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 -140:sc= -0.452 USER MOD Set 1.2: A 29 ASN :FLIP amide:sc= -5.81! C(o=-7.8!,f=-7!) USER MOD Set 1.3: C 125 DT C7 :methyl 150:sc= -0.75 (180deg=-0.364) USER MOD Set 2.1: A 12 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 14 THR OG1 : rot 36:sc= 0.337 USER MOD Single : A 1 LYS N :NH3+ -156:sc= -0.0776 (180deg=-0.452) USER MOD Single : A 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot -82:sc= -3.31! USER MOD Single : A 8 SER OG : rot 84:sc= 0.141 USER MOD Single : A 9 ASN : amide:sc= -3.32! C(o=-3.3!,f=-2.9!) USER MOD Single : A 11 GLN : amide:sc= -0.204 X(o=-0.2,f=-0.59) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -134:sc= 0.868 USER MOD Single : A 21 SER OG : rot 180:sc= -0.052 USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HE2:sc= -3.99! C(o=-4!,f=-6.7!) USER MOD Single : A 39 GLN : amide:sc= -2.17! C(o=-2.2!,f=-2.3!) USER MOD Single : A 41 ASN : amide:sc= -1.09 X(o=-1.1,f=-0.9) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 173:sc= -0.0846 (180deg=-0.155) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -0.0212 X(o=-0.021,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.0513 USER MOD Single : A 55 ASN : amide:sc= -0.0292 K(o=-0.029,f=-1.3!) USER MOD Single : A 57 LYS NZ :NH3+ 137:sc= -2.26! (180deg=-4.86!) 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+ -132:sc= -1.76 (180deg=-4.28!) USER MOD Single : A 63 LYS NZ :NH3+ -158:sc= -0.154 (180deg=-0.873) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 101 DG O5' : rot 180:sc= -0.244 USER MOD Single : B 102 DT C7 :methyl -30:sc= -1.44! (180deg=-1.68) USER MOD Single : B 103 DT C7 :methyl -30:sc= -0.578 (180deg=-1.14) USER MOD Single : B 109 DT C7 :methyl 150:sc= -2.23 (180deg=-2.23) USER MOD Single : B 115 DT C7 :methyl -30:sc= -0.161 (180deg=-0.329) USER MOD Single : B 116 DT C7 :methyl 150:sc= -0.973 (180deg=-0.973) USER MOD Single : B 116 DT O3' : rot 180:sc= 0 USER MOD Single : C 117 DA O5' : rot 79:sc= -2.11! USER MOD Single : C 119 DT C7 :methyl -30:sc= -0.013 (180deg=-0.536) USER MOD Single : C 121 DT C7 :methyl 150:sc= -1.14 (180deg=-1.14) USER MOD Single : C 122 DT C7 :methyl 150:sc= -0.917 (180deg=-0.917) USER MOD Single : C 123 DT C7 :methyl -30:sc= -1.33 (180deg=-3.61!) USER MOD Single : C 127 DT C7 :methyl -30:sc= -1.14 (180deg=-1.29) USER MOD Single : C 132 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG B 101 19.056 26.149 6.125 1.00 0.00 O ATOM 2 C5' DG B 101 19.695 25.878 7.376 1.00 0.00 C ATOM 3 C4' DG B 101 18.896 24.872 8.213 1.00 0.00 C ATOM 4 O4' DG B 101 17.670 25.480 8.683 1.00 0.00 O ATOM 5 C3' DG B 101 18.519 23.624 7.407 1.00 0.00 C ATOM 6 O3' DG B 101 18.787 22.442 8.169 1.00 0.00 O ATOM 7 C2' DG B 101 17.040 23.755 7.145 1.00 0.00 C ATOM 8 C1' DG B 101 16.524 24.834 8.087 1.00 0.00 C ATOM 9 N9 DG B 101 15.687 25.818 7.371 1.00 0.00 N ATOM 10 C8 DG B 101 15.964 26.525 6.235 1.00 0.00 C ATOM 11 N7 DG B 101 15.036 27.351 5.858 1.00 0.00 N ATOM 12 C5 DG B 101 14.049 27.185 6.826 1.00 0.00 C ATOM 13 C6 DG B 101 12.785 27.821 6.957 1.00 0.00 C ATOM 14 O6 DG B 101 12.281 28.675 6.229 1.00 0.00 O ATOM 15 N1 DG B 101 12.099 27.365 8.074 1.00 0.00 N ATOM 16 C2 DG B 101 12.563 26.415 8.958 1.00 0.00 C ATOM 17 N2 DG B 101 11.744 26.092 9.960 1.00 0.00 N ATOM 18 N3 DG B 101 13.752 25.814 8.841 1.00 0.00 N ATOM 19 C4 DG B 101 14.438 26.246 7.756 1.00 0.00 C ATOM 0 H5' DG B 101 19.810 26.807 7.935 1.00 0.00 H new ATOM 0 H5'' DG B 101 20.697 25.488 7.196 1.00 0.00 H new ATOM 0 H4' DG B 101 19.535 24.580 9.047 1.00 0.00 H new ATOM 0 H3' DG B 101 19.091 23.545 6.483 1.00 0.00 H new ATOM 0 H2' DG B 101 16.853 24.026 6.106 1.00 0.00 H new ATOM 0 H2'' DG B 101 16.530 22.809 7.324 1.00 0.00 H new ATOM 0 HO5' DG B 101 19.591 26.795 5.618 1.00 0.00 H new ATOM 0 H1' DG B 101 15.895 24.384 8.855 1.00 0.00 H new ATOM 0 H8 DG B 101 16.889 26.405 5.690 1.00 0.00 H new ATOM 0 H1 DG B 101 11.178 27.765 8.255 1.00 0.00 H new ATOM 0 H21 DG B 101 12.030 25.395 10.648 1.00 0.00 H new ATOM 0 H22 DG B 101 10.832 26.542 10.038 1.00 0.00 H new ATOM 32 P DT B 102 18.483 20.971 7.580 1.00 0.00 P ATOM 33 OP1 DT B 102 19.511 20.043 8.101 1.00 0.00 O ATOM 34 OP2 DT B 102 18.271 21.090 6.119 1.00 0.00 O ATOM 35 O5' DT B 102 17.068 20.597 8.268 1.00 0.00 O ATOM 36 C5' DT B 102 16.968 20.542 9.694 1.00 0.00 C ATOM 37 C4' DT B 102 15.559 20.173 10.189 1.00 0.00 C ATOM 38 O4' DT B 102 14.629 21.256 9.929 1.00 0.00 O ATOM 39 C3' DT B 102 14.996 18.911 9.521 1.00 0.00 C ATOM 40 O3' DT B 102 14.670 17.937 10.520 1.00 0.00 O ATOM 41 C2' DT B 102 13.745 19.344 8.797 1.00 0.00 C ATOM 42 C1' DT B 102 13.441 20.759 9.266 1.00 0.00 C ATOM 43 N1 DT B 102 13.047 21.652 8.136 1.00 0.00 N ATOM 44 C2 DT B 102 11.809 22.283 8.193 1.00 0.00 C ATOM 45 O2 DT B 102 11.020 22.087 9.115 1.00 0.00 O ATOM 46 N3 DT B 102 11.511 23.142 7.151 1.00 0.00 N ATOM 47 C4 DT B 102 12.326 23.420 6.068 1.00 0.00 C ATOM 48 O4 DT B 102 11.961 24.203 5.195 1.00 0.00 O ATOM 49 C5 DT B 102 13.587 22.716 6.083 1.00 0.00 C ATOM 50 C7 DT B 102 14.558 22.920 4.915 1.00 0.00 C ATOM 51 C6 DT B 102 13.902 21.873 7.097 1.00 0.00 C ATOM 0 H5' DT B 102 17.250 21.510 10.109 1.00 0.00 H new ATOM 0 H5'' DT B 102 17.682 19.812 10.074 1.00 0.00 H new ATOM 0 H4' DT B 102 15.664 19.986 11.258 1.00 0.00 H new ATOM 0 H3' DT B 102 15.717 18.462 8.838 1.00 0.00 H new ATOM 0 H2' DT B 102 13.893 19.317 7.717 1.00 0.00 H new ATOM 0 H2'' DT B 102 12.915 18.674 9.022 1.00 0.00 H new ATOM 0 H1' DT B 102 12.591 20.747 9.949 1.00 0.00 H new ATOM 0 H3 DT B 102 10.607 23.614 7.184 1.00 0.00 H new ATOM 0 H71 DT B 102 13.995 23.134 4.007 1.00 0.00 H new ATOM 0 H72 DT B 102 15.222 23.756 5.136 1.00 0.00 H new ATOM 0 H73 DT B 102 15.149 22.015 4.771 1.00 0.00 H new ATOM 0 H6 DT B 102 14.854 21.364 7.081 1.00 0.00 H new ATOM 64 P DT B 103 14.055 16.498 10.128 1.00 0.00 P ATOM 65 OP1 DT B 103 14.393 15.539 11.203 1.00 0.00 O ATOM 66 OP2 DT B 103 14.423 16.201 8.727 1.00 0.00 O ATOM 67 O5' DT B 103 12.463 16.780 10.181 1.00 0.00 O ATOM 68 C5' DT B 103 11.866 17.216 11.407 1.00 0.00 C ATOM 69 C4' DT B 103 10.355 17.453 11.287 1.00 0.00 C ATOM 70 O4' DT B 103 10.096 18.632 10.486 1.00 0.00 O ATOM 71 C3' DT B 103 9.615 16.271 10.642 1.00 0.00 C ATOM 72 O3' DT B 103 8.651 15.756 11.559 1.00 0.00 O ATOM 73 C2' DT B 103 8.901 16.850 9.434 1.00 0.00 C ATOM 74 C1' DT B 103 9.051 18.368 9.529 1.00 0.00 C ATOM 75 N1 DT B 103 9.370 18.978 8.205 1.00 0.00 N ATOM 76 C2 DT B 103 8.496 19.925 7.685 1.00 0.00 C ATOM 77 O2 DT B 103 7.480 20.273 8.283 1.00 0.00 O ATOM 78 N3 DT B 103 8.838 20.460 6.457 1.00 0.00 N ATOM 79 C4 DT B 103 9.958 20.139 5.712 1.00 0.00 C ATOM 80 O4 DT B 103 10.162 20.671 4.624 1.00 0.00 O ATOM 81 C5 DT B 103 10.810 19.149 6.327 1.00 0.00 C ATOM 82 C7 DT B 103 12.082 18.712 5.596 1.00 0.00 C ATOM 83 C6 DT B 103 10.495 18.611 7.530 1.00 0.00 C ATOM 0 H5' DT B 103 12.348 18.138 11.732 1.00 0.00 H new ATOM 0 H5'' DT B 103 12.051 16.470 12.180 1.00 0.00 H new ATOM 0 H4' DT B 103 9.986 17.578 12.305 1.00 0.00 H new ATOM 0 H3' DT B 103 10.294 15.463 10.369 1.00 0.00 H new ATOM 0 H2' DT B 103 9.337 16.474 8.508 1.00 0.00 H new ATOM 0 H2'' DT B 103 7.849 16.563 9.430 1.00 0.00 H new ATOM 0 H1' DT B 103 8.111 18.817 9.848 1.00 0.00 H new ATOM 0 H3 DT B 103 8.205 21.157 6.064 1.00 0.00 H new ATOM 0 H71 DT B 103 11.929 18.792 4.520 1.00 0.00 H new ATOM 0 H72 DT B 103 12.911 19.354 5.893 1.00 0.00 H new ATOM 0 H73 DT B 103 12.313 17.678 5.854 1.00 0.00 H new ATOM 0 H6 DT B 103 11.152 17.873 7.965 1.00 0.00 H new ATOM 96 P DG B 104 7.736 14.481 11.205 1.00 0.00 P ATOM 97 OP1 DG B 104 7.306 13.851 12.474 1.00 0.00 O ATOM 98 OP2 DG B 104 8.436 13.675 10.182 1.00 0.00 O ATOM 99 O5' DG B 104 6.453 15.165 10.520 1.00 0.00 O ATOM 100 C5' DG B 104 5.663 16.099 11.252 1.00 0.00 C ATOM 101 C4' DG B 104 4.493 16.633 10.423 1.00 0.00 C ATOM 102 O4' DG B 104 4.991 17.450 9.330 1.00 0.00 O ATOM 103 C3' DG B 104 3.663 15.498 9.816 1.00 0.00 C ATOM 104 O3' DG B 104 2.280 15.712 10.106 1.00 0.00 O ATOM 105 C2' DG B 104 3.882 15.587 8.327 1.00 0.00 C ATOM 106 C1' DG B 104 4.547 16.925 8.055 1.00 0.00 C ATOM 107 N9 DG B 104 5.675 16.791 7.101 1.00 0.00 N ATOM 108 C8 DG B 104 6.732 15.925 7.123 1.00 0.00 C ATOM 109 N7 DG B 104 7.581 16.060 6.148 1.00 0.00 N ATOM 110 C5 DG B 104 7.048 17.108 5.400 1.00 0.00 C ATOM 111 C6 DG B 104 7.531 17.717 4.205 1.00 0.00 C ATOM 112 O6 DG B 104 8.549 17.450 3.566 1.00 0.00 O ATOM 113 N1 DG B 104 6.693 18.736 3.779 1.00 0.00 N ATOM 114 C2 DG B 104 5.533 19.127 4.413 1.00 0.00 C ATOM 115 N2 DG B 104 4.856 20.122 3.839 1.00 0.00 N ATOM 116 N3 DG B 104 5.074 18.560 5.537 1.00 0.00 N ATOM 117 C4 DG B 104 5.878 17.561 5.973 1.00 0.00 C ATOM 0 H5' DG B 104 6.290 16.931 11.573 1.00 0.00 H new ATOM 0 H5'' DG B 104 5.280 15.622 12.154 1.00 0.00 H new ATOM 0 H4' DG B 104 3.866 17.218 11.096 1.00 0.00 H new ATOM 0 H3' DG B 104 3.950 14.525 10.214 1.00 0.00 H new ATOM 0 H2' DG B 104 4.510 14.767 7.980 1.00 0.00 H new ATOM 0 H2'' DG B 104 2.935 15.511 7.793 1.00 0.00 H new ATOM 0 H1' DG B 104 3.840 17.610 7.587 1.00 0.00 H new ATOM 0 H8 DG B 104 6.853 15.181 7.896 1.00 0.00 H new ATOM 0 H1 DG B 104 6.955 19.236 2.929 1.00 0.00 H new ATOM 0 H21 DG B 104 3.989 20.458 4.259 1.00 0.00 H new ATOM 0 H22 DG B 104 5.205 20.547 2.980 1.00 0.00 H new ATOM 129 P DC B 105 1.131 14.694 9.611 1.00 0.00 P ATOM 130 OP1 DC B 105 -0.026 14.836 10.521 1.00 0.00 O ATOM 131 OP2 DC B 105 1.750 13.364 9.415 1.00 0.00 O ATOM 132 O5' DC B 105 0.697 15.260 8.164 1.00 0.00 O ATOM 133 C5' DC B 105 0.170 16.582 8.031 1.00 0.00 C ATOM 134 C4' DC B 105 -0.181 16.929 6.576 1.00 0.00 C ATOM 135 O4' DC B 105 1.011 17.060 5.758 1.00 0.00 O ATOM 136 C3' DC B 105 -1.065 15.854 5.927 1.00 0.00 C ATOM 137 O3' DC B 105 -2.256 16.466 5.424 1.00 0.00 O ATOM 138 C2' DC B 105 -0.249 15.262 4.807 1.00 0.00 C ATOM 139 C1' DC B 105 0.914 16.215 4.580 1.00 0.00 C ATOM 140 N1 DC B 105 2.199 15.495 4.341 1.00 0.00 N ATOM 141 C2 DC B 105 2.885 15.739 3.154 1.00 0.00 C ATOM 142 O2 DC B 105 2.405 16.493 2.312 1.00 0.00 O ATOM 143 N3 DC B 105 4.086 15.129 2.962 1.00 0.00 N ATOM 144 C4 DC B 105 4.600 14.313 3.890 1.00 0.00 C ATOM 145 N4 DC B 105 5.776 13.726 3.667 1.00 0.00 N ATOM 146 C5 DC B 105 3.901 14.059 5.109 1.00 0.00 C ATOM 147 C6 DC B 105 2.709 14.665 5.285 1.00 0.00 C ATOM 0 H5' DC B 105 0.899 17.300 8.407 1.00 0.00 H new ATOM 0 H5'' DC B 105 -0.722 16.679 8.650 1.00 0.00 H new ATOM 0 H4' DC B 105 -0.718 17.876 6.620 1.00 0.00 H new ATOM 0 H3' DC B 105 -1.364 15.081 6.634 1.00 0.00 H new ATOM 0 H2' DC B 105 0.109 14.267 5.070 1.00 0.00 H new ATOM 0 H2'' DC B 105 -0.848 15.156 3.903 1.00 0.00 H new ATOM 0 H1' DC B 105 0.731 16.807 3.683 1.00 0.00 H new ATOM 0 H41 DC B 105 6.176 13.102 4.368 1.00 0.00 H new ATOM 0 H42 DC B 105 6.276 13.900 2.795 1.00 0.00 H new ATOM 0 H5 DC B 105 4.312 13.405 5.863 1.00 0.00 H new ATOM 0 H6 DC B 105 2.151 14.486 6.192 1.00 0.00 H new ATOM 159 P DA B 106 -3.406 15.622 4.679 1.00 0.00 P ATOM 160 OP1 DA B 106 -4.717 16.225 5.011 1.00 0.00 O ATOM 161 OP2 DA B 106 -3.167 14.185 4.937 1.00 0.00 O ATOM 162 O5' DA B 106 -3.090 15.921 3.126 1.00 0.00 O ATOM 163 C5' DA B 106 -3.126 17.276 2.663 1.00 0.00 C ATOM 164 C4' DA B 106 -2.806 17.417 1.168 1.00 0.00 C ATOM 165 O4' DA B 106 -1.420 17.085 0.910 1.00 0.00 O ATOM 166 C3' DA B 106 -3.677 16.513 0.294 1.00 0.00 C ATOM 167 O3' DA B 106 -4.373 17.294 -0.668 1.00 0.00 O ATOM 168 C2' DA B 106 -2.727 15.579 -0.421 1.00 0.00 C ATOM 169 C1' DA B 106 -1.318 16.041 -0.086 1.00 0.00 C ATOM 170 N9 DA B 106 -0.522 14.922 0.419 1.00 0.00 N ATOM 171 C8 DA B 106 -0.785 14.138 1.478 1.00 0.00 C ATOM 172 N7 DA B 106 0.100 13.224 1.731 1.00 0.00 N ATOM 173 C5 DA B 106 1.044 13.426 0.725 1.00 0.00 C ATOM 174 C6 DA B 106 2.246 12.788 0.409 1.00 0.00 C ATOM 175 N6 DA B 106 2.738 11.773 1.121 1.00 0.00 N ATOM 176 N1 DA B 106 2.927 13.243 -0.659 1.00 0.00 N ATOM 177 C2 DA B 106 2.450 14.268 -1.371 1.00 0.00 C ATOM 178 N3 DA B 106 1.326 14.941 -1.155 1.00 0.00 N ATOM 179 C4 DA B 106 0.669 14.461 -0.082 1.00 0.00 C ATOM 0 H5' DA B 106 -2.413 17.868 3.237 1.00 0.00 H new ATOM 0 H5'' DA B 106 -4.115 17.692 2.856 1.00 0.00 H new ATOM 0 H4' DA B 106 -3.010 18.457 0.912 1.00 0.00 H new ATOM 0 H3' DA B 106 -4.410 15.972 0.893 1.00 0.00 H new ATOM 0 H2' DA B 106 -2.883 14.549 -0.099 1.00 0.00 H new ATOM 0 H2'' DA B 106 -2.896 15.606 -1.497 1.00 0.00 H new ATOM 0 H1' DA B 106 -0.821 16.422 -0.978 1.00 0.00 H new ATOM 0 H8 DA B 106 -1.674 14.261 2.079 1.00 0.00 H new ATOM 0 H61 DA B 106 3.621 11.340 0.849 1.00 0.00 H new ATOM 0 H62 DA B 106 2.232 11.430 1.937 1.00 0.00 H new ATOM 0 H2 DA B 106 3.044 14.584 -2.216 1.00 0.00 H new ATOM 191 P DG B 107 -5.357 16.583 -1.710 1.00 0.00 P ATOM 192 OP1 DG B 107 -6.303 17.595 -2.231 1.00 0.00 O ATOM 193 OP2 DG B 107 -5.862 15.330 -1.106 1.00 0.00 O ATOM 194 O5' DG B 107 -4.321 16.204 -2.878 1.00 0.00 O ATOM 195 C5' DG B 107 -3.578 17.222 -3.549 1.00 0.00 C ATOM 196 C4' DG B 107 -2.623 16.619 -4.577 1.00 0.00 C ATOM 197 O4' DG B 107 -1.519 15.922 -3.942 1.00 0.00 O ATOM 198 C3' DG B 107 -3.355 15.625 -5.479 1.00 0.00 C ATOM 199 O3' DG B 107 -3.308 16.059 -6.837 1.00 0.00 O ATOM 200 C2' DG B 107 -2.616 14.314 -5.306 1.00 0.00 C ATOM 201 C1' DG B 107 -1.320 14.640 -4.580 1.00 0.00 C ATOM 202 N9 DG B 107 -0.930 13.590 -3.599 1.00 0.00 N ATOM 203 C8 DG B 107 -1.583 13.146 -2.471 1.00 0.00 C ATOM 204 N7 DG B 107 -0.952 12.258 -1.785 1.00 0.00 N ATOM 205 C5 DG B 107 0.220 12.067 -2.492 1.00 0.00 C ATOM 206 C6 DG B 107 1.298 11.198 -2.207 1.00 0.00 C ATOM 207 O6 DG B 107 1.418 10.438 -1.253 1.00 0.00 O ATOM 208 N1 DG B 107 2.296 11.285 -3.165 1.00 0.00 N ATOM 209 C2 DG B 107 2.265 12.117 -4.264 1.00 0.00 C ATOM 210 N2 DG B 107 3.328 12.056 -5.072 1.00 0.00 N ATOM 211 N3 DG B 107 1.244 12.950 -4.538 1.00 0.00 N ATOM 212 C4 DG B 107 0.256 12.870 -3.609 1.00 0.00 C ATOM 0 H5' DG B 107 -3.013 17.804 -2.821 1.00 0.00 H new ATOM 0 H5'' DG B 107 -4.263 17.910 -4.044 1.00 0.00 H new ATOM 0 H4' DG B 107 -2.235 17.450 -5.165 1.00 0.00 H new ATOM 0 H3' DG B 107 -4.409 15.531 -5.218 