USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 913 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 60 SER OG : rot 141:sc= 0.627 USER MOD Set 1.2: A 61 LYS NZ :NH3+ 161:sc= -0.692 (180deg=-1.81) USER MOD Set 2.1: A 16 THR OG1 : rot -150:sc= -0.117 USER MOD Set 2.2: A 29 ASN : amide:sc= -6.66! C(o=-8!,f=-8.4!) USER MOD Set 2.3: C 125 DT C7 :methyl 150:sc= -1.26 (180deg=-0.408) USER MOD Set 3.1: A 12 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 14 THR OG1 : rot 13:sc= 0.916 USER MOD Single : A 1 LYS N :NH3+ -177:sc= -3.27! (180deg=-3.3!) USER MOD Single : A 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 86:sc= -0.303 USER MOD Single : A 8 SER OG : rot 66:sc= 1.18 USER MOD Single : A 9 ASN : amide:sc= -3.03! C(o=-3!,f=-4.2!) USER MOD Single : A 11 GLN : amide:sc= -0.521 X(o=-0.52,f=-0.47) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -135:sc= 0.884 USER MOD Single : A 21 SER OG : rot 180:sc= 0.199 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+ 139:sc= -0.921 (180deg=-1.67!) USER MOD Single : A 38 HIS : no HD1:sc= -0.0846 X(o=-0.085,f=0) USER MOD Single : A 39 GLN : amide:sc= -2.5! C(o=-2.5!,f=-2.4!) USER MOD Single : A 41 ASN : amide:sc= 0.156 K(o=0.16,f=-6.3!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 170:sc= -0.614 (180deg=-0.965) USER MOD Single : A 48 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0558) USER MOD Single : A 52 GLN : amide:sc= -2.06 K(o=-2.1,f=-5.5!) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.243 USER MOD Single : A 55 ASN : amide:sc= -0.0712 K(o=-0.071,f=-1.4!) USER MOD Single : A 57 LYS NZ :NH3+ -158:sc= 1.83 (180deg=1.13!) USER MOD Single : A 59 SER OG : rot 28:sc= 0.17 USER MOD Single : A 63 LYS NZ :NH3+ 152:sc= -0.278 (180deg=-1.44!) USER MOD Single : A 64 LYS NZ :NH3+ 160:sc= -0.0667 (180deg=-0.565) USER MOD Single : B 101 DG O5' : rot 68:sc= -0.374! USER MOD Single : B 102 DT C7 :methyl -30:sc= -1.5! (180deg=-2.06!) USER MOD Single : B 103 DT C7 :methyl -30:sc= -1 (180deg=-1.73!) USER MOD Single : B 109 DT C7 :methyl 150:sc= -1.93 (180deg=-1.93) USER MOD Single : B 115 DT C7 :methyl -30:sc= -0.942 (180deg=-1.4) USER MOD Single : B 116 DT C7 :methyl 150:sc= -0.733 (180deg=-0.733) USER MOD Single : B 116 DT O3' : rot 180:sc= 0 USER MOD Single : C 117 DA O5' : rot 82:sc= -1.16! USER MOD Single : C 119 DT C7 :methyl -30:sc= -0.743 (180deg=-1.23) USER MOD Single : C 121 DT C7 :methyl 150:sc= -0.678 (180deg=-0.678) USER MOD Single : C 122 DT C7 :methyl 150:sc= -0.731 (180deg=-0.731) USER MOD Single : C 123 DT C7 :methyl -30:sc= -1.54! (180deg=-3.39) USER MOD Single : C 127 DT C7 :methyl -30:sc= -1.11 (180deg=-1.42!) USER MOD Single : C 132 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG B 101 19.179 24.568 7.485 1.00 0.00 O ATOM 2 C5' DG B 101 19.747 24.269 8.761 1.00 0.00 C ATOM 3 C4' DG B 101 18.823 23.374 9.588 1.00 0.00 C ATOM 4 O4' DG B 101 17.651 24.118 9.987 1.00 0.00 O ATOM 5 C3' DG B 101 18.351 22.152 8.794 1.00 0.00 C ATOM 6 O3' DG B 101 18.445 20.973 9.594 1.00 0.00 O ATOM 7 C2' DG B 101 16.911 22.437 8.445 1.00 0.00 C ATOM 8 C1' DG B 101 16.480 23.621 9.304 1.00 0.00 C ATOM 9 N9 DG B 101 15.868 24.686 8.481 1.00 0.00 N ATOM 10 C8 DG B 101 16.314 25.253 7.319 1.00 0.00 C ATOM 11 N7 DG B 101 15.535 26.163 6.813 1.00 0.00 N ATOM 12 C5 DG B 101 14.474 26.210 7.717 1.00 0.00 C ATOM 13 C6 DG B 101 13.305 27.016 7.707 1.00 0.00 C ATOM 14 O6 DG B 101 12.966 27.862 6.882 1.00 0.00 O ATOM 15 N1 DG B 101 12.498 26.748 8.806 1.00 0.00 N ATOM 16 C2 DG B 101 12.777 25.826 9.790 1.00 0.00 C ATOM 17 N2 DG B 101 11.892 25.733 10.782 1.00 0.00 N ATOM 18 N3 DG B 101 13.872 25.066 9.801 1.00 0.00 N ATOM 19 C4 DG B 101 14.673 25.310 8.739 1.00 0.00 C ATOM 0 H5' DG B 101 19.938 25.196 9.302 1.00 0.00 H new ATOM 0 H5'' DG B 101 20.709 23.775 8.626 1.00 0.00 H new ATOM 0 H4' DG B 101 19.393 23.039 10.454 1.00 0.00 H new ATOM 0 H3' DG B 101 18.960 21.983 7.906 1.00 0.00 H new ATOM 0 H2' DG B 101 16.808 22.670 7.385 1.00 0.00 H new ATOM 0 H2'' DG B 101 16.285 21.567 8.643 1.00 0.00 H new ATOM 0 HO5' DG B 101 18.390 25.137 7.603 1.00 0.00 H new ATOM 0 H1' DG B 101 15.725 23.301 10.022 1.00 0.00 H new ATOM 0 H8 DG B 101 17.246 24.966 6.855 1.00 0.00 H new ATOM 0 H1 DG B 101 11.630 27.276 8.891 1.00 0.00 H new ATOM 0 H21 DG B 101 12.044 25.068 11.540 1.00 0.00 H new ATOM 0 H22 DG B 101 11.063 26.327 10.783 1.00 0.00 H new ATOM 32 P DT B 102 18.013 19.531 9.015 1.00 0.00 P ATOM 33 OP1 DT B 102 18.901 18.510 9.613 1.00 0.00 O ATOM 34 OP2 DT B 102 17.902 19.638 7.543 1.00 0.00 O ATOM 35 O5' DT B 102 16.532 19.326 9.624 1.00 0.00 O ATOM 36 C5' DT B 102 16.340 19.311 11.042 1.00 0.00 C ATOM 37 C4' DT B 102 14.869 19.106 11.438 1.00 0.00 C ATOM 38 O4' DT B 102 14.078 20.282 11.128 1.00 0.00 O ATOM 39 C3' DT B 102 14.232 17.909 10.720 1.00 0.00 C ATOM 40 O3' DT B 102 13.753 16.966 11.679 1.00 0.00 O ATOM 41 C2' DT B 102 13.064 18.471 9.941 1.00 0.00 C ATOM 42 C1' DT B 102 12.880 19.910 10.405 1.00 0.00 C ATOM 43 N1 DT B 102 12.639 20.841 9.268 1.00 0.00 N ATOM 44 C2 DT B 102 11.478 21.606 9.274 1.00 0.00 C ATOM 45 O2 DT B 102 10.632 21.501 10.159 1.00 0.00 O ATOM 46 N3 DT B 102 11.325 22.491 8.223 1.00 0.00 N ATOM 47 C4 DT B 102 12.211 22.673 7.177 1.00 0.00 C ATOM 48 O4 DT B 102 11.976 23.495 6.294 1.00 0.00 O ATOM 49 C5 DT B 102 13.385 21.832 7.247 1.00 0.00 C ATOM 50 C7 DT B 102 14.433 21.927 6.133 1.00 0.00 C ATOM 51 C6 DT B 102 13.557 20.963 8.270 1.00 0.00 C ATOM 0 H5' DT B 102 16.698 20.250 11.463 1.00 0.00 H new ATOM 0 H5'' DT B 102 16.944 18.515 11.478 1.00 0.00 H new ATOM 0 H4' DT B 102 14.873 18.919 12.512 1.00 0.00 H new ATOM 0 H3' DT B 102 14.948 17.401 10.074 1.00 0.00 H new ATOM 0 H2' DT B 102 13.259 18.432 8.869 1.00 0.00 H new ATOM 0 H2'' DT B 102 12.161 17.888 10.122 1.00 0.00 H new ATOM 0 H1' DT B 102 11.999 19.980 11.042 1.00 0.00 H new ATOM 0 H3 DT B 102 10.480 23.063 8.219 1.00 0.00 H new ATOM 0 H71 DT B 102 13.946 22.206 5.198 1.00 0.00 H new ATOM 0 H72 DT B 102 15.175 22.681 6.395 1.00 0.00 H new ATOM 0 H73 DT B 102 14.924 20.962 6.012 1.00 0.00 H new ATOM 0 H6 DT B 102 14.446 20.350 8.295 1.00 0.00 H new ATOM 64 P DT B 103 13.033 15.604 11.212 1.00 0.00 P ATOM 65 OP1 DT B 103 13.176 14.608 12.299 1.00 0.00 O ATOM 66 OP2 DT B 103 13.489 15.282 9.842 1.00 0.00 O ATOM 67 O5' DT B 103 11.489 16.055 11.138 1.00 0.00 O ATOM 68 C5' DT B 103 10.831 16.544 12.307 1.00 0.00 C ATOM 69 C4' DT B 103 9.384 16.962 12.030 1.00 0.00 C ATOM 70 O4' DT B 103 9.343 18.170 11.235 1.00 0.00 O ATOM 71 C3' DT B 103 8.602 15.876 11.280 1.00 0.00 C ATOM 72 O3' DT B 103 7.533 15.416 12.099 1.00 0.00 O ATOM 73 C2' DT B 103 8.053 16.555 10.039 1.00 0.00 C ATOM 74 C1' DT B 103 8.353 18.046 10.194 1.00 0.00 C ATOM 75 N1 DT B 103 8.840 18.651 8.921 1.00 0.00 N ATOM 76 C2 DT B 103 8.121 19.705 8.367 1.00 0.00 C ATOM 77 O2 DT B 103 7.090 20.134 8.880 1.00 0.00 O ATOM 78 N3 DT B 103 8.636 20.247 7.201 1.00 0.00 N ATOM 79 C4 DT B 103 9.784 19.835 6.551 1.00 0.00 C ATOM 80 O4 DT B 103 10.154 20.391 5.521 1.00 0.00 O ATOM 81 C5 DT B 103 10.465 18.734 7.196 1.00 0.00 C ATOM 82 C7 DT B 103 11.747 18.183 6.563 1.00 0.00 C ATOM 83 C6 DT B 103 9.978 18.191 8.336 1.00 0.00 C ATOM 0 H5' DT B 103 11.383 17.397 12.702 1.00 0.00 H new ATOM 0 H5'' DT B 103 10.843 15.772 13.077 1.00 0.00 H new ATOM 0 H4' DT B 103 8.922 17.128 13.003 1.00 0.00 H new ATOM 0 H3' DT B 103 9.224 15.018 11.026 1.00 0.00 H new ATOM 0 H2' DT B 103 8.521 16.156 9.139 1.00 0.00 H new ATOM 0 H2'' DT B 103 6.981 16.382 9.944 1.00 0.00 H new ATOM 0 H1' DT B 103 7.442 18.585 10.454 1.00 0.00 H new ATOM 0 H3 DT B 103 8.120 21.022 6.784 1.00 0.00 H new ATOM 0 H71 DT B 103 11.705 18.316 5.482 1.00 0.00 H new ATOM 0 H72 DT B 103 12.609 18.718 6.962 1.00 0.00 H new ATOM 0 H73 DT B 103 11.840 17.122 6.795 1.00 0.00 H new ATOM 0 H6 DT B 103 10.508 17.369 8.794 1.00 0.00 H new ATOM 96 P DG B 104 6.570 14.213 11.648 1.00 0.00 P ATOM 97 OP1 DG B 104 5.994 13.598 12.863 1.00 0.00 O ATOM 98 OP2 DG B 104 7.301 13.376 10.670 1.00 0.00 O ATOM 99 O5' DG B 104 5.397 14.984 10.869 1.00 0.00 O ATOM 100 C5' DG B 104 4.612 15.961 11.547 1.00 0.00 C ATOM 101 C4' DG B 104 3.548 16.555 10.626 1.00 0.00 C ATOM 102 O4' DG B 104 4.166 17.345 9.580 1.00 0.00 O ATOM 103 C3' DG B 104 2.730 15.447 9.958 1.00 0.00 C ATOM 104 O3' DG B 104 1.339 15.674 10.185 1.00 0.00 O ATOM 105 C2' DG B 104 3.038 15.545 8.487 1.00 0.00 C ATOM 106 C1' DG B 104 3.797 16.843 8.274 1.00 0.00 C ATOM 107 N9 DG B 104 4.997 16.648 7.426 1.00 0.00 N ATOM 108 C8 DG B 104 6.013 15.744 7.551 1.00 0.00 C ATOM 109 N7 DG B 104 6.961 15.849 6.663 1.00 0.00 N ATOM 110 C5 DG B 104 6.537 16.915 5.867 1.00 0.00 C ATOM 111 C6 DG B 104 7.150 17.509 4.726 1.00 0.00 C ATOM 112 O6 DG B 104 8.216 17.214 4.185 1.00 0.00 O ATOM 113 N1 DG B 104 6.387 18.555 4.225 1.00 0.00 N ATOM 114 C2 DG B 104 5.184 18.981 4.751 1.00 0.00 C ATOM 115 N2 DG B 104 4.590 19.996 4.125 1.00 0.00 N ATOM 116 N3 DG B 104 4.608 18.428 5.821 1.00 0.00 N ATOM 117 C4 DG B 104 5.334 17.406 6.326 1.00 0.00 C ATOM 0 H5' DG B 104 5.259 16.756 11.919 1.00 0.00 H new ATOM 0 H5'' DG B 104 4.133 15.507 12.415 1.00 0.00 H new ATOM 0 H4' DG B 104 2.899 17.181 11.238 1.00 0.00 H new ATOM 0 H3' DG B 104 2.975 14.462 10.354 1.00 0.00 H new ATOM 0 H2' DG B 104 3.634 14.693 8.161 1.00 0.00 H new ATOM 0 H2'' DG B 104 2.120 15.535 7.900 1.00 0.00 H new ATOM 0 H1' DG B 104 3.165 17.558 7.747 1.00 0.00 H new ATOM 0 H8 DG B 104 6.030 14.996 8.330 1.00 0.00 H new ATOM 0 H1 DG B 104 6.743 19.047 3.405 1.00 0.00 H new ATOM 0 H21 DG B 104 3.699 20.355 4.467 1.00 0.00 H new ATOM 0 H22 DG B 104 5.027 20.414 3.304 1.00 0.00 H new ATOM 129 P DC B 105 0.208 14.672 9.628 1.00 0.00 P ATOM 130 OP1 DC B 105 -0.990 14.810 10.484 1.00 0.00 O ATOM 131 OP2 DC B 105 0.827 13.338 9.445 1.00 0.00 O ATOM 132 O5' DC B 105 -0.151 15.259 8.173 1.00 0.00 O ATOM 133 C5' DC B 105 -0.659 16.587 8.043 1.00 0.00 C ATOM 134 C4' DC B 105 -0.941 16.959 6.582 1.00 0.00 C ATOM 135 O4' DC B 105 0.287 17.095 5.820 1.00 0.00 O ATOM 136 C3' DC B 105 -1.799 15.899 5.883 1.00 0.00 C ATOM 137 O3' DC B 105 -2.958 16.524 5.331 1.00 0.00 O ATOM 138 C2' DC B 105 -0.939 15.325 4.790 1.00 0.00 C ATOM 139 C1' DC B 105 0.223 16.285 4.618 1.00 0.00 C ATOM 140 N1 DC B 105 1.509 15.575 4.384 1.00 0.00 N ATOM 141 C2 DC B 105 2.204 15.830 3.203 1.00 0.00 C ATOM 142 O2 DC B 105 1.727 16.591 2.362 1.00 0.00 O ATOM 143 N3 DC B 105 3.406 15.223 3.017 1.00 0.00 N ATOM 144 C4 DC B 105 3.912 14.401 3.945 1.00 0.00 C ATOM 145 N4 DC B 105 5.089 13.816 3.728 1.00 0.00 N ATOM 146 C5 DC B 105 3.204 14.137 5.157 1.00 0.00 C ATOM 147 C6 DC B 105 2.012 14.739 5.327 1.00 0.00 C ATOM 0 H5' DC B 105 0.059 17.291 8.463 1.00 0.00 H new ATOM 0 H5'' DC B 105 -1.576 16.682 8.624 1.00 0.00 H new ATOM 0 H4' DC B 105 -1.473 17.910 6.614 1.00 0.00 H new ATOM 0 H3' DC B 105 -2.132 15.119 6.568 1.00 0.00 H new ATOM 0 H2' DC B 105 -0.585 14.329 5.056 1.00 0.00 H new ATOM 0 H2'' DC B 105 -1.503 15.226 3.862 1.00 0.00 H new ATOM 0 H1' DC B 105 0.063 16.905 3.736 1.00 0.00 H new ATOM 0 H41 DC B 105 5.483 13.188 4.429 1.00 0.00 H new ATOM 0 H42 DC B 105 5.596 13.996 2.861 1.00 0.00 H new ATOM 0 H5 DC B 105 3.610 13.478 5.910 1.00 0.00 H new ATOM 0 H6 DC B 105 1.447 14.554 6.229 1.00 0.00 H new ATOM 159 P DA B 106 -4.073 15.691 4.526 1.00 0.00 P ATOM 160 OP1 DA B 106 -5.395 16.307 4.779 1.00 0.00 O ATOM 161 OP2 DA B 106 -3.863 14.252 4.800 1.00 0.00 O ATOM 162 O5' DA B 106 -3.659 15.976 2.995 1.00 0.00 O ATOM 163 C5' DA B 106 -3.643 17.322 2.508 1.00 0.00 C ATOM 164 C4' DA B 106 -3.228 17.404 1.036 1.00 0.00 C ATOM 165 O4' DA B 106 -1.821 17.083 0.873 1.00 0.00 O ATOM 166 C3' DA B 106 -4.034 16.436 0.169 1.00 0.00 C ATOM 167 O3' DA B 106 -4.713 17.150 -0.855 1.00 0.00 O ATOM 168 C2' DA B 106 -3.026 15.496 -0.458 1.00 0.00 C ATOM 169 C1' DA B 106 -1.642 16.021 -0.099 1.00 0.00 C ATOM 170 N9 DA B 106 -0.804 14.945 0.447 1.00 0.00 N ATOM 171 C8 DA B 106 -1.071 14.151 1.499 1.00 0.00 C ATOM 172 N7 DA B 106 -0.146 13.294 1.806 1.00 0.00 N ATOM 173 C5 DA B 106 0.835 13.540 0.845 1.00 0.00 C ATOM 174 C6 DA B 106 2.086 12.963 0.598 1.00 0.00 C ATOM 175 N6 DA B 106 2.597 11.982 1.342 1.00 0.00 N ATOM 176 N1 DA B 106 2.793 13.440 -0.441 1.00 0.00 N ATOM 177 C2 DA B 106 2.301 14.425 -1.192 1.00 0.00 C ATOM 178 N3 DA B 106 1.130 15.046 -1.043 1.00 0.00 N ATOM 179 C4 DA B 106 0.442 14.546 0.006 1.00 0.00 C ATOM 0 H5' DA B 106 -2.955 17.916 3.110 1.00 0.00 H new ATOM 0 H5'' DA B 106 -4.633 17.761 2.629 1.00 0.00 H new ATOM 0 H4' DA B 106 -3.421 18.429 0.718 1.00 0.00 H new ATOM 0 H3' DA B 106 -4.778 15.901 0.759 1.00 0.00 H new ATOM 0 H2' DA B 106 -3.162 14.481 -0.085 1.00 0.00 H new ATOM 0 H2'' DA B 106 -3.155 15.458 -1.540 1.00 0.00 H new ATOM 0 H1' DA B 106 -1.134 16.401 -0.986 1.00 0.00 H new ATOM 0 H8 DA B 106 -1.996 14.222 2.053 1.00 0.00 H new ATOM 0 H61 DA B 106 3.514 11.597 1.118 1.00 0.00 H new ATOM 0 H62 DA B 106 2.070 11.617 2.136 1.00 0.00 H new ATOM 0 H2 DA B 106 2.919 14.757 -2.013 1.00 0.00 H new ATOM 191 P DG B 107 -5.632 16.363 -1.905 1.00 0.00 P ATOM 192 OP1 DG B 107 -6.610 17.310 -2.486 1.00 0.00 O ATOM 193 OP2 DG B 107 -6.093 15.105 -1.277 1.00 0.00 O ATOM 194 O5' DG B 107 -4.540 16.003 -3.021 1.00 0.00 O ATOM 195 C5' DG B 107 -3.834 17.047 -3.684 1.00 0.00 C ATOM 196 C4' DG B 107 -2.828 16.495 -4.689 1.00 0.00 C ATOM 197 O4' DG B 107 -1.709 15.847 -4.022 1.00 0.00 O ATOM 198 C3' DG B 107 -3.477 15.462 -5.612 1.00 0.00 C ATOM 199 O3' DG B 107 -3.379 15.899 -6.965 1.00 0.00 O ATOM 200 C2' DG B 107 -2.703 14.186 -5.402 1.00 0.00 C ATOM 201 C1' DG B 107 -1.450 14.569 -4.648 1.00 0.00 C ATOM 202 N9 DG B 107 -1.053 13.525 -3.669 1.00 0.00 N ATOM 203 C8 DG B 107 -1.704 13.078 -2.545 1.00 0.00 C ATOM 204 N7 DG B 107 -1.060 12.210 -1.850 1.00 0.00 N ATOM 205 C5 DG B 107 0.120 12.036 -2.551 1.00 0.00 C ATOM 206 C6 DG B 107 1.214 11.191 -2.261 1.00 0.00 C ATOM 207 O6 DG B 107 1.355 10.445 -1.298 1.00 0.00 O ATOM 208 N1 DG B 107 2.208 11.292 -3.225 1.00 0.00 N ATOM 209 C2 DG B 107 2.158 12.111 -4.328 1.00 0.00 C ATOM 210 N2 DG B 107 3.195 12.025 -5.167 1.00 0.00 N ATOM 211 N3 DG B 107 1.126 12.923 -4.602 1.00 0.00 N ATOM 212 C4 DG B 107 0.142 12.831 -3.670 1.00 0.00 C ATOM 0 H5' DG B 107 -3.314 17.660 -2.948 