USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 771 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0349 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.0496 K(o=-0.05,f=-1.9) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -0.153 K(o=-0.15,f=-1) USER MOD Single : A 27 CYS SG : rot -100:sc= -2.68! USER MOD Single : A 28 SER OG : rot 69:sc= 0.134 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 GLN : amide:sc= -0.258 X(o=-0.26,f=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -0.504 K(o=-0.5,f=1) USER MOD Single : A 46 MET CE :methyl -161:sc= 0 (180deg=-0.81) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 70:sc= -0.639 USER MOD Single : A 63 GLN : amide:sc= -0.302 K(o=-0.3,f=-1.7) USER MOD Single : A 66 SER OG : rot 152:sc= 0.478 USER MOD Single : A 67 GLN : amide:sc=-0.00925 X(o=-0.0092,f=-0.17) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 171:sc= -0.0122 (180deg=-0.136) USER MOD Single : A 77 HIS : no HE2:sc= -3.33 X(o=-3.3,f=-3.6!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 HIS : no HD1:sc= -0.319 X(o=-0.32,f=-0.8) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 164:sc= -0.131 (180deg=-0.387) USER MOD Single : A 91 SER OG : rot -115:sc= 0.215 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -20.263 -0.330 20.487 1.00 0.00 N ATOM 2 CA GLY A 1 -20.098 -0.639 19.079 1.00 0.00 C ATOM 3 C GLY A 1 -18.731 -0.245 18.555 1.00 0.00 C ATOM 4 O GLY A 1 -18.589 0.767 17.869 1.00 0.00 O ATOM 0 H1 GLY A 1 -21.213 -0.618 20.797 1.00 0.00 H new ATOM 0 H2 GLY A 1 -19.548 -0.843 21.041 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.147 0.693 20.634 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -20.249 -1.707 18.925 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -20.867 -0.122 18.504 1.00 0.00 H new ATOM 8 N SER A 2 -17.721 -1.045 18.881 1.00 0.00 N ATOM 9 CA SER A 2 -16.357 -0.772 18.443 1.00 0.00 C ATOM 10 C SER A 2 -16.133 -1.273 17.019 1.00 0.00 C ATOM 11 O SER A 2 -15.841 -0.491 16.115 1.00 0.00 O ATOM 12 CB SER A 2 -15.354 -1.431 19.391 1.00 0.00 C ATOM 13 OG SER A 2 -15.653 -2.804 19.577 1.00 0.00 O ATOM 0 H SER A 2 -17.821 -1.888 19.447 1.00 0.00 H new ATOM 0 HA SER A 2 -16.206 0.307 18.458 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.346 -1.326 18.989 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.368 -0.919 20.353 1.00 0.00 H new ATOM 0 HG SER A 2 -14.996 -3.202 20.186 1.00 0.00 H new ATOM 19 N SER A 3 -16.271 -2.582 16.830 1.00 0.00 N ATOM 20 CA SER A 3 -16.081 -3.188 15.518 1.00 0.00 C ATOM 21 C SER A 3 -17.203 -2.788 14.566 1.00 0.00 C ATOM 22 O SER A 3 -18.240 -3.447 14.498 1.00 0.00 O ATOM 23 CB SER A 3 -16.019 -4.711 15.641 1.00 0.00 C ATOM 24 OG SER A 3 -16.166 -5.331 14.375 1.00 0.00 O ATOM 0 H SER A 3 -16.514 -3.242 17.569 1.00 0.00 H new ATOM 0 HA SER A 3 -15.137 -2.825 15.111 1.00 0.00 H new ATOM 0 HB2 SER A 3 -15.068 -5.005 16.085 1.00 0.00 H new ATOM 0 HB3 SER A 3 -16.805 -5.057 16.312 1.00 0.00 H new ATOM 0 HG SER A 3 -16.121 -6.304 14.480 1.00 0.00 H new ATOM 30 N GLY A 4 -16.988 -1.701 13.831 1.00 0.00 N ATOM 31 CA GLY A 4 -17.990 -1.230 12.893 1.00 0.00 C ATOM 32 C GLY A 4 -17.517 -0.035 12.090 1.00 0.00 C ATOM 33 O GLY A 4 -17.535 -0.057 10.859 1.00 0.00 O ATOM 0 H GLY A 4 -16.138 -1.138 13.869 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -18.255 -2.039 12.212 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -18.896 -0.962 13.438 1.00 0.00 H new ATOM 37 N SER A 5 -17.094 1.015 12.787 1.00 0.00 N ATOM 38 CA SER A 5 -16.619 2.228 12.132 1.00 0.00 C ATOM 39 C SER A 5 -15.188 2.548 12.553 1.00 0.00 C ATOM 40 O SER A 5 -14.857 2.525 13.739 1.00 0.00 O ATOM 41 CB SER A 5 -17.536 3.406 12.466 1.00 0.00 C ATOM 42 OG SER A 5 -18.178 3.898 11.302 1.00 0.00 O ATOM 0 H SER A 5 -17.071 1.050 13.806 1.00 0.00 H new ATOM 0 HA SER A 5 -16.634 2.059 11.055 1.00 0.00 H new ATOM 0 HB2 SER A 5 -18.285 3.093 13.194 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.955 4.203 12.929 1.00 0.00 H new ATOM 0 HG SER A 5 -18.760 4.649 11.542 1.00 0.00 H new ATOM 48 N SER A 6 -14.342 2.846 11.572 1.00 0.00 N ATOM 49 CA SER A 6 -12.945 3.168 11.839 1.00 0.00 C ATOM 50 C SER A 6 -12.595 4.554 11.307 1.00 0.00 C ATOM 51 O SER A 6 -13.177 5.020 10.328 1.00 0.00 O ATOM 52 CB SER A 6 -12.029 2.119 11.206 1.00 0.00 C ATOM 53 OG SER A 6 -11.244 1.467 12.189 1.00 0.00 O ATOM 0 H SER A 6 -14.600 2.871 10.585 1.00 0.00 H new ATOM 0 HA SER A 6 -12.797 3.166 12.919 1.00 0.00 H new ATOM 0 HB2 SER A 6 -12.629 1.384 10.669 1.00 0.00 H new ATOM 0 HB3 SER A 6 -11.378 2.595 10.473 1.00 0.00 H new ATOM 0 HG SER A 6 -10.669 0.800 11.759 1.00 0.00 H new ATOM 59 N GLY A 7 -11.638 5.207 11.958 1.00 0.00 N ATOM 60 CA GLY A 7 -11.225 6.533 11.537 1.00 0.00 C ATOM 61 C GLY A 7 -9.732 6.750 11.682 1.00 0.00 C ATOM 62 O GLY A 7 -9.043 5.956 12.320 1.00 0.00 O ATOM 0 H GLY A 7 -11.141 4.841 12.770 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -11.512 6.686 10.497 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -11.756 7.280 12.127 1.00 0.00 H new ATOM 66 N ASN A 8 -9.232 7.827 11.088 1.00 0.00 N ATOM 67 CA ASN A 8 -7.810 8.145 11.152 1.00 0.00 C ATOM 68 C ASN A 8 -7.485 8.936 12.417 1.00 0.00 C ATOM 69 O ASN A 8 -8.217 9.851 12.793 1.00 0.00 O ATOM 70 CB ASN A 8 -7.387 8.943 9.916 1.00 0.00 C ATOM 71 CG ASN A 8 -7.491 8.130 8.641 1.00 0.00 C ATOM 72 OD1 ASN A 8 -8.021 7.020 8.640 1.00 0.00 O ATOM 73 ND2 ASN A 8 -6.984 8.683 7.544 1.00 0.00 N ATOM 0 H ASN A 8 -9.790 8.495 10.556 1.00 0.00 H new ATOM 0 HA ASN A 8 -7.255 7.207 11.178 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -8.012 9.832 9.829 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -6.360 9.286 10.042 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -7.026 8.184 6.655 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -6.553 9.606 7.591 1.00 0.00 H new ATOM 80 N SER A 9 -6.384 8.575 13.067 1.00 0.00 N ATOM 81 CA SER A 9 -5.964 9.247 14.291 1.00 0.00 C ATOM 82 C SER A 9 -5.721 10.732 14.039 1.00 0.00 C ATOM 83 O SER A 9 -6.433 11.597 14.548 1.00 0.00 O ATOM 84 CB SER A 9 -4.693 8.598 14.844 1.00 0.00 C ATOM 85 OG SER A 9 -4.997 7.697 15.895 1.00 0.00 O ATOM 0 H SER A 9 -5.766 7.821 12.767 1.00 0.00 H new ATOM 0 HA SER A 9 -6.764 9.146 15.024 1.00 0.00 H new ATOM 0 HB2 SER A 9 -4.174 8.068 14.045 1.00 0.00 H new ATOM 0 HB3 SER A 9 -4.015 9.370 15.207 1.00 0.00 H new ATOM 0 HG SER A 9 -4.169 7.294 16.230 1.00 0.00 H new ATOM 91 N PRO A 10 -4.693 11.034 13.234 1.00 0.00 N ATOM 92 CA PRO A 10 -4.332 12.414 12.895 1.00 0.00 C ATOM 93 C PRO A 10 -5.363 13.077 11.988 1.00 0.00 C ATOM 94 O PRO A 10 -5.950 12.429 11.121 1.00 0.00 O ATOM 95 CB PRO A 10 -2.996 12.263 12.163 1.00 0.00 C ATOM 96 CG PRO A 10 -3.024 10.881 11.606 1.00 0.00 C ATOM 97 CD PRO A 10 -3.802 10.053 12.592 1.00 0.00 C ATOM 0 HA PRO A 10 -4.280 13.049 13.779 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -2.891 13.006 11.373 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -2.155 12.399 12.842 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -3.497 10.865 10.624 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -2.014 10.491 11.479 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -4.366 9.262 12.096 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -3.147 9.571 13.317 1.00 0.00 H new ATOM 105 N ASP A 11 -5.578 14.372 12.193 1.00 0.00 N ATOM 106 CA ASP A 11 -6.538 15.123 11.392 1.00 0.00 C ATOM 107 C ASP A 11 -5.903 15.605 10.092 1.00 0.00 C ATOM 108 O ASP A 11 -6.069 16.760 9.697 1.00 0.00 O ATOM 109 CB ASP A 11 -7.074 16.316 12.185 1.00 0.00 C ATOM 110 CG ASP A 11 -8.524 16.621 11.864 1.00 0.00 C ATOM 111 OD1 ASP A 11 -9.404 15.858 12.313 1.00 0.00 O ATOM 112 OD2 ASP A 11 -8.778 17.624 11.165 1.00 0.00 O ATOM 0 H ASP A 11 -5.101 14.923 12.906 1.00 0.00 H new ATOM 0 HA ASP A 11 -7.366 14.458 11.146 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -6.976 16.113 13.251 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -6.465 17.194 11.970 1.00 0.00 H new ATOM 117 N THR A 12 -5.173 14.713 9.430 1.00 0.00 N ATOM 118 CA THR A 12 -4.509 15.048 8.175 1.00 0.00 C ATOM 119 C THR A 12 -3.777 13.840 7.602 1.00 0.00 C ATOM 120 O THR A 12 -2.987 13.196 8.291 1.00 0.00 O ATOM 121 CB THR A 12 -3.506 16.202 8.361 1.00 0.00 C ATOM 122 OG1 THR A 12 -2.644 16.289 7.222 1.00 0.00 O ATOM 123 CG2 THR A 12 -2.674 15.999 9.618 1.00 0.00 C ATOM 0 H THR A 12 -5.026 13.753 9.742 1.00 0.00 H new ATOM 0 HA THR A 12 -5.287 15.362 7.479 1.00 0.00 H new ATOM 0 HB THR A 12 -4.068 17.130 8.463 1.00 0.00 H new ATOM 0 HG1 THR A 12 -2.010 17.026 7.347 1.00 0.00 H new ATOM 0 HG21 THR A 12 -1.973 16.826 9.728 1.00 0.00 H new ATOM 0 HG22 THR A 12 -3.331 15.962 10.487 1.00 0.00 H new ATOM 0 HG23 THR A 12 -2.121 15.063 9.541 1.00 0.00 H new ATOM 131 N ALA A 13 -4.044 13.540 6.335 1.00 0.00 N ATOM 132 CA ALA A 13 -3.409 12.410 5.667 1.00 0.00 C ATOM 133 C ALA A 13 -3.829 12.330 4.203 1.00 0.00 C ATOM 134 O ALA A 13 -4.757 11.604 3.854 1.00 0.00 O ATOM 135 CB ALA A 13 -3.745 11.114 6.388 1.00 0.00 C ATOM 0 H ALA A 13 -4.696 14.064 5.751 1.00 0.00 H new ATOM 0 HA ALA A 13 -2.330 12.560 5.699 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -3.264 10.279 5.878 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -3.387 11.166 7.416 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -4.825 10.967 6.387 1.00 0.00 H new ATOM 141 N ASN A 14 -3.140 13.083 3.353 1.00 0.00 N ATOM 142 CA ASN A 14 -3.443 13.098 1.927 1.00 0.00 C ATOM 143 C ASN A 14 -2.168 12.973 1.097 1.00 0.00 C ATOM 144 O ASN A 14 -1.991 13.675 0.102 1.00 0.00 O ATOM 145 CB ASN A 14 -4.182 14.385 1.554 1.00 0.00 C ATOM 146 CG ASN A 14 -5.479 14.549 2.322 1.00 0.00 C ATOM 147 OD1 ASN A 14 -6.151 13.568 2.645 1.00 0.00 O ATOM 148 ND2 ASN A 14 -5.839 15.792 2.618 1.00 0.00 N ATOM 0 H ASN A 14 -2.368 13.691 3.627 1.00 0.00 H new ATOM 0 HA ASN A 14 -4.083 12.243 1.709 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -3.536 15.241 1.749 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -4.394 14.383 0.485 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -6.703 15.964 3.133 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -5.252 16.575 2.331 1.00 0.00 H new ATOM 155 N ASP A 15 -1.283 12.075 1.515 1.00 0.00 N ATOM 156 CA ASP A 15 -0.024 11.856 0.812 1.00 0.00 C ATOM 157 C ASP A 15 -0.021 10.500 0.113 1.00 0.00 C ATOM 158 O ASP A 15 0.557 10.345 -0.962 1.00 0.00 O ATOM 159 CB ASP A 15 1.151 11.945 1.785 1.00 0.00 C ATOM 160 CG ASP A 15 2.072 13.109 1.477 1.00 0.00 C ATOM 161 OD1 ASP A 15 1.806 14.223 1.976 1.00 0.00 O ATOM 162 OD2 ASP A 15 3.057 12.908 0.736 1.00 0.00 O ATOM 0 H ASP A 15 -1.414 11.486 2.338 1.00 0.00 H new ATOM 0 HA ASP A 15 0.082 12.634 0.056 1.00 0.00 H new ATOM 0 HB2 ASP A 15 0.770 12.046 2.801 1.00 0.00 H new ATOM 0 HB3 ASP A 15 1.720 11.016 1.749 1.00 0.00 H new ATOM 167 N GLY A 16 -0.671 9.519 0.733 1.00 0.00 N ATOM 168 CA GLY A 16 -0.730 8.188 0.157 1.00 0.00 C ATOM 169 C GLY A 16 0.333 7.266 0.718 1.00 0.00 C ATOM 170 O GLY A 16 0.832 6.383 0.020 1.00 0.00 O ATOM 0 H GLY A 16 -1.157 9.622 1.624 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -1.714 7.758 0.343 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.612 8.258 -0.924 1.00 0.00 H new ATOM 174 N PHE A 17 0.683 