1.00 0.00 H new ATOM 0 H2' DG B 107 -3.213 13.605 -4.733 1.00 0.00 H new ATOM 0 H2'' DG B 107 -2.413 13.853 -6.273 1.00 0.00 H new ATOM 0 H1' DG B 107 -0.492 14.677 -5.288 1.00 0.00 H new ATOM 0 H8 DG B 107 -2.556 13.516 -2.182 1.00 0.00 H new ATOM 0 H1 DG B 107 3.115 10.689 -3.048 1.00 0.00 H new ATOM 0 H21 DG B 107 3.371 12.645 -5.904 1.00 0.00 H new ATOM 0 H22 DG B 107 4.096 11.421 -4.857 1.00 0.00 H new ATOM 224 P DA B 108 -4.004 15.193 -7.999 1.00 0.00 P ATOM 225 OP1 DA B 108 -4.517 16.126 -9.029 1.00 0.00 O ATOM 226 OP2 DA B 108 -4.917 14.216 -7.368 1.00 0.00 O ATOM 227 O5' DA B 108 -2.756 14.394 -8.621 1.00 0.00 O ATOM 228 C5' DA B 108 -1.668 15.131 -9.180 1.00 0.00 C ATOM 229 C4' DA B 108 -0.566 14.221 -9.726 1.00 0.00 C ATOM 230 O4' DA B 108 0.154 13.562 -8.650 1.00 0.00 O ATOM 231 C3' DA B 108 -1.132 13.138 -10.647 1.00 0.00 C ATOM 232 O3' DA B 108 -0.460 13.173 -11.910 1.00 0.00 O ATOM 233 C2' DA B 108 -0.877 11.833 -9.928 1.00 0.00 C ATOM 234 C1' DA B 108 0.149 12.128 -8.845 1.00 0.00 C ATOM 235 N9 DA B 108 -0.155 11.421 -7.576 1.00 0.00 N ATOM 236 C8 DA B 108 -1.304 11.434 -6.837 1.00 0.00 C ATOM 237 N7 DA B 108 -1.250 10.785 -5.715 1.00 0.00 N ATOM 238 C5 DA B 108 0.049 10.288 -5.702 1.00 0.00 C ATOM 239 C6 DA B 108 0.748 9.508 -4.779 1.00 0.00 C ATOM 240 N6 DA B 108 0.234 9.126 -3.620 1.00 0.00 N ATOM 241 N1 DA B 108 2.013 9.180 -5.069 1.00 0.00 N ATOM 242 C2 DA B 108 2.571 9.597 -6.196 1.00 0.00 C ATOM 243 N3 DA B 108 2.006 10.351 -7.145 1.00 0.00 N ATOM 244 C4 DA B 108 0.727 10.661 -6.828 1.00 0.00 C ATOM 0 H5' DA B 108 -1.248 15.788 -8.418 1.00 0.00 H new ATOM 0 H5'' DA B 108 -2.039 15.769 -9.982 1.00 0.00 H new ATOM 0 H4' DA B 108 0.110 14.865 -10.289 1.00 0.00 H new ATOM 0 H3' DA B 108 -2.194 13.276 -10.852 1.00 0.00 H new ATOM 0 H2' DA B 108 -1.798 11.443 -9.494 1.00 0.00 H new ATOM 0 H2'' DA B 108 -0.505 11.076 -10.619 1.00 0.00 H new ATOM 0 H1' DA B 108 1.130 11.769 -9.156 1.00 0.00 H new ATOM 0 H8 DA B 108 -2.195 11.949 -7.164 1.00 0.00 H new ATOM 0 H61 DA B 108 0.787 8.556 -2.980 1.00 0.00 H new ATOM 0 H62 DA B 108 -0.715 9.402 -3.367 1.00 0.00 H new ATOM 0 H2 DA B 108 3.594 9.295 -6.367 1.00 0.00 H new ATOM 256 P DT B 109 -0.831 12.153 -13.099 1.00 0.00 P ATOM 257 OP1 DT B 109 -0.665 12.860 -14.389 1.00 0.00 O ATOM 258 OP2 DT B 109 -2.121 11.505 -12.771 1.00 0.00 O ATOM 259 O5' DT B 109 0.338 11.052 -12.969 1.00 0.00 O ATOM 260 C5' DT B 109 1.695 11.477 -13.116 1.00 0.00 C ATOM 261 C4' DT B 109 2.702 10.335 -12.956 1.00 0.00 C ATOM 262 O4' DT B 109 2.729 9.887 -11.582 1.00 0.00 O ATOM 263 C3' DT B 109 2.372 9.131 -13.847 1.00 0.00 C ATOM 264 O3' DT B 109 3.452 8.877 -14.743 1.00 0.00 O ATOM 265 C2' DT B 109 2.217 7.956 -12.905 1.00 0.00 C ATOM 266 C1' DT B 109 2.573 8.456 -11.509 1.00 0.00 C ATOM 267 N1 DT B 109 1.520 8.089 -10.524 1.00 0.00 N ATOM 268 C2 DT B 109 1.873 7.296 -9.442 1.00 0.00 C ATOM 269 O2 DT B 109 3.017 6.872 -9.289 1.00 0.00 O ATOM 270 N3 DT B 109 0.864 7.011 -8.543 1.00 0.00 N ATOM 271 C4 DT B 109 -0.446 7.446 -8.624 1.00 0.00 C ATOM 272 O4 DT B 109 -1.262 7.142 -7.760 1.00 0.00 O ATOM 273 C5 DT B 109 -0.727 8.262 -9.780 1.00 0.00 C ATOM 274 C7 DT B 109 -2.148 8.801 -9.971 1.00 0.00 C ATOM 275 C6 DT B 109 0.247 8.550 -10.678 1.00 0.00 C ATOM 0 H5' DT B 109 1.910 12.249 -12.377 1.00 0.00 H new ATOM 0 H5'' DT B 109 1.823 11.931 -14.098 1.00 0.00 H new ATOM 0 H4' DT B 109 3.672 10.731 -13.257 1.00 0.00 H new ATOM 0 H3' DT B 109 1.474 9.306 -14.440 1.00 0.00 H new ATOM 0 H2' DT B 109 1.197 7.574 -12.929 1.00 0.00 H new ATOM 0 H2'' DT B 109 2.872 7.136 -13.200 1.00 0.00 H new ATOM 0 H1' DT B 109 3.499 7.991 -11.171 1.00 0.00 H new ATOM 0 H3 DT B 109 1.108 6.425 -7.745 1.00 0.00 H new ATOM 0 H71 DT B 109 -2.108 9.752 -10.501 1.00 0.00 H new ATOM 0 H72 DT B 109 -2.733 8.087 -10.551 1.00 0.00 H new ATOM 0 H73 DT B 109 -2.615 8.948 -8.997 1.00 0.00 H new ATOM 0 H6 DT B 109 0.008 9.160 -11.537 1.00 0.00 H new ATOM 288 P DA B 110 3.346 7.749 -15.888 1.00 0.00 P ATOM 289 OP1 DA B 110 4.327 8.067 -16.948 1.00 0.00 O ATOM 290 OP2 DA B 110 1.917 7.569 -16.230 1.00 0.00 O ATOM 291 O5' DA B 110 3.845 6.431 -15.114 1.00 0.00 O ATOM 292 C5' DA B 110 5.155 6.382 -14.554 1.00 0.00 C ATOM 293 C4' DA B 110 5.424 5.049 -13.859 1.00 0.00 C ATOM 294 O4' DA B 110 4.521 4.903 -12.729 1.00 0.00 O ATOM 295 C3' DA B 110 5.184 3.853 -14.782 1.00 0.00 C ATOM 296 O3' DA B 110 6.270 2.930 -14.646 1.00 0.00 O ATOM 297 C2' DA B 110 3.900 3.221 -14.316 1.00 0.00 C ATOM 298 C1' DA B 110 3.601 3.800 -12.943 1.00 0.00 C ATOM 299 N9 DA B 110 2.191 4.251 -12.840 1.00 0.00 N ATOM 300 C8 DA B 110 1.466 5.038 -13.691 1.00 0.00 C ATOM 301 N7 DA B 110 0.234 5.250 -13.336 1.00 0.00 N ATOM 302 C5 DA B 110 0.125 4.547 -12.141 1.00 0.00 C ATOM 303 C6 DA B 110 -0.935 4.367 -11.246 1.00 0.00 C ATOM 304 N6 DA B 110 -2.141 4.905 -11.427 1.00 0.00 N ATOM 305 N1 DA B 110 -0.705 3.613 -10.158 1.00 0.00 N ATOM 306 C2 DA B 110 0.495 3.068 -9.961 1.00 0.00 C ATOM 307 N3 DA B 110 1.566 3.174 -10.745 1.00 0.00 N ATOM 308 C4 DA B 110 1.307 3.936 -11.827 1.00 0.00 C ATOM 0 H5' DA B 110 5.276 7.196 -13.839 1.00 0.00 H new ATOM 0 H5'' DA B 110 5.893 6.537 -15.341 1.00 0.00 H new ATOM 0 H4' DA B 110 6.469 5.059 -13.551 1.00 0.00 H new ATOM 0 H3' DA B 110 5.119 4.147 -15.830 1.00 0.00 H new ATOM 0 H2' DA B 110 3.089 3.435 -15.011 1.00 0.00 H new ATOM 0 H2'' DA B 110 3.998 2.137 -14.266 1.00 0.00 H new ATOM 0 H1' DA B 110 3.735 3.037 -12.176 1.00 0.00 H new ATOM 0 H8 DA B 110 1.887 5.454 -14.594 1.00 0.00 H new ATOM 0 H61 DA B 110 -2.880 4.742 -10.743 1.00 0.00 H new ATOM 0 H62 DA B 110 -2.325 5.479 -12.250 1.00 0.00 H new ATOM 0 H2 DA B 110 0.612 2.475 -9.066 1.00 0.00 H new ATOM 320 P DA B 111 6.335 1.553 -15.482 1.00 0.00 P ATOM 321 OP1 DA B 111 7.752 1.251 -15.777 1.00 0.00 O ATOM 322 OP2 DA B 111 5.347 1.629 -16.581 1.00 0.00 O ATOM 323 O5' DA B 111 5.804 0.492 -14.393 1.00 0.00 O ATOM 324 C5' DA B 111 6.523 0.334 -13.165 1.00 0.00 C ATOM 325 C4' DA B 111 5.854 -0.662 -12.212 1.00 0.00 C ATOM 326 O4' DA B 111 4.591 -0.131 -11.748 1.00 0.00 O ATOM 327 C3' DA B 111 5.590 -2.021 -12.872 1.00 0.00 C ATOM 328 O3' DA B 111 6.277 -3.053 -12.164 1.00 0.00 O ATOM 329 C2' DA B 111 4.100 -2.245 -12.764 1.00 0.00 C ATOM 330 C1' DA B 111 3.518 -1.062 -11.997 1.00 0.00 C ATOM 331 N9 DA B 111 2.439 -0.425 -12.776 1.00 0.00 N ATOM 332 C8 DA B 111 2.480 0.060 -14.046 1.00 0.00 C ATOM 333 N7 DA B 111 1.362 0.549 -14.489 1.00 0.00 N ATOM 334 C5 DA B 111 0.497 0.374 -13.413 1.00 0.00 C ATOM 335 C6 DA B 111 -0.854 0.682 -13.224 1.00 0.00 C ATOM 336 N6 DA B 111 -1.610 1.257 -14.161 1.00 0.00 N ATOM 337 N1 DA B 111 -1.399 0.371 -12.036 1.00 0.00 N ATOM 338 C2 DA B 111 -0.660 -0.210 -11.089 1.00 0.00 C ATOM 339 N3 DA B 111 0.625 -0.543 -11.165 1.00 0.00 N ATOM 340 C4 DA B 111 1.143 -0.220 -12.365 1.00 0.00 C ATOM 0 H5' DA B 111 6.608 1.302 -12.671 1.00 0.00 H new ATOM 0 H5'' DA B 111 7.537 -0.003 -13.383 1.00 0.00 H new ATOM 0 H4' DA B 111 6.545 -0.811 -11.382 1.00 0.00 H new ATOM 0 H3' DA B 111 5.935 -2.037 -13.906 1.00 0.00 H new ATOM 0 H2' DA B 111 3.650 -2.320 -13.754 1.00 0.00 H new ATOM 0 H2'' DA B 111 3.889 -3.180 -12.246 1.00 0.00 H new ATOM 0 H1' DA B 111 3.085 -1.394 -11.053 1.00 0.00 H new ATOM 0 H8 DA B 111 3.379 0.040 -14.644 1.00 0.00 H new ATOM 0 H61 DA B 111 -2.591 1.460 -13.971 1.00 0.00 H new ATOM 0 H62 DA B 111 -1.207 1.493 -15.068 1.00 0.00 H new ATOM 0 H2 DA B 111 -1.161 -0.434 -10.159 1.00 0.00 H new ATOM 352 P DA B 112 6.237 -4.586 -12.662 1.00 0.00 P ATOM 353 OP1 DA B 112 7.432 -5.277 -12.129 1.00 0.00 O ATOM 354 OP2 DA B 112 5.967 -4.594 -14.118 1.00 0.00 O ATOM 355 O5' DA B 112 4.939 -5.163 -11.902 1.00 0.00 O ATOM 356 C5' DA B 112 4.878 -5.155 -10.477 1.00 0.00 C ATOM 357 C4' DA B 112 3.512 -5.625 -9.960 1.00 0.00 C ATOM 358 O4' DA B 112 2.494 -4.702 -10.422 1.00 0.00 O ATOM 359 C3' DA B 112 3.127 -7.013 -10.483 1.00 0.00 C ATOM 360 O3' DA B 112 2.576 -7.800 -9.413 1.00 0.00 O ATOM 361 C2' DA B 112 2.086 -6.769 -11.542 1.00 0.00 C ATOM 362 C1' DA B 112 1.536 -5.376 -11.276 1.00 0.00 C ATOM 363 N9 DA B 112 1.313 -4.630 -12.537 1.00 0.00 N ATOM 364 C8 DA B 112 2.139 -4.460 -13.615 1.00 0.00 C ATOM 365 N7 DA B 112 1.646 -3.746 -14.581 1.00 0.00 N ATOM 366 C5 DA B 112 0.378 -3.414 -14.111 1.00 0.00 C ATOM 367 C6 DA B 112 -0.666 -2.663 -14.656 1.00 0.00 C ATOM 368 N6 DA B 112 -0.582 -2.050 -15.838 1.00 0.00 N ATOM 369 N1 DA B 112 -1.787 -2.535 -13.923 1.00 0.00 N ATOM 370 C2 DA B 112 -1.870 -3.110 -12.723 1.00 0.00 C ATOM 371 N3 DA B 112 -0.940 -3.840 -12.116 1.00 0.00 N ATOM 372 C4 DA B 112 0.167 -3.952 -12.873 1.00 0.00 C ATOM 0 H5' DA B 112 5.078 -4.148 -10.111 1.00 0.00 H new ATOM 0 H5'' DA B 112 5.659 -5.801 -10.077 1.00 0.00 H new ATOM 0 H4' DA B 112 3.581 -5.666 -8.873 1.00 0.00 H new ATOM 0 H3' DA B 112 3.985 -7.555 -10.881 1.00 0.00 H new ATOM 0 H2' DA B 112 2.521 -6.833 -12.539 1.00 0.00 H new ATOM 0 H2'' DA B 112 1.295 -7.517 -11.491 1.00 0.00 H new ATOM 0 H1' DA B 112 0.563 -5.435 -10.789 1.00 0.00 H new ATOM 0 H8 DA B 112 3.129 -4.889 -13.659 1.00 0.00 H new ATOM 0 H61 DA B 112 -1.374 -1.513 -16.192 1.00 0.00 H new ATOM 0 H62 DA B 112 0.274 -2.118 -16.388 1.00 0.00 H new ATOM 0 H2 DA B 112 -2.795 -2.967 -12.185 1.00 0.00 H new ATOM 384 P DC B 113 2.077 -9.316 -9.659 1.00 0.00 P ATOM 385 OP1 DC B 113 2.359 -10.093 -8.432 1.00 0.00 O ATOM 386 OP2 DC B 113 2.621 -9.773 -10.957 1.00 0.00 O ATOM 387 O5' DC B 113 0.471 -9.175 -9.806 1.00 0.00 O ATOM 388 C5' DC B 113 -0.314 -8.704 -8.701 1.00 0.00 C ATOM 389 C4' DC B 113 -1.817 -8.636 -9.022 1.00 0.00 C ATOM 390 O4' DC B 113 -2.110 -7.557 -9.939 1.00 0.00 O ATOM 391 C3' DC B 113 -2.342 -9.940 -9.635 1.00 0.00 C ATOM 392 O3' DC B 113 -3.377 -10.493 -8.823 1.00 0.00 O ATOM 393 C2' DC B 113 -2.933 -9.550 -10.969 1.00 0.00 C ATOM 394 C1' DC B 113 -2.912 -8.033 -11.044 1.00 0.00 C ATOM 395 N1 DC B 113 -2.346 -7.550 -12.327 1.00 0.00 N ATOM 396 C2 DC B 113 -3.127 -6.721 -13.130 1.00 0.00 C ATOM 397 O2 DC B 113 -4.288 -6.467 -12.813 1.00 0.00 O ATOM 398 N3 DC B 113 -2.570 -6.208 -14.258 1.00 0.00 N ATOM 399 C4 DC B 113 -1.305 -6.488 -14.590 1.00 0.00 C ATOM 400 N4 DC B 113 -0.801 -5.968 -15.706 1.00 0.00 N ATOM 401 C5 DC B 113 -0.499 -7.343 -13.768 1.00 0.00 C ATOM 402 C6 DC B 113 -1.068 -7.853 -12.657 1.00 0.00 C ATOM 0 H5' DC B 113 0.035 -7.714 -8.409 1.00 0.00 H new ATOM 0 H5'' DC B 113 -0.159 -9.361 -7.845 1.00 0.00 H new ATOM 0 H4' DC B 113 -2.316 -8.465 -8.068 1.00 0.00 H new ATOM 0 H3' DC B 113 -1.547 -10.680 -9.723 1.00 0.00 H new ATOM 0 H2' DC B 113 -2.357 -9.984 -11.786 1.00 0.00 H new ATOM 0 H2'' DC B 113 -3.952 -9.926 -11.063 1.00 0.00 H new ATOM 0 H1' DC B 113 -3.932 -7.653 -10.987 1.00 0.00 H new ATOM 0 H41 DC B 113 0.162 -6.171 -15.974 1.00 0.00 H new ATOM 0 H42 DC B 113 -1.378 -5.366 -16.294 1.00 0.00 H new ATOM 0 H5 DC B 113 0.524 -7.570 -14.029 1.00 0.00 H new ATOM 0 H6 DC B 113 -0.496 -8.513 -12.021 1.00 0.00 H new ATOM 414 P DA B 114 -4.098 -11.875 -9.231 1.00 0.00 P ATOM 415 OP1 DA B 114 -4.653 -12.486 -8.004 1.00 0.00 O ATOM 416 OP2 DA B 114 -3.167 -12.649 -10.084 1.00 0.00 O ATOM 417 O5' DA B 114 -5.332 -11.379 -10.148 1.00 0.00 O ATOM 418 C5' DA B 114 -6.332 -10.506 -9.619 1.00 0.00 C ATOM 419 C4' DA B 114 -7.412 -10.161 -10.659 1.00 0.00 C ATOM 420 O4' DA B 114 -6.880 -9.296 -11.701 1.00 0.00 O ATOM 421 C3' DA B 114 -7.962 -11.422 -11.336 1.00 0.00 C ATOM 422 O3' DA B 114 -9.394 -11.415 -11.302 1.00 0.00 O ATOM 423 C2' DA B 114 -7.478 -11.351 -12.764 1.00 0.00 C ATOM 424 C1' DA B 114 -7.056 -9.912 -13.002 1.00 0.00 C ATOM 425 N9 DA B 114 -5.824 -9.829 -13.807 1.00 0.00 N ATOM 426 C8 DA B 114 -4.622 -10.398 -13.564 1.00 0.00 C ATOM 427 N7 DA B 114 -3.679 -10.099 -14.404 1.00 0.00 N ATOM 428 C5 DA B 114 -4.319 -9.250 -15.300 1.00 0.00 C ATOM 429 C6 DA B 114 -3.877 -8.575 -16.441 1.00 0.00 C ATOM 430 N6 DA B 114 -2.620 -8.638 -16.881 1.00 0.00 N ATOM 431 N1 DA B 114 -4.772 -7.822 -17.102 1.00 0.00 N ATOM 432 C2 DA B 114 -6.029 -7.733 -16.667 1.00 0.00 C ATOM 433 N3 DA B 114 -6.552 -8.327 -15.593 1.00 0.00 N ATOM 434 C4 DA B 114 -5.629 -9.078 -14.950 1.00 0.00 C ATOM 0 H5' DA B 114 -5.861 -9.588 -9.268 1.00 0.00 H new ATOM 0 H5'' DA B 114 -6.800 -10.975 -8.754 1.00 0.00 H new ATOM 0 H4' DA B 114 -8.209 -9.652 -10.117 1.00 0.00 H new ATOM 0 H3' DA B 114 -7.629 -12.331 -10.836 1.00 0.00 H new ATOM 0 H2' DA B 114 -6.643 -12.033 -12.925 1.00 0.00 H new ATOM 0 H2'' DA B 114 -8.267 -11.644 -13.457 1.00 0.00 H new ATOM 0 H1' DA B 114 -7.821 -9.387 -13.574 1.00 0.00 H new ATOM 0 H8 DA B 114 -4.457 -11.058 -12.725 1.00 0.00 H new ATOM 0 H61 DA B 114 -2.347 -8.126 -17.720 1.00 0.00 H new ATOM 0 H62 DA B 114 -1.931 -9.198 -16.379 1.00 0.00 H new ATOM 0 H2 DA B 114 -6.696 -7.113 -17.247 1.00 0.00 H new ATOM 446 P DT B 115 -10.252 -12.622 -11.943 1.00 0.00 P ATOM 447 OP1 DT B 115 -11.560 -12.672 -11.251 1.00 0.00 O ATOM 448 OP2 DT B 115 -9.395 -13.828 -11.983 1.00 0.00 O ATOM 449 O5' DT B 115 -10.502 -12.129 -13.458 1.00 0.00 O ATOM 450 C5' DT B 115 -11.205 -10.909 -13.708 1.00 0.00 C ATOM 451 C4' DT B 115 -11.197 -10.520 -15.192 1.00 0.00 C ATOM 452 O4' DT B 115 -9.876 -10.096 -15.604 1.00 0.00 O ATOM 453 C3' DT B 115 -11.624 -11.678 -16.107 1.00 0.00 C ATOM 454 O3' DT B 115 -12.869 -11.388 -16.738 1.00 0.00 O ATOM 455 C2' DT B 115 -10.539 -11.782 -17.162 1.00 0.00 C ATOM 456 C1' DT B 115 -9.580 -10.617 -16.916 1.00 0.00 C ATOM 457 N1 DT B 115 -8.155 -11.045 -17.018 1.00 0.00 N ATOM 458 C2 DT B 115 -7.343 -10.413 -17.950 1.00 0.00 C ATOM 459 O2 DT B 115 -7.767 -9.526 -18.689 1.00 0.00 O ATOM 460 N3 DT B 115 -6.028 -10.837 -17.999 1.00 0.00 N ATOM 461 C4 DT B 115 -5.460 -11.823 -17.214 1.00 0.00 C ATOM 462 O4 DT B 115 -4.274 -12.120 -17.339 1.00 0.00 O ATOM 463 C5 DT B 115 -6.377 -12.428 -16.276 1.00 0.00 C ATOM 464 C7 DT B 115 -5.880 -13.556 -15.370 1.00 0.00 C ATOM 465 C6 DT B 115 -7.666 -12.025 -16.208 1.00 0.00 C ATOM 0 H5' DT B 115 -10.754 -10.107 -13.123 1.00 0.00 H new ATOM 0 H5'' DT B 115 -12.236 -11.011 -13.368 1.00 0.00 H new ATOM 0 H4' DT B 115 -11.915 -9.706 -15.291 1.00 0.00 H new ATOM 0 H3' DT B 115 -11.749 -12.602 -15.543 1.00 0.00 H new ATOM 0 H2' DT B 115 -10.017 -12.736 -17.089 1.00 0.00 H new ATOM 0 H2'' DT B 115 -10.966 -11.728 -18.164 1.00 0.00 H new ATOM 0 H1' DT B 115 -9.717 -9.848 -17.676 1.00 0.00 H new ATOM 0 H3 DT B 115 -5.420 -10.379 -18.678 1.00 0.00 H new ATOM 0 H71 DT B 115 -5.089 -14.109 -15.878 1.00 0.00 H new ATOM 0 H72 DT B 115 -5.490 -13.134 -14.444 1.00 0.00 H new ATOM 0 H73 DT B 115 -6.706 -14.230 -15.142 1.00 0.00 H new ATOM 0 H6 DT B 115 -8.326 -12.493 -15.492 1.00 0.00 H new ATOM 478 P DT B 116 -13.597 -12.493 -17.654 1.00 0.00 P ATOM 479 OP1 DT B 116 -15.032 -12.138 -17.754 1.00 0.00 O ATOM 480 OP2 DT B 116 -13.200 -13.834 -17.168 1.00 0.00 O ATOM 481 O5' DT B 116 -12.913 -12.247 -19.091 1.00 0.00 O ATOM 482 C5' DT B 116 -13.129 -11.021 -19.790 1.00 0.00 C ATOM 483 C4' DT B 116 -12.330 -10.953 -21.097 1.00 0.00 C ATOM 484 O4' DT B 116 -10.908 -10.990 -20.824 1.00 0.00 O ATOM 485 C3' DT B 116 -12.663 -12.115 -22.045 1.00 0.00 C ATOM 486 O3' DT B 116 -13.259 -11.626 -23.249 1.00 0.00 O ATOM 487 C2' DT B 116 -11.343 -12.787 -22.353 1.00 0.00 C ATOM 488 C1' DT B 116 -10.257 -11.961 -21.673 1.00 0.00 C ATOM 489 N1 DT B 116 -9.339 -12.828 -20.885 1.00 0.00 N ATOM 490 C2 DT B 116 -7.993 -12.839 -21.220 1.00 0.00 C ATOM 491 O2 DT B 116 -7.543 -12.166 -22.145 1.00 0.00 O ATOM 492 N3 DT B 116 -7.183 -13.650 -20.451 1.00 0.00 N ATOM 493 C4 DT B 116 -7.586 -14.439 -19.392 1.00 0.00 C ATOM 494 O4 DT B 116 -6.770 -15.127 -18.781 1.00 0.00 O ATOM 495 C5 DT B 116 -9.002 -14.365 -19.110 1.00 0.00 C ATOM 496 C7 DT B 116 -9.575 -15.199 -17.959 1.00 0.00 C ATOM 497 C6 DT B 116 -9.817 -13.576 -19.850 1.00 0.00 C ATOM 0 H5' DT B 116 -12.848 -10.185 -19.150 1.00 0.00 H new ATOM 0 H5'' DT B 116 -14.191 -10.911 -20.009 1.00 0.00 H new ATOM 0 H4' DT B 116 -12.607 -10.015 -21.578 1.00 0.00 H new ATOM 0 H3' DT B 116 -13.374 -12.806 -21.592 1.00 0.00 H new ATOM 0 H2' DT B 116 -11.336 -13.813 -21.984 1.00 0.00 H new ATOM 0 H2'' DT B 116 -11.175 -12.834 -23.429 1.00 0.00 H new ATOM 0 HO3' DT B 116 -13.463 -12.379 -23.842 1.00 0.00 H new ATOM 0 H1' DT B 116 -9.647 -11.456 -22.422 1.00 0.00 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0.00 C ATOM 684 O2 DT C 122 -4.176 -1.072 -9.915 1.00 0.00 O ATOM 685 N3 DT C 122 -4.138 0.584 -11.486 1.00 0.00 N ATOM 686 C4 DT C 122 -4.715 1.598 -12.228 1.00 0.00 C ATOM 687 O4 DT C 122 -4.056 2.216 -13.061 1.00 0.00 O ATOM 688 C5 DT C 122 -6.109 1.831 -11.927 1.00 0.00 C ATOM 689 C7 DT C 122 -6.852 2.940 -12.682 1.00 0.00 C ATOM 690 C6 DT C 122 -6.753 1.091 -10.989 1.00 0.00 C ATOM 0 H5' DT C 122 -10.381 -1.591 -10.760 1.00 0.00 H new ATOM 0 H5'' DT C 122 -11.239 -0.940 -9.378 1.00 0.00 H new ATOM 0 H4' DT C 122 -9.402 -2.163 -8.525 1.00 0.00 H new ATOM 0 H3' DT C 122 -9.509 0.704 -8.138 1.00 0.00 H new ATOM 0 H2' DT C 122 -7.268 1.243 -8.425 1.00 0.00 H new ATOM 0 H2'' DT C 122 -6.848 0.038 -7.224 1.00 0.00 H new ATOM 0 H1' DT C 122 -6.103 -1.405 -8.842 1.00 0.00 H new ATOM 0 H3 DT C 122 -3.154 0.384 -11.664 1.00 0.00 H new ATOM 0 H71 DT C 122 -7.906 2.676 -12.772 1.00 0.00 H new ATOM 0 H72 DT C 122 -6.759 3.878 -12.135 1.00 0.00 H new ATOM 0 H73 DT C 122 -6.421 3.055 -13.676 1.00 0.00 H new ATOM 0 H6 DT C 122 -7.795 1.288 -10.785 1.00 0.00 H new ATOM 703 P DT C 123 -8.918 0.338 -5.406 1.00 0.00 P ATOM 704 OP1 DT C 123 -9.723 -0.212 -4.294 1.00 0.00 O ATOM 705 OP2 DT C 123 -9.139 1.726 -5.867 1.00 0.00 O ATOM 706 O5' DT C 123 -7.363 0.184 -5.033 1.00 0.00 O ATOM 707 C5' DT C 123 -6.838 -1.089 -4.681 1.00 0.00 C ATOM 708 C4' DT C 123 -5.347 -1.020 -4.366 1.00 0.00 C ATOM 709 O4' DT C 123 -4.601 -0.617 -5.546 1.00 0.00 O ATOM 710 C3' DT C 123 -5.019 -0.007 -3.266 1.00 0.00 C ATOM 711 O3' DT C 123 -4.164 -0.650 -2.314 1.00 0.00 O ATOM 712 C2' DT C 123 -4.320 1.132 -3.949 1.00 0.00 C ATOM 713 C1' DT C 123 -3.804 0.559 -5.254 1.00 0.00 C ATOM 714 N1 DT C 123 -3.858 1.554 -6.374 1.00 0.00 N ATOM 715 C2 DT C 123 -2.669 1.835 -7.039 1.00 0.00 C ATOM 716 O2 DT C 123 -1.604 1.317 -6.711 1.00 0.00 O ATOM 717 N3 DT C 123 -2.746 2.734 -8.085 1.00 0.00 N ATOM 718 C4 DT C 123 -3.887 3.376 -8.526 1.00 0.00 C ATOM 719 O4 DT C 123 -3.840 4.157 -9.472 1.00 0.00 O ATOM 720 C5 DT C 123 -5.080 3.037 -7.787 1.00 0.00 C ATOM 721 C7 DT C 123 -6.400 3.706 -8.184 1.00 0.00 C ATOM 722 C6 DT C 123 -5.038 2.154 -6.754 1.00 0.00 C ATOM 0 H5' DT C 123 -7.004 -1.790 -5.499 1.00 0.00 H new ATOM 0 H5'' DT C 123 -7.375 -1.477 -3.815 1.00 0.00 H new ATOM 0 H4' DT C 123 -5.068 -2.019 -4.031 1.00 0.00 H new ATOM 0 H3' DT C 123 -5.900 0.358 -2.738 1.00 0.00 H new ATOM 0 H2' DT C 123 -5.003 1.963 -4.127 1.00 0.00 H new ATOM 0 H2'' DT C 123 -3.503 1.516 -3.338 1.00 0.00 H new ATOM 0 H1' DT C 123 -2.751 0.296 -5.154 1.00 0.00 H new ATOM 0 H3 DT C 123 -1.878 2.944 -8.578 1.00 0.00 H new ATOM 0 H71 DT C 123 -6.198 4.696 -8.592 1.00 0.00 H new ATOM 0 H72 DT C 123 -6.904 3.099 -8.936 1.00 0.00 H new ATOM 0 H73 DT C 123 -7.039 3.799 -7.306 1.00 0.00 H new ATOM 0 H6 DT C 123 -5.947 1.919 -6.221 1.00 0.00 H new ATOM 735 P DA C 124 -3.552 0.093 -1.025 1.00 0.00 P ATOM 736 OP1 DA C 124 -3.646 -0.823 0.131 1.00 0.00 O ATOM 737 OP2 DA C 124 -4.147 1.447 -0.947 1.00 0.00 O ATOM 738 O5' DA C 124 -1.990 0.253 -1.423 1.00 0.00 O ATOM 739 C5' DA C 124 -1.232 -0.937 -1.688 1.00 0.00 C ATOM 740 C4' DA C 124 0.263 -0.682 -1.959 1.00 0.00 C ATOM 741 O4' DA C 124 0.412 0.089 -3.179 1.00 0.00 O ATOM 742 C3' DA C 124 0.921 0.117 -0.825 1.00 0.00 C ATOM 743 O3' DA C 124 2.199 -0.420 -0.472 1.00 0.00 O ATOM 744 C2' DA C 124 1.091 1.510 -1.368 1.00 0.00 C ATOM 745 C1' DA C 124 0.890 1.419 -2.873 1.00 0.00 C ATOM 746 N9 DA C 124 -0.054 2.445 -3.336 1.00 0.00 N ATOM 747 C8 DA C 124 -1.291 2.716 -2.870 1.00 0.00 C ATOM 748 N7 DA C 124 -1.922 3.671 -3.483 1.00 0.00 N ATOM 749 C5 DA C 124 -1.006 4.070 -4.453 1.00 0.00 C ATOM 750 C6 DA C 124 -1.048 5.050 -5.446 1.00 0.00 C ATOM 751 N6 DA C 124 -2.097 5.854 -5.624 1.00 0.00 N ATOM 752 N1 DA C 124 0.037 5.181 -6.234 1.00 0.00 N ATOM 753 C2 DA C 124 1.099 4.390 -6.050 1.00 0.00 C ATOM 754 N3 DA C 124 1.236 3.432 -5.140 1.00 0.00 N ATOM 755 C4 DA C 124 0.135 3.328 -4.371 1.00 0.00 C ATOM 0 H5' DA C 124 -1.665 -1.447 -2.549 1.00 0.00 H new ATOM 0 H5'' DA C 124 -1.326 -1.612 -0.837 1.00 0.00 H new ATOM 0 H4' DA C 124 0.746 -1.656 -2.040 1.00 0.00 H new ATOM 0 H3' DA C 124 0.310 0.085 0.077 1.00 0.00 H new ATOM 0 H2' DA C 124 0.367 2.191 -0.921 1.00 0.00 H new ATOM 0 H2'' DA C 124 2.082 1.899 -1.132 1.00 0.00 H new ATOM 0 H1' DA C 124 1.832 1.600 -3.391 1.00 0.00 H new ATOM 0 H8 DA C 124 -1.727 2.175 -2.043 1.00 0.00 H new ATOM 0 H61 DA C 124 -2.082 6.556 -6.364 1.00 0.00 H new ATOM 0 H62 DA C 124 -2.915 5.767 -5.020 1.00 0.00 H new ATOM 0 H2 DA C 124 1.937 4.547 -6.713 1.00 0.00 H new ATOM 767 P DT C 125 3.064 0.274 0.705 1.00 0.00 P ATOM 768 OP1 DT C 125 3.932 -0.761 1.311 1.00 0.00 O ATOM 769 OP2 DT C 125 2.137 1.050 1.559 1.00 0.00 O ATOM 770 O5' DT C 125 4.005 1.315 -0.101 1.00 0.00 O ATOM 771 C5' DT C 125 4.916 0.816 -1.084 1.00 0.00 C ATOM 772 C4' DT C 125 5.636 1.918 -1.883 1.00 0.00 C ATOM 773 O4' DT C 125 4.713 2.588 -2.784 1.00 0.00 O ATOM 774 C3' DT C 125 6.275 3.003 -0.994 1.00 0.00 C ATOM 775 O3' DT C 125 7.672 3.149 -1.307 1.00 0.00 O ATOM 776 C2' DT C 125 5.540 4.275 -1.328 1.00 0.00 C ATOM 777 C1' DT C 125 4.895 4.018 -2.681 1.00 0.00 C ATOM 778 N1 DT C 125 3.615 4.764 -2.892 1.00 0.00 N ATOM 779 C2 DT C 125 3.485 5.506 -4.066 1.00 0.00 C ATOM 780 O2 DT C 125 4.389 5.576 -4.895 1.00 0.00 O ATOM 781 N3 DT C 125 2.279 6.155 -4.252 1.00 0.00 N ATOM 782 C4 DT C 125 1.200 6.125 -3.387 1.00 0.00 C ATOM 783 O4 DT C 125 0.144 6.669 -3.678 1.00 0.00 O ATOM 784 C5 DT C 125 1.421 5.347 -2.198 1.00 0.00 C ATOM 785 C7 DT C 125 0.321 5.290 -1.147 1.00 0.00 C ATOM 786 C6 DT C 125 2.588 4.701 -1.987 1.00 0.00 C ATOM 0 H5' DT C 125 4.372 0.175 -1.777 1.00 0.00 H new ATOM 0 H5'' DT C 125 5.662 0.192 -0.591 1.00 0.00 H new ATOM 0 H4' DT C 125 6.426 1.402 -2.429 1.00 0.00 H new ATOM 0 H3' DT C 125 6.204 2.751 0.064 1.00 0.00 H new ATOM 0 H2' DT C 125 4.790 4.507 -0.572 1.00 0.00 H new ATOM 0 H2'' DT C 125 6.222 5.124 -1.372 1.00 0.00 H new ATOM 0 H1' DT C 125 5.545 4.394 -3.471 1.00 0.00 H new ATOM 0 H3 DT C 125 2.175 6.706 -5.104 1.00 0.00 H new ATOM 0 H71 DT C 125 0.365 4.334 -0.626 1.00 0.00 H new ATOM 0 H72 DT C 125 0.459 6.100 -0.431 1.00 0.00 H new ATOM 0 H73 DT C 125 -0.650 5.395 -1.631 1.00 0.00 H new ATOM 0 H6 DT C 125 2.715 4.122 -1.084 1.00 0.00 H new ATOM 799 P DC C 126 8.599 4.225 -0.536 1.00 0.00 P ATOM 800 OP1 DC C 126 9.960 3.664 -0.392 1.00 0.00 O ATOM 801 OP2 DC C 126 7.867 4.687 0.665 1.00 0.00 O ATOM 802 O5' DC C 126 8.669 5.458 -1.588 1.00 0.00 O ATOM 803 C5' DC C 126 9.283 5.256 -2.872 1.00 0.00 C ATOM 804 C4' DC C 126 9.276 6.514 -3.765 1.00 0.00 C ATOM 805 O4' DC C 126 7.932 6.799 -4.234 1.00 0.00 O ATOM 806 C3' DC C 126 9.807 7.759 -3.036 1.00 0.00 C ATOM 807 O3' DC C 126 11.018 8.227 -3.630 1.00 0.00 O ATOM 808 C2' DC C 126 8.737 8.816 -3.205 1.00 0.00 C ATOM 809 C1' DC C 126 7.576 8.173 -3.962 1.00 0.00 C ATOM 810 N1 DC C 126 6.338 8.240 -3.145 1.00 0.00 N ATOM 811 C2 DC C 126 5.223 8.904 -3.658 1.00 0.00 C ATOM 812 O2 DC C 126 5.273 9.449 -4.762 1.00 0.00 O ATOM 813 N3 DC C 126 4.098 8.946 -2.899 1.00 0.00 N ATOM 814 C4 DC C 126 4.059 8.368 -1.692 1.00 0.00 C ATOM 815 N4 DC C 126 2.940 8.428 -0.979 1.00 0.00 N ATOM 816 C5 DC C 126 5.198 7.690 -1.163 1.00 0.00 C ATOM 817 C6 DC C 126 6.306 7.650 -1.919 1.00 0.00 C ATOM 0 H5' DC C 126 8.764 4.450 -3.391 1.00 0.00 H new ATOM 0 H5'' DC C 126 10.313 4.930 -2.726 1.00 0.00 H new ATOM 0 H4' DC C 126 9.937 6.295 -4.603 1.00 0.00 H new ATOM 0 H3' DC C 126 10.020 7.533 -1.991 1.00 0.00 H new ATOM 0 H2' DC C 126 8.405 9.185 -2.235 1.00 0.00 H new ATOM 0 H2'' DC C 126 9.127 9.672 -3.755 1.00 0.00 H new ATOM 0 H1' DC C 126 7.388 8.701 -4.897 1.00 0.00 H new ATOM 0 H41 DC C 126 2.898 7.991 -0.058 1.00 0.00 H new ATOM 0 H42 DC C 126 2.123 8.911 -1.352 1.00 0.00 H new ATOM 0 H5 DC C 126 5.169 7.225 -0.188 1.00 0.00 H new ATOM 0 H6 DC C 126 7.185 7.142 -1.549 1.00 0.00 H new ATOM 829 P DT C 127 11.892 9.374 -2.905 1.00 0.00 P ATOM 830 OP1 DT C 127 13.286 9.268 -3.387 1.00 0.00 O ATOM 831 OP2 DT C 127 11.607 9.323 -1.454 1.00 0.00 O ATOM 832 O5' DT C 127 11.256 10.732 -3.494 1.00 0.00 O ATOM 833 C5' DT C 127 11.270 10.991 -4.898 1.00 0.00 C ATOM 834 C4' DT C 127 10.473 12.253 -5.253 1.00 0.00 C ATOM 835 O4' DT C 127 9.064 12.020 -5.023 1.00 0.00 O ATOM 836 C3' DT C 127 10.897 13.470 -4.412 1.00 0.00 C ATOM 837 O3' DT C 127 11.371 14.523 -5.261 1.00 0.00 O ATOM 838 C2' DT C 127 9.646 13.916 -3.682 1.00 0.00 C ATOM 839 C1' DT C 127 8.489 13.103 -4.262 1.00 0.00 C ATOM 840 N1 DT C 127 7.586 12.590 -3.184 1.00 0.00 N ATOM 841 C2 DT C 127 6.249 12.970 -3.225 1.00 0.00 C ATOM 842 O2 DT C 127 5.801 13.678 -4.123 1.00 0.00 O ATOM 843 N3 DT C 127 5.450 12.503 -2.200 1.00 0.00 N ATOM 844 C4 DT C 127 5.851 11.704 -1.149 1.00 0.00 C ATOM 845 O4 DT C 127 5.047 11.352 -0.289 1.00 0.00 O ATOM 846 C5 DT C 127 7.251 11.352 -1.176 1.00 0.00 C ATOM 847 C7 DT C 127 7.811 10.485 -0.041 1.00 0.00 C ATOM 848 C6 DT C 127 8.063 11.791 -2.171 1.00 0.00 C ATOM 0 H5' DT C 127 10.852 10.136 -5.429 1.00 0.00 H new ATOM 0 H5'' DT C 127 12.300 11.104 -5.236 1.00 0.00 H new ATOM 0 H4' DT C 127 10.674 12.469 -6.302 1.00 0.00 H new ATOM 0 H3' DT C 127 11.704 13.220 -3.723 1.00 0.00 H new ATOM 0 H2' DT C 127 9.741 13.744 -2.610 1.00 0.00 H new ATOM 0 H2'' DT C 127 9.477 14.984 -3.820 1.00 0.00 H new ATOM 0 H1' DT C 127 7.871 13.731 -4.903 1.00 0.00 H new ATOM 0 H3 DT C 127 4.467 12.775 -2.222 1.00 0.00 H new ATOM 0 H71 DT C 127 7.250 10.676 0.874 1.00 0.00 H new ATOM 0 H72 DT C 127 7.721 9.432 -0.309 1.00 0.00 H new ATOM 0 H73 DT C 127 8.861 10.730 0.120 1.00 0.00 H new ATOM 0 H6 DT C 127 9.105 11.507 -2.167 1.00 0.00 H new ATOM 861 P DG C 128 11.917 15.912 -4.645 1.00 0.00 P ATOM 862 OP1 DG C 128 12.840 16.518 -5.630 1.00 0.00 O ATOM 863 OP2 DG C 128 12.383 15.655 -3.263 1.00 0.00 O ATOM 864 O5' DG C 128 10.592 16.828 -4.571 1.00 0.00 O ATOM 865 C5' DG C 128 9.874 17.156 -5.762 1.00 0.00 C ATOM 866 C4' DG C 128 8.648 18.031 -5.477 1.00 0.00 C ATOM 867 O4' DG C 128 7.686 17.295 -4.692 1.00 0.00 O ATOM 868 C3' DG C 128 9.003 19.317 -4.718 1.00 0.00 C ATOM 869 O3' DG C 128 8.615 20.455 -5.491 1.00 0.00 O ATOM 870 C2' DG C 128 8.208 19.267 -3.430 1.00 0.00 C ATOM 871 C1' DG C 128 7.355 18.004 -3.480 1.00 0.00 C ATOM 872 N9 DG C 128 7.612 17.165 -2.303 1.00 0.00 N ATOM 873 C8 DG C 128 8.792 16.660 -1.877 1.00 0.00 C ATOM 874 N7 DG C 128 8.735 15.952 -0.789 1.00 0.00 N ATOM 875 C5 DG C 128 7.381 15.996 -0.456 1.00 0.00 C ATOM 876 C6 DG C 128 6.691 15.408 0.637 1.00 0.00 C ATOM 877 O6 DG C 128 7.149 14.719 1.546 1.00 0.00 O ATOM 878 N1 DG C 128 5.333 15.699 0.597 1.00 0.00 N ATOM 879 C2 DG C 128 4.714 16.459 -0.374 1.00 0.00 C ATOM 880 N2 DG C 128 3.398 16.626 -0.243 1.00 0.00 N ATOM 881 N3 DG C 128 5.360 17.013 -1.404 1.00 0.00 N ATOM 882 C4 DG C 128 6.686 16.740 -1.381 1.00 0.00 C ATOM 0 H5' DG C 128 9.556 16.238 -6.257 1.00 0.00 H new ATOM 0 H5'' DG C 128 10.537 17.677 -6.452 1.00 0.00 H new ATOM 0 H4' DG C 128 8.233 18.307 -6.446 1.00 0.00 H new ATOM 0 H3' DG C 128 10.073 19.395 -4.526 1.00 0.00 H new ATOM 0 H2' DG C 128 8.873 19.249 -2.567 1.00 0.00 H new ATOM 0 H2'' DG C 128 7.580 20.152 -3.330 1.00 0.00 H new ATOM 0 H1' DG C 128 6.296 18.262 -3.474 1.00 0.00 H new ATOM 0 H8 DG C 128 9.718 16.833 -2.405 1.00 0.00 H new ATOM 0 H1 DG C 128 4.749 15.322 1.343 1.00 0.00 H new ATOM 0 H21 DG C 128 2.883 17.178 -0.929 1.00 0.00 H new ATOM 0 H22 DG C 128 2.906 16.202 0.543 1.00 0.00 H new ATOM 894 P DC C 129 9.014 21.952 -5.056 1.00 0.00 P ATOM 895 OP1 DC C 129 9.002 22.803 -6.266 1.00 0.00 O ATOM 896 OP2 DC C 129 10.230 21.884 -4.216 1.00 0.00 O ATOM 897 O5' DC C 129 7.780 22.393 -4.120 1.00 0.00 O ATOM 898 C5' DC C 129 6.450 22.427 -4.640 1.00 0.00 C ATOM 899 C4' DC C 129 5.437 22.875 -3.578 1.00 0.00 C ATOM 900 O4' DC C 129 5.374 21.915 -2.493 1.00 0.00 O ATOM 901 C3' DC C 129 5.814 24.235 -2.978 1.00 0.00 C ATOM 902 O3' DC C 129 4.729 25.157 -3.122 