USER MOD reduce.3.24.130724 H: found=0, std=0, add=894, rem=0, adj=39 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: B 102 U O2' : rot -75:sc= 1.08 USER MOD Set 1.2: B 109 C O2' : rot 180:sc= 0.832 USER MOD Set 2.1: A 67 LYS NZ :NH3+ -157:sc= 0.272 (180deg=0.155) USER MOD Set 2.2: A 68 TYR OH : rot 25:sc= 0.297 USER MOD Set 2.3: B 99 C O2' : rot 140:sc= 0.665 USER MOD Set 2.4: B 100 G O2' : rot 27:sc= 0.3 USER MOD Set 3.1: A 89 GLN : amide:sc= 1.77 K(o=3.5,f=0.88) USER MOD Set 3.2: A 92 ASN : amide:sc= 0.953 K(o=3.5,f=1.7) USER MOD Set 3.3: B 107 C O2' : rot -14:sc= 0.774 USER MOD Set 4.1: A 56 SER OG : rot 144:sc= 0.00626 USER MOD Set 4.2: A 76 LYS NZ :NH3+ -167:sc= 0.422 (180deg=0.339) USER MOD Set 5.1: A 40 SER OG : rot -54:sc= 0.629 USER MOD Set 5.2: A 43 CYS SG : rot 180:sc= 0.85 USER MOD Single : A 1 MET CE :methyl 171:sc= 0 (180deg=-0.0841) USER MOD Single : A 1 MET N :NH3+ 169:sc= 0.775 (180deg=0.547) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.00673 USER MOD Single : A 12 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000755) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.00698 USER MOD Single : A 23 GLN :FLIP amide:sc= 0 F(o=-1.2!,f=0) USER MOD Single : A 26 THR OG1 : rot 160:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.0191 USER MOD Single : A 35 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0528) USER MOD Single : A 41 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00499) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= 0.35 K(o=0.35,f=-4!) USER MOD Single : A 47 ASN : amide:sc= -0.129 X(o=-0.13,f=-0.59) USER MOD Single : A 58 LYS NZ :NH3+ -134:sc= 0.232 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -0.0447 K(o=-0.045,f=-0.6) USER MOD Single : A 74 HIS : no HD1:sc= -0.174 X(o=-0.17,f=-0.00032) USER MOD Single : A 77 THR OG1 : rot 73:sc= 0.671 USER MOD Single : A 78 GLN : amide:sc= -0.106 X(o=-0.11,f=-0.11) USER MOD Single : A 82 ASN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : A 85 ASN : amide:sc= 1.06 K(o=1.1,f=0) USER MOD Single : A 86 ASN : amide:sc= 1.04 K(o=1,f=-0.49) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 95 G O2' : rot -103:sc= 0.162 USER MOD Single : B 96 U O2' : rot -31:sc= 0.269 USER MOD Single : B 97 C O2' : rot 35:sc= 0.205 USER MOD Single : B 98 U O2' : rot 30:sc= 0.137 USER MOD Single : B 101 C O2' : rot -19:sc= 0.158 USER MOD Single : B 103 U O2' : rot -167:sc= 1.35 USER MOD Single : B 104 U O2' : rot -23:sc= 0.148 USER MOD Single : B 105 U O2' : rot 24:sc= 0.0929 USER MOD Single : B 106 C O2' : rot -28:sc= 0.148 USER MOD Single : B 108 C O2' : rot -29:sc= 0.248 USER MOD Single : B 109 C O3' : rot 103:sc= 0.833 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 37.515 15.567 -3.291 1.00 0.00 N ATOM 2 CA MET A 1 37.842 16.879 -3.860 1.00 0.00 C ATOM 3 C MET A 1 36.593 17.673 -4.301 1.00 0.00 C ATOM 4 O MET A 1 36.690 18.860 -4.623 1.00 0.00 O ATOM 5 CB MET A 1 38.818 16.716 -5.043 1.00 0.00 C ATOM 6 CG MET A 1 40.221 16.224 -4.647 1.00 0.00 C ATOM 7 SD MET A 1 40.401 14.497 -4.098 1.00 0.00 S ATOM 8 CE MET A 1 39.992 13.607 -5.626 1.00 0.00 C ATOM 0 H1 MET A 1 38.385 15.007 -3.186 1.00 0.00 H new ATOM 0 H2 MET A 1 37.071 15.694 -2.359 1.00 0.00 H new ATOM 0 H3 MET A 1 36.857 15.069 -3.923 1.00 0.00 H new ATOM 0 HA MET A 1 38.317 17.458 -3.068 1.00 0.00 H new ATOM 0 HB2 MET A 1 38.389 16.014 -5.758 1.00 0.00 H new ATOM 0 HB3 MET A 1 38.913 17.674 -5.554 1.00 0.00 H new ATOM 0 HG2 MET A 1 40.880 16.372 -5.502 1.00 0.00 H new ATOM 0 HG3 MET A 1 40.587 16.868 -3.847 1.00 0.00 H new ATOM 0 HE1 MET A 1 40.211 12.547 -5.499 1.00 0.00 H new ATOM 0 HE2 MET A 1 38.933 13.735 -5.849 1.00 0.00 H new ATOM 0 HE3 MET A 1 40.586 14.004 -6.449 1.00 0.00 H new ATOM 18 N ALA A 2 35.424 17.024 -4.312 1.00 0.00 N ATOM 19 CA ALA A 2 34.125 17.590 -4.709 1.00 0.00 C ATOM 20 C ALA A 2 32.948 17.100 -3.828 1.00 0.00 C ATOM 21 O ALA A 2 31.780 17.256 -4.200 1.00 0.00 O ATOM 22 CB ALA A 2 33.914 17.267 -6.197 1.00 0.00 C ATOM 0 H ALA A 2 35.351 16.046 -4.032 1.00 0.00 H new ATOM 0 HA ALA A 2 34.142 18.669 -4.555 1.00 0.00 H new ATOM 0 HB1 ALA A 2 32.957 17.673 -6.525 1.00 0.00 H new ATOM 0 HB2 ALA A 2 34.718 17.712 -6.783 1.00 0.00 H new ATOM 0 HB3 ALA A 2 33.917 16.186 -6.339 1.00 0.00 H new ATOM 28 N VAL A 3 33.243 16.512 -2.661 1.00 0.00 N ATOM 29 CA VAL A 3 32.272 15.969 -1.688 1.00 0.00 C ATOM 30 C VAL A 3 32.668 16.317 -0.244 1.00 0.00 C ATOM 31 O VAL A 3 33.816 16.681 0.027 1.00 0.00 O ATOM 32 CB VAL A 3 32.110 14.436 -1.838 1.00 0.00 C ATOM 33 CG1 VAL A 3 31.536 14.054 -3.207 1.00 0.00 C ATOM 34 CG2 VAL A 3 33.418 13.657 -1.630 1.00 0.00 C ATOM 0 H VAL A 3 34.207 16.394 -2.351 1.00 0.00 H new ATOM 0 HA VAL A 3 31.313 16.438 -1.906 1.00 0.00 H new ATOM 0 HB VAL A 3 31.414 14.156 -1.047 1.00 0.00 H new ATOM 0 HG11 VAL A 3 31.438 12.970 -3.271 1.00 0.00 H new ATOM 0 HG12 VAL A 3 30.556 14.515 -3.332 1.00 0.00 H new ATOM 0 HG13 VAL A 3 32.205 14.405 -3.993 1.00 0.00 H new ATOM 0 HG21 VAL A 3 33.229 12.590 -1.750 1.00 0.00 H new ATOM 0 HG22 VAL A 3 34.155 13.980 -2.365 1.00 0.00 H new ATOM 0 HG23 VAL A 3 33.799 13.847 -0.627 1.00 0.00 H new ATOM 44 N SER A 4 31.723 16.195 0.690 1.00 0.00 N ATOM 45 CA SER A 4 31.910 16.463 2.125 1.00 0.00 C ATOM 46 C SER A 4 31.020 15.559 2.991 1.00 0.00 C ATOM 47 O SER A 4 29.993 15.048 2.533 1.00 0.00 O ATOM 48 CB SER A 4 31.645 17.945 2.436 1.00 0.00 C ATOM 49 OG SER A 4 30.328 18.333 2.073 1.00 0.00 O ATOM 0 H SER A 4 30.774 15.897 0.465 1.00 0.00 H new ATOM 0 HA SER A 4 32.947 16.235 2.372 1.00 0.00 H new ATOM 0 HB2 SER A 4 31.797 18.126 3.500 1.00 0.00 H new ATOM 0 HB3 SER A 4 32.366 18.563 1.902 1.00 0.00 H new ATOM 0 HG SER A 4 30.195 19.280 2.287 1.00 0.00 H new ATOM 55 N VAL A 5 31.422 15.352 4.251 1.00 0.00 N ATOM 56 CA VAL A 5 30.751 14.467 5.218 1.00 0.00 C ATOM 57 C VAL A 5 30.700 15.074 6.624 1.00 0.00 C ATOM 58 O VAL A 5 31.595 15.814 7.039 1.00 0.00 O ATOM 59 CB VAL A 5 31.425 13.073 5.210 1.00 0.00 C ATOM 60 CG1 VAL A 5 32.933 13.114 5.502 1.00 0.00 C ATOM 61 CG2 VAL A 5 30.790 12.076 6.186 1.00 0.00 C ATOM 0 H VAL A 5 32.247 15.808 4.640 1.00 0.00 H new ATOM 0 HA VAL A 5 29.713 14.350 4.908 1.00 0.00 H new ATOM 0 HB VAL A 5 31.263 12.733 4.187 1.00 0.00 H new ATOM 0 HG11 VAL A 5 33.336 12.101 5.480 1.00 0.00 H new ATOM 0 HG12 VAL A 5 33.433 13.720 4.747 1.00 0.00 H new ATOM 0 HG13 VAL A 5 33.101 13.550 6.487 1.00 0.00 H new ATOM 0 HG21 VAL A 5 31.315 11.122 6.125 1.00 0.00 H new ATOM 0 HG22 VAL A 5 30.862 12.465 7.202 1.00 0.00 H new ATOM 0 HG23 VAL A 5 29.741 11.931 5.927 1.00 0.00 H new ATOM 71 N THR A 6 29.636 14.752 7.361 1.00 0.00 N ATOM 72 CA THR A 6 29.384 15.201 8.741 1.00 0.00 C ATOM 73 C THR A 6 30.481 14.684 9.697 1.00 0.00 C ATOM 74 O THR A 6 30.836 13.505 9.606 1.00 0.00 O ATOM 75 CB THR A 6 28.011 14.679 9.209 1.00 0.00 C ATOM 76 OG1 THR A 6 27.029 14.977 8.234 1.00 0.00 O ATOM 77 CG2 THR A 6 27.537 15.317 10.516 1.00 0.00 C ATOM 0 H THR A 6 28.895 14.149 7.004 1.00 0.00 H new ATOM 0 HA THR A 6 29.394 16.291 8.757 1.00 0.00 H new ATOM 0 HB THR A 6 28.136 13.607 9.362 1.00 0.00 H new ATOM 0 HG1 THR A 6 26.158 14.642 8.534 1.00 0.00 H new ATOM 0 HG21 THR A 6 26.565 14.906 10.790 1.00 0.00 H new ATOM 0 HG22 THR A 6 28.257 15.104 11.307 1.00 0.00 H new ATOM 0 HG23 THR A 6 27.451 16.396 10.384 1.00 0.00 H new ATOM 85 N PRO A 7 31.024 15.508 10.622 1.00 0.00 N ATOM 86 CA PRO A 7 32.058 15.090 11.585 1.00 0.00 C ATOM 87 C PRO A 7 31.736 13.820 12.394 1.00 0.00 C ATOM 88 O PRO A 7 32.638 13.061 12.752 1.00 0.00 O ATOM 89 CB PRO A 7 32.225 16.280 12.537 1.00 0.00 C ATOM 90 CG PRO A 7 31.836 17.481 11.683 1.00 0.00 C ATOM 91 CD PRO A 7 30.717 16.922 10.809 1.00 0.00 C ATOM 0 HA PRO A 7 32.959 14.826 11.031 1.00 0.00 H new ATOM 0 HB2 PRO A 7 31.583 16.186 13.413 1.00 0.00 H new ATOM 0 HB3 PRO A 7 33.249 16.362 12.901 1.00 0.00 H new ATOM 0 HG2 PRO A 7 31.494 18.318 12.292 1.00 0.00 H new ATOM 0 HG3 PRO A 7 32.674 17.842 11.087 1.00 0.00 H new ATOM 0 HD2 PRO A 7 29.746 17.051 11.288 1.00 0.00 H new ATOM 0 HD3 PRO A 7 30.672 17.442 9.852 1.00 0.00 H new ATOM 99 N ILE A 8 30.448 13.602 12.682 1.00 0.00 N ATOM 100 CA ILE A 8 29.891 12.469 13.439 1.00 0.00 C ATOM 101 C ILE A 8 28.889 11.648 12.612 1.00 0.00 C ATOM 102 O ILE A 8 28.318 12.138 11.634 1.00 0.00 O ATOM 103 CB ILE A 8 29.250 12.954 14.761 1.00 0.00 C ATOM 104 CG1 ILE A 8 28.110 13.972 14.514 1.00 0.00 C ATOM 105 CG2 ILE A 8 30.347 13.513 15.681 1.00 0.00 C ATOM 106 CD1 ILE A 8 27.291 14.302 15.765 1.00 0.00 C ATOM 0 H ILE A 8 29.721 14.249 12.376 1.00 0.00 H new ATOM 0 HA ILE A 8 30.722 11.806 13.678 1.00 0.00 H new ATOM 0 HB ILE A 8 28.780 12.106 15.259 1.00 0.00 H new ATOM 0 HG12 ILE A 8 28.538 14.893 14.119 1.00 0.00 H new ATOM 0 HG13 ILE A 8 27.442 13.576 13.749 1.00 0.00 H new ATOM 0 HG21 ILE A 8 29.900 13.856 16.614 1.00 0.00 H new ATOM 0 HG22 ILE A 8 31.076 12.731 15.894 1.00 0.00 H new ATOM 0 HG23 ILE A 8 30.844 14.349 15.188 1.00 0.00 H new ATOM 0 HD11 ILE A 8 26.512 15.021 15.511 1.00 0.00 H new ATOM 0 HD12 ILE A 8 26.832 13.391 16.150 1.00 0.00 H new ATOM 0 HD13 ILE A 8 27.945 14.729 16.526 1.00 0.00 H new ATOM 118 N ARG A 9 28.649 10.400 13.038 1.00 0.00 N ATOM 119 CA ARG A 9 27.673 9.474 12.432 1.00 0.00 C ATOM 120 C ARG A 9 26.258 10.053 12.498 1.00 0.00 C ATOM 121 O ARG A 9 25.817 10.501 13.558 1.00 0.00 O ATOM 122 CB ARG A 9 27.702 8.124 13.166 1.00 0.00 C ATOM 123 CG ARG A 9 28.947 7.290 12.844 1.00 0.00 C ATOM 124 CD ARG A 9 28.986 6.039 13.723 1.00 0.00 C ATOM 125 NE ARG A 9 30.080 5.142 13.321 1.00 0.00 N ATOM 126 CZ ARG A 9 30.264 3.906 13.748 1.00 0.00 C ATOM 127 NH1 ARG A 9 29.484 3.341 14.629 1.00 0.00 N ATOM 128 NH2 ARG A 9 31.252 3.191 13.287 1.00 0.00 N ATOM 0 H ARG A 9 29.140 9.993 13.834 1.00 0.00 H new ATOM 0 HA ARG A 9 27.947 9.331 11.387 1.00 0.00 H new ATOM 0 HB2 ARG A 9 27.659 8.301 14.241 1.00 0.00 H new ATOM 0 HB3 ARG A 9 26.812 7.554 12.901 1.00 0.00 H new ATOM 0 HG2 ARG A 9 28.940 7.004 11.792 1.00 0.00 H new ATOM 0 HG3 ARG A 9 29.845 7.886 13.007 1.00 0.00 H new ATOM 0 HD2 ARG A 9 29.113 6.328 14.766 1.00 0.00 H new ATOM 0 HD3 ARG A 9 28.035 5.512 13.652 1.00 0.00 H new ATOM 0 HE ARG A 9 30.758 5.508 12.652 1.00 0.00 H new ATOM 0 HH11 ARG A 9 28.694 3.857 15.016 1.00 0.00 H new ATOM 0 HH12 ARG A 9 29.664 2.383 14.930 1.00 0.00 H new ATOM 0 HH21 ARG A 9 31.887 3.586 12.593 1.00 0.00 H new ATOM 0 HH22 ARG A 9 31.390 2.237 13.620 1.00 0.00 H new ATOM 142 N ASP A 10 25.540 10.036 11.380 1.00 0.00 N ATOM 143 CA ASP A 10 24.172 10.550 11.300 1.00 0.00 C ATOM 144 C ASP A 10 23.151 9.543 11.871 1.00 0.00 C ATOM 145 O ASP A 10 22.707 8.631 11.186 1.00 0.00 O ATOM 146 CB ASP A 10 23.867 10.888 9.830 1.00 0.00 C ATOM 147 CG ASP A 10 22.421 11.353 9.644 1.00 0.00 C ATOM 148 OD1 ASP A 10 21.991 12.218 10.440 1.00 0.00 O ATOM 149 OD2 ASP A 10 21.744 10.832 8.727 1.00 0.00 O ATOM 0 H ASP A 10 25.890 9.664 10.497 1.00 0.00 H new ATOM 0 HA ASP A 10 24.086 11.450 11.909 1.00 0.00 H new ATOM 0 HB2 ASP A 10 24.547 11.668 9.487 1.00 0.00 H new ATOM 0 HB3 ASP A 10 24.050 10.011 9.209 1.00 0.00 H new ATOM 154 N THR A 11 22.704 9.731 13.109 1.00 0.00 N ATOM 155 CA THR A 11 21.701 8.856 13.757 1.00 0.00 C ATOM 156 C THR A 11 20.290 8.993 13.170 1.00 0.00 C ATOM 157 O THR A 11 19.457 8.103 13.366 1.00 0.00 O ATOM 158 CB THR A 11 21.639 9.114 15.272 1.00 0.00 C ATOM 159 OG1 THR A 11 21.555 10.501 15.524 1.00 0.00 O ATOM 160 CG2 THR A 11 22.880 8.573 15.984 1.00 0.00 C ATOM 0 H THR A 11 23.022 10.496 13.704 1.00 0.00 H new ATOM 0 HA THR A 11 22.040 7.839 13.559 1.00 0.00 H new ATOM 0 HB THR A 11 20.756 8.600 15.652 1.00 0.00 H new ATOM 0 HG1 THR A 11 21.514 10.656 16.491 1.00 0.00 H new ATOM 0 HG21 THR A 11 22.802 8.773 17.053 1.00 0.00 H new ATOM 0 HG22 THR A 11 22.954 7.498 15.820 1.00 0.00 H new ATOM 0 HG23 THR A 11 23.769 9.062 15.587 1.00 0.00 H new ATOM 168 N LYS A 12 20.011 10.070 12.418 1.00 0.00 N ATOM 169 CA LYS A 12 18.701 10.351 11.798 1.00 0.00 C ATOM 170 C LYS A 12 18.203 9.235 10.874 1.00 0.00 C ATOM 171 O LYS A 12 16.993 9.036 10.763 1.00 0.00 O ATOM 172 CB LYS A 12 18.724 11.692 11.044 1.00 0.00 C ATOM 173 CG LYS A 12 19.073 12.883 11.953 1.00 0.00 C ATOM 174 CD LYS A 12 19.077 14.196 11.156 1.00 0.00 C ATOM 175 CE LYS A 12 19.530 15.386 12.010 1.00 0.00 C ATOM 176 NZ LYS A 12 18.559 15.700 13.082 1.00 0.00 N ATOM 0 H LYS A 12 20.706 10.789 12.218 1.00 0.00 H new ATOM 0 HA LYS A 12 17.992 10.409 12.624 1.00 0.00 H new ATOM 0 HB2 LYS A 12 19.450 11.635 10.233 1.00 0.00 H new ATOM 0 HB3 LYS A 12 17.749 11.863 10.587 1.00 0.00 H new ATOM 0 HG2 LYS A 12 18.351 12.949 12.767 1.00 0.00 H new ATOM 0 HG3 LYS A 12 20.051 12.725 12.407 1.00 0.00 H new ATOM 0 HD2 LYS A 12 19.738 14.095 10.295 1.00 0.00 H new ATOM 0 HD3 LYS A 12 18.076 14.388 10.769 1.00 0.00 H new ATOM 0 HE2 LYS A 12 20.501 15.165 12.453 1.00 0.00 H new ATOM 0 HE3 LYS A 12 19.662 16.260 11.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 18.895 16.521 13.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 17.634 15.919 12.