USER MOD reduce.3.24.130724 H: found=0, std=0, add=894, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 891 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 NoAdj-H: A 38 HIS HE2 : A 38 HIS NE2 : A 101 ZNZN :(H bumps) USER MOD NoAdj-H: A 70 HIS HE2 : A 70 HIS NE2 : A 102 ZNZN :(H bumps) USER MOD Set 1.1: A 85 ASN : amide:sc= 0.896 K(o=1.7,f=-1.7) USER MOD Set 1.2: A 90 GLN : amide:sc= 0.793 K(o=1.7,f=-1.9) USER MOD Set 2.1: A 89 GLN : amide:sc= 1.67 K(o=2.3,f=-4) USER MOD Set 2.2: A 92 ASN : amide:sc= 0.673 K(o=2.3,f=-1.9!) USER MOD Set 3.1: A 56 SER OG : rot 142:sc= 0.00341 USER MOD Set 3.2: A 76 LYS NZ :NH3+ -162:sc= 0.571 (180deg=0.409) USER MOD Set 4.1: A 44 GLN : amide:sc= -0.603 K(o=1.5,f=-0.22) USER MOD Set 4.2: A 67 LYS NZ :NH3+ 131:sc= 1.48 (180deg=0.548) USER MOD Set 4.3: A 68 TYR OH : rot -112:sc= 0.647 USER MOD Set 5.1: A 40 SER OG : rot -51:sc= 0.874 USER MOD Set 5.2: A 43 CYS SG : rot 180:sc= 0.943 USER MOD Single : A 1 MET CE :methyl -174:sc= 0 (180deg=-0.0414) USER MOD Single : A 1 MET N :NH3+ 173:sc= -0.0817 (180deg=-0.135) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 158:sc= 0.201 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 140:sc= -0.246 USER MOD Single : A 23 GLN : amide:sc= 0.711 K(o=0.71,f=0) USER MOD Single : A 26 THR OG1 : rot 145:sc= 0.0619 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.0175 USER MOD Single : A 35 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0178) USER MOD Single : A 41 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00735) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= -0.127 X(o=-0.13,f=-0.54) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 74 HIS : no HD1:sc= -0.0487 X(o=-0.049,f=-0.34) USER MOD Single : A 77 THR OG1 : rot 74:sc= 0.924 USER MOD Single : A 78 GLN : amide:sc= -0.0477 X(o=-0.048,f=-0.049) USER MOD Single : A 82 ASN : amide:sc= 1.08 K(o=1.1,f=0) USER MOD Single : A 86 ASN : amide:sc= 1 K(o=1,f=0) USER MOD Single : A 91 LYS NZ :NH3+ 169:sc= 0.533 (180deg=0.465) USER MOD Single : B 95 G O2' : rot -24:sc= 0.572 USER MOD Single : B 96 U O2' : rot 19:sc= 0.0463 USER MOD Single : B 97 C O2' : rot -104:sc= 0.427 USER MOD Single : B 98 U O2' : rot -149:sc= 0.13 USER MOD Single : B 99 C O2' : rot 180:sc= 0 USER MOD Single : B 100 G O2' : rot -60:sc= 0.342 USER MOD Single : B 101 C O2' : rot -18:sc= 0.131 USER MOD Single : B 102 U O2' : rot -11:sc= 0.383 USER MOD Single : B 103 U O2' : rot -29:sc= 0.0437 USER MOD Single : B 104 U O2' : rot -28:sc= 0.219 USER MOD Single : B 105 U O2' : rot 20:sc= 0.261 USER MOD Single : B 106 C O2' : rot 17:sc= 0.0694 USER MOD Single : B 107 C O2' : rot 17:sc= 0.172 USER MOD Single : B 108 C O2' : rot -28:sc= 0.126 USER MOD Single : B 109 C O2' : rot 180:sc= 0 USER MOD Single : B 109 C O3' : rot 134:sc= 0.101 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 29.398 27.851 12.343 1.00 0.00 N ATOM 2 CA MET A 1 29.961 26.535 12.671 1.00 0.00 C ATOM 3 C MET A 1 29.137 25.345 12.132 1.00 0.00 C ATOM 4 O MET A 1 29.529 24.187 12.301 1.00 0.00 O ATOM 5 CB MET A 1 30.187 26.430 14.191 1.00 0.00 C ATOM 6 CG MET A 1 28.884 26.451 15.005 1.00 0.00 C ATOM 7 SD MET A 1 29.100 26.396 16.809 1.00 0.00 S ATOM 8 CE MET A 1 29.709 24.699 17.026 1.00 0.00 C ATOM 0 H1 MET A 1 29.937 28.592 12.836 1.00 0.00 H new ATOM 0 H2 MET A 1 29.455 28.007 11.316 1.00 0.00 H new ATOM 0 H3 MET A 1 28.403 27.888 12.644 1.00 0.00 H new ATOM 0 HA MET A 1 30.919 26.463 12.156 1.00 0.00 H new ATOM 0 HB2 MET A 1 30.727 25.508 14.408 1.00 0.00 H new ATOM 0 HB3 MET A 1 30.822 27.255 14.514 1.00 0.00 H new ATOM 0 HG2 MET A 1 28.328 27.353 14.749 1.00 0.00 H new ATOM 0 HG3 MET A 1 28.271 25.602 14.702 1.00 0.00 H new ATOM 0 HE1 MET A 1 29.788 24.474 18.090 1.00 0.00 H new ATOM 0 HE2 MET A 1 29.015 24.001 16.558 1.00 0.00 H new ATOM 0 HE3 MET A 1 30.690 24.602 16.561 1.00 0.00 H new ATOM 18 N ALA A 2 27.997 25.618 11.489 1.00 0.00 N ATOM 19 CA ALA A 2 27.102 24.616 10.904 1.00 0.00 C ATOM 20 C ALA A 2 27.740 23.850 9.719 1.00 0.00 C ATOM 21 O ALA A 2 28.677 24.329 9.071 1.00 0.00 O ATOM 22 CB ALA A 2 25.808 25.324 10.478 1.00 0.00 C ATOM 0 H ALA A 2 27.662 26.572 11.358 1.00 0.00 H new ATOM 0 HA ALA A 2 26.892 23.856 11.656 1.00 0.00 H new ATOM 0 HB1 ALA A 2 25.124 24.598 10.039 1.00 0.00 H new ATOM 0 HB2 ALA A 2 25.340 25.782 11.349 1.00 0.00 H new ATOM 0 HB3 ALA A 2 26.040 26.095 9.743 1.00 0.00 H new ATOM 28 N VAL A 3 27.195 22.664 9.415 1.00 0.00 N ATOM 29 CA VAL A 3 27.629 21.768 8.322 1.00 0.00 C ATOM 30 C VAL A 3 26.396 21.144 7.648 1.00 0.00 C ATOM 31 O VAL A 3 25.379 20.899 8.302 1.00 0.00 O ATOM 32 CB VAL A 3 28.570 20.654 8.848 1.00 0.00 C ATOM 33 CG1 VAL A 3 29.229 19.862 7.708 1.00 0.00 C ATOM 34 CG2 VAL A 3 29.717 21.186 9.721 1.00 0.00 C ATOM 0 H VAL A 3 26.409 22.283 9.941 1.00 0.00 H new ATOM 0 HA VAL A 3 28.185 22.358 7.593 1.00 0.00 H new ATOM 0 HB VAL A 3 27.913 20.019 9.441 1.00 0.00 H new ATOM 0 HG11 VAL A 3 29.879 19.093 8.127 1.00 0.00 H new ATOM 0 HG12 VAL A 3 28.457 19.392 7.098 1.00 0.00 H new ATOM 0 HG13 VAL A 3 29.819 20.538 7.089 1.00 0.00 H new ATOM 0 HG21 VAL A 3 30.336 20.354 10.055 1.00 0.00 H new ATOM 0 HG22 VAL A 3 30.325 21.880 9.140 1.00 0.00 H new ATOM 0 HG23 VAL A 3 29.305 21.702 10.588 1.00 0.00 H new ATOM 44 N SER A 4 26.477 20.880 6.340 1.00 0.00 N ATOM 45 CA SER A 4 25.398 20.296 5.516 1.00 0.00 C ATOM 46 C SER A 4 25.000 18.853 5.883 1.00 0.00 C ATOM 47 O SER A 4 23.976 18.355 5.412 1.00 0.00 O ATOM 48 CB SER A 4 25.804 20.324 4.035 1.00 0.00 C ATOM 49 OG SER A 4 26.225 21.621 3.637 1.00 0.00 O ATOM 0 H SER A 4 27.322 21.071 5.801 1.00 0.00 H new ATOM 0 HA SER A 4 24.524 20.916 5.716 1.00 0.00 H new ATOM 0 HB2 SER A 4 26.609 19.610 3.864 1.00 0.00 H new ATOM 0 HB3 SER A 4 24.962 20.008 3.419 1.00 0.00 H new ATOM 0 HG SER A 4 26.479 21.607 2.690 1.00 0.00 H new ATOM 55 N VAL A 5 25.792 18.173 6.718 1.00 0.00 N ATOM 56 CA VAL A 5 25.587 16.796 7.200 1.00 0.00 C ATOM 57 C VAL A 5 26.226 16.624 8.585 1.00 0.00 C ATOM 58 O VAL A 5 27.099 17.401 8.979 1.00 0.00 O ATOM 59 CB VAL A 5 26.137 15.783 6.169 1.00 0.00 C ATOM 60 CG1 VAL A 5 27.658 15.867 5.977 1.00 0.00 C ATOM 61 CG2 VAL A 5 25.755 14.329 6.473 1.00 0.00 C ATOM 0 H VAL A 5 26.642 18.589 7.099 1.00 0.00 H new ATOM 0 HA VAL A 5 24.520 16.600 7.307 1.00 0.00 H new ATOM 0 HB VAL A 5 25.652 16.082 5.240 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.973 15.128 5.240 1.00 0.00 H new ATOM 0 HG12 VAL A 5 27.926 16.864 5.628 1.00 0.00 H new ATOM 0 HG13 VAL A 5 28.156 15.668 6.926 1.00 0.00 H new ATOM 0 HG21 VAL A 5 26.175 13.675 5.709 1.00 0.00 H new ATOM 0 HG22 VAL A 5 26.149 14.046 7.449 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.669 14.231 6.478 1.00 0.00 H new ATOM 71 N THR A 6 25.791 15.614 9.337 1.00 0.00 N ATOM 72 CA THR A 6 26.271 15.316 10.699 1.00 0.00 C ATOM 73 C THR A 6 27.778 14.972 10.695 1.00 0.00 C ATOM 74 O THR A 6 28.181 14.091 9.929 1.00 0.00 O ATOM 75 CB THR A 6 25.467 14.149 11.304 1.00 0.00 C ATOM 76 OG1 THR A 6 24.087 14.339 11.054 1.00 0.00 O ATOM 77 CG2 THR A 6 25.632 14.060 12.822 1.00 0.00 C ATOM 0 H THR A 6 25.078 14.960 9.014 1.00 0.00 H new ATOM 0 HA THR A 6 26.125 16.207 11.310 1.00 0.00 H new ATOM 0 HB THR A 6 25.845 13.237 10.841 1.00 0.00 H new ATOM 0 HG1 THR A 6 23.622 13.479 11.116 1.00 0.00 H new ATOM 0 HG21 THR A 6 25.047 13.223 13.203 1.00 0.00 H new ATOM 0 HG22 THR A 6 26.684 13.909 13.065 1.00 0.00 H new ATOM 0 HG23 THR A 6 25.283 14.985 13.281 1.00 0.00 H new ATOM 85 N PRO A 7 28.631 15.636 11.513 1.00 0.00 N ATOM 86 CA PRO A 7 30.084 15.391 11.574 1.00 0.00 C ATOM 87 C PRO A 7 30.509 13.927 11.797 1.00 0.00 C ATOM 88 O PRO A 7 31.542 13.488 11.287 1.00 0.00 O ATOM 89 CB PRO A 7 30.594 16.256 12.732 1.00 0.00 C ATOM 90 CG PRO A 7 29.591 17.401 12.795 1.00 0.00 C ATOM 91 CD PRO A 7 28.277 16.719 12.424 1.00 0.00 C ATOM 0 HA PRO A 7 30.510 15.640 10.602 1.00 0.00 H new ATOM 0 HB2 PRO A 7 30.623 15.697 13.667 1.00 0.00 H new ATOM 0 HB3 PRO A 7 31.605 16.619 12.546 1.00 0.00 H new ATOM 0 HG2 PRO A 7 29.549 17.848 13.788 1.00 0.00 H new ATOM 0 HG3 PRO A 7 29.844 18.199 12.097 1.00 0.00 H new ATOM 0 HD2 PRO A 7 27.773 16.334 13.311 1.00 0.00 H new ATOM 0 HD3 PRO A 7 27.593 17.422 11.948 1.00 0.00 H new ATOM 99 N ILE A 8 29.702 13.179 12.555 1.00 0.00 N ATOM 100 CA ILE A 8 29.863 11.758 12.897 1.00 0.00 C ATOM 101 C ILE A 8 28.665 10.934 12.402 1.00 0.00 C ATOM 102 O ILE A 8 27.600 11.496 12.138 1.00 0.00 O ATOM 103 CB ILE A 8 30.119 11.544 14.410 1.00 0.00 C ATOM 104 CG1 ILE A 8 28.985 11.995 15.365 1.00 0.00 C ATOM 105 CG2 ILE A 8 31.483 12.130 14.804 1.00 0.00 C ATOM 106 CD1 ILE A 8 28.801 13.502 15.606 1.00 0.00 C ATOM 0 H ILE A 8 28.861 13.575 12.976 1.00 0.00 H new ATOM 0 HA ILE A 8 30.753 11.400 12.379 1.00 0.00 H new ATOM 0 HB ILE A 8 30.131 10.463 14.548 1.00 0.00 H new ATOM 0 HG12 ILE A 8 28.045 11.602 14.977 1.00 0.00 H new ATOM 0 HG13 ILE A 8 29.154 11.520 16.332 1.00 0.00 H new ATOM 0 HG21 ILE A 8 31.652 11.974 15.869 1.00 0.00 H new ATOM 0 HG22 ILE A 8 32.270 11.635 14.235 1.00 0.00 H new ATOM 0 HG23 ILE A 8 31.496 13.198 14.587 1.00 0.00 H new ATOM 0 HD11 ILE A 8 27.971 13.662 16.295 1.00 0.00 H new ATOM 0 HD12 ILE A 8 29.713 13.916 16.035 1.00 0.00 H new ATOM 0 HD13 ILE A 8 28.588 13.998 14.659 1.00 0.00 H new ATOM 118 N ARG A 9 28.850 9.610 12.270 1.00 0.00 N ATOM 119 CA ARG A 9 27.852 8.622 11.797 1.00 0.00 C ATOM 120 C ARG A 9 26.419 8.900 12.290 1.00 0.00 C ATOM 121 O ARG A 9 26.077 8.713 13.458 1.00 0.00 O ATOM 122 CB ARG A 9 28.345 7.185 12.036 1.00 0.00 C ATOM 123 CG ARG A 9 28.669 6.811 13.486 1.00 0.00 C ATOM 124 CD ARG A 9 29.406 5.464 13.519 1.00 0.00 C ATOM 125 NE ARG A 9 29.423 4.877 14.866 1.00 0.00 N ATOM 126 CZ ARG A 9 30.202 5.230 15.879 1.00 0.00 C ATOM 127 NH1 ARG A 9 31.103 6.173 15.785 1.00 0.00 N ATOM 128 NH2 ARG A 9 30.098 4.633 17.034 1.00 0.00 N ATOM 0 H ARG A 9 29.742 9.173 12.500 1.00 0.00 H new ATOM 0 HA ARG A 9 27.765 8.741 10.717 1.00 0.00 H new ATOM 0 HB2 ARG A 9 27.585 6.497 11.667 1.00 0.00 H new ATOM 0 HB3 ARG A 9 29.239 7.025 11.433 1.00 0.00 H new ATOM 0 HG2 ARG A 9 29.285 7.585 13.943 1.00 0.00 H new ATOM 0 HG3 ARG A 9 27.751 6.749 14.070 1.00 0.00 H new ATOM 0 HD2 ARG A 9 28.926 4.771 12.828 1.00 0.00 H new ATOM 0 HD3 ARG A 9 30.430 5.603 13.171 1.00 0.00 H new ATOM 0 HE ARG A 9 28.765 4.117 15.040 1.00 0.00 H new ATOM 0 HH11 ARG A 9 31.229 6.672 14.904 1.00 0.00 H new ATOM 0 HH12 ARG A 9 31.679 6.410 16.592 1.00 0.00 H new ATOM 0 HH21 ARG A 9 29.413 3.888 17.163 1.00 0.00 H new ATOM 0 HH22 ARG A 9 30.701 4.911 17.808 1.00 0.00 H new ATOM 142 N ASP A 10 25.624 9.439 11.371 1.00 0.00 N ATOM 143 CA ASP A 10 24.272 9.970 11.549 1.00 0.00 C ATOM 144 C ASP A 10 23.220 9.019 12.160 1.00 0.00 C ATOM 145 O ASP A 10 22.579 8.243 11.463 1.00 0.00 O ATOM 146 CB ASP A 10 23.812 10.498 10.178 1.00 0.00 C ATOM 147 CG ASP A 10 22.410 11.103 10.241 1.00 0.00 C ATOM 148 OD1 ASP A 10 22.170 11.882 11.192 1.00 0.00 O ATOM 149 OD2 ASP A 10 21.578 10.765 9.368 1.00 0.00 O ATOM 0 H ASP A 10 25.932 9.524 10.402 1.00 0.00 H new ATOM 0 HA ASP A 10 24.341 10.751 12.306 1.00 0.00 H new ATOM 0 HB2 ASP A 10 24.516 11.251 9.824 1.00 0.00 H new ATOM 0 HB3 ASP A 10 23.824 9.684 9.453 1.00 0.00 H new ATOM 154 N THR A 11 22.931 9.141 13.454 1.00 0.00 N ATOM 155 CA THR A 11 21.867 8.362 14.126 1.00 0.00 C ATOM 156 C THR A 11 20.458 8.609 13.560 1.00 0.00 C ATOM 157 O THR A 11 19.560 7.790 13.771 1.00 0.00 O ATOM 158 CB THR A 11 21.838 8.653 15.635 1.00 0.00 C ATOM 159 OG1 THR A 11 21.774 10.048 15.853 1.00 0.00 O ATOM 160 CG2 THR A 11 23.086 8.123 16.341 1.00 0.00 C ATOM 0 H THR A 11 23.423 9.782 14.076 1.00 0.00 H new ATOM 0 HA THR A 11 22.124 7.320 13.936 1.00 0.00 H new ATOM 0 HB THR A 11 20.960 8.152 16.042 1.00 0.00 H new ATOM 0 HG1 THR A 11 21.754 10.228 16.816 1.00 0.00 H new ATOM 0 HG21 THR A 11 23.026 8.349 17.406 1.00 0.00 H new ATOM 0 HG22 THR A 11 23.152 7.044 16.203 1.00 0.00 H new ATOM 0 HG23 THR A 11 23.972 8.597 15.919 1.00 0.00 H new ATOM 168 N LYS A 12 20.235 9.700 12.810 1.00 0.00 N ATOM 169 CA LYS A 12 18.916 10.034 12.240 1.00 0.00 C ATOM 170 C LYS A 12 18.428 9.040 11.189 1.00 0.00 C ATOM 171 O LYS A 12 17.219 8.841 11.066 1.00 0.00 O ATOM 172 CB LYS A 12 18.862 11.479 11.723 1.00 0.00 C ATOM 173 CG LYS A 12 19.256 12.523 12.782 1.00 0.00 C ATOM 174 CD LYS A 12 18.497 12.438 14.122 1.00 0.00 C ATOM 175 CE LYS A 12 16.968 12.403 13.990 1.00 0.00 C ATOM 176 NZ LYS A 12 16.438 13.641 13.381 1.00 0.00 N ATOM 0 H LYS A 12 20.963 10.377 12.581 1.00 0.00 H new ATOM 0 HA LYS A 12 18.215 9.951 13.070 1.00 0.00 H new ATOM 0 HB2 LYS A 12 19.527 11.575 10.865 1.00 0.00 H new ATOM 0 HB3 LYS A 12 17.853 11.693 11.370 1.00 0.00 H new ATOM 0 HG2 LYS A 12 20.323 12.424 12.983 1.00 0.00 H new ATOM 0 HG3 LYS A 12 19.102 13.516 12.361 1.00 0.00 H new ATOM 0 HD2 LYS A 12 18.823 11.544 14.653 1.00 0.00 H new ATOM 0 HD3 LYS A 12 18.776 13.293 14.737 1.00 0.00 H new ATOM 0 HE2 LYS A 12 16.676 11.546 13.383 1.00 0.00 H new ATOM 0 HE3 LYS A 12 16.522 12.263 14.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 15.402 13.577 13.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 16.695 14.457 13.