USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 946 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 833 THR OG1 : rot -167:sc= 0.884 USER MOD Set 1.2: A 867 THR OG1 : rot 75:sc= 0.455! USER MOD Set 2.1: A 852 ASN : amide:sc= -4.37! C(o=-1!,f=-3.2!) USER MOD Set 2.2: A 855 LYS NZ :NH3+ -149:sc= 1.5 (180deg=-0.00274) USER MOD Set 2.3: A 907 ASN : amide:sc= 1.82 K(o=-1,f=-16!) USER MOD Set 3.1: A 816 MET CE :methyl -146:sc= -0.395 (180deg=-1.79) USER MOD Set 3.2: A 822 MET CE :methyl 145:sc= -0.131 (180deg=-0.711) USER MOD Single : A 786 THR OG1 : rot 180:sc= 0.0381 USER MOD Single : A 788 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 790 THR OG1 : rot 180:sc= 0 USER MOD Single : A 798 TYR OH : rot 96:sc= 1 USER MOD Single : A 800 GLN : amide:sc= -0.169 K(o=-0.17,f=-0.86) USER MOD Single : A 802 THR OG1 : rot -84:sc= 1.03 USER MOD Single : A 804 THR OG1 : rot 75:sc= 0.181 USER MOD Single : A 807 THR OG1 : rot 81:sc= 0.839 USER MOD Single : A 809 THR OG1 : rot 78:sc= 1.28 USER MOD Single : A 811 ASN : amide:sc= -1.36 X(o=-1.4,f=-1.3) USER MOD Single : A 814 SER OG : rot 180:sc= 0 USER MOD Single : A 815 SER OG : rot 81:sc= 1.07 USER MOD Single : A 825 GLN : amide:sc= -1.46 K(o=-1.5,f=-0.09) USER MOD Single : A 831 GLN : amide:sc= -0.594 K(o=-0.59,f=0) USER MOD Single : A 834 SER OG : rot 58:sc= 1.26 USER MOD Single : A 838 ASN : amide:sc= 0.409 X(o=0.41,f=0) USER MOD Single : A 841 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0666) USER MOD Single : A 848 SER OG : rot 180:sc= 0 USER MOD Single : A 853 SER OG : rot 68:sc= 0.51 USER MOD Single : A 858 SER OG : rot -79:sc= 1.16 USER MOD Single : A 861 LYS NZ :NH3+ 170:sc= -0.02 (180deg=-0.155) USER MOD Single : A 869 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0683) USER MOD Single : A 870 MET CE :methyl 136:sc= -1.79 (180deg=-2.69!) USER MOD Single : A 875 LYS NZ :NH3+ 173:sc= 1.26 (180deg=1.06) USER MOD Single : A 880 HIS : no HD1:sc= 0 X(o=0,f=-0.0069) USER MOD Single : A 883 SER OG : rot 160:sc= 0.0137 USER MOD Single : A 886 GLN : amide:sc= -1.39 K(o=-1.4,f=-0.27) USER MOD Single : A 887 GLN : amide:sc= 0.519 K(o=0.52,f=-1.4) USER MOD Single : A 888 GLN : amide:sc= -1.09 K(o=-1.1,f=-2.8!) USER MOD Single : A 899 MET CE :methyl 148:sc= -0.183 (180deg=-0.903) USER MOD Single : A 901 THR OG1 : rot 75:sc= 0.533 USER MOD Single : A 902 ASN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 906 GLN : amide:sc= -1.8! K(o=-1.8!,f=-0.51) USER MOD Single : A 910 LYS NZ :NH3+ 172:sc= 1.12 (180deg=0.965) USER MOD Single : A 911 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 781 22.314 -2.665 28.654 1.00 0.00 N ATOM 2 CA GLY A 781 23.740 -2.383 28.945 1.00 0.00 C ATOM 3 C GLY A 781 24.656 -2.904 27.857 1.00 0.00 C ATOM 4 O GLY A 781 25.548 -2.193 27.393 1.00 0.00 O ATOM 0 HA2 GLY A 781 23.882 -1.308 29.054 1.00 0.00 H new ATOM 0 HA3 GLY A 781 24.013 -2.839 29.897 1.00 0.00 H new ATOM 10 N ILE A 782 24.438 -4.145 27.444 1.00 0.00 N ATOM 11 CA ILE A 782 25.229 -4.745 26.384 1.00 0.00 C ATOM 12 C ILE A 782 24.316 -5.382 25.336 1.00 0.00 C ATOM 13 O ILE A 782 23.401 -6.144 25.663 1.00 0.00 O ATOM 14 CB ILE A 782 26.231 -5.791 26.936 1.00 0.00 C ATOM 15 CG1 ILE A 782 27.022 -6.447 25.800 1.00 0.00 C ATOM 16 CG2 ILE A 782 25.520 -6.848 27.767 1.00 0.00 C ATOM 17 CD1 ILE A 782 27.895 -5.480 25.029 1.00 0.00 C ATOM 0 H ILE A 782 23.717 -4.755 27.829 1.00 0.00 H new ATOM 0 HA ILE A 782 25.809 -3.950 25.915 1.00 0.00 H new ATOM 0 HB ILE A 782 26.932 -5.265 27.583 1.00 0.00 H new ATOM 0 HG12 ILE A 782 27.648 -7.237 26.214 1.00 0.00 H new ATOM 0 HG13 ILE A 782 26.324 -6.922 25.110 1.00 0.00 H new ATOM 0 HG21 ILE A 782 26.248 -7.568 28.141 1.00 0.00 H new ATOM 0 HG22 ILE A 782 25.016 -6.372 28.608 1.00 0.00 H new ATOM 0 HG23 ILE A 782 24.785 -7.363 27.149 1.00 0.00 H new ATOM 0 HD11 ILE A 782 28.424 -6.016 24.241 1.00 0.00 H new ATOM 0 HD12 ILE A 782 27.273 -4.703 24.584 1.00 0.00 H new ATOM 0 HD13 ILE A 782 28.617 -5.023 25.705 1.00 0.00 H new ATOM 29 N ASP A 783 24.553 -5.040 24.081 1.00 0.00 N ATOM 30 CA ASP A 783 23.761 -5.564 22.979 1.00 0.00 C ATOM 31 C ASP A 783 24.351 -6.879 22.475 1.00 0.00 C ATOM 32 O ASP A 783 25.556 -6.974 22.237 1.00 0.00 O ATOM 33 CB ASP A 783 23.696 -4.537 21.845 1.00 0.00 C ATOM 34 CG ASP A 783 22.846 -5.002 20.680 1.00 0.00 C ATOM 35 OD1 ASP A 783 21.602 -4.986 20.803 1.00 0.00 O ATOM 36 OD2 ASP A 783 23.414 -5.376 19.633 1.00 0.00 O ATOM 0 H ASP A 783 25.293 -4.397 23.798 1.00 0.00 H new ATOM 0 HA ASP A 783 22.749 -5.757 23.336 1.00 0.00 H new ATOM 0 HB2 ASP A 783 23.294 -3.601 22.232 1.00 0.00 H new ATOM 0 HB3 ASP A 783 24.706 -4.328 21.492 1.00 0.00 H new ATOM 41 N PRO A 784 23.512 -7.917 22.339 1.00 0.00 N ATOM 42 CA PRO A 784 23.943 -9.233 21.852 1.00 0.00 C ATOM 43 C PRO A 784 24.464 -9.171 20.423 1.00 0.00 C ATOM 44 O PRO A 784 23.772 -8.691 19.522 1.00 0.00 O ATOM 45 CB PRO A 784 22.670 -10.084 21.916 1.00 0.00 C ATOM 46 CG PRO A 784 21.753 -9.349 22.829 1.00 0.00 C ATOM 47 CD PRO A 784 22.077 -7.896 22.654 1.00 0.00 C ATOM 0 HA PRO A 784 24.764 -9.634 22.446 1.00 0.00 H new ATOM 0 HB2 PRO A 784 22.227 -10.205 20.927 1.00 0.00 H new ATOM 0 HB3 PRO A 784 22.884 -11.084 22.294 1.00 0.00 H new ATOM 0 HG2 PRO A 784 20.711 -9.550 22.580 1.00 0.00 H new ATOM 0 HG3 PRO A 784 21.900 -9.660 23.863 1.00 0.00 H new ATOM 0 HD2 PRO A 784 21.493 -7.446 21.851 1.00 0.00 H new ATOM 0 HD3 PRO A 784 21.870 -7.324 23.558 1.00 0.00 H new ATOM 55 N PHE A 785 25.680 -9.669 20.217 1.00 0.00 N ATOM 56 CA PHE A 785 26.309 -9.629 18.902 1.00 0.00 C ATOM 57 C PHE A 785 25.574 -10.531 17.915 1.00 0.00 C ATOM 58 O PHE A 785 25.601 -10.297 16.708 1.00 0.00 O ATOM 59 CB PHE A 785 27.795 -10.015 18.988 1.00 0.00 C ATOM 60 CG PHE A 785 28.072 -11.372 19.579 1.00 0.00 C ATOM 61 CD1 PHE A 785 28.137 -12.496 18.770 1.00 0.00 C ATOM 62 CD2 PHE A 785 28.279 -11.520 20.941 1.00 0.00 C ATOM 63 CE1 PHE A 785 28.402 -13.741 19.310 1.00 0.00 C ATOM 64 CE2 PHE A 785 28.543 -12.762 21.485 1.00 0.00 C ATOM 65 CZ PHE A 785 28.606 -13.873 20.670 1.00 0.00 C ATOM 0 H PHE A 785 26.248 -10.104 20.944 1.00 0.00 H new ATOM 0 HA PHE A 785 26.246 -8.604 18.536 1.00 0.00 H new ATOM 0 HB2 PHE A 785 28.222 -9.979 17.986 1.00 0.00 H new ATOM 0 HB3 PHE A 785 28.315 -9.264 19.583 1.00 0.00 H new ATOM 0 HD1 PHE A 785 27.979 -12.398 17.706 1.00 0.00 H new ATOM 0 HD2 PHE A 785 28.233 -10.654 21.585 1.00 0.00 H new ATOM 0 HE1 PHE A 785 28.449 -14.609 18.669 1.00 0.00 H new ATOM 0 HE2 PHE A 785 28.700 -12.863 22.549 1.00 0.00 H new ATOM 0 HZ PHE A 785 28.814 -14.844 21.094 1.00 0.00 H new ATOM 75 N THR A 786 24.914 -11.554 18.433 1.00 0.00 N ATOM 76 CA THR A 786 24.107 -12.433 17.608 1.00 0.00 C ATOM 77 C THR A 786 22.760 -11.791 17.312 1.00 0.00 C ATOM 78 O THR A 786 22.341 -11.698 16.156 1.00 0.00 O ATOM 79 CB THR A 786 23.901 -13.791 18.297 1.00 0.00 C ATOM 80 OG1 THR A 786 23.700 -13.587 19.702 1.00 0.00 O ATOM 81 CG2 THR A 786 25.099 -14.703 18.074 1.00 0.00 C ATOM 0 H THR A 786 24.923 -11.795 19.424 1.00 0.00 H new ATOM 0 HA THR A 786 24.636 -12.598 16.669 1.00 0.00 H new ATOM 0 HB THR A 786 23.023 -14.271 17.864 1.00 0.00 H new ATOM 0 HG1 THR A 786 23.567 -14.452 20.142 1.00 0.00 H new ATOM 0 HG21 THR A 786 24.927 -15.657 18.572 1.00 0.00 H new ATOM 0 HG22 THR A 786 25.235 -14.870 17.006 1.00 0.00 H new ATOM 0 HG23 THR A 786 25.994 -14.235 18.485 1.00 0.00 H new ATOM 89 N ALA A 787 22.110 -11.354 18.383 1.00 0.00 N ATOM 90 CA ALA A 787 20.841 -10.628 18.321 1.00 0.00 C ATOM 91 C ALA A 787 19.672 -11.533 17.947 1.00 0.00 C ATOM 92 O ALA A 787 19.838 -12.555 17.280 1.00 0.00 O ATOM 93 CB ALA A 787 20.930 -9.450 17.359 1.00 0.00 C ATOM 0 H ALA A 787 22.451 -11.494 19.334 1.00 0.00 H new ATOM 0 HA ALA A 787 20.650 -10.248 19.324 1.00 0.00 H new ATOM 0 HB1 ALA A 787 19.973 -8.929 17.333 1.00 0.00 H new ATOM 0 HB2 ALA A 787 21.708 -8.764 17.695 1.00 0.00 H new ATOM 0 HB3 ALA A 787 21.173 -9.813 16.360 1.00 0.00 H new ATOM 99 N HIS A 788 18.483 -11.146 18.384 1.00 0.00 N ATOM 100 CA HIS A 788 17.266 -11.888 18.073 1.00 0.00 C ATOM 101 C HIS A 788 16.528 -11.242 16.908 1.00 0.00 C ATOM 102 O HIS A 788 15.394 -11.605 16.596 1.00 0.00 O ATOM 103 CB HIS A 788 16.353 -11.968 19.299 1.00 0.00 C ATOM 104 CG HIS A 788 16.791 -12.986 20.308 1.00 0.00 C ATOM 105 ND1 HIS A 788 17.541 -12.675 21.421 1.00 0.00 N ATOM 106 CD2 HIS A 788 16.576 -14.321 20.365 1.00 0.00 C ATOM 107 CE1 HIS A 788 17.768 -13.775 22.116 1.00 0.00 C ATOM 108 NE2 HIS A 788 17.193 -14.785 21.498 1.00 0.00 N ATOM 0 H HIS A 788 18.333 -10.317 18.959 1.00 0.00 H new ATOM 0 HA HIS A 788 17.550 -12.901 17.787 1.00 0.00 H new ATOM 0 HB2 HIS A 788 16.313 -10.989 19.777 1.00 0.00 H new ATOM 0 HB3 HIS A 788 15.340 -12.205 18.973 1.00 0.00 H new ATOM 0 HD2 HIS A 788 16.021 -14.911 19.651 1.00 0.00 H new ATOM 0 HE1 HIS A 788 18.330 -13.836 23.036 1.00 0.00 H new ATOM 0 HE2 HIS A 788 17.205 -15.756 21.811 1.00 0.00 H new ATOM 116 N ALA A 789 17.176 -10.278 16.273 1.00 0.00 N ATOM 117 CA ALA A 789 16.625 -9.641 15.088 1.00 0.00 C ATOM 118 C ALA A 789 17.032 -10.422 13.847 1.00 0.00 C ATOM 119 O ALA A 789 18.156 -10.923 13.765 1.00 0.00 O ATOM 120 CB ALA A 789 17.098 -8.199 14.990 1.00 0.00 C ATOM 0 H ALA A 789 18.087 -9.919 16.560 1.00 0.00 H new ATOM 0 HA ALA A 789 15.537 -9.637 15.162 1.00 0.00 H new ATOM 0 HB1 ALA A 789 16.676 -7.738 14.097 1.00 0.00 H new ATOM 0 HB2 ALA A 789 16.771 -7.648 15.872 1.00 0.00 H new ATOM 0 HB3 ALA A 789 18.186 -8.176 14.930 1.00 0.00 H new ATOM 126 N THR A 790 16.124 -10.534 12.895 1.00 0.00 N ATOM 127 CA THR A 790 16.397 -11.280 11.681 1.00 0.00 C ATOM 128 C THR A 790 15.933 -10.506 10.443 1.00 0.00 C ATOM 129 O THR A 790 14.809 -10.660 9.958 1.00 0.00 O ATOM 130 CB THR A 790 15.764 -12.694 11.735 1.00 0.00 C ATOM 131 OG1 THR A 790 15.924 -13.369 10.479 1.00 0.00 O ATOM 132 CG2 THR A 790 14.289 -12.636 12.113 1.00 0.00 C ATOM 0 H THR A 790 15.193 -10.119 12.939 1.00 0.00 H new ATOM 0 HA THR A 790 17.477 -11.409 11.605 1.00 0.00 H new ATOM 0 HB THR A 790 16.288 -13.255 12.509 1.00 0.00 H new ATOM 0 HG1 THR A 790 15.520 -14.260 10.533 1.00 0.00 H new ATOM 0 HG21 THR A 790 13.880 -13.646 12.140 1.00 0.00 H new ATOM 0 HG22 THR A 790 14.183 -12.175 13.095 1.00 0.00 H new ATOM 0 HG23 THR A 790 13.747 -12.045 11.374 1.00 0.00 H new ATOM 140 N GLY A 791 16.808 -9.636 9.966 1.00 0.00 N ATOM 141 CA GLY A 791 16.536 -8.876 8.766 1.00 0.00 C ATOM 142 C GLY A 791 17.793 -8.691 7.949 1.00 0.00 C ATOM 143 O GLY A 791 18.169 -7.567 7.608 1.00 0.00 O ATOM 0 H GLY A 791 17.713 -9.441 10.395 1.00 0.00 H new ATOM 0 HA2 GLY A 791 15.782 -9.389 8.169 1.00 0.00 H new ATOM 0 HA3 GLY A 791 16.124 -7.903 9.033 1.00 0.00 H new ATOM 147 N ALA A 792 18.444 -9.804 7.637 1.00 0.00 N ATOM 148 CA ALA A 792 19.732 -9.781 6.960 1.00 0.00 C ATOM 149 C ALA A 792 19.597 -10.234 5.513 1.00 0.00 C ATOM 150 O ALA A 792 20.582 -10.289 4.776 1.00 0.00 O ATOM 151 CB ALA A 792 20.727 -10.661 7.698 1.00 0.00 C ATOM 0 H ALA A 792 18.097 -10.740 7.844 1.00 0.00 H new ATOM 0 HA ALA A 792 20.099 -8.755 6.960 1.00 0.00 H new ATOM 0 HB1 ALA A 792 21.687 -10.636 7.182 1.00 0.00 H new ATOM 0 HB2 ALA A 792 20.852 -10.293 8.716 1.00 0.00 H new ATOM 0 HB3 ALA A 792 20.356 -11.686 7.725 1.00 0.00 H new ATOM 157 N GLY A 793 18.379 -10.566 5.115 1.00 0.00 N ATOM 158 CA GLY A 793 18.132 -10.973 3.745 1.00 0.00 C ATOM 159 C GLY A 793 18.122 -9.791 2.798 1.00 0.00 C ATOM 160 O GLY A 793 17.824 -8.669 3.214 1.00 0.00 O ATOM 0 H GLY A 793 17.555 -10.561 5.716 1.00 0.00 H new ATOM 0 HA2 GLY A 793 18.899 -11.682 3.433 1.00 0.00 H new ATOM 0 HA3 GLY A 793 17.176 -11.493 3.687 1.00 0.00 H new ATOM 164 N PRO A 794 18.459 -10.007 1.515 1.00 0.00 N ATOM 165 CA PRO A 794 18.462 -8.943 0.511 1.00 0.00 C ATOM 166 C PRO A 794 17.083 -8.334 0.322 1.00 0.00 C ATOM 167 O PRO A 794 16.080 -9.049 0.233 1.00 0.00 O ATOM 168 CB PRO A 794 18.903 -9.643 -0.778 1.00 0.00 C ATOM 169 CG PRO A 794 19.539 -10.917 -0.339 1.00 0.00 C ATOM 170 CD PRO A 794 18.866 -11.301 0.948 1.00 0.00 C ATOM 0 HA PRO A 794 19.115 -8.121 0.805 1.00 0.00 H new ATOM 0 HB2 PRO A 794 18.052 -9.834 -1.432 1.00 0.00 H new ATOM 0 HB3 PRO A 794 19.605 -9.027 -1.339 1.00 0.00 H new ATOM 0 HG2 PRO A 794 19.412 -11.695 -1.092 1.00 0.00 H new ATOM 0 HG3 PRO A 794 20.611 -10.787 -0.193 1.00 0.00 H new ATOM 0 HD2 PRO A 794 18.009 -11.952 0.775 1.00 0.00 H new ATOM 0 HD3 PRO A 794 19.544 -11.836 1.613 1.00 0.00 H new ATOM 178 N ALA A 795 17.036 -7.015 0.263 1.00 0.00 N ATOM 179 CA ALA A 795 15.787 -6.304 0.074 1.00 0.00 C ATOM 180 C ALA A 795 16.013 -5.067 -0.776 1.00 0.00 C ATOM 181 O ALA A 795 17.129 -4.552 -0.840 1.00 0.00 O ATOM 182 CB ALA A 795 15.190 -5.915 1.418 1.00 0.00 C ATOM 0 H ALA A 795 17.855 -6.412 0.344 1.00 0.00 H new ATOM 0 HA ALA A 795 15.086 -6.962 -0.440 1.00 0.00 H new ATOM 0 HB1 ALA A 795 14.253 -5.382 1.259 1.00 0.00 H new ATOM 0 HB2 ALA A 795 15.002 -6.813 2.006 1.00 0.00 H new ATOM 0 HB3 ALA A 795 15.888 -5.271 1.953 1.00 0.00 H new ATOM 188 N GLY A 796 14.967 -4.622 -1.453 1.00 0.00 N ATOM 189 CA GLY A 796 15.043 -3.378 -2.196 1.00 0.00 C ATOM 190 C GLY A 796 14.958 -2.178 -1.273 1.00 0.00 C ATOM 191 O GLY A 796 15.891 -1.900 -0.519 1.00 0.00 O ATOM 0 H GLY A 796 14.066 -5.098 -1.503 1.00 0.00 H new ATOM 0 HA2 GLY A 796 15.978 -3.343 -2.756 1.00 0.00 H new ATOM 0 HA3 GLY A 796 14.233 -3.337 -2.924 1.00 0.00 H new ATOM 195 N ARG A 797 13.843 -1.466 -1.324 1.00 0.00 N ATOM 196 CA ARG A 797 13.596 -0.374 -0.389 1.00 0.00 C ATOM 197 C ARG A 797 12.283 -0.597 0.337 1.00 0.00 C ATOM 198 O ARG A 797 12.249 -0.755 1.555 1.00 0.00 O ATOM 199 CB ARG A 797 13.551 0.986 -1.092 1.00 0.00 C ATOM 200 CG ARG A 797 14.812 1.335 -1.850 1.00 0.00 C ATOM 