1.00 0.00 O ATOM 903 C2' DC C 129 6.092 23.984 -1.521 1.00 0.00 C ATOM 904 C1' DC C 129 5.696 22.549 -1.231 1.00 0.00 C ATOM 905 N1 DC C 129 6.787 21.810 -0.532 1.00 0.00 N ATOM 906 C2 DC C 129 6.515 21.282 0.729 1.00 0.00 C ATOM 907 O2 DC C 129 5.425 21.490 1.258 1.00 0.00 O ATOM 908 N3 DC C 129 7.477 20.549 1.348 1.00 0.00 N ATOM 909 C4 DC C 129 8.661 20.335 0.766 1.00 0.00 C ATOM 910 N4 DC C 129 9.575 19.597 1.400 1.00 0.00 N ATOM 911 C5 DC C 129 8.954 20.877 -0.526 1.00 0.00 C ATOM 912 C6 DC C 129 7.995 21.605 -1.137 1.00 0.00 C ATOM 0 H5' DC C 129 6.178 21.438 -5.008 1.00 0.00 H new ATOM 0 H5'' DC C 129 6.409 23.106 -5.491 1.00 0.00 H new ATOM 0 H4' DC C 129 4.472 22.950 -4.079 1.00 0.00 H new ATOM 0 H3' DC C 129 6.679 24.667 -3.481 1.00 0.00 H new ATOM 0 H2' DC C 129 7.146 24.145 -1.297 1.00 0.00 H new ATOM 0 H2'' DC C 129 5.524 24.674 -0.896 1.00 0.00 H new ATOM 0 H1' DC C 129 4.833 22.534 -0.566 1.00 0.00 H new ATOM 0 H41 DC C 129 10.482 19.426 0.967 1.00 0.00 H new ATOM 0 H42 DC C 129 9.366 19.204 2.318 1.00 0.00 H new ATOM 0 H5 DC C 129 9.911 20.709 -0.997 1.00 0.00 H new ATOM 0 H6 DC C 129 8.184 22.029 -2.112 1.00 0.00 H new ATOM 924 P DA C 130 4.846 26.671 -2.578 1.00 0.00 P ATOM 925 OP1 DA C 130 3.910 27.512 -3.358 1.00 0.00 O ATOM 926 OP2 DA C 130 6.281 27.028 -2.525 1.00 0.00 O ATOM 927 O5' DA C 130 4.298 26.583 -1.057 1.00 0.00 O ATOM 928 C5' DA C 130 2.961 26.139 -0.787 1.00 0.00 C ATOM 929 C4' DA C 130 2.638 26.131 0.719 1.00 0.00 C ATOM 930 O4' DA C 130 3.377 25.078 1.398 1.00 0.00 O ATOM 931 C3' DA C 130 3.008 27.464 1.389 1.00 0.00 C ATOM 932 O3' DA C 130 1.923 27.954 2.186 1.00 0.00 O ATOM 933 C2' DA C 130 4.188 27.153 2.274 1.00 0.00 C ATOM 934 C1' DA C 130 4.218 25.644 2.433 1.00 0.00 C ATOM 935 N9 DA C 130 5.591 25.120 2.364 1.00 0.00 N ATOM 936 C8 DA C 130 6.529 25.324 1.410 1.00 0.00 C ATOM 937 N7 DA C 130 7.656 24.707 1.593 1.00 0.00 N ATOM 938 C5 DA C 130 7.446 24.027 2.788 1.00 0.00 C ATOM 939 C6 DA C 130 8.256 23.180 3.549 1.00 0.00 C ATOM 940 N6 DA C 130 9.500 22.857 3.198 1.00 0.00 N ATOM 941 N1 DA C 130 7.736 22.679 4.684 1.00 0.00 N ATOM 942 C2 DA C 130 6.492 22.993 5.048 1.00 0.00 C ATOM 943 N3 DA C 130 5.642 23.784 4.399 1.00 0.00 N ATOM 944 C4 DA C 130 6.191 24.270 3.268 1.00 0.00 C ATOM 0 H5' DA C 130 2.826 25.135 -1.190 1.00 0.00 H new ATOM 0 H5'' DA C 130 2.254 26.788 -1.304 1.00 0.00 H new ATOM 0 H4' DA C 130 1.564 25.965 0.803 1.00 0.00 H new ATOM 0 H3' DA C 130 3.234 28.231 0.648 1.00 0.00 H new ATOM 0 H2' DA C 130 5.114 27.515 1.828 1.00 0.00 H new ATOM 0 H2'' DA C 130 4.087 27.644 3.242 1.00 0.00 H new ATOM 0 H1' DA C 130 3.840 25.363 3.416 1.00 0.00 H new ATOM 0 H8 DA C 130 6.352 25.958 0.554 1.00 0.00 H new ATOM 0 H61 DA C 130 10.051 22.234 3.788 1.00 0.00 H new ATOM 0 H62 DA C 130 9.901 23.233 2.339 1.00 0.00 H new ATOM 0 H2 DA C 130 6.136 22.558 5.970 1.00 0.00 H new ATOM 956 P DA C 131 2.062 29.343 2.994 1.00 0.00 P ATOM 957 OP1 DA C 131 0.725 29.971 3.070 1.00 0.00 O ATOM 958 OP2 DA C 131 3.197 30.098 2.416 1.00 0.00 O ATOM 959 O5' DA C 131 2.481 28.867 4.482 1.00 0.00 O ATOM 960 C5' DA C 131 1.583 28.069 5.265 1.00 0.00 C ATOM 961 C4' DA C 131 2.157 27.718 6.648 1.00 0.00 C ATOM 962 O4' DA C 131 3.243 26.764 6.535 1.00 0.00 O ATOM 963 C3' DA C 131 2.692 28.952 7.387 1.00 0.00 C ATOM 964 O3' DA C 131 2.001 29.143 8.626 1.00 0.00 O ATOM 965 C2' DA C 131 4.147 28.667 7.659 1.00 0.00 C ATOM 966 C1' DA C 131 4.393 27.217 7.289 1.00 0.00 C ATOM 967 N9 DA C 131 5.629 27.070 6.511 1.00 0.00 N ATOM 968 C8 DA C 131 5.975 27.693 5.364 1.00 0.00 C ATOM 969 N7 DA C 131 7.134 27.360 4.876 1.00 0.00 N ATOM 970 C5 DA C 131 7.601 26.425 5.800 1.00 0.00 C ATOM 971 C6 DA C 131 8.783 25.677 5.880 1.00 0.00 C ATOM 972 N6 DA C 131 9.762 25.768 4.982 1.00 0.00 N ATOM 973 N1 DA C 131 8.922 24.848 6.931 1.00 0.00 N ATOM 974 C2 DA C 131 7.956 24.760 7.848 1.00 0.00 C ATOM 975 N3 DA C 131 6.802 25.422 7.865 1.00 0.00 N ATOM 976 C4 DA C 131 6.691 26.244 6.800 1.00 0.00 C ATOM 0 H5' DA C 131 1.356 27.149 4.726 1.00 0.00 H new ATOM 0 H5'' DA C 131 0.642 28.605 5.391 1.00 0.00 H new ATOM 0 H4' DA C 131 1.330 27.290 7.214 1.00 0.00 H new ATOM 0 H3' DA C 131 2.551 29.856 6.794 1.00 0.00 H new ATOM 0 H2' DA C 131 4.785 29.328 7.073 1.00 0.00 H new ATOM 0 H2'' DA C 131 4.385 28.843 8.708 1.00 0.00 H new ATOM 0 H1' DA C 131 4.520 26.613 8.187 1.00 0.00 H new ATOM 0 H8 DA C 131 5.334 28.418 4.885 1.00 0.00 H new ATOM 0 H61 DA C 131 10.604 25.201 5.086 1.00 0.00 H new ATOM 0 H62 DA C 131 9.670 26.405 4.190 1.00 0.00 H new ATOM 0 H2 DA C 131 8.130 24.076 8.666 1.00 0.00 H new ATOM 988 P DC C 132 2.376 30.377 9.596 1.00 0.00 P ATOM 989 OP1 DC C 132 1.189 30.699 10.419 1.00 0.00 O ATOM 990 OP2 DC C 132 3.012 31.432 8.776 1.00 0.00 O ATOM 991 O5' DC C 132 3.505 29.741 10.563 1.00 0.00 O ATOM 992 C5' DC C 132 3.221 28.560 11.323 1.00 0.00 C ATOM 993 C4' DC C 132 4.444 28.055 12.107 1.00 0.00 C ATOM 994 O4' DC C 132 5.437 27.490 11.219 1.00 0.00 O ATOM 995 C3' DC C 132 5.115 29.168 12.920 1.00 0.00 C ATOM 996 O3' DC C 132 4.917 28.961 14.321 1.00 0.00 O ATOM 997 C2' DC C 132 6.590 29.092 12.575 1.00 0.00 C ATOM 998 C1' DC C 132 6.756 27.948 11.588 1.00 0.00 C ATOM 999 N1 DC C 132 7.521 28.385 10.390 1.00 0.00 N ATOM 1000 C2 DC C 132 8.766 27.810 10.145 1.00 0.00 C ATOM 1001 O2 DC C 132 9.212 26.957 10.909 1.00 0.00 O ATOM 1002 N3 DC C 132 9.462 28.222 9.050 1.00 0.00 N ATOM 1003 C4 DC C 132 8.962 29.155 8.228 1.00 0.00 C ATOM 1004 N4 DC C 132 9.672 29.539 7.167 1.00 0.00 N ATOM 1005 C5 DC C 132 7.684 29.741 8.476 1.00 0.00 C ATOM 1006 C6 DC C 132 7.006 29.328 9.562 1.00 0.00 C ATOM 0 H5' DC C 132 2.874 27.774 10.651 1.00 0.00 H new ATOM 0 H5'' DC C 132 2.408 28.766 12.019 1.00 0.00 H new ATOM 0 H4' DC C 132 4.066 27.292 12.788 1.00 0.00 H new ATOM 0 H3' DC C 132 4.694 30.146 12.684 1.00 0.00 H new ATOM 0 H2' DC C 132 6.933 30.030 12.139 1.00 0.00 H new ATOM 0 H2'' DC C 132 7.187 28.919 13.470 1.00 0.00 H new ATOM 0 HO3' DC C 132 5.354 29.680 14.823 1.00 0.00 H new ATOM 0 H1' DC C 132 7.321 27.136 12.046 1.00 0.00 H new ATOM 0 H41 DC C 132 9.301 30.248 6.535 1.00 0.00 H new ATOM 0 H42 DC C 132 10.586 29.123 6.988 1.00 0.00 H new ATOM 0 H5 DC C 132 7.275 30.490 7.814 1.00 0.00 H new ATOM 0 H6 DC C 132 6.037 29.754 9.778 1.00 0.00 H new TER 1019 DC C 132 ATOM 1020 N LYS A 1 -6.281 15.067 11.348 1.00 0.00 N ATOM 1021 CA LYS A 1 -6.684 14.368 12.602 1.00 0.00 C ATOM 1022 C LYS A 1 -6.801 12.870 12.327 1.00 0.00 C ATOM 1023 O LYS A 1 -7.877 12.345 12.124 1.00 0.00 O ATOM 1024 CB LYS A 1 -8.029 14.913 13.081 1.00 0.00 C ATOM 1025 CG LYS A 1 -7.841 16.331 13.629 1.00 0.00 C ATOM 1026 CD LYS A 1 -9.200 17.027 13.739 1.00 0.00 C ATOM 1027 CE LYS A 1 -10.065 16.308 14.777 1.00 0.00 C ATOM 1028 NZ LYS A 1 -11.236 17.163 15.121 1.00 0.00 N ATOM 0 H1 LYS A 1 -5.815 15.966 11.586 1.00 0.00 H new ATOM 0 H2 LYS A 1 -5.622 14.467 10.812 1.00 0.00 H new ATOM 0 H3 LYS A 1 -7.124 15.257 10.770 1.00 0.00 H new ATOM 0 HA LYS A 1 -5.934 14.538 13.375 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -8.744 14.922 12.258 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -8.441 14.265 13.854 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -7.361 16.292 14.607 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -7.182 16.900 12.973 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -9.063 18.070 14.025 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -9.700 17.025 12.770 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -10.403 15.349 14.384 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -9.479 16.097 15.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -11.826 16.677 15.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -10.903 18.067 15.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -11.798 17.343 14.265 1.00 0.00 H new ATOM 1044 N ARG A 2 -5.695 12.184 12.327 1.00 0.00 N ATOM 1045 CA ARG A 2 -5.708 10.716 12.072 1.00 0.00 C ATOM 1046 C ARG A 2 -6.472 10.011 13.196 1.00 0.00 C ATOM 1047 O ARG A 2 -7.194 9.059 12.976 1.00 0.00 O ATOM 1048 CB ARG A 2 -4.268 10.199 12.019 1.00 0.00 C ATOM 1049 CG ARG A 2 -3.618 10.592 10.682 1.00 0.00 C ATOM 1050 CD ARG A 2 -3.507 12.120 10.553 1.00 0.00 C ATOM 1051 NE ARG A 2 -2.971 12.712 11.813 1.00 0.00 N ATOM 1052 CZ ARG A 2 -2.511 13.935 11.809 1.00 0.00 C ATOM 1053 NH1 ARG A 2 -2.510 14.625 10.702 1.00 0.00 N ATOM 1054 NH2 ARG A 2 -2.051 14.466 12.910 1.00 0.00 N ATOM 0 H ARG A 2 -4.771 12.581 12.495 1.00 0.00 H new ATOM 0 HA ARG A 2 -6.200 10.512 11.121 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -3.693 10.613 12.848 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -4.257 9.115 12.133 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -2.627 10.144 10.610 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -4.208 10.195 9.856 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -2.854 12.374 9.718 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -4.486 12.545 10.332 1.00 0.00 H new ATOM 0 HE ARG A 2 -2.964 12.165 12.674 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -2.868 14.210 9.842 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -2.151 15.580 10.697 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -2.050 13.926 13.775 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -1.692 15.421 12.905 1.00 0.00 H new ATOM 1068 N ALA A 3 -6.287 10.465 14.402 1.00 0.00 N ATOM 1069 CA ALA A 3 -6.967 9.834 15.572 1.00 0.00 C ATOM 1070 C ALA A 3 -8.483 9.743 15.349 1.00 0.00 C ATOM 1071 O ALA A 3 -9.158 10.741 15.198 1.00 0.00 O ATOM 1072 CB ALA A 3 -6.703 10.693 16.810 1.00 0.00 C ATOM 0 H ALA A 3 -5.686 11.256 14.633 1.00 0.00 H new ATOM 0 HA ALA A 3 -6.575 8.825 15.702 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -7.193 10.246 17.675 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -5.630 10.750 16.991 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -7.098 11.696 16.648 1.00 0.00 H new ATOM 1078 N GLY A 4 -9.026 8.551 15.353 1.00 0.00 N ATOM 1079 CA GLY A 4 -10.501 8.394 15.174 1.00 0.00 C ATOM 1080 C GLY A 4 -10.865 8.365 13.688 1.00 0.00 C ATOM 1081 O GLY A 4 -11.997 8.112 13.326 1.00 0.00 O ATOM 0 H GLY A 4 -8.510 7.679 15.473 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.835 7.474 15.653 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.022 9.216 15.665 1.00 0.00 H new ATOM 1085 N THR A 5 -9.934 8.649 12.821 1.00 0.00 N ATOM 1086 CA THR A 5 -10.271 8.661 11.371 1.00 0.00 C ATOM 1087 C THR A 5 -10.626 7.263 10.884 1.00 0.00 C ATOM 1088 O THR A 5 -9.804 6.367 10.863 1.00 0.00 O ATOM 1089 CB THR A 5 -9.088 9.174 10.552 1.00 0.00 C ATOM 1090 OG1 THR A 5 -8.517 10.292 11.206 1.00 0.00 O ATOM 1091 CG2 THR A 5 -9.565 9.587 9.148 1.00 0.00 C ATOM 0 H THR A 5 -8.965 8.871 13.050 1.00 0.00 H new ATOM 0 HA THR A 5 -11.129 9.321 11.239 1.00 0.00 H new ATOM 0 HB THR A 5 -8.343 8.384 10.458 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.035 11.096 10.992 1.00 0.00 H new ATOM 0 HG21 THR A 5 -8.717 9.952 8.568 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.004 8.726 8.645 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.312 10.376 9.235 1.00 0.00 H new ATOM 1099 N VAL A 6 -11.835 7.099 10.431 1.00 0.00 N ATOM 1100 CA VAL A 6 -12.283 5.799 9.863 1.00 0.00 C ATOM 1101 C VAL A 6 -12.704 6.097 8.431 1.00 0.00 C ATOM 1102 O VAL A 6 -13.288 7.127 8.159 1.00 0.00 O ATOM 1103 CB VAL A 6 -13.469 5.240 10.657 1.00 0.00 C ATOM 1104 CG1 VAL A 6 -12.974 4.687 11.994 1.00 0.00 C ATOM 1105 CG2 VAL A 6 -14.493 6.347 10.916 1.00 0.00 C ATOM 0 H VAL A 6 -12.548 7.828 10.431 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.490 5.053 9.906 1.00 0.00 H new ATOM 0 HB VAL A 6 -13.939 4.443 10.080 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -13.818 4.290 12.558 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -12.251 3.891 11.813 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -12.500 5.485 12.565 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -15.332 5.941 11.481 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -14.025 7.149 11.487 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -14.852 6.740 9.965 1.00 0.00 H new ATOM 1115 N CYS A 7 -12.417 5.246 7.505 1.00 0.00 N ATOM 1116 CA CYS A 7 -12.819 5.543 6.113 1.00 0.00 C ATOM 1117 C CYS A 7 -14.337 5.594 6.027 1.00 0.00 C ATOM 1118 O CYS A 7 -15.020 4.626 6.283 1.00 0.00 O ATOM 1119 CB CYS A 7 -12.270 4.459 5.206 1.00 0.00 C ATOM 1120 SG CYS A 7 -12.683 4.849 3.496 1.00 0.00 S ATOM 0 H CYS A 7 -11.926 4.363 7.645 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.421 6.508 5.800 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -11.189 4.384 5.323 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -12.689 3.491 5.482 1.00 0.00 H new ATOM 1125 N SER A 8 -14.872 6.724 5.678 1.00 0.00 N ATOM 1126 CA SER A 8 -16.345 6.840 5.589 1.00 0.00 C ATOM 1127 C SER A 8 -16.892 5.865 4.548 1.00 0.00 C ATOM 1128 O SER A 8 -17.939 5.278 4.735 1.00 0.00 O ATOM 1129 CB SER A 8 -16.725 8.264 5.188 1.00 0.00 C ATOM 1130 OG SER A 8 -16.384 9.154 6.242 1.00 0.00 O ATOM 0 H SER A 8 -14.352 7.572 5.451 1.00 0.00 H new ATOM 0 HA SER A 8 -16.773 6.602 6.563 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.204 8.548 4.274 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.793 8.323 4.978 1.00 0.00 H new ATOM 0 HG SER A 8 -15.440 9.406 6.165 1.00 0.00 H new ATOM 1136 N ASN A 9 -16.221 5.704 3.432 1.00 0.00 N ATOM 1137 CA ASN A 9 -16.763 4.788 2.392 1.00 0.00 C ATOM 1138 C ASN A 9 -16.607 3.319 2.785 1.00 0.00 C ATOM 1139 O ASN A 9 -17.490 2.533 2.508 1.00 0.00 O ATOM 1140 CB ASN A 9 -16.044 5.033 1.065 1.00 0.00 C ATOM 1141 CG ASN A 9 -16.464 6.391 0.503 1.00 0.00 C ATOM 1142 OD1 ASN A 9 -17.489 6.925 0.878 1.00 0.00 O ATOM 1143 ND2 ASN A 9 -15.714 6.977 -0.388 1.00 0.00 N ATOM 0 H ASN A 9 -15.338 6.160 3.203 1.00 0.00 H new ATOM 0 HA ASN A 9 -17.828 4.999 2.292 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -14.964 5.007 1.213 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -16.288 4.242 0.355 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -15.988 7.883 -0.769 