7.471 1.984 1.00 0.00 N ATOM 175 CA PHE A 17 1.696 6.651 2.639 1.00 0.00 C ATOM 176 C PHE A 17 1.052 5.513 3.424 1.00 0.00 C ATOM 177 O PHE A 17 -0.046 5.658 3.961 1.00 0.00 O ATOM 178 CB PHE A 17 2.551 7.510 3.574 1.00 0.00 C ATOM 179 CG PHE A 17 3.931 7.780 3.046 1.00 0.00 C ATOM 180 CD1 PHE A 17 4.922 6.816 3.137 1.00 0.00 C ATOM 181 CD2 PHE A 17 4.238 8.998 2.461 1.00 0.00 C ATOM 182 CE1 PHE A 17 6.193 7.060 2.651 1.00 0.00 C ATOM 183 CE2 PHE A 17 5.507 9.248 1.974 1.00 0.00 C ATOM 184 CZ PHE A 17 6.486 8.279 2.070 1.00 0.00 C ATOM 0 H PHE A 17 0.280 8.197 2.576 1.00 0.00 H new ATOM 0 HA PHE A 17 2.333 6.220 1.867 1.00 0.00 H new ATOM 0 HB2 PHE A 17 2.044 8.460 3.746 1.00 0.00 H new ATOM 0 HB3 PHE A 17 2.631 7.012 4.540 1.00 0.00 H new ATOM 0 HD1 PHE A 17 4.699 5.863 3.593 1.00 0.00 H new ATOM 0 HD2 PHE A 17 3.477 9.761 2.385 1.00 0.00 H new ATOM 0 HE1 PHE A 17 6.956 6.299 2.725 1.00 0.00 H new ATOM 0 HE2 PHE A 17 5.733 10.201 1.519 1.00 0.00 H new ATOM 0 HZ PHE A 17 7.479 8.473 1.692 1.00 0.00 H new ATOM 194 N VAL A 18 1.743 4.379 3.485 1.00 0.00 N ATOM 195 CA VAL A 18 1.239 3.215 4.203 1.00 0.00 C ATOM 196 C VAL A 18 2.353 2.528 4.986 1.00 0.00 C ATOM 197 O VAL A 18 3.488 2.433 4.518 1.00 0.00 O ATOM 198 CB VAL A 18 0.599 2.195 3.243 1.00 0.00 C ATOM 199 CG1 VAL A 18 -0.572 2.823 2.501 1.00 0.00 C ATOM 200 CG2 VAL A 18 1.635 1.660 2.265 1.00 0.00 C ATOM 0 H VAL A 18 2.653 4.242 3.046 1.00 0.00 H new ATOM 0 HA VAL A 18 0.479 3.576 4.896 1.00 0.00 H new ATOM 0 HB VAL A 18 0.221 1.358 3.830 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.012 2.088 1.827 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -1.323 3.153 3.219 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.221 3.679 1.925 1.00 0.00 H new ATOM 0 HG21 VAL A 18 1.165 0.941 1.594 1.00 0.00 H new ATOM 0 HG22 VAL A 18 2.045 2.485 1.682 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.438 1.171 2.817 1.00 0.00 H new ATOM 210 N ARG A 19 2.020 2.050 6.181 1.00 0.00 N ATOM 211 CA ARG A 19 2.993 1.372 7.029 1.00 0.00 C ATOM 212 C ARG A 19 2.735 -0.132 7.058 1.00 0.00 C ATOM 213 O ARG A 19 1.594 -0.575 7.186 1.00 0.00 O ATOM 214 CB ARG A 19 2.942 1.935 8.451 1.00 0.00 C ATOM 215 CG ARG A 19 3.887 1.239 9.416 1.00 0.00 C ATOM 216 CD ARG A 19 3.847 1.881 10.795 1.00 0.00 C ATOM 217 NE ARG A 19 2.625 1.545 11.520 1.00 0.00 N ATOM 218 CZ ARG A 19 2.484 1.698 12.832 1.00 0.00 C ATOM 219 NH1 ARG A 19 3.484 2.177 13.558 1.00 0.00 N ATOM 220 NH2 ARG A 19 1.340 1.371 13.420 1.00 0.00 N ATOM 0 H ARG A 19 1.085 2.120 6.583 1.00 0.00 H new ATOM 0 HA ARG A 19 3.985 1.546 6.611 1.00 0.00 H new ATOM 0 HB2 ARG A 19 3.185 2.997 8.421 1.00 0.00 H new ATOM 0 HB3 ARG A 19 1.923 1.851 8.829 1.00 0.00 H new ATOM 0 HG2 ARG A 19 3.617 0.186 9.496 1.00 0.00 H new ATOM 0 HG3 ARG A 19 4.903 1.279 9.024 1.00 0.00 H new ATOM 0 HD2 ARG A 19 4.712 1.554 11.372 1.00 0.00 H new ATOM 0 HD3 ARG A 19 3.922 2.964 10.693 1.00 0.00 H new ATOM 0 HE ARG A 19 1.837 1.173 10.990 1.00 0.00 H new ATOM 0 HH11 ARG A 19 4.365 2.429 13.110 1.00 0.00 H new ATOM 0 HH12 ARG A 19 3.373 2.293 14.565 1.00 0.00 H new ATOM 0 HH21 ARG A 19 0.568 1.002 12.864 1.00 0.00 H new ATOM 0 HH22 ARG A 19 1.233 1.489 14.427 1.00 0.00 H new ATOM 234 N LEU A 20 3.803 -0.912 6.936 1.00 0.00 N ATOM 235 CA LEU A 20 3.694 -2.367 6.947 1.00 0.00 C ATOM 236 C LEU A 20 4.338 -2.952 8.199 1.00 0.00 C ATOM 237 O LEU A 20 5.348 -2.443 8.687 1.00 0.00 O ATOM 238 CB LEU A 20 4.352 -2.957 5.698 1.00 0.00 C ATOM 239 CG LEU A 20 4.204 -2.142 4.413 1.00 0.00 C ATOM 240 CD1 LEU A 20 4.721 -2.930 3.219 1.00 0.00 C ATOM 241 CD2 LEU A 20 2.751 -1.741 4.201 1.00 0.00 C ATOM 0 H LEU A 20 4.755 -0.562 6.828 1.00 0.00 H new ATOM 0 HA LEU A 20 2.636 -2.627 6.950 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.415 -3.090 5.900 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.934 -3.949 5.526 1.00 0.00 H new ATOM 0 HG LEU A 20 4.800 -1.235 4.509 1.00 0.00 H new ATOM 0 HD11 LEU A 20 4.608 -2.334 2.313 1.00 0.00 H new ATOM 0 HD12 LEU A 20 5.774 -3.167 3.368 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.152 -3.854 3.119 1.00 0.00 H new ATOM 0 HD21 LEU A 20 2.664 -1.162 3.282 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.134 -2.636 4.125 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.413 -1.138 5.044 1.00 0.00 H new ATOM 253 N ARG A 21 3.748 -4.025 8.716 1.00 0.00 N ATOM 254 CA ARG A 21 4.265 -4.680 9.911 1.00 0.00 C ATOM 255 C ARG A 21 4.250 -6.198 9.749 1.00 0.00 C ATOM 256 O ARG A 21 3.209 -6.792 9.466 1.00 0.00 O ATOM 257 CB ARG A 21 3.440 -4.279 11.135 1.00 0.00 C ATOM 258 CG ARG A 21 4.175 -3.348 12.086 1.00 0.00 C ATOM 259 CD ARG A 21 3.521 -3.326 13.459 1.00 0.00 C ATOM 260 NE ARG A 21 4.464 -3.670 14.520 1.00 0.00 N ATOM 261 CZ ARG A 21 5.528 -2.935 14.824 1.00 0.00 C ATOM 262 NH1 ARG A 21 5.782 -1.820 14.153 1.00 0.00 N ATOM 263 NH2 ARG A 21 6.340 -3.313 15.803 1.00 0.00 N ATOM 0 H ARG A 21 2.912 -4.459 8.326 1.00 0.00 H new ATOM 0 HA ARG A 21 5.296 -4.357 10.054 1.00 0.00 H new ATOM 0 HB2 ARG A 21 2.523 -3.794 10.801 1.00 0.00 H new ATOM 0 HB3 ARG A 21 3.146 -5.179 11.675 1.00 0.00 H new ATOM 0 HG2 ARG A 21 5.213 -3.668 12.181 1.00 0.00 H new ATOM 0 HG3 ARG A 21 4.189 -2.340 11.672 1.00 0.00 H new ATOM 0 HD2 ARG A 21 3.108 -2.335 13.648 1.00 0.00 H new ATOM 0 HD3 ARG A 21 2.687 -4.027 13.474 1.00 0.00 H new ATOM 0 HE ARG A 21 4.296 -4.521 15.057 1.00 0.00 H new ATOM 0 HH11 ARG A 21 5.160 -1.524 13.401 1.00 0.00 H new ATOM 0 HH12 ARG A 21 6.600 -1.258 14.389 1.00 0.00 H new ATOM 0 HH21 ARG A 21 6.148 -4.169 16.323 1.00 0.00 H new ATOM 0 HH22 ARG A 21 7.157 -2.748 16.035 1.00 0.00 H new ATOM 277 N GLY A 22 5.411 -6.819 9.929 1.00 0.00 N ATOM 278 CA GLY A 22 5.509 -8.261 9.798 1.00 0.00 C ATOM 279 C GLY A 22 6.089 -8.683 8.463 1.00 0.00 C ATOM 280 O GLY A 22 5.660 -9.680 7.879 1.00 0.00 O ATOM 0 H GLY A 22 6.286 -6.350 10.163 1.00 0.00 H new ATOM 0 HA2 GLY A 22 6.131 -8.654 10.602 1.00 0.00 H new ATOM 0 HA3 GLY A 22 4.519 -8.702 9.916 1.00 0.00 H new ATOM 284 N LEU A 23 7.064 -7.924 7.976 1.00 0.00 N ATOM 285 CA LEU A 23 7.702 -8.225 6.699 1.00 0.00 C ATOM 286 C LEU A 23 8.598 -9.454 6.813 1.00 0.00 C ATOM 287 O LEU A 23 9.218 -9.707 7.847 1.00 0.00 O ATOM 288 CB LEU A 23 8.523 -7.025 6.222 1.00 0.00 C ATOM 289 CG LEU A 23 7.746 -5.728 5.997 1.00 0.00 C ATOM 290 CD1 LEU A 23 8.701 -4.559 5.809 1.00 0.00 C ATOM 291 CD2 LEU A 23 6.820 -5.861 4.797 1.00 0.00 C ATOM 0 H LEU A 23 7.430 -7.096 8.446 1.00 0.00 H new ATOM 0 HA LEU A 23 6.919 -8.436 5.971 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.308 -6.833 6.954 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.017 -7.296 5.289 1.00 0.00 H new ATOM 0 HG LEU A 23 7.137 -5.535 6.880 1.00 0.00 H new ATOM 0 HD11 LEU A 23 8.130 -3.644 5.650 1.00 0.00 H new ATOM 0 HD12 LEU A 23 9.321 -4.449 6.698 1.00 0.00 H new ATOM 0 HD13 LEU A 23 9.337 -4.744 4.944 1.00 0.00 H new ATOM 0 HD21 LEU A 23 6.275 -4.928 4.653 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.408 -6.079 3.906 1.00 0.00 H new ATOM 0 HD23 LEU A 23 6.112 -6.671 4.972 1.00 0.00 H new ATOM 303 N PRO A 24 8.669 -10.238 5.728 1.00 0.00 N ATOM 304 CA PRO A 24 9.488 -11.453 5.680 1.00 0.00 C ATOM 305 C PRO A 24 10.982 -11.145 5.678 1.00 0.00 C ATOM 306 O PRO A 24 11.387 -9.988 5.557 1.00 0.00 O ATOM 307 CB PRO A 24 9.075 -12.109 4.360 1.00 0.00 C ATOM 308 CG PRO A 24 8.586 -10.983 3.515 1.00 0.00 C ATOM 309 CD PRO A 24 7.956 -9.998 4.462 1.00 0.00 C ATOM 0 HA PRO A 24 9.329 -12.086 6.553 1.00 0.00 H new ATOM 0 HB2 PRO A 24 9.916 -12.620 3.891 1.00 0.00 H new ATOM 0 HB3 PRO A 24 8.296 -12.855 4.515 1.00 0.00 H new ATOM 0 HG2 PRO A 24 9.406 -10.524 2.963 1.00 0.00 H new ATOM 0 HG3 PRO A 24 7.863 -11.333 2.778 1.00 0.00 H new ATOM 0 HD2 PRO A 24 8.083 -8.972 4.118 1.00 0.00 H new ATOM 0 HD3 PRO A 24 6.884 -10.169 4.566 1.00 0.00 H new ATOM 317 N PHE A 25 11.797 -12.187 5.810 1.00 0.00 N ATOM 318 CA PHE A 25 13.246 -12.027 5.824 1.00 0.00 C ATOM 319 C PHE A 25 13.758 -11.591 4.454 1.00 0.00 C ATOM 320 O PHE A 25 13.430 -12.198 3.435 1.00 0.00 O ATOM 321 CB PHE A 25 13.921 -13.336 6.240 1.00 0.00 C ATOM 322 CG PHE A 25 15.299 -13.146 6.804 1.00 0.00 C ATOM 323 CD1 PHE A 25 15.494 -12.410 7.962 1.00 0.00 C ATOM 324 CD2 PHE A 25 16.402 -13.705 6.178 1.00 0.00 C ATOM 325 CE1 PHE A 25 16.762 -12.233 8.482 1.00 0.00 C ATOM 326 CE2 PHE A 25 17.672 -13.532 6.694 1.00 0.00 C ATOM 327 CZ PHE A 25 17.852 -12.795 7.849 1.00 0.00 C ATOM 0 H PHE A 25 11.478 -13.151 5.909 1.00 0.00 H new ATOM 0 HA PHE A 25 13.494 -11.252 6.549 1.00 0.00 H new ATOM 0 HB2 PHE A 25 13.299 -13.836 6.982 1.00 0.00 H new ATOM 0 HB3 PHE A 25 13.979 -13.997 5.375 1.00 0.00 H new ATOM 0 HD1 PHE A 25 14.645 -11.970 8.464 1.00 0.00 H new ATOM 0 HD2 PHE A 25 16.267 -14.283 5.276 1.00 0.00 H new ATOM 0 HE1 PHE A 25 16.900 -11.655 9.384 1.00 0.00 H new ATOM 0 HE2 PHE A 25 18.523 -13.972 6.195 1.00 0.00 H new ATOM 0 HZ PHE A 25 18.843 -12.659 8.255 1.00 0.00 H new ATOM 337 N GLY A 26 14.564 -10.534 4.438 1.00 0.00 N ATOM 338 CA GLY A 26 15.107 -10.034 3.189 1.00 0.00 C ATOM 339 C GLY A 26 14.092 -9.243 2.389 1.00 0.00 C ATOM 340 O GLY A 26 14.316 -8.935 1.219 1.00 0.00 O ATOM 0 H GLY A 26 14.851 -10.015 5.268 1.00 0.00 H new ATOM 0 HA2 GLY A 26 15.971 -9.403 3.399 1.00 0.00 H new ATOM 0 HA3 GLY A 26 15.463 -10.872 2.590 1.00 0.00 H new ATOM 344 N CYS A 27 12.970 -8.915 3.022 1.00 0.00 N ATOM 345 CA CYS A 27 11.914 -8.157 2.360 1.00 0.00 C ATOM 346 C CYS A 27 12.449 -6.832 1.826 1.00 0.00 C ATOM 347 O CYS A 27 13.058 -6.055 2.561 1.00 0.00 O ATOM 348 CB CYS A 27 10.759 -7.900 3.329 1.00 0.00 C ATOM 349 SG CYS A 27 9.378 -6.984 2.606 1.00 0.00 S ATOM 0 H CYS A 27 12.769 -9.162 3.991 1.00 0.00 H new ATOM 0 HA CYS A 27 11.550 -8.747 1.519 1.00 0.00 H new ATOM 0 HB2 CYS A 27 10.391 -8.856 3.701 1.00 0.00 H new ATOM 0 HB3 CYS A 27 11.137 -7.347 4.189 1.00 0.00 H new ATOM 0 HG CYS A 27 9.455 -5.734 2.956 1.00 0.00 H new ATOM 355 N SER A 28 12.217 -6.581 0.541 1.00 0.00 N ATOM 356 CA SER A 28 12.680 -5.353 -0.093 1.00 0.00 C ATOM 357 C SER A 28 11.666 -4.855 -1.119 1.00 0.00 C ATOM 358 O SER A 28 10.691 -5.540 -1.429 1.00 0.00 O ATOM 359 CB SER A 28 14.034 -5.582 -0.768 1.00 0.00 C ATOM 360 OG SER A 28 15.004 -6.015 0.169 1.00 0.00 O ATOM 0 H SER A 28 11.711 -7.212 -0.081 1.00 0.00 H new ATOM 0 HA SER A 28 12.791 -4.593 0.681 1.00 0.00 H new ATOM 0 HB2 SER A 28 13.929 -6.326 -1.558 1.00 0.00 H new ATOM 0 HB3 SER A 28 14.368 -4.659 -1.242 1.00 0.00 H new ATOM 0 HG SER A 28 14.785 -6.921 0.471 1.00 0.00 H new ATOM 366 N LYS A 29 11.902 -3.657 -1.641 1.00 0.00 N ATOM 367 CA LYS A 29 11.011 -3.065 -2.632 1.00 0.00 C ATOM 368 C LYS A 29 10.732 -4.046 -3.767 1.00 0.00 C ATOM 369 O LYS A 29 9.607 -4.135 -4.258 1.00 0.00 O ATOM 370 CB LYS A 29 11.623 -1.780 -3.195 1.00 0.00 C ATOM 371 CG LYS A 29 11.993 -0.764 -2.129 1.00 0.00 C ATOM 372 CD LYS A 29 13.292 -0.051 -2.463 1.00 0.00 C ATOM 373 CE LYS A 29 14.326 -0.227 -1.361 1.00 0.00 C ATOM 374 NZ LYS A 29 15.434 0.760 -1.476 1.00 0.00 N ATOM 0 H LYS A 29 12.703 -3.076 -1.394 1.00 0.00 H new ATOM 0 HA LYS A 29 10.068 -2.827 -2.140 1.00 0.00 H new ATOM 0 HB2 LYS A 29 12.515 -2.033 -3.768 1.00 0.00 H new ATOM 0 HB3 LYS A 29 10.916 -1.325 -3.889 1.00 0.00 H new ATOM 0 HG2 LYS A 29 11.191 -0.033 -2.029 1.00 0.00 H new ATOM 0 HG3 LYS A 29 12.090 -1.265 -1.166 1.00 0.00 H new ATOM 0 HD2 LYS A 29 13.690 -0.438 -3.401 1.00 0.00 H new ATOM 0 HD3 LYS A 29 13.097 1.011 -2.614 1.00 0.00 H new ATOM 0 HE2 LYS A 29 13.843 -0.119 -0.390 1.00 0.00 H new ATOM 0 HE3 LYS A 29 14.734 -1.237 -1.