201 CD ARG A 797 14.883 2.822 -2.147 1.00 0.00 C ATOM 202 NE ARG A 797 16.110 3.183 -2.852 1.00 0.00 N ATOM 203 CZ ARG A 797 16.689 4.383 -2.777 1.00 0.00 C ATOM 204 NH1 ARG A 797 16.192 5.324 -1.983 1.00 0.00 N ATOM 205 NH2 ARG A 797 17.783 4.632 -3.482 1.00 0.00 N ATOM 0 H ARG A 797 13.095 -1.622 -2.000 1.00 0.00 H new ATOM 0 HA ARG A 797 14.424 -0.365 0.320 1.00 0.00 H new ATOM 0 HB2 ARG A 797 12.710 0.996 -1.785 1.00 0.00 H new ATOM 0 HB3 ARG A 797 13.361 1.760 -0.349 1.00 0.00 H new ATOM 0 HG2 ARG A 797 15.684 1.036 -1.267 1.00 0.00 H new ATOM 0 HG3 ARG A 797 14.845 0.773 -2.784 1.00 0.00 H new ATOM 0 HD2 ARG A 797 14.021 3.113 -2.748 1.00 0.00 H new ATOM 0 HD3 ARG A 797 14.824 3.381 -1.213 1.00 0.00 H new ATOM 0 HE ARG A 797 16.552 2.474 -3.438 1.00 0.00 H new ATOM 0 HH11 ARG A 797 15.361 5.133 -1.424 1.00 0.00 H new ATOM 0 HH12 ARG A 797 16.641 6.238 -1.932 1.00 0.00 H new ATOM 0 HH21 ARG A 797 18.180 3.907 -4.080 1.00 0.00 H new ATOM 0 HH22 ARG A 797 18.228 5.548 -3.427 1.00 0.00 H new ATOM 219 N TYR A 798 11.204 -0.617 -0.431 1.00 0.00 N ATOM 220 CA TYR A 798 9.866 -0.763 0.121 1.00 0.00 C ATOM 221 C TYR A 798 9.206 -1.982 -0.495 1.00 0.00 C ATOM 222 O TYR A 798 8.006 -2.206 -0.344 1.00 0.00 O ATOM 223 CB TYR A 798 9.024 0.475 -0.196 1.00 0.00 C ATOM 224 CG TYR A 798 9.799 1.773 -0.202 1.00 0.00 C ATOM 225 CD1 TYR A 798 10.336 2.300 0.963 1.00 0.00 C ATOM 226 CD2 TYR A 798 9.984 2.475 -1.384 1.00 0.00 C ATOM 227 CE1 TYR A 798 11.033 3.492 0.949 1.00 0.00 C ATOM 228 CE2 TYR A 798 10.673 3.668 -1.407 1.00 0.00 C ATOM 229 CZ TYR A 798 11.196 4.173 -0.240 1.00 0.00 C ATOM 230 OH TYR A 798 11.875 5.364 -0.268 1.00 0.00 O ATOM 0 H TYR A 798 11.230 -0.533 -1.447 1.00 0.00 H new ATOM 0 HA TYR A 798 9.937 -0.878 1.203 1.00 0.00 H new ATOM 0 HB2 TYR A 798 8.556 0.341 -1.171 1.00 0.00 H new ATOM 0 HB3 TYR A 798 8.220 0.550 0.536 1.00 0.00 H new ATOM 0 HD1 TYR A 798 10.207 1.770 1.895 1.00 0.00 H new ATOM 0 HD2 TYR A 798 9.580 2.079 -2.304 1.00 0.00 H new ATOM 0 HE1 TYR A 798 11.448 3.889 1.864 1.00 0.00 H new ATOM 0 HE2 TYR A 798 10.801 4.203 -2.336 1.00 0.00 H new ATOM 0 HH TYR A 798 12.807 5.203 -0.526 1.00 0.00 H new ATOM 240 N ASP A 799 10.024 -2.786 -1.148 1.00 0.00 N ATOM 241 CA ASP A 799 9.551 -3.836 -2.039 1.00 0.00 C ATOM 242 C ASP A 799 8.806 -4.931 -1.290 1.00 0.00 C ATOM 243 O ASP A 799 7.798 -5.442 -1.776 1.00 0.00 O ATOM 244 CB ASP A 799 10.739 -4.451 -2.778 1.00 0.00 C ATOM 245 CG ASP A 799 11.504 -3.448 -3.617 1.00 0.00 C ATOM 246 OD1 ASP A 799 12.014 -2.464 -3.042 1.00 0.00 O ATOM 247 OD2 ASP A 799 11.583 -3.635 -4.854 1.00 0.00 O ATOM 0 H ASP A 799 11.040 -2.731 -1.077 1.00 0.00 H new ATOM 0 HA ASP A 799 8.855 -3.381 -2.744 1.00 0.00 H new ATOM 0 HB2 ASP A 799 11.417 -4.900 -2.052 1.00 0.00 H new ATOM 0 HB3 ASP A 799 10.382 -5.255 -3.421 1.00 0.00 H new ATOM 252 N GLN A 800 9.297 -5.286 -0.113 1.00 0.00 N ATOM 253 CA GLN A 800 8.693 -6.358 0.666 1.00 0.00 C ATOM 254 C GLN A 800 7.273 -5.992 1.094 1.00 0.00 C ATOM 255 O GLN A 800 6.334 -6.761 0.886 1.00 0.00 O ATOM 256 CB GLN A 800 9.547 -6.670 1.897 1.00 0.00 C ATOM 257 CG GLN A 800 9.127 -7.941 2.619 1.00 0.00 C ATOM 258 CD GLN A 800 9.262 -9.171 1.743 1.00 0.00 C ATOM 259 OE1 GLN A 800 10.131 -9.235 0.873 1.00 0.00 O ATOM 260 NE2 GLN A 800 8.406 -10.158 1.962 1.00 0.00 N ATOM 0 H GLN A 800 10.109 -4.850 0.324 1.00 0.00 H new ATOM 0 HA GLN A 800 8.643 -7.245 0.034 1.00 0.00 H new ATOM 0 HB2 GLN A 800 10.590 -6.762 1.593 1.00 0.00 H new ATOM 0 HB3 GLN A 800 9.490 -5.831 2.591 1.00 0.00 H new ATOM 0 HG2 GLN A 800 9.736 -8.066 3.514 1.00 0.00 H new ATOM 0 HG3 GLN A 800 8.093 -7.844 2.949 1.00 0.00 H new ATOM 0 HE21 GLN A 800 7.700 -10.068 2.692 1.00 0.00 H new ATOM 0 HE22 GLN A 800 8.453 -11.008 1.400 1.00 0.00 H new ATOM 269 N ALA A 801 7.121 -4.808 1.671 1.00 0.00 N ATOM 270 CA ALA A 801 5.836 -4.387 2.210 1.00 0.00 C ATOM 271 C ALA A 801 4.854 -4.012 1.100 1.00 0.00 C ATOM 272 O ALA A 801 3.658 -4.283 1.208 1.00 0.00 O ATOM 273 CB ALA A 801 6.023 -3.234 3.178 1.00 0.00 C ATOM 0 H ALA A 801 7.870 -4.124 1.778 1.00 0.00 H new ATOM 0 HA ALA A 801 5.407 -5.231 2.750 1.00 0.00 H new ATOM 0 HB1 ALA A 801 5.054 -2.930 3.573 1.00 0.00 H new ATOM 0 HB2 ALA A 801 6.667 -3.549 3.999 1.00 0.00 H new ATOM 0 HB3 ALA A 801 6.483 -2.394 2.658 1.00 0.00 H new ATOM 279 N THR A 802 5.356 -3.399 0.028 1.00 0.00 N ATOM 280 CA THR A 802 4.500 -3.036 -1.095 1.00 0.00 C ATOM 281 C THR A 802 3.925 -4.280 -1.753 1.00 0.00 C ATOM 282 O THR A 802 2.740 -4.323 -2.079 1.00 0.00 O ATOM 283 CB THR A 802 5.247 -2.203 -2.156 1.00 0.00 C ATOM 284 OG1 THR A 802 6.507 -2.810 -2.460 1.00 0.00 O ATOM 285 CG2 THR A 802 5.464 -0.775 -1.684 1.00 0.00 C ATOM 0 H THR A 802 6.338 -3.147 -0.084 1.00 0.00 H new ATOM 0 HA THR A 802 3.695 -2.424 -0.688 1.00 0.00 H new ATOM 0 HB THR A 802 4.631 -2.175 -3.055 1.00 0.00 H new ATOM 0 HG1 THR A 802 7.176 -2.522 -1.804 1.00 0.00 H new ATOM 0 HG21 THR A 802 5.993 -0.214 -2.454 1.00 0.00 H new ATOM 0 HG22 THR A 802 4.500 -0.305 -1.490 1.00 0.00 H new ATOM 0 HG23 THR A 802 6.055 -0.780 -0.768 1.00 0.00 H new ATOM 293 N ASP A 803 4.768 -5.299 -1.924 1.00 0.00 N ATOM 294 CA ASP A 803 4.338 -6.570 -2.503 1.00 0.00 C ATOM 295 C ASP A 803 3.155 -7.124 -1.729 1.00 0.00 C ATOM 296 O ASP A 803 2.179 -7.591 -2.316 1.00 0.00 O ATOM 297 CB ASP A 803 5.483 -7.585 -2.488 1.00 0.00 C ATOM 298 CG ASP A 803 5.132 -8.874 -3.204 1.00 0.00 C ATOM 299 OD1 ASP A 803 4.581 -9.786 -2.555 1.00 0.00 O ATOM 300 OD2 ASP A 803 5.388 -8.976 -4.423 1.00 0.00 O ATOM 0 H ASP A 803 5.755 -5.267 -1.669 1.00 0.00 H new ATOM 0 HA ASP A 803 4.041 -6.391 -3.536 1.00 0.00 H new ATOM 0 HB2 ASP A 803 6.362 -7.142 -2.956 1.00 0.00 H new ATOM 0 HB3 ASP A 803 5.751 -7.809 -1.455 1.00 0.00 H new ATOM 305 N THR A 804 3.243 -7.045 -0.406 1.00 0.00 N ATOM 306 CA THR A 804 2.163 -7.478 0.460 1.00 0.00 C ATOM 307 C THR A 804 0.871 -6.730 0.121 1.00 0.00 C ATOM 308 O THR A 804 -0.159 -7.347 -0.150 1.00 0.00 O ATOM 309 CB THR A 804 2.519 -7.245 1.942 1.00 0.00 C ATOM 310 OG1 THR A 804 3.785 -7.849 2.242 1.00 0.00 O ATOM 311 CG2 THR A 804 1.451 -7.823 2.859 1.00 0.00 C ATOM 0 H THR A 804 4.058 -6.682 0.088 1.00 0.00 H new ATOM 0 HA THR A 804 2.013 -8.545 0.298 1.00 0.00 H new ATOM 0 HB THR A 804 2.576 -6.170 2.111 1.00 0.00 H new ATOM 0 HG1 THR A 804 4.506 -7.302 1.865 1.00 0.00 H new ATOM 0 HG21 THR A 804 1.728 -7.644 3.898 1.00 0.00 H new ATOM 0 HG22 THR A 804 0.494 -7.344 2.651 1.00 0.00 H new ATOM 0 HG23 THR A 804 1.365 -8.896 2.686 1.00 0.00 H new ATOM 319 N ILE A 805 0.944 -5.404 0.099 1.00 0.00 N ATOM 320 CA ILE A 805 -0.228 -4.575 -0.158 1.00 0.00 C ATOM 321 C ILE A 805 -0.800 -4.826 -1.557 1.00 0.00 C ATOM 322 O ILE A 805 -2.002 -5.057 -1.703 1.00 0.00 O ATOM 323 CB ILE A 805 0.088 -3.075 0.005 1.00 0.00 C ATOM 324 CG1 ILE A 805 0.570 -2.775 1.429 1.00 0.00 C ATOM 325 CG2 ILE A 805 -1.140 -2.237 -0.329 1.00 0.00 C ATOM 326 CD1 ILE A 805 0.939 -1.326 1.651 1.00 0.00 C ATOM 0 H ILE A 805 1.804 -4.879 0.256 1.00 0.00 H new ATOM 0 HA ILE A 805 -0.975 -4.858 0.584 1.00 0.00 H new ATOM 0 HB ILE A 805 0.888 -2.814 -0.688 1.00 0.00 H new ATOM 0 HG12 ILE A 805 -0.212 -3.054 2.135 1.00 0.00 H new ATOM 0 HG13 ILE A 805 1.436 -3.399 1.650 1.00 0.00 H new ATOM 0 HG21 ILE A 805 -0.903 -1.180 -0.210 1.00 0.00 H new ATOM 0 HG22 ILE A 805 -1.441 -2.427 -1.359 1.00 0.00 H new ATOM 0 HG23 ILE A 805 -1.956 -2.504 0.343 1.00 0.00 H new ATOM 0 HD11 ILE A 805 1.271 -1.189 2.680 1.00 0.00 H new ATOM 0 HD12 ILE A 805 1.743 -1.047 0.970 1.00 0.00 H new ATOM 0 HD13 ILE A 805 0.069 -0.696 1.463 1.00 0.00 H new ATOM 338 N LEU A 806 0.059 -4.788 -2.578 1.00 0.00 N ATOM 339 CA LEU A 806 -0.376 -5.012 -3.960 1.00 0.00 C ATOM 340 C LEU A 806 -1.137 -6.332 -4.099 1.00 0.00 C ATOM 341 O LEU A 806 -2.164 -6.396 -4.780 1.00 0.00 O ATOM 342 CB LEU A 806 0.812 -5.000 -4.935 1.00 0.00 C ATOM 343 CG LEU A 806 1.167 -3.639 -5.554 1.00 0.00 C ATOM 344 CD1 LEU A 806 -0.089 -2.870 -5.921 1.00 0.00 C ATOM 345 CD2 LEU A 806 2.042 -2.813 -4.629 1.00 0.00 C ATOM 0 H LEU A 806 1.057 -4.605 -2.475 1.00 0.00 H new ATOM 0 HA LEU A 806 -1.046 -4.190 -4.214 1.00 0.00 H new ATOM 0 HB2 LEU A 806 1.690 -5.377 -4.410 1.00 0.00 H new ATOM 0 HB3 LEU A 806 0.599 -5.699 -5.744 1.00 0.00 H new ATOM 0 HG LEU A 806 1.736 -3.834 -6.463 1.00 0.00 H new ATOM 0 HD11 LEU A 806 0.187 -1.910 -6.357 1.00 0.00 H new ATOM 0 HD12 LEU A 806 -0.669 -3.444 -6.644 1.00 0.00 H new ATOM 0 HD13 LEU A 806 -0.688 -2.703 -5.026 1.00 0.00 H new ATOM 0 HD21 LEU A 806 2.272 -1.858 -5.102 1.00 0.00 H new ATOM 0 HD22 LEU A 806 1.515 -2.636 -3.691 1.00 0.00 H new ATOM 0 HD23 LEU A 806 2.969 -3.351 -4.429 1.00 0.00 H new ATOM 357 N THR A 807 -0.636 -7.380 -3.452 1.00 0.00 N ATOM 358 CA THR A 807 -1.269 -8.691 -3.522 1.00 0.00 C ATOM 359 C THR A 807 -2.588 -8.714 -2.745 1.00 0.00 C ATOM 360 O THR A 807 -3.623 -9.120 -3.275 1.00 0.00 O ATOM 361 CB THR A 807 -0.334 -9.792 -2.980 1.00 0.00 C ATOM 362 OG1 THR A 807 0.918 -9.758 -3.676 1.00 0.00 O ATOM 363 CG2 THR A 807 -0.961 -11.170 -3.139 1.00 0.00 C ATOM 0 H THR A 807 0.204 -7.346 -2.875 1.00 0.00 H new ATOM 0 HA THR A 807 -1.476 -8.889 -4.574 1.00 0.00 H new ATOM 0 HB THR A 807 -0.172 -9.603 -1.919 1.00 0.00 H new ATOM 0 HG1 THR A 807 1.482 -9.051 -3.300 1.00 0.00 H new ATOM 0 HG21 THR A 807 -0.280 -11.927 -2.749 1.00 0.00 H new ATOM 0 HG22 THR A 807 -1.901 -11.208 -2.588 1.00 0.00 H new ATOM 0 HG23 THR A 807 -1.152 -11.363 -4.195 1.00 0.00 H new ATOM 371 N VAL A 808 -2.550 -8.254 -1.495 1.00 0.00 N ATOM 372 CA VAL A 808 -3.725 -8.287 -0.626 1.00 0.00 C ATOM 373 C VAL A 808 -4.874 -7.468 -1.213 1.00 0.00 C ATOM 374 O VAL A 808 -6.036 -7.850 -1.094 1.00 0.00 O ATOM 375 CB VAL A 808 -3.396 -7.781 0.800 1.00 0.00 C ATOM 376 CG1 VAL A 808 -4.649 -7.712 1.661 1.00 0.00 C ATOM 377 CG2 VAL A 808 -2.359 -8.680 1.456 1.00 0.00 C ATOM 0 H VAL A 808 -1.718 -7.854 -1.062 1.00 0.00 H new ATOM 0 HA VAL A 808 -4.036 -9.329 -0.558 1.00 0.00 H new ATOM 0 HB VAL A 808 -2.987 -6.774 0.712 1.00 0.00 H new ATOM 0 HG11 VAL A 808 -4.387 -7.354 2.657 1.00 0.00 H new ATOM 0 HG12 VAL A 808 -5.366 -7.028 1.206 1.00 0.00 H new ATOM 0 HG13 VAL A 808 -5.093 -8.705 1.738 1.00 0.00 H new ATOM 0 HG21 VAL A 808 -2.139 -8.311 2.458 1.00 0.00 H new ATOM 0 HG22 VAL A 808 -2.748 -9.696 1.521 1.00 0.00 H new ATOM 0 HG23 VAL A 808 -1.446 -8.678 0.860 1.00 0.00 H new ATOM 387 N THR A 809 -4.539 -6.357 -1.864 1.00 0.00 N ATOM 388 CA THR A 809 -5.540 -5.495 -2.485 1.00 0.00 C ATOM 389 C THR A 809 -6.432 -6.272 -3.458 1.00 0.00 C ATOM 390 O THR A 809 -7.658 -6.134 -3.440 1.00 0.00 O ATOM 391 CB THR A 809 -4.873 -4.333 -3.241 1.00 0.00 C ATOM 392 OG1 THR A 809 -4.120 -3.522 -2.331 1.00 0.00 O ATOM 393 CG2 THR A 809 -5.916 -3.484 -3.947 1.00 0.00 C ATOM 0 H THR A 809 -3.579 -6.032 -1.975 1.00 0.00 H new ATOM 0 HA THR A 809 -6.158 -5.101 -1.678 1.00 0.00 H new ATOM 0 HB THR A 809 -4.200 -4.751 -3.990 1.00 0.00 H new ATOM 0 HG1 THR A 809 -3.274 -3.968 -2.119 1.00 0.00 H new ATOM 0 HG21 THR A 809 -5.424 -2.668 -4.476 1.00 0.00 H new ATOM 0 HG22 THR A 809 -6.464 -4.100 -4.660 1.00 0.00 H new ATOM 0 HG23 THR A 809 -6.610 -3.074 -3.213 1.00 0.00 H new ATOM 401 N GLU A 810 -5.811 -7.101 -4.289 1.00 0.00 N ATOM 402 CA GLU A 810 -6.541 -7.897 -5.269 1.00 0.00 C ATOM 403 C GLU A 810 -7.482 -8.875 -4.583 1.00 0.00 C ATOM 404 O GLU A 810 -8.499 -9.284 -5.150 1.00 0.00 O ATOM 405 CB GLU A 810 -5.570 -8.652 -6.177 1.00 0.00 C ATOM 406 CG GLU A 810 -4.832 -7.753 -7.153 1.00 0.00 C ATOM 407 CD GLU A 810 -5.756 -7.134 -8.185 1.00 0.00 C ATOM 408 OE1 GLU A 810 -6.732 -6.466 -7.793 1.00 0.00 O ATOM 409 OE2 GLU A 810 -5.510 -7.310 -9.395 1.00 0.00 O ATOM 0 H GLU A 810 -4.801 -7.240 -4.304 1.00 0.00 H new ATOM 0 HA GLU A 810 -7.136 -7.217 -5.878 1.00 0.00 H new ATOM 0 HB2 GLU A 810 -4.843 -9.179 -5.560 1.00 0.00 H new ATOM 0 HB3 GLU A 810 -6.121 -9.408 -6.737 1.00 0.00 H new ATOM 0 HG2 GLU A 810 -4.326 -6.961 -6.601 1.00 0.00 H new ATOM 0 HG3 GLU A 810 -4.060 -8.330 -7.661 1.00 0.00 H new ATOM 416 N ASN A 811 -7.144 -9.239 -3.357 1.00 0.00 N ATOM 417 CA ASN A 811 -7.906 -10.232 -2.626 1.00 0.00 C ATOM 418 C ASN A 811 -9.256 -9.683 -2.175 1.00 0.00 C ATOM 419 O ASN A 811 -10.194 -10.447 -1.959 1.00 0.00 O ATOM 420 CB ASN A 811 -7.118 -10.764 -1.421 1.00 0.00 C ATOM 421 CG ASN A 811 -5.817 -11.440 -1.824 1.00 0.00 C ATOM 422 OD1 ASN A 811 -5.682 -11.939 -2.940 1.00 0.00 O ATOM 423 ND2 ASN A 811 -4.857 -11.483 -0.913 1.00 0.00 N ATOM 0 H ASN A 811 -6.345 -8.860 -2.848 1.00 0.00 H new ATOM 0 HA ASN A 811 -8.089 -11.061 -3.310 1.00 0.00 H new ATOM 0 HB2 ASN A 811 -6.899 -9.940 -0.742 1.00 0.00 H new ATOM 0 HB3 ASN A 811 -7.737 -11.474 -0.872 1.00 0.00 H new ATOM 0 HD21 ASN A 811 -3.971 -11.941 -1.127 1.00 0.00 H new ATOM 0 HD22 ASN A 811 -5.004 -11.058 0.003 1.00 0.00 H new ATOM 430 N ILE A 812 -9.369 -8.363 -2.050 1.00 0.00 N ATOM 431 CA ILE A 812 -10.639 -7.754 -1.658 1.00 0.00 C ATOM 432 C ILE A 812 -11.683 -7.942 -2.752 1.00 0.00 C ATOM 433 O ILE A 812 -12.820 -8.311 -2.475 1.00 0.00 O ATOM 434 CB ILE A 812 -10.514 -6.246 -1.318 1.00 0.00 C ATOM 435 CG1 ILE A 812 -9.757 -6.046 -0.005 1.00 0.00 C ATOM 436 CG2 ILE A 812 -11.887 -5.590 -1.229 1.00 0.00 C ATOM 437 CD1 ILE A 812 -8.260 -5.936 -0.168 1.00 0.00 C ATOM 0 H ILE A 812 -8.609 -7.702 -2.212 1.00 0.00 H new ATOM 0 HA ILE A 812 -10.952 -8.267 -0.749 1.00 0.00 H new ATOM 0 HB ILE A 812 -9.953 -5.772 -2.123 1.00 0.00 H new ATOM 0 HG12 ILE A 812 -10.126 -5.143 0.481 1.00 0.00 H new ATOM 0 HG13 ILE A 812 -9.979 -6.880 0.661 1.00 0.00 H new ATOM 0 HG21 ILE A 812 -11.770 -4.533 -0.989 1.00 0.00 H new ATOM 0 HG22 ILE A 812 -12.401 -5.691 -2.185 1.00 0.00 H new ATOM 0 HG23 ILE A 812 -12.473 -6.076 -0.449 1.00 0.00 