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 16.844 13.762 12.431 1.00 0.00 H new ATOM 190 N TRP A 13 19.337 8.359 10.481 1.00 0.00 N ATOM 191 CA TRP A 13 18.941 7.280 9.559 1.00 0.00 C ATOM 192 C TRP A 13 18.576 5.984 10.317 1.00 0.00 C ATOM 193 O TRP A 13 17.997 5.081 9.722 1.00 0.00 O ATOM 194 CB TRP A 13 19.975 7.053 8.438 1.00 0.00 C ATOM 195 CG TRP A 13 21.139 6.144 8.715 1.00 0.00 C ATOM 196 CD1 TRP A 13 22.371 6.541 9.098 1.00 0.00 C ATOM 197 CD2 TRP A 13 21.222 4.688 8.582 1.00 0.00 C ATOM 198 NE1 TRP A 13 23.194 5.444 9.264 1.00 0.00 N ATOM 199 CE2 TRP A 13 22.536 4.270 8.960 1.00 0.00 C ATOM 200 CE3 TRP A 13 20.321 3.676 8.177 1.00 0.00 C ATOM 201 CZ2 TRP A 13 22.921 2.920 8.959 1.00 0.00 C ATOM 202 CZ3 TRP A 13 20.698 2.320 8.172 1.00 0.00 C ATOM 203 CH2 TRP A 13 21.991 1.941 8.566 1.00 0.00 C ATOM 0 H TRP A 13 20.341 8.531 10.525 1.00 0.00 H new ATOM 0 HA TRP A 13 18.032 7.608 9.056 1.00 0.00 H new ATOM 0 HB2 TRP A 13 19.444 6.659 7.571 1.00 0.00 H new ATOM 0 HB3 TRP A 13 20.374 8.026 8.152 1.00 0.00 H new ATOM 0 HD1 TRP A 13 22.670 7.567 9.252 1.00 0.00 H new ATOM 0 HE1 TRP A 13 24.165 5.495 9.572 1.00 0.00 H new ATOM 0 HE3 TRP A 13 19.324 3.949 7.865 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 23.920 2.637 9.257 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 19.988 1.567 7.863 1.00 0.00 H new ATOM 0 HH2 TRP A 13 22.271 0.898 8.567 1.00 0.00 H new ATOM 214 N LEU A 14 18.866 5.909 11.628 1.00 0.00 N ATOM 215 CA LEU A 14 18.575 4.778 12.520 1.00 0.00 C ATOM 216 C LEU A 14 17.452 5.072 13.540 1.00 0.00 C ATOM 217 O LEU A 14 16.939 4.130 14.144 1.00 0.00 O ATOM 218 CB LEU A 14 19.872 4.336 13.232 1.00 0.00 C ATOM 219 CG LEU A 14 20.916 3.685 12.303 1.00 0.00 C ATOM 220 CD1 LEU A 14 22.244 3.504 13.040 1.00 0.00 C ATOM 221 CD2 LEU A 14 20.465 2.303 11.819 1.00 0.00 C ATOM 0 H LEU A 14 19.332 6.674 12.116 1.00 0.00 H new ATOM 0 HA LEU A 14 18.199 3.965 11.899 1.00 0.00 H new ATOM 0 HB2 LEU A 14 20.322 5.204 13.713 1.00 0.00 H new ATOM 0 HB3 LEU A 14 19.616 3.630 14.022 1.00 0.00 H new ATOM 0 HG LEU A 14 21.031 4.351 11.448 1.00 0.00 H new ATOM 0 HD11 LEU A 14 22.971 3.043 12.371 1.00 0.00 H new ATOM 0 HD12 LEU A 14 22.615 4.476 13.365 1.00 0.00 H new ATOM 0 HD13 LEU A 14 22.093 2.864 13.909 1.00 0.00 H new ATOM 0 HD21 LEU A 14 21.229 1.879 11.167 1.00 0.00 H new ATOM 0 HD22 LEU A 14 20.316 1.648 12.677 1.00 0.00 H new ATOM 0 HD23 LEU A 14 19.529 2.398 11.268 1.00 0.00 H new ATOM 233 N THR A 15 17.039 6.328 13.752 1.00 0.00 N ATOM 234 CA THR A 15 15.939 6.652 14.688 1.00 0.00 C ATOM 235 C THR A 15 14.536 6.422 14.103 1.00 0.00 C ATOM 236 O THR A 15 14.303 6.600 12.906 1.00 0.00 O ATOM 237 CB THR A 15 15.952 8.122 15.151 1.00 0.00 C ATOM 238 OG1 THR A 15 16.253 9.016 14.105 1.00 0.00 O ATOM 239 CG2 THR A 15 16.928 8.386 16.293 1.00 0.00 C ATOM 0 H THR A 15 17.446 7.141 13.291 1.00 0.00 H new ATOM 0 HA THR A 15 16.127 5.970 15.518 1.00 0.00 H new ATOM 0 HB THR A 15 14.936 8.297 15.505 1.00 0.00 H new ATOM 0 HG1 THR A 15 15.687 9.812 14.182 1.00 0.00 H new ATOM 0 HG21 THR A 15 16.887 9.439 16.570 1.00 0.00 H new ATOM 0 HG22 THR A 15 16.656 7.774 17.153 1.00 0.00 H new ATOM 0 HG23 THR A 15 17.939 8.134 15.973 1.00 0.00 H new ATOM 247 N LEU A 16 13.577 6.105 14.983 1.00 0.00 N ATOM 248 CA LEU A 16 12.141 5.951 14.699 1.00 0.00 C ATOM 249 C LEU A 16 11.318 6.691 15.768 1.00 0.00 C ATOM 250 O LEU A 16 11.694 6.725 16.940 1.00 0.00 O ATOM 251 CB LEU A 16 11.773 4.456 14.606 1.00 0.00 C ATOM 252 CG LEU A 16 12.183 3.784 13.280 1.00 0.00 C ATOM 253 CD1 LEU A 16 11.947 2.279 13.365 1.00 0.00 C ATOM 254 CD2 LEU A 16 11.371 4.307 12.089 1.00 0.00 C ATOM 0 H LEU A 16 13.792 5.940 15.966 1.00 0.00 H new ATOM 0 HA LEU A 16 11.905 6.399 13.734 1.00 0.00 H new ATOM 0 HB2 LEU A 16 12.247 3.925 15.431 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.696 4.350 14.736 1.00 0.00 H new ATOM 0 HG LEU A 16 13.237 4.016 13.126 1.00 0.00 H new ATOM 0 HD11 LEU A 16 12.239 1.811 12.425 1.00 0.00 H new ATOM 0 HD12 LEU A 16 12.542 1.863 14.178 1.00 0.00 H new ATOM 0 HD13 LEU A 16 10.891 2.086 13.554 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.696 3.804 11.178 1.00 0.00 H new ATOM 0 HD22 LEU A 16 10.312 4.108 12.255 1.00 0.00 H new ATOM 0 HD23 LEU A 16 11.527 5.381 11.986 1.00 0.00 H new ATOM 266 N GLU A 17 10.220 7.327 15.352 1.00 0.00 N ATOM 267 CA GLU A 17 9.347 8.152 16.202 1.00 0.00 C ATOM 268 C GLU A 17 8.450 7.340 17.156 1.00 0.00 C ATOM 269 O GLU A 17 7.876 6.313 16.786 1.00 0.00 O ATOM 270 CB GLU A 17 8.525 9.080 15.287 1.00 0.00 C ATOM 271 CG GLU A 17 7.711 10.142 16.047 1.00 0.00 C ATOM 272 CD GLU A 17 6.967 11.127 15.127 1.00 0.00 C ATOM 273 OE1 GLU A 17 5.964 11.720 15.596 1.00 0.00 O ATOM 274 OE2 GLU A 17 7.401 11.326 13.967 1.00 0.00 O ATOM 0 H GLU A 17 9.901 7.283 14.384 1.00 0.00 H new ATOM 0 HA GLU A 17 9.978 8.739 16.869 1.00 0.00 H new ATOM 0 HB2 GLU A 17 9.200 9.581 14.593 1.00 0.00 H new ATOM 0 HB3 GLU A 17 7.845 8.474 14.688 1.00 0.00 H new ATOM 0 HG2 GLU A 17 6.987 9.641 16.689 1.00 0.00 H new ATOM 0 HG3 GLU A 17 8.381 10.703 16.699 1.00 0.00 H new ATOM 281 N VAL A 18 8.320 7.834 18.391 1.00 0.00 N ATOM 282 CA VAL A 18 7.501 7.276 19.478 1.00 0.00 C ATOM 283 C VAL A 18 6.053 7.767 19.367 1.00 0.00 C ATOM 284 O VAL A 18 5.808 8.935 19.053 1.00 0.00 O ATOM 285 CB VAL A 18 8.092 7.675 20.847 1.00 0.00 C ATOM 286 CG1 VAL A 18 7.271 7.145 22.029 1.00 0.00 C ATOM 287 CG2 VAL A 18 9.513 7.122 20.990 1.00 0.00 C ATOM 0 H VAL A 18 8.810 8.681 18.678 1.00 0.00 H new ATOM 0 HA VAL A 18 7.507 6.189 19.392 1.00 0.00 H new ATOM 0 HB VAL A 18 8.081 8.765 20.873 1.00 0.00 H new ATOM 0 HG11 VAL A 18 7.736 7.458 22.964 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.258 7.544 21.976 1.00 0.00 H new ATOM 0 HG13 VAL A 18 7.235 6.056 21.988 1.00 0.00 H new ATOM 0 HG21 VAL A 18 9.920 7.410 21.960 1.00 0.00 H new ATOM 0 HG22 VAL A 18 9.490 6.035 20.915 1.00 0.00 H new ATOM 0 HG23 VAL A 18 10.143 7.527 20.198 1.00 0.00 H new ATOM 297 N CYS A 19 5.090 6.880 19.630 1.00 0.00 N ATOM 298 CA CYS A 19 3.663 7.186 19.561 1.00 0.00 C ATOM 299 C CYS A 19 3.263 8.348 20.489 1.00 0.00 C ATOM 300 O CYS A 19 3.646 8.430 21.664 1.00 0.00 O ATOM 301 CB CYS A 19 2.884 5.891 19.811 1.00 0.00 C ATOM 302 SG CYS A 19 1.084 6.107 19.637 1.00 0.00 S ATOM 0 H CYS A 19 5.285 5.916 19.900 1.00 0.00 H new ATOM 0 HA CYS A 19 3.408 7.553 18.567 1.00 0.00 H new ATOM 0 HB2 CYS A 19 3.223 5.127 19.111 1.00 0.00 H new ATOM 0 HB3 CYS A 19 3.107 5.526 20.814 1.00 0.00 H new ATOM 307 N ARG A 20 2.505 9.293 19.925 1.00 0.00 N ATOM 308 CA ARG A 20 2.031 10.514 20.595 1.00 0.00 C ATOM 309 C ARG A 20 0.999 10.192 21.679 1.00 0.00 C ATOM 310 O ARG A 20 1.014 10.802 22.746 1.00 0.00 O ATOM 311 CB ARG A 20 1.487 11.491 19.534 1.00 0.00 C ATOM 312 CG ARG A 20 2.573 11.848 18.497 1.00 0.00 C ATOM 313 CD ARG A 20 2.062 12.769 17.387 1.00 0.00 C ATOM 314 NE ARG A 20 3.073 12.891 16.323 1.00 0.00 N ATOM 315 CZ ARG A 20 2.951 13.543 15.180 1.00 0.00 C ATOM 316 NH1 ARG A 20 3.931 13.516 14.320 1.00 0.00 N ATOM 317 NH2 ARG A 20 1.880 14.222 14.861 1.00 0.00 N ATOM 0 H ARG A 20 2.192 9.230 18.956 1.00 0.00 H new ATOM 0 HA ARG A 20 2.863 10.994 21.110 1.00 0.00 H new ATOM 0 HB2 ARG A 20 0.631 11.044 19.029 1.00 0.00 H new ATOM 0 HB3 ARG A 20 1.132 12.400 20.020 1.00 0.00 H new ATOM 0 HG2 ARG A 20 3.408 12.330 19.005 1.00 0.00 H new ATOM 0 HG3 ARG A 20 2.958 10.930 18.052 1.00 0.00 H new ATOM 0 HD2 ARG A 20 1.134 12.373 16.974 1.00 0.00 H new ATOM 0 HD3 ARG A 20 1.834 13.753 17.797 1.00 0.00 H new ATOM 0 HE ARG A 20 3.964 12.421 16.486 1.00 0.00 H new ATOM 0 HH11 ARG A 20 4.782 12.995 14.532 1.00 0.00 H new ATOM 0 HH12 ARG A 20 3.847 14.016 13.435 1.00 0.00 H new ATOM 0 HH21 ARG A 20 1.092 14.264 15.507 1.00 0.00 H new ATOM 0 HH22 ARG A 20 1.833 14.709 13.966 1.00 0.00 H new ATOM 331 N GLU A 21 0.158 9.186 21.448 1.00 0.00 N ATOM 332 CA GLU A 21 -0.826 8.696 22.421 1.00 0.00 C ATOM 333 C GLU A 21 -0.159 7.811 23.493 1.00 0.00 C ATOM 334 O GLU A 21 -0.594 7.806 24.645 1.00 0.00 O ATOM 335 CB GLU A 21 -1.962 7.957 21.692 1.00 0.00 C ATOM 336 CG GLU A 21 -2.756 8.837 20.710 1.00 0.00 C ATOM 337 CD GLU A 21 -3.355 10.078 21.380 1.00 0.00 C ATOM 338 OE1 GLU A 21 -4.428 9.956 22.015 1.00 0.00 O ATOM 339 OE2 GLU A 21 -2.730 11.161 21.270 1.00 0.00 O ATOM 0 H GLU A 21 0.138 8.677 20.564 1.00 0.00 H new ATOM 0 HA GLU A 21 -1.258 9.549 22.944 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -1.540 7.112 21.147 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -2.649 7.547 22.433 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -2.101 9.149 19.897 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.557 8.247 20.266 1.00 0.00 H new ATOM 346 N PHE A 22 0.934 7.110 23.170 1.00 0.00 N ATOM 347 CA PHE A 22 1.706 6.333 24.150 1.00 0.00 C ATOM 348 C PHE A 22 2.362 7.273 25.173 1.00 0.00 C ATOM 349 O PHE A 22 2.289 7.032 26.379 1.00 0.00 O ATOM 350 CB PHE A 22 2.744 5.488 23.409 1.00 0.00 C ATOM 351 CG PHE A 22 3.598 4.582 24.271 1.00 0.00 C ATOM 352 CD1 PHE A 22 3.069 3.372 24.759 1.00 0.00 C ATOM 353 CD2 PHE A 22 4.937 4.922 24.545 1.00 0.00 C ATOM 354 CE1 PHE A 22 3.874 2.507 25.522 1.00 0.00 C ATOM 355 CE2 PHE A 22 5.741 4.057 25.306 1.00 0.00 C ATOM 356 CZ PHE A 22 5.210 2.850 25.795 1.00 0.00 C ATOM 0 H PHE A 22 1.309 7.065 22.223 1.00 0.00 H new ATOM 0 HA PHE A 22 1.046 5.664 24.702 1.00 0.00 H new ATOM 0 HB2 PHE A 22 2.225 4.874 22.673 1.00 0.00 H new ATOM 0 HB3 PHE A 22 3.403 6.159 22.857 1.00 0.00 H new ATOM 0 HD1 PHE A 22 2.044 3.108 24.547 1.00 0.00 H new ATOM 0 HD2 PHE A 22 5.346 5.848 24.170 1.00 0.00 H new ATOM 0 HE1 PHE A 22 3.466 1.580 25.898 1.00 0.00 H new ATOM 0 HE2 PHE A 22 6.768 4.319 25.516 1.00 0.00 H new ATOM 0 HZ PHE A 22 5.829 2.186 26.381 1.00 0.00 H new ATOM 366 N GLN A 23 2.935 8.392 24.705 1.00 0.00 N ATOM 367 CA GLN A 23 3.510 9.445 25.557 1.00 0.00 C ATOM 368 C GLN A 23 2.430 10.130 26.421 1.00 0.00 C ATOM 369 O GLN A 23 2.695 10.488 27.571 1.00 0.00 O ATOM 370 CB GLN A 23 4.251 10.465 24.678 1.00 0.00 C ATOM 371 CG GLN A 23 5.566 9.882 24.134 1.00 0.00 C ATOM 372 CD GLN A 23 6.136 10.723 22.996 1.00 0.00 C ATOM 373 OE1 GLN A 23 6.974 11.597 23.180 1.00 0.00 O ATOM 374 NE2 GLN A 23 5.700 10.486 21.779 1.00 0.00 N ATOM 0 H GLN A 23 3.013 8.594 23.708 1.00 0.00 H new ATOM 0 HA GLN A 23 4.220 8.988 26.247 1.00 0.00 H new ATOM 0 HB2 GLN A 23 3.612 10.764 23.847 1.00 0.00 H new ATOM 0 HB3 GLN A 23 4.461 11.363 25.258 1.00 0.00 H new ATOM 0 HG2 GLN A 23 6.297 9.821 24.941 1.00 0.00 H new ATOM 0 HG3 GLN A 23 5.394 8.865 23.782 1.00 0.00 H new ATOM 0 HE21 GLN A 23 5.002 9.759 21.620 1.00 0.00 H new ATOM 0 HE22 GLN A 23 6.060 11.029 20.994 1.00 0.00 H new ATOM 383 N ARG A 24 1.200 10.268 25.897 1.00 0.00 N ATOM 384 CA ARG A 24 0.024 10.803 26.618 1.00 0.00 C ATOM 385 C ARG A 24 -0.531 9.806 27.655 1.00 0.00 C ATOM 386 O ARG A 24 -1.290 10.193 28.544 1.00 0.00 O ATOM 387 CB ARG A 24 -1.063 11.171 25.587 1.00 0.00 C ATOM 388 CG ARG A 24 -2.098 12.182 26.114 1.00 0.00 C ATOM 389 CD ARG A 24 -3.294 12.353 25.164 1.00 0.00 C ATOM 390 NE ARG A 24 -2.899 12.729 23.795 1.00 0.00 N ATOM 391 CZ ARG A 24 -2.553 13.924 23.350 1.00 0.00 C ATOM 392 NH1 ARG A 24 -2.512 14.989 24.110 1.00 0.00 N ATOM 393 NH2 ARG A 24 -2.238 14.065 22.093 1.00 0.00 N ATOM 0 H ARG A 24 0.987 10.005 24.935 1.00 0.00 H new ATOM 0 HA ARG A 24 0.334 11.688 27.173 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -0.584 11.584 24.699 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -1.580 10.263 25.277 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -2.457 11.853 27.089 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -1.615 13.148 26.261 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -3.858 11.421 25.129 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -3.962 13.115 25.565 1.00 0.00 H new ATOM 0 HE ARG A 24 -2.892 11.975 23.108 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -2.755 14.920 25.098 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -2.238 15.888 23.714 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -2.261 13.259 21.468 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -1.969 14.981 21.734 1.00 0.00 H new ATOM 407 N GLY A 25 -0.165 8.526 27.545 1.00 0.00 N ATOM 408 CA GLY A 25 -0.630 7.437 28.409 1.00 0.00 C ATOM 409 C GLY A 25 -2.022 6.911 28.029 1.00 0.00 C ATOM 410 O GLY A 25 -2.753 6.437 28.902 1.00 0.00 O ATOM 0 H GLY A 25 0.486 8.208 26.827 1.00 0.00 H new ATOM 0 HA2 GLY A 25 0.086 6.616 28.364 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.650 7.785 29.442 1.00 0.00 H new ATOM 414 N THR A 26 -2.406 7.012 26.749 1.00 0.00 N ATOM 415 CA THR A 26 -3.727 6.607 26.226 1.00 0.00 C ATOM 416 C THR A 26 -3.685 5.487 25.173 1.00 0.00 C ATOM 417 O THR A 26 -4.692 4.791 25.013 1.00 0.00 O ATOM 418 CB THR A 26 -4.496 7.814 25.659 1.00 0.00 C ATOM 419 OG1 THR A 26 -3.736 8.477 24.672 1.00 0.00 O ATOM 420 CG2 THR A 26 -4.830 8.848 26.736 1.00 0.00 C ATOM 0 H THR A 26 -1.793 7.387 26.026 1.00 0.00 H new ATOM 0 HA THR A 26 -4.249 6.199 27.091 1.00 0.00 H new ATOM 0 HB THR A 26 -5.417 7.408 25.240 1.00 0.00 H new ATOM 0 HG1 THR A 26 -4.333 8.818 23.973 1.00 0.00 H new ATOM 0 HG21 THR A 26 -5.372 9.680 26.286 1.00 0.00 H new ATOM 0 HG22 THR A 26 -5.448 8.385 27.505 1.00 0.00 H new ATOM 0 HG23 THR A 26 -3.908 9.217 27.185 1.00 0.00 H new ATOM 428 N CYS A 27 -2.556 5.258 24.486 1.00 0.00 N ATOM 429 CA CYS A 27 -2.408 4.162 23.514 1.00 0.00 C ATOM 430 C CYS A 27 -2.349 2.795 24.237 1.00 0.00 C ATOM 431 O CYS A 27 -1.647 2.648 25.248 1.00 0.00 O ATOM 432 CB CYS A 27 -1.149 4.411 22.662 1.00 0.00 C ATOM 433 SG CYS A 27 -1.199 3.527 21.064 1.00 0.00 S ATOM 0 H CYS A 27 -1.717 5.829 24.588 1.00 0.00 H new ATOM 0 HA CYS A 27 -3.275 4.136 22.854 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -1.044 5.480 22.479 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -0.268 4.095 23.221 1.00 0.00 H new ATOM 438 N SER A 28 -3.089 1.796 23.742 1.00 0.00 N ATOM 439 CA SER A 28 -3.165 0.440 24.320 1.00 0.00 C ATOM 440 C SER A 28 -3.190 -0.668 23.251 1.00 0.00 C ATOM 441 O SER A 28 -4.119 -1.479 23.170 1.00 0.00 O ATOM 442 CB SER A 28 -4.352 0.356 25.297 1.00 0.00 C ATOM 443 OG SER A 28 -5.580 0.752 24.695 1.00 0.00 O ATOM 0 H SER A 28 -3.667 1.906 22.909 1.00 0.00 H new ATOM 0 HA SER A 28 -2.249 0.260 