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 16.117 0.606 -0.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 15.912 0.641 -2.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 15.049 1.724 -1.409 1.00 0.00 H new ATOM 388 N GLU A 30 11.762 -4.780 -4.177 1.00 0.00 N ATOM 389 CA GLU A 30 11.624 -5.755 -5.252 1.00 0.00 C ATOM 390 C GLU A 30 10.424 -6.666 -5.010 1.00 0.00 C ATOM 391 O GLU A 30 9.708 -7.027 -5.943 1.00 0.00 O ATOM 392 CB GLU A 30 12.898 -6.593 -5.377 1.00 0.00 C ATOM 393 CG GLU A 30 14.062 -5.840 -5.998 1.00 0.00 C ATOM 394 CD GLU A 30 14.993 -5.245 -4.959 1.00 0.00 C ATOM 395 OE1 GLU A 30 15.261 -5.923 -3.944 1.00 0.00 O ATOM 396 OE2 GLU A 30 15.455 -4.103 -5.160 1.00 0.00 O ATOM 0 H GLU A 30 12.700 -4.718 -3.781 1.00 0.00 H new ATOM 0 HA GLU A 30 11.463 -5.211 -6.183 1.00 0.00 H new ATOM 0 HB2 GLU A 30 13.190 -6.945 -4.388 1.00 0.00 H new ATOM 0 HB3 GLU A 30 12.685 -7.476 -5.979 1.00 0.00 H new ATOM 0 HG2 GLU A 30 14.626 -6.516 -6.641 1.00 0.00 H new ATOM 0 HG3 GLU A 30 13.676 -5.043 -6.634 1.00 0.00 H new ATOM 403 N GLU A 31 10.214 -7.036 -3.751 1.00 0.00 N ATOM 404 CA GLU A 31 9.102 -7.907 -3.387 1.00 0.00 C ATOM 405 C GLU A 31 7.832 -7.097 -3.150 1.00 0.00 C ATOM 406 O GLU A 31 6.724 -7.576 -3.393 1.00 0.00 O ATOM 407 CB GLU A 31 9.447 -8.714 -2.132 1.00 0.00 C ATOM 408 CG GLU A 31 10.281 -9.952 -2.416 1.00 0.00 C ATOM 409 CD GLU A 31 9.581 -10.927 -3.343 1.00 0.00 C ATOM 410 OE1 GLU A 31 8.346 -11.070 -3.231 1.00 0.00 O ATOM 411 OE2 GLU A 31 10.270 -11.546 -4.180 1.00 0.00 O ATOM 0 H GLU A 31 10.798 -6.747 -2.967 1.00 0.00 H new ATOM 0 HA GLU A 31 8.925 -8.593 -4.215 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.988 -8.073 -1.435 1.00 0.00 H new ATOM 0 HB3 GLU A 31 8.523 -9.014 -1.637 1.00 0.00 H new ATOM 0 HG2 GLU A 31 11.230 -9.652 -2.860 1.00 0.00 H new ATOM 0 HG3 GLU A 31 10.513 -10.453 -1.476 1.00 0.00 H new ATOM 418 N ILE A 32 8.000 -5.868 -2.673 1.00 0.00 N ATOM 419 CA ILE A 32 6.868 -4.991 -2.405 1.00 0.00 C ATOM 420 C ILE A 32 6.179 -4.571 -3.698 1.00 0.00 C ATOM 421 O ILE A 32 4.996 -4.848 -3.903 1.00 0.00 O ATOM 422 CB ILE A 32 7.302 -3.730 -1.634 1.00 0.00 C ATOM 423 CG1 ILE A 32 7.886 -4.114 -0.272 1.00 0.00 C ATOM 424 CG2 ILE A 32 6.125 -2.782 -1.463 1.00 0.00 C ATOM 425 CD1 ILE A 32 8.447 -2.939 0.497 1.00 0.00 C ATOM 0 H ILE A 32 8.910 -5.457 -2.464 1.00 0.00 H new ATOM 0 HA ILE A 32 6.168 -5.559 -1.792 1.00 0.00 H new ATOM 0 HB ILE A 32 8.074 -3.219 -2.209 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.110 -4.592 0.326 1.00 0.00 H new ATOM 0 HG13 ILE A 32 8.675 -4.852 -0.419 1.00 0.00 H new ATOM 0 HG21 ILE A 32 6.448 -1.896 -0.916 1.00 0.00 H new ATOM 0 HG22 ILE A 32 5.750 -2.487 -2.443 1.00 0.00 H new ATOM 0 HG23 ILE A 32 5.332 -3.283 -0.907 1.00 0.00 H new ATOM 0 HD11 ILE A 32 8.844 -3.285 1.452 1.00 0.00 H new ATOM 0 HD12 ILE A 32 9.246 -2.474 -0.081 1.00 0.00 H new ATOM 0 HD13 ILE A 32 7.657 -2.210 0.675 1.00 0.00 H new ATOM 437 N VAL A 33 6.925 -3.901 -4.569 1.00 0.00 N ATOM 438 CA VAL A 33 6.388 -3.444 -5.845 1.00 0.00 C ATOM 439 C VAL A 33 5.367 -4.433 -6.397 1.00 0.00 C ATOM 440 O VAL A 33 4.280 -4.044 -6.821 1.00 0.00 O ATOM 441 CB VAL A 33 7.506 -3.243 -6.886 1.00 0.00 C ATOM 442 CG1 VAL A 33 6.917 -3.087 -8.279 1.00 0.00 C ATOM 443 CG2 VAL A 33 8.362 -2.039 -6.522 1.00 0.00 C ATOM 0 H VAL A 33 7.904 -3.662 -4.414 1.00 0.00 H new ATOM 0 HA VAL A 33 5.900 -2.487 -5.658 1.00 0.00 H new ATOM 0 HB VAL A 33 8.143 -4.127 -6.884 1.00 0.00 H new ATOM 0 HG11 VAL A 33 7.722 -2.946 -9.001 1.00 0.00 H new ATOM 0 HG12 VAL A 33 6.351 -3.982 -8.537 1.00 0.00 H new ATOM 0 HG13 VAL A 33 6.256 -2.221 -8.299 1.00 0.00 H new ATOM 0 HG21 VAL A 33 9.147 -1.912 -7.268 1.00 0.00 H new ATOM 0 HG22 VAL A 33 7.739 -1.145 -6.494 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.814 -2.197 -5.543 1.00 0.00 H new ATOM 453 N GLN A 34 5.726 -5.713 -6.387 1.00 0.00 N ATOM 454 CA GLN A 34 4.841 -6.758 -6.887 1.00 0.00 C ATOM 455 C GLN A 34 3.704 -7.024 -5.906 1.00 0.00 C ATOM 456 O GLN A 34 2.555 -7.208 -6.306 1.00 0.00 O ATOM 457 CB GLN A 34 5.627 -8.046 -7.136 1.00 0.00 C ATOM 458 CG GLN A 34 6.005 -8.255 -8.594 1.00 0.00 C ATOM 459 CD GLN A 34 4.923 -8.971 -9.379 1.00 0.00 C ATOM 460 OE1 GLN A 34 5.014 -10.173 -9.629 1.00 0.00 O ATOM 461 NE2 GLN A 34 3.892 -8.234 -9.774 1.00 0.00 N ATOM 0 H GLN A 34 6.623 -6.051 -6.038 1.00 0.00 H new ATOM 0 HA GLN A 34 4.412 -6.415 -7.828 1.00 0.00 H new ATOM 0 HB2 GLN A 34 6.535 -8.031 -6.532 1.00 0.00 H new ATOM 0 HB3 GLN A 34 5.034 -8.895 -6.798 1.00 0.00 H new ATOM 0 HG2 GLN A 34 6.205 -7.288 -9.056 1.00 0.00 H new ATOM 0 HG3 GLN A 34 6.929 -8.831 -8.647 1.00 0.00 H new ATOM 0 HE21 GLN A 34 3.857 -7.241 -9.545 1.00 0.00 H new ATOM 0 HE22 GLN A 34 3.134 -8.661 -10.307 1.00 0.00 H new ATOM 470 N PHE A 35 4.033 -7.043 -4.618 1.00 0.00 N ATOM 471 CA PHE A 35 3.040 -7.288 -3.579 1.00 0.00 C ATOM 472 C PHE A 35 1.836 -6.366 -3.750 1.00 0.00 C ATOM 473 O PHE A 35 0.741 -6.662 -3.269 1.00 0.00 O ATOM 474 CB PHE A 35 3.658 -7.086 -2.194 1.00 0.00 C ATOM 475 CG PHE A 35 2.642 -6.876 -1.108 1.00 0.00 C ATOM 476 CD1 PHE A 35 2.041 -7.959 -0.486 1.00 0.00 C ATOM 477 CD2 PHE A 35 2.289 -5.598 -0.710 1.00 0.00 C ATOM 478 CE1 PHE A 35 1.105 -7.769 0.513 1.00 0.00 C ATOM 479 CE2 PHE A 35 1.354 -5.401 0.289 1.00 0.00 C ATOM 480 CZ PHE A 35 0.762 -6.488 0.902 1.00 0.00 C ATOM 0 H PHE A 35 4.980 -6.892 -4.269 1.00 0.00 H new ATOM 0 HA PHE A 35 2.702 -8.320 -3.671 1.00 0.00 H new ATOM 0 HB2 PHE A 35 4.268 -7.955 -1.947 1.00 0.00 H new ATOM 0 HB3 PHE A 35 4.327 -6.226 -2.226 1.00 0.00 H new ATOM 0 HD1 PHE A 35 2.307 -8.962 -0.785 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.750 -4.745 -1.186 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.642 -8.621 0.989 1.00 0.00 H new ATOM 0 HE2 PHE A 35 1.087 -4.399 0.590 1.00 0.00 H new ATOM 0 HZ PHE A 35 0.032 -6.337 1.684 1.00 0.00 H new ATOM 490 N PHE A 36 2.047 -5.248 -4.436 1.00 0.00 N ATOM 491 CA PHE A 36 0.980 -4.281 -4.669 1.00 0.00 C ATOM 492 C PHE A 36 0.541 -4.297 -6.130 1.00 0.00 C ATOM 493 O PHE A 36 0.166 -3.266 -6.688 1.00 0.00 O ATOM 494 CB PHE A 36 1.442 -2.876 -4.279 1.00 0.00 C ATOM 495 CG PHE A 36 1.408 -2.623 -2.798 1.00 0.00 C ATOM 496 CD1 PHE A 36 0.249 -2.844 -2.070 1.00 0.00 C ATOM 497 CD2 PHE A 36 2.534 -2.164 -2.135 1.00 0.00 C ATOM 498 CE1 PHE A 36 0.215 -2.613 -0.709 1.00 0.00 C ATOM 499 CE2 PHE A 36 2.505 -1.931 -0.773 1.00 0.00 C ATOM 500 CZ PHE A 36 1.344 -2.154 -0.059 1.00 0.00 C ATOM 0 H PHE A 36 2.947 -4.989 -4.840 1.00 0.00 H new ATOM 0 HA PHE A 36 0.128 -4.561 -4.049 1.00 0.00 H new ATOM 0 HB2 PHE A 36 2.458 -2.722 -4.643 1.00 0.00 H new ATOM 0 HB3 PHE A 36 0.810 -2.142 -4.779 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -0.637 -3.201 -2.573 1.00 0.00 H new ATOM 0 HD2 PHE A 36 3.444 -1.986 -2.688 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -0.694 -2.791 -0.153 1.00 0.00 H new ATOM 0 HE2 PHE A 36 3.390 -1.575 -0.267 1.00 0.00 H new ATOM 0 HZ PHE A 36 1.319 -1.970 1.005 1.00 0.00 H new ATOM 510 N SER A 37 0.592 -5.475 -6.744 1.00 0.00 N ATOM 511 CA SER A 37 0.204 -5.626 -8.142 1.00 0.00 C ATOM 512 C SER A 37 -1.094 -4.877 -8.429 1.00 0.00 C ATOM 513 O SER A 37 -2.001 -4.845 -7.599 1.00 0.00 O ATOM 514 CB SER A 37 0.041 -7.106 -8.492 1.00 0.00 C ATOM 515 OG SER A 37 -1.221 -7.593 -8.072 1.00 0.00 O ATOM 0 H SER A 37 0.898 -6.339 -6.296 1.00 0.00 H new ATOM 0 HA SER A 37 0.994 -5.200 -8.761 1.00 0.00 H new ATOM 0 HB2 SER A 37 0.147 -7.242 -9.568 1.00 0.00 H new ATOM 0 HB3 SER A 37 0.834 -7.685 -8.018 1.00 0.00 H new ATOM 0 HG SER A 37 -1.301 -8.541 -8.309 1.00 0.00 H new ATOM 521 N GLY A 38 -1.175 -4.277 -9.612 1.00 0.00 N ATOM 522 CA GLY A 38 -2.365 -3.537 -9.991 1.00 0.00 C ATOM 523 C GLY A 38 -2.340 -2.106 -9.493 1.00 0.00 C ATOM 524 O GLY A 38 -3.003 -1.234 -10.054 1.00 0.00 O ATOM 0 H GLY A 38 -0.437 -4.290 -10.316 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -2.460 -3.539 -11.077 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.245 -4.042 -9.593 1.00 0.00 H new ATOM 528 N LEU A 39 -1.574 -1.862 -8.435 1.00 0.00 N ATOM 529 CA LEU A 39 -1.466 -0.525 -7.861 1.00 0.00 C ATOM 530 C LEU A 39 -0.267 0.221 -8.438 1.00 0.00 C ATOM 531 O LEU A 39 0.710 -0.393 -8.864 1.00 0.00 O ATOM 532 CB LEU A 39 -1.343 -0.612 -6.338 1.00 0.00 C ATOM 533 CG LEU A 39 -2.504 -1.285 -5.607 1.00 0.00 C ATOM 534 CD1 LEU A 39 -2.040 -1.852 -4.275 1.00 0.00 C ATOM 535 CD2 LEU A 39 -3.647 -0.301 -5.402 1.00 0.00 C ATOM 0 H LEU A 39 -1.019 -2.572 -7.957 1.00 0.00 H new ATOM 0 HA LEU A 39 -2.370 0.028 -8.116 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -0.427 -1.152 -6.098 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -1.229 0.398 -5.945 1.00 0.00 H new ATOM 0 HG LEU A 39 -2.866 -2.109 -6.222 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -2.881 -2.327 -3.769 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -1.256 -2.589 -4.447 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.650 -1.046 -3.653 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -4.465 -0.797 -4.880 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -3.298 0.544 -4.809 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -3.998 0.056 -6.370 1.00 0.00 H new ATOM 547 N GLU A 40 -0.350 1.547 -8.446 1.00 0.00 N ATOM 548 CA GLU A 40 0.729 2.377 -8.970 1.00 0.00 C ATOM 549 C GLU A 40 1.415 3.150 -7.848 1.00 0.00 C ATOM 550 O GLU A 40 0.787 3.961 -7.166 1.00 0.00 O ATOM 551 CB GLU A 40 0.191 3.350 -10.020 1.00 0.00 C ATOM 552 CG GLU A 40 1.134 4.502 -10.322 1.00 0.00 C ATOM 553 CD GLU A 40 0.587 5.442 -11.379 1.00 0.00 C ATOM 554 OE1 GLU A 40 0.304 4.972 -12.501 1.00 0.00 O ATOM 555 OE2 GLU A 40 0.442 6.647 -11.085 1.00 0.00 O ATOM 0 H GLU A 40 -1.153 2.070 -8.096 1.00 0.00 H new ATOM 0 HA GLU A 40 1.463 1.720 -9.437 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -0.008 2.803 -10.942 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -0.762 3.752 -9.676 1.00 0.00 H new ATOM 0 HG2 GLU A 40 1.323 5.062 -9.406 1.00 0.00 H new ATOM 0 HG3 GLU A 40 2.092 4.104 -10.656 1.00 0.00 H new ATOM 562 N ILE A 41 2.705 2.894 -7.662 1.00 0.00 N ATOM 563 CA ILE A 41 3.476 3.566 -6.623 1.00 0.00 C ATOM 564 C ILE A 41 4.531 4.485 -7.230 1.00 0.00 C ATOM 565 O ILE A 41 4.964 4.288 -8.365 1.00 0.00 O ATOM 566 CB ILE A 41 4.168 2.554 -5.691 1.00 0.00 C ATOM 567 CG1 ILE A 41 3.184 1.460 -5.269 1.00 0.00 C ATOM 568 CG2 ILE A 41 4.738 3.261 -4.471 1.00 0.00 C ATOM 569 CD1 ILE A 41 3.854 0.158 -4.890 1.00 0.00 C ATOM 0 H ILE A 41 3.239 2.226 -8.217 1.00 0.00 H new ATOM 0 HA ILE A 41 2.771 4.160 -6.041 1.00 0.00 H new ATOM 0 HB ILE A 41 4.990 2.087 -6.233 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.597 1.817 -4.423 1.00 0.00 H new ATOM 0 HG13 ILE A 41 2.486 1.276 -6.086 1.00 0.00 H new ATOM 0 HG21 ILE A 41 5.224 2.532 -3.822 1.00 0.00 H new ATOM 0 HG22 ILE A 41 5.467 4.006 -4.790 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.932 