B 116 -12.940 -12.262 -18.824 1.00 0.00 O ATOM 482 C5' DT B 116 -13.245 -11.046 -19.507 1.00 0.00 C ATOM 483 C4' DT B 116 -12.499 -10.940 -20.844 1.00 0.00 C ATOM 484 O4' DT B 116 -11.067 -10.897 -20.620 1.00 0.00 O ATOM 485 C3' DT B 116 -12.798 -12.126 -21.776 1.00 0.00 C ATOM 486 O3' DT B 116 -13.478 -11.686 -22.955 1.00 0.00 O ATOM 487 C2' DT B 116 -11.451 -12.715 -22.140 1.00 0.00 C ATOM 488 C1' DT B 116 -10.392 -11.820 -21.502 1.00 0.00 C ATOM 489 N1 DT B 116 -9.385 -12.633 -20.766 1.00 0.00 N ATOM 490 C2 DT B 116 -8.064 -12.582 -21.189 1.00 0.00 C ATOM 491 O2 DT B 116 -7.708 -11.885 -22.137 1.00 0.00 O ATOM 492 N3 DT B 116 -7.169 -13.358 -20.481 1.00 0.00 N ATOM 493 C4 DT B 116 -7.466 -14.169 -19.400 1.00 0.00 C ATOM 494 O4 DT B 116 -6.583 -14.817 -18.841 1.00 0.00 O ATOM 495 C5 DT B 116 -8.862 -14.162 -19.027 1.00 0.00 C ATOM 496 C7 DT B 116 -9.313 -15.010 -17.833 1.00 0.00 C ATOM 497 C6 DT B 116 -9.759 -13.411 -19.710 1.00 0.00 C ATOM 0 H5' DT B 116 -12.980 -10.198 -18.875 1.00 0.00 H new ATOM 0 H5'' DT B 116 -14.319 -10.988 -19.685 1.00 0.00 H new ATOM 0 H4' DT B 116 -12.846 -10.022 -21.319 1.00 0.00 H new ATOM 0 H3' DT B 116 -13.443 -12.858 -21.290 1.00 0.00 H new ATOM 0 H2' DT B 116 -11.365 -13.738 -21.774 1.00 0.00 H new ATOM 0 H2'' DT B 116 -11.325 -12.752 -23.222 1.00 0.00 H new ATOM 0 HO3' DT B 116 -13.657 -12.455 -23.535 1.00 0.00 H new ATOM 0 H1' DT B 116 -9.850 -11.268 -22.270 1.00 0.00 H new ATOM 0 H3 DT B 116 -6.195 -13.331 -20.784 1.00 0.00 H new ATOM 0 H71 DT B 116 -10.171 -14.538 -17.355 1.00 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1.00 0.00 C ATOM 650 N1 DT C 121 -7.169 -1.545 -14.306 1.00 0.00 N ATOM 651 C2 DT C 121 -6.024 -2.218 -13.902 1.00 0.00 C ATOM 652 O2 DT C 121 -6.064 -3.152 -13.106 1.00 0.00 O ATOM 653 N3 DT C 121 -4.832 -1.774 -14.443 1.00 0.00 N ATOM 654 C4 DT C 121 -4.680 -0.734 -15.336 1.00 0.00 C ATOM 655 O4 DT C 121 -3.565 -0.418 -15.750 1.00 0.00 O ATOM 656 C5 DT C 121 -5.920 -0.093 -15.701 1.00 0.00 C ATOM 657 C7 DT C 121 -5.900 1.091 -16.659 1.00 0.00 C ATOM 658 C6 DT C 121 -7.096 -0.506 -15.194 1.00 0.00 C ATOM 0 H5' DT C 121 -11.543 -2.292 -16.328 1.00 0.00 H new ATOM 0 H5'' DT C 121 -12.654 -1.522 -15.212 1.00 0.00 H new ATOM 0 H4' DT C 121 -11.259 -2.913 -13.939 1.00 0.00 H new ATOM 0 H3' DT C 121 -11.043 -0.002 -13.576 1.00 0.00 H new ATOM 0 H2' DT C 121 -8.754 0.108 -13.233 1.00 0.00 H new ATOM 0 H2'' DT C 121 -8.968 -0.978 -11.874 1.00 0.00 H new ATOM 0 H1' DT C 121 -8.240 -2.825 -13.081 1.00 0.00 H new ATOM 0 H3 DT C 121 -3.984 -2.262 -14.154 1.00 0.00 H new ATOM 0 H71 DT C 121 -6.830 1.115 -17.227 1.00 0.00 H new ATOM 0 H72 DT C 121 -5.797 2.016 -16.092 1.00 0.00 H new ATOM 0 H73 DT C 121 -5.058 0.990 -17.344 1.00 0.00 H new ATOM 0 H6 DT C 121 -8.004 -0.005 -15.495 1.00 0.00 H new ATOM 671 P DT C 122 -11.569 -0.333 -10.861 1.00 0.00 P ATOM 672 OP1 DT C 122 -12.781 -0.746 -10.120 1.00 0.00 O ATOM 673 OP2 DT C 122 -11.456 1.044 -11.388 1.00 0.00 O ATOM 674 O5' DT C 122 -10.292 -0.617 -9.927 1.00 0.00 O ATOM 675 C5' DT C 122 -10.090 -1.918 -9.379 1.00 0.00 C ATOM 676 C4' DT C 122 -8.824 -1.980 -8.524 1.00 0.00 C ATOM 677 O4' DT C 122 -7.654 -1.875 -9.368 1.00 0.00 O ATOM 678 C3' DT C 122 -8.769 -0.839 -7.497 1.00 0.00 C ATOM 679 O3' DT C 122 -8.838 -1.346 -6.167 1.00 0.00 O ATOM 680 C2' DT C 122 -7.428 -0.172 -7.707 1.00 0.00 C ATOM 681 C1' DT C 122 -6.692 -0.988 -8.769 1.00 0.00 C ATOM 682 N1 DT C 122 -6.041 -0.111 -9.797 1.00 0.00 N ATOM 683 C2 DT C 122 -4.673 -0.257 -9.993 1.00 0.00 C ATOM 684 O2 DT C 122 -4.011 -1.078 -9.361 1.00 0.00 O ATOM 685 N3 DT C 122 -4.096 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0.00 C ATOM 722 C6 DT C 123 -4.977 2.040 -6.596 1.00 0.00 C ATOM 0 H5' DT C 123 -6.638 -2.147 -5.050 1.00 0.00 H new ATOM 0 H5'' DT C 123 -6.909 -1.839 -3.347 1.00 0.00 H new ATOM 0 H4' DT C 123 -4.581 -2.064 -3.736 1.00 0.00 H new ATOM 0 H3' DT C 123 -5.635 0.300 -2.507 1.00 0.00 H new ATOM 0 H2' DT C 123 -4.860 1.900 -3.959 1.00 0.00 H new ATOM 0 H2'' DT C 123 -3.305 1.550 -3.229 1.00 0.00 H new ATOM 0 H1' DT C 123 -2.581 0.293 -5.038 1.00 0.00 H new ATOM 0 H3 DT C 123 -1.913 2.845 -8.571 1.00 0.00 H new ATOM 0 H71 DT C 123 -6.284 4.497 -8.431 1.00 0.00 H new ATOM 0 H72 DT C 123 -6.960 2.873 -8.700 1.00 0.00 H new ATOM 0 H73 DT C 123 -7.032 3.610 -7.081 1.00 0.00 H new ATOM 0 H6 DT C 123 -5.859 1.800 -6.020 1.00 0.00 H new ATOM 735 P DA C 124 -3.299 0.242 -0.788 1.00 0.00 P ATOM 736 OP1 DA C 124 -3.430 -0.612 0.415 1.00 0.00 O ATOM 737 OP2 DA C 124 -3.918 1.586 -0.810 1.00 0.00 O ATOM 738 O5' DA C 124 -1.725 0.397 -1.130 1.00 0.00 O ATOM 739 C5' DA C 124 -0.968 -0.809 -1.290 1.00 0.00 C ATOM 740 C4' DA C 124 0.531 -0.603 -1.585 1.00 0.00 C ATOM 741 O4' DA C 124 0.700 0.081 -2.848 1.00 0.00 O ATOM 742 C3' DA C 124 1.216 0.248 -0.512 1.00 0.00 C ATOM 743 O3' DA C 124 2.505 -0.284 -0.186 1.00 0.00 O ATOM 744 C2' DA C 124 1.365 1.616 -1.126 1.00 0.00 C ATOM 745 C1' DA C 124 1.155 1.434 -2.625 1.00 0.00 C ATOM 746 N9 DA C 124 0.175 2.392 -3.140 1.00 0.00 N ATOM 747 C8 DA C 124 -1.087 2.595 -2.720 1.00 0.00 C ATOM 748 N7 DA C 124 -1.775 3.452 -3.410 1.00 0.00 N ATOM 749 C5 DA C 124 -0.871 3.856 -4.386 1.00 0.00 C ATOM 750 C6 DA C 124 -0.968 4.757 -5.448 1.00 0.00 C ATOM 751 N6 DA C 124 -2.091 5.422 -5.729 1.00 0.00 N ATOM 752 N1 DA C 124 0.126 4.922 -6.220 1.00 0.00 N ATOM 753 C2 DA C 124 1.243 4.231 -5.956 1.00 0.00 C ATOM 754 N3 DA C 124 1.429 3.353 -4.978 1.00 0.00 N ATOM 755 C4 DA C 124 0.323 3.215 -4.228 1.00 0.00 C ATOM 0 H5' DA C 124 -1.406 -1.390 -2.101 1.00 0.00 H new ATOM 0 H5'' DA C 124 -1.066 -1.405 -0.382 1.00 0.00 H new ATOM 0 H4' DA C 124 0.983 -1.595 -1.606 1.00 0.00 H new ATOM 0 H3' DA C 124 0.637 0.268 0.412 1.00 0.00 H new ATOM 0 H2' DA C 124 0.634 2.310 -0.712 1.00 0.00 H new ATOM 0 H2'' DA C 124 2.352 2.031 -0.919 1.00 0.00 H new ATOM 0 H1' DA C 124 2.092 1.614 -3.153 1.00 0.00 H new ATOM 0 H8 DA C 124 -1.500 2.079 -1.866 1.00 0.00 H new ATOM 0 H61 DA C 124 -2.116 6.071 -6.515 1.00 0.00 H new ATOM 0 H62 DA C 124 -2.924 5.281 -5.157 1.00 0.00 H new ATOM 0 H2 DA C 124 2.084 4.408 -6.610 1.00 0.00 H new ATOM 767 P DT C 125 3.424 0.441 0.922 1.00 0.00 P ATOM 768 OP1 DT C 125 4.334 -0.570 1.507 1.00 0.00 O ATOM 769 OP2 DT C 125 2.542 1.238 1.803 1.00 0.00 O ATOM 770 O5' DT C 125 4.305 1.461 0.034 1.00 0.00 O ATOM 771 C5' DT C 125 5.180 0.931 -0.964 1.00 0.00 C ATOM 772 C4' DT C 125 5.843 2.009 -1.830 1.00 0.00 C ATOM 773 O4' DT C 125 4.872 2.629 -2.711 1.00 0.00 O ATOM 774 C3' DT C 125 6.496 3.133 -1.009 1.00 0.00 C ATOM 775 O3' DT C 125 7.869 3.288 -1.396 1.00 0.00 O ATOM 776 C2' DT C 125 5.724 4.379 -1.359 1.00 0.00 C ATOM 777 C1' DT C 125 5.048 4.061 -2.682 1.00 0.00 C ATOM 778 N1 DT C 125 3.755 4.790 -2.894 1.00 0.00 N ATOM 779 C2 DT C 125 3.600 5.469 -4.100 1.00 0.00 C ATOM 780 O2 DT C 125 4.490 5.498 -4.948 1.00 0.00 O ATOM 781 N3 DT C 125 2.390 6.099 -4.299 1.00 0.00 N ATOM 782 C4 DT C 125 1.324 6.109 -3.418 1.00 0.00 C ATOM 783 O4 DT C 125 0.252 6.606 -3.743 1.00 0.00 O ATOM 784 C5 DT C 125 1.570 5.400 -2.186 1.00 0.00 C ATOM 785 C7 DT C 125 0.505 5.411 -1.091 1.00 0.00 C ATOM 786 C6 DT C 125 2.744 4.771 -1.963 1.00 0.00 C ATOM 0 H5' DT C 125 4.617 0.254 -1.607 1.00 0.00 H new ATOM 0 H5'' DT C 125 5.955 0.338 -0.479 1.00 0.00 H new ATOM 0 H4' DT C 125 6.618 1.488 -2.392 1.00 0.00 H new ATOM 0 H3' DT C 125 6.475 2.923 0.060 1.00 0.00 H new ATOM 0 H2' DT C 125 4.991 4.619 -0.589 1.00 0.00 H new ATOM 0 H2'' DT C 125 6.385 5.241 -1.450 1.00 0.00 H new ATOM 0 H1' DT C 125 5.674 4.405 -3.505 1.00 0.00 H new ATOM 0 H3 DT C 125 2.270 6.604 -5.177 1.00 0.00 H new ATOM 0 H71 DT C 125 0.563 4.486 -0.518 1.00 0.00 H new ATOM 0 H72 DT C 125 0.674 6.259 -0.428 1.00 0.00 H new ATOM 0 H73 DT C 125 -0.482 5.496 -1.545 1.00 0.00 H new ATOM 0 H6 DT C 125 2.892 4.242 -1.033 1.00 0.00 H new ATOM 799 P DC C 126 8.819 4.395 -0.707 1.00 0.00 P ATOM 800 OP1 DC C 126 10.191 3.847 -0.630 1.00 0.00 O ATOM 801 OP2 DC C 126 8.148 4.883 0.518 1.00 0.00 O ATOM 802 O5' DC C 126 8.814 5.593 -1.797 1.00 0.00 O ATOM 803 C5' DC C 126 9.309 5.343 -3.121 1.00 0.00 C ATOM 804 C4' DC C 126 9.233 6.571 -4.046 1.00 0.00 C ATOM 805 O4' DC C 126 7.857 6.861 -4.400 1.00 0.00 O ATOM 806 C3' DC C 126 9.839 7.827 -3.403 1.00 0.00 C ATOM 807 O3' DC C 126 10.972 8.284 -4.136 1.00 0.00 O ATOM 808 C2' DC C 126 8.758 8.882 -3.471 1.00 0.00 C ATOM 809 C1' DC C 126 7.542 8.248 -4.134 1.00 0.00 C ATOM 810 N1 DC C 126 6.354 8.354 -3.245 1.00 0.00 N ATOM 811 C2 DC C 126 5.216 9.029 -3.701 1.00 0.00 C ATOM 812 O2 DC C 126 5.217 9.590 -4.798 1.00 0.00 O ATOM 813 N3 DC C 126 4.130 9.075 -2.885 1.00 0.00 N ATOM 814 C4 DC C 126 4.148 8.494 -1.679 1.00 0.00 C ATOM 815 N4 DC C 126 3.062 8.549 -0.916 1.00 0.00 N ATOM 816 C5 DC C 126 5.309 7.809 -1.208 1.00 0.00 C ATOM 817 C6 DC C 126 6.379 7.765 -2.021 1.00 0.00 C ATOM 0 H5' DC C 126 8.739 4.527 -3.566 1.00 0.00 H new ATOM 0 H5'' DC C 126 10.345 5.010 -3.056 1.00 0.00 H new ATOM 0 H4' DC C 126 9.812 6.319 -4.935 1.00 0.00 H new ATOM 0 H3' DC C 126 10.166 7.618 -2.384 1.00 0.00 H new ATOM 0 H2' DC C 126 8.508 9.239 -2.472 1.00 0.00 H new ATOM 0 H2'' DC C 126 9.100 9.745 -4.042 1.00 0.00 H new ATOM 0 H1' DC C 126 7.304 8.764 -5.064 1.00 0.00 H new ATOM 0 H41 DC C 126 3.063 8.110 0.005 1.00 0.00 H new ATOM 0 H42 DC C 126 2.227 9.030 -1.251 1.00 0.00 H new ATOM 0 H5 DC C 126 5.327 7.343 -0.234 1.00 0.00 H new ATOM 0 H6 DC C 126 7.273 7.253 -1.696 1.00 0.00 H new ATOM 829 P DT C 127 11.853 9.507 -3.574 1.00 0.00 P ATOM 830 OP1 DT C 127 13.187 9.452 -4.209 1.00 0.00 O ATOM 831 OP2 DT C 127 11.736 9.527 -2.098 1.00 0.00 O ATOM 832 O5' DT C 127 11.075 10.784 -4.162 1.00 0.00 O ATOM 833 C5' DT C 127 10.925 10.945 -5.571 1.00 0.00 C ATOM 834 C4' DT C 127 10.075 12.170 -5.914 1.00 0.00 C ATOM 835 O4' DT C 127 8.700 11.938 -5.519 1.00 0.00 O ATOM 836 C3' DT C 127 10.564 13.440 -5.200 1.00 0.00 C ATOM 837 O3' DT C 127 10.927 14.433 -6.167 1.00 0.00 O ATOM 838 C2' DT C 127 9.390 13.913 -4.362 1.00 0.00 C ATOM 839 C1' DT C 127 8.190 13.065 -4.777 1.00 0.00 C ATOM 840 N1 DT C 127 7.390 12.622 -3.589 1.00 0.00 N ATOM 841 C2 DT C 127 6.056 13.011 -3.526 1.00 0.00 C ATOM 842 O2 DT C 127 5.531 13.685 -4.409 1.00 0.00 O ATOM 843 N3 DT C 127 5.347 12.596 -2.413 1.00 0.00 N ATOM 844 C4 DT C 127 5.838 11.839 -1.368 1.00 0.00 C ATOM 845 O4 DT C 127 5.110 11.521 -0.430 1.00 0.00 O ATOM 846 C5 DT C 127 7.230 11.476 -1.502 1.00 0.00 C ATOM 847 C7 DT C 127 7.885 10.655 -0.382 