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 18.465 14.881 13.716 1.00 0.00 H new ATOM 190 N TRP A 13 19.110 8.489 10.232 1.00 0.00 N ATOM 191 CA TRP A 13 18.739 7.360 9.369 1.00 0.00 C ATOM 192 C TRP A 13 18.465 6.061 10.157 1.00 0.00 C ATOM 193 O TRP A 13 17.885 5.135 9.597 1.00 0.00 O ATOM 194 CB TRP A 13 19.755 7.178 8.227 1.00 0.00 C ATOM 195 CG TRP A 13 21.007 6.406 8.517 1.00 0.00 C ATOM 196 CD1 TRP A 13 22.209 6.926 8.854 1.00 0.00 C ATOM 197 CD2 TRP A 13 21.206 4.959 8.452 1.00 0.00 C ATOM 198 NE1 TRP A 13 23.127 5.906 9.024 1.00 0.00 N ATOM 199 CE2 TRP A 13 22.566 4.674 8.782 1.00 0.00 C ATOM 200 CE3 TRP A 13 20.378 3.857 8.139 1.00 0.00 C ATOM 201 CZ2 TRP A 13 23.078 3.371 8.801 1.00 0.00 C ATOM 202 CZ3 TRP A 13 20.878 2.541 8.175 1.00 0.00 C ATOM 203 CH2 TRP A 13 22.223 2.299 8.499 1.00 0.00 C ATOM 0 H TRP A 13 20.115 8.649 10.295 1.00 0.00 H new ATOM 0 HA TRP A 13 17.784 7.608 8.906 1.00 0.00 H new ATOM 0 HB2 TRP A 13 19.243 6.686 7.400 1.00 0.00 H new ATOM 0 HB3 TRP A 13 20.046 8.169 7.878 1.00 0.00 H new ATOM 0 HD1 TRP A 13 22.420 7.979 8.972 1.00 0.00 H new ATOM 0 HE1 TRP A 13 24.100 6.050 9.295 1.00 0.00 H new ATOM 0 HE3 TRP A 13 19.346 4.027 7.868 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 24.115 3.193 9.044 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 20.223 1.712 7.952 1.00 0.00 H new ATOM 0 HH2 TRP A 13 22.600 1.287 8.516 1.00 0.00 H new ATOM 214 N LEU A 14 18.818 6.003 11.453 1.00 0.00 N ATOM 215 CA LEU A 14 18.576 4.865 12.357 1.00 0.00 C ATOM 216 C LEU A 14 17.469 5.134 13.396 1.00 0.00 C ATOM 217 O LEU A 14 16.982 4.186 14.013 1.00 0.00 O ATOM 218 CB LEU A 14 19.881 4.458 13.074 1.00 0.00 C ATOM 219 CG LEU A 14 20.929 3.731 12.213 1.00 0.00 C ATOM 220 CD1 LEU A 14 22.143 3.398 13.086 1.00 0.00 C ATOM 221 CD2 LEU A 14 20.406 2.408 11.645 1.00 0.00 C ATOM 0 H LEU A 14 19.297 6.775 11.916 1.00 0.00 H new ATOM 0 HA LEU A 14 18.226 4.046 11.728 1.00 0.00 H new ATOM 0 HB2 LEU A 14 20.340 5.356 13.487 1.00 0.00 H new ATOM 0 HB3 LEU A 14 19.624 3.816 13.916 1.00 0.00 H new ATOM 0 HG LEU A 14 21.180 4.395 11.386 1.00 0.00 H new ATOM 0 HD11 LEU A 14 22.892 2.882 12.486 1.00 0.00 H new ATOM 0 HD12 LEU A 14 22.568 4.319 13.484 1.00 0.00 H new ATOM 0 HD13 LEU A 14 21.833 2.755 13.910 1.00 0.00 H new ATOM 0 HD21 LEU A 14 21.185 1.936 11.046 1.00 0.00 H new ATOM 0 HD22 LEU A 14 20.127 1.745 12.464 1.00 0.00 H new ATOM 0 HD23 LEU A 14 19.534 2.600 11.020 1.00 0.00 H new ATOM 233 N THR A 15 17.053 6.386 13.619 1.00 0.00 N ATOM 234 CA THR A 15 15.987 6.708 14.587 1.00 0.00 C ATOM 235 C THR A 15 14.567 6.466 14.057 1.00 0.00 C ATOM 236 O THR A 15 14.288 6.642 12.869 1.00 0.00 O ATOM 237 CB THR A 15 16.038 8.176 15.051 1.00 0.00 C ATOM 238 OG1 THR A 15 16.304 9.062 13.985 1.00 0.00 O ATOM 239 CG2 THR A 15 17.099 8.403 16.123 1.00 0.00 C ATOM 0 H THR A 15 17.439 7.200 13.141 1.00 0.00 H new ATOM 0 HA THR A 15 16.187 6.027 15.414 1.00 0.00 H new ATOM 0 HB THR A 15 15.049 8.381 15.462 1.00 0.00 H new ATOM 0 HG1 THR A 15 16.326 9.982 14.322 1.00 0.00 H new ATOM 0 HG21 THR A 15 17.098 9.452 16.419 1.00 0.00 H new ATOM 0 HG22 THR A 15 16.879 7.781 16.990 1.00 0.00 H new ATOM 0 HG23 THR A 15 18.079 8.139 15.726 1.00 0.00 H new ATOM 247 N LEU A 16 13.649 6.140 14.974 1.00 0.00 N ATOM 248 CA LEU A 16 12.208 5.981 14.738 1.00 0.00 C ATOM 249 C LEU A 16 11.426 6.773 15.796 1.00 0.00 C ATOM 250 O LEU A 16 11.880 6.948 16.929 1.00 0.00 O ATOM 251 CB LEU A 16 11.816 4.490 14.704 1.00 0.00 C ATOM 252 CG LEU A 16 12.176 3.762 13.392 1.00 0.00 C ATOM 253 CD1 LEU A 16 11.789 2.287 13.501 1.00 0.00 C ATOM 254 CD2 LEU A 16 11.435 4.332 12.177 1.00 0.00 C ATOM 0 H LEU A 16 13.902 5.972 15.948 1.00 0.00 H new ATOM 0 HA LEU A 16 11.951 6.386 13.759 1.00 0.00 H new ATOM 0 HB2 LEU A 16 12.306 3.980 15.534 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.742 4.406 14.868 1.00 0.00 H new ATOM 0 HG LEU A 16 13.248 3.896 13.249 1.00 0.00 H new ATOM 0 HD11 LEU A 16 12.044 1.774 12.573 1.00 0.00 H new ATOM 0 HD12 LEU A 16 12.330 1.829 14.329 1.00 0.00 H new ATOM 0 HD13 LEU A 16 10.717 2.204 13.678 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.727 3.782 11.282 1.00 0.00 H new ATOM 0 HD22 LEU A 16 10.360 4.235 12.328 1.00 0.00 H new ATOM 0 HD23 LEU A 16 11.691 5.385 12.056 1.00 0.00 H new ATOM 266 N GLU A 17 10.264 7.292 15.400 1.00 0.00 N ATOM 267 CA GLU A 17 9.403 8.136 16.233 1.00 0.00 C ATOM 268 C GLU A 17 8.516 7.344 17.203 1.00 0.00 C ATOM 269 O GLU A 17 7.908 6.332 16.849 1.00 0.00 O ATOM 270 CB GLU A 17 8.587 9.061 15.312 1.00 0.00 C ATOM 271 CG GLU A 17 7.505 9.883 16.034 1.00 0.00 C ATOM 272 CD GLU A 17 6.979 11.055 15.187 1.00 0.00 C ATOM 273 OE1 GLU A 17 6.667 12.112 15.786 1.00 0.00 O ATOM 274 OE2 GLU A 17 6.884 10.909 13.945 1.00 0.00 O ATOM 0 H GLU A 17 9.884 7.134 14.467 1.00 0.00 H new ATOM 0 HA GLU A 17 10.038 8.735 16.885 1.00 0.00 H new ATOM 0 HB2 GLU A 17 9.269 9.745 14.807 1.00 0.00 H new ATOM 0 HB3 GLU A 17 8.112 8.457 14.539 1.00 0.00 H new ATOM 0 HG2 GLU A 17 6.673 9.229 16.296 1.00 0.00 H new ATOM 0 HG3 GLU A 17 7.913 10.270 16.968 1.00 0.00 H new ATOM 281 N VAL A 18 8.429 7.856 18.433 1.00 0.00 N ATOM 282 CA VAL A 18 7.597 7.323 19.517 1.00 0.00 C ATOM 283 C VAL A 18 6.162 7.837 19.352 1.00 0.00 C ATOM 284 O VAL A 18 5.956 9.008 19.020 1.00 0.00 O ATOM 285 CB VAL A 18 8.178 7.740 20.883 1.00 0.00 C ATOM 286 CG1 VAL A 18 7.346 7.210 22.054 1.00 0.00 C ATOM 287 CG2 VAL A 18 9.606 7.202 21.041 1.00 0.00 C ATOM 0 H VAL A 18 8.955 8.684 18.713 1.00 0.00 H new ATOM 0 HA VAL A 18 7.588 6.234 19.473 1.00 0.00 H new ATOM 0 HB VAL A 18 8.166 8.830 20.903 1.00 0.00 H new ATOM 0 HG11 VAL A 18 7.796 7.530 22.994 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.331 7.601 21.985 1.00 0.00 H new ATOM 0 HG13 VAL A 18 7.318 6.121 22.017 1.00 0.00 H new ATOM 0 HG21 VAL A 18 10.004 7.504 22.010 1.00 0.00 H new ATOM 0 HG22 VAL A 18 9.594 6.114 20.977 1.00 0.00 H new ATOM 0 HG23 VAL A 18 10.236 7.605 20.249 1.00 0.00 H new ATOM 297 N CYS A 19 5.167 6.981 19.586 1.00 0.00 N ATOM 298 CA CYS A 19 3.752 7.333 19.463 1.00 0.00 C ATOM 299 C CYS A 19 3.369 8.533 20.352 1.00 0.00 C ATOM 300 O CYS A 19 3.728 8.613 21.537 1.00 0.00 O ATOM 301 CB CYS A 19 2.929 6.072 19.750 1.00 0.00 C ATOM 302 SG CYS A 19 1.153 6.298 19.425 1.00 0.00 S ATOM 0 H CYS A 19 5.322 6.014 19.869 1.00 0.00 H new ATOM 0 HA CYS A 19 3.535 7.673 18.450 1.00 0.00 H new ATOM 0 HB2 CYS A 19 3.304 5.252 19.138 1.00 0.00 H new ATOM 0 HB3 CYS A 19 3.069 5.782 20.791 1.00 0.00 H new ATOM 307 N ARG A 20 2.650 9.498 19.765 1.00 0.00 N ATOM 308 CA ARG A 20 2.197 10.729 20.437 1.00 0.00 C ATOM 309 C ARG A 20 1.237 10.432 21.593 1.00 0.00 C ATOM 310 O ARG A 20 1.303 11.081 22.635 1.00 0.00 O ATOM 311 CB ARG A 20 1.516 11.665 19.420 1.00 0.00 C ATOM 312 CG ARG A 20 2.365 12.096 18.209 1.00 0.00 C ATOM 313 CD ARG A 20 3.617 12.916 18.560 1.00 0.00 C ATOM 314 NE ARG A 20 4.788 12.070 18.855 1.00 0.00 N ATOM 315 CZ ARG A 20 6.013 12.507 19.091 1.00 0.00 C ATOM 316 NH1 ARG A 20 6.315 13.775 19.182 1.00 0.00 N ATOM 317 NH2 ARG A 20 6.980 11.649 19.266 1.00 0.00 N ATOM 0 H ARG A 20 2.359 9.447 18.789 1.00 0.00 H new ATOM 0 HA ARG A 20 3.078 11.217 20.855 1.00 0.00 H new ATOM 0 HB2 ARG A 20 0.618 11.171 19.049 1.00 0.00 H new ATOM 0 HB3 ARG A 20 1.191 12.563 19.946 1.00 0.00 H new ATOM 0 HG2 ARG A 20 2.673 11.204 17.663 1.00 0.00 H new ATOM 0 HG3 ARG A 20 1.740 12.683 17.535 1.00 0.00 H new ATOM 0 HD2 ARG A 20 3.855 13.581 17.730 1.00 0.00 H new ATOM 0 HD3 ARG A 20 3.403 13.547 19.423 1.00 0.00 H new ATOM 0 HE ARG A 20 4.640 11.061 18.879 1.00 0.00 H new ATOM 0 HH11 ARG A 20 5.588 14.482 19.069 1.00 0.00 H new ATOM 0 HH12 ARG A 20 7.278 14.058 19.366 1.00 0.00 H new ATOM 0 HH21 ARG A 20 6.788 10.648 19.220 1.00 0.00 H new ATOM 0 HH22 ARG A 20 7.928 11.979 19.448 1.00 0.00 H new ATOM 331 N GLU A 21 0.364 9.440 21.426 1.00 0.00 N ATOM 332 CA GLU A 21 -0.606 9.014 22.443 1.00 0.00 C ATOM 333 C GLU A 21 0.024 8.109 23.515 1.00 0.00 C ATOM 334 O GLU A 21 -0.401 8.141 24.671 1.00 0.00 O ATOM 335 CB GLU A 21 -1.809 8.342 21.765 1.00 0.00 C ATOM 336 CG GLU A 21 -2.644 9.344 20.959 1.00 0.00 C ATOM 337 CD GLU A 21 -3.923 8.693 20.419 1.00 0.00 C ATOM 338 OE1 GLU A 21 -3.933 8.306 19.225 1.00 0.00 O ATOM 339 OE2 GLU A 21 -4.910 8.603 21.188 1.00 0.00 O ATOM 0 H GLU A 21 0.307 8.897 20.564 1.00 0.00 H new ATOM 0 HA GLU A 21 -0.952 9.903 22.971 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -1.458 7.549 21.105 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -2.437 7.872 22.522 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -2.904 10.195 21.589 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.052 9.731 20.130 1.00 0.00 H new ATOM 346 N PHE A 22 1.074 7.344 23.192 1.00 0.00 N ATOM 347 CA PHE A 22 1.800 6.520 24.170 1.00 0.00 C ATOM 348 C PHE A 22 2.466 7.401 25.239 1.00 0.00 C ATOM 349 O PHE A 22 2.374 7.122 26.436 1.00 0.00 O ATOM 350 CB PHE A 22 2.834 5.667 23.429 1.00 0.00 C ATOM 351 CG PHE A 22 3.675 4.750 24.296 1.00 0.00 C ATOM 352 CD1 PHE A 22 5.033 5.043 24.531 1.00 0.00 C ATOM 353 CD2 PHE A 22 3.108 3.581 24.840 1.00 0.00 C ATOM 354 CE1 PHE A 22 5.818 4.173 25.308 1.00 0.00 C ATOM 355 CE2 PHE A 22 3.893 2.714 25.621 1.00 0.00 C ATOM 356 CZ PHE A 22 5.248 3.009 25.854 1.00 0.00 C ATOM 0 H PHE A 22 1.446 7.278 22.244 1.00 0.00 H new ATOM 0 HA PHE A 22 1.100 5.863 24.686 1.00 0.00 H new ATOM 0 HB2 PHE A 22 2.313 5.060 22.689 1.00 0.00 H new ATOM 0 HB3 PHE A 22 3.502 6.333 22.882 1.00 0.00 H new ATOM 0 HD1 PHE A 22 5.472 5.937 24.114 1.00 0.00 H new ATOM 0 HD2 PHE A 22 2.069 3.350 24.657 1.00 0.00 H new ATOM 0 HE1 PHE A 22 6.859 4.399 25.486 1.00 0.00 H new ATOM 0 HE2 PHE A 22 3.455 1.821 26.042 1.00 0.00 H new ATOM 0 HZ PHE A 22 5.851 2.342 26.452 1.00 0.00 H new ATOM 366 N GLN A 23 3.068 8.518 24.812 1.00 0.00 N ATOM 367 CA GLN A 23 3.686 9.531 25.681 1.00 0.00 C ATOM 368 C GLN A 23 2.664 10.275 26.571 1.00 0.00 C ATOM 369 O GLN A 23 3.049 10.904 27.560 1.00 0.00 O ATOM 370 CB GLN A 23 4.478 10.518 24.807 1.00 0.00 C ATOM 371 CG GLN A 23 5.735 9.856 24.220 1.00 0.00 C ATOM 372 CD GLN A 23 6.345 10.686 23.096 1.00 0.00 C ATOM 373 OE1 GLN A 23 5.875 10.515 21.881 1.00 0.00 O flip ATOM 374 NE2 GLN A 23 7.246 11.491 23.284 1.00 0.00 N flip ATOM 0 H GLN A 23 3.141 8.750 23.822 1.00 0.00 H new ATOM 0 HA GLN A 23 4.356 9.017 26.371 1.00 0.00 H new ATOM 0 HB2 GLN A 23 3.844 10.881 23.998 1.00 0.00 H new ATOM 0 HB3 GLN A 23 4.765 11.385 25.402 1.00 0.00 H new ATOM 0 HG2 GLN A 23 6.473 9.716 25.009 1.00 0.00 H new ATOM 0 HG3 GLN A 23 5.481 8.866 23.842 1.00 0.00 H new ATOM 0 HE21 GLN A 23 7.617 11.631 24.224 1.00 0.00 H new ATOM 0 HE22 GLN A 23 7.626 12.023 22.501 1.00 0.00 H new ATOM 383 N ARG A 24 1.366 10.186 26.243 1.00 0.00 N ATOM 384 CA ARG A 24 0.231 10.785 26.975 1.00 0.00 C ATOM 385 C ARG A 24 -0.584 9.749 27.769 1.00 0.00 C ATOM 386 O ARG A 24 -1.492 10.126 28.512 1.00 0.00 O ATOM 387 CB ARG A 24 -0.681 11.515 25.970 1.00 0.00 C ATOM 388 CG ARG A 24 -0.016 12.752 25.341 1.00 0.00 C ATOM 389 CD ARG A 24 -0.870 13.347 24.213 1.00 0.00 C ATOM 390 NE ARG A 24 -2.171 13.842 24.706 1.00 0.00 N ATOM 391 CZ ARG A 24 -3.378 13.474 24.303 1.00 0.00 C ATOM 392 NH1 ARG A 24 -3.582 12.591 23.360 1.00 0.00 N ATOM 393 NH2 ARG A 24 -4.437 14.002 24.853 1.00 0.00 N ATOM 0 H ARG A 24 1.060 9.669 25.419 1.00 0.00 H new ATOM 0 HA ARG A 24 0.639 11.484 27.705 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -0.968 10.822 25.179 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -1.598 11.820 26.475 1.00 0.00 H new ATOM 0 HG2 ARG A 24 0.148 13.507 26.110 1.00 0.00 H new ATOM 0 HG3 ARG A 24 0.964 12.478 24.949 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -0.327 14.165 23.740 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -1.037 12.590 23.447 1.00 0.00 H new ATOM 0 HE ARG A 24 -2.136 14.548 25.441 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -2.789 12.149 22.895 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -4.534 12.345 23.089 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -4.335 14.697 25.592 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -5.367 13.720 24.544 1.00 0.00 H new ATOM 407 N GLY A 25 -0.276 8.456 27.627 1.00 0.00 N ATOM 408 CA GLY A 25 -0.986 7.351 28.282 1.00 0.00 C ATOM 409 C GLY A 25 -2.396 7.110 27.721 1.00 0.00 C ATOM 410 O GLY A 25 -3.278 6.668 28.462 1.00 0.00 O ATOM 0 H GLY A 25 0.494 8.140 27.038 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.400 6.438 28.174 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -1.059 7.559 29.350 1.00 0.00 H new ATOM 414 N THR A 26 -2.630 7.426 26.440 1.00 0.00 N ATOM 415 CA THR A 26 -3.942 7.335 25.766 1.00 0.00 C ATOM 416 C THR A 26 -4.001 6.357 24.580 1.00 0.00 C ATOM 417 O THR A 26 -5.100 6.072 24.095 1.00 0.00 O ATOM 418 CB THR A 26 -4.422 8.728 25.314 1.00 0.00 C ATOM 419 OG1 THR A 26 -3.427 9.389 24.559 1.00 0.00 O ATOM 420 CG2 THR A 26 -4.757 9.633 26.500 1.00 0.00 C ATOM 0 H THR A 26 -1.892 7.763 25.821 1.00 0.00 H new ATOM 0 HA THR A 26 -4.611 6.925 26.522 1.00 0.00 H new ATOM 0 HB THR A 26 -5.315 8.553 24.714 1.00 0.00 H new ATOM 0 HG1 THR A 26 -3.840 10.099 24.024 1.00 0.00 H new ATOM 0 HG21 THR A 26 -5.091 10.604 26.134 1.00 0.00 H new ATOM 0 HG22 THR A 26 -5.550 9.177 27.093 1.00 0.00 H new ATOM 0 HG23 THR A 26 -3.870 9.764 27.120 1.00 0.00 H new ATOM 428 N CYS A 27 -2.867 5.808 24.125 1.00 0.00 N ATOM 429 CA CYS A 27 -2.819 4.824 23.032 1.00 0.00 C ATOM 430 C CYS A 27 -3.402 3.456 23.473 1.00 0.00 C ATOM 431 O CYS A 27 -3.302 3.081 24.649 1.00 0.00 O ATOM 432 CB CYS A 27 -1.365 4.709 22.537 1.00 0.00 C ATOM 433 SG CYS A 27 -1.271 3.929 20.891 1.00 0.00 S ATOM 0 H CYS A 27 -1.949 6.035 24.507 1.00 0.00 H new ATOM 0 HA CYS A 27 -3.446 5.161 22.206 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -0.915 5.701 22.496 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -0.783 4.125 23.250 1.00 0.00 H new ATOM 438 N SER A 28 -3.982 2.704 22.528 1.00 0.00 N ATOM 439 CA SER A 28 -4.597 1.384 22.763 1.00 0.00 C ATOM 440 C SER A 28 -4.302 0.382 21.631 1.00 0.00 C ATOM 441 O SER A 28 -5.212 -0.169 21.002 1.00 0.00 O ATOM 442 CB SER A 28 -6.118 1.527 22.977 1.00 0.00 C ATOM 443 OG SER A 28 -6.425 2.317 24.119 1.00 0.00 O ATOM 0 H SER A 28 -4.040 3.001 21.554 1.00 0.00 H new ATOM 0 HA SER A 28 -4.144 0.980 23.669 1.00 0.00 H new ATOM 0 HB2 SER A 28 -6.567 1.979 