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 852 ASN : amide:sc= 2.21 K(o=4.2,f=-10!) USER MOD Set 1.2: A 855 LYS NZ :NH3+ -136:sc= 1.25 (180deg=-3.34!) USER MOD Set 1.3: A 907 ASN : amide:sc= 0.703 K(o=4.2,f=-7.4!) USER MOD Set 2.1: A 833 THR OG1 : rot -166:sc= 0.0407 USER MOD Set 2.2: A 867 THR OG1 : rot 68:sc= -0.954! USER MOD Set 3.1: A 816 MET CE :methyl 141:sc= -0.25 (180deg=-1.24) USER MOD Set 3.2: A 887 GLN : amide:sc= 1.1 K(o=0.85,f=-2.2) USER MOD Single : A 786 THR OG1 : rot 180:sc= 0.0668 USER MOD Single : A 788 HIS : no HD1:sc= -0.0678 X(o=-0.068,f=0) USER MOD Single : A 790 THR OG1 : rot 180:sc= 0.364 USER MOD Single : A 798 TYR OH : rot 130:sc= -0.924 USER MOD Single : A 800 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 802 THR OG1 : rot -89:sc= 1.24 USER MOD Single : A 804 THR OG1 : rot 76:sc= 0.482 USER MOD Single : A 807 THR OG1 : rot 72:sc= 0.947 USER MOD Single : A 809 THR OG1 : rot 69:sc= 0.717 USER MOD Single : A 811 ASN : amide:sc= 0.903 K(o=0.9,f=0) USER MOD Single : A 814 SER OG : rot 180:sc= 0 USER MOD Single : A 815 SER OG : rot -84:sc= 1.18 USER MOD Single : A 822 MET CE :methyl 163:sc= -0.11 (180deg=-0.584) USER MOD Single : A 825 GLN :FLIP amide:sc= -0.511 F(o=-3.1!,f=-0.51) USER MOD Single : A 831 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 834 SER OG : rot 180:sc= 0 USER MOD Single : A 838 ASN : amide:sc= -0.136 K(o=-0.14,f=-0.72) USER MOD Single : A 841 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 848 SER OG : rot 180:sc= 0 USER MOD Single : A 853 SER OG : rot 79:sc= 1.19 USER MOD Single : A 858 SER OG : rot -80:sc= 1.07 USER MOD Single : A 861 LYS NZ :NH3+ 173:sc= 1.18 (180deg=0.909) USER MOD Single : A 869 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 870 MET CE :methyl -109:sc= -1.37 (180deg=-2.33!) USER MOD Single : A 875 LYS NZ :NH3+ 153:sc= 1.23 (180deg=1.11) USER MOD Single : A 880 HIS : no HD1:sc= -0.0972 X(o=-0.097,f=0) USER MOD Single : A 883 SER OG : rot 160:sc= -0.0187 USER MOD Single : A 886 GLN : amide:sc= -1.95! C(o=-1.9!,f=-3!) USER MOD Single : A 888 GLN : amide:sc= -0.194 X(o=-0.19,f=-0.62) USER MOD Single : A 899 MET CE :methyl -166:sc= -0.476 (180deg=-0.781) USER MOD Single : A 901 THR OG1 : rot 78:sc= 1.04 USER MOD Single : A 902 ASN : amide:sc= -0.0977 X(o=-0.098,f=-0.047!) USER MOD Single : A 906 GLN : amide:sc= -1.25 K(o=-1.3,f=-6!) USER MOD Single : A 910 LYS NZ :NH3+ 169:sc= 1.77 (180deg=1.26) USER MOD Single : A 911 LYS NZ :NH3+ 170:sc=-0.00145 (180deg=-0.11) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 781 22.115 -9.746 12.557 1.00 0.00 N ATOM 2 CA GLY A 781 22.560 -9.212 11.248 1.00 0.00 C ATOM 3 C GLY A 781 21.388 -8.912 10.343 1.00 0.00 C ATOM 4 O GLY A 781 20.244 -9.214 10.684 1.00 0.00 O ATOM 0 HA2 GLY A 781 23.142 -8.304 11.404 1.00 0.00 H new ATOM 0 HA3 GLY A 781 23.218 -9.934 10.765 1.00 0.00 H new ATOM 10 N ILE A 782 21.661 -8.325 9.194 1.00 0.00 N ATOM 11 CA ILE A 782 20.613 -8.005 8.245 1.00 0.00 C ATOM 12 C ILE A 782 21.092 -8.235 6.814 1.00 0.00 C ATOM 13 O ILE A 782 22.171 -7.783 6.424 1.00 0.00 O ATOM 14 CB ILE A 782 20.114 -6.546 8.421 1.00 0.00 C ATOM 15 CG1 ILE A 782 18.957 -6.249 7.464 1.00 0.00 C ATOM 16 CG2 ILE A 782 21.247 -5.550 8.217 1.00 0.00 C ATOM 17 CD1 ILE A 782 17.723 -7.083 7.734 1.00 0.00 C ATOM 0 H ILE A 782 22.600 -8.060 8.895 1.00 0.00 H new ATOM 0 HA ILE A 782 19.774 -8.672 8.444 1.00 0.00 H new ATOM 0 HB ILE A 782 19.751 -6.439 9.443 1.00 0.00 H new ATOM 0 HG12 ILE A 782 18.696 -5.193 7.538 1.00 0.00 H new ATOM 0 HG13 ILE A 782 19.288 -6.424 6.440 1.00 0.00 H new ATOM 0 HG21 ILE A 782 20.868 -4.536 8.346 1.00 0.00 H new ATOM 0 HG22 ILE A 782 22.034 -5.739 8.947 1.00 0.00 H new ATOM 0 HG23 ILE A 782 21.652 -5.660 7.211 1.00 0.00 H new ATOM 0 HD11 ILE A 782 16.943 -6.821 7.019 1.00 0.00 H new ATOM 0 HD12 ILE A 782 17.969 -8.140 7.631 1.00 0.00 H new ATOM 0 HD13 ILE A 782 17.368 -6.890 8.746 1.00 0.00 H new ATOM 29 N ASP A 783 20.304 -8.979 6.053 1.00 0.00 N ATOM 30 CA ASP A 783 20.584 -9.190 4.640 1.00 0.00 C ATOM 31 C ASP A 783 20.125 -7.981 3.847 1.00 0.00 C ATOM 32 O ASP A 783 19.035 -7.457 4.086 1.00 0.00 O ATOM 33 CB ASP A 783 19.883 -10.446 4.111 1.00 0.00 C ATOM 34 CG ASP A 783 20.538 -11.730 4.577 1.00 0.00 C ATOM 35 OD1 ASP A 783 20.298 -12.134 5.738 1.00 0.00 O ATOM 36 OD2 ASP A 783 21.296 -12.337 3.788 1.00 0.00 O ATOM 0 H ASP A 783 19.464 -9.448 6.391 1.00 0.00 H new ATOM 0 HA ASP A 783 21.659 -9.328 4.524 1.00 0.00 H new ATOM 0 HB2 ASP A 783 18.842 -10.438 4.434 1.00 0.00 H new ATOM 0 HB3 ASP A 783 19.879 -10.421 3.021 1.00 0.00 H new ATOM 41 N PRO A 784 20.951 -7.515 2.905 1.00 0.00 N ATOM 42 CA PRO A 784 20.627 -6.350 2.082 1.00 0.00 C ATOM 43 C PRO A 784 19.388 -6.582 1.225 1.00 0.00 C ATOM 44 O PRO A 784 19.388 -7.428 0.328 1.00 0.00 O ATOM 45 CB PRO A 784 21.866 -6.165 1.199 1.00 0.00 C ATOM 46 CG PRO A 784 22.947 -6.940 1.873 1.00 0.00 C ATOM 47 CD PRO A 784 22.265 -8.078 2.567 1.00 0.00 C ATOM 0 HA PRO A 784 20.398 -5.475 2.690 1.00 0.00 H new ATOM 0 HB2 PRO A 784 21.688 -6.534 0.189 1.00 0.00 H new ATOM 0 HB3 PRO A 784 22.133 -5.112 1.111 1.00 0.00 H new ATOM 0 HG2 PRO A 784 23.676 -7.304 1.149 1.00 0.00 H new ATOM 0 HG3 PRO A 784 23.489 -6.317 2.585 1.00 0.00 H new ATOM 0 HD2 PRO A 784 22.176 -8.951 1.920 1.00 0.00 H new ATOM 0 HD3 PRO A 784 22.810 -8.394 3.456 1.00 0.00 H new ATOM 55 N PHE A 785 18.332 -5.838 1.522 1.00 0.00 N ATOM 56 CA PHE A 785 17.087 -5.928 0.770 1.00 0.00 C ATOM 57 C PHE A 785 17.268 -5.358 -0.631 1.00 0.00 C ATOM 58 O PHE A 785 16.726 -5.881 -1.605 1.00 0.00 O ATOM 59 CB PHE A 785 15.971 -5.168 1.486 1.00 0.00 C ATOM 60 CG PHE A 785 15.478 -5.813 2.750 1.00 0.00 C ATOM 61 CD1 PHE A 785 16.102 -5.556 3.960 1.00 0.00 C ATOM 62 CD2 PHE A 785 14.404 -6.687 2.728 1.00 0.00 C ATOM 63 CE1 PHE A 785 15.665 -6.160 5.122 1.00 0.00 C ATOM 64 CE2 PHE A 785 13.961 -7.292 3.889 1.00 0.00 C ATOM 65 CZ PHE A 785 14.539 -6.985 5.089 1.00 0.00 C ATOM 0 H PHE A 785 18.313 -5.160 2.284 1.00 0.00 H new ATOM 0 HA PHE A 785 16.813 -6.980 0.697 1.00 0.00 H new ATOM 0 HB2 PHE A 785 16.327 -4.165 1.722 1.00 0.00 H new ATOM 0 HB3 PHE A 785 15.131 -5.055 0.801 1.00 0.00 H new ATOM 0 HD1 PHE A 785 16.940 -4.875 3.995 1.00 0.00 H new ATOM 0 HD2 PHE A 785 13.907 -6.898 1.793 1.00 0.00 H new ATOM 0 HE1 PHE A 785 16.191 -5.995 6.051 1.00 0.00 H new ATOM 0 HE2 PHE A 785 13.155 -8.010 3.848 1.00 0.00 H new ATOM 0 HZ PHE A 785 14.127 -7.378 6.007 1.00 0.00 H new ATOM 75 N THR A 786 18.017 -4.269 -0.723 1.00 0.00 N ATOM 76 CA THR A 786 18.322 -3.660 -2.006 1.00 0.00 C ATOM 77 C THR A 786 19.467 -4.394 -2.686 1.00 0.00 C ATOM 78 O THR A 786 19.430 -4.653 -3.888 1.00 0.00 O ATOM 79 CB THR A 786 18.680 -2.173 -1.833 1.00 0.00 C ATOM 80 OG1 THR A 786 19.486 -2.007 -0.659 1.00 0.00 O ATOM 81 CG2 THR A 786 17.426 -1.319 -1.720 1.00 0.00 C ATOM 0 H THR A 786 18.425 -3.789 0.079 1.00 0.00 H new ATOM 0 HA THR A 786 17.434 -3.733 -2.634 1.00 0.00 H new ATOM 0 HB THR A 786 19.237 -1.848 -2.712 1.00 0.00 H new ATOM 0 HG1 THR A 786 19.715 -1.060 -0.551 1.00 0.00 H new ATOM 0 HG21 THR A 786 17.708 -0.273 -1.599 1.00 0.00 H new ATOM 0 HG22 THR A 786 16.827 -1.431 -2.624 1.00 0.00 H new ATOM 0 HG23 THR A 786 16.844 -1.640 -0.857 1.00 0.00 H new ATOM 89 N ALA A 787 20.457 -4.742 -1.878 1.00 0.00 N ATOM 90 CA ALA A 787 21.639 -5.482 -2.319 1.00 0.00 C ATOM 91 C ALA A 787 22.415 -4.726 -3.404 1.00 0.00 C ATOM 92 O ALA A 787 23.307 -3.934 -3.094 1.00 0.00 O ATOM 93 CB ALA A 787 21.260 -6.887 -2.777 1.00 0.00 C ATOM 0 H ALA A 787 20.466 -4.517 -0.883 1.00 0.00 H new ATOM 0 HA ALA A 787 22.307 -5.577 -1.463 1.00 0.00 H new ATOM 0 HB1 ALA A 787 22.155 -7.418 -3.100 1.00 0.00 H new ATOM 0 HB2 ALA A 787 20.797 -7.426 -1.951 1.00 0.00 H new ATOM 0 HB3 ALA A 787 20.557 -6.822 -3.607 1.00 0.00 H new ATOM 99 N HIS A 788 22.064 -4.958 -4.665 1.00 0.00 N ATOM 100 CA HIS A 788 22.734 -4.317 -5.792 1.00 0.00 C ATOM 101 C HIS A 788 21.934 -4.538 -7.069 1.00 0.00 C ATOM 102 O HIS A 788 21.230 -5.538 -7.199 1.00 0.00 O ATOM 103 CB HIS A 788 24.174 -4.837 -5.961 1.00 0.00 C ATOM 104 CG HIS A 788 24.305 -6.335 -5.998 1.00 0.00 C ATOM 105 ND1 HIS A 788 25.016 -7.044 -5.055 1.00 0.00 N ATOM 106 CD2 HIS A 788 23.831 -7.254 -6.872 1.00 0.00 C ATOM 107 CE1 HIS A 788 24.971 -8.328 -5.346 1.00 0.00 C ATOM 108 NE2 HIS A 788 24.258 -8.484 -6.441 1.00 0.00 N ATOM 0 H HIS A 788 21.311 -5.592 -4.934 1.00 0.00 H new ATOM 0 HA HIS A 788 22.791 -3.248 -5.588 1.00 0.00 H new ATOM 0 HB2 HIS A 788 24.587 -4.428 -6.883 1.00 0.00 H new ATOM 0 HB3 HIS A 788 24.782 -4.454 -5.142 1.00 0.00 H new ATOM 0 HD2 HIS A 788 23.229 -7.055 -7.746 1.00 0.00 H new ATOM 0 HE1 HIS A 788 25.440 -9.120 -4.781 1.00 0.00 H new ATOM 0 HE2 HIS A 788 24.056 -9.375 -6.895 1.00 0.00 H new ATOM 116 N ALA A 789 22.035 -3.599 -7.996 1.00 0.00 N ATOM 117 CA ALA A 789 21.337 -3.696 -9.266 1.00 0.00 C ATOM 118 C ALA A 789 21.963 -4.769 -10.150 1.00 0.00 C ATOM 119 O ALA A 789 23.136 -4.680 -10.512 1.00 0.00 O ATOM 120 CB ALA A 789 21.349 -2.352 -9.979 1.00 0.00 C ATOM 0 H ALA A 789 22.598 -2.755 -7.890 1.00 0.00 H new ATOM 0 HA ALA A 789 20.304 -3.979 -9.066 1.00 0.00 H new ATOM 0 HB1 ALA A 789 20.822 -2.440 -10.929 1.00 0.00 H new ATOM 0 HB2 ALA A 789 20.854 -1.606 -9.357 1.00 0.00 H new ATOM 0 HB3 ALA A 789 22.379 -2.046 -10.162 1.00 0.00 H new ATOM 126 N THR A 790 21.186 -5.787 -10.477 1.00 0.00 N ATOM 127 CA THR A 790 21.657 -6.858 -11.339 1.00 0.00 C ATOM 128 C THR A 790 21.356 -6.547 -12.803 1.00 0.00 C ATOM 129 O THR A 790 22.216 -6.056 -13.534 1.00 0.00 O ATOM 130 CB THR A 790 21.019 -8.204 -10.947 1.00 0.00 C ATOM 131 OG1 THR A 790 19.607 -8.032 -10.744 1.00 0.00 O ATOM 132 CG2 THR A 790 21.657 -8.764 -9.684 1.00 0.00 C ATOM 0 H THR A 790 20.223 -5.895 -10.158 1.00 0.00 H new ATOM 0 HA THR A 790 22.737 -6.935 -11.211 1.00 0.00 H new ATOM 0 HB THR A 790 21.188 -8.912 -11.758 1.00 0.00 H new ATOM 0 HG1 THR A 790 19.205 -8.891 -10.497 1.00 0.00 H new ATOM 0 HG21 THR A 790 21.188 -9.714 -9.430 1.00 0.00 H new ATOM 0 HG22 THR A 790 22.723 -8.919 -9.853 1.00 0.00 H new ATOM 0 HG23 THR A 790 21.518 -8.060 -8.863 1.00 0.00 H new ATOM 140 N GLY A 791 20.126 -6.815 -13.212 1.00 0.00 N ATOM 141 CA GLY A 791 19.706 -6.518 -14.566 1.00 0.00 C ATOM 142 C GLY A 791 18.542 -5.557 -14.588 1.00 0.00 C ATOM 143 O GLY A 791 17.849 -5.420 -15.596 1.00 0.00 O ATOM 0 H GLY A 791 19.406 -7.236 -12.626 1.00 0.00 H new ATOM 0 HA2 GLY A 791 20.541 -6.092 -15.121 1.00 0.00 H new ATOM 0 HA3 GLY A 791 19.425 -7.442 -15.072 1.00 0.00 H new ATOM 147 N ALA A 792 18.330 -4.893 -13.462 1.00 0.00 N ATOM 148 CA ALA A 792 17.235 -3.951 -13.300 1.00 0.00 C ATOM 149 C ALA A 792 17.486 -3.096 -12.068 1.00 0.00 C ATOM 150 O ALA A 792 18.569 -3.157 -11.486 1.00 0.00 O ATOM 151 CB ALA A 792 15.908 -4.694 -13.177 1.00 0.00 C ATOM 0 H ALA A 792 18.915 -4.993 -12.632 1.00 0.00 H new ATOM 0 HA ALA A 792 17.180 -3.306 -14.177 1.00 0.00 H new ATOM 0 HB1 ALA A 792 15.098 -3.975 -13.056 1.00 0.00 H new ATOM 0 HB2 ALA A 792 15.737 -5.285 -14.077 1.00 0.00 H new ATOM 0 HB3 ALA A 792 15.939 -5.354 -12.310 1.00 0.00 H new ATOM 157 N GLY A 793 16.499 -2.308 -11.668 1.00 0.00 N ATOM 158 CA GLY A 793 16.640 -1.505 -10.471 1.00 0.00 C ATOM 159 C GLY A 793 16.643 -2.361 -9.220 1.00 0.00 C ATOM 160 O GLY A 793 16.025 -3.427 -9.204 1.00 0.00 O ATOM 0 H GLY A 793 15.605 -2.210 -12.149 1.00 0.00 H new ATOM 0 HA2 GLY A 793 17.567 -0.933 -10.523 1.00 0.00 H new ATOM 0 HA3 GLY A 793 15.824 -0.785 -10.417 1.00 0.00 H new ATOM 164 N PRO A 794 17.340 -1.929 -8.158 1.00 0.00 N ATOM 165 CA PRO A 794 17.427 -2.674 -6.895 1.00 0.00 C ATOM 166 C PRO A 794 16.121 -2.641 -6.101 1.00 0.00 C ATOM 167 O PRO A 794 16.097 -2.294 -4.917 1.00 0.00 O ATOM 168 CB PRO A 794 18.541 -1.953 -6.117 1.00 0.00 C ATOM 169 CG PRO A 794 19.180 -1.019 -7.091 1.00 0.00 C ATOM 170 CD PRO A 794 18.124 -0.691 -8.104 1.00 0.00 C ATOM 0 HA PRO A 794 17.628 -3.731 -7.070 1.00 0.00 H new ATOM 0 HB2 PRO A 794 18.134 -1.410 -5.264 1.00 0.00 H new ATOM 0 HB3 PRO A 794 19.267 -2.665 -5.724 1.00 0.00 H new ATOM 0 HG2 PRO A 794 19.535 -0.117 -6.592 1.00 0.00 H new ATOM 0 HG3 PRO A 794 20.045 -1.482 -7.565 1.00 0.00 H new ATOM 0 HD2 PRO A 794 17.517 0.160 -7.796 1.00 0.00 H new ATOM 0 HD3 PRO A 794 18.555 -0.441 -9.073 1.00 0.00 H new ATOM 178 N ALA A 795 15.043 -3.028 -6.757 1.00 0.00 N ATOM 179 CA ALA A 795 13.732 -3.047 -6.138 1.00 0.00 C ATOM 180 C ALA A 795 13.486 -4.386 -5.457 1.00 0.00 C ATOM 181 O ALA A 795 13.021 -5.341 -6.080 1.00 0.00 O ATOM 182 CB ALA A 795 12.647 -2.757 -7.164 1.00 0.00 C ATOM 0 H ALA A 795 15.051 -3.337 -7.729 1.00 0.00 H new ATOM 0 HA ALA A 795 13.698 -2.264 -5.380 1.00 0.00 H new ATOM 0 HB1 ALA A 795 11.672 -2.776 -6.678 1.00 0.00 H new ATOM 0 HB2 ALA A 795 12.814 -1.773 -7.602 1.00 0.00 H new ATOM 0 HB3 ALA A 795 12.676 -3.513 -7.948 1.00 0.00 H new ATOM 188 N GLY A 796 13.849 -4.455 -4.186 1.00 0.00 N ATOM 189 CA GLY A 796 13.613 -5.653 -3.407 1.00 0.00 C ATOM 190 C GLY A 796 12.963 -5.332 -2.081 1.00 0.00 C ATOM 191 O GLY A 796 11.933 -5.904 -1.732 1.00 0.00 O ATOM 0 H GLY A 796 14.306 -3.698 -3.677 1.00 0.00 H new ATOM 0 HA2 GLY A 796 12.976 -6.335 -3.970 1.00 0.00 H new ATOM 0 HA3 GLY A 796 14.558 -6.168 -3.235 1.00 0.00 H new ATOM 195 N ARG A 797 13.562 -4.393 -1.358 1.00 0.00 N ATOM 196 CA ARG A 797 13.050 -3.959 -0.061 1.00 0.00 C ATOM 197 C ARG A 797 11.604 -3.486 -0.168 1.00 0.00 C ATOM 198 O ARG A 797 10.702 -4.062 0.441 1.00 0.00 O ATOM 199 CB ARG A 797 13.930 -2.833 0.485 1.00 0.00 C ATOM 200 CG ARG A 797 13.489 -2.302 1.838 1.00 0.00 C ATOM 201 CD ARG A 797 14.458 -1.255 2.348 1.00 0.00 C ATOM 202 NE ARG A 797 13.921 -0.519 3.486 1.00 0.00 N ATOM 203 CZ ARG A 797 14.042 0.795 3.632 1.00 0.00 C ATOM 204 NH1 ARG A 797 14.688 1.512 2.717 1.00 0.00 N ATOM 205 NH2 ARG A 797 13.521 1.398 4.687 1.00 0.00 N ATOM 0 H ARG A 797 14.412 -3.912 -1.651 1.00 0.00 H new ATOM 0 HA ARG A 797 13.075 -4.809 0.621 1.00 0.00 H new ATOM 0 HB2 ARG A 797 14.955 -3.194 0.565 1.00 0.00 H new ATOM 0 HB3 ARG A 797 13.936 -2.011 -0.231 1.00 0.00 H new ATOM 0 HG2 ARG A 797 12.491 -1.871 1.757 1.00 0.00 H new ATOM 0 HG3 ARG A 797 13.425 -3.123 2.552 1.00 0.00 H new ATOM 0 HD2 ARG A 797 15.392 -1.736 2.636 1.00 0.00 H new ATOM 0 HD3 ARG A 797 14.694 -0.558 1.544 1.00 0.00 H new ATOM 0 HE ARG A 797 13.426 -1.041 4.209 1.00 0.00 H new ATOM 0 HH11 ARG A 797 15.092 1.053 1.901 1.00 0.00 H new ATOM 0 HH12 ARG A 797 14.780 2.521 2.831 1.00 0.00 H new ATOM 0 HH21 ARG A 797 13.024 0.853 5.392 1.00 0.00 H new ATOM 0 HH22 ARG A 797 13.616 2.408 4.796 1.00 0.00 H new ATOM 219 N TYR A 798 11.386 -2.441 -0.953 1.00 0.00 N ATOM 220 CA TYR A 798 10.050 -1.888 -1.124 1.00 0.00 C ATOM 221 C TYR A 798 9.197 -2.783 -2.009 1.00 0.00 C ATOM 222 O TYR A 798 7.977 -2.749 -1.930 1.00 0.00 O ATOM 223 CB TYR A 798 10.113 -0.477 -1.713 1.00 0.00 C ATOM 224 CG TYR A 798 10.411 0.603 -0.692 1.00 0.00 C ATOM 225 CD1 TYR A 798 11.185 0.328 0.428 1.00 0.00 C ATOM 226 CD2 TYR A 798 9.924 1.894 -0.849 1.00 0.00 C ATOM 227 CE1 TYR A 798 11.461 1.307 1.363 1.00 0.00 C ATOM 228 CE2 TYR A 798 10.196 2.878 0.080 1.00 0.00 C ATOM 229 CZ TYR A 798 10.954 2.586 1.180 1.00 0.00 C ATOM 230 OH TYR A 798 11.237 3.558 2.109 1.00 0.00 O ATOM 0 H TYR A 798 12.115 -1.960 -1.480 1.00 0.00 H new ATOM 0 HA TYR A 798 9.588 -1.834 -0.138 1.00 0.00 H new ATOM 0 HB2 TYR A 798 10.879 -0.452 -2.488 1.00 0.00 H new ATOM 0 HB3 TYR A 798 9.162 -0.253 -2.197 1.00 0.00 H new ATOM 0 HD1 TYR A 798 11.578 -0.668 0.570 1.00 0.00 H new ATOM 0 HD2 TYR A 798 9.322 2.132 -1.713 1.00 0.00 H new ATOM 0 HE1 TYR A 798 12.066 1.079 2.228 1.00 0.00 H new ATOM 0 HE2 TYR A 798 9.811 3.877 -0.062 1.00 0.00 H new ATOM 0 HH TYR A 798 11.569 4.359 1.653 1.00 0.00 H new ATOM 240 N ASP A 799 9.843 -3.600 -2.832 1.00 0.00 N ATOM 241 CA ASP A 799 9.117 -4.493 -3.729 1.00 0.00 C ATOM 242 C ASP A 799 8.401 -5.572 -2.937 1.00 0.00 C ATOM 243 O ASP A 799 7.245 -5.876 -3.201 1.00 0.00 O ATOM 244 CB ASP A 799 10.062 -5.141 -4.741 1.00 0.00 C ATOM 245 CG ASP A 799 9.348 -6.135 -5.640 1.00 0.00 C ATOM 246 OD1 ASP A 799 8.686 -5.702 -6.607 1.00 0.00 O ATOM 247 OD2 ASP A 799 9.453 -7.353 -5.383 1.00 0.00 O ATOM 0 H ASP A 799 10.859 -3.664 -2.898 1.00 0.00 H new ATOM 0 HA ASP A 799 8.382 -3.897 -4.270 1.00 0.00 H new ATOM 0 HB2 ASP A 799 10.522 -4.366 -5.353 1.00 0.00 H new ATOM 0 HB3 ASP A 799 10.868 -5.648 -4.210 1.00 0.00 H new ATOM 252 N GLN A 800 9.086 -6.118 -1.941 1.00 0.00 N ATOM 253 CA GLN A 800 8.498 -7.124 -1.071 1.00 0.00 C ATOM 254 C GLN A 800 7.320 -6.536 -0.299 1.00 0.00 C ATOM 255 O GLN A 800 6.251 -7.140 -0.213 1.00 0.00 O ATOM 256 CB GLN A 800 9.545 -7.656 -0.091 1.00 0.00 C ATOM 257 CG GLN A 800 9.012 -8.728 0.843 1.00 0.00 C ATOM 258 CD GLN A 800 10.015 -9.144 1.900 1.00 0.00 C ATOM 259 OE1 GLN A 800 11.226 -9.097 1.683 1.00 0.00 O ATOM 260 NE2 GLN A 800 9.515 -9.557 3.054 1.00 0.00 N ATOM 0 H GLN A 800 10.052 -5.879 -1.716 1.00 0.00 H new ATOM 0 HA GLN A 800 8.140 -7.947 -1.690 1.00 0.00 H new ATOM 0 HB2 GLN A 800 10.385 -8.062 -0.654 1.00 0.00 H new ATOM 0 HB3 GLN A 800 9.930 -6.827 0.503 1.00 0.00 H new ATOM 0 HG2 GLN A 800 8.109 -8.361 1.331 1.00 0.00 H new ATOM 0 HG3 GLN A 800 8.725 -9.602 0.258 1.00 0.00 H new ATOM 0 HE21 GLN A 800 8.505 -9.581 3.193 1.00 0.00 H new ATOM 0 HE22 GLN A 800 10.140 -9.852 3.804 1.00 0.00 H new ATOM 269 N ALA A 801 7.527 -5.344 0.248 1.00 0.00 N ATOM 270 CA ALA A 801 6.504 -4.676 1.037 1.00 0.00 C ATOM 271 C ALA A 801 5.286 -4.322 0.188 1.00 0.00 C ATOM 272 O ALA A 801 4.144 -4.532 0.602 1.00 0.00 O ATOM 273 CB ALA A 801 7.078 -3.428 1.690 1.00 0.00 C ATOM 0 H ALA A 801 8.398 -4.820 0.158 1.00 0.00 H new ATOM 0 HA ALA A 801 6.175 -5.365 1.815 1.00 0.00 H new ATOM 0 HB1 ALA A 801 6.303 -2.936 2.278 1.00 0.00 H new ATOM 0 HB2 ALA A 801 7.906 -3.706 2.341 1.00 0.00 H new ATOM 0 HB3 ALA A 801 7.436 -2.746 0.919 1.00 0.00 H new ATOM 279 N THR A 802 5.528 -3.797 -1.008 1.00 0.00 N ATOM 280 CA THR A 802 4.442 -3.394 -1.888 1.00 0.00 C ATOM 281 C THR A 802 3.728 -4.595 -2.479 1.00 0.00 C ATOM 282 O THR A 802 2.512 -4.579 -2.617 1.00 0.00 O ATOM 283 CB THR A 802 4.927 -2.486 -3.029 1.00 0.00 C ATOM 284 OG1 THR A 802 6.068 -3.066 -3.675 1.00 0.00 O ATOM 285 CG2 THR A 802 5.270 -1.103 -2.506 1.00 0.00 C ATOM 0 H THR A 802 6.462 -3.642 -1.387 1.00 0.00 H new ATOM 0 HA THR A 802 3.745 -2.831 -1.267 1.00 0.00 H new ATOM 0 HB THR A 802 4.120 -2.390 -3.756 1.00 0.00 H new ATOM 0 HG1 THR A 802 6.886 -2.762 -3.229 1.00 0.00 H new ATOM 0 HG21 THR A 802 5.611 -0.477 -3.330 1.00 0.00 H new ATOM 0 HG22 THR A 802 4.385 -0.656 -2.052 1.00 0.00 H new ATOM 0 HG23 THR A 802 6.060 -1.182 -1.759 1.00 0.00 H new ATOM 293 N ASP A 803 4.481 -5.636 -2.820 1.00 0.00 N ATOM 294 CA ASP A 803 3.899 -6.839 -3.411 1.00 0.00 C ATOM 295 C ASP A 803 2.850 -7.438 -2.487 1.00 0.00 C ATOM 296 O ASP A 803 1.785 -7.860 -2.937 1.00 0.00 O ATOM 297 CB ASP A 803 4.975 -7.881 -3.712 1.00 0.00 C ATOM 298 CG ASP A 803 4.387 -9.154 -4.278 1.00 0.00 C ATOM 299 OD1 ASP A 803 4.011 -9.162 -5.470 1.00 0.00 O ATOM 300 OD2 ASP A 803 4.284 -10.149 -3.529 1.00 0.00 O ATOM 0 H ASP A 803 5.493 -5.672 -2.698 1.00 0.00 H new ATOM 0 HA ASP A 803 3.424 -6.549 -4.348 1.00 0.00 H new ATOM 0 HB2 ASP A 803 5.693 -7.467 -4.420 1.00 0.00 H new ATOM 0 HB3 ASP A 803 5.524 -8.110 -2.799 1.00 0.00 H new ATOM 305 N THR A 804 3.151 -7.460 -1.194 1.00 0.00 N ATOM 306 CA THR A 804 2.201 -7.938 -0.203 1.00 0.00 C ATOM 307 C THR A 804 0.909 -7.121 -0.269 1.00 0.00 C ATOM 308 O THR A 804 -0.179 -7.674 -0.409 1.00 0.00 O ATOM 309 CB THR A 804 2.799 -7.863 1.217 1.00 0.00 C ATOM 310 OG1 THR A 804 4.061 -8.551 1.251 1.00 0.00 O ATOM 311 CG2 THR A 804 1.857 -8.482 2.240 1.00 0.00 C ATOM 0 H THR A 804 4.045 -7.152 -0.810 1.00 0.00 H new ATOM 0 HA THR A 804 1.976 -8.981 -0.427 1.00 0.00 H new ATOM 0 HB THR A 804 2.944 -6.813 1.470 1.00 0.00 H new ATOM 0 HG1 THR A 804 4.747 -7.998 0.822 1.00 0.00 H new ATOM 0 HG21 THR A 804 2.303 -8.416 3.232 1.00 0.00 H new ATOM 0 HG22 THR A 804 0.908 -7.946 2.232 1.00 0.00 H new ATOM 0 HG23 THR A 804 1.684 -9.529 1.989 1.00 0.00 H new ATOM 319 N ILE A 805 1.049 -5.800 -0.205 1.00 0.00 N ATOM 320 CA ILE A 805 -0.092 -4.896 -0.297 1.00 0.00 C ATOM 321 C ILE A 805 -0.829 -5.084 -1.624 1.00 0.00 C ATOM 322 O ILE A 805 -2.044 -5.264 -1.647 1.00 0.00 O ATOM 323 CB ILE A 805 0.354 -3.424 -0.159 1.00 0.00 C ATOM 324 CG1 ILE A 805 0.931 -3.176 1.239 1.00 0.00 C ATOM 325 CG2 ILE A 805 -0.805 -2.475 -0.441 1.00 0.00 C ATOM 326 CD1 ILE A 805 1.476 -1.779 1.437 1.00 0.00 C ATOM 0 H ILE A 805 1.947 -5.330 -0.089 1.00 0.00 H new ATOM 0 HA ILE A 805 -0.768 -5.137 0.523 1.00 0.00 H new ATOM 0 HB ILE A 805 1.132 -3.229 -0.897 1.00 0.00 H new ATOM 0 HG12 ILE A 805 0.154 -3.361 1.980 1.00 0.00 H new ATOM 0 HG13 ILE A 805 1.728 -3.896 1.426 1.00 0.00 H new ATOM 0 HG21 ILE A 805 -0.465 -1.445 -0.337 1.00 0.00 H new ATOM 0 HG22 ILE A 805 -1.169 -2.637 -1.456 1.00 0.00 H new ATOM 0 HG23 ILE A 805 -1.611 -2.664 0.268 1.00 0.00 H new ATOM 0 HD11 ILE A 805 1.866 -1.681 2.450 1.00 0.00 H new ATOM 0 HD12 ILE A 805 2.277 -1.596 0.720 1.00 0.00 H new ATOM 0 HD13 ILE A 805 0.678 -1.052 1.284 1.00 0.00 H new ATOM 338 N LEU A 806 -0.068 -5.071 -2.714 1.00 0.00 N ATOM 339 CA LEU A 806 -0.607 -5.241 -4.061 1.00 0.00 C ATOM 340 C LEU A 806 -1.495 -6.485 -4.157 1.00 0.00 C ATOM 341 O LEU A 806 -2.543 -6.462 -4.804 1.00 0.00 O ATOM 342 CB LEU A 806 0.542 -5.337 -5.071 1.00 0.00 C ATOM 343 CG LEU A 806 0.902 -4.031 -5.797 1.00 0.00 C ATOM 344 CD1 LEU A 806 0.870 -2.840 -4.853 1.00 0.00 C ATOM 345 CD2 LEU A 806 2.276 -4.149 -6.434 1.00 0.00 C ATOM 0 H LEU A 806 0.943 -4.942 -2.689 1.00 0.00 H new ATOM 0 HA LEU A 806 -1.224 -4.372 -4.291 1.00 0.00 H new ATOM 0 HB2 LEU A 806 1.429 -5.698 -4.551 1.00 0.00 H new ATOM 0 HB3 LEU A 806 0.283 -6.087 -5.818 1.00 0.00 H new ATOM 0 HG LEU A 806 0.155 -3.865 -6.573 1.00 0.00 H new ATOM 0 HD11 LEU A 806 1.130 -1.934 -5.401 1.00 0.00 H new ATOM 0 HD12 LEU A 806 -0.130 -2.736 -4.433 1.00 0.00 H new ATOM 0 HD13 LEU A 806 1.588 -2.995 -4.047 1.00 0.00 H new ATOM 0 HD21 LEU A 806 2.521 -3.218 -6.946 1.00 0.00 H new ATOM 0 HD22 LEU A 806 3.020 -4.345 -5.661 1.00 0.00 H new ATOM 0 HD23 LEU A 806 2.275 -4.969 -7.153 1.00 0.00 H new ATOM 357 N THR A 807 -1.074 -7.565 -3.500 1.00 0.00 N ATOM 358 CA THR A 807 -1.836 -8.808 -3.501 1.00 0.00 C ATOM 359 C THR A 807 -3.061 -8.711 -2.590 1.00 0.00 C ATOM 360 O THR A 807 -4.157 -9.142 -2.961 1.00 0.00 O ATOM 361 CB THR A 807 -0.964 -9.998 -3.047 1.00 0.00 C ATOM 362 OG1 THR A 807 0.232 -10.058 -3.834 1.00 0.00 O ATOM 363 CG2 THR A 807 -1.721 -11.313 -3.180 1.00 0.00 C ATOM 0 H THR A 807 -0.209 -7.602 -2.961 1.00 0.00 H new ATOM 0 HA THR A 807 -2.166 -8.975 -4.526 1.00 0.00 H new ATOM 0 HB THR A 807 -0.708 -9.847 -1.998 1.00 0.00 H new ATOM 0 HG1 THR A 807 0.827 -9.321 -3.582 1.00 0.00 H new ATOM 0 HG21 THR A 807 -1.083 -12.135 -2.853 1.00 0.00 H new ATOM 0 HG22 THR A 807 -2.617 -11.281 -2.561 1.00 0.00 H new ATOM 0 HG23 THR A 807 -2.005 -11.466 -4.221 1.00 0.00 H new ATOM 371 N VAL A 808 -2.880 -8.146 -1.400 1.00 0.00 N ATOM 372 CA VAL A 808 -3.970 -8.041 -0.438 1.00 0.00 C ATOM 373 C VAL A 808 -5.075 -7.123 -0.959 1.00 0.00 C ATOM 374 O VAL A 808 -6.255 -7.391 -0.747 1.00 0.00 O ATOM 375 CB VAL A 808 -3.479 -7.547 0.941 1.00 0.00 C ATOM 376 CG1 VAL A 808 -4.637 -7.426 1.919 1.00 0.00 C ATOM 377 CG2 VAL A 808 -2.420 -8.484 1.499 1.00 0.00 C ATOM 0 H VAL A 808 -1.993 -7.756 -1.081 1.00 0.00 H new ATOM 0 HA VAL A 808 -4.375 -9.045 -0.310 1.00 0.00 H new ATOM 0 HB VAL A 808 -3.038 -6.560 0.805 1.00 0.00 H new ATOM 0 HG11 VAL A 808 -4.265 -7.077 2.882 1.00 0.00 H new ATOM 0 HG12 VAL A 808 -5.367 -6.715 1.532 1.00 0.00 H new ATOM 0 HG13 VAL A 808 -5.110 -8.400 2.045 1.00 0.00 H new ATOM 0 HG21 VAL A 808 -2.087 -8.119 2.471 1.00 0.00 H new ATOM 0 HG22 VAL A 808 -2.841 -9.483 1.612 1.00 0.00 H new ATOM 0 HG23 VAL A 808 -1.572 -8.523 0.816 1.00 0.00 H new ATOM 387 N THR A 809 -4.691 -6.056 -1.653 1.00 0.00 N ATOM 388 CA THR A 809 -5.654 -5.146 -2.265 1.00 0.00 C ATOM 389 C THR A 809 -6.606 -5.890 -3.198 1.00 0.00 C ATOM 390 O THR A 809 -7.828 -5.779 -3.073 1.00 0.00 O ATOM 391 CB THR A 809 -4.945 -4.040 -3.062 1.00 0.00 C ATOM 392 OG1 THR A 809 -4.088 -3.286 -2.202 1.00 0.00 O ATOM 393 CG2 THR A 809 -5.967 -3.123 -3.712 1.00 0.00 C ATOM 0 H THR A 809 -3.716 -5.799 -1.806 1.00 0.00 H new ATOM 0 HA THR A 809 -6.224 -4.698 -1.451 1.00 0.00 H new ATOM 0 HB THR A 809 -4.342 -4.504 -3.843 1.00 0.00 H new ATOM 0 HG1 THR A 809 -3.331 -3.843 -1.925 1.00 0.00 H new ATOM 0 HG21 THR A 809 -5.452 -2.344 -4.274 1.00 0.00 H new ATOM 0 HG22 THR A 809 -6.597 -3.701 -4.388 1.00 0.00 H new ATOM 0 HG23 THR A 809 -6.587 -2.665 -2.941 1.00 0.00 H new ATOM 401 N GLU A 810 -6.037 -6.660 -4.119 1.00 0.00 N ATOM 402 CA GLU A 810 -6.823 -7.447 -5.064 1.00 0.00 C ATOM 403 C GLU A 810 -7.737 -8.416 -4.324 1.00 0.00 C ATOM 404 O GLU A 810 -8.798 -8.802 -4.821 1.00 0.00 O ATOM 405 CB GLU A 810 -5.897 -8.212 -6.009 1.00 0.00 C ATOM 406 CG GLU A 810 -5.081 -7.309 -6.920 1.00 0.00 C ATOM 407 CD GLU A 810 -5.936 -6.585 -7.939 1.00 0.00 C ATOM 408 OE1 GLU A 810 -6.598 -5.593 -7.561 1.00 0.00 O ATOM 409 OE2 GLU A 810 -5.945 -6.992 -9.119 1.00 0.00 O ATOM 0 H GLU A 810 -5.028 -6.757 -4.232 1.00 0.00 H new ATOM 0 HA GLU A 810 -7.442 -6.768 -5.650 1.00 0.00 H new ATOM 0 HB2 GLU A 810 -5.219 -8.829 -5.420 1.00 0.00 H new ATOM 0 HB3 GLU A 810 -6.494 -8.889 -6.621 1.00 0.00 H new ATOM 0 HG2 GLU A 810 -4.545 -6.577 -6.315 1.00 0.00 H new ATOM 0 HG3 GLU A 810 -4.330 -7.905 -7.439 1.00 0.00 H new ATOM 416 N ASN A 811 -7.328 -8.785 -3.118 1.00 0.00 N ATOM 417 CA ASN A 811 -8.088 -9.717 -2.306 1.00 0.00 C ATOM 418 C ASN A 811 -9.400 -9.112 -1.826 1.00 0.00 C ATOM 419 O ASN A 811 -10.361 -9.839 -1.585 1.00 0.00 O ATOM 420 CB ASN A 811 -7.263 -10.209 -1.117 1.00 0.00 C ATOM 421 CG ASN A 811 -6.613 -11.551 -1.380 1.00 0.00 C ATOM 422 OD1 ASN A 811 -7.180 -12.595 -1.061 1.00 0.00 O ATOM 423 ND2 ASN A 811 -5.426 -11.538 -1.966 1.00 0.00 N ATOM 0 H ASN A 811 -6.469 -8.450 -2.681 1.00 0.00 H new ATOM 0 HA ASN A 811 -8.328 -10.570 -2.940 1.00 0.00 H new ATOM 0 HB2 ASN A 811 -6.492 -9.474 -0.885 1.00 0.00 H new ATOM 0 HB3 ASN A 811 -7.905 -10.285 -0.240 1.00 0.00 H new ATOM 0 HD21 ASN A 811 -4.948 -12.416 -2.169 1.00 0.00 H new ATOM 0 HD22 ASN A 811 -4.990 -10.650 -2.215 1.00 0.00 H new ATOM 430 N ILE A 812 -9.453 -7.789 -1.696 1.00 0.00 N ATOM 431 CA ILE A 812 -10.706 -7.122 -1.347 1.00 0.00 C ATOM 432 C ILE A 812 -11.727 -7.341 -2.457 1.00 0.00 C ATOM 433 O ILE A 812 -12.893 -7.627 -2.200 1.00 0.00 O ATOM 434 CB ILE A 812 -10.536 -5.597 -1.095 1.00 0.00 C ATOM 435 CG1 ILE A 812 -9.861 -5.328 0.251 1.00 0.00 C ATOM 436 CG2 ILE A 812 -11.878 -4.880 -1.150 1.00 0.00 C ATOM 437 CD1 ILE A 812 -8.361 -5.474 0.228 1.00 0.00 C ATOM 0 H ILE A 812 -8.657 -7.165 -1.825 1.00 0.00 H new ATOM 0 HA ILE A 812 -11.050 -7.564 -0.412 1.00 0.00 H new ATOM 0 HB ILE A 812 -9.897 -5.209 -1.888 1.00 0.00 H new ATOM 0 HG12 ILE A 812 -10.112 -4.318 0.576 1.00 0.00 H new ATOM 0 HG13 ILE A 812 -10.270 -6.013 0.994 1.00 0.00 H new ATOM 0 HG21 ILE A 812 -11.729 -3.815 -0.970 1.00 0.00 H new ATOM 0 HG22 ILE A 812 -12.327 -5.023 -2.133 1.00 0.00 H new ATOM 0 HG23 ILE A 812 -12.540 -5.288 -0.386 1.00 0.00 H new ATOM 0 HD11 ILE A 812 -7.960 -5.267 1.220 1.00 0.00 H new ATOM 0 HD12 ILE A 812 -8.099 -6.491 -0.064 1.00 0.00 H new ATOM 0 HD13 ILE A 812 -7.938 -4.770 -0.489 1.00 0.00 H new ATOM 449 N PHE A 813 -11.264 -7.240 -3.694 1.00 0.00 N ATOM 450 CA PHE A 813 -12.124 -7.428 -4.853 1.00 0.00 C ATOM 451 C PHE A 813 -12.533 -8.890 -5.001 1.00 0.00 C ATOM 452 O PHE A 813 -13.594 -9.200 -5.541 1.00 0.00 O ATOM 453 CB PHE A 813 -11.427 -6.928 -6.114 1.00 0.00 C ATOM 454 CG PHE A 813 -11.263 -5.436 -6.131 1.00 0.00 C ATOM 455 CD1 PHE A 813 -12.295 -4.615 -6.555 1.00 0.00 C ATOM 456 CD2 PHE A 813 -10.068 -4.856 -5.737 1.00 0.00 C ATOM 457 CE1 PHE A 813 -12.138 -3.243 -6.584 1.00 0.00 C ATOM 458 CE2 PHE A 813 -9.905 -3.485 -5.762 1.00 0.00 C ATOM 459 CZ PHE A 813 -10.982 -2.673 -6.139 1.00 0.00 C ATOM 0 H PHE A 813 -10.293 -7.028 -3.922 1.00 0.00 H new ATOM 0 HA PHE A 813 -13.032 -6.844 -4.704 1.00 0.00 H new ATOM 0 HB2 PHE A 813 -10.447 -7.398 -6.193 1.00 0.00 H new ATOM 0 HB3 PHE A 813 -12.000 -7.237 -6.988 1.00 0.00 H new ATOM 0 HD1 PHE A 813 -13.232 -5.052 -6.866 1.00 0.00 H new ATOM 0 HD2 PHE A 813 -9.254 -5.484 -5.406 1.00 0.00 H new ATOM 0 HE1 PHE A 813 -12.935 -2.619 -6.961 1.00 0.00 H new ATOM 0 HE2 PHE A 813 -8.957 -3.043 -5.494 1.00 0.00 H new ATOM 0 HZ PHE A 813 -10.897 -1.598 -6.077 1.00 0.00 H new ATOM 469 N SER A 814 -11.692 -9.786 -4.510 1.00 0.00 N ATOM 470 CA SER A 814 -11.983 -11.210 -4.557 1.00 0.00 C ATOM 471 C SER A 814 -12.983 -11.601 -3.463 1.00 0.00 C ATOM 472 O SER A 814 -13.825 -12.478 -3.661 1.00 0.00 O ATOM 473 CB SER A 814 -10.684 -12.012 -4.407 1.00 0.00 C ATOM 474 OG SER A 814 -10.915 -13.403 -4.548 1.00 0.00 O ATOM 0 H SER A 814 -10.800 -9.552 -4.073 1.00 0.00 H new ATOM 0 HA SER A 814 -12.434 -11.440 -5.522 1.00 0.00 H new ATOM 0 HB2 SER A 814 -9.964 -11.684 -5.156 1.00 0.00 H new ATOM 0 HB3 SER A 814 -10.242 -11.812 -3.431 1.00 0.00 H new ATOM 0 HG SER A 814 -10.069 -13.887 -4.449 1.00 0.00 H new ATOM 480 N SER A 815 -12.890 -10.941 -2.312 1.00 0.00 N ATOM 481 CA SER A 815 -13.734 -11.266 -1.166 1.00 0.00 C ATOM 482 C SER A 815 -15.100 -10.585 -1.243 1.00 0.00 C ATOM 483 O SER A 815 -15.955 -10.810 -0.383 1.00 0.00 O ATOM 484 CB SER A 815 -13.019 -10.887 0.134 1.00 0.00 C ATOM 485 OG SER A 815 -12.475 -9.582 0.058 1.00 0.00 O ATOM 0 H SER A 815 -12.236 -10.175 -2.148 1.00 0.00 H new ATOM 0 HA SER A 815 -13.912 -12.341 -1.182 1.00 0.00 H new ATOM 0 HB2 SER A 815 -13.720 -10.944 0.967 1.00 0.00 H new ATOM 0 HB3 SER A 815 -12.224 -11.604 0.337 1.00 0.00 H new ATOM 0 HG SER A 815 -11.599 -9.618 -0.379 1.00 0.00 H new ATOM 491 N MET A 816 -15.295 -9.754 -2.269 1.00 0.00 N ATOM 492 CA MET A 816 -16.543 -9.012 -2.447 1.00 0.00 C ATOM 493 C MET A 816 -17.753 -9.929 -2.347 1.00 0.00 C ATOM 494 O MET A 816 -17.922 -10.847 -3.151 1.00 0.00 O ATOM 495 CB MET A 816 -16.546 -8.285 -3.786 1.00 0.00 C ATOM 496 CG MET A 816 -15.487 -7.208 -3.878 1.00 0.00 C ATOM 497 SD MET A 816 -15.599 -6.248 -5.396 1.00 0.00 S ATOM 498 CE MET A 816 -17.218 -5.526 -5.167 1.00 0.00 C ATOM 0 H MET A 816 -14.599 -9.578 -2.993 1.00 0.00 H new ATOM 0 HA MET A 816 -16.608 -8.277 -1.644 1.00 0.00 H new ATOM 0 HB2 MET A 816 -16.390 -9.009 -4.586 1.00 0.00 H new ATOM 0 HB3 MET A 816 -17.527 -7.837 -3.947 1.00 0.00 H new ATOM 0 HG2 MET A 816 -15.580 -6.539 -3.023 1.00 0.00 H new ATOM 0 HG3 MET A 816 -14.501 -7.668 -3.816 1.00 0.00 H new ATOM 0 HE1 MET A 816 -17.210 -4.495 -5.520 1.00 0.00 H new ATOM 0 HE2 MET A 816 -17.954 -6.097 -5.732 1.00 0.00 H new ATOM 0 HE3 MET A 816 -17.479 -5.545 -4.109 1.00 0.00 H new ATOM 508 N GLY A 817 -18.575 -9.683 -1.343 1.00 0.00 N ATOM 509 CA GLY A 817 -19.719 -10.527 -1.094 1.00 0.00 C ATOM 510 C GLY A 817 -19.817 -10.901 0.367 1.00 