USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 913 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 16 THR OG1 : rot -150:sc= -0.105 USER MOD Set 1.2: C 125 DT C7 :methyl 150:sc= -1.46 (180deg=-1.39) USER MOD Set 2.1: A 12 THR OG1 : rot 180:sc= -0.0263 USER MOD Set 2.2: A 14 THR OG1 : rot -169:sc= 0.926 USER MOD Single : A 1 LYS N :NH3+ -153:sc= -0.0404 (180deg=-0.797) USER MOD Single : A 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 179:sc= 0.212! USER MOD Single : A 8 SER OG : rot 73:sc= -0.366 USER MOD Single : A 9 ASN : amide:sc= -0.0133 X(o=-0.013,f=-0.091) USER MOD Single : A 11 GLN : amide:sc= -5.81! K(o=-5.8!,f=-2.4) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -138:sc= 1.06 USER MOD Single : A 21 SER OG : rot 180:sc= -0.177 USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -4.1! C(o=-4.1!,f=-12!) USER MOD Single : A 34 TYR OH : rot 180:sc= -0.151 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0616) USER MOD Single : A 38 HIS : no HD1:sc= -1.13 K(o=-1.1,f=-2.4!) USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 41 ASN : amide:sc= -1.63! C(o=-1.6!,f=-7.3!) USER MOD Single : A 45 THR OG1 : rot 180:sc=0.000715 USER MOD Single : A 46 MET CE :methyl -152:sc= -2.31 (180deg=-4.6!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -1.82! C(o=-1.8!,f=-2.8!) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.242 USER MOD Single : A 55 ASN : amide:sc= -1.45 K(o=-1.4,f=-9.3!) USER MOD Single : A 57 LYS NZ :NH3+ 166:sc= 1.16 (180deg=1) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 151:sc= -0.116 (180deg=-0.917) USER MOD Single : A 63 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0102) USER MOD Single : A 64 LYS NZ :NH3+ -149:sc= -0.347 (180deg=-1.45!) USER MOD Single : B 101 DG O5' : rot 180:sc= -0.0372 USER MOD Single : B 102 DT C7 :methyl -30:sc= -0.359 (180deg=-1.08) USER MOD Single : B 103 DT C7 :methyl -30:sc= -1.01 (180deg=-1.2) USER MOD Single : B 109 DT C7 :methyl -30:sc= -1.33 (180deg=-1.94!) USER MOD Single : B 115 DT C7 :methyl -30:sc= -0.979 (180deg=-1.39) USER MOD Single : B 116 DT C7 :methyl 150:sc= -0.588 (180deg=-0.588) USER MOD Single : B 116 DT O3' : rot 180:sc= 0 USER MOD Single : C 117 DA O5' : rot 86:sc= -2.04! USER MOD Single : C 119 DT C7 :methyl 150:sc= -0.435 (180deg=-0.435) USER MOD Single : C 121 DT C7 :methyl 150:sc= -1.84! (180deg=-1.84!) USER MOD Single : C 122 DT C7 :methyl -30:sc= -0.0649 (180deg=-1.53!) USER MOD Single : C 123 DT C7 :methyl -30:sc= -0.0201 (180deg=-1.7) USER MOD Single : C 127 DT C7 :methyl 150:sc= -1.31 (180deg=-1.31) USER MOD Single : C 132 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG B 101 19.592 20.414 10.000 1.00 0.00 O ATOM 2 C5' DG B 101 19.955 19.770 11.226 1.00 0.00 C ATOM 3 C4' DG B 101 18.796 18.945 11.793 1.00 0.00 C ATOM 4 O4' DG B 101 17.751 19.827 12.271 1.00 0.00 O ATOM 5 C3' DG B 101 18.180 18.013 10.739 1.00 0.00 C ATOM 6 O3' DG B 101 18.060 16.682 11.249 1.00 0.00 O ATOM 7 C2' DG B 101 16.814 18.579 10.448 1.00 0.00 C ATOM 8 C1' DG B 101 16.538 19.633 11.512 1.00 0.00 C ATOM 9 N9 DG B 101 16.086 20.900 10.902 1.00 0.00 N ATOM 10 C8 DG B 101 16.629 21.605 9.864 1.00 0.00 C ATOM 11 N7 DG B 101 15.985 22.683 9.532 1.00 0.00 N ATOM 12 C5 DG B 101 14.918 22.704 10.426 1.00 0.00 C ATOM 13 C6 DG B 101 13.860 23.642 10.558 1.00 0.00 C ATOM 14 O6 DG B 101 13.656 24.660 9.900 1.00 0.00 O ATOM 15 N1 DG B 101 12.996 23.291 11.586 1.00 0.00 N ATOM 16 C2 DG B 101 13.127 22.178 12.389 1.00 0.00 C ATOM 17 N2 DG B 101 12.181 21.999 13.309 1.00 0.00 N ATOM 18 N3 DG B 101 14.120 21.293 12.267 1.00 0.00 N ATOM 19 C4 DG B 101 14.974 21.617 11.270 1.00 0.00 C ATOM 0 H5' DG B 101 20.260 20.520 11.956 1.00 0.00 H new ATOM 0 H5'' DG B 101 20.815 19.122 11.057 1.00 0.00 H new ATOM 0 H4' DG B 101 19.204 18.342 12.604 1.00 0.00 H new ATOM 0 H3' DG B 101 18.800 17.958 9.844 1.00 0.00 H new ATOM 0 H2' DG B 101 16.782 19.019 9.451 1.00 0.00 H new ATOM 0 H2'' DG B 101 16.057 17.795 10.475 1.00 0.00 H new ATOM 0 HO5' DG B 101 20.353 20.933 9.666 1.00 0.00 H new ATOM 0 H1' DG B 101 15.736 19.297 12.169 1.00 0.00 H new ATOM 0 H8 DG B 101 17.528 21.288 9.357 1.00 0.00 H new ATOM 0 H1 DG B 101 12.201 23.905 11.761 1.00 0.00 H new ATOM 0 H21 DG B 101 12.223 21.194 13.933 1.00 0.00 H new ATOM 0 H22 DG B 101 11.415 22.667 13.389 1.00 0.00 H new ATOM 32 P DT B 102 17.422 15.503 10.351 1.00 0.00 P ATOM 33 OP1 DT B 102 18.091 14.232 10.706 1.00 0.00 O ATOM 34 OP2 DT B 102 17.403 15.956 8.942 1.00 0.00 O ATOM 35 O5' DT B 102 15.893 15.435 10.875 1.00 0.00 O ATOM 36 C5' DT B 102 15.622 15.142 12.249 1.00 0.00 C ATOM 37 C4' DT B 102 14.118 15.116 12.575 1.00 0.00 C ATOM 38 O4' DT B 102 13.547 16.451 12.514 1.00 0.00 O ATOM 39 C3' DT B 102 13.323 14.229 11.606 1.00 0.00 C ATOM 40 O3' DT B 102 12.670 13.181 12.330 1.00 0.00 O ATOM 41 C2' DT B 102 12.293 15.130 10.967 1.00 0.00 C ATOM 42 C1' DT B 102 12.324 16.442 11.737 1.00 0.00 C ATOM 43 N1 DT B 102 12.251 17.621 10.828 1.00 0.00 N ATOM 44 C2 DT B 102 11.189 18.508 10.976 1.00 0.00 C ATOM 45 O2 DT B 102 10.326 18.355 11.837 1.00 0.00 O ATOM 46 N3 DT B 102 11.164 19.579 10.103 1.00 0.00 N ATOM 47 C4 DT B 102 12.088 19.841 9.109 1.00 0.00 C ATOM 48 O4 DT B 102 11.964 20.824 8.381 1.00 0.00 O ATOM 49 C5 DT B 102 13.155 18.870 9.028 1.00 0.00 C ATOM 50 C7 DT B 102 14.240 19.045 7.964 1.00 0.00 C ATOM 51 C6 DT B 102 13.201 17.816 9.874 1.00 0.00 C ATOM 0 H5' DT B 102 16.111 15.887 12.877 1.00 0.00 H new ATOM 0 H5'' DT B 102 16.059 14.176 12.502 1.00 0.00 H new ATOM 0 H4' DT B 102 14.042 14.708 13.583 1.00 0.00 H new ATOM 0 H3' DT B 102 13.971 13.767 10.861 1.00 0.00 H new ATOM 0 H2' DT B 102 12.522 15.294 9.914 1.00 0.00 H new ATOM 0 H2'' DT B 102 11.302 14.678 11.012 1.00 0.00 H new ATOM 0 H1' DT B 102 11.453 16.515 12.389 1.00 0.00 H new ATOM 0 H3 DT B 102 10.391 20.238 10.201 1.00 0.00 H new ATOM 0 H71 DT B 102 13.819 19.549 7.094 1.00 0.00 H new ATOM 0 H72 DT B 102 15.055 19.644 8.371 1.00 0.00 H new ATOM 0 H73 DT B 102 14.620 18.067 7.668 1.00 0.00 H new ATOM 0 H6 DT B 102 14.014 17.110 9.790 1.00 0.00 H new ATOM 64 P DT B 103 11.758 12.089 11.575 1.00 0.00 P ATOM 65 OP1 DT B 103 11.712 10.866 12.406 1.00 0.00 O ATOM 66 OP2 DT B 103 12.199 12.009 10.165 1.00 0.00 O ATOM 67 O5' DT B 103 10.301 12.781 11.612 1.00 0.00 O ATOM 68 C5' DT B 103 9.681 13.055 12.871 1.00 0.00 C ATOM 69 C4' DT B 103 8.306 13.717 12.724 1.00 0.00 C ATOM 70 O4' DT B 103 8.448 15.077 12.255 1.00 0.00 O ATOM 71 C3' DT B 103 7.395 12.967 11.742 1.00 0.00 C ATOM 72 O3' DT B 103 6.260 12.446 12.431 1.00 0.00 O ATOM 73 C2' DT B 103 6.944 14.003 10.733 1.00 0.00 C ATOM 74 C1' DT B 103 7.496 15.348 11.207 1.00 0.00 C ATOM 75 N1 DT B 103 8.139 16.092 10.091 1.00 0.00 N ATOM 76 C2 DT B 103 7.646 17.345 9.755 1.00 0.00 C ATOM 77 O2 DT B 103 6.710 17.861 10.361 1.00 0.00 O ATOM 78 N3 DT B 103 8.275 17.983 8.703 1.00 0.00 N ATOM 79 C4 DT B 103 9.336 17.487 7.966 1.00 0.00 C ATOM 80 O4 DT B 103 9.818 18.138 7.043 1.00 0.00 O ATOM 81 C5 DT B 103 9.781 16.179 8.385 1.00 0.00 C ATOM 82 C7 DT B 103 10.939 15.513 7.634 1.00 0.00 C ATOM 83 C6 DT B 103 9.182 15.540 9.413 1.00 0.00 C ATOM 0 H5' DT B 103 10.331 13.704 13.457 1.00 0.00 H new ATOM 0 H5'' DT B 103 9.574 12.124 13.428 1.00 0.00 H new ATOM 0 H4' DT B 103 7.848 13.694 13.713 1.00 0.00 H new ATOM 0 H3' DT B 103 7.912 12.132 11.270 1.00 0.00 H new ATOM 0 H2' DT B 103 7.316 13.761 9.737 1.00 0.00 H new ATOM 0 H2'' DT B 103 5.856 14.032 10.668 1.00 0.00 H new ATOM 0 H1' DT B 103 6.686 15.976 11.576 1.00 0.00 H new ATOM 0 H3 DT B 103 7.925 18.906 8.446 1.00 0.00 H new ATOM 0 H71 DT B 103 10.938 15.845 6.596 1.00 0.00 H new ATOM 0 H72 DT B 103 11.883 15.790 8.102 1.00 0.00 H new ATOM 0 H73 DT B 103 10.820 14.430 7.669 1.00 0.00 H new ATOM 0 H6 DT B 103 9.541 14.564 9.705 1.00 0.00 H new ATOM 96 P DG B 104 5.250 11.417 11.721 1.00 0.00 P ATOM 97 OP1 DG B 104 4.579 10.628 12.777 1.00 0.00 O ATOM 98 OP2 DG B 104 5.985 10.722 10.640 1.00 0.00 O ATOM 99 O5' DG B 104 4.150 12.381 11.042 1.00 0.00 O ATOM 100 C5' DG B 104 3.374 13.264 11.851 1.00 0.00 C ATOM 101 C4' DG B 104 2.386 14.095 11.022 1.00 0.00 C ATOM 102 O4' DG B 104 3.090 15.070 10.213 1.00 0.00 O ATOM 103 C3' DG B 104 1.567 13.205 10.079 1.00 0.00 C ATOM 104 O3' DG B 104 0.169 13.449 10.258 1.00 0.00 O ATOM 105 C2' DG B 104 1.973 13.604 8.686 1.00 0.00 C ATOM 106 C1' DG B 104 2.811 14.864 8.809 1.00 0.00 C ATOM 107 N9 DG B 104 4.064 14.755 8.035 1.00 0.00 N ATOM 108 C8 DG B 104 5.014 13.776 8.063 1.00 0.00 C ATOM 109 N7 DG B 104 6.045 13.981 7.297 1.00 0.00 N ATOM 110 C5 DG B 104 5.757 15.207 6.698 1.00 0.00 C ATOM 111 C6 DG B 104 6.511 15.960 5.754 1.00 0.00 C ATOM 112 O6 DG B 104 7.607 15.696 5.262 1.00 0.00 O ATOM 113 N1 DG B 104 5.858 17.136 5.406 1.00 0.00 N ATOM 114 C2 DG B 104 4.636 17.540 5.898 1.00 0.00 C ATOM 115 N2 DG B 104 4.164 18.696 5.429 1.00 0.00 N ATOM 116 N3 DG B 104 3.926 16.837 6.787 1.00 0.00 N ATOM 117 C4 DG B 104 4.544 15.685 7.140 1.00 0.00 C ATOM 0 H5' DG B 104 4.040 13.933 12.397 1.00 0.00 H new ATOM 0 H5'' DG B 104 2.825 12.685 12.594 1.00 0.00 H new ATOM 0 H4' DG B 104 1.722 14.596 11.727 1.00 0.00 H new ATOM 0 H3' DG B 104 1.748 12.148 10.272 1.00 0.00 H new ATOM 0 H2' DG B 104 2.543 12.807 8.208 1.00 0.00 H new ATOM 0 H2'' DG B 104 1.095 13.784 8.066 1.00 0.00 H new ATOM 0 H1' DG B 104 2.264 15.714 8.401 1.00 0.00 H new ATOM 0 H8 DG B 104 4.917 12.893 8.678 1.00 0.00 H new ATOM 0 H1 DG B 104 6.320 17.748 4.733 1.00 0.00 H new ATOM 0 H21 DG B 104 3.264 19.049 5.755 1.00 0.00 H new ATOM 0 H22 DG B 104 4.703 19.227 4.745 1.00 0.00 H new ATOM 129 P DC B 105 -0.930 12.639 9.404 1.00 0.00 P ATOM 130 OP1 DC B 105 -2.192 12.629 10.175 1.00 0.00 O ATOM 131 OP2 DC B 105 -0.325 11.360 8.976 1.00 0.00 O ATOM 132 O5' DC B 105 -1.165 13.536 8.086 1.00 0.00 O ATOM 133 C5' DC B 105 -1.638 14.882 8.186 1.00 0.00 C ATOM 134 C4' DC B 105 -1.794 15.523 6.801 1.00 0.00 C ATOM 135 O4' DC B 105 -0.510 15.780 6.182 1.00 0.00 O ATOM 136 C3' DC B 105 -2.595 14.606 5.867 1.00 0.00 C ATOM 137 O3' DC B 105 -3.768 15.272 5.390 1.00 0.00 O ATOM 138 C2' DC B 105 -1.666 14.289 4.720 1.00 0.00 C ATOM 139 C1' DC B 105 -0.483 15.238 4.840 1.00 0.00 C ATOM 140 N1 DC B 105 0.815 14.558 4.573 1.00 0.00 N ATOM 141 C2 DC B 105 1.617 15.032 3.536 1.00 0.00 C ATOM 142 O2 DC B 105 1.226 15.959 2.828 1.00 0.00 O ATOM 143 N3 DC B 105 2.830 14.448 3.335 1.00 0.00 N ATOM 144 C4 DC B 105 3.245 13.441 4.115 1.00 0.00 C ATOM 145 N4 DC B 105 4.439 12.891 3.895 1.00 0.00 N ATOM 146 C5 DC B 105 2.425 12.949 5.178 1.00 0.00 C ATOM 147 C6 DC B 105 1.225 13.534 5.363 1.00 0.00 C ATOM 0 H5' DC B 105 -0.943 15.470 8.785 1.00 0.00 H new ATOM 0 H5'' DC B 105 -2.596 14.895 8.705 1.00 0.00 H new ATOM 0 H4' DC B 105 -2.319 16.466 6.951 1.00 0.00 H new ATOM 0 H3' DC B 105 -2.931 13.704 6.379 1.00 0.00 H new ATOM 0 H2' DC B 105 -1.336 13.251 4.765 1.00 0.00 H new ATOM 0 H2'' DC B 105 -2.173 14.421 3.764 1.00 0.00 H new ATOM 0 H1' DC B 105 -0.567 16.027 4.092 1.00 0.00 H new ATOM 0 H41 DC B 105 4.763 12.124 4.484 1.00 0.00 H new ATOM 0 H42 DC B 105 5.028 13.237 3.138 1.00 0.00 H new ATOM 0 H5 DC B 105 2.755 12.138 5.810 1.00 0.00 H new ATOM 0 H6 DC B 105 0.579 13.182 6.153 1.00 0.00 H new ATOM 159 P DA B 106 -4.787 14.514 4.399 1.00 0.00 P ATOM 160 OP1 DA B 106 -6.148 15.036 4.657 1.00 0.00 O ATOM 161 OP2 DA B 106 -4.529 13.061 4.498 1.00 0.00 O ATOM 162 O5' DA B 106 -4.338 15.002 2.926 1.00 0.00 O ATOM 163 C5' DA B 106 -4.368 16.391 2.580 1.00 0.00 C ATOM 164 C4' DA B 106 -3.904 16.640 1.135 1.00 0.00 C ATOM 165 O4' DA B 106 -2.478 16.430 0.977 1.00 0.00 O ATOM 166 C3' DA B 106 -4.633 15.719 0.149 1.00 0.00 C ATOM 167 O3' DA B 106 -5.294 16.489 -0.845 1.00 0.00 O ATOM 168 C2' DA B 106 -3.550 14.878 -0.497 1.00 0.00 C ATOM 169 C1' DA B 106 -2.216 15.498 -0.106 1.00 0.00 C ATOM 170 N9 DA B 106 -1.267 14.471 0.327 1.00 0.00 N ATOM 171 C8 DA B 106 -1.419 13.612 1.345 1.00 0.00 C ATOM 172 N7 DA B 106 -0.402 12.848 1.593 1.00 0.00 N ATOM 173 C5 DA B 106 0.519 13.235 0.623 1.00 0.00 C ATOM 174 C6 DA B 106 1.814 12.800 0.325 1.00 0.00 C ATOM 175 N6 DA B 106 2.448 11.862 1.027 1.00 0.00 N ATOM 176 N1 DA B 106 2.439 13.379 -0.708 1.00 0.00 N ATOM 177 C2 DA B 106 1.831 14.333 -1.409 1.00 0.00 C ATOM 178 N3 DA B 106 0.607 14.829 -1.209 1.00 0.00 N ATOM 179 C4 DA B 106 0.002 14.224 -0.164 1.00 0.00 C ATOM 0 H5' DA B 106 -3.730 16.948 3.266 1.00 0.00 H new ATOM 0 H5'' DA B 106 -5.381 16.773 2.705 1.00 0.00 H new ATOM 0 H4' DA B 106 -4.141 17.682 0.920 1.00 0.00 H new ATOM 0 H3' DA B 106 -5.385 15.109 0.650 1.00 0.00 H new ATOM 0 H2' DA B 106 -3.610 13.844 -0.157 1.00 0.00 H new ATOM 0 H2'' DA B 106 -3.667 14.864 -1.581 1.00 0.00 H new ATOM 0 H1' DA B 106 -1.771 16.007 -0.961 1.00 0.00 H new ATOM 0 H8 DA B 106 -2.331 13.560 1.922 1.00 0.00 H new ATOM 0 H61 DA B 106 3.393 11.581 0.766 1.00 0.00 H new ATOM 0 H62 DA B 106 1.988 11.424 1.825 1.00 0.00 H new ATOM 0 H2 DA B 106 2.390 14.753 -2.232 1.00 0.00 H new ATOM 191 P DG B 107 -6.139 15.773 -2.009 1.00 0.00 P ATOM 192 OP1 DG B 107 -7.109 16.746 -2.556 1.00 0.00 O ATOM 193 OP2 DG B 107 -6.601 14.457 -1.510 1.00 0.00 O ATOM 194 O5' DG B 107 -4.987 15.528 -3.101 1.00 0.00 O ATOM 195 C5' DG B 107 -4.277 16.639 -3.639 1.00 0.00 C ATOM 196 C4' DG B 107 -3.202 16.203 -4.634 1.00 0.00 C ATOM 197 O4' DG B 107 -2.107 15.526 -3.955 1.00 0.00 O ATOM 198 C3' DG B 107 -3.751 15.238 -5.689 1.00 0.00 C ATOM 199 O3' DG B 107 -3.554 15.800 -6.994 1.00 0.00 O ATOM 200 C2' DG B 107 -2.957 13.966 -5.531 1.00 0.00 C ATOM 201 C1' DG B 107 -1.760 14.321 -4.674 1.00 0.00 C ATOM 202 N9 DG B 107 -1.379 13.207 -3.767 1.00 0.00 N ATOM 203 C8 DG B 107 -2.104 12.573 -2.784 1.00 0.00 C ATOM 204 N7 DG B 107 -1.487 11.620 -2.179 1.00 0.00 N ATOM 205 C5 DG B 107 -0.244 11.603 -2.783 1.00 0.00 C ATOM 206 C6 DG B 107 0.857 10.765 -2.520 1.00 0.00 C ATOM 207 O6 DG B 107 0.927 9.862 -1.701 1.00 0.00 O ATOM 208 N1 DG B 107 1.935 11.063 -3.342 1.00 0.00 N ATOM 209 C2 DG B 107 1.948 12.043 -4.306 1.00 0.00 C ATOM 210 N2 DG B 107 3.084 12.168 -4.998 1.00 0.00 N ATOM 211 N3 DG B 107 0.901 12.843 -4.560 1.00 0.00 N ATOM 212 C4 DG B 107 -0.159 12.565 -3.758 1.00 0.00 C ATOM 0 H5' DG B 107 -3.814 17.201 -2.828 1.00 0.00 H new ATOM 0 H5'' DG B 107 -4.977 17.312 -4.134 1.00 0.00 H new ATOM 0 H4' DG B 107 -2.853 17.116 -5.117 1.00 0.00 H new ATOM 0 H3' DG B 107 -4.818 15.052 -5.568 1.00 0.00 H new ATOM 0 H2' DG B 107 -3.557 13.188 -5.059 1.00 0.00 H new ATOM 0 H2'' DG B 107 -2.641 13.581 -6.501 1.00 0.00 H new ATOM 0 H1' DG B 107 -0.878 14.492 -5.291 1.00 0.00 H new ATOM 0 H8 DG B 107 -3.117 12.855 -2.538 1.00 0.00 H new ATOM 0 H1 DG B 107 2.784 10.511 -3.221 1.00 0.00 H new ATOM 0 H21 DG B 107 3.161 12.876 -5.728 1.00 0.00 H new ATOM 0 H22 DG B 107 3.874 11.556 -4.796 1.00 0.00 H new ATOM 224 P DA B 108 -4.025 15.028 -8.325 1.00 0.00 P ATOM 225 OP1 DA B 108 -4.444 16.040 -9.319 1.00 0.00 O ATOM 226 OP2 DA B 108 -4.958 13.950 -7.930 1.00 0.00 O ATOM 227 O5' DA B 108 -2.653 14.350 -8.843 1.00 0.00 O ATOM 228 C5' DA B 108 -1.527 15.173 -9.177 1.00 0.00 C ATOM 229 C4' DA B 108 -0.316 14.352 -9.650 1.00 0.00 C ATOM 230 O4' DA B 108 0.279 13.625 -8.548 1.00 0.00 O ATOM 231 C3' DA B 108 -0.692 13.341 -10.742 1.00 0.00 C ATOM 232 O3' DA B 108 0.053 13.588 -11.940 1.00 0.00 O ATOM 233 C2' DA B 108 -0.332 11.988 -10.182 1.00 0.00 C ATOM 234 C1' DA B 108 0.432 12.230 -8.890 1.00 0.00 C ATOM 235 N9 DA B 108 -0.069 11.358 -7.812 1.00 0.00 N ATOM 236 C8 DA B 108 -1.343 11.223 -7.336 1.00 0.00 C ATOM 237 N7 DA B 108 -1.501 10.313 -6.432 1.00 0.00 N ATOM 238 C5 DA B 108 -0.219 9.797 -6.281 1.00 0.00 C ATOM 239 C6 DA B 108 0.291 8.796 -5.466 1.00 0.00 C ATOM 240 N6 DA B 108 -0.479 8.079 -4.662 1.00 0.00 N ATOM 241 N1 DA B 108 1.605 8.528 -5.546 1.00 0.00 N ATOM 242 C2 DA B 108 2.378 9.211 -6.391 1.00 0.00 C ATOM 243 N3 DA B 108 1.992 10.183 -7.221 1.00 0.00 N ATOM 244 C4 DA B 108 0.664 10.426 -7.109 1.00 0.00 C ATOM 0 H5' DA B 108 -1.243 15.765 -8.307 1.00 0.00 H new ATOM 0 H5'' DA B 108 -1.814 15.875 -9.960 1.00 0.00 H new ATOM 0 H4' DA B 108 0.396 15.069 -10.059 1.00 0.00 H new ATOM 0 H3' DA B 108 -1.748 13.411 -11.001 1.00 0.00 H new ATOM 0 H2' DA B 108 -1.229 11.397 -9.995 1.00 0.00 H new ATOM 0 H2'' DA B 108 0.277 11.427 -10.891 1.00 0.00 H new ATOM 0 H1' DA B 108 1.487 11.991 -9.022 1.00 0.00 H new ATOM 0 H8 DA B 108 -2.160 11.834 -7.690 1.00 0.00 H new ATOM 0 H61 DA B 108 -0.068 7.351 -4.077 1.00 0.00 H new ATOM 0 H62 DA B 108 -1.483 8.254 -4.627 1.00 0.00 H new ATOM 0 H2 DA B 108 3.426 8.951 -6.406 1.00 0.00 H new ATOM 256 P DT B 109 -0.151 12.663 -13.250 1.00 0.00 P ATOM 257 OP1 DT B 109 0.244 13.452 -14.437 1.00 0.00 O ATOM 258 OP2 DT B 109 -1.502 12.060 -13.182 1.00 0.00 O ATOM 259 O5' DT B 109 0.935 11.484 -13.047 1.00 0.00 O ATOM 260 C5' DT B 109 2.325 11.804 -12.956 1.00 0.00 C ATOM 261 C4' DT B 109 3.212 10.568 -12.765 1.00 0.00 C ATOM 262 O4' DT B 109 3.026 10.017 -11.437 1.00 0.00 O ATOM 263 C3' DT B 109 2.909 9.460 -13.785 1.00 0.00 C ATOM 264 O3' DT B 109 4.077 9.179 -14.559 1.00 0.00 O ATOM 265 C2' DT B 109 2.554 8.239 -12.963 1.00 0.00 C ATOM 266 C1' DT B 109 2.854 8.587 -11.510 1.00 0.00 C ATOM 267 N1 DT B 109 1.770 8.128 -10.597 1.00 0.00 N ATOM 268 C2 DT B 109 2.091 7.223 -9.592 1.00 0.00 C ATOM 269 O2 DT B 109 3.228 6.780 -9.454 1.00 0.00 O ATOM 270 N3 DT B 109 1.057 6.846 -8.759 1.00 0.00 N ATOM 271 C4 DT B 109 -0.252 7.283 -8.838 1.00 0.00 C ATOM 272 O4 DT B 109 -1.095 6.881 -8.042 1.00 0.00 O ATOM 273 C5 DT B 109 -0.500 8.216 -9.909 1.00 0.00 C ATOM 274 C7 DT B 109 -1.922 8.754 -10.102 1.00 0.00 C ATOM 275 C6 DT B 109 0.500 8.604 -10.736 1.00 0.00 C ATOM 0 H5' DT B 109 2.481 12.489 -12.122 1.00 0.00 H new ATOM 0 H5'' DT B 109 2.632 12.328 -13.861 1.00 0.00 H new ATOM 0 H4' DT B 109 4.239 10.903 -12.910 1.00 0.00 H new ATOM 0 H3' DT B 109 2.109 9.749 -14.467 1.00 0.00 H new ATOM 0 H2' DT B 109 1.503 7.979 -13.090 1.00 0.00 H new ATOM 0 H2'' DT B 109 3.137 7.375 -13.282 1.00 0.00 H new ATOM 0 H1' DT B 109 3.759 8.075 -11.184 1.00 0.00 H new ATOM 0 H3 DT B 109 1.279 6.183 -8.016 1.00 0.00 H new ATOM 0 H71 DT B 109 -2.642 8.005 -9.772 1.00 0.00 H new ATOM 0 H72 DT B 109 -2.050 9.664 -9.515 1.00 0.00 H new ATOM 0 H73 DT B 109 -2.087 8.976 -11.156 1.00 0.00 H new ATOM 0 H6 DT B 109 0.286 9.309 -11.526 1.00 0.00 H new ATOM 288 P DA B 110 4.043 8.161 -15.810 1.00 0.00 P ATOM 289 OP1 DA B 110 5.179 8.485 -16.701 1.00 0.00 O ATOM 290 OP2 DA B 110 2.665 8.132 -16.350 1.00 0.00 O ATOM 291 O5' DA B 110 4.343 6.746 -15.104 1.00 0.00 O ATOM 292 C5' DA B 110 5.566 6.562 -14.396 1.00 0.00 C ATOM 293 C4' DA B 110 5.682 5.167 -13.776 1.00 0.00 C ATOM 294 O4' DA B 110 4.728 5.036 -12.690 1.00 0.00 O ATOM 295 C3' DA B 110 5.389 4.043 -14.771 1.00 0.00 C ATOM 296 O3' DA B 110 6.420 3.058 -14.670 1.00 0.00 O ATOM 297 C2' DA B 110 4.065 3.453 -14.360 1.00 0.00 C ATOM 298 C1' DA B 110 3.781 3.968 -12.958 1.00 0.00 C ATOM 299 N9 DA B 110 2.384 4.446 -12.832 1.00 0.00 N ATOM 300 C8 DA B 110 1.672 5.285 -13.643 1.00 0.00 C ATOM 301 N7 DA B 110 0.447 5.505 -13.270 1.00 0.00 N ATOM 302 C5 DA B 110 0.329 4.746 -12.108 1.00 0.00 C ATOM 303 C6 DA B 110 -0.726 4.541 -11.211 1.00 0.00 C ATOM 304 N6 DA B 110 -1.924 5.110 -11.350 1.00 0.00 N ATOM 305 N1 DA B 110 -0.500 3.727 -10.164 1.00 0.00 N ATOM 306 C2 DA B 110 0.692 3.152 -10.006 1.00 0.00 C ATOM 307 N3 DA B 110 1.756 3.279 -10.794 1.00 0.00 N ATOM 308 C4 DA B 110 1.501 4.098 -11.835 1.00 0.00 C ATOM 0 H5' DA B 110 5.643 7.313 -13.610 1.00 0.00 H new ATOM 0 H5'' DA B 110 6.403 6.725 -15.075 1.00 0.00 H new ATOM 0 H4' DA B 110 6.712 5.071 -13.434 1.00 0.00 H new ATOM 0 H3' DA B 110 5.354 4.401 -15.800 1.00 0.00 H new ATOM 0 H2' DA B 110 3.276 3.751 -15.050 1.00 0.00 H new ATOM 0 H2'' DA B 110 4.105 2.364 -14.373 1.00 0.00 H new ATOM 0 H1' DA B 110 3.897 3.165 -12.230 1.00 0.00 H new ATOM 0 H8 DA B 110 2.097 5.732 -14.529 1.00 0.00 H new ATOM 0 H61 DA B 110 -2.658 4.926 -10.666 1.00 0.00 H new ATOM 0 H62 DA B 110 -2.106 5.729 -12.140 1.00 0.00 H new ATOM 0 H2 DA B 110 0.807 2.513 -9.143 1.00 0.00 H new ATOM 320 P DA B 111 6.427 1.731 -15.579 1.00 0.00 P ATOM 321 OP1 DA B 111 7.834 1.379 -15.874 1.00 0.00 O ATOM 322 OP2 DA B 111 5.459 1.914 -16.682 1.00 0.00 O ATOM 323 O5' DA B 111 5.832 0.636 -14.550 1.00 0.00 O ATOM 324 C5' DA B 111 6.534 0.381 -13.328 1.00 0.00 C ATOM 325 C4' DA B 111 5.762 -0.528 -12.363 1.00 0.00 C ATOM 326 O4' DA B 111 4.526 0.103 -11.947 1.00 0.00 O ATOM 327 C3' DA B 111 5.420 -1.890 -12.976 1.00 0.00 C ATOM 328 O3' DA B 111 6.018 -2.924 -12.196 1.00 0.00 O ATOM 329 C2' DA B 111 3.909 -2.005 -12.905 1.00 0.00 C ATOM 330 C1' DA B 111 3.406 -0.793 -12.124 1.00 0.00 C ATOM 331 N9 DA B 111 2.311 -0.126 -12.855 1.00 0.00 N ATOM 332 C8 DA B 111 2.328 0.386 -14.114 1.00 0.00 C ATOM 333 N7 DA B 111 1.208 0.901 -14.519 1.00 0.00 N ATOM 334 C5 DA B 111 0.363 0.716 -13.429 1.00 0.00 C ATOM 335 C6 DA B 111 -0.979 1.042 -13.209 1.00 0.00 C ATOM 336 N6 DA B 111 -1.741 1.643 -14.124 1.00 0.00 N ATOM 337 N1 DA B 111 -1.508 0.718 -12.018 1.00 0.00 N ATOM 338 C2 DA B 111 -0.761 0.107 -11.095 1.00 0.00 C ATOM 339 N3 DA B 111 0.519 -0.248 -11.200 1.00 0.00 N ATOM 340 C4 DA B 111 1.023 0.091 -12.407 1.00 0.00 C ATOM 0 H5' DA B 111 6.744 1.329 -12.833 1.00 0.00 H new ATOM 0 H5'' DA B 111 7.495 -0.078 -13.558 1.00 0.00 H new ATOM 0 H4' DA B 111 6.421 -0.688 -11.510 1.00 0.00 H new ATOM 0 H3' DA B 111 5.784 -1.981 -13.999 1.00 0.00 H new ATOM 0 H2' DA B 111 3.476 -2.026 -13.905 1.00 0.00 H new ATOM 0 H2'' DA B 111 3.615 -2.931 -12.411 1.00 0.00 H new ATOM 0 H1' DA B 111 3.009 -1.098 -11.156 1.00 0.00 H new ATOM 0 H8 DA B 111 3.212 0.366 -14.734 1.00 0.00 H new ATOM 0 H61 DA B 111 -2.715 1.859 -13.914 1.00 0.00 H new ATOM 0 H62 DA B 111 -1.349 1.886 -15.034 1.00 0.00 H new ATOM 0 H2 DA B 111 -1.248 -0.125 -10.160 1.00 0.00 H new ATOM 352 P DA B 112 5.857 -4.481 -12.571 1.00 0.00 P ATOM 353 OP1 DA B 112 6.963 -5.231 -11.936 1.00 0.00 O ATOM 354 OP2 DA B 112 5.628 -4.589 -14.030 1.00 0.00 O ATOM 355 O5' DA B 112 4.491 -4.855 -11.812 1.00 0.00 O ATOM 356 C5' DA B 112 4.407 -4.707 -10.397 1.00 0.00 C ATOM 357 C4' DA B 112 3.024 -5.080 -9.864 1.00 0.00 C ATOM 358 O4' DA B 112 2.039 -4.125 -10.355 1.00 0.00 O ATOM 359 C3' DA B 112 2.573 -6.469 -10.330 1.00 0.00 C ATOM 360 O3' DA B 112 2.052 -7.202 -9.213 1.00 0.00 O ATOM 361 C2' DA B 112 1.502 -6.228 -11.351 1.00 0.00 C ATOM 362 C1' DA B 112 1.012 -4.814 -11.114 1.00 0.00 C ATOM 363 N9 DA B 112 0.696 -4.135 -12.392 1.00 0.00 N ATOM 364 C8 DA B 112 1.435 -4.034 -13.539 1.00 0.00 C ATOM 365 N7 DA B 112 0.863 -3.384 -14.508 1.00 0.00 N ATOM 366 C5 DA B 112 -0.365 -3.020 -13.962 1.00 0.00 C ATOM 367 C6 DA B 112 -1.459 -2.311 -14.472 1.00 0.00 C ATOM 368 N6 DA B 112 -1.494 -1.814 -15.708 1.00 0.00 N ATOM 369 N1 DA B 112 -2.516 -2.135 -13.660 1.00 0.00 N ATOM 370 C2 DA B 112 -2.499 -2.628 -12.421 1.00 0.00 C ATOM 371 N3 DA B 112 -1.519 -3.309 -11.842 1.00 0.00 N ATOM 372 C4 DA B 112 -0.474 -3.470 -12.677 1.00 0.00 C ATOM 0 H5' DA B 112 4.634 -3.676 -10.126 1.00 0.00 H new ATOM 0 H5'' DA B 112 5.160 -5.335 -9.921 1.00 0.00 H new ATOM 0 H4' DA B 112 3.096 -5.073 -8.776 1.00 0.00 H new ATOM 0 H3' DA B 112 3.393 -7.051 -10.751 1.00 0.00 H new ATOM 0 H2' DA B 112 1.894 -6.341 -12.362 1.00 0.00 H new ATOM 0 H2'' DA B 112 0.689 -6.946 -11.242 1.00 0.00 H new ATOM 0 H1' DA B 112 0.080 -4.814 -10.549 1.00 0.00 H new ATOM 0 H8 DA B 112 2.422 -4.463 -13.632 1.00 0.00 H new ATOM 0 H61 DA B 112 -2.317 -1.305 -16.030 1.00 0.00 H new ATOM 0 H62 DA B 112 -0.698 -1.943 -16.332 1.00 0.00 H new ATOM 0 H2 DA B 112 -3.381 -2.453 -11.823 1.00 0.00 H new ATOM 384 P DC B 113 1.491 -8.704 -9.367 1.00 0.00 P ATOM 385 OP1 DC B 113 1.815 -9.454 -8.140 1.00 0.00 O ATOM 386 OP2 DC B 113 1.935 -9.221 -10.681 1.00 0.00 O ATOM 387 O5' DC B 113 -0.113 -8.502 -9.430 1.00 0.00 O ATOM 388 C5' DC B 113 -0.791 -7.886 -8.324 1.00 0.00 C ATOM 389 C4' DC B 113 -2.310 -7.767 -8.535 1.00 0.00 C ATOM 390 O4' DC B 113 -2.624 -6.777 -9.544 1.00 0.00 O ATOM 391 C3' DC B 113 -2.931 -9.097 -8.972 1.00 0.00 C ATOM 392 O3' DC B 113 -3.968 -9.489 -8.068 1.00 0.00 O ATOM 393 C2' DC B 113 -3.545 -8.838 -10.323 1.00 0.00 C ATOM 394 C1' DC B 113 -3.489 -7.342 -10.559 1.00 0.00 C ATOM 395 N1 DC B 113 -2.975 -7.017 -11.912 1.00 0.00 N ATOM 396 C2 DC B 113 -3.784 -6.281 -12.772 1.00 0.00 C ATOM 397 O2 DC B 113 -4.930 -5.988 -12.438 1.00 0.00 O ATOM 398 N3 DC B 113 -3.272 -5.904 -13.973 1.00 0.00 N ATOM 399 C4 DC B 113 -2.022 -6.229 -14.320 1.00 0.00 C ATOM 400 N4 DC B 113 -1.556 -5.840 -15.507 1.00 0.00 N ATOM 401 C5 DC B 113 -1.186 -6.989 -13.438 1.00 0.00 C ATOM 402 C6 DC B 113 -1.713 -7.366 -12.255 1.00 0.00 C ATOM 0 H5' DC B 113 -0.375 -6.892 -8.159 1.00 0.00 H new ATOM 0 H5'' DC B 113 -0.600 -8.466 -7.421 1.00 0.00 H new ATOM 0 H4' DC B 113 -2.726 -7.469 -7.573 1.00 0.00 H new ATOM 0 H3' DC B 113 -2.181 -9.888 -8.993 1.00 0.00 H new ATOM 0 H2' DC B 113 -3.000 -9.371 -11.102 1.00 0.00 H new ATOM 0 H2'' DC B 113 -4.575 -9.194 -10.353 1.00 0.00 H new ATOM 0 H1' DC B 113 -4.494 -6.923 -10.497 1.00 0.00 H new ATOM 0 H41 DC B 113 -0.605 -6.081 -15.785 1.00 0.00 H new ATOM 0 H42 DC B 113 -2.151 -5.302 -16.137 1.00 0.00 H new ATOM 0 H5 DC B 113 -0.174 -7.250 -13.710 1.00 0.00 H new ATOM 0 H6 DC B 113 -1.119 -7.955 -11.571 1.00 0.00 H new ATOM 414 P DA B 114 -4.757 -10.876 -8.287 1.00 0.00 P ATOM 415 OP1 DA B 114 -5.310 -11.301 -6.981 1.00 0.00 O ATOM 416 OP2 DA B 114 -3.881 -11.792 -9.050 1.00 0.00 O ATOM 417 O5' DA B 114 -5.989 -10.444 -9.239 1.00 0.00 O ATOM 418 C5' DA B 114 -6.943 -9.467 -8.815 1.00 0.00 C ATOM 419 C4' DA B 114 -8.023 -9.212 -9.880 1.00 0.00 C ATOM 420 O4' DA B 114 -7.465 -8.512 -11.027 1.00 0.00 O ATOM 421 C3' DA B 114 -8.641 -10.521 -10.390 1.00 0.00 C ATOM 422 O3' DA B 114 -10.071 -10.450 -10.352 1.00 0.00 O ATOM 423 C2' DA B 114 -8.172 -10.651 -11.819 1.00 0.00 C ATOM 424 C1' DA B 114 -7.678 -9.279 -12.239 1.00 0.00 C ATOM 425 N9 DA B 114 -6.447 -9.360 -13.047 1.00 0.00 N ATOM 426 C8 DA B 114 -5.267 -9.939 -12.727 1.00 0.00 C ATOM 427 N7 DA B 114 -4.308 -9.767 -13.585 1.00 0.00 N ATOM 428 C5 DA B 114 -4.911 -9.003 -14.579 1.00 0.00 C ATOM 429 C6 DA B 114 -4.438 -8.477 -15.785 1.00 0.00 C ATOM 430 N6 DA B 114 -3.178 -8.616 -16.195 1.00 0.00 N ATOM 431 N1 DA B 114 -5.305 -7.780 -16.537 1.00 0.00 N ATOM 432 C2 DA B 114 -6.560 -7.605 -16.129 1.00 0.00 C ATOM 433 N3 DA B 114 -7.109 -8.053 -15.000 1.00 0.00 N ATOM 434 C4 DA B 114 -6.217 -8.752 -14.265 1.00 0.00 C ATOM 0 H5' DA B 114 -6.429 -8.533 -8.590 1.00 0.00 H new ATOM 0 H5'' DA B 114 -7.417 -9.800 -7.892 1.00 0.00 H new ATOM 0 H4' DA B 114 -8.791 -8.607 -9.398 1.00 0.00 H new ATOM 0 H3' DA B 114 -8.344 -11.372 -9.777 1.00 0.00 H new ATOM 0 H2' DA B 114 -7.376 -11.391 -11.900 1.00 0.00 H new ATOM 0 H2'' DA B 114 -8.984 -10.985 -12.465 1.00 0.00 H new ATOM 0 H1' DA B 114 -8.418 -8.794 -12.876 1.00 0.00 H new ATOM 0 H8 DA B 114 -5.132 -10.507 -11.818 1.00 0.00 H new ATOM 0 H61 DA B 114 -2.884 -8.212 -17.084 1.00 0.00 H new ATOM 0 H62 DA B 114 -2.508 -9.126 -15.620 1.00 0.00 H new ATOM 0 H2 DA B 114 -7.204 -7.038 -16.785 1.00 0.00 H new ATOM 446 P DT B 115 -10.975 -11.695 -10.835 1.00 0.00 P ATOM 447 OP1 DT B 115 -12.290 -11.606 -10.163 1.00 0.00 O ATOM 448 OP2 DT B 115 -10.165 -12.928 -10.713 1.00 0.00 O ATOM 449 O5' DT B 115 -11.183 -11.384 -12.405 1.00 0.00 O ATOM 450 C5' DT B 115 -11.874 -10.198 -12.810 1.00 0.00 C ATOM 451 C4' DT B 115 -11.949 -10.054 -14.336 1.00 0.00 C ATOM 452 O4' DT B 115 -10.645 -9.748 -14.879 1.00 0.00 O ATOM 453 C3' DT B 115 -12.460 -11.331 -15.019 1.00 0.00 C ATOM 454 O3' DT B 115 -13.707 -11.085 -15.672 1.00 0.00 O ATOM 455 C2' DT B 115 -11.404 -11.690 -16.048 1.00 0.00 C ATOM 456 C1' DT B 115 -10.396 -10.540 -16.059 1.00 0.00 C ATOM 457 N1 DT B 115 -8.989 -11.037 -16.084 1.00 0.00 N ATOM 458 C2 DT B 115 -8.173 -10.653 -17.138 1.00 0.00 C ATOM 459 O2 DT B 115 -8.581 -9.941 -18.053 1.00 0.00 O ATOM 460 N3 DT B 115 -6.872 -11.123 -17.105 