USER MOD reduce.3.24.130724 H: found=0, std=0, add=894, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 891 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 38 HIS HE2 : A 38 HIS NE2 : A 101 ZNZN :(H bumps) USER MOD NoAdj-H: A 70 HIS HE2 : A 70 HIS NE2 : A 102 ZNZN :(H bumps) USER MOD Set 1.1: A 90 GLN : amide:sc= -1.12 X(o=-1,f=-0.65) USER MOD Set 1.2: A 91 LYS NZ :NH3+ 164:sc= 0.119 (180deg=0.0573) USER MOD Set 2.1: A 44 GLN : amide:sc= 0.259 K(o=1.7,f=-5!) USER MOD Set 2.2: A 67 LYS NZ :NH3+ 166:sc= 0.955 (180deg=0.207) USER MOD Set 2.3: A 68 TYR OH : rot 17:sc= 0.0383 USER MOD Set 2.4: B 99 C O2' : rot 180:sc= 0.0926 USER MOD Set 2.5: B 100 G O2' : rot 20:sc= 0.325 USER MOD Set 3.1: A 12 LYS NZ :NH3+ -136:sc= 0.0104 (180deg=-0.0521) USER MOD Set 3.2: A 86 ASN : amide:sc= 1.66 K(o=1.7,f=-0.07) USER MOD Single : A 1 MET CE :methyl 176:sc= 0 (180deg=-0.0283) USER MOD Single : A 1 MET N :NH3+ 178:sc= -0.0947 (180deg=-0.112) USER MOD Single : A 4 SER OG : rot 180:sc= 0.0195 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.0296 USER MOD Single : A 23 GLN : amide:sc= -0.0117 X(o=-0.012,f=-0.056) 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= 0.048 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0131) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 CYS SG : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= -0.153 X(o=-0.15,f=-0.62) USER MOD Single : A 56 SER OG : rot -170:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 65:sc= 0.581 USER MOD Single : A 65 ASN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : A 74 HIS : no HD1:sc= 0.569 K(o=0.57,f=-2!) USER MOD Single : A 76 LYS NZ :NH3+ -156:sc= 0.0194 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= 0.659 K(o=0.66,f=-0.017) USER MOD Single : A 82 ASN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 92 ASN : amide:sc=-0.00499 K(o=-0.005,f=-0.7) USER MOD Single : B 95 G O2' : rot -18:sc= 0.0485 USER MOD Single : B 96 U O2' : rot -16:sc= 0.169 USER MOD Single : B 97 C O2' : rot 29:sc= 0.137 USER MOD Single : B 98 U O2' : rot 25:sc= 0.116 USER MOD Single : B 101 C O2' : rot -18:sc= 0.174 USER MOD Single : B 102 U O2' : rot -36:sc= 0.126 USER MOD Single : B 103 U O2' : rot -161:sc= 0.36 USER MOD Single : B 104 U O2' : rot -14:sc= 0.053 USER MOD Single : B 105 U O2' : rot -74:sc= 0.357 USER MOD Single : B 106 C O2' : rot 17:sc= 0.168 USER MOD Single : B 107 C O2' : rot 122:sc= 0.618 USER MOD Single : B 108 C O2' : rot -22:sc= 0.0649 USER MOD Single : B 109 C O2' : rot 180:sc= 0 USER MOD Single : B 109 C O3' : rot 138:sc= 0.103 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 39.857 2.527 -8.838 1.00 0.00 N ATOM 2 CA MET A 1 40.398 1.845 -7.655 1.00 0.00 C ATOM 3 C MET A 1 41.673 2.501 -7.084 1.00 0.00 C ATOM 4 O MET A 1 42.156 2.105 -6.021 1.00 0.00 O ATOM 5 CB MET A 1 40.625 0.356 -7.974 1.00 0.00 C ATOM 6 CG MET A 1 41.703 0.118 -9.045 1.00 0.00 C ATOM 7 SD MET A 1 42.070 -1.626 -9.398 1.00 0.00 S ATOM 8 CE MET A 1 40.545 -2.130 -10.243 1.00 0.00 C ATOM 0 H1 MET A 1 39.023 2.011 -9.185 1.00 0.00 H new ATOM 0 H2 MET A 1 39.583 3.498 -8.584 1.00 0.00 H new ATOM 0 H3 MET A 1 40.581 2.555 -9.584 1.00 0.00 H new ATOM 0 HA MET A 1 39.654 1.941 -6.865 1.00 0.00 H new ATOM 0 HB2 MET A 1 40.911 -0.164 -7.060 1.00 0.00 H new ATOM 0 HB3 MET A 1 39.686 -0.083 -8.311 1.00 0.00 H new ATOM 0 HG2 MET A 1 41.387 0.601 -9.970 1.00 0.00 H new ATOM 0 HG3 MET A 1 42.623 0.609 -8.728 1.00 0.00 H new ATOM 0 HE1 MET A 1 40.643 -3.160 -10.587 1.00 0.00 H new ATOM 0 HE2 MET A 1 39.705 -2.057 -9.552 1.00 0.00 H new ATOM 0 HE3 MET A 1 40.370 -1.477 -11.098 1.00 0.00 H new ATOM 18 N ALA A 2 42.225 3.501 -7.782 1.00 0.00 N ATOM 19 CA ALA A 2 43.443 4.227 -7.398 1.00 0.00 C ATOM 20 C ALA A 2 43.304 5.094 -6.122 1.00 0.00 C ATOM 21 O ALA A 2 44.314 5.487 -5.532 1.00 0.00 O ATOM 22 CB ALA A 2 43.875 5.082 -8.596 1.00 0.00 C ATOM 0 H ALA A 2 41.824 3.838 -8.657 1.00 0.00 H new ATOM 0 HA ALA A 2 44.200 3.487 -7.138 1.00 0.00 H new ATOM 0 HB1 ALA A 2 44.779 5.635 -8.341 1.00 0.00 H new ATOM 0 HB2 ALA A 2 44.073 4.436 -9.451 1.00 0.00 H new ATOM 0 HB3 ALA A 2 43.080 5.784 -8.848 1.00 0.00 H new ATOM 28 N VAL A 3 42.072 5.394 -5.691 1.00 0.00 N ATOM 29 CA VAL A 3 41.753 6.205 -4.499 1.00 0.00 C ATOM 30 C VAL A 3 40.401 5.798 -3.896 1.00 0.00 C ATOM 31 O VAL A 3 39.524 5.275 -4.588 1.00 0.00 O ATOM 32 CB VAL A 3 41.811 7.711 -4.849 1.00 0.00 C ATOM 33 CG1 VAL A 3 40.801 8.125 -5.928 1.00 0.00 C ATOM 34 CG2 VAL A 3 41.658 8.637 -3.637 1.00 0.00 C ATOM 0 H VAL A 3 41.237 5.069 -6.177 1.00 0.00 H new ATOM 0 HA VAL A 3 42.504 6.015 -3.732 1.00 0.00 H new ATOM 0 HB VAL A 3 42.818 7.837 -5.246 1.00 0.00 H new ATOM 0 HG11 VAL A 3 40.896 9.193 -6.125 1.00 0.00 H new ATOM 0 HG12 VAL A 3 40.999 7.568 -6.844 1.00 0.00 H new ATOM 0 HG13 VAL A 3 39.790 7.908 -5.583 1.00 0.00 H new ATOM 0 HG21 VAL A 3 41.709 9.676 -3.964 1.00 0.00 H new ATOM 0 HG22 VAL A 3 40.696 8.454 -3.159 1.00 0.00 H new ATOM 0 HG23 VAL A 3 42.460 8.441 -2.925 1.00 0.00 H new ATOM 44 N SER A 4 40.243 6.039 -2.594 1.00 0.00 N ATOM 45 CA SER A 4 39.041 5.748 -1.792 1.00 0.00 C ATOM 46 C SER A 4 39.024 6.587 -0.497 1.00 0.00 C ATOM 47 O SER A 4 39.960 7.348 -0.231 1.00 0.00 O ATOM 48 CB SER A 4 38.996 4.246 -1.469 1.00 0.00 C ATOM 49 OG SER A 4 37.706 3.873 -1.008 1.00 0.00 O ATOM 0 H SER A 4 40.984 6.464 -2.037 1.00 0.00 H new ATOM 0 HA SER A 4 38.156 6.017 -2.369 1.00 0.00 H new ATOM 0 HB2 SER A 4 39.251 3.669 -2.358 1.00 0.00 H new ATOM 0 HB3 SER A 4 39.742 4.009 -0.710 1.00 0.00 H new ATOM 0 HG SER A 4 37.695 2.914 -0.809 1.00 0.00 H new ATOM 55 N VAL A 5 37.984 6.440 0.332 1.00 0.00 N ATOM 56 CA VAL A 5 37.822 7.131 1.627 1.00 0.00 C ATOM 57 C VAL A 5 37.083 6.261 2.654 1.00 0.00 C ATOM 58 O VAL A 5 36.232 5.438 2.311 1.00 0.00 O ATOM 59 CB VAL A 5 37.126 8.499 1.436 1.00 0.00 C ATOM 60 CG1 VAL A 5 35.684 8.396 0.920 1.00 0.00 C ATOM 61 CG2 VAL A 5 37.130 9.349 2.712 1.00 0.00 C ATOM 0 H VAL A 5 37.204 5.818 0.118 1.00 0.00 H new ATOM 0 HA VAL A 5 38.819 7.313 2.029 1.00 0.00 H new ATOM 0 HB VAL A 5 37.727 8.990 0.671 1.00 0.00 H new ATOM 0 HG11 VAL A 5 35.264 9.396 0.812 1.00 0.00 H new ATOM 0 HG12 VAL A 5 35.679 7.894 -0.047 1.00 0.00 H new ATOM 0 HG13 VAL A 5 35.084 7.825 1.629 1.00 0.00 H new ATOM 0 HG21 VAL A 5 36.629 10.297 2.519 1.00 0.00 H new ATOM 0 HG22 VAL A 5 36.606 8.816 3.506 1.00 0.00 H new ATOM 0 HG23 VAL A 5 38.158 9.538 3.020 1.00 0.00 H new ATOM 71 N THR A 6 37.414 6.457 3.931 1.00 0.00 N ATOM 72 CA THR A 6 36.820 5.763 5.088 1.00 0.00 C ATOM 73 C THR A 6 35.318 6.093 5.215 1.00 0.00 C ATOM 74 O THR A 6 34.957 7.272 5.109 1.00 0.00 O ATOM 75 CB THR A 6 37.544 6.192 6.380 1.00 0.00 C ATOM 76 OG1 THR A 6 38.945 6.092 6.203 1.00 0.00 O ATOM 77 CG2 THR A 6 37.193 5.326 7.590 1.00 0.00 C ATOM 0 H THR A 6 38.131 7.129 4.205 1.00 0.00 H new ATOM 0 HA THR A 6 36.933 4.689 4.937 1.00 0.00 H new ATOM 0 HB THR A 6 37.219 7.215 6.572 1.00 0.00 H new ATOM 0 HG1 THR A 6 39.399 6.367 7.027 1.00 0.00 H new ATOM 0 HG21 THR A 6 37.738 5.684 8.464 1.00 0.00 H new ATOM 0 HG22 THR A 6 36.121 5.385 7.781 1.00 0.00 H new ATOM 0 HG23 THR A 6 37.469 4.291 7.389 1.00 0.00 H new ATOM 85 N PRO A 7 34.424 5.109 5.447 1.00 0.00 N ATOM 86 CA PRO A 7 32.987 5.360 5.590 1.00 0.00 C ATOM 87 C PRO A 7 32.640 6.136 6.874 1.00 0.00 C ATOM 88 O PRO A 7 33.411 6.170 7.837 1.00 0.00 O ATOM 89 CB PRO A 7 32.329 3.975 5.565 1.00 0.00 C ATOM 90 CG PRO A 7 33.415 3.054 6.117 1.00 0.00 C ATOM 91 CD PRO A 7 34.702 3.684 5.585 1.00 0.00 C ATOM 0 HA PRO A 7 32.622 5.998 4.785 1.00 0.00 H new ATOM 0 HB2 PRO A 7 31.429 3.947 6.179 1.00 0.00 H new ATOM 0 HB3 PRO A 7 32.035 3.689 4.555 1.00 0.00 H new ATOM 0 HG2 PRO A 7 33.402 3.022 7.206 1.00 0.00 H new ATOM 0 HG3 PRO A 7 33.292 2.029 5.766 1.00 0.00 H new ATOM 0 HD2 PRO A 7 35.532 3.513 6.270 1.00 0.00 H new ATOM 0 HD3 PRO A 7 34.984 3.247 4.627 1.00 0.00 H new ATOM 99 N ILE A 8 31.445 6.733 6.888 1.00 0.00 N ATOM 100 CA ILE A 8 30.872 7.504 8.006 1.00 0.00 C ATOM 101 C ILE A 8 29.552 6.882 8.495 1.00 0.00 C ATOM 102 O ILE A 8 28.913 6.114 7.773 1.00 0.00 O ATOM 103 CB ILE A 8 30.731 9.009 7.663 1.00 0.00 C ATOM 104 CG1 ILE A 8 29.823 9.352 6.455 1.00 0.00 C ATOM 105 CG2 ILE A 8 32.119 9.661 7.544 1.00 0.00 C ATOM 106 CD1 ILE A 8 30.394 9.126 5.044 1.00 0.00 C ATOM 0 H ILE A 8 30.818 6.693 6.085 1.00 0.00 H new ATOM 0 HA ILE A 8 31.575 7.449 8.837 1.00 0.00 H new ATOM 0 HB ILE A 8 30.191 9.441 8.506 1.00 0.00 H new ATOM 0 HG12 ILE A 8 28.909 8.765 6.545 1.00 0.00 H new ATOM 0 HG13 ILE A 8 29.537 10.401 6.537 1.00 0.00 H new ATOM 0 HG21 ILE A 8 32.005 10.718 7.303 1.00 0.00 H new ATOM 0 HG22 ILE A 8 32.651 9.560 8.490 1.00 0.00 H new ATOM 0 HG23 ILE A 8 32.686 9.168 6.755 1.00 0.00 H new ATOM 0 HD11 ILE A 8 29.649 9.409 4.300 1.00 0.00 H new ATOM 0 HD12 ILE A 8 31.288 9.735 4.911 1.00 0.00 H new ATOM 0 HD13 ILE A 8 30.650 8.074 4.919 1.00 0.00 H new ATOM 118 N ARG A 9 29.146 7.214 9.729 1.00 0.00 N ATOM 119 CA ARG A 9 27.949 6.683 10.415 1.00 0.00 C ATOM 120 C ARG A 9 27.026 7.805 10.905 1.00 0.00 C ATOM 121 O ARG A 9 27.485 8.918 11.162 1.00 0.00 O ATOM 122 CB ARG A 9 28.409 5.772 11.567 1.00 0.00 C ATOM 123 CG ARG A 9 29.133 4.520 11.048 1.00 0.00 C ATOM 124 CD ARG A 9 29.385 3.496 12.159 1.00 0.00 C ATOM 125 NE ARG A 9 30.001 2.265 11.629 1.00 0.00 N ATOM 126 CZ ARG A 9 31.266 2.088 11.281 1.00 0.00 C ATOM 127 NH1 ARG A 9 32.170 3.026 11.386 1.00 0.00 N ATOM 128 NH2 ARG A 9 31.660 0.938 10.803 1.00 0.00 N ATOM 0 H ARG A 9 29.658 7.885 10.302 1.00 0.00 H new ATOM 0 HA ARG A 9 27.357 6.100 9.709 1.00 0.00 H new ATOM 0 HB2 ARG A 9 29.073 6.329 12.228 1.00 0.00 H new ATOM 0 HB3 ARG A 9 27.546 5.473 12.161 1.00 0.00 H new ATOM 0 HG2 ARG A 9 28.538 4.059 10.259 1.00 0.00 H new ATOM 0 HG3 ARG A 9 30.084 4.811 10.602 1.00 0.00 H new ATOM 0 HD2 ARG A 9 30.035 3.932 12.917 1.00 0.00 H new ATOM 0 HD3 ARG A 9 28.443 3.251 12.650 1.00 0.00 H new ATOM 0 HE ARG A 9 29.384 1.461 11.518 1.00 0.00 H new ATOM 0 HH11 ARG A 9 31.913 3.944 11.750 1.00 0.00 H new ATOM 0 HH12 ARG A 9 33.133 2.840 11.104 1.00 0.00 H new ATOM 0 HH21 ARG A 9 30.993 0.174 10.697 1.00 0.00 H new ATOM 0 HH22 ARG A 9 32.635 0.804 10.536 1.00 0.00 H new ATOM 142 N ASP A 10 25.723 7.523 11.006 1.00 0.00 N ATOM 143 CA ASP A 10 24.695 8.515 11.354 1.00 0.00 C ATOM 144 C ASP A 10 23.438 7.903 12.010 1.00 0.00 C ATOM 145 O ASP A 10 22.598 7.306 11.348 1.00 0.00 O ATOM 146 CB ASP A 10 24.324 9.236 10.044 1.00 0.00 C ATOM 147 CG ASP A 10 23.326 10.383 10.214 1.00 0.00 C ATOM 148 OD1 ASP A 10 22.796 10.846 9.176 1.00 0.00 O ATOM 149 OD2 ASP A 10 23.086 10.802 11.371 1.00 0.00 O ATOM 0 H ASP A 10 25.346 6.589 10.847 1.00 0.00 H new ATOM 0 HA ASP A 10 25.097 9.197 12.103 1.00 0.00 H new ATOM 0 HB2 ASP A 10 25.234 9.627 9.589 1.00 0.00 H new ATOM 0 HB3 ASP A 10 23.907 8.508 9.348 1.00 0.00 H new ATOM 154 N THR A 11 23.246 8.085 13.317 1.00 0.00 N ATOM 155 CA THR A 11 22.059 7.580 14.051 1.00 0.00 C ATOM 156 C THR A 11 20.704 8.064 13.500 1.00 0.00 C ATOM 157 O THR A 11 19.686 7.399 13.713 1.00 0.00 O ATOM 158 CB THR A 11 22.134 7.949 15.542 1.00 0.00 C ATOM 159 OG1 THR A 11 22.338 9.339 15.682 1.00 0.00 O ATOM 160 CG2 THR A 11 23.291 7.240 16.246 1.00 0.00 C ATOM 0 H THR A 11 23.906 8.588 13.910 1.00 0.00 H new ATOM 0 HA THR A 11 22.096 6.500 13.909 1.00 0.00 H new ATOM 0 HB THR A 11 21.192 7.639 15.995 1.00 0.00 H new ATOM 0 HG1 THR A 11 22.383 9.569 16.634 1.00 0.00 H new ATOM 0 HG21 THR A 11 23.309 7.528 17.297 1.00 0.00 H new ATOM 0 HG22 THR A 11 23.158 6.161 16.168 1.00 0.00 H new ATOM 0 HG23 THR A 11 24.232 7.525 15.776 1.00 0.00 H new ATOM 168 N LYS A 12 20.682 9.177 12.747 1.00 0.00 N ATOM 169 CA LYS A 12 19.477 9.777 12.141 1.00 0.00 C ATOM 170 C LYS A 12 18.739 8.832 11.186 1.00 0.00 C ATOM 171 O LYS A 12 17.518 8.926 11.055 1.00 0.00 O ATOM 172 CB LYS A 12 19.879 11.088 11.442 1.00 0.00 C ATOM 173 CG LYS A 12 18.692 11.919 10.932 1.00 0.00 C ATOM 174 CD LYS A 12 19.194 13.244 10.339 1.00 0.00 C ATOM 175 CE LYS A 12 18.067 14.071 9.711 1.00 0.00 C ATOM 176 NZ LYS A 12 17.529 13.426 8.494 1.00 0.00 N ATOM 0 H LYS A 12 21.530 9.703 12.535 1.00 0.00 H new ATOM 0 HA LYS A 12 18.763 9.982 12.939 1.00 0.00 H new ATOM 0 HB2 LYS A 12 20.460 11.694 12.137 1.00 0.00 H new ATOM 0 HB3 LYS A 12 20.532 10.853 10.601 1.00 0.00 H new ATOM 0 HG2 LYS A 12 18.143 11.358 10.176 1.00 0.00 H new ATOM 0 HG3 LYS A 12 17.998 12.117 11.749 1.00 0.00 H new ATOM 0 HD2 LYS A 12 19.676 13.829 11.122 1.00 0.00 H new ATOM 0 HD3 LYS A 12 19.952 13.036 9.584 1.00 0.00 H new ATOM 0 HE2 LYS A 12 17.265 14.204 10.437 1.00 0.00 H new ATOM 0 HE3 LYS A 12 18.440 15.065 9.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 17.403 14.141 7.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 18.193 12.696 8.