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -14.853 6.530 -0.704 1.00 0.00 H new ATOM 1150 N CYS A 10 -15.502 2.909 3.396 1.00 0.00 N ATOM 1151 CA CYS A 10 -15.355 1.448 3.744 1.00 0.00 C ATOM 1152 C CYS A 10 -14.961 1.238 5.210 1.00 0.00 C ATOM 1153 O CYS A 10 -14.586 0.150 5.596 1.00 0.00 O ATOM 1154 CB CYS A 10 -14.338 0.768 2.805 1.00 0.00 C ATOM 1155 SG CYS A 10 -12.631 1.160 3.288 1.00 0.00 S ATOM 0 H CYS A 10 -14.719 3.507 3.661 1.00 0.00 H new ATOM 0 HA CYS A 10 -16.331 0.983 3.604 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -14.486 -0.312 2.826 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -14.512 1.094 1.779 1.00 0.00 H new ATOM 1160 N GLN A 11 -15.080 2.239 6.040 1.00 0.00 N ATOM 1161 CA GLN A 11 -14.766 2.068 7.491 1.00 0.00 C ATOM 1162 C GLN A 11 -13.354 1.523 7.741 1.00 0.00 C ATOM 1163 O GLN A 11 -12.964 1.352 8.880 1.00 0.00 O ATOM 1164 CB GLN A 11 -15.798 1.120 8.116 1.00 0.00 C ATOM 1165 CG GLN A 11 -17.166 1.811 8.164 1.00 0.00 C ATOM 1166 CD GLN A 11 -17.136 2.938 9.199 1.00 0.00 C ATOM 1167 OE1 GLN A 11 -16.678 2.748 10.309 1.00 0.00 O ATOM 1168 NE2 GLN A 11 -17.606 4.114 8.881 1.00 0.00 N ATOM 0 H GLN A 11 -15.384 3.176 5.774 1.00 0.00 H new ATOM 0 HA GLN A 11 -14.809 3.055 7.952 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -15.863 0.201 7.533 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -15.486 0.838 9.122 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -17.417 2.212 7.182 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -17.941 1.089 8.421 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -17.991 4.275 7.950 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -17.589 4.872 9.564 1.00 0.00 H new ATOM 1177 N THR A 12 -12.567 1.253 6.735 1.00 0.00 N ATOM 1178 CA THR A 12 -11.200 0.737 7.038 1.00 0.00 C ATOM 1179 C THR A 12 -10.465 1.801 7.867 1.00 0.00 C ATOM 1180 O THR A 12 -10.654 2.981 7.650 1.00 0.00 O ATOM 1181 CB THR A 12 -10.431 0.420 5.737 1.00 0.00 C ATOM 1182 OG1 THR A 12 -9.312 -0.395 6.049 1.00 0.00 O ATOM 1183 CG2 THR A 12 -9.944 1.693 5.042 1.00 0.00 C ATOM 0 H THR A 12 -12.799 1.362 5.748 1.00 0.00 H new ATOM 0 HA THR A 12 -11.267 -0.193 7.603 1.00 0.00 H new ATOM 0 HB THR A 12 -11.110 -0.096 5.059 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.819 -0.602 5.228 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.408 1.428 4.131 1.00 0.00 H new ATOM 0 HG22 THR A 12 -10.799 2.320 4.790 1.00 0.00 H new ATOM 0 HG23 THR A 12 -9.277 2.240 5.709 1.00 0.00 H new ATOM 1191 N SER A 13 -9.620 1.404 8.801 1.00 0.00 N ATOM 1192 CA SER A 13 -8.869 2.424 9.626 1.00 0.00 C ATOM 1193 C SER A 13 -7.400 2.390 9.204 1.00 0.00 C ATOM 1194 O SER A 13 -6.604 3.217 9.602 1.00 0.00 O ATOM 1195 CB SER A 13 -9.021 2.117 11.126 1.00 0.00 C ATOM 1196 OG SER A 13 -7.747 2.153 11.760 1.00 0.00 O ATOM 0 H SER A 13 -9.418 0.430 9.027 1.00 0.00 H new ATOM 0 HA SER A 13 -9.275 3.421 9.456 1.00 0.00 H new ATOM 0 HB2 SER A 13 -9.688 2.844 11.589 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.476 1.136 11.261 1.00 0.00 H new ATOM 0 HG SER A 13 -7.851 1.958 12.715 1.00 0.00 H new ATOM 1202 N THR A 14 -7.049 1.449 8.369 1.00 0.00 N ATOM 1203 CA THR A 14 -5.649 1.357 7.866 1.00 0.00 C ATOM 1204 C THR A 14 -5.626 1.936 6.454 1.00 0.00 C ATOM 1205 O THR A 14 -6.312 1.459 5.571 1.00 0.00 O ATOM 1206 CB THR A 14 -5.214 -0.110 7.821 1.00 0.00 C ATOM 1207 OG1 THR A 14 -6.232 -0.886 7.204 1.00 0.00 O ATOM 1208 CG2 THR A 14 -4.975 -0.619 9.242 1.00 0.00 C ATOM 0 H THR A 14 -7.680 0.733 8.010 1.00 0.00 H new ATOM 0 HA THR A 14 -4.971 1.905 8.520 1.00 0.00 H new ATOM 0 HB THR A 14 -4.291 -0.197 7.247 1.00 0.00 H new ATOM 0 HG1 THR A 14 -6.647 -0.367 6.484 1.00 0.00 H new ATOM 0 HG21 THR A 14 -4.665 -1.664 9.207 1.00 0.00 H new ATOM 0 HG22 THR A 14 -4.193 -0.024 9.715 1.00 0.00 H new ATOM 0 HG23 THR A 14 -5.896 -0.533 9.819 1.00 0.00 H new ATOM 1216 N THR A 15 -4.856 2.963 6.230 1.00 0.00 N ATOM 1217 CA THR A 15 -4.802 3.578 4.871 1.00 0.00 C ATOM 1218 C THR A 15 -3.388 4.055 4.597 1.00 0.00 C ATOM 1219 O THR A 15 -2.695 4.499 5.491 1.00 0.00 O ATOM 1220 CB THR A 15 -5.735 4.787 4.830 1.00 0.00 C ATOM 1221 OG1 THR A 15 -5.092 5.897 5.441 1.00 0.00 O ATOM 1222 CG2 THR A 15 -7.011 4.465 5.590 1.00 0.00 C ATOM 0 H THR A 15 -4.260 3.405 6.929 1.00 0.00 H new ATOM 0 HA THR A 15 -5.104 2.842 4.126 1.00 0.00 H new ATOM 0 HB THR A 15 -5.977 5.027 3.795 1.00 0.00 H new ATOM 0 HG1 THR A 15 -5.714 6.337 6.057 1.00 0.00 H new ATOM 0 HG21 THR A 15 -7.678 5.326 5.562 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.503 3.609 5.128 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.768 4.228 6.626 1.00 0.00 H new ATOM 1230 N THR A 16 -2.948 4.006 3.375 1.00 0.00 N ATOM 1231 CA THR A 16 -1.582 4.503 3.100 1.00 0.00 C ATOM 1232 C THR A 16 -1.626 6.032 3.188 1.00 0.00 C ATOM 1233 O THR A 16 -0.741 6.659 3.736 1.00 0.00 O ATOM 1234 CB THR A 16 -1.109 4.072 1.712 1.00 0.00 C ATOM 1235 OG1 THR A 16 -1.851 4.770 0.720 1.00 0.00 O ATOM 1236 CG2 THR A 16 -1.280 2.555 1.507 1.00 0.00 C ATOM 0 H THR A 16 -3.465 3.650 2.571 1.00 0.00 H new ATOM 0 HA THR A 16 -0.881 4.089 3.825 1.00 0.00 H new ATOM 0 HB THR A 16 -0.049 4.310 1.625 1.00 0.00 H new ATOM 0 HG1 THR A 16 -2.062 4.162 -0.019 1.00 0.00 H new ATOM 0 HG21 THR A 16 -0.934 2.281 0.510 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.695 2.019 2.254 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.332 2.290 1.612 1.00 0.00 H new ATOM 1244 N LEU A 17 -2.680 6.632 2.680 1.00 0.00 N ATOM 1245 CA LEU A 17 -2.823 8.126 2.763 1.00 0.00 C ATOM 1246 C LEU A 17 -4.308 8.464 2.956 1.00 0.00 C ATOM 1247 O LEU A 17 -5.162 7.959 2.256 1.00 0.00 O ATOM 1248 CB LEU A 17 -2.284 8.811 1.484 1.00 0.00 C ATOM 1249 CG LEU A 17 -1.721 10.210 1.818 1.00 0.00 C ATOM 1250 CD1 LEU A 17 -0.475 10.092 2.737 1.00 0.00 C ATOM 1251 CD2 LEU A 17 -1.360 10.949 0.503 1.00 0.00 C ATOM 0 H LEU A 17 -3.448 6.152 2.211 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.239 8.495 3.606 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.504 8.196 1.036 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.083 8.900 0.747 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.480 10.782 2.352 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.093 11.088 2.961 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.753 9.593 3.665 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.297 9.513 2.231 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -0.963 11.936 0.738 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.610 10.376 -0.042 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.254 11.054 -0.112 1.00 0.00 H new ATOM 1263 N TRP A 18 -4.625 9.312 3.899 1.00 0.00 N ATOM 1264 CA TRP A 18 -6.048 9.684 4.140 1.00 0.00 C ATOM 1265 C TRP A 18 -6.503 10.729 3.111 1.00 0.00 C ATOM 1266 O TRP A 18 -5.839 11.723 2.895 1.00 0.00 O ATOM 1267 CB TRP A 18 -6.155 10.283 5.552 1.00 0.00 C ATOM 1268 CG TRP A 18 -6.150 9.177 6.564 1.00 0.00 C ATOM 1269 CD1 TRP A 18 -5.149 8.907 7.433 1.00 0.00 C ATOM 1270 CD2 TRP A 18 -7.182 8.185 6.809 1.00 0.00 C ATOM 1271 NE1 TRP A 18 -5.509 7.809 8.200 1.00 0.00 N ATOM 1272 CE2 TRP A 18 -6.755 7.332 7.851 1.00 0.00 C ATOM 1273 CE3 TRP A 18 -8.438 7.948 6.231 1.00 0.00 C ATOM 1274 CZ2 TRP A 18 -7.549 6.280 8.305 1.00 0.00 C ATOM 1275 CZ3 TRP A 18 -9.238 6.892 6.684 1.00 0.00 C ATOM 1276 CH2 TRP A 18 -8.797 6.060 7.716 1.00 0.00 C ATOM 0 H TRP A 18 -3.952 9.766 4.517 1.00 0.00 H new ATOM 0 HA TRP A 18 -6.681 8.802 4.047 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -5.322 10.962 5.735 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.070 10.869 5.642 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.223 9.456 7.516 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -4.925 7.404 8.932 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -8.790 8.584 5.432 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -7.203 5.641 9.104 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -10.204 6.719 6.232 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -9.420 5.247 8.058 1.00 0.00 H new ATOM 1287 N ARG A 19 -7.631 10.507 2.474 1.00 0.00 N ATOM 1288 CA ARG A 19 -8.143 11.481 1.450 1.00 0.00 C ATOM 1289 C ARG A 19 -9.414 12.158 1.973 1.00 0.00 C ATOM 1290 O ARG A 19 -9.890 11.861 3.049 1.00 0.00 O ATOM 1291 CB ARG A 19 -8.488 10.735 0.157 1.00 0.00 C ATOM 1292 CG ARG A 19 -7.374 9.767 -0.196 1.00 0.00 C ATOM 1293 CD ARG A 19 -6.060 10.520 -0.366 1.00 0.00 C ATOM 1294 NE ARG A 19 -5.104 9.631 -1.086 1.00 0.00 N ATOM 1295 CZ ARG A 19 -3.969 10.090 -1.538 1.00 0.00 C ATOM 1296 NH1 ARG A 19 -3.600 11.314 -1.294 1.00 0.00 N ATOM 1297 NH2 ARG A 19 -3.193 9.310 -2.227 1.00 0.00 N ATOM 0 H ARG A 19 -8.223 9.689 2.619 1.00 0.00 H new ATOM 0 HA ARG A 19 -7.373 12.228 1.257 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -9.426 10.194 0.279 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -8.634 11.447 -0.656 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -7.273 9.016 0.587 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -7.620 9.237 -1.116 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -6.219 11.441 -0.927 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -5.656 10.805 0.606 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.341 8.649 -1.228 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.201 11.928 -0.743 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -2.710 11.660 -1.653 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.472 8.346 -2.411 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.304 9.661 -2.584 1.00 0.00 H new ATOM 1311 N ARG A 20 -9.982 13.046 1.193 1.00 0.00 N ATOM 1312 CA ARG A 20 -11.246 13.735 1.598 1.00 0.00 C ATOM 1313 C ARG A 20 -12.223 13.635 0.418 1.00 0.00 C ATOM 1314 O ARG A 20 -11.831 13.771 -0.724 1.00 0.00 O ATOM 1315 CB ARG A 20 -10.949 15.208 1.901 1.00 0.00 C ATOM 1316 CG ARG A 20 -12.141 15.849 2.630 1.00 0.00 C ATOM 1317 CD ARG A 20 -12.004 15.647 4.143 1.00 0.00 C ATOM 1318 NE ARG A 20 -10.986 16.594 4.679 1.00 0.00 N ATOM 1319 CZ ARG A 20 -10.925 16.829 5.962 1.00 0.00 C ATOM 1320 NH1 ARG A 20 -11.766 16.246 6.772 1.00 0.00 N ATOM 1321 NH2 ARG A 20 -10.028 17.651 6.432 1.00 0.00 N ATOM 0 H ARG A 20 -9.618 13.325 0.282 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.672 13.274 2.489 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.052 15.287 2.515 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -10.749 15.745 0.974 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -12.188 16.913 2.400 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -13.073 15.406 2.279 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -12.964 15.813 4.632 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -11.710 14.620 4.359 1.00 0.00 H new ATOM 0 HE ARG A 20 -10.337 17.059 4.044 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -12.470 15.607 6.403 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -11.719 16.429 7.774 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -9.375 18.110 5.797 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -9.980 17.835 7.434 1.00 0.00 H new ATOM 1335 N SER A 21 -13.489 13.403 0.671 1.00 0.00 N ATOM 1336 CA SER A 21 -14.475 13.302 -0.460 1.00 0.00 C ATOM 1337 C SER A 21 -15.095 14.686 -0.722 1.00 0.00 C ATOM 1338 O SER A 21 -15.054 15.552 0.126 1.00 0.00 O ATOM 1339 CB SER A 21 -15.564 12.274 -0.104 1.00 0.00 C ATOM 1340 OG SER A 21 -16.850 12.813 -0.386 1.00 0.00 O ATOM 0 H SER A 21 -13.883 13.280 1.604 1.00 0.00 H new ATOM 0 HA SER A 21 -13.968 12.969 -1.366 1.00 0.00 H new ATOM 0 HB2 SER A 21 -15.411 11.358 -0.674 1.00 0.00 H new ATOM 0 HB3 SER A 21 -15.495 12.009 0.951 1.00 0.00 H new ATOM 0 HG SER A 21 -17.538 12.153 -0.159 1.00 0.00 H new ATOM 1346 N PRO A 22 -15.657 14.904 -1.895 1.00 0.00 N ATOM 1347 CA PRO A 22 -16.273 16.223 -2.217 1.00 0.00 C ATOM 1348 C PRO A 22 -17.312 16.648 -1.166 1.00 0.00 C ATOM 1349 O PRO A 22 -17.743 17.782 -1.128 1.00 0.00 O ATOM 1350 CB PRO A 22 -16.933 15.963 -3.592 1.00 0.00 C ATOM 1351 CG PRO A 22 -16.649 14.502 -4.007 1.00 0.00 C ATOM 1352 CD PRO A 22 -15.714 13.869 -2.966 1.00 0.00 C ATOM 0 HA PRO A 22 -15.549 17.038 -2.228 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -18.007 16.138 -3.535 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -16.537 16.652 -4.338 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -17.580 13.939 -4.071 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -16.190 14.472 -4.995 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -16.107 12.923 -2.593 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -14.728 13.663 -3.381 1.00 0.00 H new ATOM 1360 N MET A 23 -17.716 15.735 -0.318 1.00 0.00 N ATOM 1361 CA MET A 23 -18.728 16.063 0.733 1.00 0.00 C ATOM 1362 C MET A 23 -18.020 16.334 2.063 1.00 0.00 C ATOM 1363 O MET A 23 -18.614 16.819 3.004 1.00 0.00 O ATOM 1364 CB MET A 23 -19.679 14.875 0.899 1.00 0.00 C ATOM 1365 CG MET A 23 -20.861 15.281 1.785 1.00 0.00 C ATOM 1366 SD MET A 23 -22.131 13.993 1.727 1.00 0.00 S ATOM 1367 CE MET A 23 -23.049 14.647 0.310 1.00 0.00 C ATOM 0 H MET A 23 -17.386 14.770 -0.309 1.00 0.00 H new ATOM 0 HA MET A 23 -19.289 16.949 0.436 1.00 0.00 H new ATOM 0 HB2 MET A 23 -20.039 14.546 -0.076 1.00 0.00 H new ATOM 0 HB3 MET A 23 -19.150 14.033 1.345 1.00 0.00 H new ATOM 0 HG2 MET A 23 -20.525 15.429 2.811 1.00 0.00 H new ATOM 0 HG3 MET A 23 -21.275 16.230 1.445 1.00 0.00 H new ATOM 0 HE1 MET A 23 -23.895 13.995 0.092 1.00 0.00 H new ATOM 0 HE2 MET A 23 -23.412 15.648 0.543 1.00 0.00 H new ATOM 0 HE3 MET A 23 -22.393 14.692 -0.559 1.00 0.00 H new ATOM 1377 N GLY A 24 -16.753 16.027 2.145 1.00 0.00 N ATOM 1378 CA GLY A 24 -15.996 16.263 3.411 1.00 0.00 C ATOM 1379 C GLY A 24 -16.047 15.008 4.286 1.00 0.00 C ATOM 1380 O GLY A 24 -15.962 15.081 5.496 1.00 0.00 O ATOM 0 H GLY A 24 -16.206 15.621 1.386 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.961 16.518 3.185 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.423 17.110 3.948 1.00 0.00 H new ATOM 1384 N ASP A 25 -16.179 13.855 3.685 1.00 0.00 N ATOM 1385 CA ASP A 25 -16.231 12.582 4.463 1.00 0.00 C