22.093 1.00 0.00 H new ATOM 0 HB3 SER A 28 -6.562 0.538 23.090 1.00 0.00 H new ATOM 0 HG SER A 28 -7.398 2.384 24.218 1.00 0.00 H new ATOM 449 N ARG A 29 -3.010 0.107 21.400 1.00 0.00 N ATOM 450 CA ARG A 29 -2.475 -0.872 20.431 1.00 0.00 C ATOM 451 C ARG A 29 -1.085 -1.367 20.868 1.00 0.00 C ATOM 452 O ARG A 29 -0.329 -0.590 21.459 1.00 0.00 O ATOM 453 CB ARG A 29 -2.299 -0.241 19.030 1.00 0.00 C ATOM 454 CG ARG A 29 -3.592 -0.093 18.217 1.00 0.00 C ATOM 455 CD ARG A 29 -3.255 0.265 16.763 1.00 0.00 C ATOM 456 NE ARG A 29 -4.471 0.407 15.946 1.00 0.00 N ATOM 457 CZ ARG A 29 -4.537 0.396 14.624 1.00 0.00 C ATOM 458 NH1 ARG A 29 -3.499 0.201 13.852 1.00 0.00 N ATOM 459 NH2 ARG A 29 -5.684 0.584 14.029 1.00 0.00 N ATOM 0 H ARG A 29 -2.267 0.585 21.909 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.192 -1.692 20.394 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -1.846 0.744 19.146 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -1.597 -0.849 18.460 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -4.161 -1.022 18.250 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -4.221 0.682 18.655 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -2.688 1.196 16.738 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -2.617 -0.508 16.336 1.00 0.00 H new ATOM 0 HE ARG A 29 -5.351 0.526 16.449 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -2.579 0.047 14.264 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -3.610 0.203 12.838 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -6.526 0.739 14.583 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -5.738 0.576 13.010 1.00 0.00 H new ATOM 473 N PRO A 30 -0.705 -2.619 20.552 1.00 0.00 N ATOM 474 CA PRO A 30 0.647 -3.109 20.808 1.00 0.00 C ATOM 475 C PRO A 30 1.631 -2.454 19.820 1.00 0.00 C ATOM 476 O PRO A 30 1.239 -2.003 18.740 1.00 0.00 O ATOM 477 CB PRO A 30 0.563 -4.625 20.595 1.00 0.00 C ATOM 478 CG PRO A 30 -0.526 -4.770 19.532 1.00 0.00 C ATOM 479 CD PRO A 30 -1.497 -3.638 19.873 1.00 0.00 C ATOM 0 HA PRO A 30 1.005 -2.870 21.809 1.00 0.00 H new ATOM 0 HB2 PRO A 30 1.514 -5.037 20.256 1.00 0.00 H new ATOM 0 HB3 PRO A 30 0.299 -5.147 21.515 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -0.123 -4.665 18.525 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -1.010 -5.745 19.582 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -1.959 -3.236 18.972 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -2.304 -3.996 20.513 1.00 0.00 H new ATOM 487 N ASP A 31 2.926 -2.450 20.154 1.00 0.00 N ATOM 488 CA ASP A 31 4.002 -1.923 19.290 1.00 0.00 C ATOM 489 C ASP A 31 3.964 -2.513 17.863 1.00 0.00 C ATOM 490 O ASP A 31 4.325 -1.850 16.892 1.00 0.00 O ATOM 491 CB ASP A 31 5.349 -2.235 19.960 1.00 0.00 C ATOM 492 CG ASP A 31 6.542 -1.666 19.185 1.00 0.00 C ATOM 493 OD1 ASP A 31 7.219 -2.460 18.493 1.00 0.00 O ATOM 494 OD2 ASP A 31 6.785 -0.442 19.303 1.00 0.00 O ATOM 0 H ASP A 31 3.267 -2.816 21.043 1.00 0.00 H new ATOM 0 HA ASP A 31 3.861 -0.848 19.179 1.00 0.00 H new ATOM 0 HB2 ASP A 31 5.350 -1.827 20.971 1.00 0.00 H new ATOM 0 HB3 ASP A 31 5.463 -3.315 20.052 1.00 0.00 H new ATOM 499 N THR A 32 3.504 -3.760 17.748 1.00 0.00 N ATOM 500 CA THR A 32 3.351 -4.545 16.514 1.00 0.00 C ATOM 501 C THR A 32 2.257 -4.042 15.561 1.00 0.00 C ATOM 502 O THR A 32 2.301 -4.351 14.371 1.00 0.00 O ATOM 503 CB THR A 32 2.983 -5.994 16.885 1.00 0.00 C ATOM 504 OG1 THR A 32 3.635 -6.421 18.068 1.00 0.00 O ATOM 505 CG2 THR A 32 3.322 -7.020 15.801 1.00 0.00 C ATOM 0 H THR A 32 3.207 -4.288 18.569 1.00 0.00 H new ATOM 0 HA THR A 32 4.306 -4.456 15.996 1.00 0.00 H new ATOM 0 HB THR A 32 1.902 -5.958 17.019 1.00 0.00 H new ATOM 0 HG1 THR A 32 3.374 -7.344 18.270 1.00 0.00 H new ATOM 0 HG21 THR A 32 3.032 -8.015 16.139 1.00 0.00 H new ATOM 0 HG22 THR A 32 2.781 -6.775 14.887 1.00 0.00 H new ATOM 0 HG23 THR A 32 4.394 -7.001 15.605 1.00 0.00 H new ATOM 513 N GLU A 33 1.265 -3.293 16.055 1.00 0.00 N ATOM 514 CA GLU A 33 0.101 -2.842 15.270 1.00 0.00 C ATOM 515 C GLU A 33 -0.046 -1.314 15.184 1.00 0.00 C ATOM 516 O GLU A 33 -0.725 -0.815 14.283 1.00 0.00 O ATOM 517 CB GLU A 33 -1.155 -3.494 15.884 1.00 0.00 C ATOM 518 CG GLU A 33 -2.426 -3.460 15.021 1.00 0.00 C ATOM 519 CD GLU A 33 -2.280 -4.286 13.735 1.00 0.00 C ATOM 520 OE1 GLU A 33 -2.472 -5.524 13.807 1.00 0.00 O ATOM 521 OE2 GLU A 33 -1.972 -3.688 12.677 1.00 0.00 O ATOM 0 H GLU A 33 1.244 -2.976 17.024 1.00 0.00 H new ATOM 0 HA GLU A 33 0.243 -3.156 14.236 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -0.924 -4.534 16.113 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.370 -2.999 16.831 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.267 -3.841 15.601 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.659 -2.427 14.762 1.00 0.00 H new ATOM 528 N CYS A 34 0.590 -0.558 16.085 1.00 0.00 N ATOM 529 CA CYS A 34 0.544 0.908 16.048 1.00 0.00 C ATOM 530 C CYS A 34 1.390 1.488 14.887 1.00 0.00 C ATOM 531 O CYS A 34 2.291 0.836 14.341 1.00 0.00 O ATOM 532 CB CYS A 34 0.942 1.466 17.424 1.00 0.00 C ATOM 533 SG CYS A 34 0.310 3.168 17.646 1.00 0.00 S ATOM 0 H CYS A 34 1.145 -0.939 16.852 1.00 0.00 H new ATOM 0 HA CYS A 34 -0.477 1.228 15.839 1.00 0.00 H new ATOM 0 HB2 CYS A 34 0.548 0.822 18.210 1.00 0.00 H new ATOM 0 HB3 CYS A 34 2.028 1.461 17.523 1.00 0.00 H new ATOM 538 N LYS A 35 1.101 2.740 14.512 1.00 0.00 N ATOM 539 CA LYS A 35 1.778 3.504 13.447 1.00 0.00 C ATOM 540 C LYS A 35 3.192 3.969 13.845 1.00 0.00 C ATOM 541 O LYS A 35 4.014 4.265 12.975 1.00 0.00 O ATOM 542 CB LYS A 35 0.875 4.704 13.089 1.00 0.00 C ATOM 543 CG LYS A 35 1.364 5.625 11.955 1.00 0.00 C ATOM 544 CD LYS A 35 1.561 4.900 10.613 1.00 0.00 C ATOM 545 CE LYS A 35 2.044 5.856 9.515 1.00 0.00 C ATOM 546 NZ LYS A 35 1.011 6.849 9.148 1.00 0.00 N ATOM 0 H LYS A 35 0.357 3.275 14.960 1.00 0.00 H new ATOM 0 HA LYS A 35 1.924 2.856 12.583 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -0.108 4.320 12.816 1.00 0.00 H new ATOM 0 HB3 LYS A 35 0.743 5.309 13.986 1.00 0.00 H new ATOM 0 HG2 LYS A 35 0.645 6.433 11.819 1.00 0.00 H new ATOM 0 HG3 LYS A 35 2.307 6.084 12.252 1.00 0.00 H new ATOM 0 HD2 LYS A 35 2.285 4.094 10.738 1.00 0.00 H new ATOM 0 HD3 LYS A 35 0.621 4.440 10.307 1.00 0.00 H new ATOM 0 HE2 LYS A 35 2.940 6.375 9.855 1.00 0.00 H new ATOM 0 HE3 LYS A 35 2.324 5.281 8.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 1.333 7.397 8.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 0.125 6.358 8.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 0.847 7.492 9.949 1.00 0.00 H new ATOM 560 N PHE A 36 3.473 4.022 15.145 1.00 0.00 N ATOM 561 CA PHE A 36 4.722 4.498 15.748 1.00 0.00 C ATOM 562 C PHE A 36 5.259 3.526 16.819 1.00 0.00 C ATOM 563 O PHE A 36 4.687 2.459 17.056 1.00 0.00 O ATOM 564 CB PHE A 36 4.470 5.908 16.299 1.00 0.00 C ATOM 565 CG PHE A 36 4.148 6.952 15.245 1.00 0.00 C ATOM 566 CD1 PHE A 36 5.148 7.379 14.351 1.00 0.00 C ATOM 567 CD2 PHE A 36 2.851 7.495 15.154 1.00 0.00 C ATOM 568 CE1 PHE A 36 4.852 8.340 13.367 1.00 0.00 C ATOM 569 CE2 PHE A 36 2.557 8.457 14.171 1.00 0.00 C ATOM 570 CZ PHE A 36 3.557 8.879 13.278 1.00 0.00 C ATOM 0 H PHE A 36 2.799 3.718 15.848 1.00 0.00 H new ATOM 0 HA PHE A 36 5.507 4.540 14.993 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.646 5.863 17.011 1.00 0.00 H new ATOM 0 HB3 PHE A 36 5.352 6.230 16.853 1.00 0.00 H new ATOM 0 HD1 PHE A 36 6.144 6.968 14.421 1.00 0.00 H new ATOM 0 HD2 PHE A 36 2.082 7.172 15.840 1.00 0.00 H new ATOM 0 HE1 PHE A 36 5.620 8.664 12.680 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.562 8.872 14.102 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.330 9.618 12.523 1.00 0.00 H new ATOM 580 N ALA A 37 6.396 3.863 17.436 1.00 0.00 N ATOM 581 CA ALA A 37 7.085 3.000 18.395 1.00 0.00 C ATOM 582 C ALA A 37 6.629 3.209 19.856 1.00 0.00 C ATOM 583 O ALA A 37 6.330 4.327 20.280 1.00 0.00 O ATOM 584 CB ALA A 37 8.585 3.298 18.257 1.00 0.00 C ATOM 0 H ALA A 37 6.868 4.754 17.280 1.00 0.00 H new ATOM 0 HA ALA A 37 6.847 1.961 18.169 1.00 0.00 H new ATOM 0 HB1 ALA A 37 9.145 2.676 18.955 1.00 0.00 H new ATOM 0 HB2 ALA A 37 8.907 3.081 17.239 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.769 4.349 18.479 1.00 0.00 H new ATOM 590 N HIS A 38 6.613 2.119 20.632 1.00 0.00 N ATOM 591 CA HIS A 38 6.262 2.056 22.059 1.00 0.00 C ATOM 592 C HIS A 38 7.460 1.511 22.883 1.00 0.00 C ATOM 593 O HIS A 38 7.459 0.338 23.275 1.00 0.00 O ATOM 594 CB HIS A 38 4.981 1.218 22.261 1.00 0.00 C ATOM 595 CG HIS A 38 3.732 1.726 21.576 1.00 0.00 C ATOM 596 ND1 HIS A 38 2.625 0.974 21.245 1.00 0.00 N ATOM 597 CD2 HIS A 38 3.454 3.016 21.202 1.00 0.00 C ATOM 598 CE1 HIS A 38 1.717 1.788 20.676 1.00 0.00 C ATOM 599 NE2 HIS A 38 2.179 3.048 20.621 1.00 0.00 N ATOM 0 H HIS A 38 6.859 1.202 20.260 1.00 0.00 H new ATOM 0 HA HIS A 38 6.049 3.061 22.424 1.00 0.00 H new ATOM 0 HB2 HIS A 38 5.176 0.205 21.909 1.00 0.00 H new ATOM 0 HB3 HIS A 38 4.781 1.151 23.330 1.00 0.00 H new ATOM 0 HD1 HIS A 38 2.513 -0.027 21.404 1.00 0.00 H new ATOM 0 HD2 HIS A 38 4.108 3.865 21.333 1.00 0.00 H new ATOM 0 HE1 HIS A 38 0.750 1.472 20.314 1.00 0.00 H new ATOM 607 N PRO A 39 8.516 2.318 23.116 1.00 0.00 N ATOM 608 CA PRO A 39 9.721 1.909 23.843 1.00 0.00 C ATOM 609 C PRO A 39 9.500 1.668 25.346 1.00 0.00 C ATOM 610 O PRO A 39 8.500 2.087 25.933 1.00 0.00 O ATOM 611 CB PRO A 39 10.740 3.023 23.614 1.00 0.00 C ATOM 612 CG PRO A 39 9.861 4.259 23.439 1.00 0.00 C ATOM 613 CD PRO A 39 8.643 3.708 22.701 1.00 0.00 C ATOM 0 HA PRO A 39 10.059 0.943 23.468 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.421 3.128 24.459 1.00 0.00 H new ATOM 0 HB3 PRO A 39 11.353 2.835 22.732 1.00 0.00 H new ATOM 0 HG2 PRO A 39 9.588 4.700 24.398 1.00 0.00 H new ATOM 0 HG3 PRO A 39 10.365 5.035 22.864 1.00 0.00 H new ATOM 0 HD2 PRO A 39 7.746 4.274 22.952 1.00 0.00 H new ATOM 0 HD3 PRO A 39 8.775 3.782 21.622 1.00 0.00 H new ATOM 621 N SER A 40 10.474 1.008 25.971 1.00 0.00 N ATOM 622 CA SER A 40 10.505 0.685 27.402 1.00 0.00 C ATOM 623 C SER A 40 11.393 1.660 28.186 1.00 0.00 C ATOM 624 O SER A 40 12.132 2.465 27.610 1.00 0.00 O ATOM 625 CB SER A 40 11.035 -0.745 27.578 1.00 0.00 C ATOM 626 OG SER A 40 12.419 -0.801 27.262 1.00 0.00 O ATOM 0 H SER A 40 11.299 0.668 25.476 1.00 0.00 H new ATOM 0 HA SER A 40 9.492 0.770 27.794 1.00 0.00 H new ATOM 0 HB2 SER A 40 10.876 -1.075 28.605 1.00 0.00 H new ATOM 0 HB3 SER A 40 10.480 -1.427 26.934 1.00 0.00 H new ATOM 0 HG SER A 40 12.565 -0.436 26.364 1.00 0.00 H new ATOM 632 N LYS A 41 11.372 1.548 29.520 1.00 0.00 N ATOM 633 CA LYS A 41 12.225 2.338 30.434 1.00 0.00 C ATOM 634 C LYS A 41 13.729 2.074 30.232 1.00 0.00 C ATOM 635 O LYS A 41 14.556 2.893 30.634 1.00 0.00 O ATOM 636 CB LYS A 41 11.821 2.074 31.895 1.00 0.00 C ATOM 637 CG LYS A 41 10.396 2.563 32.207 1.00 0.00 C ATOM 638 CD LYS A 41 10.047 2.340 33.686 1.00 0.00 C ATOM 639 CE LYS A 41 8.658 2.886 34.042 1.00 0.00 C ATOM 640 NZ LYS A 41 7.575 2.129 33.377 1.00 0.00 N ATOM 0 H LYS A 41 10.755 0.898 30.008 1.00 0.00 H new ATOM 0 HA LYS A 41 12.061 3.389 30.194 1.00 0.00 H new ATOM 0 HB2 LYS A 41 11.889 1.006 32.100 1.00 0.00 H new ATOM 0 HB3 LYS A 41 12.527 2.572 32.560 1.00 0.00 H new ATOM 0 HG2 LYS A 41 10.311 3.623 31.966 1.00 0.00 H new ATOM 0 HG3 LYS A 41 9.681 2.034 31.577 1.00 0.00 H new ATOM 0 HD2 LYS A 41 10.085 1.274 33.910 1.00 0.00 H new ATOM 0 HD3 LYS A 41 10.797 2.824 34.312 1.00 0.00 H new ATOM 0 HE2 LYS A 41 8.518 2.844 35.122 1.00 0.00 H new ATOM 0 HE3 LYS A 41 8.596 3.935 33.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 6.653 2.510 33.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 7.672 2.218 32.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 7.637 1.126 33.646 1.00 0.00 H new ATOM 654 N SER A 42 14.078 0.950 29.599 1.00 0.00 N ATOM 655 CA SER A 42 15.456 0.535 29.291 1.00 0.00 C ATOM 656 C SER A 42 15.964 1.051 27.935 1.00 0.00 C ATOM 657 O SER A 42 17.174 1.041 27.696 1.00 0.00 O ATOM 658 CB SER A 42 15.557 -0.996 29.304 1.00 0.00 C ATOM 659 OG SER A 42 15.147 -1.515 30.562 1.00 0.00 O ATOM 0 H SER A 42 13.385 0.277 29.273 1.00 0.00 H new ATOM 0 HA SER A 42 16.084 0.977 30.064 1.00 0.00 H new ATOM 0 HB2 SER A 42 14.935 -1.413 28.512 1.00 0.00 H new ATOM 0 HB3 SER A 42 16.583 -1.300 29.096 1.00 0.00 H new ATOM 0 HG SER A 42 15.216 -2.492 30.551 1.00 0.00 H new ATOM 665 N CYS A 43 15.078 1.514 27.043 1.00 0.00 N ATOM 666 CA CYS A 43 15.459 2.060 25.737 1.00 0.00 C ATOM 667 C CYS A 43 16.087 3.462 25.869 1.00 0.00 C ATOM 668 O CYS A 43 15.721 4.238 26.756 1.00 0.00 O ATOM 669 CB CYS A 43 14.208 2.130 24.849 1.00 0.00 C ATOM 670 SG CYS A 43 13.602 0.467 24.439 1.00 0.00 S ATOM 0 H CYS A 43 14.072 1.520 27.210 1.00 0.00 H new ATOM 0 HA CYS A 43 16.208 1.406 25.290 1.00 0.00 H new ATOM 0 HB2 CYS A 43 13.425 2.689 25.362 1.00 0.00 H new ATOM 0 HB3 CYS A 43 14.439 2.672 23.932 1.00 0.00 H new ATOM 0 HG CYS A 43 12.544 0.563 23.690 1.00 0.00 H new ATOM 676 N GLN A 44 16.998 3.824 24.959 1.00 0.00 N ATOM 677 CA GLN A 44 17.655 5.145 24.914 1.00 0.00 C ATOM 678 C GLN A 44 16.755 6.233 24.278 1.00 0.00 C ATOM 679 O GLN A 44 17.149 6.931 23.340 1.00 0.00 O ATOM 680 CB GLN A 44 19.024 5.036 24.213 1.00 0.00 C ATOM 681 CG GLN A 44 20.004 4.072 24.902 1.00 0.00 C ATOM 682 CD GLN A 44 20.385 4.448 26.338 1.00 0.00 C ATOM 683 OE1 GLN A 44 20.280 5.582 26.782 1.00 0.00 O ATOM 684 NE2 GLN A 44 20.832 3.503 27.134 1.00 0.00 N ATOM 0 H GLN A 44 17.309 3.198 24.216 1.00 0.00 H new ATOM 0 HA GLN A 44 17.825 5.469 25.941 1.00 0.00 H new ATOM 0 HB2 GLN A 44 18.869 4.708 23.185 1.00 0.00 H new ATOM 0 HB3 GLN A 44 19.477 6.026 24.166 1.00 0.00 H new ATOM 0 HG2 GLN A 44 19.564 3.075 24.909 1.00 0.00 H new ATOM 0 HG3 GLN A 44 