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 16.612 12.987 8.711 1.00 0.00 H new ATOM 190 N TRP A 13 19.452 7.906 10.538 1.00 0.00 N ATOM 191 CA TRP A 13 18.826 6.913 9.659 1.00 0.00 C ATOM 192 C TRP A 13 18.373 5.667 10.433 1.00 0.00 C ATOM 193 O TRP A 13 17.387 5.042 10.049 1.00 0.00 O ATOM 194 CB TRP A 13 19.754 6.568 8.493 1.00 0.00 C ATOM 195 CG TRP A 13 20.736 5.458 8.689 1.00 0.00 C ATOM 196 CD1 TRP A 13 22.038 5.614 9.006 1.00 0.00 C ATOM 197 CD2 TRP A 13 20.534 4.023 8.512 1.00 0.00 C ATOM 198 NE1 TRP A 13 22.661 4.383 9.042 1.00 0.00 N ATOM 199 CE2 TRP A 13 21.782 3.365 8.734 1.00 0.00 C ATOM 200 CE3 TRP A 13 19.428 3.215 8.161 1.00 0.00 C ATOM 201 CZ2 TRP A 13 21.921 1.975 8.610 1.00 0.00 C ATOM 202 CZ3 TRP A 13 19.564 1.819 8.033 1.00 0.00 C ATOM 203 CH2 TRP A 13 20.805 1.199 8.262 1.00 0.00 C ATOM 0 H TRP A 13 20.466 7.823 10.606 1.00 0.00 H new ATOM 0 HA TRP A 13 17.921 7.354 9.241 1.00 0.00 H new ATOM 0 HB2 TRP A 13 19.133 6.318 7.633 1.00 0.00 H new ATOM 0 HB3 TRP A 13 20.312 7.467 8.232 1.00 0.00 H new ATOM 0 HD1 TRP A 13 22.520 6.560 9.202 1.00 0.00 H new ATOM 0 HE1 TRP A 13 23.646 4.244 9.268 1.00 0.00 H new ATOM 0 HE3 TRP A 13 18.466 3.675 7.989 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 22.879 1.506 8.781 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 18.709 1.220 7.757 1.00 0.00 H new ATOM 0 HH2 TRP A 13 20.899 0.127 8.170 1.00 0.00 H new ATOM 214 N LEU A 14 19.052 5.336 11.542 1.00 0.00 N ATOM 215 CA LEU A 14 18.702 4.223 12.433 1.00 0.00 C ATOM 216 C LEU A 14 17.513 4.553 13.359 1.00 0.00 C ATOM 217 O LEU A 14 16.926 3.635 13.928 1.00 0.00 O ATOM 218 CB LEU A 14 19.916 3.833 13.298 1.00 0.00 C ATOM 219 CG LEU A 14 21.081 3.129 12.578 1.00 0.00 C ATOM 220 CD1 LEU A 14 22.216 2.930 13.585 1.00 0.00 C ATOM 221 CD2 LEU A 14 20.714 1.740 12.050 1.00 0.00 C ATOM 0 H LEU A 14 19.879 5.848 11.850 1.00 0.00 H new ATOM 0 HA LEU A 14 18.407 3.392 11.792 1.00 0.00 H new ATOM 0 HB2 LEU A 14 20.303 4.737 13.768 1.00 0.00 H new ATOM 0 HB3 LEU A 14 19.568 3.181 14.099 1.00 0.00 H new ATOM 0 HG LEU A 14 21.357 3.758 11.732 1.00 0.00 H new ATOM 0 HD11 LEU A 14 23.053 2.432 13.096 1.00 0.00 H new ATOM 0 HD12 LEU A 14 22.541 3.899 13.963 1.00 0.00 H new ATOM 0 HD13 LEU A 14 21.863 2.317 14.414 1.00 0.00 H new ATOM 0 HD21 LEU A 14 21.579 1.299 11.554 1.00 0.00 H new ATOM 0 HD22 LEU A 14 20.409 1.104 12.881 1.00 0.00 H new ATOM 0 HD23 LEU A 14 19.893 1.826 11.339 1.00 0.00 H new ATOM 233 N THR A 15 17.152 5.826 13.564 1.00 0.00 N ATOM 234 CA THR A 15 16.070 6.198 14.500 1.00 0.00 C ATOM 235 C THR A 15 14.645 6.029 13.955 1.00 0.00 C ATOM 236 O THR A 15 14.379 6.206 12.765 1.00 0.00 O ATOM 237 CB THR A 15 16.182 7.669 14.948 1.00 0.00 C ATOM 238 OG1 THR A 15 16.679 8.523 13.940 1.00 0.00 O ATOM 239 CG2 THR A 15 17.094 7.797 16.159 1.00 0.00 C ATOM 0 H THR A 15 17.590 6.620 13.097 1.00 0.00 H new ATOM 0 HA THR A 15 16.216 5.499 15.323 1.00 0.00 H new ATOM 0 HB THR A 15 15.164 7.976 15.190 1.00 0.00 H new ATOM 0 HG1 THR A 15 16.726 9.440 14.282 1.00 0.00 H new ATOM 0 HG21 THR A 15 17.158 8.843 16.457 1.00 0.00 H new ATOM 0 HG22 THR A 15 16.690 7.209 16.983 1.00 0.00 H new ATOM 0 HG23 THR A 15 18.089 7.430 15.906 1.00 0.00 H new ATOM 247 N LEU A 16 13.710 5.751 14.876 1.00 0.00 N ATOM 248 CA LEU A 16 12.262 5.633 14.661 1.00 0.00 C ATOM 249 C LEU A 16 11.534 6.459 15.730 1.00 0.00 C ATOM 250 O LEU A 16 11.907 6.438 16.904 1.00 0.00 O ATOM 251 CB LEU A 16 11.828 4.153 14.710 1.00 0.00 C ATOM 252 CG LEU A 16 12.254 3.320 13.487 1.00 0.00 C ATOM 253 CD1 LEU A 16 11.880 1.852 13.691 1.00 0.00 C ATOM 254 CD2 LEU A 16 11.580 3.794 12.194 1.00 0.00 C ATOM 0 H LEU A 16 13.962 5.593 15.852 1.00 0.00 H new ATOM 0 HA LEU A 16 12.002 6.017 13.675 1.00 0.00 H new ATOM 0 HB2 LEU A 16 12.244 3.695 15.608 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.743 4.109 14.803 1.00 0.00 H new ATOM 0 HG LEU A 16 13.333 3.444 13.392 1.00 0.00 H new ATOM 0 HD11 LEU A 16 12.187 1.274 12.819 1.00 0.00 H new ATOM 0 HD12 LEU A 16 12.385 1.468 14.577 1.00 0.00 H new ATOM 0 HD13 LEU A 16 10.801 1.766 13.822 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.914 3.174 11.362 1.00 0.00 H new ATOM 0 HD22 LEU A 16 10.498 3.712 12.297 1.00 0.00 H new ATOM 0 HD23 LEU A 16 11.849 4.833 12.003 1.00 0.00 H new ATOM 266 N GLU A 17 10.513 7.212 15.321 1.00 0.00 N ATOM 267 CA GLU A 17 9.738 8.085 16.213 1.00 0.00 C ATOM 268 C GLU A 17 8.773 7.315 17.130 1.00 0.00 C ATOM 269 O GLU A 17 8.230 6.267 16.771 1.00 0.00 O ATOM 270 CB GLU A 17 8.956 9.121 15.394 1.00 0.00 C ATOM 271 CG GLU A 17 9.875 10.156 14.734 1.00 0.00 C ATOM 272 CD GLU A 17 9.052 11.241 14.034 1.00 0.00 C ATOM 273 OE1 GLU A 17 8.474 12.088 14.757 1.00 0.00 O ATOM 274 OE2 GLU A 17 8.989 11.224 12.781 1.00 0.00 O ATOM 0 H GLU A 17 10.195 7.236 14.352 1.00 0.00 H new ATOM 0 HA GLU A 17 10.461 8.583 16.859 1.00 0.00 H new ATOM 0 HB2 GLU A 17 8.376 8.610 14.625 1.00 0.00 H new ATOM 0 HB3 GLU A 17 8.244 9.632 16.043 1.00 0.00 H new ATOM 0 HG2 GLU A 17 10.519 10.610 15.487 1.00 0.00 H new ATOM 0 HG3 GLU A 17 10.526 9.664 14.012 1.00 0.00 H new ATOM 281 N VAL A 18 8.536 7.879 18.315 1.00 0.00 N ATOM 282 CA VAL A 18 7.631 7.366 19.351 1.00 0.00 C ATOM 283 C VAL A 18 6.239 7.984 19.183 1.00 0.00 C ATOM 284 O VAL A 18 6.112 9.186 18.922 1.00 0.00 O ATOM 285 CB VAL A 18 8.210 7.671 20.749 1.00 0.00 C ATOM 286 CG1 VAL A 18 7.277 7.264 21.894 1.00 0.00 C ATOM 287 CG2 VAL A 18 9.537 6.927 20.942 1.00 0.00 C ATOM 0 H VAL A 18 8.991 8.748 18.594 1.00 0.00 H new ATOM 0 HA VAL A 18 7.537 6.285 19.248 1.00 0.00 H new ATOM 0 HB VAL A 18 8.345 8.752 20.786 1.00 0.00 H new ATOM 0 HG11 VAL A 18 7.745 7.506 22.848 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.334 7.804 21.805 1.00 0.00 H new ATOM 0 HG13 VAL A 18 7.087 6.192 21.845 1.00 0.00 H new ATOM 0 HG21 VAL A 18 9.938 7.148 21.931 1.00 0.00 H new ATOM 0 HG22 VAL A 18 9.369 5.854 20.850 1.00 0.00 H new ATOM 0 HG23 VAL A 18 10.249 7.249 20.182 1.00 0.00 H new ATOM 297 N CYS A 19 5.193 7.170 19.341 1.00 0.00 N ATOM 298 CA CYS A 19 3.799 7.597 19.231 1.00 0.00 C ATOM 299 C CYS A 19 3.473 8.695 20.267 1.00 0.00 C ATOM 300 O CYS A 19 3.676 8.528 21.478 1.00 0.00 O ATOM 301 CB CYS A 19 2.914 6.352 19.373 1.00 0.00 C ATOM 302 SG CYS A 19 1.163 6.668 18.982 1.00 0.00 S ATOM 0 H CYS A 19 5.294 6.177 19.553 1.00 0.00 H new ATOM 0 HA CYS A 19 3.607 8.052 18.259 1.00 0.00 H new ATOM 0 HB2 CYS A 19 3.291 5.569 18.715 1.00 0.00 H new ATOM 0 HB3 CYS A 19 2.990 5.975 20.393 1.00 0.00 H new ATOM 307 N ARG A 20 2.990 9.850 19.793 1.00 0.00 N ATOM 308 CA ARG A 20 2.658 11.001 20.653 1.00 0.00 C ATOM 309 C ARG A 20 1.512 10.685 21.616 1.00 0.00 C ATOM 310 O ARG A 20 1.561 11.068 22.783 1.00 0.00 O ATOM 311 CB ARG A 20 2.336 12.240 19.799 1.00 0.00 C ATOM 312 CG ARG A 20 3.440 12.650 18.805 1.00 0.00 C ATOM 313 CD ARG A 20 4.823 12.822 19.452 1.00 0.00 C ATOM 314 NE ARG A 20 5.750 13.523 18.545 1.00 0.00 N ATOM 315 CZ ARG A 20 6.505 12.988 17.599 1.00 0.00 C ATOM 316 NH1 ARG A 20 7.192 13.761 16.803 1.00 0.00 N ATOM 317 NH2 ARG A 20 6.616 11.704 17.390 1.00 0.00 N ATOM 0 H ARG A 20 2.817 10.017 18.802 1.00 0.00 H new ATOM 0 HA ARG A 20 3.536 11.219 21.262 1.00 0.00 H new ATOM 0 HB2 ARG A 20 1.418 12.050 19.242 1.00 0.00 H new ATOM 0 HB3 ARG A 20 2.137 13.080 20.465 1.00 0.00 H new ATOM 0 HG2 ARG A 20 3.507 11.897 18.020 1.00 0.00 H new ATOM 0 HG3 ARG A 20 3.155 13.586 18.325 1.00 0.00 H new ATOM 0 HD2 ARG A 20 4.726 13.382 20.382 1.00 0.00 H new ATOM 0 HD3 ARG A 20 5.231 11.845 19.710 1.00 0.00 H new ATOM 0 HE ARG A 20 5.817 14.534 18.660 1.00 0.00 H new ATOM 0 HH11 ARG A 20 7.146 14.774 16.911 1.00 0.00 H new ATOM 0 HH12 ARG A 20 7.775 13.352 16.073 1.00 0.00 H new ATOM 0 HH21 ARG A 20 6.102 11.046 17.975 1.00 0.00 H new ATOM 0 HH22 ARG A 20 7.217 11.359 16.642 1.00 0.00 H new ATOM 331 N GLU A 21 0.506 9.942 21.157 1.00 0.00 N ATOM 332 CA GLU A 21 -0.630 9.520 21.985 1.00 0.00 C ATOM 333 C GLU A 21 -0.225 8.480 23.042 1.00 0.00 C ATOM 334 O GLU A 21 -0.838 8.433 24.108 1.00 0.00 O ATOM 335 CB GLU A 21 -1.779 9.003 21.101 1.00 0.00 C ATOM 336 CG GLU A 21 -2.386 10.071 20.178 1.00 0.00 C ATOM 337 CD GLU A 21 -3.056 11.199 20.969 1.00 0.00 C ATOM 338 OE1 GLU A 21 -4.260 11.065 21.290 1.00 0.00 O ATOM 339 OE2 GLU A 21 -2.364 12.195 21.285 1.00 0.00 O ATOM 0 H GLU A 21 0.453 9.612 20.193 1.00 0.00 H new ATOM 0 HA GLU A 21 -0.982 10.396 22.530 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -1.412 8.177 20.492 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -2.564 8.602 21.742 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -1.604 10.488 19.543 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.119 9.606 19.518 1.00 0.00 H new ATOM 346 N PHE A 22 0.820 7.679 22.808 1.00 0.00 N ATOM 347 CA PHE A 22 1.350 6.730 23.795 1.00 0.00 C ATOM 348 C PHE A 22 2.007 7.491 24.954 1.00 0.00 C ATOM 349 O PHE A 22 1.734 7.205 26.121 1.00 0.00 O ATOM 350 CB PHE A 22 2.335 5.782 23.102 1.00 0.00 C ATOM 351 CG PHE A 22 3.180 4.905 24.007 1.00 0.00 C ATOM 352 CD1 PHE A 22 2.581 3.893 24.781 1.00 0.00 C ATOM 353 CD2 PHE A 22 4.577 5.084 24.048 1.00 0.00 C ATOM 354 CE1 PHE A 22 3.377 3.071 25.600 1.00 0.00 C ATOM 355 CE2 PHE A 22 5.371 4.264 24.869 1.00 0.00 C ATOM 356 CZ PHE A 22 4.770 3.256 25.645 1.00 0.00 C ATOM 0 H PHE A 22 1.326 7.670 21.922 1.00 0.00 H new ATOM 0 HA PHE A 22 0.541 6.133 24.216 1.00 0.00 H new ATOM 0 HB2 PHE A 22 1.771 5.135 22.430 1.00 0.00 H new ATOM 0 HB3 PHE A 22 3.005 6.379 22.483 1.00 0.00 H new ATOM 0 HD1 PHE A 22 1.511 3.748 24.746 1.00 0.00 H new ATOM 0 HD2 PHE A 22 5.039 5.853 23.447 1.00 0.00 H new ATOM 0 HE1 PHE A 22 2.917 2.296 26.195 1.00 0.00 H new ATOM 0 HE2 PHE A 22 6.441 4.408 24.904 1.00 0.00 H new ATOM 0 HZ PHE A 22 5.379 2.624 26.275 1.00 0.00 H new ATOM 366 N GLN A 23 2.814 8.516 24.645 1.00 0.00 N ATOM 367 CA GLN A 23 3.435 9.392 25.648 1.00 0.00 C ATOM 368 C GLN A 23 2.380 10.204 26.428 1.00 0.00 C ATOM 369 O GLN A 23 2.540 10.427 27.630 1.00 0.00 O ATOM 370 CB GLN A 23 4.456 10.322 24.970 1.00 0.00 C ATOM 371 CG GLN A 23 5.666 9.570 24.391 1.00 0.00 C ATOM 372 CD GLN A 23 6.559 8.966 25.475 1.00 0.00 C ATOM 373 OE1 GLN A 23 7.376 9.638 26.090 1.00 0.00 O ATOM 374 NE2 GLN A 23 6.442 7.685 25.763 1.00 0.00 N ATOM 0 H GLN A 23 3.056 8.762 23.685 1.00 0.00 H new ATOM 0 HA GLN A 23 3.954 8.765 26.373 1.00 0.00 H new ATOM 0 HB2 GLN A 23 3.961 10.873 24.170 1.00 0.00 H new ATOM 0 HB3 GLN A 23 4.806 11.057 25.695 1.00 0.00 H new ATOM 0 HG2 GLN A 23 5.314 8.776 23.732 1.00 0.00 H new ATOM 0 HG3 GLN A 23 6.255 10.254 23.780 1.00 0.00 H new ATOM 0 HE21 GLN A 23 5.766 7.109 25.261 1.00 0.00 H new ATOM 0 HE22 GLN A 23 7.027 7.270 26.488 1.00 0.00 H new ATOM 383 N ARG A 24 1.284 10.611 25.766 1.00 0.00 N ATOM 384 CA ARG A 24 0.150 11.334 26.379 1.00 0.00 C ATOM 385 C ARG A 24 -0.760 10.428 27.233 1.00 0.00 C ATOM 386 O ARG A 24 -1.563 10.933 28.019 1.00 0.00 O ATOM 387 CB ARG A 24 -0.637 12.060 25.266 1.00 0.00 C ATOM 388 CG ARG A 24 -1.498 13.217 25.803 1.00 0.00 C ATOM 389 CD ARG A 24 -2.051 14.107 24.679 1.00 0.00 C ATOM 390 NE ARG A 24 -3.124 13.451 23.908 1.00 0.00 N ATOM 391 CZ ARG A 24 -4.422 13.497 24.166 1.00 0.00 C ATOM 392 NH1 ARG A 24 -5.273 12.933 23.355 1.00 0.00 N ATOM 393 NH2 ARG A 24 -4.920 14.110 25.210 1.00 0.00 N ATOM 0 H ARG A 24 1.156 10.444 24.768 1.00 0.00 H new ATOM 0 HA ARG A 24 0.551 12.066 27.081 1.00 0.00 H new ATOM 0 HB2 ARG A 24 0.063 12.447 24.526 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -1.279 11.343 24.754 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -2.327 12.811 26.382 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -0.901 13.825 26.484 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -2.433 15.033 25.109 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -1.239 14.380 24.005 1.00 0.00 H new ATOM 0 HE ARG A 24 -2.837 12.907 23.094 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -4.940 12.454 22.518 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -6.272 12.971 23.557 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -4.300 14.581 25.869 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -5.928 14.117 25.365 1.00 0.00 H new ATOM 407 N GLY A 25 -0.631 9.103 27.109 1.00 0.00 N ATOM 408 CA GLY A 25 -1.422 8.109 27.848 1.00 0.00 C ATOM 409 C GLY A 25 -2.821 7.876 27.259 1.00 0.00 C ATOM 410 O GLY A 25 -3.780 7.675 28.007 1.00 0.00 O ATOM 0 H GLY A 25 0.045 8.679 26.474 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.880 7.163 27.862 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -1.522 8.434 28.884 1.00 0.00 H new ATOM 414 N THR A 26 -2.946 7.938 25.928 1.00 0.00 N ATOM 415 CA THR A 26 -4.216 7.826 25.180 1.00 0.00 C ATOM 416 C THR A 26 -4.216 6.721 24.112 1.00 0.00 C ATOM 417 O THR A 26 -5.278 6.151 23.839 1.00 0.00 O ATOM 418 CB THR A 26 -4.552 9.183 24.522 1.00 0.00 C ATOM 419 OG1 THR A 26 -4.412 10.249 25.442 1.00 0.00 O ATOM 420 CG2 THR A 26 -5.978 9.261 23.973 1.00 0.00 C ATOM 0 H THR A 26 -2.141 8.072 25.316 1.00 0.00 H new ATOM 0 HA THR A 26 -4.977 7.547 25.909 1.00 0.00 H new ATOM 0 HB THR A 26 -3.844 9.268 23.697 1.00 0.00 H new ATOM 0 HG1 THR A 26 -4.917 11.026 25.122 1.00 0.00 H new ATOM 0 HG21 THR A 26 -6.143 10.241 23.526 1.00 0.00 H new ATOM 0 HG22 THR A 26 -6.119 8.489 23.217 1.00 0.00 H new ATOM 0 HG23 THR A 26 -6.689 9.108 24.785 1.00 0.00 H new ATOM 428 N CYS A 27 -3.064 6.380 23.515 1.00 0.00 N ATOM 429 CA CYS A 27 -2.967 5.324 22.495 1.00 0.00 C ATOM 430 C CYS A 27 -3.394 3.946 23.056 1.00 0.00 C ATOM 431 O CYS A 27 -3.068 3.597 24.198 1.00 0.00 O ATOM 432 CB CYS A 27 -1.539 5.304 21.921 1.00 0.00 C ATOM 433 SG CYS A 27 -1.447 4.401 20.338 1.00 0.00 S ATOM 0 H CYS A 27 -2.173 6.829 23.726 1.00 0.00 H new ATOM 0 HA CYS A 27 -3.662 5.544 21.685 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -1.193 6.327 21.775 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -0.866 4.840 22.642 1.00 0.00 H new ATOM 438 N SER A 28 -4.124 3.168 22.249 1.00 0.00 N ATOM 439 CA SER A 28 -4.650 1.837 22.597 1.00 0.00 C ATOM 440 C SER A 28 -4.498 0.846 21.430 1.00 0.00 C ATOM 441 O SER A 28 -5.474 0.282 20.924 1.00 0.00 O ATOM 442 CB SER A 28 -6.121 1.941 23.049 1.00 0.00 C ATOM 443 OG SER A 28 -6.269 2.748 24.209 1.00 0.00 O ATOM 0 H SER A 28 -4.375 3.455 21.303 1.00 0.00 H new ATOM 0 HA SER A 28 -4.060 1.450 23.428 1.00 0.00 H new ATOM 0 HB2 SER A 28 -6.720 2.358 22.239 1.00 0.00 H new ATOM 0 HB3 SER A 28 -6.509 0.943 23.251 1.00 0.00 H new ATOM 0 HG SER A 28 -7.215 2.789 24.461 1.00 0.00 H new ATOM 449 N ARG A 29 -3.247 0.624 