1.00 0.00 N ATOM 461 C4 DT B 115 -6.322 -11.931 -16.127 1.00 0.00 C ATOM 462 O4 DT B 115 -5.146 -12.285 -16.194 1.00 0.00 O ATOM 463 C5 DT B 115 -7.243 -12.285 -15.070 1.00 0.00 C ATOM 464 C7 DT B 115 -6.756 -13.190 -13.934 1.00 0.00 C ATOM 465 C6 DT B 115 -8.519 -11.834 -15.084 1.00 0.00 C ATOM 0 H5' DT B 115 -11.371 -9.327 -12.390 1.00 0.00 H new ATOM 0 H5'' DT B 115 -12.884 -10.211 -12.399 1.00 0.00 H new ATOM 0 H4' DT B 115 -12.651 -9.244 -14.533 1.00 0.00 H new ATOM 0 H3' DT B 115 -12.623 -12.132 -14.298 1.00 0.00 H new ATOM 0 H2' DT B 115 -10.916 -12.630 -15.791 1.00 0.00 H new ATOM 0 H2'' DT B 115 -11.852 -11.822 -17.033 1.00 0.00 H new ATOM 0 H1' DT B 115 -10.520 -9.941 -16.961 1.00 0.00 H new ATOM 0 H3 DT B 115 -6.261 -10.848 -17.874 1.00 0.00 H new ATOM 0 H71 DT B 115 -5.983 -13.861 -14.309 1.00 0.00 H new ATOM 0 H72 DT B 115 -6.347 -12.577 -13.131 1.00 0.00 H new ATOM 0 H73 DT B 115 -7.592 -13.777 -13.553 1.00 0.00 H new ATOM 0 H6 DT B 115 -9.183 -12.114 -14.280 1.00 0.00 H new ATOM 478 P DT B 116 -14.573 -12.305 -16.268 1.00 0.00 P ATOM 479 OP1 DT B 116 -15.990 -11.878 -16.328 1.00 0.00 O ATOM 480 OP2 DT B 116 -14.206 -13.534 -15.532 1.00 0.00 O ATOM 481 O5' DT B 116 -14.026 -12.442 -17.775 1.00 0.00 O ATOM 482 C5' DT B 116 -14.154 -11.355 -18.694 1.00 0.00 C ATOM 483 C4' DT B 116 -13.389 -11.619 -19.993 1.00 0.00 C ATOM 484 O4' DT B 116 -11.963 -11.564 -19.760 1.00 0.00 O ATOM 485 C3' DT B 116 -13.720 -12.995 -20.588 1.00 0.00 C ATOM 486 O3' DT B 116 -14.484 -12.860 -21.789 1.00 0.00 O ATOM 487 C2' DT B 116 -12.384 -13.641 -20.888 1.00 0.00 C ATOM 488 C1' DT B 116 -11.304 -12.676 -20.401 1.00 0.00 C ATOM 489 N1 DT B 116 -10.367 -13.353 -19.462 1.00 0.00 N ATOM 490 C2 DT B 116 -9.019 -13.374 -19.784 1.00 0.00 C ATOM 491 O2 DT B 116 -8.583 -12.847 -20.805 1.00 0.00 O ATOM 492 N3 DT B 116 -8.189 -14.017 -18.889 1.00 0.00 N ATOM 493 C4 DT B 116 -8.572 -14.634 -17.716 1.00 0.00 C ATOM 494 O4 DT B 116 -7.735 -15.179 -16.997 1.00 0.00 O ATOM 495 C5 DT B 116 -9.993 -14.566 -17.455 1.00 0.00 C ATOM 496 C7 DT B 116 -10.551 -15.239 -16.199 1.00 0.00 C ATOM 497 C6 DT B 116 -10.829 -13.938 -18.316 1.00 0.00 C ATOM 0 H5' DT B 116 -13.781 -10.441 -18.231 1.00 0.00 H new ATOM 0 H5'' DT B 116 -15.208 -11.191 -18.919 1.00 0.00 H new ATOM 0 H4' DT B 116 -13.695 -10.844 -20.696 1.00 0.00 H new ATOM 0 H3' DT B 116 -14.317 -13.592 -19.899 1.00 0.00 H new ATOM 0 H2' DT B 116 -12.298 -14.603 -20.383 1.00 0.00 H new ATOM 0 H2'' DT B 116 -12.278 -13.831 -21.956 1.00 0.00 H new ATOM 0 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H71 DT C 122 -6.964 3.366 -13.417 1.00 0.00 H new ATOM 0 H72 DT C 122 -7.689 1.834 -13.959 1.00 0.00 H new ATOM 0 H73 DT C 122 -8.378 2.701 -12.566 1.00 0.00 H new ATOM 0 H6 DT C 122 -8.126 0.821 -11.087 1.00 0.00 H new ATOM 703 P DT C 123 -8.742 -0.288 -5.331 1.00 0.00 P ATOM 704 OP1 DT C 123 -9.398 -0.989 -4.206 1.00 0.00 O ATOM 705 OP2 DT C 123 -9.189 1.067 -5.726 1.00 0.00 O ATOM 706 O5' DT C 123 -7.158 -0.241 -5.050 1.00 0.00 O ATOM 707 C5' DT C 123 -6.483 -1.471 -4.780 1.00 0.00 C ATOM 708 C4' DT C 123 -4.980 -1.305 -4.534 1.00 0.00 C ATOM 709 O4' DT C 123 -4.314 -0.796 -5.718 1.00 0.00 O ATOM 710 C3' DT C 123 -4.650 -0.349 -3.386 1.00 0.00 C ATOM 711 O3' DT C 123 -3.811 -1.047 -2.459 1.00 0.00 O ATOM 712 C2' DT C 123 -3.925 0.810 -4.005 1.00 0.00 C ATOM 713 C1' DT C 123 -3.466 0.323 -5.366 1.00 0.00 C ATOM 714 N1 DT C 123 -3.536 1.392 -6.402 1.00 0.00 N ATOM 715 C2 DT C 123 -2.363 1.727 -7.067 1.00 0.00 C ATOM 716 O2 DT C 123 -1.288 1.193 -6.800 1.00 0.00 O ATOM 717 N3 DT C 123 -2.469 2.695 -8.045 1.00 0.00 N ATOM 718 C4 DT C 123 -3.625 3.356 -8.416 1.00 0.00 C ATOM 719 O4 DT C 123 -3.604 4.200 -9.309 1.00 0.00 O ATOM 720 C5 DT C 123 -4.798 2.952 -7.673 1.00 0.00 C ATOM 721 C7 DT C 123 -6.139 3.616 -7.980 1.00 0.00 C ATOM 722 C6 DT C 123 -4.724 2.004 -6.712 1.00 0.00 C ATOM 0 H5' DT C 123 -6.632 -2.150 -5.620 1.00 0.00 H new ATOM 0 H5'' DT C 123 -6.936 -1.940 -3.907 1.00 0.00 H new ATOM 0 H4' DT C 123 -4.628 -2.303 -4.274 1.00 0.00 H new ATOM 0 H3' DT C 123 -5.533 0.003 -2.853 1.00 0.00 H new ATOM 0 H2' DT C 123 -4.579 1.677 -4.099 1.00 0.00 H new ATOM 0 H2'' DT C 123 -3.077 1.115 -3.391 1.00 0.00 H new ATOM 0 H1' DT C 123 -2.418 0.026 -5.320 1.00 0.00 H new ATOM 0 H3 DT C 123 -1.614 2.946 -8.541 1.00 0.00 H new ATOM 0 H71 DT C 123 -5.969 4.636 -8.325 1.00 0.00 H new ATOM 0 H72 DT C 123 -6.655 3.052 -8.757 1.00 0.00 H new ATOM 0 H73 DT C 123 -6.751 3.635 -7.078 1.00 0.00 H new ATOM 0 H6 DT C 123 -5.619 1.723 -6.177 1.00 0.00 H new ATOM 735 P DA C 124 -3.237 -0.394 -1.104 1.00 0.00 P ATOM 736 OP1 DA C 124 -3.267 -1.421 -0.041 1.00 0.00 O ATOM 737 OP2 DA C 124 -3.918 0.904 -0.897 1.00 0.00 O ATOM 738 O5' DA C 124 -1.690 -0.093 -1.479 1.00 0.00 O ATOM 739 C5' DA C 124 -0.845 -1.189 -1.867 1.00 0.00 C ATOM 740 C4' DA C 124 0.617 -0.789 -2.128 1.00 0.00 C ATOM 741 O4' DA C 124 0.692 0.058 -3.304 1.00 0.00 O ATOM 742 C3' DA C 124 1.221 0.002 -0.960 1.00 0.00 C ATOM 743 O3' DA C 124 2.562 -0.436 -0.691 1.00 0.00 O ATOM 744 C2' DA C 124 1.238 1.428 -1.418 1.00 0.00 C ATOM 745 C1' DA C 124 1.126 1.390 -2.935 1.00 0.00 C ATOM 746 N9 DA C 124 0.199 2.417 -3.435 1.00 0.00 N ATOM 747 C8 DA C 124 -1.054 2.697 -3.014 1.00 0.00 C ATOM 748 N7 DA C 124 -1.643 3.677 -3.625 1.00 0.00 N ATOM 749 C5 DA C 124 -0.684 4.087 -4.545 1.00 0.00 C ATOM 750 C6 DA C 124 -0.675 5.093 -5.510 1.00 0.00 C ATOM 751 N6 DA C 124 -1.704 5.914 -5.703 1.00 0.00 N ATOM 752 N1 DA C 124 0.437 5.228 -6.256 1.00 0.00 N ATOM 753 C2 DA C 124 1.480 4.419 -6.058 1.00 0.00 C ATOM 754 N3 DA C 124 1.573 3.434 -5.167 1.00 0.00 N ATOM 755 C4 DA C 124 0.444 3.325 -4.439 1.00 0.00 C ATOM 0 H5' DA C 124 -1.252 -1.647 -2.768 1.00 0.00 H new ATOM 0 H5'' DA C 124 -0.869 -1.948 -1.085 1.00 0.00 H new ATOM 0 H4' DA C 124 1.175 -1.716 -2.261 1.00 0.00 H new ATOM 0 H3' DA C 124 0.647 -0.135 -0.044 1.00 0.00 H new ATOM 0 H2' DA C 124 0.411 1.987 -0.981 1.00 0.00 H new ATOM 0 H2'' DA C 124 2.157 1.925 -1.108 1.00 0.00 H new ATOM 0 H1' DA C 124 2.092 1.612 -3.389 1.00 0.00 H new ATOM 0 H8 DA C 124 -1.533 2.141 -2.221 1.00 0.00 H new ATOM 0 H61 DA C 124 -1.652 6.636 -6.422 1.00 0.00 H new ATOM 0 H62 DA C 124 -2.544 5.821 -5.132 1.00 0.00 H new ATOM 0 H2 DA C 124 2.342 4.581 -6.689 1.00 0.00 H new ATOM 767 P DT C 125 3.442 0.229 0.494 1.00 0.00 P ATOM 768 OP1 DT C 125 4.373 -0.798 1.014 1.00 0.00 O ATOM 769 OP2 DT C 125 2.519 0.923 1.419 1.00 0.00 O ATOM 770 O5' DT C 125 4.308 1.350 -0.291 1.00 0.00 O ATOM 771 C5' DT C 125 5.193 0.939 -1.340 1.00 0.00 C ATOM 772 C4' DT C 125 5.858 2.110 -2.084 1.00 0.00 C ATOM 773 O4' DT C 125 4.875 2.828 -2.876 1.00 0.00 O ATOM 774 C3' DT C 125 6.526 3.134 -1.153 1.00 0.00 C ATOM 775 O3' DT C 125 7.909 3.292 -1.499 1.00 0.00 O ATOM 776 C2' DT C 125 5.807 4.434 -1.385 1.00 0.00 C ATOM 777 C1' DT C 125 5.035 4.251 -2.679 1.00 0.00 C ATOM 778 N1 DT C 125 3.724 4.960 -2.649 1.00 0.00 N ATOM 779 C2 DT C 125 3.472 5.918 -3.625 1.00 0.00 C ATOM 780 O2 DT C 125 4.285 6.178 -4.509 1.00 0.00 O ATOM 781 N3 DT C 125 2.248 6.556 -3.549 1.00 0.00 N ATOM 782 C4 DT C 125 1.270 6.323 -2.597 1.00 0.00 C ATOM 783 O4 DT C 125 0.224 6.959 -2.587 1.00 0.00 O ATOM 784 C5 DT C 125 1.617 5.317 -1.638 1.00 0.00 C ATOM 785 C7 DT C 125 0.612 4.966 -0.554 1.00 0.00 C ATOM 786 C6 DT C 125 2.801 4.680 -1.686 1.00 0.00 C ATOM 0 H5' DT C 125 4.637 0.334 -2.056 1.00 0.00 H new ATOM 0 H5'' DT C 125 5.969 0.300 -0.919 1.00 0.00 H new ATOM 0 H4' DT C 125 6.628 1.654 -2.705 1.00 0.00 H new ATOM 0 H3' DT C 125 6.473 2.814 -0.113 1.00 0.00 H new ATOM 0 H2' DT C 125 5.136 4.663 -0.558 1.00 0.00 H new ATOM 0 H2'' DT C 125 6.511 5.262 -1.463 1.00 0.00 H new ATOM 0 H1' DT C 125 5.581 4.691 -3.514 1.00 0.00 H new ATOM 0 H3 DT C 125 2.047 7.262 -4.258 1.00 0.00 H new ATOM 0 H71 DT C 125 0.736 3.922 -0.267 1.00 0.00 H new ATOM 0 H72 DT C 125 0.777 5.603 0.315 1.00 0.00 H new ATOM 0 H73 DT C 125 -0.399 5.121 -0.931 1.00 0.00 H new ATOM 0 H6 DT C 125 3.026 3.929 -0.943 1.00 0.00 H new ATOM 799 P DC C 126 8.850 4.311 -0.678 1.00 0.00 P ATOM 800 OP1 DC C 126 10.217 3.750 -0.628 1.00 0.00 O ATOM 801 OP2 DC C 126 8.156 4.672 0.578 1.00 0.00 O ATOM 802 O5' DC C 126 8.874 5.619 -1.636 1.00 0.00 O ATOM 803 C5' DC C 126 9.397 5.530 -2.971 1.00 0.00 C ATOM 804 C4' DC C 126 9.245 6.839 -3.764 1.00 0.00 C ATOM 805 O4' DC C 126 7.862 7.085 -4.110 1.00 0.00 O ATOM 806 C3' DC C 126 9.765 8.044 -2.970 1.00 0.00 C ATOM 807 O3' DC C 126 10.958 8.573 -3.547 1.00 0.00 O ATOM 808 C2' DC C 126 8.663 9.083 -3.048 1.00 0.00 C ATOM 809 C1' DC C 126 7.500 8.452 -3.812 1.00 0.00 C ATOM 810 N1 DC C 126 6.263 8.489 -2.994 1.00 0.00 N ATOM 811 C2 DC C 126 5.144 9.154 -3.496 1.00 0.00 C ATOM 812 O2 DC C 126 5.204 9.751 -4.571 1.00 0.00 O ATOM 813 N3 DC C 126 4.004 9.136 -2.757 1.00 0.00 N ATOM 814 C4 DC C 126 3.958 8.497 -1.580 1.00 0.00 C ATOM 815 N4 DC C 126 2.827 8.489 -0.890 1.00 0.00 N ATOM 816 C5 DC C 126 5.102 7.823 -1.062 1.00 0.00 C ATOM 817 C6 DC C 126 6.224 7.845 -1.797 1.00 0.00 C ATOM 0 H5' DC C 126 8.886 4.728 -3.503 1.00 0.00 H new ATOM 0 H5'' DC C 126 10.452 5.260 -2.925 1.00 0.00 H new ATOM 0 H4' DC C 126 9.837 6.720 -4.671 1.00 0.00 H new ATOM 0 H3' DC C 126 10.007 7.760 -1.946 1.00 0.00 H new ATOM 0 H2' DC C 126 8.348 9.386 -2.049 1.00 0.00 H new ATOM 0 H2'' DC C 126 9.016 9.980 -3.557 1.00 0.00 H new ATOM 0 H1' DC C 126 7.307 9.005 -4.731 1.00 0.00 H new ATOM 0 H41 DC C 126 2.780 8.006 0.007 1.00 0.00 H new ATOM 0 H42 DC C 126 2.003 8.966 -1.256 1.00 0.00 H new ATOM 0 H5 DC C 126 5.067 7.312 -0.111 1.00 0.00 H new ATOM 0 H6 DC C 126 7.109 7.344 -1.433 1.00 0.00 H new ATOM 829 P DT C 127 11.816 9.682 -2.748 1.00 0.00 P ATOM 830 OP1 DT C 127 13.166 9.737 -3.347 1.00 0.00 O ATOM 831 OP2 DT C 127 11.665 9.418 -1.299 1.00 0.00 O ATOM 832 O5' DT C 127 11.061 11.064 -3.082 1.00 0.00 O ATOM 833 C5' DT C 127 11.053 11.590 -4.408 1.00 0.00 C ATOM 834 C4' DT C 127 10.277 12.911 -4.492 1.00 0.00 C ATOM 835 O4' DT C 127 8.859 12.664 -4.316 1.00 0.00 O ATOM 836 C3' DT C 127 10.724 13.911 -3.414 1.00 0.00 C ATOM 837 O3' DT C 127 11.333 15.064 -4.003 1.00 0.00 O ATOM 838 C2' DT C 127 9.460 14.319 -2.688 1.00 0.00 C ATOM 839 C1' DT C 127 8.299 13.595 -3.368 1.00 0.00 C ATOM 840 N1 DT C 127 7.437 12.901 -2.360 1.00 0.00 N ATOM 841 C2 DT C 127 6.099 13.271 -2.281 1.00 0.00 C ATOM 842 O2 DT C 127 5.610 14.109 -3.035 1.00 0.00 O ATOM 843 N3 DT C 127 5.344 12.638 -1.312 1.00 0.00 N ATOM 844 C4 DT C 127 5.795 11.679 -0.423 1.00 0.00 C ATOM 845 O4 DT C 127 5.032 11.189 0.408 1.00 0.00 O ATOM 846 C5 DT C 127 7.192 11.346 -0.572 1.00 0.00 C ATOM 847 C7 DT C 127 7.803 10.293 0.360 1.00 0.00 C ATOM 848 C6 DT C 127 7.958 11.950 -1.515 1.00 0.00 C ATOM 0 H5' DT C 127 10.606 10.862 -5.085 1.00 0.00 H new ATOM 0 H5'' DT C 127 12.078 11.749 -4.742 1.00 0.00 H new ATOM 0 H4' DT C 127 10.480 13.337 -5.475 1.00 0.00 H new ATOM 0 H3' DT C 127 11.461 13.464 -2.747 1.00 0.00 H new ATOM 0 H2' DT C 127 9.517 14.050 -1.633 1.00 0.00 H new ATOM 0 H2'' DT C 127 9.321 15.399 -2.734 1.00 0.00 H new ATOM 0 H1' DT C 127 7.657 14.308 -3.885 1.00 0.00 H new ATOM 0 H3 DT C 127 4.361 12.903 -1.246 1.00 0.00 H new ATOM 0 H71 DT C 127 8.612 9.776 -0.156 1.00 0.00 H new ATOM 0 H72 DT C 127 8.195 10.781 1.252 1.00 0.00 H new ATOM 0 H73 DT C 127 7.037 9.573 0.647 1.00 0.00 H new ATOM 0 H6 DT C 127 8.999 11.678 -1.604 1.00 0.00 H new ATOM 861 P DG C 128 11.908 16.255 -3.078 1.00 0.00 P ATOM 862 OP1 DG C 128 12.953 16.972 -3.841 1.00 0.00 O ATOM 863 OP2 DG C 128 12.227 15.691 -1.746 1.00 0.00 O ATOM 864 O5' DG C 128 10.645 17.239 -2.915 1.00 0.00 O ATOM 865 C5' DG C 128 10.043 17.836 -4.065 1.00 0.00 C ATOM 866 C4' DG C 128 8.843 18.713 -3.693 1.00 0.00 C ATOM 867 O4' DG C 128 7.753 17.885 -3.231 1.00 0.00 O ATOM 868 C3' DG C 128 9.186 19.721 -2.585 1.00 0.00 C ATOM 869 O3' DG C 128 8.960 21.054 -3.053 1.00 0.00 O ATOM 870 C2' DG C 128 8.250 19.401 -1.436 1.00 0.00 C ATOM 871 C1' DG C 128 7.318 18.290 -1.916 1.00 0.00 C ATOM 872 N9 DG C 128 7.337 17.151 -0.983 1.00 0.00 N ATOM 873 C8 DG C 128 8.405 16.451 -0.530 1.00 0.00 C ATOM 874 N7 DG C 128 8.133 15.494 0.305 1.00 0.00 N ATOM 875 C5 DG C 128 6.746 15.562 0.421 1.00 0.00 C ATOM 876 C6 DG C 128 5.855 14.770 1.196 1.00 0.00 C ATOM 877 O6 DG C 128 6.124 13.837 1.950 1.00 0.00 O ATOM 878 N1 DG C 128 4.537 15.172 1.025 1.00 0.00 N ATOM 879 C2 DG C 128 4.122 16.206 0.214 1.00 0.00 C ATOM 880 N2 DG C 128 2.810 16.445 0.191 1.00 0.00 N ATOM 881 N3 DG C 128 4.956 16.955 -0.517 1.00 0.00 N ATOM 882 C4 DG C 128 6.247 16.577 -0.366 1.00 0.00 C ATOM 0 H5' DG C 128 9.722 17.054 -4.753 1.00 0.00 H new ATOM 0 H5'' DG C 128 10.784 18.439 -4.591 1.00 0.00 H new ATOM 0 H4' DG C 128 8.560 19.263 -4.590 1.00 0.00 H new ATOM 0 H3' DG C 128 10.231 19.653 -2.281 1.00 0.00 H new ATOM 0 H2' DG C 128 8.812 19.081 -0.559 1.00 0.00 H new ATOM 0 H2'' DG C 128 7.680 20.284 -1.145 1.00 0.00 H new ATOM 0 H1' DG C 128 6.291 18.653 -1.957 1.00 0.00 H new ATOM 0 H8 DG C 128 9.415 16.674 -0.842 1.00 0.00 H new ATOM 0 H1 DG C 128 3.820 14.662 1.540 1.00 0.00 H new ATOM 0 H21 DG C 128 2.439 17.197 -0.389 1.00 0.00 H new ATOM 0 H22 DG C 128 2.178 15.876 0.754 1.00 0.00 H new ATOM 894 P DC C 129 9.473 22.337 -2.224 1.00 0.00 P ATOM 895 OP1 DC C 129 9.643 23.458 -3.176 1.00 0.00 O ATOM 896 OP2 DC C 129 10.616 21.912 -1.385 1.00 0.00 O ATOM 897 O5' DC C 129 8.244 22.700 -1.246 1.00 0.00 O ATOM 898 C5' DC C 129 6.960 23.036 -1.777 1.00 0.00 C ATOM 899 C4' DC C 129 5.950 23.343 -0.664 1.00 0.00 C ATOM 900 O4' DC C 129 5.608 22.142 0.069 1.00 0.00 O ATOM 901 C3' DC C 129 6.507 24.363 0.335 1.00 0.00 C ATOM 902 O3' DC C 129 5.631 25.485 0.425 1.00 0.00 O ATOM 903 C2' DC C 129 6.547 23.659 1.666 1.00 0.00 C ATOM 904 C1' DC C 129 5.858 22.319 1.483 1.00 0.00 C ATOM 905 N1 DC C 129 6.687 21.201 2.011 1.00 0.00 N ATOM 906 C2 DC C 129 6.146 20.406 3.020 1.00 0.00 C ATOM 907 O2 DC C 129 5.028 20.657 3.468 1.00 0.00 O ATOM 908 N3 DC C 129 6.880 19.362 3.487 1.00 0.00 