20.914 4.015 24.304 1.00 0.00 H new ATOM 0 HE21 GLN A 44 20.929 2.548 26.788 1.00 0.00 H new ATOM 0 HE22 GLN A 44 21.082 3.724 28.098 1.00 0.00 H new ATOM 693 N VAL A 45 15.517 6.355 24.768 1.00 0.00 N ATOM 694 CA VAL A 45 14.503 7.316 24.294 1.00 0.00 C ATOM 695 C VAL A 45 14.954 8.765 24.535 1.00 0.00 C ATOM 696 O VAL A 45 15.422 9.102 25.626 1.00 0.00 O ATOM 697 CB VAL A 45 13.139 7.077 24.985 1.00 0.00 C ATOM 698 CG1 VAL A 45 12.023 7.856 24.276 1.00 0.00 C ATOM 699 CG2 VAL A 45 12.736 5.593 25.011 1.00 0.00 C ATOM 0 H VAL A 45 15.177 5.770 25.531 1.00 0.00 H new ATOM 0 HA VAL A 45 14.388 7.157 23.222 1.00 0.00 H new ATOM 0 HB VAL A 45 13.263 7.425 26.010 1.00 0.00 H new ATOM 0 HG11 VAL A 45 11.074 7.672 24.780 1.00 0.00 H new ATOM 0 HG12 VAL A 45 12.248 8.922 24.305 1.00 0.00 H new ATOM 0 HG13 VAL A 45 11.953 7.528 23.239 1.00 0.00 H new ATOM 0 HG21 VAL A 45 11.772 5.487 25.508 1.00 0.00 H new ATOM 0 HG22 VAL A 45 12.662 5.218 23.990 1.00 0.00 H new ATOM 0 HG23 VAL A 45 13.489 5.021 25.554 1.00 0.00 H new ATOM 709 N GLU A 46 14.801 9.635 23.534 1.00 0.00 N ATOM 710 CA GLU A 46 15.155 11.060 23.606 1.00 0.00 C ATOM 711 C GLU A 46 14.295 11.895 22.640 1.00 0.00 C ATOM 712 O GLU A 46 14.127 11.523 21.480 1.00 0.00 O ATOM 713 CB GLU A 46 16.655 11.219 23.277 1.00 0.00 C ATOM 714 CG GLU A 46 17.194 12.656 23.369 1.00 0.00 C ATOM 715 CD GLU A 46 17.065 13.246 24.780 1.00 0.00 C ATOM 716 OE1 GLU A 46 18.053 13.168 25.547 1.00 0.00 O ATOM 717 OE2 GLU A 46 15.969 13.768 25.093 1.00 0.00 O ATOM 0 H GLU A 46 14.419 9.365 22.628 1.00 0.00 H new ATOM 0 HA GLU A 46 14.960 11.427 24.614 1.00 0.00 H new ATOM 0 HB2 GLU A 46 17.229 10.588 23.956 1.00 0.00 H new ATOM 0 HB3 GLU A 46 16.832 10.845 22.268 1.00 0.00 H new ATOM 0 HG2 GLU A 46 18.242 12.667 23.069 1.00 0.00 H new ATOM 0 HG3 GLU A 46 16.654 13.288 22.664 1.00 0.00 H new ATOM 724 N ASN A 47 13.768 13.036 23.102 1.00 0.00 N ATOM 725 CA ASN A 47 12.947 13.991 22.336 1.00 0.00 C ATOM 726 C ASN A 47 11.864 13.354 21.418 1.00 0.00 C ATOM 727 O ASN A 47 11.629 13.806 20.295 1.00 0.00 O ATOM 728 CB ASN A 47 13.907 14.958 21.608 1.00 0.00 C ATOM 729 CG ASN A 47 13.217 16.202 21.062 1.00 0.00 C ATOM 730 OD1 ASN A 47 12.287 16.746 21.645 1.00 0.00 O ATOM 731 ND2 ASN A 47 13.661 16.711 19.933 1.00 0.00 N ATOM 0 H ASN A 47 13.908 13.336 24.067 1.00 0.00 H new ATOM 0 HA ASN A 47 12.324 14.548 23.036 1.00 0.00 H new ATOM 0 HB2 ASN A 47 14.695 15.262 22.297 1.00 0.00 H new ATOM 0 HB3 ASN A 47 14.389 14.429 20.786 1.00 0.00 H new ATOM 0 HD21 ASN A 47 13.231 17.553 19.549 1.00 0.00 H new ATOM 0 HD22 ASN A 47 14.435 16.264 19.442 1.00 0.00 H new ATOM 738 N GLY A 48 11.211 12.279 21.881 1.00 0.00 N ATOM 739 CA GLY A 48 10.170 11.560 21.126 1.00 0.00 C ATOM 740 C GLY A 48 10.694 10.641 20.011 1.00 0.00 C ATOM 741 O GLY A 48 9.942 10.309 19.089 1.00 0.00 O ATOM 0 H GLY A 48 11.392 11.878 22.801 1.00 0.00 H new ATOM 0 HA2 GLY A 48 9.584 10.962 21.824 1.00 0.00 H new ATOM 0 HA3 GLY A 48 9.492 12.291 20.685 1.00 0.00 H new ATOM 745 N ARG A 49 11.969 10.240 20.071 1.00 0.00 N ATOM 746 CA ARG A 49 12.680 9.370 19.116 1.00 0.00 C ATOM 747 C ARG A 49 13.500 8.307 19.860 1.00 0.00 C ATOM 748 O ARG A 49 13.835 8.479 21.033 1.00 0.00 O ATOM 749 CB ARG A 49 13.653 10.221 18.263 1.00 0.00 C ATOM 750 CG ARG A 49 13.037 11.388 17.474 1.00 0.00 C ATOM 751 CD ARG A 49 12.030 10.905 16.429 1.00 0.00 C ATOM 752 NE ARG A 49 11.465 12.022 15.652 1.00 0.00 N ATOM 753 CZ ARG A 49 10.346 12.676 15.915 1.00 0.00 C ATOM 754 NH1 ARG A 49 9.928 13.611 15.107 1.00 0.00 N ATOM 755 NH2 ARG A 49 9.600 12.426 16.959 1.00 0.00 N ATOM 0 H ARG A 49 12.575 10.532 20.838 1.00 0.00 H new ATOM 0 HA ARG A 49 11.939 8.883 18.482 1.00 0.00 H new ATOM 0 HB2 ARG A 49 14.421 10.624 18.923 1.00 0.00 H new ATOM 0 HB3 ARG A 49 14.155 9.559 17.557 1.00 0.00 H new ATOM 0 HG2 ARG A 49 12.543 12.072 18.164 1.00 0.00 H new ATOM 0 HG3 ARG A 49 13.830 11.951 16.981 1.00 0.00 H new ATOM 0 HD2 ARG A 49 12.517 10.203 15.753 1.00 0.00 H new ATOM 0 HD3 ARG A 49 11.224 10.364 16.925 1.00 0.00 H new ATOM 0 HE ARG A 49 11.989 12.321 14.829 1.00 0.00 H new ATOM 0 HH11 ARG A 49 10.465 13.839 14.270 1.00 0.00 H new ATOM 0 HH12 ARG A 49 9.065 14.114 15.312 1.00 0.00 H new ATOM 0 HH21 ARG A 49 9.872 11.696 17.618 1.00 0.00 H new ATOM 0 HH22 ARG A 49 8.746 12.961 17.115 1.00 0.00 H new ATOM 769 N VAL A 50 13.873 7.231 19.166 1.00 0.00 N ATOM 770 CA VAL A 50 14.772 6.183 19.692 1.00 0.00 C ATOM 771 C VAL A 50 15.603 5.651 18.533 1.00 0.00 C ATOM 772 O VAL A 50 15.065 5.442 17.445 1.00 0.00 O ATOM 773 CB VAL A 50 14.044 4.953 20.279 1.00 0.00 C ATOM 774 CG1 VAL A 50 14.983 4.187 21.224 1.00 0.00 C ATOM 775 CG2 VAL A 50 12.744 5.244 21.008 1.00 0.00 C ATOM 0 H VAL A 50 13.560 7.053 18.212 1.00 0.00 H new ATOM 0 HA VAL A 50 15.348 6.654 20.488 1.00 0.00 H new ATOM 0 HB VAL A 50 13.769 4.358 19.409 1.00 0.00 H new ATOM 0 HG11 VAL A 50 14.461 3.322 21.633 1.00 0.00 H new ATOM 0 HG12 VAL A 50 15.862 3.853 20.672 1.00 0.00 H new ATOM 0 HG13 VAL A 50 15.293 4.842 22.038 1.00 0.00 H new ATOM 0 HG21 VAL A 50 12.318 4.312 21.379 1.00 0.00 H new ATOM 0 HG22 VAL A 50 12.939 5.913 21.847 1.00 0.00 H new ATOM 0 HG23 VAL A 50 12.041 5.717 20.323 1.00 0.00 H new ATOM 785 N ILE A 51 16.886 5.375 18.759 1.00 0.00 N ATOM 786 CA ILE A 51 17.736 4.729 17.754 1.00 0.00 C ATOM 787 C ILE A 51 17.342 3.239 17.716 1.00 0.00 C ATOM 788 O ILE A 51 17.285 2.591 18.764 1.00 0.00 O ATOM 789 CB ILE A 51 19.237 4.918 18.076 1.00 0.00 C ATOM 790 CG1 ILE A 51 19.598 6.393 18.377 1.00 0.00 C ATOM 791 CG2 ILE A 51 20.050 4.426 16.872 1.00 0.00 C ATOM 792 CD1 ILE A 51 21.080 6.634 18.692 1.00 0.00 C ATOM 0 H ILE A 51 17.364 5.589 19.634 1.00 0.00 H new ATOM 0 HA ILE A 51 17.584 5.184 16.775 1.00 0.00 H new ATOM 0 HB ILE A 51 19.470 4.345 18.974 1.00 0.00 H new ATOM 0 HG12 ILE A 51 19.318 7.005 17.519 1.00 0.00 H new ATOM 0 HG13 ILE A 51 19.000 6.735 19.222 1.00 0.00 H new ATOM 0 HG21 ILE A 51 21.114 4.550 17.076 1.00 0.00 H new ATOM 0 HG22 ILE A 51 19.835 3.372 16.694 1.00 0.00 H new ATOM 0 HG23 ILE A 51 19.780 5.006 15.989 1.00 0.00 H new ATOM 0 HD11 ILE A 51 21.242 7.694 18.890 1.00 0.00 H new ATOM 0 HD12 ILE A 51 21.365 6.053 19.569 1.00 0.00 H new ATOM 0 HD13 ILE A 51 21.688 6.327 17.841 1.00 0.00 H new ATOM 804 N ALA A 52 17.045 2.693 16.535 1.00 0.00 N ATOM 805 CA ALA A 52 16.662 1.290 16.370 1.00 0.00 C ATOM 806 C ALA A 52 17.889 0.371 16.169 1.00 0.00 C ATOM 807 O ALA A 52 18.917 0.797 15.636 1.00 0.00 O ATOM 808 CB ALA A 52 15.657 1.193 15.218 1.00 0.00 C ATOM 0 H ALA A 52 17.064 3.216 15.660 1.00 0.00 H new ATOM 0 HA ALA A 52 16.188 0.933 17.284 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.360 0.153 15.081 1.00 0.00 H new ATOM 0 HB2 ALA A 52 14.778 1.794 15.451 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.117 1.563 14.302 1.00 0.00 H new ATOM 814 N CYS A 53 17.777 -0.887 16.609 1.00 0.00 N ATOM 815 CA CYS A 53 18.827 -1.910 16.544 1.00 0.00 C ATOM 816 C CYS A 53 19.131 -2.319 15.081 1.00 0.00 C ATOM 817 O CYS A 53 18.299 -2.946 14.421 1.00 0.00 O ATOM 818 CB CYS A 53 18.357 -3.085 17.428 1.00 0.00 C ATOM 819 SG CYS A 53 19.627 -4.368 17.712 1.00 0.00 S ATOM 0 H CYS A 53 16.919 -1.234 17.037 1.00 0.00 H new ATOM 0 HA CYS A 53 19.777 -1.532 16.922 1.00 0.00 H new ATOM 0 HB2 CYS A 53 18.032 -2.692 18.392 1.00 0.00 H new ATOM 0 HB3 CYS A 53 17.487 -3.548 16.963 1.00 0.00 H new ATOM 824 N PHE A 54 20.310 -1.961 14.559 1.00 0.00 N ATOM 825 CA PHE A 54 20.785 -2.261 13.196 1.00 0.00 C ATOM 826 C PHE A 54 20.678 -3.757 12.890 1.00 0.00 C ATOM 827 O PHE A 54 20.159 -4.151 11.847 1.00 0.00 O ATOM 828 CB PHE A 54 22.251 -1.799 13.047 1.00 0.00 C ATOM 829 CG PHE A 54 22.863 -1.771 11.656 1.00 0.00 C ATOM 830 CD1 PHE A 54 23.395 -0.563 11.170 1.00 0.00 C ATOM 831 CD2 PHE A 54 23.030 -2.949 10.896 1.00 0.00 C ATOM 832 CE1 PHE A 54 24.022 -0.515 9.913 1.00 0.00 C ATOM 833 CE2 PHE A 54 23.658 -2.902 9.639 1.00 0.00 C ATOM 834 CZ PHE A 54 24.140 -1.682 9.140 1.00 0.00 C ATOM 0 H PHE A 54 20.994 -1.429 15.098 1.00 0.00 H new ATOM 0 HA PHE A 54 20.155 -1.725 12.486 1.00 0.00 H new ATOM 0 HB2 PHE A 54 22.326 -0.794 13.463 1.00 0.00 H new ATOM 0 HB3 PHE A 54 22.868 -2.448 13.668 1.00 0.00 H new ATOM 0 HD1 PHE A 54 23.321 0.334 11.767 1.00 0.00 H new ATOM 0 HD2 PHE A 54 22.673 -3.892 11.283 1.00 0.00 H new ATOM 0 HE1 PHE A 54 24.414 0.420 9.541 1.00 0.00 H new ATOM 0 HE2 PHE A 54 23.770 -3.805 9.057 1.00 0.00 H new ATOM 0 HZ PHE A 54 24.601 -1.640 8.164 1.00 0.00 H new ATOM 844 N ASP A 55 21.156 -4.603 13.804 1.00 0.00 N ATOM 845 CA ASP A 55 21.111 -6.054 13.623 1.00 0.00 C ATOM 846 C ASP A 55 19.658 -6.572 13.510 1.00 0.00 C ATOM 847 O ASP A 55 19.357 -7.389 12.633 1.00 0.00 O ATOM 848 CB ASP A 55 21.922 -6.726 14.737 1.00 0.00 C ATOM 849 CG ASP A 55 23.406 -6.341 14.700 1.00 0.00 C ATOM 850 OD1 ASP A 55 24.019 -6.457 13.612 1.00 0.00 O ATOM 851 OD2 ASP A 55 23.941 -5.959 15.768 1.00 0.00 O ATOM 0 H ASP A 55 21.581 -4.305 14.682 1.00 0.00 H new ATOM 0 HA ASP A 55 21.575 -6.321 12.673 1.00 0.00 H new ATOM 0 HB2 ASP A 55 21.503 -6.449 15.704 1.00 0.00 H new ATOM 0 HB3 ASP A 55 21.829 -7.808 14.647 1.00 0.00 H new ATOM 856 N SER A 56 18.726 -6.044 14.314 1.00 0.00 N ATOM 857 CA SER A 56 17.295 -6.370 14.222 1.00 0.00 C ATOM 858 C SER A 56 16.670 -5.827 12.927 1.00 0.00 C ATOM 859 O SER A 56 15.910 -6.535 12.265 1.00 0.00 O ATOM 860 CB SER A 56 16.550 -5.818 15.439 1.00 0.00 C ATOM 861 OG SER A 56 15.204 -6.264 15.441 1.00 0.00 O ATOM 0 H SER A 56 18.944 -5.374 15.052 1.00 0.00 H new ATOM 0 HA SER A 56 17.203 -7.456 14.204 1.00 0.00 H new ATOM 0 HB2 SER A 56 17.047 -6.140 16.354 1.00 0.00 H new ATOM 0 HB3 SER A 56 16.578 -4.728 15.427 1.00 0.00 H new ATOM 0 HG SER A 56 14.914 -6.425 16.363 1.00 0.00 H new ATOM 867 N LEU A 57 17.027 -4.604 12.508 1.00 0.00 N ATOM 868 CA LEU A 57 16.575 -3.976 11.256 1.00 0.00 C ATOM 869 C LEU A 57 16.961 -4.809 10.018 1.00 0.00 C ATOM 870 O LEU A 57 16.197 -4.859 9.052 1.00 0.00 O ATOM 871 CB LEU A 57 17.175 -2.559 11.151 1.00 0.00 C ATOM 872 CG LEU A 57 16.553 -1.509 12.088 1.00 0.00 C ATOM 873 CD1 LEU A 57 17.474 -0.292 12.157 1.00 0.00 C ATOM 874 CD2 LEU A 57 15.183 -1.073 11.575 1.00 0.00 C ATOM 0 H LEU A 57 17.656 -4.007 13.045 1.00 0.00 H new ATOM 0 HA LEU A 57 15.487 -3.920 11.280 1.00 0.00 H new ATOM 0 HB2 LEU A 57 18.243 -2.619 11.358 1.00 0.00 H new ATOM 0 HB3 LEU A 57 17.068 -2.213 10.123 1.00 0.00 H new ATOM 0 HG LEU A 57 16.432 -1.949 13.078 1.00 0.00 H new ATOM 0 HD11 LEU A 57 17.039 0.456 12.820 1.00 0.00 H new ATOM 0 HD12 LEU A 57 18.448 -0.594 12.541 1.00 0.00 H new ATOM 0 HD13 LEU A 57 17.593 0.132 11.160 1.00 0.00 H new ATOM 0 HD21 LEU A 57 14.760 -0.330 12.252 1.00 0.00 H new ATOM 0 HD22 LEU A 57 15.288 -0.639 10.580 1.00 0.00 H new ATOM 0 HD23 LEU A 57 14.521 -1.937 11.526 1.00 0.00 H new ATOM 886 N LYS A 58 18.107 -5.504 10.063 1.00 0.00 N ATOM 887 CA LYS A 58 18.581 -6.432 9.016 1.00 0.00 C ATOM 888 C LYS A 58 17.971 -7.844 9.148 1.00 0.00 C ATOM 889 O LYS A 58 18.254 -8.718 8.327 1.00 0.00 O ATOM 890 CB LYS A 58 20.123 -6.472 9.014 1.00 0.00 C ATOM 891 CG LYS A 58 20.802 -5.140 8.636 1.00 0.00 C ATOM 892 CD LYS A 58 20.478 -4.653 7.213 1.00 0.00 C ATOM 893 CE LYS A 58 21.301 -3.415 6.829 1.00 0.00 C ATOM 894 NZ LYS A 58 20.931 -2.229 7.632 1.00 0.00 N ATOM 0 H LYS A 58 18.751 -5.437 10.851 1.00 0.00 H new ATOM 0 HA LYS A 58 18.237 -6.053 8.054 1.00 0.00 H new ATOM 0 HB2 LYS A 58 20.466 -6.771 10.004 1.00 0.00 H new ATOM 0 HB3 LYS A 58 20.452 -7.242 8.317 1.00 0.00 H new ATOM 0 HG2 LYS A 58 20.498 -4.374 9.349 1.00 0.00 H new ATOM 0 HG3 LYS A 58 21.882 -5.254 8.733 1.00 0.00 H new ATOM 0 HD2 LYS A 58 20.675 -5.455 6.501 1.00 0.00 H new ATOM 0 HD3 LYS A 58 19.416 -4.419 7.143 1.00 0.00 H new ATOM 0 HE2 LYS A 58 22.361 -3.628 6.966 1.00 0.00 H new ATOM 0 HE3 LYS A 58 21.154 -3.196 5.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 20.822 -1.406 7.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 20.034 -2.410 8.