24.882 1.00 0.00 H new ATOM 0 HB2 SER A 28 -4.444 -0.666 25.665 1.00 0.00 H new ATOM 0 HB3 SER A 28 -4.153 0.990 26.161 1.00 0.00 H new ATOM 0 HG SER A 28 -6.304 0.681 25.352 1.00 0.00 H new ATOM 449 N ARG A 29 -2.135 -0.727 22.427 1.00 0.00 N ATOM 450 CA ARG A 29 -1.938 -1.705 21.336 1.00 0.00 C ATOM 451 C ARG A 29 -0.445 -2.015 21.112 1.00 0.00 C ATOM 452 O ARG A 29 0.397 -1.165 21.419 1.00 0.00 O ATOM 453 CB ARG A 29 -2.510 -1.121 20.021 1.00 0.00 C ATOM 454 CG ARG A 29 -4.042 -1.031 19.924 1.00 0.00 C ATOM 455 CD ARG A 29 -4.727 -2.403 20.011 1.00 0.00 C ATOM 456 NE ARG A 29 -6.183 -2.299 19.801 1.00 0.00 N ATOM 457 CZ ARG A 29 -7.090 -1.961 20.704 1.00 0.00 C ATOM 458 NH1 ARG A 29 -8.354 -1.924 20.375 1.00 0.00 N ATOM 459 NH2 ARG A 29 -6.792 -1.652 21.938 1.00 0.00 N ATOM 0 H ARG A 29 -1.360 -0.069 22.502 1.00 0.00 H new ATOM 0 HA ARG A 29 -2.450 -2.625 21.618 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -2.099 -0.121 19.884 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.150 -1.730 19.191 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -4.415 -0.393 20.725 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -4.314 -0.553 18.983 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -4.298 -3.072 19.265 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -4.531 -2.847 20.987 1.00 0.00 H new ATOM 0 HE ARG A 29 -6.526 -2.509 18.864 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -8.640 -2.155 19.424 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -9.054 -1.664 21.069 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -5.820 -1.664 22.246 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -7.532 -1.399 22.593 1.00 0.00 H new ATOM 473 N PRO A 30 -0.091 -3.190 20.553 1.00 0.00 N ATOM 474 CA PRO A 30 1.295 -3.510 20.207 1.00 0.00 C ATOM 475 C PRO A 30 1.758 -2.636 19.029 1.00 0.00 C ATOM 476 O PRO A 30 0.941 -2.126 18.259 1.00 0.00 O ATOM 477 CB PRO A 30 1.290 -4.998 19.846 1.00 0.00 C ATOM 478 CG PRO A 30 -0.120 -5.221 19.302 1.00 0.00 C ATOM 479 CD PRO A 30 -0.974 -4.280 20.155 1.00 0.00 C ATOM 0 HA PRO A 30 1.988 -3.312 21.025 1.00 0.00 H new ATOM 0 HB2 PRO A 30 2.051 -5.234 19.102 1.00 0.00 H new ATOM 0 HB3 PRO A 30 1.490 -5.624 20.716 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -0.186 -4.976 18.242 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -0.434 -6.259 19.410 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -1.827 -3.905 19.589 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -1.373 -4.798 21.027 1.00 0.00 H new ATOM 487 N ASP A 31 3.074 -2.470 18.867 1.00 0.00 N ATOM 488 CA ASP A 31 3.680 -1.645 17.805 1.00 0.00 C ATOM 489 C ASP A 31 3.184 -2.001 16.387 1.00 0.00 C ATOM 490 O ASP A 31 3.071 -1.133 15.522 1.00 0.00 O ATOM 491 CB ASP A 31 5.212 -1.776 17.833 1.00 0.00 C ATOM 492 CG ASP A 31 5.877 -1.415 19.164 1.00 0.00 C ATOM 493 OD1 ASP A 31 5.640 -2.142 20.156 1.00 0.00 O ATOM 494 OD2 ASP A 31 6.659 -0.436 19.174 1.00 0.00 O ATOM 0 H ASP A 31 3.763 -2.910 19.477 1.00 0.00 H new ATOM 0 HA ASP A 31 3.371 -0.621 18.016 1.00 0.00 H new ATOM 0 HB2 ASP A 31 5.477 -2.803 17.581 1.00 0.00 H new ATOM 0 HB3 ASP A 31 5.629 -1.138 17.053 1.00 0.00 H new ATOM 499 N THR A 32 2.867 -3.275 16.140 1.00 0.00 N ATOM 500 CA THR A 32 2.354 -3.786 14.857 1.00 0.00 C ATOM 501 C THR A 32 0.951 -3.289 14.495 1.00 0.00 C ATOM 502 O THR A 32 0.641 -3.131 13.314 1.00 0.00 O ATOM 503 CB THR A 32 2.290 -5.316 14.880 1.00 0.00 C ATOM 504 OG1 THR A 32 1.728 -5.777 16.094 1.00 0.00 O ATOM 505 CG2 THR A 32 3.673 -5.949 14.739 1.00 0.00 C ATOM 0 H THR A 32 2.962 -4.005 16.846 1.00 0.00 H new ATOM 0 HA THR A 32 3.054 -3.410 14.111 1.00 0.00 H new ATOM 0 HB THR A 32 1.669 -5.608 14.033 1.00 0.00 H new ATOM 0 HG1 THR A 32 1.694 -6.756 16.088 1.00 0.00 H new ATOM 0 HG21 THR A 32 3.580 -7.035 14.760 1.00 0.00 H new ATOM 0 HG22 THR A 32 4.119 -5.642 13.793 1.00 0.00 H new ATOM 0 HG23 THR A 32 4.308 -5.623 15.563 1.00 0.00 H new ATOM 513 N GLU A 33 0.107 -3.017 15.491 1.00 0.00 N ATOM 514 CA GLU A 33 -1.263 -2.501 15.327 1.00 0.00 C ATOM 515 C GLU A 33 -1.320 -0.960 15.406 1.00 0.00 C ATOM 516 O GLU A 33 -2.397 -0.370 15.278 1.00 0.00 O ATOM 517 CB GLU A 33 -2.197 -3.154 16.360 1.00 0.00 C ATOM 518 CG GLU A 33 -2.437 -4.641 16.067 1.00 0.00 C ATOM 519 CD GLU A 33 -3.510 -5.218 16.998 1.00 0.00 C ATOM 520 OE1 GLU A 33 -3.139 -5.795 18.047 1.00 0.00 O ATOM 521 OE2 GLU A 33 -4.713 -5.079 16.667 1.00 0.00 O ATOM 0 H GLU A 33 0.362 -3.153 16.469 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.606 -2.768 14.327 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.766 -3.047 17.356 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -3.152 -2.628 16.367 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -2.746 -4.766 15.029 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -1.506 -5.195 16.191 1.00 0.00 H new ATOM 528 N CYS A 34 -0.162 -0.320 15.605 1.00 0.00 N ATOM 529 CA CYS A 34 0.023 1.130 15.726 1.00 0.00 C ATOM 530 C CYS A 34 0.901 1.698 14.585 1.00 0.00 C ATOM 531 O CYS A 34 1.480 0.953 13.786 1.00 0.00 O ATOM 532 CB CYS A 34 0.549 1.442 17.140 1.00 0.00 C ATOM 533 SG CYS A 34 0.172 3.161 17.634 1.00 0.00 S ATOM 0 H CYS A 34 0.719 -0.828 15.691 1.00 0.00 H new ATOM 0 HA CYS A 34 -0.932 1.641 15.606 1.00 0.00 H new ATOM 0 HB2 CYS A 34 0.103 0.751 17.855 1.00 0.00 H new ATOM 0 HB3 CYS A 34 1.627 1.282 17.172 1.00 0.00 H new ATOM 538 N LYS A 35 0.968 3.029 14.480 1.00 0.00 N ATOM 539 CA LYS A 35 1.700 3.774 13.433 1.00 0.00 C ATOM 540 C LYS A 35 3.078 4.308 13.864 1.00 0.00 C ATOM 541 O LYS A 35 3.806 4.851 13.033 1.00 0.00 O ATOM 542 CB LYS A 35 0.801 4.898 12.881 1.00 0.00 C ATOM 543 CG LYS A 35 0.504 6.005 13.907 1.00 0.00 C ATOM 544 CD LYS A 35 -0.392 7.096 13.300 1.00 0.00 C ATOM 545 CE LYS A 35 -0.625 8.254 14.278 1.00 0.00 C ATOM 546 NZ LYS A 35 -1.410 7.835 15.459 1.00 0.00 N ATOM 0 H LYS A 35 0.499 3.646 15.143 1.00 0.00 H new ATOM 0 HA LYS A 35 1.929 3.057 12.644 1.00 0.00 H new ATOM 0 HB2 LYS A 35 1.281 5.341 12.009 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -0.140 4.466 12.542 1.00 0.00 H new ATOM 0 HG2 LYS A 35 0.016 5.574 14.781 1.00 0.00 H new ATOM 0 HG3 LYS A 35 1.439 6.447 14.250 1.00 0.00 H new ATOM 0 HD2 LYS A 35 0.068 7.478 12.388 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -1.351 6.662 13.016 1.00 0.00 H new ATOM 0 HE2 LYS A 35 0.336 8.651 14.604 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -1.146 9.062 13.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -1.602 8.662 16.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -2.310 7.417 15.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -0.871 7.131 16.002 1.00 0.00 H new ATOM 560 N PHE A 36 3.434 4.151 15.138 1.00 0.00 N ATOM 561 CA PHE A 36 4.683 4.614 15.757 1.00 0.00 C ATOM 562 C PHE A 36 5.229 3.589 16.782 1.00 0.00 C ATOM 563 O PHE A 36 4.657 2.510 16.968 1.00 0.00 O ATOM 564 CB PHE A 36 4.433 5.989 16.401 1.00 0.00 C ATOM 565 CG PHE A 36 4.243 7.180 15.474 1.00 0.00 C ATOM 566 CD1 PHE A 36 5.182 7.457 14.460 1.00 0.00 C ATOM 567 CD2 PHE A 36 3.172 8.071 15.685 1.00 0.00 C ATOM 568 CE1 PHE A 36 5.036 8.597 13.649 1.00 0.00 C ATOM 569 CE2 PHE A 36 3.033 9.220 14.884 1.00 0.00 C ATOM 570 CZ PHE A 36 3.962 9.480 13.862 1.00 0.00 C ATOM 0 H PHE A 36 2.829 3.672 15.805 1.00 0.00 H new ATOM 0 HA PHE A 36 5.452 4.711 14.990 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.546 5.909 17.030 1.00 0.00 H new ATOM 0 HB3 PHE A 36 5.273 6.208 17.061 1.00 0.00 H new ATOM 0 HD1 PHE A 36 6.018 6.791 14.305 1.00 0.00 H new ATOM 0 HD2 PHE A 36 2.453 7.871 16.466 1.00 0.00 H new ATOM 0 HE1 PHE A 36 5.749 8.794 12.862 1.00 0.00 H new ATOM 0 HE2 PHE A 36 2.213 9.902 15.055 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.851 10.357 13.241 1.00 0.00 H new ATOM 580 N ALA A 37 6.365 3.895 17.419 1.00 0.00 N ATOM 581 CA ALA A 37 7.060 3.004 18.353 1.00 0.00 C ATOM 582 C ALA A 37 6.612 3.155 19.826 1.00 0.00 C ATOM 583 O ALA A 37 6.252 4.245 20.277 1.00 0.00 O ATOM 584 CB ALA A 37 8.557 3.311 18.222 1.00 0.00 C ATOM 0 H ALA A 37 6.837 4.791 17.296 1.00 0.00 H new ATOM 0 HA ALA A 37 6.818 1.974 18.092 1.00 0.00 H new ATOM 0 HB1 ALA A 37 9.121 2.670 18.900 1.00 0.00 H new ATOM 0 HB2 ALA A 37 8.878 3.125 17.197 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.738 4.356 18.475 1.00 0.00 H new ATOM 590 N HIS A 38 6.658 2.047 20.576 1.00 0.00 N ATOM 591 CA HIS A 38 6.291 1.912 21.996 1.00 0.00 C ATOM 592 C HIS A 38 7.483 1.425 22.868 1.00 0.00 C ATOM 593 O HIS A 38 7.504 0.264 23.296 1.00 0.00 O ATOM 594 CB HIS A 38 5.054 0.995 22.108 1.00 0.00 C ATOM 595 CG HIS A 38 3.816 1.483 21.389 1.00 0.00 C ATOM 596 ND1 HIS A 38 2.797 0.698 20.896 1.00 0.00 N ATOM 597 CD2 HIS A 38 3.452 2.784 21.163 1.00 0.00 C ATOM 598 CE1 HIS A 38 1.851 1.508 20.387 1.00 0.00 C ATOM 599 NE2 HIS A 38 2.204 2.796 20.525 1.00 0.00 N ATOM 0 H HIS A 38 6.973 1.160 20.183 1.00 0.00 H new ATOM 0 HA HIS A 38 6.033 2.893 22.394 1.00 0.00 H new ATOM 0 HB2 HIS A 38 5.316 0.011 21.718 1.00 0.00 H new ATOM 0 HB3 HIS A 38 4.813 0.866 23.163 1.00 0.00 H new ATOM 0 HD1 HIS A 38 2.765 -0.321 20.914 1.00 0.00 H new ATOM 0 HD2 HIS A 38 4.030 3.656 21.432 1.00 0.00 H new ATOM 0 HE1 HIS A 38 0.933 1.169 19.930 1.00 0.00 H new ATOM 607 N PRO A 39 8.509 2.265 23.118 1.00 0.00 N ATOM 608 CA PRO A 39 9.709 1.913 23.893 1.00 0.00 C ATOM 609 C PRO A 39 9.487 1.803 25.410 1.00 0.00 C ATOM 610 O PRO A 39 8.497 2.293 25.959 1.00 0.00 O ATOM 611 CB PRO A 39 10.714 3.021 23.595 1.00 0.00 C ATOM 612 CG PRO A 39 9.816 4.238 23.391 1.00 0.00 C ATOM 613 CD PRO A 39 8.609 3.647 22.668 1.00 0.00 C ATOM 0 HA PRO A 39 10.044 0.918 23.598 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.413 3.166 24.418 1.00 0.00 H new ATOM 0 HB3 PRO A 39 11.308 2.802 22.708 1.00 0.00 H new ATOM 0 HG2 PRO A 39 9.535 4.697 24.339 1.00 0.00 H new ATOM 0 HG3 PRO A 39 10.307 5.008 22.796 1.00 0.00 H new ATOM 0 HD2 PRO A 39 7.701 4.202 22.906 1.00 0.00 H new ATOM 0 HD3 PRO A 39 8.739 3.697 21.587 1.00 0.00 H new ATOM 621 N SER A 40 10.455 1.195 26.101 1.00 0.00 N ATOM 622 CA SER A 40 10.492 1.058 27.561 1.00 0.00 C ATOM 623 C SER A 40 11.347 2.162 28.199 1.00 0.00 C ATOM 624 O SER A 40 12.091 2.878 27.518 1.00 0.00 O ATOM 625 CB SER A 40 11.061 -0.318 27.938 1.00 0.00 C ATOM 626 OG SER A 40 12.460 -0.368 27.692 1.00 0.00 O ATOM 0 H SER A 40 11.262 0.770 25.645 1.00 0.00 H new ATOM 0 HA SER A 40 9.474 1.152 27.938 1.00 0.00 H new ATOM 0 HB2 SER A 40 10.864 -0.522 28.990 1.00 0.00 H new ATOM 0 HB3 SER A 40 10.558 -1.095 27.363 1.00 0.00 H new ATOM 0 HG SER A 40 12.642 -0.073 26.775 1.00 0.00 H new ATOM 632 N LYS A 41 11.287 2.274 29.531 1.00 0.00 N ATOM 633 CA LYS A 41 12.086 3.232 30.324 1.00 0.00 C ATOM 634 C LYS A 41 13.609 3.050 30.185 1.00 0.00 C ATOM 635 O LYS A 41 14.368 3.978 30.467 1.00 0.00 O ATOM 636 CB LYS A 41 11.642 3.194 31.799 1.00 0.00 C ATOM 637 CG LYS A 41 11.973 1.874 32.520 1.00 0.00 C ATOM 638 CD LYS A 41 11.473 1.899 33.973 1.00 0.00 C ATOM 639 CE LYS A 41 11.871 0.633 34.743 1.00 0.00 C ATOM 640 NZ LYS A 41 11.188 -0.572 34.222 1.00 0.00 N ATOM 0 H LYS A 41 10.673 1.694 30.103 1.00 0.00 H new ATOM 0 HA LYS A 41 11.886 4.221 29.911 1.00 0.00 H new ATOM 0 HB2 LYS A 41 12.119 4.017 32.332 1.00 0.00 H new ATOM 0 HB3 LYS A 41 10.566 3.363 31.848 1.00 0.00 H new ATOM 0 HG2 LYS A 41 11.514 1.040 31.988 1.00 0.00 H new ATOM 0 HG3 LYS A 41 13.050 1.708 32.505 1.00 0.00 H new ATOM 0 HD2 LYS A 41 11.879 2.774 34.481 1.00 0.00 H new ATOM 0 HD3 LYS A 41 10.388 2.001 33.981 1.00 0.00 H new ATOM 0 HE2 LYS A 41 12.950 0.494 34.679 1.00 0.00 H new ATOM 0 HE3 LYS A 41 11.628 0.759 35.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 11.459 -1.399 34.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 10.158 -0.438 34.