3.752 -3.926 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.096 -0.571 -4.602 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.418 -0.222 -5.742 1.00 0.00 H new ATOM 0 HD13 ILE A 41 4.531 0.327 -4.053 1.00 0.00 H new ATOM 581 N VAL A 42 4.942 5.491 -6.464 1.00 0.00 N ATOM 582 CA VAL A 42 5.948 6.440 -6.924 1.00 0.00 C ATOM 583 C VAL A 42 7.346 5.839 -6.847 1.00 0.00 C ATOM 584 O VAL A 42 7.657 5.039 -5.963 1.00 0.00 O ATOM 585 CB VAL A 42 5.914 7.740 -6.097 1.00 0.00 C ATOM 586 CG1 VAL A 42 4.669 8.549 -6.426 1.00 0.00 C ATOM 587 CG2 VAL A 42 5.978 7.426 -4.610 1.00 0.00 C ATOM 0 H VAL A 42 4.593 5.669 -5.522 1.00 0.00 H new ATOM 0 HA VAL A 42 5.712 6.672 -7.962 1.00 0.00 H new ATOM 0 HB VAL A 42 6.787 8.339 -6.357 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.662 9.463 -5.833 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.670 8.804 -7.486 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.781 7.960 -6.196 1.00 0.00 H new ATOM 0 HG21 VAL A 42 5.953 8.355 -4.041 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.125 6.807 -4.332 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.902 6.891 -4.391 1.00 0.00 H new ATOM 597 N PRO A 43 8.213 6.232 -7.793 1.00 0.00 N ATOM 598 CA PRO A 43 9.595 5.744 -7.853 1.00 0.00 C ATOM 599 C PRO A 43 10.448 6.280 -6.709 1.00 0.00 C ATOM 600 O PRO A 43 10.645 7.487 -6.583 1.00 0.00 O ATOM 601 CB PRO A 43 10.101 6.278 -9.195 1.00 0.00 C ATOM 602 CG PRO A 43 9.262 7.478 -9.465 1.00 0.00 C ATOM 603 CD PRO A 43 7.910 7.182 -8.876 1.00 0.00 C ATOM 0 HA PRO A 43 9.650 4.659 -7.763 1.00 0.00 H new ATOM 0 HB2 PRO A 43 11.158 6.537 -9.145 1.00 0.00 H new ATOM 0 HB3 PRO A 43 9.993 5.533 -9.984 1.00 0.00 H new ATOM 0 HG2 PRO A 43 9.698 8.368 -9.012 1.00 0.00 H new ATOM 0 HG3 PRO A 43 9.188 7.669 -10.536 1.00 0.00 H new ATOM 0 HD2 PRO A 43 7.430 8.084 -8.497 1.00 0.00 H new ATOM 0 HD3 PRO A 43 7.236 6.748 -9.614 1.00 0.00 H new ATOM 611 N ASN A 44 10.954 5.373 -5.879 1.00 0.00 N ATOM 612 CA ASN A 44 11.788 5.756 -4.746 1.00 0.00 C ATOM 613 C ASN A 44 10.932 6.234 -3.577 1.00 0.00 C ATOM 614 O ASN A 44 11.383 7.017 -2.742 1.00 0.00 O ATOM 615 CB ASN A 44 12.770 6.855 -5.157 1.00 0.00 C ATOM 616 CG ASN A 44 14.018 6.867 -4.295 1.00 0.00 C ATOM 617 OD1 ASN A 44 13.940 6.947 -3.069 1.00 0.00 O ATOM 618 ND2 ASN A 44 15.179 6.786 -4.935 1.00 0.00 N ATOM 0 H ASN A 44 10.801 4.369 -5.970 1.00 0.00 H new ATOM 0 HA ASN A 44 12.349 4.878 -4.427 1.00 0.00 H new ATOM 0 HB2 ASN A 44 13.053 6.714 -6.200 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.276 7.824 -5.089 1.00 0.00 H new ATOM 0 HD21 ASN A 44 16.053 6.789 -4.409 1.00 0.00 H new ATOM 0 HD22 ASN A 44 15.197 6.721 -5.953 1.00 0.00 H new ATOM 625 N GLY A 45 9.692 5.757 -3.524 1.00 0.00 N ATOM 626 CA GLY A 45 8.792 6.146 -2.454 1.00 0.00 C ATOM 627 C GLY A 45 8.596 5.045 -1.431 1.00 0.00 C ATOM 628 O GLY A 45 7.481 4.810 -0.968 1.00 0.00 O ATOM 0 H GLY A 45 9.295 5.108 -4.203 1.00 0.00 H new ATOM 0 HA2 GLY A 45 9.185 7.033 -1.957 1.00 0.00 H new ATOM 0 HA3 GLY A 45 7.826 6.420 -2.878 1.00 0.00 H new ATOM 632 N MET A 46 9.684 4.367 -1.080 1.00 0.00 N ATOM 633 CA MET A 46 9.627 3.283 -0.106 1.00 0.00 C ATOM 634 C MET A 46 10.765 3.397 0.902 1.00 0.00 C ATOM 635 O MET A 46 11.903 3.694 0.538 1.00 0.00 O ATOM 636 CB MET A 46 9.690 1.928 -0.813 1.00 0.00 C ATOM 637 CG MET A 46 8.410 1.567 -1.551 1.00 0.00 C ATOM 638 SD MET A 46 8.415 -0.130 -2.158 1.00 0.00 S ATOM 639 CE MET A 46 7.627 0.078 -3.753 1.00 0.00 C ATOM 0 H MET A 46 10.615 4.549 -1.455 1.00 0.00 H new ATOM 0 HA MET A 46 8.681 3.361 0.430 1.00 0.00 H new ATOM 0 HB2 MET A 46 10.518 1.935 -1.521 1.00 0.00 H new ATOM 0 HB3 MET A 46 9.906 1.153 -0.077 1.00 0.00 H new ATOM 0 HG2 MET A 46 7.559 1.708 -0.885 1.00 0.00 H new ATOM 0 HG3 MET A 46 8.274 2.249 -2.391 1.00 0.00 H new ATOM 0 HE1 MET A 46 7.253 -0.884 -4.102 1.00 0.00 H new ATOM 0 HE2 MET A 46 6.797 0.778 -3.660 1.00 0.00 H new ATOM 0 HE3 MET A 46 8.351 0.467 -4.469 1.00 0.00 H new ATOM 649 N THR A 47 10.452 3.161 2.173 1.00 0.00 N ATOM 650 CA THR A 47 11.449 3.239 3.233 1.00 0.00 C ATOM 651 C THR A 47 11.488 1.951 4.046 1.00 0.00 C ATOM 652 O THR A 47 10.452 1.445 4.480 1.00 0.00 O ATOM 653 CB THR A 47 11.170 4.422 4.180 1.00 0.00 C ATOM 654 OG1 THR A 47 11.323 5.659 3.476 1.00 0.00 O ATOM 655 CG2 THR A 47 12.112 4.392 5.374 1.00 0.00 C ATOM 0 H THR A 47 9.515 2.914 2.493 1.00 0.00 H new ATOM 0 HA THR A 47 12.414 3.390 2.749 1.00 0.00 H new ATOM 0 HB THR A 47 10.146 4.335 4.543 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.142 6.406 4.084 1.00 0.00 H new ATOM 0 HG21 THR A 47 11.897 5.236 6.029 1.00 0.00 H new ATOM 0 HG22 THR A 47 11.973 3.461 5.924 1.00 0.00 H new ATOM 0 HG23 THR A 47 13.143 4.457 5.026 1.00 0.00 H new ATOM 663 N LEU A 48 12.690 1.422 4.250 1.00 0.00 N ATOM 664 CA LEU A 48 12.865 0.191 5.013 1.00 0.00 C ATOM 665 C LEU A 48 13.984 0.340 6.039 1.00 0.00 C ATOM 666 O LEU A 48 15.161 0.132 5.745 1.00 0.00 O ATOM 667 CB LEU A 48 13.171 -0.976 4.073 1.00 0.00 C ATOM 668 CG LEU A 48 11.975 -1.825 3.644 1.00 0.00 C ATOM 669 CD1 LEU A 48 11.745 -1.706 2.146 1.00 0.00 C ATOM 670 CD2 LEU A 48 12.184 -3.280 4.039 1.00 0.00 C ATOM 0 H LEU A 48 13.558 1.826 3.898 1.00 0.00 H new ATOM 0 HA LEU A 48 11.935 -0.013 5.544 1.00 0.00 H new ATOM 0 HB2 LEU A 48 13.649 -0.579 3.177 1.00 0.00 H new ATOM 0 HB3 LEU A 48 13.897 -1.627 4.560 1.00 0.00 H new ATOM 0 HG LEU A 48 11.088 -1.453 4.158 1.00 0.00 H new ATOM 0 HD11 LEU A 48 10.889 -2.318 1.860 1.00 0.00 H new ATOM 0 HD12 LEU A 48 11.549 -0.665 1.890 1.00 0.00 H new ATOM 0 HD13 LEU A 48 12.631 -2.050 1.613 1.00 0.00 H new ATOM 0 HD21 LEU A 48 11.322 -3.869 3.726 1.00 0.00 H new ATOM 0 HD22 LEU A 48 13.082 -3.663 3.554 1.00 0.00 H new ATOM 0 HD23 LEU A 48 12.298 -3.351 5.121 1.00 0.00 H new ATOM 682 N PRO A 49 13.610 0.707 7.273 1.00 0.00 N ATOM 683 CA PRO A 49 14.567 0.890 8.368 1.00 0.00 C ATOM 684 C PRO A 49 15.170 -0.430 8.838 1.00 0.00 C ATOM 685 O PRO A 49 14.776 -1.501 8.379 1.00 0.00 O ATOM 686 CB PRO A 49 13.720 1.516 9.480 1.00 0.00 C ATOM 687 CG PRO A 49 12.328 1.067 9.193 1.00 0.00 C ATOM 688 CD PRO A 49 12.225 0.972 7.696 1.00 0.00 C ATOM 0 HA PRO A 49 15.418 1.501 8.067 1.00 0.00 H new ATOM 0 HB2 PRO A 49 14.049 1.182 10.464 1.00 0.00 H new ATOM 0 HB3 PRO A 49 13.795 2.603 9.471 1.00 0.00 H new ATOM 0 HG2 PRO A 49 12.124 0.104 9.660 1.00 0.00 H new ATOM 0 HG3 PRO A 49 11.600 1.774 9.590 1.00 0.00 H new ATOM 0 HD2 PRO A 49 11.552 0.171 7.390 1.00 0.00 H new ATOM 0 HD3 PRO A 49 11.842 1.895 7.261 1.00 0.00 H new ATOM 696 N VAL A 50 16.128 -0.345 9.755 1.00 0.00 N ATOM 697 CA VAL A 50 16.784 -1.533 10.288 1.00 0.00 C ATOM 698 C VAL A 50 17.196 -1.328 11.741 1.00 0.00 C ATOM 699 O VAL A 50 17.026 -0.244 12.299 1.00 0.00 O ATOM 700 CB VAL A 50 18.029 -1.905 9.461 1.00 0.00 C ATOM 701 CG1 VAL A 50 17.622 -2.461 8.105 1.00 0.00 C ATOM 702 CG2 VAL A 50 18.942 -0.698 9.300 1.00 0.00 C ATOM 0 H VAL A 50 16.467 0.535 10.145 1.00 0.00 H new ATOM 0 HA VAL A 50 16.061 -2.347 10.230 1.00 0.00 H new ATOM 0 HB VAL A 50 18.580 -2.680 9.994 1.00 0.00 H new ATOM 0 HG11 VAL A 50 18.514 -2.718 7.535 1.00 0.00 H new ATOM 0 HG12 VAL A 50 17.012 -3.353 8.246 1.00 0.00 H new ATOM 0 HG13 VAL A 50 17.048 -1.711 7.562 1.00 0.00 H new ATOM 0 HG21 VAL A 50 19.817 -0.979 8.713 1.00 0.00 H new ATOM 0 HG22 VAL A 50 18.403 0.100 8.789 1.00 0.00 H new ATOM 0 HG23 VAL A 50 19.261 -0.349 10.282 1.00 0.00 H new ATOM 712 N ASP A 51 17.739 -2.376 12.350 1.00 0.00 N ATOM 713 CA ASP A 51 18.178 -2.312 13.739 1.00 0.00 C ATOM 714 C ASP A 51 19.618 -1.817 13.832 1.00 0.00 C ATOM 715 O ASP A 51 20.138 -1.211 12.896 1.00 0.00 O ATOM 716 CB ASP A 51 18.053 -3.686 14.400 1.00 0.00 C ATOM 717 CG ASP A 51 17.587 -3.596 15.839 1.00 0.00 C ATOM 718 OD1 ASP A 51 16.392 -3.303 16.060 1.00 0.00 O ATOM 719 OD2 ASP A 51 18.416 -3.819 16.747 1.00 0.00 O ATOM 0 H ASP A 51 17.886 -3.281 11.903 1.00 0.00 H new ATOM 0 HA ASP A 51 17.536 -1.605 14.265 1.00 0.00 H new ATOM 0 HB2 ASP A 51 17.352 -4.297 13.832 1.00 0.00 H new ATOM 0 HB3 ASP A 51 19.018 -4.192 14.365 1.00 0.00 H new ATOM 724 N PHE A 52 20.255 -2.079 14.969 1.00 0.00 N ATOM 725 CA PHE A 52 21.634 -1.659 15.186 1.00 0.00 C ATOM 726 C PHE A 52 22.606 -2.597 14.476 1.00 0.00 C ATOM 727 O PHE A 52 23.805 -2.324 14.399 1.00 0.00 O ATOM 728 CB PHE A 52 21.949 -1.618 16.682 1.00 0.00 C ATOM 729 CG PHE A 52 23.398 -1.362 16.984 1.00 0.00 C ATOM 730 CD1 PHE A 52 23.875 -0.066 17.104 1.00 0.00 C ATOM 731 CD2 PHE A 52 24.282 -2.416 17.148 1.00 0.00 C ATOM 732 CE1 PHE A 52 25.208 0.172 17.381 1.00 0.00 C ATOM 733 CE2 PHE A 52 25.616 -2.183 17.426 1.00 0.00 C ATOM 734 CZ PHE A 52 26.079 -0.888 17.543 1.00 0.00 C ATOM 0 H PHE A 52 19.838 -2.580 15.754 1.00 0.00 H new ATOM 0 HA PHE A 52 21.752 -0.658 14.770 1.00 0.00 H new ATOM 0 HB2 PHE A 52 21.346 -0.840 17.151 1.00 0.00 H new ATOM 0 HB3 PHE A 52 21.654 -2.565 17.133 1.00 0.00 H new ATOM 0 HD1 PHE A 52 23.198 0.766 16.980 1.00 0.00 H new ATOM 0 HD2 PHE A 52 23.925 -3.431 17.058 1.00 0.00 H new ATOM 0 HE1 PHE A 52 25.568 1.186 17.471 1.00 0.00 H new ATOM 0 HE2 PHE A 52 26.295 -3.013 17.551 1.00 0.00 H new ATOM 0 HZ PHE A 52 27.121 -0.704 17.761 1.00 0.00 H new ATOM 744 N GLN A 53 22.081 -3.703 13.959 1.00 0.00 N ATOM 745 CA GLN A 53 22.903 -4.681 13.256 1.00 0.00 C ATOM 746 C GLN A 53 22.632 -4.643 11.756 1.00 0.00 C ATOM 747 O GLN A 53 23.300 -5.322 10.977 1.00 0.00 O ATOM 748 CB GLN A 53 22.636 -6.087 13.799 1.00 0.00 C ATOM 749 CG GLN A 53 23.175 -6.309 15.202 1.00 0.00 C ATOM 750 CD GLN A 53 22.718 -7.624 15.802 1.00 0.00 C ATOM 751 OE1 GLN A 53 22.155 -8.472 15.110 1.00 0.00 O ATOM 752 NE2 GLN A 53 22.959 -7.801 17.096 1.00 0.00 N ATOM 0 H GLN A 53 21.091 -3.944 14.014 1.00 0.00 H new ATOM 0 HA GLN A 53 23.949 -4.426 13.424 1.00 0.00 H new ATOM 0 HB2 GLN A 53 21.561 -6.270 13.798 1.00 0.00 H new ATOM 0 HB3 GLN A 53 23.084 -6.818 13.127 1.00 0.00 H new ATOM 0 HG2 GLN A 53 24.264 -6.285 15.176 1.00 0.00 H new ATOM 0 HG3 GLN A 53 22.853 -5.490 15.845 1.00 0.00 H new ATOM 0 HE21 GLN A 53 23.429 -7.071 17.632 1.00 0.00 H new ATOM 0 HE22 GLN A 53 22.674 -8.667 17.554 1.00 0.00 H new ATOM 761 N GLY A 54 21.646 -3.845 11.357 1.00 0.00 N ATOM 762 CA GLY A 54 21.304 -3.733 9.952 1.00 0.00 C ATOM 763 C GLY A 54 20.318 -4.797 9.509 1.00 0.00 C ATOM 764 O GLY A 54 20.236 -5.122 8.325 1.00 0.00 O ATOM 0 H GLY A 54 21.078 -3.274 11.983 1.00 0.00 H new ATOM 0 HA2 GLY A 54 20.880 -2.747 9.762 1.00 0.00 H new ATOM 0 HA3 GLY A 54 22.211 -3.811 9.353 1.00 0.00 H new ATOM 768 N ARG A 55 19.571 -5.342 10.462 1.00 0.00 N ATOM 769 CA ARG A 55 18.588 -6.377 10.165 1.00 0.00 C ATOM 770 C ARG A 55 17.191 -5.779 10.035 1.00 0.00 C ATOM 771 O ARG A 55 16.719 -5.079 10.930 1.00 0.00 O ATOM 772 CB ARG A 55 18.596 -7.448 11.258 1.00 0.00 C ATOM 773 CG ARG A 55 17.526 -7.245 12.317 1.00 0.00 C ATOM 774 CD ARG A 55 17.639 -8.278 13.428 1.00 0.00 C ATOM 775 NE ARG A 55 16.691 -8.023 14.510 1.00 0.00 N ATOM 776 CZ ARG A 55 16.844 -8.487 15.746 1.00 0.00 C ATOM 777 NH1 ARG A 55 17.901 -9.225 16.053 1.00 0.00 N ATOM 778 NH2 ARG A 55 15.938 -8.213 16.675 1.00 0.00 N ATOM 0 H ARG A 55 19.627 -5.084 11.447 1.00 0.00 H new ATOM 0 HA ARG A 55 18.858 -6.836 9.214 1.00 0.00 H new ATOM 0 HB2 ARG