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 21.677 -2.036 8.330 1.00 0.00 H new ATOM 908 N GLY A 59 17.113 -8.068 10.148 1.00 0.00 N ATOM 909 CA GLY A 59 16.371 -9.310 10.400 1.00 0.00 C ATOM 910 C GLY A 59 17.042 -10.355 11.296 1.00 0.00 C ATOM 911 O GLY A 59 16.510 -11.464 11.412 1.00 0.00 O ATOM 0 H GLY A 59 16.905 -7.350 10.842 1.00 0.00 H new ATOM 0 HA2 GLY A 59 15.413 -9.046 10.847 1.00 0.00 H new ATOM 0 HA3 GLY A 59 16.156 -9.777 9.439 1.00 0.00 H new ATOM 915 N ARG A 60 18.173 -10.039 11.945 1.00 0.00 N ATOM 916 CA ARG A 60 18.872 -10.962 12.858 1.00 0.00 C ATOM 917 C ARG A 60 19.720 -10.219 13.896 1.00 0.00 C ATOM 918 O ARG A 60 20.900 -9.943 13.667 1.00 0.00 O ATOM 919 CB ARG A 60 19.709 -11.980 12.059 1.00 0.00 C ATOM 920 CG ARG A 60 20.245 -13.125 12.940 1.00 0.00 C ATOM 921 CD ARG A 60 19.161 -14.043 13.533 1.00 0.00 C ATOM 922 NE ARG A 60 18.278 -14.620 12.501 1.00 0.00 N ATOM 923 CZ ARG A 60 18.483 -15.729 11.807 1.00 0.00 C ATOM 924 NH1 ARG A 60 19.538 -16.485 11.966 1.00 0.00 N ATOM 925 NH2 ARG A 60 17.610 -16.109 10.914 1.00 0.00 N ATOM 0 H ARG A 60 18.632 -9.133 11.852 1.00 0.00 H new ATOM 0 HA ARG A 60 18.114 -11.510 13.418 1.00 0.00 H new ATOM 0 HB2 ARG A 60 19.099 -12.397 11.258 1.00 0.00 H new ATOM 0 HB3 ARG A 60 20.547 -11.466 11.587 1.00 0.00 H new ATOM 0 HG2 ARG A 60 20.930 -13.731 12.347 1.00 0.00 H new ATOM 0 HG3 ARG A 60 20.825 -12.695 13.757 1.00 0.00 H new ATOM 0 HD2 ARG A 60 19.638 -14.850 14.090 1.00 0.00 H new ATOM 0 HD3 ARG A 60 18.560 -13.477 14.244 1.00 0.00 H new ATOM 0 HE ARG A 60 17.418 -14.110 12.301 1.00 0.00 H new ATOM 0 HH11 ARG A 60 20.250 -16.230 12.650 1.00 0.00 H new ATOM 0 HH12 ARG A 60 19.649 -17.330 11.406 1.00 0.00 H new ATOM 0 HH21 ARG A 60 16.771 -15.552 10.751 1.00 0.00 H new ATOM 0 HH22 ARG A 60 17.767 -16.963 10.379 1.00 0.00 H new ATOM 939 N CYS A 61 19.105 -9.922 15.042 1.00 0.00 N ATOM 940 CA CYS A 61 19.761 -9.277 16.187 1.00 0.00 C ATOM 941 C CYS A 61 21.009 -10.085 16.624 1.00 0.00 C ATOM 942 O CYS A 61 21.013 -11.321 16.560 1.00 0.00 O ATOM 943 CB CYS A 61 18.740 -9.084 17.323 1.00 0.00 C ATOM 944 SG CYS A 61 19.388 -7.967 18.620 1.00 0.00 S ATOM 0 H CYS A 61 18.119 -10.126 15.206 1.00 0.00 H new ATOM 0 HA CYS A 61 20.121 -8.288 15.903 1.00 0.00 H new ATOM 0 HB2 CYS A 61 17.815 -8.675 16.917 1.00 0.00 H new ATOM 0 HB3 CYS A 61 18.495 -10.051 17.762 1.00 0.00 H new ATOM 949 N SER A 62 22.067 -9.392 17.060 1.00 0.00 N ATOM 950 CA SER A 62 23.357 -9.991 17.469 1.00 0.00 C ATOM 951 C SER A 62 23.721 -9.721 18.940 1.00 0.00 C ATOM 952 O SER A 62 24.879 -9.866 19.343 1.00 0.00 O ATOM 953 CB SER A 62 24.473 -9.518 16.526 1.00 0.00 C ATOM 954 OG SER A 62 24.236 -9.951 15.193 1.00 0.00 O ATOM 0 H SER A 62 22.057 -8.375 17.143 1.00 0.00 H new ATOM 0 HA SER A 62 23.246 -11.072 17.390 1.00 0.00 H new ATOM 0 HB2 SER A 62 24.538 -8.430 16.552 1.00 0.00 H new ATOM 0 HB3 SER A 62 25.432 -9.903 16.871 1.00 0.00 H new ATOM 0 HG SER A 62 24.960 -9.635 14.613 1.00 0.00 H new ATOM 960 N ARG A 63 22.722 -9.373 19.758 1.00 0.00 N ATOM 961 CA ARG A 63 22.798 -9.160 21.213 1.00 0.00 C ATOM 962 C ARG A 63 21.680 -9.949 21.919 1.00 0.00 C ATOM 963 O ARG A 63 20.887 -10.644 21.282 1.00 0.00 O ATOM 964 CB ARG A 63 22.756 -7.648 21.540 1.00 0.00 C ATOM 965 CG ARG A 63 24.038 -6.873 21.180 1.00 0.00 C ATOM 966 CD ARG A 63 24.005 -6.210 19.795 1.00 0.00 C ATOM 967 NE ARG A 63 25.300 -5.569 19.494 1.00 0.00 N ATOM 968 CZ ARG A 63 25.496 -4.428 18.850 1.00 0.00 C ATOM 969 NH1 ARG A 63 24.531 -3.669 18.414 1.00 0.00 N ATOM 970 NH2 ARG A 63 26.708 -4.001 18.620 1.00 0.00 N ATOM 0 H ARG A 63 21.778 -9.222 19.402 1.00 0.00 H new ATOM 0 HA ARG A 63 23.749 -9.538 21.589 1.00 0.00 H new ATOM 0 HB2 ARG A 63 21.916 -7.199 21.010 1.00 0.00 H new ATOM 0 HB3 ARG A 63 22.562 -7.526 22.606 1.00 0.00 H new ATOM 0 HG2 ARG A 63 24.209 -6.105 21.934 1.00 0.00 H new ATOM 0 HG3 ARG A 63 24.886 -7.556 21.223 1.00 0.00 H new ATOM 0 HD2 ARG A 63 23.777 -6.956 19.034 1.00 0.00 H new ATOM 0 HD3 ARG A 63 23.209 -5.467 19.761 1.00 0.00 H new ATOM 0 HE ARG A 63 26.135 -6.058 19.817 1.00 0.00 H new ATOM 0 HH11 ARG A 63 23.560 -3.943 18.562 1.00 0.00 H new ATOM 0 HH12 ARG A 63 24.747 -2.801 17.924 1.00 0.00 H new ATOM 0 HH21 ARG A 63 27.510 -4.547 18.937 1.00 0.00 H new ATOM 0 HH22 ARG A 63 26.853 -3.122 18.124 1.00 0.00 H new ATOM 984 N GLU A 64 21.624 -9.857 23.247 1.00 0.00 N ATOM 985 CA GLU A 64 20.627 -10.531 24.102 1.00 0.00 C ATOM 986 C GLU A 64 19.844 -9.564 25.017 1.00 0.00 C ATOM 987 O GLU A 64 18.787 -9.925 25.539 1.00 0.00 O ATOM 988 CB GLU A 64 21.294 -11.666 24.910 1.00 0.00 C ATOM 989 CG GLU A 64 22.220 -11.236 26.066 1.00 0.00 C ATOM 990 CD GLU A 64 23.511 -10.556 25.592 1.00 0.00 C ATOM 991 OE1 GLU A 64 24.530 -11.268 25.424 1.00 0.00 O ATOM 992 OE2 GLU A 64 23.475 -9.319 25.378 1.00 0.00 O ATOM 0 H GLU A 64 22.288 -9.296 23.781 1.00 0.00 H new ATOM 0 HA GLU A 64 19.881 -10.963 23.435 1.00 0.00 H new ATOM 0 HB2 GLU A 64 20.508 -12.300 25.320 1.00 0.00 H new ATOM 0 HB3 GLU A 64 21.872 -12.281 24.221 1.00 0.00 H new ATOM 0 HG2 GLU A 64 21.678 -10.554 26.721 1.00 0.00 H new ATOM 0 HG3 GLU A 64 22.477 -12.112 26.661 1.00 0.00 H new ATOM 999 N ASN A 65 20.350 -8.339 25.204 1.00 0.00 N ATOM 1000 CA ASN A 65 19.761 -7.281 26.029 1.00 0.00 C ATOM 1001 C ASN A 65 20.281 -5.893 25.580 1.00 0.00 C ATOM 1002 O ASN A 65 20.894 -5.163 26.368 1.00 0.00 O ATOM 1003 CB ASN A 65 20.056 -7.593 27.514 1.00 0.00 C ATOM 1004 CG ASN A 65 19.345 -6.653 28.479 1.00 0.00 C ATOM 1005 OD1 ASN A 65 18.277 -6.117 28.209 1.00 0.00 O ATOM 1006 ND2 ASN A 65 19.904 -6.431 29.649 1.00 0.00 N ATOM 0 H ASN A 65 21.222 -8.046 24.763 1.00 0.00 H new ATOM 0 HA ASN A 65 18.679 -7.249 25.903 1.00 0.00 H new ATOM 0 HB2 ASN A 65 19.756 -8.619 27.729 1.00 0.00 H new ATOM 0 HB3 ASN A 65 21.131 -7.533 27.684 1.00 0.00 H new ATOM 0 HD21 ASN A 65 19.448 -5.816 30.324 1.00 0.00 H new ATOM 0 HD22 ASN A 65 20.793 -6.873 29.882 1.00 0.00 H new ATOM 1013 N CYS A 66 20.082 -5.536 24.305 1.00 0.00 N ATOM 1014 CA CYS A 66 20.561 -4.283 23.720 1.00 0.00 C ATOM 1015 C CYS A 66 19.650 -3.080 24.073 1.00 0.00 C ATOM 1016 O CYS A 66 18.440 -3.202 24.303 1.00 0.00 O ATOM 1017 CB CYS A 66 20.762 -4.471 22.197 1.00 0.00 C ATOM 1018 SG CYS A 66 19.402 -5.343 21.328 1.00 0.00 S ATOM 0 H CYS A 66 19.575 -6.122 23.642 1.00 0.00 H new ATOM 0 HA CYS A 66 21.527 -4.035 24.159 1.00 0.00 H new ATOM 0 HB2 CYS A 66 20.892 -3.490 21.741 1.00 0.00 H new ATOM 0 HB3 CYS A 66 21.688 -5.023 22.035 1.00 0.00 H new ATOM 1023 N LYS A 67 20.279 -1.901 24.181 1.00 0.00 N ATOM 1024 CA LYS A 67 19.675 -0.618 24.600 1.00 0.00 C ATOM 1025 C LYS A 67 18.829 0.115 23.543 1.00 0.00 C ATOM 1026 O LYS A 67 18.198 1.129 23.851 1.00 0.00 O ATOM 1027 CB LYS A 67 20.807 0.284 25.122 1.00 0.00 C ATOM 1028 CG LYS A 67 21.734 0.807 24.009 1.00 0.00 C ATOM 1029 CD LYS A 67 22.979 1.487 24.589 1.00 0.00 C ATOM 1030 CE LYS A 67 23.902 1.954 23.463 1.00 0.00 C ATOM 1031 NZ LYS A 67 25.093 2.629 24.016 1.00 0.00 N ATOM 0 H LYS A 67 21.272 -1.806 23.969 1.00 0.00 H new ATOM 0 HA LYS A 67 18.945 -0.857 25.374 1.00 0.00 H new ATOM 0 HB2 LYS A 67 20.372 1.132 25.650 1.00 0.00 H new ATOM 0 HB3 LYS A 67 21.400 -0.273 25.847 1.00 0.00 H new ATOM 0 HG2 LYS A 67 22.036 -0.020 23.367 1.00 0.00 H new ATOM 0 HG3 LYS A 67 21.190 1.514 23.383 1.00 0.00 H new ATOM 0 HD2 LYS A 67 22.684 2.338 25.203 1.00 0.00 H new ATOM 0 HD3 LYS A 67 23.511 0.793 25.240 1.00 0.00 H new ATOM 0 HE2 LYS A 67 24.209 1.100 22.859 1.00 0.00 H new ATOM 0 HE3 LYS A 67 23.364 2.635 22.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 25.498 3.263 23.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 24.821 3.183 24.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 25.801 1.917 24.287 1.00 0.00 H new ATOM 1045 N TYR A 68 18.830 -0.366 22.305 1.00 0.00 N ATOM 1046 CA TYR A 68 18.115 0.227 21.172 1.00 0.00 C ATOM 1047 C TYR A 68 16.680 -0.325 21.020 1.00 0.00 C ATOM 1048 O TYR A 68 16.296 -1.310 21.656 1.00 0.00 O ATOM 1049 CB TYR A 68 18.955 -0.037 19.912 1.00 0.00 C ATOM 1050 CG TYR A 68 20.362 0.548 19.917 1.00 0.00 C ATOM 1051 CD1 TYR A 68 20.598 1.880 20.322 1.00 0.00 C ATOM 1052 CD2 TYR A 68 21.440 -0.239 19.466 1.00 0.00 C ATOM 1053 CE1 TYR A 68 21.900 2.419 20.270 1.00 0.00 C ATOM 1054 CE2 TYR A 68 22.737 0.304 19.398 1.00 0.00 C ATOM 1055 CZ TYR A 68 22.970 1.637 19.790 1.00 0.00 C ATOM 1056 OH TYR A 68 24.216 2.173 19.678 1.00 0.00 O ATOM 0 H TYR A 68 19.345 -1.208 22.050 1.00 0.00 H new ATOM 0 HA TYR A 68 17.994 1.297 21.338 1.00 0.00 H new ATOM 0 HB2 TYR A 68 19.031 -1.115 19.768 1.00 0.00 H new ATOM 0 HB3 TYR A 68 18.419 0.362 19.051 1.00 0.00 H new ATOM 0 HD1 TYR A 68 19.778 2.489 20.673 1.00 0.00 H new ATOM 0 HD2 TYR A 68 21.270 -1.264 19.171 1.00 0.00 H new ATOM 0 HE1 TYR A 68 22.078 3.432 20.598 1.00 0.00 H new ATOM 0 HE2 TYR A 68 23.557 -0.304 19.044 1.00 0.00 H new ATOM 0 HH TYR A 68 24.308 2.920 20.305 1.00 0.00 H new ATOM 1066 N LEU A 69 15.878 0.305 20.156 1.00 0.00 N ATOM 1067 CA LEU A 69 14.484 -0.065 19.882 1.00 0.00 C ATOM 1068 C LEU A 69 14.388 -1.179 18.823 1.00 0.00 C ATOM 1069 O LEU A 69 15.034 -1.106 17.777 1.00 0.00 O ATOM 1070 CB LEU A 69 13.772 1.207 19.367 1.00 0.00 C ATOM 1071 CG LEU A 69 12.391 1.011 18.710 1.00 0.00 C ATOM 1072 CD1 LEU A 69 11.324 0.588 19.720 1.00 0.00 C ATOM 1073 CD2 LEU A 69 11.954 2.314 18.048 1.00 0.00 C ATOM 0 H LEU A 69 16.189 1.110 19.612 1.00 0.00 H new ATOM 0 HA LEU A 69 14.019 -0.448 20.791 1.00 0.00 H new ATOM 0 HB2 LEU A 69 13.655 1.894 20.205 1.00 0.00 H new ATOM 0 HB3 LEU A 69 14.426 1.694 18.644 1.00 0.00 H new ATOM 0 HG LEU A 69 12.491 0.215 17.972 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.369 0.463 19.209 1.00 0.00 H new ATOM 0 HD12 LEU A 69 11.615 -0.355 20.183 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.226 1.355 20.489 1.00 0.00 H new ATOM 0 HD21 LEU A 69 10.978 2.176 17.583 1.00 0.00 H new ATOM 0 HD22 LEU A 69 11.890 3.101 18.800 1.00 0.00 H new ATOM 0 HD23 LEU A 69 12.681 2.597 17.287 1.00 0.00 H new ATOM 1085 N HIS A 70 13.542 -2.184 19.075 1.00 0.00 N ATOM 1086 CA HIS A 70 13.209 -3.228 18.098 1.00 0.00 C ATOM 1087 C HIS A 70 11.812 -2.907 17.516 1.00 0.00 C ATOM 1088 O HIS A 70 10.807 -3.134 18.199 1.00 0.00 O ATOM 1089 CB HIS A 70 13.185 -4.608 18.783 1.00 0.00 C ATOM 1090 CG HIS A 70 14.520 -5.294 18.917 1.00 0.00 C ATOM 1091 ND1 HIS A 70 14.727 -6.655 18.857 1.00 0.00 N ATOM 1092 CD2 HIS A 70 15.750 -4.709 19.078 1.00 0.00 C ATOM 1093 CE1 HIS A 70 16.047 -6.884 18.967 1.00 0.00 C ATOM 1094 NE2 HIS A 70 16.714 -5.726 19.100 1.00 0.00 N ATOM 0 H HIS A 70 13.065 -2.297 19.970 1.00 0.00 H new ATOM 0 HA HIS A 70 13.956 -3.253 17.305 1.00 0.00 H new ATOM 0 HB2 HIS A 70 12.755 -4.492 19.778 1.00 0.00 H new ATOM 0 HB3 HIS A 70 12.517 -5.261 18.221 1.00 0.00 H new ATOM 0 HD1 HIS A 70 14.004 -7.366 18.748 1.00 0.00 H new ATOM 0 HD2 HIS A 70 15.942 -3.650 19.171 1.00 0.00 H new ATOM 0 HE1 HIS A 70 16.506 -7.861 18.951 1.00 0.00 H new ATOM 1102 N PRO A 71 11.712 -2.397 16.273 1.00 0.00 N ATOM 1103 CA PRO A 71 10.435 -2.070 15.638 1.00 0.00 C ATOM 1104 C PRO A 71 9.835 -3.278 14.879 1.00 0.00 C ATOM 1105 O PRO A 71 10.563 -4.222 14.551 1.00 0.00 O ATOM 1106 CB PRO A 71 10.802 -0.940 14.674 1.00 0.00 C ATOM 1107 CG PRO A 71 12.190 -1.341 14.180 1.00 0.00 C ATOM 1108 CD PRO A 71 12.816 -2.030 15.392 1.00 0.00 C ATOM 0 HA PRO A 71 9.670 -1.790 16.362 1.00 0.00 H new ATOM 0 HB2 PRO A 71 10.089 -0.863 13.853 1.00 0.00 H new ATOM 0 HB3 PRO A 71 10.817 0.028 15.175 1.00 0.00 H new ATOM 0 HG2 PRO A 71 12.132 -2.012 13.323 1.00 0.00 H new ATOM 0 HG3 PRO A 71 12.771 -0.473 13.867 1.00 0.00 H new ATOM 0 HD2 PRO A 71 13.381 -2.912 15.089 1.00 0.00 H new ATOM 0 HD3 PRO A 71 13.513 -1.364 15.900 1.00 0.00 H new ATOM 1116 N PRO A 72 8.528 -3.271 14.554 1.00 0.00 N ATOM 1117 CA PRO A 72 7.884 -4.337 13.777 1.00 0.00 C ATOM 1118 C PRO A 72 8.311 -4.307 12.293 1.00 0.00 C ATOM 1119 O PRO A 72 8.753 -3.261 11.811 1.00 0.00 O ATOM 1120 CB PRO A 72 6.384 -4.073 13.926 1.00 0.00 C ATOM 1121 CG PRO A 72 6.314 -2.554 14.068 1.00 0.00 C ATOM 1122 CD PRO A 72 7.559 -2.239 14.894 1.00 0.00 C ATOM 0 HA PRO A 72 8.169 -5.326 14.137 1.00 0.00 H new ATOM 0 HB2 PRO A 72 5.825 -4.423 13.059 1.00 0.00 H new ATOM 0 HB3 PRO A 72 5.970 -4.579 14.798 1.00 0.00 H new ATOM 0 HG2 PRO A 72 6.333 -2.055 13.099 1.00 0.00 H new ATOM 0 HG3 PRO A 72 5.402 -2.236 14.572 1.00 0.00 H new ATOM 0 HD2 PRO A 72 7.944 -1.247 14.659 1.00 0.00 H new ATOM 0 HD3 PRO A 72 7.334 -2.249 15.961 1.00 0.00 H new ATOM 1130 N PRO A 73 8.165 -5.416 11.535 1.00 0.00 N ATOM 1131 CA PRO A 73 8.549 -5.524 10.119 1.00 0.00 C ATOM 1132 C PRO A 73 8.170 -4.344 9.208 1.00 0.00 C ATOM 1133 O PRO A 73 8.990 -3.919 8.390 1.00 0.00 O ATOM 1134 CB PRO A 73 7.933 -6.838 9.630 1.00 0.00 C ATOM 1135 CG PRO A 73 7.937 -7.703 10.886 1.00 0.00 C ATOM 1136 CD PRO A 73 7.642 -6.698 11.999 1.00 0.00 C ATOM 0 HA PRO A 73 9.637 -5.503 10.058 1.00 0.00 H new ATOM 0 HB2 PRO A 73 6.925 -6.692 9.243 1.00 0.00 H new ATOM 0 HB3 PRO A 73 8.520 -7.286 8.829 1.00 0.00 H new ATOM 0 HG2 PRO A 73 7.180 -8.486 10.839 1.00 0.00 H new ATOM 0 HG3 PRO A 73 8.898 -8.197 11.033 1.00 0.00 H new ATOM 0 HD2 PRO A 73 6.571 -6.635 12.194 1.00 0.00 H new ATOM 0 HD3 PRO A 73 8.118 -6.999 12.932 1.00 0.00 H new ATOM 1144 N HIS A 74 6.965 -3.773 9.347 1.00 0.00 N ATOM 1145 CA HIS A 74 6.551 -2.611 8.540 1.00 0.00 C ATOM 1146 C HIS A 74 7.414 -1.373 8.826 1.00 0.00 C ATOM 1147 O HIS A 74 7.877 -0.718 7.892 1.00 0.00 O ATOM 1148 CB HIS A 74 5.039 -2.349 8.687 1.00 0.00 C ATOM 1149 CG HIS A 74 4.559 -1.988 10.073 1.00 0.00 C ATOM 1150 ND1 HIS A 74 4.084 -2.871 11.026 1.00 0.00 N ATOM 1151 CD2 HIS A 74 4.400 -0.722 10.567 1.00 0.00 C ATOM 1152 CE1 HIS A 74 3.644 -2.154 12.078 1.00 0.00 C ATOM 1153 NE2 HIS A 74 3.843 -0.846 11.827 1.00 0.00 N ATOM 0 H HIS A 74 6.259 -4.095 10.009 1.00 0.00 H new ATOM 0 HA HIS A 74 6.726 -2.849 7.491 1.00 0.00 H new ATOM 0 HB2 HIS A 74 4.763 -1.543 8.007 1.00 0.00 H new ATOM 0 HB3 HIS A 74 4.503 -3.240 8.359 1.00 0.00 H new ATOM 0 HD2 HIS A 74 4.660 0.200 10.068 1.00 0.00 H new ATOM 0 HE1 HIS A 74 3.204 -2.562 12.976 1.00 0.00 H new ATOM 0 HE2 HIS A 74 3.621 -0.077 12.459 1.00 0.00 H new ATOM 1162 N LEU A 75 7.718 -1.088 10.097 1.00 0.00 N ATOM 1163 CA LEU A 75 8.618 0.007 10.482 1.00 0.00 C ATOM 1164 C LEU A 75 10.085 -0.327 10.155 1.00 0.00 C ATOM 1165 O LEU A 75 10.811 0.574 9.734 1.00 0.00 O ATOM 1166 CB LEU A 75 8.407 0.387 11.960 1.00 0.00 C ATOM 1167 CG LEU A 75 7.200 1.315 12.214 1.00 0.00 C ATOM 1168 CD1 LEU A 75 6.967 1.492 13.715 1.00 0.00 C ATOM 1169 CD2 LEU A 75 7.399 2.713 11.619 1.00 0.00 C ATOM 0 H LEU A 75 7.346 -1.611 10.890 1.00 0.00 H new ATOM 0 HA LEU A 75 8.369 0.886 9.887 1.00 0.00 H new ATOM 0 HB2 LEU A 75 8.277 -0.525 12.542 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.309 0.875 12.329 1.00 0.00 H new ATOM 0 HG LEU A 75 6.347 0.836 11.733 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.112 2.149 13.876 1.00 0.00 H new ATOM 0 HD12 LEU A 75 6.769 0.521 14.169 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.854 1.932 14.171 1.00 0.00 H new ATOM 0 HD21 LEU A 75 6.521 3.325 11.826 1.00 0.00 H new ATOM 0 HD22 LEU A 75 8.278 3.177 12.066 1.00 0.00 H new ATOM 0 HD23 LEU A 75 7.539 2.633 10.541 1.00 0.00 H new ATOM 1181 N LYS A 76 10.518 -1.600 10.242 1.00 0.00 N ATOM 1182 CA LYS A 76 11.869 -2.015 9.793 1.00 0.00 C ATOM 1183 C LYS A 76 12.048 -1.677 8.311 1.00 0.00 C ATOM 1184 O LYS A 76 13.074 -1.125 7.918 1.00 0.00 O ATOM 1185 CB LYS A 76 12.125 -3.528 9.977 1.00 0.00 C ATOM 1186 CG LYS A 76 12.210 -4.017 11.427 1.00 0.00 C ATOM 1187 CD LYS A 76 12.560 -5.510 11.491 1.00 0.00 C ATOM 1188 CE LYS A 76 12.663 -5.967 12.948 1.00 0.00 C ATOM 1189 NZ LYS A 76 13.128 -7.365 13.039 1.00 0.00 N ATOM 0 H LYS A 76 9.954 -2.362 10.619 1.00 0.00 H new ATOM 0 HA LYS A 76 12.582 -1.472 10.413 1.00 0.00 H new ATOM 0 HB2 LYS A 76 11.328 -4.076 9.474 1.00 0.00 H new ATOM 0 HB3 LYS A 76 13.056 -3.784 9.472 1.00 0.00 H new ATOM 0 HG2 LYS A 76 12.964 -3.441 11.964 1.00 0.00 H new ATOM 0 HG3 LYS A 76 11.258 -3.842 11.929 1.00 0.00 H new ATOM 0 HD2 LYS A 76 11.798 -6.092 10.973 1.00 0.00 H new ATOM 0 HD3 LYS A 76 13.504 -5.692 10.978 1.00 0.00 H new ATOM 0 HE2 LYS A 76 13.351 -5.317 13.488 1.00 0.00 H new ATOM 0 HE3 LYS A 76 11.690 -5.873 13.