H new ATOM 0 HD11 ILE A 812 -7.797 -5.796 0.809 1.00 0.00 H new ATOM 0 HD12 ILE A 812 -7.876 -6.848 -0.624 1.00 0.00 H new ATOM 0 HD13 ILE A 812 -8.025 -5.084 -0.807 1.00 0.00 H new ATOM 449 N PHE A 813 -11.288 -7.711 -3.997 1.00 0.00 N ATOM 450 CA PHE A 813 -12.208 -7.852 -5.122 1.00 0.00 C ATOM 451 C PHE A 813 -12.564 -9.317 -5.350 1.00 0.00 C ATOM 452 O PHE A 813 -13.671 -9.639 -5.783 1.00 0.00 O ATOM 453 CB PHE A 813 -11.610 -7.244 -6.392 1.00 0.00 C ATOM 454 CG PHE A 813 -11.498 -5.748 -6.346 1.00 0.00 C ATOM 455 CD1 PHE A 813 -12.558 -4.950 -6.748 1.00 0.00 C ATOM 456 CD2 PHE A 813 -10.337 -5.137 -5.899 1.00 0.00 C ATOM 457 CE1 PHE A 813 -12.463 -3.574 -6.705 1.00 0.00 C ATOM 458 CE2 PHE A 813 -10.237 -3.761 -5.853 1.00 0.00 C ATOM 459 CZ PHE A 813 -11.301 -2.978 -6.257 1.00 0.00 C ATOM 0 H PHE A 813 -10.343 -7.427 -4.254 1.00 0.00 H new ATOM 0 HA PHE A 813 -13.122 -7.310 -4.879 1.00 0.00 H new ATOM 0 HB2 PHE A 813 -10.620 -7.669 -6.557 1.00 0.00 H new ATOM 0 HB3 PHE A 813 -12.226 -7.528 -7.246 1.00 0.00 H new ATOM 0 HD1 PHE A 813 -13.469 -5.411 -7.099 1.00 0.00 H new ATOM 0 HD2 PHE A 813 -9.501 -5.744 -5.583 1.00 0.00 H new ATOM 0 HE1 PHE A 813 -13.296 -2.964 -7.021 1.00 0.00 H new ATOM 0 HE2 PHE A 813 -9.327 -3.297 -5.501 1.00 0.00 H new ATOM 0 HZ PHE A 813 -11.224 -1.901 -6.222 1.00 0.00 H new ATOM 469 N SER A 814 -11.629 -10.203 -5.039 1.00 0.00 N ATOM 470 CA SER A 814 -11.864 -11.632 -5.169 1.00 0.00 C ATOM 471 C SER A 814 -12.814 -12.111 -4.068 1.00 0.00 C ATOM 472 O SER A 814 -13.701 -12.935 -4.304 1.00 0.00 O ATOM 473 CB SER A 814 -10.532 -12.388 -5.110 1.00 0.00 C ATOM 474 OG SER A 814 -10.703 -13.764 -5.398 1.00 0.00 O ATOM 0 H SER A 814 -10.701 -9.957 -4.695 1.00 0.00 H new ATOM 0 HA SER A 814 -12.331 -11.833 -6.133 1.00 0.00 H new ATOM 0 HB2 SER A 814 -9.832 -11.950 -5.822 1.00 0.00 H new ATOM 0 HB3 SER A 814 -10.092 -12.275 -4.119 1.00 0.00 H new ATOM 0 HG SER A 814 -9.835 -14.218 -5.354 1.00 0.00 H new ATOM 480 N SER A 815 -12.629 -11.576 -2.867 1.00 0.00 N ATOM 481 CA SER A 815 -13.468 -11.930 -1.728 1.00 0.00 C ATOM 482 C SER A 815 -14.767 -11.121 -1.724 1.00 0.00 C ATOM 483 O SER A 815 -15.652 -11.358 -0.898 1.00 0.00 O ATOM 484 CB SER A 815 -12.699 -11.697 -0.427 1.00 0.00 C ATOM 485 OG SER A 815 -11.453 -12.374 -0.450 1.00 0.00 O ATOM 0 H SER A 815 -11.902 -10.892 -2.656 1.00 0.00 H new ATOM 0 HA SER A 815 -13.730 -12.985 -1.811 1.00 0.00 H new ATOM 0 HB2 SER A 815 -12.535 -10.629 -0.283 1.00 0.00 H new ATOM 0 HB3 SER A 815 -13.292 -12.046 0.419 1.00 0.00 H new ATOM 0 HG SER A 815 -10.800 -11.841 -0.950 1.00 0.00 H new ATOM 491 N MET A 816 -14.868 -10.167 -2.651 1.00 0.00 N ATOM 492 CA MET A 816 -16.043 -9.307 -2.760 1.00 0.00 C ATOM 493 C MET A 816 -17.308 -10.141 -2.875 1.00 0.00 C ATOM 494 O MET A 816 -17.445 -10.966 -3.783 1.00 0.00 O ATOM 495 CB MET A 816 -15.909 -8.362 -3.956 1.00 0.00 C ATOM 496 CG MET A 816 -17.121 -7.471 -4.175 1.00 0.00 C ATOM 497 SD MET A 816 -16.819 -6.189 -5.402 1.00 0.00 S ATOM 498 CE MET A 816 -15.606 -5.196 -4.537 1.00 0.00 C ATOM 0 H MET A 816 -14.143 -9.971 -3.341 1.00 0.00 H new ATOM 0 HA MET A 816 -16.112 -8.705 -1.854 1.00 0.00 H new ATOM 0 HB2 MET A 816 -15.029 -7.734 -3.814 1.00 0.00 H new ATOM 0 HB3 MET A 816 -15.737 -8.953 -4.856 1.00 0.00 H new ATOM 0 HG2 MET A 816 -17.965 -8.083 -4.493 1.00 0.00 H new ATOM 0 HG3 MET A 816 -17.402 -7.006 -3.230 1.00 0.00 H new ATOM 0 HE1 MET A 816 -15.741 -4.147 -4.799 1.00 0.00 H new ATOM 0 HE2 MET A 816 -15.733 -5.321 -3.462 1.00 0.00 H new ATOM 0 HE3 MET A 816 -14.604 -5.515 -4.823 1.00 0.00 H new ATOM 508 N GLY A 817 -18.215 -9.935 -1.938 1.00 0.00 N ATOM 509 CA GLY A 817 -19.408 -10.744 -1.862 1.00 0.00 C ATOM 510 C GLY A 817 -19.595 -11.293 -0.467 1.00 0.00 C ATOM 511 O GLY A 817 -20.702 -11.654 -0.072 1.00 0.00 O ATOM 0 H GLY A 817 -18.144 -9.213 -1.221 1.00 0.00 H new ATOM 0 HA2 GLY A 817 -20.276 -10.147 -2.142 1.00 0.00 H new ATOM 0 HA3 GLY A 817 -19.342 -11.566 -2.575 1.00 0.00 H new ATOM 515 N ASP A 818 -18.500 -11.358 0.276 1.00 0.00 N ATOM 516 CA ASP A 818 -18.544 -11.776 1.669 1.00 0.00 C ATOM 517 C ASP A 818 -18.139 -10.613 2.556 1.00 0.00 C ATOM 518 O ASP A 818 -17.004 -10.137 2.489 1.00 0.00 O ATOM 519 CB ASP A 818 -17.620 -12.969 1.913 1.00 0.00 C ATOM 520 CG ASP A 818 -17.806 -13.564 3.293 1.00 0.00 C ATOM 521 OD1 ASP A 818 -17.203 -13.034 4.254 1.00 0.00 O ATOM 522 OD2 ASP A 818 -18.547 -14.560 3.426 1.00 0.00 O ATOM 0 H ASP A 818 -17.567 -11.126 -0.064 1.00 0.00 H new ATOM 0 HA ASP A 818 -19.561 -12.084 1.910 1.00 0.00 H new ATOM 0 HB2 ASP A 818 -17.811 -13.734 1.161 1.00 0.00 H new ATOM 0 HB3 ASP A 818 -16.583 -12.654 1.792 1.00 0.00 H new ATOM 527 N ALA A 819 -19.069 -10.157 3.381 1.00 0.00 N ATOM 528 CA ALA A 819 -18.865 -8.958 4.183 1.00 0.00 C ATOM 529 C ALA A 819 -17.740 -9.136 5.200 1.00 0.00 C ATOM 530 O ALA A 819 -16.833 -8.305 5.285 1.00 0.00 O ATOM 531 CB ALA A 819 -20.163 -8.580 4.878 1.00 0.00 C ATOM 0 H ALA A 819 -19.978 -10.601 3.514 1.00 0.00 H new ATOM 0 HA ALA A 819 -18.565 -8.151 3.514 1.00 0.00 H new ATOM 0 HB1 ALA A 819 -20.007 -7.683 5.477 1.00 0.00 H new ATOM 0 HB2 ALA A 819 -20.933 -8.388 4.131 1.00 0.00 H new ATOM 0 HB3 ALA A 819 -20.481 -9.398 5.525 1.00 0.00 H new ATOM 537 N GLY A 820 -17.805 -10.216 5.963 1.00 0.00 N ATOM 538 CA GLY A 820 -16.796 -10.482 6.975 1.00 0.00 C ATOM 539 C GLY A 820 -15.387 -10.557 6.412 1.00 0.00 C ATOM 540 O GLY A 820 -14.452 -9.998 6.991 1.00 0.00 O ATOM 0 H GLY A 820 -18.542 -10.919 5.901 1.00 0.00 H new ATOM 0 HA2 GLY A 820 -16.836 -9.700 7.733 1.00 0.00 H new ATOM 0 HA3 GLY A 820 -17.031 -11.422 7.475 1.00 0.00 H new ATOM 544 N GLU A 821 -15.234 -11.239 5.281 1.00 0.00 N ATOM 545 CA GLU A 821 -13.922 -11.432 4.670 1.00 0.00 C ATOM 546 C GLU A 821 -13.345 -10.115 4.148 1.00 0.00 C ATOM 547 O GLU A 821 -12.168 -9.817 4.355 1.00 0.00 O ATOM 548 CB GLU A 821 -14.016 -12.437 3.522 1.00 0.00 C ATOM 549 CG GLU A 821 -12.668 -12.846 2.953 1.00 0.00 C ATOM 550 CD GLU A 821 -11.879 -13.717 3.906 1.00 0.00 C ATOM 551 OE1 GLU A 821 -11.193 -13.160 4.786 1.00 0.00 O ATOM 552 OE2 GLU A 821 -11.931 -14.957 3.781 1.00 0.00 O ATOM 0 H GLU A 821 -16.004 -11.668 4.768 1.00 0.00 H new ATOM 0 HA GLU A 821 -13.255 -11.816 5.441 1.00 0.00 H new ATOM 0 HB2 GLU A 821 -14.537 -13.328 3.873 1.00 0.00 H new ATOM 0 HB3 GLU A 821 -14.621 -12.007 2.724 1.00 0.00 H new ATOM 0 HG2 GLU A 821 -12.820 -13.382 2.016 1.00 0.00 H new ATOM 0 HG3 GLU A 821 -12.090 -11.952 2.719 1.00 0.00 H new ATOM 559 N MET A 822 -14.179 -9.324 3.478 1.00 0.00 N ATOM 560 CA MET A 822 -13.723 -8.083 2.852 1.00 0.00 C ATOM 561 C MET A 822 -13.151 -7.110 3.880 1.00 0.00 C ATOM 562 O MET A 822 -12.139 -6.455 3.628 1.00 0.00 O ATOM 563 CB MET A 822 -14.863 -7.414 2.084 1.00 0.00 C ATOM 564 CG MET A 822 -15.286 -8.171 0.834 1.00 0.00 C ATOM 565 SD MET A 822 -16.713 -7.428 0.016 1.00 0.00 S ATOM 566 CE MET A 822 -16.094 -5.778 -0.308 1.00 0.00 C ATOM 0 H MET A 822 -15.173 -9.518 3.354 1.00 0.00 H new ATOM 0 HA MET A 822 -12.928 -8.347 2.155 1.00 0.00 H new ATOM 0 HB2 MET A 822 -15.724 -7.312 2.745 1.00 0.00 H new ATOM 0 HB3 MET A 822 -14.557 -6.407 1.802 1.00 0.00 H new ATOM 0 HG2 MET A 822 -14.450 -8.206 0.136 1.00 0.00 H new ATOM 0 HG3 MET A 822 -15.522 -9.201 1.101 1.00 0.00 H new ATOM 0 HE1 MET A 822 -16.496 -5.418 -1.255 1.00 0.00 H new ATOM 0 HE2 MET A 822 -16.404 -5.109 0.495 1.00 0.00 H new ATOM 0 HE3 MET A 822 -15.006 -5.802 -0.361 1.00 0.00 H new ATOM 576 N VAL A 823 -13.790 -7.029 5.039 1.00 0.00 N ATOM 577 CA VAL A 823 -13.321 -6.152 6.106 1.00 0.00 C ATOM 578 C VAL A 823 -11.976 -6.640 6.646 1.00 0.00 C ATOM 579 O VAL A 823 -11.092 -5.839 6.957 1.00 0.00 O ATOM 580 CB VAL A 823 -14.350 -6.059 7.256 1.00 0.00 C ATOM 581 CG1 VAL A 823 -13.847 -5.153 8.370 1.00 0.00 C ATOM 582 CG2 VAL A 823 -15.687 -5.559 6.727 1.00 0.00 C ATOM 0 H VAL A 823 -14.632 -7.558 5.265 1.00 0.00 H new ATOM 0 HA VAL A 823 -13.196 -5.155 5.683 1.00 0.00 H new ATOM 0 HB VAL A 823 -14.486 -7.058 7.671 1.00 0.00 H new ATOM 0 HG11 VAL A 823 -14.591 -5.106 9.165 1.00 0.00 H new ATOM 0 HG12 VAL A 823 -12.914 -5.551 8.769 1.00 0.00 H new ATOM 0 HG13 VAL A 823 -13.675 -4.152 7.975 1.00 0.00 H new ATOM 0 HG21 VAL A 823 -16.403 -5.498 7.547 1.00 0.00 H new ATOM 0 HG22 VAL A 823 -15.557 -4.571 6.285 1.00 0.00 H new ATOM 0 HG23 VAL A 823 -16.060 -6.249 5.970 1.00 0.00 H new ATOM 592 N ARG A 824 -11.822 -7.957 6.723 1.00 0.00 N ATOM 593 CA ARG A 824 -10.570 -8.563 7.166 1.00 0.00 C ATOM 594 C ARG A 824 -9.427 -8.184 6.230 1.00 0.00 C ATOM 595 O ARG A 824 -8.348 -7.797 6.676 1.00 0.00 O ATOM 596 CB ARG A 824 -10.714 -10.085 7.224 1.00 0.00 C ATOM 597 CG ARG A 824 -9.403 -10.814 7.472 1.00 0.00 C ATOM 598 CD ARG A 824 -9.599 -12.319 7.473 1.00 0.00 C ATOM 599 NE ARG A 824 -10.410 -12.766 8.604 1.00 0.00 N ATOM 600 CZ ARG A 824 -11.527 -13.481 8.484 1.00 0.00 C ATOM 601 NH1 ARG A 824 -12.015 -13.767 7.283 1.00 0.00 N ATOM 602 NH2 ARG A 824 -12.165 -13.894 9.572 1.00 0.00 N ATOM 0 H ARG A 824 -12.551 -8.629 6.483 1.00 0.00 H new ATOM 0 HA ARG A 824 -10.340 -8.187 8.163 1.00 0.00 H new ATOM 0 HB2 ARG A 824 -11.419 -10.345 8.014 1.00 0.00 H new ATOM 0 HB3 ARG A 824 -11.143 -10.437 6.286 1.00 0.00 H new ATOM 0 HG2 ARG A 824 -8.681 -10.540 6.703 1.00 0.00 H new ATOM 0 HG3 ARG A 824 -8.985 -10.499 8.428 1.00 0.00 H new ATOM 0 HD2 ARG A 824 -10.077 -12.623 6.542 1.00 0.00 H new ATOM 0 HD3 ARG A 824 -8.627 -12.811 7.507 1.00 0.00 H new ATOM 0 HE ARG A 824 -10.101 -12.515 9.543 1.00 0.00 H new ATOM 0 HH11 ARG A 824 -11.534 -13.439 6.446 1.00 0.00 H new ATOM 0 HH12 ARG A 824 -12.871 -14.315 7.198 1.00 0.00 H new ATOM 0 HH21 ARG A 824 -11.799 -13.664 10.496 1.00 0.00 H new ATOM 0 HH22 ARG A 824 -13.021 -14.442 9.484 1.00 0.00 H new ATOM 616 N GLN A 825 -9.680 -8.292 4.931 1.00 0.00 N ATOM 617 CA GLN A 825 -8.677 -7.969 3.921 1.00 0.00 C ATOM 618 C GLN A 825 -8.215 -6.518 4.046 1.00 0.00 C ATOM 619 O GLN A 825 -7.027 -6.220 3.903 1.00 0.00 O ATOM 620 CB GLN A 825 -9.235 -8.223 2.520 1.00 0.00 C ATOM 621 CG GLN A 825 -9.572 -9.680 2.242 1.00 0.00 C ATOM 622 CD GLN A 825 -8.356 -10.587 2.288 1.00 0.00 C ATOM 623 OE1 GLN A 825 -8.455 -11.762 2.640 1.00 0.00 O ATOM 624 NE2 GLN A 825 -7.202 -10.054 1.916 1.00 0.00 N ATOM 0 H GLN A 825 -10.574 -8.602 4.550 1.00 0.00 H new ATOM 0 HA GLN A 825 -7.815 -8.616 4.085 1.00 0.00 H new ATOM 0 HB2 GLN A 825 -10.133 -7.621 2.383 1.00 0.00 H new ATOM 0 HB3 GLN A 825 -8.508 -7.882 1.783 1.00 0.00 H new ATOM 0 HG2 GLN A 825 -10.304 -10.024 2.973 1.00 0.00 H new ATOM 0 HG3 GLN A 825 -10.041 -9.758 1.261 1.00 0.00 H new ATOM 0 HE21 GLN A 825 -7.161 -9.076 1.631 1.00 0.00 H new ATOM 0 HE22 GLN A 825 -6.355 -10.622 1.915 1.00 0.00 H new ATOM 633 N ALA A 826 -9.158 -5.623 4.318 1.00 0.00 N ATOM 634 CA ALA A 826 -8.847 -4.209 4.494 1.00 0.00 C ATOM 635 C ALA A 826 -7.964 -3.991 5.719 1.00 0.00 C ATOM 636 O ALA A 826 -7.059 -3.156 5.707 1.00 0.00 O ATOM 637 CB ALA A 826 -10.126 -3.399 4.614 1.00 0.00 C ATOM 0 H ALA A 826 -10.146 -5.852 4.422 1.00 0.00 H new ATOM 0 HA ALA A 826 -8.297 -3.871 3.616 1.00 0.00 H new ATOM 0 HB1 ALA A 826 -9.879 -2.346 4.745 1.00 0.00 H new ATOM 0 HB2 ALA A 826 -10.721 -3.522 3.709 1.00 0.00 H new ATOM 0 HB3 ALA A 826 -10.698 -3.747 5.474 1.00 0.00 H new ATOM 643 N ARG A 827 -8.229 -4.756 6.773 1.00 0.00 N ATOM 644 CA ARG A 827 -7.438 -4.681 7.997 1.00 0.00 C ATOM 645 C ARG A 827 -5.986 -5.062 7.731 1.00 0.00 C ATOM 646 O ARG A 827 -5.063 -4.478 8.305 1.00 0.00 O ATOM 647 CB ARG A 827 -8.038 -5.595 9.068 1.00 0.00 C ATOM 648 CG ARG A 827 -9.349 -5.079 9.637 1.00 0.00 C ATOM 649 CD ARG A 827 -10.072 -6.145 10.446 1.00 0.00 C ATOM 650 NE ARG A 827 -9.205 -6.775 11.444 1.00 0.00 N ATOM 651 CZ ARG A 827 -9.290 -6.553 12.755 1.00 0.00 C ATOM 652 NH1 ARG A 827 -10.166 -5.678 13.232 1.00 0.00 N ATOM 653 NH2 ARG A 827 -8.506 -7.221 13.590 1.00 0.00 N ATOM 0 H ARG A 827 -8.988 -5.437 6.804 1.00 0.00 H new ATOM 0 HA ARG A 827 -7.459 -3.652 8.356 1.00 0.00 H new ATOM 0 HB2 ARG A 827 -8.200 -6.585 8.641 1.00 0.00 H new ATOM 0 HB3 ARG A 827 -7.319 -5.712 9.879 1.00 0.00 H new ATOM 0 HG2 ARG A 827 -9.155 -4.212 10.269 1.00 0.00 H new ATOM 0 HG3 ARG A 827 -9.991 -4.743 8.823 1.00 0.00 H new ATOM 0 HD2 ARG A 827 -10.931 -5.697 10.946 1.00 0.00 H new ATOM 0 HD3 ARG A 827 -10.459 -6.909 9.771 1.00 0.00 H new ATOM 0 HE ARG A 827 -8.491 -7.425 11.115 1.00 0.00 H new ATOM 0 HH11 ARG A 827 -10.779 -5.171 12.594 1.00 0.00 H new ATOM 0 HH12 ARG A 827 -10.226 -5.513 14.237 1.00 0.00 H new ATOM 0 HH21 ARG A 827 -7.840 -7.903 13.228 1.00 0.00 H new ATOM 0 HH22 ARG A 827 -8.569 -7.053 14.594 1.00 0.00 H new ATOM 667 N ILE A 828 -5.791 -6.036 6.848 1.00 0.00 N ATOM 668 CA ILE A 828 -4.455 -6.471 6.466 1.00 0.00 C ATOM 669 C ILE A 828 -3.706 -5.340 5.759 1.00 0.00 C ATOM 670 O ILE A 828 -2.532 -5.089 6.040 1.00 0.00 O ATOM 671 CB ILE A 828 -4.508 -7.712 5.547 1.00 0.00 C ATOM 672 CG1 ILE A 828 -5.305 -8.833 6.218 1.00 0.00 C ATOM 673 CG2 ILE A 828 -3.099 -8.187 5.213 1.00 0.00 C ATOM 674 CD1 ILE A 828 -5.540 -10.035 5.325 1.00 0.00 C ATOM 0 H ILE A 828 -6.546 -6.540 6.383 1.00 0.00 H new ATOM 0 HA ILE A 828 -3.924 -6.741 7.379 1.00 0.00 H new ATOM 0 HB ILE A 828 -5.008 -7.437 4.618 1.00 0.00 H new ATOM 0 HG12 ILE A 828 -4.776 -9.156 7.115 1.00 0.00 H new ATOM 0 HG13 ILE A 828 -6.268 -8.438 6.541 1.00 0.00 H new ATOM 0 HG21 ILE A 828 -3.154 -9.062 4.565 1.00 0.00 H new ATOM 0 HG22 ILE A 828 -2.558 -7.390 4.702 1.00 0.00 H new ATOM 0 HG23 ILE A 828 -2.576 -8.449 6.133 1.00 0.00 H new ATOM 0 HD11 ILE A 828 -6.111 -10.787 5.870 1.00 0.00 H new ATOM 0 HD12 ILE A 828 -6.097 -9.727 4.440 1.00 0.00 H new ATOM 0 HD13 ILE A 828 -4.581 -10.456 5.022 1.00 0.00 H new ATOM 686 N LEU