A 55 18.458 -8.426 10.797 1.00 0.00 H new ATOM 0 HB3 ARG A 55 19.574 -7.457 11.739 1.00 0.00 H new ATOM 0 HG2 ARG A 55 17.615 -6.244 12.739 1.00 0.00 H new ATOM 0 HG3 ARG A 55 16.540 -7.310 11.857 1.00 0.00 H new ATOM 0 HD2 ARG A 55 17.462 -9.272 13.018 1.00 0.00 H new ATOM 0 HD3 ARG A 55 18.654 -8.273 13.826 1.00 0.00 H new ATOM 0 HE ARG A 55 15.867 -7.458 14.306 1.00 0.00 H new ATOM 0 HH11 ARG A 55 18.599 -9.438 15.340 1.00 0.00 H new ATOM 0 HH12 ARG A 55 18.017 -9.580 17.002 1.00 0.00 H new ATOM 0 HH21 ARG A 55 15.123 -7.646 16.441 1.00 0.00 H new ATOM 0 HH22 ARG A 55 16.056 -8.569 17.623 1.00 0.00 H new ATOM 792 N SER A 56 16.534 -6.059 8.913 1.00 0.00 N ATOM 793 CA SER A 56 15.193 -5.546 8.664 1.00 0.00 C ATOM 794 C SER A 56 14.381 -5.495 9.955 1.00 0.00 C ATOM 795 O SER A 56 14.363 -6.453 10.730 1.00 0.00 O ATOM 796 CB SER A 56 14.474 -6.416 7.631 1.00 0.00 C ATOM 797 OG SER A 56 14.403 -7.764 8.062 1.00 0.00 O ATOM 0 H SER A 56 16.910 -6.639 8.162 1.00 0.00 H new ATOM 0 HA SER A 56 15.286 -4.533 8.274 1.00 0.00 H new ATOM 0 HB2 SER A 56 13.468 -6.031 7.463 1.00 0.00 H new ATOM 0 HB3 SER A 56 14.999 -6.363 6.677 1.00 0.00 H new ATOM 0 HG SER A 56 13.938 -8.300 7.386 1.00 0.00 H new ATOM 803 N THR A 57 13.711 -4.370 10.181 1.00 0.00 N ATOM 804 CA THR A 57 12.899 -4.191 11.378 1.00 0.00 C ATOM 805 C THR A 57 11.468 -4.663 11.148 1.00 0.00 C ATOM 806 O THR A 57 10.550 -4.269 11.867 1.00 0.00 O ATOM 807 CB THR A 57 12.875 -2.718 11.827 1.00 0.00 C ATOM 808 OG1 THR A 57 12.716 -1.862 10.690 1.00 0.00 O ATOM 809 CG2 THR A 57 14.155 -2.356 12.566 1.00 0.00 C ATOM 0 H THR A 57 13.715 -3.568 9.550 1.00 0.00 H new ATOM 0 HA THR A 57 13.357 -4.794 12.162 1.00 0.00 H new ATOM 0 HB THR A 57 12.032 -2.582 12.505 1.00 0.00 H new ATOM 0 HG1 THR A 57 11.810 -1.962 10.330 1.00 0.00 H new ATOM 0 HG21 THR A 57 14.115 -1.311 12.873 1.00 0.00 H new ATOM 0 HG22 THR A 57 14.258 -2.989 13.447 1.00 0.00 H new ATOM 0 HG23 THR A 57 15.010 -2.508 11.908 1.00 0.00 H new ATOM 817 N GLY A 58 11.285 -5.510 10.140 1.00 0.00 N ATOM 818 CA GLY A 58 9.962 -6.022 9.832 1.00 0.00 C ATOM 819 C GLY A 58 8.957 -4.916 9.576 1.00 0.00 C ATOM 820 O GLY A 58 7.748 -5.142 9.633 1.00 0.00 O ATOM 0 H GLY A 58 12.029 -5.851 9.531 1.00 0.00 H new ATOM 0 HA2 GLY A 58 10.020 -6.666 8.954 1.00 0.00 H new ATOM 0 HA3 GLY A 58 9.614 -6.641 10.659 1.00 0.00 H new ATOM 824 N GLU A 59 9.458 -3.717 9.294 1.00 0.00 N ATOM 825 CA GLU A 59 8.594 -2.572 9.031 1.00 0.00 C ATOM 826 C GLU A 59 9.032 -1.840 7.766 1.00 0.00 C ATOM 827 O GLU A 59 10.208 -1.858 7.401 1.00 0.00 O ATOM 828 CB GLU A 59 8.608 -1.611 10.221 1.00 0.00 C ATOM 829 CG GLU A 59 7.866 -2.138 11.438 1.00 0.00 C ATOM 830 CD GLU A 59 8.281 -1.442 12.719 1.00 0.00 C ATOM 831 OE1 GLU A 59 8.240 -0.194 12.758 1.00 0.00 O ATOM 832 OE2 GLU A 59 8.645 -2.146 13.685 1.00 0.00 O ATOM 0 H GLU A 59 10.456 -3.514 9.242 1.00 0.00 H new ATOM 0 HA GLU A 59 7.579 -2.941 8.883 1.00 0.00 H new ATOM 0 HB2 GLU A 59 9.642 -1.404 10.498 1.00 0.00 H new ATOM 0 HB3 GLU A 59 8.163 -0.663 9.917 1.00 0.00 H new ATOM 0 HG2 GLU A 59 6.794 -2.009 11.289 1.00 0.00 H new ATOM 0 HG3 GLU A 59 8.048 -3.208 11.535 1.00 0.00 H new ATOM 839 N ALA A 60 8.078 -1.197 7.100 1.00 0.00 N ATOM 840 CA ALA A 60 8.365 -0.457 5.878 1.00 0.00 C ATOM 841 C ALA A 60 7.270 0.563 5.584 1.00 0.00 C ATOM 842 O ALA A 60 6.132 0.413 6.029 1.00 0.00 O ATOM 843 CB ALA A 60 8.525 -1.416 4.706 1.00 0.00 C ATOM 0 H ALA A 60 7.099 -1.174 7.387 1.00 0.00 H new ATOM 0 HA ALA A 60 9.300 0.084 6.021 1.00 0.00 H new ATOM 0 HB1 ALA A 60 8.739 -0.850 3.799 1.00 0.00 H new ATOM 0 HB2 ALA A 60 9.347 -2.103 4.908 1.00 0.00 H new ATOM 0 HB3 ALA A 60 7.604 -1.982 4.571 1.00 0.00 H new ATOM 849 N PHE A 61 7.622 1.600 4.832 1.00 0.00 N ATOM 850 CA PHE A 61 6.669 2.647 4.480 1.00 0.00 C ATOM 851 C PHE A 61 6.617 2.849 2.968 1.00 0.00 C ATOM 852 O PHE A 61 7.625 3.171 2.340 1.00 0.00 O ATOM 853 CB PHE A 61 7.044 3.961 5.169 1.00 0.00 C ATOM 854 CG PHE A 61 6.995 3.886 6.668 1.00 0.00 C ATOM 855 CD1 PHE A 61 5.814 4.132 7.350 1.00 0.00 C ATOM 856 CD2 PHE A 61 8.130 3.569 7.398 1.00 0.00 C ATOM 857 CE1 PHE A 61 5.766 4.065 8.729 1.00 0.00 C ATOM 858 CE2 PHE A 61 8.089 3.501 8.777 1.00 0.00 C ATOM 859 CZ PHE A 61 6.904 3.748 9.444 1.00 0.00 C ATOM 0 H PHE A 61 8.559 1.738 4.455 1.00 0.00 H new ATOM 0 HA PHE A 61 5.682 2.335 4.822 1.00 0.00 H new ATOM 0 HB2 PHE A 61 8.048 4.250 4.860 1.00 0.00 H new ATOM 0 HB3 PHE A 61 6.368 4.746 4.830 1.00 0.00 H new ATOM 0 HD1 PHE A 61 4.920 4.379 6.797 1.00 0.00 H new ATOM 0 HD2 PHE A 61 9.058 3.373 6.882 1.00 0.00 H new ATOM 0 HE1 PHE A 61 4.839 4.260 9.248 1.00 0.00 H new ATOM 0 HE2 PHE A 61 8.982 3.255 9.333 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.868 3.693 10.522 1.00 0.00 H new ATOM 869 N VAL A 62 5.435 2.657 2.392 1.00 0.00 N ATOM 870 CA VAL A 62 5.250 2.818 0.955 1.00 0.00 C ATOM 871 C VAL A 62 4.392 4.039 0.645 1.00 0.00 C ATOM 872 O VAL A 62 3.416 4.317 1.343 1.00 0.00 O ATOM 873 CB VAL A 62 4.595 1.573 0.330 1.00 0.00 C ATOM 874 CG1 VAL A 62 4.545 1.699 -1.186 1.00 0.00 C ATOM 875 CG2 VAL A 62 5.343 0.314 0.743 1.00 0.00 C ATOM 0 H VAL A 62 4.591 2.390 2.899 1.00 0.00 H new ATOM 0 HA VAL A 62 6.241 2.954 0.522 1.00 0.00 H new ATOM 0 HB VAL A 62 3.572 1.499 0.699 1.00 0.00 H new ATOM 0 HG11 VAL A 62 4.079 0.810 -1.610 1.00 0.00 H new ATOM 0 HG12 VAL A 62 3.963 2.579 -1.459 1.00 0.00 H new ATOM 0 HG13 VAL A 62 5.558 1.799 -1.576 1.00 0.00 H new ATOM 0 HG21 VAL A 62 4.867 -0.557 0.292 1.00 0.00 H new ATOM 0 HG22 VAL A 62 6.377 0.378 0.404 1.00 0.00 H new ATOM 0 HG23 VAL A 62 5.322 0.218 1.829 1.00 0.00 H new ATOM 885 N GLN A 63 4.761 4.765 -0.406 1.00 0.00 N ATOM 886 CA GLN A 63 4.024 5.957 -0.807 1.00 0.00 C ATOM 887 C GLN A 63 3.440 5.791 -2.207 1.00 0.00 C ATOM 888 O GLN A 63 4.154 5.892 -3.204 1.00 0.00 O ATOM 889 CB GLN A 63 4.936 7.185 -0.766 1.00 0.00 C ATOM 890 CG GLN A 63 4.249 8.469 -1.202 1.00 0.00 C ATOM 891 CD GLN A 63 5.213 9.632 -1.329 1.00 0.00 C ATOM 892 OE1 GLN A 63 6.371 9.541 -0.920 1.00 0.00 O ATOM 893 NE2 GLN A 63 4.738 10.734 -1.897 1.00 0.00 N ATOM 0 H GLN A 63 5.565 4.548 -0.994 1.00 0.00 H new ATOM 0 HA GLN A 63 3.203 6.099 -0.104 1.00 0.00 H new ATOM 0 HB2 GLN A 63 5.315 7.312 0.248 1.00 0.00 H new ATOM 0 HB3 GLN A 63 5.798 7.008 -1.409 1.00 0.00 H new ATOM 0 HG2 GLN A 63 3.755 8.305 -2.160 1.00 0.00 H new ATOM 0 HG3 GLN A 63 3.472 8.723 -0.482 1.00 0.00 H new ATOM 0 HE21 GLN A 63 3.771 10.765 -2.221 1.00 0.00 H new ATOM 0 HE22 GLN A 63 5.340 11.550 -2.009 1.00 0.00 H new ATOM 902 N PHE A 64 2.138 5.533 -2.271 1.00 0.00 N ATOM 903 CA PHE A 64 1.458 5.351 -3.549 1.00 0.00 C ATOM 904 C PHE A 64 1.422 6.656 -4.338 1.00 0.00 C ATOM 905 O PHE A 64 1.829 7.706 -3.840 1.00 0.00 O ATOM 906 CB PHE A 64 0.033 4.839 -3.324 1.00 0.00 C ATOM 907 CG PHE A 64 -0.027 3.393 -2.921 1.00 0.00 C ATOM 908 CD1 PHE A 64 0.099 2.390 -3.869 1.00 0.00 C ATOM 909 CD2 PHE A 64 -0.209 3.036 -1.594 1.00 0.00 C ATOM 910 CE1 PHE A 64 0.043 1.059 -3.501 1.00 0.00 C ATOM 911 CE2 PHE A 64 -0.266 1.707 -1.220 1.00 0.00 C ATOM 912 CZ PHE A 64 -0.139 0.717 -2.176 1.00 0.00 C ATOM 0 H PHE A 64 1.533 5.445 -1.454 1.00 0.00 H new ATOM 0 HA PHE A 64 2.016 4.614 -4.126 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -0.444 5.443 -2.552 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.543 4.977 -4.239 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.243 2.651 -4.907 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.307 3.806 -0.843 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.142 0.287 -4.250 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.409 1.442 -0.183 1.00 0.00 H new ATOM 0 HZ PHE A 64 -0.182 -0.323 -1.887 1.00 0.00 H new ATOM 922 N ALA A 65 0.934 6.583 -5.571 1.00 0.00 N ATOM 923 CA ALA A 65 0.844 7.758 -6.429 1.00 0.00 C ATOM 924 C ALA A 65 -0.092 8.802 -5.831 1.00 0.00 C ATOM 925 O ALA A 65 0.121 10.004 -5.993 1.00 0.00 O ATOM 926 CB ALA A 65 0.374 7.360 -7.820 1.00 0.00 C ATOM 0 H ALA A 65 0.594 5.722 -5.999 1.00 0.00 H new ATOM 0 HA ALA A 65 1.838 8.200 -6.506 1.00 0.00 H new ATOM 0 HB1 ALA A 65 0.311 8.247 -8.450 1.00 0.00 H new ATOM 0 HB2 ALA A 65 1.082 6.655 -8.255 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -0.608 6.893 -7.752 1.00 0.00 H new ATOM 932 N SER A 66 -1.128 8.338 -5.141 1.00 0.00 N ATOM 933 CA SER A 66 -2.099 9.232 -4.523 1.00 0.00 C ATOM 934 C SER A 66 -2.809 8.545 -3.360 1.00 0.00 C ATOM 935 O SER A 66 -2.451 7.434 -2.971 1.00 0.00 O ATOM 936 CB SER A 66 -3.125 9.699 -5.557 1.00 0.00 C ATOM 937 OG SER A 66 -2.883 9.105 -6.820 1.00 0.00 O ATOM 0 H SER A 66 -1.317 7.346 -4.996 1.00 0.00 H new ATOM 0 HA SER A 66 -1.562 10.099 -4.137 1.00 0.00 H new ATOM 0 HB2 SER A 66 -4.129 9.444 -5.218 1.00 0.00 H new ATOM 0 HB3 SER A 66 -3.085 10.784 -5.649 1.00 0.00 H new ATOM 0 HG SER A 66 -3.726 9.034 -7.315 1.00 0.00 H new ATOM 943 N GLN A 67 -3.816 9.215 -2.810 1.00 0.00 N ATOM 944 CA GLN A 67 -4.576 8.670 -1.691 1.00 0.00 C ATOM 945 C GLN A 67 -5.620 7.671 -2.179 1.00 0.00 C ATOM 946 O GLN A 67 -6.090 6.828 -1.415 1.00 0.00 O ATOM 947 CB GLN A 67 -5.256 9.797 -0.912 1.00 0.00 C ATOM 948 CG GLN A 67 -5.210 9.607 0.596 1.00 0.00 C ATOM 949 CD GLN A 67 -6.590 9.537 1.218 1.00 0.00 C ATOM 950 OE1 GLN A 67 -7.460 10.355 0.917 1.00 0.00 O ATOM 951 NE2 GLN A 67 -6.798 8.559 2.091 1.00 0.00 N ATOM 0 H GLN A 67 -4.125 10.136 -3.121 1.00 0.00 H new ATOM 0 HA GLN A 67 -3.882 8.150 -1.031 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -4.778 10.743 -1.166 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -6.296 9.871 -1.229 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -4.665 8.692 0.826 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -4.655 10.430 1.045 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -6.048 7.903 2.311 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -7.708 8.463 2.542 1.00 0.00 H new ATOM 960 N GLU A 68 -5.979 7.772 -3.454 1.00 0.00 N ATOM 961 CA GLU A 68 -6.969 6.878 -4.042 1.00 0.00 C ATOM 962 C GLU A 68 -6.370 5.499 -4.303 1.00 0.00 C ATOM 963 O GLU A 68 -7.071 4.487 -4.260 1.00 0.00 O ATOM 964 CB GLU A 68 -7.510 7.466 -5.348 1.00 0.00 C ATOM 965 CG GLU A 68 -6.519 7.406 -6.497 1.00 0.00 C ATOM 966 CD GLU A 68 -6.677 8.564 -7.464 1.00 0.00 C ATOM 967 OE1 GLU A 68 -7.810 8.790 -7.939 1.00 0.00 O ATOM 968 OE2 GLU A 68 -5.668 9.245 -7.745 1.00 0.00 O ATOM 0 H GLU A 68 -5.599 8.464 -4.100 1.00 0.00 H new ATOM 0 HA GLU A 68 -7.790 6.771 -3.333 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -8.415 6.929 -5.631 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -7.795 8.504 -5.179 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -5.505 7.407 -6.098 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -6.649 6.467 -7.036 1.00 0.00 H new ATOM 975 N ILE A 69 -5.069 5.466 -4.572 1.00 0.00 N ATOM 976 CA ILE A 69 -4.375 4.212 -4.838 1.00 0.00 C ATOM 977 C ILE A 69 -4.004 3.503 -3.541 1.00 0.00 C ATOM 978 O ILE A 69 -3.932 2.276 -3.491 1.00 0.00 O ATOM 979 CB ILE A 69 -3.099 4.441 -5.669 1.00 0.00 C ATOM 980 CG1 ILE A 69 -3.454 5.007 -7.046 1.00 0.00 C ATOM 981 CG2 ILE A 69 -2.318 3.143 -5.809 1.00 0.00 C ATOM 982 CD1 ILE A 69 -2.246 5.376 -7.878 1.00 0.00 C ATOM 0 H ILE A 69 -4.474 6.294 -4.611 1.00 0.00 H new