21.007 1.00 0.00 N ATOM 450 CA ARG A 29 -2.827 -0.292 19.926 1.00 0.00 C ATOM 451 C ARG A 29 -1.460 -0.913 20.261 1.00 0.00 C ATOM 452 O ARG A 29 -0.634 -0.239 20.886 1.00 0.00 O ATOM 453 CB ARG A 29 -2.683 0.476 18.593 1.00 0.00 C ATOM 454 CG ARG A 29 -3.999 1.025 18.021 1.00 0.00 C ATOM 455 CD ARG A 29 -3.766 1.849 16.745 1.00 0.00 C ATOM 456 NE ARG A 29 -3.336 1.033 15.591 1.00 0.00 N ATOM 457 CZ ARG A 29 -4.123 0.441 14.707 1.00 0.00 C ATOM 458 NH1 ARG A 29 -3.608 -0.145 13.663 1.00 0.00 N ATOM 459 NH2 ARG A 29 -5.427 0.413 14.819 1.00 0.00 N ATOM 0 H ARG A 29 -2.452 1.103 21.430 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.586 -1.068 19.832 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -1.993 1.307 18.741 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.231 -0.187 17.855 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -4.673 0.197 17.801 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -4.490 1.646 18.770 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -4.686 2.374 16.487 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -3.011 2.609 16.945 1.00 0.00 H new ATOM 0 HE ARG A 29 -2.331 0.914 15.463 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -2.597 -0.148 13.527 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -4.216 -0.601 12.982 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -5.880 0.861 15.615 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -5.990 -0.057 14.110 1.00 0.00 H new ATOM 473 N PRO A 30 -1.178 -2.162 19.848 1.00 0.00 N ATOM 474 CA PRO A 30 0.133 -2.769 20.063 1.00 0.00 C ATOM 475 C PRO A 30 1.167 -2.136 19.117 1.00 0.00 C ATOM 476 O PRO A 30 0.823 -1.667 18.029 1.00 0.00 O ATOM 477 CB PRO A 30 -0.067 -4.259 19.766 1.00 0.00 C ATOM 478 CG PRO A 30 -1.174 -4.261 18.713 1.00 0.00 C ATOM 479 CD PRO A 30 -2.049 -3.070 19.114 1.00 0.00 C ATOM 0 HA PRO A 30 0.509 -2.616 21.074 1.00 0.00 H new ATOM 0 HB2 PRO A 30 0.846 -4.721 19.391 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -0.360 -4.812 20.659 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -0.772 -4.143 17.707 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -1.737 -5.194 18.724 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -2.470 -2.582 18.235 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -2.887 -3.392 19.732 1.00 0.00 H new ATOM 487 N ASP A 31 2.448 -2.165 19.497 1.00 0.00 N ATOM 488 CA ASP A 31 3.562 -1.654 18.676 1.00 0.00 C ATOM 489 C ASP A 31 3.547 -2.245 17.247 1.00 0.00 C ATOM 490 O ASP A 31 3.861 -1.567 16.269 1.00 0.00 O ATOM 491 CB ASP A 31 4.874 -1.986 19.404 1.00 0.00 C ATOM 492 CG ASP A 31 6.103 -1.393 18.713 1.00 0.00 C ATOM 493 OD1 ASP A 31 6.674 -2.088 17.844 1.00 0.00 O ATOM 494 OD2 ASP A 31 6.492 -0.261 19.081 1.00 0.00 O ATOM 0 H ASP A 31 2.749 -2.548 20.393 1.00 0.00 H new ATOM 0 HA ASP A 31 3.461 -0.576 18.555 1.00 0.00 H new ATOM 0 HB2 ASP A 31 4.822 -1.611 20.426 1.00 0.00 H new ATOM 0 HB3 ASP A 31 4.985 -3.068 19.467 1.00 0.00 H new ATOM 499 N THR A 32 3.130 -3.509 17.135 1.00 0.00 N ATOM 500 CA THR A 32 2.964 -4.294 15.904 1.00 0.00 C ATOM 501 C THR A 32 1.961 -3.708 14.904 1.00 0.00 C ATOM 502 O THR A 32 2.071 -3.982 13.710 1.00 0.00 O ATOM 503 CB THR A 32 2.485 -5.712 16.273 1.00 0.00 C ATOM 504 OG1 THR A 32 3.144 -6.181 17.436 1.00 0.00 O ATOM 505 CG2 THR A 32 2.741 -6.750 15.177 1.00 0.00 C ATOM 0 H THR A 32 2.881 -4.052 17.962 1.00 0.00 H new ATOM 0 HA THR A 32 3.940 -4.290 15.418 1.00 0.00 H new ATOM 0 HB THR A 32 1.411 -5.610 16.426 1.00 0.00 H new ATOM 0 HG1 THR A 32 2.824 -7.081 17.653 1.00 0.00 H new ATOM 0 HG21 THR A 32 2.378 -7.724 15.506 1.00 0.00 H new ATOM 0 HG22 THR A 32 2.217 -6.456 14.268 1.00 0.00 H new ATOM 0 HG23 THR A 32 3.811 -6.810 14.976 1.00 0.00 H new ATOM 513 N GLU A 33 0.987 -2.909 15.354 1.00 0.00 N ATOM 514 CA GLU A 33 -0.062 -2.324 14.500 1.00 0.00 C ATOM 515 C GLU A 33 -0.101 -0.785 14.486 1.00 0.00 C ATOM 516 O GLU A 33 -0.684 -0.209 13.562 1.00 0.00 O ATOM 517 CB GLU A 33 -1.436 -2.885 14.905 1.00 0.00 C ATOM 518 CG GLU A 33 -1.544 -4.406 14.729 1.00 0.00 C ATOM 519 CD GLU A 33 -2.970 -4.889 15.020 1.00 0.00 C ATOM 520 OE1 GLU A 33 -3.745 -5.061 14.048 1.00 0.00 O ATOM 521 OE2 GLU A 33 -3.292 -5.088 16.215 1.00 0.00 O ATOM 0 H GLU A 33 0.901 -2.645 16.335 1.00 0.00 H new ATOM 0 HA GLU A 33 0.191 -2.615 13.480 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.632 -2.632 15.947 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.209 -2.401 14.308 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -1.263 -4.680 13.712 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -0.843 -4.905 15.398 1.00 0.00 H new ATOM 528 N CYS A 34 0.502 -0.107 15.469 1.00 0.00 N ATOM 529 CA CYS A 34 0.538 1.364 15.511 1.00 0.00 C ATOM 530 C CYS A 34 1.604 1.924 14.540 1.00 0.00 C ATOM 531 O CYS A 34 2.658 1.316 14.333 1.00 0.00 O ATOM 532 CB CYS A 34 0.757 1.831 16.958 1.00 0.00 C ATOM 533 SG CYS A 34 0.256 3.579 17.158 1.00 0.00 S ATOM 0 H CYS A 34 0.976 -0.556 16.253 1.00 0.00 H new ATOM 0 HA CYS A 34 -0.420 1.759 15.172 1.00 0.00 H new ATOM 0 HB2 CYS A 34 0.182 1.203 17.639 1.00 0.00 H new ATOM 0 HB3 CYS A 34 1.807 1.716 17.227 1.00 0.00 H new ATOM 538 N LYS A 35 1.337 3.086 13.926 1.00 0.00 N ATOM 539 CA LYS A 35 2.207 3.757 12.933 1.00 0.00 C ATOM 540 C LYS A 35 3.584 4.201 13.458 1.00 0.00 C ATOM 541 O LYS A 35 4.466 4.512 12.653 1.00 0.00 O ATOM 542 CB LYS A 35 1.469 4.970 12.337 1.00 0.00 C ATOM 543 CG LYS A 35 0.217 4.572 11.532 1.00 0.00 C ATOM 544 CD LYS A 35 -0.528 5.782 10.949 1.00 0.00 C ATOM 545 CE LYS A 35 0.302 6.533 9.901 1.00 0.00 C ATOM 546 NZ LYS A 35 -0.464 7.656 9.320 1.00 0.00 N ATOM 0 H LYS A 35 0.480 3.608 14.110 1.00 0.00 H new ATOM 0 HA LYS A 35 2.416 3.001 12.176 1.00 0.00 H new ATOM 0 HB2 LYS A 35 1.178 5.644 13.143 1.00 0.00 H new ATOM 0 HB3 LYS A 35 2.151 5.522 11.690 1.00 0.00 H new ATOM 0 HG2 LYS A 35 0.510 3.906 10.720 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -0.460 4.011 12.176 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -1.461 5.447 10.497 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -0.793 6.465 11.756 1.00 0.00 H new ATOM 0 HE2 LYS A 35 1.216 6.911 10.359 1.00 0.00 H new ATOM 0 HE3 LYS A 35 0.602 5.846 9.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 0.121 8.147 8.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -1.324 7.290 8.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -0.729 8.322 10.073 1.00 0.00 H new ATOM 560 N PHE A 36 3.771 4.228 14.777 1.00 0.00 N ATOM 561 CA PHE A 36 4.991 4.654 15.472 1.00 0.00 C ATOM 562 C PHE A 36 5.384 3.674 16.598 1.00 0.00 C ATOM 563 O PHE A 36 4.728 2.651 16.808 1.00 0.00 O ATOM 564 CB PHE A 36 4.781 6.089 15.982 1.00 0.00 C ATOM 565 CG PHE A 36 4.612 7.122 14.882 1.00 0.00 C ATOM 566 CD1 PHE A 36 5.716 7.486 14.089 1.00 0.00 C ATOM 567 CD2 PHE A 36 3.354 7.708 14.639 1.00 0.00 C ATOM 568 CE1 PHE A 36 5.567 8.434 13.061 1.00 0.00 C ATOM 569 CE2 PHE A 36 3.204 8.654 13.608 1.00 0.00 C ATOM 570 CZ PHE A 36 4.311 9.018 12.820 1.00 0.00 C ATOM 0 H PHE A 36 3.039 3.939 15.426 1.00 0.00 H new ATOM 0 HA PHE A 36 5.832 4.644 14.779 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.899 6.110 16.623 1.00 0.00 H new ATOM 0 HB3 PHE A 36 5.632 6.371 16.602 1.00 0.00 H new ATOM 0 HD1 PHE A 36 6.681 7.036 14.270 1.00 0.00 H new ATOM 0 HD2 PHE A 36 2.504 7.431 15.245 1.00 0.00 H new ATOM 0 HE1 PHE A 36 6.417 8.713 12.457 1.00 0.00 H new ATOM 0 HE2 PHE A 36 2.239 9.101 13.422 1.00 0.00 H new ATOM 0 HZ PHE A 36 4.196 9.746 12.030 1.00 0.00 H new ATOM 580 N ALA A 37 6.482 3.957 17.306 1.00 0.00 N ATOM 581 CA ALA A 37 7.034 3.059 18.321 1.00 0.00 C ATOM 582 C ALA A 37 6.470 3.299 19.740 1.00 0.00 C ATOM 583 O ALA A 37 6.193 4.434 20.134 1.00 0.00 O ATOM 584 CB ALA A 37 8.557 3.256 18.312 1.00 0.00 C ATOM 0 H ALA A 37 7.014 4.819 17.189 1.00 0.00 H new ATOM 0 HA ALA A 37 6.750 2.037 18.072 1.00 0.00 H new ATOM 0 HB1 ALA A 37 9.013 2.603 19.057 1.00 0.00 H new ATOM 0 HB2 ALA A 37 8.950 3.010 17.325 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.791 4.294 18.548 1.00 0.00 H new ATOM 590 N HIS A 38 6.341 2.214 20.512 1.00 0.00 N ATOM 591 CA HIS A 38 5.887 2.165 21.911 1.00 0.00 C ATOM 592 C HIS A 38 6.987 1.558 22.826 1.00 0.00 C ATOM 593 O HIS A 38 6.818 0.444 23.339 1.00 0.00 O ATOM 594 CB HIS A 38 4.550 1.398 22.014 1.00 0.00 C ATOM 595 CG HIS A 38 3.384 1.969 21.239 1.00 0.00 C ATOM 596 ND1 HIS A 38 2.264 1.278 20.829 1.00 0.00 N ATOM 597 CD2 HIS A 38 3.198 3.274 20.866 1.00 0.00 C ATOM 598 CE1 HIS A 38 1.435 2.145 20.218 1.00 0.00 C ATOM 599 NE2 HIS A 38 1.965 3.379 20.209 1.00 0.00 N ATOM 0 H HIS A 38 6.565 1.285 20.155 1.00 0.00 H new ATOM 0 HA HIS A 38 5.708 3.181 22.262 1.00 0.00 H new ATOM 0 HB2 HIS A 38 4.716 0.375 21.676 1.00 0.00 H new ATOM 0 HB3 HIS A 38 4.267 1.344 23.065 1.00 0.00 H new ATOM 0 HD1 HIS A 38 2.093 0.282 20.965 1.00 0.00 H new ATOM 0 HD2 HIS A 38 3.887 4.086 21.048 1.00 0.00 H new ATOM 0 HE1 HIS A 38 0.477 1.884 19.794 1.00 0.00 H new ATOM 607 N PRO A 39 8.143 2.229 23.010 1.00 0.00 N ATOM 608 CA PRO A 39 9.265 1.722 23.805 1.00 0.00 C ATOM 609 C PRO A 39 9.020 1.749 25.323 1.00 0.00 C ATOM 610 O PRO A 39 8.139 2.448 25.829 1.00 0.00 O ATOM 611 CB PRO A 39 10.449 2.622 23.445 1.00 0.00 C ATOM 612 CG PRO A 39 9.766 3.962 23.179 1.00 0.00 C ATOM 613 CD PRO A 39 8.483 3.539 22.469 1.00 0.00 C ATOM 0 HA PRO A 39 9.432 0.670 23.574 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.172 2.688 24.258 1.00 0.00 H new ATOM 0 HB3 PRO A 39 10.986 2.258 22.569 1.00 0.00 H new ATOM 0 HG2 PRO A 39 9.560 4.504 24.102 1.00 0.00 H new ATOM 0 HG3 PRO A 39 10.379 4.614 22.557 1.00 0.00 H new ATOM 0 HD2 PRO A 39 7.682 4.256 22.649 1.00 0.00 H new ATOM 0 HD3 PRO A 39 8.631 3.490 21.390 1.00 0.00 H new ATOM 621 N SER A 40 9.868 1.023 26.053 1.00 0.00 N ATOM 622 CA SER A 40 9.902 0.965 27.519 1.00 0.00 C ATOM 623 C SER A 40 11.073 1.806 28.047 1.00 0.00 C ATOM 624 O SER A 40 11.990 2.159 27.300 1.00 0.00 O ATOM 625 CB SER A 40 10.046 -0.493 27.987 1.00 0.00 C ATOM 626 OG SER A 40 8.925 -1.261 27.575 1.00 0.00 O ATOM 0 H SER A 40 10.581 0.434 25.623 1.00 0.00 H new ATOM 0 HA SER A 40 8.969 1.369 27.912 1.00 0.00 H new ATOM 0 HB2 SER A 40 10.960 -0.924 27.578 1.00 0.00 H new ATOM 0 HB3 SER A 40 10.137 -0.525 29.073 1.00 0.00 H new ATOM 0 HG SER A 40 9.033 -2.186 27.879 1.00 0.00 H new ATOM 632 N LYS A 41 11.071 2.112 29.351 1.00 0.00 N ATOM 633 CA LYS A 41 12.109 2.924 30.028 1.00 0.00 C ATOM 634 C LYS A 41 13.544 2.399 29.864 1.00 0.00 C ATOM 635 O LYS A 41 14.500 3.171 29.958 1.00 0.00 O ATOM 636 CB LYS A 41 11.762 3.090 31.520 1.00 0.00 C ATOM 637 CG LYS A 41 10.471 3.896 31.740 1.00 0.00 C ATOM 638 CD LYS A 41 10.199 4.098 33.239 1.00 0.00 C ATOM 639 CE LYS A 41 8.891 4.858 33.492 1.00 0.00 C ATOM 640 NZ LYS A 41 8.963 6.259 33.027 1.00 0.00 N ATOM 0 H LYS A 41 10.335 1.799 29.984 1.00 0.00 H new ATOM 0 HA LYS A 41 12.099 3.892 29.527 1.00 0.00 H new ATOM 0 HB2 LYS A 41 11.654 2.106 31.976 1.00 0.00 H new ATOM 0 HB3 LYS A 41 12.588 3.588 32.028 1.00 0.00 H new ATOM 0 HG2 LYS A 41 10.554 4.865 31.248 1.00 0.00 H new ATOM 0 HG3 LYS A 41 9.630 3.376 31.281 1.00 0.00 H new ATOM 0 HD2 LYS A 41 10.155 3.127 33.733 1.00 0.00 H new ATOM 0 HD3 LYS A 41 11.028 4.646 33.687 1.00 0.00 H new ATOM 0 HE2 LYS A 41 8.072 4.349 32.983 1.00 0.00 H new ATOM 0 HE3 LYS A 41 8.663 4.842 34.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 8.083 6.754 33.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 9.769 6.734 33.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 9.087 6.276 31.995 1.00 0.00 H new ATOM 654 N SER A 42 13.694 1.101 29.604 1.00 0.00 N ATOM 655 CA SER A 42 14.979 0.420 29.378 1.00 0.00 C ATOM 656 C SER A 42 15.618 0.728 28.011 1.00 0.00 C ATOM 657 O SER A 42 16.825 0.528 27.848 1.00 0.00 O ATOM 658 CB SER A 42 14.791 -1.100 29.487 1.00 0.00 C ATOM 659 OG SER A 42 14.174 -1.443 30.721 1.00 0.00 O ATOM 0 H SER A 42 12.898 0.467 29.542 1.00 0.00 H new ATOM 0 HA SER A 42 15.652 0.799 30.147 1.00 0.00 H new ATOM 0 HB2 SER A 42 14.180 -1.456 28.658 1.00 0.00 H new ATOM 0 HB3 SER A 42 15.758 -1.598 29.407 1.00 0.00 H new ATOM 0 HG SER A 42 14.061 -2.415 30.771 1.00 0.00 H new ATOM 665 N CYS A 43 14.845 1.200 27.024 1.00 0.00 N ATOM 666 CA CYS A 43 15.343 1.518 25.682 1.00 0.00 C ATOM 667 C CYS A 43 16.030 2.899 25.616 1.00 0.00 C ATOM 668 O CYS A 43 15.817 3.761 26.472 1.00 0.00 O ATOM 669 CB CYS A 43 14.166 1.463 24.692 1.00 0.00 C ATOM 670 SG CYS A 43 13.429 -0.198 24.658 1.00 0.00 S ATOM 0 H CYS A 43 13.846 1.373 27.137 1.00 0.00 H new ATOM 0 HA CYS A 43 16.101 0.780 25.419 1.00 0.00 H new ATOM 0 HB2 CYS A 43 13.411 2.195 24.977 1.00 0.00 H new ATOM 0 HB3 CYS A 43 14.511 1.733 23.694 1.00 0.00 H new ATOM 0 HG CYS A 43 12.438 -0.216 23.817 1.00 0.00 H new ATOM 676 N GLN A 44 16.831 3.131 24.570 1.00 0.00 N ATOM 677 CA GLN A 44 17.551 4.385 24.281 1.00 0.00 C ATOM 678 C GLN A 44 16.613 5.517 23.777 1.00 0.00 C ATOM 679 O GLN A 44 16.886 6.175 22.772 1.00 0.00 O ATOM 680 CB GLN A 44 18.711 4.054 23.312 1.00 0.00 C ATOM 681 CG GLN A 44 19.783 5.149 23.159 1.00 0.00 C ATOM 682 CD GLN A 44 20.413 5.553 24.488 1.00 0.00 C ATOM 683 OE1 GLN A 44 21.272 4.873 25.029 1.00 0.00 O ATOM 684 NE2 GLN A 44 20.034 6.679 25.055 1.00 0.00 N ATOM 0 H GLN A 44 17.006 2.416 23.864 1.00 0.00 H new ATOM 0 HA GLN A 44 17.968 4.795 25.201 1.00 0.00 H new ATOM 0 HB2 GLN A 44 19.197 3.140 23.654 1.00 0.00 H new ATOM 0 HB3 GLN A 44 18.290 3.843 22.329 1.00 0.00 H new ATOM 0 HG2 GLN A 44 20.563 4.795 22.486 1.00 0.00 H new ATOM 0 HG3 GLN A 44 19.335 6.027 22.694 1.00 0.00 H new ATOM 0 HE21 GLN A 44 19.318 7.256 24.614 1.00 0.00 H new ATOM 0 HE22 GLN A 44 