N ATOM 909 C4 DC C 129 8.095 19.100 2.992 1.00 0.00 C ATOM 910 N4 DC C 129 8.779 18.057 3.465 1.00 0.00 N ATOM 911 C5 DC C 129 8.662 19.914 1.959 1.00 0.00 C ATOM 912 C6 DC C 129 7.927 20.946 1.498 1.00 0.00 C ATOM 0 H5' DC C 129 6.591 22.211 -2.386 1.00 0.00 H new ATOM 0 H5'' DC C 129 7.052 23.901 -2.434 1.00 0.00 H new ATOM 0 H4' DC C 129 5.065 23.753 -1.151 1.00 0.00 H new ATOM 0 H3' DC C 129 7.490 24.721 0.030 1.00 0.00 H new ATOM 0 H2' DC C 129 7.576 23.521 1.998 1.00 0.00 H new ATOM 0 H2'' DC C 129 6.042 24.250 2.430 1.00 0.00 H new ATOM 0 H1' DC C 129 4.923 22.308 2.043 1.00 0.00 H new ATOM 0 H41 DC C 129 9.706 17.846 3.097 1.00 0.00 H new ATOM 0 H42 DC C 129 8.375 17.471 4.195 1.00 0.00 H new ATOM 0 H5 DC C 129 9.645 19.708 1.563 1.00 0.00 H new ATOM 0 H6 DC C 129 8.322 21.577 0.716 1.00 0.00 H new ATOM 924 P DA C 130 5.977 26.739 1.372 1.00 0.00 P ATOM 925 OP1 DA C 130 5.274 27.927 0.840 1.00 0.00 O ATOM 926 OP2 DA C 130 7.444 26.777 1.563 1.00 0.00 O ATOM 927 O5' DA C 130 5.299 26.347 2.782 1.00 0.00 O ATOM 928 C5' DA C 130 3.891 26.117 2.877 1.00 0.00 C ATOM 929 C4' DA C 130 3.461 25.767 4.310 1.00 0.00 C ATOM 930 O4' DA C 130 3.944 24.451 4.692 1.00 0.00 O ATOM 931 C3' DA C 130 4.026 26.785 5.311 1.00 0.00 C ATOM 932 O3' DA C 130 2.991 27.266 6.176 1.00 0.00 O ATOM 933 C2' DA C 130 5.054 26.025 6.109 1.00 0.00 C ATOM 934 C1' DA C 130 4.779 24.552 5.869 1.00 0.00 C ATOM 935 N9 DA C 130 6.024 23.782 5.713 1.00 0.00 N ATOM 936 C8 DA C 130 7.056 24.002 4.866 1.00 0.00 C ATOM 937 N7 DA C 130 8.017 23.130 4.921 1.00 0.00 N ATOM 938 C5 DA C 130 7.577 22.245 5.903 1.00 0.00 C ATOM 939 C6 DA C 130 8.132 21.086 6.451 1.00 0.00 C ATOM 940 N6 DA C 130 9.309 20.593 6.068 1.00 0.00 N ATOM 941 N1 DA C 130 7.428 20.456 7.409 1.00 0.00 N ATOM 942 C2 DA C 130 6.249 20.938 7.803 1.00 0.00 C ATOM 943 N3 DA C 130 5.636 22.026 7.347 1.00 0.00 N ATOM 944 C4 DA C 130 6.364 22.635 6.390 1.00 0.00 C ATOM 0 H5' DA C 130 3.610 25.306 2.206 1.00 0.00 H new ATOM 0 H5'' DA C 130 3.355 27.006 2.544 1.00 0.00 H new ATOM 0 H4' DA C 130 2.371 25.784 4.330 1.00 0.00 H new ATOM 0 H3' DA C 130 4.453 27.653 4.808 1.00 0.00 H new ATOM 0 H2' DA C 130 6.063 26.288 5.793 1.00 0.00 H new ATOM 0 H2'' DA C 130 4.979 26.266 7.169 1.00 0.00 H new ATOM 0 H1' DA C 130 4.269 24.124 6.732 1.00 0.00 H new ATOM 0 H8 DA C 130 7.079 24.845 4.191 1.00 0.00 H new ATOM 0 H61 DA C 130 9.671 19.743 6.500 1.00 0.00 H new ATOM 0 H62 DA C 130 9.848 21.066 5.343 1.00 0.00 H new ATOM 0 H2 DA C 130 5.737 20.385 8.576 1.00 0.00 H new ATOM 956 P DA C 131 3.310 28.350 7.327 1.00 0.00 P ATOM 957 OP1 DA C 131 2.065 29.100 7.604 1.00 0.00 O ATOM 958 OP2 DA C 131 4.532 29.084 6.930 1.00 0.00 O ATOM 959 O5' DA C 131 3.663 27.471 8.638 1.00 0.00 O ATOM 960 C5' DA C 131 2.642 26.703 9.282 1.00 0.00 C ATOM 961 C4' DA C 131 3.165 25.935 10.509 1.00 0.00 C ATOM 962 O4' DA C 131 4.032 24.844 10.120 1.00 0.00 O ATOM 963 C3' DA C 131 3.956 26.852 11.455 1.00 0.00 C ATOM 964 O3' DA C 131 3.302 26.975 12.721 1.00 0.00 O ATOM 965 C2' DA C 131 5.292 26.181 11.651 1.00 0.00 C ATOM 966 C1' DA C 131 5.236 24.849 10.923 1.00 0.00 C ATOM 967 N9 DA C 131 6.427 24.648 10.088 1.00 0.00 N ATOM 968 C8 DA C 131 6.889 25.422 9.083 1.00 0.00 C ATOM 969 N7 DA C 131 7.963 24.989 8.494 1.00 0.00 N ATOM 970 C5 DA C 131 8.240 23.811 9.182 1.00 0.00 C ATOM 971 C6 DA C 131 9.254 22.856 9.059 1.00 0.00 C ATOM 972 N6 DA C 131 10.217 22.933 8.141 1.00 0.00 N ATOM 973 N1 DA C 131 9.230 21.814 9.909 1.00 0.00 N ATOM 974 C2 DA C 131 8.264 21.716 10.823 1.00 0.00 C ATOM 975 N3 DA C 131 7.258 22.562 11.022 1.00 0.00 N ATOM 976 C4 DA C 131 7.310 23.596 10.158 1.00 0.00 C ATOM 0 H5' DA C 131 2.220 25.996 8.568 1.00 0.00 H new ATOM 0 H5'' DA C 131 1.834 27.366 9.590 1.00 0.00 H new ATOM 0 H4' DA C 131 2.285 25.547 11.021 1.00 0.00 H new ATOM 0 H3' DA C 131 4.046 27.854 11.036 1.00 0.00 H new ATOM 0 H2' DA C 131 6.096 26.802 11.256 1.00 0.00 H new ATOM 0 H2'' DA C 131 5.496 26.032 12.711 1.00 0.00 H new ATOM 0 H1' DA C 131 5.218 24.029 11.641 1.00 0.00 H new ATOM 0 H8 DA C 131 6.399 26.339 8.789 1.00 0.00 H new ATOM 0 H61 DA C 131 10.935 22.210 8.093 1.00 0.00 H new ATOM 0 H62 DA C 131 10.236 23.715 7.487 1.00 0.00 H new ATOM 0 H2 DA C 131 8.303 20.855 11.473 1.00 0.00 H new ATOM 988 P DC C 132 3.913 27.940 13.861 1.00 0.00 P ATOM 989 OP1 DC C 132 2.809 28.343 14.761 1.00 0.00 O ATOM 990 OP2 DC C 132 4.729 28.977 13.192 1.00 0.00 O ATOM 991 O5' DC C 132 4.910 26.974 14.689 1.00 0.00 O ATOM 992 C5' DC C 132 4.439 25.742 15.247 1.00 0.00 C ATOM 993 C4' DC C 132 5.585 24.877 15.794 1.00 0.00 C ATOM 994 O4' DC C 132 6.404 24.356 14.722 1.00 0.00 O ATOM 995 C3' DC C 132 6.505 25.653 16.746 1.00 0.00 C ATOM 996 O3' DC C 132 6.341 25.193 18.092 1.00 0.00 O ATOM 997 C2' DC C 132 7.915 25.384 16.258 1.00 0.00 C ATOM 998 C1' DC C 132 7.799 24.421 15.093 1.00 0.00 C ATOM 999 N1 DC C 132 8.643 24.867 13.954 1.00 0.00 N ATOM 1000 C2 DC C 132 9.768 24.116 13.629 1.00 0.00 C ATOM 1001 O2 DC C 132 10.034 23.104 14.270 1.00 0.00 O ATOM 1002 N3 DC C 132 10.554 24.540 12.602 1.00 0.00 N ATOM 1003 C4 DC C 132 10.251 25.652 11.917 1.00 0.00 C ATOM 1004 N4 DC C 132 11.039 26.034 10.913 1.00 0.00 N ATOM 1005 C5 DC C 132 9.093 26.422 12.246 1.00 0.00 C ATOM 1006 C6 DC C 132 8.325 25.991 13.266 1.00 0.00 C ATOM 0 H5' DC C 132 3.897 25.183 14.484 1.00 0.00 H new ATOM 0 H5'' DC C 132 3.732 25.955 16.049 1.00 0.00 H new ATOM 0 H4' DC C 132 5.104 24.066 16.340 1.00 0.00 H new ATOM 0 H3' DC C 132 6.276 26.719 16.748 1.00 0.00 H new ATOM 0 H2' DC C 132 8.400 26.310 15.948 1.00 0.00 H new ATOM 0 H2'' DC C 132 8.525 24.956 17.054 1.00 0.00 H new ATOM 0 HO3' DC C 132 6.936 25.697 18.685 1.00 0.00 H new ATOM 0 H1' DC C 132 8.156 23.431 15.376 1.00 0.00 H new ATOM 0 H41 DC C 132 10.819 26.878 10.385 1.00 0.00 H new ATOM 0 H42 DC C 132 11.863 25.482 10.673 1.00 0.00 H new ATOM 0 H5 DC C 132 8.842 27.317 11.697 1.00 0.00 H new ATOM 0 H6 DC C 132 7.442 26.550 13.540 1.00 0.00 H new TER 1019 DC C 132 ATOM 1020 N LYS A 1 -4.085 13.267 11.705 1.00 0.00 N ATOM 1021 CA LYS A 1 -5.087 12.825 12.714 1.00 0.00 C ATOM 1022 C LYS A 1 -5.647 11.465 12.296 1.00 0.00 C ATOM 1023 O LYS A 1 -6.707 11.369 11.714 1.00 0.00 O ATOM 1024 CB LYS A 1 -6.211 13.861 12.799 1.00 0.00 C ATOM 1025 CG LYS A 1 -5.648 15.145 13.406 1.00 0.00 C ATOM 1026 CD LYS A 1 -6.740 16.210 13.509 1.00 0.00 C ATOM 1027 CE LYS A 1 -6.107 17.521 13.981 1.00 0.00 C ATOM 1028 NZ LYS A 1 -7.171 18.506 14.316 1.00 0.00 N ATOM 0 H1 LYS A 1 -3.393 13.899 12.156 1.00 0.00 H new ATOM 0 H2 LYS A 1 -3.594 12.437 11.317 1.00 0.00 H new ATOM 0 H3 LYS A 1 -4.567 13.774 10.936 1.00 0.00 H new ATOM 0 HA LYS A 1 -4.619 12.733 13.694 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -6.619 14.059 11.808 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -7.030 13.481 13.410 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -5.239 14.938 14.395 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -4.827 15.515 12.792 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -7.223 16.351 12.542 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -7.513 15.891 14.208 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -5.480 17.339 14.854 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -5.459 17.923 13.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -6.734 19.394 14.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -7.752 18.690 13.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -7.772 18.124 15.074 1.00 0.00 H new ATOM 1044 N ARG A 2 -4.932 10.412 12.601 1.00 0.00 N ATOM 1045 CA ARG A 2 -5.407 9.043 12.237 1.00 0.00 C ATOM 1046 C ARG A 2 -6.238 8.475 13.392 1.00 0.00 C ATOM 1047 O ARG A 2 -6.776 7.389 13.308 1.00 0.00 O ATOM 1048 CB ARG A 2 -4.207 8.117 11.983 1.00 0.00 C ATOM 1049 CG ARG A 2 -3.472 8.514 10.678 1.00 0.00 C ATOM 1050 CD ARG A 2 -2.298 9.447 10.994 1.00 0.00 C ATOM 1051 NE ARG A 2 -1.151 8.639 11.503 1.00 0.00 N ATOM 1052 CZ ARG A 2 0.052 9.151 11.539 1.00 0.00 C ATOM 1053 NH1 ARG A 2 0.258 10.374 11.139 1.00 0.00 N ATOM 1054 NH2 ARG A 2 1.052 8.436 11.979 1.00 0.00 N ATOM 0 H ARG A 2 -4.036 10.442 13.088 1.00 0.00 H new ATOM 0 HA ARG A 2 -6.012 9.105 11.332 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -3.517 8.170 12.825 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -4.547 7.084 11.914 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -3.109 7.620 10.170 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -4.165 9.008 9.997 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -2.003 9.995 10.099 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -2.596 10.186 11.738 1.00 0.00 H new ATOM 0 HE ARG A 2 -1.306 7.683 11.824 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -0.521 10.936 10.796 1.00 0.00 H new ATOM 0 HH12 ARG A 2 1.198 10.769 11.169 1.00 0.00 H new ATOM 0 HH21 ARG A 2 0.895 7.479 12.294 1.00 0.00 H new ATOM 0 HH22 ARG A 2 1.990 8.835 12.007 1.00 0.00 H new ATOM 1068 N ALA A 3 -6.340 9.199 14.475 1.00 0.00 N ATOM 1069 CA ALA A 3 -7.127 8.692 15.635 1.00 0.00 C ATOM 1070 C ALA A 3 -8.624 8.837 15.352 1.00 0.00 C ATOM 1071 O ALA A 3 -9.151 9.931 15.283 1.00 0.00 O ATOM 1072 CB ALA A 3 -6.764 9.493 16.890 1.00 0.00 C ATOM 0 H ALA A 3 -5.914 10.116 14.606 1.00 0.00 H new ATOM 0 HA ALA A 3 -6.892 7.639 15.793 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -7.340 9.122 17.738 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -5.700 9.382 17.098 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -6.994 10.546 16.729 1.00 0.00 H new ATOM 1078 N GLY A 4 -9.315 7.738 15.204 1.00 0.00 N ATOM 1079 CA GLY A 4 -10.782 7.801 14.944 1.00 0.00 C ATOM 1080 C GLY A 4 -11.054 7.932 13.441 1.00 0.00 C ATOM 1081 O GLY A 4 -12.184 7.845 13.004 1.00 0.00 O ATOM 0 H GLY A 4 -8.925 6.797 15.252 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.265 6.903 15.330 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.215 8.649 15.474 1.00 0.00 H new ATOM 1085 N THR A 5 -10.042 8.169 12.645 1.00 0.00 N ATOM 1086 CA THR A 5 -10.290 8.328 11.179 1.00 0.00 C ATOM 1087 C THR A 5 -10.673 6.987 10.551 1.00 0.00 C ATOM 1088 O THR A 5 -9.915 6.039 10.557 1.00 0.00 O ATOM 1089 CB THR A 5 -9.045 8.865 10.477 1.00 0.00 C ATOM 1090 OG1 THR A 5 -8.500 9.939 11.228 1.00 0.00 O ATOM 1091 CG2 THR A 5 -9.425 9.357 9.072 1.00 0.00 C ATOM 0 H THR A 5 -9.070 8.258 12.940 1.00 0.00 H new ATOM 0 HA THR A 5 -11.110 9.036 11.056 1.00 0.00 H new ATOM 0 HB THR A 5 -8.302 8.071 10.396 1.00 0.00 H new ATOM 0 HG1 THR A 5 -7.692 10.272 10.784 1.00 0.00 H new ATOM 0 HG21 THR A 5 -8.538 9.741 8.569 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.839 8.529 8.496 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.168 10.150 9.153 1.00 0.00 H new ATOM 1099 N VAL A 6 -11.853 6.925 9.997 1.00 0.00 N ATOM 1100 CA VAL A 6 -12.342 5.679 9.333 1.00 0.00 C ATOM 1101 C VAL A 6 -12.643 6.014 7.874 1.00 0.00 C ATOM 1102 O VAL A 6 -13.123 7.088 7.572 1.00 0.00 O ATOM 1103 CB VAL A 6 -13.620 5.203 10.021 1.00 0.00 C ATOM 1104 CG1 VAL A 6 -13.325 4.929 11.496 1.00 0.00 C ATOM 1105 CG2 VAL A 6 -14.693 6.288 9.906 1.00 0.00 C ATOM 0 H VAL A 6 -12.514 7.702 9.976 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.592 4.891 9.397 1.00 0.00 H new ATOM 0 HB VAL A 6 -13.976 4.290 9.544 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -14.234 4.589 11.992 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -12.558 4.159 11.577 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -12.972 5.844 11.973 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -15.606 5.950 10.396 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -14.340 7.201 10.385 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -14.898 6.487 8.854 1.00 0.00 H new ATOM 1115 N CYS A 7 -12.376 5.126 6.958 1.00 0.00 N ATOM 1116 CA CYS A 7 -12.661 5.429 5.533 1.00 0.00 C ATOM 1117 C CYS A 7 -14.155 5.242 5.259 1.00 0.00 C ATOM 1118 O CYS A 7 -14.738 4.224 5.579 1.00 0.00 O ATOM 1119 CB CYS A 7 -11.833 4.482 4.667 1.00 0.00 C ATOM 1120 SG CYS A 7 -12.369 4.542 2.942 1.00 0.00 S ATOM 0 H CYS A 7 -11.974 4.206 7.136 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.397 6.461 5.300 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -10.779 4.752 4.733 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -11.926 3.464 5.045 1.00 0.00 H new ATOM 1125 N SER A 8 -14.780 6.241 4.706 1.00 0.00 N ATOM 1126 CA SER A 8 -16.245 6.174 4.443 1.00 0.00 C ATOM 1127 C SER A 8 -16.628 5.037 3.485 1.00 0.00 C ATOM 1128 O SER A 8 -17.637 4.390 3.679 1.00 0.00 O ATOM 1129 CB SER A 8 -16.695 7.508 3.855 1.00 0.00 C ATOM 1130 OG SER A 8 -16.520 8.521 4.834 1.00 0.00 O ATOM 0 H SER A 8 -14.334 7.113 4.421 1.00 0.00 H new ATOM 0 HA SER A 8 -16.744 5.971 5.390 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.115 7.742 2.962 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.740 7.453 3.551 1.00 0.00 H new ATOM 0 HG SER A 8 -15.565 8.710 4.942 1.00 0.00 H new ATOM 1136 N ASN A 9 -15.871 4.777 2.448 1.00 0.00 N ATOM 1137 CA ASN A 9 -16.282 3.678 1.527 1.00 0.00 C ATOM 1138 C ASN A 9 -15.912 2.342 2.151 1.00 0.00 C ATOM 1139 O ASN A 9 -16.658 1.387 2.066 1.00 0.00 O ATOM 1140 CB ASN A 9 -15.561 3.837 0.192 1.00 0.00 C ATOM 1141 CG ASN A 9 -16.181 5.000 -0.586 1.00 0.00 C ATOM 1142 OD1 ASN A 9 -15.542 6.008 -0.812 1.00 0.00 O ATOM 1143 ND2 ASN A 9 -17.412 4.900 -1.009 1.00 0.00 N ATOM 0 H ASN A 9 -15.009 5.265 2.205 1.00 0.00 H new ATOM 0 HA ASN A 9 -17.359 3.719 1.361 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -14.500 4.022 0.359 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -15.637 2.916 -0.387 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -17.837 5.668 -1.529 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -17.949 4.054 -0.820 1.00 0.00 H new ATOM 1150 N CYS A 10 -14.769 2.267 2.794 1.00 0.00 N ATOM 1151 CA CYS A 10 -14.356 0.992 3.447 1.00 0.00 C ATOM 1152 C CYS A 10 -13.905 1.305 4.875 1.00 0.00 C ATOM 1153 O CYS A 10 -12.769 1.551 5.156 1.00 0.00 O ATOM 