1.00 0.00 C ATOM 848 C6 DT C 127 7.953 11.865 -2.585 1.00 0.00 C ATOM 0 H5' DT C 127 10.463 10.052 -5.992 1.00 0.00 H new ATOM 0 H5'' DT C 127 11.908 11.043 -6.033 1.00 0.00 H new ATOM 0 H4' DT C 127 10.159 12.320 -6.990 1.00 0.00 H new ATOM 0 H3' DT C 127 11.443 13.253 -4.584 1.00 0.00 H new ATOM 0 H2' DT C 127 9.600 13.794 -3.299 1.00 0.00 H new ATOM 0 H2'' DT C 127 9.194 14.972 -4.532 1.00 0.00 H new ATOM 0 H1' DT C 127 7.509 13.651 -5.395 1.00 0.00 H new ATOM 0 H3 DT C 127 4.368 12.876 -2.359 1.00 0.00 H new ATOM 0 H71 DT C 127 7.407 10.890 0.569 1.00 0.00 H new ATOM 0 H72 DT C 127 7.768 9.592 -0.594 1.00 0.00 H new ATOM 0 H73 DT C 127 8.946 10.899 -0.325 1.00 0.00 H new ATOM 0 H6 DT C 127 8.991 11.575 -2.660 1.00 0.00 H new ATOM 861 P DG C 128 11.482 15.878 -5.719 1.00 0.00 P ATOM 862 OP1 DG C 128 12.295 16.421 -6.831 1.00 0.00 O ATOM 863 OP2 DG C 128 12.075 15.745 -4.370 1.00 0.00 O ATOM 864 O5' DG C 128 10.139 16.760 -5.600 1.00 0.00 O ATOM 865 C5' DG C 128 9.309 16.945 -6.748 1.00 0.00 C ATOM 866 C4' DG C 128 8.044 17.749 -6.431 1.00 0.00 C ATOM 867 O4' DG C 128 7.240 17.060 -5.452 1.00 0.00 O ATOM 868 C3' DG C 128 8.352 19.152 -5.896 1.00 0.00 C ATOM 869 O3' DG C 128 7.774 20.120 -6.772 1.00 0.00 O ATOM 870 C2' DG C 128 7.710 19.221 -4.526 1.00 0.00 C ATOM 871 C1' DG C 128 6.932 17.922 -4.338 1.00 0.00 C ATOM 872 N9 DG C 128 7.298 17.270 -3.075 1.00 0.00 N ATOM 873 C8 DG C 128 8.516 16.840 -2.674 1.00 0.00 C ATOM 874 N7 DG C 128 8.555 16.290 -1.497 1.00 0.00 N ATOM 875 C5 DG C 128 7.229 16.363 -1.074 1.00 0.00 C ATOM 876 C6 DG C 128 6.633 15.924 0.139 1.00 0.00 C ATOM 877 O6 DG C 128 7.171 15.374 1.097 1.00 0.00 O ATOM 878 N1 DG C 128 5.270 16.190 0.162 1.00 0.00 N ATOM 879 C2 DG C 128 4.564 16.801 -0.853 1.00 0.00 C ATOM 880 N2 DG C 128 3.258 16.961 -0.650 1.00 0.00 N ATOM 881 N3 DG C 128 5.121 17.214 -1.996 1.00 0.00 N ATOM 882 C4 DG C 128 6.450 16.964 -2.035 1.00 0.00 C ATOM 0 H5' DG C 128 9.027 15.972 -7.149 1.00 0.00 H new ATOM 0 H5'' DG C 128 9.877 17.457 -7.525 1.00 0.00 H new ATOM 0 H4' DG C 128 7.506 17.849 -7.373 1.00 0.00 H new ATOM 0 H3' DG C 128 9.422 19.351 -5.836 1.00 0.00 H new ATOM 0 H2' DG C 128 8.467 19.334 -3.750 1.00 0.00 H new ATOM 0 H2'' DG C 128 7.047 20.083 -4.453 1.00 0.00 H new ATOM 0 H1' DG C 128 5.863 18.132 -4.299 1.00 0.00 H new ATOM 0 H8 DG C 128 9.397 16.946 -3.290 1.00 0.00 H new ATOM 0 H1 DG C 128 4.751 15.912 0.995 1.00 0.00 H new ATOM 0 H21 DG C 128 2.682 17.406 -1.364 1.00 0.00 H new ATOM 0 H22 DG C 128 2.834 16.638 0.220 1.00 0.00 H new ATOM 894 P DC C 129 8.066 21.697 -6.641 1.00 0.00 P ATOM 895 OP1 DC C 129 7.803 22.326 -7.954 1.00 0.00 O ATOM 896 OP2 DC C 129 9.383 21.875 -5.990 1.00 0.00 O ATOM 897 O5' DC C 129 6.927 22.189 -5.616 1.00 0.00 O ATOM 898 C5' DC C 129 5.548 22.019 -5.943 1.00 0.00 C ATOM 899 C4' DC C 129 4.625 22.551 -4.841 1.00 0.00 C ATOM 900 O4' DC C 129 4.715 21.723 -3.653 1.00 0.00 O ATOM 901 C3' DC C 129 4.996 23.984 -4.446 1.00 0.00 C ATOM 902 O3' DC C 129 3.837 24.821 -4.528 1.00 0.00 O ATOM 903 C2' DC C 129 5.470 23.903 -3.014 1.00 0.00 C ATOM 904 C1' DC C 129 5.098 22.518 -2.504 1.00 0.00 C ATOM 905 N1 DC C 129 6.214 21.855 -1.755 1.00 0.00 N ATOM 906 C2 DC C 129 5.946 21.390 -0.464 1.00 0.00 C ATOM 907 O2 DC C 129 4.843 21.584 0.046 1.00 0.00 O ATOM 908 N3 DC C 129 6.926 20.722 0.205 1.00 0.00 N ATOM 909 C4 DC C 129 8.122 20.513 -0.355 1.00 0.00 C ATOM 910 N4 DC C 129 9.051 19.838 0.325 1.00 0.00 N ATOM 911 C5 DC C 129 8.412 20.991 -1.674 1.00 0.00 C ATOM 912 C6 DC C 129 7.437 21.652 -2.335 1.00 0.00 C ATOM 0 H5' DC C 129 5.343 20.961 -6.108 1.00 0.00 H new ATOM 0 H5'' DC C 129 5.331 22.536 -6.878 1.00 0.00 H new ATOM 0 H4' DC C 129 3.611 22.531 -5.241 1.00 0.00 H new ATOM 0 H3' DC C 129 5.760 24.403 -5.101 1.00 0.00 H new ATOM 0 H2' DC C 129 6.547 24.060 -2.954 1.00 0.00 H new ATOM 0 H2'' DC C 129 5.000 24.677 -2.407 1.00 0.00 H new ATOM 0 H1' DC C 129 4.277 22.610 -1.792 1.00 0.00 H new ATOM 0 H41 DC C 129 9.967 19.672 -0.091 1.00 0.00 H new ATOM 0 H42 DC C 129 8.845 19.488 1.261 1.00 0.00 H new ATOM 0 H5 DC C 129 9.379 20.828 -2.125 1.00 0.00 H new ATOM 0 H6 DC C 129 7.624 22.024 -3.331 1.00 0.00 H new ATOM 924 P DA C 130 3.927 26.391 -4.194 1.00 0.00 P ATOM 925 OP1 DA C 130 2.820 27.074 -4.904 1.00 0.00 O ATOM 926 OP2 DA C 130 5.322 26.831 -4.414 1.00 0.00 O ATOM 927 O5' DA C 130 3.622 26.448 -2.613 1.00 0.00 O ATOM 928 C5' DA C 130 2.356 26.026 -2.098 1.00 0.00 C ATOM 929 C4' DA C 130 2.290 26.166 -0.574 1.00 0.00 C ATOM 930 O4' DA C 130 3.143 25.187 0.058 1.00 0.00 O ATOM 931 C3' DA C 130 2.740 27.560 -0.117 1.00 0.00 C ATOM 932 O3' DA C 130 1.759 28.158 0.730 1.00 0.00 O ATOM 933 C2' DA C 130 4.010 27.324 0.669 1.00 0.00 C ATOM 934 C1' DA C 130 4.069 25.831 0.956 1.00 0.00 C ATOM 935 N9 DA C 130 5.427 25.285 0.793 1.00 0.00 N ATOM 936 C8 DA C 130 6.271 25.394 -0.258 1.00 0.00 C ATOM 937 N7 DA C 130 7.400 24.763 -0.134 1.00 0.00 N ATOM 938 C5 DA C 130 7.292 24.182 1.125 1.00 0.00 C ATOM 939 C6 DA C 130 8.149 23.371 1.871 1.00 0.00 C ATOM 940 N6 DA C 130 9.339 22.968 1.421 1.00 0.00 N ATOM 941 N1 DA C 130 7.727 22.976 3.087 1.00 0.00 N ATOM 942 C2 DA C 130 6.528 23.358 3.537 1.00 0.00 C ATOM 943 N3 DA C 130 5.643 24.121 2.909 1.00 0.00 N ATOM 944 C4 DA C 130 6.096 24.500 1.699 1.00 0.00 C ATOM 0 H5' DA C 130 2.178 24.987 -2.376 1.00 0.00 H new ATOM 0 H5'' DA C 130 1.562 26.619 -2.553 1.00 0.00 H new ATOM 0 H4' DA C 130 1.251 26.010 -0.283 1.00 0.00 H new ATOM 0 H3' DA C 130 2.886 28.231 -0.964 1.00 0.00 H new ATOM 0 H2' DA C 130 4.883 27.645 0.101 1.00 0.00 H new ATOM 0 H2'' DA C 130 4.005 27.897 1.596 1.00 0.00 H new ATOM 0 H1' DA C 130 3.797 25.646 1.995 1.00 0.00 H new ATOM 0 H8 DA C 130 6.024 25.966 -1.140 1.00 0.00 H new ATOM 0 H61 DA C 130 9.931 22.375 2.003 1.00 0.00 H new ATOM 0 H62 DA C 130 9.657 23.253 0.495 1.00 0.00 H new ATOM 0 H2 DA C 130 6.249 23.007 4.520 1.00 0.00 H new ATOM 956 P DA C 131 1.995 29.632 1.338 1.00 0.00 P ATOM 957 OP1 DA C 131 0.671 30.224 1.634 1.00 0.00 O ATOM 958 OP2 DA C 131 2.936 30.348 0.448 1.00 0.00 O ATOM 959 O5' DA C 131 2.751 29.358 2.739 1.00 0.00 O ATOM 960 C5' DA C 131 2.061 28.744 3.832 1.00 0.00 C ATOM 961 C4' DA C 131 2.960 28.575 5.067 1.00 0.00 C ATOM 962 O4' DA C 131 3.970 27.554 4.863 1.00 0.00 O ATOM 963 C3' DA C 131 3.679 29.883 5.419 1.00 0.00 C ATOM 964 O3' DA C 131 3.248 30.388 6.683 1.00 0.00 O ATOM 965 C2' DA C 131 5.147 29.535 5.498 1.00 0.00 C ATOM 966 C1' DA C 131 5.263 28.033 5.307 1.00 0.00 C ATOM 967 N9 DA C 131 6.316 27.702 4.335 1.00 0.00 N ATOM 968 C8 DA C 131 6.411 28.082 3.042 1.00 0.00 C ATOM 969 N7 DA C 131 7.432 27.609 2.394 1.00 0.00 N ATOM 970 C5 DA C 131 8.085 26.844 3.357 1.00 0.00 C ATOM 971 C6 DA C 131 9.249 26.068 3.322 1.00 0.00 C ATOM 972 N6 DA C 131 9.985 25.912 2.222 1.00 0.00 N ATOM 973 N1 DA C 131 9.612 25.446 4.457 1.00 0.00 N ATOM 974 C2 DA C 131 8.875 25.580 5.562 1.00 0.00 C ATOM 975 N3 DA C 131 7.755 26.286 5.701 1.00 0.00 N ATOM 976 C4 DA C 131 7.416 26.898 4.547 1.00 0.00 C ATOM 0 H5' DA C 131 1.687 27.768 3.521 1.00 0.00 H new ATOM 0 H5'' DA C 131 1.193 29.348 4.097 1.00 0.00 H new ATOM 0 H4' DA C 131 2.299 28.280 5.882 1.00 0.00 H new ATOM 0 H3' DA C 131 3.468 30.650 4.674 1.00 0.00 H new ATOM 0 H2' DA C 131 5.710 30.065 4.730 1.00 0.00 H new ATOM 0 H2'' DA C 131 5.562 29.834 6.461 1.00 0.00 H new ATOM 0 H1' DA C 131 5.544 27.551 6.243 1.00 0.00 H new ATOM 0 H8 DA C 131 5.686 28.735 2.579 1.00 0.00 H new ATOM 0 H61 DA C 131 10.826 25.335 2.249 1.00 0.00 H new ATOM 0 H62 DA C 131 9.707 26.369 1.354 1.00 0.00 H new ATOM 0 H2 DA C 131 9.226 25.058 6.440 1.00 0.00 H new ATOM 988 P DC C 132 3.851 31.776 7.231 1.00 0.00 P ATOM 989 OP1 DC C 132 2.882 32.358 8.186 1.00 0.00 O ATOM 990 OP2 DC C 132 4.306 32.567 6.067 1.00 0.00 O ATOM 991 O5' DC C 132 5.150 31.298 8.062 1.00 0.00 O ATOM 992 C5' DC C 132 5.023 30.266 9.042 1.00 0.00 C ATOM 993 C4' DC C 132 6.378 29.767 9.563 1.00 0.00 C ATOM 994 O4' DC C 132 7.078 28.998 8.560 1.00 0.00 O ATOM 995 C3' DC C 132 7.296 30.914 9.999 1.00 0.00 C ATOM 996 O3' DC C 132 7.448 30.920 11.422 1.00 0.00 O ATOM 997 C2' DC C 132 8.630 30.638 9.326 1.00 0.00 C ATOM 998 C1' DC C 132 8.485 29.316 8.593 1.00 0.00 C ATOM 999 N1 DC C 132 9.042 29.399 7.218 1.00 0.00 N ATOM 1000 C2 DC C 132 10.171 28.644 6.905 1.00 0.00 C ATOM 1001 O2 DC C 132 10.692 27.927 7.757 1.00 0.00 O ATOM 1002 N3 DC C 132 10.666 28.721 5.640 1.00 0.00 N ATOM 1003 C4 DC C 132 10.083 29.499 4.720 1.00 0.00 C ATOM 1004 N4 DC C 132 10.593 29.545 3.490 1.00 0.00 N ATOM 1005 C5 DC C 132 8.927 30.275 5.039 1.00 0.00 C ATOM 1006 C6 DC C 132 8.446 30.192 6.293 1.00 0.00 C ATOM 0 H5' DC C 132 4.474 29.428 8.611 1.00 0.00 H new ATOM 0 H5'' DC C 132 4.432 30.638 9.879 1.00 0.00 H new ATOM 0 H4' DC C 132 6.147 29.143 10.426 1.00 0.00 H new ATOM 0 H3' DC C 132 6.891 31.887 9.719 1.00 0.00 H new ATOM 0 H2' DC C 132 8.886 31.439 8.632 1.00 0.00 H new ATOM 0 H2'' DC C 132 9.432 30.586 10.063 1.00 0.00 H new ATOM 0 HO3' DC C 132 8.038 31.657 11.685 1.00 0.00 H new ATOM 0 H1' DC C 132 9.044 28.535 9.108 1.00 0.00 H new ATOM 0 H41 DC C 132 10.158 30.134 2.779 1.00 0.00 H new ATOM 0 H42 DC C 132 11.418 28.991 3.259 1.00 0.00 H new ATOM 0 H5 DC C 132 8.456 30.906 4.300 1.00 0.00 H new ATOM 0 H6 DC C 132 7.573 30.765 6.567 1.00 0.00 H new TER 1019 DC C 132 ATOM 1020 N LYS A 1 -2.703 11.084 15.245 1.00 0.00 N ATOM 1021 CA LYS A 1 -2.851 9.666 14.805 1.00 0.00 C ATOM 1022 C LYS A 1 -4.172 9.507 14.049 1.00 0.00 C ATOM 1023 O LYS A 1 -4.943 10.438 13.930 1.00 0.00 O ATOM 1024 CB LYS A 1 -2.866 8.748 16.028 1.00 0.00 C ATOM 1025 CG LYS A 1 -1.623 8.993 16.891 1.00 0.00 C ATOM 1026 CD LYS A 1 -0.353 8.622 16.111 1.00 0.00 C ATOM 1027 CE LYS A 1 0.808 8.410 17.087 1.00 0.00 C ATOM 1028 NZ LYS A 1 0.557 7.180 17.887 1.00 0.00 N ATOM 0 H1 LYS A 1 -1.697 11.348 15.235 1.00 0.00 H new ATOM 0 H2 LYS A 1 -3.230 11.705 14.598 1.00 0.00 H new ATOM 0 H3 LYS A 1 -3.078 11.189 16.209 1.00 0.00 H new ATOM 0 HA LYS A 1 -2.016 9.400 14.157 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -3.766 8.928 16.615 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -2.896 7.706 15.709 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -1.581 10.040 17.192 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -1.683 8.401 17.804 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -0.523 7.715 15.530 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -0.106 9.413 15.403 1.00 0.00 H new ATOM 0 HE2 LYS A 1 1.746 8.317 16.540 1.00 0.00 H new ATOM 0 HE3 LYS A 1 0.907 9.273 17.