A 829 -4.397 -4.649 4.853 1.00 0.00 N ATOM 687 CA LEU A 829 -3.807 -3.519 4.139 1.00 0.00 C ATOM 688 C LEU A 829 -3.404 -2.418 5.111 1.00 0.00 C ATOM 689 O LEU A 829 -2.300 -1.881 5.029 1.00 0.00 O ATOM 690 CB LEU A 829 -4.779 -2.952 3.101 1.00 0.00 C ATOM 691 CG LEU A 829 -5.034 -3.843 1.888 1.00 0.00 C ATOM 692 CD1 LEU A 829 -5.944 -3.138 0.896 1.00 0.00 C ATOM 693 CD2 LEU A 829 -3.720 -4.227 1.225 1.00 0.00 C ATOM 0 H LEU A 829 -5.363 -4.852 4.597 1.00 0.00 H new ATOM 0 HA LEU A 829 -2.919 -3.886 3.624 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -5.732 -2.753 3.591 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -4.394 -1.994 2.752 1.00 0.00 H new ATOM 0 HG LEU A 829 -5.529 -4.754 2.225 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -6.117 -3.786 0.037 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -6.896 -2.909 1.375 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -5.473 -2.213 0.564 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -3.920 -4.862 0.362 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -3.200 -3.326 0.900 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -3.097 -4.768 1.937 1.00 0.00 H new ATOM 705 N ALA A 830 -4.301 -2.102 6.038 1.00 0.00 N ATOM 706 CA ALA A 830 -4.053 -1.064 7.031 1.00 0.00 C ATOM 707 C ALA A 830 -2.784 -1.358 7.824 1.00 0.00 C ATOM 708 O ALA A 830 -1.999 -0.457 8.115 1.00 0.00 O ATOM 709 CB ALA A 830 -5.247 -0.933 7.964 1.00 0.00 C ATOM 0 H ALA A 830 -5.212 -2.553 6.122 1.00 0.00 H new ATOM 0 HA ALA A 830 -3.911 -0.118 6.508 1.00 0.00 H new ATOM 0 HB1 ALA A 830 -5.049 -0.155 8.701 1.00 0.00 H new ATOM 0 HB2 ALA A 830 -6.133 -0.669 7.386 1.00 0.00 H new ATOM 0 HB3 ALA A 830 -5.416 -1.881 8.474 1.00 0.00 H new ATOM 715 N GLN A 831 -2.586 -2.628 8.158 1.00 0.00 N ATOM 716 CA GLN A 831 -1.405 -3.051 8.897 1.00 0.00 C ATOM 717 C GLN A 831 -0.146 -2.864 8.050 1.00 0.00 C ATOM 718 O GLN A 831 0.837 -2.275 8.502 1.00 0.00 O ATOM 719 CB GLN A 831 -1.540 -4.521 9.306 1.00 0.00 C ATOM 720 CG GLN A 831 -0.402 -5.014 10.185 1.00 0.00 C ATOM 721 CD GLN A 831 -0.407 -6.521 10.368 1.00 0.00 C ATOM 722 OE1 GLN A 831 0.645 -7.134 10.555 1.00 0.00 O ATOM 723 NE2 GLN A 831 -1.579 -7.133 10.318 1.00 0.00 N ATOM 0 H GLN A 831 -3.231 -3.384 7.927 1.00 0.00 H new ATOM 0 HA GLN A 831 -1.320 -2.435 9.792 1.00 0.00 H new ATOM 0 HB2 GLN A 831 -2.483 -4.657 9.836 1.00 0.00 H new ATOM 0 HB3 GLN A 831 -1.587 -5.137 8.408 1.00 0.00 H new ATOM 0 HG2 GLN A 831 0.548 -4.710 9.746 1.00 0.00 H new ATOM 0 HG3 GLN A 831 -0.470 -4.534 11.161 1.00 0.00 H new ATOM 0 HE21 GLN A 831 -2.430 -6.593 10.161 1.00 0.00 H new ATOM 0 HE22 GLN A 831 -1.631 -8.145 10.436 1.00 0.00 H new ATOM 732 N ALA A 832 -0.199 -3.353 6.817 1.00 0.00 N ATOM 733 CA ALA A 832 0.949 -3.320 5.917 1.00 0.00 C ATOM 734 C ALA A 832 1.363 -1.895 5.577 1.00 0.00 C ATOM 735 O ALA A 832 2.550 -1.562 5.603 1.00 0.00 O ATOM 736 CB ALA A 832 0.637 -4.098 4.650 1.00 0.00 C ATOM 0 H ALA A 832 -1.033 -3.781 6.414 1.00 0.00 H new ATOM 0 HA ALA A 832 1.789 -3.788 6.431 1.00 0.00 H new ATOM 0 HB1 ALA A 832 1.499 -4.069 3.983 1.00 0.00 H new ATOM 0 HB2 ALA A 832 0.411 -5.133 4.905 1.00 0.00 H new ATOM 0 HB3 ALA A 832 -0.223 -3.651 4.151 1.00 0.00 H new ATOM 742 N THR A 833 0.385 -1.055 5.267 1.00 0.00 N ATOM 743 CA THR A 833 0.650 0.334 4.932 1.00 0.00 C ATOM 744 C THR A 833 1.367 1.051 6.073 1.00 0.00 C ATOM 745 O THR A 833 2.256 1.875 5.843 1.00 0.00 O ATOM 746 CB THR A 833 -0.656 1.085 4.597 1.00 0.00 C ATOM 747 OG1 THR A 833 -1.228 0.563 3.392 1.00 0.00 O ATOM 748 CG2 THR A 833 -0.408 2.579 4.450 1.00 0.00 C ATOM 0 H THR A 833 -0.601 -1.314 5.241 1.00 0.00 H new ATOM 0 HA THR A 833 1.295 0.333 4.053 1.00 0.00 H new ATOM 0 HB THR A 833 -1.353 0.935 5.421 1.00 0.00 H new ATOM 0 HG1 THR A 833 -1.926 1.171 3.071 1.00 0.00 H new ATOM 0 HG21 THR A 833 -1.346 3.082 4.214 1.00 0.00 H new ATOM 0 HG22 THR A 833 -0.009 2.975 5.384 1.00 0.00 H new ATOM 0 HG23 THR A 833 0.308 2.752 3.647 1.00 0.00 H new ATOM 756 N SER A 834 1.002 0.701 7.298 1.00 0.00 N ATOM 757 CA SER A 834 1.542 1.367 8.480 1.00 0.00 C ATOM 758 C SER A 834 3.062 1.227 8.545 1.00 0.00 C ATOM 759 O SER A 834 3.769 2.158 8.943 1.00 0.00 O ATOM 760 CB SER A 834 0.900 0.798 9.747 1.00 0.00 C ATOM 761 OG SER A 834 -0.506 0.999 9.739 1.00 0.00 O ATOM 0 H SER A 834 0.333 -0.041 7.502 1.00 0.00 H new ATOM 0 HA SER A 834 1.305 2.429 8.409 1.00 0.00 H new ATOM 0 HB2 SER A 834 1.118 -0.267 9.823 1.00 0.00 H new ATOM 0 HB3 SER A 834 1.334 1.276 10.625 1.00 0.00 H new ATOM 0 HG SER A 834 -0.892 0.580 8.941 1.00 0.00 H new ATOM 767 N ASP A 835 3.562 0.078 8.116 1.00 0.00 N ATOM 768 CA ASP A 835 4.996 -0.179 8.138 1.00 0.00 C ATOM 769 C ASP A 835 5.693 0.631 7.050 1.00 0.00 C ATOM 770 O ASP A 835 6.774 1.184 7.263 1.00 0.00 O ATOM 771 CB ASP A 835 5.272 -1.669 7.944 1.00 0.00 C ATOM 772 CG ASP A 835 6.702 -2.038 8.278 1.00 0.00 C ATOM 773 OD1 ASP A 835 6.996 -2.237 9.477 1.00 0.00 O ATOM 774 OD2 ASP A 835 7.534 -2.137 7.356 1.00 0.00 O ATOM 0 H ASP A 835 2.999 -0.690 7.749 1.00 0.00 H new ATOM 0 HA ASP A 835 5.389 0.125 9.108 1.00 0.00 H new ATOM 0 HB2 ASP A 835 4.594 -2.246 8.573 1.00 0.00 H new ATOM 0 HB3 ASP A 835 5.060 -1.944 6.911 1.00 0.00 H new ATOM 779 N LEU A 836 5.043 0.724 5.893 1.00 0.00 N ATOM 780 CA LEU A 836 5.591 1.455 4.758 1.00 0.00 C ATOM 781 C LEU A 836 5.698 2.942 5.037 1.00 0.00 C ATOM 782 O LEU A 836 6.690 3.564 4.678 1.00 0.00 O ATOM 783 CB LEU A 836 4.742 1.238 3.509 1.00 0.00 C ATOM 784 CG LEU A 836 5.128 0.022 2.678 1.00 0.00 C ATOM 785 CD1 LEU A 836 4.192 -0.125 1.493 1.00 0.00 C ATOM 786 CD2 LEU A 836 6.569 0.145 2.209 1.00 0.00 C ATOM 0 H LEU A 836 4.132 0.300 5.718 1.00 0.00 H new ATOM 0 HA LEU A 836 6.594 1.063 4.590 1.00 0.00 H new ATOM 0 HB2 LEU A 836 3.699 1.139 3.809 1.00 0.00 H new ATOM 0 HB3 LEU A 836 4.811 2.126 2.881 1.00 0.00 H new ATOM 0 HG LEU A 836 5.040 -0.870 3.298 1.00 0.00 H new ATOM 0 HD11 LEU A 836 4.480 -0.998 0.908 1.00 0.00 H new ATOM 0 HD12 LEU A 836 3.170 -0.248 1.850 1.00 0.00 H new ATOM 0 HD13 LEU A 836 4.253 0.766 0.868 1.00 0.00 H new ATOM 0 HD21 LEU A 836 6.834 -0.730 1.616 1.00 0.00 H new ATOM 0 HD22 LEU A 836 6.678 1.043 1.601 1.00 0.00 H new ATOM 0 HD23 LEU A 836 7.229 0.211 3.074 1.00 0.00 H new ATOM 798 N VAL A 837 4.680 3.508 5.675 1.00 0.00 N ATOM 799 CA VAL A 837 4.667 4.937 5.967 1.00 0.00 C ATOM 800 C VAL A 837 5.938 5.354 6.703 1.00 0.00 C ATOM 801 O VAL A 837 6.533 6.386 6.397 1.00 0.00 O ATOM 802 CB VAL A 837 3.423 5.333 6.791 1.00 0.00 C ATOM 803 CG1 VAL A 837 3.438 6.816 7.132 1.00 0.00 C ATOM 804 CG2 VAL A 837 2.155 4.978 6.030 1.00 0.00 C ATOM 0 H VAL A 837 3.856 3.002 5.999 1.00 0.00 H new ATOM 0 HA VAL A 837 4.625 5.463 5.013 1.00 0.00 H new ATOM 0 HB VAL A 837 3.444 4.774 7.726 1.00 0.00 H new ATOM 0 HG11 VAL A 837 2.550 7.065 7.712 1.00 0.00 H new ATOM 0 HG12 VAL A 837 4.329 7.046 7.716 1.00 0.00 H new ATOM 0 HG13 VAL A 837 3.446 7.401 6.212 1.00 0.00 H new ATOM 0 HG21 VAL A 837 1.284 5.262 6.621 1.00 0.00 H new ATOM 0 HG22 VAL A 837 2.139 5.513 5.080 1.00 0.00 H new ATOM 0 HG23 VAL A 837 2.132 3.905 5.842 1.00 0.00 H new ATOM 814 N ASN A 838 6.376 4.524 7.642 1.00 0.00 N ATOM 815 CA ASN A 838 7.603 4.790 8.384 1.00 0.00 C ATOM 816 C ASN A 838 8.830 4.530 7.518 1.00 0.00 C ATOM 817 O ASN A 838 9.771 5.326 7.505 1.00 0.00 O ATOM 818 CB ASN A 838 7.674 3.929 9.651 1.00 0.00 C ATOM 819 CG ASN A 838 6.665 4.349 10.700 1.00 0.00 C ATOM 820 OD1 ASN A 838 6.938 5.227 11.520 1.00 0.00 O ATOM 821 ND2 ASN A 838 5.499 3.719 10.697 1.00 0.00 N ATOM 0 H ASN A 838 5.900 3.662 7.908 1.00 0.00 H new ATOM 0 HA ASN A 838 7.592 5.841 8.672 1.00 0.00 H new ATOM 0 HB2 ASN A 838 7.504 2.885 9.386 1.00 0.00 H new ATOM 0 HB3 ASN A 838 8.677 3.991 10.072 1.00 0.00 H new ATOM 0 HD21 ASN A 838 4.790 3.956 11.391 1.00 0.00 H new ATOM 0 HD22 ASN A 838 5.311 2.997 10.001 1.00 0.00 H new ATOM 828 N ALA A 839 8.803 3.424 6.782 1.00 0.00 N ATOM 829 CA ALA A 839 9.930 3.028 5.943 1.00 0.00 C ATOM 830 C ALA A 839 10.213 4.061 4.856 1.00 0.00 C ATOM 831 O ALA A 839 11.359 4.464 4.658 1.00 0.00 O ATOM 832 CB ALA A 839 9.669 1.665 5.320 1.00 0.00 C ATOM 0 H ALA A 839 8.010 2.783 6.749 1.00 0.00 H new ATOM 0 HA ALA A 839 10.813 2.967 6.580 1.00 0.00 H new ATOM 0 HB1 ALA A 839 10.517 1.381 4.697 1.00 0.00 H new ATOM 0 HB2 ALA A 839 9.534 0.924 6.108 1.00 0.00 H new ATOM 0 HB3 ALA A 839 8.768 1.711 4.708 1.00 0.00 H new ATOM 838 N ILE A 840 9.162 4.486 4.160 1.00 0.00 N ATOM 839 CA ILE A 840 9.295 5.468 3.087 1.00 0.00 C ATOM 840 C ILE A 840 9.887 6.771 3.614 1.00 0.00 C ATOM 841 O ILE A 840 10.794 7.337 3.008 1.00 0.00 O ATOM 842 CB ILE A 840 7.939 5.750 2.406 1.00 0.00 C ATOM 843 CG1 ILE A 840 7.355 4.459 1.824 1.00 0.00 C ATOM 844 CG2 ILE A 840 8.101 6.796 1.312 1.00 0.00 C ATOM 845 CD1 ILE A 840 5.970 4.626 1.235 1.00 0.00 C ATOM 0 H ILE A 840 8.207 4.165 4.320 1.00 0.00 H new ATOM 0 HA ILE A 840 9.971 5.044 2.344 1.00 0.00 H new ATOM 0 HB ILE A 840 7.250 6.136 3.157 1.00 0.00 H new ATOM 0 HG12 ILE A 840 8.026 4.084 1.051 1.00 0.00 H new ATOM 0 HG13 ILE A 840 7.318 3.702 2.608 1.00 0.00 H new ATOM 0 HG21 ILE A 840 7.136 6.983 0.842 1.00 0.00 H new ATOM 0 HG22 ILE A 840 8.479 7.722 1.747 1.00 0.00 H new ATOM 0 HG23 ILE A 840 8.805 6.433 0.563 1.00 0.00 H new ATOM 0 HD11 ILE A 840 5.624 3.670 0.843 1.00 0.00 H new ATOM 0 HD12 ILE A 840 5.284 4.971 2.009 1.00 0.00 H new ATOM 0 HD13 ILE A 840 6.004 5.358 0.428 1.00 0.00 H new ATOM 857 N LYS A 841 9.386 7.228 4.757 1.00 0.00 N ATOM 858 CA LYS A 841 9.900 8.441 5.385 1.00 0.00 C ATOM 859 C LYS A 841 11.385 8.304 5.692 1.00 0.00 C ATOM 860 O LYS A 841 12.178 9.198 5.398 1.00 0.00 O ATOM 861 CB LYS A 841 9.142 8.736 6.675 1.00 0.00 C ATOM 862 CG LYS A 841 7.708 9.187 6.461 1.00 0.00 C ATOM 863 CD LYS A 841 6.956 9.258 7.780 1.00 0.00 C ATOM 864 CE LYS A 841 5.531 9.748 7.597 1.00 0.00 C ATOM 865 NZ LYS A 841 5.477 11.176 7.191 1.00 0.00 N ATOM 0 H LYS A 841 8.626 6.778 5.267 1.00 0.00 H new ATOM 0 HA LYS A 841 9.757 9.265 4.686 1.00 0.00 H new ATOM 0 HB2 LYS A 841 9.141 7.840 7.296 1.00 0.00 H new ATOM 0 HB3 LYS A 841 9.676 9.508 7.229 1.00 0.00 H new ATOM 0 HG2 LYS A 841 7.699 10.165 5.980 1.00 0.00 H new ATOM 0 HG3 LYS A 841 7.202 8.496 5.787 1.00 0.00 H new ATOM 0 HD2 LYS A 841 6.943 8.272 8.244 1.00 0.00 H new ATOM 0 HD3 LYS A 841 7.484 9.924 8.463 1.00 0.00 H new ATOM 0 HE2 LYS A 841 5.033 9.138 6.843 1.00 0.00 H new ATOM 0 HE3 LYS A 841 4.981 9.616 8.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 841 4.491 11.505 7.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 841 6.044 11.746 7.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 841 5.858 11.278 6.229 1.00 0.00 H new ATOM 879 N ALA A 842 11.751 7.168 6.275 1.00 0.00 N ATOM 880 CA ALA A 842 13.126 6.919 6.687 1.00 0.00 C ATOM 881 C ALA A 842 14.075 6.909 5.494 1.00 0.00 C ATOM 882 O ALA A 842 15.167 7.479 5.552 1.00 0.00 O ATOM 883 CB ALA A 842 13.212 5.606 7.446 1.00 0.00 C ATOM 0 H ALA A 842 11.109 6.401 6.474 1.00 0.00 H new ATOM 0 HA ALA A 842 13.434 7.732 7.344 1.00 0.00 H new ATOM 0 HB1 ALA A 842 14.244 5.428 7.750 1.00 0.00 H new ATOM 0 HB2 ALA A 842 12.576 5.655 8.330 1.00 0.00 H new ATOM 0 HB3 ALA A 842 12.878 4.792 6.803 1.00 0.00 H new ATOM 889 N ASP A 843 13.658 6.274 4.407 1.00 0.00 N ATOM 890 CA ASP A 843 14.497 6.177 3.220 1.00 0.00 C ATOM 891 C ASP A 843 14.538 7.517 2.487 1.00 0.00 C ATOM 892 O ASP A 843 15.544 7.866 1.866 1.00 0.00 O ATOM 893 CB ASP A 843 13.994 5.066 2.298 1.00 0.00 C ATOM 894 CG ASP A 843 14.893 4.854 1.095 1.00 0.00 C ATOM 895 OD1 ASP A 843 16.046 4.405 1.275 1.00 0.00 O ATOM 896 OD2 ASP A 843 14.442 5.115 -0.036 1.00 0.00 O ATOM 0 H ASP A 843 12.748 5.820 4.322 1.00 0.00 H new ATOM 0 HA ASP A 843 15.512 5.926 3.530 1.00 0.00 H new ATOM 0 HB2 ASP A 843 13.922 4.136 2.862 1.00 0.00 H new ATOM 0 HB3 ASP A 843 12.988 5.310 1.957 1.00 0.00 H new ATOM 901 N ALA A 844 13.455 8.276 2.591 1.00 0.00 N ATOM 902 CA ALA A 844 13.394 9.615 2.014 1.00 0.00 C ATOM 903 C ALA A 844 14.393 10.545 2.694 1.00 0.00 C ATOM 904 O ALA A 844 14.984 11.416 2.054 1.00 0.00 O ATOM 905 CB ALA A 844 11.989 10.182 2.127 1.00 0.00 C ATOM 0 H ALA A 844 12.603 7.987 3.071 1.00 0.00 H new ATOM 0 HA ALA A 844 13.657 9.540 0.959 1.00 0.00 H new ATOM 0 HB1 ALA A 844 11.964 11.181 1.691 1.00 0.00 H new ATOM 0 HB2 ALA A 844 11.292 9.536 1.594 1.00 0.00 H new ATOM 0 HB3 ALA A 844 11.702 10.237 3.177 1.00 0.00 H new ATOM 911 N GLU A 845 14.583 10.350 3.994 1.00 0.00 N ATOM 912 CA GLU A 845 15.539 11.144 4.756 1.00 0.00 C ATOM 913 C GLU A 845 16.967 10.702 4.451 1.00 0.00 C ATOM 914 O GLU A 845 17.928 11.415 4.738 1.00 0.00 O ATOM 915 CB GLU A 845 15.253 11.032 6.255 1.00 0.00 C ATOM 916 CG GLU A 845 13.870 11.531 6.641 1.00 0.00 C ATOM 917 CD GLU A 845 13.619 11.482 8.132 1.00 0.00 C ATOM 918 OE1 GLU A 845 13.292 10.396 8.654 1.00 0.00 O ATOM 919 OE2 GLU A 845 13.735 12.540 8.791 1.00 0.00 O ATOM 0 H GLU A 845 14.087 9.648 4.543 1.00 0.00 H new ATOM 0 HA GLU A 845 15.432 12.188 4.460 1.00 0.00 H new ATOM 0 HB2 GLU A 845 15.355 9.991 6.561 1.00 0.00 H new ATOM 0 HB3 GLU A 845 16.003 11.600 6.805 1.00 0.00 H new ATOM 0 HG2 GLU A 845 13.749 12.556 6.291 1.00 0.00 H new ATOM 0 HG3 GLU A 845 13.117 10.929 6.131 1.00 0.00 H new ATOM 926 N GLY A 846 17.093 9.524 3.853 1.00 0.00 N ATOM 927 CA GLY A 846 18.393 9.025 3.449 1.00 0.00 C ATOM 928 C GLY A 846 18.735 9.443 2.032 1.00 0.00 C ATOM 929 O GLY A 846 19.853 9.223 1.562 1.00 0.00 O ATOM 0 H GLY A 846 16.313 8.902 3.640 1.00 0.00 H new ATOM 0 HA2 GLY A 846 19.155 9.398 4.133 1.00 0.00 H new ATOM 0 HA3 GLY A 846 18.405 7.937 3.521 1.00 0.00 H new ATOM 933 N GLU A 847 17.766 10.046 1.354 1.00 0.00 N ATOM 934 CA GLU A 847 17.950 10.517 -0.011 1.00 0.00 C ATOM 935 C GLU A 847 18.600 11.901 -0.012 1.00 0.00 C ATOM 936 O GLU A 847 18.287 12.749 0.828 1.00 0.00 O ATOM 937 CB GLU A 847 16.597 10.545 -0.739 1.00 0.00 C ATOM 938 CG GLU A 847 16.639 11.143 -2.139 1.00 0.00 C ATOM 939 CD GLU A 847 17.568 10.406 -3.083 1.00 0.00 C ATOM 940 OE1 GLU A 847 18.761 10.763 -3.149 1.00 0.00 O ATOM 941 OE2 GLU A 847 17.105 9.480 -3.773 1.00 0.00 O ATOM 0 H GLU A 847 16.836 10.221 1.733 1.00 0.00 H new ATOM 0 HA GLU A 847 18.614 9.833 -0.540 1.00 0.00 H new ATOM 0 HB2 GLU A 847 16.214 9.526 -0.805 1.00 0.00 H new ATOM 0 HB3 GLU A 847 15.888 11.113 -0.137 1.00 0.00 H new ATOM 0 HG2 GLU A 847 15.632 11.141 -2.557 1.00 0.00 H new ATOM 0 HG3 GLU A 847 16.954 12.184 -2.072 1.00 0.00 H new ATOM 948 N SER A 848 19.507 12.117 -0.956 1.00 0.00 N ATOM 949 CA SER A 848 20.237 13.372 -1.058 1.00 0.00 C ATOM 950 C SER A 848 19.489 14.345 -1.971 1.00 0.00 C ATOM 951 O SER A 848 19.700 15.558 -1.922 1.00 0.00 O ATOM 952 CB SER A 848 21.650 13.100 -1.594 1.00 0.00 C ATOM 953 OG SER A 848 22.458 14.266 -1.552 1.00 0.00 O ATOM 0 H SER A 848 19.756 11.431 -1.668 1.00 0.00 H new ATOM 0 HA SER A 848 20.316 13.827 -0.071 1.00 0.00 H new ATOM 0 HB2 SER A 848 22.118 12.311 -1.005 1.00 0.00 H new ATOM 0 HB3 SER A 848 21.587 12.737 -2.620 1.00 0.00 H new ATOM 0 HG SER A 848 23.351 14.058 -1.899 1.00 0.00 H new ATOM 959 N ASP A 849 18.604 13.802 -2.797 1.00 0.00 N ATOM 960 CA ASP A 849 17.808 14.614 -3.709 1.00 0.00 C ATOM 961 C ASP A 849 16.445 14.911 -3.117 1.00 0.00 C ATOM 962 O ASP A 849 15.589 14.033 -3.050 1.00 0.00 O ATOM 963 CB ASP A 849 17.636 13.914 -5.058 1.00 0.00 C ATOM 964 CG ASP A 849 18.784 14.181 -6.003 1.00 0.00 C ATOM 965 OD1 ASP A 849 19.778 13.427 -5.966 1.00 0.00 O ATOM 966 OD2 ASP A 849 18.704 15.145 -6.788 1.00 0.00 O ATOM 0 H ASP A 849 18.419 12.801 -2.854 1.00 0.00 H new ATOM 0 HA ASP A 849 18.342 15.552 -3.863 1.00 0.00 H new ATOM 0 HB2 ASP A 849 17.546 12.840 -4.897 1.00 0.00 H new ATOM 0 HB3 ASP A 849 16.706 14.246 -5.519 1.00 0.00 H new ATOM 971 N LEU A 850 16.237 16.158 -2.712 1.00 0.00 N ATOM 972 CA LEU A 850 14.982 16.563 -2.091 1.00 0.00 C ATOM 973 C LEU A 850 13.810 16.411 -3.044 1.00 0.00 C ATOM 974 O LEU A 850 12.685 16.167 -2.613 1.00 0.00 O ATOM 975 CB LEU A 850 15.056 17.988 -1.589 1.00 0.00 C ATOM 976 CG LEU A 850 15.831 18.139 -0.297 1.00 0.00 C ATOM 977 CD1 LEU A 850 17.284 18.422 -0.588 1.00 0.00 C ATOM 978 CD2 LEU A 850 15.208 19.213 0.564 1.00 0.00 C ATOM 0 H LEU A 850 16.923 16.908 -2.803 1.00 0.00 H new ATOM 0 HA LEU A 850 14.820 15.899 -1.242 1.00 0.00 H new ATOM 0 HB2 LEU A 850 15.519 18.610 -2.355 1.00 0.00 H new ATOM 0 HB3 LEU A 850 14.044 18.365 -1.441 1.00 0.00 H new ATOM 0 HG LEU A 850 15.785 17.204 0.261 1.00 0.00 H new ATOM 0 HD11 LEU A 850 17.829 18.528 0.350 1.00 0.00 H new ATOM 0 HD12 LEU A 850 17.707 17.598 -1.162 1.00 0.00 H new ATOM 0 HD13 LEU A 850 17.367 19.345 -1.162 1.00 0.00 H new ATOM 0 HD21 LEU A 850 15.775 19.311 1.490 1.00 0.00 H new ATOM 0 HD22 LEU A 850 15.221 20.162 0.028 1.00 0.00 H new ATOM 0 HD23 LEU A 850 14.178 18.941 0.796 1.00 0.00 H new ATOM 990 N GLU A 851 14.076 16.549 -4.342 1.00 0.00 N ATOM 991 CA GLU A 851 13.044 16.360 -5.351 1.00 0.00 C ATOM 992 C GLU A 851 12.465 14.962 -5.229 1.00 0.00 C ATOM 993 O GLU A 851 11.257 14.754 -5.350 1.00 0.00 O ATOM 994 CB GLU A 851 13.606 16.612 -6.760 1.00 0.00 C ATOM 995 CG GLU A 851 14.768 15.718 -7.174 1.00 0.00 C ATOM 996 CD GLU A 851 14.336 14.496 -7.962 1.00 0.00 C ATOM 997 OE1 GLU A 851 13.491 14.632 -8.872 1.00 0.00 O ATOM 998 OE2 GLU A 851 14.862 13.398 -7.697 1.00 0.00 O ATOM 0 H GLU A 851 14.994 16.790 -4.715 1.00 0.00 H new ATOM 0 HA GLU A 851 12.245 17.083 -5.186 1.00 0.00 H new ATOM 0 HB2 GLU A 851 12.799 16.486 -7.482 1.00 0.00 H new ATOM 0 HB3 GLU A 851 13.930 17.651 -6.822 1.00 0.00 H new ATOM 0 HG2 GLU A 851 15.468 16.299 -7.774 1.00 0.00 H new ATOM 0 HG3 GLU A 851 15.304 15.395 -6.282 1.00 0.00 H new ATOM 1005 N ASN A 852 13.342 14.015 -4.969 1.00 0.00 N ATOM 1006 CA ASN A 852 12.943 12.642 -4.743 1.00 0.00 C ATOM 1007 C ASN A 852 12.439 12.454 -3.314 1.00 0.00 C ATOM 1008 O ASN A 852 11.430 11.792 -3.092 1.00 0.00 O ATOM 1009 CB ASN A 852 14.113 11.707 -5.015 1.00 0.00 C ATOM 1010 CG ASN A 852 13.678 10.257 -5.077 1.00 0.00 C ATOM 1011 OD1 ASN A 852 12.573 9.945 -5.529 1.00 0.00 O ATOM 1012 ND2 ASN A 852 14.531 9.360 -4.621 1.00 0.00 N ATOM 0 H ASN A 852 14.348 14.174 -4.909 1.00 0.00 H new ATOM 0 HA ASN A 852 12.130 12.402 -5.428 1.00 0.00 H new ATOM 0 HB2 ASN A 852 14.587 11.984 -5.957 1.00 0.00 H new ATOM 0 HB3 ASN A 852 14.863 11.827 -4.233 1.00 0.00 H new ATOM 0 HD21 ASN A 852 14.286 8.370 -4.635 1.00 0.00 H new ATOM 0 HD22 ASN A 852 15.436 9.656 -4.255 1.00 0.00 H new ATOM 1019 N SER A 853 13.142 13.057 -2.353 1.00 0.00 N ATOM 1020 CA SER A 853 12.787 12.937 -0.939 1.00 0.00 C ATOM 1021 C SER A 853 11.345 13.369 -0.694 1.00 0.00 C ATOM 1022 O SER A 853 10.572 12.651 -0.063 1.00 0.00 O ATOM 1023 CB SER A 853 13.728 13.782 -0.077 1.00 0.00 C ATOM 1024 OG SER A 853 15.076 13.398 -0.265 1.00 0.00 O ATOM 0 H SER A 853 13.963 13.635 -2.530 1.00 0.00 H new ATOM 0 HA SER A 853 12.888 11.888 -0.661 1.00 0.00 H new ATOM 0 HB2 SER A 853 13.609 14.836 -0.329 1.00 0.00 H new ATOM 0 HB3 SER A 853 13.459 13.673 0.974 1.00 0.00 H new ATOM 0 HG SER A 853 15.360 13.635 -1.172 1.00 0.00 H new ATOM 1030 N ARG A 854 10.986 14.536 -1.210 1.00 0.00 N ATOM 1031 CA ARG A 854 9.640 15.066 -1.038 1.00 0.00 C ATOM 1032 C ARG A 854 8.629 14.230 -1.813 1.00 0.00 C ATOM 1033 O ARG A 854 7.466 14.123 -1.424 1.00 0.00 O ATOM 1034 CB ARG A 854 9.576 16.522 -1.495 1.00 0.00 C ATOM 1035 CG ARG A 854 10.502 17.443 -0.718 1.00 0.00 C ATOM 1036 CD ARG A 854 10.335 18.888 -1.153 1.00 0.00 C ATOM 1037 NE ARG A 854 8.979 19.380 -0.912 1.00 0.00 N ATOM 1038 CZ ARG A 854 8.688 20.648 -0.636 1.00 0.00 C ATOM 1039 NH1 ARG A 854 9.653 21.556 -0.574 1.00 0.00 N ATOM 1040 NH2 ARG A 854 7.429 21.000 -0.422 1.00 0.00 N ATOM 0 H ARG A 854 11.609 15.135 -1.752 1.00 0.00 H new ATOM 0 HA ARG A 854 9.390 15.019 0.022 1.00 0.00 H new ATOM 0 HB2 ARG A 854 9.830 16.574 -2.554 1.00 0.00 H new ATOM 0 HB3 ARG A 854 8.552 16.881 -1.395 1.00 0.00 H new ATOM 0 HG2 ARG A 854 10.294 17.356 0.348 1.00 0.00 H new ATOM 0 HG3 ARG A 854 11.536 17.133 -0.868 1.00 0.00 H new ATOM 0 HD2 ARG A 854 11.048 19.513 -0.616 1.00 0.00 H new ATOM 0 HD3 ARG A 854 10.570 18.977 -2.214 1.00 0.00 H new ATOM 0 HE ARG A 854 8.211 18.711 -0.958 1.00 0.00 H new ATOM 0 HH11 ARG A 854 10.622 21.283 -0.738 1.00 0.00 H new ATOM 0 HH12 ARG A 854 9.426 22.528 -0.362 1.00 0.00 H new ATOM 0 HH21 ARG A 854 6.689 20.300 -0.469 1.00 0.00 H new ATOM 0 HH22 ARG A 854 7.200 21.971 -0.210 1.00 0.00 H new ATOM 1054 N LYS A 855 9.082 13.629 -2.905 1.00 0.00 N ATOM 1055 CA LYS A 855 8.236 12.754 -3.704 1.00 0.00 C ATOM 1056 C LYS A 855 7.950 11.465 -2.938 1.00 0.00 C ATOM 1057 O LYS A 855 6.848 10.922 -3.001 1.00 0.00 O ATOM 1058 CB LYS A 855 8.915 12.455 -5.042 1.00 0.00 C ATOM 1059 CG LYS A 855 8.084 11.602 -5.987 1.00 0.00 C ATOM 1060 CD LYS A 855 8.697 11.561 -7.377 1.00 0.00 C ATOM 1061 CE LYS A 855 10.099 10.972 -7.361 1.00 0.00 C ATOM 1062 NZ LYS A 855 10.093 9.514 -7.078 1.00 0.00 N ATOM 0 H LYS A 855 10.033 13.732 -3.258 1.00 0.00 H new ATOM 0 HA LYS A 855 7.287 13.251 -3.904 1.00 0.00 H new ATOM 0 HB2 LYS A 855 9.152 13.398 -5.535 1.00 0.00 H new ATOM 0 HB3 LYS A 855 9.861 11.949 -4.851 1.00 0.00 H new ATOM 0 HG2 LYS A 855 8.005 10.589 -5.592 1.00 0.00 H new ATOM 0 HG3 LYS A 855 7.071 12.001 -6.045 1.00 0.00 H new ATOM 0 HD2 LYS A 855 8.062 10.969 -8.037 1.00 0.00 H new ATOM 0 HD3 LYS A 855 8.732 12.570 -7.788 1.00 0.00 H new ATOM 0 HE2 LYS A 855 10.577 11.151 -8.324 1.00 0.00 H new ATOM 0 HE3 LYS A 855 10.698 11.484 -6.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 855 10.965 9.255 -6.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 855 9.269 9.278 -6.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 855 10.042 8.987 -7.973 1.00 0.00 H new ATOM 1076 N LEU A 856 8.952 10.994 -2.206 1.00 0.00 N ATOM 1077 CA LEU A 856 8.795 9.840 -1.332 1.00 0.00 C ATOM 1078 C LEU A 856 7.879 10.183 -0.159 1.00 0.00 C ATOM 1079 O LEU A 856 6.943 9.444 0.148 1.00 0.00 O ATOM 1080 CB LEU A 856 10.163 9.376 -0.816 1.00 0.00 C ATOM 1081 CG LEU A 856 11.109 8.819 -1.884 1.00 0.00 C ATOM 1082 CD1 LEU A 856 12.500 8.598 -1.310 1.00 0.00 C ATOM 1083 CD2 LEU A 856 10.563 7.518 -2.443 1.00 0.00 C ATOM 0 H LEU A 856 9.889 11.398 -2.201 1.00 0.00 H new ATOM 0 HA LEU A 856 8.342 9.030 -1.903 1.00 0.00 H new ATOM 0 HB2 LEU A 856 10.652 10.217 -0.324 1.00 0.00 H new ATOM 0 HB3 LEU A 856 10.006 8.609 -0.057 1.00 0.00 H new ATOM 0 HG LEU A 856 11.181 9.549 -2.691 1.00 0.00 H new ATOM 0 HD11 LEU A 856 13.155 8.202 -2.086 1.00 0.00 H new ATOM 0 HD12 LEU A 856 12.899 9.545 -0.947 1.00 0.00 H new ATOM 0 HD13 LEU A 856 12.445 7.888 -0.485 1.00 0.00 H new ATOM 0 HD21 LEU A 856 11.245 7.133 -3.201 1.00 0.00 H new ATOM 0 HD22 LEU A 856 10.466 6.789 -1.639 1.00 0.00 H new ATOM 0 HD23 LEU A 856 9.586 7.696 -2.891 1.00 0.00 H new ATOM 1095 N LEU A 857 8.145 11.321 0.476 1.00 0.00 N ATOM 1096 CA LEU A 857 7.347 11.776 1.613 1.00 0.00 C ATOM 1097 C LEU A 857 5.873 11.904 1.239 1.00 0.00 C ATOM 1098 O LEU A 857 5.001 11.387 1.943 1.00 0.00 O ATOM 1099 CB LEU A 857 7.870 13.120 2.130 1.00 0.00 C ATOM 1100 CG LEU A 857 9.255 13.075 2.776 1.00 0.00 C ATOM 1101 CD1 LEU A 857 9.701 14.473 3.177 1.00 0.00 C ATOM 1102 CD2 LEU A 857 9.249 12.152 3.985 1.00 0.00 C ATOM 0 H LEU A 857 8.909 11.947 0.222 1.00 0.00 H new ATOM 0 HA LEU A 857 7.437 11.029 2.401 1.00 0.00 H new ATOM 0 HB2 LEU A 857 7.897 13.825 1.299 1.00 0.00 H new ATOM 0 HB3 LEU A 857 7.160 13.512 2.858 1.00 0.00 H new ATOM 0 HG LEU A 857 9.963 12.683 2.046 1.00 0.00 H new ATOM 0 HD11 LEU A 857 10.689 14.422 3.635 1.00 0.00 H new ATOM 0 HD12 LEU A 857 9.743 15.109 2.293 1.00 0.00 H new ATOM 0 HD13 LEU A 857 8.991 14.891 3.891 1.00 0.00 H new ATOM 0 HD21 LEU A 857 10.243 12.132 4.432 1.00 0.00 H new ATOM 0 HD22 LEU A 857 8.529 12.516 4.717 1.00 0.00 H new ATOM 0 HD23 LEU A 857 8.971 11.145 3.673 1.00 0.00 H new ATOM 1114 N SER A 858 5.602 12.576 0.127 1.00 0.00 N ATOM 1115 CA SER A 858 4.234 12.763 -0.332 1.00 0.00 C ATOM 1116 C SER A 858 3.587 11.422 -0.664 1.00 0.00 C ATOM 1117 O SER A 858 2.420 11.199 -0.352 1.00 0.00 O ATOM 1118 CB SER A 858 4.194 13.698 -1.543 1.00 0.00 C ATOM 1119 OG SER A 858 5.126 13.297 -2.534 1.00 0.00 O ATOM 0 H SER A 858 6.311 12.999 -0.472 1.00 0.00 H new ATOM 0 HA SER A 858 3.664 13.224 0.475 1.00 0.00 H new ATOM 0 HB2 SER A 858 3.190 13.705 -1.967 1.00 0.00 H new ATOM 0 HB3 SER A 858 4.413 14.717 -1.226 1.00 0.00 H new ATOM 0 HG SER A 858 6.023 13.600 -2.281 1.00 0.00 H new ATOM 1125 N ALA A 859 4.359 10.522 -1.270 1.00 0.00 N ATOM 1126 CA ALA A 859 3.863 9.195 -1.611 1.00 0.00 C ATOM 1127 C ALA A 859 3.413 8.447 -0.362 1.00 0.00 C ATOM 1128 O ALA A 859 2.371 7.797 -0.361 1.00 0.00 O ATOM 1129 CB ALA A 859 4.927 8.400 -2.355 1.00 0.00 C ATOM 0 H ALA A 859 5.330 10.690 -1.534 1.00 0.00 H new ATOM 0 HA ALA A 859 3.000 9.314 -2.266 1.00 0.00 H new ATOM 0 HB1 ALA A 859 4.538 7.412 -2.601 1.00 0.00 H new ATOM 0 HB2 ALA A 859 5.196 8.923 -3.273 1.00 0.00 H new ATOM 0 HB3 ALA A 859 5.810 8.295 -1.725 1.00 0.00 H new ATOM 1135 N ALA A 860 4.201 8.557 0.706 1.00 0.00 N ATOM 1136 CA ALA A 860 3.861 7.930 1.978 1.00 0.00 C ATOM 1137 C ALA A 860 2.575 8.517 2.549 1.00 0.00 C ATOM 1138 O ALA A 860 1.711 7.789 3.042 1.00 0.00 O ATOM 1139 CB ALA A 860 5.002 8.094 2.974 1.00 0.00 C ATOM 0 H ALA A 860 5.080 9.075 0.714 1.00 0.00 H new ATOM 0 HA ALA A 860 3.701 6.867 1.798 1.00 0.00 H new ATOM 0 HB1 ALA A 860 4.732 7.620 3.918 1.00 0.00 H new ATOM 0 HB2 ALA A 860 5.902 7.624 2.577 1.00 0.00 H new ATOM 0 HB3 ALA A 860 5.190 9.155 3.141 1.00 0.00 H new ATOM 1145 N LYS A 861 2.451 9.837 2.472 1.00 0.00 N ATOM 1146 CA LYS A 861 1.271 10.527 2.981 1.00 0.00 C ATOM 1147 C LYS A 861 0.041 10.184 2.141 1.00 0.00 C ATOM 1148 O LYS A 861 -1.060 10.016 2.672 1.00 0.00 O ATOM 1149 CB LYS A 861 1.502 12.041 3.006 1.00 0.00 C ATOM 1150 CG LYS A 861 0.311 12.824 3.530 1.00 0.00 C ATOM 1151 CD LYS A 861 0.612 14.307 3.651 1.00 0.00 C ATOM 1152 CE LYS A 861 -0.634 15.091 4.033 1.00 0.00 C ATOM 1153 NZ LYS A 861 -1.242 14.597 5.300 1.00 0.00 N ATOM 0 H LYS A 861 3.154 10.452 2.062 1.00 0.00 H new ATOM 0 HA LYS A 861 1.092 10.190 4.002 1.00 0.00 H new ATOM 0 HB2 LYS A 861 2.372 12.258 3.626 1.00 0.00 H new ATOM 0 HB3 LYS A 861 1.736 12.382 1.998 1.00 0.00 H new ATOM 0 HG2 LYS A 861 -0.539 12.680 2.863 1.00 0.00 H new ATOM 0 HG3 LYS A 861 0.021 12.433 4.505 1.00 0.00 H new ATOM 0 HD2 LYS A 861 1.388 14.463 4.401 1.00 0.00 H new ATOM 0 HD3 LYS A 861 1.004 14.680 2.705 1.00 0.00 H new ATOM 0 HE2 LYS A 861 -0.379 16.145 4.141 1.00 0.00 H new ATOM 0 HE3 LYS A 861 -1.366 15.021 3.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 861 -1.981 15.259 5.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 861 -1.662 13.659 5.