20.456 6.974 25.935 1.00 0.00 H new ATOM 693 N VAL A 45 15.474 5.728 24.446 1.00 0.00 N ATOM 694 CA VAL A 45 14.470 6.751 24.101 1.00 0.00 C ATOM 695 C VAL A 45 15.011 8.155 24.405 1.00 0.00 C ATOM 696 O VAL A 45 15.481 8.419 25.514 1.00 0.00 O ATOM 697 CB VAL A 45 13.143 6.537 24.863 1.00 0.00 C ATOM 698 CG1 VAL A 45 12.023 7.364 24.216 1.00 0.00 C ATOM 699 CG2 VAL A 45 12.694 5.068 24.883 1.00 0.00 C ATOM 0 H VAL A 45 15.214 5.179 25.265 1.00 0.00 H new ATOM 0 HA VAL A 45 14.269 6.656 23.034 1.00 0.00 H new ATOM 0 HB VAL A 45 13.328 6.855 25.889 1.00 0.00 H new ATOM 0 HG11 VAL A 45 11.092 7.206 24.761 1.00 0.00 H new ATOM 0 HG12 VAL A 45 12.287 8.421 24.248 1.00 0.00 H new ATOM 0 HG13 VAL A 45 11.894 7.053 23.179 1.00 0.00 H new ATOM 0 HG21 VAL A 45 11.757 4.982 25.432 1.00 0.00 H new ATOM 0 HG22 VAL A 45 12.549 4.718 23.861 1.00 0.00 H new ATOM 0 HG23 VAL A 45 13.457 4.461 25.370 1.00 0.00 H new ATOM 709 N GLU A 46 14.950 9.062 23.431 1.00 0.00 N ATOM 710 CA GLU A 46 15.434 10.446 23.541 1.00 0.00 C ATOM 711 C GLU A 46 14.692 11.364 22.550 1.00 0.00 C ATOM 712 O GLU A 46 14.447 10.977 21.413 1.00 0.00 O ATOM 713 CB GLU A 46 16.952 10.431 23.272 1.00 0.00 C ATOM 714 CG GLU A 46 17.621 11.813 23.281 1.00 0.00 C ATOM 715 CD GLU A 46 19.151 11.687 23.237 1.00 0.00 C ATOM 716 OE1 GLU A 46 19.682 11.224 22.197 1.00 0.00 O ATOM 717 OE2 GLU A 46 19.800 12.050 24.247 1.00 0.00 O ATOM 0 H GLU A 46 14.552 8.853 22.516 1.00 0.00 H new ATOM 0 HA GLU A 46 15.240 10.843 24.537 1.00 0.00 H new ATOM 0 HB2 GLU A 46 17.434 9.805 24.023 1.00 0.00 H new ATOM 0 HB3 GLU A 46 17.131 9.963 22.304 1.00 0.00 H new ATOM 0 HG2 GLU A 46 17.276 12.393 22.425 1.00 0.00 H new ATOM 0 HG3 GLU A 46 17.324 12.359 24.176 1.00 0.00 H new ATOM 724 N ASN A 47 14.341 12.588 22.967 1.00 0.00 N ATOM 725 CA ASN A 47 13.663 13.619 22.156 1.00 0.00 C ATOM 726 C ASN A 47 12.517 13.124 21.224 1.00 0.00 C ATOM 727 O ASN A 47 12.342 13.625 20.111 1.00 0.00 O ATOM 728 CB ASN A 47 14.759 14.431 21.428 1.00 0.00 C ATOM 729 CG ASN A 47 14.260 15.760 20.875 1.00 0.00 C ATOM 730 OD1 ASN A 47 13.416 16.435 21.451 1.00 0.00 O ATOM 731 ND2 ASN A 47 14.780 16.199 19.749 1.00 0.00 N ATOM 0 H ASN A 47 14.528 12.904 23.919 1.00 0.00 H new ATOM 0 HA ASN A 47 13.099 14.259 22.834 1.00 0.00 H new ATOM 0 HB2 ASN A 47 15.581 14.619 22.119 1.00 0.00 H new ATOM 0 HB3 ASN A 47 15.161 13.833 20.610 1.00 0.00 H new ATOM 0 HD21 ASN A 47 14.480 17.094 19.363 1.00 0.00 H new ATOM 0 HD22 ASN A 47 15.484 15.644 19.262 1.00 0.00 H new ATOM 738 N GLY A 48 11.736 12.126 21.661 1.00 0.00 N ATOM 739 CA GLY A 48 10.607 11.561 20.900 1.00 0.00 C ATOM 740 C GLY A 48 10.961 10.471 19.874 1.00 0.00 C ATOM 741 O GLY A 48 10.126 10.148 19.026 1.00 0.00 O ATOM 0 H GLY A 48 11.871 11.680 22.568 1.00 0.00 H new ATOM 0 HA2 GLY A 48 9.890 11.146 21.608 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.104 12.375 20.377 1.00 0.00 H new ATOM 745 N ARG A 49 12.171 9.899 19.922 1.00 0.00 N ATOM 746 CA ARG A 49 12.662 8.836 19.018 1.00 0.00 C ATOM 747 C ARG A 49 13.552 7.818 19.741 1.00 0.00 C ATOM 748 O ARG A 49 13.997 8.051 20.864 1.00 0.00 O ATOM 749 CB ARG A 49 13.303 9.462 17.756 1.00 0.00 C ATOM 750 CG ARG A 49 14.313 10.607 17.954 1.00 0.00 C ATOM 751 CD ARG A 49 15.624 10.163 18.602 1.00 0.00 C ATOM 752 NE ARG A 49 16.576 11.281 18.698 1.00 0.00 N ATOM 753 CZ ARG A 49 17.733 11.248 19.335 1.00 0.00 C ATOM 754 NH1 ARG A 49 18.207 10.158 19.874 1.00 0.00 N ATOM 755 NH2 ARG A 49 18.453 12.329 19.457 1.00 0.00 N ATOM 0 H ARG A 49 12.867 10.171 20.617 1.00 0.00 H new ATOM 0 HA ARG A 49 11.812 8.247 18.675 1.00 0.00 H new ATOM 0 HB2 ARG A 49 13.804 8.666 17.205 1.00 0.00 H new ATOM 0 HB3 ARG A 49 12.498 9.832 17.121 1.00 0.00 H new ATOM 0 HG2 ARG A 49 14.531 11.059 16.986 1.00 0.00 H new ATOM 0 HG3 ARG A 49 13.856 11.380 18.572 1.00 0.00 H new ATOM 0 HD2 ARG A 49 15.424 9.766 19.597 1.00 0.00 H new ATOM 0 HD3 ARG A 49 16.066 9.355 18.019 1.00 0.00 H new ATOM 0 HE ARG A 49 16.322 12.153 18.235 1.00 0.00 H new ATOM 0 HH11 ARG A 49 17.679 9.287 19.812 1.00 0.00 H new ATOM 0 HH12 ARG A 49 19.105 10.177 20.357 1.00 0.00 H new ATOM 0 HH21 ARG A 49 18.124 13.209 19.059 1.00 0.00 H new ATOM 0 HH22 ARG A 49 19.345 12.295 19.950 1.00 0.00 H new ATOM 769 N VAL A 50 13.810 6.684 19.093 1.00 0.00 N ATOM 770 CA VAL A 50 14.670 5.602 19.604 1.00 0.00 C ATOM 771 C VAL A 50 15.531 5.104 18.456 1.00 0.00 C ATOM 772 O VAL A 50 15.037 4.946 17.340 1.00 0.00 O ATOM 773 CB VAL A 50 13.889 4.367 20.108 1.00 0.00 C ATOM 774 CG1 VAL A 50 14.763 3.529 21.054 1.00 0.00 C ATOM 775 CG2 VAL A 50 12.580 4.679 20.813 1.00 0.00 C ATOM 0 H VAL A 50 13.420 6.480 18.173 1.00 0.00 H new ATOM 0 HA VAL A 50 15.231 6.024 20.438 1.00 0.00 H new ATOM 0 HB VAL A 50 13.634 3.816 19.203 1.00 0.00 H new ATOM 0 HG11 VAL A 50 14.198 2.663 21.400 1.00 0.00 H new ATOM 0 HG12 VAL A 50 15.654 3.193 20.524 1.00 0.00 H new ATOM 0 HG13 VAL A 50 15.058 4.136 21.910 1.00 0.00 H new ATOM 0 HG21 VAL A 50 12.106 3.750 21.129 1.00 0.00 H new ATOM 0 HG22 VAL A 50 12.776 5.301 21.686 1.00 0.00 H new ATOM 0 HG23 VAL A 50 11.917 5.210 20.130 1.00 0.00 H new ATOM 785 N ILE A 51 16.799 4.816 18.725 1.00 0.00 N ATOM 786 CA ILE A 51 17.700 4.218 17.737 1.00 0.00 C ATOM 787 C ILE A 51 17.315 2.729 17.626 1.00 0.00 C ATOM 788 O ILE A 51 17.227 2.041 18.645 1.00 0.00 O ATOM 789 CB ILE A 51 19.173 4.418 18.159 1.00 0.00 C ATOM 790 CG1 ILE A 51 19.478 5.888 18.542 1.00 0.00 C ATOM 791 CG2 ILE A 51 20.085 3.967 17.008 1.00 0.00 C ATOM 792 CD1 ILE A 51 20.908 6.133 19.023 1.00 0.00 C ATOM 0 H ILE A 51 17.234 4.989 19.631 1.00 0.00 H new ATOM 0 HA ILE A 51 17.601 4.695 16.762 1.00 0.00 H new ATOM 0 HB ILE A 51 19.360 3.815 19.048 1.00 0.00 H new ATOM 0 HG12 ILE A 51 19.285 6.523 17.678 1.00 0.00 H new ATOM 0 HG13 ILE A 51 18.786 6.197 19.326 1.00 0.00 H new ATOM 0 HG21 ILE A 51 21.128 4.104 17.295 1.00 0.00 H new ATOM 0 HG22 ILE A 51 19.903 2.914 16.791 1.00 0.00 H new ATOM 0 HG23 ILE A 51 19.872 4.562 16.120 1.00 0.00 H new ATOM 0 HD11 ILE A 51 21.033 7.187 19.269 1.00 0.00 H new ATOM 0 HD12 ILE A 51 21.103 5.528 19.908 1.00 0.00 H new ATOM 0 HD13 ILE A 51 21.609 5.859 18.235 1.00 0.00 H new ATOM 804 N ALA A 52 17.049 2.228 16.418 1.00 0.00 N ATOM 805 CA ALA A 52 16.684 0.829 16.186 1.00 0.00 C ATOM 806 C ALA A 52 17.928 -0.082 16.131 1.00 0.00 C ATOM 807 O ALA A 52 19.004 0.344 15.701 1.00 0.00 O ATOM 808 CB ALA A 52 15.865 0.730 14.895 1.00 0.00 C ATOM 0 H ALA A 52 17.081 2.787 15.565 1.00 0.00 H new ATOM 0 HA ALA A 52 16.079 0.480 17.023 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.590 -0.310 14.717 1.00 0.00 H new ATOM 0 HB2 ALA A 52 14.962 1.333 14.990 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.459 1.097 14.058 1.00 0.00 H new ATOM 814 N CYS A 53 17.777 -1.335 16.558 1.00 0.00 N ATOM 815 CA CYS A 53 18.839 -2.342 16.579 1.00 0.00 C ATOM 816 C CYS A 53 19.223 -2.766 15.143 1.00 0.00 C ATOM 817 O CYS A 53 18.422 -3.366 14.416 1.00 0.00 O ATOM 818 CB CYS A 53 18.341 -3.498 17.463 1.00 0.00 C ATOM 819 SG CYS A 53 19.577 -4.812 17.723 1.00 0.00 S ATOM 0 H CYS A 53 16.887 -1.688 16.909 1.00 0.00 H new ATOM 0 HA CYS A 53 19.764 -1.952 17.005 1.00 0.00 H new ATOM 0 HB2 CYS A 53 18.040 -3.099 18.432 1.00 0.00 H new ATOM 0 HB3 CYS A 53 17.452 -3.934 17.008 1.00 0.00 H new ATOM 824 N PHE A 54 20.444 -2.435 14.710 1.00 0.00 N ATOM 825 CA PHE A 54 20.971 -2.767 13.380 1.00 0.00 C ATOM 826 C PHE A 54 20.999 -4.289 13.149 1.00 0.00 C ATOM 827 O PHE A 54 20.641 -4.767 12.071 1.00 0.00 O ATOM 828 CB PHE A 54 22.376 -2.164 13.219 1.00 0.00 C ATOM 829 CG PHE A 54 23.058 -2.478 11.903 1.00 0.00 C ATOM 830 CD1 PHE A 54 23.990 -3.531 11.838 1.00 0.00 C ATOM 831 CD2 PHE A 54 22.777 -1.720 10.750 1.00 0.00 C ATOM 832 CE1 PHE A 54 24.672 -3.798 10.639 1.00 0.00 C ATOM 833 CE2 PHE A 54 23.444 -2.002 9.542 1.00 0.00 C ATOM 834 CZ PHE A 54 24.397 -3.035 9.490 1.00 0.00 C ATOM 0 H PHE A 54 21.108 -1.918 15.286 1.00 0.00 H new ATOM 0 HA PHE A 54 20.308 -2.339 12.628 1.00 0.00 H new ATOM 0 HB2 PHE A 54 22.305 -1.082 13.326 1.00 0.00 H new ATOM 0 HB3 PHE A 54 23.005 -2.524 14.033 1.00 0.00 H new ATOM 0 HD1 PHE A 54 24.181 -4.135 12.712 1.00 0.00 H new ATOM 0 HD2 PHE A 54 22.050 -0.922 10.792 1.00 0.00 H new ATOM 0 HE1 PHE A 54 25.407 -4.589 10.600 1.00 0.00 H new ATOM 0 HE2 PHE A 54 23.224 -1.425 8.656 1.00 0.00 H new ATOM 0 HZ PHE A 54 24.918 -3.242 8.567 1.00 0.00 H new ATOM 844 N ASP A 55 21.370 -5.066 14.170 1.00 0.00 N ATOM 845 CA ASP A 55 21.373 -6.530 14.097 1.00 0.00 C ATOM 846 C ASP A 55 19.937 -7.097 13.997 1.00 0.00 C ATOM 847 O ASP A 55 19.695 -8.052 13.251 1.00 0.00 O ATOM 848 CB ASP A 55 22.137 -7.104 15.299 1.00 0.00 C ATOM 849 CG ASP A 55 23.629 -6.751 15.313 1.00 0.00 C ATOM 850 OD1 ASP A 55 24.256 -6.781 14.227 1.00 0.00 O ATOM 851 OD2 ASP A 55 24.161 -6.516 16.424 1.00 0.00 O ATOM 0 H ASP A 55 21.677 -4.698 15.071 1.00 0.00 H new ATOM 0 HA ASP A 55 21.886 -6.837 13.186 1.00 0.00 H new ATOM 0 HB2 ASP A 55 21.678 -6.737 16.217 1.00 0.00 H new ATOM 0 HB3 ASP A 55 22.030 -8.189 15.300 1.00 0.00 H new ATOM 856 N SER A 56 18.960 -6.478 14.672 1.00 0.00 N ATOM 857 CA SER A 56 17.536 -6.852 14.579 1.00 0.00 C ATOM 858 C SER A 56 16.972 -6.533 13.190 1.00 0.00 C ATOM 859 O SER A 56 16.245 -7.345 12.612 1.00 0.00 O ATOM 860 CB SER A 56 16.707 -6.117 15.635 1.00 0.00 C ATOM 861 OG SER A 56 15.351 -6.538 15.615 1.00 0.00 O ATOM 0 H SER A 56 19.133 -5.697 15.304 1.00 0.00 H new ATOM 0 HA SER A 56 17.473 -7.926 14.754 1.00 0.00 H new ATOM 0 HB2 SER A 56 17.131 -6.297 16.623 1.00 0.00 H new ATOM 0 HB3 SER A 56 16.759 -5.043 15.457 1.00 0.00 H new ATOM 0 HG SER A 56 14.816 -5.946 16.184 1.00 0.00 H new ATOM 867 N LEU A 57 17.347 -5.386 12.606 1.00 0.00 N ATOM 868 CA LEU A 57 16.960 -4.986 11.247 1.00 0.00 C ATOM 869 C LEU A 57 17.457 -5.995 10.193 1.00 0.00 C ATOM 870 O LEU A 57 16.766 -6.240 9.202 1.00 0.00 O ATOM 871 CB LEU A 57 17.474 -3.561 10.968 1.00 0.00 C ATOM 872 CG LEU A 57 16.656 -2.468 11.679 1.00 0.00 C ATOM 873 CD1 LEU A 57 17.446 -1.161 11.708 1.00 0.00 C ATOM 874 CD2 LEU A 57 15.331 -2.228 10.951 1.00 0.00 C ATOM 0 H LEU A 57 17.938 -4.699 13.074 1.00 0.00 H new ATOM 0 HA LEU A 57 15.872 -4.984 11.175 1.00 0.00 H new ATOM 0 HB2 LEU A 57 18.515 -3.489 11.284 1.00 0.00 H new ATOM 0 HB3 LEU A 57 17.454 -3.379 9.894 1.00 0.00 H new ATOM 0 HG LEU A 57 16.453 -2.803 12.696 1.00 0.00 H new ATOM 0 HD11 LEU A 57 16.860 -0.393 12.213 1.00 0.00 H new ATOM 0 HD12 LEU A 57 18.383 -1.314 12.244 1.00 0.00 H new ATOM 0 HD13 LEU A 57 17.660 -0.842 10.688 1.00 0.00 H new ATOM 0 HD21 LEU A 57 14.767 -1.452 11.469 1.00 0.00 H new ATOM 0 HD22 LEU A 57 15.530 -1.910 9.928 1.00 0.00 H new ATOM 0 HD23 LEU A 57 14.751 -3.151 10.938 1.00 0.00 H new ATOM 886 N LYS A 58 18.613 -6.629 10.435 1.00 0.00 N ATOM 887 CA LYS A 58 19.185 -7.708 9.604 1.00 0.00 C ATOM 888 C LYS A 58 18.552 -9.086 9.892 1.00 0.00 C ATOM 889 O LYS A 58 18.852 -10.058 9.196 1.00 0.00 O ATOM 890 CB LYS A 58 20.714 -7.730 9.786 1.00 0.00 C ATOM 891 CG LYS A 58 21.363 -6.513 9.105 1.00 0.00 C ATOM 892 CD LYS A 58 22.868 -6.393 9.380 1.00 0.00 C ATOM 893 CE LYS A 58 23.707 -7.598 8.938 1.00 0.00 C ATOM 894 NZ LYS A 58 23.633 -7.816 7.476 1.00 0.00 N ATOM 0 H LYS A 58 19.197 -6.401 11.239 1.00 0.00 H new ATOM 0 HA LYS A 58 18.950 -7.496 8.561 1.00 0.00 H new ATOM 0 HB2 LYS A 58 20.958 -7.731 10.848 1.00 0.00 H new ATOM 0 HB3 LYS A 58 21.122 -8.649 9.364 1.00 0.00 H new ATOM 0 HG2 LYS A 58 21.202 -6.579 8.029 1.00 0.00 H new ATOM 0 HG3 LYS A 58 20.865 -5.606 9.447 1.00 0.00 H new ATOM 0 HD2 LYS A 58 23.244 -5.503 8.875 1.00 0.00 H new ATOM 0 HD3 LYS A 58 23.015 -6.240 10.449 1.00 0.00 H new ATOM 0 HE2 LYS A 58 24.746 -7.444 9.230 1.00 0.00 H new ATOM 0 HE3 LYS A 58 23.360 -8.492 9.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 24.214 -8.639 7.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 22.645 -7.989 7.