ATOM 1386 C ASP A 25 -14.860 11.873 4.373 1.00 0.00 C ATOM 1387 O ASP A 25 -14.474 11.446 3.302 1.00 0.00 O ATOM 1388 CB ASP A 25 -17.286 11.681 3.817 1.00 0.00 C ATOM 1389 CG ASP A 25 -18.626 12.418 3.786 1.00 0.00 C ATOM 1390 OD1 ASP A 25 -18.614 13.634 3.900 1.00 0.00 O ATOM 1391 OD2 ASP A 25 -19.641 11.756 3.650 1.00 0.00 O ATOM 0 H ASP A 25 -16.254 13.740 2.674 1.00 0.00 H new ATOM 0 HA ASP A 25 -16.473 12.785 5.506 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -16.982 11.412 2.805 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -17.381 10.752 4.379 1.00 0.00 H new ATOM 1396 N PRO A 26 -14.115 11.733 5.456 1.00 0.00 N ATOM 1397 CA PRO A 26 -12.786 11.048 5.381 1.00 0.00 C ATOM 1398 C PRO A 26 -12.856 9.700 4.640 1.00 0.00 C ATOM 1399 O PRO A 26 -13.763 8.916 4.837 1.00 0.00 O ATOM 1400 CB PRO A 26 -12.442 10.869 6.869 1.00 0.00 C ATOM 1401 CG PRO A 26 -13.269 11.898 7.651 1.00 0.00 C ATOM 1402 CD PRO A 26 -14.510 12.227 6.812 1.00 0.00 C ATOM 0 HA PRO A 26 -12.041 11.609 4.817 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -12.675 9.857 7.199 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -11.376 11.022 7.039 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -13.558 11.498 8.623 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -12.683 12.798 7.838 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -15.400 11.721 7.186 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -14.728 13.295 6.809 1.00 0.00 H new ATOM 1410 N VAL A 27 -11.894 9.435 3.790 1.00 0.00 N ATOM 1411 CA VAL A 27 -11.882 8.139 3.025 1.00 0.00 C ATOM 1412 C VAL A 27 -10.447 7.602 2.916 1.00 0.00 C ATOM 1413 O VAL A 27 -9.492 8.340 3.057 1.00 0.00 O ATOM 1414 CB VAL A 27 -12.468 8.357 1.616 1.00 0.00 C ATOM 1415 CG1 VAL A 27 -14.005 8.335 1.693 1.00 0.00 C ATOM 1416 CG2 VAL A 27 -11.972 9.716 1.045 1.00 0.00 C ATOM 0 H VAL A 27 -11.113 10.059 3.589 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.492 7.409 3.558 1.00 0.00 H new ATOM 0 HB VAL A 27 -12.135 7.559 0.953 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.421 8.489 0.698 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.336 7.371 2.080 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -14.347 9.129 2.356 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.389 9.866 0.049 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.296 10.525 1.699 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -10.884 9.710 0.986 1.00 0.00 H new ATOM 1426 N CYS A 28 -10.277 6.319 2.652 1.00 0.00 N ATOM 1427 CA CYS A 28 -8.897 5.758 2.524 1.00 0.00 C ATOM 1428 C CYS A 28 -8.367 5.982 1.096 1.00 0.00 C ATOM 1429 O CYS A 28 -9.121 6.153 0.158 1.00 0.00 O ATOM 1430 CB CYS A 28 -8.877 4.258 2.916 1.00 0.00 C ATOM 1431 SG CYS A 28 -9.761 3.212 1.721 1.00 0.00 S ATOM 0 H CYS A 28 -11.033 5.647 2.522 1.00 0.00 H new ATOM 0 HA CYS A 28 -8.235 6.281 3.214 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -7.844 3.920 2.994 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -9.327 4.138 3.901 1.00 0.00 H new ATOM 1436 N ASN A 29 -7.068 6.019 0.941 1.00 0.00 N ATOM 1437 CA ASN A 29 -6.450 6.275 -0.401 1.00 0.00 C ATOM 1438 C ASN A 29 -7.131 5.451 -1.496 1.00 0.00 C ATOM 1439 O ASN A 29 -7.267 5.896 -2.623 1.00 0.00 O ATOM 1440 CB ASN A 29 -4.965 5.901 -0.335 1.00 0.00 C ATOM 1441 CG ASN A 29 -4.259 6.344 -1.617 1.00 0.00 C ATOM 1442 OD1 ASN A 29 -3.037 6.800 -1.551 1.00 0.00 O flip ATOM 1443 ND2 ASN A 29 -4.823 6.276 -2.690 1.00 0.00 N flip ATOM 0 H ASN A 29 -6.398 5.881 1.697 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.574 7.330 -0.647 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.500 6.375 0.529 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -4.858 4.824 -0.204 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -5.777 5.920 -2.743 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -4.342 6.575 -3.539 1.00 0.00 H new ATOM 1450 N ALA A 30 -7.554 4.266 -1.195 1.00 0.00 N ATOM 1451 CA ALA A 30 -8.207 3.436 -2.244 1.00 0.00 C ATOM 1452 C ALA A 30 -9.641 3.919 -2.537 1.00 0.00 C ATOM 1453 O ALA A 30 -10.010 4.100 -3.681 1.00 0.00 O ATOM 1454 CB ALA A 30 -8.230 1.991 -1.780 1.00 0.00 C ATOM 0 H ALA A 30 -7.480 3.832 -0.275 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.636 3.527 -3.168 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -8.706 1.372 -2.540 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -7.209 1.645 -1.617 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.791 1.917 -0.848 1.00 0.00 H new ATOM 1460 N CYS A 31 -10.464 4.106 -1.533 1.00 0.00 N ATOM 1461 CA CYS A 31 -11.873 4.549 -1.803 1.00 0.00 C ATOM 1462 C CYS A 31 -11.882 5.864 -2.574 1.00 0.00 C ATOM 1463 O CYS A 31 -12.677 6.063 -3.456 1.00 0.00 O ATOM 1464 CB CYS A 31 -12.634 4.778 -0.493 1.00 0.00 C ATOM 1465 SG CYS A 31 -13.134 3.206 0.224 1.00 0.00 S ATOM 0 H CYS A 31 -10.228 3.974 -0.550 1.00 0.00 H new ATOM 0 HA CYS A 31 -12.352 3.761 -2.384 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -12.004 5.322 0.211 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -13.512 5.396 -0.678 1.00 0.00 H new ATOM 1470 N GLY A 32 -11.037 6.777 -2.226 1.00 0.00 N ATOM 1471 CA GLY A 32 -11.058 8.084 -2.928 1.00 0.00 C ATOM 1472 C GLY A 32 -10.811 7.897 -4.423 1.00 0.00 C ATOM 1473 O GLY A 32 -11.539 8.413 -5.247 1.00 0.00 O ATOM 0 H GLY A 32 -10.335 6.681 -1.492 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -12.020 8.571 -2.771 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.296 8.741 -2.508 1.00 0.00 H new ATOM 1477 N LEU A 33 -9.791 7.177 -4.788 1.00 0.00 N ATOM 1478 CA LEU A 33 -9.515 6.987 -6.240 1.00 0.00 C ATOM 1479 C LEU A 33 -10.608 6.117 -6.859 1.00 0.00 C ATOM 1480 O LEU A 33 -11.124 6.413 -7.916 1.00 0.00 O ATOM 1481 CB LEU A 33 -8.161 6.301 -6.402 1.00 0.00 C ATOM 1482 CG LEU A 33 -7.068 7.147 -5.732 1.00 0.00 C ATOM 1483 CD1 LEU A 33 -5.815 6.292 -5.524 1.00 0.00 C ATOM 1484 CD2 LEU A 33 -6.718 8.362 -6.608 1.00 0.00 C ATOM 0 H LEU A 33 -9.141 6.715 -4.153 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.500 7.954 -6.743 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -8.190 5.307 -5.955 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.934 6.168 -7.460 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.438 7.500 -4.769 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.040 6.893 -5.049 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.057 5.441 -4.887 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.456 5.933 -6.488 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.942 8.951 -6.119 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.357 8.019 -7.578 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -7.607 8.977 -6.748 1.00 0.00 H new ATOM 1496 N TYR A 34 -10.969 5.045 -6.215 1.00 0.00 N ATOM 1497 CA TYR A 34 -12.027 4.163 -6.777 1.00 0.00 C ATOM 1498 C TYR A 34 -13.313 4.966 -6.925 1.00 0.00 C ATOM 1499 O TYR A 34 -13.959 4.956 -7.954 1.00 0.00 O ATOM 1500 CB TYR A 34 -12.274 3.005 -5.808 1.00 0.00 C ATOM 1501 CG TYR A 34 -13.198 1.991 -6.440 1.00 0.00 C ATOM 1502 CD1 TYR A 34 -14.578 2.220 -6.462 1.00 0.00 C ATOM 1503 CD2 TYR A 34 -12.673 0.819 -6.999 1.00 0.00 C ATOM 1504 CE1 TYR A 34 -15.434 1.276 -7.043 1.00 0.00 C ATOM 1505 CE2 TYR A 34 -13.529 -0.123 -7.580 1.00 0.00 C ATOM 1506 CZ TYR A 34 -14.909 0.105 -7.602 1.00 0.00 C ATOM 1507 OH TYR A 34 -15.753 -0.824 -8.176 1.00 0.00 O ATOM 0 H TYR A 34 -10.577 4.741 -5.324 1.00 0.00 H new ATOM 0 HA TYR A 34 -11.714 3.777 -7.747 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -11.328 2.532 -5.544 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -12.711 3.381 -4.883 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -14.983 3.124 -6.031 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -11.608 0.642 -6.982 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -16.499 1.452 -7.060 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -13.124 -1.026 -8.012 1.00 0.00 H new ATOM 0 HH TYR A 34 -15.227 -1.577 -8.517 1.00 0.00 H new ATOM 1517 N TYR A 35 -13.692 5.651 -5.888 1.00 0.00 N ATOM 1518 CA TYR A 35 -14.937 6.452 -5.926 1.00 0.00 C ATOM 1519 C TYR A 35 -14.820 7.579 -6.958 1.00 0.00 C ATOM 1520 O TYR A 35 -15.700 7.805 -7.744 1.00 0.00 O ATOM 1521 CB TYR A 35 -15.184 7.060 -4.541 1.00 0.00 C ATOM 1522 CG TYR A 35 -16.638 7.418 -4.428 1.00 0.00 C ATOM 1523 CD1 TYR A 35 -17.080 8.654 -4.896 1.00 0.00 C ATOM 1524 CD2 TYR A 35 -17.543 6.503 -3.876 1.00 0.00 C ATOM 1525 CE1 TYR A 35 -18.434 8.985 -4.815 1.00 0.00 C ATOM 1526 CE2 TYR A 35 -18.897 6.831 -3.790 1.00 0.00 C ATOM 1527 CZ TYR A 35 -19.346 8.074 -4.260 1.00 0.00 C ATOM 1528 OH TYR A 35 -20.683 8.399 -4.181 1.00 0.00 O ATOM 0 H TYR A 35 -13.184 5.689 -5.004 1.00 0.00 H new ATOM 0 HA TYR A 35 -15.767 5.803 -6.207 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -14.907 6.350 -3.761 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -14.564 7.946 -4.400 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -16.376 9.355 -5.321 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -17.194 5.546 -3.518 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -18.779 9.941 -5.179 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -19.598 6.129 -3.362 1.00 0.00 H new ATOM 0 HH TYR A 35 -21.176 7.657 -3.772 1.00 0.00 H new ATOM 1538 N LYS A 36 -13.755 8.308 -6.948 1.00 0.00 N ATOM 1539 CA LYS A 36 -13.628 9.428 -7.919 1.00 0.00 C ATOM 1540 C LYS A 36 -13.696 8.891 -9.350 1.00 0.00 C ATOM 1541 O LYS A 36 -14.319 9.475 -10.214 1.00 0.00 O ATOM 1542 CB LYS A 36 -12.278 10.111 -7.697 1.00 0.00 C ATOM 1543 CG LYS A 36 -12.110 11.266 -8.677 1.00 0.00 C ATOM 1544 CD LYS A 36 -10.847 12.056 -8.314 1.00 0.00 C ATOM 1545 CE LYS A 36 -9.594 11.190 -8.516 1.00 0.00 C ATOM 1546 NZ LYS A 36 -8.425 12.076 -8.786 1.00 0.00 N ATOM 0 H LYS A 36 -12.965 8.184 -6.315 1.00 0.00 H new ATOM 0 HA LYS A 36 -14.442 10.138 -7.770 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.212 10.479 -6.673 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.471 9.391 -7.829 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -12.035 10.886 -9.696 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -12.983 11.917 -8.643 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -10.781 12.951 -8.932 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.904 12.388 -7.277 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -9.409 10.584 -7.629 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -9.743 10.501 -9.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -7.573 11.495 -8.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -8.605 12.636 -9.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -8.281 12.716 -7.979 1.00 0.00 H new ATOM 1560 N LEU A 37 -13.052 7.795 -9.611 1.00 0.00 N ATOM 1561 CA LEU A 37 -13.064 7.230 -10.989 1.00 0.00 C ATOM 1562 C LEU A 37 -14.451 6.663 -11.361 1.00 0.00 C ATOM 1563 O LEU A 37 -14.881 6.803 -12.488 1.00 0.00 O ATOM 1564 CB LEU A 37 -11.993 6.124 -11.074 1.00 0.00 C ATOM 1565 CG LEU A 37 -10.641 6.708 -11.526 1.00 0.00 C ATOM 1566 CD1 LEU A 37 -10.285 7.961 -10.703 1.00 0.00 C ATOM 1567 CD2 LEU A 37 -9.557 5.640 -11.341 1.00 0.00 C ATOM 0 H LEU A 37 -12.514 7.261 -8.929 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.843 8.026 -11.700 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.881 5.644 -10.102 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.314 5.353 -11.775 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.708 6.998 -12.574 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.327 8.357 -11.039 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -11.058 8.717 -10.839 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -10.218 7.696 -9.648 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.594 6.040 -11.657 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.504 5.354 -10.291 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.802 4.765 -11.943 1.00 0.00 H new ATOM 1579 N HIS A 38 -15.137 5.999 -10.451 1.00 0.00 N ATOM 1580 CA HIS A 38 -16.478 5.399 -10.802 1.00 0.00 C ATOM 1581 C HIS A 38 -17.607 5.933 -9.908 1.00 0.00 C ATOM 1582 O HIS A 38 -18.723 5.473 -10.010 1.00 0.00 O ATOM 1583 CB HIS A 38 -16.406 3.879 -10.628 1.00 0.00 C ATOM 1584 CG HIS A 38 -15.419 3.293 -11.599 1.00 0.00 C ATOM 1585 ND1 HIS A 38 -15.799 2.839 -12.853 1.00 0.00 N ATOM 1586 CD2 HIS A 38 -14.069 3.059 -11.508 1.00 0.00 C ATOM 1587 CE1 HIS A 38 -14.698 2.356 -13.459 1.00 0.00 C ATOM 1588 NE2 HIS A 38 -13.616 2.467 -12.684 1.00 0.00 N ATOM 0 H HIS A 38 -14.832 5.847 -9.490 1.00 0.00 H new ATOM 0 HA HIS A 38 -16.700 5.674 -11.833 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -16.112 3.636 -9.607 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -17.391 3.440 -10.789 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -16.740 2.866 -13.245 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -13.452 3.298 -10.654 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -14.691 1.930 -14.452 1.00 0.00 H new ATOM 1596 N GLN A 39 -17.345 6.885 -9.048 1.00 0.00 N ATOM 1597 CA GLN A 39 -18.403 7.462 -8.142 1.00 0.00 C ATOM 1598 C GLN A 39 -19.499 6.455 -7.764 1.00 0.00 C ATOM 1599 O GLN A 39 -20.675 6.751 -7.823 1.00 0.00 O ATOM 1600 CB GLN A 39 -18.990 8.736 -8.778 1.00 0.00 C ATOM 1601 CG GLN A 39 -20.070 8.408 -9.853 1.00 0.00 C ATOM 1602 CD GLN A 39 -21.460 8.832 -9.363 1.00 0.00 C ATOM 1603 OE1 GLN A 39 -22.286 7.998 -9.049 1.00 0.00 O ATOM 1604 NE2 GLN A 39 -21.751 10.102 -9.285 1.00 0.00 N ATOM 0 H GLN A 39 -16.421 7.301 -8.928 1.00 0.00 H new ATOM 0 HA GLN A 39 -17.920 7.721 -7.200 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -19.431 9.360 -8.000 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -18.188 9.316 -9.235 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -19.833 8.923 -10.784 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -20.064 7.340 -10.069 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -21.057 10.801 -9.549 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -22.672 10.395 -8.960 1.00 0.00 H new ATOM 1613 N VAL A 40 -19.116 5.278 -7.338 1.00 0.00 N ATOM 1614 CA VAL