0.00 C ATOM 511 O GLY A 817 -20.908 -10.932 0.940 1.00 0.00 O ATOM 0 H GLY A 817 -18.468 -8.906 -0.691 1.00 0.00 H new ATOM 0 HA2 GLY A 817 -20.628 -10.011 -1.401 1.00 0.00 H new ATOM 0 HA3 GLY A 817 -19.646 -11.431 -1.699 1.00 0.00 H new ATOM 515 N ASP A 818 -18.673 -11.175 0.977 1.00 0.00 N ATOM 516 CA ASP A 818 -18.630 -11.509 2.394 1.00 0.00 C ATOM 517 C ASP A 818 -18.115 -10.323 3.191 1.00 0.00 C ATOM 518 O ASP A 818 -17.013 -9.828 2.948 1.00 0.00 O ATOM 519 CB ASP A 818 -17.749 -12.730 2.651 1.00 0.00 C ATOM 520 CG ASP A 818 -17.790 -13.158 4.105 1.00 0.00 C ATOM 521 OD1 ASP A 818 -18.663 -13.973 4.463 1.00 0.00 O ATOM 522 OD2 ASP A 818 -16.960 -12.676 4.900 1.00 0.00 O ATOM 0 H ASP A 818 -17.764 -11.173 0.515 1.00 0.00 H new ATOM 0 HA ASP A 818 -19.644 -11.750 2.714 1.00 0.00 H new ATOM 0 HB2 ASP A 818 -18.078 -13.555 2.020 1.00 0.00 H new ATOM 0 HB3 ASP A 818 -16.721 -12.503 2.368 1.00 0.00 H new ATOM 527 N ALA A 819 -18.913 -9.880 4.149 1.00 0.00 N ATOM 528 CA ALA A 819 -18.610 -8.679 4.909 1.00 0.00 C ATOM 529 C ALA A 819 -17.338 -8.834 5.741 1.00 0.00 C ATOM 530 O ALA A 819 -16.409 -8.033 5.620 1.00 0.00 O ATOM 531 CB ALA A 819 -19.793 -8.317 5.791 1.00 0.00 C ATOM 0 H ALA A 819 -19.783 -10.339 4.420 1.00 0.00 H new ATOM 0 HA ALA A 819 -18.429 -7.869 4.202 1.00 0.00 H new ATOM 0 HB1 ALA A 819 -19.561 -7.416 6.359 1.00 0.00 H new ATOM 0 HB2 ALA A 819 -20.670 -8.138 5.168 1.00 0.00 H new ATOM 0 HB3 ALA A 819 -19.998 -9.137 6.479 1.00 0.00 H new ATOM 537 N GLY A 820 -17.291 -9.866 6.570 1.00 0.00 N ATOM 538 CA GLY A 820 -16.146 -10.073 7.435 1.00 0.00 C ATOM 539 C GLY A 820 -14.854 -10.288 6.669 1.00 0.00 C ATOM 540 O GLY A 820 -13.776 -9.904 7.133 1.00 0.00 O ATOM 0 H GLY A 820 -18.027 -10.566 6.660 1.00 0.00 H new ATOM 0 HA2 GLY A 820 -16.033 -9.210 8.091 1.00 0.00 H new ATOM 0 HA3 GLY A 820 -16.331 -10.937 8.073 1.00 0.00 H new ATOM 544 N GLU A 821 -14.951 -10.899 5.499 1.00 0.00 N ATOM 545 CA GLU A 821 -13.774 -11.195 4.695 1.00 0.00 C ATOM 546 C GLU A 821 -13.160 -9.917 4.130 1.00 0.00 C ATOM 547 O GLU A 821 -11.949 -9.703 4.231 1.00 0.00 O ATOM 548 CB GLU A 821 -14.131 -12.145 3.555 1.00 0.00 C ATOM 549 CG GLU A 821 -12.981 -13.042 3.147 1.00 0.00 C ATOM 550 CD GLU A 821 -12.589 -13.991 4.258 1.00 0.00 C ATOM 551 OE1 GLU A 821 -11.809 -13.584 5.141 1.00 0.00 O ATOM 552 OE2 GLU A 821 -13.042 -15.154 4.249 1.00 0.00 O ATOM 0 H GLU A 821 -15.833 -11.200 5.084 1.00 0.00 H new ATOM 0 HA GLU A 821 -13.040 -11.675 5.343 1.00 0.00 H new ATOM 0 HB2 GLU A 821 -14.977 -12.763 3.856 1.00 0.00 H new ATOM 0 HB3 GLU A 821 -14.453 -11.562 2.692 1.00 0.00 H new ATOM 0 HG2 GLU A 821 -13.262 -13.614 2.262 1.00 0.00 H new ATOM 0 HG3 GLU A 821 -12.122 -12.430 2.872 1.00 0.00 H new ATOM 559 N MET A 822 -14.001 -9.068 3.553 1.00 0.00 N ATOM 560 CA MET A 822 -13.539 -7.827 2.936 1.00 0.00 C ATOM 561 C MET A 822 -12.886 -6.914 3.968 1.00 0.00 C ATOM 562 O MET A 822 -11.853 -6.295 3.705 1.00 0.00 O ATOM 563 CB MET A 822 -14.705 -7.103 2.257 1.00 0.00 C ATOM 564 CG MET A 822 -15.333 -7.895 1.123 1.00 0.00 C ATOM 565 SD MET A 822 -16.793 -7.093 0.428 1.00 0.00 S ATOM 566 CE MET A 822 -16.090 -5.546 -0.129 1.00 0.00 C ATOM 0 H MET A 822 -15.009 -9.215 3.498 1.00 0.00 H new ATOM 0 HA MET A 822 -12.793 -8.082 2.183 1.00 0.00 H new ATOM 0 HB2 MET A 822 -15.469 -6.883 3.003 1.00 0.00 H new ATOM 0 HB3 MET A 822 -14.353 -6.147 1.870 1.00 0.00 H new ATOM 0 HG2 MET A 822 -14.594 -8.039 0.335 1.00 0.00 H new ATOM 0 HG3 MET A 822 -15.608 -8.885 1.487 1.00 0.00 H new ATOM 0 HE1 MET A 822 -16.770 -5.071 -0.837 1.00 0.00 H new ATOM 0 HE2 MET A 822 -15.938 -4.887 0.726 1.00 0.00 H new ATOM 0 HE3 MET A 822 -15.133 -5.735 -0.616 1.00 0.00 H new ATOM 576 N VAL A 823 -13.485 -6.851 5.153 1.00 0.00 N ATOM 577 CA VAL A 823 -12.954 -6.029 6.234 1.00 0.00 C ATOM 578 C VAL A 823 -11.601 -6.565 6.709 1.00 0.00 C ATOM 579 O VAL A 823 -10.703 -5.791 7.047 1.00 0.00 O ATOM 580 CB VAL A 823 -13.942 -5.951 7.420 1.00 0.00 C ATOM 581 CG1 VAL A 823 -13.360 -5.139 8.567 1.00 0.00 C ATOM 582 CG2 VAL A 823 -15.264 -5.348 6.963 1.00 0.00 C ATOM 0 H VAL A 823 -14.338 -7.359 5.389 1.00 0.00 H new ATOM 0 HA VAL A 823 -12.814 -5.022 5.842 1.00 0.00 H new ATOM 0 HB VAL A 823 -14.119 -6.964 7.781 1.00 0.00 H new ATOM 0 HG11 VAL A 823 -14.077 -5.101 9.387 1.00 0.00 H new ATOM 0 HG12 VAL A 823 -12.438 -5.606 8.913 1.00 0.00 H new ATOM 0 HG13 VAL A 823 -13.147 -4.126 8.225 1.00 0.00 H new ATOM 0 HG21 VAL A 823 -15.952 -5.298 7.807 1.00 0.00 H new ATOM 0 HG22 VAL A 823 -15.091 -4.344 6.576 1.00 0.00 H new ATOM 0 HG23 VAL A 823 -15.696 -5.970 6.179 1.00 0.00 H new ATOM 592 N ARG A 824 -11.453 -7.892 6.707 1.00 0.00 N ATOM 593 CA ARG A 824 -10.189 -8.523 7.083 1.00 0.00 C ATOM 594 C ARG A 824 -9.053 -8.010 6.208 1.00 0.00 C ATOM 595 O ARG A 824 -8.014 -7.578 6.705 1.00 0.00 O ATOM 596 CB ARG A 824 -10.265 -10.046 6.939 1.00 0.00 C ATOM 597 CG ARG A 824 -8.954 -10.739 7.280 1.00 0.00 C ATOM 598 CD ARG A 824 -8.832 -12.103 6.619 1.00 0.00 C ATOM 599 NE ARG A 824 -9.883 -13.024 7.035 1.00 0.00 N ATOM 600 CZ ARG A 824 -9.724 -13.968 7.960 1.00 0.00 C ATOM 601 NH1 ARG A 824 -8.559 -14.103 8.588 1.00 0.00 N ATOM 602 NH2 ARG A 824 -10.732 -14.777 8.257 1.00 0.00 N ATOM 0 H ARG A 824 -12.191 -8.547 6.450 1.00 0.00 H new ATOM 0 HA ARG A 824 -9.999 -8.269 8.126 1.00 0.00 H new ATOM 0 HB2 ARG A 824 -11.052 -10.429 7.589 1.00 0.00 H new ATOM 0 HB3 ARG A 824 -10.547 -10.296 5.916 1.00 0.00 H new ATOM 0 HG2 ARG A 824 -8.121 -10.110 6.966 1.00 0.00 H new ATOM 0 HG3 ARG A 824 -8.877 -10.854 8.361 1.00 0.00 H new ATOM 0 HD2 ARG A 824 -8.867 -11.982 5.536 1.00 0.00 H new ATOM 0 HD3 ARG A 824 -7.860 -12.534 6.860 1.00 0.00 H new ATOM 0 HE ARG A 824 -10.797 -12.940 6.590 1.00 0.00 H new ATOM 0 HH11 ARG A 824 -7.783 -13.482 8.362 1.00 0.00 H new ATOM 0 HH12 ARG A 824 -8.442 -14.828 9.296 1.00 0.00 H new ATOM 0 HH21 ARG A 824 -11.626 -14.675 7.777 1.00 0.00 H new ATOM 0 HH22 ARG A 824 -10.613 -15.501 8.965 1.00 0.00 H new ATOM 616 N GLN A 825 -9.269 -8.055 4.900 1.00 0.00 N ATOM 617 CA GLN A 825 -8.245 -7.678 3.938 1.00 0.00 C ATOM 618 C GLN A 825 -7.857 -6.209 4.098 1.00 0.00 C ATOM 619 O GLN A 825 -6.680 -5.857 3.999 1.00 0.00 O ATOM 620 CB GLN A 825 -8.733 -7.949 2.514 1.00 0.00 C ATOM 621 CG GLN A 825 -9.178 -9.387 2.286 1.00 0.00 C ATOM 622 CD GLN A 825 -8.074 -10.399 2.532 1.00 0.00 C ATOM 623 OE1 GLN A 825 -6.837 -10.021 2.241 1.00 0.00 O flip ATOM 624 NE2 GLN A 825 -8.333 -11.519 2.966 1.00 0.00 N flip ATOM 0 H GLN A 825 -10.150 -8.351 4.480 1.00 0.00 H new ATOM 0 HA GLN A 825 -7.359 -8.283 4.128 1.00 0.00 H new ATOM 0 HB2 GLN A 825 -9.564 -7.280 2.290 1.00 0.00 H new ATOM 0 HB3 GLN A 825 -7.933 -7.709 1.813 1.00 0.00 H new ATOM 0 HG2 GLN A 825 -10.019 -9.609 2.943 1.00 0.00 H new ATOM 0 HG3 GLN A 825 -9.537 -9.492 1.262 1.00 0.00 H new ATOM 0 HE21 GLN A 825 -9.298 -11.773 3.178 1.00 0.00 H new ATOM 0 HE22 GLN A 825 -7.583 -12.195 3.114 1.00 0.00 H new ATOM 633 N ALA A 826 -8.846 -5.361 4.356 1.00 0.00 N ATOM 634 CA ALA A 826 -8.596 -3.944 4.599 1.00 0.00 C ATOM 635 C ALA A 826 -7.714 -3.746 5.833 1.00 0.00 C ATOM 636 O ALA A 826 -6.840 -2.878 5.849 1.00 0.00 O ATOM 637 CB ALA A 826 -9.911 -3.197 4.762 1.00 0.00 C ATOM 0 H ALA A 826 -9.829 -5.630 4.402 1.00 0.00 H new ATOM 0 HA ALA A 826 -8.066 -3.540 3.737 1.00 0.00 H new ATOM 0 HB1 ALA A 826 -9.710 -2.141 4.943 1.00 0.00 H new ATOM 0 HB2 ALA A 826 -10.505 -3.303 3.854 1.00 0.00 H new ATOM 0 HB3 ALA A 826 -10.462 -3.611 5.606 1.00 0.00 H new ATOM 643 N ARG A 827 -7.942 -4.564 6.856 1.00 0.00 N ATOM 644 CA ARG A 827 -7.151 -4.502 8.082 1.00 0.00 C ATOM 645 C ARG A 827 -5.701 -4.885 7.814 1.00 0.00 C ATOM 646 O ARG A 827 -4.779 -4.258 8.338 1.00 0.00 O ATOM 647 CB ARG A 827 -7.732 -5.431 9.144 1.00 0.00 C ATOM 648 CG ARG A 827 -9.065 -4.968 9.702 1.00 0.00 C ATOM 649 CD ARG A 827 -9.584 -5.936 10.749 1.00 0.00 C ATOM 650 NE ARG A 827 -8.614 -6.153 11.822 1.00 0.00 N ATOM 651 CZ ARG A 827 -8.877 -6.833 12.937 1.00 0.00 C ATOM 652 NH1 ARG A 827 -10.086 -7.344 13.143 1.00 0.00 N ATOM 653 NH2 ARG A 827 -7.932 -7.003 13.852 1.00 0.00 N ATOM 0 H ARG A 827 -8.669 -5.279 6.861 1.00 0.00 H new ATOM 0 HA ARG A 827 -7.184 -3.475 8.445 1.00 0.00 H new ATOM 0 HB2 ARG A 827 -7.854 -6.426 8.715 1.00 0.00 H new ATOM 0 HB3 ARG A 827 -7.018 -5.522 9.963 1.00 0.00 H new ATOM 0 HG2 ARG A 827 -8.954 -3.977 10.142 1.00 0.00 H new ATOM 0 HG3 ARG A 827 -9.790 -4.879 8.893 1.00 0.00 H new ATOM 0 HD2 ARG A 827 -10.512 -5.550 11.171 1.00 0.00 H new ATOM 0 HD3 ARG A 827 -9.821 -6.889 10.276 1.00 0.00 H new ATOM 0 HE ARG A 827 -7.680 -5.760 11.710 1.00 0.00 H new ATOM 0 HH11 ARG A 827 -10.819 -7.217 12.445 1.00 0.00 H new ATOM 0 HH12 ARG A 827 -10.281 -7.864 13.999 1.00 0.00 H new ATOM 0 HH21 ARG A 827 -7.002 -6.613 13.703 1.00 0.00 H new ATOM 0 HH22 ARG A 827 -8.136 -7.524 14.705 1.00 0.00 H new ATOM 667 N ILE A 828 -5.511 -5.916 6.999 1.00 0.00 N ATOM 668 CA ILE A 828 -4.173 -6.364 6.633 1.00 0.00 C ATOM 669 C ILE A 828 -3.413 -5.242 5.932 1.00 0.00 C ATOM 670 O ILE A 828 -2.236 -5.003 6.210 1.00 0.00 O ATOM 671 CB ILE A 828 -4.226 -7.606 5.716 1.00 0.00 C ATOM 672 CG1 ILE A 828 -5.024 -8.728 6.389 1.00 0.00 C ATOM 673 CG2 ILE A 828 -2.818 -8.081 5.377 1.00 0.00 C ATOM 674 CD1 ILE A 828 -5.231 -9.945 5.511 1.00 0.00 C ATOM 0 H ILE A 828 -6.267 -6.457 6.579 1.00 0.00 H new ATOM 0 HA ILE A 828 -3.653 -6.637 7.551 1.00 0.00 H new ATOM 0 HB ILE A 828 -4.727 -7.331 4.788 1.00 0.00 H new ATOM 0 HG12 ILE A 828 -4.508 -9.032 7.299 1.00 0.00 H new ATOM 0 HG13 ILE A 828 -5.997 -8.339 6.689 1.00 0.00 H new ATOM 0 HG21 ILE A 828 -2.875 -8.957 4.730 1.00 0.00 H new ATOM 0 HG22 ILE A 828 -2.279 -7.285 4.863 1.00 0.00 H new ATOM 0 HG23 ILE A 828 -2.291 -8.342 6.295 1.00 0.00 H new ATOM 0 HD11 ILE A 828 -5.804 -10.695 6.057 1.00 0.00 H new ATOM 0 HD12 ILE A 828 -5.775 -9.657 4.612 1.00 0.00 H new ATOM 0 HD13 ILE A 828 -4.263 -10.361 5.231 1.00 0.00 H new ATOM 686 N LEU A 829 -4.105 -4.540 5.042 1.00 0.00 N ATOM 687 CA LEU A 829 -3.518 -3.408 4.334 1.00 0.00 C ATOM 688 C LEU A 829 -3.154 -2.290 5.300 1.00 0.00 C ATOM 689 O LEU A 829 -2.070 -1.723 5.215 1.00 0.00 O ATOM 690 CB LEU A 829 -4.482 -2.881 3.276 1.00 0.00 C ATOM 691 CG LEU A 829 -4.722 -3.819 2.098 1.00 0.00 C ATOM 692 CD1 LEU A 829 -5.771 -3.238 1.172 1.00 0.00 C ATOM 693 CD2 LEU A 829 -3.426 -4.064 