ATOM 0 HA ILE A 69 -5.062 3.585 -5.407 1.00 0.00 H new ATOM 0 HB ILE A 69 -2.471 5.166 -5.151 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -4.049 4.273 -7.589 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -4.079 5.890 -6.916 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -1.419 3.321 -6.399 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -2.037 2.779 -4.821 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -2.937 2.398 -6.308 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -2.573 5.770 -8.840 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -1.662 6.134 -7.355 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -1.631 4.491 -8.039 1.00 0.00 H new ATOM 994 N ALA A 70 -3.769 4.285 -2.491 1.00 0.00 N ATOM 995 CA ALA A 70 -3.410 3.731 -1.192 1.00 0.00 C ATOM 996 C ALA A 70 -4.566 2.938 -0.593 1.00 0.00 C ATOM 997 O ALA A 70 -4.377 1.826 -0.101 1.00 0.00 O ATOM 998 CB ALA A 70 -2.984 4.843 -0.244 1.00 0.00 C ATOM 0 H ALA A 70 -3.821 5.303 -2.516 1.00 0.00 H new ATOM 0 HA ALA A 70 -2.572 3.048 -1.336 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -2.719 4.415 0.723 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -2.122 5.365 -0.659 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -3.806 5.547 -0.116 1.00 0.00 H new ATOM 1004 N GLU A 71 -5.762 3.516 -0.640 1.00 0.00 N ATOM 1005 CA GLU A 71 -6.948 2.862 -0.101 1.00 0.00 C ATOM 1006 C GLU A 71 -7.121 1.469 -0.700 1.00 0.00 C ATOM 1007 O GLU A 71 -7.462 0.516 0.001 1.00 0.00 O ATOM 1008 CB GLU A 71 -8.193 3.706 -0.377 1.00 0.00 C ATOM 1009 CG GLU A 71 -8.389 4.844 0.612 1.00 0.00 C ATOM 1010 CD GLU A 71 -9.820 4.952 1.101 1.00 0.00 C ATOM 1011 OE1 GLU A 71 -10.743 4.791 0.275 1.00 0.00 O ATOM 1012 OE2 GLU A 71 -10.017 5.197 2.309 1.00 0.00 O ATOM 0 H GLU A 71 -5.935 4.436 -1.046 1.00 0.00 H new ATOM 0 HA GLU A 71 -6.818 2.762 0.977 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -8.126 4.118 -1.384 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -9.071 3.061 -0.354 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -7.727 4.696 1.466 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -8.098 5.783 0.142 1.00 0.00 H new ATOM 1019 N LYS A 72 -6.885 1.359 -2.003 1.00 0.00 N ATOM 1020 CA LYS A 72 -7.013 0.085 -2.699 1.00 0.00 C ATOM 1021 C LYS A 72 -6.051 -0.950 -2.123 1.00 0.00 C ATOM 1022 O LYS A 72 -6.373 -2.135 -2.046 1.00 0.00 O ATOM 1023 CB LYS A 72 -6.747 0.267 -4.196 1.00 0.00 C ATOM 1024 CG LYS A 72 -7.603 1.345 -4.838 1.00 0.00 C ATOM 1025 CD LYS A 72 -7.630 1.208 -6.351 1.00 0.00 C ATOM 1026 CE LYS A 72 -6.594 2.104 -7.011 1.00 0.00 C ATOM 1027 NZ LYS A 72 -6.528 1.887 -8.483 1.00 0.00 N ATOM 0 H LYS A 72 -6.604 2.138 -2.598 1.00 0.00 H new ATOM 0 HA LYS A 72 -8.032 -0.275 -2.559 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -5.696 0.514 -4.342 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -6.926 -0.679 -4.706 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -8.619 1.284 -4.448 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -7.216 2.327 -4.568 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -7.443 0.170 -6.627 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.622 1.463 -6.723 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -6.835 3.148 -6.808 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -5.615 1.912 -6.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -5.810 2.517 -8.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -6.273 0.898 -8.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -7.455 2.095 -8.906 1.00 0.00 H new ATOM 1041 N ALA A 73 -4.870 -0.492 -1.722 1.00 0.00 N ATOM 1042 CA ALA A 73 -3.863 -1.377 -1.149 1.00 0.00 C ATOM 1043 C ALA A 73 -4.183 -1.707 0.305 1.00 0.00 C ATOM 1044 O ALA A 73 -3.817 -2.770 0.805 1.00 0.00 O ATOM 1045 CB ALA A 73 -2.483 -0.745 -1.258 1.00 0.00 C ATOM 0 H ALA A 73 -4.587 0.486 -1.783 1.00 0.00 H new ATOM 0 HA ALA A 73 -3.870 -2.309 -1.714 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -1.740 -1.416 -0.826 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -2.246 -0.568 -2.307 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -2.473 0.202 -0.719 1.00 0.00 H new ATOM 1051 N LEU A 74 -4.867 -0.788 0.977 1.00 0.00 N ATOM 1052 CA LEU A 74 -5.236 -0.981 2.375 1.00 0.00 C ATOM 1053 C LEU A 74 -5.986 -2.295 2.564 1.00 0.00 C ATOM 1054 O LEU A 74 -5.789 -2.998 3.555 1.00 0.00 O ATOM 1055 CB LEU A 74 -6.098 0.186 2.861 1.00 0.00 C ATOM 1056 CG LEU A 74 -5.385 1.238 3.712 1.00 0.00 C ATOM 1057 CD1 LEU A 74 -6.309 2.414 3.991 1.00 0.00 C ATOM 1058 CD2 LEU A 74 -4.890 0.626 5.014 1.00 0.00 C ATOM 0 H LEU A 74 -5.177 0.098 0.577 1.00 0.00 H new ATOM 0 HA LEU A 74 -4.320 -1.019 2.965 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -6.527 0.682 1.990 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -6.929 -0.218 3.439 1.00 0.00 H new ATOM 0 HG LEU A 74 -4.522 1.604 3.155 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -5.785 3.153 4.598 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -6.614 2.869 3.048 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -7.191 2.064 4.527 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -4.385 1.389 5.606 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -5.737 0.232 5.576 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -4.193 -0.182 4.794 1.00 0.00 H new ATOM 1070 N LYS A 75 -6.847 -2.622 1.606 1.00 0.00 N ATOM 1071 CA LYS A 75 -7.625 -3.853 1.663 1.00 0.00 C ATOM 1072 C LYS A 75 -6.712 -5.075 1.653 1.00 0.00 C ATOM 1073 O LYS A 75 -7.143 -6.189 1.952 1.00 0.00 O ATOM 1074 CB LYS A 75 -8.599 -3.921 0.484 1.00 0.00 C ATOM 1075 CG LYS A 75 -9.579 -2.762 0.438 1.00 0.00 C ATOM 1076 CD LYS A 75 -10.931 -3.151 1.013 1.00 0.00 C ATOM 1077 CE LYS A 75 -12.073 -2.634 0.151 1.00 0.00 C ATOM 1078 NZ LYS A 75 -13.402 -2.941 0.749 1.00 0.00 N ATOM 0 H LYS A 75 -7.023 -2.050 0.780 1.00 0.00 H new ATOM 0 HA LYS A 75 -8.191 -3.852 2.594 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.030 -3.942 -0.446 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.157 -4.856 0.538 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -9.174 -1.919 0.998 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -9.703 -2.430 -0.593 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -10.996 -4.236 1.092 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -11.027 -2.752 2.023 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -11.972 -1.556 0.023 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -12.010 -3.080 -0.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -14.154 -2.573 0.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -13.509 -3.971 0.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -13.473 -2.494 1.686 1.00 0.00 H new ATOM 1092 N LYS A 76 -5.447 -4.860 1.308 1.00 0.00 N ATOM 1093 CA LYS A 76 -4.471 -5.942 1.260 1.00 0.00 C ATOM 1094 C LYS A 76 -3.799 -6.127 2.616 1.00 0.00 C ATOM 1095 O LYS A 76 -2.607 -6.431 2.693 1.00 0.00 O ATOM 1096 CB LYS A 76 -3.416 -5.658 0.190 1.00 0.00 C ATOM 1097 CG LYS A 76 -4.002 -5.248 -1.150 1.00 0.00 C ATOM 1098 CD LYS A 76 -2.927 -4.747 -2.100 1.00 0.00 C ATOM 1099 CE LYS A 76 -2.130 -5.899 -2.694 1.00 0.00 C ATOM 1100 NZ LYS A 76 -2.192 -5.908 -4.181 1.00 0.00 N ATOM 0 H LYS A 76 -5.073 -3.945 1.057 1.00 0.00 H new ATOM 0 HA LYS A 76 -4.997 -6.862 1.006 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -2.755 -4.867 0.545 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -2.803 -6.548 0.051 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -4.517 -6.098 -1.598 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -4.747 -4.467 -0.998 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.388 -4.170 -2.902 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -2.255 -4.073 -1.568 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -1.091 -5.824 -2.374 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.515 -6.843 -2.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -1.519 -6.609 -4.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -3.154 -6.156 -4.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -1.946 -4.965 -4.544 1.00 0.00 H new ATOM 1114 N HIS A 77 -4.568 -5.943 3.684 1.00 0.00 N ATOM 1115 CA HIS A 77 -4.046 -6.092 5.038 1.00 0.00 C ATOM 1116 C HIS A 77 -3.894 -7.566 5.403 1.00 0.00 C ATOM 1117 O HIS A 77 -4.565 -8.429 4.835 1.00 0.00 O ATOM 1118 CB HIS A 77 -4.967 -5.398 6.041 1.00 0.00 C ATOM 1119 CG HIS A 77 -4.768 -5.857 7.454 1.00 0.00 C ATOM 1120 ND1 HIS A 77 -3.936 -5.211 8.345 1.00 0.00 N ATOM 1121 CD2 HIS A 77 -5.300 -6.902 8.128 1.00 0.00 C ATOM 1122 CE1 HIS A 77 -3.965 -5.842 9.505 1.00 0.00 C ATOM 1123 NE2 HIS A 77 -4.785 -6.871 9.400 1.00 0.00 N ATOM 0 H HIS A 77 -5.555 -5.690 3.638 1.00 0.00 H new ATOM 0 HA HIS A 77 -3.062 -5.624 5.075 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -4.801 -4.322 5.990 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -6.003 -5.574 5.753 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -3.385 -4.377 8.140 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -6.000 -7.626 7.738 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -3.412 -5.563 10.390 1.00 0.00 H new ATOM 1131 N LYS A 78 -3.009 -7.847 6.352 1.00 0.00 N ATOM 1132 CA LYS A 78 -2.768 -9.215 6.795 1.00 0.00 C ATOM 1133 C LYS A 78 -2.326 -10.094 5.628 1.00 0.00 C ATOM 1134 O LYS A 78 -2.277 -11.318 5.746 1.00 0.00 O ATOM 1135 CB LYS A 78 -4.032 -9.797 7.433 1.00 0.00 C ATOM 1136 CG LYS A 78 -4.035 -9.726 8.951 1.00 0.00 C ATOM 1137 CD LYS A 78 -3.592 -11.041 9.571 1.00 0.00 C ATOM 1138 CE LYS A 78 -2.517 -10.825 10.625 1.00 0.00 C ATOM 1139 NZ LYS A 78 -2.772 -11.632 11.850 1.00 0.00 N ATOM 0 H LYS A 78 -2.445 -7.144 6.830 1.00 0.00 H new ATOM 0 HA LYS A 78 -1.970 -9.195 7.537 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -4.901 -9.262 7.051 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -4.138 -10.838 7.126 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -3.372 -8.926 9.280 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -5.036 -9.476 9.303 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -4.450 -11.540 10.022 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -3.212 -11.702 8.792 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -1.544 -11.090 10.211 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -2.474 -9.768 10.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -2.018 -11.457 12.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -3.689 -11.361 12.