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 1.464 6.774 18.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -0.015 7.420 18.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 0.046 6.486 17.305 1.00 0.00 H new ATOM 1044 N ARG A 2 -4.438 8.338 13.528 1.00 0.00 N ATOM 1045 CA ARG A 2 -5.704 8.119 12.773 1.00 0.00 C ATOM 1046 C ARG A 2 -6.790 7.671 13.752 1.00 0.00 C ATOM 1047 O ARG A 2 -7.612 6.831 13.444 1.00 0.00 O ATOM 1048 CB ARG A 2 -5.490 7.011 11.735 1.00 0.00 C ATOM 1049 CG ARG A 2 -4.284 7.330 10.835 1.00 0.00 C ATOM 1050 CD ARG A 2 -2.957 7.200 11.602 1.00 0.00 C ATOM 1051 NE ARG A 2 -1.904 6.747 10.649 1.00 0.00 N ATOM 1052 CZ ARG A 2 -0.649 6.782 10.997 1.00 0.00 C ATOM 1053 NH1 ARG A 2 -0.314 7.179 12.193 1.00 0.00 N ATOM 1054 NH2 ARG A 2 0.273 6.409 10.150 1.00 0.00 N ATOM 0 H ARG A 2 -3.829 7.522 13.594 1.00 0.00 H new ATOM 0 HA ARG A 2 -6.000 9.042 12.274 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -5.330 6.059 12.241 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -6.386 6.901 11.124 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -4.279 6.654 9.980 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -4.380 8.342 10.441 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -2.680 8.156 12.046 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -3.060 6.487 12.420 1.00 0.00 H new ATOM 0 HE ARG A 2 -2.166 6.409 9.723 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -1.035 7.462 12.857 1.00 0.00 H new ATOM 0 HH12 ARG A 2 0.669 7.206 12.465 1.00 0.00 H new ATOM 0 HH21 ARG A 2 0.010 6.091 9.217 1.00 0.00 H new ATOM 0 HH22 ARG A 2 1.256 6.436 10.421 1.00 0.00 H new ATOM 1068 N ALA A 3 -6.784 8.209 14.937 1.00 0.00 N ATOM 1069 CA ALA A 3 -7.792 7.805 15.956 1.00 0.00 C ATOM 1070 C ALA A 3 -9.214 8.179 15.519 1.00 0.00 C ATOM 1071 O ALA A 3 -9.521 9.333 15.289 1.00 0.00 O ATOM 1072 CB ALA A 3 -7.474 8.529 17.266 1.00 0.00 C ATOM 0 H ALA A 3 -6.119 8.917 15.247 1.00 0.00 H new ATOM 0 HA ALA A 3 -7.746 6.723 16.080 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -8.203 8.245 18.025 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -6.474 8.252 17.601 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -7.518 9.606 17.106 1.00 0.00 H new ATOM 1078 N GLY A 4 -10.094 7.213 15.448 1.00 0.00 N ATOM 1079 CA GLY A 4 -11.514 7.503 15.081 1.00 0.00 C ATOM 1080 C GLY A 4 -11.708 7.614 13.564 1.00 0.00 C ATOM 1081 O GLY A 4 -12.808 7.464 13.071 1.00 0.00 O ATOM 0 H GLY A 4 -9.889 6.230 15.629 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -12.157 6.714 15.471 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.827 8.433 15.555 1.00 0.00 H new ATOM 1085 N THR A 5 -10.680 7.901 12.816 1.00 0.00 N ATOM 1086 CA THR A 5 -10.879 8.043 11.343 1.00 0.00 C ATOM 1087 C THR A 5 -11.213 6.691 10.708 1.00 0.00 C ATOM 1088 O THR A 5 -10.385 5.803 10.638 1.00 0.00 O ATOM 1089 CB THR A 5 -9.612 8.602 10.689 1.00 0.00 C ATOM 1090 OG1 THR A 5 -9.056 9.612 11.518 1.00 0.00 O ATOM 1091 CG2 THR A 5 -9.953 9.198 9.315 1.00 0.00 C ATOM 0 H THR A 5 -9.727 8.042 13.150 1.00 0.00 H new ATOM 0 HA THR A 5 -11.710 8.730 11.181 1.00 0.00 H new ATOM 0 HB THR A 5 -8.890 7.796 10.561 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.244 9.968 11.100 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.047 9.594 8.855 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.375 8.422 8.676 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.679 10.002 9.437 1.00 0.00 H new ATOM 1099 N VAL A 6 -12.415 6.557 10.200 1.00 0.00 N ATOM 1100 CA VAL A 6 -12.830 5.297 9.506 1.00 0.00 C ATOM 1101 C VAL A 6 -13.179 5.681 8.077 1.00 0.00 C ATOM 1102 O VAL A 6 -13.750 6.726 7.833 1.00 0.00 O ATOM 1103 CB VAL A 6 -14.053 4.671 10.186 1.00 0.00 C ATOM 1104 CG1 VAL A 6 -13.645 4.101 11.544 1.00 0.00 C ATOM 1105 CG2 VAL A 6 -15.148 5.725 10.381 1.00 0.00 C ATOM 0 H VAL A 6 -13.136 7.278 10.238 1.00 0.00 H new ATOM 0 HA VAL A 6 -12.026 4.562 9.541 1.00 0.00 H new ATOM 0 HB VAL A 6 -14.440 3.872 9.554 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -14.514 3.656 12.028 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -12.878 3.339 11.403 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -13.251 4.901 12.171 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -16.011 5.268 10.865 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -14.768 6.533 11.006 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -15.445 6.125 9.411 1.00 0.00 H new ATOM 1115 N CYS A 7 -12.837 4.872 7.121 1.00 0.00 N ATOM 1116 CA CYS A 7 -13.147 5.231 5.717 1.00 0.00 C ATOM 1117 C CYS A 7 -14.648 5.308 5.507 1.00 0.00 C ATOM 1118 O CYS A 7 -15.365 4.343 5.675 1.00 0.00 O ATOM 1119 CB CYS A 7 -12.548 4.170 4.808 1.00 0.00 C ATOM 1120 SG CYS A 7 -12.924 4.541 3.078 1.00 0.00 S ATOM 0 H CYS A 7 -12.358 3.981 7.250 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.723 6.208 5.485 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -11.468 4.126 4.951 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -12.945 3.190 5.071 1.00 0.00 H new ATOM 1125 N SER A 8 -15.125 6.455 5.131 1.00 0.00 N ATOM 1126 CA SER A 8 -16.578 6.616 4.895 1.00 0.00 C ATOM 1127 C SER A 8 -17.049 5.661 3.795 1.00 0.00 C ATOM 1128 O SER A 8 -18.128 5.108 3.872 1.00 0.00 O ATOM 1129 CB SER A 8 -16.862 8.052 4.462 1.00 0.00 C ATOM 1130 OG SER A 8 -16.626 8.928 5.556 1.00 0.00 O ATOM 0 H SER A 8 -14.566 7.294 4.976 1.00 0.00 H new ATOM 0 HA SER A 8 -17.112 6.388 5.818 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.225 8.323 3.620 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.894 8.145 4.123 1.00 0.00 H new ATOM 0 HG SER A 8 -15.662 9.070 5.659 1.00 0.00 H new ATOM 1136 N ASN A 9 -16.274 5.484 2.748 1.00 0.00 N ATOM 1137 CA ASN A 9 -16.741 4.592 1.648 1.00 0.00 C ATOM 1138 C ASN A 9 -16.650 3.113 2.027 1.00 0.00 C ATOM 1139 O ASN A 9 -17.524 2.350 1.665 1.00 0.00 O ATOM 1140 CB ASN A 9 -15.892 4.833 0.396 1.00 0.00 C ATOM 1141 CG ASN A 9 -16.227 6.199 -0.206 1.00 0.00 C ATOM 1142 OD1 ASN A 9 -15.351 6.897 -0.673 1.00 0.00 O ATOM 1143 ND2 ASN A 9 -17.467 6.612 -0.222 1.00 0.00 N ATOM 0 H ASN A 9 -15.358 5.911 2.613 1.00 0.00 H new ATOM 0 HA ASN A 9 -17.787 4.831 1.458 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -14.833 4.788 0.650 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -16.078 4.048 -0.337 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -17.697 7.520 -0.627 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -18.205 6.027 0.170 1.00 0.00 H new ATOM 1150 N CYS A 10 -15.606 2.668 2.715 1.00 0.00 N ATOM 1151 CA CYS A 10 -15.517 1.200 3.045 1.00 0.00 C ATOM 1152 C CYS A 10 -15.225 0.952 4.534 1.00 0.00 C ATOM 1153 O CYS A 10 -15.006 -0.174 4.933 1.00 0.00 O ATOM 1154 CB CYS A 10 -14.459 0.522 2.148 1.00 0.00 C ATOM 1155 SG CYS A 10 -12.778 0.846 2.746 1.00 0.00 S ATOM 0 H CYS A 10 -14.834 3.243 3.052 1.00 0.00 H new ATOM 0 HA CYS A 10 -16.491 0.754 2.844 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -14.637 -0.553 2.122 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -14.559 0.886 1.126 1.00 0.00 H new ATOM 1160 N GLN A 11 -15.272 1.959 5.372 1.00 0.00 N ATOM 1161 CA GLN A 11 -15.055 1.742 6.840 1.00 0.00 C ATOM 1162 C GLN A 11 -13.656 1.182 7.152 1.00 0.00 C ATOM 1163 O GLN A 11 -13.323 0.967 8.299 1.00 0.00 O ATOM 1164 CB GLN A 11 -16.136 0.783 7.367 1.00 0.00 C ATOM 1165 CG GLN A 11 -16.225 0.870 8.897 1.00 0.00 C ATOM 1166 CD GLN A 11 -17.411 0.039 9.390 1.00 0.00 C ATOM 1167 OE1 GLN A 11 -18.497 0.553 9.573 1.00 0.00 O ATOM 1168 NE2 GLN A 11 -17.248 -1.238 9.612 1.00 0.00 N ATOM 0 H GLN A 11 -15.452 2.926 5.103 1.00 0.00 H new ATOM 0 HA GLN A 11 -15.126 2.709 7.338 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -17.100 1.033 6.925 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -15.903 -0.239 7.067 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -15.301 0.506 9.346 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -16.342 1.909 9.206 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -16.337 -1.670 9.459 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -18.032 -1.803 9.939 1.00 0.00 H new ATOM 1177 N THR A 12 -12.817 0.953 6.181 1.00 0.00 N ATOM 1178 CA THR A 12 -11.464 0.422 6.526 1.00 0.00 C ATOM 1179 C THR A 12 -10.746 1.444 7.419 1.00 0.00 C ATOM 1180 O THR A 12 -10.863 2.637 7.216 1.00 0.00 O ATOM 1181 CB THR A 12 -10.650 0.144 5.250 1.00 0.00 C ATOM 1182 OG1 THR A 12 -9.493 -0.608 5.589 1.00 0.00 O ATOM 1183 CG2 THR A 12 -10.223 1.447 4.575 1.00 0.00 C ATOM 0 H THR A 12 -12.999 1.104 5.189 1.00 0.00 H new ATOM 0 HA THR A 12 -11.566 -0.521 7.063 1.00 0.00 H new ATOM 0 HB THR A 12 -11.277 -0.415 4.555 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.972 -0.789 4.779 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.650 1.220 3.676 1.00 0.00 H new ATOM 0 HG22 THR A 12 -11.108 2.024 4.305 1.00 0.00 H new ATOM 0 HG23 THR A 12 -9.607 2.028 5.262 1.00 0.00 H new ATOM 1191 N SER A 13 -9.994 0.982 8.397 1.00 0.00 N ATOM 1192 CA SER A 13 -9.252 1.933 9.302 1.00 0.00 C ATOM 1193 C SER A 13 -7.769 1.914 8.927 1.00 0.00 C ATOM 1194 O SER A 13 -6.986 2.722 9.385 1.00 0.00 O ATOM 1195 CB SER A 13 -9.446 1.529 10.767 1.00 0.00 C ATOM 1196 OG SER A 13 -8.440 2.139 11.565 1.00 0.00 O ATOM 0 H SER A 13 -9.861 -0.007 8.608 1.00 0.00 H new ATOM 0 HA SER A 13 -9.643 2.943 9.178 1.00 0.00 H new ATOM 0 HB2 SER A 13 -10.434 1.835 11.112 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.396 0.445 10.866 1.00 0.00 H new ATOM 0 HG SER A 13 -7.940 2.785 11.023 1.00 0.00 H new ATOM 1202 N THR A 14 -7.386 1.004 8.068 1.00 0.00 N ATOM 1203 CA THR A 14 -5.964 0.924 7.616 1.00 0.00 C ATOM 1204 C THR A 14 -5.869 1.580 6.238 1.00 0.00 C ATOM 1205 O THR A 14 -6.536 1.170 5.309 1.00 0.00 O ATOM 1206 CB THR A 14 -5.546 -0.547 7.519 1.00 0.00 C ATOM 1207 OG1 THR A 14 -6.495 -1.265 6.737 1.00 0.00 O ATOM 1208 CG2 THR A 14 -5.480 -1.145 8.924 1.00 0.00 C ATOM 0 H THR A 14 -8.005 0.306 7.656 1.00 0.00 H new ATOM 0 HA THR A 14 -5.307 1.433 8.321 1.00 0.00 H new ATOM 0 HB THR A 14 -4.567 -0.617 7.045 1.00 0.00 H new ATOM 0 HG1 THR A 14 -6.511 -2.203 7.021 1.00 0.00 H new ATOM 0 HG21 THR A 14 -5.183 -2.192 8.860 1.00 0.00 H new ATOM 0 HG22 THR A 14 -4.750 -0.596 9.519 1.00 0.00 H new ATOM 0 HG23 THR A 14 -6.460 -1.074 9.396 1.00 0.00 H new ATOM 1216 N THR A 15 -5.059 2.601 6.091 1.00 0.00 N ATOM 1217 CA THR A 15 -4.954 3.283 4.762 1.00 0.00 C ATOM 1218 C THR