1.00 0.00 H new ATOM 0 H5'' DG B 107 -4.542 17.697 -4.197 1.00 0.00 H new ATOM 0 H4' DG B 107 -2.474 17.349 -5.267 1.00 0.00 H new ATOM 0 H3' DG B 107 -4.536 15.320 -5.395 1.00 0.00 H new ATOM 0 H2' DG B 107 -3.291 13.463 -4.837 1.00 0.00 H new ATOM 0 H2'' DG B 107 -2.456 13.720 -6.356 1.00 0.00 H new ATOM 0 H1' DG B 107 -0.602 14.652 -5.327 1.00 0.00 H new ATOM 0 H8 DG B 107 -2.686 13.431 -2.266 1.00 0.00 H new ATOM 0 H1 DG B 107 3.040 10.714 -3.106 1.00 0.00 H new ATOM 0 H21 DG B 107 3.222 12.605 -6.006 1.00 0.00 H new ATOM 0 H22 DG B 107 3.959 11.379 -4.968 1.00 0.00 H new ATOM 224 P DA B 108 -3.973 15.021 -8.170 1.00 0.00 P ATOM 225 OP1 DA B 108 -4.487 15.944 -9.207 1.00 0.00 O ATOM 226 OP2 DA B 108 -4.862 13.989 -7.592 1.00 0.00 O ATOM 227 O5' DA B 108 -2.664 14.286 -8.753 1.00 0.00 O ATOM 228 C5' DA B 108 -1.584 15.080 -9.256 1.00 0.00 C ATOM 229 C4' DA B 108 -0.422 14.230 -9.780 1.00 0.00 C ATOM 230 O4' DA B 108 0.288 13.560 -8.701 1.00 0.00 O ATOM 231 C3' DA B 108 -0.925 13.152 -10.744 1.00 0.00 C ATOM 232 O3' DA B 108 -0.194 13.224 -11.969 1.00 0.00 O ATOM 233 C2' DA B 108 -0.675 11.838 -10.042 1.00 0.00 C ATOM 234 C1' DA B 108 0.311 12.126 -8.926 1.00 0.00 C ATOM 235 N9 DA B 108 -0.031 11.390 -7.689 1.00 0.00 N ATOM 236 C8 DA B 108 -1.195 11.412 -6.977 1.00 0.00 C ATOM 237 N7 DA B 108 -1.174 10.766 -5.855 1.00 0.00 N ATOM 238 C5 DA B 108 0.119 10.252 -5.813 1.00 0.00 C ATOM 239 C6 DA B 108 0.784 9.464 -4.875 1.00 0.00 C ATOM 240 N6 DA B 108 0.242 9.108 -3.723 1.00 0.00 N ATOM 241 N1 DA B 108 2.048 9.113 -5.138 1.00 0.00 N ATOM 242 C2 DA B 108 2.638 9.521 -6.255 1.00 0.00 C ATOM 243 N3 DA B 108 2.105 10.286 -7.214 1.00 0.00 N ATOM 244 C4 DA B 108 0.825 10.617 -6.923 1.00 0.00 C ATOM 0 H5' DA B 108 -1.221 15.736 -8.465 1.00 0.00 H new ATOM 0 H5'' DA B 108 -1.951 15.720 -10.058 1.00 0.00 H new ATOM 0 H4' DA B 108 0.253 14.917 -10.291 1.00 0.00 H new ATOM 0 H3' DA B 108 -1.979 13.273 -10.992 1.00 0.00 H new ATOM 0 H2' DA B 108 -1.603 11.429 -9.643 1.00 0.00 H new ATOM 0 H2'' DA B 108 -0.272 11.099 -10.734 1.00 0.00 H new ATOM 0 H1' DA B 108 1.309 11.792 -9.210 1.00 0.00 H new ATOM 0 H8 DA B 108 -2.074 11.933 -7.326 1.00 0.00 H new ATOM 0 H61 DA B 108 0.769 8.530 -3.069 1.00 0.00 H new ATOM 0 H62 DA B 108 -0.703 9.412 -3.489 1.00 0.00 H new ATOM 0 H2 DA B 108 3.658 9.201 -6.406 1.00 0.00 H new ATOM 256 P DT B 109 -0.489 12.218 -13.189 1.00 0.00 P ATOM 257 OP1 DT B 109 -0.273 12.950 -14.457 1.00 0.00 O ATOM 258 OP2 DT B 109 -1.779 11.540 -12.933 1.00 0.00 O ATOM 259 O5' DT B 109 0.694 11.142 -13.016 1.00 0.00 O ATOM 260 C5' DT B 109 2.049 11.590 -13.089 1.00 0.00 C ATOM 261 C4' DT B 109 3.053 10.451 -12.905 1.00 0.00 C ATOM 262 O4' DT B 109 3.000 9.943 -11.552 1.00 0.00 O ATOM 263 C3' DT B 109 2.795 9.285 -13.865 1.00 0.00 C ATOM 264 O3' DT B 109 3.942 9.081 -14.685 1.00 0.00 O ATOM 265 C2' DT B 109 2.566 8.074 -12.988 1.00 0.00 C ATOM 266 C1' DT B 109 2.868 8.506 -11.557 1.00 0.00 C ATOM 267 N1 DT B 109 1.793 8.072 -10.620 1.00 0.00 N ATOM 268 C2 DT B 109 2.128 7.229 -9.569 1.00 0.00 C ATOM 269 O2 DT B 109 3.272 6.824 -9.400 1.00 0.00 O ATOM 270 N3 DT B 109 1.100 6.884 -8.711 1.00 0.00 N ATOM 271 C4 DT B 109 -0.213 7.304 -8.806 1.00 0.00 C ATOM 272 O4 DT B 109 -1.047 6.939 -7.982 1.00 0.00 O ATOM 273 C5 DT B 109 -0.474 8.176 -9.925 1.00 0.00 C ATOM 274 C7 DT B 109 -1.893 8.715 -10.127 1.00 0.00 C ATOM 275 C6 DT B 109 0.519 8.523 -10.781 1.00 0.00 C ATOM 0 H5' DT B 109 2.220 12.348 -12.324 1.00 0.00 H new ATOM 0 H5'' DT B 109 2.219 12.068 -14.054 1.00 0.00 H new ATOM 0 H4' DT B 109 4.036 10.870 -13.120 1.00 0.00 H new ATOM 0 H3' DT B 109 1.943 9.474 -14.518 1.00 0.00 H new ATOM 0 H2' DT B 109 1.539 7.720 -13.077 1.00 0.00 H new ATOM 0 H2'' DT B 109 3.214 7.250 -13.289 1.00 0.00 H new ATOM 0 H1' DT B 109 3.791 8.036 -11.216 1.00 0.00 H new ATOM 0 H3 DT B 109 1.332 6.262 -7.937 1.00 0.00 H new ATOM 0 H71 DT B 109 -1.846 9.692 -10.607 1.00 0.00 H new ATOM 0 H72 DT B 109 -2.457 8.028 -10.757 1.00 0.00 H new ATOM 0 H73 DT B 109 -2.387 8.809 -9.160 1.00 0.00 H new ATOM 0 H6 DT B 109 0.293 9.174 -11.612 1.00 0.00 H new ATOM 288 P DA B 110 3.950 8.008 -15.882 1.00 0.00 P ATOM 289 OP1 DA B 110 5.049 8.355 -16.810 1.00 0.00 O ATOM 290 OP2 DA B 110 2.567 7.868 -16.394 1.00 0.00 O ATOM 291 O5' DA B 110 4.344 6.649 -15.120 1.00 0.00 O ATOM 292 C5' DA B 110 5.579 6.552 -14.416 1.00 0.00 C ATOM 293 C4' DA B 110 5.750 5.178 -13.767 1.00 0.00 C ATOM 294 O4' DA B 110 4.776 5.003 -12.698 1.00 0.00 O ATOM 295 C3' DA B 110 5.527 4.044 -14.772 1.00 0.00 C ATOM 296 O3' DA B 110 6.601 3.111 -14.665 1.00 0.00 O ATOM 297 C2' DA B 110 4.223 3.394 -14.387 1.00 0.00 C ATOM 298 C1' DA B 110 3.869 3.907 -13.000 1.00 0.00 C ATOM 299 N9 DA B 110 2.449 4.345 -12.931 1.00 0.00 N ATOM 300 C8 DA B 110 1.758 5.169 -13.776 1.00 0.00 C ATOM 301 N7 DA B 110 0.511 5.363 -13.464 1.00 0.00 N ATOM 302 C5 DA B 110 0.350 4.603 -12.307 1.00 0.00 C ATOM 303 C6 DA B 110 -0.752 4.377 -11.468 1.00 0.00 C ATOM 304 N6 DA B 110 -1.954 4.910 -11.686 1.00 0.00 N ATOM 305 N1 DA B 110 -0.570 3.570 -10.407 1.00 0.00 N ATOM 306 C2 DA B 110 0.623 3.018 -10.184 1.00 0.00 C ATOM 307 N3 DA B 110 1.730 3.165 -10.914 1.00 0.00 N ATOM 308 C4 DA B 110 1.520 3.980 -11.971 1.00 0.00 C ATOM 0 H5' DA B 110 5.623 7.325 -13.649 1.00 0.00 H new ATOM 0 H5'' DA B 110 6.405 6.736 -15.102 1.00 0.00 H new ATOM 0 H4' DA B 110 6.770 5.136 -13.385 1.00 0.00 H new ATOM 0 H3' DA B 110 5.492 4.403 -15.800 1.00 0.00 H new ATOM 0 H2' DA B 110 3.440 3.644 -15.103 1.00 0.00 H new ATOM 0 H2'' DA B 110 4.318 2.308 -14.385 1.00 0.00 H new ATOM 0 H1' DA B 110 3.979 3.111 -12.263 1.00 0.00 H new ATOM 0 H8 DA B 110 2.216 5.626 -14.641 1.00 0.00 H new ATOM 0 H61 DA B 110 -2.723 4.714 -11.045 1.00 0.00 H new ATOM 0 H62 DA B 110 -2.105 5.514 -12.494 1.00 0.00 H new ATOM 0 H2 DA B 110 0.702 2.381 -9.316 1.00 0.00 H new ATOM 320 P DA B 111 6.690 1.788 -15.579 1.00 0.00 P ATOM 321 OP1 DA B 111 8.117 1.500 -15.847 1.00 0.00 O ATOM 322 OP2 DA B 111 5.736 1.929 -16.700 1.00 0.00 O ATOM 323 O5' DA B 111 6.125 0.674 -14.562 1.00 0.00 O ATOM 324 C5' DA B 111 6.819 0.464 -13.331 1.00 0.00 C ATOM 325 C4' DA B 111 6.068 -0.462 -12.367 1.00 0.00 C ATOM 326 O4' DA B 111 4.780 0.108 -12.027 1.00 0.00 O ATOM 327 C3' DA B 111 5.819 -1.863 -12.940 1.00 0.00 C ATOM 328 O3' DA B 111 6.391 -2.827 -12.062 1.00 0.00 O ATOM 329 C2' DA B 111 4.322 -2.041 -12.988 1.00 0.00 C ATOM 330 C1' DA B 111 3.720 -0.852 -12.255 1.00 0.00 C ATOM 331 N9 DA B 111 2.635 -0.259 -13.051 1.00 0.00 N ATOM 332 C8 DA B 111 2.690 0.258 -14.305 1.00 0.00 C ATOM 333 N7 DA B 111 1.565 0.712 -14.766 1.00 0.00 N ATOM 334 C5 DA B 111 0.679 0.471 -13.718 1.00 0.00 C ATOM 335 C6 DA B 111 -0.688 0.714 -13.559 1.00 0.00 C ATOM 336 N6 DA B 111 -1.438 1.287 -14.499 1.00 0.00 N ATOM 337 N1 DA B 111 -1.249 0.347 -12.395 1.00 0.00 N ATOM 338 C2 DA B 111 -0.509 -0.224 -11.443 1.00 0.00 C ATOM 339 N3 DA B 111 0.790 -0.498 -11.493 1.00 0.00 N ATOM 340 C4 DA B 111 1.324 -0.121 -12.670 1.00 0.00 C ATOM 0 H5' DA B 111 6.985 1.426 -12.846 1.00 0.00 H new ATOM 0 H5'' DA B 111 7.801 0.040 -13.542 1.00 0.00 H new ATOM 0 H4' DA B 111 6.709 -0.558 -11.491 1.00 0.00 H new ATOM 0 H3' DA B 111 6.261 -1.985 -13.929 1.00 0.00 H new ATOM 0 H2' DA B 111 3.969 -2.080 -14.019 1.00 0.00 H new ATOM 0 H2'' DA B 111 4.028 -2.978 -12.515 1.00 0.00 H new ATOM 0 H1' DA B 111 3.291 -1.165 -11.303 1.00 0.00 H new ATOM 0 H8 DA B 111 3.605 0.289 -14.878 1.00 0.00 H new ATOM 0 H61 DA B 111 -2.432 1.442 -14.334 1.00 0.00 H new ATOM 0 H62 DA B 111 -1.018 1.570 -15.384 1.00 0.00 H new ATOM 0 H2 DA B 111 -1.022 -0.493 -10.532 1.00 0.00 H new ATOM 352 P DA B 112 6.318 -4.405 -12.351 1.00 0.00 P ATOM 353 OP1 DA B 112 7.388 -5.075 -11.579 1.00 0.00 O ATOM 354 OP2 DA B 112 6.213 -4.611 -13.814 1.00 0.00 O ATOM 355 O5' DA B 112 4.900 -4.766 -11.682 1.00 0.00 O ATOM 356 C5' DA B 112 4.689 -4.525 -10.291 1.00 0.00 C ATOM 357 C4' DA B 112 3.253 -4.841 -9.861 1.00 0.00 C ATOM 358 O4' DA B 112 2.321 -3.962 -10.558 1.00 0.00 O ATOM 359 C3' DA B 112 2.854 -6.281 -10.198 1.00 0.00 C ATOM 360 O3' DA B 112 2.262 -6.897 -9.042 1.00 0.00 O ATOM 361 C2' DA B 112 1.867 -6.176 -11.329 1.00 0.00 C ATOM 362 C1' DA B 112 1.366 -4.745 -11.318 1.00 0.00 C ATOM 363 N9 DA B 112 1.170 -4.220 -12.689 1.00 0.00 N ATOM 364 C8 DA B 112 2.007 -4.246 -13.770 1.00 0.00 C ATOM 365 N7 DA B 112 1.522 -3.717 -14.856 1.00 0.00 N ATOM 366 C5 DA B 112 0.251 -3.302 -14.462 1.00 0.00 C ATOM 367 C6 DA B 112 -0.795 -2.667 -15.142 1.00 0.00 C ATOM 368 N6 DA B 112 -0.727 -2.327 -16.429 1.00 0.00 N ATOM 369 N1 DA B 112 -1.918 -2.405 -14.446 1.00 0.00 N ATOM 370 C2 DA B 112 -2.005 -2.751 -13.161 1.00 0.00 C ATOM 371 N3 DA B 112 -1.079 -3.355 -12.430 1.00 0.00 N ATOM 372 C4 DA B 112 0.032 -3.602 -13.149 1.00 0.00 C ATOM 0 H5' DA B 112 4.913 -3.482 -10.067 1.00 0.00 H new ATOM 0 H5'' DA B 112 5.383 -5.132 -9.709 1.00 0.00 H new ATOM 0 H4' DA B 112 3.211 -4.696 -8.781 1.00 0.00 H new ATOM 0 H3' DA B 112 3.707 -6.895 -10.486 1.00 0.00 H new ATOM 0 H2' DA B 112 2.339 -6.416 -12.282 1.00 0.00 H new ATOM 0 H2'' DA B 112 1.044 -6.878 -11.195 1.00 0.00 H new ATOM 0 H1' DA B 112 0.384 -4.688 -10.849 1.00 0.00 H new ATOM 0 H8 DA B 112 2.998 -4.674 -13.726 1.00 0.00 H new ATOM 0 H61 DA B 112 -1.519 -1.866 -16.877 1.00 0.00 H new ATOM 0 H62 DA B 112 0.117 -2.528 -16.966 1.00 0.00 H new ATOM 0 H2 DA B 112 -2.932 -2.513 -12.661 1.00 0.00 H new ATOM 384 P DC B 113 1.734 -8.419 -9.070 1.00 0.00 P ATOM 385 OP1 DC B 113 1.995 -9.017 -7.742 1.00 0.00 O ATOM 386 OP2 DC B 113 2.286 -9.067 -10.281 1.00 0.00 O ATOM 387 O5' DC B 113 0.129 -8.308 -9.258 1.00 0.00 O ATOM 388 C5' DC B 113 -0.661 -7.687 -8.234 1.00 0.00 C ATOM 389 C4' DC B 113 -2.163 -7.654 -8.553 1.00 0.00 C ATOM 390 O4' DC B 113 -2.447 -6.744 -9.642 1.00 0.00 O ATOM 391 C3' DC B 113 -2.710 -9.030 -8.943 1.00 0.00 C ATOM 392 O3' DC B 113 -3.795 -9.373 -8.075 1.00 0.00 O ATOM 393 C2' DC B 113 -3.203 -8.894 -10.359 1.00 0.00 C ATOM 394 C1' DC B 113 -3.210 -7.410 -10.677 1.00 0.00 C ATOM 395 N1 DC B 113 -2.625 -7.124 -12.013 1.00 0.00 N ATOM 396 C2 DC B 113 -3.412 -6.474 -12.957 1.00 0.00 C ATOM 397 O2 DC B 113 -4.584 -6.206 -12.700 1.00 0.00 O ATOM 398 N3 DC B 113 -2.852 -6.141 -14.149 1.00 0.00 N ATOM 399 C4 DC B 113 -1.571 -6.427 -14.411 1.00 0.00 C ATOM 400 N4 DC B 113 -1.066 -6.091 -15.596 1.00 0.00 N ATOM 401 C5 DC B 113 -0.754 -7.096 -13.441 1.00 0.00 C ATOM 402 C6 DC B 113 -1.329 -7.429 -12.267 1.00 0.00 C ATOM 0 H5' DC B 113 -0.308 -6.667 -8.082 1.00 0.00 H new ATOM 0 H5'' DC B 113 -0.509 -8.220 -7.296 1.00 0.00 H new ATOM 0 H4' DC B 113 -2.650 -7.320 -7.637 1.00 0.00 H new ATOM 0 H3' DC B 113 -1.952 -9.809 -8.860 1.00 0.00 H new ATOM 0 H2' DC B 113 -2.554 -9.435 -11.048 1.00 0.00 H new ATOM 0 H2'' DC B 113 -4.202 -9.317 -10.463 1.00 0.00 H new ATOM 0 H1' DC B 113 -4.238 -7.048 -10.705 1.00 0.00 H new ATOM 0 H41 DC B 113 -0.092 -6.301 -15.813 1.00 0.00 H new ATOM 0 H42 DC B 113 -1.653 -5.624 -16.287 1.00 0.00 H new ATOM 0 H5 DC B 113 0.282 -7.325 -13.643 1.00 0.00 H new ATOM 0 H6 DC B 113 -0.748 -7.946 -11.518 1.00 0.00 H new ATOM 414 P DA B 114 -4.593 -10.765 -8.220 1.00 0.00 P ATOM 415 OP1 DA B 114 -5.169 -11.105 -6.900 1.00 0.00 O ATOM 416 OP2 DA B 114 -3.708 -11.732 -8.905 1.00 0.00 O ATOM 417 O5' DA B 114 -5.812 -10.400 -9.221 1.00 0.00 O ATOM 418 C5' DA B 114 -6.763 -9.388 -8.858 1.00 0.00 C ATOM 419 C4' DA B 114 -7.852 -9.173 -9.927 1.00 0.00 C ATOM 420 O4' DA B 114 -7.300 -8.543 -11.117 1.00 0.00 O ATOM 421 C3' DA B 114 -8.494 -10.498 -10.364 1.00 0.00 C ATOM 422 O3' DA B 114 -9.924 -10.394 -10.321 1.00 0.00 O ATOM 423 C2' DA B 114 -8.040 -10.717 -11.784 1.00 0.00 C ATOM 424 C1' DA B 114 -7.535 -9.376 -12.283 1.00 0.00 C ATOM 425 N9 DA B 114 -6.317 -9.524 -13.094 1.00 0.00 N ATOM 426 C8 DA B 114 -5.152 -10.113 -12.748 1.00 0.00 C ATOM 427 N7 DA B 114 -4.193 -10.010 -13.613 1.00 0.00 N ATOM 428 C5 DA B 114 -4.781 -9.288 -14.645 1.00 0.00 C ATOM 429 C6 DA B 114 -4.299 -8.838 -15.877 1.00 0.00 C ATOM 430 N6 DA B 114 -3.038 -9.017 -16.268 1.00 0.00 N ATOM 431 N1 DA B 114 -5.150 -8.162 -16.667 1.00 0.00 N ATOM 432 C2 DA B 114 -6.402 -7.934 -16.268 1.00 0.00 C ATOM 433 N3 DA B 114 -6.958 -8.307 -15.115 1.00 0.00 N ATOM 434 C4 DA B 114 -6.080 -8.988 -14.345 1.00 0.00 C ATOM 0 H5' DA B 114 -6.238 -8.448 -8.688 1.00 0.00 H new ATOM 0 H5'' DA B 114 -7.236 -9.663 -7.916 1.00 0.00 H new ATOM 0 H4' DA B 114 -8.604 -8.532 -9.467 1.00 0.00 H new ATOM 0 H3' DA B 114 -8.205 -11.321 -9.710 1.00 0.00 H new ATOM 0 H2' DA B 114 -7.253 -11.470 -11.829 1.00 0.00 H new ATOM 0 H2'' DA B 114 -8.861 -11.078 -12.403 1.00 0.00 H new ATOM 0 H1' DA B 114 -8.275 -8.914 -12.936 1.00 0.00 H new ATOM 0 H8 DA B 114 -5.028 -10.636 -11.811 1.00 0.00 H new ATOM 0 H61 DA B 114 -2.732 -8.671 -17.177 1.00 0.00 H new ATOM 0 H62 DA B 114 -2.379 -9.501 -15.658 1.00 0.00 H new ATOM 0 H2 DA B 114 -7.034 -7.388 -16.953 1.00 0.00 H new ATOM 446 P DT B 115 -10.857 -11.644 -10.731 1.00 0.00 P ATOM 447 OP1 DT B 115 -12.136 -11.535 -9.991 1.00 0.00 O ATOM 448 OP2 DT B 115 -10.047 -12.876 -10.626 1.00 0.00 O ATOM 449 O5' DT B 115 -11.149 -11.363 -12.296 1.00 0.00 O ATOM 450 C5' DT B 115 -11.836 -10.171 -12.690 1.00 0.00 C ATOM 451 C4' DT B 115 -11.981 -10.038 -14.215 1.00 0.00 C ATOM 452 O4' DT B 115 -10.696 -9.758 -14.824 1.00 0.00 O ATOM 453 C3' DT B 115 -12.545 -11.310 -14.868 1.00 0.00 C ATOM 454 O3' DT B 115 -13.786 -11.048 -15.520 1.00 0.00 O ATOM 455 C2' DT B 115 -11.529 -11.711 -15.914 1.00 0.00 C ATOM 456 C1' DT B 115 -10.522 -10.571 -16.002 1.00 0.00 C ATOM 457 N1 DT B 115 -9.125 -11.082 -16.111 1.00 0.00 N ATOM 458 C2 DT B 115 -8.380 -10.736 -17.232 1.00 0.00 C ATOM 459 O2 DT B 115 -8.836 -10.027 -18.127 1.00 0.00 O ATOM 460 N3 DT B 115 -7.091 -11.231 -17.282 1.00 0.00 N ATOM 461 C4 DT B 115 -6.485 -12.028 -16.327 1.00 0.00 C ATOM 462 O4 DT B 115 -5.331 -12.421 -16.479 1.00 0.00 O ATOM 463 C5 DT B 115 -7.332 -12.333 -15.194 1.00 0.00 C ATOM 464 C7 DT B 115 -6.768 -13.191 -14.053 1.00 0.00 C ATOM 465 C6 DT B 115 -8.598 -11.862 -15.127 1.00 0.00 C ATOM 0 H5' DT B 115 -11.299 -9.304 -12.305 1.00 0.00 H new ATOM 0 H5'' DT B 115 -12.826 -10.161 -12.234 1.00 0.00 H new ATOM 0 H4' DT B 115 -12.679 -9.218 -14.382 1.00 0.00 H new ATOM 0 H3' DT B 