A 40 -20.111 4.256 -6.911 1.00 0.00 C ATOM 1615 C VAL A 40 -19.559 3.507 -5.701 1.00 0.00 C ATOM 1616 O VAL A 40 -18.363 3.343 -5.549 1.00 0.00 O ATOM 1617 CB VAL A 40 -20.370 3.246 -8.027 1.00 0.00 C ATOM 1618 CG1 VAL A 40 -21.179 3.888 -9.161 1.00 0.00 C ATOM 1619 CG2 VAL A 40 -19.037 2.714 -8.555 1.00 0.00 C ATOM 0 H VAL A 40 -18.143 4.981 -7.268 1.00 0.00 H new ATOM 0 HA VAL A 40 -21.045 4.762 -6.667 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.952 2.416 -7.626 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.353 3.152 -9.946 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -22.136 4.237 -8.773 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.624 4.732 -9.571 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -19.223 1.993 -9.351 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -18.444 3.541 -8.945 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -18.493 2.228 -7.745 1.00 0.00 H new ATOM 1629 N ASN A 41 -20.419 3.031 -4.853 1.00 0.00 N ATOM 1630 CA ASN A 41 -19.949 2.267 -3.664 1.00 0.00 C ATOM 1631 C ASN A 41 -19.728 0.813 -4.093 1.00 0.00 C ATOM 1632 O ASN A 41 -20.542 0.247 -4.797 1.00 0.00 O ATOM 1633 CB ASN A 41 -21.016 2.311 -2.567 1.00 0.00 C ATOM 1634 CG ASN A 41 -22.305 1.675 -3.093 1.00 0.00 C ATOM 1635 OD1 ASN A 41 -23.165 2.361 -3.612 1.00 0.00 O ATOM 1636 ND2 ASN A 41 -22.477 0.385 -2.985 1.00 0.00 N ATOM 0 H ASN A 41 -21.431 3.136 -4.929 1.00 0.00 H new ATOM 0 HA ASN A 41 -19.026 2.700 -3.279 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -20.668 1.777 -1.683 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -21.202 3.342 -2.265 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.332 -0.047 -3.336 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -21.756 -0.191 -2.550 1.00 0.00 H new ATOM 1643 N ARG A 42 -18.634 0.208 -3.695 1.00 0.00 N ATOM 1644 CA ARG A 42 -18.348 -1.212 -4.100 1.00 0.00 C ATOM 1645 C ARG A 42 -18.221 -2.104 -2.841 1.00 0.00 C ATOM 1646 O ARG A 42 -17.808 -1.634 -1.800 1.00 0.00 O ATOM 1647 CB ARG A 42 -17.033 -1.227 -4.911 1.00 0.00 C ATOM 1648 CG ARG A 42 -15.817 -0.864 -4.032 1.00 0.00 C ATOM 1649 CD ARG A 42 -15.905 0.591 -3.527 1.00 0.00 C ATOM 1650 NE ARG A 42 -16.511 0.608 -2.167 1.00 0.00 N ATOM 1651 CZ ARG A 42 -16.375 1.655 -1.400 1.00 0.00 C ATOM 1652 NH1 ARG A 42 -15.739 2.710 -1.833 1.00 0.00 N ATOM 1653 NH2 ARG A 42 -16.884 1.649 -0.198 1.00 0.00 N ATOM 0 H ARG A 42 -17.921 0.636 -3.104 1.00 0.00 H new ATOM 0 HA ARG A 42 -19.161 -1.604 -4.710 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -16.885 -2.215 -5.347 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -17.108 -0.522 -5.739 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -15.764 -1.544 -3.182 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -14.899 -0.998 -4.604 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -14.912 1.039 -3.500 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -16.506 1.189 -4.212 1.00 0.00 H new ATOM 0 HE ARG A 42 -17.034 -0.202 -1.834 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -15.346 2.718 -2.774 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -15.635 3.526 -1.230 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -17.386 0.828 0.139 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -16.780 2.466 0.404 1.00 0.00 H new ATOM 1667 N PRO A 43 -18.564 -3.382 -2.920 1.00 0.00 N ATOM 1668 CA PRO A 43 -18.453 -4.287 -1.736 1.00 0.00 C ATOM 1669 C PRO A 43 -17.143 -4.100 -0.952 1.00 0.00 C ATOM 1670 O PRO A 43 -16.133 -3.694 -1.492 1.00 0.00 O ATOM 1671 CB PRO A 43 -18.533 -5.682 -2.380 1.00 0.00 C ATOM 1672 CG PRO A 43 -19.122 -5.519 -3.794 1.00 0.00 C ATOM 1673 CD PRO A 43 -19.087 -4.023 -4.167 1.00 0.00 C ATOM 0 HA PRO A 43 -19.225 -4.096 -0.990 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -17.544 -6.137 -2.429 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -19.158 -6.344 -1.780 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -18.548 -6.103 -4.514 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -20.145 -5.893 -3.824 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -18.437 -3.834 -5.022 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -20.076 -3.649 -4.430 1.00 0.00 H new ATOM 1681 N LEU A 44 -17.166 -4.393 0.321 1.00 0.00 N ATOM 1682 CA LEU A 44 -15.940 -4.242 1.160 1.00 0.00 C ATOM 1683 C LEU A 44 -15.046 -5.469 0.990 1.00 0.00 C ATOM 1684 O LEU A 44 -14.035 -5.611 1.646 1.00 0.00 O ATOM 1685 CB LEU A 44 -16.347 -4.118 2.635 1.00 0.00 C ATOM 1686 CG LEU A 44 -16.871 -2.701 2.916 1.00 0.00 C ATOM 1687 CD1 LEU A 44 -18.281 -2.531 2.335 1.00 0.00 C ATOM 1688 CD2 LEU A 44 -16.910 -2.466 4.428 1.00 0.00 C ATOM 0 H LEU A 44 -17.988 -4.733 0.820 1.00 0.00 H new ATOM 0 HA LEU A 44 -15.397 -3.350 0.848 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -17.116 -4.853 2.872 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -15.492 -4.333 3.276 1.00 0.00 H new ATOM 0 HG LEU A 44 -16.206 -1.976 2.446 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -18.640 -1.523 2.541 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -18.252 -2.693 1.257 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -18.953 -3.256 2.793 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -17.281 -1.461 4.631 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -17.571 -3.198 4.893 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -15.906 -2.571 4.839 1.00 0.00 H new ATOM 1700 N THR A 45 -15.423 -6.357 0.124 1.00 0.00 N ATOM 1701 CA THR A 45 -14.609 -7.583 -0.087 1.00 0.00 C ATOM 1702 C THR A 45 -13.166 -7.188 -0.430 1.00 0.00 C ATOM 1703 O THR A 45 -12.293 -8.027 -0.538 1.00 0.00 O ATOM 1704 CB THR A 45 -15.216 -8.395 -1.234 1.00 0.00 C ATOM 1705 OG1 THR A 45 -15.347 -7.566 -2.382 1.00 0.00 O ATOM 1706 CG2 THR A 45 -16.595 -8.913 -0.816 1.00 0.00 C ATOM 0 H THR A 45 -16.263 -6.289 -0.451 1.00 0.00 H new ATOM 0 HA THR A 45 -14.605 -8.186 0.821 1.00 0.00 H new ATOM 0 HB THR A 45 -14.567 -9.239 -1.468 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.734 -8.085 -3.118 1.00 0.00 H new ATOM 0 HG21 THR A 45 -17.029 -9.492 -1.632 1.00 0.00 H new ATOM 0 HG22 THR A 45 -16.494 -9.547 0.065 1.00 0.00 H new ATOM 0 HG23 THR A 45 -17.245 -8.070 -0.583 1.00 0.00 H new ATOM 1714 N MET A 46 -12.910 -5.916 -0.610 1.00 0.00 N ATOM 1715 CA MET A 46 -11.523 -5.461 -0.958 1.00 0.00 C ATOM 1716 C MET A 46 -10.716 -5.149 0.318 1.00 0.00 C ATOM 1717 O MET A 46 -9.504 -5.064 0.287 1.00 0.00 O ATOM 1718 CB MET A 46 -11.617 -4.194 -1.826 1.00 0.00 C ATOM 1719 CG MET A 46 -10.304 -3.974 -2.608 1.00 0.00 C ATOM 1720 SD MET A 46 -10.439 -4.737 -4.250 1.00 0.00 S ATOM 1721 CE MET A 46 -9.576 -3.450 -5.193 1.00 0.00 C ATOM 0 H MET A 46 -13.601 -5.170 -0.531 1.00 0.00 H new ATOM 0 HA MET A 46 -11.015 -6.256 -1.503 1.00 0.00 H new ATOM 0 HB2 MET A 46 -12.451 -4.284 -2.522 1.00 0.00 H new ATOM 0 HB3 MET A 46 -11.821 -3.329 -1.195 1.00 0.00 H new ATOM 0 HG2 MET A 46 -10.102 -2.907 -2.707 1.00 0.00 H new ATOM 0 HG3 MET A 46 -9.466 -4.408 -2.062 1.00 0.00 H new ATOM 0 HE1 MET A 46 -9.438 -3.784 -6.221 1.00 0.00 H new ATOM 0 HE2 MET A 46 -10.168 -2.535 -5.185 1.00 0.00 H new ATOM 0 HE3 MET A 46 -8.603 -3.257 -4.740 1.00 0.00 H new ATOM 1731 N ARG A 47 -11.374 -4.954 1.431 1.00 0.00 N ATOM 1732 CA ARG A 47 -10.634 -4.621 2.693 1.00 0.00 C ATOM 1733 C ARG A 47 -10.053 -5.880 3.343 1.00 0.00 C ATOM 1734 O ARG A 47 -10.695 -6.908 3.444 1.00 0.00 O ATOM 1735 CB ARG A 47 -11.586 -3.924 3.690 1.00 0.00 C ATOM 1736 CG ARG A 47 -11.577 -2.405 3.461 1.00 0.00 C ATOM 1737 CD ARG A 47 -11.896 -2.090 1.992 1.00 0.00 C ATOM 1738 NE ARG A 47 -10.641 -2.145 1.165 1.00 0.00 N ATOM 1739 CZ ARG A 47 -9.617 -1.368 1.413 1.00 0.00 C ATOM 1740 NH1 ARG A 47 -9.712 -0.411 2.296 1.00 0.00 N ATOM 1741 NH2 ARG A 47 -8.507 -1.526 0.744 1.00 0.00 N ATOM 0 H ARG A 47 -12.388 -5.010 1.525 1.00 0.00 H new ATOM 0 HA ARG A 47 -9.812 -3.953 2.435 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -12.598 -4.311 3.569 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -11.280 -4.147 4.712 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -12.310 -1.927 4.111 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -10.602 -1.995 3.725 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -12.624 -2.805 1.609 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -12.348 -1.101 1.914 1.00 0.00 H new ATOM 0 HE ARG A 47 -10.586 -2.806 0.390 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -10.588 -0.265 2.798 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -8.910 0.191 2.484 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -8.440 -2.253 0.031 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -7.707 -0.923 0.934 1.00 0.00 H new ATOM 1755 N LYS A 48 -8.836 -5.773 3.812 1.00 0.00 N ATOM 1756 CA LYS A 48 -8.156 -6.908 4.503 1.00 0.00 C ATOM 1757 C LYS A 48 -7.618 -6.389 5.841 1.00 0.00 C ATOM 1758 O LYS A 48 -7.340 -5.216 5.990 1.00 0.00 O ATOM 1759 CB LYS A 48 -7.003 -7.425 3.639 1.00 0.00 C ATOM 1760 CG LYS A 48 -7.569 -8.141 2.410 1.00 0.00 C ATOM 1761 CD LYS A 48 -6.430 -8.501 1.449 1.00 0.00 C ATOM 1762 CE LYS A 48 -5.531 -9.576 2.072 1.00 0.00 C ATOM 1763 NZ LYS A 48 -4.737 -10.238 0.998 1.00 0.00 N ATOM 0 H LYS A 48 -8.273 -4.925 3.743 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.855 -7.728 4.669 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.366 -6.596 3.329 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.379 -8.108 4.216 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.099 -9.043 2.715 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -8.294 -7.501 1.906 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.841 -8.862 0.506 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -5.842 -7.612 1.221 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.865 -9.127 2.808 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.137 -10.313 2.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.126 -10.968 1.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.382 -10.679 0.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.148 -9.530 0.515 1.00 0.00 H new ATOM 1777 N ASP A 49 -7.511 -7.236 6.826 1.00 0.00 N ATOM 1778 CA ASP A 49 -7.037 -6.786 8.173 1.00 0.00 C ATOM 1779 C ASP A 49 -5.708 -6.012 8.095 1.00 0.00 C ATOM 1780 O ASP A 49 -5.157 -5.635 9.111 1.00 0.00 O ATOM 1781 CB ASP A 49 -6.843 -8.006 9.077 1.00 0.00 C ATOM 1782 CG ASP A 49 -8.061 -8.926 8.978 1.00 0.00 C ATOM 1783 OD1 ASP A 49 -9.087 -8.584 9.544 1.00 0.00 O ATOM 1784 OD2 ASP A 49 -7.945 -9.959 8.341 1.00 0.00 O ATOM 0 H ASP A 49 -7.732 -8.229 6.759 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.795 -6.116 8.578 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -5.943 -8.547 8.784 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -6.701 -7.686 10.109 1.00 0.00 H new ATOM 1789 N GLY A 50 -5.182 -5.758 6.924 1.00 0.00 N ATOM 1790 CA GLY A 50 -3.891 -4.998 6.840 1.00 0.00 C ATOM 1791 C GLY A 50 -3.793 -4.267 5.497 1.00 0.00 C ATOM 1792 O GLY A 50 -4.622 -4.439 4.626 1.00 0.00 O ATOM 0 H GLY A 50 -5.583 -6.039 6.029 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.829 -4.280 7.658 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -3.050 -5.682 6.952 1.00 0.00 H new ATOM 1796 N ILE A 51 -2.761 -3.476 5.303 1.00 0.00 N ATOM 1797 CA ILE A 51 -2.593 -2.775 4.001 1.00 0.00 C ATOM 1798 C ILE A 51 -1.850 -3.718 3.047 1.00 0.00 C ATOM 1799 O ILE A 51 -0.860 -4.325 3.405 1.00 0.00 O ATOM 1800 CB ILE A 51 -1.779 -1.488 4.200 1.00 0.00 C ATOM 1801 CG1 ILE A 51 -2.479 -0.610 5.255 1.00 0.00 C ATOM 1802 CG2 ILE A 51 -1.682 -0.722 2.868 1.00 0.00 C ATOM 1803 CD1 ILE A 51 -1.967 0.833 5.178 1.00 0.00 C ATOM 0 H ILE A 51 -2.033 -3.290 5.993 1.00 0.00 H new ATOM 0 HA ILE A 51 -3.566 -2.507 3.589 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.774 -1.738 4.538 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.557 -0.629 5.095 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.298 -1.014 6.251 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.104 0.190 3.014 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.190 -1.348 2.123 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.683 -0.465 2.522 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.472 1.439 5.930 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.893 0.848 5.362 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.172 1.239 4.187 1.00 0.00 H new ATOM 1815 N GLN A 52 -2.311 -3.833 1.835 1.00 0.00 N ATOM 1816 CA GLN A 52 -1.616 -4.724 0.860 1.00 0.00 C ATOM 1817 C GLN A 52 -0.273 -4.094 0.491 1.00 0.00 C ATOM 1818 O GLN A 52 -0.126 -2.894 0.501 1.00 0.00 O ATOM 1819 CB GLN A 52 -2.455 -4.873 -0.413 1.00 0.00 C ATOM 1820 CG GLN A 52 -3.706 -5.704 -0.133 1.00 0.00 C ATOM 1821 CD GLN A 52 -4.589 -5.708 -1.384 1.00 0.00 C ATOM 1822 OE1 GLN A 52 -4.807 -6.741 -1.985 1.00 0.00 O ATOM 1823 NE2 GLN A 52 -5.100 -4.582 -1.807 1.00 0.00 N ATOM 0 H GLN A 52 -3.135 -3.352 1.476 1.00 0.00 H new ATOM 0 HA GLN A 52 -1.471 -5.706 1.311 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.740 -3.889 -0.785 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.862 -5.349 -1.193 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.429 -6.723 0.136 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.253 -5.288 0.713 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.915 -3.716 -1.301 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.683 -4.569 -2.644 1.00 0.00 H new ATOM 1832 N THR A 53 0.723 -4.886 0.196 1.00 0.00 N ATOM 1833 CA THR A 53 2.058 -4.302 -0.159 1.00 0.00 C ATOM 1834 C THR A 53 2.675 -5.065 -1.327 1.00 0.00 C ATOM 1835 O THR A 53 2.376 -6.216 -1.578 1.00 0.00 O ATOM 1836 CB THR A 53 2.994 -4.354 1.049 1.00 0.00 C ATOM 1837 OG1 THR A 53 4.339 -4.439 0.602 1.00 0.00 O ATOM 1838 CG2 THR A 53 2.654 -5.571 1.897 1.00 0.00 C ATOM 0 H THR A 53 0.675 -5.905 0.184 1.00 0.00 H new ATOM 0 HA THR A 53 1.916 -3.262 -0.453 1.00 0.00 H new ATOM 0 HB THR A 53 2.872 -3.451 1.648 1.00 0.00 H new ATOM 0 HG1 THR A 53 4.940 -4.471 1.376 1.00 0.00 H new ATOM 0 HG21 THR A 53 3.320 -5.611 2.759 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.621 -5.499 2.239 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.777 -6.475 1.301 1.00 0.00 H new ATOM 1846 N ARG A 54 3.531 -4.400 -2.042 1.00 0.00 N ATOM 1847 CA ARG A 54 4.198 -5.021 -3.222 1.00 0.00 C ATOM 1848 C ARG A 54 5.575 -4.383 -3.416 1.00 0.00 C ATOM 1849 O ARG A 54 5.881 -3.354 -2.848 1.00 0.00 O ATOM 1850 CB ARG A 54 3.329 -4.790 -4.477 1.00 0.00 C ATOM 1851 CG ARG A 54 3.577 -5.901 -5.518 1.00 0.00 C ATOM 1852 CD ARG A 54 2.705 -7.126 -5.203 1.00 0.00 C ATOM 1853 NE ARG A 54 3.258 -8.322 -5.901 1.00 0.00 N ATOM 1854 CZ ARG A 54 2.857 -9.518 -5.563 1.00 0.00 C ATOM 1855 NH1 ARG A 54 1.970 -9.668 -4.618 1.00 0.00 N ATOM 1856 NH2 ARG A 54 3.343 -10.566 -6.173 1.00 0.00 N ATOM 0 H ARG A 54 3.804 -3.435 -1.858 1.00 0.00 H new ATOM 0 HA ARG A 54 4.318 -6.092 -3.060 1.00 0.00 H new ATOM 0 HB2 ARG A 54 2.275 -4.773 -4.199 1.00 0.00 H new ATOM 0 HB3 ARG A 54 3.560 -3.818 -4.912 1.00 0.00 H new ATOM 0 HG2 ARG A 54 3.349 -5.531 -6.518 1.00 0.00 H new ATOM 0 HG3 ARG A 54 4.630 -6.184 -5.515 1.00 0.00 H new ATOM 0 HD2 ARG A 54 2.678 -7.300 -4.127 1.00 0.00 H new ATOM 0 HD3 ARG A 54 1.678 -6.947 -5.523 1.00 0.00 H new ATOM 0 HE ARG A 54 3.949 -8.206 -6.642 1.00 0.00 H new ATOM 0 HH11 ARG A 54 1.589 -8.850 -4.142 1.00 0.00 H new ATOM 0 HH12 ARG A 54 1.658 -10.603 -4.355 1.00 0.00 H new ATOM 0 HH21 ARG A 54 4.035 -10.450 -6.913 1.00 0.00 H new ATOM 0 HH22 ARG A 54 3.030 -11.500 -5.909 1.00 0.00 H new ATOM 1870 N ASN A 55 6.407 -4.990 -4.212 1.00 0.00 N ATOM 1871 CA ASN A 55 7.761 -4.420 -4.437 1.00 0.00 C ATOM 1872 C ASN A 55 7.611 -2.957 -4.863 1.00 0.00 C ATOM 1873 O ASN A 55 6.713 -2.596 -5.596 1.00 0.00 O ATOM 1874 CB ASN A 55 8.479 -5.227 -5.517 1.00 0.00 C ATOM 1875 CG ASN A 55 8.723 -6.645 -4.998 1.00 0.00 C ATOM 1876 OD1 ASN A 55 8.940 -6.842 -3.819 1.00 0.00 O ATOM 1877 ND2 ASN A 55 8.679 -7.650 -5.830 1.00 0.00 N ATOM 0 H ASN A 55 6.208 -5.855 -4.716 1.00 0.00 H new ATOM 0 HA ASN A 55 8.352 -4.468 -3.522 1.00 0.00 H new ATOM 0 HB2 ASN A 55 7.879 -5.257 -6.426 1.00 0.00 H new ATOM 0 HB3 ASN A 55 9.426 -4.752 -5.775 1.00 0.00 H new ATOM 0 HD21 ASN A 55 8.827 -8.600 -5.490 1.00 0.00 H new ATOM 0 HD22 ASN A 55 8.497 -7.485 -6.820 1.00 0.00 H new ATOM 1884 N ARG A 56 8.465 -2.113 -4.357 1.00 0.00 N ATOM 1885 CA ARG A 56 8.372 -0.655 -4.660 1.00 0.00 C ATOM 1886 C ARG A 56 8.559 -0.364 -6.152 1.00 0.00 C ATOM 1887 O ARG A 56 9.506 -0.800 -6.776 1.00 0.00 O ATOM 1888 CB ARG A 56 9.460 0.084 -3.882 1.00 0.00 C ATOM 1889 CG ARG A 56 9.267 -0.151 -2.384 1.00 0.00 C ATOM 1890 CD ARG A 56 10.193 0.780 -1.604 1.00 0.00 C ATOM 1891 NE ARG A 56 10.016 0.548 -0.140 1.00 0.00 N ATOM 1892 CZ ARG A 56 10.891 1.018 0.707 1.00 0.00 C ATOM 1893 NH1 ARG A 56 11.909 1.713 0.279 1.00 0.00 N ATOM 1894 NH2 ARG A 56 10.748 0.794 1.986 1.00 0.00 N ATOM 0 H ARG A 56 9.233 -2.373 -3.739 1.00 0.00 H new ATOM 0 HA ARG A 56 7.377 -0.318 -4.369 1.00 0.00 H new ATOM 0 HB2 ARG A 56 10.445 -0.266 -4.192 1.00 0.00 H new ATOM 0 HB3 ARG A 56 9.418 1.151 -4.102 1.00 0.00 H new ATOM 0 HG2 ARG A 56 8.229 0.033 -2.106 1.00 0.00 H new ATOM 0 HG3 ARG A 56 9.484 -1.190 -2.136 1.00 0.00 H new ATOM 0 HD2 ARG A 56 11.230 0.601 -1.888 1.00 0.00 H new ATOM 0 HD3 ARG A 56 9.971 1.819 -1.848 1.00 0.00 H new ATOM 0 HE ARG A 56 9.211 0.022 0.199 1.00 0.00 H new ATOM 0 HH11 ARG A 56 12.022 1.890 -0.719 1.00 0.00 H new ATOM 0 HH12 ARG A 56 12.592 2.079 0.943 1.00 0.00 H new ATOM 0 HH21 ARG A 56 9.953 0.252 2.323 1.00 0.00 H new ATOM 0 HH22 ARG A 56 11.432 1.161 2.648 1.00 0.00 H new ATOM 1908 N LYS A 57 7.658 0.399 -6.710 1.00 0.00 N ATOM 1909 CA LYS A 57 7.743 0.778 -8.150 1.00 0.00 C ATOM 1910 C LYS A 57 9.188 1.163 -8.499 1.00 0.00 C ATOM 1911 O LYS A 57 9.984 1.466 -7.634 1.00 0.00 O ATOM 1912 CB LYS A 57 6.840 1.997 -8.373 1.00 0.00 C ATOM 1913 CG LYS A 57 6.505 2.150 -9.864 1.00 0.00 C ATOM 1914 CD LYS A 57 6.131 3.602 -10.163 1.00 0.00 C ATOM 1915 CE LYS A 57 5.006 4.071 -9.229 1.00 0.00 C ATOM 1916 NZ LYS A 57 5.584 4.495 -7.924 1.00 0.00 N ATOM 0 H LYS A 57 6.851 0.783 -6.218 1.00 0.00 H new ATOM 0 HA LYS A 57 7.431 -0.058 -8.776 1.00 0.00 H new ATOM 0 HB2 LYS A 57 5.921 1.887 -7.797 1.00 0.00 H new ATOM 0 HB3 LYS A 57 7.337 2.897 -8.011 1.00 0.00 H new ATOM 0 HG2 LYS A 57 7.360 1.852 -10.471 1.00 0.00 H new ATOM 0 HG3 LYS A 57 5.680 1.490 -10.131 1.00 0.00 H new ATOM 0 HD2 LYS A 57 7.005 4.242 -10.039 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.812 3.695 -11.201 1.00 0.00 H new ATOM 0 HE2 LYS A 57 4.463 4.900 -9.684 1.00 0.00 H new ATOM 0 HE3 LYS A 57 4.288 3.266 -9.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 5.129 5.377 -7.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.421 3.752 -7.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 6.606 4.652 -8.032 1.00 0.00 H new ATOM 1930 N VAL A 58 9.521 1.184 -9.760 1.00 0.00 N ATOM 1931 CA VAL A 58 10.897 1.582 -10.161 1.00 0.00 C ATOM 1932 C VAL A 58 11.147 3.004 -9.654 1.00 0.00 C ATOM 1933 O VAL A 58 10.244 3.815 -9.606 1.00 0.00 O ATOM 1934 CB VAL A 58 11.000 1.562 -11.691 1.00 0.00 C ATOM 1935 CG1 VAL A 58 12.324 2.200 -12.132 1.00 0.00 C ATOM 1936 CG2 VAL A 58 10.939 0.112 -12.182 1.00 0.00 C ATOM 0 H VAL A 58 8.898 0.942 -10.530 1.00 0.00 H new ATOM 0 HA VAL A 58 11.632 0.895 -9.741 1.00 0.00 H new ATOM 0 HB VAL A 58 10.172 2.129 -12.118 1.00 0.00 H new ATOM 0 HG11 VAL A 58 12.392 2.183 -13.220 1.00 0.00 H new ATOM 0 HG12 VAL A 58 12.365 3.231 -11.782 1.00 0.00 H new ATOM 0 HG13 VAL A 58 13.157 1.639 -11.708 1.00 0.00 H new ATOM 0 HG21 VAL A 58 11.012 0.093 -13.269 1.00 0.00 H new ATOM 0 HG22 VAL A 58 11.767 -0.453 -11.753 1.00 0.00 H new ATOM 0 HG23 VAL A 58 9.995 -0.337 -11.874 1.00 0.00 H new ATOM 1946 N SER A 59 12.356 3.327 -9.278 1.00 0.00 N ATOM 1947 CA SER A 59 12.620 4.714 -8.784 1.00 0.00 C ATOM 1948 C SER A 59 12.905 5.617 -9.986 1.00 0.00 C ATOM 1949 O SER A 59 13.928 5.494 -10.630 1.00 0.00 O ATOM 1950 CB SER A 59 13.823 4.714 -7.840 1.00 0.00 C ATOM 1951 OG SER A 59 13.713 3.624 -6.935 1.00 0.00 O ATOM 0 H SER A 59 13.162 2.703 -9.290 1.00 0.00 H new ATOM 0 HA SER A 59 11.750 5.082 -8.240 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.748 4.634 -8.412 1.00 0.00 H new ATOM 0 HB3 SER A 59 13.868 5.654 -7.290 1.00 0.00 H new ATOM 0 HG SER A 59 14.484 3.622 -6.330 1.00 0.00 H new ATOM 1957 N SER A 60 12.002 6.517 -10.299 1.00 0.00 N ATOM 1958 CA SER A 60 12.203 7.433 -11.470 1.00 0.00 C ATOM 1959 C SER A 60 12.007 8.886 -11.032 1.00 0.00 C ATOM 1960 O SER A 60 11.059 9.215 -10.346 1.00 0.00 O ATOM 1961 CB SER A 60 11.177 7.095 -12.552 1.00 0.00 C ATOM 1962 OG SER A 60 11.296 8.029 -13.619 1.00 0.00 O ATOM 0 H SER A 60 11.129 6.658 -9.791 1.00 0.00 H new ATOM 0 HA SER A 60 13.213 7.305 -11.859 1.00 0.00 H new ATOM 0 HB2 SER A 60 11.339 6.082 -12.920 1.00 0.00 H new ATOM 0 HB3 SER A 60 10.170 7.126 -12.137 1.00 0.00 H new ATOM 0 HG SER A 60 10.641 7.815 -14.316 1.00 0.00 H new ATOM 1968 N LYS A 61 12.892 9.764 -11.429 1.00 0.00 N ATOM 1969 CA LYS A 61 12.751 11.199 -11.040 1.00 0.00 C ATOM 1970 C LYS A 61 11.895 11.917 -12.089 1.00 0.00 C ATOM 1971 O LYS A 61 12.150 11.837 -13.275 1.00 0.00 O ATOM 1972 CB LYS A 61 14.139 11.845 -10.961 1.00 0.00 C ATOM 1973 CG LYS A 61 13.997 13.296 -10.492 1.00 0.00 C ATOM 1974 CD LYS A 61 15.376 13.882 -10.165 1.00 0.00 C ATOM 1975 CE LYS A 61 16.261 13.892 -11.417 1.00 0.00 C ATOM 1976 NZ LYS A 61 16.883 12.548 -11.599 1.00 0.00 N ATOM 0 H LYS A 61 13.706 9.549 -12.005 1.00 0.00 H new ATOM 0 HA LYS A 61 12.270 11.276 -10.065 1.00 0.00 H new ATOM 0 HB2 LYS A 61 14.773 11.288 -10.271 1.00 0.00 H new ATOM 0 HB3 LYS A 61 14.624 11.812 -11.937 1.00 0.00 H new ATOM 0 HG2 LYS A 61 13.515 13.891 -11.267 1.00 0.00 H new ATOM 0 HG3 LYS A 61 13.356 13.341 -9.611 1.00 0.00 H new ATOM 0 HD2 LYS A 61 15.266 14.896 -9.781 1.00 0.00 H new ATOM 0 HD3 LYS A 61 15.852 13.294 -9.380 1.00 0.00 H new ATOM 0 HE2 LYS A 61 15.666 14.151 -12.293 1.00 0.00 H new ATOM 0 HE3 LYS A 61 17.036 14.653 -11.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 17.902 12.658 -11.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 16.741 11.981 -10.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 16.440 12.067 -12.408 1.00 0.00 H new ATOM 1990 N GLY A 62 10.868 12.603 -11.662 1.00 0.00 N ATOM 1991 CA GLY A 62 9.976 13.310 -12.628 1.00 0.00 C ATOM 1992 C GLY A 62 10.626 14.610 -13.111 1.00 0.00 C ATOM 1993 O GLY A 62 9.948 15.526 -13.534 1.00 0.00 O ATOM 0 H GLY A 62 10.607 12.705 -10.681 1.00 0.00 H new ATOM 0 HA2 GLY A 62 9.768 12.663 -13.480 1.00 0.00 H new ATOM 0 HA3 GLY A 62 9.019 13.530 -12.154 1.00 0.00 H new ATOM 1997 N LYS A 63 11.927 14.705 -13.060 1.00 0.00 N ATOM 1998 CA LYS A 63 12.600 15.955 -13.525 1.00 0.00 C ATOM 1999 C LYS A 63 14.032 15.633 -13.963 1.00 0.00 C ATOM 2000 O LYS A 63 14.989 16.180 -13.452 1.00 0.00 O ATOM 2001 CB LYS A 63 12.622 16.974 -12.381 1.00 0.00 C ATOM 2002 CG LYS A 63 13.023 18.350 -12.924 1.00 0.00 C ATOM 2003 CD LYS A 63 13.413 19.276 -11.765 1.00 0.00 C ATOM 2004 CE LYS A 63 12.199 19.550 -10.871 1.00 0.00 C ATOM 2005 NZ LYS A 63 11.043 19.974 -11.712 1.00 0.00 N ATOM 0 H LYS A 63 12.552 13.975 -12.718 1.00 0.00 H new ATOM 0 HA LYS A 63 12.054 16.373 -14.370 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.640 17.030 -11.911 1.00 0.00 H new ATOM 0 HB3 LYS A 63 13.326 16.657 -11.612 1.00 0.00 H new ATOM 0 HG2 LYS A 63 13.859 18.248 -13.616 1.00 0.00 H new ATOM 0 HG3 LYS A 63 12.196 18.784 -13.485 1.00 0.00 H new ATOM 0 HD2 LYS A 63 14.210 18.819 -11.178 1.00 0.00 H new ATOM 0 HD3 LYS A 63 13.804 20.215 -12.157 1.00 0.00 H new ATOM 0 HE2 LYS A 63 11.941 18.654 -10.306 1.00 0.00 H new ATOM 0 HE3 LYS A 63 12.438 20.327 -10.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 10.365 20.504 -11.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 11.381 20.580 -12.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 10.576 19.134 -12.109 1.00 0.00 H new ATOM 2019 N LYS A 64 14.184 14.744 -14.908 1.00 0.00 N ATOM 2020 CA LYS A 64 15.550 14.379 -15.388 1.00 0.00 C ATOM 2021 C LYS A 64 16.157 15.548 -16.164 1.00 0.00 C ATOM 2022 O LYS A 64 17.329 15.845 -16.045 1.00 0.00 O ATOM 2023 CB LYS A 64 15.451 13.155 -16.300 1.00 0.00 C ATOM 2024 CG LYS A 64 15.088 11.931 -15.457 1.00 0.00 C ATOM 2025 CD LYS A 64 14.824 10.726 -16.368 1.00 0.00 C ATOM 2026 CE LYS A 64 16.137 10.222 -16.976 1.00 0.00 C ATOM 2027 NZ LYS A 64 15.929 8.854 -17.529 1.00 0.00 N ATOM 0 H LYS A 64 13.419 14.253 -15.370 1.00 0.00 H new ATOM 0 HA LYS A 64 16.187 14.151 -14.533 1.00 0.00 H new ATOM 0 HB2 LYS A 64 14.696 13.319 -17.069 1.00 0.00 H new ATOM 0 HB3 LYS A 64 16.399 12.991 -16.813 1.00 0.00 H new ATOM 0 HG2 LYS A 64 15.898 11.703 -14.764 1.00 0.00 H new ATOM 0 HG3 LYS A 64 14.204 12.143 -14.855 1.00 0.00 H new ATOM 0 HD2 LYS A 64 14.349 9.928 -15.798 1.00 0.00 H new ATOM 0 HD3 LYS A 64 14.132 11.006 -17.162 1.00 0.00 H new ATOM 0 HE2 LYS A 64 16.470 10.898 -17.763 1.00 0.00 H new ATOM 0 HE3 LYS A 64 16.920 10.205 -16.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 16.818 8.508 -17.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 15.629 8.213 -16.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 15.194 8.885 -18.264 1.00 0.00 H new ATOM 2041 N ARG A 65 15.367 16.217 -16.960 1.00 0.00 N ATOM 2042 CA ARG A 65 15.888 17.371 -17.747 1.00 0.00 C ATOM 2043 C ARG A 65 14.799 18.443 -17.845 1.00 0.00 C ATOM 2044 O ARG A 65 13.635 18.142 -18.017 1.00 0.00 O ATOM 2045 CB ARG A 65 16.282 16.899 -19.150 1.00 0.00 C ATOM 2046 CG ARG A 65 16.886 18.067 -19.930 1.00 0.00 C ATOM 2047 CD ARG A 65 17.509 17.554 -21.231 1.00 0.00 C ATOM 2048 NE ARG A 65 16.437 17.114 -22.167 1.00 0.00 N ATOM 2049 CZ ARG A 65 16.711 16.931 -23.430 1.00 0.00 C ATOM 2050 NH1 ARG A 65 17.922 17.140 -23.870 1.00 0.00 N ATOM 2051 NH2 ARG A 65 15.776 16.545 -24.255 1.00 0.00 N ATOM 0 H ARG A 65 14.378 16.012 -17.099 1.00 0.00 H new ATOM 0 HA ARG A 65 16.766 17.788 -17.253 1.00 0.00 H new ATOM 0 HB2 ARG A 65 17.001 16.083 -19.082 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.408 16.511 -19.674 1.00 0.00 H new ATOM 0 HG2 ARG A 65 16.116 18.806 -20.151 1.00 0.00 H new ATOM 0 HG3 ARG A 65 17.643 18.567 -19.326 1.00 0.00 H new ATOM 0 HD2 ARG A 65 18.107 18.340 -21.693 1.00 0.00 H new ATOM 0 HD3 ARG A 65 18.182 16.724 -21.019 1.00 0.00 H new ATOM 0 HE ARG A 65 15.490 16.956 -21.822 1.00 0.00 H new ATOM 0 HH11 ARG A 65 18.652 17.446 -23.227 1.00 0.00 H new ATOM 0 HH12 ARG A 65 18.138 16.997 -24.857 1.00 0.00 H new ATOM 0 HH21 ARG A 65 14.828 16.386 -23.913 1.00 0.00 H new ATOM 0 HH22 ARG A 65 15.993 16.403 -25.241 1.00 0.00 H new ATOM 2065 N ARG A 66 15.167 19.688 -17.735 1.00 0.00 N ATOM 2066 CA ARG A 66 14.149 20.774 -17.821 1.00 0.00 C ATOM 2067 C ARG A 66 13.754 20.991 -19.283 1.00 0.00 C ATOM 2068 O ARG A 66 13.322 22.087 -19.603 1.00 0.00 O ATOM 2069 CB ARG A 66 14.734 22.070 -17.257 1.00 0.00 C ATOM 2070 CG ARG A 66 14.902 21.949 -15.740 1.00 0.00 C ATOM 2071 CD ARG A 66 15.488 23.251 -15.195 1.00 0.00 C ATOM 2072 NE ARG A 66 16.849 23.483 -15.786 1.00 0.00 N ATOM 2073 CZ ARG A 66 17.834 22.644 -15.596 1.00 0.00 C ATOM 2074 NH1 ARG A 66 17.700 21.645 -14.769 1.00 0.00 N ATOM 2075 NH2 ARG A 66 18.972 22.831 -16.206 1.00 0.00 N ATOM 2076 OXT ARG A 66 13.891 20.059 -20.058 1.00 0.00 O ATOM 0 H ARG A 66 16.127 20.002 -17.589 1.00 0.00 H new ATOM 0 HA ARG A 66 13.269 20.490 -17.244 1.00 0.00 H new ATOM 0 HB2 ARG A 66 15.697 22.277 -17.723 1.00 0.00 H new ATOM 0 HB3 ARG A 66 14.079 22.908 -17.493 1.00 0.00 H new ATOM 0 HG2 ARG A 66 13.940 21.744 -15.271 1.00 0.00 H new ATOM 0 HG3 ARG A 66 15.558 21.112 -15.500 1.00 0.00 H new ATOM 0 HD2 ARG A 66 14.830 24.086 -15.436 1.00 0.00 H new ATOM 0 HD3 ARG A 66 15.557 23.203 -14.108 1.00 0.00 H new ATOM 0 HE ARG A 66 17.009 24.317 -16.351 1.00 0.00 H new ATOM 0 HH11 ARG A 66 16.823 21.514 -14.265 1.00 0.00 H new ATOM 0 HH12 ARG A 66 18.472 20.994 -14.626 1.00 0.00 H new ATOM 0 HH21 ARG A 66 19.091 23.630 -16.829 1.00 0.00 H new ATOM 0 HH22 ARG A 66 19.742 22.178 -16.060 1.00 0.00 H new TER 2090 ARG A 66 HETATM 2091 ZN ZN A 67 -12.035 3.096 2.205 1.00 0.00 ZN