A 15 -3.531 3.804 4.553 1.00 0.00 C ATOM 1219 O THR A 15 -2.855 4.168 5.494 1.00 0.00 O ATOM 1220 CB THR A 15 -5.891 4.496 4.742 1.00 0.00 C ATOM 1221 OG1 THR A 15 -5.240 5.595 5.367 1.00 0.00 O ATOM 1222 CG2 THR A 15 -7.164 4.185 5.519 1.00 0.00 C ATOM 0 H THR A 15 -4.470 2.989 6.828 1.00 0.00 H new ATOM 0 HA THR A 15 -5.217 2.568 3.982 1.00 0.00 H new ATOM 0 HB THR A 15 -6.142 4.735 3.708 1.00 0.00 H new ATOM 0 HG1 THR A 15 -5.857 6.028 5.993 1.00 0.00 H new ATOM 0 HG21 THR A 15 -7.823 5.053 5.499 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.670 3.334 5.063 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.911 3.945 6.552 1.00 0.00 H new ATOM 1230 N THR A 16 -3.081 3.889 3.328 1.00 0.00 N ATOM 1231 CA THR A 16 -1.720 4.444 3.087 1.00 0.00 C ATOM 1232 C THR A 16 -1.812 5.967 3.212 1.00 0.00 C ATOM 1233 O THR A 16 -0.945 6.611 3.769 1.00 0.00 O ATOM 1234 CB THR A 16 -1.229 4.077 1.683 1.00 0.00 C ATOM 1235 OG1 THR A 16 -2.072 4.684 0.715 1.00 0.00 O ATOM 1236 CG2 THR A 16 -1.244 2.557 1.483 1.00 0.00 C ATOM 0 H THR A 16 -3.592 3.601 2.494 1.00 0.00 H new ATOM 0 HA THR A 16 -1.017 4.032 3.811 1.00 0.00 H new ATOM 0 HB THR A 16 -0.206 4.436 1.568 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.986 4.208 -0.138 1.00 0.00 H new ATOM 0 HG21 THR A 16 -0.892 2.319 0.479 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.591 2.087 2.218 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.260 2.183 1.609 1.00 0.00 H new ATOM 1244 N LEU A 17 -2.884 6.544 2.718 1.00 0.00 N ATOM 1245 CA LEU A 17 -3.069 8.028 2.829 1.00 0.00 C ATOM 1246 C LEU A 17 -4.562 8.334 2.980 1.00 0.00 C ATOM 1247 O LEU A 17 -5.385 7.847 2.228 1.00 0.00 O ATOM 1248 CB LEU A 17 -2.509 8.752 1.585 1.00 0.00 C ATOM 1249 CG LEU A 17 -2.024 10.168 1.960 1.00 0.00 C ATOM 1250 CD1 LEU A 17 -0.632 10.107 2.612 1.00 0.00 C ATOM 1251 CD2 LEU A 17 -1.944 11.018 0.688 1.00 0.00 C ATOM 0 H LEU A 17 -3.639 6.050 2.242 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.523 8.387 3.701 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.684 8.178 1.163 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.279 8.816 0.816 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.726 10.607 2.669 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.306 11.115 2.870 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.680 9.499 3.515 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.078 9.664 1.914 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.602 12.021 0.942 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -1.243 10.562 -0.011 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.930 11.077 0.227 1.00 0.00 H new ATOM 1263 N TRP A 18 -4.917 9.150 3.933 1.00 0.00 N ATOM 1264 CA TRP A 18 -6.346 9.508 4.120 1.00 0.00 C ATOM 1265 C TRP A 18 -6.708 10.594 3.098 1.00 0.00 C ATOM 1266 O TRP A 18 -6.011 11.580 2.971 1.00 0.00 O ATOM 1267 CB TRP A 18 -6.521 10.065 5.539 1.00 0.00 C ATOM 1268 CG TRP A 18 -6.528 8.938 6.529 1.00 0.00 C ATOM 1269 CD1 TRP A 18 -5.553 8.681 7.430 1.00 0.00 C ATOM 1270 CD2 TRP A 18 -7.542 7.911 6.727 1.00 0.00 C ATOM 1271 NE1 TRP A 18 -5.910 7.567 8.168 1.00 0.00 N ATOM 1272 CE2 TRP A 18 -7.124 7.058 7.773 1.00 0.00 C ATOM 1273 CE3 TRP A 18 -8.771 7.643 6.108 1.00 0.00 C ATOM 1274 CZ2 TRP A 18 -7.898 5.976 8.192 1.00 0.00 C ATOM 1275 CZ3 TRP A 18 -9.552 6.554 6.525 1.00 0.00 C ATOM 1276 CH2 TRP A 18 -9.118 5.723 7.564 1.00 0.00 C ATOM 0 H TRP A 18 -4.273 9.586 4.593 1.00 0.00 H new ATOM 0 HA TRP A 18 -6.988 8.638 3.981 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -5.713 10.759 5.770 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.453 10.627 5.607 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.645 9.252 7.553 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -5.341 7.171 8.916 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -9.119 8.278 5.306 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -7.556 5.340 8.995 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -10.496 6.356 6.040 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -9.726 4.888 7.879 1.00 0.00 H new ATOM 1287 N ARG A 19 -7.776 10.420 2.356 1.00 0.00 N ATOM 1288 CA ARG A 19 -8.162 11.445 1.330 1.00 0.00 C ATOM 1289 C ARG A 19 -9.500 12.071 1.719 1.00 0.00 C ATOM 1290 O ARG A 19 -10.496 11.390 1.792 1.00 0.00 O ATOM 1291 CB ARG A 19 -8.344 10.766 -0.045 1.00 0.00 C ATOM 1292 CG ARG A 19 -7.228 9.759 -0.311 1.00 0.00 C ATOM 1293 CD ARG A 19 -5.928 10.488 -0.620 1.00 0.00 C ATOM 1294 NE ARG A 19 -4.869 9.479 -0.891 1.00 0.00 N ATOM 1295 CZ ARG A 19 -3.772 9.803 -1.521 1.00 0.00 C ATOM 1296 NH1 ARG A 19 -3.570 11.025 -1.942 1.00 0.00 N ATOM 1297 NH2 ARG A 19 -2.873 8.890 -1.725 1.00 0.00 N ATOM 0 H ARG A 19 -8.398 9.614 2.415 1.00 0.00 H new ATOM 0 HA ARG A 19 -7.380 12.202 1.279 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -9.310 10.262 -0.080 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -8.351 11.522 -0.830 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -7.095 9.114 0.558 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -7.500 9.115 -1.147 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -6.057 11.142 -1.483 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -5.641 11.121 0.220 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.002 8.517 -0.579 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.276 11.743 -1.780 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -2.707 11.259 -2.432 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.029 7.938 -1.395 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.010 9.125 -2.215 1.00 0.00 H new ATOM 1311 N ARG A 20 -9.566 13.346 1.950 1.00 0.00 N ATOM 1312 CA ARG A 20 -10.892 13.918 2.298 1.00 0.00 C ATOM 1313 C ARG A 20 -11.757 13.820 1.037 1.00 0.00 C ATOM 1314 O ARG A 20 -11.279 14.022 -0.062 1.00 0.00 O ATOM 1315 CB ARG A 20 -10.747 15.384 2.723 1.00 0.00 C ATOM 1316 CG ARG A 20 -12.061 15.891 3.345 1.00 0.00 C ATOM 1317 CD ARG A 20 -12.168 15.433 4.808 1.00 0.00 C ATOM 1318 NE ARG A 20 -13.314 16.129 5.458 1.00 0.00 N ATOM 1319 CZ ARG A 20 -13.721 15.743 6.636 1.00 0.00 C ATOM 1320 NH1 ARG A 20 -13.133 14.740 7.229 1.00 0.00 N ATOM 1321 NH2 ARG A 20 -14.713 16.358 7.220 1.00 0.00 N ATOM 0 H ARG A 20 -8.786 14.002 1.915 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.343 13.377 3.130 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -9.934 15.483 3.442 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -10.485 15.996 1.860 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -12.100 16.979 3.293 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -12.910 15.514 2.775 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -12.310 14.353 4.854 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -11.243 15.656 5.340 1.00 0.00 H new ATOM 0 HE ARG A 20 -13.778 16.904 4.984 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -12.358 14.260 6.772 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -13.449 14.436 8.150 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -15.172 17.142 6.755 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -15.030 16.055 8.141 1.00 0.00 H new ATOM 1335 N SER A 21 -13.018 13.503 1.175 1.00 0.00 N ATOM 1336 CA SER A 21 -13.897 13.382 -0.036 1.00 0.00 C ATOM 1337 C SER A 21 -14.547 14.740 -0.327 1.00 0.00 C ATOM 1338 O SER A 21 -14.675 15.560 0.553 1.00 0.00 O ATOM 1339 CB SER A 21 -14.977 12.324 0.228 1.00 0.00 C ATOM 1340 OG SER A 21 -16.190 12.700 -0.411 1.00 0.00 O ATOM 0 H SER A 21 -13.479 13.323 2.067 1.00 0.00 H new ATOM 0 HA SER A 21 -13.304 13.079 -0.899 1.00 0.00 H new ATOM 0 HB2 SER A 21 -14.646 11.354 -0.143 1.00 0.00 H new ATOM 0 HB3 SER A 21 -15.139 12.217 1.301 1.00 0.00 H new ATOM 0 HG SER A 21 -16.874 12.020 -0.240 1.00 0.00 H new ATOM 1346 N PRO A 22 -14.951 14.990 -1.554 1.00 0.00 N ATOM 1347 CA PRO A 22 -15.594 16.288 -1.894 1.00 0.00 C ATOM 1348 C PRO A 22 -16.736 16.656 -0.926 1.00 0.00 C ATOM 1349 O PRO A 22 -17.100 17.808 -0.792 1.00 0.00 O ATOM 1350 CB PRO A 22 -16.134 16.029 -3.320 1.00 0.00 C ATOM 1351 CG PRO A 22 -15.637 14.645 -3.794 1.00 0.00 C ATOM 1352 CD PRO A 22 -14.783 14.023 -2.679 1.00 0.00 C ATOM 0 HA PRO A 22 -14.904 17.129 -1.825 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -17.224 16.061 -3.323 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -15.791 16.807 -4.001 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -16.483 13.999 -4.028 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -15.051 14.746 -4.708 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -15.132 13.026 -2.411 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -13.739 13.926 -2.976 1.00 0.00 H new ATOM 1360 N MET A 23 -17.303 15.683 -0.252 1.00 0.00 N ATOM 1361 CA MET A 23 -18.420 15.972 0.704 1.00 0.00 C ATOM 1362 C MET A 23 -17.860 16.217 2.107 1.00 0.00 C ATOM 1363 O MET A 23 -18.566 16.633 3.005 1.00 0.00 O ATOM 1364 CB MET A 23 -19.374 14.774 0.746 1.00 0.00 C ATOM 1365 CG MET A 23 -20.136 14.678 -0.578 1.00 0.00 C ATOM 1366 SD MET A 23 -21.393 15.984 -0.643 1.00 0.00 S ATOM 1367 CE MET A 23 -21.193 16.430 -2.386 1.00 0.00 C ATOM 0 H MET A 23 -17.040 14.700 -0.323 1.00 0.00 H new ATOM 0 HA MET A 23 -18.954 16.862 0.370 1.00 0.00 H new ATOM 0 HB2 MET A 23 -18.813 13.856 0.922 1.00 0.00 H new ATOM 0 HB3 MET A 23 -20.075 14.883 1.574 1.00 0.00 H new ATOM 0 HG2 MET A 23 -19.446 14.779 -1.416 1.00 0.00 H new ATOM 0 HG3 MET A 23 -20.607 13.699 -0.670 1.00 0.00 H new ATOM 0 HE1 MET A 23 -21.887 17.232 -2.638 1.00 0.00 H new ATOM 0 HE2 MET A 23 -20.171 16.766 -2.561 1.00 0.00 H new ATOM 0 HE3 MET A 23 -21.400 15.561 -3.010 1.00 0.00 H new ATOM 1377 N GLY A 24 -16.604 15.938 2.307 1.00 0.00 N ATOM 1378 CA GLY A 24 -15.991 16.122 3.656 1.00 0.00 C ATOM 1379 C GLY A 24 -16.121 14.811 4.436 1.00 0.00 C ATOM 1380 O GLY A 24 -16.247 14.805 5.644 1.00 0.00 O ATOM 0 H GLY A 24 -15.969 15.588 1.590 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.942 16.402 3.560 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.489 16.931 4.190 1.00 0.00 H new ATOM 1384 N ASP A 25 -16.109 13.697 3.745 1.00 0.00 N ATOM 1385 CA ASP A 25 -16.244 12.367 4.411 1.00 0.00 C ATOM 1386 C ASP A 25 -14.897 11.612 4.331 1.00 0.00 C ATOM 1387 O ASP A 25 -14.484 11.227 3.257 1.00 0.00 O ATOM 1388 CB ASP A 25 -17.295 11.565 3.640 1.00 0.00 C ATOM 1389 CG ASP A 25 -18.652 12.258 3.765 1.00 0.00 C ATOM 1390 OD1 ASP A 25 -18.663 13.460 3.975 1.00 0.00 O ATOM 1391 OD2 ASP A 25 -19.656 11.575 3.648 1.00 0.00 O ATOM 