115 -12.719 -12.082 -14.119 1.00 0.00 H new ATOM 0 H2' DT B 115 -11.036 -12.643 -15.638 1.00 0.00 H new ATOM 0 H2'' DT B 115 -12.010 -11.878 -16.878 1.00 0.00 H new ATOM 0 H1' DT B 115 -10.696 -9.980 -16.901 1.00 0.00 H new ATOM 0 H3 DT B 115 -6.534 -10.986 -18.100 1.00 0.00 H new ATOM 0 H71 DT B 115 -6.023 -13.880 -14.450 1.00 0.00 H new ATOM 0 H72 DT B 115 -6.304 -12.545 -13.307 1.00 0.00 H new ATOM 0 H73 DT B 115 -7.576 -13.758 -13.590 1.00 0.00 H new ATOM 0 H6 DT B 115 -9.207 -12.111 -14.271 1.00 0.00 H new ATOM 478 P DT B 116 -14.655 -12.260 -16.134 1.00 0.00 P ATOM 479 OP1 DT B 116 -16.063 -11.817 -16.228 1.00 0.00 O ATOM 480 OP2 DT B 116 -14.319 -13.493 -15.387 1.00 0.00 O ATOM 481 O5' DT B 116 -14.071 -12.404 -17.631 1.00 0.00 O ATOM 482 C5' DT B 116 -14.142 -11.309 -18.547 1.00 0.00 C ATOM 483 C4' DT B 116 -13.346 -11.584 -19.830 1.00 0.00 C ATOM 484 O4' DT B 116 -11.927 -11.605 -19.552 1.00 0.00 O ATOM 485 C3' DT B 116 -13.717 -12.930 -20.470 1.00 0.00 C ATOM 486 O3' DT B 116 -14.408 -12.728 -21.708 1.00 0.00 O ATOM 487 C2' DT B 116 -12.403 -13.648 -20.709 1.00 0.00 C ATOM 488 C1' DT B 116 -11.296 -12.712 -20.231 1.00 0.00 C ATOM 489 N1 DT B 116 -10.342 -13.419 -19.329 1.00 0.00 N ATOM 490 C2 DT B 116 -9.003 -13.473 -19.697 1.00 0.00 C ATOM 491 O2 DT B 116 -8.596 -12.983 -20.747 1.00 0.00 O ATOM 492 N3 DT B 116 -8.154 -14.115 -18.816 1.00 0.00 N ATOM 493 C4 DT B 116 -8.509 -14.701 -17.619 1.00 0.00 C ATOM 494 O4 DT B 116 -7.659 -15.246 -16.916 1.00 0.00 O ATOM 495 C5 DT B 116 -9.920 -14.602 -17.313 1.00 0.00 C ATOM 496 C7 DT B 116 -10.446 -15.245 -16.026 1.00 0.00 C ATOM 497 C6 DT B 116 -10.774 -13.974 -18.160 1.00 0.00 C ATOM 0 H5' DT B 116 -13.758 -10.409 -18.067 1.00 0.00 H new ATOM 0 H5'' DT B 116 -15.184 -11.115 -18.801 1.00 0.00 H new ATOM 0 H4' DT B 116 -13.596 -10.779 -20.521 1.00 0.00 H new ATOM 0 H3' DT B 116 -14.381 -13.508 -19.827 1.00 0.00 H new ATOM 0 H2' DT B 116 -12.373 -14.592 -20.164 1.00 0.00 H new ATOM 0 H2'' DT B 116 -12.279 -13.886 -21.765 1.00 0.00 H new ATOM 0 HO3' DT B 116 -14.635 -13.596 -22.102 1.00 0.00 H new ATOM 0 H1' DT B 116 -10.714 -12.355 -21.080 1.00 0.00 H new ATOM 0 H3 DT B 116 -7.169 -14.160 -19.076 1.00 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DG C 120 -9.327 0.270 -20.524 1.00 0.00 H new ATOM 0 H2' DG C 120 -7.691 -0.206 -18.938 1.00 0.00 H new ATOM 0 H2'' DG C 120 -9.009 -0.457 -17.811 1.00 0.00 H new ATOM 0 H1' DG C 120 -8.764 -2.747 -17.873 1.00 0.00 H new ATOM 0 H8 DG C 120 -5.950 -1.324 -20.097 1.00 0.00 H new ATOM 0 H1 DG C 120 -4.110 -5.273 -15.407 1.00 0.00 H new ATOM 0 H21 DG C 120 -7.513 -5.540 -14.729 1.00 0.00 H new ATOM 0 H22 DG C 120 -5.862 -6.002 -14.300 1.00 0.00 H new ATOM 639 P DT C 121 -11.114 1.016 -18.413 1.00 0.00 P ATOM 640 OP1 DT C 121 -12.558 1.336 -18.441 1.00 0.00 O ATOM 641 OP2 DT C 121 -10.122 2.039 -18.816 1.00 0.00 O ATOM 642 O5' DT C 121 -10.736 0.505 -16.931 1.00 0.00 O ATOM 643 C5' DT C 121 -11.448 -0.577 -16.330 1.00 0.00 C ATOM 644 C4' DT C 121 -10.783 -1.053 -15.028 1.00 0.00 C ATOM 645 O4' DT C 121 -9.532 -1.731 -15.300 1.00 0.00 O ATOM 646 C3' DT C 121 -10.481 0.113 -14.074 1.00 0.00 C ATOM 647 O3' DT C 121 -11.335 0.062 -12.928 1.00 0.00 O ATOM 648 C2' DT C 121 -9.034 -0.067 -13.659 1.00 0.00 C ATOM 649 C1' DT C 121 -8.559 -1.373 -14.295 1.00 0.00 C ATOM 650 N1 DT C 121 -7.184 -1.236 -14.875 1.00 0.00 N ATOM 651 C2 DT C 121 -6.187 -2.065 -14.380 1.00 0.00 C ATOM 652 O2 DT C 121 -6.405 -2.889 -13.494 1.00 0.00 O ATOM 653 N3 DT C 121 -4.928 -1.904 -14.932 1.00 0.00 N ATOM 654 C4 DT C 121 -4.576 -0.999 -15.916 1.00 0.00 C ATOM 655 O4 DT C 121 -3.420 -0.935 -16.326 1.00 0.00 O ATOM 656 C5 DT C 121 -5.670 -0.179 -16.373 1.00 0.00 C ATOM 657 C7 DT C 121 -5.416 0.885 -17.443 1.00 0.00 C ATOM 658 C6 DT C 121 -6.908 -0.319 -15.859 1.00 0.00 C ATOM 0 H5' DT C 121 -11.505 -1.408 -17.033 1.00 0.00 H new ATOM 0 H5'' DT C 121 -12.472 -0.266 -16.121 1.00 0.00 H new ATOM 0 H4' DT C 121 -11.494 -1.733 -14.559 1.00 0.00 H new ATOM 0 H3' DT C 121 -10.651 1.077 -14.553 1.00 0.00 H new ATOM 0 H2' DT C 121 -8.426 0.772 -13.997 1.00 0.00 H new ATOM 0 H2'' DT C 121 -8.944 -0.109 -12.574 1.00 0.00 H new ATOM 0 H1' DT C 121 -8.483 -2.159 -13.544 1.00 0.00 H new ATOM 0 H3 DT C 121 -4.189 -2.512 -14.579 1.00 0.00 H new ATOM 0 H71 DT C 121 -6.319 1.026 -18.037 1.00 0.00 H new ATOM 0 H72 DT C 121 -5.146 1.826 -16.964 1.00 0.00 H new ATOM 0 H73 DT C 121 -4.602 0.562 -18.091 1.00 0.00 H new ATOM 0 H6 DT C 121 -7.705 0.307 -16.231 1.00 0.00 H new ATOM 671 P DT C 122 -11.235 1.180 -11.771 1.00 0.00 P ATOM 672 OP1 DT C 122 -12.539 1.243 -11.077 1.00 0.00 O ATOM 673 OP2 DT C 122 -10.663 2.406 -12.374 1.00 0.00 O ATOM 674 O5' DT C 122 -10.149 0.574 -10.742 1.00 0.00 O ATOM 675 C5' DT C 122 -10.390 -0.683 -10.104 1.00 0.00 C ATOM 676 C4' DT C 122 -9.246 -1.087 -9.166 1.00 0.00 C ATOM 677 O4' DT C 122 -8.061 -1.409 -9.934 1.00 0.00 O ATOM 678 C3' DT C 122 -8.879 0.038 -8.182 1.00 0.00 C ATOM 679 O3' DT C 122 -9.106 -0.373 -6.840 1.00 0.00 O ATOM 680 C2' DT C 122 -7.407 0.295 -8.379 1.00 0.00 C ATOM 681 C1' DT C 122 -6.908 -0.731 -9.390 1.00 0.00 C ATOM 682 N1 DT C 122 -6.111 -0.066 -10.463 1.00 0.00 N ATOM 683 C2 DT C 122 -4.789 -0.456 -10.633 1.00 0.00 C ATOM 684 O2 DT C 122 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1.00 0.00 C ATOM 721 C7 DT C 123 -6.167 3.692 -8.097 1.00 0.00 C ATOM 722 C6 DT C 123 -4.852 2.043 -6.744 1.00 0.00 C ATOM 0 H5' DT C 123 -7.141 -1.720 -5.634 1.00 0.00 H new ATOM 0 H5'' DT C 123 -7.466 -1.322 -3.959 1.00 0.00 H new ATOM 0 H4' DT C 123 -5.228 -2.168 -4.235 1.00 0.00 H new ATOM 0 H3' DT C 123 -5.824 0.216 -2.836 1.00 0.00 H new ATOM 0 H2' DT C 123 -4.745 1.789 -4.127 1.00 0.00 H new ATOM 0 H2'' DT C 123 -3.304 1.138 -3.372 1.00 0.00 H new ATOM 0 H1' DT C 123 -2.671 -0.013 -5.267 1.00 0.00 H new ATOM 0 H3 DT C 123 -1.676 2.773 -8.573 1.00 0.00 H new ATOM 0 H71 DT C 123 -5.937 4.688 -8.477 1.00 0.00 H new ATOM 0 H72 DT C 123 -6.697 3.125 -8.863 1.00 0.00 H new ATOM 0 H73 DT C 123 -6.795 3.778 -7.210 1.00 0.00 H new ATOM 0 H6 DT C 123 -5.765 1.826 -6.209 1.00 0.00 H new ATOM 735 P DA C 124 -3.565 -0.334 -1.096 1.00 0.00 P ATOM 736 OP1 DA C 124 -3.622 -1.363 -0.033 1.00 0.00 O ATOM 737 OP2 DA C 124 -4.189 0.988 -0.872 1.00 0.00 O ATOM 738 O5' DA C 124 -2.011 -0.099 -1.491 1.00 0.00 O ATOM 739 C5' DA C 124 -1.225 -1.237 -1.877 1.00 0.00 C ATOM 740 C4' DA C 124 0.251 -0.916 -2.168 1.00 0.00 C ATOM 741 O4' DA C 124 0.352 -0.093 -3.356 1.00 0.00 O ATOM 742 C3' DA C 124 0.915 -0.148 -1.014 1.00 0.00 C ATOM 743 O3' DA C 124 2.197 -0.704 -0.691 1.00 0.00 O ATOM 744 C2' DA C 124 1.084 1.261 -1.518 1.00 0.00 C ATOM 745 C1' DA C 124 0.887 1.211 -3.028 1.00 0.00 C ATOM 746 N9 DA C 124 -0.015 2.279 -3.483 1.00 0.00 N ATOM 747 C8 DA C 124 -1.246 2.585 -3.024 1.00 0.00 C ATOM 748 N7 DA C 124 -1.847 3.557 -3.637 1.00 0.00 N ATOM 749 C5 DA C 124 -0.916 3.937 -4.600 1.00 0.00 C ATOM 750 C6 DA C 124 -0.930 4.921 -5.592 1.00 0.00 C ATOM 751 N6 DA C 124 -1.968 5.733 -5.788 1.00 0.00 N ATOM 752 N1 DA C 124 0.162 5.030 -6.374 1.00 0.00 N ATOM 753 C2 DA C 124 1.202 4.214 -6.186 1.00 0.00 C ATOM 754 N3 DA C 124 1.313 3.248 -5.277 1.00 0.00 N ATOM 755 C4 DA C 124 0.206 3.165 -4.512 1.00 0.00 C ATOM 0 H5' DA C 124 -1.669 -1.687 -2.765 1.00 0.00 H new ATOM 0 H5'' DA C 124 -1.273 -1.983 -1.084 1.00 0.00 H new ATOM 0 H4' DA C 124 0.760 -1.871 -2.301 1.00 0.00 H new ATOM 0 H3' DA C 124 0.311 -0.199 -0.108 1.00 0.00 H new ATOM 0 H2' DA C 124 0.357 1.928 -1.055 1.00 0.00 H new ATOM 0 H2'' DA C 124 2.073 1.645 -1.269 1.00 0.00 H new ATOM 0 H1' DA C 124 1.839 1.369 -3.535 1.00 0.00 H new ATOM 0 H8 DA C 124 -1.701 2.055 -2.200 1.00 0.00 H new ATOM 0 H61 DA C 124 -1.933 6.437 -6.525 1.00 0.00 H new ATOM 0 H62 DA C 124 -2.798 5.651 -5.201 1.00 0.00 H new ATOM 0 H2 DA C 124 2.047 4.353 -6.844 1.00 0.00 H new ATOM 767 P DT C 125 3.088 -0.062 0.494 1.00 0.00 P ATOM 768 OP1 DT C 125 4.004 -1.107 1.007 1.00 0.00 O ATOM 769 OP2 DT C 125 2.177 0.640 1.425 1.00 0.00 O ATOM 770 O5' DT C 125 3.968 1.050 -0.279 1.00 0.00 O ATOM 771 C5' DT C 125 4.924 0.631 -1.254 1.00 0.00 C ATOM 772 C4' DT C 125 5.563 1.797 -2.019 1.00 0.00 C ATOM 773 O4' DT C 125 4.590 2.447 -2.876 1.00 0.00 O ATOM 774 C3' DT C 125 6.153 2.880 -1.104 1.00 0.00 C ATOM 775 O3' DT C 125 7.564 2.988 -1.326 1.00 0.00 O ATOM 776 C2' DT C 125 5.472 4.165 -1.499 1.00 0.00 C ATOM 777 C1' DT C 125 4.796 3.875 -2.827 1.00 0.00 C ATOM 778 N1 DT C 125 3.520 4.635 -3.010 1.00 0.00 N ATOM 779 C2 DT C 125 3.404 5.439 -4.142 1.00 0.00 C ATOM 780 O2 DT C 125 4.313 5.541 -4.963 1.00 0.00 O ATOM 781 N3 DT C 125 2.211 6.115 -4.295 1.00 0.00 N ATOM 782 C4 DT C 125 1.131 6.061 -3.432 1.00 0.00 C ATOM 783 O4 DT C 125 0.078 6.629 -3.702 1.00 0.00 O ATOM 784 C5 DT C 125 1.339 5.219 -2.279 1.00 0.00 C ATOM 785 C7 DT C 125 0.255 5.159 -1.203 1.00 0.00 C ATOM 786 C6 DT C 125 2.494 4.540 -2.106 1.00 0.00 C ATOM 0 H5' DT C 125 4.438 -0.038 -1.965 1.00 0.00 H new ATOM 0 H5'' DT C 125 5.708 0.057 -0.760 1.00 0.00 H new ATOM 0 H4' DT C 125 6.370 1.346 -2.597 1.00 0.00 H new ATOM 0 H3' DT C 125 5.998 2.648 -0.050 1.00 0.00 H new ATOM 0 H2' DT C 125 4.745 4.471 -0.747 1.00 0.00 H new ATOM 0 H2'' DT C 125 6.192 4.977 -1.595 1.00 0.00 H new ATOM 0 H1' DT C 125 5.427 4.208 -3.651 1.00 0.00 H new ATOM 0 H3 DT C 125 2.117 6.708 -5.119 1.00 0.00 H new ATOM 0 H71 DT C 125 0.269 4.179 -0.727 1.00 0.00 H new ATOM 0 H72 DT C 125 0.442 5.929 -0.455 1.00 0.00 H new ATOM 0 H73 DT C 125 -0.721 5.326 -1.660 1.00 0.00 H new ATOM 0 H6 DT C 125 2.611 3.909 -1.237 1.00 0.00 H new ATOM 799 P DC C 126 8.463 4.045 -0.507 1.00 0.00 P ATOM 800 OP1 DC C 126 9.822 3.479 -0.358 1.00 0.00 O ATOM 801 OP2 DC C 126 7.704 4.467 0.691 1.00 0.00 O ATOM 802 O5' DC C 126 8.547 5.303 -1.526 1.00 0.00 O ATOM 803 C5' DC C 126 9.212 5.140 -2.788 1.00 0.00 C ATOM 804 C4' DC C 126 9.219 6.414 -3.659 1.00 0.00 C ATOM 805 O4' DC C 126 7.900 6.697 -4.190 1.00 0.00 O ATOM 806 C3' DC C 126 9.699 7.650 -2.887 1.00 0.00 C ATOM 807 O3' DC C 126 10.933 8.130 -3.415 1.00 0.00 O ATOM 808 C2' DC C 126 8.622 8.702 -3.085 1.00 0.00 C ATOM 809 C1' DC C 126 7.531 8.078 -3.955 1.00 0.00 C ATOM 810 N1 DC C 126 6.216 8.150 -3.269 1.00 0.00 N ATOM 811 C2 DC C 126 5.156 8.823 -3.889 1.00 0.00 C ATOM 812 O2 DC C 126 5.326 9.416 -4.956 1.00 0.00 O ATOM 813 N3 DC C 126 3.953 8.832 -3.261 1.00 0.00 N ATOM 814 C4 DC C 126 3.785 8.221 -2.084 1.00 0.00 C ATOM 815 N4 DC C 126 2.582 8.213 -1.520 1.00 0.00 N ATOM 816 C5 DC C 126 4.868 7.546 -1.444 1.00 0.00 C ATOM 817 C6 DC C 126 6.052 7.535 -2.071 1.00 0.00 C ATOM 0 H5' DC C 126 8.728 4.336 -3.342 1.00 0.00 H new ATOM 0 H5'' DC C 126 10.241 4.829 -2.608 1.00 0.00 H new ATOM 0 H4' DC C 126 9.916 6.211 -4.472 1.00 0.00 H new ATOM 0 H3' DC C 126 9.863 7.415 -1.835 1.00 0.00 H new ATOM 0 H2' DC C 126 8.214 9.019 -2.125 1.00 0.00 H new ATOM 0 H2'' DC C 126 9.035 9.589 -3.565 1.00 0.00 H new ATOM 0 H1' DC C 126 7.441 8.617 -4.898 1.00 0.00 H new ATOM 0 H41 DC C 126 2.443 7.750 -0.622 1.00 0.00 H new ATOM 0 H42 DC C 126 1.798 8.670 -1.985 1.00 0.00 H new ATOM 0 H5 DC C 126 4.737 7.061 -0.488 1.00 0.00 H new ATOM 0 H6 DC C 126 6.890 7.028 -1.615 1.00 0.00 H new ATOM 829 P DT C 127 11.762 9.266 -2.633 1.00 0.00 P ATOM 830 OP1 DT C 127 13.161 9.229 -3.116 1.00 0.00 O ATOM 831 OP2 DT C 127 11.477 9.136 -1.187 1.00 0.00 O ATOM 832 O5' DT C 127 11.083 10.620 -3.171 1.00 0.00 O ATOM 833 C5' DT C 127 11.120 10.923 -4.564 1.00 0.00 C ATOM 834 C4' DT C 127 10.338 12.196 -4.904 1.00 0.00 C ATOM 835 O4' DT C 127 8.914 11.964 -4.764 1.00 0.00 O ATOM 836 C3' DT C 127 10.722 13.375 -4.000 1.00 0.00 C ATOM 837 O3' DT C 127 11.283 14.430 -4.783 1.00 0.00 O ATOM 838 C2' DT C 127 9.426 13.839 -3.364 1.00 0.00 C ATOM 839 C1' DT C 127 8.303 13.032 -4.010 1.00 0.00 C ATOM 840 N1 DT C 127 7.358 12.497 -2.981 1.00 0.00 N ATOM 841 C2 DT C 127 6.024 12.880 -3.058 1.00 0.00 C ATOM 842 O2 DT C 127 5.607 13.619 -3.948 1.00 0.00 O ATOM 843 N3 DT C 127 5.185 12.375 -2.083 1.00 0.00 N ATOM 844 C4 DT C 127 5.547 11.530 -1.051 1.00 0.00 C ATOM 845 O4 DT C 127 4.711 11.143 -0.238 1.00 0.00 O ATOM 846 C5 DT C 127 6.948 11.176 -1.042 1.00 0.00 C ATOM 847 C7 DT C 127 7.469 10.249 0.065 1.00 0.00 C ATOM 848 C6 DT C 127 7.795 11.657 -1.987 1.00 0.00 C ATOM 0 H5' DT C 127 10.708 10.085 -5.127 1.00 0.00 H new ATOM 0 H5'' DT C 127 12.156 11.041 -4.880 1.00 0.00 H new ATOM 0 H4' DT C 127 10.590 12.449 -5.934 1.00 0.00 H new ATOM 0 H3' DT C 127 11.463 13.088 -3.254 1.00 0.00 H new ATOM 0 H2' DT C 127 9.446 13.679 -2.286 1.00 0.00 H new ATOM 0 H2'' DT C 127 9.277 14.907 -3.525 1.00 0.00 H new ATOM 0 H1' DT C 127 7.713 13.669 -4.669 1.00 0.00 H new ATOM 0 H3 DT C 127 4.205 12.652 -2.129 1.00 0.00 H new ATOM 0 H71 DT C 127 6.875 10.391 0.968 1.00 0.00 H new ATOM 0 H72 DT C 127 7.390 9.212 -0.262 1.00 0.00 H new ATOM 0 H73 DT C 127 8.512 10.484 0.276 1.00 0.00 H new ATOM 0 H6 DT C 127 8.836 11.373 -1.956 1.00 0.00 H new ATOM 861 P DG C 128 11.795 15.796 -4.102 1.00 0.00 P ATOM 862 OP1 DG C 128 12.811 16.404 -4.991 1.00 0.00 O ATOM 863 OP2 DG C 128 12.124 15.514 -2.688 1.00 0.00 O ATOM 864 O5' DG C 128 10.479 16.722 -4.134 1.00 0.00 O ATOM 865 C5' DG C 128 9.854 17.056 -5.376 1.00 0.00 C ATOM 866 C4' DG C 128 8.625 17.942 -5.161 1.00 0.00 C ATOM 867 O4' DG C 128 7.616 17.223 -4.417 1.00 0.00 O ATOM 868 C3' DG C 128 8.980 19.219 -4.385 1.00 0.00 C ATOM 869 O3' DG C 128 8.673 20.376 -5.166 1.00 0.00 O ATOM 870 C2' DG C 128 8.130 19.185 -3.133 1.00 0.00 C ATOM 871 C1' DG C 128 7.249 17.945 -3.224 1.00 0.00 C ATOM 872 N9 DG C 128 7.419 17.102 -2.032 1.00 0.00 N ATOM 873 C8 DG C 128 8.554 16.537 -1.561 1.00 0.00 C ATOM 874 N7 DG C 128 8.419 15.846 -0.467 1.00 0.00 N ATOM 875 C5 DG C 128 7.060 15.968 -0.185 1.00 0.00 C ATOM 876 C6 DG C 128 6.301 15.434 0.890 1.00 0.00 C ATOM 877 O6 DG C 128 6.690 14.733 1.820 1.00 0.00 O ATOM 878 N1 DG C 128 4.964 15.799 0.801 1.00 0.00 N ATOM 879 C2 DG C 128 4.424 16.581 -0.199 1.00 0.00 C ATOM 880 N2 DG C 128 3.119 16.831 -0.117 1.00 0.00 N ATOM 881 N3 DG C 128 5.135 17.083 -1.211 1.00 0.00 N ATOM 882 C4 DG C 128 6.439 16.739 -1.140 1.00 0.00 C ATOM 0 H5' DG C 128 9.560 16.143 -5.895 1.00 0.00 H new ATOM 0 H5'' DG C 128 10.568 17.571 -6.018 1.00 0.00 H new ATOM 0 H4' DG