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 11.466 -0.728 33.232 1.00 0.00 H new ATOM 654 N SER A 42 14.049 1.865 29.753 1.00 0.00 N ATOM 655 CA SER A 42 15.460 1.495 29.561 1.00 0.00 C ATOM 656 C SER A 42 15.991 1.762 28.141 1.00 0.00 C ATOM 657 O SER A 42 17.203 1.702 27.923 1.00 0.00 O ATOM 658 CB SER A 42 15.653 0.008 29.889 1.00 0.00 C ATOM 659 OG SER A 42 15.221 -0.273 31.214 1.00 0.00 O ATOM 0 H SER A 42 13.410 1.106 29.517 1.00 0.00 H new ATOM 0 HA SER A 42 16.031 2.131 30.237 1.00 0.00 H new ATOM 0 HB2 SER A 42 15.092 -0.602 29.181 1.00 0.00 H new ATOM 0 HB3 SER A 42 16.704 -0.261 29.779 1.00 0.00 H new ATOM 0 HG SER A 42 15.350 -1.226 31.405 1.00 0.00 H new ATOM 665 N CYS A 43 15.117 2.052 27.169 1.00 0.00 N ATOM 666 CA CYS A 43 15.510 2.324 25.781 1.00 0.00 C ATOM 667 C CYS A 43 16.188 3.702 25.601 1.00 0.00 C ATOM 668 O CYS A 43 16.052 4.596 26.438 1.00 0.00 O ATOM 669 CB CYS A 43 14.260 2.226 24.891 1.00 0.00 C ATOM 670 SG CYS A 43 13.665 0.513 24.786 1.00 0.00 S ATOM 0 H CYS A 43 14.110 2.105 27.325 1.00 0.00 H new ATOM 0 HA CYS A 43 16.253 1.581 25.491 1.00 0.00 H new ATOM 0 HB2 CYS A 43 13.473 2.864 25.293 1.00 0.00 H new ATOM 0 HB3 CYS A 43 14.491 2.596 23.892 1.00 0.00 H new ATOM 0 HG CYS A 43 12.609 0.466 24.030 1.00 0.00 H new ATOM 676 N GLN A 44 16.880 3.897 24.471 1.00 0.00 N ATOM 677 CA GLN A 44 17.544 5.152 24.054 1.00 0.00 C ATOM 678 C GLN A 44 16.537 6.238 23.593 1.00 0.00 C ATOM 679 O GLN A 44 16.694 6.844 22.531 1.00 0.00 O ATOM 680 CB GLN A 44 18.578 4.835 22.950 1.00 0.00 C ATOM 681 CG GLN A 44 19.762 3.986 23.431 1.00 0.00 C ATOM 682 CD GLN A 44 20.753 4.781 24.273 1.00 0.00 C ATOM 683 OE1 GLN A 44 21.634 5.452 23.760 1.00 0.00 O ATOM 684 NE2 GLN A 44 20.666 4.732 25.586 1.00 0.00 N ATOM 0 H GLN A 44 17.002 3.152 23.785 1.00 0.00 H new ATOM 0 HA GLN A 44 18.054 5.572 24.921 1.00 0.00 H new ATOM 0 HB2 GLN A 44 18.076 4.312 22.136 1.00 0.00 H new ATOM 0 HB3 GLN A 44 18.958 5.772 22.542 1.00 0.00 H new ATOM 0 HG2 GLN A 44 19.387 3.146 24.015 1.00 0.00 H new ATOM 0 HG3 GLN A 44 20.279 3.568 22.567 1.00 0.00 H new ATOM 0 HE21 GLN A 44 19.935 4.175 26.028 1.00 0.00 H new ATOM 0 HE22 GLN A 44 21.330 5.251 26.161 1.00 0.00 H new ATOM 693 N VAL A 45 15.462 6.456 24.357 1.00 0.00 N ATOM 694 CA VAL A 45 14.391 7.419 24.049 1.00 0.00 C ATOM 695 C VAL A 45 14.878 8.862 24.247 1.00 0.00 C ATOM 696 O VAL A 45 15.332 9.228 25.333 1.00 0.00 O ATOM 697 CB VAL A 45 13.129 7.166 24.906 1.00 0.00 C ATOM 698 CG1 VAL A 45 11.937 7.932 24.318 1.00 0.00 C ATOM 699 CG2 VAL A 45 12.747 5.680 24.978 1.00 0.00 C ATOM 0 H VAL A 45 15.305 5.955 25.232 1.00 0.00 H new ATOM 0 HA VAL A 45 14.123 7.276 23.002 1.00 0.00 H new ATOM 0 HB VAL A 45 13.366 7.510 25.913 1.00 0.00 H new ATOM 0 HG11 VAL A 45 11.051 7.749 24.926 1.00 0.00 H new ATOM 0 HG12 VAL A 45 12.158 8.999 24.310 1.00 0.00 H new ATOM 0 HG13 VAL A 45 11.753 7.592 23.299 1.00 0.00 H new ATOM 0 HG21 VAL A 45 11.854 5.563 25.592 1.00 0.00 H new ATOM 0 HG22 VAL A 45 12.548 5.307 23.974 1.00 0.00 H new ATOM 0 HG23 VAL A 45 13.568 5.114 25.419 1.00 0.00 H new ATOM 709 N GLU A 46 14.778 9.692 23.207 1.00 0.00 N ATOM 710 CA GLU A 46 15.177 11.108 23.212 1.00 0.00 C ATOM 711 C GLU A 46 14.397 11.921 22.161 1.00 0.00 C ATOM 712 O GLU A 46 14.168 11.451 21.047 1.00 0.00 O ATOM 713 CB GLU A 46 16.700 11.232 22.990 1.00 0.00 C ATOM 714 CG GLU A 46 17.223 10.652 21.664 1.00 0.00 C ATOM 715 CD GLU A 46 18.754 10.702 21.614 1.00 0.00 C ATOM 716 OE1 GLU A 46 19.296 11.779 21.265 1.00 0.00 O ATOM 717 OE2 GLU A 46 19.392 9.669 21.932 1.00 0.00 O ATOM 0 H GLU A 46 14.405 9.391 22.307 1.00 0.00 H new ATOM 0 HA GLU A 46 14.931 11.525 24.188 1.00 0.00 H new ATOM 0 HB2 GLU A 46 16.972 12.286 23.038 1.00 0.00 H new ATOM 0 HB3 GLU A 46 17.212 10.732 23.813 1.00 0.00 H new ATOM 0 HG2 GLU A 46 16.885 9.622 21.554 1.00 0.00 H new ATOM 0 HG3 GLU A 46 16.809 11.215 20.827 1.00 0.00 H new ATOM 724 N ASN A 47 13.985 13.151 22.502 1.00 0.00 N ATOM 725 CA ASN A 47 13.232 14.081 21.638 1.00 0.00 C ATOM 726 C ASN A 47 12.051 13.445 20.848 1.00 0.00 C ATOM 727 O ASN A 47 11.786 13.802 19.698 1.00 0.00 O ATOM 728 CB ASN A 47 14.248 14.838 20.756 1.00 0.00 C ATOM 729 CG ASN A 47 13.661 16.067 20.071 1.00 0.00 C ATOM 730 OD1 ASN A 47 12.840 16.791 20.621 1.00 0.00 O ATOM 731 ND2 ASN A 47 14.074 16.359 18.857 1.00 0.00 N ATOM 0 H ASN A 47 14.173 13.544 23.424 1.00 0.00 H new ATOM 0 HA ASN A 47 12.703 14.789 22.275 1.00 0.00 H new ATOM 0 HB2 ASN A 47 15.094 15.144 21.371 1.00 0.00 H new ATOM 0 HB3 ASN A 47 14.635 14.159 19.997 1.00 0.00 H new ATOM 0 HD21 ASN A 47 13.711 17.184 18.379 1.00 0.00 H new ATOM 0 HD22 ASN A 47 14.757 15.761 18.393 1.00 0.00 H new ATOM 738 N GLY A 48 11.349 12.474 21.449 1.00 0.00 N ATOM 739 CA GLY A 48 10.220 11.760 20.828 1.00 0.00 C ATOM 740 C GLY A 48 10.614 10.663 19.825 1.00 0.00 C ATOM 741 O GLY A 48 9.767 10.206 19.058 1.00 0.00 O ATOM 0 H GLY A 48 11.552 12.156 22.397 1.00 0.00 H new ATOM 0 HA2 GLY A 48 9.617 11.310 21.617 1.00 0.00 H new ATOM 0 HA3 GLY A 48 9.587 12.486 20.318 1.00 0.00 H new ATOM 745 N ARG A 49 11.884 10.241 19.805 1.00 0.00 N ATOM 746 CA ARG A 49 12.464 9.210 18.921 1.00 0.00 C ATOM 747 C ARG A 49 13.286 8.200 19.732 1.00 0.00 C ATOM 748 O ARG A 49 13.631 8.449 20.885 1.00 0.00 O ATOM 749 CB ARG A 49 13.365 9.864 17.844 1.00 0.00 C ATOM 750 CG ARG A 49 12.628 10.529 16.669 1.00 0.00 C ATOM 751 CD ARG A 49 12.169 11.961 16.961 1.00 0.00 C ATOM 752 NE ARG A 49 11.227 12.444 15.937 1.00 0.00 N ATOM 753 CZ ARG A 49 10.330 13.404 16.099 1.00 0.00 C ATOM 754 NH1 ARG A 49 9.504 13.697 15.132 1.00 0.00 N ATOM 755 NH2 ARG A 49 10.216 14.095 17.203 1.00 0.00 N ATOM 0 H ARG A 49 12.580 10.630 20.441 1.00 0.00 H new ATOM 0 HA ARG A 49 11.643 8.686 18.432 1.00 0.00 H new ATOM 0 HB2 ARG A 49 13.991 10.614 18.327 1.00 0.00 H new ATOM 0 HB3 ARG A 49 14.033 9.101 17.444 1.00 0.00 H new ATOM 0 HG2 ARG A 49 13.284 10.538 15.798 1.00 0.00 H new ATOM 0 HG3 ARG A 49 11.759 9.925 16.408 1.00 0.00 H new ATOM 0 HD2 ARG A 49 11.694 11.999 17.941 1.00 0.00 H new ATOM 0 HD3 ARG A 49 13.035 12.621 17.001 1.00 0.00 H new ATOM 0 HE ARG A 49 11.270 11.999 15.020 1.00 0.00 H new ATOM 0 HH11 ARG A 49 9.549 13.186 14.250 1.00 0.00 H new ATOM 0 HH12 ARG A 49 8.813 14.437 15.258 1.00 0.00 H new ATOM 0 HH21 ARG A 49 10.836 13.904 17.990 1.00 0.00 H new ATOM 0 HH22 ARG A 49 9.507 14.825 17.277 1.00 0.00 H new ATOM 769 N VAL A 50 13.632 7.071 19.113 1.00 0.00 N ATOM 770 CA VAL A 50 14.503 6.034 19.694 1.00 0.00 C ATOM 771 C VAL A 50 15.413 5.516 18.594 1.00 0.00 C ATOM 772 O VAL A 50 14.949 5.283 17.477 1.00 0.00 O ATOM 773 CB VAL A 50 13.746 4.796 20.220 1.00 0.00 C ATOM 774 CG1 VAL A 50 14.613 4.023 21.226 1.00 0.00 C ATOM 775 CG2 VAL A 50 12.403 5.084 20.866 1.00 0.00 C ATOM 0 H VAL A 50 13.310 6.841 18.173 1.00 0.00 H new ATOM 0 HA VAL A 50 15.021 6.506 20.529 1.00 0.00 H new ATOM 0 HB VAL A 50 13.541 4.206 19.327 1.00 0.00 H new ATOM 0 HG11 VAL A 50 14.064 3.153 21.587 1.00 0.00 H new ATOM 0 HG12 VAL A 50 15.531 3.696 20.739 1.00 0.00 H new ATOM 0 HG13 VAL A 50 14.860 4.671 22.067 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.953 4.150 21.202 1.00 0.00 H new ATOM 0 HG22 VAL A 50 12.545 5.746 21.720 1.00 0.00 H new ATOM 0 HG23 VAL A 50 11.746 5.563 20.141 1.00 0.00 H new ATOM 785 N ILE A 51 16.685 5.286 18.905 1.00 0.00 N ATOM 786 CA ILE A 51 17.625 4.662 17.968 1.00 0.00 C ATOM 787 C ILE A 51 17.248 3.170 17.876 1.00 0.00 C ATOM 788 O ILE A 51 17.150 2.490 18.902 1.00 0.00 O ATOM 789 CB ILE A 51 19.079 4.888 18.439 1.00 0.00 C ATOM 790 CG1 ILE A 51 19.404 6.399 18.527 1.00 0.00 C ATOM 791 CG2 ILE A 51 20.040 4.193 17.465 1.00 0.00 C ATOM 792 CD1 ILE A 51 20.792 6.718 19.093 1.00 0.00 C ATOM 0 H ILE A 51 17.096 5.524 19.808 1.00 0.00 H new ATOM 0 HA ILE A 51 17.563 5.107 16.975 1.00 0.00 H new ATOM 0 HB ILE A 51 19.198 4.462 19.435 1.00 0.00 H new ATOM 0 HG12 ILE A 51 19.323 6.834 17.531 1.00 0.00 H new ATOM 0 HG13 ILE A 51 18.652 6.884 19.149 1.00 0.00 H new ATOM 0 HG21 ILE A 51 21.067 4.350 17.793 1.00 0.00 H new ATOM 0 HG22 ILE A 51 19.825 3.125 17.442 1.00 0.00 H new ATOM 0 HG23 ILE A 51 19.911 4.610 16.466 1.00 0.00 H new ATOM 0 HD11 ILE A 51 20.935 7.798 19.119 1.00 0.00 H new ATOM 0 HD12 ILE A 51 20.874 6.317 20.103 1.00 0.00 H new ATOM 0 HD13 ILE A 51 21.556 6.266 18.460 1.00 0.00 H new ATOM 804 N ALA A 52 17.004 2.660 16.667 1.00 0.00 N ATOM 805 CA ALA A 52 16.630 1.264 16.439 1.00 0.00 C ATOM 806 C ALA A 52 17.860 0.348 16.260 1.00 0.00 C ATOM 807 O ALA A 52 18.920 0.789 15.803 1.00 0.00 O ATOM 808 CB ALA A 52 15.686 1.203 15.234 1.00 0.00 C ATOM 0 H ALA A 52 17.061 3.211 15.810 1.00 0.00 H new ATOM 0 HA ALA A 52 16.115 0.885 17.321 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.397 0.168 15.050 1.00 0.00 H new ATOM 0 HB2 ALA A 52 14.796 1.797 15.439 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.193 1.600 14.354 1.00 0.00 H new ATOM 814 N CYS A 53 17.707 -0.925 16.635 1.00 0.00 N ATOM 815 CA CYS A 53 18.743 -1.960 16.588 1.00 0.00 C ATOM 816 C CYS A 53 19.082 -2.352 15.132 1.00 0.00 C ATOM 817 O CYS A 53 18.260 -2.967 14.449 1.00 0.00 O ATOM 818 CB CYS A 53 18.217 -3.142 17.429 1.00 0.00 C ATOM 819 SG CYS A 53 19.442 -4.465 17.720 1.00 0.00 S ATOM 0 H CYS A 53 16.820 -1.277 16.995 1.00 0.00 H new ATOM 0 HA CYS A 53 19.686 -1.604 17.003 1.00 0.00 H new ATOM 0 HB2 CYS A 53 17.874 -2.763 18.392 1.00 0.00 H new ATOM 0 HB3 CYS A 53 17.349 -3.571 16.928 1.00 0.00 H new ATOM 824 N PHE A 54 20.277 -2.003 14.640 1.00 0.00 N ATOM 825 CA PHE A 54 20.776 -2.321 13.291 1.00 0.00 C ATOM 826 C PHE A 54 20.647 -3.817 13.003 1.00 0.00 C ATOM 827 O PHE A 54 20.165 -4.224 11.946 1.00 0.00 O ATOM 828 CB PHE A 54 22.258 -1.911 13.171 1.00 0.00 C ATOM 829 CG PHE A 54 22.889 -1.956 11.791 1.00 0.00 C ATOM 830 CD1 PHE A 54 23.365 -0.762 11.226 1.00 0.00 C ATOM 831 CD2 PHE A 54 23.098 -3.173 11.109 1.00 0.00 C ATOM 832 CE1 PHE A 54 23.957 -0.767 9.951 1.00 0.00 C ATOM 833 CE2 PHE A 54 23.705 -3.181 9.841 1.00 0.00 C ATOM 834 CZ PHE A 54 24.118 -1.975 9.252 1.00 0.00 C ATOM 0 H PHE A 54 20.951 -1.471 15.190 1.00 0.00 H new ATOM 0 HA PHE A 54 20.177 -1.768 12.568 1.00 0.00 H new ATOM 0 HB2 PHE A 54 22.358 -0.895 13.553 1.00 0.00 H new ATOM 0 HB3 PHE A 54 22.840 -2.557 13.828 1.00 0.00 H new ATOM 0 HD1 PHE A 54 23.276 0.165 11.774 1.00 0.00 H new ATOM 0 HD2 PHE A 54 22.790 -4.103 11.563 1.00 0.00 H new ATOM 0 HE1 PHE A 54 24.289 0.160 9.508 1.00 0.00 H new ATOM 0 HE2 PHE A 54 23.854 -4.115 9.320 1.00 0.00 H new ATOM 0 HZ PHE A 54 24.558 -1.976 8.266 1.00 0.00 H new ATOM 844 N ASP A 55 21.078 -4.646 13.952 1.00 0.00 N ATOM 845 CA ASP A 55 21.027 -6.098 13.810 1.00 0.00 C ATOM 846 C ASP A 55 19.575 -6.617 13.684 1.00 0.00 C ATOM 847 O ASP A 55 19.289 -7.449 12.815 1.00 0.00 O ATOM 848 CB ASP A 55 21.837 -6.721 14.950 1.00 0.00 C ATOM 849 CG ASP A 55 23.311 -6.296 14.887 1.00 0.00 C ATOM 850 OD1 ASP A 55 23.800 -5.712 15.882 1.00 0.00 O ATOM 851 OD2 ASP A 55 23.954 -6.559 13.843 1.00 0.00 O ATOM 0 H ASP A 55 21.471 -4.330 14.839 1.00 0.00 H new ATOM 0 HA ASP A 55 21.489 -6.409 12.873 1.00 0.00 H new ATOM 0 HB2 ASP A 55 21.411 -6.421 15.907 1.00 0.00 H new ATOM 0 HB3 ASP A 55 21.767 -7.807 14.896 1.00 0.00 H new ATOM 856 N SER A 56 18.625 -6.075 14.457 1.00 0.00 N ATOM 857 CA SER A 56 17.195 -6.405 14.334 1.00 0.00 C ATOM 858 C SER A 56 16.587 -5.859 13.032 1.00 0.00 C ATOM 859 O SER A 56 15.818 -6.557 12.371 1.00 0.00 O ATOM 860 CB SER A 56 16.419 -5.861 15.532 1.00 0.00 C ATOM 861 OG SER A 56 15.077 -6.321 15.506 1.00 0.00 O ATOM 0 H SER A 56 18.825 -5.393 15.188 1.00 0.00 H new ATOM 0 HA SER A 56 17.117 -7.492 14.310 1.00 0.00 H new ATOM 0 HB2 SER A 56 16.900 -6.177 16.458 1.00 0.00 H new ATOM 0 HB3 SER A 56 16.436 -4.771 15.519 1.00 0.00 H new ATOM 0 HG SER A 56 14.779 -6.512 16.420 1.00 0.00 H new ATOM 867 N LEU A 57 16.968 -4.646 12.605 1.00 0.00 N ATOM 868 CA LEU A 57 16.535 -4.014 11.349 1.00 0.00 C ATOM 869 C LEU A 57 16.879 -4.863 10.109 1.00 0.00 C ATOM 870 O LEU A 57 16.182 -4.780 9.096 1.00 0.00 O ATOM 871 CB LEU A 57 17.159 -2.609 11.228 1.00 0.00 C ATOM 872 CG LEU A 57 16.544 -1.521 12.126 1.00 0.00 C ATOM 873 CD1 LEU A 57 17.484 -0.314 12.147 1.00 0.00 C ATOM 874 CD2 LEU A 57 15.175 -1.082 11.611 1.00 0.00 C ATOM 0 H LEU A 57 17.607 -4.059 13.141 1.00 0.00 H new ATOM 0 HA LEU A 57 15.449 -3.932 11.383 1.00 0.00 H new ATOM 0 HB2 LEU A 57 18.222 -2.684 11.457 1.00 0.00 H new ATOM 0 HB3 LEU A 57 17.078 -2.285 10.190 1.00 0.00 H new ATOM 0 HG LEU A 57 16.414 -1.929 13.128 1.00 0.00 H new ATOM 0 HD11 LEU A 57 17.061 0.466 12.780 1.00 0.00 H new ATOM 0 HD12 LEU A 57 18.454 -0.615 12.542 1.00 0.00 H new ATOM 0 HD13 LEU A 57 17.608 0.069 11.134 1.00 0.00 H new ATOM 0 HD21 LEU A 57 14.769 -0.313 12.268 1.00 0.00 H new ATOM 0 HD22 LEU A 57 15.277 -0.681 10.603 1.00 0.00 H new ATOM 0 HD23 LEU A 57 14.501 -1.938 11.594 1.00 0.00 H new ATOM 886 N LYS A 58 17.920 -5.704 10.200 1.00 0.00 N ATOM 887 CA LYS A 58 18.363 -6.657 9.162 1.00 0.00 C ATOM 888 C LYS A 58 17.834 -8.089 9.396 1.00 0.00 C ATOM 889 O LYS A 58 18.115 -8.988 8.602 1.00 0.00 O ATOM 890 CB LYS A 58 19.901 -6.583 9.027 1.00 0.00 C ATOM 891 CG LYS A 58 20.368 -5.760 7.809 1.00 0.00 C ATOM 892 CD LYS A 58 19.855 -4.312 7.707 1.00 0.00 C ATOM 893 CE LYS A 58 20.271 -3.460 8.907 1.00 0.00 C ATOM 894 NZ LYS A 58 19.872 -2.047 8.735 1.00 0.00 N ATOM 0 H LYS A 58 18.505 -5.743 11.035 1.00 0.00 H new ATOM 0 HA LYS A 58 17.924 -6.366 8.208 1.00 0.00 H new ATOM 0 HB2 LYS A 58 20.318 -6.145 9.934 1.00 0.00 H new ATOM 0 HB3 LYS A 58 20.301 -7.594 8.948 1.00 0.00 H new ATOM 0 HG2 LYS A 58 21.458 -5.734 7.815 1.00 0.00 H new ATOM 0 HG3 LYS A 58 20.067 -6.291 6.906 1.00 0.00 H new ATOM 0 HD2 LYS A 58 20.237 -3.858 6.793 1.00 0.00 H new ATOM 0 HD3 LYS A 58 18.768 -4.319 7.629 1.00 0.00 H new ATOM 0 HE2 LYS A 58 19.816 -3.860 9.813 1.00 0.00 H new ATOM 0 HE3 LYS A 58 21.351 -3.520 9.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 20.170 -1.498 9.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 20.326 -1.659 7.