0 H ASP A 25 -16.010 13.655 2.731 1.00 0.00 H new ATOM 0 HA ASP A 25 -16.530 12.494 5.455 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -17.010 11.485 2.591 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -17.355 10.550 4.033 1.00 0.00 H new ATOM 1396 N PRO A 26 -14.199 11.387 5.427 1.00 0.00 N ATOM 1397 CA PRO A 26 -12.894 10.663 5.357 1.00 0.00 C ATOM 1398 C PRO A 26 -12.975 9.334 4.581 1.00 0.00 C ATOM 1399 O PRO A 26 -13.849 8.521 4.809 1.00 0.00 O ATOM 1400 CB PRO A 26 -12.583 10.424 6.845 1.00 0.00 C ATOM 1401 CG PRO A 26 -13.435 11.405 7.658 1.00 0.00 C ATOM 1402 CD PRO A 26 -14.632 11.818 6.790 1.00 0.00 C ATOM 0 HA PRO A 26 -12.131 11.225 4.819 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -12.812 9.395 7.124 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -11.523 10.580 7.045 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -13.776 10.939 8.583 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -12.848 12.279 7.939 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -15.551 11.321 7.101 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -14.818 12.891 6.837 1.00 0.00 H new ATOM 1410 N VAL A 27 -12.036 9.106 3.692 1.00 0.00 N ATOM 1411 CA VAL A 27 -12.009 7.814 2.916 1.00 0.00 C ATOM 1412 C VAL A 27 -10.579 7.287 2.855 1.00 0.00 C ATOM 1413 O VAL A 27 -9.632 8.025 3.035 1.00 0.00 O ATOM 1414 CB VAL A 27 -12.533 7.997 1.491 1.00 0.00 C ATOM 1415 CG1 VAL A 27 -14.053 8.176 1.524 1.00 0.00 C ATOM 1416 CG2 VAL A 27 -11.853 9.204 0.843 1.00 0.00 C ATOM 0 H VAL A 27 -11.284 9.757 3.467 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.658 7.104 3.430 1.00 0.00 H new ATOM 0 HB VAL A 27 -12.302 7.113 0.896 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.426 8.306 0.508 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.514 7.294 1.969 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -14.303 9.055 2.118 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.229 9.332 -0.172 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.070 10.100 1.425 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -10.775 9.042 0.814 1.00 0.00 H new ATOM 1426 N CYS A 28 -10.402 6.019 2.584 1.00 0.00 N ATOM 1427 CA CYS A 28 -9.022 5.473 2.497 1.00 0.00 C ATOM 1428 C CYS A 28 -8.444 5.754 1.103 1.00 0.00 C ATOM 1429 O CYS A 28 -9.163 5.961 0.144 1.00 0.00 O ATOM 1430 CB CYS A 28 -9.021 3.966 2.826 1.00 0.00 C ATOM 1431 SG CYS A 28 -9.800 2.968 1.524 1.00 0.00 S ATOM 0 H CYS A 28 -11.150 5.345 2.421 1.00 0.00 H new ATOM 0 HA CYS A 28 -8.386 5.966 3.232 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -7.994 3.630 2.971 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -9.546 3.803 3.767 1.00 0.00 H new ATOM 1436 N ASN A 29 -7.146 5.795 1.004 1.00 0.00 N ATOM 1437 CA ASN A 29 -6.474 6.096 -0.297 1.00 0.00 C ATOM 1438 C ASN A 29 -7.102 5.303 -1.448 1.00 0.00 C ATOM 1439 O ASN A 29 -7.289 5.821 -2.531 1.00 0.00 O ATOM 1440 CB ASN A 29 -4.999 5.704 -0.161 1.00 0.00 C ATOM 1441 CG ASN A 29 -4.253 5.913 -1.482 1.00 0.00 C ATOM 1442 OD1 ASN A 29 -4.830 5.833 -2.548 1.00 0.00 O ATOM 1443 ND2 ASN A 29 -2.971 6.149 -1.455 1.00 0.00 N ATOM 0 H ASN A 29 -6.508 5.630 1.782 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.586 7.156 -0.523 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.531 6.299 0.623 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -4.923 4.660 0.143 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.455 6.266 -2.327 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -2.484 6.217 -0.562 1.00 0.00 H new ATOM 1450 N ALA A 30 -7.410 4.061 -1.244 1.00 0.00 N ATOM 1451 CA ALA A 30 -7.998 3.261 -2.354 1.00 0.00 C ATOM 1452 C ALA A 30 -9.386 3.805 -2.750 1.00 0.00 C ATOM 1453 O ALA A 30 -9.633 4.102 -3.902 1.00 0.00 O ATOM 1454 CB ALA A 30 -8.103 1.803 -1.908 1.00 0.00 C ATOM 0 H ALA A 30 -7.283 3.562 -0.363 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.354 3.333 -3.230 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -8.533 1.206 -2.713 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -7.110 1.424 -1.666 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.741 1.737 -1.027 1.00 0.00 H new ATOM 1460 N CYS A 31 -10.295 3.929 -1.816 1.00 0.00 N ATOM 1461 CA CYS A 31 -11.658 4.440 -2.172 1.00 0.00 C ATOM 1462 C CYS A 31 -11.547 5.823 -2.799 1.00 0.00 C ATOM 1463 O CYS A 31 -12.208 6.132 -3.758 1.00 0.00 O ATOM 1464 CB CYS A 31 -12.529 4.577 -0.922 1.00 0.00 C ATOM 1465 SG CYS A 31 -13.013 2.959 -0.297 1.00 0.00 S ATOM 0 H CYS A 31 -10.157 3.702 -0.831 1.00 0.00 H new ATOM 0 HA CYS A 31 -12.105 3.729 -2.867 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -11.983 5.121 -0.151 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -13.418 5.162 -1.156 1.00 0.00 H new ATOM 1470 N GLY A 32 -10.737 6.665 -2.246 1.00 0.00 N ATOM 1471 CA GLY A 32 -10.623 8.035 -2.801 1.00 0.00 C ATOM 1472 C GLY A 32 -10.329 7.971 -4.301 1.00 0.00 C ATOM 1473 O GLY A 32 -11.038 8.540 -5.106 1.00 0.00 O ATOM 0 H GLY A 32 -10.149 6.469 -1.436 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.548 8.585 -2.627 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -9.828 8.578 -2.289 1.00 0.00 H new ATOM 1477 N LEU A 33 -9.280 7.297 -4.675 1.00 0.00 N ATOM 1478 CA LEU A 33 -8.918 7.206 -6.118 1.00 0.00 C ATOM 1479 C LEU A 33 -10.012 6.502 -6.923 1.00 0.00 C ATOM 1480 O LEU A 33 -10.447 6.995 -7.943 1.00 0.00 O ATOM 1481 CB LEU A 33 -7.619 6.410 -6.241 1.00 0.00 C ATOM 1482 CG LEU A 33 -6.499 7.114 -5.468 1.00 0.00 C ATOM 1483 CD1 LEU A 33 -5.305 6.165 -5.340 1.00 0.00 C ATOM 1484 CD2 LEU A 33 -6.060 8.389 -6.210 1.00 0.00 C ATOM 0 H LEU A 33 -8.653 6.802 -4.041 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.800 8.214 -6.514 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.762 5.402 -5.852 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.341 6.311 -7.290 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.865 7.389 -4.479 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.504 6.660 -4.791 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.610 5.266 -4.805 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.949 5.892 -6.333 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.264 8.880 -5.650 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.696 8.125 -7.203 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.909 9.066 -6.303 1.00 0.00 H new ATOM 1496 N TYR A 34 -10.459 5.356 -6.493 1.00 0.00 N ATOM 1497 CA TYR A 34 -11.517 4.655 -7.272 1.00 0.00 C ATOM 1498 C TYR A 34 -12.767 5.525 -7.348 1.00 0.00 C ATOM 1499 O TYR A 34 -13.392 5.647 -8.381 1.00 0.00 O ATOM 1500 CB TYR A 34 -11.873 3.321 -6.613 1.00 0.00 C ATOM 1501 CG TYR A 34 -12.978 2.648 -7.408 1.00 0.00 C ATOM 1502 CD1 TYR A 34 -12.776 2.305 -8.755 1.00 0.00 C ATOM 1503 CD2 TYR A 34 -14.207 2.369 -6.797 1.00 0.00 C ATOM 1504 CE1 TYR A 34 -13.803 1.687 -9.480 1.00 0.00 C ATOM 1505 CE2 TYR A 34 -15.230 1.751 -7.524 1.00 0.00 C ATOM 1506 CZ TYR A 34 -15.029 1.412 -8.865 1.00 0.00 C ATOM 1507 OH TYR A 34 -16.037 0.798 -9.578 1.00 0.00 O ATOM 0 H TYR A 34 -10.143 4.879 -5.648 1.00 0.00 H new ATOM 0 HA TYR A 34 -11.137 4.467 -8.276 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -10.995 2.677 -6.572 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -12.197 3.485 -5.585 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -11.830 2.517 -9.231 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -14.365 2.632 -5.761 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -13.648 1.422 -10.516 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -16.176 1.536 -7.049 1.00 0.00 H new ATOM 0 HH TYR A 34 -16.820 0.679 -9.001 1.00 0.00 H new ATOM 1517 N TYR A 35 -13.145 6.125 -6.259 1.00 0.00 N ATOM 1518 CA TYR A 35 -14.358 6.977 -6.262 1.00 0.00 C ATOM 1519 C TYR A 35 -14.163 8.142 -7.236 1.00 0.00 C ATOM 1520 O TYR A 35 -14.998 8.440 -8.046 1.00 0.00 O ATOM 1521 CB TYR A 35 -14.597 7.515 -4.844 1.00 0.00 C ATOM 1522 CG TYR A 35 -16.025 7.982 -4.715 1.00 0.00 C ATOM 1523 CD1 TYR A 35 -16.362 9.282 -5.092 1.00 0.00 C ATOM 1524 CD2 TYR A 35 -17.009 7.112 -4.221 1.00 0.00 C ATOM 1525 CE1 TYR A 35 -17.684 9.723 -4.978 1.00 0.00 C ATOM 1526 CE2 TYR A 35 -18.332 7.548 -4.105 1.00 0.00 C ATOM 1527 CZ TYR A 35 -18.673 8.856 -4.484 1.00 0.00 C ATOM 1528 OH TYR A 35 -19.978 9.293 -4.368 1.00 0.00 O ATOM 0 H TYR A 35 -12.663 6.061 -5.363 1.00 0.00 H new ATOM 0 HA TYR A 35 -15.221 6.391 -6.578 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -14.390 6.737 -4.109 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -13.914 8.339 -4.637 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -15.602 9.948 -5.472 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -16.744 6.106 -3.931 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -17.945 10.730 -5.270 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -19.090 6.880 -3.725 1.00 0.00 H new ATOM 0 HH TYR A 35 -20.535 8.570 -4.011 1.00 0.00 H new ATOM 1538 N LYS A 36 -13.072 8.821 -7.156 1.00 0.00 N ATOM 1539 CA LYS A 36 -12.861 9.969 -8.077 1.00 0.00 C ATOM 1540 C LYS A 36 -12.894 9.488 -9.538 1.00 0.00 C ATOM 1541 O LYS A 36 -13.485 10.123 -10.390 1.00 0.00 O ATOM 1542 CB LYS A 36 -11.499 10.581 -7.753 1.00 0.00 C ATOM 1543 CG LYS A 36 -11.218 11.785 -8.650 1.00 0.00 C ATOM 1544 CD LYS A 36 -9.849 12.375 -8.286 1.00 0.00 C ATOM 1545 CE LYS A 36 -8.719 11.446 -8.760 1.00 0.00 C ATOM 1546 NZ LYS A 36 -7.440 12.208 -8.830 1.00 0.00 N ATOM 0 H LYS A 36 -12.314 8.639 -6.498 1.00 0.00 H new ATOM 0 HA LYS A 36 -13.650 10.710 -7.949 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -11.472 10.887 -6.707 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -10.718 9.832 -7.886 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.231 11.484 -9.698 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -11.997 12.537 -8.524 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -9.736 13.358 -8.744 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -9.783 12.517 -7.207 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -8.615 10.604 -8.075 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -8.961 11.032 -9.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -6.677 11.578 -9.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -7.542 12.997 -9.