1.343 1.00 0.00 C ATOM 0 H LEU A 829 -5.075 -4.735 4.793 1.00 0.00 H new ATOM 0 HA LEU A 829 -2.608 -3.756 3.846 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -5.439 -2.668 3.752 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -4.098 -1.935 2.895 1.00 0.00 H new ATOM 0 HG LEU A 829 -5.084 -4.773 2.480 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -5.934 -3.917 0.335 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -6.705 -3.105 1.718 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -5.430 -2.273 0.796 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -3.614 -4.735 0.505 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -3.038 -3.117 0.969 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -2.695 -4.516 2.013 1.00 0.00 H new ATOM 705 N ALA A 830 -4.056 -1.989 6.228 1.00 0.00 N ATOM 706 CA ALA A 830 -3.827 -0.933 7.209 1.00 0.00 C ATOM 707 C ALA A 830 -2.543 -1.181 7.997 1.00 0.00 C ATOM 708 O ALA A 830 -1.846 -0.242 8.381 1.00 0.00 O ATOM 709 CB ALA A 830 -5.016 -0.821 8.151 1.00 0.00 C ATOM 0 H ALA A 830 -4.955 -2.462 6.322 1.00 0.00 H new ATOM 0 HA ALA A 830 -3.714 0.009 6.672 1.00 0.00 H new ATOM 0 HB1 ALA A 830 -4.831 -0.030 8.877 1.00 0.00 H new ATOM 0 HB2 ALA A 830 -5.913 -0.586 7.578 1.00 0.00 H new ATOM 0 HB3 ALA A 830 -5.157 -1.767 8.673 1.00 0.00 H new ATOM 715 N GLN A 831 -2.243 -2.449 8.241 1.00 0.00 N ATOM 716 CA GLN A 831 -1.028 -2.825 8.948 1.00 0.00 C ATOM 717 C GLN A 831 0.180 -2.790 8.011 1.00 0.00 C ATOM 718 O GLN A 831 1.216 -2.207 8.337 1.00 0.00 O ATOM 719 CB GLN A 831 -1.183 -4.220 9.554 1.00 0.00 C ATOM 720 CG GLN A 831 0.020 -4.670 10.363 1.00 0.00 C ATOM 721 CD GLN A 831 -0.127 -6.083 10.885 1.00 0.00 C ATOM 722 OE1 GLN A 831 -1.237 -6.549 11.148 1.00 0.00 O ATOM 723 NE2 GLN A 831 0.990 -6.775 11.035 1.00 0.00 N ATOM 0 H GLN A 831 -2.827 -3.236 7.959 1.00 0.00 H new ATOM 0 HA GLN A 831 -0.861 -2.105 9.749 1.00 0.00 H new ATOM 0 HB2 GLN A 831 -2.065 -4.233 10.194 1.00 0.00 H new ATOM 0 HB3 GLN A 831 -1.360 -4.937 8.753 1.00 0.00 H new ATOM 0 HG2 GLN A 831 0.915 -4.606 9.743 1.00 0.00 H new ATOM 0 HG3 GLN A 831 0.164 -3.989 11.202 1.00 0.00 H new ATOM 0 HE21 GLN A 831 1.888 -6.350 10.805 1.00 0.00 H new ATOM 0 HE22 GLN A 831 0.953 -7.734 11.381 1.00 0.00 H new ATOM 732 N ALA A 832 0.032 -3.408 6.843 1.00 0.00 N ATOM 733 CA ALA A 832 1.119 -3.503 5.872 1.00 0.00 C ATOM 734 C ALA A 832 1.547 -2.129 5.376 1.00 0.00 C ATOM 735 O ALA A 832 2.741 -1.816 5.342 1.00 0.00 O ATOM 736 CB ALA A 832 0.703 -4.377 4.702 1.00 0.00 C ATOM 0 H ALA A 832 -0.836 -3.853 6.544 1.00 0.00 H new ATOM 0 HA ALA A 832 1.974 -3.958 6.373 1.00 0.00 H new ATOM 0 HB1 ALA A 832 1.522 -4.440 3.985 1.00 0.00 H new ATOM 0 HB2 ALA A 832 0.459 -5.376 5.063 1.00 0.00 H new ATOM 0 HB3 ALA A 832 -0.171 -3.943 4.217 1.00 0.00 H new ATOM 742 N THR A 833 0.572 -1.313 5.000 1.00 0.00 N ATOM 743 CA THR A 833 0.840 0.034 4.532 1.00 0.00 C ATOM 744 C THR A 833 1.538 0.849 5.615 1.00 0.00 C ATOM 745 O THR A 833 2.435 1.635 5.325 1.00 0.00 O ATOM 746 CB THR A 833 -0.459 0.747 4.098 1.00 0.00 C ATOM 747 OG1 THR A 833 -1.027 0.084 2.962 1.00 0.00 O ATOM 748 CG2 THR A 833 -0.202 2.208 3.765 1.00 0.00 C ATOM 0 H THR A 833 -0.416 -1.565 5.011 1.00 0.00 H new ATOM 0 HA THR A 833 1.495 -0.044 3.665 1.00 0.00 H new ATOM 0 HB THR A 833 -1.160 0.705 4.932 1.00 0.00 H new ATOM 0 HG1 THR A 833 -1.718 0.653 2.563 1.00 0.00 H new ATOM 0 HG21 THR A 833 -1.136 2.682 3.463 1.00 0.00 H new ATOM 0 HG22 THR A 833 0.196 2.717 4.643 1.00 0.00 H new ATOM 0 HG23 THR A 833 0.519 2.274 2.950 1.00 0.00 H new ATOM 756 N SER A 834 1.144 0.625 6.860 1.00 0.00 N ATOM 757 CA SER A 834 1.727 1.338 7.986 1.00 0.00 C ATOM 758 C SER A 834 3.232 1.106 8.046 1.00 0.00 C ATOM 759 O SER A 834 4.010 2.055 8.099 1.00 0.00 O ATOM 760 CB SER A 834 1.062 0.899 9.294 1.00 0.00 C ATOM 761 OG SER A 834 1.691 1.472 10.428 1.00 0.00 O ATOM 0 H SER A 834 0.421 -0.047 7.116 1.00 0.00 H new ATOM 0 HA SER A 834 1.552 2.405 7.849 1.00 0.00 H new ATOM 0 HB2 SER A 834 0.010 1.185 9.280 1.00 0.00 H new ATOM 0 HB3 SER A 834 1.096 -0.188 9.371 1.00 0.00 H new ATOM 0 HG SER A 834 1.237 1.169 11.242 1.00 0.00 H new ATOM 767 N ASP A 835 3.634 -0.160 7.994 1.00 0.00 N ATOM 768 CA ASP A 835 5.047 -0.515 8.063 1.00 0.00 C ATOM 769 C ASP A 835 5.810 0.070 6.880 1.00 0.00 C ATOM 770 O ASP A 835 6.956 0.506 7.016 1.00 0.00 O ATOM 771 CB ASP A 835 5.219 -2.033 8.098 1.00 0.00 C ATOM 772 CG ASP A 835 6.675 -2.445 8.149 1.00 0.00 C ATOM 773 OD1 ASP A 835 7.338 -2.172 9.171 1.00 0.00 O ATOM 774 OD2 ASP A 835 7.162 -3.056 7.170 1.00 0.00 O ATOM 0 H ASP A 835 3.002 -0.956 7.904 1.00 0.00 H new ATOM 0 HA ASP A 835 5.455 -0.095 8.982 1.00 0.00 H new ATOM 0 HB2 ASP A 835 4.699 -2.435 8.967 1.00 0.00 H new ATOM 0 HB3 ASP A 835 4.751 -2.470 7.216 1.00 0.00 H new ATOM 779 N LEU A 836 5.162 0.094 5.723 1.00 0.00 N ATOM 780 CA LEU A 836 5.762 0.666 4.526 1.00 0.00 C ATOM 781 C LEU A 836 5.933 2.175 4.701 1.00 0.00 C ATOM 782 O LEU A 836 7.012 2.714 4.470 1.00 0.00 O ATOM 783 CB LEU A 836 4.889 0.376 3.302 1.00 0.00 C ATOM 784 CG LEU A 836 5.639 -0.099 2.053 1.00 0.00 C ATOM 785 CD1 LEU A 836 4.670 -0.295 0.900 1.00 0.00 C ATOM 786 CD2 LEU A 836 6.735 0.879 1.662 1.00 0.00 C ATOM 0 H LEU A 836 4.221 -0.276 5.588 1.00 0.00 H new ATOM 0 HA LEU A 836 6.740 0.211 4.372 1.00 0.00 H new ATOM 0 HB2 LEU A 836 4.154 -0.382 3.573 1.00 0.00 H new ATOM 0 HB3 LEU A 836 4.336 1.281 3.050 1.00 0.00 H new ATOM 0 HG LEU A 836 6.110 -1.054 2.286 1.00 0.00 H new ATOM 0 HD11 LEU A 836 5.216 -0.632 0.019 1.00 0.00 H new ATOM 0 HD12 LEU A 836 3.925 -1.042 1.174 1.00 0.00 H new ATOM 0 HD13 LEU A 836 4.172 0.649 0.679 1.00 0.00 H new ATOM 0 HD21 LEU A 836 7.248 0.514 0.773 1.00 0.00 H new ATOM 0 HD22 LEU A 836 6.295 1.854 1.452 1.00 0.00 H new ATOM 0 HD23 LEU A 836 7.449 0.972 2.481 1.00 0.00 H new ATOM 798 N VAL A 837 4.862 2.838 5.131 1.00 0.00 N ATOM 799 CA VAL A 837 4.874 4.281 5.345 1.00 0.00 C ATOM 800 C VAL A 837 5.954 4.682 6.349 1.00 0.00 C ATOM 801 O VAL A 837 6.656 5.677 6.150 1.00 0.00 O ATOM 802 CB VAL A 837 3.490 4.786 5.822 1.00 0.00 C ATOM 803 CG1 VAL A 837 3.559 6.235 6.281 1.00 0.00 C ATOM 804 CG2 VAL A 837 2.463 4.641 4.709 1.00 0.00 C ATOM 0 H VAL A 837 3.968 2.393 5.339 1.00 0.00 H new ATOM 0 HA VAL A 837 5.102 4.750 4.388 1.00 0.00 H new ATOM 0 HB VAL A 837 3.186 4.175 6.672 1.00 0.00 H new ATOM 0 HG11 VAL A 837 2.572 6.560 6.610 1.00 0.00 H new ATOM 0 HG12 VAL A 837 4.264 6.321 7.108 1.00 0.00 H new ATOM 0 HG13 VAL A 837 3.891 6.863 5.454 1.00 0.00 H new ATOM 0 HG21 VAL A 837 1.495 5.000 5.058 1.00 0.00 H new ATOM 0 HG22 VAL A 837 2.777 5.227 3.845 1.00 0.00 H new ATOM 0 HG23 VAL A 837 2.380 3.592 4.425 1.00 0.00 H new ATOM 814 N ASN A 838 6.094 3.898 7.414 1.00 0.00 N ATOM 815 CA ASN A 838 7.129 4.148 8.416 1.00 0.00 C ATOM 816 C ASN A 838 8.509 4.145 7.767 1.00 0.00 C ATOM 817 O ASN A 838 9.336 5.019 8.033 1.00 0.00 O ATOM 818 CB ASN A 838 7.098 3.093 9.525 1.00 0.00 C ATOM 819 CG ASN A 838 5.790 3.059 10.285 1.00 0.00 C ATOM 820 OD1 ASN A 838 5.097 4.070 10.408 1.00 0.00 O ATOM 821 ND2 ASN A 838 5.445 1.893 10.810 1.00 0.00 N ATOM 0 H ASN A 838 5.507 3.087 7.606 1.00 0.00 H new ATOM 0 HA ASN A 838 6.929 5.126 8.854 1.00 0.00 H new ATOM 0 HB2 ASN A 838 7.281 2.111 9.088 1.00 0.00 H new ATOM 0 HB3 ASN A 838 7.911 3.288 10.224 1.00 0.00 H new ATOM 0 HD21 ASN A 838 4.577 1.809 11.339 1.00 0.00 H new ATOM 0 HD22 ASN A 838 6.047 1.079 10.685 1.00 0.00 H new ATOM 828 N ALA A 839 8.742 3.159 6.910 1.00 0.00 N ATOM 829 CA ALA A 839 10.011 3.037 6.213 1.00 0.00 C ATOM 830 C ALA A 839 10.217 4.200 5.250 1.00 0.00 C ATOM 831 O ALA A 839 11.287 4.801 5.217 1.00 0.00 O ATOM 832 CB ALA A 839 10.080 1.710 5.471 1.00 0.00 C ATOM 0 H ALA A 839 8.065 2.431 6.682 1.00 0.00 H new ATOM 0 HA ALA A 839 10.812 3.066 6.952 1.00 0.00 H new ATOM 0 HB1 ALA A 839 11.036 1.632 4.953 1.00 0.00 H new ATOM 0 HB2 ALA A 839 9.985 0.890 6.183 1.00 0.00 H new ATOM 0 HB3 ALA A 839 9.269 1.657 4.745 1.00 0.00 H new ATOM 838 N ILE A 840 9.177 4.525 4.486 1.00 0.00 N ATOM 839 CA ILE A 840 9.249 5.602 3.501 1.00 0.00 C ATOM 840 C ILE A 840 9.617 6.930 4.160 1.00 0.00 C ATOM 841 O ILE A 840 10.476 7.658 3.668 1.00 0.00 O ATOM 842 CB ILE A 840 7.917 5.768 2.735 1.00 0.00 C ATOM 843 CG1 ILE A 840 7.532 4.466 2.030 1.00 0.00 C ATOM 844 CG2 ILE A 840 8.028 6.896 1.724 1.00 0.00 C ATOM 845 CD1 ILE A 840 6.198 4.534 1.315 1.00 0.00 C ATOM 0 H ILE A 840 8.272 4.057 4.530 1.00 0.00 H new ATOM 0 HA ILE A 840 10.028 5.323 2.792 1.00 0.00 H new ATOM 0 HB ILE A 840 7.137 6.014 3.455 1.00 0.00 H new ATOM 0 HG12 ILE A 840 8.308 4.210 1.309 1.00 0.00 H new ATOM 0 HG13 ILE A 840 7.501 3.661 2.764 1.00 0.00 H new ATOM 0 HG21 ILE A 840 7.083 7.002 1.192 1.00 0.00 H new ATOM 0 HG22 ILE A 840 8.259 7.827 2.242 1.00 0.00 H new ATOM 0 HG23 ILE A 840 8.822 6.670 1.012 1.00 0.00 H new ATOM 0 HD11 ILE A 840 5.991 3.576 0.839 1.00 0.00 H new ATOM 0 HD12 ILE A 840 5.411 4.759 2.034 1.00 0.00 H new ATOM 0 HD13 ILE A 840 6.231 5.316 0.557 1.00 0.00 H new ATOM 857 N LYS A 841 8.973 7.237 5.280 1.00 0.00 N ATOM 858 CA LYS A 841 9.245 8.477 6.001 1.00 0.00 C ATOM 859 C LYS A 841 10.677 8.508 6.524 1.00 0.00 C ATOM 860 O LYS A 841 11.336 9.550 6.499 1.00 0.00 O ATOM 861 CB LYS A 841 8.270 8.648 7.164 1.00 0.00 C ATOM 862 CG LYS A 841 6.853 8.982 6.727 1.00 0.00 C ATOM 863 CD LYS A 841 5.912 9.055 7.917 1.00 0.00 C ATOM 864 CE LYS A 841 4.496 9.403 7.489 1.00 0.00 C ATOM 865 NZ LYS A 841 3.583 9.539 8.654 1.00 0.00 N ATOM 0 H LYS A 841 8.260 6.647 5.709 1.00 0.00 H new ATOM 0 HA LYS A 841 9.114 9.301 5.299 1.00 0.00 H new ATOM 0 HB2 LYS A 841 8.253 7.730 7.751 1.00 0.00 H new ATOM 0 HB3 LYS A 841 8.635 9.439 7.820 1.00 0.00 H new ATOM 0 HG2 LYS A 841 6.848 9.935 6.198 1.00 0.00 H new ATOM 0 HG3 LYS A 841 6.499 8.226 6.026 1.00 0.00 H new ATOM 0 HD2 LYS A 841 5.910 8.098 8.440 1.00 0.00 H new ATOM 0 HD3 LYS A 841 6.274 9.803 8.623 1.00 0.00 H new ATOM 0 HE2 LYS A 841 4.506 10.336 6.925 1.00 0.00 H new ATOM 0 HE3 LYS A 841 4.118 8.630 6.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 841 2.627 9.777 8.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 841 3.553 8.641 9.