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 861 -0.508 14.528 6.033 1.00 0.00 H new ATOM 1167 N ILE A 862 0.231 10.087 0.830 1.00 0.00 N ATOM 1168 CA ILE A 862 -0.836 9.659 -0.067 1.00 0.00 C ATOM 1169 C ILE A 862 -1.241 8.226 0.252 1.00 0.00 C ATOM 1170 O ILE A 862 -2.426 7.921 0.380 1.00 0.00 O ATOM 1171 CB ILE A 862 -0.409 9.758 -1.552 1.00 0.00 C ATOM 1172 CG1 ILE A 862 -0.178 11.219 -1.947 1.00 0.00 C ATOM 1173 CG2 ILE A 862 -1.456 9.119 -2.458 1.00 0.00 C ATOM 1174 CD1 ILE A 862 0.354 11.394 -3.354 1.00 0.00 C ATOM 0 H ILE A 862 1.114 10.299 0.365 1.00 0.00 H new ATOM 0 HA ILE A 862 -1.684 10.326 0.087 1.00 0.00 H new ATOM 0 HB ILE A 862 0.527 9.214 -1.675 1.00 0.00 H new ATOM 0 HG12 ILE A 862 -1.117 11.764 -1.853 1.00 0.00 H new ATOM 0 HG13 ILE A 862 0.523 11.669 -1.245 1.00 0.00 H new ATOM 0 HG21 ILE A 862 -1.136 9.200 -3.497 1.00 0.00 H new ATOM 0 HG22 ILE A 862 -1.572 8.068 -2.195 1.00 0.00 H new ATOM 0 HG23 ILE A 862 -2.409 9.632 -2.331 1.00 0.00 H new ATOM 0 HD11 ILE A 862 0.492 12.455 -3.561 1.00 0.00 H new ATOM 0 HD12 ILE A 862 1.310 10.878 -3.448 1.00 0.00 H new ATOM 0 HD13 ILE A 862 -0.356 10.975 -4.066 1.00 0.00 H new ATOM 1186 N LEU A 863 -0.243 7.362 0.401 1.00 0.00 N ATOM 1187 CA LEU A 863 -0.470 5.955 0.712 1.00 0.00 C ATOM 1188 C LEU A 863 -1.289 5.782 1.984 1.00 0.00 C ATOM 1189 O LEU A 863 -2.350 5.154 1.968 1.00 0.00 O ATOM 1190 CB LEU A 863 0.865 5.220 0.862 1.00 0.00 C ATOM 1191 CG LEU A 863 0.771 3.842 1.517 1.00 0.00 C ATOM 1192 CD1 LEU A 863 -0.291 2.997 0.833 1.00 0.00 C ATOM 1193 CD2 LEU A 863 2.121 3.147 1.491 1.00 0.00 C ATOM 0 H LEU A 863 0.741 7.615 0.310 1.00 0.00 H new ATOM 0 HA LEU A 863 -1.034 5.528 -0.117 1.00 0.00 H new ATOM 0 HB2 LEU A 863 1.314 5.107 -0.125 1.00 0.00 H new ATOM 0 HB3 LEU A 863 1.541 5.841 1.451 1.00 0.00 H new ATOM 0 HG LEU A 863 0.478 3.973 2.559 1.00 0.00 H new ATOM 0 HD11 LEU A 863 -0.343 2.020 1.313 1.00 0.00 H new ATOM 0 HD12 LEU A 863 -1.258 3.493 0.914 1.00 0.00 H new ATOM 0 HD13 LEU A 863 -0.034 2.871 -0.219 1.00 0.00 H new ATOM 0 HD21 LEU A 863 2.035 2.168 1.961 1.00 0.00 H new ATOM 0 HD22 LEU A 863 2.448 3.026 0.458 1.00 0.00 H new ATOM 0 HD23 LEU A 863 2.850 3.748 2.035 1.00 0.00 H new ATOM 1205 N ALA A 864 -0.787 6.337 3.079 1.00 0.00 N ATOM 1206 CA ALA A 864 -1.423 6.182 4.379 1.00 0.00 C ATOM 1207 C ALA A 864 -2.887 6.591 4.323 1.00 0.00 C ATOM 1208 O ALA A 864 -3.747 5.976 4.957 1.00 0.00 O ATOM 1209 CB ALA A 864 -0.681 6.995 5.422 1.00 0.00 C ATOM 0 H ALA A 864 0.063 6.901 3.092 1.00 0.00 H new ATOM 0 HA ALA A 864 -1.381 5.129 4.659 1.00 0.00 H new ATOM 0 HB1 ALA A 864 -1.165 6.872 6.391 1.00 0.00 H new ATOM 0 HB2 ALA A 864 0.351 6.650 5.485 1.00 0.00 H new ATOM 0 HB3 ALA A 864 -0.695 8.048 5.140 1.00 0.00 H new ATOM 1215 N ASP A 865 -3.173 7.603 3.520 1.00 0.00 N ATOM 1216 CA ASP A 865 -4.519 8.129 3.433 1.00 0.00 C ATOM 1217 C ASP A 865 -5.373 7.330 2.468 1.00 0.00 C ATOM 1218 O ASP A 865 -6.553 7.089 2.727 1.00 0.00 O ATOM 1219 CB ASP A 865 -4.488 9.601 3.026 1.00 0.00 C ATOM 1220 CG ASP A 865 -5.866 10.221 2.974 1.00 0.00 C ATOM 1221 OD1 ASP A 865 -6.417 10.553 4.042 1.00 0.00 O ATOM 1222 OD2 ASP A 865 -6.409 10.375 1.860 1.00 0.00 O ATOM 0 H ASP A 865 -2.492 8.073 2.923 1.00 0.00 H new ATOM 0 HA ASP A 865 -4.972 8.043 4.421 1.00 0.00 H new ATOM 0 HB2 ASP A 865 -3.871 10.156 3.732 1.00 0.00 H new ATOM 0 HB3 ASP A 865 -4.015 9.694 2.048 1.00 0.00 H new ATOM 1227 N ALA A 866 -4.776 6.905 1.366 1.00 0.00 N ATOM 1228 CA ALA A 866 -5.465 6.052 0.411 1.00 0.00 C ATOM 1229 C ALA A 866 -5.877 4.749 1.084 1.00 0.00 C ATOM 1230 O ALA A 866 -6.864 4.127 0.702 1.00 0.00 O ATOM 1231 CB ALA A 866 -4.582 5.777 -0.796 1.00 0.00 C ATOM 0 H ALA A 866 -3.816 7.137 1.111 1.00 0.00 H new ATOM 0 HA ALA A 866 -6.361 6.566 0.063 1.00 0.00 H new ATOM 0 HB1 ALA A 866 -5.115 5.137 -1.499 1.00 0.00 H new ATOM 0 HB2 ALA A 866 -4.328 6.718 -1.283 1.00 0.00 H new ATOM 0 HB3 ALA A 866 -3.669 5.278 -0.472 1.00 0.00 H new ATOM 1237 N THR A 867 -5.121 4.361 2.104 1.00 0.00 N ATOM 1238 CA THR A 867 -5.425 3.171 2.877 1.00 0.00 C ATOM 1239 C THR A 867 -6.649 3.396 3.758 1.00 0.00 C ATOM 1240 O THR A 867 -7.570 2.592 3.754 1.00 0.00 O ATOM 1241 CB THR A 867 -4.230 2.755 3.754 1.00 0.00 C ATOM 1242 OG1 THR A 867 -3.045 2.684 2.955 1.00 0.00 O ATOM 1243 CG2 THR A 867 -4.480 1.405 4.411 1.00 0.00 C ATOM 0 H THR A 867 -4.287 4.860 2.414 1.00 0.00 H new ATOM 0 HA THR A 867 -5.635 2.369 2.170 1.00 0.00 H new ATOM 0 HB THR A 867 -4.104 3.504 4.536 1.00 0.00 H new ATOM 0 HG1 THR A 867 -2.734 3.590 2.750 1.00 0.00 H new ATOM 0 HG21 THR A 867 -3.621 1.134 5.025 1.00 0.00 H new ATOM 0 HG22 THR A 867 -5.370 1.465 5.038 1.00 0.00 H new ATOM 0 HG23 THR A 867 -4.629 0.648 3.641 1.00 0.00 H new ATOM 1251 N ALA A 868 -6.656 4.496 4.504 1.00 0.00 N ATOM 1252 CA ALA A 868 -7.804 4.846 5.332 1.00 0.00 C ATOM 1253 C ALA A 868 -9.064 4.950 4.478 1.00 0.00 C ATOM 1254 O ALA A 868 -10.117 4.421 4.838 1.00 0.00 O ATOM 1255 CB ALA A 868 -7.549 6.150 6.071 1.00 0.00 C ATOM 0 H ALA A 868 -5.882 5.158 4.552 1.00 0.00 H new ATOM 0 HA ALA A 868 -7.953 4.057 6.070 1.00 0.00 H new ATOM 0 HB1 ALA A 868 -8.416 6.396 6.684 1.00 0.00 H new ATOM 0 HB2 ALA A 868 -6.672 6.041 6.709 1.00 0.00 H new ATOM 0 HB3 ALA A 868 -7.376 6.949 5.350 1.00 0.00 H new ATOM 1261 N LYS A 869 -8.935 5.629 3.341 1.00 0.00 N ATOM 1262 CA LYS A 869 -9.985 5.711 2.343 1.00 0.00 C ATOM 1263 C LYS A 869 -10.451 4.315 1.936 1.00 0.00 C ATOM 1264 O LYS A 869 -11.648 4.019 1.928 1.00 0.00 O ATOM 1265 CB LYS A 869 -9.423 6.441 1.127 1.00 0.00 C ATOM 1266 CG LYS A 869 -10.438 6.704 0.042 1.00 0.00 C ATOM 1267 CD LYS A 869 -9.769 7.255 -1.207 1.00 0.00 C ATOM 1268 CE LYS A 869 -10.761 7.460 -2.340 1.00 0.00 C ATOM 1269 NZ LYS A 869 -11.797 8.471 -2.007 1.00 0.00 N ATOM 0 H LYS A 869 -8.089 6.140 3.089 1.00 0.00 H new ATOM 0 HA LYS A 869 -10.842 6.247 2.752 1.00 0.00 H new ATOM 0 HB2 LYS A 869 -8.999 7.392 1.451 1.00 0.00 H new ATOM 0 HB3 LYS A 869 -8.605 5.853 0.710 1.00 0.00 H new ATOM 0 HG2 LYS A 869 -10.964 5.781 -0.200 1.00 0.00 H new ATOM 0 HG3 LYS A 869 -11.185 7.412 0.401 1.00 0.00 H new ATOM 0 HD2 LYS A 869 -9.286 8.204 -0.971 1.00 0.00 H new ATOM 0 HD3 LYS A 869 -8.985 6.570 -1.531 1.00 0.00 H new ATOM 0 HE2 LYS A 869 -10.226 7.773 -3.236 1.00 0.00 H new ATOM 0 HE3 LYS A 869 -11.244 6.511 -2.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 869 -12.378 8.663 -2.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 869 -12.403 8.109 -1.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 869 -11.337 9.350 -1.696 1.00 0.00 H new ATOM 1283 N MET A 870 -9.479 3.476 1.603 1.00 0.00 N ATOM 1284 CA MET A 870 -9.721 2.109 1.155 1.00 0.00 C ATOM 1285 C MET A 870 -10.445 1.301 2.225 1.00 0.00 C ATOM 1286 O MET A 870 -11.509 0.732 1.978 1.00 0.00 O ATOM 1287 CB MET A 870 -8.371 1.460 0.817 1.00 0.00 C ATOM 1288 CG MET A 870 -8.456 0.158 0.042 1.00 0.00 C ATOM 1289 SD MET A 870 -9.105 -1.213 1.006 1.00 0.00 S ATOM 1290 CE MET A 870 -9.091 -2.479 -0.245 1.00 0.00 C ATOM 0 H MET A 870 -8.491 3.727 1.636 1.00 0.00 H new ATOM 0 HA MET A 870 -10.359 2.127 0.271 1.00 0.00 H new ATOM 0 HB2 MET A 870 -7.779 2.170 0.239 1.00 0.00 H new ATOM 0 HB3 MET A 870 -7.831 1.277 1.746 1.00 0.00 H new ATOM 0 HG2 MET A 870 -9.088 0.307 -0.834 1.00 0.00 H new ATOM 0 HG3 MET A 870 -7.463 -0.103 -0.323 1.00 0.00 H new ATOM 0 HE1 MET A 870 -8.696 -3.403 0.177 1.00 0.00 H new ATOM 0 HE2 MET A 870 -10.107 -2.649 -0.602 1.00 0.00 H new ATOM 0 HE3 MET A 870 -8.462 -2.162 -1.077 1.00 0.00 H new ATOM 1300 N VAL A 871 -9.864 1.279 3.417 1.00 0.00 N ATOM 1301 CA VAL A 871 -10.370 0.486 4.526 1.00 0.00 C ATOM 1302 C VAL A 871 -11.820 0.839 4.867 1.00 0.00 C ATOM 1303 O VAL A 871 -12.642 -0.048 5.104 1.00 0.00 O ATOM 1304 CB VAL A 871 -9.464 0.660 5.767 1.00 0.00 C ATOM 1305 CG1 VAL A 871 -10.065 0.004 6.994 1.00 0.00 C ATOM 1306 CG2 VAL A 871 -8.084 0.088 5.494 1.00 0.00 C ATOM 0 H VAL A 871 -9.025 1.814 3.641 1.00 0.00 H new ATOM 0 HA VAL A 871 -10.354 -0.559 4.217 1.00 0.00 H new ATOM 0 HB VAL A 871 -9.379 1.728 5.967 1.00 0.00 H new ATOM 0 HG11 VAL A 871 -9.400 0.147 7.846 1.00 0.00 H new ATOM 0 HG12 VAL A 871 -11.034 0.455 7.210 1.00 0.00 H new ATOM 0 HG13 VAL A 871 -10.194 -1.063 6.810 1.00 0.00 H new ATOM 0 HG21 VAL A 871 -7.456 0.217 6.375 1.00 0.00 H new ATOM 0 HG22 VAL A 871 -8.170 -0.973 5.261 1.00 0.00 H new ATOM 0 HG23 VAL A 871 -7.635 0.610 4.649 1.00 0.00 H new ATOM 1316 N GLU A 872 -12.145 2.129 4.865 1.00 0.00 N ATOM 1317 CA GLU A 872 -13.503 2.562 5.179 1.00 0.00 C ATOM 1318 C GLU A 872 -14.476 2.143 4.083 1.00 0.00 C ATOM 1319 O GLU A 872 -15.618 1.766 4.364 1.00 0.00 O ATOM 1320 CB GLU A 872 -13.563 4.077 5.377 1.00 0.00 C ATOM 1321 CG GLU A 872 -12.751 4.566 6.563 1.00 0.00 C ATOM 1322 CD GLU A 872 -13.120 3.865 7.856 1.00 0.00 C ATOM 1323 OE1 GLU A 872 -14.161 4.220 8.454 1.00 0.00 O ATOM 1324 OE2 GLU A 872 -12.387 2.949 8.272 1.00 0.00 O ATOM 0 H GLU A 872 -11.495 2.885 4.652 1.00 0.00 H new ATOM 0 HA GLU A 872 -13.796 2.077 6.110 1.00 0.00 H new ATOM 0 HB2 GLU A 872 -13.203 4.568 4.473 1.00 0.00 H new ATOM 0 HB3 GLU A 872 -14.602 4.377 5.510 1.00 0.00 H new ATOM 0 HG2 GLU A 872 -11.691 4.411 6.361 1.00 0.00 H new ATOM 0 HG3 GLU A 872 -12.899 5.639 6.682 1.00 0.00 H new ATOM 1331 N ALA A 873 -14.018 2.195 2.841 1.00 0.00 N ATOM 1332 CA ALA A 873 -14.850 1.812 1.710 1.00 0.00 C ATOM 1333 C ALA A 873 -15.089 0.312 1.712 1.00 0.00 C ATOM 1334 O ALA A 873 -16.198 -0.147 1.436 1.00 0.00 O ATOM 1335 CB ALA A 873 -14.210 2.252 0.405 1.00 0.00 C ATOM 0 H ALA A 873 -13.077 2.498 2.591 1.00 0.00 H new ATOM 0 HA ALA A 873 -15.814 2.313 1.803 1.00 0.00 H new ATOM 0 HB1 ALA A 873 -14.846 1.957 -0.430 1.00 0.00 H new ATOM 0 HB2 ALA A 873 -14.091 3.335 0.405 1.00 0.00 H new ATOM 0 HB3 ALA A 873 -13.233 1.780 0.301 1.00 0.00 H new ATOM 1341 N ALA A 874 -14.047 -0.442 2.044 1.00 0.00 N ATOM 1342 CA ALA A 874 -14.142 -1.890 2.143 1.00 0.00 C ATOM 1343 C ALA A 874 -15.168 -2.288 3.195 1.00 0.00 C ATOM 1344 O ALA A 874 -15.983 -3.175 2.963 1.00 0.00 O ATOM 1345 CB ALA A 874 -12.784 -2.491 2.469 1.00 0.00 C ATOM 0 H ALA A 874 -13.120 -0.069 2.250 1.00 0.00 H new ATOM 0 HA ALA A 874 -14.470 -2.280 1.179 1.00 0.00 H new ATOM 0 HB1 ALA A 874 -12.873 -3.575 2.539 1.00 0.00 H new ATOM 0 HB2 ALA A 874 -12.075 -2.236 1.682 1.00 0.00 H new ATOM 0 HB3 ALA A 874 -12.429 -2.094 3.420 1.00 0.00 H new ATOM 1351 N LYS A 875 -15.128 -1.616 4.342 1.00 0.00 N ATOM 1352 CA LYS A 875 -16.093 -1.858 5.412 1.00 0.00 C ATOM 1353 C LYS A 875 -17.516 -1.645 4.913 1.00 0.00 C ATOM 1354 O LYS A 875 -18.381 -2.505 5.087 1.00 0.00 O ATOM 1355 CB LYS A 875 -15.832 -0.925 6.596 1.00 0.00 C ATOM 1356 CG LYS A 875 -14.525 -1.191 7.317 1.00 0.00 C ATOM 1357 CD LYS A 875 -14.240 -0.109 8.340 1.00 0.00 C ATOM 1358 CE LYS A 875 -12.916 -0.346 9.042 1.00 0.00 C ATOM 1359 NZ LYS A 875 -12.527 0.810 9.888 1.00 0.00 N ATOM 0 H LYS A 875 -14.436 -0.898 4.555 1.00 0.00 H new ATOM 0 HA LYS A 875 -15.976 -2.892 5.735 1.00 0.00 H new ATOM 0 HB2 LYS A 875 -15.835 0.105 6.240 1.00 0.00 H new ATOM 0 HB3 LYS A 875 -16.653 -1.019 7.307 1.00 0.00 H new ATOM 0 HG2 LYS A 875 -14.569 -2.162 7.811 1.00 0.00 H new ATOM 0 HG3 LYS A 875 -13.710 -1.238 6.595 1.00 0.00 H new ATOM 0 HD2 LYS A 875 -14.224 0.864 7.848 1.00 0.00 H new ATOM 0 HD3 LYS A 875 -15.044 -0.081 9.076 1.00 0.00 H new ATOM 0 HE2 LYS A 875 -12.987 -1.241 9.660 1.00 0.00 H new ATOM 0 HE3 LYS A 875 -12.139 -0.532 8.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 875 -11.681 0.566 10.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 875 -12.319 1.629 9.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 875 -13.307 1.046 10.534 1.00 0.00 H new ATOM 1373 N GLY A 876 -17.743 -0.499 4.283 1.00 0.00 N ATOM 1374 CA GLY A 876 -19.064 -0.165 3.797 1.00 0.00 C ATOM 1375 C GLY A 876 -19.536 -1.105 2.709 1.00 0.00 C ATOM 1376 O GLY A 876 -20.673 -1.573 2.739 1.00 0.00 O ATOM 0 H GLY A 876 -17.030 0.207 4.100 1.00 0.00 H new ATOM 0 HA2 GLY A 876 -19.770 -0.191 4.627 1.00 0.00 H new ATOM 0 HA3 GLY A 876 -19.060 0.856 3.414 1.00 0.00 H new ATOM 1380 N ALA A 877 -18.657 -1.391 1.754 1.00 0.00 N ATOM 1381 CA ALA A 877 -18.990 -2.260 0.629 1.00 0.00 C ATOM 1382 C ALA A 877 -19.224 -3.691 1.091 1.00 0.00 C ATOM 1383 O ALA A 877 -20.002 -4.433 0.495 1.00 0.00 O ATOM 1384 CB ALA A 877 -17.880 -2.221 -0.408 1.00 0.00 C ATOM 0 H ALA A 877 -17.703 -1.031 1.737 1.00 0.00 H new ATOM 0 HA ALA A 877 -19.913 -1.894 0.180 1.00 0.00 H new ATOM 0 HB1 ALA A 877 -18.139 -2.873 -1.243 1.00 0.00 H new ATOM 0 HB2 ALA A 877 -17.756 -1.200 -0.770 1.00 0.00 H new ATOM 0 HB3 ALA A 877 -16.948 -2.562 0.043 1.00 0.00 H new ATOM 1390 N ALA A 878 -18.536 -4.077 2.148 1.00 0.00 N ATOM 1391 CA ALA A 878 -18.685 -5.407 2.695 1.00 0.00 C ATOM 1392 C ALA A 878 -19.971 -5.523 3.496 1.00 0.00 C ATOM 1393 O ALA A 878 -20.886 -6.249 3.109 1.00 0.00 O ATOM 1394 CB ALA A 878 -17.490 -5.755 3.563 1.00 0.00 C ATOM 0 H ALA A 878 -17.868 -3.486 2.644 1.00 0.00 H new ATOM 0 HA ALA A 878 -18.736 -6.113 1.866 1.00 0.00 H new ATOM 0 HB1 ALA A 878 -17.615 -6.759 3.969 1.00 0.00 H new ATOM 0 HB2 ALA A 878 -16.581 -5.717 2.963 1.00 0.00 H new ATOM 0 HB3 ALA A 878 -17.415 -5.040 4.382 1.00 0.00 H new ATOM 1400 N ALA A 879 -20.041 -4.781 4.598 1.00 0.00 N ATOM 1401 CA ALA A 879 -21.152 -4.890 5.535 1.00 0.00 C ATOM 1402 C ALA A 879 -22.476 -4.497 4.890 1.00 0.00 C ATOM 1403 O ALA A 879 -23.532 -5.003 5.272 1.00 0.00 O ATOM 1404 CB ALA A 879 -20.881 -4.049 6.771 1.00 0.00 C ATOM 0 H ALA A 879 -19.336 -4.094 4.864 1.00 0.00 H new ATOM 0 HA ALA A 879 -21.237 -5.935 5.833 1.00 0.00 H new ATOM 0 HB1 ALA A 879 -21.718 -4.139 7.463 1.00 0.00 H new ATOM 0 HB2 ALA A 879 -19.970 -4.399 7.256 1.00 0.00 H new ATOM 0 HB3 ALA A 879 -20.760 -3.005 6.481 1.00 0.00 H new ATOM 1410 N HIS A 880 -22.423 -3.577 3.935 1.00 0.00 N ATOM 1411 CA HIS A 880 -23.583 -3.267 3.108 1.00 0.00 C ATOM 1412 C HIS A 880 -23.382 -3.844 1.710 1.00 0.00 C ATOM 1413 O HIS A 880 -22.940 -3.143 0.799 1.00 0.00 O ATOM 1414 CB HIS A 880 -23.830 -1.755 3.032 1.00 0.00 C ATOM 1415 CG HIS A 880 -24.455 -1.179 4.266 1.00 0.00 C ATOM 1416 ND1 HIS A 880 -25.799 -0.886 4.355 1.00 0.00 N ATOM 1417 CD2 HIS A 880 -23.915 -0.833 5.461 1.00 0.00 C ATOM 1418 CE1 HIS A 880 -26.061 -0.384 5.548 1.00 0.00 C ATOM 1419 NE2 HIS A 880 -24.937 -0.341 6.236 1.00 0.00 N ATOM 0 H HIS A 880 -21.589 -3.032 3.714 1.00 0.00 H new ATOM 0 HA HIS A 880 -24.462 -3.720 3.565 1.00 0.00 H new ATOM 0 HB2 HIS A 880 -22.881 -1.251 2.848 1.00 0.00 H new ATOM 0 HB3 HIS A 880 -24.474 -1.544 2.178 1.00 0.00 H new ATOM 0 HD2 HIS A 880 -22.878 -0.927 5.749 1.00 0.00 H new ATOM 0 HE1 HIS A 880 -27.030 -0.063 5.900 1.00 0.00 H new ATOM 0 HE2 HIS A 880 -24.842 0.003 7.192 1.00 0.00 H new ATOM 1427 N PRO A 881 -23.700 -5.136 1.528 1.00 0.00 N ATOM 1428 CA PRO A 881 -23.388 -5.860 0.291 1.00 0.00 C ATOM 1429 C PRO A 881 -24.143 -5.309 -0.921 1.00 0.00 C ATOM 1430 O PRO A 881 -23.593 -5.192 -2.015 1.00 0.00 O ATOM 1431 CB PRO A 881 -23.836 -7.297 0.590 1.00 0.00 C ATOM 1432 CG PRO A 881 -24.831 -7.173 1.691 1.00 0.00 C ATOM 1433 CD PRO A 881 -24.401 -5.988 2.504 1.00 0.00 C ATOM 0 HA PRO A 881 -22.333 -5.772 0.031 1.00 0.00 H new ATOM 0 HB2 PRO A 881 -24.279 -7.763 -0.290 1.00 0.00 H new ATOM 0 HB3 PRO A 881 -22.992 -7.919 0.890 1.00 0.00 H new ATOM 0 HG2 PRO A 881 -25.836 -7.030 1.294 1.00 0.00 H new ATOM 0 HG3 PRO A 881 -24.854 -8.077 2.300 1.00 0.00 H new ATOM 0 HD2 PRO A 881 -25.254 -5.473 2.946 1.00 0.00 H new ATOM 0 HD3 PRO A 881 -23.746 -6.281 3.324 1.00 0.00 H new ATOM 1441 N ASP A 882 -25.407 -4.966 -0.707 1.00 0.00 N ATOM 1442 CA ASP A 882 -26.289 -4.522 -1.784 1.00 0.00 C ATOM 1443 C ASP A 882 -26.006 -3.081 -2.211 1.00 0.00 C ATOM 1444 O ASP A 882 -26.537 -2.614 -3.219 1.00 0.00 O ATOM 1445 CB ASP A 882 -27.750 -4.653 -1.354 1.00 0.00 C ATOM 1446 CG ASP A 882 -28.078 -3.805 -0.142 1.00 0.00 C ATOM 1447 OD1 ASP A 882 -27.838 -4.260 0.993 1.00 0.00 O ATOM 1448 OD2 ASP A 882 -28.585 -2.674 -0.320 1.00 0.00 O ATOM 0 H ASP A 882 -25.850 -4.987 0.212 1.00 0.00 H new ATOM 0 HA ASP A 882 -26.095 -5.164 -2.643 1.00 0.00 H new ATOM 0 HB2 ASP A 882 -28.396 -4.362 -2.182 1.00 0.00 H new ATOM 0 HB3 ASP A 882 -27.967 -5.698 -1.132 1.00 0.00 H new ATOM 1453 N SER A 883 -25.178 -2.376 -1.452 1.00 0.00 N ATOM 1454 CA SER A 883 -24.883 -0.985 -1.754 1.00 0.00 C ATOM 1455 C SER A 883 -23.851 -0.882 -2.871 1.00 0.00 C ATOM 1456 O SER A 883 -22.648 -1.008 -2.636 1.00 0.00 O ATOM 1457 CB SER A 883 -24.389 -0.251 -0.501 1.00 0.00 C ATOM 1458 OG SER A 883 -24.155 1.123 -0.769 1.00 0.00 O ATOM 0 H SER A 883 -24.702 -2.743 -0.628 1.00 0.00 H new ATOM 0 HA SER A 883 -25.804 -0.510 -2.092 1.00 0.00 H new ATOM 0 HB2 SER A 883 -25.127 -0.348 0.295 1.00 0.00 H new ATOM 0 HB3 SER A 883 -23.470 -0.716 -0.143 1.00 0.00 H new ATOM 0 HG SER A 883 -24.157 1.625 0.072 1.00 0.00 H new ATOM 1464 N GLU A 884 -24.330 -0.661 -4.093 1.00 0.00 N ATOM 1465 CA GLU A 884 -23.445 -0.512 -5.242 1.00 0.00 C ATOM 1466 C GLU A 884 -22.623 0.766 -5.116 1.00 0.00 C ATOM 1467 O GLU A 884 -21.522 0.867 -5.657 1.00 0.00 O ATOM 1468 CB GLU A 884 -24.244 -0.504 -6.548 1.00 0.00 C ATOM 1469 CG GLU A 884 -25.269 0.613 -6.639 1.00 0.00 C ATOM 1470 CD GLU A 884 -25.984 0.634 -7.972 1.00 0.00 C ATOM 1471 OE1 GLU A 884 -25.456 1.239 -8.925 1.00 0.00 O ATOM 1472 OE2 GLU A 884 -27.081 0.044 -8.074 1.00 0.00 O ATOM 0 H GLU A 884 -25.323 -0.582 -4.311 1.00 0.00 H new ATOM 0 HA GLU A 884 -22.766 -1.365 -5.262 1.00 0.00 H new ATOM 0 HB2 GLU A 884 -23.551 -0.416 -7.385 1.00 0.00 H new ATOM 0 HB3 GLU A 884 -24.754 -1.461 -6.655 1.00 0.00 H new ATOM 0 HG2 GLU A 884 -26.001 0.497 -5.839 1.00 0.00 H new ATOM 0 HG3 GLU A 884 -24.773 1.571 -6.481 1.00 0.00 H new ATOM 1479 N GLU A 885 -23.165 1.735 -4.384 1.00 0.00 N ATOM 1480 CA GLU A 885 -22.457 2.973 -4.104 1.00 0.00 C ATOM 1481 C GLU A 885 -21.172 2.677 -3.351 1.00 0.00 C ATOM 1482 O GLU A 885 -20.097 3.132 -3.733 1.00 0.00 O ATOM 1483 CB GLU A 885 -23.328 3.915 -3.278 1.00 0.00 C ATOM 1484 CG GLU A 885 -24.583 4.374 -3.995 1.00 0.00 C ATOM 1485 CD GLU A 885 -25.416 5.295 -3.135 1.00 0.00 C ATOM 1486 OE1 GLU A 885 -25.170 6.516 -3.159 1.00 0.00 O ATOM 1487 OE2 GLU A 885 -26.329 4.803 -2.442 1.00 0.00 O ATOM 0 H GLU A 885 -24.097 1.683 -3.974 1.00 0.00 H new ATOM 0 HA GLU A 885 -22.219 3.455 -5.052 1.00 0.00 H new ATOM 0 HB2 GLU A 885 -23.612 3.414 -2.352 1.00 0.00 H new ATOM 0 HB3 GLU A 885 -22.739 4.789 -3.000 1.00 0.00 H new ATOM 0 HG2 GLU A 885 -24.308 4.887 -4.916 1.00 0.00 H new ATOM 0 HG3 GLU A 885 -25.177 3.506 -4.279 1.00 0.00 H new ATOM 1494 N GLN A 886 -21.291 1.891 -2.288 1.00 0.00 N ATOM 1495 CA GLN A 886 -20.136 1.503 -1.496 1.00 0.00 C ATOM 1496 C GLN A 886 -19.174 0.657 -2.315 1.00 0.00 C ATOM 1497 O GLN A 886 -17.961 0.737 -2.130 1.00 0.00 O ATOM 1498 CB GLN A 886 -20.568 0.747 -0.241 1.00 0.00 C ATOM 1499 CG GLN A 886 -21.124 1.647 0.849 1.00 0.00 C ATOM 1500 CD GLN A 886 -20.112 2.671 1.334 1.00 0.00 C ATOM 1501 OE1 GLN A 886 -20.475 3.763 1.767 1.00 0.00 O ATOM 1502 NE2 GLN A 886 -18.833 2.330 1.271 1.00 0.00 N ATOM 0 H GLN A 886 -22.177 1.511 -1.956 1.00 0.00 H new ATOM 0 HA GLN A 886 -19.620 2.413 -1.192 1.00 0.00 H new ATOM 0 HB2 GLN A 886 -21.324 0.010 -0.513 1.00 0.00 H new ATOM 0 HB3 GLN A 886 -19.714 0.197 0.154 1.00 0.00 H new ATOM 0 HG2 GLN A 886 -22.007 2.164 0.473 1.00 0.00 H new ATOM 0 HG3 GLN A 886 -21.448 1.035 1.691 1.00 0.00 H new ATOM 0 HE21 GLN A 886 -18.566 1.416 0.906 1.00 0.00 H new ATOM 0 HE22 GLN A 886 -18.115 2.982 1.587 1.00 0.00 H new ATOM 1511 N GLN A 887 -19.715 -0.146 -3.225 1.00 0.00 N ATOM 1512 CA GLN A 887 -18.887 -0.954 -4.112 1.00 0.00 C ATOM 1513 C GLN A 887 -18.026 -0.054 -4.988 1.00 0.00 C ATOM 1514 O GLN A 887 -16.815 -0.247 -5.096 1.00 0.00 O ATOM 1515 CB GLN A 887 -19.746 -1.857 -4.998 1.00 0.00 C ATOM 1516 CG GLN A 887 -20.692 -2.765 -4.231 1.00 0.00 C ATOM 1517 CD GLN A 887 -19.990 -3.619 -3.196 1.00 0.00 C ATOM 1518 OE1 GLN A 887 -18.826 -3.990 -3.355 1.00 0.00 O ATOM 1519 NE2 GLN A 887 -20.696 -3.936 -2.126 1.00 0.00 N ATOM 0 H GLN A 887 -20.719 -0.254 -3.367 1.00 0.00 H new ATOM 0 HA GLN A 887 -18.247 -1.583 -3.493 1.00 0.00 H new ATOM 0 HB2 GLN A 887 -20.329 -1.234 -5.676 1.00 0.00 H new ATOM 0 HB3 GLN A 887 -19.090 -2.472 -5.615 1.00 0.00 H new ATOM 0 HG2 GLN A 887 -21.449 -2.156 -3.737 1.00 0.00 H new ATOM 0 HG3 GLN A 887 -21.213 -3.414 -4.935 1.00 0.00 H new ATOM 0 HE21 GLN A 887 -21.657 -3.608 -2.034 1.00 0.00 H new ATOM 0 HE22 GLN A 887 -20.280 -4.509 -1.392 1.00 0.00 H new ATOM 1528 N GLN A 888 -18.658 0.943 -5.601 1.00 0.00 N ATOM 1529 CA GLN A 888 -17.947 1.895 -6.442 1.00 0.00 C ATOM 1530 C GLN A 888 -16.945 2.695 -5.618 1.00 0.00 C ATOM 1531 O GLN A 888 -15.815 2.915 -6.051 1.00 0.00 O ATOM 1532 CB GLN A 888 -18.928 2.835 -7.146 1.00 0.00 C ATOM 1533 CG GLN A 888 -18.260 3.788 -8.127 1.00 0.00 C ATOM 1534 CD GLN A 888 -17.476 3.064 -9.209 1.00 0.00 C ATOM 1535 OE1 GLN A 888 -17.814 1.945 -9.599 1.00 0.00 O ATOM 1536 NE2 GLN A 888 -16.427 3.701 -9.708 1.00 0.00 N ATOM 0 H GLN A 888 -19.662 1.111 -5.530 1.00 0.00 H new ATOM 0 HA GLN A 888 -17.402 1.335 -7.202 1.00 0.00 H new ATOM 0 HB2 GLN A 888 -19.670 2.240 -7.678 1.00 0.00 H new ATOM 0 HB3 GLN A 888 -19.464 3.416 -6.395 1.00 0.00 H new ATOM 0 HG2 GLN A 888 -19.020 4.414 -8.593 1.00 0.00 H new ATOM 0 HG3 GLN A 888 -17.590 4.453 -7.582 1.00 0.00 H new ATOM 0 HE21 GLN A 888 -16.179 4.627 -9.359 1.00 0.00 H new ATOM 0 HE22 GLN A 888 -15.867 3.266 -10.441 1.00 0.00 H new ATOM 1545 N ARG A 889 -17.359 3.114 -4.424 1.00 0.00 N ATOM 1546 CA ARG A 889 -16.468 3.833 -3.516 1.00 0.00 C ATOM 1547 C ARG A 889 -15.250 2.983 -3.183 1.00 0.00 C ATOM 1548 O ARG A 889 -14.131 3.490 -3.104 1.00 0.00 O ATOM 1549 CB ARG A 889 -17.193 4.221 -2.226 1.00 0.00 C ATOM 1550 CG ARG A 889 -18.309 5.229 -2.426 1.00 0.00 C ATOM 1551 CD ARG A 889 -18.973 5.581 -1.107 1.00 0.00 C ATOM 1552 NE ARG A 889 -20.132 6.453 -1.290 1.00 0.00 N ATOM 1553 CZ ARG A 889 -20.743 7.102 -0.298 1.00 0.00 C ATOM 1554 NH1 ARG A 889 -20.260 7.051 0.940 1.00 0.00 N ATOM 1555 NH2 ARG A 889 -21.830 7.815 -0.556 1.00 0.00 N ATOM 0 H ARG A 889 -18.302 2.969 -4.064 1.00 0.00 H new ATOM 0 HA ARG A 889 -16.144 4.744 -4.020 1.00 0.00 H new ATOM 0 HB2 ARG A 889 -17.607 3.322 -1.769 1.00 0.00 H new ATOM 0 HB3 ARG A 889 -16.468 4.631 -1.523 1.00 0.00 H new ATOM 0 HG2 ARG A 889 -17.909 6.132 -2.887 1.00 0.00 H new ATOM 0 HG3 ARG A 889 -19.051 4.822 -3.113 1.00 0.00 H new ATOM 0 HD2 ARG A 889 -19.284 4.666 -0.603 1.00 0.00 H new ATOM 0 HD3 ARG A 889 -18.249 6.073 -0.457 1.00 0.00 H new ATOM 0 HE ARG A 889 -20.496 6.572 -2.235 1.00 0.00 H new ATOM 0 HH11 ARG A 889 -19.416 6.513 1.136 1.00 0.00 H new ATOM 0 HH12 ARG A 889 -20.733 7.550 1.693 1.00 0.00 H new ATOM 0 HH21 ARG A 889 -22.193 7.864 -1.508 1.00 0.00 H new ATOM 0 HH22 ARG A 889 -22.303 8.314 0.197 1.00 0.00 H new ATOM 1569 N LEU A 890 -15.478 1.688 -2.990 1.00 0.00 N ATOM 1570 CA LEU A 890 -14.394 0.756 -2.723 1.00 0.00 C ATOM 1571 C LEU A 890 -13.476 0.650 -3.928 1.00 0.00 C ATOM 1572 O LEU A 890 -12.263 0.583 -3.777 1.00 0.00 O ATOM 1573 CB LEU A 890 -14.936 -0.623 -2.346 1.00 0.00 C ATOM 1574 CG LEU A 890 -13.872 -1.708 -2.147 1.00 0.00 C ATOM 1575 CD1 LEU A 890 -12.861 -1.289 -1.091 1.00 0.00 C ATOM 1576 CD2 LEU A 890 -14.526 -3.022 -1.763 1.00 0.00 C ATOM 0 H LEU A 890 -16.405 1.262 -3.014 1.00 0.00 H new ATOM 0 HA LEU A 890 -13.821 1.139 -1.878 1.00 0.00 H new ATOM 0 HB2 LEU A 890 -15.514 -0.530 -1.427 1.00 0.00 H new ATOM 0 HB3 LEU A 890 -15.625 -0.950 -3.124 1.00 0.00 H new ATOM 0 HG LEU A 890 -13.341 -1.843 -3.089 1.00 0.00 H new ATOM 0 HD11 LEU A 890 -12.116 -2.075 -0.968 1.00 0.00 H new ATOM 0 HD12 LEU A 890 -12.368 -0.368 -1.404 1.00 0.00 H new ATOM 0 HD13 LEU A 890 -13.373 -1.122 -0.143 1.00 0.00 H new ATOM 0 HD21 LEU A 890 -13.759 -3.784 -1.625 1.00 0.00 H new ATOM 0 HD22 LEU A 890 -15.082 -2.894 -0.834 1.00 0.00 H new ATOM 0 HD23 LEU A 890 -15.208 -3.334 -2.554 1.00 0.00 H new ATOM 1588 N ARG A 891 -14.054 0.639 -5.121 1.00 0.00 N ATOM 1589 CA ARG A 891 -13.261 0.616 -6.342 1.00 0.00 C ATOM 1590 C ARG A 891 -12.339 1.827 -6.386 1.00 0.00 C ATOM 1591 O ARG A 891 -11.132 1.685 -6.564 1.00 0.00 O ATOM 1592 CB ARG A 891 -14.157 0.584 -7.584 1.00 0.00 C ATOM 1593 CG ARG A 891 -15.044 -0.649 -7.663 1.00 0.00 C ATOM 1594 CD ARG A 891 -15.884 -0.664 -8.930 1.00 0.00 C ATOM 1595 NE ARG A 891 -16.838 -1.774 -8.934 1.00 0.00 N ATOM 1596 CZ ARG A 891 -17.571 -2.131 -9.988 1.00 0.00 C ATOM 1597 NH1 ARG A 891 -17.425 -1.512 -11.155 1.00 0.00 N ATOM 1598 NH2 ARG A 891 -18.442 -3.125 -9.874 1.00 0.00 N ATOM 0 H ARG A 891 -15.063 0.646 -5.269 1.00 0.00 H new ATOM 0 HA ARG A 891 -12.659 -0.292 -6.341 1.00 0.00 H new ATOM 0 HB2 ARG A 891 -14.785 1.475 -7.591 1.00 0.00 H new ATOM 0 HB3 ARG A 891 -13.531 0.628 -8.475 1.00 0.00 H new ATOM 0 HG2 ARG A 891 -14.424 -1.545 -7.628 1.00 0.00 H new ATOM 0 HG3 ARG A 891 -15.699 -0.681 -6.793 1.00 0.00 H new ATOM 0 HD2 ARG A 891 -16.423 0.279 -9.021 1.00 0.00 H new ATOM 0 HD3 ARG A 891 -15.231 -0.743 -9.799 1.00 0.00 H new ATOM 0 HE ARG A 891 -16.949 -2.310 -8.073 1.00 0.00 H new ATOM 0 HH11 ARG A 891 -16.747 -0.756 -11.250 1.00 0.00 H new ATOM 0 HH12 ARG A 891 -17.991 -1.793 -11.956 1.00 0.00 H new ATOM 0 HH21 ARG A 891 -18.548 -3.611 -8.983 1.00 0.00 H new ATOM 0 HH22 ARG A 891 -19.006 -3.403 -10.677 1.00 0.00 H new ATOM 1612 N GLU A 892 -12.913 3.011 -6.181 1.00 0.00 N ATOM 1613 CA GLU A 892 -12.142 4.254 -6.145 1.00 0.00 C ATOM 1614 C GLU A 892 -11.037 4.168 -5.097 1.00 0.00 C ATOM 1615 O GLU A 892 -9.873 4.468 -5.365 1.00 0.00 O ATOM 1616 CB GLU A 892 -13.044 5.440 -5.796 1.00 0.00 C ATOM 1617 CG GLU A 892 -14.296 5.548 -6.643 1.00 0.00 C ATOM 1618 CD GLU A 892 -15.197 6.672 -6.181 1.00 0.00 C ATOM 1619 OE1 GLU A 892 -15.666 6.629 -5.026 1.00 0.00 O ATOM 1620 OE2 GLU A 892 -15.439 7.610 -6.972 1.00 0.00 O ATOM 0 H GLU A 892 -13.915 3.137 -6.036 1.00 0.00 H new ATOM 0 HA GLU A 892 -11.707 4.399 -7.134 1.00 0.00 H new ATOM 0 HB2 GLU A 892 -13.335 5.363 -4.748 1.00 0.00 H new ATOM 0 HB3 GLU A 892 -12.469 6.360 -5.900 1.00 0.00 H new ATOM 0 HG2 GLU A 892 -14.017 5.712 -7.684 1.00 0.00 H new ATOM 0 HG3 GLU A 892 -14.843 4.606 -6.604 1.00 0.00 H new ATOM 1627 N ALA A 893 -11.422 3.751 -3.901 1.00 0.00 N ATOM 1628 CA ALA A 893 -10.515 3.706 -2.768 1.00 0.00 C ATOM 1629 C ALA A 893 -9.420 2.661 -2.956 1.00 0.00 C ATOM 1630 O ALA A 893 -8.251 2.937 -2.707 1.00 0.00 O ATOM 1631 CB ALA A 893 -11.296 3.437 -1.496 1.00 0.00 C ATOM 0 H ALA A 893 -12.369 3.436 -3.690 1.00 0.00 H new ATOM 0 HA ALA A 893 -10.023 4.676 -2.692 1.00 0.00 H new ATOM 0 HB1 ALA A 893 -10.611 3.404 -0.649 1.00 0.00 H new ATOM 0 HB2 ALA A 893 -12.026 4.232 -1.342 1.00 0.00 H new ATOM 0 HB3 ALA A 893 -11.813 2.481 -1.582 1.00 0.00 H new ATOM 1637 N ALA A 894 -9.800 1.471 -3.400 1.00 0.00 N ATOM 1638 CA ALA A 894 -8.846 0.383 -3.582 1.00 0.00 C ATOM 1639 C ALA A 894 -7.907 0.666 -4.745 1.00 0.00 C ATOM 1640 O ALA A 894 -6.724 0.347 -4.677 1.00 0.00 O ATOM 1641 CB ALA A 894 -9.563 -0.942 -3.782 1.00 0.00 C ATOM 0 H ALA A 894 -10.762 1.233 -3.641 1.00 0.00 H new ATOM 0 HA ALA A 894 -8.247 0.312 -2.674 1.00 0.00 H new ATOM 0 HB1 ALA A 894 -8.829 -1.737 -3.915 1.00 0.00 H new ATOM 0 HB2 ALA A 894 -10.177 -1.159 -2.908 1.00 0.00 H new ATOM 0 HB3 ALA A 894 -10.198 -0.882 -4.666 1.00 0.00 H new ATOM 1647 N GLU A 895 -8.429 1.270 -5.806 1.00 0.00 N ATOM 1648 CA GLU A 895 -7.596 1.657 -6.938 1.00 0.00 C ATOM 1649 C GLU A 895 -6.675 2.804 -6.547 1.00 0.00 C ATOM 1650 O GLU A 895 -5.532 2.871 -6.992 1.00 0.00 O ATOM 1651 CB GLU A 895 -8.452 2.053 -8.139 1.00 0.00 C ATOM 1652 CG GLU A 895 -9.163 0.883 -8.793 1.00 0.00 C ATOM 1653 CD GLU A 895 -10.049 1.309 -9.943 1.00 0.00 C ATOM 1654 OE1 GLU A 895 -9.551 1.987 -10.867 1.00 0.00 O ATOM 1655 OE2 GLU A 895 -11.254 0.979 -9.925 1.00 0.00 O ATOM 0 H GLU A 895 -9.417 1.501 -5.906 1.00 0.00 H new ATOM 0 HA GLU A 895 -6.990 0.797 -7.222 1.00 0.00 H new ATOM 0 HB2 GLU A 895 -9.194 2.785 -7.820 1.00 0.00 H new ATOM 0 HB3 GLU A 895 -7.819 2.542 -8.880 