1154 CB CYS A 10 -13.282 0.265 2.606 1.00 0.00 C ATOM 1155 SG CYS A 10 -11.606 0.879 2.937 1.00 0.00 S ATOM 0 H CYS A 10 -14.107 3.037 2.892 1.00 0.00 H new ATOM 0 HA CYS A 10 -15.195 0.298 3.504 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -13.322 -0.804 2.817 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -13.509 0.390 1.547 1.00 0.00 H new ATOM 1160 N GLN A 11 -14.878 1.287 5.743 1.00 0.00 N ATOM 1161 CA GLN A 11 -14.740 1.576 7.224 1.00 0.00 C ATOM 1162 C GLN A 11 -13.428 1.044 7.865 1.00 0.00 C ATOM 1163 O GLN A 11 -13.398 0.726 9.036 1.00 0.00 O ATOM 1164 CB GLN A 11 -15.938 0.922 7.934 1.00 0.00 C ATOM 1165 CG GLN A 11 -16.228 1.624 9.265 1.00 0.00 C ATOM 1166 CD GLN A 11 -16.845 2.996 8.994 1.00 0.00 C ATOM 1167 OE1 GLN A 11 -17.773 3.116 8.219 1.00 0.00 O ATOM 1168 NE2 GLN A 11 -16.368 4.045 9.605 1.00 0.00 N ATOM 0 H GLN A 11 -15.837 1.068 5.474 1.00 0.00 H new ATOM 0 HA GLN A 11 -14.711 2.659 7.341 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -16.818 0.970 7.292 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -15.730 -0.133 8.111 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -16.908 1.020 9.866 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -15.308 1.734 9.838 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -15.589 3.946 10.256 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -16.774 4.965 9.432 1.00 0.00 H new ATOM 1177 N THR A 12 -12.360 0.943 7.140 1.00 0.00 N ATOM 1178 CA THR A 12 -11.094 0.442 7.735 1.00 0.00 C ATOM 1179 C THR A 12 -10.492 1.519 8.636 1.00 0.00 C ATOM 1180 O THR A 12 -10.958 2.642 8.671 1.00 0.00 O ATOM 1181 CB THR A 12 -10.105 0.130 6.602 1.00 0.00 C ATOM 1182 OG1 THR A 12 -9.019 -0.625 7.120 1.00 0.00 O ATOM 1183 CG2 THR A 12 -9.572 1.426 5.968 1.00 0.00 C ATOM 0 H THR A 12 -12.305 1.187 6.151 1.00 0.00 H new ATOM 0 HA THR A 12 -11.293 -0.455 8.321 1.00 0.00 H new ATOM 0 HB THR A 12 -10.625 -0.442 5.834 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.387 -0.827 6.399 1.00 0.00 H new ATOM 0 HG21 THR A 12 -8.874 1.179 5.168 1.00 0.00 H new ATOM 0 HG22 THR A 12 -10.404 2.000 5.559 1.00 0.00 H new ATOM 0 HG23 THR A 12 -9.060 2.019 6.727 1.00 0.00 H new ATOM 1191 N SER A 13 -9.431 1.194 9.327 1.00 0.00 N ATOM 1192 CA SER A 13 -8.741 2.203 10.191 1.00 0.00 C ATOM 1193 C SER A 13 -7.256 2.164 9.833 1.00 0.00 C ATOM 1194 O SER A 13 -6.428 2.820 10.432 1.00 0.00 O ATOM 1195 CB SER A 13 -8.960 1.873 11.664 1.00 0.00 C ATOM 1196 OG SER A 13 -8.261 0.680 11.991 1.00 0.00 O ATOM 0 H SER A 13 -9.008 0.266 9.331 1.00 0.00 H new ATOM 0 HA SER A 13 -9.142 3.203 10.023 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.609 2.695 12.288 1.00 0.00 H new ATOM 0 HB3 SER A 13 -10.024 1.751 11.866 1.00 0.00 H new ATOM 0 HG SER A 13 -8.400 0.468 12.938 1.00 0.00 H new ATOM 1202 N THR A 14 -6.941 1.402 8.817 1.00 0.00 N ATOM 1203 CA THR A 14 -5.539 1.286 8.325 1.00 0.00 C ATOM 1204 C THR A 14 -5.501 1.854 6.910 1.00 0.00 C ATOM 1205 O THR A 14 -6.241 1.427 6.047 1.00 0.00 O ATOM 1206 CB THR A 14 -5.135 -0.190 8.287 1.00 0.00 C ATOM 1207 OG1 THR A 14 -6.114 -0.931 7.573 1.00 0.00 O ATOM 1208 CG2 THR A 14 -5.024 -0.722 9.716 1.00 0.00 C ATOM 0 H THR A 14 -7.616 0.842 8.296 1.00 0.00 H new ATOM 0 HA THR A 14 -4.854 1.826 8.979 1.00 0.00 H new ATOM 0 HB THR A 14 -4.172 -0.293 7.787 1.00 0.00 H new ATOM 0 HG1 THR A 14 -5.947 -1.890 7.689 1.00 0.00 H new ATOM 0 HG21 THR A 14 -4.736 -1.773 9.692 1.00 0.00 H new ATOM 0 HG22 THR A 14 -4.270 -0.152 10.259 1.00 0.00 H new ATOM 0 HG23 THR A 14 -5.986 -0.621 10.218 1.00 0.00 H new ATOM 1216 N THR A 15 -4.649 2.808 6.658 1.00 0.00 N ATOM 1217 CA THR A 15 -4.577 3.402 5.291 1.00 0.00 C ATOM 1218 C THR A 15 -3.154 3.858 5.006 1.00 0.00 C ATOM 1219 O THR A 15 -2.431 4.256 5.898 1.00 0.00 O ATOM 1220 CB THR A 15 -5.493 4.626 5.215 1.00 0.00 C ATOM 1221 OG1 THR A 15 -4.903 5.695 5.941 1.00 0.00 O ATOM 1222 CG2 THR A 15 -6.854 4.300 5.821 1.00 0.00 C ATOM 0 H THR A 15 -3.999 3.203 7.338 1.00 0.00 H new ATOM 0 HA THR A 15 -4.886 2.651 4.564 1.00 0.00 H new ATOM 0 HB THR A 15 -5.625 4.910 4.171 1.00 0.00 H new ATOM 0 HG1 THR A 15 -5.594 6.159 6.459 1.00 0.00 H new ATOM 0 HG21 THR A 15 -7.498 5.177 5.762 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.310 3.477 5.270 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.728 4.012 6.865 1.00 0.00 H new ATOM 1230 N THR A 16 -2.755 3.856 3.766 1.00 0.00 N ATOM 1231 CA THR A 16 -1.395 4.349 3.447 1.00 0.00 C ATOM 1232 C THR A 16 -1.451 5.880 3.422 1.00 0.00 C ATOM 1233 O THR A 16 -0.560 6.554 3.898 1.00 0.00 O ATOM 1234 CB THR A 16 -0.935 3.840 2.086 1.00 0.00 C ATOM 1235 OG1 THR A 16 -1.832 4.284 1.080 1.00 0.00 O ATOM 1236 CG2 THR A 16 -0.857 2.315 2.073 1.00 0.00 C ATOM 0 H THR A 16 -3.307 3.537 2.970 1.00 0.00 H new ATOM 0 HA THR A 16 -0.690 3.990 4.197 1.00 0.00 H new ATOM 0 HB THR A 16 0.061 4.237 1.888 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.853 3.632 0.349 1.00 0.00 H new ATOM 0 HG21 THR A 16 -0.527 1.976 1.091 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.148 1.980 2.830 1.00 0.00 H new ATOM 0 HG23 THR A 16 -1.841 1.899 2.288 1.00 0.00 H new ATOM 1244 N LEU A 17 -2.522 6.433 2.888 1.00 0.00 N ATOM 1245 CA LEU A 17 -2.668 7.924 2.852 1.00 0.00 C ATOM 1246 C LEU A 17 -4.154 8.271 3.055 1.00 0.00 C ATOM 1247 O LEU A 17 -5.017 7.734 2.390 1.00 0.00 O ATOM 1248 CB LEU A 17 -2.179 8.485 1.491 1.00 0.00 C ATOM 1249 CG LEU A 17 -1.521 9.861 1.683 1.00 0.00 C ATOM 1250 CD1 LEU A 17 -0.230 9.723 2.532 1.00 0.00 C ATOM 1251 CD2 LEU A 17 -1.203 10.475 0.297 1.00 0.00 C ATOM 0 H LEU A 17 -3.298 5.914 2.477 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.063 8.370 3.641 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.466 7.794 1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.020 8.570 0.802 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.206 10.522 2.214 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.227 10.704 2.661 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.479 9.307 3.508 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.471 9.060 2.024 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -0.736 11.451 0.430 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.522 9.818 -0.245 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.126 10.589 -0.271 1.00 0.00 H new ATOM 1263 N TRP A 18 -4.460 9.169 3.956 1.00 0.00 N ATOM 1264 CA TRP A 18 -5.888 9.546 4.176 1.00 0.00 C ATOM 1265 C TRP A 18 -6.297 10.585 3.123 1.00 0.00 C ATOM 1266 O TRP A 18 -5.638 11.588 2.940 1.00 0.00 O ATOM 1267 CB TRP A 18 -6.047 10.158 5.579 1.00 0.00 C ATOM 1268 CG TRP A 18 -6.129 9.074 6.616 1.00 0.00 C ATOM 1269 CD1 TRP A 18 -5.189 8.836 7.558 1.00 0.00 C ATOM 1270 CD2 TRP A 18 -7.187 8.088 6.838 1.00 0.00 C ATOM 1271 NE1 TRP A 18 -5.598 7.770 8.341 1.00 0.00 N ATOM 1272 CE2 TRP A 18 -6.820 7.276 7.938 1.00 0.00 C ATOM 1273 CE3 TRP A 18 -8.415 7.819 6.201 1.00 0.00 C ATOM 1274 CZ2 TRP A 18 -7.635 6.240 8.392 1.00 0.00 C ATOM 1275 CZ3 TRP A 18 -9.240 6.771 6.658 1.00 0.00 C ATOM 1276 CH2 TRP A 18 -8.849 5.986 7.751 1.00 0.00 C ATOM 0 H TRP A 18 -3.786 9.656 4.547 1.00 0.00 H new ATOM 0 HA TRP A 18 -6.519 8.661 4.092 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -5.203 10.814 5.795 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -6.946 10.773 5.615 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.269 9.388 7.680 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -5.060 7.395 9.122 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -8.726 8.419 5.358 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -7.329 5.638 9.235 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -10.179 6.572 6.163 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -9.486 5.185 8.097 1.00 0.00 H new ATOM 1287 N ARG A 19 -7.374 10.340 2.422 1.00 0.00 N ATOM 1288 CA ARG A 19 -7.842 11.290 1.361 1.00 0.00 C ATOM 1289 C ARG A 19 -9.189 11.922 1.748 1.00 0.00 C ATOM 1290 O ARG A 19 -10.173 11.235 1.891 1.00 0.00 O ATOM 1291 CB ARG A 19 -8.043 10.490 0.057 1.00 0.00 C ATOM 1292 CG ARG A 19 -6.705 10.292 -0.680 1.00 0.00 C ATOM 1293 CD ARG A 19 -6.329 11.563 -1.457 1.00 0.00 C ATOM 1294 NE ARG A 19 -5.424 11.208 -2.605 1.00 0.00 N ATOM 1295 CZ ARG A 19 -4.309 10.541 -2.432 1.00 0.00 C ATOM 1296 NH1 ARG A 19 -3.857 10.291 -1.236 1.00 0.00 N ATOM 1297 NH2 ARG A 19 -3.614 10.164 -3.471 1.00 0.00 N ATOM 0 H ARG A 19 -7.958 9.512 2.539 1.00 0.00 H new ATOM 0 HA ARG A 19 -7.102 12.080 1.239 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -8.484 9.520 0.286 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -8.745 11.014 -0.591 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -5.920 10.050 0.037 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -6.781 9.448 -1.366 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -7.229 12.053 -1.829 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -5.831 12.271 -0.795 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.686 11.495 -3.548 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.372 10.616 -0.418 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -2.988 9.771 -1.118 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.939 10.389 -4.411 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.746 9.645 -3.343 1.00 0.00 H new ATOM 1311 N ARG A 20 -9.266 13.218 1.881 1.00 0.00 N ATOM 1312 CA ARG A 20 -10.589 13.832 2.202 1.00 0.00 C ATOM 1313 C ARG A 20 -11.452 13.713 0.937 1.00 0.00 C ATOM 1314 O ARG A 20 -10.957 13.860 -0.163 1.00 0.00 O ATOM 1315 CB ARG A 20 -10.403 15.310 2.570 1.00 0.00 C ATOM 1316 CG ARG A 20 -11.714 15.904 3.115 1.00 0.00 C ATOM 1317 CD ARG A 20 -11.905 15.533 4.590 1.00 0.00 C ATOM 1318 NE ARG A 20 -13.030 16.327 5.157 1.00 0.00 N ATOM 1319 CZ ARG A 20 -13.593 15.950 6.272 1.00 0.00 C ATOM 1320 NH1 ARG A 20 -13.177 14.870 6.876 1.00 0.00 N ATOM 1321 NH2 ARG A 20 -14.571 16.648 6.781 1.00 0.00 N ATOM 0 H ARG A 20 -8.487 13.869 1.784 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.060 13.330 3.047 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -9.615 15.408 3.317 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -10.081 15.871 1.692 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -11.700 16.988 3.006 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -12.557 15.536 2.530 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -12.113 14.467 4.684 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -10.989 15.729 5.148 1.00 0.00 H new ATOM 0 HE ARG A 20 -13.360 17.163 4.675 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -12.414 14.324 6.476 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -13.615 14.572 7.748 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -14.897 17.490 6.307 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -15.010 16.351 7.653 1.00 0.00 H new ATOM 1335 N SER A 21 -12.726 13.435 1.066 1.00 0.00 N ATOM 1336 CA SER A 21 -13.588 13.295 -0.159 1.00 0.00 C ATOM 1337 C SER A 21 -14.205 14.659 -0.520 1.00 0.00 C ATOM 1338 O SER A 21 -14.369 15.500 0.335 1.00 0.00 O ATOM 1339 CB SER A 21 -14.696 12.270 0.125 1.00 0.00 C ATOM 1340 OG SER A 21 -14.181 10.958 -0.058 1.00 0.00 O ATOM 0 H SER A 21 -13.207 13.299 1.955 1.00 0.00 H new ATOM 0 HA SER A 21 -12.984 12.953 -1.000 1.00 0.00 H new ATOM 0 HB2 SER A 21 -15.065 12.389 1.144 1.00 0.00 H new ATOM 0 HB3 SER A 21 -15.542 12.437 -0.542 1.00 0.00 H new ATOM 0 HG SER A 21 -14.886 10.302 0.124 1.00 0.00 H new ATOM 1346 N PRO A 22 -14.551 14.886 -1.774 1.00 0.00 N ATOM 1347 CA PRO A 22 -15.173 16.181 -2.178 1.00 0.00 C ATOM 1348 C PRO A 22 -16.325 16.596 -1.244 1.00 0.00 C ATOM 1349 O PRO A 22 -16.647 17.761 -1.113 1.00 0.00 O ATOM 1350 CB PRO A 22 -15.703 15.861 -3.593 1.00 0.00 C ATOM 1351 CG PRO A 22 -15.089 14.524 -4.055 1.00 0.00 C ATOM 1352 CD PRO A 22 -14.337 13.895 -2.871 1.00 0.00 C ATOM 0 HA PRO A 22 -14.474 17.016 -2.138 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -16.791 15.795 -3.584 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -15.438 16.659 -4.286 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -15.870 13.851 -4.408 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -14.409 14.689 -4.891 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -14.737 12.915 -2.613 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -13.278 13.759 -3.091 1.00 0.00 H new ATOM 1360 N MET A 23 -16.951 15.637 -0.610 1.00 0.00 N ATOM 1361 CA MET A 23 -18.092 15.942 0.306 1.00 0.00 C ATOM 1362 C MET A 23 -17.565 16.169 1.724 1.00 0.00 C ATOM 1363 O MET A 23 -18.252 16.684 2.583 1.00 0.00 O ATOM 1364 CB MET A 23 -19.047 14.747 0.300 1.00 0.00 C ATOM 1365 CG MET A 23 -19.625 14.572 -1.106 1.00 0.00 C ATOM 1366 SD MET A 23 -20.740 13.148 -1.133 1.00 0.00 S ATOM 1367 CE MET A 23 -21.131 13.205 -2.899 1.00 0.00 C ATOM 0 H MET A 23 -16.718 14.647 -0.689 1.00 0.00 H new ATOM 0 HA MET A 23 -18.611 16.841 -0.027 1.00 0.00 H new ATOM 0 HB2 MET A 23 -18.519 13.843 0.604 1.00 0.00 H new ATOM 0 HB3 MET A 23 -19.850 14.905 1.019 1.00 0.00 H new ATOM 0 HG2 MET A 23 -20.162 15.473 -1.404 1.00 0.00 H new ATOM 0 HG3 MET A 23 -18.819 14.429 -1.826 1.00 0.00 H new ATOM 0 HE1 MET A 23 -21.820 12.397 -3.145 1.00 0.00 H new ATOM 0 HE2 MET A 23 -21.593 14.163 -3.139 1.00 0.00 H new ATOM 0 HE3 MET A 23 -20.215 13.089 -3.478 1.00 0.00 H new ATOM 1377 N GLY A 24 -16.346 15.775 1.969 1.00 0.00 N ATOM 1378 CA GLY A 24 -15.742 15.945 3.324 1.00 0.00 C ATOM 1379 C GLY A 24 -15.819 14.619 4.080 1.00 0.00 C ATOM 1380 O GLY A 24 -15.712 14.579 5.289 1.00 0.00 O ATOM 0 H GLY A 24 -15.734 15.337 1.281 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.704 16.266 3.235 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.270 16.723 3.876 1.00 0.00 H new ATOM 1384 N ASP A 25 -16.007 13.528 3.379 1.00 0.00 N ATOM 1385 CA ASP A 25 -16.096 12.197 4.050 1.00 0.00 C ATOM 1386 C ASP A 25 -14.709 11.513 4.035 1.00 0.00 C ATOM 1387 O ASP A 25 -14.227 11.150 2.981 1.00 0.00 O ATOM 1388 CB ASP A 25 -17.067 11.324 3.252 1.00 0.00 C