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 841 3.929 10.294 9.280 1.00 0.00 H new ATOM 879 N ALA A 842 11.155 7.359 6.979 1.00 0.00 N ATOM 880 CA ALA A 842 12.502 7.254 7.513 1.00 0.00 C ATOM 881 C ALA A 842 13.536 7.315 6.393 1.00 0.00 C ATOM 882 O ALA A 842 14.660 7.780 6.594 1.00 0.00 O ATOM 883 CB ALA A 842 12.649 5.975 8.316 1.00 0.00 C ATOM 0 H ALA A 842 10.628 6.486 6.988 1.00 0.00 H new ATOM 0 HA ALA A 842 12.679 8.101 8.176 1.00 0.00 H new ATOM 0 HB1 ALA A 842 13.663 5.908 8.711 1.00 0.00 H new ATOM 0 HB2 ALA A 842 11.937 5.980 9.142 1.00 0.00 H new ATOM 0 HB3 ALA A 842 12.453 5.117 7.673 1.00 0.00 H new ATOM 889 N ASP A 843 13.157 6.838 5.219 1.00 0.00 N ATOM 890 CA ASP A 843 14.005 6.959 4.041 1.00 0.00 C ATOM 891 C ASP A 843 13.993 8.387 3.533 1.00 0.00 C ATOM 892 O ASP A 843 15.008 8.891 3.073 1.00 0.00 O ATOM 893 CB ASP A 843 13.556 6.008 2.931 1.00 0.00 C ATOM 894 CG ASP A 843 14.138 4.621 3.084 1.00 0.00 C ATOM 895 OD1 ASP A 843 13.867 3.965 4.107 1.00 0.00 O ATOM 896 OD2 ASP A 843 14.859 4.167 2.171 1.00 0.00 O ATOM 0 H ASP A 843 12.269 6.364 5.055 1.00 0.00 H new ATOM 0 HA ASP A 843 15.020 6.687 4.331 1.00 0.00 H new ATOM 0 HB2 ASP A 843 12.468 5.944 2.931 1.00 0.00 H new ATOM 0 HB3 ASP A 843 13.851 6.418 1.965 1.00 0.00 H new ATOM 901 N ALA A 844 12.842 9.037 3.640 1.00 0.00 N ATOM 902 CA ALA A 844 12.699 10.423 3.214 1.00 0.00 C ATOM 903 C ALA A 844 13.628 11.332 4.004 1.00 0.00 C ATOM 904 O ALA A 844 14.291 12.199 3.435 1.00 0.00 O ATOM 905 CB ALA A 844 11.260 10.881 3.367 1.00 0.00 C ATOM 0 H ALA A 844 11.990 8.625 4.020 1.00 0.00 H new ATOM 0 HA ALA A 844 12.975 10.483 2.161 1.00 0.00 H new ATOM 0 HB1 ALA A 844 11.172 11.918 3.044 1.00 0.00 H new ATOM 0 HB2 ALA A 844 10.612 10.254 2.755 1.00 0.00 H new ATOM 0 HB3 ALA A 844 10.961 10.800 4.412 1.00 0.00 H new ATOM 911 N GLU A 845 13.687 11.120 5.315 1.00 0.00 N ATOM 912 CA GLU A 845 14.537 11.933 6.174 1.00 0.00 C ATOM 913 C GLU A 845 16.005 11.546 5.998 1.00 0.00 C ATOM 914 O GLU A 845 16.907 12.329 6.297 1.00 0.00 O ATOM 915 CB GLU A 845 14.116 11.793 7.640 1.00 0.00 C ATOM 916 CG GLU A 845 14.258 10.386 8.193 1.00 0.00 C ATOM 917 CD GLU A 845 13.939 10.305 9.669 1.00 0.00 C ATOM 918 OE1 GLU A 845 14.846 10.536 10.493 1.00 0.00 O ATOM 919 OE2 GLU A 845 12.775 10.012 10.014 1.00 0.00 O ATOM 0 H GLU A 845 13.159 10.396 5.802 1.00 0.00 H new ATOM 0 HA GLU A 845 14.419 12.977 5.882 1.00 0.00 H new ATOM 0 HB2 GLU A 845 14.716 12.472 8.246 1.00 0.00 H new ATOM 0 HB3 GLU A 845 13.078 12.109 7.741 1.00 0.00 H new ATOM 0 HG2 GLU A 845 13.596 9.716 7.645 1.00 0.00 H new ATOM 0 HG3 GLU A 845 15.276 10.035 8.026 1.00 0.00 H new ATOM 926 N GLY A 846 16.235 10.342 5.485 1.00 0.00 N ATOM 927 CA GLY A 846 17.589 9.862 5.288 1.00 0.00 C ATOM 928 C GLY A 846 18.044 9.989 3.848 1.00 0.00 C ATOM 929 O GLY A 846 19.136 9.547 3.492 1.00 0.00 O ATOM 0 H GLY A 846 15.505 9.689 5.202 1.00 0.00 H new ATOM 0 HA2 GLY A 846 18.267 10.423 5.931 1.00 0.00 H new ATOM 0 HA3 GLY A 846 17.649 8.818 5.594 1.00 0.00 H new ATOM 933 N GLU A 847 17.197 10.580 3.018 1.00 0.00 N ATOM 934 CA GLU A 847 17.526 10.809 1.620 1.00 0.00 C ATOM 935 C GLU A 847 18.251 12.139 1.477 1.00 0.00 C ATOM 936 O GLU A 847 17.828 13.155 2.035 1.00 0.00 O ATOM 937 CB GLU A 847 16.251 10.781 0.762 1.00 0.00 C ATOM 938 CG GLU A 847 16.457 11.168 -0.699 1.00 0.00 C ATOM 939 CD GLU A 847 17.411 10.254 -1.450 1.00 0.00 C ATOM 940 OE1 GLU A 847 18.638 10.394 -1.271 1.00 0.00 O ATOM 941 OE2 GLU A 847 16.942 9.423 -2.250 1.00 0.00 O ATOM 0 H GLU A 847 16.272 10.911 3.291 1.00 0.00 H new ATOM 0 HA GLU A 847 18.185 10.015 1.269 1.00 0.00 H new ATOM 0 HB2 GLU A 847 15.825 9.779 0.801 1.00 0.00 H new ATOM 0 HB3 GLU A 847 15.518 11.457 1.203 1.00 0.00 H new ATOM 0 HG2 GLU A 847 15.492 11.164 -1.205 1.00 0.00 H new ATOM 0 HG3 GLU A 847 16.836 12.189 -0.744 1.00 0.00 H new ATOM 948 N SER A 848 19.351 12.120 0.740 1.00 0.00 N ATOM 949 CA SER A 848 20.155 13.308 0.536 1.00 0.00 C ATOM 950 C SER A 848 19.614 14.116 -0.636 1.00 0.00 C ATOM 951 O SER A 848 19.921 15.298 -0.786 1.00 0.00 O ATOM 952 CB SER A 848 21.610 12.911 0.292 1.00 0.00 C ATOM 953 OG SER A 848 22.110 12.146 1.381 1.00 0.00 O ATOM 0 H SER A 848 19.707 11.287 0.271 1.00 0.00 H new ATOM 0 HA SER A 848 20.107 13.930 1.430 1.00 0.00 H new ATOM 0 HB2 SER A 848 21.685 12.334 -0.630 1.00 0.00 H new ATOM 0 HB3 SER A 848 22.219 13.805 0.159 1.00 0.00 H new ATOM 0 HG SER A 848 23.042 11.899 1.207 1.00 0.00 H new ATOM 959 N ASP A 849 18.805 13.471 -1.466 1.00 0.00 N ATOM 960 CA ASP A 849 18.170 14.147 -2.588 1.00 0.00 C ATOM 961 C ASP A 849 16.916 14.870 -2.113 1.00 0.00 C ATOM 962 O ASP A 849 16.005 14.252 -1.564 1.00 0.00 O ATOM 963 CB ASP A 849 17.810 13.150 -3.689 1.00 0.00 C ATOM 964 CG ASP A 849 17.298 13.843 -4.929 1.00 0.00 C ATOM 965 OD1 ASP A 849 18.128 14.312 -5.738 1.00 0.00 O ATOM 966 OD2 ASP A 849 16.070 13.925 -5.101 1.00 0.00 O ATOM 0 H ASP A 849 18.573 12.481 -1.383 1.00 0.00 H new ATOM 0 HA ASP A 849 18.873 14.872 -2.997 1.00 0.00 H new ATOM 0 HB2 ASP A 849 18.688 12.555 -3.942 1.00 0.00 H new ATOM 0 HB3 ASP A 849 17.052 12.459 -3.320 1.00 0.00 H new ATOM 971 N LEU A 850 16.868 16.174 -2.334 1.00 0.00 N ATOM 972 CA LEU A 850 15.808 16.999 -1.771 1.00 0.00 C ATOM 973 C LEU A 850 14.464 16.715 -2.442 1.00 0.00 C ATOM 974 O LEU A 850 13.450 16.546 -1.760 1.00 0.00 O ATOM 975 CB LEU A 850 16.167 18.483 -1.902 1.00 0.00 C ATOM 976 CG LEU A 850 15.666 19.393 -0.768 1.00 0.00 C ATOM 977 CD1 LEU A 850 14.149 19.493 -0.766 1.00 0.00 C ATOM 978 CD2 LEU A 850 16.160 18.882 0.576 1.00 0.00 C ATOM 0 H LEU A 850 17.548 16.684 -2.898 1.00 0.00 H new ATOM 0 HA LEU A 850 15.712 16.748 -0.715 1.00 0.00 H new ATOM 0 HB2 LEU A 850 17.252 18.572 -1.962 1.00 0.00 H new ATOM 0 HB3 LEU A 850 15.765 18.853 -2.845 1.00 0.00 H new ATOM 0 HG LEU A 850 16.068 20.392 -0.939 1.00 0.00 H new ATOM 0 HD11 LEU A 850 13.828 20.143 0.048 1.00 0.00 H new ATOM 0 HD12 LEU A 850 13.810 19.906 -1.716 1.00 0.00 H new ATOM 0 HD13 LEU A 850 13.719 18.501 -0.628 1.00 0.00 H new ATOM 0 HD21 LEU A 850 15.798 19.536 1.369 1.00 0.00 H new ATOM 0 HD22 LEU A 850 15.787 17.871 0.740 1.00 0.00 H new ATOM 0 HD23 LEU A 850 17.250 18.872 0.583 1.00 0.00 H new ATOM 990 N GLU A 851 14.446 16.652 -3.769 1.00 0.00 N ATOM 991 CA GLU A 851 13.191 16.446 -4.482 1.00 0.00 C ATOM 992 C GLU A 851 12.624 15.069 -4.164 1.00 0.00 C ATOM 993 O GLU A 851 11.409 14.900 -4.044 1.00 0.00 O ATOM 994 CB GLU A 851 13.359 16.619 -5.997 1.00 0.00 C ATOM 995 CG GLU A 851 13.956 15.418 -6.710 1.00 0.00 C ATOM 996 CD GLU A 851 13.841 15.518 -8.214 1.00 0.00 C ATOM 997 OE1 GLU A 851 14.720 16.144 -8.839 1.00 0.00 O ATOM 998 OE2 GLU A 851 12.868 14.972 -8.778 1.00 0.00 O ATOM 0 H GLU A 851 15.270 16.739 -4.364 1.00 0.00 H new ATOM 0 HA GLU A 851 12.490 17.208 -4.142 1.00 0.00 H new ATOM 0 HB2 GLU A 851 12.385 16.837 -6.434 1.00 0.00 H new ATOM 0 HB3 GLU A 851 13.993 17.486 -6.182 1.00 0.00 H new ATOM 0 HG2 GLU A 851 15.006 15.322 -6.435 1.00 0.00 H new ATOM 0 HG3 GLU A 851 13.454 14.512 -6.370 1.00 0.00 H new ATOM 1005 N ASN A 852 13.508 14.091 -4.007 1.00 0.00 N ATOM 1006 CA ASN A 852 13.093 12.735 -3.686 1.00 0.00 C ATOM 1007 C ASN A 852 12.628 12.651 -2.243 1.00 0.00 C ATOM 1008 O ASN A 852 11.743 11.863 -1.914 1.00 0.00 O ATOM 1009 CB ASN A 852 14.228 11.745 -3.926 1.00 0.00 C ATOM 1010 CG ASN A 852 13.734 10.313 -3.948 1.00 0.00 C ATOM 1011 OD1 ASN A 852 12.616 10.039 -4.391 1.00 0.00 O ATOM 1012 ND2 ASN A 852 14.547 9.391 -3.461 1.00 0.00 N ATOM 0 H ASN A 852 14.517 14.214 -4.097 1.00 0.00 H new ATOM 0 HA ASN A 852 12.263 12.473 -4.342 1.00 0.00 H new ATOM 0 HB2 ASN A 852 14.716 11.975 -4.873 1.00 0.00 H new ATOM 0 HB3 ASN A 852 14.979 11.858 -3.144 1.00 0.00 H new ATOM 0 HD21 ASN A 852 14.257 8.413 -3.443 1.00 0.00 H new ATOM 0 HD22 ASN A 852 15.464 9.657 -3.104 1.00 0.00 H new ATOM 1019 N SER A 853 13.217 13.476 -1.384 1.00 0.00 N ATOM 1020 CA SER A 853 12.786 13.557 0.000 1.00 0.00 C ATOM 1021 C SER A 853 11.321 13.986 0.040 1.00 0.00 C ATOM 1022 O SER A 853 10.517 13.445 0.804 1.00 0.00 O ATOM 1023 CB SER A 853 13.665 14.545 0.776 1.00 0.00 C ATOM 1024 OG SER A 853 13.415 14.481 2.169 1.00 0.00 O ATOM 0 H SER A 853 13.991 14.095 -1.624 1.00 0.00 H new ATOM 0 HA SER A 853 12.886 12.580 0.473 1.00 0.00 H new ATOM 0 HB2 SER A 853 14.716 14.327 0.584 1.00 0.00 H new ATOM 0 HB3 SER A 853 13.479 15.558 0.418 1.00 0.00 H new ATOM 0 HG SER A 853 13.870 13.700 2.547 1.00 0.00 H new ATOM 1030 N ARG A 854 10.978 14.946 -0.818 1.00 0.00 N ATOM 1031 CA ARG A 854 9.594 15.380 -0.973 1.00 0.00 C ATOM 1032 C ARG A 854 8.754 14.243 -1.549 1.00 0.00 C ATOM 1033 O ARG A 854 7.651 13.971 -1.077 1.00 0.00 O ATOM 1034 CB ARG A 854 9.499 16.585 -1.910 1.00 0.00 C ATOM 1035 CG ARG A 854 10.385 17.760 -1.537 1.00 0.00 C ATOM 1036 CD ARG A 854 10.163 18.914 -2.500 1.00 0.00 C ATOM 1037 NE ARG A 854 11.074 20.036 -2.277 1.00 0.00 N ATOM 1038 CZ ARG A 854 10.664 21.290 -2.077 1.00 0.00 C ATOM 1039 NH1 ARG A 854 9.377 21.545 -1.884 1.00 0.00 N ATOM 1040 NH2 ARG A 854 11.545 22.280 -2.033 1.00 0.00 N ATOM 0 H ARG A 854 11.642 15.437 -1.416 1.00 0.00 H new ATOM 0 HA ARG A 854 9.220 15.663 0.011 1.00 0.00 H new ATOM 0 HB2 ARG A 854 9.755 16.262 -2.919 1.00 0.00 H new ATOM 0 HB3 ARG A 854 8.464 16.924 -1.937 1.00 0.00 H new ATOM 0 HG2 ARG A 854 10.166 18.080 -0.518 1.00 0.00 H new ATOM 0 HG3 ARG A 854 11.432 17.456 -1.558 1.00 0.00 H new ATOM 0 HD2 ARG A 854 10.284 18.554 -3.522 1.00 0.00 H new ATOM 0 HD3 ARG A 854 9.135 19.265 -2.405 1.00 0.00 H new ATOM 0 HE ARG A 854 12.077 19.850 -2.274 1.00 0.00 H new ATOM 0 HH11 ARG A 854 8.700 20.782 -1.888 1.00 0.00 H new ATOM 0 HH12 ARG A 854 9.064 22.504 -1.731 1.00 0.00 H new ATOM 0 HH21 ARG A 854 12.539 22.084 -2.152 1.00 0.00 H new ATOM 0 HH22 ARG A 854 11.229 23.238 -1.880 1.00 0.00 H new ATOM 1054 N LYS A 855 9.294 13.590 -2.579 1.00 0.00 N ATOM 1055 CA LYS A 855 8.614 12.486 -3.255 1.00 0.00 C ATOM 1056 C LYS A 855 8.224 11.385 -2.280 1.00 0.00 C ATOM 1057 O LYS A 855 7.093 10.912 -2.298 1.00 0.00 O ATOM 1058 CB LYS A 855 9.506 11.895 -4.346 1.00 0.00 C ATOM 1059 CG LYS A 855 9.653 12.783 -5.569 1.00 0.00 C ATOM 1060 CD LYS A 855 10.711 12.262 -6.538 1.00 0.00 C ATOM 1061 CE LYS A 855 10.355 10.905 -7.139 1.00 0.00 C ATOM 1062 NZ LYS A 855 10.589 9.778 -6.194 1.00 0.00 N ATOM 0 H LYS A 855 10.211 13.811 -2.966 1.00 0.00 H new ATOM 0 HA LYS A 855 7.706 12.893 -3.701 1.00 0.00 H new ATOM 0 HB2 LYS A 855 10.494 11.702 -3.929 1.00 0.00 H new ATOM 0 HB3 LYS A 855 9.097 10.933 -4.655 1.00 0.00 H new ATOM 0 HG2 LYS A 855 8.694 12.851 -6.083 1.00 0.00 H new ATOM 0 HG3 LYS A 855 9.918 13.792 -5.253 1.00 0.00 H new ATOM 0 HD2 LYS A 855 10.846 12.985 -7.342 1.00 0.00 H new ATOM 0 HD3 LYS A 855 11.665 12.183 -6.017 1.00 0.00 H new ATOM 0 HE2 LYS A 855 9.307 10.909 -7.440 1.00 0.00 H new ATOM 0 HE3 LYS A 855 10.946 10.746 -8.