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -2.788 -12.642 11.603 1.00 0.00 H new ATOM 1153 N GLU A 79 -2.003 -9.460 4.506 1.00 0.00 N ATOM 1154 CA GLU A 79 -1.563 -10.186 3.319 1.00 0.00 C ATOM 1155 C GLU A 79 -0.146 -10.719 3.502 1.00 0.00 C ATOM 1156 O GLU A 79 0.812 -9.950 3.594 1.00 0.00 O ATOM 1157 CB GLU A 79 -1.624 -9.278 2.088 1.00 0.00 C ATOM 1158 CG GLU A 79 -3.026 -9.098 1.534 1.00 0.00 C ATOM 1159 CD GLU A 79 -3.254 -9.884 0.257 1.00 0.00 C ATOM 1160 OE1 GLU A 79 -2.831 -11.058 0.200 1.00 0.00 O ATOM 1161 OE2 GLU A 79 -3.856 -9.327 -0.685 1.00 0.00 O ATOM 0 H GLU A 79 -2.037 -8.447 4.393 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.234 -11.032 3.171 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -1.217 -8.301 2.347 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -0.985 -9.693 1.309 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -3.752 -9.412 2.284 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -3.204 -8.040 1.342 1.00 0.00 H new ATOM 1168 N ARG A 80 -0.019 -12.041 3.556 1.00 0.00 N ATOM 1169 CA ARG A 80 1.280 -12.678 3.730 1.00 0.00 C ATOM 1170 C ARG A 80 2.038 -12.737 2.406 1.00 0.00 C ATOM 1171 O ARG A 80 1.437 -12.872 1.340 1.00 0.00 O ATOM 1172 CB ARG A 80 1.109 -14.089 4.294 1.00 0.00 C ATOM 1173 CG ARG A 80 0.305 -15.013 3.392 1.00 0.00 C ATOM 1174 CD ARG A 80 1.184 -16.087 2.770 1.00 0.00 C ATOM 1175 NE ARG A 80 0.567 -16.679 1.585 1.00 0.00 N ATOM 1176 CZ ARG A 80 1.097 -17.695 0.913 1.00 0.00 C ATOM 1177 NH1 ARG A 80 2.245 -18.229 1.306 1.00 0.00 N ATOM 1178 NH2 ARG A 80 0.477 -18.179 -0.156 1.00 0.00 N ATOM 0 H ARG A 80 -0.801 -12.692 3.482 1.00 0.00 H new ATOM 0 HA ARG A 80 1.858 -12.080 4.435 1.00 0.00 H new ATOM 0 HB2 ARG A 80 2.093 -14.526 4.462 1.00 0.00 H new ATOM 0 HB3 ARG A 80 0.618 -14.026 5.265 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -0.492 -15.482 3.968 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -0.172 -14.430 2.604 1.00 0.00 H new ATOM 0 HD2 ARG A 80 2.148 -15.655 2.500 1.00 0.00 H new ATOM 0 HD3 ARG A 80 1.379 -16.867 3.506 1.00 0.00 H new ATOM 0 HE ARG A 80 -0.317 -16.292 1.256 1.00 0.00 H new ATOM 0 HH11 ARG A 80 2.725 -17.860 2.127 1.00 0.00 H new ATOM 0 HH12 ARG A 80 2.649 -19.009 0.787 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -0.406 -17.771 -0.462 1.00 0.00 H new ATOM 0 HH22 ARG A 80 0.884 -18.959 -0.672 1.00 0.00 H new ATOM 1192 N ILE A 81 3.361 -12.634 2.483 1.00 0.00 N ATOM 1193 CA ILE A 81 4.200 -12.675 1.293 1.00 0.00 C ATOM 1194 C ILE A 81 5.198 -13.826 1.363 1.00 0.00 C ATOM 1195 O ILE A 81 6.321 -13.661 1.838 1.00 0.00 O ATOM 1196 CB ILE A 81 4.970 -11.356 1.100 1.00 0.00 C ATOM 1197 CG1 ILE A 81 4.001 -10.219 0.766 1.00 0.00 C ATOM 1198 CG2 ILE A 81 6.015 -11.507 0.004 1.00 0.00 C ATOM 1199 CD1 ILE A 81 4.606 -8.842 0.932 1.00 0.00 C ATOM 0 H ILE A 81 3.874 -12.522 3.357 1.00 0.00 H new ATOM 0 HA ILE A 81 3.534 -12.825 0.444 1.00 0.00 H new ATOM 0 HB ILE A 81 5.481 -11.112 2.031 1.00 0.00 H new ATOM 0 HG12 ILE A 81 3.658 -10.335 -0.262 1.00 0.00 H new ATOM 0 HG13 ILE A 81 3.123 -10.301 1.406 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.551 -10.566 -0.120 1.00 0.00 H new ATOM 0 HG22 ILE A 81 6.720 -12.292 0.279 1.00 0.00 H new ATOM 0 HG23 ILE A 81 5.524 -11.771 -0.933 1.00 0.00 H new ATOM 0 HD11 ILE A 81 3.864 -8.085 0.678 1.00 0.00 H new ATOM 0 HD12 ILE A 81 4.924 -8.706 1.966 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.467 -8.741 0.272 1.00 0.00 H new ATOM 1211 N GLY A 82 4.780 -14.996 0.885 1.00 0.00 N ATOM 1212 CA GLY A 82 5.649 -16.157 0.902 1.00 0.00 C ATOM 1213 C GLY A 82 5.431 -17.027 2.124 1.00 0.00 C ATOM 1214 O GLY A 82 5.215 -18.234 2.006 1.00 0.00 O ATOM 0 H GLY A 82 3.855 -15.159 0.487 1.00 0.00 H new ATOM 0 HA2 GLY A 82 5.477 -16.749 0.003 1.00 0.00 H new ATOM 0 HA3 GLY A 82 6.688 -15.829 0.874 1.00 0.00 H new ATOM 1218 N HIS A 83 5.488 -16.416 3.303 1.00 0.00 N ATOM 1219 CA HIS A 83 5.296 -17.142 4.553 1.00 0.00 C ATOM 1220 C HIS A 83 5.376 -16.199 5.748 1.00 0.00 C ATOM 1221 O HIS A 83 5.979 -16.526 6.770 1.00 0.00 O ATOM 1222 CB HIS A 83 6.343 -18.248 4.690 1.00 0.00 C ATOM 1223 CG HIS A 83 7.740 -17.733 4.853 1.00 0.00 C ATOM 1224 ND1 HIS A 83 8.381 -16.981 3.892 1.00 0.00 N ATOM 1225 CD2 HIS A 83 8.619 -17.865 5.874 1.00 0.00 C ATOM 1226 CE1 HIS A 83 9.595 -16.673 4.315 1.00 0.00 C ATOM 1227 NE2 HIS A 83 9.763 -17.198 5.515 1.00 0.00 N ATOM 0 H HIS A 83 5.666 -15.418 3.419 1.00 0.00 H new ATOM 0 HA HIS A 83 4.303 -17.591 4.534 1.00 0.00 H new ATOM 0 HB2 HIS A 83 6.092 -18.871 5.549 1.00 0.00 H new ATOM 0 HB3 HIS A 83 6.301 -18.888 3.809 1.00 0.00 H new ATOM 0 HD2 HIS A 83 8.451 -18.396 6.799 1.00 0.00 H new ATOM 0 HE1 HIS A 83 10.325 -16.091 3.772 1.00 0.00 H new ATOM 0 HE2 HIS A 83 10.607 -17.120 6.083 1.00 0.00 H new ATOM 1235 N ARG A 84 4.763 -15.027 5.613 1.00 0.00 N ATOM 1236 CA ARG A 84 4.767 -14.035 6.681 1.00 0.00 C ATOM 1237 C ARG A 84 3.666 -13.000 6.467 1.00 0.00 C ATOM 1238 O ARG A 84 3.739 -12.182 5.550 1.00 0.00 O ATOM 1239 CB ARG A 84 6.127 -13.340 6.756 1.00 0.00 C ATOM 1240 CG ARG A 84 6.992 -13.815 7.912 1.00 0.00 C ATOM 1241 CD ARG A 84 6.778 -12.964 9.155 1.00 0.00 C ATOM 1242 NE ARG A 84 7.659 -13.361 10.248 1.00 0.00 N ATOM 1243 CZ ARG A 84 7.381 -14.343 11.098 1.00 0.00 C ATOM 1244 NH1 ARG A 84 6.250 -15.026 10.979 1.00 0.00 N ATOM 1245 NH2 ARG A 84 8.234 -14.645 12.068 1.00 0.00 N ATOM 0 H ARG A 84 4.257 -14.742 4.774 1.00 0.00 H new ATOM 0 HA ARG A 84 4.578 -14.551 7.622 1.00 0.00 H new ATOM 0 HB2 ARG A 84 6.662 -13.506 5.821 1.00 0.00 H new ATOM 0 HB3 ARG A 84 5.971 -12.265 6.848 1.00 0.00 H new ATOM 0 HG2 ARG A 84 6.760 -14.856 8.138 1.00 0.00 H new ATOM 0 HG3 ARG A 84 8.042 -13.779 7.621 1.00 0.00 H new ATOM 0 HD2 ARG A 84 6.952 -11.916 8.911 1.00 0.00 H new ATOM 0 HD3 ARG A 84 5.740 -13.048 9.477 1.00 0.00 H new ATOM 0 HE ARG A 84 8.537 -12.856 10.366 1.00 0.00 H new ATOM 0 HH11 ARG A 84 5.592 -14.797 10.234 1.00 0.00 H new ATOM 0 HH12 ARG A 84 6.038 -15.780 11.633 1.00 0.00 H new ATOM 0 HH21 ARG A 84 9.105 -14.123 12.162 1.00 0.00 H new ATOM 0 HH22 ARG A 84 8.019 -15.399 12.720 1.00 0.00 H new ATOM 1259 N TYR A 85 2.646 -13.044 7.318 1.00 0.00 N ATOM 1260 CA TYR A 85 1.528 -12.113 7.220 1.00 0.00 C ATOM 1261 C TYR A 85 2.012 -10.670 7.322 1.00 0.00 C ATOM 1262 O TYR A 85 2.897 -10.354 8.118 1.00 0.00 O ATOM 1263 CB TYR A 85 0.503 -12.399 8.318 1.00 0.00 C ATOM 1264 CG TYR A 85 -0.169 -13.746 8.183 1.00 0.00 C ATOM 1265 CD1 TYR A 85 -1.131 -13.972 7.207 1.00 0.00 C ATOM 1266 CD2 TYR A 85 0.160 -14.796 9.034 1.00 0.00 C ATOM 1267 CE1 TYR A 85 -1.746 -15.202 7.081 1.00 0.00 C ATOM 1268 CE2 TYR A 85 -0.450 -16.030 8.915 1.00 0.00 C ATOM 1269 CZ TYR A 85 -1.403 -16.227 7.937 1.00 0.00 C ATOM 1270 OH TYR A 85 -2.014 -17.454 7.815 1.00 0.00 O ATOM 0 H TYR A 85 2.571 -13.714 8.083 1.00 0.00 H new ATOM 0 HA TYR A 85 1.056 -12.251 6.247 1.00 0.00 H new ATOM 0 HB2 TYR A 85 0.997 -12.345 9.288 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -0.259 -11.619 8.304 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -1.403 -13.172 6.535 1.00 0.00 H new ATOM 0 HD2 TYR A 85 0.905 -14.644 9.801 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -2.492 -15.360 6.316 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -0.183 -16.835 9.583 1.00 0.00 H new ATOM 0 HH TYR A 85 -1.658 -18.065 8.493 1.00 0.00 H new ATOM 1280 N ILE A 86 1.423 -9.797 6.511 1.00 0.00 N ATOM 1281 CA ILE A 86 1.790 -8.386 6.511 1.00 0.00 C ATOM 1282 C ILE A 86 0.656 -7.523 7.053 1.00 0.00 C ATOM 1283 O ILE A 86 -0.504 -7.703 6.684 1.00 0.00 O ATOM 1284 CB ILE A 86 2.161 -7.901 5.097 1.00 0.00 C ATOM 1285 CG1 ILE A 86 3.059 -8.927 4.402 1.00 0.00 C ATOM 1286 CG2 ILE A 86 2.847 -6.546 5.165 1.00 0.00 C ATOM 1287 CD1 ILE A 86 4.531 -8.734 4.691 1.00 0.00 C ATOM 0 H ILE A 86 0.690 -10.042 5.846 1.00 0.00 H new ATOM 0 HA ILE A 86 2.660 -8.286 7.160 1.00 0.00 H new ATOM 0 HB ILE A 86 1.247 -7.793 4.514 1.00 0.00 H new ATOM 0 HG12 ILE A 86 2.763 -9.928 4.716 1.00 0.00 H new ATOM 0 HG13 ILE A 86 2.898 -8.869 3.326 1.00 0.00 H new ATOM 0 HG21 ILE A 86 3.103 -6.217 4.158 1.00 0.00 H new ATOM 0 HG22 ILE A 86 2.175 -5.821 5.624 1.00 0.00 H new ATOM 0 HG23 ILE A 86 3.755 -6.628 5.762 1.00 0.00 H new ATOM 0 HD11 ILE A 86 5.108 -9.496 4.166 1.00 0.00 H new ATOM 0 HD12 ILE A 86 4.842 -7.746 4.352 1.00 0.00 H new ATOM 0 HD13 ILE A 86 4.706 -8.821 5.763 1.00 0.00 H new ATOM 1299 N GLU A 87 1.001 -6.583 7.927 1.00 0.00 N ATOM 1300 CA GLU A 87 0.011 -5.690 8.518 1.00 0.00 C ATOM 1301 C GLU A 87 0.146 -4.278 7.954 1.00 0.00 C ATOM 1302 O GLU A 87 1.127 -3.583 8.223 1.00 0.00 O ATOM 1303 CB GLU A 87 0.163 -5.660 10.041 1.00 0.00 C ATOM 1304 CG GLU A 87 -0.483 -6.843 10.740 1.00 0.00 C ATOM 1305 CD GLU A 87 -0.265 -6.824 12.241 1.00 0.00 C ATOM 1306 OE1 GLU A 87 0.883 -7.055 12.675 1.00 0.00 O ATOM 1307 OE2 GLU A 87 -1.241 -6.577 12.980 1.00 0.00 O ATOM 0 H GLU A 87 1.958 -6.420 8.241 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.979 -6.070 8.266 1.00 0.00 H new ATOM 0 HB2 GLU A 87 1.224 -5.636 10.291 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -0.276 -4.739 10.423 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -1.553 -6.843 10.532 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.078 -7.768 10.330 1.00 0.00 H new ATOM 1314 N ILE A 88 -0.844 -3.863 7.171 1.00 0.00 N ATOM 1315 CA ILE A 88 -0.836 -2.535 6.570 1.00 0.00 C ATOM 1316 C ILE A 88 -1.678 -1.558 7.384 1.00 0.00 C ATOM 1317 O ILE A 88 -2.790 -1.880 7.804 1.00 0.00 O ATOM 1318 CB ILE A 88 -1.364 -2.570 5.124 1.00 0.00 C ATOM 1319 CG1 ILE A 88 -0.462 -3.442 4.248 1.00 0.00 C ATOM 1320 CG2 ILE A 88 -1.454 -1.159 4.560 1.00 0.00 C ATOM 1321 CD1 ILE A 88 -1.218 -4.247 3.215 1.00 0.00 C ATOM 0 H ILE A 88 -1.661 -4.427 6.938 1.00 0.00 H new ATOM 0 HA ILE A 88 0.200 -2.198 6.562 1.00 0.00 H new ATOM 0 HB ILE A 88 -2.364 -3.005 5.128 1.00 0.00 H new ATOM 0 HG12 ILE A 88 0.263 -2.806 3.741 1.00 0.00 H new ATOM 0 HG13 ILE A 88 0.102 -4.123 4.886 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -1.829 -1.199 3.537 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -2.133 -0.565 5.172 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -0.465 -0.701 4.566 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -0.515 -4.841 2.631 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.924 -4.909 3.715 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.760 -3.572 2.553 1.00 0.00 H new ATOM 1333 N PHE A 89 -1.142 -0.362 7.600 1.00 0.00 N ATOM 1334 CA PHE A 89 -1.844 0.663 8.363 1.00 0.00 C ATOM 1335 C PHE A 89 -1.638 2.041 7.740 1.00 0.00 C ATOM 1336 O PHE A 89 -0.508 2.514 7.611 1.00 0.00 O ATOM 1337 CB PHE A 89 -1.361 0.670 9.815 1.00 0.00 C ATOM 1338 CG PHE A 89 -1.621 -0.619 10.540 1.00 0.00 C ATOM 1339 CD1 PHE A 89 -2.916 -1.069 10.737 1.00 0.00 C ATOM 1340 CD2 PHE A 89 -0.570 -1.382 11.022 1.00 0.00 C ATOM 1341 CE1 PHE A 89 -3.158 -2.254 11.405 1.00 0.00 C ATOM 1342 CE2 PHE A 89 -0.806 -2.570 11.690 1.00 0.00 C ATOM 1343 CZ PHE A 89 -2.102 -3.007 11.881 1.00 0.00 C ATOM 0 H PHE A 89 -0.224 -0.079 7.258 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.909 0.430 8.343 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.291 0.878 9.832 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.852 1.483 10.349 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.746 -0.487 10.364 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.446 -1.045 10.874 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -4.173 -2.592 11.555 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.022 -3.155 12.062 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.290 -3.935 12.401 1.00 0.00 H new ATOM 1353 N LYS A 90 -2.737 2.680 7.355 1.00 0.00 N ATOM 1354 CA LYS A 90 -2.680 4.003 6.746 1.00 0.00 C ATOM 1355 C LYS A 90 -1.714 4.909 7.502 1.00 0.00 C ATOM 1356 O LYS A 90 -1.790 5.031 8.724 1.00 0.00 O ATOM 1357 CB LYS A 90 -4.073 4.636 6.719 1.00 0.00 C ATOM 1358 CG LYS A 90 -4.470 5.176 5.356 1.00 0.00 C ATOM 1359 CD LYS A 90 -3.611 6.363 4.955 1.00 0.00 C ATOM 1360 CE LYS A 90 -3.777 6.701 3.481 1.00 0.00 C ATOM 1361 NZ LYS A 90 -2.510 6.510 2.722 1.00 0.00 N ATOM 0 H LYS A 90 -3.679 2.302 7.454 1.00 0.00 H new ATOM 0 HA LYS A 90 -2.320 3.889 5.724 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -4.806 3.894 7.034 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -4.108 5.447 7.446 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -4.374 4.388 4.609 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -5.518 5.474 5.373 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -3.880 7.229 5.560 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.564 6.142 5.163 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.557 6.073 3.050 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -4.108 7.735 3.