ATOM 1389 CG ASP A 25 -18.345 12.110 2.958 1.00 0.00 C ATOM 1390 OD1 ASP A 25 -18.589 13.087 3.644 1.00 0.00 O ATOM 1391 OD2 ASP A 25 -19.060 11.718 2.049 1.00 0.00 O ATOM 0 H ASP A 25 -16.103 13.504 2.364 1.00 0.00 H new ATOM 0 HA ASP A 25 -16.434 12.324 5.079 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -16.602 11.005 2.319 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -17.305 10.421 3.814 1.00 0.00 H new ATOM 1396 N PRO A 26 -14.057 11.315 5.168 1.00 0.00 N ATOM 1397 CA PRO A 26 -12.719 10.644 5.171 1.00 0.00 C ATOM 1398 C PRO A 26 -12.697 9.322 4.373 1.00 0.00 C ATOM 1399 O PRO A 26 -13.515 8.448 4.583 1.00 0.00 O ATOM 1400 CB PRO A 26 -12.508 10.391 6.674 1.00 0.00 C ATOM 1401 CG PRO A 26 -13.403 11.377 7.432 1.00 0.00 C ATOM 1402 CD PRO A 26 -14.572 11.736 6.507 1.00 0.00 C ATOM 0 HA PRO A 26 -11.943 11.242 4.692 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -12.765 9.363 6.930 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -11.462 10.535 6.945 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -13.768 10.931 8.357 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -12.843 12.270 7.708 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -15.484 11.204 6.778 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -14.803 12.801 6.538 1.00 0.00 H new ATOM 1410 N VAL A 27 -11.732 9.159 3.494 1.00 0.00 N ATOM 1411 CA VAL A 27 -11.609 7.875 2.718 1.00 0.00 C ATOM 1412 C VAL A 27 -10.140 7.466 2.666 1.00 0.00 C ATOM 1413 O VAL A 27 -9.253 8.295 2.730 1.00 0.00 O ATOM 1414 CB VAL A 27 -12.173 7.996 1.291 1.00 0.00 C ATOM 1415 CG1 VAL A 27 -13.700 7.860 1.330 1.00 0.00 C ATOM 1416 CG2 VAL A 27 -11.783 9.341 0.678 1.00 0.00 C ATOM 0 H VAL A 27 -11.023 9.860 3.279 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.199 7.114 3.229 1.00 0.00 H new ATOM 0 HB VAL A 27 -11.755 7.200 0.675 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.099 7.946 0.319 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -13.968 6.888 1.745 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -14.120 8.649 1.954 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.189 9.412 -0.331 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.185 10.149 1.289 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -10.697 9.422 0.639 1.00 0.00 H new ATOM 1426 N CYS A 28 -9.869 6.195 2.537 1.00 0.00 N ATOM 1427 CA CYS A 28 -8.458 5.745 2.468 1.00 0.00 C ATOM 1428 C CYS A 28 -7.942 6.023 1.057 1.00 0.00 C ATOM 1429 O CYS A 28 -8.703 6.334 0.163 1.00 0.00 O ATOM 1430 CB CYS A 28 -8.365 4.247 2.793 1.00 0.00 C ATOM 1431 SG CYS A 28 -9.065 3.270 1.441 1.00 0.00 S ATOM 0 H CYS A 28 -10.566 5.453 2.477 1.00 0.00 H new ATOM 0 HA CYS A 28 -7.851 6.282 3.197 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -7.324 3.966 2.953 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -8.899 4.035 3.719 1.00 0.00 H new ATOM 1436 N ASN A 29 -6.660 5.971 0.860 1.00 0.00 N ATOM 1437 CA ASN A 29 -6.102 6.294 -0.483 1.00 0.00 C ATOM 1438 C ASN A 29 -6.744 5.431 -1.578 1.00 0.00 C ATOM 1439 O ASN A 29 -7.035 5.910 -2.655 1.00 0.00 O ATOM 1440 CB ASN A 29 -4.594 6.053 -0.475 1.00 0.00 C ATOM 1441 CG ASN A 29 -3.993 6.581 -1.776 1.00 0.00 C ATOM 1442 OD1 ASN A 29 -4.633 6.556 -2.809 1.00 0.00 O ATOM 1443 ND2 ASN A 29 -2.784 7.071 -1.771 1.00 0.00 N ATOM 0 H ASN A 29 -5.971 5.719 1.569 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.319 7.340 -0.699 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.138 6.554 0.379 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -4.385 4.989 -0.370 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.377 7.433 -2.633 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -2.246 7.093 -0.905 1.00 0.00 H new ATOM 1450 N ALA A 30 -6.948 4.168 -1.334 1.00 0.00 N ATOM 1451 CA ALA A 30 -7.548 3.300 -2.390 1.00 0.00 C ATOM 1452 C ALA A 30 -8.941 3.804 -2.795 1.00 0.00 C ATOM 1453 O ALA A 30 -9.185 4.108 -3.945 1.00 0.00 O ATOM 1454 CB ALA A 30 -7.665 1.878 -1.858 1.00 0.00 C ATOM 0 H ALA A 30 -6.728 3.699 -0.455 1.00 0.00 H new ATOM 0 HA ALA A 30 -6.903 3.327 -3.268 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -8.103 1.238 -2.624 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -6.675 1.505 -1.596 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.301 1.872 -0.973 1.00 0.00 H new ATOM 1460 N CYS A 31 -9.863 3.870 -1.870 1.00 0.00 N ATOM 1461 CA CYS A 31 -11.243 4.326 -2.222 1.00 0.00 C ATOM 1462 C CYS A 31 -11.212 5.739 -2.784 1.00 0.00 C ATOM 1463 O CYS A 31 -11.926 6.063 -3.701 1.00 0.00 O ATOM 1464 CB CYS A 31 -12.129 4.350 -0.982 1.00 0.00 C ATOM 1465 SG CYS A 31 -12.284 2.696 -0.275 1.00 0.00 S ATOM 0 H CYS A 31 -9.722 3.629 -0.889 1.00 0.00 H new ATOM 0 HA CYS A 31 -11.637 3.629 -2.962 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -11.708 5.029 -0.241 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -13.116 4.734 -1.242 1.00 0.00 H new ATOM 1470 N GLY A 32 -10.411 6.593 -2.230 1.00 0.00 N ATOM 1471 CA GLY A 32 -10.379 7.989 -2.736 1.00 0.00 C ATOM 1472 C GLY A 32 -10.066 7.989 -4.232 1.00 0.00 C ATOM 1473 O GLY A 32 -10.747 8.619 -5.017 1.00 0.00 O ATOM 0 H GLY A 32 -9.780 6.391 -1.454 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.339 8.473 -2.556 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -9.626 8.564 -2.197 1.00 0.00 H new ATOM 1477 N LEU A 33 -9.040 7.294 -4.633 1.00 0.00 N ATOM 1478 CA LEU A 33 -8.681 7.261 -6.080 1.00 0.00 C ATOM 1479 C LEU A 33 -9.776 6.572 -6.893 1.00 0.00 C ATOM 1480 O LEU A 33 -10.246 7.099 -7.881 1.00 0.00 O ATOM 1481 CB LEU A 33 -7.386 6.472 -6.253 1.00 0.00 C ATOM 1482 CG LEU A 33 -6.246 7.156 -5.491 1.00 0.00 C ATOM 1483 CD1 LEU A 33 -5.036 6.219 -5.467 1.00 0.00 C ATOM 1484 CD2 LEU A 33 -5.868 8.483 -6.178 1.00 0.00 C ATOM 0 H LEU A 33 -8.433 6.747 -4.023 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.563 8.286 -6.432 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.520 5.454 -5.886 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.134 6.399 -7.311 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.567 7.373 -4.472 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.218 6.695 -4.927 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.306 5.288 -4.969 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.721 6.005 -6.488 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.057 8.960 -5.627 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.545 8.285 -7.200 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.734 9.145 -6.193 1.00 0.00 H new ATOM 1496 N TYR A 34 -10.184 5.401 -6.500 1.00 0.00 N ATOM 1497 CA TYR A 34 -11.240 4.702 -7.276 1.00 0.00 C ATOM 1498 C TYR A 34 -12.516 5.550 -7.297 1.00 0.00 C ATOM 1499 O TYR A 34 -13.156 5.699 -8.318 1.00 0.00 O ATOM 1500 CB TYR A 34 -11.539 3.327 -6.662 1.00 0.00 C ATOM 1501 CG TYR A 34 -12.782 2.772 -7.314 1.00 0.00 C ATOM 1502 CD1 TYR A 34 -14.034 3.151 -6.826 1.00 0.00 C ATOM 1503 CD2 TYR A 34 -12.687 1.918 -8.418 1.00 0.00 C ATOM 1504 CE1 TYR A 34 -15.194 2.679 -7.439 1.00 0.00 C ATOM 1505 CE2 TYR A 34 -13.854 1.440 -9.029 1.00 0.00 C ATOM 1506 CZ TYR A 34 -15.107 1.823 -8.539 1.00 0.00 C ATOM 1507 OH TYR A 34 -16.258 1.361 -9.143 1.00 0.00 O ATOM 0 H TYR A 34 -9.835 4.901 -5.682 1.00 0.00 H new ATOM 0 HA TYR A 34 -10.885 4.558 -8.296 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -10.697 2.652 -6.816 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -11.683 3.416 -5.585 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -14.104 3.810 -5.973 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -11.718 1.628 -8.798 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -16.162 2.976 -7.062 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -13.786 0.776 -9.878 1.00 0.00 H new ATOM 0 HH TYR A 34 -16.022 0.777 -9.894 1.00 0.00 H new ATOM 1517 N TYR A 35 -12.900 6.091 -6.177 1.00 0.00 N ATOM 1518 CA TYR A 35 -14.142 6.906 -6.134 1.00 0.00 C ATOM 1519 C TYR A 35 -14.002 8.091 -7.091 1.00 0.00 C ATOM 1520 O TYR A 35 -14.895 8.421 -7.826 1.00 0.00 O ATOM 1521 CB TYR A 35 -14.364 7.418 -4.705 1.00 0.00 C ATOM 1522 CG TYR A 35 -15.795 7.868 -4.553 1.00 0.00 C ATOM 1523 CD1 TYR A 35 -16.163 9.143 -4.977 1.00 0.00 C ATOM 1524 CD2 TYR A 35 -16.748 7.008 -3.993 1.00 0.00 C ATOM 1525 CE1 TYR A 35 -17.490 9.570 -4.842 1.00 0.00 C ATOM 1526 CE2 TYR A 35 -18.076 7.429 -3.858 1.00 0.00 C ATOM 1527 CZ TYR A 35 -18.448 8.713 -4.283 1.00 0.00 C ATOM 1528 OH TYR A 35 -19.757 9.134 -4.151 1.00 0.00 O ATOM 0 H TYR A 35 -12.407 6.004 -5.289 1.00 0.00 H new ATOM 0 HA TYR A 35 -14.994 6.296 -6.435 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -14.140 6.630 -3.985 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -13.686 8.245 -4.493 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -15.425 9.802 -5.410 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -16.458 6.020 -3.665 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -17.775 10.559 -5.168 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -18.813 6.767 -3.428 1.00 0.00 H new ATOM 0 HH TYR A 35 -20.291 8.419 -3.746 1.00 0.00 H new ATOM 1538 N LYS A 36 -12.888 8.737 -7.097 1.00 0.00 N ATOM 1539 CA LYS A 36 -12.727 9.890 -8.020 1.00 0.00 C ATOM 1540 C LYS A 36 -12.898 9.424 -9.471 1.00 0.00 C ATOM 1541 O LYS A 36 -13.566 10.062 -10.260 1.00 0.00 O ATOM 1542 CB LYS A 36 -11.319 10.457 -7.828 1.00 0.00 C ATOM 1543 CG LYS A 36 -11.065 11.606 -8.813 1.00 0.00 C ATOM 1544 CD LYS A 36 -9.705 12.262 -8.522 1.00 0.00 C ATOM 1545 CE LYS A 36 -8.563 11.450 -9.160 1.00 0.00 C ATOM 1546 NZ LYS A 36 -8.512 11.726 -10.625 1.00 0.00 N ATOM 0 H LYS A 36 -12.081 8.525 -6.510 1.00 0.00 H new ATOM 0 HA LYS A 36 -13.478 10.651 -7.806 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -11.200 10.814 -6.805 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -10.580 9.670 -7.979 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.084 11.229 -9.836 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -11.860 12.347 -8.731 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -9.696 13.280 -8.911 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -9.552 12.331 -7.445 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -7.612 11.714 -8.697 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -8.718 10.385 -8.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -7.644 11.315 -11.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -9.341 11.302 -11.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -8.515 12.754 -10.785 1.00 0.00 H new ATOM 1560 N LEU A 37 -12.289 8.332 -9.834 1.00 0.00 N ATOM 1561 CA LEU A 37 -12.402 7.843 -11.242 1.00 0.00 C ATOM 1562 C LEU A 37 -13.810 7.296 -11.546 1.00 0.00 C ATOM 1563 O LEU A 37 -14.339 7.524 -12.617 1.00 0.00 O ATOM 1564 CB LEU A 37 -11.353 6.730 -11.469 1.00 0.00 C ATOM 1565 CG LEU A 37 -10.025 7.324 -11.966 1.00 0.00 C ATOM 1566 CD1 LEU A 37 -9.369 8.150 -10.856 1.00 0.00 C ATOM 1567 CD2 LEU A 37 -9.090 6.180 -12.366 1.00 0.00 C ATOM 0 H LEU A 37 -11.717 7.754 -9.219 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.223 8.683 -11.913 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.188 6.185 -10.540 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -11.730 6.012 -12.197 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.216 7.971 -12.822 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.429 8.566 -11.219 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.036 8.961 -10.564 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -9.174 7.512 -9.994 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.144 6.590 -12.720 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -8.907 5.540 -11.502 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.552 5.594 -13.160 1.00 0.00 H new ATOM 1579 N HIS A 38 -14.401 6.542 -10.646 1.00 0.00 N ATOM 1580 CA HIS A 38 -15.754 5.938 -10.924 1.00 0.00 C ATOM 1581 C HIS A 38 -16.854 6.546 -10.039 1.00 0.00 C ATOM 1582 O HIS A 38 -18.021 6.312 -10.265 1.00 0.00 O ATOM 1583 CB HIS A 38 -15.677 4.433 -10.666 1.00 0.00 C ATOM 1584 CG HIS A 38 -14.670 3.809 -11.596 1.00 0.00 C ATOM 1585 ND1 HIS A 38 -15.043 3.171 -12.770 1.00 0.00 N ATOM 1586 CD2 HIS A 38 -13.301 3.708 -11.535 1.00 0.00 C ATOM 1587 CE1 HIS A 38 -13.921 2.717 -13.359 1.00 0.00 C ATOM 1588 NE2 HIS A 38 -12.831 3.017 -12.648 1.00 0.00 N ATOM 0 H HIS A 38 -14.009 6.317 -9.732 1.00 0.00 H new ATOM 0 HA HIS A 38 -16.013 6.148 -11.962 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -15.394 4.246 -9.630 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -16.656 3.978 -10.816 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -12.683 4.105 -10.743 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -13.904 2.176 -14.293 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -11.862 2.789 -12.872 1.00 0.00 H new ATOM 1596 N GLN A 39 -16.514 7.326 -9.051 1.00 0.00 N ATOM 1597 CA GLN A 39 -17.539 7.961 -8.158 1.00 0.00 C ATOM 1598 C GLN A 39 -18.708 7.028 -7.817 1.00 0.00 C ATOM 1599 O GLN A 39 -19.861 7.413 -7.833 1.00 0.00 O ATOM 1600 CB GLN A 39 -18.017 9.286 -8.761 1.00 0.00 C ATOM 1601 CG GLN A 39 -18.772 9.045 -10.074 1.00 0.00 C ATOM 1602 CD GLN A 39 -19.371 10.364 -10.561 1.00 0.00 C ATOM 1603 OE1 GLN A 39 -18.775 11.411 -10.402 1.00 0.00 O ATOM 1604 NE2 GLN A 39 -20.534 10.359 -11.151 1.00 0.00 N ATOM 0 H GLN A 39 -15.549 7.558 -8.816 1.00 0.00 H new ATOM 0 HA GLN A 39 -17.053 8.168 -7.205 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -18.666 9.800 -8.052 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -17.162 9.938 -8.942 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -18.096 8.639 -10.827 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -19.561 8.308 -9.924 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -21.034 9.480 -11.285 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -20.943 11.234 -11.479 1.00 0.00 H new ATOM 1613 N VAL A 40 -18.404 5.821 -7.425 1.00 0.00 N ATOM 1614 CA VAL A 40 -19.452 4.861 -6.990 1.00 0.00 C ATOM 1615 C VAL A 40 -18.899 