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 855 11.055 8.995 -6.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 855 11.196 10.100 -5.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 855 9.679 9.451 -5.812 1.00 0.00 H new ATOM 1076 N LEU A 856 9.163 10.981 -1.443 1.00 0.00 N ATOM 1077 CA LEU A 856 8.915 9.926 -0.472 1.00 0.00 C ATOM 1078 C LEU A 856 7.830 10.337 0.518 1.00 0.00 C ATOM 1079 O LEU A 856 6.881 9.588 0.754 1.00 0.00 O ATOM 1080 CB LEU A 856 10.209 9.569 0.260 1.00 0.00 C ATOM 1081 CG LEU A 856 11.261 8.870 -0.604 1.00 0.00 C ATOM 1082 CD1 LEU A 856 12.568 8.720 0.155 1.00 0.00 C ATOM 1083 CD2 LEU A 856 10.754 7.511 -1.057 1.00 0.00 C ATOM 0 H LEU A 856 10.107 11.367 -1.415 1.00 0.00 H new ATOM 0 HA LEU A 856 8.561 9.044 -1.006 1.00 0.00 H new ATOM 0 HB2 LEU A 856 10.643 10.482 0.669 1.00 0.00 H new ATOM 0 HB3 LEU A 856 9.966 8.925 1.105 1.00 0.00 H new ATOM 0 HG LEU A 856 11.445 9.486 -1.484 1.00 0.00 H new ATOM 0 HD11 LEU A 856 13.301 8.221 -0.478 1.00 0.00 H new ATOM 0 HD12 LEU A 856 12.941 9.705 0.435 1.00 0.00 H new ATOM 0 HD13 LEU A 856 12.401 8.127 1.054 1.00 0.00 H new ATOM 0 HD21 LEU A 856 11.513 7.026 -1.671 1.00 0.00 H new ATOM 0 HD22 LEU A 856 10.542 6.892 -0.185 1.00 0.00 H new ATOM 0 HD23 LEU A 856 9.843 7.639 -1.641 1.00 0.00 H new ATOM 1095 N LEU A 857 7.952 11.536 1.075 1.00 0.00 N ATOM 1096 CA LEU A 857 6.975 12.028 2.038 1.00 0.00 C ATOM 1097 C LEU A 857 5.586 12.133 1.416 1.00 0.00 C ATOM 1098 O LEU A 857 4.596 11.702 2.012 1.00 0.00 O ATOM 1099 CB LEU A 857 7.411 13.382 2.598 1.00 0.00 C ATOM 1100 CG LEU A 857 8.610 13.327 3.546 1.00 0.00 C ATOM 1101 CD1 LEU A 857 9.001 14.727 3.989 1.00 0.00 C ATOM 1102 CD2 LEU A 857 8.291 12.453 4.753 1.00 0.00 C ATOM 0 H LEU A 857 8.715 12.183 0.877 1.00 0.00 H new ATOM 0 HA LEU A 857 6.922 11.309 2.856 1.00 0.00 H new ATOM 0 HB2 LEU A 857 7.654 14.043 1.766 1.00 0.00 H new ATOM 0 HB3 LEU A 857 6.569 13.830 3.125 1.00 0.00 H new ATOM 0 HG LEU A 857 9.454 12.887 3.014 1.00 0.00 H new ATOM 0 HD11 LEU A 857 9.856 14.670 4.663 1.00 0.00 H new ATOM 0 HD12 LEU A 857 9.266 15.324 3.116 1.00 0.00 H new ATOM 0 HD13 LEU A 857 8.162 15.193 4.506 1.00 0.00 H new ATOM 0 HD21 LEU A 857 9.154 12.423 5.419 1.00 0.00 H new ATOM 0 HD22 LEU A 857 7.435 12.867 5.286 1.00 0.00 H new ATOM 0 HD23 LEU A 857 8.056 11.443 4.419 1.00 0.00 H new ATOM 1114 N SER A 858 5.514 12.683 0.211 1.00 0.00 N ATOM 1115 CA SER A 858 4.240 12.820 -0.482 1.00 0.00 C ATOM 1116 C SER A 858 3.678 11.454 -0.861 1.00 0.00 C ATOM 1117 O SER A 858 2.477 11.221 -0.738 1.00 0.00 O ATOM 1118 CB SER A 858 4.389 13.709 -1.720 1.00 0.00 C ATOM 1119 OG SER A 858 5.458 13.275 -2.543 1.00 0.00 O ATOM 0 H SER A 858 6.318 13.040 -0.305 1.00 0.00 H new ATOM 0 HA SER A 858 3.535 13.298 0.197 1.00 0.00 H new ATOM 0 HB2 SER A 858 3.461 13.698 -2.291 1.00 0.00 H new ATOM 0 HB3 SER A 858 4.561 14.740 -1.411 1.00 0.00 H new ATOM 0 HG SER A 858 6.307 13.592 -2.170 1.00 0.00 H new ATOM 1125 N ALA A 859 4.549 10.546 -1.294 1.00 0.00 N ATOM 1126 CA ALA A 859 4.131 9.198 -1.667 1.00 0.00 C ATOM 1127 C ALA A 859 3.531 8.470 -0.471 1.00 0.00 C ATOM 1128 O ALA A 859 2.490 7.829 -0.589 1.00 0.00 O ATOM 1129 CB ALA A 859 5.301 8.406 -2.236 1.00 0.00 C ATOM 0 H ALA A 859 5.549 10.720 -1.395 1.00 0.00 H new ATOM 0 HA ALA A 859 3.366 9.284 -2.439 1.00 0.00 H new ATOM 0 HB1 ALA A 859 4.965 7.405 -2.507 1.00 0.00 H new ATOM 0 HB2 ALA A 859 5.686 8.911 -3.122 1.00 0.00 H new ATOM 0 HB3 ALA A 859 6.090 8.334 -1.487 1.00 0.00 H new ATOM 1135 N ALA A 860 4.190 8.585 0.677 1.00 0.00 N ATOM 1136 CA ALA A 860 3.695 7.976 1.906 1.00 0.00 C ATOM 1137 C ALA A 860 2.350 8.579 2.299 1.00 0.00 C ATOM 1138 O ALA A 860 1.441 7.872 2.727 1.00 0.00 O ATOM 1139 CB ALA A 860 4.704 8.150 3.031 1.00 0.00 C ATOM 0 H ALA A 860 5.068 9.094 0.782 1.00 0.00 H new ATOM 0 HA ALA A 860 3.556 6.910 1.728 1.00 0.00 H new ATOM 0 HB1 ALA A 860 4.318 7.690 3.940 1.00 0.00 H new ATOM 0 HB2 ALA A 860 5.644 7.673 2.754 1.00 0.00 H new ATOM 0 HB3 ALA A 860 4.874 9.212 3.206 1.00 0.00 H new ATOM 1145 N LYS A 861 2.232 9.891 2.128 1.00 0.00 N ATOM 1146 CA LYS A 861 1.005 10.609 2.446 1.00 0.00 C ATOM 1147 C LYS A 861 -0.128 10.195 1.504 1.00 0.00 C ATOM 1148 O LYS A 861 -1.276 10.048 1.925 1.00 0.00 O ATOM 1149 CB LYS A 861 1.249 12.119 2.365 1.00 0.00 C ATOM 1150 CG LYS A 861 0.026 12.968 2.671 1.00 0.00 C ATOM 1151 CD LYS A 861 -0.490 12.739 4.081 1.00 0.00 C ATOM 1152 CE LYS A 861 -1.682 13.634 4.387 1.00 0.00 C ATOM 1153 NZ LYS A 861 -2.829 13.369 3.477 1.00 0.00 N ATOM 0 H LYS A 861 2.980 10.483 1.767 1.00 0.00 H new ATOM 0 HA LYS A 861 0.705 10.354 3.463 1.00 0.00 H new ATOM 0 HB2 LYS A 861 2.044 12.384 3.061 1.00 0.00 H new ATOM 0 HB3 LYS A 861 1.606 12.364 1.365 1.00 0.00 H new ATOM 0 HG2 LYS A 861 0.275 14.021 2.543 1.00 0.00 H new ATOM 0 HG3 LYS A 861 -0.763 12.738 1.955 1.00 0.00 H new ATOM 0 HD2 LYS A 861 -0.777 11.694 4.200 1.00 0.00 H new ATOM 0 HD3 LYS A 861 0.307 12.934 4.798 1.00 0.00 H new ATOM 0 HE2 LYS A 861 -1.996 13.479 5.419 1.00 0.00 H new ATOM 0 HE3 LYS A 861 -1.383 14.678 4.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 861 -3.657 13.913 3.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 861 -2.577 13.654 2.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 861 -3.056 12.354 3.491 1.00 0.00 H new ATOM 1167 N ILE A 862 0.200 10.016 0.230 1.00 0.00 N ATOM 1168 CA ILE A 862 -0.773 9.547 -0.749 1.00 0.00 C ATOM 1169 C ILE A 862 -1.168 8.106 -0.446 1.00 0.00 C ATOM 1170 O ILE A 862 -2.353 7.772 -0.398 1.00 0.00 O ATOM 1171 CB ILE A 862 -0.220 9.641 -2.192 1.00 0.00 C ATOM 1172 CG1 ILE A 862 0.016 11.106 -2.575 1.00 0.00 C ATOM 1173 CG2 ILE A 862 -1.172 8.977 -3.183 1.00 0.00 C ATOM 1174 CD1 ILE A 862 0.683 11.282 -3.924 1.00 0.00 C ATOM 0 H ILE A 862 1.131 10.188 -0.149 1.00 0.00 H new ATOM 0 HA ILE A 862 -1.649 10.191 -0.678 1.00 0.00 H new ATOM 0 HB ILE A 862 0.732 9.111 -2.230 1.00 0.00 H new ATOM 0 HG12 ILE A 862 -0.940 11.629 -2.581 1.00 0.00 H new ATOM 0 HG13 ILE A 862 0.633 11.578 -1.810 1.00 0.00 H new ATOM 0 HG21 ILE A 862 -0.762 9.056 -4.190 1.00 0.00 H new ATOM 0 HG22 ILE A 862 -1.294 7.926 -2.922 1.00 0.00 H new ATOM 0 HG23 ILE A 862 -2.141 9.475 -3.146 1.00 0.00 H new ATOM 0 HD11 ILE A 862 0.818 12.344 -4.127 1.00 0.00 H new ATOM 0 HD12 ILE A 862 1.655 10.788 -3.917 1.00 0.00 H new ATOM 0 HD13 ILE A 862 0.057 10.841 -4.700 1.00 0.00 H new ATOM 1186 N LEU A 863 -0.161 7.273 -0.214 1.00 0.00 N ATOM 1187 CA LEU A 863 -0.367 5.861 0.071 1.00 0.00 C ATOM 1188 C LEU A 863 -1.214 5.651 1.324 1.00 0.00 C ATOM 1189 O LEU A 863 -2.269 5.013 1.266 1.00 0.00 O ATOM 1190 CB LEU A 863 0.987 5.160 0.225 1.00 0.00 C ATOM 1191 CG LEU A 863 0.946 3.796 0.918 1.00 0.00 C ATOM 1192 CD1 LEU A 863 -0.104 2.905 0.285 1.00 0.00 C ATOM 1193 CD2 LEU A 863 2.315 3.137 0.873 1.00 0.00 C ATOM 0 H LEU A 863 0.818 7.558 -0.218 1.00 0.00 H new ATOM 0 HA LEU A 863 -0.911 5.427 -0.768 1.00 0.00 H new ATOM 0 HB2 LEU A 863 1.425 5.032 -0.765 1.00 0.00 H new ATOM 0 HB3 LEU A 863 1.654 5.814 0.787 1.00 0.00 H new ATOM 0 HG LEU A 863 0.674 3.947 1.963 1.00 0.00 H new ATOM 0 HD11 LEU A 863 -0.117 1.940 0.792 1.00 0.00 H new ATOM 0 HD12 LEU A 863 -1.083 3.375 0.376 1.00 0.00 H new ATOM 0 HD13 LEU A 863 0.131 2.757 -0.769 1.00 0.00 H new ATOM 0 HD21 LEU A 863 2.269 2.168 1.370 1.00 0.00 H new ATOM 0 HD22 LEU A 863 2.618 2.998 -0.165 1.00 0.00 H new ATOM 0 HD23 LEU A 863 3.041 3.771 1.381 1.00 0.00 H new ATOM 1205 N ALA A 864 -0.758 6.191 2.446 1.00 0.00 N ATOM 1206 CA ALA A 864 -1.432 5.986 3.722 1.00 0.00 C ATOM 1207 C ALA A 864 -2.884 6.436 3.646 1.00 0.00 C ATOM 1208 O ALA A 864 -3.769 5.828 4.251 1.00 0.00 O ATOM 1209 CB ALA A 864 -0.701 6.723 4.831 1.00 0.00 C ATOM 0 H ALA A 864 0.077 6.775 2.499 1.00 0.00 H new ATOM 0 HA ALA A 864 -1.420 4.920 3.948 1.00 0.00 H new ATOM 0 HB1 ALA A 864 -1.217 6.560 5.777 1.00 0.00 H new ATOM 0 HB2 ALA A 864 0.320 6.349 4.905 1.00 0.00 H new ATOM 0 HB3 ALA A 864 -0.681 7.790 4.608 1.00 0.00 H new ATOM 1215 N ASP A 865 -3.129 7.478 2.868 1.00 0.00 N ATOM 1216 CA ASP A 865 -4.471 8.014 2.740 1.00 0.00 C ATOM 1217 C ASP A 865 -5.316 7.187 1.800 1.00 0.00 C ATOM 1218 O ASP A 865 -6.482 6.917 2.084 1.00 0.00 O ATOM 1219 CB ASP A 865 -4.444 9.466 2.269 1.00 0.00 C ATOM 1220 CG ASP A 865 -4.905 10.435 3.336 1.00 0.00 C ATOM 1221 OD1 ASP A 865 -6.131 10.558 3.543 1.00 0.00 O ATOM 1222 OD2 ASP A 865 -4.047 11.079 3.980 1.00 0.00 O ATOM 0 H ASP A 865 -2.420 7.965 2.320 1.00 0.00 H new ATOM 0 HA ASP A 865 -4.922 7.974 3.731 1.00 0.00 H new ATOM 0 HB2 ASP A 865 -3.431 9.725 1.962 1.00 0.00 H new ATOM 0 HB3 ASP A 865 -5.080 9.570 1.390 1.00 0.00 H new ATOM 1227 N ALA A 866 -4.734 6.776 0.685 1.00 0.00 N ATOM 1228 CA ALA A 866 -5.428 5.915 -0.252 1.00 0.00 C ATOM 1229 C ALA A 866 -5.829 4.621 0.441 1.00 0.00 C ATOM 1230 O ALA A 866 -6.852 4.015 0.116 1.00 0.00 O ATOM 1231 CB ALA A 866 -4.554 5.641 -1.463 1.00 0.00 C ATOM 0 H ALA A 866 -3.784 7.026 0.409 1.00 0.00 H new ATOM 0 HA ALA A 866 -6.332 6.414 -0.600 1.00 0.00 H new ATOM 0 HB1 ALA A 866 -5.088 4.993 -2.158 1.00 0.00 H new ATOM 0 HB2 ALA A 866 -4.312 6.582 -1.957 1.00 0.00 H new ATOM 0 HB3 ALA A 866 -3.634 5.151 -1.144 1.00 0.00 H new ATOM 1237 N THR A 867 -5.028 4.223 1.425 1.00 0.00 N ATOM 1238 CA THR A 867 -5.342 3.065 2.236 1.00 0.00 C ATOM 1239 C THR A 867 -6.569 3.341 3.095 1.00 0.00 C ATOM 1240 O THR A 867 -7.541 2.587 3.062 1.00 0.00 O ATOM 1241 CB THR A 867 -4.167 2.666 3.148 1.00 0.00 C ATOM 1242 OG1 THR A 867 -2.960 2.568 2.382 1.00 0.00 O ATOM 1243 CG2 THR A 867 -4.445 1.334 3.830 1.00 0.00 C ATOM 0 H THR A 867 -4.157 4.690 1.676 1.00 0.00 H new ATOM 0 HA THR A 867 -5.541 2.239 1.554 1.00 0.00 H new ATOM 0 HB THR A 867 -4.051 3.436 3.911 1.00 0.00 H new ATOM 0 HG1 THR A 867 -2.700 3.459 2.067 1.00 0.00 H new ATOM 0 HG21 THR A 867 -3.603 1.070 4.470 1.00 0.00 H new ATOM 0 HG22 THR A 867 -5.348 1.416 4.435 1.00 0.00 H new ATOM 0 HG23 THR A 867 -4.583 