C 128 8.248 18.217 -6.146 1.00 0.00 H new ATOM 0 H3' DG C 128 10.043 19.266 -4.148 1.00 0.00 H new ATOM 0 H2' DG C 128 8.757 19.147 -2.242 1.00 0.00 H new ATOM 0 H2'' DG C 128 7.521 20.086 -3.056 1.00 0.00 H new ATOM 0 H1' DG C 128 6.199 18.233 -3.272 1.00 0.00 H new ATOM 0 H8 DG C 128 9.506 16.651 -2.058 1.00 0.00 H new ATOM 0 H1 DG C 128 4.334 15.464 1.530 1.00 0.00 H new ATOM 0 H21 DG C 128 2.664 17.404 -0.828 1.00 0.00 H new ATOM 0 H22 DG C 128 2.574 16.450 0.657 1.00 0.00 H new ATOM 894 P DC C 129 9.158 21.842 -4.708 1.00 0.00 P ATOM 895 OP1 DC C 129 9.224 22.703 -5.909 1.00 0.00 O ATOM 896 OP2 DC C 129 10.357 21.680 -3.857 1.00 0.00 O ATOM 897 O5' DC C 129 7.957 22.378 -3.775 1.00 0.00 O ATOM 898 C5' DC C 129 6.634 22.518 -4.294 1.00 0.00 C ATOM 899 C4' DC C 129 5.661 23.042 -3.231 1.00 0.00 C ATOM 900 O4' DC C 129 5.464 22.063 -2.181 1.00 0.00 O ATOM 901 C3' DC C 129 6.183 24.327 -2.583 1.00 0.00 C ATOM 902 O3' DC C 129 5.224 25.375 -2.732 1.00 0.00 O ATOM 903 C2' DC C 129 6.371 24.009 -1.122 1.00 0.00 C ATOM 904 C1' DC C 129 5.793 22.624 -0.887 1.00 0.00 C ATOM 905 N1 DC C 129 6.752 21.740 -0.164 1.00 0.00 N ATOM 906 C2 DC C 129 6.353 21.198 1.059 1.00 0.00 C ATOM 907 O2 DC C 129 5.253 21.485 1.526 1.00 0.00 O ATOM 908 N3 DC C 129 7.202 20.351 1.705 1.00 0.00 N ATOM 909 C4 DC C 129 8.396 20.045 1.185 1.00 0.00 C ATOM 910 N4 DC C 129 9.199 19.200 1.838 1.00 0.00 N ATOM 911 C5 DC C 129 8.818 20.600 -0.066 1.00 0.00 C ATOM 912 C6 DC C 129 7.970 21.437 -0.703 1.00 0.00 C ATOM 0 H5' DC C 129 6.284 21.554 -4.664 1.00 0.00 H new ATOM 0 H5'' DC C 129 6.647 23.200 -5.144 1.00 0.00 H new ATOM 0 H4' DC C 129 4.719 23.242 -3.741 1.00 0.00 H new ATOM 0 H3' DC C 129 7.113 24.659 -3.046 1.00 0.00 H new ATOM 0 H2' DC C 129 7.427 24.036 -0.855 1.00 0.00 H new ATOM 0 H2'' DC C 129 5.866 24.748 -0.499 1.00 0.00 H new ATOM 0 H1' DC C 129 4.905 22.700 -0.259 1.00 0.00 H new ATOM 0 H41 DC C 129 10.111 18.960 1.450 1.00 0.00 H new ATOM 0 H42 DC C 129 8.900 18.795 2.725 1.00 0.00 H new ATOM 0 H5 DC C 129 9.783 20.357 -0.487 1.00 0.00 H new ATOM 0 H6 DC C 129 8.258 21.871 -1.649 1.00 0.00 H new ATOM 924 P DA C 130 5.519 26.852 -2.165 1.00 0.00 P ATOM 925 OP1 DA C 130 4.699 27.811 -2.939 1.00 0.00 O ATOM 926 OP2 DA C 130 6.988 27.033 -2.091 1.00 0.00 O ATOM 927 O5' DA C 130 4.941 26.803 -0.659 1.00 0.00 O ATOM 928 C5' DA C 130 3.559 26.521 -0.419 1.00 0.00 C ATOM 929 C4' DA C 130 3.221 26.522 1.079 1.00 0.00 C ATOM 930 O4' DA C 130 3.810 25.375 1.739 1.00 0.00 O ATOM 931 C3' DA C 130 3.749 27.789 1.768 1.00 0.00 C ATOM 932 O3' DA C 130 2.712 28.422 2.529 1.00 0.00 O ATOM 933 C2' DA C 130 4.845 27.307 2.693 1.00 0.00 C ATOM 934 C1' DA C 130 4.672 25.801 2.819 1.00 0.00 C ATOM 935 N9 DA C 130 5.960 25.087 2.776 1.00 0.00 N ATOM 936 C8 DA C 130 6.941 25.164 1.849 1.00 0.00 C ATOM 937 N7 DA C 130 7.951 24.368 2.038 1.00 0.00 N ATOM 938 C5 DA C 130 7.606 23.699 3.209 1.00 0.00 C ATOM 939 C6 DA C 130 8.249 22.708 3.962 1.00 0.00 C ATOM 940 N6 DA C 130 9.422 22.177 3.616 1.00 0.00 N ATOM 941 N1 DA C 130 7.624 22.272 5.071 1.00 0.00 N ATOM 942 C2 DA C 130 6.437 22.778 5.415 1.00 0.00 C ATOM 943 N3 DA C 130 5.746 23.714 4.771 1.00 0.00 N ATOM 944 C4 DA C 130 6.396 24.133 3.668 1.00 0.00 C ATOM 0 H5' DA C 130 3.308 25.550 -0.846 1.00 0.00 H new ATOM 0 H5'' DA C 130 2.944 27.262 -0.929 1.00 0.00 H new ATOM 0 H4' DA C 130 2.135 26.486 1.159 1.00 0.00 H new ATOM 0 H3' DA C 130 4.107 28.521 1.044 1.00 0.00 H new ATOM 0 H2' DA C 130 5.828 27.552 2.291 1.00 0.00 H new ATOM 0 H2'' DA C 130 4.770 27.789 3.668 1.00 0.00 H new ATOM 0 H1' DA C 130 4.230 25.563 3.787 1.00 0.00 H new ATOM 0 H8 DA C 130 6.889 25.841 1.009 1.00 0.00 H new ATOM 0 H61 DA C 130 9.848 21.457 4.200 1.00 0.00 H new ATOM 0 H62 DA C 130 9.893 22.490 2.767 1.00 0.00 H new ATOM 0 H2 DA C 130 5.989 22.384 6.315 1.00 0.00 H new ATOM 956 P DA C 131 3.008 29.777 3.351 1.00 0.00 P ATOM 957 OP1 DA C 131 1.768 30.584 3.361 1.00 0.00 O ATOM 958 OP2 DA C 131 4.261 30.364 2.827 1.00 0.00 O ATOM 959 O5' DA C 131 3.283 29.270 4.862 1.00 0.00 O ATOM 960 C5' DA C 131 2.261 28.590 5.596 1.00 0.00 C ATOM 961 C4' DA C 131 2.723 28.193 7.009 1.00 0.00 C ATOM 962 O4' DA C 131 3.699 27.125 6.953 1.00 0.00 O ATOM 963 C3' DA C 131 3.357 29.377 7.756 1.00 0.00 C ATOM 964 O3' DA C 131 2.631 29.682 8.953 1.00 0.00 O ATOM 965 C2' DA C 131 4.749 28.923 8.128 1.00 0.00 C ATOM 966 C1' DA C 131 4.857 27.455 7.754 1.00 0.00 C ATOM 967 N9 DA C 131 6.100 27.181 7.021 1.00 0.00 N ATOM 968 C8 DA C 131 6.536 27.746 5.876 1.00 0.00 C ATOM 969 N7 DA C 131 7.677 27.303 5.434 1.00 0.00 N ATOM 970 C5 DA C 131 8.032 26.351 6.388 1.00 0.00 C ATOM 971 C6 DA C 131 9.137 25.500 6.519 1.00 0.00 C ATOM 972 N6 DA C 131 10.151 25.483 5.653 1.00 0.00 N ATOM 973 N1 DA C 131 9.164 24.678 7.585 1.00 0.00 N ATOM 974 C2 DA C 131 8.167 24.696 8.471 1.00 0.00 C ATOM 975 N3 DA C 131 7.077 25.461 8.440 1.00 0.00 N ATOM 976 C4 DA C 131 7.076 26.270 7.360 1.00 0.00 C ATOM 0 H5' DA C 131 1.959 27.696 5.050 1.00 0.00 H new ATOM 0 H5'' DA C 131 1.382 29.231 5.670 1.00 0.00 H new ATOM 0 H4' DA C 131 1.832 27.863 7.543 1.00 0.00 H new ATOM 0 H3' DA C 131 3.355 30.272 7.134 1.00 0.00 H new ATOM 0 H2' DA C 131 5.500 29.511 7.600 1.00 0.00 H new ATOM 0 H2'' DA C 131 4.927 29.063 9.194 1.00 0.00 H new ATOM 0 H1' DA C 131 4.886 26.840 8.653 1.00 0.00 H new ATOM 0 H8 DA C 131 5.976 28.513 5.362 1.00 0.00 H new ATOM 0 H61 DA C 131 10.932 24.843 5.795 1.00 0.00 H new ATOM 0 H62 DA C 131 10.145 26.110 4.849 1.00 0.00 H new ATOM 0 H2 DA C 131 8.253 24.015 9.305 1.00 0.00 H new ATOM 988 P DC C 132 3.102 30.895 9.906 1.00 0.00 P ATOM 989 OP1 DC C 132 1.927 31.362 10.674 1.00 0.00 O ATOM 990 OP2 DC C 132 3.871 31.854 9.082 1.00 0.00 O ATOM 991 O5' DC C 132 4.125 30.184 10.933 1.00 0.00 O ATOM 992 C5' DC C 132 3.716 29.052 11.707 1.00 0.00 C ATOM 993 C4' DC C 132 4.883 28.443 12.500 1.00 0.00 C ATOM 994 O4' DC C 132 5.818 27.771 11.624 1.00 0.00 O ATOM 995 C3' DC C 132 5.659 29.501 13.296 1.00 0.00 C ATOM 996 O3' DC C 132 5.436 29.342 14.701 1.00 0.00 O ATOM 997 C2' DC C 132 7.118 29.270 12.962 1.00 0.00 C ATOM 998 C1' DC C 132 7.174 28.083 12.016 1.00 0.00 C ATOM 999 N1 DC C 132 8.014 28.387 10.826 1.00 0.00 N ATOM 1000 C2 DC C 132 9.192 27.666 10.638 1.00 0.00 C ATOM 1001 O2 DC C 132 9.524 26.805 11.450 1.00 0.00 O ATOM 1002 N3 DC C 132 9.949 27.943 9.541 1.00 0.00 N ATOM 1003 C4 DC C 132 9.570 28.879 8.662 1.00 0.00 C ATOM 1004 N4 DC C 132 10.325 29.110 7.588 1.00 0.00 N ATOM 1005 C5 DC C 132 8.363 29.620 8.853 1.00 0.00 C ATOM 1006 C6 DC C 132 7.624 29.340 9.944 1.00 0.00 C ATOM 0 H5' DC C 132 3.293 28.295 11.046 1.00 0.00 H new ATOM 0 H5'' DC C 132 2.926 29.351 12.396 1.00 0.00 H new ATOM 0 H4' DC C 132 4.433 27.731 13.191 1.00 0.00 H new ATOM 0 H3' DC C 132 5.339 30.511 13.039 1.00 0.00 H new ATOM 0 H2' DC C 132 7.552 30.155 12.497 1.00 0.00 H new ATOM 0 H2'' DC C 132 7.694 29.070 13.866 1.00 0.00 H new ATOM 0 HO3' DC C 132 5.940 30.024 15.192 1.00 0.00 H new ATOM 0 H1' DC C 132 7.630 27.227 12.514 1.00 0.00 H new ATOM 0 H41 DC C 132 10.046 29.821 6.912 1.00 0.00 H new ATOM 0 H42 DC C 132 11.182 28.576 7.443 1.00 0.00 H new ATOM 0 H5 DC C 132 8.054 30.377 8.148 1.00 0.00 H new ATOM 0 H6 DC C 132 6.707 29.883 10.119 1.00 0.00 H new TER 1019 DC C 132 ATOM 1020 N LYS A 1 -8.240 16.714 12.734 1.00 0.00 N ATOM 1021 CA LYS A 1 -8.305 15.695 13.820 1.00 0.00 C ATOM 1022 C LYS A 1 -8.235 14.286 13.215 1.00 0.00 C ATOM 1023 O LYS A 1 -9.206 13.558 13.182 1.00 0.00 O ATOM 1024 CB LYS A 1 -9.605 15.879 14.619 1.00 0.00 C ATOM 1025 CG LYS A 1 -10.808 15.983 13.673 1.00 0.00 C ATOM 1026 CD LYS A 1 -12.062 16.336 14.478 1.00 0.00 C ATOM 1027 CE LYS A 1 -13.267 16.395 13.540 1.00 0.00 C ATOM 1028 NZ LYS A 1 -14.463 16.876 14.289 1.00 0.00 N ATOM 0 H1 LYS A 1 -8.236 17.667 13.151 1.00 0.00 H new ATOM 0 H2 LYS A 1 -7.371 16.576 12.180 1.00 0.00 H new ATOM 0 H3 LYS A 1 -9.067 16.612 12.112 1.00 0.00 H new ATOM 0 HA LYS A 1 -7.458 15.823 14.495 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -9.742 15.039 15.300 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -9.538 16.778 15.232 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -10.623 16.744 12.915 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -10.954 15.039 13.148 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -12.229 15.592 15.257 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -11.929 17.296 14.978 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -13.057 17.062 12.704 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -13.462 15.408 13.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -15.281 16.915 13.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -14.668 16.223 15.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -14.276 17.826 14.669 1.00 0.00 H new ATOM 1044 N ARG A 2 -7.083 13.895 12.740 1.00 0.00 N ATOM 1045 CA ARG A 2 -6.942 12.535 12.141 1.00 0.00 C ATOM 1046 C ARG A 2 -6.909 11.492 13.270 1.00 0.00 C ATOM 1047 O ARG A 2 -6.511 10.357 13.080 1.00 0.00 O ATOM 1048 CB ARG A 2 -5.630 12.474 11.320 1.00 0.00 C ATOM 1049 CG ARG A 2 -5.902 12.759 9.834 1.00 0.00 C ATOM 1050 CD ARG A 2 -6.337 14.216 9.634 1.00 0.00 C ATOM 1051 NE ARG A 2 -7.795 14.335 9.929 1.00 0.00 N ATOM 1052 CZ ARG A 2 -8.361 15.509 9.987 1.00 0.00 C ATOM 1053 NH1 ARG A 2 -7.661 16.585 9.749 1.00 0.00 N ATOM 1054 NH2 ARG A 2 -9.630 15.607 10.275 1.00 0.00 N ATOM 0 H ARG A 2 -6.233 14.458 12.741 1.00 0.00 H new ATOM 0 HA ARG A 2 -7.784 12.325 11.482 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -4.918 13.201 11.710 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -5.173 11.490 11.429 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -5.004 12.559 9.250 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -6.678 12.088 9.466 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -5.766 14.872 10.290 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -6.133 14.532 8.611 1.00 0.00 H new ATOM 0 HE ARG A 2 -8.352 13.495 10.086 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -6.671 16.508 9.517 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -8.105 17.502 9.795 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -10.179 14.766 10.455 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -10.073 16.525 10.321 1.00 0.00 H new ATOM 1068 N ALA A 3 -7.364 11.865 14.434 1.00 0.00 N ATOM 1069 CA ALA A 3 -7.386 10.899 15.574 1.00 0.00 C ATOM 1070 C ALA A 3 -8.714 10.154 15.562 1.00 0.00 C ATOM 1071 O ALA A 3 -9.750 10.711 15.867 1.00 0.00 O ATOM 1072 CB ALA A 3 -7.230 11.654 16.894 1.00 0.00 C ATOM 0 H ALA A 3 -7.722 12.796 14.647 1.00 0.00 H new ATOM 0 HA ALA A 3 -6.564 10.190 15.473 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -7.247 10.946 17.722 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -6.282 12.192 16.896 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -8.050 12.363 17.007 1.00 0.00 H new ATOM 1078 N GLY A 4 -8.702 8.902 15.184 1.00 0.00 N ATOM 1079 CA GLY A 4 -9.970 8.124 15.117 1.00 0.00 C ATOM 1080 C GLY A 4 -10.454 8.128 13.670 1.00 0.00 C ATOM 1081 O GLY A 4 -11.590 7.808 13.383 1.00 0.00 O ATOM 0 H GLY A 4 -7.864 8.385 14.918 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.808 7.103 15.461 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -10.722 8.565 15.771 1.00 0.00 H new ATOM 1085 N THR A 5 -9.602 8.509 12.751 1.00 0.00 N ATOM 1086 CA THR A 5 -10.032 8.549 11.327 1.00 0.00 C ATOM 1087 C THR A 5 -10.442 7.156 10.855 1.00 0.00 C ATOM 1088 O THR A 5 -9.641 6.242 10.819 1.00 0.00 O ATOM 1089 CB THR A 5 -8.881 9.041 10.446 1.00 0.00 C ATOM 1090 OG1 THR A 5 -8.212 10.105 11.098 1.00 0.00 O ATOM 1091 CG2 THR A 5 -9.430 9.527 9.095 1.00 0.00 C ATOM 0 H THR A 5 -8.637 8.791 12.926 1.00 0.00 H new ATOM 0 HA THR A 5 -10.881 9.228 11.248 1.00 0.00 H new ATOM 0 HB THR A 5 -8.182 8.222 10.274 1.00 0.00 H new ATOM 0 HG1 THR A 5 -7.533 9.742 11.704 1.00 0.00 H new ATOM 0 HG21 THR A 5 -8.607 9.876 8.472 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.942 8.706 8.593 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.132 10.345 9.260 1.00 0.00 H new ATOM 1099 N VAL A 6 -11.672 7.012 10.439 1.00 0.00 N ATOM 1100 CA VAL A 6 -12.155 5.711 9.892 1.00 0.00 C ATOM 1101 C VAL A 6 -12.602 6.005 8.468 1.00 0.00 C ATOM 1102 O VAL A 6 -13.167 7.047 8.200 1.00 0.00 O ATOM 1103 CB VAL A 6 -13.335 5.179 10.714 1.00 0.00 C ATOM 1104 CG1 VAL A 6 -12.847 4.752 12.099 1.00 0.00 C ATOM 1105 CG2 VAL A 6 -14.397 6.273 10.861 1.00 0.00 C ATOM 0 H VAL A 6 -12.373 7.753 10.456 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.374 4.952 9.927 1.00 0.00 H new ATOM 0 HB VAL A 6 -13.769 4.320 10.203 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -13.688 4.374 12.681 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -12.097 3.968 11.995 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -12.408 5.609 12.610 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -15.234 5.891 11.446 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -13.964 7.135 11.368 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -14.750 6.572 9.874 1.00 0.00 H new ATOM 1115 N CYS A 7 -12.346 5.135 7.542 1.00 0.00 N ATOM 1116 CA CYS A 7 -12.749 5.419 6.142 1.00 0.00 C ATOM 1117 C CYS A 7 -14.261 5.458 6.021 1.00 0.00 C ATOM 1118 O CYS A 7 -14.945 4.487 6.273 1.00 0.00 O ATOM 1119 CB CYS A 7 -12.206 4.321 5.253 1.00 0.00 C ATOM 1120 SG CYS A 7 -12.664 4.638 3.534 1.00 0.00 S ATOM 0 H CYS A 7 -11.877 4.242 7.691 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.351 6.388 5.842 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -11.121 4.269 5.346 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -12.600 3.356 5.571 1.00 0.00 H new ATOM 1125 N SER A 8 -14.786 6.574 5.625 1.00 0.00 N ATOM 1126 CA SER A 8 -16.250 6.684 5.473 1.00 0.00 C ATOM 1127 C SER A 8 -16.734 5.675 4.430 1.00 0.00 C ATOM 1128 O SER A 8 -17.785 5.086 4.574 1.00 0.00 O ATOM 1129 CB SER A 8 -16.603 8.089 4.996 1.00 0.00 C ATOM 1130 OG SER A 8 -16.146 9.045 5.947 1.00 0.00 O ATOM 0 H SER A 8 -14.260 7.418 5.399 1.00 0.00 H new ATOM 0 HA SER A 8 -16.728 6.483 6.432 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.146 8.280 4.025 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.681 8.179 4.864 1.00 0.00 H