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -7.207 12.582 -7.888 1.00 0.00 H new ATOM 1560 N LEU A 37 -12.261 8.386 -9.839 1.00 0.00 N ATOM 1561 CA LEU A 37 -12.252 7.884 -11.248 1.00 0.00 C ATOM 1562 C LEU A 37 -13.637 7.349 -11.668 1.00 0.00 C ATOM 1563 O LEU A 37 -14.066 7.569 -12.784 1.00 0.00 O ATOM 1564 CB LEU A 37 -11.200 6.759 -11.375 1.00 0.00 C ATOM 1565 CG LEU A 37 -9.828 7.343 -11.762 1.00 0.00 C ATOM 1566 CD1 LEU A 37 -9.447 8.482 -10.806 1.00 0.00 C ATOM 1567 CD2 LEU A 37 -8.770 6.235 -11.697 1.00 0.00 C ATOM 0 H LEU A 37 -11.749 7.810 -9.171 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.002 8.714 -11.908 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.119 6.221 -10.431 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -11.520 6.038 -12.127 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.881 7.741 -12.775 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.475 8.886 -11.090 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.198 9.270 -10.861 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -9.397 8.100 -9.786 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.797 6.644 -11.970 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -8.724 5.835 -10.684 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.036 5.437 -12.390 1.00 0.00 H new ATOM 1579 N HIS A 38 -14.319 6.618 -10.812 1.00 0.00 N ATOM 1580 CA HIS A 38 -15.653 6.036 -11.202 1.00 0.00 C ATOM 1581 C HIS A 38 -16.806 6.663 -10.403 1.00 0.00 C ATOM 1582 O HIS A 38 -17.955 6.517 -10.764 1.00 0.00 O ATOM 1583 CB HIS A 38 -15.623 4.529 -10.930 1.00 0.00 C ATOM 1584 CG HIS A 38 -14.389 3.928 -11.543 1.00 0.00 C ATOM 1585 ND1 HIS A 38 -14.423 3.180 -12.711 1.00 0.00 N ATOM 1586 CD2 HIS A 38 -13.074 3.958 -11.155 1.00 0.00 C ATOM 1587 CE1 HIS A 38 -13.160 2.793 -12.980 1.00 0.00 C ATOM 1588 NE2 HIS A 38 -12.300 3.242 -12.063 1.00 0.00 N ATOM 0 H HIS A 38 -14.013 6.399 -9.864 1.00 0.00 H new ATOM 0 HA HIS A 38 -15.824 6.245 -12.258 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -15.635 4.343 -9.856 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -16.514 4.057 -11.345 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -12.696 4.461 -10.277 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -12.878 2.193 -13.833 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -11.291 3.092 -12.034 1.00 0.00 H new ATOM 1596 N GLN A 39 -16.529 7.372 -9.342 1.00 0.00 N ATOM 1597 CA GLN A 39 -17.611 8.022 -8.536 1.00 0.00 C ATOM 1598 C GLN A 39 -18.786 7.071 -8.294 1.00 0.00 C ATOM 1599 O GLN A 39 -19.922 7.348 -8.618 1.00 0.00 O ATOM 1600 CB GLN A 39 -18.035 9.337 -9.204 1.00 0.00 C ATOM 1601 CG GLN A 39 -19.099 10.051 -8.353 1.00 0.00 C ATOM 1602 CD GLN A 39 -19.127 11.542 -8.700 1.00 0.00 C ATOM 1603 OE1 GLN A 39 -18.304 12.018 -9.456 1.00 0.00 O ATOM 1604 NE2 GLN A 39 -20.044 12.305 -8.171 1.00 0.00 N ATOM 0 H GLN A 39 -15.585 7.533 -8.992 1.00 0.00 H new ATOM 0 HA GLN A 39 -17.221 8.263 -7.547 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -17.167 9.984 -9.331 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -18.431 9.136 -10.199 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -20.079 9.608 -8.533 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -18.879 9.919 -7.294 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -20.735 11.906 -7.536 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -20.069 13.300 -8.392 1.00 0.00 H new ATOM 1613 N VAL A 40 -18.502 5.954 -7.681 1.00 0.00 N ATOM 1614 CA VAL A 40 -19.554 4.969 -7.345 1.00 0.00 C ATOM 1615 C VAL A 40 -19.117 4.218 -6.089 1.00 0.00 C ATOM 1616 O VAL A 40 -17.942 4.027 -5.848 1.00 0.00 O ATOM 1617 CB VAL A 40 -19.709 3.984 -8.490 1.00 0.00 C ATOM 1618 CG1 VAL A 40 -20.498 4.632 -9.627 1.00 0.00 C ATOM 1619 CG2 VAL A 40 -18.323 3.594 -8.987 1.00 0.00 C ATOM 0 H VAL A 40 -17.561 5.683 -7.395 1.00 0.00 H new ATOM 0 HA VAL A 40 -20.505 5.474 -7.176 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.246 3.099 -8.148 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -20.606 3.921 -10.446 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -21.485 4.923 -9.266 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -19.967 5.515 -9.981 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -18.418 2.886 -9.810 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -17.797 4.484 -9.332 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -17.762 3.133 -8.175 1.00 0.00 H new ATOM 1629 N ASN A 41 -20.047 3.782 -5.297 1.00 0.00 N ATOM 1630 CA ASN A 41 -19.680 3.028 -4.059 1.00 0.00 C ATOM 1631 C ASN A 41 -19.504 1.544 -4.417 1.00 0.00 C ATOM 1632 O ASN A 41 -20.273 0.998 -5.184 1.00 0.00 O ATOM 1633 CB ASN A 41 -20.792 3.176 -3.016 1.00 0.00 C ATOM 1634 CG ASN A 41 -22.119 2.702 -3.608 1.00 0.00 C ATOM 1635 OD1 ASN A 41 -22.214 2.445 -4.791 1.00 0.00 O ATOM 1636 ND2 ASN A 41 -23.158 2.578 -2.828 1.00 0.00 N ATOM 0 H ASN A 41 -21.048 3.911 -5.447 1.00 0.00 H new ATOM 0 HA ASN A 41 -18.751 3.423 -3.647 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -20.550 2.593 -2.127 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -20.874 4.217 -2.702 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -24.050 2.265 -3.212 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -23.078 2.794 -1.834 1.00 0.00 H new ATOM 1643 N ARG A 42 -18.488 0.892 -3.891 1.00 0.00 N ATOM 1644 CA ARG A 42 -18.242 -0.554 -4.220 1.00 0.00 C ATOM 1645 C ARG A 42 -18.284 -1.399 -2.925 1.00 0.00 C ATOM 1646 O ARG A 42 -17.977 -0.901 -1.861 1.00 0.00 O ATOM 1647 CB ARG A 42 -16.850 -0.668 -4.849 1.00 0.00 C ATOM 1648 CG ARG A 42 -15.864 0.219 -4.068 1.00 0.00 C ATOM 1649 CD ARG A 42 -14.434 -0.283 -4.274 1.00 0.00 C ATOM 1650 NE ARG A 42 -13.502 0.485 -3.406 1.00 0.00 N ATOM 1651 CZ ARG A 42 -12.325 -0.005 -3.140 1.00 0.00 C ATOM 1652 NH1 ARG A 42 -11.995 -1.181 -3.597 1.00 0.00 N ATOM 1653 NH2 ARG A 42 -11.481 0.672 -2.409 1.00 0.00 N ATOM 0 H ARG A 42 -17.815 1.303 -3.244 1.00 0.00 H new ATOM 0 HA ARG A 42 -19.006 -0.917 -4.907 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -16.515 -1.705 -4.833 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -16.884 -0.360 -5.894 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -15.947 1.253 -4.404 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -16.113 0.207 -3.007 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -14.374 -1.345 -4.038 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -14.147 -0.172 -5.320 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.782 1.388 -3.022 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -12.658 -1.714 -4.161 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -11.074 -1.568 -3.391 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.743 1.588 -2.044 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -10.560 0.285 -2.203 1.00 0.00 H new ATOM 1667 N PRO A 43 -18.662 -2.666 -3.002 1.00 0.00 N ATOM 1668 CA PRO A 43 -18.729 -3.540 -1.782 1.00 0.00 C ATOM 1669 C PRO A 43 -17.359 -3.745 -1.088 1.00 0.00 C ATOM 1670 O PRO A 43 -16.315 -3.674 -1.705 1.00 0.00 O ATOM 1671 CB PRO A 43 -19.286 -4.860 -2.354 1.00 0.00 C ATOM 1672 CG PRO A 43 -19.172 -4.800 -3.885 1.00 0.00 C ATOM 1673 CD PRO A 43 -19.049 -3.324 -4.289 1.00 0.00 C ATOM 0 HA PRO A 43 -19.340 -3.103 -0.992 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -18.727 -5.710 -1.963 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -20.325 -4.997 -2.054 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -18.303 -5.363 -4.226 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -20.047 -5.252 -4.351 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -18.295 -3.177 -5.063 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -19.988 -2.931 -4.679 1.00 0.00 H new ATOM 1681 N LEU A 44 -17.379 -3.995 0.203 1.00 0.00 N ATOM 1682 CA LEU A 44 -16.112 -4.205 0.988 1.00 0.00 C ATOM 1683 C LEU A 44 -15.380 -5.470 0.526 1.00 0.00 C ATOM 1684 O LEU A 44 -14.613 -6.055 1.267 1.00 0.00 O ATOM 1685 CB LEU A 44 -16.473 -4.340 2.481 1.00 0.00 C ATOM 1686 CG LEU A 44 -16.624 -2.948 3.097 1.00 0.00 C ATOM 1687 CD1 LEU A 44 -17.830 -2.244 2.473 1.00 0.00 C ATOM 1688 CD2 LEU A 44 -16.831 -3.061 4.612 1.00 0.00 C ATOM 0 H LEU A 44 -18.233 -4.064 0.756 1.00 0.00 H new ATOM 0 HA LEU A 44 -15.452 -3.352 0.828 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -17.401 -4.901 2.592 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -15.697 -4.899 3.005 1.00 0.00 H new ATOM 0 HG LEU A 44 -15.718 -2.373 2.902 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -17.939 -1.252 2.911 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -17.681 -2.151 1.397 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -18.731 -2.826 2.665 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -16.937 -2.064 5.040 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -17.732 -3.641 4.814 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -15.971 -3.559 5.061 1.00 0.00 H new ATOM 1700 N THR A 45 -15.594 -5.895 -0.682 1.00 0.00 N ATOM 1701 CA THR A 45 -14.892 -7.109 -1.168 1.00 0.00 C ATOM 1702 C THR A 45 -13.397 -6.794 -1.348 1.00 0.00 C ATOM 1703 O THR A 45 -12.573 -7.683 -1.430 1.00 0.00 O ATOM 1704 CB THR A 45 -15.517 -7.552 -2.500 1.00 0.00 C ATOM 1705 OG1 THR A 45 -15.114 -8.881 -2.790 1.00 0.00 O ATOM 1706 CG2 THR A 45 -15.074 -6.622 -3.636 1.00 0.00 C ATOM 0 H THR A 45 -16.223 -5.456 -1.354 1.00 0.00 H new ATOM 0 HA THR A 45 -14.993 -7.918 -0.445 1.00 0.00 H new ATOM 0 HB THR A 45 -16.603 -7.505 -2.413 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.513 -9.166 -3.639 1.00 0.00 H new ATOM 0 HG21 THR A 45 -15.526 -6.950 -4.572 1.00 0.00 H new ATOM 0 HG22 THR A 45 -15.393 -5.603 -3.417 1.00 0.00 H new ATOM 0 HG23 THR A 45 -13.988 -6.651 -3.727 1.00 0.00 H new ATOM 1714 N MET A 46 -13.042 -5.529 -1.409 1.00 0.00 N ATOM 1715 CA MET A 46 -11.598 -5.152 -1.583 1.00 0.00 C ATOM 1716 C MET A 46 -11.007 -4.756 -0.229 1.00 0.00 C ATOM 1717 O MET A 46 -9.841 -4.434 -0.117 1.00 0.00 O ATOM 1718 CB MET A 46 -11.494 -3.955 -2.533 1.00 0.00 C ATOM 1719 CG MET A 46 -11.940 -4.358 -3.943 1.00 0.00 C ATOM 1720 SD MET A 46 -10.606 -5.270 -4.767 1.00 0.00 S ATOM 1721 CE MET A 46 -9.658 -3.838 -5.349 1.00 0.00 C ATOM 0 H MET A 46 -13.688 -4.742 -1.346 1.00 0.00 H new ATOM 0 HA MET A 46 -11.052 -6.002 -1.993 1.00 0.00 H new ATOM 0 HB2 MET A 46 -12.114 -3.136 -2.168 1.00 0.00 H new ATOM 0 HB3 MET A 46 -10.467 -3.590 -2.559 1.00 0.00 H new ATOM 0 HG2 MET A 46 -12.837 -4.975 -3.889 1.00 0.00 H new ATOM 0 HG3 MET A 46 -12.198 -3.471 -4.521 1.00 0.00 H new ATOM 0 HE1 MET A 46 -8.929 -4.162 -6.091 1.00 0.00 H new ATOM 0 HE2 MET A 46 -10.335 -3.112 -5.798 1.00 0.00 H new ATOM 0 HE3 MET A 46 -9.140 -3.378 -4.507 1.00 