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 23.988 -6.973 6.981 1.00 0.00 H new ATOM 908 N GLY A 59 17.661 -9.173 10.883 1.00 0.00 N ATOM 909 CA GLY A 59 16.895 -10.367 11.265 1.00 0.00 C ATOM 910 C GLY A 59 17.533 -11.289 12.307 1.00 0.00 C ATOM 911 O GLY A 59 16.987 -12.367 12.555 1.00 0.00 O ATOM 0 H GLY A 59 17.441 -8.371 11.473 1.00 0.00 H new ATOM 0 HA2 GLY A 59 15.926 -10.043 11.645 1.00 0.00 H new ATOM 0 HA3 GLY A 59 16.704 -10.951 10.365 1.00 0.00 H new ATOM 915 N ARG A 60 18.657 -10.899 12.929 1.00 0.00 N ATOM 916 CA ARG A 60 19.342 -11.702 13.959 1.00 0.00 C ATOM 917 C ARG A 60 20.136 -10.814 14.920 1.00 0.00 C ATOM 918 O ARG A 60 21.299 -10.505 14.666 1.00 0.00 O ATOM 919 CB ARG A 60 20.208 -12.794 13.291 1.00 0.00 C ATOM 920 CG ARG A 60 20.564 -13.957 14.234 1.00 0.00 C ATOM 921 CD ARG A 60 21.762 -13.706 15.158 1.00 0.00 C ATOM 922 NE ARG A 60 22.070 -14.910 15.951 1.00 0.00 N ATOM 923 CZ ARG A 60 22.920 -14.991 16.962 1.00 0.00 C ATOM 924 NH1 ARG A 60 23.626 -13.977 17.387 1.00 0.00 N ATOM 925 NH2 ARG A 60 23.088 -16.129 17.582 1.00 0.00 N ATOM 0 H ARG A 60 19.120 -10.012 12.731 1.00 0.00 H new ATOM 0 HA ARG A 60 18.595 -12.210 14.570 1.00 0.00 H new ATOM 0 HB2 ARG A 60 19.677 -13.189 12.425 1.00 0.00 H new ATOM 0 HB3 ARG A 60 21.128 -12.341 12.922 1.00 0.00 H new ATOM 0 HG2 ARG A 60 19.693 -14.185 14.849 1.00 0.00 H new ATOM 0 HG3 ARG A 60 20.769 -14.842 13.632 1.00 0.00 H new ATOM 0 HD2 ARG A 60 22.632 -13.423 14.565 1.00 0.00 H new ATOM 0 HD3 ARG A 60 21.545 -12.871 15.824 1.00 0.00 H new ATOM 0 HE ARG A 60 21.579 -15.766 15.695 1.00 0.00 H new ATOM 0 HH11 ARG A 60 23.536 -13.067 16.934 1.00 0.00 H new ATOM 0 HH12 ARG A 60 24.267 -14.095 18.171 1.00 0.00 H new ATOM 0 HH21 ARG A 60 22.564 -16.953 17.286 1.00 0.00 H new ATOM 0 HH22 ARG A 60 23.743 -16.193 18.361 1.00 0.00 H new ATOM 939 N CYS A 61 19.485 -10.419 16.016 1.00 0.00 N ATOM 940 CA CYS A 61 20.086 -9.615 17.092 1.00 0.00 C ATOM 941 C CYS A 61 21.331 -10.332 17.673 1.00 0.00 C ATOM 942 O CYS A 61 21.275 -11.534 17.965 1.00 0.00 O ATOM 943 CB CYS A 61 19.017 -9.328 18.161 1.00 0.00 C ATOM 944 SG CYS A 61 19.632 -8.133 19.399 1.00 0.00 S ATOM 0 H CYS A 61 18.507 -10.651 16.188 1.00 0.00 H new ATOM 0 HA CYS A 61 20.434 -8.660 16.699 1.00 0.00 H new ATOM 0 HB2 CYS A 61 18.119 -8.934 17.685 1.00 0.00 H new ATOM 0 HB3 CYS A 61 18.734 -10.257 18.656 1.00 0.00 H new ATOM 949 N SER A 62 22.449 -9.609 17.824 1.00 0.00 N ATOM 950 CA SER A 62 23.744 -10.160 18.276 1.00 0.00 C ATOM 951 C SER A 62 24.495 -9.274 19.289 1.00 0.00 C ATOM 952 O SER A 62 25.707 -9.431 19.468 1.00 0.00 O ATOM 953 CB SER A 62 24.648 -10.410 17.053 1.00 0.00 C ATOM 954 OG SER A 62 24.069 -11.331 16.142 1.00 0.00 O ATOM 0 H SER A 62 22.485 -8.608 17.634 1.00 0.00 H new ATOM 0 HA SER A 62 23.510 -11.088 18.798 1.00 0.00 H new ATOM 0 HB2 SER A 62 24.836 -9.465 16.543 1.00 0.00 H new ATOM 0 HB3 SER A 62 25.613 -10.790 17.388 1.00 0.00 H new ATOM 0 HG SER A 62 23.251 -10.947 15.764 1.00 0.00 H new ATOM 960 N ARG A 63 23.810 -8.348 19.976 1.00 0.00 N ATOM 961 CA ARG A 63 24.421 -7.446 20.970 1.00 0.00 C ATOM 962 C ARG A 63 24.458 -8.087 22.365 1.00 0.00 C ATOM 963 O ARG A 63 23.468 -8.657 22.821 1.00 0.00 O ATOM 964 CB ARG A 63 23.674 -6.096 20.943 1.00 0.00 C ATOM 965 CG ARG A 63 24.474 -4.877 21.444 1.00 0.00 C ATOM 966 CD ARG A 63 25.857 -4.678 20.795 1.00 0.00 C ATOM 967 NE ARG A 63 25.859 -4.957 19.346 1.00 0.00 N ATOM 968 CZ ARG A 63 26.926 -5.174 18.594 1.00 0.00 C ATOM 969 NH1 ARG A 63 26.787 -5.603 17.370 1.00 0.00 N ATOM 970 NH2 ARG A 63 28.148 -5.005 19.031 1.00 0.00 N ATOM 0 H ARG A 63 22.808 -8.201 19.858 1.00 0.00 H new ATOM 0 HA ARG A 63 25.464 -7.262 20.711 1.00 0.00 H new ATOM 0 HB2 ARG A 63 23.352 -5.900 19.920 1.00 0.00 H new ATOM 0 HB3 ARG A 63 22.772 -6.189 21.548 1.00 0.00 H new ATOM 0 HG2 ARG A 63 23.880 -3.979 21.273 1.00 0.00 H new ATOM 0 HG3 ARG A 63 24.608 -4.970 22.522 1.00 0.00 H new ATOM 0 HD2 ARG A 63 26.187 -3.653 20.963 1.00 0.00 H new ATOM 0 HD3 ARG A 63 26.580 -5.330 21.286 1.00 0.00 H new ATOM 0 HE ARG A 63 24.952 -4.985 18.880 1.00 0.00 H new ATOM 0 HH11 ARG A 63 25.855 -5.772 16.991 1.00 0.00 H new ATOM 0 HH12 ARG A 63 27.610 -5.770 16.791 1.00 0.00 H new ATOM 0 HH21 ARG A 63 28.309 -4.693 19.989 1.00 0.00 H new ATOM 0 HH22 ARG A 63 28.940 -5.185 18.414 1.00 0.00 H new ATOM 984 N GLU A 64 25.606 -8.003 23.043 1.00 0.00 N ATOM 985 CA GLU A 64 25.823 -8.593 24.384 1.00 0.00 C ATOM 986 C GLU A 64 24.913 -7.994 25.475 1.00 0.00 C ATOM 987 O GLU A 64 24.546 -8.677 26.433 1.00 0.00 O ATOM 988 CB GLU A 64 27.297 -8.427 24.798 1.00 0.00 C ATOM 989 CG GLU A 64 28.303 -9.124 23.869 1.00 0.00 C ATOM 990 CD GLU A 64 28.149 -10.651 23.882 1.00 0.00 C ATOM 991 OE1 GLU A 64 28.748 -11.297 24.776 1.00 0.00 O ATOM 992 OE2 GLU A 64 27.424 -11.180 23.005 1.00 0.00 O ATOM 0 H GLU A 64 26.427 -7.519 22.679 1.00 0.00 H new ATOM 0 HA GLU A 64 25.563 -9.648 24.300 1.00 0.00 H new ATOM 0 HB2 GLU A 64 27.533 -7.364 24.835 1.00 0.00 H new ATOM 0 HB3 GLU A 64 27.424 -8.817 25.808 1.00 0.00 H new ATOM 0 HG2 GLU A 64 28.169 -8.757 22.852 1.00 0.00 H new ATOM 0 HG3 GLU A 64 29.316 -8.861 24.172 1.00 0.00 H new ATOM 999 N ASN A 65 24.527 -6.727 25.308 1.00 0.00 N ATOM 1000 CA ASN A 65 23.618 -5.975 26.174 1.00 0.00 C ATOM 1001 C ASN A 65 22.830 -4.991 25.292 1.00 0.00 C ATOM 1002 O ASN A 65 23.243 -3.848 25.089 1.00 0.00 O ATOM 1003 CB ASN A 65 24.412 -5.286 27.299 1.00 0.00 C ATOM 1004 CG ASN A 65 23.483 -4.579 28.275 1.00 0.00 C ATOM 1005 OD1 ASN A 65 22.680 -5.198 28.958 1.00 0.00 O ATOM 1006 ND2 ASN A 65 23.543 -3.272 28.368 1.00 0.00 N ATOM 0 H ASN A 65 24.859 -6.168 24.522 1.00 0.00 H new ATOM 0 HA ASN A 65 22.903 -6.631 26.671 1.00 0.00 H new ATOM 0 HB2 ASN A 65 25.009 -6.026 27.832 1.00 0.00 H new ATOM 0 HB3 ASN A 65 25.108 -4.566 26.868 1.00 0.00 H new ATOM 0 HD21 ASN A 65 22.922 -2.777 29.008 1.00 0.00 H new ATOM 0 HD22 ASN A 65 24.211 -2.750 27.801 1.00 0.00 H new ATOM 1013 N CYS A 66 21.723 -5.462 24.714 1.00 0.00 N ATOM 1014 CA CYS A 66 20.920 -4.702 23.759 1.00 0.00 C ATOM 1015 C CYS A 66 19.995 -3.695 24.481 1.00 0.00 C ATOM 1016 O CYS A 66 19.336 -4.020 25.478 1.00 0.00 O ATOM 1017 CB CYS A 66 20.161 -5.736 22.905 1.00 0.00 C ATOM 1018 SG CYS A 66 19.438 -4.990 21.410 1.00 0.00 S ATOM 0 H CYS A 66 21.356 -6.395 24.900 1.00 0.00 H new ATOM 0 HA CYS A 66 21.540 -4.083 23.110 1.00 0.00 H new ATOM 0 HB2 CYS A 66 20.841 -6.537 22.617 1.00 0.00 H new ATOM 0 HB3 CYS A 66 19.370 -6.189 23.503 1.00 0.00 H new ATOM 1023 N LYS A 67 19.994 -2.450 23.984 1.00 0.00 N ATOM 1024 CA LYS A 67 19.263 -1.277 24.520 1.00 0.00 C ATOM 1025 C LYS A 67 18.519 -0.459 23.452 1.00 0.00 C ATOM 1026 O LYS A 67 17.954 0.596 23.744 1.00 0.00 O ATOM 1027 CB LYS A 67 20.250 -0.399 25.319 1.00 0.00 C ATOM 1028 CG LYS A 67 21.349 0.251 24.455 1.00 0.00 C ATOM 1029 CD LYS A 67 22.329 1.046 25.330 1.00 0.00 C ATOM 1030 CE LYS A 67 23.460 1.684 24.516 1.00 0.00 C ATOM 1031 NZ LYS A 67 22.978 2.780 23.654 1.00 0.00 N ATOM 0 H LYS A 67 20.532 -2.214 23.150 1.00 0.00 H new ATOM 0 HA LYS A 67 18.476 -1.653 25.174 1.00 0.00 H new ATOM 0 HB2 LYS A 67 19.692 0.386 25.830 1.00 0.00 H new ATOM 0 HB3 LYS A 67 20.721 -1.009 26.090 1.00 0.00 H new ATOM 0 HG2 LYS A 67 21.888 -0.519 23.904 1.00 0.00 H new ATOM 0 HG3 LYS A 67 20.895 0.912 23.717 1.00 0.00 H new ATOM 0 HD2 LYS A 67 21.785 1.826 25.863 1.00 0.00 H new ATOM 0 HD3 LYS A 67 22.757 0.385 26.083 1.00 0.00 H new ATOM 0 HE2 LYS A 67 24.222 2.067 25.195 1.00 0.00 H new ATOM 0 HE3 LYS A 67 23.936 0.922 23.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 23.789 3.332 23.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 22.459 2.383 22.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 22.346 3.399 24.201 1.00 0.00 H new ATOM 1045 N TYR A 68 18.521 -0.937 22.213 1.00 0.00 N ATOM 1046 CA TYR A 68 17.897 -0.305 21.051 1.00 0.00 C ATOM 1047 C TYR A 68 16.491 -0.884 20.778 1.00 0.00 C ATOM 1048 O TYR A 68 16.091 -1.890 21.373 1.00 0.00 O ATOM 1049 CB TYR A 68 18.873 -0.498 19.879 1.00 0.00 C ATOM 1050 CG TYR A 68 20.240 0.148 20.082 1.00 0.00 C ATOM 1051 CD1 TYR A 68 20.334 1.516 20.409 1.00 0.00 C ATOM 1052 CD2 TYR A 68 21.417 -0.616 19.945 1.00 0.00 C ATOM 1053 CE1 TYR A 68 21.593 2.123 20.584 1.00 0.00 C ATOM 1054 CE2 TYR A 68 22.680 -0.014 20.121 1.00 0.00 C ATOM 1055 CZ TYR A 68 22.771 1.357 20.437 1.00 0.00 C ATOM 1056 OH TYR A 68 23.990 1.937 20.600 1.00 0.00 O ATOM 0 H TYR A 68 18.979 -1.818 21.978 1.00 0.00 H new ATOM 0 HA TYR A 68 17.724 0.759 21.216 1.00 0.00 H new ATOM 0 HB2 TYR A 68 19.011 -1.566 19.710 1.00 0.00 H new ATOM 0 HB3 TYR A 68 18.422 -0.088 18.975 1.00 0.00 H new ATOM 0 HD1 TYR A 68 19.435 2.103 20.526 1.00 0.00 H new ATOM 0 HD2 TYR A 68 21.351 -1.667 19.704 1.00 0.00 H new ATOM 0 HE1 TYR A 68 21.658 3.173 20.830 1.00 0.00 H new ATOM 0 HE2 TYR A 68 23.578 -0.604 20.014 1.00 0.00 H new ATOM 0 HH TYR A 68 23.886 2.791 21.069 1.00 0.00 H new ATOM 1066 N LEU A 69 15.717 -0.261 19.882 1.00 0.00 N ATOM 1067 CA LEU A 69 14.350 -0.690 19.559 1.00 0.00 C ATOM 1068 C LEU A 69 14.344 -1.801 18.493 1.00 0.00 C ATOM 1069 O LEU A 69 15.032 -1.695 17.479 1.00 0.00 O ATOM 1070 CB LEU A 69 13.587 0.543 19.027 1.00 0.00 C ATOM 1071 CG LEU A 69 12.157 0.281 18.514 1.00 0.00 C ATOM 1072 CD1 LEU A 69 11.199 -0.103 19.643 1.00 0.00 C ATOM 1073 CD2 LEU A 69 11.623 1.538 17.834 1.00 0.00 C ATOM 0 H LEU A 69 16.022 0.559 19.358 1.00 0.00 H new ATOM 0 HA LEU A 69 13.876 -1.094 20.454 1.00 0.00 H new ATOM 0 HB2 LEU A 69 13.536 1.286 19.823 1.00 0.00 H new ATOM 0 HB3 LEU A 69 14.168 0.984 18.217 1.00 0.00 H new ATOM 0 HG LEU A 69 12.212 -0.552 17.813 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.204 -0.278 19.233 1.00 0.00 H new ATOM 0 HD12 LEU A 69 11.555 -1.011 20.130 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.154 0.706 20.373 1.00 0.00 H new ATOM 0 HD21 LEU A 69 10.612 1.354 17.471 1.00 0.00 H new ATOM 0 HD22 LEU A 69 11.607 2.360 18.550 1.00 0.00 H new ATOM 0 HD23 LEU A 69 12.268 1.800 16.995 1.00 0.00 H new ATOM 1085 N HIS A 70 13.540 -2.848 18.707 1.00 0.00 N ATOM 1086 CA HIS A 70 13.323 -3.932 17.738 1.00 0.00 C ATOM 1087 C HIS A 70 11.995 -3.648 16.998 1.00 0.00 C ATOM 1088 O HIS A 70 10.923 -3.834 17.588 1.00 0.00 O ATOM 1089 CB HIS A 70 13.245 -5.281 18.477 1.00 0.00 C ATOM 1090 CG HIS A 70 14.562 -5.843 18.961 1.00 0.00 C ATOM 1091 ND1 HIS A 70 14.776 -7.143 19.371 1.00 0.00 N ATOM 1092 CD2 HIS A 70 15.780 -5.216 18.982 1.00 0.00 C ATOM 1093 CE1 HIS A 70 16.091 -7.298 19.606 1.00 0.00 C ATOM 1094 NE2 HIS A 70 16.747 -6.146 19.381 1.00 0.00 N ATOM 0 H HIS A 70 13.013 -2.970 19.572 1.00 0.00 H new ATOM 0 HA HIS A 70 14.146 -3.981 17.025 1.00 0.00 H new ATOM 0 HB2 HIS A 70 12.583 -5.166 19.335 1.00 0.00 H new ATOM 0 HB3 HIS A 70 12.782 -6.011 17.813 1.00 0.00 H new ATOM 0 HD1 HIS A 70 14.060 -7.862 19.477 1.00 0.00 H new ATOM 0 HD2 HIS A 70 15.963 -4.181 18.733 1.00 0.00 H new ATOM 0 HE1 HIS A 70 16.555 -8.218 19.930 1.00 0.00 H new ATOM 1102 N PRO A 71 12.020 -3.186 15.732 1.00 0.00 N ATOM 1103 CA PRO A 71 10.805 -2.825 15.002 1.00 0.00 C ATOM 1104 C PRO A 71 10.079 -4.013 14.327 1.00 0.00 C ATOM 1105 O PRO A 71 10.734 -4.895 13.758 1.00 0.00 O ATOM 1106 CB PRO A 71 11.284 -1.834 13.939 1.00 0.00 C ATOM 1107 CG PRO A 71 12.705 -2.297 13.625 1.00 0.00 C ATOM 1108 CD PRO A 71 13.205 -2.868 14.947 1.00 0.00 C ATOM 0 HA PRO A 71 10.066 -2.423 15.695 1.00 0.00 H new ATOM 0 HB2 PRO A 71 10.650 -1.860 13.053 1.00 0.00 H new ATOM 0 HB3 PRO A 71 11.270 -0.810 14.311 1.00 0.00 H new ATOM 0 HG2 PRO A 71 12.715 -3.049 12.836 1.00 0.00 H new ATOM 0 HG3 PRO A 71 13.329 -1.470 13.286 1.00 0.00 H new ATOM 0 HD2 PRO A 71 13.811 -3.758 14.781 1.00 0.00 H new ATOM 0 HD3 PRO A 71 13.834 -2.147 15.468 1.00 0.00 H new ATOM 1116 N PRO A 72 8.729 -4.026 14.321 1.00 0.00 N ATOM 1117 CA PRO A 72 7.912 -5.014 13.606 1.00 0.00 C ATOM 1118 C PRO A 72 8.017 -4.803 12.075 1.00 0.00 C ATOM 1119 O PRO A 72 8.422 -3.722 11.637 1.00 0.00 O ATOM 1120 CB PRO A 72 6.480 -4.787 14.115 1.00 0.00 C ATOM 1121 CG PRO A 72 6.468 -3.296 14.432 1.00 0.00 C ATOM 1122 CD PRO A 72 7.869 -3.061 14.982 1.00 0.00 C ATOM 0 HA PRO A 72 8.241 -6.037 13.788 1.00 0.00 H new ATOM 0 HB2 PRO A 72 5.737 -5.046 13.361 1.00 0.00 H new ATOM 0 HB3 PRO A 72 6.264 -5.390 14.997 1.00 0.00 H new ATOM 0 HG2 PRO A 72 6.275 -2.694 13.544 1.00 0.00 H new ATOM 0 HG3 PRO A 72 5.699 -3.043 15.161 1.00 0.00 H new ATOM 0 HD2 PRO A 72 8.200 -2.042 14.781 1.00 0.00 H new ATOM 0 HD3 PRO A 72 7.891 -3.196 16.063 1.00 0.00 H new ATOM 1130 N PRO A 73 7.643 -5.792 11.235 1.00 0.00 N ATOM 1131 CA PRO A 73 7.752 -5.729 9.770 1.00 0.00 C ATOM 1132 C PRO A 73 7.334 -4.415 9.086 1.00 0.00 C ATOM 1133 O PRO A 73 8.073 -3.918 8.234 1.00 0.00 O ATOM 1134 CB PRO A 73 6.945 -6.924 9.256 1.00 0.00 C ATOM 1135 CG PRO A 73 7.123 -7.954 10.368 1.00 0.00 C ATOM 1136 CD PRO A 73 7.138 -7.101 11.635 1.00 0.00 C ATOM 0 HA PRO A 73 8.809 -5.766 9.508 1.00 0.00 H new ATOM 0 HB2 PRO A 73 5.896 -6.669 9.105 1.00 0.00 H new ATOM 0 HB3 PRO A 73 7.325 -7.289 8.302 1.00 0.00 H new ATOM 0 HG2 PRO A 73 6.309 -8.678 10.380 1.00 0.00 H new ATOM 0 HG3 PRO A 73 8.049 -8.517 10.251 1.00 0.00 H new ATOM 0 HD2 PRO A 73 6.138 -7.019 12.062 1.00 0.00 H new ATOM 0 HD3 PRO A 73 7.775 -7.548 12.398 1.00 0.00 H new ATOM 1144 N HIS A 74 6.194 -3.809 9.449 1.00 0.00 N ATOM 1145 CA HIS A 74 5.764 -2.535 8.838 1.00 0.00 C ATOM 1146 C HIS A 74 6.703 -1.364 9.189 1.00 0.00 C ATOM 1147 O HIS A 74 7.037 -0.555 8.320 1.00 0.00 O ATOM 1148 CB HIS A 74 4.290 -2.244 9.168 1.00 0.00 C ATOM 1149 CG HIS A 74 4.054 -1.680 10.544 1.00 0.00 C ATOM 1150 ND1 HIS A 74 4.016 -2.384 11.735 1.00 0.00 N ATOM 1151 CD2 HIS A 74 3.853 -0.360 10.832 1.00 0.00 C ATOM 1152 CE1 HIS A 74 3.798 -1.501 12.728 1.00 0.00 C ATOM 1153 NE2 HIS A 74 3.698 -0.271 12.197 1.00 0.00 N ATOM 0 H HIS A 74 5.556 -4.174 10.156 1.00 0.00 H new ATOM 0 HA HIS A 74 5.837 -2.644 7.756 1.00 0.00 H new ATOM 0 HB2 HIS A 74 3.898 -1.543 8.431 1.00 0.00 H new ATOM 0 HB3 HIS A 74 3.720 -3.167 9.066 1.00 0.00 H new ATOM 0 HD2 HIS A 74 3.822 0.456 10.125 1.00 0.00 H new ATOM 0 HE1 HIS A 74 3.717 -1.742 13.778 1.00 0.00 H new ATOM 0 HE2 HIS A 74 3.534 0.589 12.720 1.00 0.00 H new ATOM 1162 N LEU A 75 7.207 -1.309 10.429 1.00 0.00 N ATOM 1163 CA LEU A 75 8.192 -0.307 10.859 1.00 0.00 C ATOM 1164 C LEU A 75 9.569 -0.571 10.229 1.00 0.00 C ATOM 1165 O LEU A 75 10.291 0.388 9.970 1.00 0.00 O ATOM 1166 CB LEU A 75 8.246 -0.213 12.396 1.00 0.00 C ATOM 1167 CG LEU A 75 7.220 0.787 12.970 1.00 0.00 C ATOM 1168 CD1 LEU A 75 6.985 0.550 14.462 1.00 0.00 C ATOM 1169 CD2 LEU A 75 7.696 2.236 12.822 1.00 0.00 C ATOM 0 H LEU A 75 6.941 -1.962 11.166 1.00 0.00 H new ATOM 0 HA LEU A 75 7.871 0.669 10.496 1.00 0.00 H new ATOM 0 HB2 LEU A 75 8.063 -1.199 12.822 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.248 0.086 12.702 1.00 0.00 H new ATOM 0 HG LEU A 75 6.303 0.628 12.403 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.257 1.271 14.835 1.00 0.00 H new ATOM 0 HD12 LEU A 75 6.606 -0.460 14.615 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.924 0.670 15.002 1.00 0.00 H new ATOM 0 HD21 LEU A 75 6.947 2.909 13.238 1.00 0.00 H new ATOM 0 HD22 LEU A 75 8.637 2.366 13.356 1.00 0.00 H new ATOM 0 HD23 LEU A 75 7.843 2.465 11.766 1.00 0.00 H new ATOM 1181 N LYS A 76 9.924 -1.824 9.892 1.00 0.00 N ATOM 1182 CA LYS A 76 11.159 -2.125 9.135 1.00 0.00 C ATOM 1183 C LYS A 76 11.108 -1.460 7.753 1.00 0.00 C ATOM 1184 O LYS A 76 12.103 -0.889 7.312 1.00 0.00 O ATOM 1185 CB LYS A 76 11.415 -3.639 9.008 1.00 0.00 C ATOM 1186 CG LYS A 76 11.729 -4.276 10.370 1.00 0.00 C ATOM 1187 CD LYS A 76 12.064 -5.772 10.309 1.00 0.00 C ATOM 1188 CE LYS A 76 13.376 -6.034 9.560 1.00 0.00 C ATOM 1189 NZ LYS A 76 13.815 -7.437 9.713 1.00 0.00 N ATOM 0 H LYS A 76 9.373 -2.648 10.131 1.00 0.00 H new ATOM 0 HA LYS A 76 11.996 -1.712 9.697 1.00 0.00 H new ATOM 0 HB2 LYS A 76 10.539 -4.121 8.573 1.00 0.00 H new ATOM 0 HB3 LYS A 76 12.246 -3.812 8.325 1.00 0.00 H new ATOM 0 HG2 LYS A 76 12.569 -3.746 10.820 1.00 0.00 H new ATOM 0 HG3 LYS A 76 10.873 -4.135 11.029 1.00 0.00 H new ATOM 0 HD2 LYS A 76 12.138 -6.169 11.321 1.00 0.00 H new ATOM 0 HD3 LYS A 76 11.252 -6.306 9.816 1.00 0.00 H new ATOM 0 HE2 LYS A 76 13.244 -5.806 8.502 1.00 0.00 H new ATOM 0 HE3 LYS A 76 14.151 -5.366 9.