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 18.839 -1.988 8.633 1.00 0.00 H new ATOM 908 N GLY A 59 17.030 -8.298 10.444 1.00 0.00 N ATOM 909 CA GLY A 59 16.339 -9.551 10.774 1.00 0.00 C ATOM 910 C GLY A 59 17.070 -10.551 11.673 1.00 0.00 C ATOM 911 O GLY A 59 16.577 -11.671 11.832 1.00 0.00 O ATOM 0 H GLY A 59 16.833 -7.560 11.120 1.00 0.00 H new ATOM 0 HA2 GLY A 59 15.394 -9.297 11.254 1.00 0.00 H new ATOM 0 HA3 GLY A 59 16.096 -10.056 9.839 1.00 0.00 H new ATOM 915 N ARG A 60 18.212 -10.186 12.275 1.00 0.00 N ATOM 916 CA ARG A 60 18.967 -11.070 13.181 1.00 0.00 C ATOM 917 C ARG A 60 19.813 -10.279 14.183 1.00 0.00 C ATOM 918 O ARG A 60 20.956 -9.926 13.893 1.00 0.00 O ATOM 919 CB ARG A 60 19.820 -12.065 12.365 1.00 0.00 C ATOM 920 CG ARG A 60 20.412 -13.190 13.235 1.00 0.00 C ATOM 921 CD ARG A 60 19.370 -14.125 13.876 1.00 0.00 C ATOM 922 NE ARG A 60 18.438 -14.702 12.886 1.00 0.00 N ATOM 923 CZ ARG A 60 18.615 -15.801 12.171 1.00 0.00 C ATOM 924 NH1 ARG A 60 19.684 -16.550 12.267 1.00 0.00 N ATOM 925 NH2 ARG A 60 17.701 -16.180 11.320 1.00 0.00 N ATOM 0 H ARG A 60 18.640 -9.269 12.148 1.00 0.00 H new ATOM 0 HA ARG A 60 18.251 -11.640 13.772 1.00 0.00 H new ATOM 0 HB2 ARG A 60 19.206 -12.504 11.578 1.00 0.00 H new ATOM 0 HB3 ARG A 60 20.630 -11.526 11.874 1.00 0.00 H new ATOM 0 HG2 ARG A 60 21.087 -13.787 12.622 1.00 0.00 H new ATOM 0 HG3 ARG A 60 21.012 -12.741 14.026 1.00 0.00 H new ATOM 0 HD2 ARG A 60 19.884 -14.932 14.398 1.00 0.00 H new ATOM 0 HD3 ARG A 60 18.802 -13.572 14.624 1.00 0.00 H new ATOM 0 HE ARG A 60 17.563 -14.199 12.738 1.00 0.00 H new ATOM 0 HH11 ARG A 60 20.429 -16.295 12.916 1.00 0.00 H new ATOM 0 HH12 ARG A 60 19.772 -17.388 11.693 1.00 0.00 H new ATOM 0 HH21 ARG A 60 16.850 -15.629 11.206 1.00 0.00 H new ATOM 0 HH22 ARG A 60 17.837 -17.027 10.769 1.00 0.00 H new ATOM 939 N CYS A 61 19.228 -10.020 15.355 1.00 0.00 N ATOM 940 CA CYS A 61 19.854 -9.314 16.484 1.00 0.00 C ATOM 941 C CYS A 61 21.204 -9.964 16.891 1.00 0.00 C ATOM 942 O CYS A 61 21.373 -11.186 16.769 1.00 0.00 O ATOM 943 CB CYS A 61 18.841 -9.265 17.644 1.00 0.00 C ATOM 944 SG CYS A 61 19.280 -7.994 18.881 1.00 0.00 S ATOM 0 H CYS A 61 18.269 -10.305 15.555 1.00 0.00 H new ATOM 0 HA CYS A 61 20.105 -8.294 16.193 1.00 0.00 H new ATOM 0 HB2 CYS A 61 17.847 -9.058 17.249 1.00 0.00 H new ATOM 0 HB3 CYS A 61 18.795 -10.241 18.127 1.00 0.00 H new ATOM 949 N SER A 62 22.160 -9.158 17.375 1.00 0.00 N ATOM 950 CA SER A 62 23.530 -9.601 17.723 1.00 0.00 C ATOM 951 C SER A 62 23.987 -9.297 19.160 1.00 0.00 C ATOM 952 O SER A 62 25.187 -9.293 19.436 1.00 0.00 O ATOM 953 CB SER A 62 24.553 -9.047 16.716 1.00 0.00 C ATOM 954 OG SER A 62 24.220 -9.409 15.385 1.00 0.00 O ATOM 0 H SER A 62 22.007 -8.163 17.541 1.00 0.00 H new ATOM 0 HA SER A 62 23.483 -10.688 17.666 1.00 0.00 H new ATOM 0 HB2 SER A 62 24.596 -7.961 16.799 1.00 0.00 H new ATOM 0 HB3 SER A 62 25.546 -9.425 16.959 1.00 0.00 H new ATOM 0 HG SER A 62 24.888 -9.041 14.769 1.00 0.00 H new ATOM 960 N ARG A 63 23.062 -9.051 20.093 1.00 0.00 N ATOM 961 CA ARG A 63 23.341 -8.876 21.534 1.00 0.00 C ATOM 962 C ARG A 63 22.408 -9.760 22.369 1.00 0.00 C ATOM 963 O ARG A 63 21.262 -9.999 21.987 1.00 0.00 O ATOM 964 CB ARG A 63 23.226 -7.399 21.963 1.00 0.00 C ATOM 965 CG ARG A 63 24.406 -6.496 21.556 1.00 0.00 C ATOM 966 CD ARG A 63 24.256 -5.874 20.161 1.00 0.00 C ATOM 967 NE ARG A 63 25.444 -5.082 19.790 1.00 0.00 N ATOM 968 CZ ARG A 63 26.542 -5.542 19.213 1.00 0.00 C ATOM 969 NH1 ARG A 63 27.507 -4.717 18.915 1.00 0.00 N ATOM 970 NH2 ARG A 63 26.729 -6.808 18.944 1.00 0.00 N ATOM 0 H ARG A 63 22.071 -8.965 19.868 1.00 0.00 H new ATOM 0 HA ARG A 63 24.371 -9.186 21.713 1.00 0.00 H new ATOM 0 HB2 ARG A 63 22.311 -6.986 21.538 1.00 0.00 H new ATOM 0 HB3 ARG A 63 23.119 -7.361 23.047 1.00 0.00 H new ATOM 0 HG2 ARG A 63 24.511 -5.697 22.291 1.00 0.00 H new ATOM 0 HG3 ARG A 63 25.326 -7.080 21.587 1.00 0.00 H new ATOM 0 HD2 ARG A 63 24.099 -6.663 19.425 1.00 0.00 H new ATOM 0 HD3 ARG A 63 23.372 -5.237 20.139 1.00 0.00 H new ATOM 0 HE ARG A 63 25.416 -4.084 19.998 1.00 0.00 H new ATOM 0 HH11 ARG A 63 27.412 -3.724 19.127 1.00 0.00 H new ATOM 0 HH12 ARG A 63 28.356 -5.065 18.470 1.00 0.00 H new ATOM 0 HH21 ARG A 63 26.010 -7.491 19.180 1.00 0.00 H new ATOM 0 HH22 ARG A 63 27.594 -7.112 18.498 1.00 0.00 H new ATOM 984 N GLU A 64 22.867 -10.221 23.534 1.00 0.00 N ATOM 985 CA GLU A 64 22.039 -10.990 24.484 1.00 0.00 C ATOM 986 C GLU A 64 20.887 -10.119 25.042 1.00 0.00 C ATOM 987 O GLU A 64 19.788 -10.608 25.314 1.00 0.00 O ATOM 988 CB GLU A 64 22.944 -11.523 25.609 1.00 0.00 C ATOM 989 CG GLU A 64 22.217 -12.462 26.580 1.00 0.00 C ATOM 990 CD GLU A 64 23.191 -13.051 27.608 1.00 0.00 C ATOM 991 OE1 GLU A 64 23.337 -12.445 28.698 1.00 0.00 O ATOM 992 OE2 GLU A 64 23.796 -14.110 27.309 1.00 0.00 O ATOM 0 H GLU A 64 23.825 -10.075 23.852 1.00 0.00 H new ATOM 0 HA GLU A 64 21.576 -11.833 23.972 1.00 0.00 H new ATOM 0 HB2 GLU A 64 23.788 -12.052 25.167 1.00 0.00 H new ATOM 0 HB3 GLU A 64 23.353 -10.680 26.167 1.00 0.00 H new ATOM 0 HG2 GLU A 64 21.425 -11.917 27.094 1.00 0.00 H new ATOM 0 HG3 GLU A 64 21.739 -13.268 26.023 1.00 0.00 H new ATOM 999 N ASN A 65 21.142 -8.812 25.156 1.00 0.00 N ATOM 1000 CA ASN A 65 20.236 -7.744 25.563 1.00 0.00 C ATOM 1001 C ASN A 65 20.825 -6.414 25.048 1.00 0.00 C ATOM 1002 O ASN A 65 22.021 -6.165 25.244 1.00 0.00 O ATOM 1003 CB ASN A 65 20.114 -7.742 27.100 1.00 0.00 C ATOM 1004 CG ASN A 65 19.186 -6.648 27.604 1.00 0.00 C ATOM 1005 OD1 ASN A 65 18.110 -6.414 27.069 1.00 0.00 O ATOM 1006 ND2 ASN A 65 19.564 -5.940 28.644 1.00 0.00 N ATOM 0 H ASN A 65 22.071 -8.447 24.946 1.00 0.00 H new ATOM 0 HA ASN A 65 19.238 -7.885 25.148 1.00 0.00 H new ATOM 0 HB2 ASN A 65 19.744 -8.711 27.434 1.00 0.00 H new ATOM 0 HB3 ASN A 65 21.102 -7.609 27.540 1.00 0.00 H new ATOM 0 HD21 ASN A 65 18.962 -5.199 29.003 1.00 0.00 H new ATOM 0 HD22 ASN A 65 20.460 -6.131 29.093 1.00 0.00 H new ATOM 1013 N CYS A 66 20.011 -5.584 24.395 1.00 0.00 N ATOM 1014 CA CYS A 66 20.406 -4.301 23.803 1.00 0.00 C ATOM 1015 C CYS A 66 19.478 -3.131 24.208 1.00 0.00 C ATOM 1016 O CYS A 66 18.300 -3.306 24.546 1.00 0.00 O ATOM 1017 CB CYS A 66 20.598 -4.464 22.275 1.00 0.00 C ATOM 1018 SG CYS A 66 19.186 -5.216 21.378 1.00 0.00 S ATOM 0 H CYS A 66 19.022 -5.792 24.258 1.00 0.00 H new ATOM 0 HA CYS A 66 21.371 -4.011 24.219 1.00 0.00 H new ATOM 0 HB2 CYS A 66 20.798 -3.483 21.845 1.00 0.00 H new ATOM 0 HB3 CYS A 66 21.484 -5.075 22.101 1.00 0.00 H new ATOM 1023 N LYS A 67 20.051 -1.918 24.220 1.00 0.00 N ATOM 1024 CA LYS A 67 19.413 -0.647 24.636 1.00 0.00 C ATOM 1025 C LYS A 67 18.543 0.034 23.566 1.00 0.00 C ATOM 1026 O LYS A 67 17.916 1.059 23.837 1.00 0.00 O ATOM 1027 CB LYS A 67 20.512 0.309 25.145 1.00 0.00 C ATOM 1028 CG LYS A 67 21.491 0.760 24.044 1.00 0.00 C ATOM 1029 CD LYS A 67 22.702 1.498 24.632 1.00 0.00 C ATOM 1030 CE LYS A 67 23.740 1.826 23.554 1.00 0.00 C ATOM 1031 NZ LYS A 67 23.247 2.840 22.604 1.00 0.00 N ATOM 0 H LYS A 67 21.019 -1.784 23.927 1.00 0.00 H new ATOM 0 HA LYS A 67 18.707 -0.897 25.427 1.00 0.00 H new ATOM 0 HB2 LYS A 67 20.042 1.189 25.585 1.00 0.00 H new ATOM 0 HB3 LYS A 67 21.073 -0.184 25.939 1.00 0.00 H new ATOM 0 HG2 LYS A 67 21.832 -0.109 23.481 1.00 0.00 H new ATOM 0 HG3 LYS A 67 20.973 1.412 23.341 1.00 0.00 H new ATOM 0 HD2 LYS A 67 22.370 2.419 25.111 1.00 0.00 H new ATOM 0 HD3 LYS A 67 23.162 0.884 25.406 1.00 0.00 H new ATOM 0 HE2 LYS A 67 24.653 2.186 24.028 1.00 0.00 H new ATOM 0 HE3 LYS A 67 23.999 0.917 23.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 23.964 3.585 22.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 23.061 2.392 21.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 22.368 3.259 22.969 1.00 0.00 H new ATOM 1045 N TYR A 68 18.526 -0.496 22.351 1.00 0.00 N ATOM 1046 CA TYR A 68 17.801 0.060 21.208 1.00 0.00 C ATOM 1047 C TYR A 68 16.358 -0.464 21.061 1.00 0.00 C ATOM 1048 O TYR A 68 15.951 -1.438 21.699 1.00 0.00 O ATOM 1049 CB TYR A 68 18.603 -0.296 19.949 1.00 0.00 C ATOM 1050 CG TYR A 68 20.021 0.242 19.881 1.00 0.00 C ATOM 1051 CD1 TYR A 68 20.270 1.614 20.088 1.00 0.00 C ATOM 1052 CD2 TYR A 68 21.081 -0.620 19.538 1.00 0.00 C ATOM 1053 CE1 TYR A 68 21.571 2.129 19.933 1.00 0.00 C ATOM 1054 CE2 TYR A 68 22.383 -0.111 19.397 1.00 0.00 C ATOM 1055 CZ TYR A 68 22.627 1.265 19.574 1.00 0.00 C ATOM 1056 OH TYR A 68 23.874 1.752 19.359 1.00 0.00 O ATOM 0 H TYR A 68 19.031 -1.352 22.122 1.00 0.00 H new ATOM 0 HA TYR A 68 17.708 1.135 21.360 1.00 0.00 H new ATOM 0 HB2 TYR A 68 18.645 -1.382 19.865 1.00 0.00 H new ATOM 0 HB3 TYR A 68 18.056 0.070 19.080 1.00 0.00 H new ATOM 0 HD1 TYR A 68 19.460 2.272 20.366 1.00 0.00 H new ATOM 0 HD2 TYR A 68 20.893 -1.672 19.383 1.00 0.00 H new ATOM 0 HE1 TYR A 68 21.760 3.181 20.088 1.00 0.00 H new ATOM 0 HE2 TYR A 68 23.198 -0.776 19.152 1.00 0.00 H new ATOM 0 HH TYR A 68 24.099 1.667 18.409 1.00 0.00 H new ATOM 1066 N LEU A 69 15.591 0.169 20.167 1.00 0.00 N ATOM 1067 CA LEU A 69 14.217 -0.202 19.818 1.00 0.00 C ATOM 1068 C LEU A 69 14.206 -1.301 18.740 1.00 0.00 C ATOM 1069 O LEU A 69 14.906 -1.196 17.731 1.00 0.00 O ATOM 1070 CB LEU A 69 13.530 1.066 19.263 1.00 0.00 C ATOM 1071 CG LEU A 69 12.189 0.858 18.530 1.00 0.00 C ATOM 1072 CD1 LEU A 69 11.069 0.454 19.488 1.00 0.00 C ATOM 1073 CD2 LEU A 69 11.797 2.147 17.815 1.00 0.00 C ATOM 0 H LEU A 69 15.922 0.983 19.649 1.00 0.00 H new ATOM 0 HA LEU A 69 13.698 -0.587 20.696 1.00 0.00 H new ATOM 0 HB2 LEU A 69 13.362 1.754 20.092 1.00 0.00 H new ATOM 0 HB3 LEU A 69 14.221 1.556 18.577 1.00 0.00 H new ATOM 0 HG LEU A 69 12.325 0.048 17.813 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.143 0.318 18.929 1.00 0.00 H new ATOM 0 HD12 LEU A 69 11.334 -0.480 19.984 1.00 0.00 H new ATOM 0 HD13 LEU A 69 10.930 1.235 20.235 1.00 0.00 H new ATOM 0 HD21 LEU A 69 10.849 2.002 17.296 1.00 0.00 H new ATOM 0 HD22 LEU A 69 11.692 2.950 18.544 1.00 0.00 H new ATOM 0 HD23 LEU A 69 12.569 2.412 17.093 1.00 0.00 H new ATOM 1085 N HIS A 70 13.362 -2.322 18.924 1.00 0.00 N ATOM 1086 CA HIS A 70 13.084 -3.346 17.909 1.00 0.00 C ATOM 1087 C HIS A 70 11.738 -2.958 17.251 1.00 0.00 C ATOM 1088 O HIS A 70 10.688 -3.124 17.882 1.00 0.00 O ATOM 1089 CB HIS A 70 13.000 -4.737 18.565 1.00 0.00 C ATOM 1090 CG HIS A 70 14.328 -5.406 18.837 1.00 0.00 C ATOM 1091 ND1 HIS A 70 14.535 -6.767 18.916 1.00 0.00 N ATOM 1092 CD2 HIS A 70 15.555 -4.809 18.984 1.00 0.00 C ATOM 1093 CE1 HIS A 70 15.852 -6.982 19.089 1.00 0.00 C ATOM 1094 NE2 HIS A 70 16.517 -5.816 19.134 1.00 0.00 N ATOM 0 H HIS A 70 12.846 -2.463 19.792 1.00 0.00 H new ATOM 0 HA HIS A 70 13.877 -3.395 17.163 1.00 0.00 H new ATOM 0 HB2 HIS A 70 12.459 -4.644 19.507 1.00 0.00 H new ATOM 0 HB3 HIS A 70 12.409 -5.389 17.921 1.00 0.00 H new ATOM 0 HD1 HIS A 70 13.814 -7.486 18.854 1.00 0.00 H new ATOM 0 HD2 HIS A 70 15.746 -3.746 18.984 1.00 0.00 H new ATOM 0 HE1 HIS A 70 16.310 -7.956 19.179 1.00 0.00 H new ATOM 1102 N PRO A 71 11.732 -2.415 16.017 1.00 0.00 N ATOM 1103 CA PRO A 71 10.511 -1.936 15.366 1.00 0.00 C ATOM 1104 C PRO A 71 9.688 -3.036 14.662 1.00 0.00 C ATOM 1105 O PRO A 71 10.234 -4.083 14.296 1.00 0.00 O ATOM 1106 CB PRO A 71 11.014 -0.910 14.350 1.00 0.00 C ATOM 1107 CG PRO A 71 12.368 -1.465 13.920 1.00 0.00 C ATOM 1108 CD PRO A 71 12.898 -2.121 15.191 1.00 0.00 C ATOM 0 HA PRO A 71 9.821 -1.532 16.107 1.00 0.00 H new ATOM 0 HB2 PRO A 71 10.333 -0.816 13.505 1.00 0.00 H new ATOM 0 HB3 PRO A 71 11.110 0.081 14.794 1.00 0.00 H new ATOM 0 HG2 PRO A 71 12.268 -2.185 13.107 1.00 0.00 H new ATOM 0 HG3 PRO A 71 13.032 -0.676 13.567 1.00 0.00 H new ATOM 0 HD2 PRO A 71 13.449 -3.032 14.958 1.00 0.00 H new ATOM 0 HD3 PRO A 71 13.587 -1.457 15.713 1.00 0.00 H new ATOM 1116 N PRO A 72 8.382 -2.793 14.421 1.00 0.00 N ATOM 1117 CA PRO A 72 7.506 -3.709 13.689 1.00 0.00 C ATOM 1118 C PRO A 72 7.873 -3.734 12.189 1.00 0.00 C ATOM 1119 O PRO A 72 8.469 -2.770 11.697 1.00 0.00 O ATOM 1120 CB PRO A 72 6.090 -3.166 13.916 1.00 0.00 C ATOM 1121 CG PRO A 72 6.318 -1.663 14.052 1.00 0.00 C ATOM 1122 CD PRO A 72 7.646 -1.594 14.801 1.00 0.00 C ATOM 0 HA PRO A 72 7.599 -4.739 14.034 1.00 0.00 H new ATOM 0 HB2 PRO A 72 5.429 -3.400 13.082 1.00 0.00 H new ATOM 0 HB3 PRO A 72 5.634 -3.588 14.812 1.00 0.00 H new ATOM 0 HG2 PRO A 72 6.375 -1.172 13.080 1.00 0.00 H new ATOM 0 HG3 PRO A 72 5.514 -1.180 14.607 1.00 0.00 H new ATOM 0 HD2 PRO A 72 8.200 -0.694 14.532 1.00 0.00 H new ATOM 0 HD3 PRO A 72 7.485 -1.559 15.879 1.00 0.00 H new ATOM 1130 N PRO A 73 7.518 -4.794 11.430 1.00 0.00 N ATOM 1131 CA PRO A 73 7.841 -4.942 10.004 1.00 0.00 C ATOM 1132 C PRO A 73 7.627 -3.706 9.118 1.00 0.00 C ATOM 1133 O PRO A 73 8.482 -3.400 8.282 1.00 0.00 O ATOM 1134 CB PRO A 73 7.009 -6.135 9.523 1.00 0.00 C ATOM 1135 CG PRO A 73 6.902 -7.003 10.773 1.00 0.00 C ATOM 1136 CD PRO A 73 6.804 -5.977 11.899 1.00 0.00 C ATOM 0 HA PRO A 73 8.916 -5.093 9.909 1.00 0.00 H new ATOM 0 HB2 PRO A 73 6.029 -5.824 9.162 1.00 0.00 H new ATOM 0 HB3 PRO A 73 7.497 -6.664 8.705 1.00 0.00 H new ATOM 0 HG2 PRO A 73 6.026 -7.651 10.740 1.00 0.00 H new ATOM 0 HG3 PRO A 73 7.772 -7.649 10.891 1.00 0.00 H new ATOM 0 HD2 PRO A 73 5.763 -5.741 12.122 1.00 0.00 H new ATOM 0 HD3 PRO A 73 7.248 -6.362 12.817 1.00 0.00 H new ATOM 1144 N HIS A 74 6.522 -2.965 9.290 1.00 0.00 N ATOM 1145 CA HIS A 74 6.250 -1.760 8.487 1.00 0.00 C ATOM 1146 C HIS A 74 7.251 -0.625 8.759 1.00 0.00 C ATOM 1147 O HIS A 74 7.847 -0.102 7.817 1.00 0.00 O ATOM 1148 CB HIS A 74 4.776 -1.332 8.624 1.00 0.00 C ATOM 1149 CG HIS A 74 4.355 -0.798 9.972 1.00 0.00 C ATOM 1150 ND1 HIS A 74 3.943 -1.544 11.064 1.00 0.00 N ATOM 1151 CD2 HIS A 74 4.196 0.523 10.291 1.00 0.00 C ATOM 1152 CE1 HIS A 74 3.542 -0.690 12.026 1.00 0.00 C ATOM 1153 NE2 HIS A 74 3.698 0.569 11.578 1.00 0.00 N ATOM 0 H HIS A 74 5.800 -3.178 9.979 1.00 0.00 H new ATOM 0 HA HIS A 74 6.406 -2.016 7.439 1.00 0.00 H new ATOM 0 HB2 HIS A 74 4.571 -0.568 7.874 1.00 0.00 H new ATOM 0 HB3 HIS A 74 4.147 -2.190 8.385 1.00 0.00 H new ATOM 0 HD2 HIS A 74 4.418 1.369 9.657 1.00 0.00 H new ATOM 0 HE1 HIS A 74 3.159 -0.970 12.996 1.00 0.00 H new ATOM 0 HE2 HIS A 74 3.484 1.417 12.102 1.00 0.00 H new ATOM 1162 N LEU A 75 7.508 -0.282 10.028 1.00 0.00 N ATOM 1163 CA LEU A 75 8.507 0.740 10.384 1.00 0.00 C ATOM 1164 C LEU A 75 9.932 0.269 10.063 1.00 0.00 C ATOM 1165 O LEU A 75 10.745 1.064 9.599 1.00 0.00 O ATOM 1166 CB LEU A 75 8.388 1.151 11.862 1.00 0.00 C ATOM 1167 CG LEU A 75 7.065 1.829 12.257 1.00 0.00 C ATOM 1168 CD1 LEU A 75 7.123 2.290 13.713 1.00 0.00 C ATOM 1169 CD2 LEU A 75 6.743 3.048 11.389 1.00 0.00 C ATOM 0 H LEU A 75 7.036 -0.699 10.831 1.00 0.00 H new ATOM 0 HA LEU A 75 8.300 1.619 9.773 1.00 0.00 H new ATOM 0 HB2 LEU A 75 8.519 0.263 12.480 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.208 1.828 12.100 1.00 0.00 H new ATOM 0 HG LEU A 75 6.284 1.083 12.111 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.181 2.768 13.981 1.00 0.00 H new ATOM 0 HD12 LEU A 75 7.290 1.429 14.361 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.939 3.001 13.837 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.799 3.486 11.713 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.539 3.786 11.489 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.662 2.741 10.346 1.00 0.00 H new ATOM 1181 N LYS A 76 10.218 -1.028 10.235 1.00 0.00 N ATOM 1182 CA LYS A 76 11.502 -1.653 9.877 1.00 0.00 C ATOM 1183 C LYS A 76 11.792 -1.465 8.385 1.00 0.00 C ATOM 1184 O LYS A 76 12.881 -1.031 8.016 1.00 0.00 O ATOM 1185 CB LYS A 76 11.440 -3.135 10.289 1.00 0.00 C ATOM 1186 CG LYS A 76 12.738 -3.907 10.010 1.00 0.00 C ATOM 1187 CD LYS A 76 12.772 -5.290 10.682 1.00 0.00 C ATOM 1188 CE LYS A 76 12.723 -5.204 12.216 1.00 0.00 C ATOM 1189 NZ LYS A 76 12.891 -6.533 12.835 1.00 0.00 N ATOM 0 H LYS A 76 9.551 -1.688 10.635 1.00 0.00 H new ATOM 0 HA LYS A 76 12.328 -1.178 10.406 1.00 0.00 H new ATOM 0 HB2 LYS A 76 11.211 -3.198 11.353 1.00 0.00 H new ATOM 0 HB3 LYS A 76 10.619 -3.617 9.758 1.00 0.00 H new ATOM 0 HG2 LYS A 76 12.857 -4.029 8.933 1.00 0.00 H new ATOM 0 HG3 LYS A 76 13.586 -3.319 10.360 1.00 0.00 H new ATOM 0 HD2 LYS A 76 11.928 -5.883 10.328 1.00 0.00 H new ATOM 0 HD3 LYS A 76 13.679 -5.814 10.380 1.00 0.00 H new ATOM 0 HE2 LYS A 76 13.507 -4.534 12.570 1.00 0.00 H new ATOM 0 HE3 LYS A 76 11.771 -4.773 12.