0.00 H new ATOM 1731 N ARG A 47 -11.811 -4.760 0.794 1.00 0.00 N ATOM 1732 CA ARG A 47 -11.319 -4.367 2.143 1.00 0.00 C ATOM 1733 C ARG A 47 -10.521 -5.512 2.775 1.00 0.00 C ATOM 1734 O ARG A 47 -10.977 -6.636 2.845 1.00 0.00 O ATOM 1735 CB ARG A 47 -12.531 -4.045 3.021 1.00 0.00 C ATOM 1736 CG ARG A 47 -12.081 -3.644 4.428 1.00 0.00 C ATOM 1737 CD ARG A 47 -13.317 -3.382 5.279 1.00 0.00 C ATOM 1738 NE ARG A 47 -12.884 -2.964 6.645 1.00 0.00 N ATOM 1739 CZ ARG A 47 -13.754 -2.505 7.503 1.00 0.00 C ATOM 1740 NH1 ARG A 47 -15.017 -2.430 7.186 1.00 0.00 N ATOM 1741 NH2 ARG A 47 -13.359 -2.132 8.687 1.00 0.00 N ATOM 0 H ARG A 47 -12.796 -5.021 0.754 1.00 0.00 H new ATOM 0 HA ARG A 47 -10.667 -3.498 2.056 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -13.108 -3.236 2.573 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -13.188 -4.913 3.076 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -11.477 -4.436 4.872 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -11.456 -2.752 4.385 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -13.930 -2.604 4.824 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -13.932 -4.280 5.337 1.00 0.00 H new ATOM 0 HE ARG A 47 -11.902 -3.038 6.910 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -15.330 -2.731 6.263 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -15.692 -2.070 7.861 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -12.373 -2.199 8.940 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -14.035 -1.773 9.361 1.00 0.00 H new ATOM 1755 N LYS A 48 -9.335 -5.220 3.258 1.00 0.00 N ATOM 1756 CA LYS A 48 -8.488 -6.265 3.920 1.00 0.00 C ATOM 1757 C LYS A 48 -7.999 -5.713 5.262 1.00 0.00 C ATOM 1758 O LYS A 48 -7.934 -4.515 5.458 1.00 0.00 O ATOM 1759 CB LYS A 48 -7.277 -6.603 3.048 1.00 0.00 C ATOM 1760 CG LYS A 48 -7.731 -7.346 1.788 1.00 0.00 C ATOM 1761 CD LYS A 48 -6.497 -7.726 0.966 1.00 0.00 C ATOM 1762 CE LYS A 48 -6.924 -8.418 -0.332 1.00 0.00 C ATOM 1763 NZ LYS A 48 -7.624 -9.695 -0.020 1.00 0.00 N ATOM 0 H LYS A 48 -8.914 -4.292 3.221 1.00 0.00 H new ATOM 0 HA LYS A 48 -9.078 -7.170 4.066 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.751 -5.689 2.772 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.574 -7.218 3.610 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.293 -8.240 2.059 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -8.398 -6.716 1.199 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.914 -6.834 0.737 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -5.853 -8.388 1.546 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -7.582 -7.763 -0.904 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.051 -8.615 -0.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -7.685 -10.277 -0.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -7.094 -10.212 0.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.582 -9.490 0.327 1.00 0.00 H new ATOM 1777 N ASP A 49 -7.677 -6.563 6.200 1.00 0.00 N ATOM 1778 CA ASP A 49 -7.222 -6.069 7.530 1.00 0.00 C ATOM 1779 C ASP A 49 -6.070 -5.066 7.374 1.00 0.00 C ATOM 1780 O ASP A 49 -6.272 -3.868 7.412 1.00 0.00 O ATOM 1781 CB ASP A 49 -6.766 -7.264 8.372 1.00 0.00 C ATOM 1782 CG ASP A 49 -7.930 -8.248 8.521 1.00 0.00 C ATOM 1783 OD1 ASP A 49 -8.958 -7.842 9.038 1.00 0.00 O ATOM 1784 OD2 ASP A 49 -7.775 -9.387 8.111 1.00 0.00 O ATOM 0 H ASP A 49 -7.710 -7.578 6.102 1.00 0.00 H new ATOM 0 HA ASP A 49 -8.048 -5.559 8.025 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -5.917 -7.756 7.897 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -6.431 -6.927 9.353 1.00 0.00 H new ATOM 1789 N GLY A 50 -4.860 -5.539 7.236 1.00 0.00 N ATOM 1790 CA GLY A 50 -3.694 -4.608 7.117 1.00 0.00 C ATOM 1791 C GLY A 50 -3.612 -4.001 5.713 1.00 0.00 C ATOM 1792 O GLY A 50 -4.495 -4.169 4.895 1.00 0.00 O ATOM 0 H GLY A 50 -4.626 -6.531 7.200 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.784 -3.812 7.856 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.772 -5.145 7.338 1.00 0.00 H new ATOM 1796 N ILE A 51 -2.541 -3.298 5.432 1.00 0.00 N ATOM 1797 CA ILE A 51 -2.361 -2.675 4.091 1.00 0.00 C ATOM 1798 C ILE A 51 -1.593 -3.640 3.182 1.00 0.00 C ATOM 1799 O ILE A 51 -0.724 -4.367 3.617 1.00 0.00 O ATOM 1800 CB ILE A 51 -1.583 -1.366 4.258 1.00 0.00 C ATOM 1801 CG1 ILE A 51 -2.373 -0.458 5.218 1.00 0.00 C ATOM 1802 CG2 ILE A 51 -1.408 -0.668 2.897 1.00 0.00 C ATOM 1803 CD1 ILE A 51 -1.867 0.983 5.137 1.00 0.00 C ATOM 0 H ILE A 51 -1.777 -3.130 6.086 1.00 0.00 H new ATOM 0 HA ILE A 51 -3.329 -2.464 3.637 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.592 -1.572 4.662 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.433 -0.491 4.968 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.275 -0.827 6.239 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -0.853 0.260 3.033 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -0.859 -1.323 2.220 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.387 -0.447 2.473 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.438 1.608 5.823 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.812 1.014 5.410 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -1.989 1.355 4.120 1.00 0.00 H new ATOM 1815 N GLN A 52 -1.903 -3.631 1.917 1.00 0.00 N ATOM 1816 CA GLN A 52 -1.188 -4.527 0.961 1.00 0.00 C ATOM 1817 C GLN A 52 0.156 -3.897 0.589 1.00 0.00 C ATOM 1818 O GLN A 52 0.340 -2.706 0.691 1.00 0.00 O ATOM 1819 CB GLN A 52 -2.025 -4.698 -0.308 1.00 0.00 C ATOM 1820 CG GLN A 52 -3.261 -5.542 -0.010 1.00 0.00 C ATOM 1821 CD GLN A 52 -4.137 -5.614 -1.263 1.00 0.00 C ATOM 1822 OE1 GLN A 52 -4.949 -6.506 -1.399 1.00 0.00 O ATOM 1823 NE2 GLN A 52 -4.017 -4.694 -2.188 1.00 0.00 N ATOM 0 H GLN A 52 -2.623 -3.041 1.500 1.00 0.00 H new ATOM 0 HA GLN A 52 -1.028 -5.499 1.428 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.325 -3.722 -0.690 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.428 -5.175 -1.085 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -2.965 -6.544 0.299 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -3.823 -5.106 0.816 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -3.335 -3.944 -2.076 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -4.605 -4.728 -3.021 1.00 0.00 H new ATOM 1832 N THR A 53 1.110 -4.686 0.181 1.00 0.00 N ATOM 1833 CA THR A 53 2.442 -4.115 -0.189 1.00 0.00 C ATOM 1834 C THR A 53 2.970 -4.810 -1.440 1.00 0.00 C ATOM 1835 O THR A 53 2.556 -5.896 -1.798 1.00 0.00 O ATOM 1836 CB THR A 53 3.424 -4.281 0.972 1.00 0.00 C ATOM 1837 OG1 THR A 53 4.750 -4.342 0.469 1.00 0.00 O ATOM 1838 CG2 THR A 53 3.097 -5.559 1.735 1.00 0.00 C ATOM 0 H THR A 53 1.029 -5.698 0.087 1.00 0.00 H new ATOM 0 HA THR A 53 2.332 -3.051 -0.399 1.00 0.00 H new ATOM 0 HB THR A 53 3.339 -3.429 1.647 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.378 -4.447 1.214 1.00 0.00 H new ATOM 0 HG21 THR A 53 3.796 -5.678 2.562 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.081 -5.500 2.125 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.180 -6.414 1.064 1.00 0.00 H new ATOM 1846 N ARG A 54 3.866 -4.157 -2.115 1.00 0.00 N ATOM 1847 CA ARG A 54 4.438 -4.714 -3.376 1.00 0.00 C ATOM 1848 C ARG A 54 5.871 -4.209 -3.539 1.00 0.00 C ATOM 1849 O ARG A 54 6.235 -3.174 -3.016 1.00 0.00 O ATOM 1850 CB ARG A 54 3.569 -4.236 -4.554 1.00 0.00 C ATOM 1851 CG ARG A 54 3.965 -4.945 -5.872 1.00 0.00 C ATOM 1852 CD ARG A 54 3.115 -6.206 -6.095 1.00 0.00 C ATOM 1853 NE ARG A 54 3.461 -7.229 -5.077 1.00 0.00 N ATOM 1854 CZ ARG A 54 2.697 -8.273 -4.931 1.00 0.00 C ATOM 1855 NH1 ARG A 54 1.645 -8.424 -5.689 1.00 0.00 N ATOM 1856 NH2 ARG A 54 2.987 -9.170 -4.032 1.00 0.00 N ATOM 0 H ARG A 54 4.236 -3.245 -1.846 1.00 0.00 H new ATOM 0 HA ARG A 54 4.449 -5.804 -3.347 1.00 0.00 H new ATOM 0 HB2 ARG A 54 2.519 -4.430 -4.336 1.00 0.00 H new ATOM 0 HB3 ARG A 54 3.676 -3.158 -4.673 1.00 0.00 H new ATOM 0 HG2 ARG A 54 3.835 -4.261 -6.711 1.00 0.00 H new ATOM 0 HG3 ARG A 54 5.021 -5.214 -5.841 1.00 0.00 H new ATOM 0 HD2 ARG A 54 2.056 -5.958 -6.030 1.00 0.00 H new ATOM 0 HD3 ARG A 54 3.289 -6.601 -7.096 1.00 0.00 H new ATOM 0 HE ARG A 54 4.291 -7.115 -4.496 1.00 0.00 H new ATOM 0 HH11 ARG A 54 1.421 -7.724 -6.396 1.00 0.00 H new ATOM 0 HH12 ARG A 54 1.047 -9.242 -5.574 1.00 0.00 H new ATOM 0 HH21 ARG A 54 3.812 -9.054 -3.443 1.00 0.00 H new ATOM 0 HH22 ARG A 54 2.389 -9.988 -3.917 1.00 0.00 H new ATOM 1870 N ASN A 55 6.689 -4.920 -4.264 1.00 0.00 N ATOM 1871 CA ASN A 55 8.087 -4.460 -4.452 1.00 0.00 C ATOM 1872 C ASN A 55 8.058 -3.041 -5.018 1.00 0.00 C ATOM 1873 O ASN A 55 7.259 -2.720 -5.876 1.00 0.00 O ATOM 1874 CB ASN A 55 8.801 -5.386 -5.442 1.00 0.00 C ATOM 1875 CG ASN A 55 9.009 -6.760 -4.805 1.00 0.00 C ATOM 1876 OD1 ASN A 55 8.771 -7.774 -5.430 1.00 0.00 O ATOM 1877 ND2 ASN A 55 9.448 -6.838 -3.579 1.00 0.00 N ATOM 0 H ASN A 55 6.449 -5.795 -4.731 1.00 0.00 H new ATOM 0 HA ASN A 55 8.617 -4.475 -3.500 1.00 0.00 H new ATOM 0 HB2 ASN A 55 8.212 -5.483 -6.354 1.00 0.00 H new ATOM 0 HB3 ASN A 55 9.762 -4.958 -5.727 1.00 0.00 H new ATOM 0 HD21 ASN A 55 9.591 -7.750 -3.146 1.00 0.00 H new ATOM 0 HD22 ASN A 55 9.648 -5.987 -3.054 1.00 0.00 H new ATOM 1884 N ARG A 56 8.911 -2.189 -4.536 1.00 0.00 N ATOM 1885 CA ARG A 56 8.927 -0.784 -5.032 1.00 0.00 C ATOM 1886 C ARG A 56 9.256 -0.752 -6.526 1.00 0.00 C ATOM 1887 O ARG A 56 10.220 -1.345 -6.969 1.00 0.00 O ATOM 1888 CB ARG A 56 10.006 -0.009 -4.278 1.00 0.00 C ATOM 1889 CG ARG A 56 9.677 0.007 -2.783 1.00 0.00 C ATOM 1890 CD ARG A 56 10.617 0.977 -2.062 1.00 0.00 C ATOM 1891 NE ARG A 56 10.623 0.676 -0.602 1.00 0.00 N ATOM 1892 CZ ARG A 56 11.562 1.161 0.162 1.00 0.00 C ATOM 1893 NH1 ARG A 56 12.474 1.949 -0.342 1.00 0.00 N ATOM 1894 NH2 ARG A 56 11.583 0.862 1.433 1.00 0.00 N ATOM 0 H ARG A 56 9.602 -2.402 -3.817 1.00 0.00 H new ATOM 0 HA ARG A 56 7.946 -0.337 -4.870 1.00 0.00 H new ATOM 0 HB2 ARG A 56 10.980 -0.470 -4.441 1.00 0.00 H new ATOM 0 HB3 ARG A 56 10.068 1.011 -4.658 1.00 0.00 H new ATOM 0 HG2 ARG A 56 8.641 0.308 -2.631 1.00 0.00 H new ATOM 0 HG3 ARG A 56 9.782 -0.995 -2.366 1.00 0.00 H new ATOM 0 HD2 ARG A 56 11.626 0.889 -2.466 1.00 0.00 H new ATOM 0 HD3 ARG A 56 10.294 2.004 -2.230 1.00 0.00 H new ATOM 0 HE ARG A 56 9.892 0.090 -0.200 1.00 0.00 H new ATOM 0 HH11 ARG A 56 12.452 2.185 -1.334 1.00 0.00 H new ATOM 0 HH12 ARG A 56 13.208 2.328 0.256 1.00 0.00 H new ATOM 0 HH21 ARG A 56 10.867 0.251 1.825 1.00 0.00 H new ATOM 0 HH22 ARG A 56 12.316 1.239 2.034 1.00 0.00 H new ATOM 1908 N LYS A 57 8.466 -0.063 -7.307 1.00 0.00 N ATOM 1909 CA LYS A 57 8.741 0.006 -8.770 1.00 0.00 C ATOM 1910 C LYS A 57 10.147 0.556 -9.008 1.00 0.00 C ATOM 1911 O LYS A 57 10.924 0.716 -8.087 1.00 0.00 O ATOM 1912 CB LYS A 57 7.723 0.907 -9.443 1.00 0.00 C ATOM 1913 CG LYS A 57 7.738 2.262 -8.769 1.00 0.00 C ATOM 1914 CD LYS A 57 6.684 3.136 -9.428 1.00 0.00 C ATOM 1915 CE LYS A 57 6.738 4.550 -8.851 1.00 0.00 C ATOM 1916 NZ LYS A 57 6.023 4.587 -7.543 1.00 0.00 N ATOM 0 H LYS A 57 7.644 0.454 -6.995 1.00 0.00 H new ATOM 0 HA LYS A 57 8.670 -0.996 -9.192 1.00 0.00 H new ATOM 0 HB2 LYS A 57 7.956 1.012 -10.503 1.00 0.00 H new ATOM 0 HB3 LYS A 57 6.729 0.465 -9.377 1.00 0.00 H new ATOM 0 HG2 LYS A 57 7.533 2.158 -7.704 1.00 0.00 H new ATOM 0 HG3 LYS A 57 8.723 2.721 -8.861 1.00 0.00 H new ATOM 0 HD2 LYS A 57 6.849 3.168 -10.505 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.694 2.708 -9.269 1.00 0.00 H new ATOM 0 HE2 LYS A 57 7.775 4.860 -8.719 1.00 0.00 H new ATOM 0 HE3 LYS A 57 6.281 5.254 -9.