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 12.980 -7.718 14.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 12.592 -7.954 12.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 14.140 -7.410 12.805 1.00 0.00 H new ATOM 1203 N THR A 77 11.030 -1.966 7.497 1.00 0.00 N ATOM 1204 CA THR A 77 11.024 -1.664 6.058 1.00 0.00 C ATOM 1205 C THR A 77 11.081 -0.155 5.804 1.00 0.00 C ATOM 1206 O THR A 77 11.889 0.288 4.989 1.00 0.00 O ATOM 1207 CB THR A 77 9.802 -2.280 5.357 1.00 0.00 C ATOM 1208 OG1 THR A 77 9.752 -3.675 5.581 1.00 0.00 O ATOM 1209 CG2 THR A 77 9.871 -2.083 3.844 1.00 0.00 C ATOM 0 H THR A 77 10.176 -2.421 7.819 1.00 0.00 H new ATOM 0 HA THR A 77 11.921 -2.116 5.633 1.00 0.00 H new ATOM 0 HB THR A 77 8.924 -1.781 5.768 1.00 0.00 H new ATOM 0 HG1 THR A 77 9.486 -3.848 6.508 1.00 0.00 H new ATOM 0 HG21 THR A 77 8.993 -2.530 3.378 1.00 0.00 H new ATOM 0 HG22 THR A 77 9.900 -1.017 3.617 1.00 0.00 H new ATOM 0 HG23 THR A 77 10.770 -2.561 3.455 1.00 0.00 H new ATOM 1217 N GLN A 78 10.291 0.659 6.521 1.00 0.00 N ATOM 1218 CA GLN A 78 10.334 2.123 6.377 1.00 0.00 C ATOM 1219 C GLN A 78 11.718 2.680 6.749 1.00 0.00 C ATOM 1220 O GLN A 78 12.230 3.578 6.074 1.00 0.00 O ATOM 1221 CB GLN A 78 9.237 2.784 7.233 1.00 0.00 C ATOM 1222 CG GLN A 78 7.813 2.549 6.702 1.00 0.00 C ATOM 1223 CD GLN A 78 7.567 3.217 5.350 1.00 0.00 C ATOM 1224 OE1 GLN A 78 7.620 2.596 4.297 1.00 0.00 O ATOM 1225 NE2 GLN A 78 7.296 4.506 5.318 1.00 0.00 N ATOM 0 H GLN A 78 9.613 0.328 7.208 1.00 0.00 H new ATOM 0 HA GLN A 78 10.148 2.361 5.330 1.00 0.00 H new ATOM 0 HB2 GLN A 78 9.303 2.401 8.251 1.00 0.00 H new ATOM 0 HB3 GLN A 78 9.424 3.857 7.283 1.00 0.00 H new ATOM 0 HG2 GLN A 78 7.637 1.477 6.610 1.00 0.00 H new ATOM 0 HG3 GLN A 78 7.093 2.929 7.426 1.00 0.00 H new ATOM 0 HE21 GLN A 78 7.248 5.039 6.186 1.00 0.00 H new ATOM 0 HE22 GLN A 78 7.134 4.971 4.425 1.00 0.00 H new ATOM 1234 N LEU A 79 12.347 2.131 7.790 1.00 0.00 N ATOM 1235 CA LEU A 79 13.692 2.511 8.218 1.00 0.00 C ATOM 1236 C LEU A 79 14.732 2.128 7.148 1.00 0.00 C ATOM 1237 O LEU A 79 15.548 2.965 6.765 1.00 0.00 O ATOM 1238 CB LEU A 79 13.958 1.876 9.594 1.00 0.00 C ATOM 1239 CG LEU A 79 15.149 2.422 10.406 1.00 0.00 C ATOM 1240 CD1 LEU A 79 16.512 2.095 9.801 1.00 0.00 C ATOM 1241 CD2 LEU A 79 15.048 3.930 10.629 1.00 0.00 C ATOM 0 H LEU A 79 11.930 1.400 8.366 1.00 0.00 H new ATOM 0 HA LEU A 79 13.777 3.592 8.327 1.00 0.00 H new ATOM 0 HB2 LEU A 79 13.058 1.990 10.198 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.111 0.807 9.448 1.00 0.00 H new ATOM 0 HG LEU A 79 15.082 1.906 11.364 1.00 0.00 H new ATOM 0 HD11 LEU A 79 17.299 2.513 10.429 1.00 0.00 H new ATOM 0 HD12 LEU A 79 16.633 1.013 9.739 1.00 0.00 H new ATOM 0 HD13 LEU A 79 16.579 2.525 8.802 1.00 0.00 H new ATOM 0 HD21 LEU A 79 15.908 4.271 11.205 1.00 0.00 H new ATOM 0 HD22 LEU A 79 15.031 4.440 9.666 1.00 0.00 H new ATOM 0 HD23 LEU A 79 14.132 4.157 11.175 1.00 0.00 H new ATOM 1253 N GLU A 80 14.679 0.908 6.592 1.00 0.00 N ATOM 1254 CA GLU A 80 15.594 0.512 5.511 1.00 0.00 C ATOM 1255 C GLU A 80 15.406 1.375 4.255 1.00 0.00 C ATOM 1256 O GLU A 80 16.395 1.720 3.614 1.00 0.00 O ATOM 1257 CB GLU A 80 15.475 -0.980 5.167 1.00 0.00 C ATOM 1258 CG GLU A 80 16.134 -1.875 6.227 1.00 0.00 C ATOM 1259 CD GLU A 80 16.445 -3.258 5.642 1.00 0.00 C ATOM 1260 OE1 GLU A 80 17.602 -3.455 5.196 1.00 0.00 O ATOM 1261 OE2 GLU A 80 15.523 -4.109 5.609 1.00 0.00 O ATOM 0 H GLU A 80 14.017 0.183 6.871 1.00 0.00 H new ATOM 0 HA GLU A 80 16.602 0.684 5.887 1.00 0.00 H new ATOM 0 HB2 GLU A 80 14.422 -1.246 5.073 1.00 0.00 H new ATOM 0 HB3 GLU A 80 15.939 -1.166 4.198 1.00 0.00 H new ATOM 0 HG2 GLU A 80 17.053 -1.410 6.585 1.00 0.00 H new ATOM 0 HG3 GLU A 80 15.473 -1.978 7.087 1.00 0.00 H new ATOM 1268 N ILE A 81 14.179 1.794 3.916 1.00 0.00 N ATOM 1269 CA ILE A 81 13.926 2.717 2.792 1.00 0.00 C ATOM 1270 C ILE A 81 14.610 4.070 3.059 1.00 0.00 C ATOM 1271 O ILE A 81 15.256 4.624 2.166 1.00 0.00 O ATOM 1272 CB ILE A 81 12.405 2.849 2.530 1.00 0.00 C ATOM 1273 CG1 ILE A 81 11.884 1.534 1.904 1.00 0.00 C ATOM 1274 CG2 ILE A 81 12.076 4.036 1.604 1.00 0.00 C ATOM 1275 CD1 ILE A 81 10.355 1.403 1.900 1.00 0.00 C ATOM 0 H ILE A 81 13.334 1.506 4.409 1.00 0.00 H new ATOM 0 HA ILE A 81 14.363 2.313 1.879 1.00 0.00 H new ATOM 0 HB ILE A 81 11.913 3.037 3.484 1.00 0.00 H new ATOM 0 HG12 ILE A 81 12.246 1.464 0.878 1.00 0.00 H new ATOM 0 HG13 ILE A 81 12.308 0.691 2.450 1.00 0.00 H new ATOM 0 HG21 ILE A 81 10.998 4.089 1.449 1.00 0.00 H new ATOM 0 HG22 ILE A 81 12.422 4.962 2.063 1.00 0.00 H new ATOM 0 HG23 ILE A 81 12.574 3.898 0.644 1.00 0.00 H new ATOM 0 HD11 ILE A 81 10.072 0.454 1.444 1.00 0.00 H new ATOM 0 HD12 ILE A 81 9.984 1.439 2.924 1.00 0.00 H new ATOM 0 HD13 ILE A 81 9.921 2.223 1.328 1.00 0.00 H new ATOM 1287 N ASN A 82 14.533 4.584 4.292 1.00 0.00 N ATOM 1288 CA ASN A 82 15.223 5.818 4.695 1.00 0.00 C ATOM 1289 C ASN A 82 16.754 5.664 4.588 1.00 0.00 C ATOM 1290 O ASN A 82 17.429 6.575 4.106 1.00 0.00 O ATOM 1291 CB ASN A 82 14.787 6.229 6.114 1.00 0.00 C ATOM 1292 CG ASN A 82 13.514 7.057 6.099 1.00 0.00 C ATOM 1293 OD1 ASN A 82 13.543 8.279 6.068 1.00 0.00 O ATOM 1294 ND2 ASN A 82 12.358 6.434 6.104 1.00 0.00 N ATOM 0 H ASN A 82 13.989 4.156 5.041 1.00 0.00 H new ATOM 0 HA ASN A 82 14.938 6.616 4.009 1.00 0.00 H new ATOM 0 HB2 ASN A 82 14.632 5.336 6.719 1.00 0.00 H new ATOM 0 HB3 ASN A 82 15.586 6.800 6.588 1.00 0.00 H new ATOM 0 HD21 ASN A 82 11.490 6.969 6.082 1.00 0.00 H new ATOM 0 HD22 ASN A 82 12.328 5.415 6.130 1.00 0.00 H new ATOM 1301 N GLY A 83 17.300 4.506 4.978 1.00 0.00 N ATOM 1302 CA GLY A 83 18.728 4.195 4.855 1.00 0.00 C ATOM 1303 C GLY A 83 19.165 4.115 3.388 1.00 0.00 C ATOM 1304 O GLY A 83 20.091 4.815 2.977 1.00 0.00 O ATOM 0 H GLY A 83 16.755 3.750 5.393 1.00 0.00 H new ATOM 0 HA2 GLY A 83 19.313 4.959 5.368 1.00 0.00 H new ATOM 0 HA3 GLY A 83 18.938 3.247 5.350 1.00 0.00 H new ATOM 1308 N ARG A 84 18.457 3.319 2.574 1.00 0.00 N ATOM 1309 CA ARG A 84 18.681 3.137 1.126 1.00 0.00 C ATOM 1310 C ARG A 84 18.668 4.441 0.340 1.00 0.00 C ATOM 1311 O ARG A 84 19.471 4.584 -0.574 1.00 0.00 O ATOM 1312 CB ARG A 84 17.649 2.152 0.547 1.00 0.00 C ATOM 1313 CG ARG A 84 17.959 0.686 0.898 1.00 0.00 C ATOM 1314 CD ARG A 84 19.168 0.107 0.146 1.00 0.00 C ATOM 1315 NE ARG A 84 18.945 0.081 -1.313 1.00 0.00 N ATOM 1316 CZ ARG A 84 19.828 0.334 -2.266 1.00 0.00 C ATOM 1317 NH1 ARG A 84 21.075 0.636 -2.020 1.00 0.00 N ATOM 1318 NH2 ARG A 84 19.469 0.286 -3.519 1.00 0.00 N ATOM 0 H ARG A 84 17.678 2.758 2.918 1.00 0.00 H new ATOM 0 HA ARG A 84 19.685 2.726 1.019 1.00 0.00 H new ATOM 0 HB2 ARG A 84 16.658 2.409 0.923 1.00 0.00 H new ATOM 0 HB3 ARG A 84 17.617 2.262 -0.537 1.00 0.00 H new ATOM 0 HG2 ARG A 84 18.140 0.610 1.970 1.00 0.00 H new ATOM 0 HG3 ARG A 84 17.082 0.077 0.679 1.00 0.00 H new ATOM 0 HD2 ARG A 84 20.053 0.703 0.368 1.00 0.00 H new ATOM 0 HD3 ARG A 84 19.367 -0.904 0.501 1.00 0.00 H new ATOM 0 HE ARG A 84 18.003 -0.159 -1.622 1.00 0.00 H new ATOM 0 HH11 ARG A 84 21.407 0.685 -1.057 1.00 0.00 H new ATOM 0 HH12 ARG A 84 21.716 0.822 -2.791 1.00 0.00 H new ATOM 0 HH21 ARG A 84 18.507 0.053 -3.765 1.00 0.00 H new ATOM 0 HH22 ARG A 84 20.150 0.481 -4.253 1.00 0.00 H new ATOM 1332 N ASN A 85 17.825 5.410 0.695 1.00 0.00 N ATOM 1333 CA ASN A 85 17.808 6.716 0.018 1.00 0.00 C ATOM 1334 C ASN A 85 19.175 7.437 0.068 1.00 0.00 C ATOM 1335 O ASN A 85 19.516 8.148 -0.878 1.00 0.00 O ATOM 1336 CB ASN A 85 16.667 7.588 0.574 1.00 0.00 C ATOM 1337 CG ASN A 85 15.389 7.419 -0.231 1.00 0.00 C ATOM 1338 OD1 ASN A 85 15.111 8.166 -1.157 1.00 0.00 O ATOM 1339 ND2 ASN A 85 14.583 6.429 0.071 1.00 0.00 N ATOM 0 H ASN A 85 17.142 5.320 1.448 1.00 0.00 H new ATOM 0 HA ASN A 85 17.616 6.537 -1.040 1.00 0.00 H new ATOM 0 HB2 ASN A 85 16.480 7.323 1.615 1.00 0.00 H new ATOM 0 HB3 ASN A 85 16.970 8.635 0.561 1.00 0.00 H new ATOM 0 HD21 ASN A 85 13.728 6.285 -0.466 1.00 0.00 H new ATOM 0 HD22 ASN A 85 14.811 5.803 0.843 1.00 0.00 H new ATOM 1346 N ASN A 86 19.986 7.212 1.111 1.00 0.00 N ATOM 1347 CA ASN A 86 21.346 7.759 1.210 1.00 0.00 C ATOM 1348 C ASN A 86 22.329 6.972 0.318 1.00 0.00 C ATOM 1349 O ASN A 86 23.160 7.584 -0.354 1.00 0.00 O ATOM 1350 CB ASN A 86 21.793 7.770 2.679 1.00 0.00 C ATOM 1351 CG ASN A 86 21.102 8.820 3.540 1.00 0.00 C ATOM 1352 OD1 ASN A 86 20.283 9.618 3.103 1.00 0.00 O ATOM 1353 ND2 ASN A 86 21.424 8.854 4.812 1.00 0.00 N ATOM 0 H ASN A 86 19.716 6.643 1.913 1.00 0.00 H new ATOM 0 HA ASN A 86 21.343 8.786 0.845 1.00 0.00 H new ATOM 0 HB2 ASN A 86 21.608 6.786 3.110 1.00 0.00 H new ATOM 0 HB3 ASN A 86 22.869 7.938 2.717 1.00 0.00 H new ATOM 0 HD21 ASN A 86 20.993 9.542 5.429 1.00 0.00 H new ATOM 0 HD22 ASN A 86 22.106 8.192 5.183 1.00 0.00 H new ATOM 1360 N LEU A 87 22.190 5.638 0.230 1.00 0.00 N ATOM 1361 CA LEU A 87 22.995 4.800 -0.679 1.00 0.00 C ATOM 1362 C LEU A 87 22.705 5.167 -2.150 1.00 0.00 C ATOM 1363 O LEU A 87 23.620 5.247 -2.968 1.00 0.00 O ATOM 1364 CB LEU A 87 22.704 3.298 -0.476 1.00 0.00 C ATOM 1365 CG LEU A 87 23.277 2.578 0.757 1.00 0.00 C ATOM 1366 CD1 LEU A 87 24.788 2.701 0.903 1.00 0.00 C ATOM 1367 CD2 LEU A 87 22.668 3.020 2.076 1.00 0.00 C ATOM 0 H LEU A 87 21.518 5.110 0.786 1.00 0.00 H new ATOM 0 HA LEU A 87 24.043 4.990 -0.446 1.00 0.00 H new ATOM 0 HB2 LEU A 87 21.621 3.175 -0.453 1.00 0.00 H new ATOM 0 HB3 LEU A 87 23.066 2.772 -1.360 1.00 0.00 H new ATOM 0 HG LEU A 87 23.007 1.541 0.556 1.00 0.00 H new ATOM 0 HD11 LEU A 87 25.112 2.166 1.796 1.00 0.00 H new ATOM 0 HD12 LEU A 87 25.274 2.272 0.027 1.00 0.00 H new ATOM 0 HD13 LEU A 87 25.061 3.753 0.991 1.00 0.00 H new ATOM 0 HD21 LEU A 87 23.127 2.464 2.893 1.00 0.00 H new ATOM 0 HD22 LEU A 87 22.844 4.086 2.219 1.00 0.00 H new ATOM 0 HD23 LEU A 87 21.595 2.828 2.064 1.00 0.00 H new ATOM 1379 N ILE A 88 21.433 5.413 -2.478 1.00 0.00 N ATOM 1380 CA ILE A 88 20.959 5.857 -3.801 1.00 0.00 C ATOM 1381 C ILE A 88 21.391 7.317 -4.060 1.00 0.00 C ATOM 1382 O ILE A 88 21.564 7.728 -5.209 1.00 0.00 O ATOM 1383 CB ILE A 88 19.414 5.692 -3.864 1.00 0.00 C ATOM 1384 CG1 ILE A 88 19.024 4.194 -3.774 1.00 0.00 C ATOM 1385 CG2 ILE A 88 18.801 6.308 -5.136 1.00 0.00 C ATOM 1386 CD1 ILE A 88 17.535 3.939 -3.502 1.00 0.00 C ATOM 0 H ILE A 88 20.673 5.305 -1.807 1.00 0.00 H new ATOM 0 HA ILE A 88 21.405 5.245 -4.585 1.00 0.00 H new ATOM 0 HB ILE A 88 19.009 6.233 -3.009 1.00 0.00 H new ATOM 0 HG12 ILE A 88 19.299 3.703 -4.708 1.00 0.00 H new ATOM 0 HG13 ILE A 88 19.610 3.726 -2.983 1.00 0.00 H new ATOM 0 HG21 ILE A 88 17.721 6.163 -5.126 1.00 0.00 H new ATOM 0 HG22 ILE A 88 19.024 7.375 -5.168 1.00 0.00 H new ATOM 0 HG23 ILE A 88 19.224 5.823 -6.016 1.00 0.00 H new ATOM 0 HD11 ILE A 88 17.352 2.865 -3.455 1.00 0.00 H new ATOM 0 HD12 ILE A 88 17.255 4.397 -2.553 1.00 0.00 H new ATOM 0 HD13 ILE A 88 16.939 4.374 -4.304 1.00 0.00 H new ATOM 1398 N GLN A 89 21.573 8.096 -2.985 1.00 0.00 N ATOM 1399 CA GLN A 89 21.929 9.518 -2.965 1.00 0.00 C ATOM 1400 C GLN A 89 20.989 10.363 -3.849 1.00 0.00 C ATOM 1401 O GLN A 89 21.427 11.210 -4.630 1.00 0.00 O ATOM 1402 CB GLN A 89 23.436 9.704 -3.239 1.00 0.00 C ATOM 1403 CG GLN A 89 23.953 11.012 -2.620 1.00 0.00 C ATOM 1404 CD GLN A 89 25.384 11.323 -3.044 1.00 0.00 C ATOM 1405 OE1 GLN A 89 25.634 11.917 -4.084 1.00 0.00 O ATOM 1406 NE2 GLN A 89 26.372 10.947 -2.265 1.00 0.00 N ATOM 0 H GLN A 89 21.468 7.721 -2.042 1.00 0.00 H new ATOM 0 HA GLN A 89 21.766 9.914 -1.963 1.00 0.00 H new ATOM 0 HB2 GLN A 89 23.990 8.860 -2.829 1.00 0.00 H new ATOM 0 HB3 GLN A 89 23.615 9.711 -4.314 1.00 0.00 H new ATOM 0 HG2 GLN A 89 23.301 11.834 -2.915 1.00 0.00 H new ATOM 0 HG3 GLN A 89 23.905 10.942 -1.533 1.00 0.00 H new ATOM 0 HE21 GLN A 89 26.176 10.451 -1.396 1.00 0.00 H new ATOM 0 HE22 GLN A 89 27.336 11.151 -2.529 1.00 0.00 H new ATOM 1415 N GLN A 90 19.677 10.113 -3.737 1.00 0.00 N ATOM 1416 CA GLN A 90 18.609 10.761 -4.521 1.00 0.00 C ATOM 1417 C GLN A 90 18.681 12.305 -4.537 1.00 0.00 C ATOM 1418 O GLN A 90 18.355 12.930 -5.549 1.00 0.00 O ATOM 1419 CB GLN A 90 17.251 10.250 -4.004 1.00 0.00 C ATOM 1420 CG GLN A 90 16.080 10.622 -4.929 1.00 0.00 C ATOM 1421 CD GLN A 90 14.751 10.064 -4.419 1.00 0.00 C ATOM 1422 OE1 GLN A 90 14.012 10.714 -3.688 1.00 0.00 O ATOM 1423 NE2 GLN A 90 14.386 8.854 -4.788 1.00 0.00 N ATOM 0 H GLN A 90 19.314 9.429 -3.074 1.00 0.00 H new ATOM 0 HA GLN A 90 18.744 10.483 -5.566 1.00 0.00 H new ATOM 0 HB2 GLN A 90 17.293 9.166 -3.897 1.00 0.00 H new ATOM 0 HB3 GLN A 90 17.068 10.661 -3.011 1.00 0.00 H new ATOM 0 HG2 GLN A 90 16.011 11.707 -5.009 1.00 0.00 H new ATOM 0 HG3 GLN A 90 16.274 10.240 -5.931 1.00 0.00 H new ATOM 0 HE21 GLN A 90 14.991 8.302 -5.396 1.00 0.00 H new ATOM 0 HE22 GLN A 90 13.498 8.469 -4.466 1.00 0.00 H new ATOM 1432 N LYS A 91 19.142 12.923 -3.438 1.00 0.00 N ATOM 1433 CA LYS A 91 19.331 14.382 -3.299 1.00 0.00 C ATOM 1434 C LYS A 91 20.421 14.956 -4.231 1.00 0.00 C ATOM 1435 O LYS A 91 20.401 16.148 -4.542 1.00 0.00 O ATOM 1436 CB LYS A 91 19.632 14.678 -1.815 1.00 0.00 C ATOM 1437 CG LYS A 91 19.701 16.164 -1.418 1.00 0.00 C ATOM 1438 CD LYS A 91 18.399 16.932 -1.691 1.00 0.00 C ATOM 1439 CE LYS A 91 18.511 18.365 -1.162 1.00 0.00 C ATOM 1440 NZ LYS A 91 17.264 19.121 -1.404 1.00 0.00 N ATOM 0 H LYS A 91 19.402 12.410 -2.596 1.00 0.00 H new ATOM 0 HA LYS A 91 18.416 14.884 -3.612 1.00 0.00 H new ATOM 0 HB2 LYS A 91 18.866 14.196 -1.207 1.00 0.00 H new ATOM 0 HB3 LYS A 91 20.583 14.210 -1.558 1.00 0.00 H new ATOM 0 HG2 LYS A 91 19.942 16.238 -0.357 1.00 0.00 H new ATOM 0 HG3 LYS A 91 20.516 16.640 -1.964 1.00 0.00 H new ATOM 0 HD2 LYS A 91 18.194 16.946 -2.761 1.00 0.00 H new ATOM 0 HD3 LYS A 91 17.561 16.424 -1.213 1.00 0.00 H new ATOM 0 HE2 LYS A 91 18.727 18.346 -0.094 1.00 0.00 H new ATOM 0 HE3 LYS A 91 19.346 18.871 -1.