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 12.557 -6.502 13.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 12.338 -7.236 12.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 13.896 -6.799 12.819 1.00 0.00 H new ATOM 1203 N THR A 77 10.794 -1.716 7.536 1.00 0.00 N ATOM 1204 CA THR A 77 10.897 -1.504 6.084 1.00 0.00 C ATOM 1205 C THR A 77 11.097 -0.021 5.753 1.00 0.00 C ATOM 1206 O THR A 77 11.974 0.308 4.953 1.00 0.00 O ATOM 1207 CB THR A 77 9.665 -2.052 5.344 1.00 0.00 C ATOM 1208 OG1 THR A 77 9.486 -3.425 5.627 1.00 0.00 O ATOM 1209 CG2 THR A 77 9.828 -1.937 3.829 1.00 0.00 C ATOM 0 H THR A 77 9.886 -2.074 7.834 1.00 0.00 H new ATOM 0 HA THR A 77 11.772 -2.056 5.741 1.00 0.00 H new ATOM 0 HB THR A 77 8.813 -1.463 5.682 1.00 0.00 H new ATOM 0 HG1 THR A 77 9.138 -3.529 6.537 1.00 0.00 H new ATOM 0 HG21 THR A 77 8.940 -2.333 3.336 1.00 0.00 H new ATOM 0 HG22 THR A 77 9.958 -0.890 3.555 1.00 0.00 H new ATOM 0 HG23 THR A 77 10.702 -2.506 3.513 1.00 0.00 H new ATOM 1217 N GLN A 78 10.347 0.894 6.385 1.00 0.00 N ATOM 1218 CA GLN A 78 10.518 2.339 6.164 1.00 0.00 C ATOM 1219 C GLN A 78 11.926 2.809 6.565 1.00 0.00 C ATOM 1220 O GLN A 78 12.522 3.634 5.871 1.00 0.00 O ATOM 1221 CB GLN A 78 9.441 3.135 6.923 1.00 0.00 C ATOM 1222 CG GLN A 78 8.031 2.988 6.328 1.00 0.00 C ATOM 1223 CD GLN A 78 7.901 3.626 4.946 1.00 0.00 C ATOM 1224 OE1 GLN A 78 8.001 2.973 3.915 1.00 0.00 O ATOM 1225 NE2 GLN A 78 7.682 4.922 4.861 1.00 0.00 N ATOM 0 H GLN A 78 9.615 0.659 7.055 1.00 0.00 H new ATOM 0 HA GLN A 78 10.400 2.527 5.097 1.00 0.00 H new ATOM 0 HB2 GLN A 78 9.423 2.806 7.962 1.00 0.00 H new ATOM 0 HB3 GLN A 78 9.716 4.190 6.927 1.00 0.00 H new ATOM 0 HG2 GLN A 78 7.779 1.930 6.259 1.00 0.00 H new ATOM 0 HG3 GLN A 78 7.307 3.445 7.003 1.00 0.00 H new ATOM 0 HE21 GLN A 78 7.596 5.481 5.710 1.00 0.00 H new ATOM 0 HE22 GLN A 78 7.598 5.366 3.947 1.00 0.00 H new ATOM 1234 N LEU A 79 12.482 2.266 7.653 1.00 0.00 N ATOM 1235 CA LEU A 79 13.836 2.567 8.117 1.00 0.00 C ATOM 1236 C LEU A 79 14.877 2.095 7.087 1.00 0.00 C ATOM 1237 O LEU A 79 15.749 2.870 6.697 1.00 0.00 O ATOM 1238 CB LEU A 79 14.023 1.929 9.508 1.00 0.00 C ATOM 1239 CG LEU A 79 15.200 2.434 10.364 1.00 0.00 C ATOM 1240 CD1 LEU A 79 16.572 2.093 9.788 1.00 0.00 C ATOM 1241 CD2 LEU A 79 15.114 3.938 10.615 1.00 0.00 C ATOM 0 H LEU A 79 11.994 1.594 8.244 1.00 0.00 H new ATOM 0 HA LEU A 79 13.984 3.642 8.215 1.00 0.00 H new ATOM 0 HB2 LEU A 79 13.104 2.080 10.075 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.141 0.854 9.373 1.00 0.00 H new ATOM 0 HG LEU A 79 15.104 1.901 11.310 1.00 0.00 H new ATOM 0 HD11 LEU A 79 17.350 2.481 10.446 1.00 0.00 H new ATOM 0 HD12 LEU A 79 16.673 1.011 9.706 1.00 0.00 H new ATOM 0 HD13 LEU A 79 16.674 2.543 8.801 1.00 0.00 H new ATOM 0 HD21 LEU A 79 15.962 4.255 11.222 1.00 0.00 H new ATOM 0 HD22 LEU A 79 15.132 4.467 9.662 1.00 0.00 H new ATOM 0 HD23 LEU A 79 14.186 4.167 11.140 1.00 0.00 H new ATOM 1253 N GLU A 80 14.760 0.862 6.580 1.00 0.00 N ATOM 1254 CA GLU A 80 15.666 0.337 5.544 1.00 0.00 C ATOM 1255 C GLU A 80 15.617 1.185 4.257 1.00 0.00 C ATOM 1256 O GLU A 80 16.662 1.473 3.669 1.00 0.00 O ATOM 1257 CB GLU A 80 15.344 -1.138 5.251 1.00 0.00 C ATOM 1258 CG GLU A 80 15.764 -2.066 6.402 1.00 0.00 C ATOM 1259 CD GLU A 80 15.357 -3.515 6.105 1.00 0.00 C ATOM 1260 OE1 GLU A 80 14.156 -3.838 6.270 1.00 0.00 O ATOM 1261 OE2 GLU A 80 16.243 -4.297 5.679 1.00 0.00 O ATOM 0 H GLU A 80 14.040 0.201 6.872 1.00 0.00 H new ATOM 0 HA GLU A 80 16.685 0.400 5.927 1.00 0.00 H new ATOM 0 HB2 GLU A 80 14.274 -1.246 5.072 1.00 0.00 H new ATOM 0 HB3 GLU A 80 15.852 -1.444 4.337 1.00 0.00 H new ATOM 0 HG2 GLU A 80 16.843 -2.008 6.547 1.00 0.00 H new ATOM 0 HG3 GLU A 80 15.299 -1.735 7.331 1.00 0.00 H new ATOM 1268 N ILE A 81 14.424 1.642 3.850 1.00 0.00 N ATOM 1269 CA ILE A 81 14.235 2.539 2.696 1.00 0.00 C ATOM 1270 C ILE A 81 14.933 3.886 2.947 1.00 0.00 C ATOM 1271 O ILE A 81 15.634 4.383 2.065 1.00 0.00 O ATOM 1272 CB ILE A 81 12.728 2.698 2.375 1.00 0.00 C ATOM 1273 CG1 ILE A 81 12.192 1.370 1.787 1.00 0.00 C ATOM 1274 CG2 ILE A 81 12.462 3.854 1.391 1.00 0.00 C ATOM 1275 CD1 ILE A 81 10.663 1.294 1.698 1.00 0.00 C ATOM 0 H ILE A 81 13.551 1.397 4.317 1.00 0.00 H new ATOM 0 HA ILE A 81 14.701 2.098 1.815 1.00 0.00 H new ATOM 0 HB ILE A 81 12.209 2.939 3.303 1.00 0.00 H new ATOM 0 HG12 ILE A 81 12.610 1.232 0.790 1.00 0.00 H new ATOM 0 HG13 ILE A 81 12.551 0.543 2.400 1.00 0.00 H new ATOM 0 HG21 ILE A 81 11.392 3.927 1.196 1.00 0.00 H new ATOM 0 HG22 ILE A 81 12.816 4.789 1.824 1.00 0.00 H new ATOM 0 HG23 ILE A 81 12.989 3.664 0.456 1.00 0.00 H new ATOM 0 HD11 ILE A 81 10.370 0.333 1.276 1.00 0.00 H new ATOM 0 HD12 ILE A 81 10.235 1.398 2.695 1.00 0.00 H new ATOM 0 HD13 ILE A 81 10.295 2.097 1.060 1.00 0.00 H new ATOM 1287 N ASN A 82 14.806 4.465 4.148 1.00 0.00 N ATOM 1288 CA ASN A 82 15.499 5.710 4.514 1.00 0.00 C ATOM 1289 C ASN A 82 17.029 5.527 4.504 1.00 0.00 C ATOM 1290 O ASN A 82 17.749 6.409 4.029 1.00 0.00 O ATOM 1291 CB ASN A 82 14.990 6.224 5.873 1.00 0.00 C ATOM 1292 CG ASN A 82 13.738 7.072 5.725 1.00 0.00 C ATOM 1293 OD1 ASN A 82 13.797 8.288 5.610 1.00 0.00 O ATOM 1294 ND2 ASN A 82 12.571 6.472 5.702 1.00 0.00 N ATOM 0 H ASN A 82 14.222 4.086 4.893 1.00 0.00 H new ATOM 0 HA ASN A 82 15.270 6.466 3.763 1.00 0.00 H new ATOM 0 HB2 ASN A 82 14.780 5.377 6.526 1.00 0.00 H new ATOM 0 HB3 ASN A 82 15.772 6.811 6.355 1.00 0.00 H new ATOM 0 HD21 ASN A 82 11.718 7.020 5.589 1.00 0.00 H new ATOM 0 HD22 ASN A 82 12.517 5.458 5.798 1.00 0.00 H new ATOM 1301 N GLY A 83 17.534 4.379 4.968 1.00 0.00 N ATOM 1302 CA GLY A 83 18.961 4.045 4.922 1.00 0.00 C ATOM 1303 C GLY A 83 19.470 4.013 3.477 1.00 0.00 C ATOM 1304 O GLY A 83 20.437 4.699 3.139 1.00 0.00 O ATOM 0 H GLY A 83 16.959 3.650 5.389 1.00 0.00 H new ATOM 0 HA2 GLY A 83 19.529 4.778 5.495 1.00 0.00 H new ATOM 0 HA3 GLY A 83 19.127 3.075 5.392 1.00 0.00 H new ATOM 1308 N ARG A 84 18.770 3.289 2.594 1.00 0.00 N ATOM 1309 CA ARG A 84 19.074 3.240 1.152 1.00 0.00 C ATOM 1310 C ARG A 84 19.009 4.620 0.501 1.00 0.00 C ATOM 1311 O ARG A 84 19.905 4.962 -0.263 1.00 0.00 O ATOM 1312 CB ARG A 84 18.125 2.251 0.453 1.00 0.00 C ATOM 1313 CG ARG A 84 18.613 0.794 0.551 1.00 0.00 C ATOM 1314 CD ARG A 84 19.816 0.479 -0.355 1.00 0.00 C ATOM 1315 NE ARG A 84 19.519 0.742 -1.776 1.00 0.00 N ATOM 1316 CZ ARG A 84 18.908 -0.063 -2.630 1.00 0.00 C ATOM 1317 NH1 ARG A 84 18.721 0.323 -3.862 1.00 0.00 N ATOM 1318 NH2 ARG A 84 18.479 -1.254 -2.303 1.00 0.00 N ATOM 0 H ARG A 84 17.970 2.715 2.859 1.00 0.00 H new ATOM 0 HA ARG A 84 20.100 2.891 1.037 1.00 0.00 H new ATOM 0 HB2 ARG A 84 17.133 2.329 0.898 1.00 0.00 H new ATOM 0 HB3 ARG A 84 18.026 2.528 -0.597 1.00 0.00 H new ATOM 0 HG2 ARG A 84 18.883 0.580 1.585 1.00 0.00 H new ATOM 0 HG3 ARG A 84 17.791 0.127 0.292 1.00 0.00 H new ATOM 0 HD2 ARG A 84 20.671 1.080 -0.046 1.00 0.00 H new ATOM 0 HD3 ARG A 84 20.100 -0.566 -0.231 1.00 0.00 H new ATOM 0 HE ARG A 84 19.818 1.646 -2.141 1.00 0.00 H new ATOM 0 HH11 ARG A 84 19.045 1.242 -4.163 1.00 0.00 H new ATOM 0 HH12 ARG A 84 18.250 -0.294 -4.524 1.00 0.00 H new ATOM 0 HH21 ARG A 84 18.610 -1.600 -1.352 1.00 0.00 H new ATOM 0 HH22 ARG A 84 18.013 -1.837 -2.998 1.00 0.00 H new ATOM 1332 N ASN A 85 18.005 5.436 0.821 1.00 0.00 N ATOM 1333 CA ASN A 85 17.867 6.798 0.289 1.00 0.00 C ATOM 1334 C ASN A 85 19.085 7.691 0.615 1.00 0.00 C ATOM 1335 O ASN A 85 19.513 8.490 -0.220 1.00 0.00 O ATOM 1336 CB ASN A 85 16.553 7.408 0.801 1.00 0.00 C ATOM 1337 CG ASN A 85 16.240 8.723 0.105 1.00 0.00 C ATOM 1338 OD1 ASN A 85 16.192 8.807 -1.115 1.00 0.00 O ATOM 1339 ND2 ASN A 85 16.022 9.787 0.841 1.00 0.00 N ATOM 0 H ASN A 85 17.257 5.171 1.462 1.00 0.00 H new ATOM 0 HA ASN A 85 17.834 6.741 -0.799 1.00 0.00 H new ATOM 0 HB2 ASN A 85 15.736 6.705 0.637 1.00 0.00 H new ATOM 0 HB3 ASN A 85 16.622 7.572 1.876 1.00 0.00 H new ATOM 0 HD21 ASN A 85 15.813 10.681 0.396 1.00 0.00 H new ATOM 0 HD22 ASN A 85 16.061 9.720 1.858 1.00 0.00 H new ATOM 1346 N ASN A 86 19.684 7.520 1.801 1.00 0.00 N ATOM 1347 CA ASN A 86 20.907 8.232 2.186 1.00 0.00 C ATOM 1348 C ASN A 86 22.117 7.729 1.372 1.00 0.00 C ATOM 1349 O ASN A 86 22.905 8.544 0.889 1.00 0.00 O ATOM 1350 CB ASN A 86 21.134 8.102 3.703 1.00 0.00 C ATOM 1351 CG ASN A 86 20.315 9.107 4.494 1.00 0.00 C ATOM 1352 OD1 ASN A 86 20.752 10.213 4.775 1.00 0.00 O ATOM 1353 ND2 ASN A 86 19.095 8.781 4.860 1.00 0.00 N ATOM 0 H ASN A 86 19.334 6.885 2.519 1.00 0.00 H new ATOM 0 HA ASN A 86 20.791 9.291 1.955 1.00 0.00 H new ATOM 0 HB2 ASN A 86 20.874 7.093 4.022 1.00 0.00 H new ATOM 0 HB3 ASN A 86 22.192 8.244 3.924 1.00 0.00 H new ATOM 0 HD21 ASN A 86 18.521 9.449 5.374 1.00 0.00 H new ATOM 0 HD22 ASN A 86 18.722 7.860 4.630 1.00 0.00 H new ATOM 1360 N LEU A 87 22.244 6.411 1.150 1.00 0.00 N ATOM 1361 CA LEU A 87 23.312 5.823 0.318 1.00 0.00 C ATOM 1362 C LEU A 87 23.183 6.222 -1.164 1.00 0.00 C ATOM 1363 O LEU A 87 24.194 6.400 -1.845 1.00 0.00 O ATOM 1364 CB LEU A 87 23.310 4.292 0.449 1.00 0.00 C ATOM 1365 CG LEU A 87 23.607 3.757 1.859 1.00 0.00 C ATOM 1366 CD1 LEU A 87 23.389 2.242 1.904 1.00 0.00 C ATOM 1367 CD2 LEU A 87 25.042 4.063 2.296 1.00 0.00 C ATOM 0 H LEU A 87 21.607 5.718 1.543 1.00 0.00 H new ATOM 0 HA LEU A 87 24.259 6.220 0.685 1.00 0.00 H new ATOM 0 HB2 LEU A 87 22.336 3.917 0.133 1.00 0.00 H new ATOM 0 HB3 LEU A 87 24.048 3.883 -0.241 1.00 0.00 H new ATOM 0 HG LEU A 87 22.923 4.259 2.544 1.00 0.00 H new ATOM 0 HD11 LEU A 87 23.602 1.873 2.907 1.00 0.00 H new ATOM 0 HD12 LEU A 87 22.354 2.015 1.646 1.00 0.00 H new ATOM 0 HD13 LEU A 87 24.055 1.757 1.190 1.00 0.00 H new ATOM 0 HD21 LEU A 87 25.209 3.668 3.298 1.00 0.00 H new ATOM 0 HD22 LEU A 87 25.741 3.598 1.601 1.00 0.00 H new ATOM 0 HD23 LEU A 87 25.199 5.142 2.301 1.00 0.00 H new ATOM 1379 N ILE A 88 21.950 6.407 -1.650 1.00 0.00 N ATOM 1380 CA ILE A 88 21.613 6.893 -3.003 1.00 0.00 C ATOM 1381 C ILE A 88 22.069 8.362 -3.197 1.00 0.00 C ATOM 1382 O ILE A 88 22.187 8.837 -4.327 1.00 0.00 O ATOM 1383 CB ILE A 88 20.098 6.657 -3.252 1.00 0.00 C ATOM 1384 CG1 ILE A 88 19.863 5.147 -3.513 1.00 0.00 C ATOM 1385 CG2 ILE A 88 19.503 7.489 -4.403 1.00 0.00 C ATOM 1386 CD1 ILE A 88 18.395 4.702 -3.435 1.00 0.00 C ATOM 0 H ILE A 88 21.119 6.215 -1.090 1.00 0.00 H new ATOM 0 HA ILE A 88 22.158 6.332 -3.762 1.00 0.00 H new ATOM 0 HB ILE A 88 19.578 6.992 -2.354 1.00 0.00 H new ATOM 0 HG12 ILE A 88 20.252 4.898 -4.501 1.00 0.00 H new ATOM 0 HG13 ILE A 88 20.441 4.573 -2.789 1.00 0.00 H new ATOM 0 HG21 ILE A 88 18.442 7.261 -4.506 1.00 0.00 H new ATOM 0 HG22 ILE A 88 19.627 8.550 -4.187 1.00 0.00 H new ATOM 0 HG23 ILE A 88 20.018 7.246 -5.332 1.00 0.00 H new ATOM 0 HD11 ILE A 88 18.328 3.632 -3.631 1.00 0.00 H new ATOM 0 HD12 ILE A 88 18.003 4.914 -2.440 1.00 0.00 H new ATOM 0 HD13 ILE A 88 17.810 5.244 -4.178 1.00 0.00 H new ATOM 1398 N GLN A 89 22.395 9.062 -2.101 1.00 0.00 N ATOM 1399 CA GLN A 89 22.927 10.429 -2.057 1.00 0.00 C ATOM 1400 C GLN A 89 21.955 11.499 -2.597 1.00 0.00 C ATOM 1401 O GLN A 89 22.366 12.463 -3.246 1.00 0.00 O ATOM 1402 CB GLN A 89 24.336 10.448 -2.693 1.00 0.00 C ATOM 1403 CG GLN A 89 25.253 11.523 -2.092 1.00 0.00 C ATOM 1404 CD GLN A 89 26.581 11.607 -2.842 1.00 0.00 C ATOM 1405 OE1 GLN A 89 26.844 12.540 -3.592 1.00 0.00 O ATOM 1406 NE2 GLN A 89 27.462 10.643 -2.692 1.00 0.00 N ATOM 0 H GLN A 89 22.288 8.665 -1.168 1.00 0.00 H new ATOM 0 HA GLN A 89 23.034 10.727 -1.014 1.00 0.00 H new ATOM 0 HB2 GLN A 89 24.800 9.470 -2.564 1.00 0.00 H new ATOM 0 HB3 GLN A 89 24.242 10.617 -3.766 1.00 0.00 H new ATOM 0 HG2 GLN A 89 24.752 12.491 -2.126 1.00 0.00 H new ATOM 0 HG3 GLN A 89 25.440 11.298 -1.042 1.00 0.00 H new ATOM 0 HE21 GLN A 89 27.259 9.859 -2.072 1.00 0.00 H new ATOM 0 HE22 GLN A 89 28.348 10.679 -3.196 1.00 0.00 H new ATOM 1415 N GLN A 90 20.654 11.341 -2.317 1.00 0.00 N ATOM 1416 CA GLN A 90 19.574 12.253 -2.745 1.00 0.00 C ATOM 1417 C GLN A 90 19.841 13.745 -2.426 1.00 0.00 C ATOM 1418 O GLN A 90 19.403 14.627 -3.168 1.00 0.00 O ATOM 1419 CB GLN A 90 18.250 11.771 -2.118 1.00 0.00 C ATOM 1420 CG GLN A 90 17.015 12.494 -2.686 1.00 0.00 C ATOM 1421 CD GLN A 90 15.710 12.027 -2.042 1.00 0.00 C ATOM 1422 OE1 GLN A 90 15.530 12.067 -0.831 1.00 0.00 O ATOM 1423 NE2 GLN A 90 14.737 11.588 -2.814 1.00 0.00 N ATOM 0 H GLN A 90 20.309 10.552 -1.770 1.00 0.00 H new ATOM 0 HA GLN A 90 19.520 12.213 -3.833 1.00 0.00 H new ATOM 0 HB2 GLN A 90 18.145 10.699 -2.285 1.00 0.00 H new ATOM 0 HB3 GLN A 90 18.289 11.923 -1.039 1.00 0.00 H new ATOM 0 HG2 GLN A 90 17.126 13.568 -2.535 1.00 0.00 H new ATOM 0 HG3 GLN A 90 16.964 12.327 -3.762 1.00 0.00 H new ATOM 0 HE21 GLN A 90 14.867 11.547 -3.825 1.00 0.00 H new ATOM 0 HE22 GLN A 90 13.854 11.289 -2.401 1.00 0.00 H new ATOM 1432 N LYS A 91 20.583 14.032 -1.344 1.00 0.00 N ATOM 1433 CA LYS A 91 20.976 15.388 -0.908 1.00 0.00 C ATOM 1434 C LYS A 91 21.804 16.157 -1.958 1.00 0.00 C ATOM 1435 O LYS A 91 21.719 17.384 -2.027 1.00 0.00 O ATOM 1436 CB LYS A 91 21.732 15.253 0.430 1.00 0.00 C ATOM 1437 CG LYS A 91 22.056 16.603 1.098 1.00 0.00 C ATOM 1438 CD LYS A 91 22.784 16.445 2.443 1.00 0.00 C ATOM 1439 CE LYS A 91 21.892 15.822 3.524 1.00 0.00 C ATOM 1440 NZ LYS A 91 22.618 15.705 4.806 1.00 0.00 N ATOM 0 H LYS A 91 20.940 13.303 -0.725 1.00 0.00 H new ATOM 0 HA LYS A 91 20.075 15.988 -0.780 1.00 0.00 H new ATOM 0 HB2 LYS A 91 21.134 14.653 1.116 1.00 0.00 H new ATOM 0 HB3 LYS A 91 22.662 14.710 0.259 1.00 0.00 H new ATOM 0 HG2 LYS A 91 22.673 17.197 0.424 1.00 0.00 H new ATOM 0 HG3 LYS A 91 21.130 17.157 1.254 1.00 0.00 H new ATOM 0 HD2 LYS A 91 23.668 15.823 2.303 1.00 0.00 H new ATOM 0 HD3 LYS A 91 23.131 17.421 2.781 1.00 0.00 H new ATOM 0 HE2 LYS A 91 21.000 16.433 3.661 1.00 0.00 H new ATOM 0 HE3 LYS A 91 21.557 14.837 3.