4.107 -5.783 1.00 0.00 C ATOM 1616 O VAL A 40 -17.705 3.958 -5.632 1.00 0.00 O ATOM 1617 CB VAL A 40 -19.803 3.879 -8.106 1.00 0.00 C ATOM 1618 CG1 VAL A 40 -20.571 4.610 -9.207 1.00 0.00 C ATOM 1619 CG2 VAL A 40 -18.532 3.247 -8.682 1.00 0.00 C ATOM 0 H VAL A 40 -17.453 5.455 -7.388 1.00 0.00 H new ATOM 0 HA VAL A 40 -20.366 5.397 -6.736 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.427 3.085 -7.696 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -20.821 3.909 -10.003 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -21.487 5.031 -8.793 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -19.953 5.412 -9.611 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -18.800 2.550 -9.476 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -17.889 4.028 -9.087 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -18.002 2.713 -7.894 1.00 0.00 H new ATOM 1629 N ASN A 41 -19.742 3.656 -4.903 1.00 0.00 N ATOM 1630 CA ASN A 41 -19.232 2.938 -3.691 1.00 0.00 C ATOM 1631 C ASN A 41 -19.022 1.450 -4.006 1.00 0.00 C ATOM 1632 O ASN A 41 -19.891 0.794 -4.545 1.00 0.00 O ATOM 1633 CB ASN A 41 -20.240 3.087 -2.550 1.00 0.00 C ATOM 1634 CG ASN A 41 -21.527 2.340 -2.899 1.00 0.00 C ATOM 1635 OD1 ASN A 41 -21.812 2.107 -4.057 1.00 0.00 O ATOM 1636 ND2 ASN A 41 -22.321 1.952 -1.940 1.00 0.00 N ATOM 0 H ASN A 41 -20.756 3.749 -4.962 1.00 0.00 H new ATOM 0 HA ASN A 41 -18.277 3.372 -3.394 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -19.818 2.692 -1.626 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -20.455 4.141 -2.378 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.182 1.452 -2.162 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -22.081 2.148 -0.968 1.00 0.00 H new ATOM 1643 N ARG A 42 -17.863 0.915 -3.679 1.00 0.00 N ATOM 1644 CA ARG A 42 -17.572 -0.532 -3.963 1.00 0.00 C ATOM 1645 C ARG A 42 -17.606 -1.345 -2.645 1.00 0.00 C ATOM 1646 O ARG A 42 -17.290 -0.819 -1.596 1.00 0.00 O ATOM 1647 CB ARG A 42 -16.168 -0.635 -4.570 1.00 0.00 C ATOM 1648 CG ARG A 42 -16.158 -0.033 -5.986 1.00 0.00 C ATOM 1649 CD ARG A 42 -16.985 -0.900 -6.961 1.00 0.00 C ATOM 1650 NE ARG A 42 -18.305 -0.252 -7.196 1.00 0.00 N ATOM 1651 CZ ARG A 42 -19.062 -0.663 -8.176 1.00 0.00 C ATOM 1652 NH1 ARG A 42 -18.652 -1.627 -8.954 1.00 0.00 N ATOM 1653 NH2 ARG A 42 -20.226 -0.110 -8.381 1.00 0.00 N ATOM 0 H ARG A 42 -17.103 1.422 -3.225 1.00 0.00 H new ATOM 0 HA ARG A 42 -18.320 -0.928 -4.650 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -15.451 -0.110 -3.938 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -15.856 -1.679 -4.608 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -16.564 0.978 -5.958 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -15.132 0.046 -6.344 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -16.451 -1.017 -7.904 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -17.126 -1.899 -6.548 1.00 0.00 H new ATOM 0 HE ARG A 42 -18.616 0.510 -6.593 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -17.741 -2.058 -8.795 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -19.242 -1.950 -9.721 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -20.546 0.645 -7.775 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -20.816 -0.433 -9.148 1.00 0.00 H new ATOM 1667 N PRO A 43 -17.971 -2.619 -2.687 1.00 0.00 N ATOM 1668 CA PRO A 43 -18.007 -3.460 -1.447 1.00 0.00 C ATOM 1669 C PRO A 43 -16.634 -3.578 -0.762 1.00 0.00 C ATOM 1670 O PRO A 43 -15.599 -3.483 -1.392 1.00 0.00 O ATOM 1671 CB PRO A 43 -18.486 -4.830 -1.973 1.00 0.00 C ATOM 1672 CG PRO A 43 -18.500 -4.781 -3.510 1.00 0.00 C ATOM 1673 CD PRO A 43 -18.374 -3.311 -3.946 1.00 0.00 C ATOM 0 HA PRO A 43 -18.651 -3.032 -0.679 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -17.824 -5.623 -1.625 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -19.482 -5.056 -1.592 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -17.678 -5.370 -3.916 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -19.423 -5.214 -3.896 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -17.629 -3.186 -4.731 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -19.316 -2.924 -4.335 1.00 0.00 H new ATOM 1681 N LEU A 44 -16.632 -3.791 0.526 1.00 0.00 N ATOM 1682 CA LEU A 44 -15.350 -3.927 1.278 1.00 0.00 C ATOM 1683 C LEU A 44 -14.578 -5.150 0.778 1.00 0.00 C ATOM 1684 O LEU A 44 -13.570 -5.532 1.339 1.00 0.00 O ATOM 1685 CB LEU A 44 -15.660 -4.092 2.771 1.00 0.00 C ATOM 1686 CG LEU A 44 -16.076 -2.735 3.364 1.00 0.00 C ATOM 1687 CD1 LEU A 44 -17.521 -2.398 2.963 1.00 0.00 C ATOM 1688 CD2 LEU A 44 -15.976 -2.788 4.893 1.00 0.00 C ATOM 0 H LEU A 44 -17.473 -3.878 1.096 1.00 0.00 H new ATOM 0 HA LEU A 44 -14.742 -3.036 1.122 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -16.459 -4.821 2.909 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -14.784 -4.476 3.294 1.00 0.00 H new ATOM 0 HG LEU A 44 -15.409 -1.965 2.977 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -17.802 -1.435 3.390 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -17.595 -2.349 1.877 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -18.192 -3.171 3.338 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -16.271 -1.825 5.311 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -16.637 -3.567 5.274 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -14.949 -3.010 5.183 1.00 0.00 H new ATOM 1700 N THR A 45 -15.039 -5.767 -0.272 1.00 0.00 N ATOM 1701 CA THR A 45 -14.325 -6.958 -0.803 1.00 0.00 C ATOM 1702 C THR A 45 -12.944 -6.535 -1.308 1.00 0.00 C ATOM 1703 O THR A 45 -12.090 -7.357 -1.571 1.00 0.00 O ATOM 1704 CB THR A 45 -15.136 -7.568 -1.949 1.00 0.00 C ATOM 1705 OG1 THR A 45 -15.477 -6.549 -2.880 1.00 0.00 O ATOM 1706 CG2 THR A 45 -16.412 -8.202 -1.391 1.00 0.00 C ATOM 0 H THR A 45 -15.879 -5.498 -0.785 1.00 0.00 H new ATOM 0 HA THR A 45 -14.207 -7.701 -0.014 1.00 0.00 H new ATOM 0 HB THR A 45 -14.542 -8.333 -2.449 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.995 -6.938 -3.616 1.00 0.00 H new ATOM 0 HG21 THR A 45 -16.989 -8.636 -2.207 1.00 0.00 H new ATOM 0 HG22 THR A 45 -16.148 -8.983 -0.677 1.00 0.00 H new ATOM 0 HG23 THR A 45 -17.008 -7.439 -0.890 1.00 0.00 H new ATOM 1714 N MET A 46 -12.716 -5.252 -1.444 1.00 0.00 N ATOM 1715 CA MET A 46 -11.382 -4.769 -1.929 1.00 0.00 C ATOM 1716 C MET A 46 -10.531 -4.369 -0.729 1.00 0.00 C ATOM 1717 O MET A 46 -9.320 -4.306 -0.793 1.00 0.00 O ATOM 1718 CB MET A 46 -11.588 -3.553 -2.836 1.00 0.00 C ATOM 1719 CG MET A 46 -12.171 -4.012 -4.173 1.00 0.00 C ATOM 1720 SD MET A 46 -10.911 -4.929 -5.101 1.00 0.00 S ATOM 1721 CE MET A 46 -9.829 -3.531 -5.513 1.00 0.00 C ATOM 0 H MET A 46 -13.394 -4.517 -1.241 1.00 0.00 H new ATOM 0 HA MET A 46 -10.880 -5.560 -2.487 1.00 0.00 H new ATOM 0 HB2 MET A 46 -12.260 -2.839 -2.359 1.00 0.00 H new ATOM 0 HB3 MET A 46 -10.640 -3.040 -2.997 1.00 0.00 H new ATOM 0 HG2 MET A 46 -13.044 -4.643 -4.004 1.00 0.00 H new ATOM 0 HG3 MET A 46 -12.507 -3.151 -4.750 1.00 0.00 H new ATOM 0 HE1 MET A 46 -9.300 -3.742 -6.443 1.00 0.00 H new ATOM 0 HE2 MET A 46 -10.429 -2.629 -5.633 1.00 0.00 H new ATOM 0 HE3 MET A 46 -9.106 -3.381 -4.711 1.00 0.00 H new ATOM 1731 N ARG A 47 -11.175 -4.093 0.361 1.00 0.00 N ATOM 1732 CA ARG A 47 -10.455 -3.683 1.593 1.00 0.00 C ATOM 1733 C ARG A 47 -9.951 -4.917 2.356 1.00 0.00 C ATOM 1734 O ARG A 47 -10.589 -5.950 2.382 1.00 0.00 O ATOM 1735 CB ARG A 47 -11.431 -2.856 2.438 1.00 0.00 C ATOM 1736 CG ARG A 47 -10.982 -2.766 3.909 1.00 0.00 C ATOM 1737 CD ARG A 47 -11.699 -3.822 4.761 1.00 0.00 C ATOM 1738 NE ARG A 47 -11.042 -3.902 6.095 1.00 0.00 N ATOM 1739 CZ ARG A 47 -11.632 -4.522 7.078 1.00 0.00 C ATOM 1740 NH1 ARG A 47 -12.794 -5.086 6.890 1.00 0.00 N ATOM 1741 NH2 ARG A 47 -11.061 -4.580 8.251 1.00 0.00 N ATOM 0 H ARG A 47 -12.190 -4.134 0.454 1.00 0.00 H new ATOM 0 HA ARG A 47 -9.576 -3.085 1.351 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -11.512 -1.852 2.021 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -12.424 -3.303 2.388 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -9.904 -2.910 3.975 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -11.195 -1.771 4.299 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -12.751 -3.561 4.875 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -11.663 -4.792 4.266 1.00 0.00 H new ATOM 0 HE ARG A 47 -10.129 -3.471 6.240 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -13.240 -5.042 5.974 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -13.256 -5.571 7.659 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -10.153 -4.140 8.398 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -11.523 -5.065 9.020 1.00 0.00 H new ATOM 1755 N LYS A 48 -8.809 -4.798 2.990 1.00 0.00 N ATOM 1756 CA LYS A 48 -8.237 -5.937 3.777 1.00 0.00 C ATOM 1757 C LYS A 48 -7.833 -5.416 5.163 1.00 0.00 C ATOM 1758 O LYS A 48 -7.514 -4.254 5.321 1.00 0.00 O ATOM 1759 CB LYS A 48 -6.997 -6.477 3.061 1.00 0.00 C ATOM 1760 CG LYS A 48 -7.362 -6.909 1.635 1.00 0.00 C ATOM 1761 CD LYS A 48 -8.240 -8.170 1.663 1.00 0.00 C ATOM 1762 CE LYS A 48 -8.213 -8.849 0.289 1.00 0.00 C ATOM 1763 NZ LYS A 48 -8.948 -10.143 0.361 1.00 0.00 N ATOM 0 H LYS A 48 -8.242 -3.950 2.996 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.975 -6.734 3.873 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.222 -5.711 3.031 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.588 -7.323 3.613 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -7.891 -6.102 1.128 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.454 -7.103 1.064 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -7.880 -8.859 2.427 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -9.264 -7.906 1.929 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -8.670 -8.200 -0.458 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -7.183 -9.020 -0.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -8.930 -10.605 -0.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -8.494 -10.762 1.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -9.934 -9.967 0.642 1.00 0.00 H new ATOM 1777 N ASP A 49 -7.852 -6.254 6.170 1.00 0.00 N ATOM 1778 CA ASP A 49 -7.475 -5.785 7.542 1.00 0.00 C ATOM 1779 C ASP A 49 -6.203 -4.938 7.471 1.00 0.00 C ATOM 1780 O ASP A 49 -6.249 -3.724 7.464 1.00 0.00 O ATOM 1781 CB ASP A 49 -7.205 -6.987 8.450 1.00 0.00 C ATOM 1782 CG ASP A 49 -8.510 -7.730 8.736 1.00 0.00 C ATOM 1783 OD1 ASP A 49 -8.923 -8.509 7.892 1.00 0.00 O ATOM 1784 OD2 ASP A 49 -9.077 -7.506 9.792 1.00 0.00 O ATOM 0 H ASP A 49 -8.111 -7.238 6.103 1.00 0.00 H new ATOM 0 HA ASP A 49 -8.297 -5.193 7.943 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -6.491 -7.659 7.974 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -6.755 -6.653 9.385 1.00 0.00 H new ATOM 1789 N GLY A 50 -5.066 -5.576 7.421 1.00 0.00 N ATOM 1790 CA GLY A 50 -3.784 -4.819 7.355 1.00 0.00 C ATOM 1791 C GLY A 50 -3.668 -4.142 5.989 1.00 0.00 C ATOM 1792 O GLY A 50 -4.562 -4.223 5.171 1.00 0.00 O ATOM 0 H GLY A 50 -4.969 -6.591 7.423 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.748 -4.072 8.148 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.942 -5.493 7.513 1.00 0.00 H new ATOM 1796 N ILE A 51 -2.569 -3.483 5.729 1.00 0.00 N ATOM 1797 CA ILE A 51 -2.392 -2.812 4.414 1.00 0.00 C ATOM 1798 C ILE A 51 -1.702 -3.765 3.437 1.00 0.00 C ATOM 1799 O ILE A 51 -0.797 -4.493 3.790 1.00 0.00 O ATOM 1800 CB ILE A 51 -1.545 -1.554 4.602 1.00 0.00 C ATOM 1801 CG1 ILE A 51 -2.195 -0.680 5.694 1.00 0.00 C ATOM 1802 CG2 ILE A 51 -1.467 -0.781 3.277 1.00 0.00 C ATOM 1803 CD1 ILE A 51 -1.713 0.768 5.577 1.00 0.00 C ATOM 0 H ILE A 51 -1.786 -3.382 6.375 1.00 0.00 H new ATOM 0 HA ILE A 51 -3.366 -2.536 4.009 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.534 -1.824 4.906 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.280 -0.717 5.600 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.947 -1.074 6.679 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -0.862 0.116 3.414 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.012 -1.412 2.514 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.471 -0.497 2.962 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.181 1.371 6.355 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.630 0.802 5.694 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -1.984 1.164 4.598 1.00 0.00 H new ATOM 1815 N GLN A 52 -2.109 -3.733 2.202 1.00 0.00 N ATOM 1816 CA GLN A 52 -1.464 -4.603 1.183 1.00 0.00 C ATOM 1817 C GLN A 52 -0.145 -3.956 0.765 1.00 0.00 C ATOM 1818 O GLN A 52 0.013 -2.755 0.847 1.00 0.00 O ATOM 1819 CB GLN A 52 -2.382 -4.743 -0.033 1.00 0.00 C ATOM 1820 CG GLN A 52 -3.577 -5.625 0.326 1.00 0.00 C ATOM 1821 CD GLN A 52 -4.491 -5.758 -0.892 1.00 0.00 C ATOM 1822 OE1 GLN A 52 -5.350 -6.616 -0.931 1.00 0.00 O ATOM 1823 NE2 GLN A 52 -4.342 -4.938 -1.897 1.00 0.00 N ATOM 0 H GLN A 52 -2.862 -3.141 1.853 1.00 0.00 H new ATOM 0 HA GLN A 52 -1.280 -5.594 1.597 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.726 -3.761 -0.356 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.833 -5.179 -0.868 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.234 -6.609 0.647 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.126 -5.191 1.161 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -3.621 -4.217 -1.865 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -4.947 -5.018 -2.714 1.00 0.00 H new ATOM 1832 N THR A 53 0.814 -4.739 0.349 1.00 0.00 N ATOM 1833 CA THR A 53 2.133 -4.160 -0.054 1.00 0.00 C ATOM 1834 C THR A 53 2.663 -4.865 -1.297 1.00 0.00 C ATOM 1835 O THR A 53 2.311 -5.988 -1.599 1.00 0.00 O ATOM 1836 CB THR A 53 3.140 -4.329 1.081 1.00 0.00 C ATOM 1837 OG1 THR A 53 4.458 -4.269 0.553 1.00 0.00 O ATOM 1838 CG2 THR A 53 2.916 -5.676 1.758 1.00 0.00 C ATOM 0 H THR A 53 0.743 -5.753 0.270 1.00 0.00 H new ATOM 0 HA THR A 53 1.995 -3.101 -0.272 1.00 0.00 H new ATOM 0 HB THR A 53 3.008 -3.532 1.813 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.107 -4.375 1.280 