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 14.843 -7.497 9.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 13.579 -7.772 10.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 13.332 -8.031 9.009 1.00 0.00 H new ATOM 1203 N THR A 77 9.945 -1.455 7.094 1.00 0.00 N ATOM 1204 CA THR A 77 9.748 -0.746 5.816 1.00 0.00 C ATOM 1205 C THR A 77 9.892 0.770 6.009 1.00 0.00 C ATOM 1206 O THR A 77 10.587 1.421 5.230 1.00 0.00 O ATOM 1207 CB THR A 77 8.383 -1.076 5.189 1.00 0.00 C ATOM 1208 OG1 THR A 77 8.265 -2.473 5.020 1.00 0.00 O ATOM 1209 CG2 THR A 77 8.218 -0.440 3.808 1.00 0.00 C ATOM 0 H THR A 77 9.112 -1.940 7.427 1.00 0.00 H new ATOM 0 HA THR A 77 10.523 -1.089 5.130 1.00 0.00 H new ATOM 0 HB THR A 77 7.621 -0.683 5.862 1.00 0.00 H new ATOM 0 HG1 THR A 77 7.394 -2.682 4.622 1.00 0.00 H new ATOM 0 HG21 THR A 77 7.240 -0.699 3.403 1.00 0.00 H new ATOM 0 HG22 THR A 77 8.300 0.644 3.894 1.00 0.00 H new ATOM 0 HG23 THR A 77 8.997 -0.810 3.141 1.00 0.00 H new ATOM 1217 N GLN A 78 9.305 1.340 7.072 1.00 0.00 N ATOM 1218 CA GLN A 78 9.453 2.769 7.400 1.00 0.00 C ATOM 1219 C GLN A 78 10.932 3.125 7.653 1.00 0.00 C ATOM 1220 O GLN A 78 11.402 4.174 7.203 1.00 0.00 O ATOM 1221 CB GLN A 78 8.580 3.140 8.614 1.00 0.00 C ATOM 1222 CG GLN A 78 7.073 3.097 8.303 1.00 0.00 C ATOM 1223 CD GLN A 78 6.212 3.197 9.564 1.00 0.00 C ATOM 1224 OE1 GLN A 78 5.623 2.226 10.015 1.00 0.00 O ATOM 1225 NE2 GLN A 78 6.102 4.353 10.185 1.00 0.00 N ATOM 0 H GLN A 78 8.716 0.827 7.728 1.00 0.00 H new ATOM 0 HA GLN A 78 9.111 3.353 6.545 1.00 0.00 H new ATOM 0 HB2 GLN A 78 8.796 2.455 9.434 1.00 0.00 H new ATOM 0 HB3 GLN A 78 8.847 4.140 8.955 1.00 0.00 H new ATOM 0 HG2 GLN A 78 6.821 3.916 7.629 1.00 0.00 H new ATOM 0 HG3 GLN A 78 6.839 2.170 7.780 1.00 0.00 H new ATOM 0 HE21 GLN A 78 6.586 5.174 9.823 1.00 0.00 H new ATOM 0 HE22 GLN A 78 5.532 4.427 11.028 1.00 0.00 H new ATOM 1234 N LEU A 79 11.681 2.241 8.324 1.00 0.00 N ATOM 1235 CA LEU A 79 13.115 2.392 8.573 1.00 0.00 C ATOM 1236 C LEU A 79 13.889 2.386 7.248 1.00 0.00 C ATOM 1237 O LEU A 79 14.694 3.280 7.021 1.00 0.00 O ATOM 1238 CB LEU A 79 13.589 1.287 9.543 1.00 0.00 C ATOM 1239 CG LEU A 79 14.998 1.433 10.155 1.00 0.00 C ATOM 1240 CD1 LEU A 79 16.147 1.161 9.184 1.00 0.00 C ATOM 1241 CD2 LEU A 79 15.217 2.797 10.798 1.00 0.00 C ATOM 0 H LEU A 79 11.295 1.382 8.717 1.00 0.00 H new ATOM 0 HA LEU A 79 13.312 3.353 9.047 1.00 0.00 H new ATOM 0 HB2 LEU A 79 12.871 1.227 10.361 1.00 0.00 H new ATOM 0 HB3 LEU A 79 13.549 0.335 9.014 1.00 0.00 H new ATOM 0 HG LEU A 79 15.020 0.654 10.918 1.00 0.00 H new ATOM 0 HD11 LEU A 79 17.098 1.287 9.701 1.00 0.00 H new ATOM 0 HD12 LEU A 79 16.071 0.141 8.807 1.00 0.00 H new ATOM 0 HD13 LEU A 79 16.092 1.861 8.350 1.00 0.00 H new ATOM 0 HD21 LEU A 79 16.224 2.846 11.213 1.00 0.00 H new ATOM 0 HD22 LEU A 79 15.096 3.577 10.047 1.00 0.00 H new ATOM 0 HD23 LEU A 79 14.488 2.945 11.595 1.00 0.00 H new ATOM 1253 N GLU A 80 13.626 1.436 6.345 1.00 0.00 N ATOM 1254 CA GLU A 80 14.281 1.377 5.027 1.00 0.00 C ATOM 1255 C GLU A 80 14.027 2.634 4.174 1.00 0.00 C ATOM 1256 O GLU A 80 14.949 3.128 3.521 1.00 0.00 O ATOM 1257 CB GLU A 80 13.820 0.133 4.258 1.00 0.00 C ATOM 1258 CG GLU A 80 14.500 -1.155 4.738 1.00 0.00 C ATOM 1259 CD GLU A 80 14.026 -2.350 3.904 1.00 0.00 C ATOM 1260 OE1 GLU A 80 14.306 -2.351 2.679 1.00 0.00 O ATOM 1261 OE2 GLU A 80 13.378 -3.258 4.478 1.00 0.00 O ATOM 0 H GLU A 80 12.954 0.685 6.503 1.00 0.00 H new ATOM 0 HA GLU A 80 15.353 1.324 5.216 1.00 0.00 H new ATOM 0 HB2 GLU A 80 12.740 0.028 4.362 1.00 0.00 H new ATOM 0 HB3 GLU A 80 14.026 0.272 3.197 1.00 0.00 H new ATOM 0 HG2 GLU A 80 15.582 -1.054 4.659 1.00 0.00 H new ATOM 0 HG3 GLU A 80 14.272 -1.324 5.790 1.00 0.00 H new ATOM 1268 N ILE A 81 12.803 3.179 4.203 1.00 0.00 N ATOM 1269 CA ILE A 81 12.442 4.423 3.497 1.00 0.00 C ATOM 1270 C ILE A 81 13.264 5.596 4.061 1.00 0.00 C ATOM 1271 O ILE A 81 13.870 6.352 3.298 1.00 0.00 O ATOM 1272 CB ILE A 81 10.914 4.662 3.583 1.00 0.00 C ATOM 1273 CG1 ILE A 81 10.175 3.612 2.717 1.00 0.00 C ATOM 1274 CG2 ILE A 81 10.528 6.083 3.127 1.00 0.00 C ATOM 1275 CD1 ILE A 81 8.667 3.529 2.987 1.00 0.00 C ATOM 0 H ILE A 81 12.027 2.768 4.721 1.00 0.00 H new ATOM 0 HA ILE A 81 12.686 4.337 2.438 1.00 0.00 H new ATOM 0 HB ILE A 81 10.617 4.559 4.627 1.00 0.00 H new ATOM 0 HG12 ILE A 81 10.333 3.848 1.665 1.00 0.00 H new ATOM 0 HG13 ILE A 81 10.620 2.633 2.894 1.00 0.00 H new ATOM 0 HG21 ILE A 81 9.448 6.209 3.203 1.00 0.00 H new ATOM 0 HG22 ILE A 81 11.024 6.816 3.763 1.00 0.00 H new ATOM 0 HG23 ILE A 81 10.839 6.230 2.093 1.00 0.00 H new ATOM 0 HD11 ILE A 81 8.223 2.771 2.341 1.00 0.00 H new ATOM 0 HD12 ILE A 81 8.498 3.261 4.030 1.00 0.00 H new ATOM 0 HD13 ILE A 81 8.207 4.496 2.782 1.00 0.00 H new ATOM 1287 N ASN A 82 13.349 5.711 5.393 1.00 0.00 N ATOM 1288 CA ASN A 82 14.186 6.713 6.065 1.00 0.00 C ATOM 1289 C ASN A 82 15.670 6.508 5.718 1.00 0.00 C ATOM 1290 O ASN A 82 16.383 7.472 5.444 1.00 0.00 O ATOM 1291 CB ASN A 82 13.971 6.634 7.590 1.00 0.00 C ATOM 1292 CG ASN A 82 12.782 7.463 8.041 1.00 0.00 C ATOM 1293 OD1 ASN A 82 12.896 8.643 8.339 1.00 0.00 O ATOM 1294 ND2 ASN A 82 11.602 6.888 8.088 1.00 0.00 N ATOM 0 H ASN A 82 12.837 5.109 6.037 1.00 0.00 H new ATOM 0 HA ASN A 82 13.894 7.703 5.716 1.00 0.00 H new ATOM 0 HB2 ASN A 82 13.819 5.595 7.881 1.00 0.00 H new ATOM 0 HB3 ASN A 82 14.869 6.981 8.101 1.00 0.00 H new ATOM 0 HD21 ASN A 82 10.783 7.426 8.373 1.00 0.00 H new ATOM 0 HD22 ASN A 82 11.504 5.904 7.840 1.00 0.00 H new ATOM 1301 N GLY A 83 16.122 5.253 5.704 1.00 0.00 N ATOM 1302 CA GLY A 83 17.481 4.839 5.389 1.00 0.00 C ATOM 1303 C GLY A 83 17.925 5.289 4.006 1.00 0.00 C ATOM 1304 O GLY A 83 18.874 6.059 3.898 1.00 0.00 O ATOM 0 H GLY A 83 15.516 4.462 5.924 1.00 0.00 H new ATOM 0 HA2 GLY A 83 18.163 5.246 6.136 1.00 0.00 H new ATOM 0 HA3 GLY A 83 17.550 3.753 5.453 1.00 0.00 H new ATOM 1308 N ARG A 84 17.237 4.868 2.940 1.00 0.00 N ATOM 1309 CA ARG A 84 17.600 5.250 1.562 1.00 0.00 C ATOM 1310 C ARG A 84 17.530 6.759 1.305 1.00 0.00 C ATOM 1311 O ARG A 84 18.376 7.284 0.585 1.00 0.00 O ATOM 1312 CB ARG A 84 16.765 4.454 0.550 1.00 0.00 C ATOM 1313 CG ARG A 84 17.205 2.980 0.535 1.00 0.00 C ATOM 1314 CD ARG A 84 16.507 2.150 -0.546 1.00 0.00 C ATOM 1315 NE ARG A 84 15.095 1.872 -0.219 1.00 0.00 N ATOM 1316 CZ ARG A 84 14.621 0.796 0.391 1.00 0.00 C ATOM 1317 NH1 ARG A 84 15.385 -0.179 0.814 1.00 0.00 N ATOM 1318 NH2 ARG A 84 13.339 0.666 0.587 1.00 0.00 N ATOM 0 H ARG A 84 16.421 4.259 3.001 1.00 0.00 H new ATOM 0 HA ARG A 84 18.650 4.990 1.428 1.00 0.00 H new ATOM 0 HB2 ARG A 84 15.708 4.522 0.807 1.00 0.00 H new ATOM 0 HB3 ARG A 84 16.880 4.885 -0.445 1.00 0.00 H new ATOM 0 HG2 ARG A 84 18.283 2.931 0.381 1.00 0.00 H new ATOM 0 HG3 ARG A 84 17.002 2.538 1.510 1.00 0.00 H new ATOM 0 HD2 ARG A 84 16.559 2.680 -1.497 1.00 0.00 H new ATOM 0 HD3 ARG A 84 17.039 1.208 -0.677 1.00 0.00 H new ATOM 0 HE ARG A 84 14.414 2.581 -0.491 1.00 0.00 H new ATOM 0 HH11 ARG A 84 16.395 -0.131 0.679 1.00 0.00 H new ATOM 0 HH12 ARG A 84 14.970 -0.987 1.278 1.00 0.00 H new ATOM 0 HH21 ARG A 84 12.698 1.394 0.270 1.00 0.00 H new ATOM 0 HH22 ARG A 84 12.976 -0.164 1.057 1.00 0.00 H new ATOM 1332 N ASN A 85 16.583 7.473 1.919 1.00 0.00 N ATOM 1333 CA ASN A 85 16.503 8.933 1.800 1.00 0.00 C ATOM 1334 C ASN A 85 17.664 9.622 2.543 1.00 0.00 C ATOM 1335 O ASN A 85 18.287 10.530 1.989 1.00 0.00 O ATOM 1336 CB ASN A 85 15.129 9.390 2.317 1.00 0.00 C ATOM 1337 CG ASN A 85 14.940 10.892 2.183 1.00 0.00 C ATOM 1338 OD1 ASN A 85 15.194 11.658 3.100 1.00 0.00 O ATOM 1339 ND2 ASN A 85 14.495 11.362 1.038 1.00 0.00 N ATOM 0 H ASN A 85 15.857 7.062 2.506 1.00 0.00 H new ATOM 0 HA ASN A 85 16.603 9.225 0.754 1.00 0.00 H new ATOM 0 HB2 ASN A 85 14.344 8.875 1.763 1.00 0.00 H new ATOM 0 HB3 ASN A 85 15.022 9.103 3.363 1.00 0.00 H new ATOM 0 HD21 ASN A 85 14.362 12.366 0.916 1.00 0.00 H new ATOM 0 HD22 ASN A 85 14.283 10.723 0.272 1.00 0.00 H new ATOM 1346 N ASN A 86 18.005 9.176 3.758 1.00 0.00 N ATOM 1347 CA ASN A 86 19.142 9.722 4.502 1.00 0.00 C ATOM 1348 C ASN A 86 20.478 9.361 3.831 1.00 0.00 C ATOM 1349 O ASN A 86 21.395 10.172 3.854 1.00 0.00 O ATOM 1350 CB ASN A 86 19.105 9.234 5.958 1.00 0.00 C ATOM 1351 CG ASN A 86 20.049 10.033 6.848 1.00 0.00 C ATOM 1352 OD1 ASN A 86 19.692 11.071 7.385 1.00 0.00 O ATOM 1353 ND2 ASN A 86 21.270 9.596 7.042 1.00 0.00 N ATOM 0 H ASN A 86 17.505 8.434 4.248 1.00 0.00 H new ATOM 0 HA ASN A 86 19.062 10.809 4.498 1.00 0.00 H new ATOM 0 HB2 ASN A 86 18.088 9.315 6.342 1.00 0.00 H new ATOM 0 HB3 ASN A 86 19.377 8.179 5.995 1.00 0.00 H new ATOM 0 HD21 ASN A 86 21.911 10.121 7.636 1.00 0.00 H new ATOM 0 HD22 ASN A 86 21.578 8.731 6.599 1.00 0.00 H new ATOM 1360 N LEU A 87 20.596 8.181 3.208 1.00 0.00 N ATOM 1361 CA LEU A 87 21.807 7.697 2.530 1.00 0.00 C ATOM 1362 C LEU A 87 22.323 8.646 1.435 1.00 0.00 C ATOM 1363 O LEU A 87 23.533 8.763 1.234 1.00 0.00 O ATOM 1364 CB LEU A 87 21.500 6.299 1.971 1.00 0.00 C ATOM 1365 CG LEU A 87 22.687 5.558 1.344 1.00 0.00 C ATOM 1366 CD1 LEU A 87 23.805 5.294 2.341 1.00 0.00 C ATOM 1367 CD2 LEU A 87 22.201 4.193 0.879 1.00 0.00 C ATOM 0 H LEU A 87 19.825 7.514 3.160 1.00 0.00 H new ATOM 0 HA LEU A 87 22.619 7.654 3.255 1.00 0.00 H new ATOM 0 HB2 LEU A 87 21.098 5.686 2.777 1.00 0.00 H new ATOM 0 HB3 LEU A 87 20.716 6.392 1.220 1.00 0.00 H new ATOM 0 HG LEU A 87 23.068 6.183 0.537 1.00 0.00 H new ATOM 0 HD11 LEU A 87 24.619 4.767 1.843 1.00 0.00 H new ATOM 0 HD12 LEU A 87 24.173 6.242 2.735 1.00 0.00 H new ATOM 0 HD13 LEU A 87 23.425 4.684 3.160 1.00 0.00 H new ATOM 0 HD21 LEU A 87 23.029 3.646 0.429 1.00 0.00 H new ATOM 0 HD22 LEU A 87 21.818 3.633 1.732 1.00 0.00 H new ATOM 0 HD23 LEU A 87 21.407 4.321 0.143 1.00 0.00 H new ATOM 1379 N ILE A 88 21.412 9.358 0.766 1.00 0.00 N ATOM 1380 CA ILE A 88 21.702 10.375 -0.262 1.00 0.00 C ATOM 1381 C ILE A 88 22.473 11.584 0.331 1.00 0.00 C ATOM 1382 O ILE A 88 23.144 12.320 -0.392 1.00 0.00 O ATOM 1383 CB ILE A 88 20.367 10.740 -0.969 1.00 0.00 C ATOM 1384 CG1 ILE A 88 19.907 9.531 -1.823 1.00 0.00 C ATOM 1385 CG2 ILE A 88 20.472 12.003 -1.844 1.00 0.00 C ATOM 1386 CD1 ILE A 88 18.505 9.664 -2.430 1.00 0.00 C ATOM 0 H ILE A 88 20.412 9.241 0.928 1.00 0.00 H new ATOM 0 HA ILE A 88 22.380 9.981 -1.019 1.00 0.00 H new ATOM 0 HB ILE A 88 19.633 10.967 -0.196 1.00 0.00 H new ATOM 0 HG12 ILE A 88 20.624 9.382 -2.631 1.00 0.00 H new ATOM 0 HG13 ILE A 88 19.935 8.635 -1.203 1.00 0.00 H new ATOM 0 HG21 ILE A 88 19.507 12.204 -2.310 1.00 0.00 H new ATOM 0 HG22 ILE A 88 20.760 12.852 -1.224 1.00 0.00 H new ATOM 0 HG23 ILE A 88 21.223 11.848 -2.618 1.00 0.00 H new ATOM 0 HD11 ILE A 88 18.273 8.770 -3.009 1.00 0.00 H new ATOM 0 HD12 ILE A 88 17.772 9.779 -1.631 1.00 0.00 H new ATOM 0 HD13 ILE A 88 18.472 10.537 -3.081 1.00 0.00 H new ATOM 1398 N GLN A 89 22.430 11.756 1.658 1.00 0.00 N ATOM 1399 CA GLN A 89 23.120 12.781 2.454 1.00 0.00 C ATOM 1400 C GLN A 89 23.591 12.160 3.792 1.00 0.00 C ATOM 1401 O GLN A 89 23.385 12.710 4.874 1.00 0.00 O ATOM 1402 CB GLN A 89 22.181 13.994 2.623 1.00 0.00 C ATOM 1403 CG GLN A 89 22.923 15.271 3.060 1.00 0.00 C ATOM 1404 CD GLN A 89 22.000 16.481 3.237 1.00 0.00 C ATOM 1405 OE1 GLN A 89 20.853 16.521 2.807 1.00 0.00 O ATOM 1406 NE2 GLN A 89 22.468 17.532 3.880 1.00 0.00 N ATOM 0 H GLN A 89 21.872 11.138 2.247 1.00 0.00 H new ATOM 0 HA GLN A 89 24.018 13.143 1.953 1.00 0.00 H new ATOM 0 HB2 GLN A 89 21.667 14.183 1.681 1.00 0.00 H new ATOM 0 HB3 GLN A 89 21.415 13.754 3.361 1.00 0.00 H new ATOM 0 HG2 GLN A 89 23.441 15.078 4.000 1.00 0.00 H new ATOM 0 HG3 GLN A 89 23.686 15.511 2.319 1.00 0.00 H new ATOM 0 HE21 GLN A 89 23.420 17.523 4.247 1.00 0.00 H new ATOM 0 HE22 GLN A 89 21.879 18.354 4.010 1.00 0.00 H new ATOM 1415 N GLN A 90 24.189 10.961 3.718 1.00 0.00 N ATOM 1416 CA GLN A 90 24.599 10.108 4.852 1.00 0.00 C ATOM 1417 C GLN A 90 25.421 10.793 5.958 1.00 0.00 C ATOM 1418 O GLN A 90 25.406 10.332 7.098 1.00 0.00 O ATOM 1419 CB GLN A 90 25.295 8.833 4.334 1.00 0.00 C ATOM 1420 CG GLN A 90 26.726 9.012 3.792 1.00 0.00 C ATOM 1421 CD GLN A 90 26.855 10.107 2.740 1.00 0.00 C ATOM 1422 OE1 GLN A 90 27.537 11.105 2.923 1.00 0.00 O ATOM 1423 NE2 GLN A 90 26.162 10.009 1.629 1.00 0.00 N ATOM 0 H GLN A 90 24.413 10.535 2.819 1.00 0.00 H new ATOM 0 HA GLN A 90 23.669 9.851 5.358 1.00 0.00 H new ATOM 0 HB2 GLN A 90 25.324 8.105 5.145 1.00 0.00 H new ATOM 0 HB3 GLN A 90 24.680 8.404 3.543 1.00 0.00 H new ATOM 0 HG2 GLN A 90 27.393 9.240 4.623 1.00 0.00 H new ATOM 0 HG3 GLN A 90 27.062 8.068 3.363 1.00 0.00 H new ATOM 0 HE21 GLN A 90 25.587 9.184 1.458 1.00 0.00 H new ATOM 0 HE22 GLN A 90 26.199 10.758 0.937 1.00 0.00 H new ATOM 1432 N LYS A 91 26.093 11.914 5.657 1.00 0.00 N ATOM 1433 CA LYS A 91 26.810 12.750 6.637 1.00 0.00 C ATOM 1434 C LYS A 91 25.887 13.294 7.745 1.00 0.00 C ATOM 1435 O LYS A 91 26.330 13.492 8.876 1.00 0.00 O ATOM 1436 CB LYS A 91 27.546 13.884 5.901 1.00 0.00 C ATOM 1437 CG LYS A 91 26.647 14.800 5.045 1.00 0.00 C ATOM 1438 CD LYS A 91 27.423 15.955 4.388 1.00 0.00 C ATOM 1439 CE LYS A 91 28.560 15.520 3.452 1.00 0.00 C ATOM 1440 NZ LYS A 91 28.068 14.723 2.309 1.00 0.00 N ATOM 0 H LYS A 91 26.156 12.274 4.705 1.00 0.00 H new ATOM 0 HA LYS A 91 27.540 12.121 7.147 1.00 0.00 H new ATOM 0 HB2 LYS A 91 28.066 14.497 6.637 1.00 0.00 H new ATOM 0 HB3 LYS A 91 28.308 13.444 5.257 1.00 0.00 H new ATOM 0 HG2 LYS A 91 26.165 14.205 4.269 1.00 0.00 H new ATOM 0 HG3 LYS A 91 25.855 15.211 5.671 1.00 0.00 H new ATOM 0 HD2 LYS A 91 26.722 16.569 3.823 1.00 0.00 H new ATOM 0 HD3 LYS A 91 27.840 16.586 5.173 1.00 0.00 H new ATOM 0 HE2 LYS A 91 29.080 16.403 3.080 1.00 0.00 H new ATOM 0 HE3 LYS A 91 29.288 14.935 4.