new ATOM 0 HG SER A 8 -15.166 9.036 5.975 1.00 0.00 H new ATOM 1136 N ASN A 9 -16.000 5.496 3.352 1.00 0.00 N ATOM 1137 CA ASN A 9 -16.475 4.554 2.298 1.00 0.00 C ATOM 1138 C ASN A 9 -16.359 3.087 2.735 1.00 0.00 C ATOM 1139 O ASN A 9 -17.238 2.305 2.426 1.00 0.00 O ATOM 1140 CB ASN A 9 -15.638 4.760 1.032 1.00 0.00 C ATOM 1141 CG ASN A 9 -16.015 6.081 0.357 1.00 0.00 C ATOM 1142 OD1 ASN A 9 -15.465 6.423 -0.671 1.00 0.00 O ATOM 1143 ND2 ASN A 9 -16.926 6.846 0.893 1.00 0.00 N ATOM 0 H ASN A 9 -15.109 5.955 3.164 1.00 0.00 H new ATOM 0 HA ASN A 9 -17.528 4.766 2.113 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -14.578 4.762 1.285 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -15.799 3.932 0.342 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -17.176 7.730 0.449 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -17.389 6.560 1.756 1.00 0.00 H new ATOM 1150 N CYS A 10 -15.299 2.672 3.420 1.00 0.00 N ATOM 1151 CA CYS A 10 -15.197 1.215 3.810 1.00 0.00 C ATOM 1152 C CYS A 10 -14.900 1.034 5.305 1.00 0.00 C ATOM 1153 O CYS A 10 -14.719 -0.076 5.765 1.00 0.00 O ATOM 1154 CB CYS A 10 -14.148 0.487 2.940 1.00 0.00 C ATOM 1155 SG CYS A 10 -12.452 0.945 3.402 1.00 0.00 S ATOM 0 H CYS A 10 -14.522 3.263 3.717 1.00 0.00 H new ATOM 0 HA CYS A 10 -16.171 0.762 3.625 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -14.274 -0.591 3.044 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -14.316 0.728 1.890 1.00 0.00 H new ATOM 1160 N GLN A 11 -14.909 2.080 6.089 1.00 0.00 N ATOM 1161 CA GLN A 11 -14.697 1.922 7.563 1.00 0.00 C ATOM 1162 C GLN A 11 -13.315 1.339 7.906 1.00 0.00 C ATOM 1163 O GLN A 11 -13.007 1.135 9.063 1.00 0.00 O ATOM 1164 CB GLN A 11 -15.804 1.013 8.124 1.00 0.00 C ATOM 1165 CG GLN A 11 -16.034 1.303 9.612 1.00 0.00 C ATOM 1166 CD GLN A 11 -16.678 2.684 9.774 1.00 0.00 C ATOM 1167 OE1 GLN A 11 -17.657 2.991 9.122 1.00 0.00 O ATOM 1168 NE2 GLN A 11 -16.167 3.533 10.623 1.00 0.00 N ATOM 0 H GLN A 11 -15.054 3.039 5.774 1.00 0.00 H new ATOM 0 HA GLN A 11 -14.739 2.912 8.017 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -16.729 1.172 7.569 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -15.527 -0.033 7.990 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -16.677 0.538 10.047 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -15.087 1.267 10.150 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -15.346 3.275 11.170 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -16.589 4.454 10.740 1.00 0.00 H new ATOM 1177 N THR A 12 -12.471 1.075 6.948 1.00 0.00 N ATOM 1178 CA THR A 12 -11.128 0.523 7.308 1.00 0.00 C ATOM 1179 C THR A 12 -10.375 1.584 8.123 1.00 0.00 C ATOM 1180 O THR A 12 -10.630 2.763 7.972 1.00 0.00 O ATOM 1181 CB THR A 12 -10.345 0.177 6.028 1.00 0.00 C ATOM 1182 OG1 THR A 12 -9.184 -0.563 6.372 1.00 0.00 O ATOM 1183 CG2 THR A 12 -9.931 1.452 5.294 1.00 0.00 C ATOM 0 H THR A 12 -12.643 1.212 5.952 1.00 0.00 H new ATOM 0 HA THR A 12 -11.238 -0.387 7.897 1.00 0.00 H new ATOM 0 HB THR A 12 -10.985 -0.415 5.374 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.685 -0.786 5.558 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.379 1.189 4.392 1.00 0.00 H new ATOM 0 HG22 THR A 12 -10.820 2.021 5.022 1.00 0.00 H new ATOM 0 HG23 THR A 12 -9.298 2.057 5.944 1.00 0.00 H new ATOM 1191 N SER A 13 -9.440 1.192 8.971 1.00 0.00 N ATOM 1192 CA SER A 13 -8.664 2.209 9.773 1.00 0.00 C ATOM 1193 C SER A 13 -7.198 2.181 9.332 1.00 0.00 C ATOM 1194 O SER A 13 -6.394 2.988 9.757 1.00 0.00 O ATOM 1195 CB SER A 13 -8.785 1.914 11.269 1.00 0.00 C ATOM 1196 OG SER A 13 -8.277 0.614 11.537 1.00 0.00 O ATOM 0 H SER A 13 -9.182 0.220 9.141 1.00 0.00 H new ATOM 0 HA SER A 13 -9.074 3.203 9.594 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.233 2.658 11.843 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.827 1.980 11.581 1.00 0.00 H new ATOM 0 HG SER A 13 -8.352 0.425 12.496 1.00 0.00 H new ATOM 1202 N THR A 14 -6.857 1.275 8.452 1.00 0.00 N ATOM 1203 CA THR A 14 -5.459 1.199 7.931 1.00 0.00 C ATOM 1204 C THR A 14 -5.466 1.795 6.529 1.00 0.00 C ATOM 1205 O THR A 14 -6.165 1.322 5.655 1.00 0.00 O ATOM 1206 CB THR A 14 -5.013 -0.262 7.851 1.00 0.00 C ATOM 1207 OG1 THR A 14 -5.833 -0.954 6.920 1.00 0.00 O ATOM 1208 CG2 THR A 14 -5.140 -0.911 9.226 1.00 0.00 C ATOM 0 H THR A 14 -7.494 0.577 8.068 1.00 0.00 H new ATOM 0 HA THR A 14 -4.776 1.739 8.587 1.00 0.00 H new ATOM 0 HB THR A 14 -3.974 -0.309 7.526 1.00 0.00 H new ATOM 0 HG1 THR A 14 -6.357 -0.308 6.402 1.00 0.00 H new ATOM 0 HG21 THR A 14 -4.822 -1.952 9.168 1.00 0.00 H new ATOM 0 HG22 THR A 14 -4.511 -0.379 9.939 1.00 0.00 H new ATOM 0 HG23 THR A 14 -6.178 -0.867 9.555 1.00 0.00 H new ATOM 1216 N THR A 15 -4.704 2.829 6.297 1.00 0.00 N ATOM 1217 CA THR A 15 -4.691 3.452 4.939 1.00 0.00 C ATOM 1218 C THR A 15 -3.294 3.967 4.620 1.00 0.00 C ATOM 1219 O THR A 15 -2.569 4.401 5.492 1.00 0.00 O ATOM 1220 CB THR A 15 -5.661 4.636 4.921 1.00 0.00 C ATOM 1221 OG1 THR A 15 -5.032 5.765 5.509 1.00 0.00 O ATOM 1222 CG2 THR A 15 -6.909 4.286 5.722 1.00 0.00 C ATOM 0 H THR A 15 -4.092 3.269 6.984 1.00 0.00 H new ATOM 0 HA THR A 15 -4.986 2.706 4.201 1.00 0.00 H new ATOM 0 HB THR A 15 -5.940 4.861 3.892 1.00 0.00 H new ATOM 0 HG1 THR A 15 -5.653 6.198 6.131 1.00 0.00 H new ATOM 0 HG21 THR A 15 -7.599 5.130 5.708 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.393 3.415 5.280 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.630 4.062 6.752 1.00 0.00 H new ATOM 1230 N THR A 16 -2.916 3.950 3.372 1.00 0.00 N ATOM 1231 CA THR A 16 -1.574 4.470 3.014 1.00 0.00 C ATOM 1232 C THR A 16 -1.636 6.000 3.087 1.00 0.00 C ATOM 1233 O THR A 16 -0.740 6.643 3.598 1.00 0.00 O ATOM 1234 CB THR A 16 -1.187 4.015 1.599 1.00 0.00 C ATOM 1235 OG1 THR A 16 -2.034 4.646 0.651 1.00 0.00 O ATOM 1236 CG2 THR A 16 -1.318 2.488 1.464 1.00 0.00 C ATOM 0 H THR A 16 -3.475 3.601 2.593 1.00 0.00 H new ATOM 0 HA THR A 16 -0.820 4.088 3.702 1.00 0.00 H new ATOM 0 HB THR A 16 -0.150 4.295 1.415 1.00 0.00 H new ATOM 0 HG1 THR A 16 -2.143 4.063 -0.129 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.039 2.187 0.454 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.659 2.001 2.183 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.349 2.193 1.659 1.00 0.00 H new ATOM 1244 N LEU A 17 -2.712 6.585 2.613 1.00 0.00 N ATOM 1245 CA LEU A 17 -2.857 8.076 2.691 1.00 0.00 C ATOM 1246 C LEU A 17 -4.343 8.400 2.912 1.00 0.00 C ATOM 1247 O LEU A 17 -5.204 7.886 2.223 1.00 0.00 O ATOM 1248 CB LEU A 17 -2.344 8.742 1.395 1.00 0.00 C ATOM 1249 CG LEU A 17 -1.716 10.115 1.709 1.00 0.00 C ATOM 1250 CD1 LEU A 17 -0.367 9.937 2.452 1.00 0.00 C ATOM 1251 CD2 LEU A 17 -1.503 10.888 0.389 1.00 0.00 C ATOM 0 H LEU A 17 -3.494 6.097 2.177 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.262 8.465 3.517 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.606 8.099 0.915 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.167 8.864 0.691 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.388 10.679 2.356 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.063 10.916 2.666 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.534 9.402 3.387 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.321 9.368 1.826 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.059 11.860 0.604 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.837 10.321 -0.261 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.462 11.029 -0.109 1.00 0.00 H new ATOM 1263 N TRP A 18 -4.655 9.238 3.868 1.00 0.00 N ATOM 1264 CA TRP A 18 -6.083 9.580 4.129 1.00 0.00 C ATOM 1265 C TRP A 18 -6.579 10.587 3.087 1.00 0.00 C ATOM 1266 O TRP A 18 -5.961 11.606 2.853 1.00 0.00 O ATOM 1267 CB TRP A 18 -6.189 10.204 5.530 1.00 0.00 C ATOM 1268 CG TRP A 18 -6.125 9.117 6.559 1.00 0.00 C ATOM 1269 CD1 TRP A 18 -5.090 8.892 7.403 1.00 0.00 C ATOM 1270 CD2 TRP A 18 -7.121 8.096 6.855 1.00 0.00 C ATOM 1271 NE1 TRP A 18 -5.389 7.792 8.189 1.00 0.00 N ATOM 1272 CE2 TRP A 18 -6.629 7.272 7.892 1.00 0.00 C ATOM 1273 CE3 TRP A 18 -8.392 7.808 6.328 1.00 0.00 C ATOM 1274 CZ2 TRP A 18 -7.368 6.201 8.390 1.00 0.00 C ATOM 1275 CZ3 TRP A 18 -9.140 6.727 6.827 1.00 0.00 C ATOM 1276 CH2 TRP A 18 -8.628 5.927 7.855 1.00 0.00 C ATOM 0 H TRP A 18 -3.981 9.700 4.479 1.00 0.00 H new ATOM 0 HA TRP A 18 -6.693 8.679 4.069 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -5.379 10.917 5.686 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.123 10.757 5.625 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.182 9.474 7.454 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -4.766 7.413 8.902 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -8.796 8.420 5.536 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -6.969 5.587 9.184 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -10.115 6.513 6.415 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -9.207 5.098 8.234 1.00 0.00 H new ATOM 1287 N ARG A 19 -7.689 10.299 2.458 1.00 0.00 N ATOM 1288 CA ARG A 19 -8.247 11.218 1.416 1.00 0.00 C ATOM 1289 C ARG A 19 -9.547 11.830 1.939 1.00 0.00 C ATOM 1290 O ARG A 19 -10.007 11.504 3.016 1.00 0.00 O ATOM 1291 CB ARG A 19 -8.556 10.422 0.138 1.00 0.00 C ATOM 1292 CG ARG A 19 -7.392 9.500 -0.215 1.00 0.00 C ATOM 1293 CD ARG A 19 -6.168 10.313 -0.636 1.00 0.00 C ATOM 1294 NE ARG A 19 -5.136 9.365 -1.161 1.00 0.00 N ATOM 1295 CZ ARG A 19 -4.044 9.797 -1.741 1.00 0.00 C ATOM 1296 NH1 ARG A 19 -3.781 11.073 -1.809 1.00 0.00 N ATOM 1297 NH2 ARG A 19 -3.201 8.940 -2.238 1.00 0.00 N ATOM 0 H ARG A 19 -8.240 9.457 2.623 1.00 0.00 H new ATOM 0 HA ARG A 19 -7.521 12.001 1.195 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -9.463 9.834 0.280 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -8.747 11.108 -0.687 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -7.143 8.876 0.643 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -7.685 8.829 -1.023 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -6.440 11.041 -1.400 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -5.774 10.873 0.212 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.286 8.361 -1.065 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.430 11.750 -1.407 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -2.926 11.394 -2.264 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.393 7.940 -2.174 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.348 9.268 -2.691 1.00 0.00 H new ATOM 1311 N ARG A 20 -10.156 12.692 1.169 1.00 0.00 N ATOM 1312 CA ARG A 20 -11.450 13.316 1.580 1.00 0.00 C ATOM 1313 C ARG A 20 -12.415 13.204 0.388 1.00 0.00 C ATOM 1314 O ARG A 20 -12.016 13.367 -0.748 1.00 0.00 O ATOM 1315 CB ARG A 20 -11.208 14.786 1.933 1.00 0.00 C ATOM 1316 CG ARG A 20 -12.462 15.386 2.598 1.00 0.00 C ATOM 1317 CD ARG A 20 -12.420 15.158 4.114 1.00 0.00 C ATOM 1318 NE ARG A 20 -11.519 16.169 4.735 1.00 0.00 N ATOM 1319 CZ ARG A 20 -11.529 16.348 6.028 1.00 0.00 C ATOM 1320 NH1 ARG A 20 -12.323 15.634 6.779 1.00 0.00 N ATOM 1321 NH2 ARG A 20 -10.743 17.238 6.568 1.00 0.00 N ATOM 0 H ARG A 20 -9.807 12.995 0.260 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.872 12.816 2.452 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.355 14.870 2.606 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -10.961 15.348 1.032 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -12.520 16.453 2.385 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -13.358 14.929 2.179 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -13.422 15.239 4.534 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -12.063 14.152 4.333 1.00 0.00 H new ATOM 0 HE ARG A 20 -10.894 16.722 4.149 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -12.935 14.937 6.355 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -12.331 15.773 7.789 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -10.121 17.793 5.980 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -10.750 17.379 7.578 1.00 0.00 H new ATOM 1335 N SER A 21 -13.677 12.928 0.625 1.00 0.00 N ATOM 1336 CA SER A 21 -14.651 12.807 -0.516 1.00 0.00 C ATOM 1337 C SER A 21 -15.309 14.177 -0.776 1.00 0.00 C ATOM 1338 O SER A 21 -15.262 15.054 0.060 1.00 0.00 O ATOM 1339 CB SER A 21 -15.713 11.743 -0.178 1.00 0.00 C ATOM 1340 OG SER A 21 -17.012 12.319 -0.243 1.00 0.00 O ATOM 0 H SER A 21 -14.076 12.782 1.552 1.00 0.00 H new ATOM 0 HA SER A 21 -14.127 12.496 -1.420 1.00 0.00 H new ATOM 0 HB2 SER A 21 -15.640 10.909 -0.876 1.00 0.00 H new ATOM 0 HB3 SER A 21 -15.533 11.341 0.819 1.00 0.00 H new ATOM 0 HG SER A 21 -17.683 11.638 -0.029 1.00 0.00 H new ATOM 1346 N PRO A 22 -15.902 14.368 -1.941 1.00 0.00 N ATOM 1347 CA PRO A 22 -16.550 15.671 -2.282 1.00 0.00 C ATOM 1348 C PRO A 22 -17.560 16.141 -1.217 1.00 0.00 C ATOM 1349 O PRO A 22 -17.927 17.299 -1.174 1.00 0.00 O ATOM 1350 CB PRO A 22 -17.250 15.359 -3.626 1.00 0.00 C ATOM 1351 CG PRO A 22 -16.932 13.901 -4.025 1.00 0.00 C ATOM 1352 CD PRO A 22 -15.962 13.310 -2.993 1.00 0.00 C ATOM 0 HA PRO A 22 -15.832 16.489 -2.336 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -18.327 15.498 -3.532 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -16.906 16.046 -4.399 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -17.848 13.311 -4.064 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -16.490 13.869 -5.021 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -16.326 12.364 -2.593 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -14.981 13.116 -3.426 1.00 0.00 H new ATOM 1360 N MET A 23 -18.016 15.258 -0.364 1.00 0.00 N ATOM 1361 CA MET A 23 -19.007 15.666 0.686 1.00 0.00 C ATOM 1362 C MET A 23 -18.278 15.943 2.004 1.00 0.00 C ATOM 1363 O MET A 23 -18.877 16.333 2.988 1.00 0.00 O ATOM 1364 CB MET A 23 -20.024 14.541 0.890 1.00 0.00 C ATOM 1365 CG MET A 23 -20.876 14.388 -0.371 1.00 0.00 C ATOM 1366 SD MET A 23 -22.078 13.054 -0.124 1.00 0.00 S ATOM 1367 CE MET A 23 -23.063 13.331 -1.618 1.00 0.00 C ATOM 0 H MET A 23 -17.747 14.274 -0.347 1.00 0.00 H new ATOM 0 HA MET A 23 -19.523 16.570 0.364 1.00 0.00 H new ATOM 0 HB2 MET A 23 -19.509 13.606 1.109 1.00 0.00 H new ATOM 0 HB3 MET A 23 -20.660 14.763 1.747 1.00 0.00 H new ATOM 0 HG2 MET A 23 -21.393 15.322 -0.590 1.00 0.00 H new ATOM 0 HG3 MET A 23 -20.241 14.166 -1.228 1.00 