1.00 0.00 H new ATOM 0 HG2 GLU A 895 -8.423 0.169 -9.155 1.00 0.00 H new ATOM 0 HG3 GLU A 895 -9.766 0.366 -8.047 1.00 0.00 H new ATOM 1662 N GLY A 896 -7.179 3.706 -5.714 1.00 0.00 N ATOM 1663 CA GLY A 896 -6.349 4.770 -5.185 1.00 0.00 C ATOM 1664 C GLY A 896 -5.273 4.229 -4.267 1.00 0.00 C ATOM 1665 O GLY A 896 -4.120 4.653 -4.329 1.00 0.00 O ATOM 0 H GLY A 896 -8.148 3.719 -5.396 1.00 0.00 H new ATOM 0 HA2 GLY A 896 -5.887 5.316 -6.008 1.00 0.00 H new ATOM 0 HA3 GLY A 896 -6.970 5.481 -4.640 1.00 0.00 H new ATOM 1669 N LEU A 897 -5.661 3.282 -3.420 1.00 0.00 N ATOM 1670 CA LEU A 897 -4.730 2.606 -2.526 1.00 0.00 C ATOM 1671 C LEU A 897 -3.690 1.843 -3.338 1.00 0.00 C ATOM 1672 O LEU A 897 -2.490 1.943 -3.076 1.00 0.00 O ATOM 1673 CB LEU A 897 -5.509 1.665 -1.585 1.00 0.00 C ATOM 1674 CG LEU A 897 -4.695 0.899 -0.528 1.00 0.00 C ATOM 1675 CD1 LEU A 897 -4.086 -0.367 -1.111 1.00 0.00 C ATOM 1676 CD2 LEU A 897 -3.612 1.783 0.066 1.00 0.00 C ATOM 0 H LEU A 897 -6.626 2.963 -3.334 1.00 0.00 H new ATOM 0 HA LEU A 897 -4.205 3.341 -1.917 1.00 0.00 H new ATOM 0 HB2 LEU A 897 -6.265 2.255 -1.067 1.00 0.00 H new ATOM 0 HB3 LEU A 897 -6.038 0.936 -2.198 1.00 0.00 H new ATOM 0 HG LEU A 897 -5.380 0.609 0.269 1.00 0.00 H new ATOM 0 HD11 LEU A 897 -3.517 -0.886 -0.339 1.00 0.00 H new ATOM 0 HD12 LEU A 897 -4.880 -1.018 -1.476 1.00 0.00 H new ATOM 0 HD13 LEU A 897 -3.424 -0.105 -1.936 1.00 0.00 H new ATOM 0 HD21 LEU A 897 -3.050 1.219 0.811 1.00 0.00 H new ATOM 0 HD22 LEU A 897 -2.938 2.113 -0.724 1.00 0.00 H new ATOM 0 HD23 LEU A 897 -4.070 2.652 0.538 1.00 0.00 H new ATOM 1688 N ARG A 898 -4.156 1.089 -4.326 1.00 0.00 N ATOM 1689 CA ARG A 898 -3.269 0.339 -5.201 1.00 0.00 C ATOM 1690 C ARG A 898 -2.313 1.286 -5.912 1.00 0.00 C ATOM 1691 O ARG A 898 -1.111 1.048 -5.943 1.00 0.00 O ATOM 1692 CB ARG A 898 -4.072 -0.465 -6.225 1.00 0.00 C ATOM 1693 CG ARG A 898 -3.222 -1.395 -7.073 1.00 0.00 C ATOM 1694 CD ARG A 898 -4.071 -2.168 -8.066 1.00 0.00 C ATOM 1695 NE ARG A 898 -3.298 -3.184 -8.778 1.00 0.00 N ATOM 1696 CZ ARG A 898 -3.838 -4.261 -9.345 1.00 0.00 C ATOM 1697 NH1 ARG A 898 -5.154 -4.426 -9.344 1.00 0.00 N ATOM 1698 NH2 ARG A 898 -3.059 -5.167 -9.924 1.00 0.00 N ATOM 0 H ARG A 898 -5.147 0.982 -4.540 1.00 0.00 H new ATOM 0 HA ARG A 898 -2.692 -0.358 -4.592 1.00 0.00 H new ATOM 0 HB2 ARG A 898 -4.826 -1.053 -5.702 1.00 0.00 H new ATOM 0 HB3 ARG A 898 -4.604 0.225 -6.880 1.00 0.00 H new ATOM 0 HG2 ARG A 898 -2.469 -0.816 -7.608 1.00 0.00 H new ATOM 0 HG3 ARG A 898 -2.688 -2.093 -6.428 1.00 0.00 H new ATOM 0 HD2 ARG A 898 -4.898 -2.645 -7.541 1.00 0.00 H new ATOM 0 HD3 ARG A 898 -4.507 -1.475 -8.785 1.00 0.00 H new ATOM 0 HE ARG A 898 -2.288 -3.061 -8.844 1.00 0.00 H new ATOM 0 HH11 ARG A 898 -5.755 -3.727 -8.908 1.00 0.00 H new ATOM 0 HH12 ARG A 898 -5.565 -5.252 -9.779 1.00 0.00 H new ATOM 0 HH21 ARG A 898 -2.047 -5.038 -9.934 1.00 0.00 H new ATOM 0 HH22 ARG A 898 -3.472 -5.992 -10.358 1.00 0.00 H new ATOM 1712 N MET A 899 -2.857 2.367 -6.460 1.00 0.00 N ATOM 1713 CA MET A 899 -2.053 3.379 -7.134 1.00 0.00 C ATOM 1714 C MET A 899 -1.007 3.958 -6.187 1.00 0.00 C ATOM 1715 O MET A 899 0.168 4.016 -6.524 1.00 0.00 O ATOM 1716 CB MET A 899 -2.938 4.506 -7.672 1.00 0.00 C ATOM 1717 CG MET A 899 -2.162 5.606 -8.383 1.00 0.00 C ATOM 1718 SD MET A 899 -3.203 6.999 -8.866 1.00 0.00 S ATOM 1719 CE MET A 899 -3.777 7.566 -7.266 1.00 0.00 C ATOM 0 H MET A 899 -3.858 2.565 -6.450 1.00 0.00 H new ATOM 0 HA MET A 899 -1.546 2.897 -7.970 1.00 0.00 H new ATOM 0 HB2 MET A 899 -3.669 4.084 -8.362 1.00 0.00 H new ATOM 0 HB3 MET A 899 -3.497 4.944 -6.845 1.00 0.00 H new ATOM 0 HG2 MET A 899 -1.366 5.963 -7.729 1.00 0.00 H new ATOM 0 HG3 MET A 899 -1.684 5.191 -9.270 1.00 0.00 H new ATOM 0 HE1 MET A 899 -3.922 8.646 -7.293 1.00 0.00 H new ATOM 0 HE2 MET A 899 -4.722 7.079 -7.025 1.00 0.00 H new ATOM 0 HE3 MET A 899 -3.037 7.319 -6.505 1.00 0.00 H new ATOM 1729 N ALA A 900 -1.444 4.371 -5.000 1.00 0.00 N ATOM 1730 CA ALA A 900 -0.549 4.959 -4.008 1.00 0.00 C ATOM 1731 C ALA A 900 0.544 3.978 -3.599 1.00 0.00 C ATOM 1732 O ALA A 900 1.723 4.330 -3.548 1.00 0.00 O ATOM 1733 CB ALA A 900 -1.339 5.408 -2.788 1.00 0.00 C ATOM 0 H ALA A 900 -2.417 4.309 -4.701 1.00 0.00 H new ATOM 0 HA ALA A 900 -0.069 5.827 -4.460 1.00 0.00 H new ATOM 0 HB1 ALA A 900 -0.660 5.845 -2.056 1.00 0.00 H new ATOM 0 HB2 ALA A 900 -2.078 6.152 -3.087 1.00 0.00 H new ATOM 0 HB3 ALA A 900 -1.846 4.550 -2.347 1.00 0.00 H new ATOM 1739 N THR A 901 0.146 2.746 -3.322 1.00 0.00 N ATOM 1740 CA THR A 901 1.084 1.713 -2.922 1.00 0.00 C ATOM 1741 C THR A 901 2.038 1.367 -4.057 1.00 0.00 C ATOM 1742 O THR A 901 3.249 1.275 -3.860 1.00 0.00 O ATOM 1743 CB THR A 901 0.349 0.436 -2.490 1.00 0.00 C ATOM 1744 OG1 THR A 901 -0.601 0.745 -1.466 1.00 0.00 O ATOM 1745 CG2 THR A 901 1.336 -0.603 -1.987 1.00 0.00 C ATOM 0 H THR A 901 -0.825 2.438 -3.368 1.00 0.00 H new ATOM 0 HA THR A 901 1.651 2.108 -2.080 1.00 0.00 H new ATOM 0 HB THR A 901 -0.175 0.026 -3.353 1.00 0.00 H new ATOM 0 HG1 THR A 901 -1.375 1.196 -1.863 1.00 0.00 H new ATOM 0 HG21 THR A 901 0.797 -1.501 -1.685 1.00 0.00 H new ATOM 0 HG22 THR A 901 2.039 -0.852 -2.782 1.00 0.00 H new ATOM 0 HG23 THR A 901 1.881 -0.203 -1.132 1.00 0.00 H new ATOM 1753 N ASN A 902 1.488 1.180 -5.247 1.00 0.00 N ATOM 1754 CA ASN A 902 2.283 0.829 -6.408 1.00 0.00 C ATOM 1755 C ASN A 902 3.196 1.994 -6.786 1.00 0.00 C ATOM 1756 O ASN A 902 4.298 1.797 -7.296 1.00 0.00 O ATOM 1757 CB ASN A 902 1.375 0.442 -7.577 1.00 0.00 C ATOM 1758 CG ASN A 902 2.142 -0.080 -8.773 1.00 0.00 C ATOM 1759 OD1 ASN A 902 3.255 -0.593 -8.643 1.00 0.00 O ATOM 1760 ND2 ASN A 902 1.540 0.018 -9.945 1.00 0.00 N ATOM 0 H ASN A 902 0.489 1.267 -5.432 1.00 0.00 H new ATOM 0 HA ASN A 902 2.906 -0.032 -6.166 1.00 0.00 H new ATOM 0 HB2 ASN A 902 0.669 -0.319 -7.245 1.00 0.00 H new ATOM 0 HB3 ASN A 902 0.790 1.311 -7.878 1.00 0.00 H new ATOM 0 HD21 ASN A 902 1.997 -0.338 -10.784 1.00 0.00 H new ATOM 0 HD22 ASN A 902 0.618 0.450 -10.010 1.00 0.00 H new ATOM 1767 N ALA A 903 2.736 3.211 -6.517 1.00 0.00 N ATOM 1768 CA ALA A 903 3.558 4.399 -6.697 1.00 0.00 C ATOM 1769 C ALA A 903 4.715 4.384 -5.712 1.00 0.00 C ATOM 1770 O ALA A 903 5.849 4.671 -6.074 1.00 0.00 O ATOM 1771 CB ALA A 903 2.733 5.667 -6.531 1.00 0.00 C ATOM 0 H ALA A 903 1.795 3.400 -6.172 1.00 0.00 H new ATOM 0 HA ALA A 903 3.956 4.391 -7.712 1.00 0.00 H new ATOM 0 HB1 ALA A 903 3.373 6.538 -6.671 1.00 0.00 H new ATOM 0 HB2 ALA A 903 1.934 5.681 -7.272 1.00 0.00 H new ATOM 0 HB3 ALA A 903 2.300 5.691 -5.531 1.00 0.00 H new ATOM 1777 N ALA A 904 4.429 4.041 -4.465 1.00 0.00 N ATOM 1778 CA ALA A 904 5.476 3.877 -3.463 1.00 0.00 C ATOM 1779 C ALA A 904 6.436 2.765 -3.878 1.00 0.00 C ATOM 1780 O ALA A 904 7.634 2.828 -3.610 1.00 0.00 O ATOM 1781 CB ALA A 904 4.869 3.575 -2.100 1.00 0.00 C ATOM 0 H ALA A 904 3.484 3.871 -4.122 1.00 0.00 H new ATOM 0 HA ALA A 904 6.035 4.810 -3.390 1.00 0.00 H new ATOM 0 HB1 ALA A 904 5.665 3.456 -1.365 1.00 0.00 H new ATOM 0 HB2 ALA A 904 4.219 4.397 -1.801 1.00 0.00 H new ATOM 0 HB3 ALA A 904 4.287 2.655 -2.157 1.00 0.00 H new ATOM 1787 N ALA A 905 5.893 1.757 -4.550 1.00 0.00 N ATOM 1788 CA ALA A 905 6.684 0.642 -5.055 1.00 0.00 C ATOM 1789 C ALA A 905 7.626 1.094 -6.171 1.00 0.00 C ATOM 1790 O ALA A 905 8.781 0.671 -6.229 1.00 0.00 O ATOM 1791 CB ALA A 905 5.766 -0.470 -5.546 1.00 0.00 C ATOM 0 H ALA A 905 4.897 1.690 -4.759 1.00 0.00 H new ATOM 0 HA ALA A 905 7.296 0.259 -4.238 1.00 0.00 H new ATOM 0 HB1 ALA A 905 6.367 -1.299 -5.921 1.00 0.00 H new ATOM 0 HB2 ALA A 905 5.143 -0.818 -4.722 1.00 0.00 H new ATOM 0 HB3 ALA A 905 5.131 -0.091 -6.346 1.00 0.00 H new ATOM 1797 N GLN A 906 7.133 1.954 -7.056 1.00 0.00 N ATOM 1798 CA GLN A 906 7.947 2.463 -8.158 1.00 0.00 C ATOM 1799 C GLN A 906 8.893 3.556 -7.668 1.00 0.00 C ATOM 1800 O GLN A 906 9.926 3.818 -8.283 1.00 0.00 O ATOM 1801 CB GLN A 906 7.061 2.991 -9.294 1.00 0.00 C ATOM 1802 CG GLN A 906 6.316 4.271 -8.960 1.00 0.00 C ATOM 1803 CD GLN A 906 5.269 4.638 -9.991 1.00 0.00 C ATOM 1804 OE1 GLN A 906 4.998 5.816 -10.221 1.00 0.00 O ATOM 1805 NE2 GLN A 906 4.653 3.641 -10.607 1.00 0.00 N ATOM 0 H GLN A 906 6.178 2.313 -7.034 1.00 0.00 H new ATOM 0 HA GLN A 906 8.544 1.637 -8.546 1.00 0.00 H new ATOM 0 HB2 GLN A 906 7.682 3.164 -10.173 1.00 0.00 H new ATOM 0 HB3 GLN A 906 6.337 2.222 -9.562 1.00 0.00 H new ATOM 0 HG2 GLN A 906 5.836 4.161 -7.987 1.00 0.00 H new ATOM 0 HG3 GLN A 906 7.032 5.088 -8.872 1.00 0.00 H new ATOM 0 HE21 GLN A 906 4.903 2.676 -10.391 1.00 0.00 H new ATOM 0 HE22 GLN A 906 3.928 3.838 -11.297 1.00 0.00 H new ATOM 1814 N ASN A 907 8.528 4.187 -6.555 1.00 0.00 N ATOM 1815 CA ASN A 907 9.350 5.233 -5.947 1.00 0.00 C ATOM 1816 C ASN A 907 10.627 4.648 -5.361 1.00 0.00 C ATOM 1817 O ASN A 907 11.571 5.376 -5.064 1.00 0.00 O ATOM 1818 CB ASN A 907 8.570 5.976 -4.858 1.00 0.00 C ATOM 1819 CG ASN A 907 7.959 7.271 -5.359 1.00 0.00 C ATOM 1820 OD1 ASN A 907 8.558 8.341 -5.245 1.00 0.00 O ATOM 1821 ND2 ASN A 907 6.765 7.186 -5.921 1.00 0.00 N ATOM 0 H ASN A 907 7.663 3.991 -6.052 1.00 0.00 H new ATOM 0 HA ASN A 907 9.618 5.941 -6.731 1.00 0.00 H new ATOM 0 HB2 ASN A 907 7.780 5.329 -4.477 1.00 0.00 H new ATOM 0 HB3 ASN A 907 9.236 6.192 -4.022 1.00 0.00 H new ATOM 0 HD21 ASN A 907 6.309 8.025 -6.278 1.00 0.00 H new ATOM 0 HD22 ASN A 907 6.300 6.281 -5.997 1.00 0.00 H new ATOM 1828 N ALA A 908 10.647 3.335 -5.187 1.00 0.00 N ATOM 1829 CA ALA A 908 11.837 2.648 -4.723 1.00 0.00 C ATOM 1830 C ALA A 908 12.895 2.633 -5.817 1.00 0.00 C ATOM 1831 O ALA A 908 12.743 1.945 -6.829 1.00 0.00 O ATOM 1832 CB ALA A 908 11.499 1.231 -4.290 1.00 0.00 C ATOM 0 H ALA A 908 9.849 2.725 -5.362 1.00 0.00 H new ATOM 0 HA ALA A 908 12.235 3.184 -3.861 1.00 0.00 H new ATOM 0 HB1 ALA A 908 12.404 0.730 -3.945 1.00 0.00 H new ATOM 0 HB2 ALA A 908 10.770 1.262 -3.480 1.00 0.00 H new ATOM 0 HB3 ALA A 908 11.080 0.683 -5.134 1.00 0.00 H new ATOM 1838 N ILE A 909 13.952 3.409 -5.618 1.00 0.00 N ATOM 1839 CA ILE A 909 15.040 3.491 -6.584 1.00 0.00 C ATOM 1840 C ILE A 909 15.685 2.122 -6.750 1.00 0.00 C ATOM 1841 O ILE A 909 15.993 1.446 -5.765 1.00 0.00 O ATOM 1842 CB ILE A 909 16.115 4.532 -6.173 1.00 0.00 C ATOM 1843 CG1 ILE A 909 15.572 5.962 -6.272 1.00 0.00 C ATOM 1844 CG2 ILE A 909 17.367 4.393 -7.028 1.00 0.00 C ATOM 1845 CD1 ILE A 909 14.579 6.328 -5.191 1.00 0.00 C ATOM 0 H ILE A 909 14.079 3.994 -4.792 1.00 0.00 H new ATOM 0 HA ILE A 909 14.612 3.820 -7.531 1.00 0.00 H new ATOM 0 HB ILE A 909 16.377 4.333 -5.134 1.00 0.00 H new ATOM 0 HG12 ILE A 909 16.409 6.659 -6.231 1.00 0.00 H new ATOM 0 HG13 ILE A 909 15.097 6.091 -7.244 1.00 0.00 H new ATOM 0 HG21 ILE A 909 18.103 5.135 -6.718 1.00 0.00 H new ATOM 0 HG22 ILE A 909 17.784 3.394 -6.903 1.00 0.00 H new ATOM 0 HG23 ILE A 909 17.111 4.551 -8.076 1.00 0.00 H new ATOM 0 HD11 ILE A 909 14.246 7.356 -5.336 1.00 0.00 H new ATOM 0 HD12 ILE A 909 13.721 5.658 -5.243 1.00 0.00 H new ATOM 0 HD13 ILE A 909 15.054 6.235 -4.214 1.00 0.00 H new ATOM 1857 N LYS A 910 15.870 1.715 -7.993 1.00 0.00 N ATOM 1858 CA LYS A 910 16.392 0.398 -8.295 1.00 0.00 C ATOM 1859 C LYS A 910 17.220 0.457 -9.569 1.00 0.00 C ATOM 1860 O LYS A 910 16.674 0.500 -10.672 1.00 0.00 O ATOM 1861 CB LYS A 910 15.236 -0.594 -8.441 1.00 0.00 C ATOM 1862 CG LYS A 910 15.668 -2.033 -8.659 1.00 0.00 C ATOM 1863 CD LYS A 910 14.473 -2.976 -8.638 1.00 0.00 C ATOM 1864 CE LYS A 910 13.768 -2.945 -7.290 1.00 0.00 C ATOM 1865 NZ LYS A 910 12.553 -3.797 -7.271 1.00 0.00 N ATOM 0 H LYS A 910 15.664 2.284 -8.814 1.00 0.00 H new ATOM 0 HA LYS A 910 17.034 0.061 -7.481 1.00 0.00 H new ATOM 0 HB2 LYS A 910 14.616 -0.545 -7.546 1.00 0.00 H new ATOM 0 HB3 LYS A 910 14.611 -0.284 -9.279 1.00 0.00 H new ATOM 0 HG2 LYS A 910 16.186 -2.119 -9.614 1.00 0.00 H new ATOM 0 HG3 LYS A 910 16.378 -2.324 -7.884 1.00 0.00 H new ATOM 0 HD2 LYS A 910 13.772 -2.696 -9.424 1.00 0.00 H new ATOM 0 HD3 LYS A 910 14.805 -3.992 -8.854 1.00 0.00 H new ATOM 0 HE2 LYS A 910 14.457 -3.280 -6.514 1.00 0.00 H new ATOM 0 HE3 LYS A 910 13.493 -1.918 -7.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 910 12.183 -3.853 -6.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 910 11.830 -3.384 -7.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 910 12.793 -4.752 -7.605 1.00 0.00 H new ATOM 1879 N LYS A 911 18.533 0.500 -9.406 1.00 0.00 N ATOM 1880 CA LYS A 911 19.441 0.615 -10.538 1.00 0.00 C ATOM 1881 C LYS A 911 20.849 0.173 -10.145 1.00 0.00 C ATOM 1882 O LYS A 911 21.822 0.897 -10.450 1.00 0.00 O ATOM 1883 CB LYS A 911 19.452 2.059 -11.057 1.00 0.00 C ATOM 1884 CG LYS A 911 19.737 3.106 -9.987 1.00 0.00 C ATOM 1885 CD LYS A 911 19.756 4.509 -10.576 1.00 0.00 C ATOM 1886 CE LYS A 911 20.019 5.562 -9.510 1.00 0.00 C ATOM 1887 NZ LYS A 911 20.086 6.930 -10.090 1.00 0.00 N ATOM 1888 OXT LYS A 911 20.974 -0.895 -9.507 1.00 0.00 O ATOM 0 H LYS A 911 18.996 0.457 -8.498 1.00 0.00 H new ATOM 0 HA LYS A 911 19.091 -0.041 -11.336 1.00 0.00 H new ATOM 0 HB2 LYS A 911 20.203 2.145 -11.842 1.00 0.00 H new ATOM 0 HB3 LYS A 911 18.486 2.276 -11.514 1.00 0.00 H new ATOM 0 HG2 LYS A 911 18.978 3.047 -9.207 1.00 0.00 H new ATOM 0 HG3 LYS A 911 20.696 2.895 -9.515 1.00 0.00 H new ATOM 0 HD2 LYS A 911 20.525 4.570 -11.346 1.00 0.00 H new ATOM 0 HD3 LYS A 911 18.802 4.713 -11.062 1.00 0.00 H new ATOM 0 HE2 LYS A 911 19.230 5.524 -8.759 1.00 0.00 H new ATOM 0 HE3 LYS A 911 20.956 5.337 -9.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 911 20.267 7.620 -9.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 911 20.855 6.974 -10.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 911 19.183 7.155 -10.555 1.00 0.00 H new TER 1902 LYS A 911