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.716 6.483 1.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.862 7.298 2.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.065 5.615 3.009 1.00 0.00 H new ATOM 1375 N SER A 91 -0.806 5.544 6.767 1.00 0.00 N ATOM 1376 CA SER A 91 0.177 6.437 7.369 1.00 0.00 C ATOM 1377 C SER A 91 0.331 7.711 6.544 1.00 0.00 C ATOM 1378 O SER A 91 -0.432 7.954 5.609 1.00 0.00 O ATOM 1379 CB SER A 91 1.528 5.731 7.496 1.00 0.00 C ATOM 1380 OG SER A 91 2.361 6.389 8.435 1.00 0.00 O ATOM 0 H SER A 91 -0.731 5.456 5.754 1.00 0.00 H new ATOM 0 HA SER A 91 -0.177 6.710 8.363 1.00 0.00 H new ATOM 0 HB2 SER A 91 1.374 4.697 7.804 1.00 0.00 H new ATOM 0 HB3 SER A 91 2.021 5.704 6.524 1.00 0.00 H new ATOM 0 HG SER A 91 3.144 6.758 7.976 1.00 0.00 H new ATOM 1386 N SER A 92 1.324 8.520 6.897 1.00 0.00 N ATOM 1387 CA SER A 92 1.577 9.772 6.192 1.00 0.00 C ATOM 1388 C SER A 92 3.074 9.987 5.988 1.00 0.00 C ATOM 1389 O SER A 92 3.899 9.340 6.633 1.00 0.00 O ATOM 1390 CB SER A 92 0.983 10.948 6.968 1.00 0.00 C ATOM 1391 OG SER A 92 0.552 11.973 6.091 1.00 0.00 O ATOM 0 H SER A 92 1.967 8.332 7.666 1.00 0.00 H new ATOM 0 HA SER A 92 1.099 9.713 5.214 1.00 0.00 H new ATOM 0 HB2 SER A 92 0.142 10.603 7.570 1.00 0.00 H new ATOM 0 HB3 SER A 92 1.727 11.345 7.658 1.00 0.00 H new ATOM 0 HG SER A 92 0.175 12.712 6.612 1.00 0.00 H new ATOM 1397 N ARG A 93 3.416 10.900 5.085 1.00 0.00 N ATOM 1398 CA ARG A 93 4.813 11.201 4.794 1.00 0.00 C ATOM 1399 C ARG A 93 5.550 11.639 6.056 1.00 0.00 C ATOM 1400 O ARG A 93 6.576 11.065 6.418 1.00 0.00 O ATOM 1401 CB ARG A 93 4.909 12.294 3.728 1.00 0.00 C ATOM 1402 CG ARG A 93 6.334 12.590 3.287 1.00 0.00 C ATOM 1403 CD ARG A 93 6.393 12.974 1.817 1.00 0.00 C ATOM 1404 NE ARG A 93 7.078 14.247 1.611 1.00 0.00 N ATOM 1405 CZ ARG A 93 7.159 14.857 0.434 1.00 0.00 C ATOM 1406 NH1 ARG A 93 6.601 14.312 -0.638 1.00 0.00 N ATOM 1407 NH2 ARG A 93 7.800 16.014 0.326 1.00 0.00 N ATOM 0 H ARG A 93 2.745 11.444 4.542 1.00 0.00 H new ATOM 0 HA ARG A 93 5.284 10.293 4.417 1.00 0.00 H new ATOM 0 HB2 ARG A 93 4.323 11.995 2.859 1.00 0.00 H new ATOM 0 HB3 ARG A 93 4.460 13.208 4.116 1.00 0.00 H new ATOM 0 HG2 ARG A 93 6.743 13.399 3.892 1.00 0.00 H new ATOM 0 HG3 ARG A 93 6.959 11.714 3.461 1.00 0.00 H new ATOM 0 HD2 ARG A 93 6.906 12.192 1.258 1.00 0.00 H new ATOM 0 HD3 ARG A 93 5.381 13.038 1.418 1.00 0.00 H new ATOM 0 HE ARG A 93 7.519 14.693 2.416 1.00 0.00 H new ATOM 0 HH11 ARG A 93 6.108 13.422 -0.560 1.00 0.00 H new ATOM 0 HH12 ARG A 93 6.664 14.782 -1.541 1.00 0.00 H new ATOM 0 HH21 ARG A 93 8.232 16.437 1.148 1.00 0.00 H new ATOM 0 HH22 ARG A 93 7.861 16.481 -0.579 1.00 0.00 H new ATOM 1421 N ALA A 94 5.018 12.659 6.720 1.00 0.00 N ATOM 1422 CA ALA A 94 5.624 13.173 7.943 1.00 0.00 C ATOM 1423 C ALA A 94 5.789 12.068 8.981 1.00 0.00 C ATOM 1424 O ALA A 94 6.818 11.983 9.650 1.00 0.00 O ATOM 1425 CB ALA A 94 4.787 14.311 8.509 1.00 0.00 C ATOM 0 H ALA A 94 4.169 13.146 6.432 1.00 0.00 H new ATOM 0 HA ALA A 94 6.615 13.554 7.696 1.00 0.00 H new ATOM 0 HB1 ALA A 94 5.251 14.685 9.422 1.00 0.00 H new ATOM 0 HB2 ALA A 94 4.725 15.116 7.777 1.00 0.00 H new ATOM 0 HB3 ALA A 94 3.784 13.948 8.734 1.00 0.00 H new ATOM 1431 N GLU A 95 4.769 11.225 9.108 1.00 0.00 N ATOM 1432 CA GLU A 95 4.804 10.126 10.065 1.00 0.00 C ATOM 1433 C GLU A 95 6.058 9.278 9.877 1.00 0.00 C ATOM 1434 O GLU A 95 6.760 8.965 10.839 1.00 0.00 O ATOM 1435 CB GLU A 95 3.557 9.251 9.917 1.00 0.00 C ATOM 1436 CG GLU A 95 2.290 9.901 10.450 1.00 0.00 C ATOM 1437 CD GLU A 95 1.718 9.167 11.647 1.00 0.00 C ATOM 1438 OE1 GLU A 95 1.784 7.920 11.664 1.00 0.00 O ATOM 1439 OE2 GLU A 95 1.204 9.838 12.566 1.00 0.00 O ATOM 0 H GLU A 95 3.910 11.282 8.561 1.00 0.00 H new ATOM 0 HA GLU A 95 4.823 10.553 11.068 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.416 9.010 8.863 1.00 0.00 H new ATOM 0 HB3 GLU A 95 3.720 8.309 10.441 1.00 0.00 H new ATOM 0 HG2 GLU A 95 2.505 10.932 10.730 1.00 0.00 H new ATOM 0 HG3 GLU A 95 1.542 9.935 9.658 1.00 0.00 H new ATOM 1446 N VAL A 96 6.333 8.908 8.630 1.00 0.00 N ATOM 1447 CA VAL A 96 7.502 8.097 8.314 1.00 0.00 C ATOM 1448 C VAL A 96 8.701 8.506 9.163 1.00 0.00 C ATOM 1449 O VAL A 96 9.342 9.524 8.902 1.00 0.00 O ATOM 1450 CB VAL A 96 7.880 8.213 6.825 1.00 0.00 C ATOM 1451 CG1 VAL A 96 9.144 7.418 6.531 1.00 0.00 C ATOM 1452 CG2 VAL A 96 6.729 7.744 5.947 1.00 0.00 C ATOM 0 H VAL A 96 5.762 9.157 7.823 1.00 0.00 H new ATOM 0 HA VAL A 96 7.238 7.063 8.536 1.00 0.00 H new ATOM 0 HB VAL A 96 8.078 9.261 6.598 1.00 0.00 H new ATOM 0 HG11 VAL A 96 9.395 7.512 5.475 1.00 0.00 H new ATOM 0 HG12 VAL A 96 9.965 7.804 7.135 1.00 0.00 H new ATOM 0 HG13 VAL A 96 8.978 6.368 6.773 1.00 0.00 H new ATOM 0 HG21 VAL A 96 7.012 7.832 4.898 1.00 0.00 H new ATOM 0 HG22 VAL A 96 6.499 6.703 6.174 1.00 0.00 H new ATOM 0 HG23 VAL A 96 5.851 8.360 6.139 1.00 0.00 H new ATOM 1462 N ARG A 97 8.998 7.704 10.182 1.00 0.00 N ATOM 1463 CA ARG A 97 10.119 7.984 11.070 1.00 0.00 C ATOM 1464 C ARG A 97 10.055 9.414 11.596 1.00 0.00 C ATOM 1465 O ARG A 97 9.171 10.186 11.222 1.00 0.00 O ATOM 1466 CB ARG A 97 11.445 7.755 10.341 1.00 0.00 C ATOM 1467 CG ARG A 97 11.718 6.296 10.017 1.00 0.00 C ATOM 1468 CD ARG A 97 12.795 5.717 10.921 1.00 0.00 C ATOM 1469 NE ARG A 97 12.423 4.405 11.445 1.00 0.00 N ATOM 1470 CZ ARG A 97 13.256 3.617 12.114 1.00 0.00 C ATOM 1471 NH1 ARG A 97 14.504 4.006 12.340 1.00 0.00 N ATOM 1472 NH2 ARG A 97 12.843 2.437 12.559 1.00 0.00 N ATOM 0 H ARG A 97 8.478 6.857 10.412 1.00 0.00 H new ATOM 0 HA ARG A 97 10.056 7.302 11.918 1.00 0.00 H new ATOM 0 HB2 ARG A 97 11.445 8.330 9.415 1.00 0.00 H new ATOM 0 HB3 ARG A 97 12.259 8.140 10.955 1.00 0.00 H new ATOM 0 HG2 ARG A 97 10.800 5.719 10.128 1.00 0.00 H new ATOM 0 HG3 ARG A 97 12.028 6.205 8.976 1.00 0.00 H new ATOM 0 HD2 ARG A 97 13.729 5.634 10.365 1.00 0.00 H new ATOM 0 HD3 ARG A 97 12.978 6.400 11.750 1.00 0.00 H new ATOM 0 HE ARG A 97 11.470 4.076 11.288 1.00 0.00 H new ATOM 0 HH11 ARG A 97 14.825 4.912 12.000 1.00 0.00 H new ATOM 0 HH12 ARG A 97 15.142 3.399 12.854 1.00 0.00 H new ATOM 0 HH21 ARG A 97 11.884 2.134 12.387 1.00 0.00 H new ATOM 0 HH22 ARG A 97 13.484 1.833 13.073 1.00 0.00 H new ATOM 1486 N THR A 98 10.998 9.763 12.465 1.00 0.00 N ATOM 1487 CA THR A 98 11.047 11.101 13.042 1.00 0.00 C ATOM 1488 C THR A 98 12.483 11.608 13.133 1.00 0.00 C ATOM 1489 O THR A 98 12.743 12.797 12.955 1.00 0.00 O ATOM 1490 CB THR A 98 10.416 11.130 14.447 1.00 0.00 C ATOM 1491 OG1 THR A 98 11.141 10.265 15.330 1.00 0.00 O ATOM 1492 CG2 THR A 98 8.958 10.699 14.394 1.00 0.00 C ATOM 0 H THR A 98 11.738 9.138 12.785 1.00 0.00 H new ATOM 0 HA THR A 98 10.475 11.752 12.381 1.00 0.00 H new ATOM 0 HB THR A 98 10.464 12.153 14.820 1.00 0.00 H new ATOM 0 HG1 THR A 98 10.734 10.291 16.221 1.00 0.00 H new ATOM 0 HG21 THR A 98 8.534 10.727 15.398 1.00 0.00 H new ATOM 0 HG22 THR A 98 8.402 11.376 13.746 1.00 0.00 H new ATOM 0 HG23 THR A 98 8.893 9.684 14.001 1.00 0.00 H new ATOM 1500 N SER A 99 13.410 10.697 13.410 1.00 0.00 N ATOM 1501 CA SER A 99 14.819 11.054 13.527 1.00 0.00 C ATOM 1502 C SER A 99 15.230 12.017 12.417 1.00 0.00 C ATOM 1503 O SER A 99 14.689 11.977 11.313 1.00 0.00 O ATOM 1504 CB SER A 99 15.691 9.797 13.476 1.00 0.00 C ATOM 1505 OG SER A 99 16.356 9.587 14.708 1.00 0.00 O ATOM 0 H SER A 99 13.211 9.707 13.557 1.00 0.00 H new ATOM 0 HA SER A 99 14.964 11.550 14.487 1.00 0.00 H new ATOM 0 HB2 SER A 99 15.072 8.931 13.241 1.00 0.00 H new ATOM 0 HB3 SER A 99 16.424 9.892 12.675 1.00 0.00 H new ATOM 0 HG SER A 99 16.905 8.777 14.650 1.00 0.00 H new ATOM 1511 N GLY A 100 16.192 12.883 12.719 1.00 0.00 N ATOM 1512 CA GLY A 100 16.661 13.845 11.739 1.00 0.00 C ATOM 1513 C GLY A 100 17.615 13.231 10.734 1.00 0.00 C ATOM 1514 O GLY A 100 18.371 12.310 11.046 1.00 0.00 O ATOM 0 H GLY A 100 16.656 12.936 13.626 1.00 0.00 H new ATOM 0 HA2 GLY A 100 15.806 14.268 11.212 1.00 0.00 H new ATOM 0 HA3 GLY A 100 17.159 14.668 12.252 1.00 0.00 H new ATOM 1518 N PRO A 101 17.585 13.743 9.495 1.00 0.00 N ATOM 1519 CA PRO A 101 18.447 13.252 8.414 1.00 0.00 C ATOM 1520 C PRO A 101 19.913 13.613 8.634 1.00 0.00 C ATOM 1521 O PRO A 101 20.799 13.085 7.962 1.00 0.00 O ATOM 1522 CB PRO A 101 17.901 13.965 7.174 1.00 0.00 C ATOM 1523 CG PRO A 101 17.259 15.202 7.700 1.00 0.00 C ATOM 1524 CD PRO A 101 16.709 14.840 9.052 1.00 0.00 C ATOM 0 HA PRO A 101 18.429 12.165 8.339 1.00 0.00 H new ATOM 0 HB2 PRO A 101 18.699 14.202 6.470 1.00 0.00 H new ATOM 0 HB3 PRO A 101 17.182 13.341 6.643 1.00 0.00 H new ATOM 0 HG2 PRO A 101 17.982 16.014 7.777 1.00 0.00 H new ATOM 0 HG3 PRO A 101 16.466 15.543 7.035 1.00 0.00 H new ATOM 0 HD2 PRO A 101 16.745 15.685 9.740 1.00 0.00 H new ATOM 0 HD3 PRO A 101 15.668 14.523 8.990 1.00 0.00 H new ATOM 1532 N SER A 102 20.160 14.514 9.578 1.00 0.00 N ATOM 1533 CA SER A 102 21.519 14.947 9.885 1.00 0.00 C ATOM 1534 C SER A 102 22.101 14.136 11.038 1.00 0.00 C ATOM 1535 O SER A 102 23.132 13.480 10.892 1.00 0.00 O ATOM 1536 CB SER A 102 21.536 16.437 10.235 1.00 0.00 C ATOM 1537 OG SER A 102 22.710 17.062 9.744 1.00 0.00 O ATOM 0 H SER A 102 19.438 14.959 10.144 1.00 0.00 H new ATOM 0 HA SER A 102 22.134 14.782 9.001 1.00 0.00 H new ATOM 0 HB2 SER A 102 20.657 16.923 9.812 1.00 0.00 H new ATOM 0 HB3 SER A 102 21.479 16.561 11.316 1.00 0.00 H new ATOM 0 HG SER A 102 22.697 18.013 9.979 1.00 0.00 H new ATOM 1543 N SER A 103 21.432 14.186 12.185 1.00 0.00 N ATOM 1544 CA SER A 103 21.883 13.458 13.366 1.00 0.00 C ATOM 1545 C SER A 103 21.028 12.217 13.600 1.00 0.00 C ATOM 1546 O SER A 103 19.801 12.294 13.643 1.00 0.00 O ATOM 1547 CB SER A 103 21.836 14.365 14.598 1.00 0.00 C ATOM 1548 OG SER A 103 23.131 14.823 14.944 1.00 0.00 O ATOM 0 H SER A 103 20.576 14.723 12.322 1.00 0.00 H new ATOM 0 HA SER A 103 22.912 13.141 13.196 1.00 0.00 H new ATOM 0 HB2 SER A 103 21.186 15.218 14.401 1.00 0.00 H new ATOM 0 HB3 SER A 103 21.403 13.821 15.437 1.00 0.00 H new ATOM 0 HG SER A 103 23.073 15.402 15.733 1.00 0.00 H new ATOM 1554 N GLY A 104 21.687 11.071 13.750 1.00 0.00 N ATOM 1555 CA GLY A 104 20.973 9.829 13.978 1.00 0.00 C ATOM 1556 C GLY A 104 20.512 9.181 12.687 1.00 0.00 C ATOM 1557 O GLY A 104 21.160 8.267 12.178 1.00 0.00 O ATOM 0 H GLY A 104 22.703 10.982 13.718 1.00 0.00 H new ATOM 0 HA2 GLY A 104 21.618 9.136 14.519 1.00 0.00 H new ATOM 0 HA3 GLY A 104 20.109 10.022 14.613 1.00 0.00 H new TER 1561 GLY A 104