0.00 H new ATOM 0 HE1 MET A 23 -23.872 12.602 -1.661 1.00 0.00 H new ATOM 0 HE2 MET A 23 -23.482 14.337 -1.596 1.00 0.00 H new ATOM 0 HE3 MET A 23 -22.429 13.221 -2.498 1.00 0.00 H new ATOM 1377 N GLY A 24 -16.989 15.739 2.030 1.00 0.00 N ATOM 1378 CA GLY A 24 -16.210 15.982 3.279 1.00 0.00 C ATOM 1379 C GLY A 24 -16.220 14.719 4.142 1.00 0.00 C ATOM 1380 O GLY A 24 -16.104 14.782 5.350 1.00 0.00 O ATOM 0 H GLY A 24 -16.439 15.413 1.236 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -15.185 16.258 3.033 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.641 16.816 3.832 1.00 0.00 H new ATOM 1384 N ASP A 25 -16.354 13.569 3.533 1.00 0.00 N ATOM 1385 CA ASP A 25 -16.372 12.294 4.306 1.00 0.00 C ATOM 1386 C ASP A 25 -14.964 11.650 4.283 1.00 0.00 C ATOM 1387 O ASP A 25 -14.486 11.285 3.227 1.00 0.00 O ATOM 1388 CB ASP A 25 -17.351 11.336 3.623 1.00 0.00 C ATOM 1389 CG ASP A 25 -18.753 11.948 3.629 1.00 0.00 C ATOM 1390 OD1 ASP A 25 -18.961 12.897 4.367 1.00 0.00 O ATOM 1391 OD2 ASP A 25 -19.595 11.455 2.898 1.00 0.00 O ATOM 0 H ASP A 25 -16.453 13.459 2.524 1.00 0.00 H new ATOM 0 HA ASP A 25 -16.668 12.490 5.336 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -17.032 11.142 2.599 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -17.359 10.377 4.141 1.00 0.00 H new ATOM 1396 N PRO A 26 -14.292 11.488 5.412 1.00 0.00 N ATOM 1397 CA PRO A 26 -12.935 10.851 5.401 1.00 0.00 C ATOM 1398 C PRO A 26 -12.938 9.499 4.663 1.00 0.00 C ATOM 1399 O PRO A 26 -13.841 8.702 4.820 1.00 0.00 O ATOM 1400 CB PRO A 26 -12.643 10.682 6.905 1.00 0.00 C ATOM 1401 CG PRO A 26 -13.616 11.588 7.675 1.00 0.00 C ATOM 1402 CD PRO A 26 -14.799 11.912 6.752 1.00 0.00 C ATOM 0 HA PRO A 26 -12.184 11.439 4.874 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -12.771 9.642 7.205 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -11.611 10.953 7.127 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -13.965 11.090 8.580 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -13.116 12.504 7.988 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -15.697 11.365 7.037 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -15.051 12.972 6.773 1.00 0.00 H new ATOM 1410 N VAL A 27 -11.930 9.236 3.867 1.00 0.00 N ATOM 1411 CA VAL A 27 -11.873 7.929 3.124 1.00 0.00 C ATOM 1412 C VAL A 27 -10.422 7.425 3.039 1.00 0.00 C ATOM 1413 O VAL A 27 -9.485 8.185 3.185 1.00 0.00 O ATOM 1414 CB VAL A 27 -12.463 8.097 1.710 1.00 0.00 C ATOM 1415 CG1 VAL A 27 -13.999 8.032 1.786 1.00 0.00 C ATOM 1416 CG2 VAL A 27 -12.017 9.455 1.104 1.00 0.00 C ATOM 0 H VAL A 27 -11.145 9.865 3.697 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.465 7.192 3.667 1.00 0.00 H new ATOM 0 HB VAL A 27 -12.099 7.293 1.070 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.418 8.151 0.787 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.303 7.068 2.195 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -14.366 8.831 2.430 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.439 9.564 0.105 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.369 10.269 1.737 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -10.929 9.487 1.044 1.00 0.00 H new ATOM 1426 N CYS A 28 -10.228 6.141 2.797 1.00 0.00 N ATOM 1427 CA CYS A 28 -8.840 5.594 2.698 1.00 0.00 C ATOM 1428 C CYS A 28 -8.286 5.812 1.279 1.00 0.00 C ATOM 1429 O CYS A 28 -9.019 6.049 0.340 1.00 0.00 O ATOM 1430 CB CYS A 28 -8.819 4.095 3.080 1.00 0.00 C ATOM 1431 SG CYS A 28 -9.651 3.064 1.841 1.00 0.00 S ATOM 0 H CYS A 28 -10.973 5.457 2.665 1.00 0.00 H new ATOM 0 HA CYS A 28 -8.200 6.127 3.401 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -7.786 3.764 3.192 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -9.303 3.961 4.047 1.00 0.00 H new ATOM 1436 N ASN A 29 -6.987 5.771 1.138 1.00 0.00 N ATOM 1437 CA ASN A 29 -6.343 6.018 -0.190 1.00 0.00 C ATOM 1438 C ASN A 29 -7.014 5.218 -1.308 1.00 0.00 C ATOM 1439 O ASN A 29 -7.145 5.697 -2.417 1.00 0.00 O ATOM 1440 CB ASN A 29 -4.875 5.604 -0.109 1.00 0.00 C ATOM 1441 CG ASN A 29 -4.168 5.989 -1.408 1.00 0.00 C ATOM 1442 OD1 ASN A 29 -4.759 5.952 -2.468 1.00 0.00 O ATOM 1443 ND2 ASN A 29 -2.921 6.363 -1.371 1.00 0.00 N ATOM 0 H ASN A 29 -6.334 5.574 1.897 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.445 7.078 -0.422 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.394 6.092 0.739 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -4.797 4.529 0.056 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.441 6.625 -2.232 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -2.424 6.394 -0.481 1.00 0.00 H new ATOM 1450 N ALA A 30 -7.421 4.012 -1.057 1.00 0.00 N ATOM 1451 CA ALA A 30 -8.051 3.218 -2.152 1.00 0.00 C ATOM 1452 C ALA A 30 -9.481 3.708 -2.454 1.00 0.00 C ATOM 1453 O ALA A 30 -9.820 3.948 -3.596 1.00 0.00 O ATOM 1454 CB ALA A 30 -8.067 1.748 -1.762 1.00 0.00 C ATOM 0 H ALA A 30 -7.349 3.541 -0.155 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.462 3.351 -3.059 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -8.527 1.165 -2.560 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -7.046 1.403 -1.603 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.640 1.621 -0.844 1.00 0.00 H new ATOM 1460 N CYS A 31 -10.331 3.850 -1.464 1.00 0.00 N ATOM 1461 CA CYS A 31 -11.728 4.311 -1.759 1.00 0.00 C ATOM 1462 C CYS A 31 -11.689 5.660 -2.469 1.00 0.00 C ATOM 1463 O CYS A 31 -12.423 5.901 -3.394 1.00 0.00 O ATOM 1464 CB CYS A 31 -12.535 4.501 -0.470 1.00 0.00 C ATOM 1465 SG CYS A 31 -12.970 2.909 0.259 1.00 0.00 S ATOM 0 H CYS A 31 -10.125 3.671 -0.481 1.00 0.00 H new ATOM 0 HA CYS A 31 -12.196 3.548 -2.381 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -11.955 5.086 0.244 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -13.441 5.067 -0.684 1.00 0.00 H new ATOM 1470 N GLY A 32 -10.864 6.550 -2.022 1.00 0.00 N ATOM 1471 CA GLY A 32 -10.824 7.889 -2.660 1.00 0.00 C ATOM 1472 C GLY A 32 -10.591 7.756 -4.165 1.00 0.00 C ATOM 1473 O GLY A 32 -11.335 8.289 -4.965 1.00 0.00 O ATOM 0 H GLY A 32 -10.216 6.413 -1.246 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.761 8.415 -2.476 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.030 8.488 -2.214 1.00 0.00 H new ATOM 1477 N LEU A 33 -9.561 7.064 -4.558 1.00 0.00 N ATOM 1478 CA LEU A 33 -9.275 6.914 -6.014 1.00 0.00 C ATOM 1479 C LEU A 33 -10.379 6.107 -6.703 1.00 0.00 C ATOM 1480 O LEU A 33 -10.874 6.491 -7.742 1.00 0.00 O ATOM 1481 CB LEU A 33 -7.943 6.187 -6.186 1.00 0.00 C ATOM 1482 CG LEU A 33 -6.811 7.017 -5.552 1.00 0.00 C ATOM 1483 CD1 LEU A 33 -5.580 6.132 -5.322 1.00 0.00 C ATOM 1484 CD2 LEU A 33 -6.429 8.190 -6.474 1.00 0.00 C ATOM 0 H LEU A 33 -8.903 6.595 -3.936 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.231 7.904 -6.468 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.992 5.204 -5.718 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.740 6.026 -7.245 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.161 7.410 -4.598 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.784 6.726 -4.873 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.841 5.312 -4.654 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.239 5.729 -6.275 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.628 8.768 -6.014 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.091 7.802 -7.435 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -7.298 8.831 -6.627 1.00 0.00 H new ATOM 1496 N TYR A 34 -10.770 4.994 -6.149 1.00 0.00 N ATOM 1497 CA TYR A 34 -11.835 4.182 -6.806 1.00 0.00 C ATOM 1498 C TYR A 34 -13.105 5.016 -6.919 1.00 0.00 C ATOM 1499 O TYR A 34 -13.761 5.044 -7.942 1.00 0.00 O ATOM 1500 CB TYR A 34 -12.129 2.936 -5.962 1.00 0.00 C ATOM 1501 CG TYR A 34 -13.226 2.129 -6.617 1.00 0.00 C ATOM 1502 CD1 TYR A 34 -14.567 2.452 -6.382 1.00 0.00 C ATOM 1503 CD2 TYR A 34 -12.902 1.060 -7.462 1.00 0.00 C ATOM 1504 CE1 TYR A 34 -15.582 1.708 -6.991 1.00 0.00 C ATOM 1505 CE2 TYR A 34 -13.921 0.315 -8.071 1.00 0.00 C ATOM 1506 CZ TYR A 34 -15.261 0.641 -7.835 1.00 0.00 C ATOM 1507 OH TYR A 34 -16.265 -0.090 -8.437 1.00 0.00 O ATOM 0 H TYR A 34 -10.403 4.613 -5.277 1.00 0.00 H new ATOM 0 HA TYR A 34 -11.498 3.880 -7.798 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -11.228 2.331 -5.862 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -12.430 3.228 -4.956 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -14.818 3.276 -5.730 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -11.867 0.810 -7.644 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -16.617 1.958 -6.809 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -13.672 -0.510 -8.722 1.00 0.00 H new ATOM 0 HH TYR A 34 -15.869 -0.794 -8.992 1.00 0.00 H new ATOM 1517 N TYR A 35 -13.456 5.691 -5.867 1.00 0.00 N ATOM 1518 CA TYR A 35 -14.680 6.525 -5.876 1.00 0.00 C ATOM 1519 C TYR A 35 -14.558 7.638 -6.925 1.00 0.00 C ATOM 1520 O TYR A 35 -15.449 7.872 -7.712 1.00 0.00 O ATOM 1521 CB TYR A 35 -14.847 7.159 -4.488 1.00 0.00 C ATOM 1522 CG TYR A 35 -16.261 7.640 -4.326 1.00 0.00 C ATOM 1523 CD1 TYR A 35 -17.244 6.757 -3.867 1.00 0.00 C ATOM 1524 CD2 TYR A 35 -16.589 8.959 -4.643 1.00 0.00 C ATOM 1525 CE1 TYR A 35 -18.563 7.191 -3.724 1.00 0.00 C ATOM 1526 CE2 TYR A 35 -17.910 9.399 -4.504 1.00 0.00 C ATOM 1527 CZ TYR A 35 -18.899 8.514 -4.042 1.00 0.00 C ATOM 1528 OH TYR A 35 -20.203 8.946 -3.905 1.00 0.00 O ATOM 0 H TYR A 35 -12.938 5.700 -4.988 1.00 0.00 H new ATOM 0 HA TYR A 35 -15.541 5.903 -6.121 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -14.608 6.431 -3.713 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -14.152 7.991 -4.370 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -16.982 5.738 -3.623 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -15.826 9.638 -4.994 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -19.322 6.510 -3.369 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -18.169 10.418 -4.752 1.00 0.00 H new ATOM 0 HH TYR A 35 -20.265 9.889 -4.166 1.00 0.00 H new ATOM 1538 N LYS A 36 -13.468 8.344 -6.918 1.00 0.00 N ATOM 1539 CA LYS A 36 -13.294 9.476 -7.875 1.00 0.00 C ATOM 1540 C LYS A 36 -13.441 9.016 -9.330 1.00 0.00 C ATOM 1541 O LYS A 36 -14.052 9.696 -10.128 1.00 0.00 O ATOM 1542 CB LYS A 36 -11.903 10.076 -7.651 1.00 0.00 C ATOM 1543 CG LYS A 36 -11.594 11.121 -8.728 1.00 0.00 C ATOM 1544 CD LYS A 36 -10.342 11.922 -8.341 1.00 0.00 C ATOM 1545 CE LYS A 36 -9.081 11.075 -8.545 1.00 0.00 C ATOM 1546 NZ LYS A 36 -9.048 10.550 -9.940 1.00 0.00 N ATOM 0 H LYS A 36 -12.681 8.188 -6.288 1.00 0.00 H new ATOM 0 HA LYS A 36 -14.070 10.220 -7.695 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -11.853 10.536 -6.664 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.151 9.287 -7.674 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.439 10.630 -9.689 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -12.443 11.794 -8.848 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -10.281 12.828 -8.945 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.412 12.237 -7.300 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -8.192 11.676 -8.351 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -9.068 10.248 -7.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -8.078 10.611 -10.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -9.359 9.558 -9.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -9.684 11.115 -10.539 1.00 0.00 H new ATOM 1560 N LEU A 37 -12.902 7.897 -9.703 1.00 0.00 N ATOM 1561 CA LEU A 37 -13.054 7.473 -11.125 1.00 0.00 C ATOM 1562 C LEU A 37 -14.541 7.318 -11.462 1.00 0.00 C ATOM 1563 O LEU A 37 -15.015 7.859 -12.441 1.00 0.00 O ATOM 1564 CB LEU A 37 -12.291 6.157 -11.349 1.00 0.00 C ATOM 1565 CG LEU A 37 -10.851 6.465 -11.811 1.00 0.00 C ATOM 1566 CD1 LEU A 37 -10.102 7.301 -10.758 1.00 0.00 C ATOM 1567 CD2 LEU A 37 -10.099 5.155 -12.054 1.00 0.00 C ATOM 0 H LEU A 37 -12.372 7.265 -9.103 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.635 8.231 -11.787 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -12.271 5.575 -10.428 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.802 5.552 -12.098 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.902 7.040 -12.736 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.090 7.504 -11.108 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.628 8.243 -10.600 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -10.057 6.749 -9.819 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -9.082 5.374 -12.380 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -10.067 4.577 -11.130 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -10.611 4.579 -12.825 1.00 0.00 H new ATOM 1579 N HIS A 38 -15.283 6.606 -10.655 1.00 0.00 N ATOM 1580 CA HIS A 38 -16.745 6.442 -10.925 1.00 0.00 C ATOM 1581 C HIS A 38 -17.515 7.381 -10.000 1.00 0.00 C ATOM 1582 O HIS A 38 -18.075 8.353 -10.445 1.00 0.00 O ATOM 1583 CB HIS A 38 -17.145 4.995 -10.640 1.00 0.00 C ATOM 1584 CG HIS A 38 -16.386 4.086 -11.567 1.00 0.00 C ATOM 1585 ND1 HIS A 38 -16.946 3.583 -12.731 1.00 0.00 N ATOM 1586 CD2 HIS A 38 -15.106 3.590 -11.521 1.00 0.00 C ATOM 1587 CE1 HIS A 38 -16.014 2.821 -13.331 1.00 0.00 C ATOM 1588 NE2 HIS A 38 -14.874 2.790 -12.636 1.00 0.00 N ATOM 0 H HIS A 38 -14.941 6.130 -9.820 1.00 0.00 H new ATOM 0 HA HIS A 38 -16.971 6.679 -11.965 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -16.927 4.742 -9.602 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -18.218 4.866 -10.781 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -14.389 3.790 -10.739 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -16.169 2.297 -14.263 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -14.018 2.288 -12.872 1.00 0.00 H new ATOM 1596 N GLN A 39 -17.524 7.042 -8.724 1.00 0.00 N ATOM 1597 CA GLN A 39 -18.235 7.829 -7.641 1.00 0.00 C ATOM 1598 C GLN A 39 -19.352 6.984 -7.027 1.00 0.00 C ATOM 1599 O GLN A 39 -20.496 7.386 -6.963 1.00 0.00 O ATOM 1600 CB GLN A 39 -18.800 9.184 -8.140 1.00 0.00 C ATOM 1601 CG GLN A 39 -20.079 8.999 -9.011 1.00 0.00 C ATOM 1602 CD GLN A 39 -21.326 9.490 -8.259 1.00 0.00 C ATOM 1603 OE1 GLN A 39 -22.345 8.826 -8.248 1.00 0.00 O ATOM 1604 NE2 GLN A 39 -21.284 10.634 -7.629 1.00 0.00 N ATOM 0 H GLN A 39 -17.046 6.213 -8.371 1.00 0.00 H new ATOM 0 HA GLN A 39 -17.488 8.065 -6.883 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -19.033 9.817 -7.284 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -18.038 9.703 -8.721 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -19.971 9.550 -9.945 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -20.197 7.948 -9.273 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -20.429 11.190 -7.639 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -22.106 10.971 -7.128 1.00 0.00 H new ATOM 1613 N VAL A 40 -19.008 5.817 -6.544 1.00 0.00 N ATOM 1614 CA VAL A 40 -20.004 4.926 -5.895 1.00 0.00 C ATOM 1615 C VAL A 40 -19.297 4.138 -4.790 1.00 0.00 C ATOM 1616 O VAL A 40 -18.090 4.006 -4.790 1.00 0.00 O ATOM 1617 CB VAL A 40 -20.570 3.948 -6.914 1.00 0.00 C ATOM 1618 CG1 VAL A 40 -21.521 4.675 -7.866 1.00 0.00 C ATOM 1619 CG2 VAL A 40 -19.426 3.325 -7.711 1.00 0.00 C ATOM 0 H VAL A 40 -18.060 5.442 -6.575 1.00 0.00 H new ATOM 0 HA VAL A 40 -20.818 5.523 -5.484 1.00 0.00 H new ATOM 0 HB VAL A 40 -21.120 3.166 -6.391 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.921 3.967 -8.592 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -22.341 5.113 -7.297 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.980 5.464 -8.389 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -19.831 2.624 -8.441 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -18.874 4.109 -8.228 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -18.756 2.796 -7.033 1.00 0.00 H new ATOM 1629 N ASN A 41 -20.034 3.599 -3.860 1.00 0.00 N ATOM 1630 CA ASN A 41 -19.390 2.806 -2.773 1.00 0.00 C ATOM 1631 C ASN A 41 -19.185 1.369 -3.269 1.00 0.00 C ATOM 1632 O ASN A 41 -19.915 0.909 -4.123 1.00 0.00 O ATOM 1633 CB ASN A 41 -20.306 2.787 -1.546 1.00 0.00 C ATOM 1634 CG ASN A 41 -21.633 2.113 -1.906 1.00 0.00 C ATOM 1635 OD1 ASN A 41 -22.156 2.313 -2.983 1.00 0.00 O ATOM 1636 ND2 ASN A 41 -22.201 1.317 -1.044 1.00 0.00 N ATOM 0 H ASN A 41 -21.050 3.672 -3.804 1.00 0.00 H new ATOM 0 HA ASN A 41 -18.432 3.252 -2.505 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -19.824 2.251 -0.728 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -20.486 3.804 -1.198 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.085 0.863 -1.275 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -21.762 1.149 -0.139 1.00 0.00 H new ATOM 1643 N ARG A 42 -18.205 0.650 -2.754 1.00 0.00 N ATOM 1644 CA ARG A 42 -17.973 -0.766 -3.216 1.00 0.00 C ATOM 1645 C ARG A 42 -18.010 -1.724 -1.999 1.00 0.00 C ATOM 1646 O ARG A 42 -17.651 -1.331 -0.906 1.00 0.00 O ATOM 1647 CB ARG A 42 -16.597 -0.847 -3.913 1.00 0.00 C ATOM 1648 CG ARG A 42 -15.441 -0.614 -2.914 1.00 0.00 C ATOM 1649 CD ARG A 42 -15.426 0.846 -2.407 1.00 0.00 C ATOM 1650 NE ARG A 42 -14.012 1.346 -2.339 1.00 0.00 N ATOM 1651 CZ ARG A 42 -13.057 0.628 -1.796 1.00 0.00 C ATOM 1652 NH1 ARG A 42 -13.329 -0.497 -1.193 1.00 0.00 N ATOM 1653 NH2 ARG A 42 -11.825 1.058 -1.825 1.00 0.00 N ATOM 0 H ARG A 42 -17.559 0.981 -2.037 1.00 0.00 H new ATOM 0 HA ARG A 42 -18.754 -1.060 -3.918 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -16.483 -1.824 -4.382 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -16.547 -0.104 -4.709 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -15.545 -1.294 -2.069 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -14.490 -0.845 -3.394 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -16.013 1.478 -3.073 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -15.890 0.903 -1.422 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.789 2.264 -2.723 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -14.293 -0.827 -1.140 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -12.578 -1.046 -0.775 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.606 1.950 -2.269 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -11.081 0.502 -1.404 1.00 0.00 H new ATOM 1667 N PRO A 43 -18.423 -2.974 -2.163 1.00 0.00 N ATOM 1668 CA PRO A 43 -18.451 -3.928 -1.010 1.00 0.00 C ATOM 1669 C PRO A 43 -17.133 -3.940 -0.214 1.00 0.00 C ATOM 1670 O PRO A 43 -16.069 -3.684 -0.740 1.00 0.00 O ATOM 1671 CB PRO A 43 -18.700 -5.284 -1.700 1.00 0.00 C ATOM 1672 CG PRO A 43 -19.122 -5.018 -3.159 1.00 0.00 C ATOM 1673 CD PRO A 43 -18.892 -3.527 -3.473 1.00 0.00 C ATOM 0 HA PRO A 43 -19.205 -3.664 -0.269 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -17.798 -5.895 -1.672 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -19.478 -5.839 -1.176 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -18.543 -5.642 -3.840 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -20.171 -5.278 -3.303 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -18.148 -3.390 -4.258 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -19.807 -3.040 -3.812 1.00 0.00 H new ATOM 1681 N LEU A 44 -17.206 -4.247 1.053 1.00 0.00 N ATOM 1682 CA LEU A 44 -15.975 -4.294 1.898 1.00 0.00 C ATOM 1683 C LEU A 44 -15.165 -5.543 1.540 1.00 0.00 C ATOM 1684 O LEU A 44 -14.197 -5.878 2.191 1.00 0.00 O ATOM 1685 CB LEU A 44 -16.385 -4.340 3.381 1.00 0.00 C ATOM 1686 CG LEU A 44 -16.570 -2.914 3.909 1.00 0.00 C ATOM 1687 CD1 LEU A 44 -17.737 -2.238 3.182 1.00 0.00 C ATOM 1688 CD2 LEU A 44 -16.863 -2.963 5.412 1.00 0.00 C ATOM 0 H LEU A 44 -18.072 -4.469 1.544 1.00 0.00 H new ATOM 0 HA LEU A 44 -15.365 -3.409 1.720 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -17.311 -4.904 3.495 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -15.623 -4.858 3.963 1.00 0.00 H new ATOM 0 HG LEU A 44 -15.659 -2.343 3.732 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -17.864 -1.224 3.562 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -17.528 -2.202 2.113 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -18.651 -2.807 3.354 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -16.995 -1.949 5.790 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -17.773 -3.537 5.587 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -16.030 -3.438 5.930 1.00 0.00 H new ATOM 1700 N THR A 45 -15.558 -6.235 0.510 1.00 0.00 N ATOM 1701 CA THR A 45 -14.808 -7.456 0.114 1.00 0.00 C ATOM 1702 C THR A 45 -13.396 -7.052 -0.312 1.00 0.00 C ATOM 1703 O THR A 45 -12.518 -7.880 -0.461 1.00 0.00 O ATOM 1704 CB THR A 45 -15.523 -8.140 -1.053 1.00 0.00 C ATOM 1705 OG1 THR A 45 -15.565 -7.252 -2.162 1.00 0.00 O ATOM 1706 CG2 THR A 45 -16.948 -8.505 -0.634 1.00 0.00 C ATOM 0 H THR A 45 -16.364 -6.009 -0.073 1.00 0.00 H new ATOM 0 HA THR A 45 -14.755 -8.148 0.954 1.00 0.00 H new ATOM 0 HB THR A 45 -14.986 -9.046 -1.332 1.00 0.00 H new ATOM 0 HG1 THR A 45 -16.021 -7.687 -2.912 1.00 0.00 H new ATOM 0 HG21 THR A 45 -17.458 -8.992 -1.465 1.00 0.00 H new ATOM 0 HG22 THR A 45 -16.914 -9.183 0.219 1.00 0.00 H new ATOM 0 HG23 THR A 45 -17.489 -7.600 -0.357 1.00 0.00 H new ATOM 1714 N MET A 46 -13.169 -5.776 -0.509 1.00 0.00 N ATOM 1715 CA MET A 46 -11.811 -5.302 -0.926 1.00 0.00 C ATOM 1716 C MET A 46 -11.049 -4.846 0.320 1.00 0.00 C ATOM 1717 O MET A 46 -9.878 -4.526 0.274 1.00 0.00 O ATOM 1718 CB MET A 46 -11.967 -4.125 -1.899 1.00 0.00 C ATOM 1719 CG MET A 46 -10.672 -3.925 -2.691 1.00 0.00 C ATOM 1720 SD MET A 46 -10.853 -2.480 -3.770 1.00 0.00 S ATOM 1721 CE MET A 46 -9.820 -3.057 -5.142 1.00 0.00 C ATOM 0 H MET A 46 -13.867 -5.040 -0.399 1.00 0.00 H new ATOM 0 HA MET A 46 -11.263 -6.105 -1.419 1.00 0.00 H new ATOM 0 HB2 MET A 46 -12.795 -4.314 -2.582 1.00 0.00 H new ATOM 0 HB3 MET A 46 -12.210 -3.217 -1.348 1.00 0.00 H new ATOM 0 HG2 MET A 46 -9.833 -3.783 -2.010 1.00 0.00 H new ATOM 0 HG3 MET A 46 -10.454 -4.813 -3.285 1.00 0.00 H new ATOM 0 HE1 MET A 46 -9.939 -2.387 -5.994 1.00 0.00 H new ATOM 0 HE2 MET A 46 -8.775 -3.067 -4.832 1.00 0.00 H new ATOM 0 HE3 MET A 46 -10.123 -4.064 -5.427 1.00 0.00 H new ATOM 1731 N ARG A 47 -11.727 -4.803 1.430 1.00 0.00 N ATOM 1732 CA ARG A 47 -11.093 -4.356 2.700 1.00 0.00 C ATOM 1733 C ARG A 47 -10.274 -5.493 3.326 1.00 0.00 C ATOM 1734 O ARG A 47 -10.742 -6.606 3.471 1.00 0.00 O ATOM 1735 CB ARG A 47 -12.207 -3.927 3.652 1.00 0.00 C ATOM 1736 CG ARG A 47 -11.637 -3.524 5.010 1.00 0.00 C ATOM 1737 CD ARG A 47 -12.792 -3.095 5.911 1.00 0.00 C ATOM 1738 NE ARG A 47 -12.317 -3.049 7.324 1.00 0.00 N ATOM 1739 CZ ARG A 47 -13.072 -2.534 8.251 1.00 0.00 C ATOM 1740 NH1 ARG A 47 -14.259 -2.090 7.945 1.00 0.00 N ATOM 1741 NH2 ARG A 47 -12.646 -2.480 9.483 1.00 0.00 N ATOM 0 H ARG A 47 -12.710 -5.063 1.513 1.00 0.00 H new ATOM 0 HA ARG A 47 -10.414 -3.526 2.506 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -12.757 -3.090 3.221 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -12.917 -4.744 3.779 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -11.097 -4.359 5.457 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -10.923 -2.708 4.894 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -13.163 -2.116 5.607 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -13.623 -3.794 5.816 1.00 0.00 H new ATOM 0 HE ARG A 47 -11.399 -3.422 7.565 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -14.592 -2.147 6.983 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -14.854 -1.686 8.668 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -11.722 -2.841 9.719 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -13.237 -2.077 10.210 1.00 0.00 H new ATOM 1755 N LYS A 48 -9.052 -5.205 3.708 1.00 0.00 N ATOM 1756 CA LYS A 48 -8.171 -6.240 4.343 1.00 0.00 C ATOM 1757 C LYS A 48 -7.727 -5.730 5.718 1.00 0.00 C ATOM 1758 O LYS A 48 -7.437 -4.563 5.892 1.00 0.00 O ATOM 1759 CB LYS A 48 -6.942 -6.459 3.456 1.00 0.00 C ATOM 1760 CG LYS A 48 -6.083 -7.601 4.010 1.00 0.00 C ATOM 1761 CD LYS A 48 -4.867 -7.792 3.101 1.00 0.00 C ATOM 1762 CE LYS A 48 -3.981 -8.916 3.641 1.00 0.00 C ATOM 1763 NZ LYS A 48 -3.226 -8.426 4.829 1.00 0.00 N ATOM 0 H LYS A 48 -8.622 -4.286 3.606 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.711 -7.180 4.455 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.256 -6.692 2.439 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.353 -5.543 3.406 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.762 -7.372 5.026 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.665 -8.521 4.059 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.193 -8.030 2.089 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.297 -6.865 3.043 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.592 -9.776 3.915 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -3.288 -9.250 2.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -2.514 -9.133 5.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -2.752 -7.531 4.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -3.884 -8.272 5.619 1.00 0.00 H new ATOM 1777 N ASP A 49 -7.691 -6.588 6.701 1.00 0.00 N ATOM 1778 CA ASP A 49 -7.290 -6.161 8.077 1.00 0.00 C ATOM 1779 C ASP A 49 -5.895 -5.518 8.070 1.00 0.00 C ATOM 1780 O ASP A 49 -5.362 -5.168 9.104 1.00 0.00 O ATOM 1781 CB ASP A 49 -7.274 -7.392 8.986 1.00 0.00 C ATOM 1782 CG ASP A 49 -8.514 -8.244 8.705 1.00 0.00 C ATOM 1783 OD1 ASP A 49 -9.577 -7.670 8.541 1.00 0.00 O ATOM 1784 OD2 ASP A 49 -8.376 -9.454 8.652 1.00 0.00 O ATOM 0 H ASP A 49 -7.924 -7.577 6.611 1.00 0.00 H new ATOM 0 HA ASP A 49 -8.005 -5.423 8.440 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -6.370 -7.976 8.811 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -7.258 -7.086 10.032 1.00 0.00 H new ATOM 1789 N GLY A 50 -5.303 -5.349 6.918 1.00 0.00 N ATOM 1790 CA GLY A 50 -3.951 -4.718 6.853 1.00 0.00 C ATOM 1791 C GLY A 50 -3.765 -4.057 5.488 1.00 0.00 C ATOM 1792 O GLY A 50 -4.603 -4.175 4.615 1.00 0.00 O ATOM 0 H GLY A 50 -5.697 -5.621 6.017 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.845 -3.977 7.646 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -3.178 -5.470 7.014 1.00 0.00 H new ATOM 1796 N ILE A 51 -2.663 -3.382 5.280 1.00 0.00 N ATOM 1797 CA ILE A 51 -2.419 -2.746 3.959 1.00 0.00 C ATOM 1798 C ILE A 51 -1.675 -3.743 3.068 1.00 0.00 C ATOM 1799 O ILE A 51 -0.737 -4.389 3.490 1.00 0.00 O ATOM 1800 CB ILE A 51 -1.567 -1.489 4.147 1.00 0.00 C ATOM 1801 CG1 ILE A 51 -2.203 -0.613 5.244 1.00 0.00 C ATOM 1802 CG2 ILE A 51 -1.499 -0.715 2.821 1.00 0.00 C ATOM 1803 CD1 ILE A 51 -1.694 0.825 5.135 1.00 0.00 C ATOM 0 H ILE A 51 -1.924 -3.246 5.970 1.00 0.00 H new ATOM 0 HA ILE A 51 -3.366 -2.468 3.496 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.555 -1.763 4.446 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.289 -0.630 5.149 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.963 -1.018 6.227 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -0.892 0.181 2.953 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.051 -1.346 2.054 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.505 -0.430 2.514 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.151 1.433 5.916 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.610 0.837 5.253 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -1.957 1.231 4.158 1.00 0.00 H new ATOM 1815 N GLN A 52 -2.080 -3.868 1.838 1.00 0.00 N ATOM 1816 CA GLN A 52 -1.384 -4.815 0.927 1.00 0.00 C ATOM 1817 C GLN A 52 -0.068 -4.175 0.476 1.00 0.00 C ATOM 1818 O GLN A 52 0.066 -2.970 0.467 1.00 0.00 O ATOM 1819 CB GLN A 52 -2.264 -5.118 -0.296 1.00 0.00 C ATOM 1820 CG GLN A 52 -3.547 -5.833 0.145 1.00 0.00 C ATOM 1821 CD GLN A 52 -4.569 -4.806 0.642 1.00 0.00 C ATOM 1822 OE1 GLN A 52 -4.854 -4.738 1.820 1.00 0.00 O ATOM 1823 NE2 GLN A 52 -5.134 -3.995 -0.212 1.00 0.00 N ATOM 0 H GLN A 52 -2.860 -3.357 1.424 1.00 0.00 H new ATOM 0 HA GLN A 52 -1.186 -5.751 1.449 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.514 -4.192 -0.813 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.716 -5.740 -1.003 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.963 -6.400 -0.688 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -3.322 -6.548 0.936 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.896 -4.050 -1.202 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.813 -3.306 0.111 1.00 0.00 H new ATOM 1832 N THR A 53 0.917 -4.965 0.127 1.00 0.00 N ATOM 1833 CA THR A 53 2.232 -4.386 -0.310 1.00 0.00 C ATOM 1834 C THR A 53 2.753 -5.135 -1.532 1.00 0.00 C ATOM 1835 O THR A 53 2.355 -6.244 -1.830 1.00 0.00 O ATOM 1836 CB THR A 53 3.258 -4.479 0.825 1.00 0.00 C ATOM 1837 OG1 THR A 