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 17.367 20.088 -1.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 17.073 19.158 -2.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 16.473 18.649 -0.921 1.00 0.00 H new ATOM 1454 N ASN A 92 21.351 14.114 -4.690 1.00 0.00 N ATOM 1455 CA ASN A 92 22.462 14.454 -5.583 1.00 0.00 C ATOM 1456 C ASN A 92 22.791 13.273 -6.515 1.00 0.00 C ATOM 1457 O ASN A 92 22.954 13.453 -7.728 1.00 0.00 O ATOM 1458 CB ASN A 92 23.675 14.851 -4.720 1.00 0.00 C ATOM 1459 CG ASN A 92 24.892 15.201 -5.563 1.00 0.00 C ATOM 1460 OD1 ASN A 92 24.943 16.227 -6.226 1.00 0.00 O ATOM 1461 ND2 ASN A 92 25.902 14.360 -5.579 1.00 0.00 N ATOM 0 H ASN A 92 21.349 13.126 -4.436 1.00 0.00 H new ATOM 0 HA ASN A 92 22.187 15.293 -6.222 1.00 0.00 H new ATOM 0 HB2 ASN A 92 23.410 15.704 -4.096 1.00 0.00 H new ATOM 0 HB3 ASN A 92 23.925 14.030 -4.048 1.00 0.00 H new ATOM 0 HD21 ASN A 92 26.726 14.564 -6.144 1.00 0.00 H new ATOM 0 HD22 ASN A 92 25.861 13.504 -5.027 1.00 0.00 H new TER 1468 ASN A 92 ATOM 1469 P G B 95 27.052 11.618 33.455 1.00 0.00 P ATOM 1470 OP1 G B 95 26.743 12.757 34.356 1.00 0.00 O ATOM 1471 OP2 G B 95 28.440 11.444 32.960 1.00 0.00 O ATOM 1472 O5' G B 95 26.114 11.795 32.137 1.00 0.00 O ATOM 1473 C5' G B 95 24.695 11.772 32.223 1.00 0.00 C ATOM 1474 C4' G B 95 24.051 11.899 30.835 1.00 0.00 C ATOM 1475 O4' G B 95 24.142 13.235 30.349 1.00 0.00 O ATOM 1476 C3' G B 95 24.635 10.982 29.749 1.00 0.00 C ATOM 1477 O3' G B 95 24.088 9.669 29.738 1.00 0.00 O ATOM 1478 C2' G B 95 24.211 11.745 28.490 1.00 0.00 C ATOM 1479 O2' G B 95 22.849 11.503 28.147 1.00 0.00 O ATOM 1480 C1' G B 95 24.363 13.202 28.941 1.00 0.00 C ATOM 1481 N9 G B 95 25.714 13.736 28.635 1.00 0.00 N ATOM 1482 C8 G B 95 26.853 13.729 29.407 1.00 0.00 C ATOM 1483 N7 G B 95 27.891 14.296 28.849 1.00 0.00 N ATOM 1484 C5 G B 95 27.405 14.718 27.603 1.00 0.00 C ATOM 1485 C6 G B 95 28.039 15.414 26.510 1.00 0.00 C ATOM 1486 O6 G B 95 29.203 15.805 26.408 1.00 0.00 O ATOM 1487 N1 G B 95 27.190 15.660 25.447 1.00 0.00 N ATOM 1488 C2 G B 95 25.887 15.282 25.424 1.00 0.00 C ATOM 1489 N2 G B 95 25.190 15.536 24.352 1.00 0.00 N ATOM 1490 N3 G B 95 25.265 14.630 26.403 1.00 0.00 N ATOM 1491 C4 G B 95 26.074 14.378 27.473 1.00 0.00 C ATOM 0 H5' G B 95 24.354 12.587 32.861 1.00 0.00 H new ATOM 0 H5'' G B 95 24.372 10.843 32.693 1.00 0.00 H new ATOM 0 H4' G B 95 23.020 11.590 31.007 1.00 0.00 H new ATOM 0 H3' G B 95 25.703 10.806 29.875 1.00 0.00 H new ATOM 0 H2' G B 95 24.792 11.462 27.612 1.00 0.00 H new ATOM 0 HO2' G B 95 22.808 10.877 27.394 1.00 0.00 H new ATOM 0 H1' G B 95 23.644 13.824 28.407 1.00 0.00 H new ATOM 0 H8 G B 95 26.887 13.291 30.394 1.00 0.00 H new ATOM 0 H1 G B 95 27.563 16.153 24.636 1.00 0.00 H new ATOM 0 H21 G B 95 24.208 15.264 24.306 1.00 0.00 H new ATOM 0 H22 G B 95 25.627 16.007 23.560 1.00 0.00 H new ATOM 1503 P U B 96 24.866 8.403 30.360 1.00 0.00 P ATOM 1504 OP1 U B 96 23.909 7.278 30.427 1.00 0.00 O ATOM 1505 OP2 U B 96 25.594 8.825 31.577 1.00 0.00 O ATOM 1506 O5' U B 96 25.936 8.074 29.197 1.00 0.00 O ATOM 1507 C5' U B 96 27.288 8.506 29.259 1.00 0.00 C ATOM 1508 C4' U B 96 28.087 8.042 28.031 1.00 0.00 C ATOM 1509 O4' U B 96 28.270 6.628 28.059 1.00 0.00 O ATOM 1510 C3' U B 96 27.475 8.425 26.670 1.00 0.00 C ATOM 1511 O3' U B 96 28.236 9.419 25.987 1.00 0.00 O ATOM 1512 C2' U B 96 27.543 7.101 25.890 1.00 0.00 C ATOM 1513 O2' U B 96 28.767 6.981 25.173 1.00 0.00 O ATOM 1514 C1' U B 96 27.539 6.032 26.991 1.00 0.00 C ATOM 1515 N1 U B 96 26.213 5.537 27.489 1.00 0.00 N ATOM 1516 C2 U B 96 26.237 4.472 28.407 1.00 0.00 C ATOM 1517 O2 U B 96 27.262 3.877 28.745 1.00 0.00 O ATOM 1518 N3 U B 96 25.030 4.063 28.937 1.00 0.00 N ATOM 1519 C4 U B 96 23.796 4.572 28.615 1.00 0.00 C ATOM 1520 O4 U B 96 22.788 4.134 29.165 1.00 0.00 O ATOM 1521 C5 U B 96 23.828 5.604 27.604 1.00 0.00 C ATOM 1522 C6 U B 96 24.998 6.054 27.076 1.00 0.00 C ATOM 0 H5' U B 96 27.754 8.117 30.165 1.00 0.00 H new ATOM 0 H5'' U B 96 27.320 9.594 29.325 1.00 0.00 H new ATOM 0 H4' U B 96 29.036 8.573 28.109 1.00 0.00 H new ATOM 0 H3' U B 96 26.476 8.848 26.775 1.00 0.00 H new ATOM 0 H2' U B 96 26.730 7.021 25.169 1.00 0.00 H new ATOM 0 HO2' U B 96 29.078 7.871 24.905 1.00 0.00 H new ATOM 0 H1' U B 96 27.966 5.122 26.569 1.00 0.00 H new ATOM 0 H3 U B 96 25.057 3.315 29.630 1.00 0.00 H new ATOM 0 H5 U B 96 22.898 6.030 27.258 1.00 0.00 H new ATOM 0 H6 U B 96 24.978 6.827 26.322 1.00 0.00 H new ATOM 1533 P C B 97 27.890 10.984 26.103 1.00 0.00 P ATOM 1534 OP1 C B 97 29.030 11.758 25.564 1.00 0.00 O ATOM 1535 OP2 C B 97 27.384 11.257 27.464 1.00 0.00 O ATOM 1536 O5' C B 97 26.666 11.112 25.068 1.00 0.00 O ATOM 1537 C5' C B 97 26.833 10.780 23.696 1.00 0.00 C ATOM 1538 C4' C B 97 25.567 11.037 22.865 1.00 0.00 C ATOM 1539 O4' C B 97 24.515 10.180 23.288 1.00 0.00 O ATOM 1540 C3' C B 97 25.056 12.477 22.991 1.00 0.00 C ATOM 1541 O3' C B 97 24.487 12.902 21.754 1.00 0.00 O ATOM 1542 C2' C B 97 23.933 12.326 24.022 1.00 0.00 C ATOM 1543 O2' C B 97 22.987 13.391 23.934 1.00 0.00 O ATOM 1544 C1' C B 97 23.375 10.970 23.594 1.00 0.00 C ATOM 1545 N1 C B 97 22.417 10.386 24.582 1.00 0.00 N ATOM 1546 C2 C B 97 22.750 9.292 25.409 1.00 0.00 C ATOM 1547 O2 C B 97 23.903 8.892 25.581 1.00 0.00 O ATOM 1548 N3 C B 97 21.774 8.621 26.074 1.00 0.00 N ATOM 1549 C4 C B 97 20.538 9.065 26.007 1.00 0.00 C ATOM 1550 N4 C B 97 19.634 8.349 26.613 1.00 0.00 N ATOM 1551 C5 C B 97 20.162 10.232 25.296 1.00 0.00 C ATOM 1552 C6 C B 97 21.130 10.867 24.592 1.00 0.00 C ATOM 0 H5' C B 97 27.111 9.729 23.612 1.00 0.00 H new ATOM 0 H5'' C B 97 27.658 11.361 23.284 1.00 0.00 H new ATOM 0 H4' C B 97 25.847 10.847 21.829 1.00 0.00 H new ATOM 0 H3' C B 97 25.831 13.195 23.259 1.00 0.00 H new ATOM 0 H2' C B 97 24.237 12.370 25.068 1.00 0.00 H new ATOM 0 HO2' C B 97 22.886 13.663 22.998 1.00 0.00 H new ATOM 0 H1' C B 97 22.736 11.042 22.714 1.00 0.00 H new ATOM 0 H41 C B 97 18.657 8.641 26.597 1.00 0.00 H new ATOM 0 H42 C B 97 19.903 7.496 27.103 1.00 0.00 H new ATOM 0 H5 C B 97 19.147 10.600 25.315 1.00 0.00 H new ATOM 0 H6 C B 97 20.888 11.759 24.034 1.00 0.00 H new ATOM 1564 P U B 98 25.308 13.815 20.727 1.00 0.00 P ATOM 1565 OP1 U B 98 25.954 14.901 21.494 1.00 0.00 O ATOM 1566 OP2 U B 98 24.417 14.141 19.592 1.00 0.00 O ATOM 1567 O5' U B 98 26.456 12.796 20.227 1.00 0.00 O ATOM 1568 C5' U B 98 26.337 12.066 19.013 1.00 0.00 C ATOM 1569 C4' U B 98 27.667 11.427 18.566 1.00 0.00 C ATOM 1570 O4' U B 98 28.715 12.391 18.541 1.00 0.00 O ATOM 1571 C3' U B 98 28.158 10.298 19.472 1.00 0.00 C ATOM 1572 O3' U B 98 28.975 9.368 18.768 1.00 0.00 O ATOM 1573 C2' U B 98 28.992 11.081 20.486 1.00 0.00 C ATOM 1574 O2' U B 98 30.078 10.336 21.025 1.00 0.00 O ATOM 1575 C1' U B 98 29.477 12.347 19.753 1.00 0.00 C ATOM 1576 N1 U B 98 29.382 13.562 20.640 1.00 0.00 N ATOM 1577 C2 U B 98 29.090 14.830 20.097 1.00 0.00 C ATOM 1578 O2 U B 98 29.091 15.107 18.898 1.00 0.00 O ATOM 1579 N3 U B 98 28.819 15.848 20.992 1.00 0.00 N ATOM 1580 C4 U B 98 28.875 15.754 22.360 1.00 0.00 C ATOM 1581 O4 U B 98 28.527 16.699 23.063 1.00 0.00 O ATOM 1582 C5 U B 98 29.364 14.485 22.846 1.00 0.00 C ATOM 1583 C6 U B 98 29.616 13.452 22.001 1.00 0.00 C ATOM 0 H5' U B 98 25.977 12.731 18.228 1.00 0.00 H new ATOM 0 H5'' U B 98 25.587 11.284 19.137 1.00 0.00 H new ATOM 0 H4' U B 98 27.445 11.024 17.578 1.00 0.00 H new ATOM 0 H3' U B 98 27.355 9.697 19.898 1.00 0.00 H new ATOM 0 H2' U B 98 28.383 11.326 21.356 1.00 0.00 H new ATOM 0 HO2' U B 98 30.387 9.683 20.363 1.00 0.00 H new ATOM 0 H1' U B 98 30.537 12.329 19.499 1.00 0.00 H new ATOM 0 H3 U B 98 28.553 16.751 20.600 1.00 0.00 H new ATOM 0 H5 U B 98 29.533 14.355 23.905 1.00 0.00 H new ATOM 0 H6 U B 98 30.007 12.527 22.398 1.00 0.00 H new ATOM 1594 P C B 99 28.351 8.022 18.139 1.00 0.00 P ATOM 1595 OP1 C B 99 29.469 7.193 17.636 1.00 0.00 O ATOM 1596 OP2 C B 99 27.250 8.410 17.229 1.00 0.00 O ATOM 1597 O5' C B 99 27.731 7.305 19.446 1.00 0.00 O ATOM 1598 C5' C B 99 28.495 7.113 20.629 1.00 0.00 C ATOM 1599 C4' C B 99 27.621 6.664 21.807 1.00 0.00 C ATOM 1600 O4' C B 99 26.525 7.550 22.026 1.00 0.00 O ATOM 1601 C3' C B 99 27.076 5.235 21.623 1.00 0.00 C ATOM 1602 O3' C B 99 27.187 4.497 22.843 1.00 0.00 O ATOM 1603 C2' C B 99 25.609 5.543 21.275 1.00 0.00 C ATOM 1604 O2' C B 99 24.692 4.489 21.548 1.00 0.00 O ATOM 1605 C1' C B 99 25.360 6.753 22.170 1.00 0.00 C ATOM 1606 N1 C B 99 24.063 7.440 21.881 1.00 0.00 N ATOM 1607 C2 C B 99 23.936 8.423 20.879 1.00 0.00 C ATOM 1608 O2 C B 99 24.843 8.720 20.100 1.00 0.00 O ATOM 1609 N3 C B 99 22.760 9.091 20.723 1.00 0.00 N ATOM 1610 C4 C B 99 21.741 8.767 21.486 1.00 0.00 C ATOM 1611 N4 C B 99 20.649 9.457 21.303 1.00 0.00 N ATOM 1612 C5 C B 99 21.784 7.741 22.464 1.00 0.00 C ATOM 1613 C6 C B 99 22.964 7.096 22.632 1.00 0.00 C ATOM 0 H5' C B 99 29.004 8.042 20.888 1.00 0.00 H new ATOM 0 H5'' C B 99 29.268 6.367 20.445 1.00 0.00 H new ATOM 0 H4' C B 99 28.277 6.680 22.678 1.00 0.00 H new ATOM 0 H3' C B 99 27.595 4.627 20.882 1.00 0.00 H new ATOM 0 H2' C B 99 25.454 5.700 20.208 1.00 0.00 H new ATOM 0 HO2' C B 99 23.867 4.862 21.923 1.00 0.00 H new ATOM 0 H1' C B 99 25.221 6.482 23.217 1.00 0.00 H new ATOM 0 H41 C B 99 19.820 9.257 21.862 1.00 0.00 H new ATOM 0 H42 C B 99 20.625 10.196 20.601 1.00 0.00 H new ATOM 0 H5 C B 99 20.914 7.485 23.050 1.00 0.00 H new ATOM 0 H6 C B 99 23.042 6.304 23.363 1.00 0.00 H new ATOM 1625 P G B 100 28.594 3.892 23.368 1.00 0.00 P ATOM 1626 OP1 G B 100 28.382 3.380 24.741 1.00 0.00 O ATOM 1627 OP2 G B 100 29.690 4.846 23.090 1.00 0.00 O ATOM 1628 O5' G B 100 28.810 2.643 22.378 1.00 0.00 O ATOM 1629 C5' G B 100 28.266 1.360 22.631 1.00 0.00 C ATOM 1630 C4' G B 100 28.700 0.437 21.485 1.00 0.00 C ATOM 1631 O4' G B 100 28.267 -0.902 21.699 1.00 0.00 O ATOM 1632 C3' G B 100 28.100 0.875 20.148 1.00 0.00 C ATOM 1633 O3' G B 100 28.984 0.438 19.121 1.00 0.00 O ATOM 1634 C2' G B 100 26.749 0.150 20.210 1.00 0.00 C ATOM 1635 O2' G B 100 26.183 -0.150 18.942 1.00 0.00 O ATOM 1636 C1' G B 100 27.023 -1.109 21.039 1.00 0.00 C ATOM 1637 N9 G B 100 25.866 -1.397 21.939 1.00 0.00 N ATOM 1638 C8 G B 100 24.579 -1.666 21.541 1.00 0.00 C ATOM 1639 N7 G B 100 23.752 -1.952 22.509 1.00 0.00 N ATOM 1640 C5 G B 100 24.543 -1.845 23.656 1.00 0.00 C ATOM 1641 C6 G B 100 24.213 -2.024 25.047 1.00 0.00 C ATOM 1642 O6 G B 100 23.135 -2.330 25.555 1.00 0.00 O ATOM 1643 N1 G B 100 25.273 -1.795 25.903 1.00 0.00 N ATOM 1644 C2 G B 100 26.511 -1.439 25.478 1.00 0.00 C ATOM 1645 N2 G B 100 27.434 -1.241 26.386 1.00 0.00 N ATOM 1646 N3 G B 100 26.857 -1.262 24.206 1.00 0.00 N ATOM 1647 C4 G B 100 25.834 -1.483 23.324 1.00 0.00 C ATOM 0 H5' G B 100 27.179 1.410 22.691 1.00 0.00 H new ATOM 0 H5'' G B 100 28.621 0.976 23.587 1.00 0.00 H new ATOM 0 H4' G B 100 29.788 0.496 21.459 1.00 0.00 H new ATOM 0 H3' G B 100 27.967 1.940 19.955 1.00 0.00 H new ATOM 0 H2' G B 100 25.992 0.792 20.659 1.00 0.00 H new ATOM 0 HO2' G B 100 26.898 -0.236 18.277 1.00 0.00 H new ATOM 0 H1' G B 100 27.115 -2.008 20.429 1.00 0.00 H new ATOM 0 H8 G B 100 24.275 -1.643 20.505 1.00 0.00 H new ATOM 0 H1 G B 100 25.117 -1.899 26.906 1.00 0.00 H new ATOM 0 H21 G B 100 28.377 -0.972 26.105 1.00 0.00 H new ATOM 0 H22 G B 100 27.210 -1.356 27.374 1.00 0.00 H new ATOM 1659 P C B 101 29.095 1.194 17.704 1.00 0.00 P ATOM 1660 OP1 C B 101 30.504 1.146 17.255 1.00 0.00 O ATOM 1661 OP2 C B 101 28.382 2.488 17.770 1.00 0.00 O ATOM 1662 O5' C B 101 28.236 0.201 16.780 1.00 0.00 O ATOM 1663 C5' C B 101 28.730 -1.082 16.420 1.00 0.00 C ATOM 1664 C4' C B 101 27.729 -1.809 15.520 1.00 0.00 C ATOM 1665 O4' C B 101 26.557 -2.119 16.266 1.00 0.00 O ATOM 1666 C3' C B 101 27.292 -1.015 14.279 1.00 0.00 C ATOM 1667 O3' C B 101 28.126 -1.167 13.143 1.00 0.00 O ATOM 1668 C2' C B 101 25.921 -1.636 14.008 1.00 0.00 C ATOM 1669 O2' C B 101 26.011 -2.841 13.255 1.00 0.00 O ATOM 1670 C1' C B 101 25.430 -2.000 15.412 1.00 0.00 C ATOM 1671 N1 C B 101 24.482 -0.990 15.955 1.00 0.00 N ATOM 1672 C2 C B 101 23.147 -1.377 16.119 1.00 0.00 C ATOM 1673 O2 C B 101 22.810 -2.561 16.112 1.00 0.00 O ATOM 1674 N3 C B 101 22.180 -0.441 16.233 1.00 0.00 N ATOM 1675 C4 C B 101 22.527 0.822 16.294 1.00 0.00 C ATOM 1676 N4 C B 101 21.546 1.665 16.346 1.00 0.00 N ATOM 1677 C5 C B 101 23.872 1.272 16.273 1.00 0.00 C ATOM 1678 C6 C B 101 24.830 0.331 16.105 1.00 0.00 C ATOM 0 H5' C B 101 28.916 -1.672 17.318 1.00 0.00 H new ATOM 0 H5'' C B 101 29.684 -0.979 15.903 1.00 0.00 H new ATOM 0 H4' C B 101 28.251 -2.700 15.169 1.00 0.00 H new ATOM 0 H3' C B 101 27.317 0.060 14.458 1.00 0.00 H new ATOM 0 H2' C B 101 25.282 -0.958 13.443 1.00 0.00 H new ATOM 0 HO2' C