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 21.949 15.459 5.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 23.342 14.962 4.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 23.075 16.612 5.030 1.00 0.00 H new ATOM 1454 N ASN A 92 22.586 15.455 -2.785 1.00 0.00 N ATOM 1455 CA ASN A 92 23.423 16.042 -3.837 1.00 0.00 C ATOM 1456 C ASN A 92 22.578 16.674 -4.964 1.00 0.00 C ATOM 1457 O ASN A 92 21.818 15.988 -5.664 1.00 0.00 O ATOM 1458 CB ASN A 92 24.396 14.958 -4.344 1.00 0.00 C ATOM 1459 CG ASN A 92 25.476 15.483 -5.281 1.00 0.00 C ATOM 1460 OD1 ASN A 92 25.342 16.503 -5.944 1.00 0.00 O ATOM 1461 ND2 ASN A 92 26.600 14.808 -5.354 1.00 0.00 N ATOM 0 H ASN A 92 22.656 14.438 -2.740 1.00 0.00 H new ATOM 0 HA ASN A 92 24.004 16.869 -3.430 1.00 0.00 H new ATOM 0 HB2 ASN A 92 24.873 14.483 -3.487 1.00 0.00 H new ATOM 0 HB3 ASN A 92 23.826 14.186 -4.860 1.00 0.00 H new ATOM 0 HD21 ASN A 92 27.353 15.135 -5.960 1.00 0.00 H new ATOM 0 HD22 ASN A 92 26.720 13.957 -4.805 1.00 0.00 H new TER 1468 ASN A 92 ATOM 1469 P G B 95 29.754 -14.649 20.630 1.00 0.00 P ATOM 1470 OP1 G B 95 29.494 -15.586 19.509 1.00 0.00 O ATOM 1471 OP2 G B 95 31.026 -14.759 21.386 1.00 0.00 O ATOM 1472 O5' G B 95 29.710 -13.146 20.007 1.00 0.00 O ATOM 1473 C5' G B 95 30.690 -12.700 19.076 1.00 0.00 C ATOM 1474 C4' G B 95 30.271 -11.392 18.387 1.00 0.00 C ATOM 1475 O4' G B 95 29.126 -11.598 17.564 1.00 0.00 O ATOM 1476 C3' G B 95 29.984 -10.234 19.353 1.00 0.00 C ATOM 1477 O3' G B 95 31.018 -9.260 19.327 1.00 0.00 O ATOM 1478 C2' G B 95 28.683 -9.629 18.802 1.00 0.00 C ATOM 1479 O2' G B 95 28.916 -8.572 17.873 1.00 0.00 O ATOM 1480 C1' G B 95 28.052 -10.799 18.046 1.00 0.00 C ATOM 1481 N9 G B 95 27.115 -11.617 18.863 1.00 0.00 N ATOM 1482 C8 G B 95 27.014 -11.743 20.228 1.00 0.00 C ATOM 1483 N7 G B 95 26.013 -12.480 20.635 1.00 0.00 N ATOM 1484 C5 G B 95 25.373 -12.848 19.444 1.00 0.00 C ATOM 1485 C6 G B 95 24.181 -13.622 19.199 1.00 0.00 C ATOM 1486 O6 G B 95 23.429 -14.175 20.005 1.00 0.00 O ATOM 1487 N1 G B 95 23.863 -13.735 17.857 1.00 0.00 N ATOM 1488 C2 G B 95 24.597 -13.176 16.861 1.00 0.00 C ATOM 1489 N2 G B 95 24.190 -13.353 15.631 1.00 0.00 N ATOM 1490 N3 G B 95 25.702 -12.456 17.041 1.00 0.00 N ATOM 1491 C4 G B 95 26.045 -12.324 18.360 1.00 0.00 C ATOM 0 H5' G B 95 30.853 -13.471 18.323 1.00 0.00 H new ATOM 0 H5'' G B 95 31.639 -12.551 19.591 1.00 0.00 H new ATOM 0 H4' G B 95 31.133 -11.102 17.786 1.00 0.00 H new ATOM 0 H3' G B 95 29.914 -10.568 20.388 1.00 0.00 H new ATOM 0 H2' G B 95 28.076 -9.205 19.602 1.00 0.00 H new ATOM 0 HO2' G B 95 29.799 -8.180 18.038 1.00 0.00 H new ATOM 0 H1' G B 95 27.436 -10.402 17.239 1.00 0.00 H new ATOM 0 H8 G B 95 27.706 -11.271 20.910 1.00 0.00 H new ATOM 0 H1 G B 95 23.031 -14.268 17.602 1.00 0.00 H new ATOM 0 H21 G B 95 24.716 -12.948 14.857 1.00 0.00 H new ATOM 0 H22 G B 95 23.347 -13.896 15.446 1.00 0.00 H new ATOM 1503 P U B 96 31.804 -8.833 20.658 1.00 0.00 P ATOM 1504 OP1 U B 96 32.735 -7.737 20.314 1.00 0.00 O ATOM 1505 OP2 U B 96 32.305 -10.063 21.311 1.00 0.00 O ATOM 1506 O5' U B 96 30.607 -8.242 21.564 1.00 0.00 O ATOM 1507 C5' U B 96 29.835 -7.115 21.169 1.00 0.00 C ATOM 1508 C4' U B 96 28.547 -6.995 22.004 1.00 0.00 C ATOM 1509 O4' U B 96 27.884 -8.258 22.037 1.00 0.00 O ATOM 1510 C3' U B 96 28.770 -6.572 23.467 1.00 0.00 C ATOM 1511 O3' U B 96 27.602 -5.945 23.981 1.00 0.00 O ATOM 1512 C2' U B 96 28.938 -7.936 24.144 1.00 0.00 C ATOM 1513 O2' U B 96 28.726 -7.936 25.555 1.00 0.00 O ATOM 1514 C1' U B 96 27.854 -8.710 23.387 1.00 0.00 C ATOM 1515 N1 U B 96 27.967 -10.191 23.467 1.00 0.00 N ATOM 1516 C2 U B 96 26.804 -10.917 23.754 1.00 0.00 C ATOM 1517 O2 U B 96 25.704 -10.394 23.943 1.00 0.00 O ATOM 1518 N3 U B 96 26.919 -12.290 23.817 1.00 0.00 N ATOM 1519 C4 U B 96 28.075 -13.008 23.615 1.00 0.00 C ATOM 1520 O4 U B 96 28.060 -14.234 23.653 1.00 0.00 O ATOM 1521 C5 U B 96 29.244 -12.197 23.346 1.00 0.00 C ATOM 1522 C6 U B 96 29.170 -10.841 23.278 1.00 0.00 C ATOM 0 H5' U B 96 29.579 -7.200 20.113 1.00 0.00 H new ATOM 0 H5'' U B 96 30.429 -6.208 21.281 1.00 0.00 H new ATOM 0 H4' U B 96 27.962 -6.216 21.516 1.00 0.00 H new ATOM 0 H3' U B 96 29.595 -5.874 23.609 1.00 0.00 H new ATOM 0 H2' U B 96 29.949 -8.339 24.089 1.00 0.00 H new ATOM 0 HO2' U B 96 28.222 -7.135 25.810 1.00 0.00 H new ATOM 0 H1' U B 96 26.896 -8.504 23.864 1.00 0.00 H new ATOM 0 H3 U B 96 26.074 -12.819 24.032 1.00 0.00 H new ATOM 0 H5 U B 96 30.198 -12.681 23.196 1.00 0.00 H new ATOM 0 H6 U B 96 30.062 -10.267 23.074 1.00 0.00 H new ATOM 1533 P C B 97 27.351 -4.367 23.888 1.00 0.00 P ATOM 1534 OP1 C B 97 26.064 -4.090 24.556 1.00 0.00 O ATOM 1535 OP2 C B 97 27.585 -3.924 22.496 1.00 0.00 O ATOM 1536 O5' C B 97 28.546 -3.816 24.816 1.00 0.00 O ATOM 1537 C5' C B 97 28.514 -4.014 26.223 1.00 0.00 C ATOM 1538 C4' C B 97 29.889 -3.783 26.858 1.00 0.00 C ATOM 1539 O4' C B 97 30.807 -4.755 26.362 1.00 0.00 O ATOM 1540 C3' C B 97 30.464 -2.380 26.586 1.00 0.00 C ATOM 1541 O3' C B 97 31.005 -1.818 27.777 1.00 0.00 O ATOM 1542 C2' C B 97 31.579 -2.687 25.586 1.00 0.00 C ATOM 1543 O2' C B 97 32.657 -1.763 25.622 1.00 0.00 O ATOM 1544 C1' C B 97 32.007 -4.088 26.020 1.00 0.00 C ATOM 1545 N1 C B 97 32.759 -4.846 24.977 1.00 0.00 N ATOM 1546 C2 C B 97 33.957 -5.486 25.335 1.00 0.00 C ATOM 1547 O2 C B 97 34.382 -5.474 26.493 1.00 0.00 O ATOM 1548 N3 C B 97 34.691 -6.150 24.403 1.00 0.00 N ATOM 1549 C4 C B 97 34.260 -6.171 23.159 1.00 0.00 C ATOM 1550 N4 C B 97 34.997 -6.829 22.309 1.00 0.00 N ATOM 1551 C5 C B 97 33.062 -5.537 22.733 1.00 0.00 C ATOM 1552 C6 C B 97 32.332 -4.887 23.670 1.00 0.00 C ATOM 0 H5' C B 97 28.178 -5.028 26.440 1.00 0.00 H new ATOM 0 H5'' C B 97 27.788 -3.335 26.670 1.00 0.00 H new ATOM 0 H4' C B 97 29.752 -3.873 27.936 1.00 0.00 H new ATOM 0 H3' C B 97 29.727 -1.662 26.226 1.00 0.00 H new ATOM 0 H2' C B 97 31.246 -2.617 24.551 1.00 0.00 H new ATOM 0 HO2' C B 97 32.600 -1.163 24.849 1.00 0.00 H new ATOM 0 H1' C B 97 32.708 -4.018 26.852 1.00 0.00 H new ATOM 0 H41 C B 97 34.719 -6.884 21.329 1.00 0.00 H new ATOM 0 H42 C B 97 35.851 -7.289 22.624 1.00 0.00 H new ATOM 0 H5 C B 97 32.746 -5.572 21.701 1.00 0.00 H new ATOM 0 H6 C B 97 31.410 -4.399 23.390 1.00 0.00 H new ATOM 1564 P U B 98 30.086 -0.935 28.757 1.00 0.00 P ATOM 1565 OP1 U B 98 30.865 -0.606 29.972 1.00 0.00 O ATOM 1566 OP2 U B 98 28.759 -1.577 28.867 1.00 0.00 O ATOM 1567 O5' U B 98 29.944 0.386 27.842 1.00 0.00 O ATOM 1568 C5' U B 98 30.949 1.396 27.849 1.00 0.00 C ATOM 1569 C4' U B 98 30.997 2.190 26.536 1.00 0.00 C ATOM 1570 O4' U B 98 31.609 1.391 25.524 1.00 0.00 O ATOM 1571 C3' U B 98 29.620 2.629 26.010 1.00 0.00 C ATOM 1572 O3' U B 98 29.747 3.920 25.415 1.00 0.00 O ATOM 1573 C2' U B 98 29.384 1.551 24.947 1.00 0.00 C ATOM 1574 O2' U B 98 28.420 1.916 23.975 1.00 0.00 O ATOM 1575 C1' U B 98 30.786 1.420 24.363 1.00 0.00 C ATOM 1576 N1 U B 98 31.030 0.251 23.458 1.00 0.00 N ATOM 1577 C2 U B 98 32.298 0.160 22.859 1.00 0.00 C ATOM 1578 O2 U B 98 33.201 0.986 23.020 1.00 0.00 O ATOM 1579 N3 U B 98 32.520 -0.901 22.004 1.00 0.00 N ATOM 1580 C4 U B 98 31.587 -1.835 21.623 1.00 0.00 C ATOM 1581 O4 U B 98 31.893 -2.733 20.846 1.00 0.00 O ATOM 1582 C5 U B 98 30.281 -1.642 22.211 1.00 0.00 C ATOM 1583 C6 U B 98 30.033 -0.636 23.091 1.00 0.00 C ATOM 0 H5' U B 98 31.921 0.935 28.026 1.00 0.00 H new ATOM 0 H5'' U B 98 30.765 2.081 28.677 1.00 0.00 H new ATOM 0 H4' U B 98 31.565 3.093 26.759 1.00 0.00 H new ATOM 0 H3' U B 98 28.822 2.710 26.748 1.00 0.00 H new ATOM 0 H2' U B 98 28.968 0.625 25.344 1.00 0.00 H new ATOM 0 HO2' U B 98 27.958 1.113 23.655 1.00 0.00 H new ATOM 0 H1' U B 98 30.992 2.243 23.678 1.00 0.00 H new ATOM 0 H3 U B 98 33.460 -1.000 21.621 1.00 0.00 H new ATOM 0 H5 U B 98 29.480 -2.315 21.944 1.00 0.00 H new ATOM 0 H6 U B 98 29.043 -0.527 23.510 1.00 0.00 H new ATOM 1594 P C B 99 29.235 5.265 26.144 1.00 0.00 P ATOM 1595 OP1 C B 99 30.203 6.340 25.832 1.00 0.00 O ATOM 1596 OP2 C B 99 28.893 4.959 27.551 1.00 0.00 O ATOM 1597 O5' C B 99 27.874 5.573 25.329 1.00 0.00 O ATOM 1598 C5' C B 99 26.754 4.703 25.394 1.00 0.00 C ATOM 1599 C4' C B 99 25.618 5.136 24.458 1.00 0.00 C ATOM 1600 O4' C B 99 24.836 6.167 25.053 1.00 0.00 O ATOM 1601 C3' C B 99 26.068 5.619 23.061 1.00 0.00 C ATOM 1602 O3' C B 99 25.269 4.941 22.096 1.00 0.00 O ATOM 1603 C2' C B 99 25.727 7.119 23.150 1.00 0.00 C ATOM 1604 O2' C B 99 25.488 7.789 21.913 1.00 0.00 O ATOM 1605 C1' C B 99 24.460 7.030 23.998 1.00 0.00 C ATOM 1606 N1 C B 99 23.904 8.336 24.454 1.00 0.00 N ATOM 1607 C2 C B 99 24.616 9.178 25.330 1.00 0.00 C ATOM 1608 O2 C B 99 25.736 8.901 25.764 1.00 0.00 O ATOM 1609 N3 C B 99 24.077 10.359 25.731 1.00 0.00 N ATOM 1610 C4 C B 99 22.888 10.701 25.280 1.00 0.00 C ATOM 1611 N4 C B 99 22.426 11.846 25.706 1.00 0.00 N ATOM 1612 C5 C B 99 22.128 9.902 24.386 1.00 0.00 C ATOM 1613 C6 C B 99 22.672 8.727 23.988 1.00 0.00 C ATOM 0 H5' C B 99 26.383 4.669 26.418 1.00 0.00 H new ATOM 0 H5'' C B 99 27.068 3.692 25.135 1.00 0.00 H new ATOM 0 H4' C B 99 25.036 4.226 24.309 1.00 0.00 H new ATOM 0 H3' C B 99 27.107 5.440 22.786 1.00 0.00 H new ATOM 0 H2' C B 99 26.551 7.716 23.542 1.00 0.00 H new ATOM 0 HO2' C B 99 25.280 8.731 22.086 1.00 0.00 H new ATOM 0 H1' C B 99 23.617 6.652 23.419 1.00 0.00 H new ATOM 0 H41 C B 99 21.511 12.173 25.397 1.00 0.00 H new ATOM 0 H42 C B 99 22.980 12.413 26.348 1.00 0.00 H new ATOM 0 H5 C B 99 21.156 10.218 24.037 1.00 0.00 H new ATOM 0 H6 C B 99 22.133 8.093 23.299 1.00 0.00 H new ATOM 1625 P G B 100 25.685 4.824 20.541 1.00 0.00 P ATOM 1626 OP1 G B 100 26.881 5.653 20.263 1.00 0.00 O ATOM 1627 OP2 G B 100 24.454 4.970 19.733 1.00 0.00 O ATOM 1628 O5' G B 100 26.110 3.270 20.490 1.00 0.00 O ATOM 1629 C5' G B 100 27.360 2.822 20.984 1.00 0.00 C ATOM 1630 C4' G B 100 27.452 1.290 21.038 1.00 0.00 C ATOM 1631 O4' G B 100 26.584 0.732 22.009 1.00 0.00 O ATOM 1632 C3' G B 100 27.185 0.546 19.719 1.00 0.00 C ATOM 1633 O3' G B 100 28.429 0.045 19.247 1.00 0.00 O ATOM 1634 C2' G B 100 26.222 -0.582 20.143 1.00 0.00 C ATOM 1635 O2' G B 100 26.461 -1.851 19.539 1.00 0.00 O ATOM 1636 C1' G B 100 26.399 -0.627 21.658 1.00 0.00 C ATOM 1637 N9 G B 100 25.268 -1.196 22.428 1.00 0.00 N ATOM 1638 C8 G B 100 24.110 -1.789 21.981 1.00 0.00 C ATOM 1639 N7 G B 100 23.320 -2.213 22.932 1.00 0.00 N ATOM 1640 C5 G B 100 24.009 -1.887 24.107 1.00 0.00 C ATOM 1641 C6 G B 100 23.675 -2.079 25.497 1.00 0.00 C ATOM 1642 O6 G B 100 22.665 -2.572 25.996 1.00 0.00 O ATOM 1643 N1 G B 100 24.641 -1.609 26.367 1.00 0.00 N ATOM 1644 C2 G B 100 25.791 -1.018 25.961 1.00 0.00 C ATOM 1645 N2 G B 100 26.612 -0.601 26.890 1.00 0.00 N ATOM 1646 N3 G B 100 26.138 -0.806 24.695 1.00 0.00 N ATOM 1647 C4 G B 100 25.203 -1.265 23.804 1.00 0.00 C ATOM 0 H5' G B 100 27.520 3.228 21.983 1.00 0.00 H new ATOM 0 H5'' G B 100 28.158 3.209 20.351 1.00 0.00 H new ATOM 0 H4' G B 100 28.501 1.141 21.295 1.00 0.00 H new ATOM 0 H3' G B 100 26.759 1.148 18.916 1.00 0.00 H new ATOM 0 H2' G B 100 25.205 -0.371 19.813 1.00 0.00 H new ATOM 0 HO2' G B 100 26.386 -1.769 18.565 1.00 0.00 H new ATOM 0 H1' G B 100 27.224 -1.294 21.906 1.00 0.00 H new ATOM 0 H8 G B 100 23.874 -1.895 20.933 1.00 0.00 H new ATOM 0 H1 G B 100 24.479 -1.713 27.369 1.00 0.00 H new ATOM 0 H21 G B 100 27.489 -0.150 26.630 1.00 0.00 H new ATOM 0 H22 G B 100 26.375 -0.727 27.874 1.00 0.00 H new ATOM 1659 P C B 101 29.124 0.651 17.934 1.00 0.00 P ATOM 1660 OP1 C B 101 30.550 0.255 17.932 1.00 0.00 O ATOM 1661 OP2 C B 101 28.743 2.075 17.795 1.00 0.00 O ATOM 1662 O5' C B 101 28.345 -0.190 16.809 1.00 0.00 O ATOM 1663 C5' C B 101 28.667 -1.552 16.564 1.00 0.00 C ATOM 1664 C4' C B 101 27.596 -2.212 15.694 1.00 0.00 C ATOM 1665 O4' C B 101 26.386 -2.333 16.432 1.00 0.00 O ATOM 1666 C3' C B 101 27.270 -1.451 14.403 1.00 0.00 C ATOM 1667 O3' C B 101 28.122 -1.761 13.312 1.00 0.00 O ATOM 1668 C2' C B 101 25.846 -1.936 14.131 1.00 0.00 C ATOM 1669 O2' C B 101 25.823 -3.179 13.438 1.00 0.00 O ATOM 1670 C1' C B 101 25.292 -2.174 15.540 1.00 0.00 C ATOM 1671 N1 C B 101 24.412 -1.075 16.011 1.00 0.00 N ATOM 1672 C2 C B 101 23.060 -1.379 16.222 1.00 0.00 C ATOM 1673 O2 C B 101 22.660 -2.541 16.311 1.00 0.00 O ATOM 1674 N3 C B 101 22.143 -0.388 16.260 1.00 0.00 N ATOM 1675 C4 C B 101 22.554 0.856 16.210 1.00 0.00 C ATOM 1676 N4 C B 101 21.612 1.745 16.197 1.00 0.00 N ATOM 1677 C5 C B 101 23.921 1.234 16.127 1.00 0.00 C ATOM 1678 C6 C B 101 24.831 0.234 16.039 1.00 0.00 C ATOM 0 H5' C B 101 28.754 -2.086 17.510 1.00 0.00 H new ATOM 0 H5'' C B 101 29.636 -1.619 16.070 1.00 0.00 H new ATOM 0 H4' C B 101 28.013 -3.179 15.412 1.00 0.00 H new ATOM 0 H3' C B 101 27.394 -0.374 14.513 1.00 0.00 H new ATOM 0 H2' C B 101 25.291 -1.224 13.520 1.00 0.00 H new ATOM 0 HO2' C B 101 26.694 -3.335 13.017 1.00 