1.00 0.00 H new ATOM 0 HG21 THR A 53 3.634 -5.799 2.569 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.904 -5.717 2.160 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.050 -6.476 1.030 1.00 0.00 H new ATOM 1846 N ARG A 54 3.529 -4.195 -1.998 1.00 0.00 N ATOM 1847 CA ARG A 54 4.141 -4.768 -3.235 1.00 0.00 C ATOM 1848 C ARG A 54 5.580 -4.284 -3.353 1.00 0.00 C ATOM 1849 O ARG A 54 6.023 -3.420 -2.621 1.00 0.00 O ATOM 1850 CB ARG A 54 3.361 -4.320 -4.485 1.00 0.00 C ATOM 1851 CG ARG A 54 2.052 -5.114 -4.613 1.00 0.00 C ATOM 1852 CD ARG A 54 2.324 -6.534 -5.164 1.00 0.00 C ATOM 1853 NE ARG A 54 1.560 -7.517 -4.344 1.00 0.00 N ATOM 1854 CZ ARG A 54 1.476 -8.762 -4.721 1.00 0.00 C ATOM 1855 NH1 ARG A 54 2.135 -9.174 -5.765 1.00 0.00 N ATOM 1856 NH2 ARG A 54 0.753 -9.602 -4.032 1.00 0.00 N ATOM 0 H ARG A 54 3.848 -3.255 -1.765 1.00 0.00 H new ATOM 0 HA ARG A 54 4.109 -5.855 -3.168 1.00 0.00 H new ATOM 0 HB2 ARG A 54 3.142 -3.254 -4.422 1.00 0.00 H new ATOM 0 HB3 ARG A 54 3.972 -4.468 -5.375 1.00 0.00 H new ATOM 0 HG2 ARG A 54 1.566 -5.183 -3.640 1.00 0.00 H new ATOM 0 HG3 ARG A 54 1.365 -4.587 -5.275 1.00 0.00 H new ATOM 0 HD2 ARG A 54 2.023 -6.598 -6.210 1.00 0.00 H new ATOM 0 HD3 ARG A 54 3.390 -6.757 -5.125 1.00 0.00 H new ATOM 0 HE ARG A 54 1.101 -7.214 -3.485 1.00 0.00 H new ATOM 0 HH11 ARG A 54 2.718 -8.522 -6.290 1.00 0.00 H new ATOM 0 HH12 ARG A 54 2.068 -10.149 -6.058 1.00 0.00 H new ATOM 0 HH21 ARG A 54 0.255 -9.284 -3.201 1.00 0.00 H new ATOM 0 HH22 ARG A 54 0.686 -10.577 -4.325 1.00 0.00 H new ATOM 1870 N ASN A 55 6.310 -4.831 -4.280 1.00 0.00 N ATOM 1871 CA ASN A 55 7.717 -4.398 -4.457 1.00 0.00 C ATOM 1872 C ASN A 55 7.724 -2.906 -4.784 1.00 0.00 C ATOM 1873 O ASN A 55 6.929 -2.423 -5.566 1.00 0.00 O ATOM 1874 CB ASN A 55 8.359 -5.181 -5.600 1.00 0.00 C ATOM 1875 CG ASN A 55 9.863 -4.917 -5.619 1.00 0.00 C ATOM 1876 OD1 ASN A 55 10.316 -3.880 -5.175 1.00 0.00 O ATOM 1877 ND2 ASN A 55 10.663 -5.819 -6.115 1.00 0.00 N ATOM 0 H ASN A 55 5.993 -5.558 -4.921 1.00 0.00 H new ATOM 0 HA ASN A 55 8.284 -4.584 -3.545 1.00 0.00 H new ATOM 0 HB2 ASN A 55 8.168 -6.247 -5.477 1.00 0.00 H new ATOM 0 HB3 ASN A 55 7.915 -4.886 -6.551 1.00 0.00 H new ATOM 0 HD21 ASN A 55 11.670 -5.655 -6.131 1.00 0.00 H new ATOM 0 HD22 ASN A 55 10.282 -6.689 -6.487 1.00 0.00 H new ATOM 1884 N ARG A 56 8.605 -2.174 -4.172 1.00 0.00 N ATOM 1885 CA ARG A 56 8.666 -0.708 -4.415 1.00 0.00 C ATOM 1886 C ARG A 56 8.943 -0.427 -5.893 1.00 0.00 C ATOM 1887 O ARG A 56 9.868 -0.962 -6.472 1.00 0.00 O ATOM 1888 CB ARG A 56 9.800 -0.121 -3.578 1.00 0.00 C ATOM 1889 CG ARG A 56 9.783 1.402 -3.679 1.00 0.00 C ATOM 1890 CD ARG A 56 10.920 1.966 -2.837 1.00 0.00 C ATOM 1891 NE ARG A 56 10.767 1.505 -1.429 1.00 0.00 N ATOM 1892 CZ ARG A 56 11.769 1.600 -0.597 1.00 0.00 C ATOM 1893 NH1 ARG A 56 12.899 2.124 -0.986 1.00 0.00 N ATOM 1894 NH2 ARG A 56 11.637 1.175 0.631 1.00 0.00 N ATOM 0 H ARG A 56 9.292 -2.530 -3.508 1.00 0.00 H new ATOM 0 HA ARG A 56 7.713 -0.257 -4.140 1.00 0.00 H new ATOM 0 HB2 ARG A 56 9.692 -0.427 -2.537 1.00 0.00 H new ATOM 0 HB3 ARG A 56 10.758 -0.507 -3.926 1.00 0.00 H new ATOM 0 HG2 ARG A 56 9.894 1.712 -4.718 1.00 0.00 H new ATOM 0 HG3 ARG A 56 8.827 1.792 -3.330 1.00 0.00 H new ATOM 0 HD2 ARG A 56 11.880 1.639 -3.236 1.00 0.00 H new ATOM 0 HD3 ARG A 56 10.912 3.055 -2.878 1.00 0.00 H new ATOM 0 HE ARG A 56 9.879 1.115 -1.114 1.00 0.00 H new ATOM 0 HH11 ARG A 56 13.002 2.461 -1.943 1.00 0.00 H new ATOM 0 HH12 ARG A 56 13.679 2.196 -0.333 1.00 0.00 H new ATOM 0 HH21 ARG A 56 10.753 0.770 0.938 1.00 0.00 H new ATOM 0 HH22 ARG A 56 12.418 1.248 1.283 1.00 0.00 H new ATOM 1908 N LYS A 57 8.147 0.412 -6.503 1.00 0.00 N ATOM 1909 CA LYS A 57 8.354 0.743 -7.944 1.00 0.00 C ATOM 1910 C LYS A 57 9.847 1.001 -8.191 1.00 0.00 C ATOM 1911 O LYS A 57 10.601 1.234 -7.267 1.00 0.00 O ATOM 1912 CB LYS A 57 7.545 2.001 -8.283 1.00 0.00 C ATOM 1913 CG LYS A 57 7.310 2.077 -9.794 1.00 0.00 C ATOM 1914 CD LYS A 57 6.907 3.499 -10.184 1.00 0.00 C ATOM 1915 CE LYS A 57 5.745 3.985 -9.307 1.00 0.00 C ATOM 1916 NZ LYS A 57 5.023 5.083 -10.007 1.00 0.00 N ATOM 0 H LYS A 57 7.358 0.885 -6.062 1.00 0.00 H new ATOM 0 HA LYS A 57 8.024 -0.084 -8.573 1.00 0.00 H new ATOM 0 HB2 LYS A 57 6.590 1.982 -7.758 1.00 0.00 H new ATOM 0 HB3 LYS A 57 8.078 2.889 -7.944 1.00 0.00 H new ATOM 0 HG2 LYS A 57 8.215 1.786 -10.327 1.00 0.00 H new ATOM 0 HG3 LYS A 57 6.529 1.375 -10.086 1.00 0.00 H new ATOM 0 HD2 LYS A 57 7.760 4.169 -10.073 1.00 0.00 H new ATOM 0 HD3 LYS A 57 6.615 3.526 -11.234 1.00 0.00 H new ATOM 0 HE2 LYS A 57 5.063 3.161 -9.099 1.00 0.00 H new ATOM 0 HE3 LYS A 57 6.122 4.337 -8.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 4.110 5.252 -9.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.595 5.951 -9.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 4.859 4.814 -10.998 1.00 0.00 H new ATOM 1930 N VAL A 58 10.285 0.951 -9.419 1.00 0.00 N ATOM 1931 CA VAL A 58 11.729 1.186 -9.698 1.00 0.00 C ATOM 1932 C VAL A 58 12.175 2.488 -9.031 1.00 0.00 C ATOM 1933 O VAL A 58 11.462 3.472 -9.039 1.00 0.00 O ATOM 1934 CB VAL A 58 11.931 1.290 -11.210 1.00 0.00 C ATOM 1935 CG1 VAL A 58 11.350 0.046 -11.885 1.00 0.00 C ATOM 1936 CG2 VAL A 58 11.220 2.537 -11.744 1.00 0.00 C ATOM 0 H VAL A 58 9.708 0.758 -10.238 1.00 0.00 H new ATOM 0 HA VAL A 58 12.321 0.361 -9.302 1.00 0.00 H new ATOM 0 HB VAL A 58 12.997 1.363 -11.427 1.00 0.00 H new ATOM 0 HG11 VAL A 58 11.492 0.117 -12.963 1.00 0.00 H new ATOM 0 HG12 VAL A 58 11.858 -0.842 -11.510 1.00 0.00 H new ATOM 0 HG13 VAL A 58 10.285 -0.024 -11.664 1.00 0.00 H new ATOM 0 HG21 VAL A 58 11.367 2.606 -12.822 1.00 0.00 H new ATOM 0 HG22 VAL A 58 10.154 2.469 -11.527 1.00 0.00 H new ATOM 0 HG23 VAL A 58 11.632 3.424 -11.264 1.00 0.00 H new ATOM 1946 N SER A 59 13.355 2.515 -8.462 1.00 0.00 N ATOM 1947 CA SER A 59 13.830 3.774 -7.810 1.00 0.00 C ATOM 1948 C SER A 59 14.498 4.637 -8.879 1.00 0.00 C ATOM 1949 O SER A 59 15.419 5.385 -8.616 1.00 0.00 O ATOM 1950 CB SER A 59 14.830 3.448 -6.698 1.00 0.00 C ATOM 1951 OG SER A 59 15.915 2.707 -7.243 1.00 0.00 O ATOM 0 H SER A 59 14.004 1.729 -8.421 1.00 0.00 H new ATOM 0 HA SER A 59 12.990 4.307 -7.365 1.00 0.00 H new ATOM 0 HB2 SER A 59 15.196 4.368 -6.241 1.00 0.00 H new ATOM 0 HB3 SER A 59 14.341 2.874 -5.911 1.00 0.00 H new ATOM 0 HG SER A 59 16.558 2.498 -6.533 1.00 0.00 H new ATOM 1957 N SER A 60 14.030 4.521 -10.091 1.00 0.00 N ATOM 1958 CA SER A 60 14.610 5.304 -11.215 1.00 0.00 C ATOM 1959 C SER A 60 14.687 6.789 -10.842 1.00 0.00 C ATOM 1960 O SER A 60 15.581 7.495 -11.262 1.00 0.00 O ATOM 1961 CB SER A 60 13.718 5.128 -12.444 1.00 0.00 C ATOM 1962 OG SER A 60 14.296 5.804 -13.552 1.00 0.00 O ATOM 0 H SER A 60 13.259 3.907 -10.352 1.00 0.00 H new ATOM 0 HA SER A 60 15.618 4.947 -11.428 1.00 0.00 H new ATOM 0 HB2 SER A 60 13.601 4.069 -12.672 1.00 0.00 H new ATOM 0 HB3 SER A 60 12.722 5.523 -12.243 1.00 0.00 H new ATOM 0 HG SER A 60 13.724 5.689 -14.340 1.00 0.00 H new ATOM 1968 N LYS A 61 13.763 7.267 -10.055 1.00 0.00 N ATOM 1969 CA LYS A 61 13.799 8.707 -9.662 1.00 0.00 C ATOM 1970 C LYS A 61 15.033 8.955 -8.800 1.00 0.00 C ATOM 1971 O LYS A 61 15.699 9.963 -8.927 1.00 0.00 O ATOM 1972 CB LYS A 61 12.545 9.054 -8.850 1.00 0.00 C ATOM 1973 CG LYS A 61 11.281 8.878 -9.703 1.00 0.00 C ATOM 1974 CD LYS A 61 11.204 9.962 -10.787 1.00 0.00 C ATOM 1975 CE LYS A 61 9.783 10.021 -11.347 1.00 0.00 C ATOM 1976 NZ LYS A 61 8.849 10.491 -10.284 1.00 0.00 N ATOM 0 H LYS A 61 12.988 6.728 -9.668 1.00 0.00 H new ATOM 0 HA LYS A 61 13.834 9.327 -10.558 1.00 0.00 H new ATOM 0 HB2 LYS A 61 12.487 8.414 -7.969 1.00 0.00 H new ATOM 0 HB3 LYS A 61 12.609 10.082 -8.494 1.00 0.00 H new ATOM 0 HG2 LYS A 61 11.284 7.892 -10.167 1.00 0.00 H new ATOM 0 HG3 LYS A 61 10.397 8.929 -9.067 1.00 0.00 H new ATOM 0 HD2 LYS A 61 11.482 10.930 -10.369 1.00 0.00 H new ATOM 0 HD3 LYS A 61 11.913 9.744 -11.586 1.00 0.00 H new ATOM 0 HE2 LYS A 61 9.746 10.695 -12.203 1.00 0.00 H new ATOM 0 HE3 LYS A 61 9.480 9.036 -11.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.048 10.990 -10.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 8.496 9.674 -9.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 9.351 11.138 -9.642 1.00 0.00 H new ATOM 1990 N GLY A 62 15.347 8.039 -7.925 1.00 0.00 N ATOM 1991 CA GLY A 62 16.543 8.215 -7.055 1.00 0.00 C ATOM 1992 C GLY A 62 17.773 7.675 -7.778 1.00 0.00 C ATOM 1993 O GLY A 62 17.678 6.801 -8.617 1.00 0.00 O ATOM 0 H GLY A 62 14.826 7.175 -7.775 1.00 0.00 H new ATOM 0 HA2 GLY A 62 16.681 9.269 -6.815 1.00 0.00 H new ATOM 0 HA3 GLY A 62 16.401 7.689 -6.111 1.00 0.00 H new ATOM 1997 N LYS A 63 18.931 8.186 -7.462 1.00 0.00 N ATOM 1998 CA LYS A 63 20.171 7.702 -8.128 1.00 0.00 C ATOM 1999 C LYS A 63 21.317 7.737 -7.122 1.00 0.00 C ATOM 2000 O LYS A 63 21.428 8.649 -6.328 1.00 0.00 O ATOM 2001 CB LYS A 63 20.504 8.611 -9.308 1.00 0.00 C ATOM 2002 CG LYS A 63 21.619 7.967 -10.144 1.00 0.00 C ATOM 2003 CD LYS A 63 22.019 8.885 -11.311 1.00 0.00 C ATOM 2004 CE LYS A 63 21.048 8.715 -12.489 1.00 0.00 C ATOM 2005 NZ LYS A 63 21.407 7.492 -13.259 1.00 0.00 N ATOM 0 H LYS A 63 19.071 8.921 -6.768 1.00 0.00 H new ATOM 0 HA LYS A 63 20.024 6.684 -8.488 1.00 0.00 H new ATOM 0 HB2 LYS A 63 19.618 8.768 -9.922 1.00 0.00 H new ATOM 0 HB3 LYS A 63 20.821 9.590 -8.950 1.00 0.00 H new ATOM 0 HG2 LYS A 63 22.487 7.772 -9.514 1.00 0.00 H new ATOM 0 HG3 LYS A 63 21.282 7.005 -10.530 1.00 0.00 H new ATOM 0 HD2 LYS A 63 22.020 9.924 -10.980 1.00 0.00 H new ATOM 0 HD3 LYS A 63 23.034 8.652 -11.633 1.00 0.00 H new ATOM 0 HE2 LYS A 63 20.025 8.639 -12.122 1.00 0.00 H new ATOM 0 HE3 LYS A 63 21.090 9.590 -13.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 20.792 7.415 -14.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 22.399 7.553 -13.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 21.280 6.653 -12.657 1.00 0.00 H new ATOM 2019 N LYS A 64 22.174 6.756 -7.147 1.00 0.00 N ATOM 2020 CA LYS A 64 23.313 6.750 -6.190 1.00 0.00 C ATOM 2021 C LYS A 64 24.423 7.651 -6.733 1.00 0.00 C ATOM 2022 O LYS A 64 24.326 8.861 -6.683 1.00 0.00 O ATOM 2023 CB LYS A 64 23.828 5.318 -6.026 1.00 0.00 C ATOM 2024 CG LYS A 64 24.919 5.279 -4.944 1.00 0.00 C ATOM 2025 CD LYS A 64 25.541 3.876 -4.868 1.00 0.00 C ATOM 2026 CE LYS A 64 24.643 2.943 -4.051 1.00 0.00 C ATOM 2027 NZ LYS A 64 24.432 3.525 -2.695 1.00 0.00 N ATOM 0 H LYS A 64 22.135 5.962 -7.786 1.00 0.00 H new ATOM 0 HA LYS A 64 22.990 7.123 -5.218 1.00 0.00 H new ATOM 0 HB2 LYS A 64 23.007 4.655 -5.752 1.00 0.00 H new ATOM 0 HB3 LYS A 64 24.228 4.955 -6.973 1.00 0.00 H new ATOM 0 HG2 LYS A 64 25.691 6.015 -5.169 1.00 0.00 H new ATOM 0 HG3 LYS A 64 24.493 5.549 -3.978 1.00 0.00 H new ATOM 0 HD2 LYS A 64 25.676 3.475 -5.873 1.00 0.00 H new ATOM 0 HD3 LYS A 64 26.529 3.933 -4.412 1.00 0.00 H new ATOM 0 HE2 LYS A 64 23.686 2.808 -4.554 1.00 0.00 H new ATOM 0 HE3 LYS A 64 25.102 1.958 -3.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 24.310 2.758 -2.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 25.257 4.101 -2.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 23.581 4.123 -2.702 1.00 0.00 H new ATOM 2041 N ARG A 65 25.480 7.082 -7.253 1.00 0.00 N ATOM 2042 CA ARG A 65 26.586 7.921 -7.792 1.00 0.00 C ATOM 2043 C ARG A 65 27.302 7.167 -8.914 1.00 0.00 C ATOM 2044 O ARG A 65 27.750 6.050 -8.738 1.00 0.00 O ATOM 2045 CB ARG A 65 27.583 8.227 -6.669 1.00 0.00 C ATOM 2046 CG ARG A 65 28.585 9.300 -7.138 1.00 0.00 C ATOM 2047 CD ARG A 65 27.995 10.708 -6.933 1.00 0.00 C ATOM 2048 NE ARG A 65 28.382 11.572 -8.088 1.00 0.00 N ATOM 2049 CZ ARG A 65 29.622 11.638 -8.493 1.00 0.00 C ATOM 2050 NH1 ARG A 65 30.581 11.125 -7.771 1.00 0.00 N ATOM 2051 NH2 ARG A 65 29.906 12.264 -9.601 1.00 0.00 N ATOM 0 H ARG A 65 25.623 6.075 -7.327 1.00 0.00 H new ATOM 0 HA ARG A 65 26.177 8.852 -8.185 1.00 0.00 H new ATOM 0 HB2 ARG A 65 27.051 8.575 -5.783 1.00 0.00 H new ATOM 0 HB3 ARG A 65 28.115 7.319 -6.385 1.00 0.00 H new ATOM 0 HG2 ARG A 65 29.518 9.204 -6.582 1.00 0.00 H new ATOM 0 HG3 ARG A 65 28.825 9.148 -8.190 1.00 0.00 H new ATOM 0 HD2 ARG A 65 26.909 10.653 -6.852 1.00 0.00 H new ATOM 0 HD3 ARG A 65 28.363 11.138 -6.002 1.00 0.00 H new ATOM 0 HE ARG A 65 27.667 12.119 -8.568 1.00 0.00 H new ATOM 0 HH11 ARG A 65 30.364 10.669 -6.885 1.00 0.00 H new ATOM 0 HH12 ARG A 65 31.547 11.180 -8.093 1.00 0.00 H new ATOM 0 HH21 ARG A 65 29.162 12.699 -10.146 1.00 0.00 H new ATOM 0 HH22 ARG A 65 30.872 12.319 -9.922 1.00 0.00 H new ATOM 2065 N ARG A 66 27.427 7.773 -10.061 1.00 0.00 N ATOM 2066 CA ARG A 66 28.128 7.100 -11.189 1.00 0.00 C ATOM 2067 C ARG A 66 28.538 8.149 -12.224 1.00 0.00 C ATOM 2068 O ARG A 66 27.678 8.584 -12.972 1.00 0.00 O ATOM 2069 CB ARG A 66 27.198 6.073 -11.840 1.00 0.00 C ATOM 2070 CG ARG A 66 27.962 5.305 -12.923 1.00 0.00 C ATOM 2071 CD ARG A 66 27.093 4.156 -13.443 1.00 0.00 C ATOM 2072 NE ARG A 66 25.936 4.719 -14.197 1.00 0.00 N ATOM 2073 CZ ARG A 66 25.188 3.940 -14.932 1.00 0.00 C ATOM 2074 NH1 ARG A 66 25.429 2.659 -14.985 1.00 0.00 N ATOM 2075 NH2 ARG A 66 24.192 4.445 -15.609 1.00 0.00 N ATOM 2076 OXT ARG A 66 29.706 8.502 -12.249 1.00 0.00 O ATOM 0 H ARG A 66 27.073 8.707 -10.266 1.00 0.00 H new ATOM 0 HA ARG A 66 29.014 6.589 -10.812 1.00 0.00 H new ATOM 0 HB2 ARG A 66 26.819 5.381 -11.088 1.00 0.00 H new ATOM 0 HB3 ARG A 66 26.334 6.574 -12.276 1.00 0.00 H new ATOM 0 HG2 ARG A 66 28.226 5.975 -13.741 1.00 0.00 H new ATOM 0 HG3 ARG A 66 28.895 4.915 -12.517 1.00 0.00 H new ATOM 0 HD2 ARG A 66 27.680 3.503 -14.089 1.00 0.00 H new ATOM 0 HD3 ARG A 66 26.739 3.547 -12.611 1.00 0.00 H new ATOM 0 HE ARG A 66 25.728 5.716 -14.139 1.00 0.00 H new ATOM 0 HH11 ARG A 66 26.203 2.263 -14.452 1.00 0.00 H new ATOM 0 HH12 ARG A 66 24.843 2.053 -15.560 1.00 0.00 H new ATOM 0 HH21 ARG A 66 24.000 5.446 -15.563 1.00 0.00 H new ATOM 0 HH22 ARG A 66 23.607 3.839 -16.184 1.00 0.00 H new TER 2090 ARG A 66 HETATM 2091 ZN ZN A 67 -11.321 2.845 1.787 1.00 0.00 ZN