B 101 26.879 -2.880 12.802 1.00 0.00 H new ATOM 0 H1' C B 101 24.888 -2.944 15.355 1.00 0.00 H new ATOM 0 H41 C B 101 21.736 2.666 16.395 1.00 0.00 H new ATOM 0 H42 C B 101 20.583 1.328 16.338 1.00 0.00 H new ATOM 0 H5 C B 101 24.120 2.317 16.386 1.00 0.00 H new ATOM 0 H6 C B 101 25.871 0.619 16.089 1.00 0.00 H new ATOM 1690 P U B 102 29.103 0.011 12.669 1.00 0.00 P ATOM 1691 OP1 U B 102 29.843 -0.455 11.477 1.00 0.00 O ATOM 1692 OP2 U B 102 29.841 0.511 13.849 1.00 0.00 O ATOM 1693 O5' U B 102 28.041 1.145 12.212 1.00 0.00 O ATOM 1694 C5' U B 102 27.149 0.918 11.127 1.00 0.00 C ATOM 1695 C4' U B 102 26.489 2.211 10.608 1.00 0.00 C ATOM 1696 O4' U B 102 25.459 2.586 11.512 1.00 0.00 O ATOM 1697 C3' U B 102 27.434 3.407 10.406 1.00 0.00 C ATOM 1698 O3' U B 102 27.877 3.651 9.070 1.00 0.00 O ATOM 1699 C2' U B 102 26.550 4.599 10.817 1.00 0.00 C ATOM 1700 O2' U B 102 25.947 5.258 9.710 1.00 0.00 O ATOM 1701 C1' U B 102 25.417 3.999 11.652 1.00 0.00 C ATOM 1702 N1 U B 102 25.506 4.414 13.080 1.00 0.00 N ATOM 1703 C2 U B 102 24.936 5.642 13.447 1.00 0.00 C ATOM 1704 O2 U B 102 24.365 6.392 12.662 1.00 0.00 O ATOM 1705 N3 U B 102 25.035 6.013 14.772 1.00 0.00 N ATOM 1706 C4 U B 102 25.590 5.260 15.775 1.00 0.00 C ATOM 1707 O4 U B 102 25.583 5.672 16.928 1.00 0.00 O ATOM 1708 C5 U B 102 26.153 4.007 15.330 1.00 0.00 C ATOM 1709 C6 U B 102 26.113 3.619 14.027 1.00 0.00 C ATOM 0 H5' U B 102 26.372 0.222 11.442 1.00 0.00 H new ATOM 0 H5'' U B 102 27.692 0.441 10.311 1.00 0.00 H new ATOM 0 H4' U B 102 26.113 1.971 9.613 1.00 0.00 H new ATOM 0 H3' U B 102 28.352 3.232 10.967 1.00 0.00 H new ATOM 0 H2' U B 102 27.166 5.332 11.338 1.00 0.00 H new ATOM 0 HO2' U B 102 26.619 5.801 9.247 1.00 0.00 H new ATOM 0 H1' U B 102 24.459 4.373 11.289 1.00 0.00 H new ATOM 0 H3 U B 102 24.663 6.927 15.028 1.00 0.00 H new ATOM 0 H5 U B 102 26.621 3.357 16.055 1.00 0.00 H new ATOM 0 H6 U B 102 26.560 2.681 13.733 1.00 0.00 H new ATOM 1720 P U B 103 28.825 2.675 8.215 1.00 0.00 P ATOM 1721 OP1 U B 103 29.426 1.657 9.103 1.00 0.00 O ATOM 1722 OP2 U B 103 29.694 3.521 7.369 1.00 0.00 O ATOM 1723 O5' U B 103 27.731 1.981 7.243 1.00 0.00 O ATOM 1724 C5' U B 103 27.310 0.630 7.385 1.00 0.00 C ATOM 1725 C4' U B 103 26.137 0.316 6.452 1.00 0.00 C ATOM 1726 O4' U B 103 24.968 1.050 6.808 1.00 0.00 O ATOM 1727 C3' U B 103 26.431 0.603 4.983 1.00 0.00 C ATOM 1728 O3' U B 103 27.194 -0.434 4.387 1.00 0.00 O ATOM 1729 C2' U B 103 25.007 0.749 4.445 1.00 0.00 C ATOM 1730 O2' U B 103 24.413 -0.507 4.145 1.00 0.00 O ATOM 1731 C1' U B 103 24.240 1.360 5.620 1.00 0.00 C ATOM 1732 N1 U B 103 24.035 2.835 5.506 1.00 0.00 N ATOM 1733 C2 U B 103 22.726 3.319 5.349 1.00 0.00 C ATOM 1734 O2 U B 103 21.738 2.596 5.222 1.00 0.00 O ATOM 1735 N3 U B 103 22.560 4.686 5.283 1.00 0.00 N ATOM 1736 C4 U B 103 23.573 5.614 5.307 1.00 0.00 C ATOM 1737 O4 U B 103 23.313 6.813 5.297 1.00 0.00 O ATOM 1738 C5 U B 103 24.897 5.044 5.351 1.00 0.00 C ATOM 1739 C6 U B 103 25.101 3.709 5.476 1.00 0.00 C ATOM 0 H5' U B 103 27.016 0.444 8.418 1.00 0.00 H new ATOM 0 H5'' U B 103 28.142 -0.038 7.165 1.00 0.00 H new ATOM 0 H4' U B 103 25.974 -0.755 6.575 1.00 0.00 H new ATOM 0 H3' U B 103 27.052 1.476 4.780 1.00 0.00 H new ATOM 0 H2' U B 103 24.995 1.335 3.526 1.00 0.00 H new ATOM 0 HO2' U B 103 23.603 -0.367 3.612 1.00 0.00 H new ATOM 0 H1' U B 103 23.237 0.934 5.634 1.00 0.00 H new ATOM 0 H3 U B 103 21.605 5.038 5.210 1.00 0.00 H new ATOM 0 H5 U B 103 25.752 5.700 5.282 1.00 0.00 H new ATOM 0 H6 U B 103 26.108 3.327 5.553 1.00 0.00 H new ATOM 1750 P U B 104 27.706 -0.325 2.872 1.00 0.00 P ATOM 1751 OP1 U B 104 28.873 -1.222 2.722 1.00 0.00 O ATOM 1752 OP2 U B 104 27.811 1.108 2.511 1.00 0.00 O ATOM 1753 O5' U B 104 26.439 -0.952 2.091 1.00 0.00 O ATOM 1754 C5' U B 104 26.396 -2.327 1.729 1.00 0.00 C ATOM 1755 C4' U B 104 25.047 -2.732 1.120 1.00 0.00 C ATOM 1756 O4' U B 104 24.038 -2.828 2.112 1.00 0.00 O ATOM 1757 C3' U B 104 24.489 -1.758 0.084 1.00 0.00 C ATOM 1758 O3' U B 104 25.123 -1.897 -1.183 1.00 0.00 O ATOM 1759 C2' U B 104 23.008 -2.181 0.057 1.00 0.00 C ATOM 1760 O2' U B 104 22.757 -3.198 -0.909 1.00 0.00 O ATOM 1761 C1' U B 104 22.778 -2.799 1.451 1.00 0.00 C ATOM 1762 N1 U B 104 21.766 -2.089 2.290 1.00 0.00 N ATOM 1763 C2 U B 104 20.736 -2.840 2.879 1.00 0.00 C ATOM 1764 O2 U B 104 20.617 -4.059 2.749 1.00 0.00 O ATOM 1765 N3 U B 104 19.816 -2.153 3.648 1.00 0.00 N ATOM 1766 C4 U B 104 19.825 -0.800 3.893 1.00 0.00 C ATOM 1767 O4 U B 104 18.962 -0.301 4.606 1.00 0.00 O ATOM 1768 C5 U B 104 20.910 -0.087 3.253 1.00 0.00 C ATOM 1769 C6 U B 104 21.836 -0.728 2.492 1.00 0.00 C ATOM 0 H5' U B 104 26.591 -2.938 2.610 1.00 0.00 H new ATOM 0 H5'' U B 104 27.191 -2.536 1.014 1.00 0.00 H new ATOM 0 H4' U B 104 25.273 -3.685 0.642 1.00 0.00 H new ATOM 0 H3' U B 104 24.646 -0.706 0.323 1.00 0.00 H new ATOM 0 H2' U B 104 22.367 -1.334 -0.189 1.00 0.00 H new ATOM 0 HO2' U B 104 23.457 -3.178 -1.595 1.00 0.00 H new ATOM 0 H1' U B 104 22.362 -3.796 1.309 1.00 0.00 H new ATOM 0 H3 U B 104 19.064 -2.697 4.071 1.00 0.00 H new ATOM 0 H5 U B 104 20.986 0.982 3.384 1.00 0.00 H new ATOM 0 H6 U B 104 22.637 -0.163 2.040 1.00 0.00 H new ATOM 1780 P U B 105 25.186 -0.693 -2.253 1.00 0.00 P ATOM 1781 OP1 U B 105 24.309 0.411 -1.802 1.00 0.00 O ATOM 1782 OP2 U B 105 25.022 -1.276 -3.601 1.00 0.00 O ATOM 1783 O5' U B 105 26.729 -0.248 -2.084 1.00 0.00 O ATOM 1784 C5' U B 105 27.160 0.562 -1.001 1.00 0.00 C ATOM 1785 C4' U B 105 28.644 0.348 -0.670 1.00 0.00 C ATOM 1786 O4' U B 105 28.861 -1.007 -0.297 1.00 0.00 O ATOM 1787 C3' U B 105 29.613 0.685 -1.817 1.00 0.00 C ATOM 1788 O3' U B 105 30.826 1.221 -1.288 1.00 0.00 O ATOM 1789 C2' U B 105 29.862 -0.707 -2.409 1.00 0.00 C ATOM 1790 O2' U B 105 31.084 -0.791 -3.137 1.00 0.00 O ATOM 1791 C1' U B 105 29.854 -1.567 -1.144 1.00 0.00 C ATOM 1792 N1 U B 105 29.569 -3.002 -1.422 1.00 0.00 N ATOM 1793 C2 U B 105 30.608 -3.933 -1.286 1.00 0.00 C ATOM 1794 O2 U B 105 31.747 -3.642 -0.916 1.00 0.00 O ATOM 1795 N3 U B 105 30.311 -5.248 -1.585 1.00 0.00 N ATOM 1796 C4 U B 105 29.088 -5.725 -1.995 1.00 0.00 C ATOM 1797 O4 U B 105 28.940 -6.922 -2.232 1.00 0.00 O ATOM 1798 C5 U B 105 28.058 -4.713 -2.105 1.00 0.00 C ATOM 1799 C6 U B 105 28.314 -3.406 -1.826 1.00 0.00 C ATOM 0 H5' U B 105 26.557 0.339 -0.121 1.00 0.00 H new ATOM 0 H5'' U B 105 26.992 1.611 -1.245 1.00 0.00 H new ATOM 0 H4' U B 105 28.859 1.041 0.144 1.00 0.00 H new ATOM 0 H3' U B 105 29.239 1.420 -2.530 1.00 0.00 H new ATOM 0 H2' U B 105 29.129 -1.012 -3.155 1.00 0.00 H new ATOM 0 HO2' U B 105 31.703 -0.102 -2.818 1.00 0.00 H new ATOM 0 H1' U B 105 30.840 -1.559 -0.679 1.00 0.00 H new ATOM 0 H3 U B 105 31.067 -5.927 -1.494 1.00 0.00 H new ATOM 0 H5 U B 105 27.065 -5.002 -2.415 1.00 0.00 H new ATOM 0 H6 U B 105 27.524 -2.676 -1.922 1.00 0.00 H new ATOM 1810 P C B 106 30.929 2.753 -0.783 1.00 0.00 P ATOM 1811 OP1 C B 106 31.860 2.795 0.367 1.00 0.00 O ATOM 1812 OP2 C B 106 29.558 3.284 -0.641 1.00 0.00 O ATOM 1813 O5' C B 106 31.625 3.472 -2.045 1.00 0.00 O ATOM 1814 C5' C B 106 32.987 3.245 -2.378 1.00 0.00 C ATOM 1815 C4' C B 106 33.446 4.181 -3.504 1.00 0.00 C ATOM 1816 O4' C B 106 32.773 3.899 -4.729 1.00 0.00 O ATOM 1817 C3' C B 106 33.240 5.668 -3.200 1.00 0.00 C ATOM 1818 O3' C B 106 34.316 6.262 -2.480 1.00 0.00 O ATOM 1819 C2' C B 106 33.182 6.247 -4.618 1.00 0.00 C ATOM 1820 O2' C B 106 34.480 6.488 -5.158 1.00 0.00 O ATOM 1821 C1' C B 106 32.533 5.119 -5.429 1.00 0.00 C ATOM 1822 N1 C B 106 31.074 5.365 -5.644 1.00 0.00 N ATOM 1823 C2 C B 106 30.686 6.197 -6.707 1.00 0.00 C ATOM 1824 O2 C B 106 31.514 6.748 -7.436 1.00 0.00 O ATOM 1825 N3 C B 106 29.372 6.413 -6.973 1.00 0.00 N ATOM 1826 C4 C B 106 28.470 5.816 -6.223 1.00 0.00 C ATOM 1827 N4 C B 106 27.226 6.049 -6.537 1.00 0.00 N ATOM 1828 C5 C B 106 28.796 4.959 -5.140 1.00 0.00 C ATOM 1829 C6 C B 106 30.111 4.764 -4.869 1.00 0.00 C ATOM 0 H5' C B 106 33.121 2.208 -2.686 1.00 0.00 H new ATOM 0 H5'' C B 106 33.610 3.399 -1.497 1.00 0.00 H new ATOM 0 H4' C B 106 34.515 3.988 -3.590 1.00 0.00 H new ATOM 0 H3' C B 106 32.370 5.848 -2.569 1.00 0.00 H new ATOM 0 H2' C B 106 32.653 7.200 -4.636 1.00 0.00 H new ATOM 0 HO2' C B 106 35.111 6.662 -4.428 1.00 0.00 H new ATOM 0 H1' C B 106 32.971 5.068 -6.426 1.00 0.00 H new ATOM 0 H41 C B 106 26.475 5.619 -5.998 1.00 0.00 H new ATOM 0 H42 C B 106 27.004 6.662 -7.322 1.00 0.00 H new ATOM 0 H5 C B 106 28.026 4.480 -4.553 1.00 0.00 H new ATOM 0 H6 C B 106 30.402 4.134 -4.041 1.00 0.00 H new ATOM 1841 P C B 107 34.116 6.839 -0.991 1.00 0.00 P ATOM 1842 OP1 C B 107 35.356 7.548 -0.602 1.00 0.00 O ATOM 1843 OP2 C B 107 33.579 5.758 -0.135 1.00 0.00 O ATOM 1844 O5' C B 107 32.958 7.930 -1.224 1.00 0.00 O ATOM 1845 C5' C B 107 33.135 9.077 -2.043 1.00 0.00 C ATOM 1846 C4' C B 107 31.771 9.664 -2.440 1.00 0.00 C ATOM 1847 O4' C B 107 31.040 8.785 -3.296 1.00 0.00 O ATOM 1848 C3' C B 107 30.846 9.931 -1.254 1.00 0.00 C ATOM 1849 O3' C B 107 31.123 11.128 -0.545 1.00 0.00 O ATOM 1850 C2' C B 107 29.499 10.027 -1.965 1.00 0.00 C ATOM 1851 O2' C B 107 29.251 11.331 -2.479 1.00 0.00 O ATOM 1852 C1' C B 107 29.651 9.073 -3.154 1.00 0.00 C ATOM 1853 N1 C B 107 28.764 7.887 -2.949 1.00 0.00 N ATOM 1854 C2 C B 107 29.112 6.846 -2.064 1.00 0.00 C ATOM 1855 O2 C B 107 30.198 6.780 -1.499 1.00 0.00 O ATOM 1856 N3 C B 107 28.225 5.863 -1.784 1.00 0.00 N ATOM 1857 C4 C B 107 27.036 5.904 -2.329 1.00 0.00 C ATOM 1858 N4 C B 107 26.261 4.905 -2.034 1.00 0.00 N ATOM 1859 C5 C B 107 26.607 6.936 -3.203 1.00 0.00 C ATOM 1860 C6 C B 107 27.500 7.914 -3.491 1.00 0.00 C ATOM 0 H5' C B 107 33.698 8.810 -2.937 1.00 0.00 H new ATOM 0 H5'' C B 107 33.720 9.826 -1.510 1.00 0.00 H new ATOM 0 H4' C B 107 32.032 10.599 -2.935 1.00 0.00 H new ATOM 0 H3' C B 107 30.931 9.168 -0.480 1.00 0.00 H new ATOM 0 H2' C B 107 28.680 9.793 -1.284 1.00 0.00 H new ATOM 0 HO2' C B 107 29.884 11.965 -2.081 1.00 0.00 H new ATOM 0 H1' C B 107 29.324 9.506 -4.099 1.00 0.00 H new ATOM 0 H41 C B 107 25.317 4.861 -2.418 1.00 0.00 H new ATOM 0 H42 C B 107 26.596 4.164 -1.418 1.00 0.00 H new ATOM 0 H5 C B 107 25.611 6.942 -3.621 1.00 0.00 H new ATOM 0 H6 C B 107 27.217 8.721 -4.151 1.00 0.00 H new ATOM 1872 P C B 108 31.038 11.153 1.059 1.00 0.00 P ATOM 1873 OP1 C B 108 31.254 12.550 1.492 1.00 0.00 O ATOM 1874 OP2 C B 108 31.924 10.080 1.563 1.00 0.00 O ATOM 1875 O5' C B 108 29.491 10.738 1.333 1.00 0.00 O ATOM 1876 C5' C B 108 28.410 11.622 1.055 1.00 0.00 C ATOM 1877 C4' C B 108 27.032 10.945 1.192 1.00 0.00 C ATOM 1878 O4' C B 108 26.919 9.757 0.401 1.00 0.00 O ATOM 1879 C3' C B 108 26.614 10.587 2.622 1.00 0.00 C ATOM 1880 O3' C B 108 25.922 11.632 3.301 1.00 0.00 O ATOM 1881 C2' C B 108 25.597 9.476 2.342 1.00 0.00 C ATOM 1882 O2' C B 108 24.322 10.009 1.986 1.00 0.00 O ATOM 1883 C1' C B 108 26.161 8.771 1.109 1.00 0.00 C ATOM 1884 N1 C B 108 26.966 7.566 1.488 1.00 0.00 N ATOM 1885 C2 C B 108 26.286 6.415 1.921 1.00 0.00 C ATOM 1886 O2 C B 108 25.061 6.392 2.037 1.00 0.00 O ATOM 1887 N3 C B 108 26.967 5.279 2.219 1.00 0.00 N ATOM 1888 C4 C B 108 28.272 5.269 2.069 1.00 0.00 C ATOM 1889 N4 C B 108 28.865 4.142 2.359 1.00 0.00 N ATOM 1890 C5 C B 108 29.019 6.397 1.642 1.00 0.00 C ATOM 1891 C6 C B 108 28.334 7.532 1.364 1.00 0.00 C ATOM 0 H5' C B 108 28.518 12.013 0.043 1.00 0.00 H new ATOM 0 H5'' C B 108 28.460 12.474 1.733 1.00 0.00 H new ATOM 0 H4' C B 108 26.358 11.721 0.829 1.00 0.00 H new ATOM 0 H3' C B 108 27.473 10.350 3.249 1.00 0.00 H new ATOM 0 H2' C B 108 25.458 8.839 3.215 1.00 0.00 H new ATOM 0 HO2' C B 108 24.201 10.882 2.414 1.00 0.00 H new ATOM 0 H1' C B 108 25.370 8.379 0.469 1.00 0.00 H new ATOM 0 H41 C B 108 29.877 4.060 2.266 1.00 0.00 H new ATOM 0 H42 C B 108 28.316 3.344 2.678 1.00 0.00 H new ATOM 0 H5 C B 108 30.093 6.352 1.542 1.00 0.00 H new ATOM 0 H6 C B 108 28.866 8.415 1.043 1.00 0.00 H new ATOM 1903 P C B 109 26.465 12.260 4.673 1.00 0.00 P ATOM 1904 OP1 C B 109 25.355 13.009 5.305 1.00 0.00 O ATOM 1905 OP2 C B 109 27.747 12.938 4.387 1.00 0.00 O ATOM 1906 O5' C B 109 26.771 10.957 5.564 1.00 0.00 O ATOM 1907 C5' C B 109 25.760 10.077 6.037 1.00 0.00 C ATOM 1908 C4' C B 109 26.402 8.786 6.574 1.00 0.00 C ATOM 1909 O4' C B 109 27.012 8.030 5.529 1.00 0.00 O ATOM 1910 C3' C B 109 27.490 9.050 7.620 1.00 0.00 C ATOM 1911 O3' C B 109 26.966 9.193 8.942 1.00 0.00 O ATOM 1912 C2' C B 109 28.387 7.813 7.483 1.00 0.00 C ATOM 1913 O2' C B 109 28.055 6.818 8.439 1.00 0.00 O ATOM 1914 C1' C B 109 28.073 7.257 6.087 1.00 0.00 C ATOM 1915 N1 C B 109 29.292 7.213 5.223 1.00 0.00 N ATOM 1916 C2 C B 109 29.848 8.389 4.687 1.00 0.00 C ATOM 1917 O2 C B 109 29.362 9.500 4.871 1.00 0.00 O ATOM 1918 N3 C B 109 30.988 8.337 3.955 1.00 0.00 N ATOM 1919 C4 C B 109 31.571 7.176 3.764 1.00 0.00 C ATOM 1920 N4 C B 109 32.632 7.205 3.007 1.00 0.00 N ATOM 1921 C5 C B 109 31.089 5.959 4.313 1.00 0.00 C ATOM 1922 C6 C B 109 29.943 6.017 5.038 1.00 0.00 C ATOM 0 H5' C B 109 25.065 9.840 5.231 1.00 0.00 H new ATOM 0 H5'' C B 109 25.182 10.562 6.824 1.00 0.00 H new ATOM 0 H4' C B 109 25.579 8.236 7.030 1.00 0.00 H new ATOM 0 H3' C B 109 28.017 9.990 7.456 1.00 0.00 H new ATOM 0 H2' C B 109 29.434 8.076 7.633 1.00 0.00 H new ATOM 0 HO2' C B 109 28.644 6.044 8.323 1.00 0.00 H new ATOM 0 HO3' C B 109 27.120 8.367 9.446 1.00 0.00 H new ATOM 0 H1' C B 109 27.745 6.220 6.158 1.00 0.00 H new ATOM 0 H41 C B 109 33.142 6.344 2.810 1.00 0.00 H new ATOM 0 H42 C B 109 32.952 8.089 2.611 1.00 0.00 H new ATOM 0 H5 C B 109 31.612 5.026 4.160 1.00 0.00 H new ATOM 0 H6 C B 109 29.539 5.115 5.473 1.00 0.00 H new TER 1934 C B 109 HETATM 1935 ZN ZN A 101 0.649 4.094 19.690 1.00 0.00 ZN HETATM 1936 ZN ZN A 102 18.772 -5.857 19.201 1.00 0.00 ZN