53 4.563 -4.607 0.274 1.00 0.00 O ATOM 1838 CG2 THR A 53 2.945 -5.688 1.696 1.00 0.00 C ATOM 0 H THR A 53 0.871 -5.984 0.125 1.00 0.00 H new ATOM 0 HA THR A 53 2.081 -3.338 -0.567 1.00 0.00 H new ATOM 0 HB THR A 53 3.211 -3.576 1.434 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.220 -4.665 0.999 1.00 0.00 H new ATOM 0 HG21 THR A 53 3.675 -5.754 2.503 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.946 -5.583 2.118 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.990 -6.594 1.091 1.00 0.00 H new ATOM 1846 N ARG A 54 3.636 -4.501 -2.245 1.00 0.00 N ATOM 1847 CA ARG A 54 4.213 -5.106 -3.476 1.00 0.00 C ATOM 1848 C ARG A 54 5.616 -4.542 -3.709 1.00 0.00 C ATOM 1849 O ARG A 54 6.071 -3.673 -2.991 1.00 0.00 O ATOM 1850 CB ARG A 54 3.315 -4.753 -4.659 1.00 0.00 C ATOM 1851 CG ARG A 54 3.338 -3.236 -4.874 1.00 0.00 C ATOM 1852 CD ARG A 54 2.156 -2.829 -5.749 1.00 0.00 C ATOM 1853 NE ARG A 54 1.994 -3.815 -6.847 1.00 0.00 N ATOM 1854 CZ ARG A 54 0.887 -3.845 -7.526 1.00 0.00 C ATOM 1855 NH1 ARG A 54 -0.087 -3.038 -7.205 1.00 0.00 N ATOM 1856 NH2 ARG A 54 0.750 -4.666 -8.513 1.00 0.00 N ATOM 0 H ARG A 54 3.990 -3.570 -2.023 1.00 0.00 H new ATOM 0 HA ARG A 54 4.276 -6.189 -3.368 1.00 0.00 H new ATOM 0 HB2 ARG A 54 3.659 -5.265 -5.558 1.00 0.00 H new ATOM 0 HB3 ARG A 54 2.296 -5.090 -4.471 1.00 0.00 H new ATOM 0 HG2 ARG A 54 3.288 -2.721 -3.915 1.00 0.00 H new ATOM 0 HG3 ARG A 54 4.274 -2.939 -5.347 1.00 0.00 H new ATOM 0 HD2 ARG A 54 1.246 -2.781 -5.151 1.00 0.00 H new ATOM 0 HD3 ARG A 54 2.320 -1.833 -6.161 1.00 0.00 H new ATOM 0 HE ARG A 54 2.748 -4.466 -7.067 1.00 0.00 H new ATOM 0 HH11 ARG A 54 0.024 -2.389 -6.426 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -0.959 -3.056 -7.734 1.00 0.00 H new ATOM 0 HH21 ARG A 54 1.513 -5.295 -8.763 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -0.121 -4.686 -9.043 1.00 0.00 H new ATOM 1870 N ASN A 55 6.302 -5.017 -4.709 1.00 0.00 N ATOM 1871 CA ASN A 55 7.666 -4.485 -4.975 1.00 0.00 C ATOM 1872 C ASN A 55 7.559 -2.987 -5.276 1.00 0.00 C ATOM 1873 O ASN A 55 6.683 -2.536 -5.989 1.00 0.00 O ATOM 1874 CB ASN A 55 8.303 -5.220 -6.155 1.00 0.00 C ATOM 1875 CG ASN A 55 9.792 -4.888 -6.209 1.00 0.00 C ATOM 1876 OD1 ASN A 55 10.434 -4.764 -5.187 1.00 0.00 O ATOM 1877 ND2 ASN A 55 10.374 -4.736 -7.365 1.00 0.00 N ATOM 0 H ASN A 55 5.981 -5.744 -5.349 1.00 0.00 H new ATOM 0 HA ASN A 55 8.298 -4.640 -4.100 1.00 0.00 H new ATOM 0 HB2 ASN A 55 8.162 -6.295 -6.048 1.00 0.00 H new ATOM 0 HB3 ASN A 55 7.819 -4.926 -7.086 1.00 0.00 H new ATOM 0 HD21 ASN A 55 11.368 -4.513 -7.410 1.00 0.00 H new ATOM 0 HD22 ASN A 55 9.835 -4.840 -8.225 1.00 0.00 H new ATOM 1884 N ARG A 56 8.434 -2.216 -4.692 1.00 0.00 N ATOM 1885 CA ARG A 56 8.400 -0.736 -4.875 1.00 0.00 C ATOM 1886 C ARG A 56 8.803 -0.312 -6.286 1.00 0.00 C ATOM 1887 O ARG A 56 9.761 -0.805 -6.849 1.00 0.00 O ATOM 1888 CB ARG A 56 9.402 -0.087 -3.915 1.00 0.00 C ATOM 1889 CG ARG A 56 9.035 -0.404 -2.469 1.00 0.00 C ATOM 1890 CD ARG A 56 9.874 0.476 -1.538 1.00 0.00 C ATOM 1891 NE ARG A 56 9.581 0.122 -0.122 1.00 0.00 N ATOM 1892 CZ ARG A 56 10.378 0.515 0.832 1.00 0.00 C ATOM 1893 NH1 ARG A 56 11.412 1.262 0.558 1.00 0.00 N ATOM 1894 NH2 ARG A 56 10.135 0.166 2.066 1.00 0.00 N ATOM 0 H ARG A 56 9.182 -2.553 -4.087 1.00 0.00 H new ATOM 0 HA ARG A 56 7.375 -0.419 -4.685 1.00 0.00 H new ATOM 0 HB2 ARG A 56 10.408 -0.449 -4.129 1.00 0.00 H new ATOM 0 HB3 ARG A 56 9.413 0.992 -4.066 1.00 0.00 H new ATOM 0 HG2 ARG A 56 7.973 -0.224 -2.302 1.00 0.00 H new ATOM 0 HG3 ARG A 56 9.217 -1.458 -2.257 1.00 0.00 H new ATOM 0 HD2 ARG A 56 10.935 0.337 -1.747 1.00 0.00 H new ATOM 0 HD3 ARG A 56 9.650 1.528 -1.715 1.00 0.00 H new ATOM 0 HE ARG A 56 8.753 -0.430 0.103 1.00 0.00 H new ATOM 0 HH11 ARG A 56 11.599 1.540 -0.405 1.00 0.00 H new ATOM 0 HH12 ARG A 56 12.033 1.568 1.307 1.00 0.00 H new ATOM 0 HH21 ARG A 56 9.323 -0.413 2.282 1.00 0.00 H new ATOM 0 HH22 ARG A 56 10.757 0.472 2.814 1.00 0.00 H new ATOM 1908 N LYS A 57 8.094 0.646 -6.829 1.00 0.00 N ATOM 1909 CA LYS A 57 8.427 1.193 -8.178 1.00 0.00 C ATOM 1910 C LYS A 57 9.948 1.319 -8.307 1.00 0.00 C ATOM 1911 O LYS A 57 10.642 1.375 -7.311 1.00 0.00 O ATOM 1912 CB LYS A 57 7.794 2.580 -8.259 1.00 0.00 C ATOM 1913 CG LYS A 57 8.091 3.223 -9.611 1.00 0.00 C ATOM 1914 CD LYS A 57 7.448 4.606 -9.674 1.00 0.00 C ATOM 1915 CE LYS A 57 5.926 4.520 -9.474 1.00 0.00 C ATOM 1916 NZ LYS A 57 5.279 5.664 -10.167 1.00 0.00 N ATOM 0 H LYS A 57 7.284 1.079 -6.385 1.00 0.00 H new ATOM 0 HA LYS A 57 8.058 0.545 -8.973 1.00 0.00 H new ATOM 0 HB2 LYS A 57 6.716 2.504 -8.114 1.00 0.00 H new ATOM 0 HB3 LYS A 57 8.179 3.210 -7.457 1.00 0.00 H new ATOM 0 HG2 LYS A 57 9.168 3.305 -9.757 1.00 0.00 H new ATOM 0 HG3 LYS A 57 7.707 2.596 -10.415 1.00 0.00 H new ATOM 0 HD2 LYS A 57 7.883 5.247 -8.907 1.00 0.00 H new ATOM 0 HD3 LYS A 57 7.666 5.068 -10.637 1.00 0.00 H new ATOM 0 HE2 LYS A 57 5.547 3.578 -9.870 1.00 0.00 H new ATOM 0 HE3 LYS A 57 5.685 4.539 -8.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 4.342 5.837 -9.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.868 6.514 -10.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 5.174 5.443 -11.178 1.00 0.00 H new ATOM 1930 N VAL A 58 10.487 1.383 -9.503 1.00 0.00 N ATOM 1931 CA VAL A 58 11.971 1.529 -9.617 1.00 0.00 C ATOM 1932 C VAL A 58 12.375 2.701 -8.725 1.00 0.00 C ATOM 1933 O VAL A 58 11.749 3.743 -8.744 1.00 0.00 O ATOM 1934 CB VAL A 58 12.374 1.806 -11.071 1.00 0.00 C ATOM 1935 CG1 VAL A 58 11.559 2.974 -11.628 1.00 0.00 C ATOM 1936 CG2 VAL A 58 13.863 2.160 -11.124 1.00 0.00 C ATOM 0 H VAL A 58 9.976 1.341 -10.385 1.00 0.00 H new ATOM 0 HA VAL A 58 12.472 0.612 -9.307 1.00 0.00 H new ATOM 0 HB VAL A 58 12.181 0.916 -11.671 1.00 0.00 H new ATOM 0 HG11 VAL A 58 11.853 3.163 -12.661 1.00 0.00 H new ATOM 0 HG12 VAL A 58 10.498 2.727 -11.592 1.00 0.00 H new ATOM 0 HG13 VAL A 58 11.745 3.866 -11.029 1.00 0.00 H new ATOM 0 HG21 VAL A 58 14.154 2.358 -12.156 1.00 0.00 H new ATOM 0 HG22 VAL A 58 14.048 3.047 -10.519 1.00 0.00 H new ATOM 0 HG23 VAL A 58 14.449 1.327 -10.735 1.00 0.00 H new ATOM 1946 N SER A 59 13.363 2.534 -7.896 1.00 0.00 N ATOM 1947 CA SER A 59 13.719 3.634 -6.971 1.00 0.00 C ATOM 1948 C SER A 59 13.877 4.953 -7.722 1.00 0.00 C ATOM 1949 O SER A 59 14.627 5.067 -8.671 1.00 0.00 O ATOM 1950 CB SER A 59 15.026 3.297 -6.259 1.00 0.00 C ATOM 1951 OG SER A 59 16.016 2.966 -7.223 1.00 0.00 O ATOM 0 H SER A 59 13.933 1.692 -7.820 1.00 0.00 H new ATOM 0 HA SER A 59 12.915 3.745 -6.244 1.00 0.00 H new ATOM 0 HB2 SER A 59 15.356 4.145 -5.659 1.00 0.00 H new ATOM 0 HB3 SER A 59 14.875 2.462 -5.575 1.00 0.00 H new ATOM 0 HG SER A 59 15.817 3.424 -8.066 1.00 0.00 H new ATOM 1957 N SER A 60 13.194 5.957 -7.258 1.00 0.00 N ATOM 1958 CA SER A 60 13.296 7.306 -7.871 1.00 0.00 C ATOM 1959 C SER A 60 14.765 7.721 -7.936 1.00 0.00 C ATOM 1960 O SER A 60 15.312 7.954 -8.996 1.00 0.00 O ATOM 1961 CB SER A 60 12.539 8.279 -6.970 1.00 0.00 C ATOM 1962 OG SER A 60 12.947 9.608 -7.263 1.00 0.00 O ATOM 0 H SER A 60 12.557 5.898 -6.464 1.00 0.00 H new ATOM 0 HA SER A 60 12.880 7.305 -8.878 1.00 0.00 H new ATOM 0 HB2 SER A 60 11.465 8.174 -7.124 1.00 0.00 H new ATOM 0 HB3 SER A 60 12.735 8.049 -5.923 1.00 0.00 H new ATOM 0 HG SER A 60 12.170 10.204 -7.229 1.00 0.00 H new ATOM 1968 N LYS A 61 15.412 7.798 -6.805 1.00 0.00 N ATOM 1969 CA LYS A 61 16.853 8.182 -6.791 1.00 0.00 C ATOM 1970 C LYS A 61 17.510 7.682 -5.499 1.00 0.00 C ATOM 1971 O LYS A 61 17.065 7.969 -4.407 1.00 0.00 O ATOM 1972 CB LYS A 61 16.991 9.708 -6.883 1.00 0.00 C ATOM 1973 CG LYS A 61 16.111 10.385 -5.821 1.00 0.00 C ATOM 1974 CD LYS A 61 16.109 11.912 -6.035 1.00 0.00 C ATOM 1975 CE LYS A 61 14.988 12.310 -7.000 1.00 0.00 C ATOM 1976 NZ LYS A 61 13.681 12.204 -6.298 1.00 0.00 N ATOM 0 H LYS A 61 15.005 7.611 -5.889 1.00 0.00 H new ATOM 0 HA LYS A 61 17.349 7.727 -7.648 1.00 0.00 H new ATOM 0 HB2 LYS A 61 18.033 9.996 -6.740 1.00 0.00 H new ATOM 0 HB3 LYS A 61 16.700 10.048 -7.877 1.00 0.00 H new ATOM 0 HG2 LYS A 61 15.093 10.000 -5.880 1.00 0.00 H new ATOM 0 HG3 LYS A 61 16.483 10.149 -4.824 1.00 0.00 H new ATOM 0 HD2 LYS A 61 15.974 12.420 -5.080 1.00 0.00 H new ATOM 0 HD3 LYS A 61 17.072 12.232 -6.433 1.00 0.00 H new ATOM 0 HE2 LYS A 61 15.142 13.329 -7.356 1.00 0.00 H new ATOM 0 HE3 LYS A 61 14.998 11.661 -7.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 12.966 12.761 -6.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 13.385 11.208 -6.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 13.777 12.569 -5.329 1.00 0.00 H new ATOM 1990 N GLY A 62 18.572 6.936 -5.619 1.00 0.00 N ATOM 1991 CA GLY A 62 19.270 6.421 -4.407 1.00 0.00 C ATOM 1992 C GLY A 62 20.459 5.568 -4.843 1.00 0.00 C ATOM 1993 O GLY A 62 20.754 4.549 -4.252 1.00 0.00 O ATOM 0 H GLY A 62 18.989 6.659 -6.508 1.00 0.00 H new ATOM 0 HA2 GLY A 62 19.609 7.251 -3.787 1.00 0.00 H new ATOM 0 HA3 GLY A 62 18.584 5.829 -3.801 1.00 0.00 H new ATOM 1997 N LYS A 63 21.132 5.966 -5.888 1.00 0.00 N ATOM 1998 CA LYS A 63 22.289 5.167 -6.381 1.00 0.00 C ATOM 1999 C LYS A 63 23.357 5.065 -5.289 1.00 0.00 C ATOM 2000 O LYS A 63 23.965 4.030 -5.099 1.00 0.00 O ATOM 2001 CB LYS A 63 22.878 5.848 -7.621 1.00 0.00 C ATOM 2002 CG LYS A 63 21.884 5.725 -8.782 1.00 0.00 C ATOM 2003 CD LYS A 63 22.360 6.560 -9.983 1.00 0.00 C ATOM 2004 CE LYS A 63 23.438 5.800 -10.762 1.00 0.00 C ATOM 2005 NZ LYS A 63 22.908 4.471 -11.184 1.00 0.00 N ATOM 0 H LYS A 63 20.930 6.811 -6.422 1.00 0.00 H new ATOM 0 HA LYS A 63 21.953 4.163 -6.639 1.00 0.00 H new ATOM 0 HB2 LYS A 63 23.083 6.898 -7.411 1.00 0.00 H new ATOM 0 HB3 LYS A 63 23.828 5.385 -7.889 1.00 0.00 H new ATOM 0 HG2 LYS A 63 21.783 4.680 -9.074 1.00 0.00 H new ATOM 0 HG3 LYS A 63 20.898 6.063 -8.463 1.00 0.00 H new ATOM 0 HD2 LYS A 63 21.517 6.783 -10.637 1.00 0.00 H new ATOM 0 HD3 LYS A 63 22.756 7.515 -9.637 1.00 0.00 H new ATOM 0 HE2 LYS A 63 23.743 6.375 -11.636 1.00 0.00 H new ATOM 0 HE3 LYS A 63 24.325 5.669 -10.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 23.388 4.166 -12.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 23.080 3.774 -10.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 21.886 4.545 -11.360 1.00 0.00 H new ATOM 2019 N LYS A 64 23.593 6.128 -4.570 1.00 0.00 N ATOM 2020 CA LYS A 64 24.629 6.091 -3.494 1.00 0.00 C ATOM 2021 C LYS A 64 24.141 5.213 -2.336 1.00 0.00 C ATOM 2022 O LYS A 64 22.976 5.218 -1.992 1.00 0.00 O ATOM 2023 CB LYS A 64 24.879 7.512 -2.981 1.00 0.00 C ATOM 2024 CG LYS A 64 25.559 8.337 -4.076 1.00 0.00 C ATOM 2025 CD LYS A 64 25.810 9.757 -3.566 1.00 0.00 C ATOM 2026 CE LYS A 64 26.491 10.582 -4.660 1.00 0.00 C ATOM 2027 NZ LYS A 64 25.582 10.696 -5.837 1.00 0.00 N ATOM 0 H LYS A 64 23.114 7.022 -4.680 1.00 0.00 H new ATOM 0 HA LYS A 64 25.553 5.677 -3.897 1.00 0.00 H new ATOM 0 HB2 LYS A 64 23.936 7.977 -2.693 1.00 0.00 H new ATOM 0 HB3 LYS A 64 25.506 7.483 -2.090 1.00 0.00 H new ATOM 0 HG2 LYS A 64 26.501 7.871 -4.364 1.00 0.00 H new ATOM 0 HG3 LYS A 64 24.932 8.365 -4.967 1.00 0.00 H new ATOM 0 HD2 LYS A 64 24.867 10.223 -3.279 1.00 0.00 H new ATOM 0 HD3 LYS A 64 26.437 9.729 -2.675 1.00 0.00 H new ATOM 0 HE2 LYS A 64 26.739 11.574 -4.281 1.00 0.00 H new ATOM 0 HE3 LYS A 64 27.428 10.110 -4.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 25.873 11.505 -6.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 25.633 9.824 -6.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 24.606 10.839 -5.509 1.00 0.00 H new ATOM 2041 N ARG A 65 25.021 4.463 -1.725 1.00 0.00 N ATOM 2042 CA ARG A 65 24.595 3.599 -0.585 1.00 0.00 C ATOM 2043 C ARG A 65 24.459 4.465 0.665 1.00 0.00 C ATOM 2044 O ARG A 65 25.287 5.314 0.932 1.00 0.00 O ATOM 2045 CB ARG A 65 25.640 2.504 -0.329 1.00 0.00 C ATOM 2046 CG ARG A 65 25.738 1.559 -1.538 1.00 0.00 C ATOM 2047 CD ARG A 65 24.501 0.651 -1.615 1.00 0.00 C ATOM 2048 NE ARG A 65 24.808 -0.551 -2.463 1.00 0.00 N ATOM 2049 CZ ARG A 65 25.290 -0.429 -3.673 1.00 0.00 C ATOM 2050 NH1 ARG A 65 25.313 0.731 -4.262 1.00 0.00 N ATOM 2051 NH2 ARG A 65 25.691 -1.488 -4.319 1.00 0.00 N ATOM 0 H ARG A 65 26.011 4.412 -1.965 1.00 0.00 H new ATOM 0 HA ARG A 65 23.642 3.129 -0.826 1.00 0.00 H new ATOM 0 HB2 ARG A 65 26.612 2.959 -0.136 1.00 0.00 H new ATOM 0 HB3 ARG A 65 25.370 1.937 0.562 1.00 0.00 H new ATOM 0 HG2 ARG A 65 25.826 2.141 -2.455 1.00 0.00 H new ATOM 0 HG3 ARG A 65 26.639 0.950 -1.459 1.00 0.00 H new ATOM 0 HD2 ARG A 65 24.206 0.336 -0.614 1.00 0.00 H new ATOM 0 HD3 ARG A 65 23.660 1.201 -2.037 1.00 0.00 H new ATOM 0 HE ARG A 65 24.637 -1.483 -2.087 1.00 0.00 H new ATOM 0 HH11 ARG A 65 24.953 1.555 -3.780 1.00 0.00 H new ATOM 0 HH12 ARG A 65 25.691 0.816 -5.206 1.00 0.00 H new ATOM 0 HH21 ARG A 65 25.628 -2.407 -3.881 1.00 0.00 H new ATOM 0 HH22 ARG A 65 26.067 -1.398 -5.263 1.00 0.00 H new ATOM 2065 N ARG A 66 23.416 4.263 1.431 1.00 0.00 N ATOM 2066 CA ARG A 66 23.208 5.077 2.669 1.00 0.00 C ATOM 2067 C ARG A 66 23.540 4.232 3.899 1.00 0.00 C ATOM 2068 O ARG A 66 22.679 3.481 4.329 1.00 0.00 O ATOM 2069 CB ARG A 66 21.745 5.518 2.735 1.00 0.00 C ATOM 2070 CG ARG A 66 21.540 6.438 3.940 1.00 0.00 C ATOM 2071 CD ARG A 66 20.111 6.985 3.924 1.00 0.00 C ATOM 2072 NE ARG A 66 19.149 5.871 4.167 1.00 0.00 N ATOM 2073 CZ ARG A 66 17.910 6.137 4.480 1.00 0.00 C ATOM 2074 NH1 ARG A 66 17.513 7.376 4.571 1.00 0.00 N ATOM 2075 NH2 ARG A 66 17.069 5.163 4.703 1.00 0.00 N ATOM 2076 OXT ARG A 66 24.650 4.349 4.392 1.00 0.00 O ATOM 0 H ARG A 66 22.695 3.565 1.251 1.00 0.00 H new ATOM 0 HA ARG A 66 23.858 5.952 2.647 1.00 0.00 H new ATOM 0 HB2 ARG A 66 21.470 6.037 1.817 1.00 0.00 H new ATOM 0 HB3 ARG A 66 21.095 4.647 2.815 1.00 0.00 H new ATOM 0 HG2 ARG A 66 21.721 5.890 4.865 1.00 0.00 H new ATOM 0 HG3 ARG A 66 22.256 7.259 3.910 1.00 0.00 H new ATOM 0 HD2 ARG A 66 19.996 7.753 4.689 1.00 0.00 H new ATOM 0 HD3 ARG A 66 19.902 7.457 2.964 1.00 0.00 H new ATOM 0 HE ARG A 66 19.459 4.902 4.089 1.00 0.00 H new ATOM 0 HH11 ARG A 66 18.171 8.136 4.398 1.00 0.00 H new ATOM 0 HH12 ARG A 66 16.545 7.585 4.816 1.00 0.00 H new ATOM 0 HH21 ARG A 66 17.380 4.194 4.633 1.00 0.00 H new ATOM 0 HH22 ARG A 66 16.101 5.371 4.948 1.00 0.00 H new TER 2090 ARG A 66 HETATM 2091 ZN ZN A 67 -11.923 2.882 2.279 1.00 0.00 ZN