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 28.802 14.681 1.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 27.843 13.759 2.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 27.212 15.167 1.919 1.00 0.00 H new ATOM 1454 N ASN A 92 24.610 13.509 7.418 1.00 0.00 N ATOM 1455 CA ASN A 92 23.548 13.978 8.313 1.00 0.00 C ATOM 1456 C ASN A 92 22.165 13.513 7.804 1.00 0.00 C ATOM 1457 O ASN A 92 21.461 14.234 7.084 1.00 0.00 O ATOM 1458 CB ASN A 92 23.645 15.513 8.455 1.00 0.00 C ATOM 1459 CG ASN A 92 22.606 16.093 9.405 1.00 0.00 C ATOM 1460 OD1 ASN A 92 21.994 15.408 10.213 1.00 0.00 O ATOM 1461 ND2 ASN A 92 22.371 17.385 9.342 1.00 0.00 N ATOM 0 H ASN A 92 24.270 13.352 6.469 1.00 0.00 H new ATOM 0 HA ASN A 92 23.674 13.542 9.304 1.00 0.00 H new ATOM 0 HB2 ASN A 92 24.641 15.777 8.811 1.00 0.00 H new ATOM 0 HB3 ASN A 92 23.526 15.971 7.473 1.00 0.00 H new ATOM 0 HD21 ASN A 92 21.683 17.809 9.964 1.00 0.00 H new ATOM 0 HD22 ASN A 92 22.877 17.963 8.671 1.00 0.00 H new TER 1468 ASN A 92 ATOM 1469 P G B 95 42.155 0.094 27.875 1.00 0.00 P ATOM 1470 OP1 G B 95 42.292 -0.729 29.101 1.00 0.00 O ATOM 1471 OP2 G B 95 42.542 -0.493 26.568 1.00 0.00 O ATOM 1472 O5' G B 95 40.585 0.496 27.750 1.00 0.00 O ATOM 1473 C5' G B 95 39.903 1.221 28.770 1.00 0.00 C ATOM 1474 C4' G B 95 40.299 2.704 28.853 1.00 0.00 C ATOM 1475 O4' G B 95 41.664 2.893 29.197 1.00 0.00 O ATOM 1476 C3' G B 95 40.122 3.485 27.555 1.00 0.00 C ATOM 1477 O3' G B 95 38.755 3.703 27.232 1.00 0.00 O ATOM 1478 C2' G B 95 40.925 4.755 27.895 1.00 0.00 C ATOM 1479 O2' G B 95 40.153 5.737 28.586 1.00 0.00 O ATOM 1480 C1' G B 95 41.991 4.241 28.878 1.00 0.00 C ATOM 1481 N9 G B 95 43.365 4.373 28.329 1.00 0.00 N ATOM 1482 C8 G B 95 44.367 5.186 28.801 1.00 0.00 C ATOM 1483 N7 G B 95 45.466 5.161 28.094 1.00 0.00 N ATOM 1484 C5 G B 95 45.169 4.271 27.054 1.00 0.00 C ATOM 1485 C6 G B 95 45.955 3.828 25.927 1.00 0.00 C ATOM 1486 O6 G B 95 47.110 4.126 25.617 1.00 0.00 O ATOM 1487 N1 G B 95 45.284 2.950 25.098 1.00 0.00 N ATOM 1488 C2 G B 95 44.009 2.541 25.312 1.00 0.00 C ATOM 1489 N2 G B 95 43.491 1.710 24.447 1.00 0.00 N ATOM 1490 N3 G B 95 43.248 2.916 26.340 1.00 0.00 N ATOM 1491 C4 G B 95 43.881 3.787 27.187 1.00 0.00 C ATOM 0 H5' G B 95 40.101 0.748 29.732 1.00 0.00 H new ATOM 0 H5'' G B 95 38.829 1.151 28.595 1.00 0.00 H new ATOM 0 H4' G B 95 39.619 3.074 29.620 1.00 0.00 H new ATOM 0 H3' G B 95 40.470 2.986 26.650 1.00 0.00 H new ATOM 0 H2' G B 95 41.297 5.229 26.986 1.00 0.00 H new ATOM 0 HO2' G B 95 39.199 5.550 28.462 1.00 0.00 H new ATOM 0 H1' G B 95 41.988 4.847 29.784 1.00 0.00 H new ATOM 0 H8 G B 95 44.255 5.796 29.685 1.00 0.00 H new ATOM 0 H1 G B 95 45.775 2.589 24.280 1.00 0.00 H new ATOM 0 H21 G B 95 42.535 1.377 24.569 1.00 0.00 H new ATOM 0 H22 G B 95 44.043 1.395 23.649 1.00 0.00 H new ATOM 1503 P U B 96 38.293 4.341 25.828 1.00 0.00 P ATOM 1504 OP1 U B 96 39.064 5.577 25.574 1.00 0.00 O ATOM 1505 OP2 U B 96 36.817 4.375 25.825 1.00 0.00 O ATOM 1506 O5' U B 96 38.739 3.212 24.769 1.00 0.00 O ATOM 1507 C5' U B 96 39.959 3.279 24.044 1.00 0.00 C ATOM 1508 C4' U B 96 40.212 1.958 23.305 1.00 0.00 C ATOM 1509 O4' U B 96 40.646 1.007 24.275 1.00 0.00 O ATOM 1510 C3' U B 96 39.012 1.349 22.553 1.00 0.00 C ATOM 1511 O3' U B 96 38.886 1.679 21.170 1.00 0.00 O ATOM 1512 C2' U B 96 39.320 -0.152 22.672 1.00 0.00 C ATOM 1513 O2' U B 96 40.172 -0.613 21.623 1.00 0.00 O ATOM 1514 C1' U B 96 40.091 -0.271 23.990 1.00 0.00 C ATOM 1515 N1 U B 96 39.248 -0.752 25.127 1.00 0.00 N ATOM 1516 C2 U B 96 39.550 -2.003 25.691 1.00 0.00 C ATOM 1517 O2 U B 96 40.452 -2.739 25.287 1.00 0.00 O ATOM 1518 N3 U B 96 38.773 -2.421 26.752 1.00 0.00 N ATOM 1519 C4 U B 96 37.714 -1.731 27.294 1.00 0.00 C ATOM 1520 O4 U B 96 37.089 -2.203 28.240 1.00 0.00 O ATOM 1521 C5 U B 96 37.439 -0.464 26.654 1.00 0.00 C ATOM 1522 C6 U B 96 38.190 -0.012 25.614 1.00 0.00 C ATOM 0 H5' U B 96 40.784 3.486 24.725 1.00 0.00 H new ATOM 0 H5'' U B 96 39.921 4.102 23.330 1.00 0.00 H new ATOM 0 H4' U B 96 40.945 2.189 22.532 1.00 0.00 H new ATOM 0 H3' U B 96 38.077 1.717 22.977 1.00 0.00 H new ATOM 0 H2' U B 96 38.403 -0.739 22.623 1.00 0.00 H new ATOM 0 HO2' U B 96 40.190 0.050 20.901 1.00 0.00 H new ATOM 0 H1' U B 96 40.870 -1.024 23.874 1.00 0.00 H new ATOM 0 H3 U B 96 39.005 -3.321 27.171 1.00 0.00 H new ATOM 0 H5 U B 96 36.617 0.139 27.011 1.00 0.00 H new ATOM 0 H6 U B 96 37.955 0.940 25.163 1.00 0.00 H new ATOM 1533 P C B 97 38.167 3.016 20.617 1.00 0.00 P ATOM 1534 OP1 C B 97 38.170 2.931 19.139 1.00 0.00 O ATOM 1535 OP2 C B 97 38.750 4.199 21.281 1.00 0.00 O ATOM 1536 O5' C B 97 36.635 2.840 21.101 1.00 0.00 O ATOM 1537 C5' C B 97 36.132 3.441 22.288 1.00 0.00 C ATOM 1538 C4' C B 97 34.642 3.134 22.494 1.00 0.00 C ATOM 1539 O4' C B 97 33.855 3.953 21.633 1.00 0.00 O ATOM 1540 C3' C B 97 34.264 1.663 22.214 1.00 0.00 C ATOM 1541 O3' C B 97 33.215 1.183 23.055 1.00 0.00 O ATOM 1542 C2' C B 97 33.717 1.775 20.788 1.00 0.00 C ATOM 1543 O2' C B 97 32.869 0.694 20.429 1.00 0.00 O ATOM 1544 C1' C B 97 32.979 3.110 20.906 1.00 0.00 C ATOM 1545 N1 C B 97 32.598 3.729 19.607 1.00 0.00 N ATOM 1546 C2 C B 97 31.260 4.099 19.401 1.00 0.00 C ATOM 1547 O2 C B 97 30.405 3.943 20.274 1.00 0.00 O ATOM 1548 N3 C B 97 30.872 4.648 18.222 1.00 0.00 N ATOM 1549 C4 C B 97 31.774 4.817 17.279 1.00 0.00 C ATOM 1550 N4 C B 97 31.341 5.354 16.171 1.00 0.00 N ATOM 1551 C5 C B 97 33.145 4.475 17.429 1.00 0.00 C ATOM 1552 C6 C B 97 33.525 3.932 18.613 1.00 0.00 C ATOM 0 H5' C B 97 36.278 4.520 22.239 1.00 0.00 H new ATOM 0 H5'' C B 97 36.699 3.081 23.146 1.00 0.00 H new ATOM 0 H4' C B 97 34.443 3.338 23.546 1.00 0.00 H new ATOM 0 H3' C B 97 35.100 0.982 22.373 1.00 0.00 H new ATOM 0 H2' C B 97 34.470 1.735 20.001 1.00 0.00 H new ATOM 0 HO2' C B 97 32.422 0.349 21.230 1.00 0.00 H new ATOM 0 H1' C B 97 32.021 2.953 21.401 1.00 0.00 H new ATOM 0 H41 C B 97 31.985 5.515 15.397 1.00 0.00 H new ATOM 0 H42 C B 97 30.359 5.613 16.080 1.00 0.00 H new ATOM 0 H5 C B 97 33.856 4.641 16.633 1.00 0.00 H new ATOM 0 H6 C B 97 34.557 3.659 18.774 1.00 0.00 H new ATOM 1564 P U B 98 33.435 0.885 24.618 1.00 0.00 P ATOM 1565 OP1 U B 98 34.874 0.640 24.859 1.00 0.00 O ATOM 1566 OP2 U B 98 32.415 -0.090 25.063 1.00 0.00 O ATOM 1567 O5' U B 98 33.066 2.334 25.215 1.00 0.00 O ATOM 1568 C5' U B 98 31.723 2.787 25.286 1.00 0.00 C ATOM 1569 C4' U B 98 31.611 4.240 25.771 1.00 0.00 C ATOM 1570 O4' U B 98 32.099 4.369 27.105 1.00 0.00 O ATOM 1571 C3' U B 98 32.383 5.228 24.886 1.00 0.00 C ATOM 1572 O3' U B 98 31.719 6.490 24.853 1.00 0.00 O ATOM 1573 C2' U B 98 33.702 5.345 25.654 1.00 0.00 C ATOM 1574 O2' U B 98 34.388 6.563 25.382 1.00 0.00 O ATOM 1575 C1' U B 98 33.253 5.207 27.111 1.00 0.00 C ATOM 1576 N1 U B 98 34.335 4.654 27.977 1.00 0.00 N ATOM 1577 C2 U B 98 35.122 5.548 28.719 1.00 0.00 C ATOM 1578 O2 U B 98 34.950 6.768 28.733 1.00 0.00 O ATOM 1579 N3 U B 98 36.130 5.003 29.492 1.00 0.00 N ATOM 1580 C4 U B 98 36.406 3.661 29.625 1.00 0.00 C ATOM 1581 O4 U B 98 37.289 3.286 30.391 1.00 0.00 O ATOM 1582 C5 U B 98 35.564 2.797 28.828 1.00 0.00 C ATOM 1583 C6 U B 98 34.575 3.297 28.040 1.00 0.00 C ATOM 0 H5' U B 98 31.161 2.140 25.959 1.00 0.00 H new ATOM 0 H5'' U B 98 31.262 2.701 24.302 1.00 0.00 H new ATOM 0 H4' U B 98 30.550 4.485 25.721 1.00 0.00 H new ATOM 0 H3' U B 98 32.488 4.915 23.847 1.00 0.00 H new ATOM 0 H2' U B 98 34.438 4.592 25.371 1.00 0.00 H new ATOM 0 HO2' U B 98 33.746 7.241 25.086 1.00 0.00 H new ATOM 0 H1' U B 98 33.018 6.184 27.534 1.00 0.00 H new ATOM 0 H3 U B 98 36.722 5.653 30.010 1.00 0.00 H new ATOM 0 H5 U B 98 35.724 1.729 28.859 1.00 0.00 H new ATOM 0 H6 U B 98 33.968 2.622 27.455 1.00 0.00 H new ATOM 1594 P C B 99 30.870 6.982 23.571 1.00 0.00 P ATOM 1595 OP1 C B 99 31.543 6.498 22.345 1.00 0.00 O ATOM 1596 OP2 C B 99 30.598 8.426 23.740 1.00 0.00 O ATOM 1597 O5' C B 99 29.473 6.184 23.723 1.00 0.00 O ATOM 1598 C5' C B 99 28.592 6.413 24.816 1.00 0.00 C ATOM 1599 C4' C B 99 27.160 5.900 24.570 1.00 0.00 C ATOM 1600 O4' C B 99 26.290 6.980 24.259 1.00 0.00 O ATOM 1601 C3' C B 99 26.965 4.831 23.468 1.00 0.00 C ATOM 1602 O3' C B 99 26.411 3.657 24.040 1.00 0.00 O ATOM 1603 C2' C B 99 25.955 5.496 22.517 1.00 0.00 C ATOM 1604 O2' C B 99 25.040 4.595 21.898 1.00 0.00 O ATOM 1605 C1' C B 99 25.244 6.457 23.462 1.00 0.00 C ATOM 1606 N1 C B 99 24.447 7.514 22.775 1.00 0.00 N ATOM 1607 C2 C B 99 25.065 8.560 22.065 1.00 0.00 C ATOM 1608 O2 C B 99 26.281 8.608 21.862 1.00 0.00 O ATOM 1609 N3 C B 99 24.318 9.579 21.563 1.00 0.00 N ATOM 1610 C4 C B 99 23.012 9.548 21.724 1.00 0.00 C ATOM 1611 N4 C B 99 22.365 10.589 21.280 1.00 0.00 N ATOM 1612 C5 C B 99 22.323 8.482 22.364 1.00 0.00 C ATOM 1613 C6 C B 99 23.078 7.476 22.871 1.00 0.00 C ATOM 0 H5' C B 99 28.555 7.482 25.025 1.00 0.00 H new ATOM 0 H5'' C B 99 28.995 5.928 25.705 1.00 0.00 H new ATOM 0 H4' C B 99 26.926 5.408 25.514 1.00 0.00 H new ATOM 0 H3' C B 99 27.888 4.535 22.970 1.00 0.00 H new ATOM 0 H2' C B 99 26.438 5.960 21.657 1.00 0.00 H new ATOM 0 HO2' C B 99 24.434 5.095 21.313 1.00 0.00 H new ATOM 0 H1' C B 99 24.481 5.948 24.051 1.00 0.00 H new ATOM 0 H41 C B 99 21.350 10.635 21.370 1.00 0.00 H new ATOM 0 H42 C B 99 22.874 11.357 20.842 1.00 0.00 H new ATOM 0 H5 C B 99 21.246 8.474 22.443 1.00 0.00 H new ATOM 0 H6 C B 99 22.598 6.638 23.354 1.00 0.00 H new ATOM 1625 P G B 100 27.355 2.467 24.543 1.00 0.00 P ATOM 1626 OP1 G B 100 26.515 1.498 25.275 1.00 0.00 O ATOM 1627 OP2 G B 100 28.544 3.056 25.196 1.00 0.00 O ATOM 1628 O5' G B 100 27.785 1.816 23.130 1.00 0.00 O ATOM 1629 C5' G B 100 29.136 1.816 22.691 1.00 0.00 C ATOM 1630 C4' G B 100 29.400 0.984 21.422 1.00 0.00 C ATOM 1631 O4' G B 100 29.255 -0.409 21.665 1.00 0.00 O ATOM 1632 C3' G B 100 28.519 1.281 20.207 1.00 0.00 C ATOM 1633 O3' G B 100 29.325 0.952 19.077 1.00 0.00 O ATOM 1634 C2' G B 100 27.335 0.335 20.479 1.00 0.00 C ATOM 1635 O2' G B 100 26.683 -0.182 19.331 1.00 0.00 O ATOM 1636 C1' G B 100 27.925 -0.800 21.335 1.00 0.00 C ATOM 1637 N9 G B 100 27.051 -1.080 22.512 1.00 0.00 N ATOM 1638 C8 G B 100 25.680 -1.183 22.508 1.00 0.00 C ATOM 1639 N7 G B 100 25.145 -1.408 23.677 1.00 0.00 N ATOM 1640 C5 G B 100 26.248 -1.466 24.539 1.00 0.00 C ATOM 1641 C6 G B 100 26.330 -1.649 25.969 1.00 0.00 C ATOM 1642 O6 G B 100 25.429 -1.810 26.793 1.00 0.00 O ATOM 1643 N1 G B 100 27.621 -1.623 26.460 1.00 0.00 N ATOM 1644 C2 G B 100 28.714 -1.431 25.680 1.00 0.00 C ATOM 1645 N2 G B 100 29.880 -1.366 26.270 1.00 0.00 N ATOM 1646 N3 G B 100 28.685 -1.264 24.363 1.00 0.00 N ATOM 1647 C4 G B 100 27.421 -1.283 23.833 1.00 0.00 C ATOM 0 H5' G B 100 29.765 1.436 23.496 1.00 0.00 H new ATOM 0 H5'' G B 100 29.443 2.845 22.505 1.00 0.00 H new ATOM 0 H4' G B 100 30.421 1.279 21.181 1.00 0.00 H new ATOM 0 H3' G B 100 28.156 2.294 20.033 1.00 0.00 H new ATOM 0 H2' G B 100 26.540 0.895 20.973 1.00 0.00 H new ATOM 0 HO2' G B 100 27.276 -0.103 18.555 1.00 0.00 H new ATOM 0 H1' G B 100 27.966 -1.749 20.801 1.00 0.00 H new ATOM 0 H8 G B 100 25.092 -1.085 21.608 1.00 0.00 H new ATOM 0 H1 G B 100 27.760 -1.755 27.462 1.00 0.00 H new ATOM 0 H21 G B 100 30.724 -1.222 25.716 1.00 0.00 H new ATOM 0 H22 G B 100 29.944 -1.459 27.284 1.00 0.00 H new ATOM 1659 P C B 101 29.038 1.501 17.591 1.00 0.00 P ATOM 1660 OP1 C B 101 30.335 1.665 16.898 1.00 0.00 O ATOM 1661 OP2 C B 101 28.072 2.619 17.649 1.00 0.00 O ATOM 1662 O5' C B 101 28.285 0.228 16.953 1.00 0.00 O ATOM 1663 C5' C B 101 28.921 -1.036 16.832 1.00 0.00 C ATOM 1664 C4' C B 101 27.960 -2.056 16.211 1.00 0.00 C ATOM 1665 O4' C B 101 26.855 -2.280 17.078 1.00 0.00 O ATOM 1666 C3' C B 101 27.387 -1.665 14.843 1.00 0.00 C ATOM 1667 O3' C B 101 28.225 -2.046 13.760 1.00 0.00 O ATOM 1668 C2' C B 101 26.094 -2.482 14.817 1.00 0.00 C ATOM 1669 O2' C B 101 26.317 -3.816 14.376 1.00 0.00 O ATOM 1670 C1' C B 101 25.695 -2.533 16.295 1.00 0.00 C ATOM 1671 N1 C B 101 24.625 -1.541 16.587 1.00 0.00 N ATOM 1672 C2 C B 101 23.296 -1.985 16.580 1.00 0.00 C ATOM 1673 O2 C B 101 23.018 -3.181 16.483 1.00 0.00 O ATOM 1674 N3 C B 101 22.279 -1.091 16.629 1.00 0.00 N ATOM 1675 C4 C B 101 22.564 0.186 16.753 1.00 0.00 C ATOM 1676 N4 C B 101 21.552 1.000 16.766 1.00 0.00 N ATOM 1677 C5 C B 101 23.886 0.697 16.801 1.00 0.00 C ATOM 1678 C6 C B 101 24.895 -0.200 16.710 1.00 0.00 C ATOM 0 H5' C B 101 29.246 -1.383 17.813 1.00 0.00 H new ATOM 0 H5'' C B 101 29.814 -0.944 16.214 1.00 0.00 H new ATOM 0 H4' C B 101 28.571 -2.947 16.068 1.00 0.00 H new ATOM 0 H3' C B 101 27.267 -0.588 14.728 1.00 0.00 H new ATOM 0 H2' C B 101 25.354 -2.046 14.146 1.00 0.00 H new ATOM 0 HO2' C B 101 27.179 -3.867 13.912 1.00 0.00 H new ATOM 0 H1' C B 101 25.295 -3.517 16.539 1.00 0.00 H new