0.00 H new ATOM 0 H1' C B 101 24.675 -3.072 15.510 1.00 0.00 H new ATOM 0 H41 C B 101 21.847 2.737 16.159 1.00 0.00 H new ATOM 0 H42 C B 101 20.635 1.453 16.225 1.00 0.00 H new ATOM 0 H5 C B 101 24.221 2.271 16.134 1.00 0.00 H new ATOM 0 H6 C B 101 25.885 0.465 15.991 1.00 0.00 H new ATOM 1690 P U B 102 29.168 -0.683 12.748 1.00 0.00 P ATOM 1691 OP1 U B 102 29.912 -1.300 11.629 1.00 0.00 O ATOM 1692 OP2 U B 102 29.897 -0.085 13.887 1.00 0.00 O ATOM 1693 O5' U B 102 28.166 0.433 12.153 1.00 0.00 O ATOM 1694 C5' U B 102 27.290 0.151 11.068 1.00 0.00 C ATOM 1695 C4' U B 102 26.709 1.446 10.479 1.00 0.00 C ATOM 1696 O4' U B 102 25.750 1.964 11.392 1.00 0.00 O ATOM 1697 C3' U B 102 27.750 2.538 10.182 1.00 0.00 C ATOM 1698 O3' U B 102 28.157 2.657 8.820 1.00 0.00 O ATOM 1699 C2' U B 102 26.991 3.822 10.550 1.00 0.00 C ATOM 1700 O2' U B 102 26.494 4.515 9.408 1.00 0.00 O ATOM 1701 C1' U B 102 25.780 3.383 11.372 1.00 0.00 C ATOM 1702 N1 U B 102 25.798 3.974 12.735 1.00 0.00 N ATOM 1703 C2 U B 102 25.261 5.259 12.896 1.00 0.00 C ATOM 1704 O2 U B 102 24.817 5.931 11.968 1.00 0.00 O ATOM 1705 N3 U B 102 25.258 5.786 14.170 1.00 0.00 N ATOM 1706 C4 U B 102 25.770 5.172 15.289 1.00 0.00 C ATOM 1707 O4 U B 102 25.737 5.740 16.373 1.00 0.00 O ATOM 1708 C5 U B 102 26.338 3.863 15.041 1.00 0.00 C ATOM 1709 C6 U B 102 26.346 3.303 13.804 1.00 0.00 C ATOM 0 H5' U B 102 26.480 -0.494 11.408 1.00 0.00 H new ATOM 0 H5'' U B 102 27.828 -0.395 10.294 1.00 0.00 H new ATOM 0 H4' U B 102 26.270 1.178 9.518 1.00 0.00 H new ATOM 0 H3' U B 102 28.670 2.321 10.724 1.00 0.00 H new ATOM 0 H2' U B 102 27.671 4.491 11.078 1.00 0.00 H new ATOM 0 HO2' U B 102 26.883 4.128 8.596 1.00 0.00 H new ATOM 0 H1' U B 102 24.863 3.751 10.911 1.00 0.00 H new ATOM 0 H3 U B 102 24.841 6.709 14.293 1.00 0.00 H new ATOM 0 H5 U B 102 26.769 3.315 15.866 1.00 0.00 H new ATOM 0 H6 U B 102 26.784 2.327 13.659 1.00 0.00 H new ATOM 1720 P U B 103 29.216 1.687 8.084 1.00 0.00 P ATOM 1721 OP1 U B 103 29.646 0.622 9.014 1.00 0.00 O ATOM 1722 OP2 U B 103 30.227 2.546 7.430 1.00 0.00 O ATOM 1723 O5' U B 103 28.294 1.039 6.924 1.00 0.00 O ATOM 1724 C5' U B 103 27.461 -0.092 7.135 1.00 0.00 C ATOM 1725 C4' U B 103 26.112 0.054 6.418 1.00 0.00 C ATOM 1726 O4' U B 103 25.275 1.015 7.056 1.00 0.00 O ATOM 1727 C3' U B 103 26.183 0.494 4.956 1.00 0.00 C ATOM 1728 O3' U B 103 26.634 -0.509 4.061 1.00 0.00 O ATOM 1729 C2' U B 103 24.732 0.890 4.740 1.00 0.00 C ATOM 1730 O2' U B 103 23.881 -0.217 4.451 1.00 0.00 O ATOM 1731 C1' U B 103 24.332 1.489 6.092 1.00 0.00 C ATOM 1732 N1 U B 103 24.199 2.977 5.992 1.00 0.00 N ATOM 1733 C2 U B 103 25.307 3.833 6.155 1.00 0.00 C ATOM 1734 O2 U B 103 26.468 3.466 6.307 1.00 0.00 O ATOM 1735 N3 U B 103 25.071 5.190 6.082 1.00 0.00 N ATOM 1736 C4 U B 103 23.871 5.784 5.779 1.00 0.00 C ATOM 1737 O4 U B 103 23.791 7.005 5.705 1.00 0.00 O ATOM 1738 C5 U B 103 22.792 4.852 5.549 1.00 0.00 C ATOM 1739 C6 U B 103 22.971 3.508 5.656 1.00 0.00 C ATOM 0 H5' U B 103 27.292 -0.225 8.204 1.00 0.00 H new ATOM 0 H5'' U B 103 27.968 -0.989 6.778 1.00 0.00 H new ATOM 0 H4' U B 103 25.716 -0.960 6.467 1.00 0.00 H new ATOM 0 H3' U B 103 26.913 1.279 4.760 1.00 0.00 H new ATOM 0 H2' U B 103 24.631 1.561 3.887 1.00 0.00 H new ATOM 0 HO2' U B 103 24.398 -0.918 4.002 1.00 0.00 H new ATOM 0 H1' U B 103 23.343 1.167 6.419 1.00 0.00 H new ATOM 0 H3 U B 103 25.860 5.809 6.270 1.00 0.00 H new ATOM 0 H5 U B 103 21.816 5.233 5.285 1.00 0.00 H new ATOM 0 H6 U B 103 22.138 2.845 5.475 1.00 0.00 H new ATOM 1750 P U B 104 27.225 -0.129 2.609 1.00 0.00 P ATOM 1751 OP1 U B 104 28.524 -0.819 2.475 1.00 0.00 O ATOM 1752 OP2 U B 104 27.152 1.336 2.418 1.00 0.00 O ATOM 1753 O5' U B 104 26.163 -0.800 1.590 1.00 0.00 O ATOM 1754 C5' U B 104 25.904 -2.197 1.593 1.00 0.00 C ATOM 1755 C4' U B 104 25.465 -2.714 0.211 1.00 0.00 C ATOM 1756 O4' U B 104 24.103 -2.360 -0.025 1.00 0.00 O ATOM 1757 C3' U B 104 26.233 -2.187 -1.016 1.00 0.00 C ATOM 1758 O3' U B 104 27.455 -2.812 -1.414 1.00 0.00 O ATOM 1759 C2' U B 104 25.222 -2.545 -2.114 1.00 0.00 C ATOM 1760 O2' U B 104 25.326 -3.906 -2.535 1.00 0.00 O ATOM 1761 C1' U B 104 23.863 -2.368 -1.430 1.00 0.00 C ATOM 1762 N1 U B 104 23.219 -1.122 -1.932 1.00 0.00 N ATOM 1763 C2 U B 104 22.517 -1.199 -3.145 1.00 0.00 C ATOM 1764 O2 U B 104 22.267 -2.256 -3.727 1.00 0.00 O ATOM 1765 N3 U B 104 22.104 -0.010 -3.708 1.00 0.00 N ATOM 1766 C4 U B 104 22.271 1.237 -3.157 1.00 0.00 C ATOM 1767 O4 U B 104 21.823 2.225 -3.730 1.00 0.00 O ATOM 1768 C5 U B 104 22.965 1.240 -1.888 1.00 0.00 C ATOM 1769 C6 U B 104 23.426 0.095 -1.318 1.00 0.00 C ATOM 0 H5' U B 104 25.127 -2.418 2.325 1.00 0.00 H new ATOM 0 H5'' U B 104 26.801 -2.730 1.909 1.00 0.00 H new ATOM 0 H4' U B 104 25.662 -3.783 0.285 1.00 0.00 H new ATOM 0 H3' U B 104 26.539 -1.160 -0.816 1.00 0.00 H new ATOM 0 H2' U B 104 25.381 -1.929 -2.999 1.00 0.00 H new ATOM 0 HO2' U B 104 26.246 -4.219 -2.406 1.00 0.00 H new ATOM 0 H1' U B 104 23.169 -3.177 -1.655 1.00 0.00 H new ATOM 0 H3 U B 104 21.634 -0.061 -4.612 1.00 0.00 H new ATOM 0 H5 U B 104 23.122 2.179 -1.378 1.00 0.00 H new ATOM 0 H6 U B 104 23.957 0.139 -0.379 1.00 0.00 H new ATOM 1780 P U B 105 28.867 -2.590 -0.683 1.00 0.00 P ATOM 1781 OP1 U B 105 29.918 -3.104 -1.589 1.00 0.00 O ATOM 1782 OP2 U B 105 28.776 -3.124 0.690 1.00 0.00 O ATOM 1783 O5' U B 105 28.976 -0.976 -0.627 1.00 0.00 O ATOM 1784 C5' U B 105 29.454 -0.218 -1.732 1.00 0.00 C ATOM 1785 C4' U B 105 29.987 1.169 -1.331 1.00 0.00 C ATOM 1786 O4' U B 105 29.149 2.260 -1.682 1.00 0.00 O ATOM 1787 C3' U B 105 30.375 1.364 0.150 1.00 0.00 C ATOM 1788 O3' U B 105 31.788 1.305 0.315 1.00 0.00 O ATOM 1789 C2' U B 105 29.852 2.783 0.442 1.00 0.00 C ATOM 1790 O2' U B 105 30.730 3.552 1.259 1.00 0.00 O ATOM 1791 C1' U B 105 29.692 3.357 -0.962 1.00 0.00 C ATOM 1792 N1 U B 105 28.944 4.649 -0.993 1.00 0.00 N ATOM 1793 C2 U B 105 27.540 4.692 -1.084 1.00 0.00 C ATOM 1794 O2 U B 105 26.804 3.705 -1.069 1.00 0.00 O ATOM 1795 N3 U B 105 26.964 5.945 -1.183 1.00 0.00 N ATOM 1796 C4 U B 105 27.629 7.148 -1.128 1.00 0.00 C ATOM 1797 O4 U B 105 27.011 8.205 -1.212 1.00 0.00 O ATOM 1798 C5 U B 105 29.060 7.030 -0.974 1.00 0.00 C ATOM 1799 C6 U B 105 29.671 5.818 -0.912 1.00 0.00 C ATOM 0 H5' U B 105 28.648 -0.095 -2.456 1.00 0.00 H new ATOM 0 H5'' U B 105 30.248 -0.775 -2.230 1.00 0.00 H new ATOM 0 H4' U B 105 30.897 1.178 -1.931 1.00 0.00 H new ATOM 0 H3' U B 105 29.968 0.600 0.813 1.00 0.00 H new ATOM 0 H2' U B 105 28.930 2.789 1.023 1.00 0.00 H new ATOM 0 HO2' U B 105 31.630 3.166 1.226 1.00 0.00 H new ATOM 0 H1' U B 105 30.617 3.694 -1.429 1.00 0.00 H new ATOM 0 H3 U B 105 25.952 5.981 -1.308 1.00 0.00 H new ATOM 0 H5 U B 105 29.659 7.926 -0.907 1.00 0.00 H new ATOM 0 H6 U B 105 30.744 5.769 -0.797 1.00 0.00 H new ATOM 1810 P C B 106 32.548 -0.087 0.617 1.00 0.00 P ATOM 1811 OP1 C B 106 31.697 -0.910 1.505 1.00 0.00 O ATOM 1812 OP2 C B 106 33.933 0.246 1.016 1.00 0.00 O ATOM 1813 O5' C B 106 32.584 -0.784 -0.838 1.00 0.00 O ATOM 1814 C5' C B 106 33.315 -0.223 -1.916 1.00 0.00 C ATOM 1815 C4' C B 106 34.033 -1.287 -2.752 1.00 0.00 C ATOM 1816 O4' C B 106 35.151 -1.767 -2.019 1.00 0.00 O ATOM 1817 C3' C B 106 33.142 -2.492 -3.124 1.00 0.00 C ATOM 1818 O3' C B 106 33.347 -2.933 -4.465 1.00 0.00 O ATOM 1819 C2' C B 106 33.660 -3.553 -2.138 1.00 0.00 C ATOM 1820 O2' C B 106 33.465 -4.907 -2.542 1.00 0.00 O ATOM 1821 C1' C B 106 35.141 -3.180 -2.101 1.00 0.00 C ATOM 1822 N1 C B 106 35.933 -3.824 -1.013 1.00 0.00 N ATOM 1823 C2 C B 106 35.669 -3.561 0.345 1.00 0.00 C ATOM 1824 O2 C B 106 34.742 -2.842 0.724 1.00 0.00 O ATOM 1825 N3 C B 106 36.439 -4.121 1.314 1.00 0.00 N ATOM 1826 C4 C B 106 37.419 -4.925 0.960 1.00 0.00 C ATOM 1827 N4 C B 106 38.120 -5.430 1.938 1.00 0.00 N ATOM 1828 C5 C B 106 37.711 -5.262 -0.389 1.00 0.00 C ATOM 1829 C6 C B 106 36.943 -4.693 -1.351 1.00 0.00 C ATOM 0 H5' C B 106 34.047 0.484 -1.526 1.00 0.00 H new ATOM 0 H5'' C B 106 32.637 0.342 -2.556 1.00 0.00 H new ATOM 0 H4' C B 106 34.327 -0.806 -3.685 1.00 0.00 H new ATOM 0 H3' C B 106 32.076 -2.272 -3.065 1.00 0.00 H new ATOM 0 H2' C B 106 33.134 -3.537 -1.183 1.00 0.00 H new ATOM 0 HO2' C B 106 33.274 -4.937 -3.503 1.00 0.00 H new ATOM 0 H1' C B 106 35.645 -3.556 -2.991 1.00 0.00 H new ATOM 0 H41 C B 106 38.895 -6.062 1.737 1.00 0.00 H new ATOM 0 H42 C B 106 37.893 -5.193 2.904 1.00 0.00 H new ATOM 0 H5 C B 106 38.511 -5.943 -0.638 1.00 0.00 H new ATOM 0 H6 C B 106 37.126 -4.924 -2.390 1.00 0.00 H new ATOM 1841 P C B 107 32.924 -2.060 -5.751 1.00 0.00 P ATOM 1842 OP1 C B 107 32.005 -0.982 -5.323 1.00 0.00 O ATOM 1843 OP2 C B 107 32.547 -2.982 -6.845 1.00 0.00 O ATOM 1844 O5' C B 107 34.346 -1.387 -6.111 1.00 0.00 O ATOM 1845 C5' C B 107 35.472 -2.194 -6.440 1.00 0.00 C ATOM 1846 C4' C B 107 36.712 -1.359 -6.784 1.00 0.00 C ATOM 1847 O4' C B 107 36.632 -0.871 -8.119 1.00 0.00 O ATOM 1848 C3' C B 107 36.938 -0.153 -5.851 1.00 0.00 C ATOM 1849 O3' C B 107 38.248 -0.187 -5.299 1.00 0.00 O ATOM 1850 C2' C B 107 36.776 1.038 -6.803 1.00 0.00 C ATOM 1851 O2' C B 107 37.564 2.164 -6.438 1.00 0.00 O ATOM 1852 C1' C B 107 37.198 0.428 -8.139 1.00 0.00 C ATOM 1853 N1 C B 107 36.707 1.210 -9.308 1.00 0.00 N ATOM 1854 C2 C B 107 37.632 1.885 -10.119 1.00 0.00 C ATOM 1855 O2 C B 107 38.848 1.811 -9.925 1.00 0.00 O ATOM 1856 N3 C B 107 37.206 2.645 -11.163 1.00 0.00 N ATOM 1857 C4 C B 107 35.912 2.730 -11.395 1.00 0.00 C ATOM 1858 N4 C B 107 35.565 3.471 -12.412 1.00 0.00 N ATOM 1859 C5 C B 107 34.926 2.066 -10.614 1.00 0.00 C ATOM 1860 C6 C B 107 35.362 1.311 -9.573 1.00 0.00 C ATOM 0 H5' C B 107 35.222 -2.833 -7.287 1.00 0.00 H new ATOM 0 H5'' C B 107 35.702 -2.851 -5.601 1.00 0.00 H new ATOM 0 H4' C B 107 37.554 -2.040 -6.657 1.00 0.00 H new ATOM 0 H3' C B 107 36.258 -0.123 -4.999 1.00 0.00 H new ATOM 0 H2' C B 107 35.768 1.452 -6.807 1.00 0.00 H new ATOM 0 HO2' C B 107 38.256 1.887 -5.802 1.00 0.00 H new ATOM 0 H1' C B 107 38.282 0.420 -8.251 1.00 0.00 H new ATOM 0 H41 C B 107 34.579 3.582 -12.650 1.00 0.00 H new ATOM 0 H42 C B 107 36.280 3.939 -12.969 1.00 0.00 H new ATOM 0 H5 C B 107 33.874 2.159 -10.840 1.00 0.00 H new ATOM 0 H6 C B 107 34.650 0.788 -8.951 1.00 0.00 H new ATOM 1872 P C B 108 38.500 -0.883 -3.873 1.00 0.00 P ATOM 1873 OP1 C B 108 39.957 -0.934 -3.622 1.00 0.00 O ATOM 1874 OP2 C B 108 37.687 -2.116 -3.805 1.00 0.00 O ATOM 1875 O5' C B 108 37.836 0.243 -2.927 1.00 0.00 O ATOM 1876 C5' C B 108 38.599 1.333 -2.428 1.00 0.00 C ATOM 1877 C4' C B 108 37.786 2.265 -1.519 1.00 0.00 C ATOM 1878 O4' C B 108 37.101 3.241 -2.300 1.00 0.00 O ATOM 1879 C3' C B 108 36.743 1.582 -0.620 1.00 0.00 C ATOM 1880 O3' C B 108 37.208 1.098 0.636 1.00 0.00 O ATOM 1881 C2' C B 108 35.782 2.756 -0.388 1.00 0.00 C ATOM 1882 O2' C B 108 36.239 3.631 0.642 1.00 0.00 O ATOM 1883 C1' C B 108 35.830 3.518 -1.717 1.00 0.00 C ATOM 1884 N1 C B 108 34.708 3.124 -2.626 1.00 0.00 N ATOM 1885 C2 C B 108 33.436 3.672 -2.398 1.00 0.00 C ATOM 1886 O2 C B 108 33.225 4.478 -1.491 1.00 0.00 O ATOM 1887 N3 C B 108 32.382 3.313 -3.173 1.00 0.00 N ATOM 1888 C4 C B 108 32.580 2.470 -4.163 1.00 0.00 C ATOM 1889 N4 C B 108 31.516 2.123 -4.828 1.00 0.00 N ATOM 1890 C5 C B 108 33.844 1.895 -4.459 1.00 0.00 C ATOM 1891 C6 C B 108 34.892 2.250 -3.672 1.00 0.00 C ATOM 0 H5' C B 108 38.995 1.906 -3.266 1.00 0.00 H new ATOM 0 H5'' C B 108 39.454 0.947 -1.873 1.00 0.00 H new ATOM 0 H4' C B 108 38.535 2.702 -0.858 1.00 0.00 H new ATOM 0 H3' C B 108 36.349 0.679 -1.086 1.00 0.00 H new ATOM 0 H2' C B 108 34.794 2.407 -0.089 1.00 0.00 H new ATOM 0 HO2' C B 108 36.792 3.129 1.277 1.00 0.00 H new ATOM 0 H1' C B 108 35.706 4.588 -1.550 1.00 0.00 H new ATOM 0 H41 C B 108 31.593 1.472 -5.610 1.00 0.00 H new ATOM 0 H42 C B 108 30.606 2.502 -4.567 1.00 0.00 H new ATOM 0 H5 C B 108 33.967 1.202 -5.278 1.00 0.00 H new ATOM 0 H6 C B 108 35.874 1.845 -3.868 1.00 0.00 H new ATOM 1903 P C B 109 38.026 -0.281 0.792 1.00 0.00 P ATOM 1904 OP1 C B 109 37.677 -1.198 -0.313 1.00 0.00 O ATOM 1905 OP2 C B 109 37.902 -0.735 2.196 1.00 0.00 O ATOM 1906 O5' C B 109 39.543 0.214 0.549 1.00 0.00 O ATOM 1907 C5' C B 109 40.253 0.948 1.538 1.00 0.00 C ATOM 1908 C4' C B 109 41.742 1.084 1.187 1.00 0.00 C ATOM 1909 O4' C B 109 42.356 -0.204 1.193 1.00 0.00 O ATOM 1910 C3' C B 109 41.993 1.730 -0.186 1.00 0.00 C ATOM 1911 O3' C B 109 43.126 2.598 -0.115 1.00 0.00 O ATOM 1912 C2' C B 109 42.280 0.508 -1.067 1.00 0.00 C ATOM 1913 O2' C B 109 43.105 0.797 -2.192 1.00 0.00 O ATOM 1914 C1' C B 109 42.955 -0.442 -0.074 1.00 0.00 C ATOM 1915 N1 C B 109 42.810 -1.873 -0.473 1.00 0.00 N ATOM 1916 C2 C B 109 43.958 -2.615 -0.793 1.00 0.00 C ATOM 1917 O2 C B 109 45.092 -2.138 -0.696 1.00 0.00 O ATOM 1918 N3 C B 109 43.851 -3.899 -1.222 1.00 0.00 N ATOM 1919 C4 C B 109 42.650 -4.430 -1.329 1.00 0.00 C ATOM 1920 N4 C B 109 42.612 -5.666 -1.748 1.00 0.00 N ATOM 1921 C5 C B 109 41.450 -3.735 -1.015 1.00 0.00 C ATOM 1922 C6 C B 109 41.569 -2.453 -0.586 1.00 0.00 C ATOM 0 H5' C B 109 40.151 0.451 2.503 1.00 0.00 H new ATOM 0 H5'' C B 109 39.812 1.939 1.642 1.00 0.00 H new ATOM 0 H4' C B 109 42.173 1.739 1.944 1.00 0.00 H new ATOM 0 H3' C B 109 41.171 2.343 -0.556 1.00 0.00 H new ATOM 0 H2' C B 109 41.383 0.100 -1.534 1.00 0.00 H new ATOM 0 HO2' C B 109 43.251 -0.022 -2.710 1.00 0.00 H new ATOM 0 HO3' C B 109 43.715 2.430 -0.880 1.00 0.00 H new ATOM 0 H1' C B 109 44.028 -0.251 -0.047 1.00 0.00 H new ATOM 0 H41 C B 109 41.716 -6.141 -1.855 1.00 0.00 H new ATOM 0 H42 C B 109 43.479 -6.157 -1.969 1.00 0.00 H new ATOM 0 H5 C B 109 40.484 -4.208 -1.114 1.00 0.00 H new ATOM 0 H6 C B 109 40.685 -1.886 -0.332 1.00 0.00 H new TER 1934 C B 109 HETATM 1935 ZN ZN A 101 0.617 3.881 19.742 1.00 0.00 ZN HETATM 1936 ZN ZN A 102 18.578 -5.869 19.285 1.00 0.00 ZN