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 6.062 5.550 -7.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.030 4.309 -7.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 6.478 3.927 -6.880 1.00 0.00 H new ATOM 1930 N VAL A 58 10.481 0.844 -10.235 1.00 0.00 N ATOM 1931 CA VAL A 58 11.838 1.378 -10.527 1.00 0.00 C ATOM 1932 C VAL A 58 12.014 2.719 -9.821 1.00 0.00 C ATOM 1933 O VAL A 58 11.147 3.570 -9.863 1.00 0.00 O ATOM 1934 CB VAL A 58 11.998 1.577 -12.034 1.00 0.00 C ATOM 1935 CG1 VAL A 58 13.393 2.133 -12.333 1.00 0.00 C ATOM 1936 CG2 VAL A 58 11.821 0.231 -12.740 1.00 0.00 C ATOM 0 H VAL A 58 9.873 0.732 -11.046 1.00 0.00 H new ATOM 0 HA VAL A 58 12.589 0.673 -10.172 1.00 0.00 H new ATOM 0 HB VAL A 58 11.247 2.281 -12.392 1.00 0.00 H new ATOM 0 HG11 VAL A 58 13.506 2.274 -13.408 1.00 0.00 H new ATOM 0 HG12 VAL A 58 13.520 3.090 -11.826 1.00 0.00 H new ATOM 0 HG13 VAL A 58 14.148 1.431 -11.978 1.00 0.00 H new ATOM 0 HG21 VAL A 58 11.934 0.367 -13.816 1.00 0.00 H new ATOM 0 HG22 VAL A 58 12.575 -0.470 -12.381 1.00 0.00 H new ATOM 0 HG23 VAL A 58 10.828 -0.164 -12.527 1.00 0.00 H new ATOM 1946 N SER A 59 13.132 2.925 -9.187 1.00 0.00 N ATOM 1947 CA SER A 59 13.348 4.228 -8.499 1.00 0.00 C ATOM 1948 C SER A 59 13.733 5.262 -9.551 1.00 0.00 C ATOM 1949 O SER A 59 14.707 5.098 -10.258 1.00 0.00 O ATOM 1950 CB SER A 59 14.465 4.109 -7.462 1.00 0.00 C ATOM 1951 OG SER A 59 14.208 2.999 -6.615 1.00 0.00 O ATOM 0 H SER A 59 13.899 2.256 -9.115 1.00 0.00 H new ATOM 0 HA SER A 59 12.435 4.527 -7.983 1.00 0.00 H new ATOM 0 HB2 SER A 59 15.427 3.985 -7.960 1.00 0.00 H new ATOM 0 HB3 SER A 59 14.527 5.023 -6.872 1.00 0.00 H new ATOM 0 HG SER A 59 14.925 2.921 -5.951 1.00 0.00 H new ATOM 1957 N SER A 60 12.971 6.319 -9.674 1.00 0.00 N ATOM 1958 CA SER A 60 13.287 7.362 -10.699 1.00 0.00 C ATOM 1959 C SER A 60 13.215 8.748 -10.064 1.00 0.00 C ATOM 1960 O SER A 60 12.371 9.020 -9.235 1.00 0.00 O ATOM 1961 CB SER A 60 12.276 7.274 -11.842 1.00 0.00 C ATOM 1962 OG SER A 60 12.784 7.981 -12.965 1.00 0.00 O ATOM 0 H SER A 60 12.143 6.506 -9.109 1.00 0.00 H new ATOM 0 HA SER A 60 14.292 7.194 -11.085 1.00 0.00 H new ATOM 0 HB2 SER A 60 12.094 6.232 -12.104 1.00 0.00 H new ATOM 0 HB3 SER A 60 11.320 7.696 -11.532 1.00 0.00 H new ATOM 0 HG SER A 60 12.142 7.928 -13.703 1.00 0.00 H new ATOM 1968 N LYS A 61 14.100 9.624 -10.460 1.00 0.00 N ATOM 1969 CA LYS A 61 14.110 11.010 -9.903 1.00 0.00 C ATOM 1970 C LYS A 61 14.133 12.004 -11.069 1.00 0.00 C ATOM 1971 O LYS A 61 14.834 11.813 -12.042 1.00 0.00 O ATOM 1972 CB LYS A 61 15.362 11.196 -9.041 1.00 0.00 C ATOM 1973 CG LYS A 61 15.236 10.348 -7.766 1.00 0.00 C ATOM 1974 CD LYS A 61 16.461 10.557 -6.860 1.00 0.00 C ATOM 1975 CE LYS A 61 17.635 9.690 -7.336 1.00 0.00 C ATOM 1976 NZ LYS A 61 18.795 9.885 -6.420 1.00 0.00 N ATOM 0 H LYS A 61 14.825 9.437 -11.153 1.00 0.00 H new ATOM 0 HA LYS A 61 13.224 11.179 -9.291 1.00 0.00 H new ATOM 0 HB2 LYS A 61 16.249 10.901 -9.601 1.00 0.00 H new ATOM 0 HB3 LYS A 61 15.485 12.247 -8.781 1.00 0.00 H new ATOM 0 HG2 LYS A 61 14.328 10.620 -7.229 1.00 0.00 H new ATOM 0 HG3 LYS A 61 15.146 9.294 -8.030 1.00 0.00 H new ATOM 0 HD2 LYS A 61 16.751 11.608 -6.867 1.00 0.00 H new ATOM 0 HD3 LYS A 61 16.207 10.303 -5.831 1.00 0.00 H new ATOM 0 HE2 LYS A 61 17.343 8.640 -7.353 1.00 0.00 H new ATOM 0 HE3 LYS A 61 17.912 9.960 -8.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 19.592 9.299 -6.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 19.077 10.886 -6.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 18.526 9.606 -5.455 1.00 0.00 H new ATOM 1990 N GLY A 62 13.370 13.059 -10.986 1.00 0.00 N ATOM 1991 CA GLY A 62 13.355 14.051 -12.100 1.00 0.00 C ATOM 1992 C GLY A 62 14.565 14.976 -11.974 1.00 0.00 C ATOM 1993 O GLY A 62 14.469 16.074 -11.464 1.00 0.00 O ATOM 0 H GLY A 62 12.759 13.277 -10.199 1.00 0.00 H new ATOM 0 HA2 GLY A 62 13.376 13.536 -13.060 1.00 0.00 H new ATOM 0 HA3 GLY A 62 12.434 14.633 -12.071 1.00 0.00 H new ATOM 1997 N LYS A 63 15.706 14.542 -12.434 1.00 0.00 N ATOM 1998 CA LYS A 63 16.921 15.397 -12.337 1.00 0.00 C ATOM 1999 C LYS A 63 16.782 16.618 -13.256 1.00 0.00 C ATOM 2000 O LYS A 63 17.217 17.702 -12.923 1.00 0.00 O ATOM 2001 CB LYS A 63 18.155 14.585 -12.744 1.00 0.00 C ATOM 2002 CG LYS A 63 18.459 13.527 -11.674 1.00 0.00 C ATOM 2003 CD LYS A 63 19.695 12.721 -12.091 1.00 0.00 C ATOM 2004 CE LYS A 63 20.008 11.661 -11.031 1.00 0.00 C ATOM 2005 NZ LYS A 63 18.942 10.620 -11.035 1.00 0.00 N ATOM 0 H LYS A 63 15.849 13.632 -12.873 1.00 0.00 H new ATOM 0 HA LYS A 63 17.033 15.738 -11.308 1.00 0.00 H new ATOM 0 HB2 LYS A 63 17.983 14.103 -13.706 1.00 0.00 H new ATOM 0 HB3 LYS A 63 19.012 15.247 -12.868 1.00 0.00 H new ATOM 0 HG2 LYS A 63 18.632 14.007 -10.711 1.00 0.00 H new ATOM 0 HG3 LYS A 63 17.603 12.863 -11.550 1.00 0.00 H new ATOM 0 HD2 LYS A 63 19.520 12.243 -13.055 1.00 0.00 H new ATOM 0 HD3 LYS A 63 20.549 13.387 -12.215 1.00 0.00 H new ATOM 0 HE2 LYS A 63 20.977 11.205 -11.234 1.00 0.00 H new ATOM 0 HE3 LYS A 63 20.074 12.125 -10.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 19.367 9.687 -10.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 18.249 10.830 -10.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 18.465 10.615 -11.959 1.00 0.00 H new ATOM 2019 N LYS A 64 16.195 16.457 -14.419 1.00 0.00 N ATOM 2020 CA LYS A 64 16.059 17.626 -15.345 1.00 0.00 C ATOM 2021 C LYS A 64 14.907 17.418 -16.339 1.00 0.00 C ATOM 2022 O LYS A 64 14.195 18.348 -16.661 1.00 0.00 O ATOM 2023 CB LYS A 64 17.367 17.800 -16.117 1.00 0.00 C ATOM 2024 CG LYS A 64 17.667 16.521 -16.897 1.00 0.00 C ATOM 2025 CD LYS A 64 19.087 16.580 -17.462 1.00 0.00 C ATOM 2026 CE LYS A 64 19.359 15.315 -18.277 1.00 0.00 C ATOM 2027 NZ LYS A 64 19.575 14.167 -17.351 1.00 0.00 N ATOM 0 H LYS A 64 15.809 15.578 -14.764 1.00 0.00 H new ATOM 0 HA LYS A 64 15.841 18.515 -14.753 1.00 0.00 H new ATOM 0 HB2 LYS A 64 17.290 18.646 -16.800 1.00 0.00 H new ATOM 0 HB3 LYS A 64 18.183 18.019 -15.428 1.00 0.00 H new ATOM 0 HG2 LYS A 64 17.561 15.654 -16.246 1.00 0.00 H new ATOM 0 HG3 LYS A 64 16.948 16.401 -17.707 1.00 0.00 H new ATOM 0 HD2 LYS A 64 19.205 17.463 -18.090 1.00 0.00 H new ATOM 0 HD3 LYS A 64 19.810 16.667 -16.651 1.00 0.00 H new ATOM 0 HE2 LYS A 64 18.519 15.109 -18.940 1.00 0.00 H new ATOM 0 HE3 LYS A 64 20.236 15.457 -18.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 19.941 13.354 -17.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 20.262 14.437 -16.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 18.673 13.909 -16.902 1.00 0.00 H new ATOM 2041 N ARG A 65 14.725 16.218 -16.840 1.00 0.00 N ATOM 2042 CA ARG A 65 13.626 15.961 -17.831 1.00 0.00 C ATOM 2043 C ARG A 65 12.536 15.108 -17.177 1.00 0.00 C ATOM 2044 O ARG A 65 12.795 14.048 -16.641 1.00 0.00 O ATOM 2045 CB ARG A 65 14.206 15.215 -19.047 1.00 0.00 C ATOM 2046 CG ARG A 65 13.154 15.101 -20.171 1.00 0.00 C ATOM 2047 CD ARG A 65 13.146 16.366 -21.044 1.00 0.00 C ATOM 2048 NE ARG A 65 11.899 16.391 -21.865 1.00 0.00 N ATOM 2049 CZ ARG A 65 11.548 17.479 -22.499 1.00 0.00 C ATOM 2050 NH1 ARG A 65 12.283 18.554 -22.415 1.00 0.00 N ATOM 2051 NH2 ARG A 65 10.461 17.490 -23.219 1.00 0.00 N ATOM 0 H ARG A 65 15.291 15.403 -16.605 1.00 0.00 H new ATOM 0 HA ARG A 65 13.195 16.908 -18.155 1.00 0.00 H new ATOM 0 HB2 ARG A 65 15.085 15.742 -19.417 1.00 0.00 H new ATOM 0 HB3 ARG A 65 14.534 14.220 -18.747 1.00 0.00 H new ATOM 0 HG2 ARG A 65 13.369 14.229 -20.789 1.00 0.00 H new ATOM 0 HG3 ARG A 65 12.166 14.948 -19.736 1.00 0.00 H new ATOM 0 HD2 ARG A 65 13.200 17.255 -20.416 1.00 0.00 H new ATOM 0 HD3 ARG A 65 14.022 16.380 -21.692 1.00 0.00 H new ATOM 0 HE ARG A 65 11.318 15.555 -21.931 1.00 0.00 H new ATOM 0 HH11 ARG A 65 13.134 18.547 -21.853 1.00 0.00 H new ATOM 0 HH12 ARG A 65 12.006 19.401 -22.911 1.00 0.00 H new ATOM 0 HH21 ARG A 65 9.886 16.650 -23.287 1.00 0.00 H new ATOM 0 HH22 ARG A 65 10.186 18.338 -23.714 1.00 0.00 H new ATOM 2065 N ARG A 66 11.313 15.567 -17.220 1.00 0.00 N ATOM 2066 CA ARG A 66 10.199 14.790 -16.605 1.00 0.00 C ATOM 2067 C ARG A 66 10.101 13.420 -17.282 1.00 0.00 C ATOM 2068 O ARG A 66 9.977 12.436 -16.570 1.00 0.00 O ATOM 2069 CB ARG A 66 8.877 15.541 -16.794 1.00 0.00 C ATOM 2070 CG ARG A 66 8.883 16.822 -15.954 1.00 0.00 C ATOM 2071 CD ARG A 66 7.558 17.566 -16.147 1.00 0.00 C ATOM 2072 NE ARG A 66 6.454 16.751 -15.559 1.00 0.00 N ATOM 2073 CZ ARG A 66 5.269 17.271 -15.381 1.00 0.00 C ATOM 2074 NH1 ARG A 66 5.038 18.513 -15.711 1.00 0.00 N ATOM 2075 NH2 ARG A 66 4.313 16.543 -14.870 1.00 0.00 N ATOM 2076 OXT ARG A 66 10.150 13.377 -18.500 1.00 0.00 O ATOM 0 H ARG A 66 11.038 16.448 -17.655 1.00 0.00 H new ATOM 0 HA ARG A 66 10.395 14.663 -15.540 1.00 0.00 H new ATOM 0 HB2 ARG A 66 8.735 15.786 -17.847 1.00 0.00 H new ATOM 0 HB3 ARG A 66 8.042 14.906 -16.499 1.00 0.00 H new ATOM 0 HG2 ARG A 66 9.025 16.578 -14.901 1.00 0.00 H new ATOM 0 HG3 ARG A 66 9.716 17.459 -16.249 1.00 0.00 H new ATOM 0 HD2 ARG A 66 7.601 18.544 -15.667 1.00 0.00 H new ATOM 0 HD3 ARG A 66 7.374 17.740 -17.207 1.00 0.00 H new ATOM 0 HE ARG A 66 6.626 15.781 -15.294 1.00 0.00 H new ATOM 0 HH11 ARG A 66 5.785 19.082 -16.110 1.00 0.00 H new ATOM 0 HH12 ARG A 66 4.111 18.914 -15.570 1.00 0.00 H new ATOM 0 HH21 ARG A 66 4.493 15.573 -14.612 1.00 0.00 H new ATOM 0 HH22 ARG A 66 3.386 16.945 -14.729 1.00 0.00 H new TER 2090 ARG A 66 HETATM 2091 ZN ZN A 67 -12.111 2.826 1.791 1.00 0.00 ZN