ATOM 0 H41 C B 101 21.706 2.004 16.860 1.00 0.00 H new ATOM 0 H42 C B 101 20.603 0.635 16.683 1.00 0.00 H new ATOM 0 H5 C B 101 24.079 1.755 16.905 1.00 0.00 H new ATOM 0 H6 C B 101 25.920 0.141 16.734 1.00 0.00 H new ATOM 1690 P U B 102 29.103 -0.975 12.956 1.00 0.00 P ATOM 1691 OP1 U B 102 29.987 -1.693 12.013 1.00 0.00 O ATOM 1692 OP2 U B 102 29.668 0.006 13.904 1.00 0.00 O ATOM 1693 O5' U B 102 27.966 -0.226 12.099 1.00 0.00 O ATOM 1694 C5' U B 102 27.159 -0.931 11.162 1.00 0.00 C ATOM 1695 C4' U B 102 26.274 0.028 10.356 1.00 0.00 C ATOM 1696 O4' U B 102 25.247 0.609 11.145 1.00 0.00 O ATOM 1697 C3' U B 102 27.078 1.144 9.692 1.00 0.00 C ATOM 1698 O3' U B 102 27.600 0.645 8.468 1.00 0.00 O ATOM 1699 C2' U B 102 26.056 2.290 9.644 1.00 0.00 C ATOM 1700 O2' U B 102 25.217 2.302 8.502 1.00 0.00 O ATOM 1701 C1' U B 102 25.160 2.000 10.860 1.00 0.00 C ATOM 1702 N1 U B 102 25.501 2.819 12.063 1.00 0.00 N ATOM 1703 C2 U B 102 25.137 4.172 12.053 1.00 0.00 C ATOM 1704 O2 U B 102 24.778 4.769 11.040 1.00 0.00 O ATOM 1705 N3 U B 102 25.230 4.860 13.245 1.00 0.00 N ATOM 1706 C4 U B 102 25.732 4.360 14.423 1.00 0.00 C ATOM 1707 O4 U B 102 25.812 5.083 15.409 1.00 0.00 O ATOM 1708 C5 U B 102 26.139 2.974 14.356 1.00 0.00 C ATOM 1709 C6 U B 102 26.012 2.250 13.212 1.00 0.00 C ATOM 0 H5' U B 102 26.533 -1.652 11.688 1.00 0.00 H new ATOM 0 H5'' U B 102 27.797 -1.498 10.484 1.00 0.00 H new ATOM 0 H4' U B 102 25.819 -0.589 9.581 1.00 0.00 H new ATOM 0 H3' U B 102 27.976 1.510 10.191 1.00 0.00 H new ATOM 0 H2' U B 102 26.581 3.245 9.627 1.00 0.00 H new ATOM 0 HO2' U B 102 25.726 2.005 7.719 1.00 0.00 H new ATOM 0 H1' U B 102 24.138 2.283 10.608 1.00 0.00 H new ATOM 0 H3 U B 102 24.897 5.824 13.253 1.00 0.00 H new ATOM 0 H5 U B 102 26.553 2.503 15.235 1.00 0.00 H new ATOM 0 H6 U B 102 26.316 1.214 13.202 1.00 0.00 H new ATOM 1720 P U B 103 28.433 1.526 7.408 1.00 0.00 P ATOM 1721 OP1 U B 103 29.572 0.717 6.921 1.00 0.00 O ATOM 1722 OP2 U B 103 28.659 2.878 7.963 1.00 0.00 O ATOM 1723 O5' U B 103 27.321 1.607 6.246 1.00 0.00 O ATOM 1724 C5' U B 103 26.874 0.429 5.579 1.00 0.00 C ATOM 1725 C4' U B 103 25.494 0.609 4.934 1.00 0.00 C ATOM 1726 O4' U B 103 24.570 1.193 5.844 1.00 0.00 O ATOM 1727 C3' U B 103 25.451 1.477 3.678 1.00 0.00 C ATOM 1728 O3' U B 103 25.984 0.823 2.529 1.00 0.00 O ATOM 1729 C2' U B 103 23.937 1.738 3.615 1.00 0.00 C ATOM 1730 O2' U B 103 23.197 0.658 3.060 1.00 0.00 O ATOM 1731 C1' U B 103 23.540 1.828 5.095 1.00 0.00 C ATOM 1732 N1 U B 103 23.233 3.241 5.478 1.00 0.00 N ATOM 1733 C2 U B 103 24.251 4.177 5.752 1.00 0.00 C ATOM 1734 O2 U B 103 25.455 3.934 5.767 1.00 0.00 O ATOM 1735 N3 U B 103 23.865 5.487 5.955 1.00 0.00 N ATOM 1736 C4 U B 103 22.589 5.977 5.838 1.00 0.00 C ATOM 1737 O4 U B 103 22.373 7.177 5.981 1.00 0.00 O ATOM 1738 C5 U B 103 21.600 4.971 5.533 1.00 0.00 C ATOM 1739 C6 U B 103 21.926 3.662 5.374 1.00 0.00 C ATOM 0 H5' U B 103 26.834 -0.395 6.291 1.00 0.00 H new ATOM 0 H5'' U B 103 27.597 0.153 4.812 1.00 0.00 H new ATOM 0 H4' U B 103 25.231 -0.411 4.652 1.00 0.00 H new ATOM 0 H3' U B 103 26.063 2.378 3.704 1.00 0.00 H new ATOM 0 H2' U B 103 23.731 2.612 2.998 1.00 0.00 H new ATOM 0 HO2' U B 103 22.320 0.980 2.764 1.00 0.00 H new ATOM 0 H1' U B 103 22.610 1.302 5.312 1.00 0.00 H new ATOM 0 H3 U B 103 24.595 6.150 6.216 1.00 0.00 H new ATOM 0 H5 U B 103 20.567 5.269 5.428 1.00 0.00 H new ATOM 0 H6 U B 103 21.150 2.942 5.163 1.00 0.00 H new ATOM 1750 P U B 104 26.062 1.549 1.091 1.00 0.00 P ATOM 1751 OP1 U B 104 27.045 0.816 0.263 1.00 0.00 O ATOM 1752 OP2 U B 104 26.218 3.004 1.291 1.00 0.00 O ATOM 1753 O5' U B 104 24.579 1.256 0.503 1.00 0.00 O ATOM 1754 C5' U B 104 24.309 -0.003 -0.094 1.00 0.00 C ATOM 1755 C4' U B 104 22.842 -0.298 -0.440 1.00 0.00 C ATOM 1756 O4' U B 104 22.114 -0.745 0.693 1.00 0.00 O ATOM 1757 C3' U B 104 22.021 0.866 -0.986 1.00 0.00 C ATOM 1758 O3' U B 104 22.339 1.214 -2.323 1.00 0.00 O ATOM 1759 C2' U B 104 20.602 0.285 -0.840 1.00 0.00 C ATOM 1760 O2' U B 104 20.247 -0.565 -1.930 1.00 0.00 O ATOM 1761 C1' U B 104 20.724 -0.598 0.418 1.00 0.00 C ATOM 1762 N1 U B 104 20.015 -0.060 1.617 1.00 0.00 N ATOM 1763 C2 U B 104 19.263 -0.949 2.400 1.00 0.00 C ATOM 1764 O2 U B 104 19.171 -2.156 2.170 1.00 0.00 O ATOM 1765 N3 U B 104 18.579 -0.416 3.475 1.00 0.00 N ATOM 1766 C4 U B 104 18.564 0.910 3.841 1.00 0.00 C ATOM 1767 O4 U B 104 17.909 1.270 4.811 1.00 0.00 O ATOM 1768 C5 U B 104 19.358 1.772 2.994 1.00 0.00 C ATOM 1769 C6 U B 104 20.048 1.281 1.932 1.00 0.00 C ATOM 0 H5' U B 104 24.664 -0.783 0.580 1.00 0.00 H new ATOM 0 H5'' U B 104 24.897 -0.080 -1.009 1.00 0.00 H new ATOM 0 H4' U B 104 22.955 -1.049 -1.222 1.00 0.00 H new ATOM 0 H3' U B 104 22.189 1.810 -0.468 1.00 0.00 H new ATOM 0 H2' U B 104 19.852 1.075 -0.797 1.00 0.00 H new ATOM 0 HO2' U B 104 20.880 -0.434 -2.667 1.00 0.00 H new ATOM 0 H1' U B 104 20.239 -1.552 0.211 1.00 0.00 H new ATOM 0 H3 U B 104 18.037 -1.063 4.048 1.00 0.00 H new ATOM 0 H5 U B 104 19.403 2.829 3.210 1.00 0.00 H new ATOM 0 H6 U B 104 20.633 1.954 1.323 1.00 0.00 H new ATOM 1780 P U B 105 21.913 2.640 -2.935 1.00 0.00 P ATOM 1781 OP1 U B 105 20.636 3.068 -2.320 1.00 0.00 O ATOM 1782 OP2 U B 105 22.042 2.575 -4.407 1.00 0.00 O ATOM 1783 O5' U B 105 23.079 3.592 -2.361 1.00 0.00 O ATOM 1784 C5' U B 105 24.445 3.348 -2.672 1.00 0.00 C ATOM 1785 C4' U B 105 25.221 4.653 -2.899 1.00 0.00 C ATOM 1786 O4' U B 105 24.658 5.332 -4.019 1.00 0.00 O ATOM 1787 C3' U B 105 25.225 5.609 -1.695 1.00 0.00 C ATOM 1788 O3' U B 105 26.531 6.172 -1.623 1.00 0.00 O ATOM 1789 C2' U B 105 24.099 6.583 -2.086 1.00 0.00 C ATOM 1790 O2' U B 105 24.158 7.897 -1.546 1.00 0.00 O ATOM 1791 C1' U B 105 24.251 6.627 -3.605 1.00 0.00 C ATOM 1792 N1 U B 105 23.033 7.084 -4.335 1.00 0.00 N ATOM 1793 C2 U B 105 23.200 8.037 -5.349 1.00 0.00 C ATOM 1794 O2 U B 105 24.298 8.434 -5.744 1.00 0.00 O ATOM 1795 N3 U B 105 22.056 8.536 -5.939 1.00 0.00 N ATOM 1796 C4 U B 105 20.768 8.151 -5.646 1.00 0.00 C ATOM 1797 O4 U B 105 19.823 8.662 -6.241 1.00 0.00 O ATOM 1798 C5 U B 105 20.668 7.128 -4.629 1.00 0.00 C ATOM 1799 C6 U B 105 21.771 6.627 -4.011 1.00 0.00 C ATOM 0 H5' U B 105 24.509 2.727 -3.566 1.00 0.00 H new ATOM 0 H5'' U B 105 24.908 2.787 -1.860 1.00 0.00 H new ATOM 0 H4' U B 105 26.259 4.366 -3.067 1.00 0.00 H new ATOM 0 H3' U B 105 25.041 5.200 -0.702 1.00 0.00 H new ATOM 0 H2' U B 105 23.145 6.233 -1.692 1.00 0.00 H new ATOM 0 HO2' U B 105 23.910 7.873 -0.598 1.00 0.00 H new ATOM 0 H1' U B 105 24.997 7.380 -3.858 1.00 0.00 H new ATOM 0 H3 U B 105 22.176 9.253 -6.655 1.00 0.00 H new ATOM 0 H5 U B 105 19.694 6.753 -4.353 1.00 0.00 H new ATOM 0 H6 U B 105 21.658 5.862 -3.257 1.00 0.00 H new ATOM 1810 P C B 106 27.032 7.015 -0.345 1.00 0.00 P ATOM 1811 OP1 C B 106 28.432 6.630 -0.068 1.00 0.00 O ATOM 1812 OP2 C B 106 26.018 6.955 0.727 1.00 0.00 O ATOM 1813 O5' C B 106 27.011 8.501 -0.967 1.00 0.00 O ATOM 1814 C5' C B 106 28.173 9.306 -1.044 1.00 0.00 C ATOM 1815 C4' C B 106 27.928 10.618 -1.810 1.00 0.00 C ATOM 1816 O4' C B 106 28.404 10.487 -3.145 1.00 0.00 O ATOM 1817 C3' C B 106 26.465 11.092 -1.899 1.00 0.00 C ATOM 1818 O3' C B 106 26.376 12.514 -1.988 1.00 0.00 O ATOM 1819 C2' C B 106 26.016 10.452 -3.217 1.00 0.00 C ATOM 1820 O2' C B 106 24.966 11.178 -3.846 1.00 0.00 O ATOM 1821 C1' C B 106 27.304 10.466 -4.047 1.00 0.00 C ATOM 1822 N1 C B 106 27.405 9.299 -4.968 1.00 0.00 N ATOM 1823 C2 C B 106 27.391 9.517 -6.355 1.00 0.00 C ATOM 1824 O2 C B 106 27.347 10.651 -6.838 1.00 0.00 O ATOM 1825 N3 C B 106 27.460 8.469 -7.218 1.00 0.00 N ATOM 1826 C4 C B 106 27.507 7.248 -6.723 1.00 0.00 C ATOM 1827 N4 C B 106 27.568 6.284 -7.599 1.00 0.00 N ATOM 1828 C5 C B 106 27.545 6.963 -5.332 1.00 0.00 C ATOM 1829 C6 C B 106 27.494 8.018 -4.481 1.00 0.00 C ATOM 0 H5' C B 106 28.968 8.745 -1.535 1.00 0.00 H new ATOM 0 H5'' C B 106 28.520 9.536 -0.037 1.00 0.00 H new ATOM 0 H4' C B 106 28.464 11.366 -1.225 1.00 0.00 H new ATOM 0 H3' C B 106 25.867 10.820 -1.029 1.00 0.00 H new ATOM 0 H2' C B 106 25.595 9.455 -3.086 1.00 0.00 H new ATOM 0 HO2' C B 106 24.920 12.081 -3.467 1.00 0.00 H new ATOM 0 H1' C B 106 27.304 11.352 -4.682 1.00 0.00 H new ATOM 0 H41 C B 106 27.607 5.314 -7.287 1.00 0.00 H new ATOM 0 H42 C B 106 27.577 6.500 -8.596 1.00 0.00 H new ATOM 0 H5 C B 106 27.612 5.949 -4.967 1.00 0.00 H new ATOM 0 H6 C B 106 27.524 7.850 -3.415 1.00 0.00 H new ATOM 1841 P C B 107 26.493 13.455 -0.688 1.00 0.00 P ATOM 1842 OP1 C B 107 26.046 12.691 0.496 1.00 0.00 O ATOM 1843 OP2 C B 107 25.900 14.774 -0.994 1.00 0.00 O ATOM 1844 O5' C B 107 28.089 13.621 -0.560 1.00 0.00 O ATOM 1845 C5' C B 107 28.807 14.570 -1.335 1.00 0.00 C ATOM 1846 C4' C B 107 30.315 14.466 -1.067 1.00 0.00 C ATOM 1847 O4' C B 107 30.603 14.794 0.293 1.00 0.00 O ATOM 1848 C3' C B 107 30.875 13.060 -1.350 1.00 0.00 C ATOM 1849 O3' C B 107 32.069 13.223 -2.103 1.00 0.00 O ATOM 1850 C2' C B 107 31.051 12.536 0.088 1.00 0.00 C ATOM 1851 O2' C B 107 31.983 11.482 0.283 1.00 0.00 O ATOM 1852 C1' C B 107 31.501 13.814 0.789 1.00 0.00 C ATOM 1853 N1 C B 107 31.520 13.805 2.285 1.00 0.00 N ATOM 1854 C2 C B 107 32.299 14.781 2.930 1.00 0.00 C ATOM 1855 O2 C B 107 32.967 15.604 2.300 1.00 0.00 O ATOM 1856 N3 C B 107 32.343 14.848 4.284 1.00 0.00 N ATOM 1857 C4 C B 107 31.685 13.948 4.983 1.00 0.00 C ATOM 1858 N4 C B 107 31.747 14.078 6.279 1.00 0.00 N ATOM 1859 C5 C B 107 30.922 12.905 4.395 1.00 0.00 C ATOM 1860 C6 C B 107 30.862 12.859 3.040 1.00 0.00 C ATOM 0 H5' C B 107 28.460 15.576 -1.099 1.00 0.00 H new ATOM 0 H5'' C B 107 28.609 14.405 -2.394 1.00 0.00 H new ATOM 0 H4' C B 107 30.793 15.171 -1.747 1.00 0.00 H new ATOM 0 H3' C B 107 30.279 12.366 -1.943 1.00 0.00 H new ATOM 0 H2' C B 107 30.140 12.062 0.454 1.00 0.00 H new ATOM 0 HO2' C B 107 32.665 11.764 0.928 1.00 0.00 H new ATOM 0 H1' C B 107 32.554 13.990 0.569 1.00 0.00 H new ATOM 0 H41 C B 107 31.260 13.415 6.882 1.00 0.00 H new ATOM 0 H42 C B 107 32.282 14.843 6.690 1.00 0.00 H new ATOM 0 H5 C B 107 30.408 12.175 5.003 1.00 0.00 H new ATOM 0 H6 C B 107 30.297 12.079 2.552 1.00 0.00 H new ATOM 1872 P C B 108 32.801 11.990 -2.839 1.00 0.00 P ATOM 1873 OP1 C B 108 32.984 12.354 -4.261 1.00 0.00 O ATOM 1874 OP2 C B 108 32.130 10.719 -2.484 1.00 0.00 O ATOM 1875 O5' C B 108 34.227 12.059 -2.090 1.00 0.00 O ATOM 1876 C5' C B 108 35.230 12.962 -2.530 1.00 0.00 C ATOM 1877 C4' C B 108 36.426 13.039 -1.580 1.00 0.00 C ATOM 1878 O4' C B 108 36.115 13.866 -0.464 1.00 0.00 O ATOM 1879 C3' C B 108 36.922 11.712 -0.988 1.00 0.00 C ATOM 1880 O3' C B 108 37.715 10.876 -1.822 1.00 0.00 O ATOM 1881 C2' C B 108 37.763 12.269 0.167 1.00 0.00 C ATOM 1882 O2' C B 108 39.034 12.750 -0.264 1.00 0.00 O ATOM 1883 C1' C B 108 36.919 13.461 0.641 1.00 0.00 C ATOM 1884 N1 C B 108 36.070 13.087 1.812 1.00 0.00 N ATOM 1885 C2 C B 108 36.550 13.363 3.103 1.00 0.00 C ATOM 1886 O2 C B 108 37.574 14.024 3.286 1.00 0.00 O ATOM 1887 N3 C B 108 35.901 12.889 4.198 1.00 0.00 N ATOM 1888 C4 C B 108 34.807 12.179 4.023 1.00 0.00 C ATOM 1889 N4 C B 108 34.242 11.724 5.106 1.00 0.00 N ATOM 1890 C5 C B 108 34.254 11.892 2.747 1.00 0.00 C ATOM 1891 C6 C B 108 34.906 12.371 1.659 1.00 0.00 C ATOM 0 H5' C B 108 34.794 13.955 -2.637 1.00 0.00 H new ATOM 0 H5'' C B 108 35.577 12.657 -3.517 1.00 0.00 H new ATOM 0 H4' C B 108 37.217 13.429 -2.220 1.00 0.00 H new ATOM 0 H3' C B 108 36.097 11.038 -0.758 1.00 0.00 H new ATOM 0 H2' C B 108 37.972 11.511 0.922 1.00 0.00 H new ATOM 0 HO2' C B 108 39.271 12.330 -1.117 1.00 0.00 H new ATOM 0 H1' C B 108 37.560 14.278 0.971 1.00 0.00 H new ATOM 0 H41 C B 108 33.391 11.166 5.041 1.00 0.00 H new ATOM 0 H42 C B 108 34.651 11.926 6.018 1.00 0.00 H new ATOM 0 H5 C B 108 33.348 11.314 2.647 1.00 0.00 H new ATOM 0 H6 C B 108 34.510 12.190 0.670 1.00 0.00 H new ATOM 1903 P C B 109 37.059 9.790 -2.817 1.00 0.00 P ATOM 1904 OP1 C B 109 35.686 9.479 -2.369 1.00 0.00 O ATOM 1905 OP2 C B 109 38.032 8.690 -2.991 1.00 0.00 O ATOM 1906 O5' C B 109 36.955 10.613 -4.203 1.00 0.00 O ATOM 1907 C5' C B 109 38.057 10.700 -5.096 1.00 0.00 C ATOM 1908 C4' C B 109 37.668 11.287 -6.461 1.00 0.00 C ATOM 1909 O4' C B 109 36.694 10.453 -7.093 1.00 0.00 O ATOM 1910 C3' C B 109 37.103 12.712 -6.374 1.00 0.00 C ATOM 1911 O3' C B 109 37.588 13.495 -7.467 1.00 0.00 O ATOM 1912 C2' C B 109 35.596 12.461 -6.489 1.00 0.00 C ATOM 1913 O2' C B 109 34.878 13.569 -7.024 1.00 0.00 O ATOM 1914 C1' C B 109 35.535 11.225 -7.387 1.00 0.00 C ATOM 1915 N1 C B 109 34.281 10.451 -7.150 1.00 0.00 N ATOM 1916 C2 C B 109 33.245 10.515 -8.094 1.00 0.00 C ATOM 1917 O2 C B 109 33.381 11.099 -9.173 1.00 0.00 O ATOM 1918 N3 C B 109 32.050 9.916 -7.848 1.00 0.00 N ATOM 1919 C4 C B 109 31.888 9.276 -6.707 1.00 0.00 C ATOM 1920 N4 C B 109 30.722 8.721 -6.524 1.00 0.00 N ATOM 1921 C5 C B 109 32.903 9.160 -5.719 1.00 0.00 C ATOM 1922 C6 C B 109 34.091 9.763 -5.976 1.00 0.00 C ATOM 0 H5' C B 109 38.482 9.707 -5.240 1.00 0.00 H new ATOM 0 H5'' C B 109 38.835 11.318 -4.648 1.00 0.00 H new ATOM 0 H4' C B 109 38.589 11.330 -7.043 1.00 0.00 H new ATOM 0 H3' C B 109 37.381 13.259 -5.473 1.00 0.00 H new ATOM 0 H2' C B 109 35.117 12.316 -5.521 1.00 0.00 H new ATOM 0 HO2' C B 109 33.925 13.348 -7.074 1.00 0.00 H new ATOM 0 HO3' C B 109 36.857 14.037 -7.831 1.00 0.00 H new ATOM 0 H1' C B 109 35.519 11.504 -8.440 1.00 0.00 H new ATOM 0 H41 C B 109 30.530 8.210 -5.662 1.00 0.00 H new ATOM 0 H42 C B 109 30.002 8.798 -7.243 1.00 0.00 H new ATOM 0 H5 C B 109 32.736 8.615 -4.802 1.00 0.00 H new ATOM 0 H6 C B 109 34.892 9.702 -5.254 1.00 0.00 H new TER 1934 C B 109 HETATM 1935 ZN ZN A 101 0.526 4.495 19.217 1.00 0.00 ZN HETATM 1936 ZN ZN A 102 18.806 -6.019 19.488 1.00 0.00 ZN