0.560 3.075 1.00 0.00 H new ATOM 1251 N ALA A 868 -6.527 4.443 3.837 1.00 0.00 N ATOM 1252 CA ALA A 868 -7.631 4.829 4.709 1.00 0.00 C ATOM 1253 C ALA A 868 -8.928 4.948 3.919 1.00 0.00 C ATOM 1254 O ALA A 868 -9.982 4.513 4.377 1.00 0.00 O ATOM 1255 CB ALA A 868 -7.316 6.138 5.416 1.00 0.00 C ATOM 0 H ALA A 868 -5.736 5.087 3.852 1.00 0.00 H new ATOM 0 HA ALA A 868 -7.761 4.051 5.461 1.00 0.00 H new ATOM 0 HB1 ALA A 868 -8.150 6.412 6.063 1.00 0.00 H new ATOM 0 HB2 ALA A 868 -6.414 6.019 6.017 1.00 0.00 H new ATOM 0 HB3 ALA A 868 -7.158 6.922 4.676 1.00 0.00 H new ATOM 1261 N LYS A 869 -8.835 5.515 2.720 1.00 0.00 N ATOM 1262 CA LYS A 869 -9.990 5.660 1.845 1.00 0.00 C ATOM 1263 C LYS A 869 -10.634 4.311 1.551 1.00 0.00 C ATOM 1264 O LYS A 869 -11.852 4.158 1.664 1.00 0.00 O ATOM 1265 CB LYS A 869 -9.596 6.329 0.526 1.00 0.00 C ATOM 1266 CG LYS A 869 -9.172 7.780 0.670 1.00 0.00 C ATOM 1267 CD LYS A 869 -8.850 8.405 -0.679 1.00 0.00 C ATOM 1268 CE LYS A 869 -10.060 8.403 -1.601 1.00 0.00 C ATOM 1269 NZ LYS A 869 -9.769 9.059 -2.901 1.00 0.00 N ATOM 0 H LYS A 869 -7.966 5.883 2.332 1.00 0.00 H new ATOM 0 HA LYS A 869 -10.711 6.289 2.366 1.00 0.00 H new ATOM 0 HB2 LYS A 869 -8.779 5.766 0.075 1.00 0.00 H new ATOM 0 HB3 LYS A 869 -10.439 6.274 -0.163 1.00 0.00 H new ATOM 0 HG2 LYS A 869 -9.968 8.346 1.153 1.00 0.00 H new ATOM 0 HG3 LYS A 869 -8.298 7.842 1.318 1.00 0.00 H new ATOM 0 HD2 LYS A 869 -8.505 9.429 -0.533 1.00 0.00 H new ATOM 0 HD3 LYS A 869 -8.033 7.857 -1.149 1.00 0.00 H new ATOM 0 HE2 LYS A 869 -10.380 7.376 -1.777 1.00 0.00 H new ATOM 0 HE3 LYS A 869 -10.889 8.916 -1.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 869 -10.619 9.036 -3.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 869 -9.488 10.047 -2.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 869 -8.996 8.554 -3.379 1.00 0.00 H new ATOM 1283 N MET A 870 -9.820 3.326 1.182 1.00 0.00 N ATOM 1284 CA MET A 870 -10.353 2.033 0.782 1.00 0.00 C ATOM 1285 C MET A 870 -10.777 1.212 1.989 1.00 0.00 C ATOM 1286 O MET A 870 -11.701 0.415 1.899 1.00 0.00 O ATOM 1287 CB MET A 870 -9.355 1.245 -0.075 1.00 0.00 C ATOM 1288 CG MET A 870 -8.205 0.613 0.692 1.00 0.00 C ATOM 1289 SD MET A 870 -7.417 -0.702 -0.240 1.00 0.00 S ATOM 1290 CE MET A 870 -8.758 -1.879 -0.274 1.00 0.00 C ATOM 0 H MET A 870 -8.803 3.398 1.152 1.00 0.00 H new ATOM 0 HA MET A 870 -11.235 2.230 0.173 1.00 0.00 H new ATOM 0 HB2 MET A 870 -9.895 0.459 -0.603 1.00 0.00 H new ATOM 0 HB3 MET A 870 -8.943 1.913 -0.832 1.00 0.00 H new ATOM 0 HG2 MET A 870 -7.467 1.378 0.934 1.00 0.00 H new ATOM 0 HG3 MET A 870 -8.575 0.216 1.637 1.00 0.00 H new ATOM 0 HE1 MET A 870 -8.517 -2.724 0.372 1.00 0.00 H new ATOM 0 HE2 MET A 870 -9.671 -1.400 0.080 1.00 0.00 H new ATOM 0 HE3 MET A 870 -8.906 -2.233 -1.294 1.00 0.00 H new ATOM 1300 N VAL A 871 -10.109 1.411 3.116 1.00 0.00 N ATOM 1301 CA VAL A 871 -10.474 0.713 4.344 1.00 0.00 C ATOM 1302 C VAL A 871 -11.863 1.145 4.809 1.00 0.00 C ATOM 1303 O VAL A 871 -12.718 0.305 5.101 1.00 0.00 O ATOM 1304 CB VAL A 871 -9.444 0.948 5.471 1.00 0.00 C ATOM 1305 CG1 VAL A 871 -9.920 0.343 6.784 1.00 0.00 C ATOM 1306 CG2 VAL A 871 -8.096 0.361 5.086 1.00 0.00 C ATOM 0 H VAL A 871 -9.316 2.046 3.208 1.00 0.00 H new ATOM 0 HA VAL A 871 -10.483 -0.354 4.119 1.00 0.00 H new ATOM 0 HB VAL A 871 -9.338 2.024 5.609 1.00 0.00 H new ATOM 0 HG11 VAL A 871 -9.175 0.524 7.559 1.00 0.00 H new ATOM 0 HG12 VAL A 871 -10.865 0.802 7.075 1.00 0.00 H new ATOM 0 HG13 VAL A 871 -10.061 -0.731 6.660 1.00 0.00 H new ATOM 0 HG21 VAL A 871 -7.381 0.534 5.890 1.00 0.00 H new ATOM 0 HG22 VAL A 871 -8.200 -0.711 4.918 1.00 0.00 H new ATOM 0 HG23 VAL A 871 -7.739 0.838 4.173 1.00 0.00 H new ATOM 1316 N GLU A 872 -12.094 2.453 4.846 1.00 0.00 N ATOM 1317 CA GLU A 872 -13.393 2.989 5.241 1.00 0.00 C ATOM 1318 C GLU A 872 -14.472 2.560 4.250 1.00 0.00 C ATOM 1319 O GLU A 872 -15.599 2.240 4.635 1.00 0.00 O ATOM 1320 CB GLU A 872 -13.341 4.516 5.327 1.00 0.00 C ATOM 1321 CG GLU A 872 -12.300 5.043 6.302 1.00 0.00 C ATOM 1322 CD GLU A 872 -12.518 4.558 7.718 1.00 0.00 C ATOM 1323 OE1 GLU A 872 -11.989 3.486 8.071 1.00 0.00 O ATOM 1324 OE2 GLU A 872 -13.228 5.241 8.485 1.00 0.00 O ATOM 0 H GLU A 872 -11.400 3.161 4.608 1.00 0.00 H new ATOM 0 HA GLU A 872 -13.640 2.591 6.225 1.00 0.00 H new ATOM 0 HB2 GLU A 872 -13.133 4.919 4.336 1.00 0.00 H new ATOM 0 HB3 GLU A 872 -14.322 4.887 5.623 1.00 0.00 H new ATOM 0 HG2 GLU A 872 -11.309 4.737 5.967 1.00 0.00 H new ATOM 0 HG3 GLU A 872 -12.318 6.133 6.290 1.00 0.00 H new ATOM 1331 N ALA A 873 -14.116 2.543 2.971 1.00 0.00 N ATOM 1332 CA ALA A 873 -15.046 2.140 1.927 1.00 0.00 C ATOM 1333 C ALA A 873 -15.337 0.645 2.009 1.00 0.00 C ATOM 1334 O ALA A 873 -16.471 0.214 1.799 1.00 0.00 O ATOM 1335 CB ALA A 873 -14.497 2.504 0.556 1.00 0.00 C ATOM 0 H ALA A 873 -13.190 2.804 2.633 1.00 0.00 H new ATOM 0 HA ALA A 873 -15.983 2.677 2.078 1.00 0.00 H new ATOM 0 HB1 ALA A 873 -15.205 2.195 -0.213 1.00 0.00 H new ATOM 0 HB2 ALA A 873 -14.346 3.582 0.499 1.00 0.00 H new ATOM 0 HB3 ALA A 873 -13.546 1.996 0.398 1.00 0.00 H new ATOM 1341 N ALA A 874 -14.307 -0.138 2.327 1.00 0.00 N ATOM 1342 CA ALA A 874 -14.447 -1.582 2.463 1.00 0.00 C ATOM 1343 C ALA A 874 -15.407 -1.924 3.588 1.00 0.00 C ATOM 1344 O ALA A 874 -16.238 -2.815 3.447 1.00 0.00 O ATOM 1345 CB ALA A 874 -13.093 -2.236 2.706 1.00 0.00 C ATOM 0 H ALA A 874 -13.363 0.209 2.496 1.00 0.00 H new ATOM 0 HA ALA A 874 -14.855 -1.971 1.530 1.00 0.00 H new ATOM 0 HB1 ALA A 874 -13.222 -3.314 2.804 1.00 0.00 H new ATOM 0 HB2 ALA A 874 -12.431 -2.025 1.866 1.00 0.00 H new ATOM 0 HB3 ALA A 874 -12.656 -1.838 3.622 1.00 0.00 H new ATOM 1351 N LYS A 875 -15.292 -1.204 4.700 1.00 0.00 N ATOM 1352 CA LYS A 875 -16.196 -1.387 5.831 1.00 0.00 C ATOM 1353 C LYS A 875 -17.646 -1.264 5.383 1.00 0.00 C ATOM 1354 O LYS A 875 -18.470 -2.135 5.657 1.00 0.00 O ATOM 1355 CB LYS A 875 -15.907 -0.348 6.917 1.00 0.00 C ATOM 1356 CG LYS A 875 -14.554 -0.508 7.583 1.00 0.00 C ATOM 1357 CD LYS A 875 -14.243 0.679 8.478 1.00 0.00 C ATOM 1358 CE LYS A 875 -12.936 0.493 9.228 1.00 0.00 C ATOM 1359 NZ LYS A 875 -12.549 1.722 9.967 1.00 0.00 N ATOM 0 H LYS A 875 -14.580 -0.487 4.842 1.00 0.00 H new ATOM 0 HA LYS A 875 -16.033 -2.386 6.237 1.00 0.00 H new ATOM 0 HB2 LYS A 875 -15.968 0.648 6.478 1.00 0.00 H new ATOM 0 HB3 LYS A 875 -16.684 -0.409 7.679 1.00 0.00 H new ATOM 0 HG2 LYS A 875 -14.541 -1.425 8.172 1.00 0.00 H new ATOM 0 HG3 LYS A 875 -13.780 -0.607 6.822 1.00 0.00 H new ATOM 0 HD2 LYS A 875 -14.190 1.585 7.874 1.00 0.00 H new ATOM 0 HD3 LYS A 875 -15.055 0.819 9.192 1.00 0.00 H new ATOM 0 HE2 LYS A 875 -13.032 -0.337 9.927 1.00 0.00 H new ATOM 0 HE3 LYS A 875 -12.147 0.227 8.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 875 -11.965 1.464 10.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 875 -12.006 2.348 9.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 875 -13.405 2.215 10.293 1.00 0.00 H new ATOM 1373 N GLY A 876 -17.937 -0.184 4.668 1.00 0.00 N ATOM 1374 CA GLY A 876 -19.286 0.053 4.197 1.00 0.00 C ATOM 1375 C GLY A 876 -19.726 -0.944 3.145 1.00 0.00 C ATOM 1376 O GLY A 876 -20.854 -1.428 3.185 1.00 0.00 O ATOM 0 H GLY A 876 -17.260 0.533 4.406 1.00 0.00 H new ATOM 0 HA2 GLY A 876 -19.973 0.010 5.042 1.00 0.00 H new ATOM 0 HA3 GLY A 876 -19.350 1.060 3.785 1.00 0.00 H new ATOM 1380 N ALA A 877 -18.833 -1.261 2.212 1.00 0.00 N ATOM 1381 CA ALA A 877 -19.162 -2.151 1.103 1.00 0.00 C ATOM 1382 C ALA A 877 -19.332 -3.588 1.576 1.00 0.00 C ATOM 1383 O ALA A 877 -20.082 -4.369 0.990 1.00 0.00 O ATOM 1384 CB ALA A 877 -18.083 -2.076 0.035 1.00 0.00 C ATOM 0 H ALA A 877 -17.874 -0.914 2.202 1.00 0.00 H new ATOM 0 HA ALA A 877 -20.111 -1.823 0.679 1.00 0.00 H new ATOM 0 HB1 ALA A 877 -18.338 -2.744 -0.788 1.00 0.00 H new ATOM 0 HB2 ALA A 877 -18.009 -1.054 -0.337 1.00 0.00 H new ATOM 0 HB3 ALA A 877 -17.126 -2.376 0.463 1.00 0.00 H new ATOM 1390 N ALA A 878 -18.621 -3.935 2.630 1.00 0.00 N ATOM 1391 CA ALA A 878 -18.688 -5.272 3.178 1.00 0.00 C ATOM 1392 C ALA A 878 -19.867 -5.417 4.127 1.00 0.00 C ATOM 1393 O ALA A 878 -20.783 -6.195 3.868 1.00 0.00 O ATOM 1394 CB ALA A 878 -17.391 -5.610 3.887 1.00 0.00 C ATOM 0 H ALA A 878 -17.988 -3.306 3.125 1.00 0.00 H new ATOM 0 HA ALA A 878 -18.834 -5.972 2.355 1.00 0.00 H new ATOM 0 HB1 ALA A 878 -17.452 -6.619 4.296 1.00 0.00 H new ATOM 0 HB2 ALA A 878 -16.564 -5.555 3.179 1.00 0.00 H new ATOM 0 HB3 ALA A 878 -17.223 -4.900 4.697 1.00 0.00 H new ATOM 1400 N ALA A 879 -19.844 -4.652 5.218 1.00 0.00 N ATOM 1401 CA ALA A 879 -20.863 -4.764 6.259 1.00 0.00 C ATOM 1402 C ALA A 879 -22.249 -4.462 5.707 1.00 0.00 C ATOM 1403 O ALA A 879 -23.249 -5.008 6.176 1.00 0.00 O ATOM 1404 CB ALA A 879 -20.537 -3.843 7.422 1.00 0.00 C ATOM 0 H ALA A 879 -19.130 -3.948 5.403 1.00 0.00 H new ATOM 0 HA ALA A 879 -20.865 -5.792 6.620 1.00 0.00 H new ATOM 0 HB1 ALA A 879 -21.306 -3.939 8.189 1.00 0.00 H new ATOM 0 HB2 ALA A 879 -19.569 -4.117 7.843 1.00 0.00 H new ATOM 0 HB3 ALA A 879 -20.501 -2.812 7.071 1.00 0.00 H new ATOM 1410 N HIS A 880 -22.306 -3.579 4.720 1.00 0.00 N ATOM 1411 CA HIS A 880 -23.536 -3.335 3.981 1.00 0.00 C ATOM 1412 C HIS A 880 -23.406 -3.961 2.597 1.00 0.00 C ATOM 1413 O HIS A 880 -23.072 -3.277 1.631 1.00 0.00 O ATOM 1414 CB HIS A 880 -23.832 -1.835 3.864 1.00 0.00 C ATOM 1415 CG HIS A 880 -23.886 -1.126 5.183 1.00 0.00 C ATOM 1416 ND1 HIS A 880 -25.053 -0.929 5.888 1.00 0.00 N ATOM 1417 CD2 HIS A 880 -22.903 -0.569 5.931 1.00 0.00 C ATOM 1418 CE1 HIS A 880 -24.786 -0.285 7.008 1.00 0.00 C ATOM 1419 NE2 HIS A 880 -23.489 -0.055 7.058 1.00 0.00 N ATOM 0 H HIS A 880 -21.512 -3.018 4.412 1.00 0.00 H new ATOM 0 HA HIS A 880 -24.369 -3.787 4.519 1.00 0.00 H new ATOM 0 HB2 HIS A 880 -23.066 -1.370 3.243 1.00 0.00 H new ATOM 0 HB3 HIS A 880 -24.784 -1.701 3.350 1.00 0.00 H new ATOM 0 HD2 HIS A 880 -21.852 -0.536 5.685 1.00 0.00 H new ATOM 0 HE1 HIS A 880 -25.508 0.005 7.757 1.00 0.00 H new ATOM 0 HE2 HIS A 880 -23.001 0.427 7.813 1.00 0.00 H new ATOM 1427 N PRO A 881 -23.660 -5.276 2.486 1.00 0.00 N ATOM 1428 CA PRO A 881 -23.369 -6.038 1.271 1.00 0.00 C ATOM 1429 C PRO A 881 -24.254 -5.615 0.104 1.00 0.00 C ATOM 1430 O PRO A 881 -23.866 -5.705 -1.063 1.00 0.00 O ATOM 1431 CB PRO A 881 -23.674 -7.493 1.656 1.00 0.00 C ATOM 1432 CG PRO A 881 -23.816 -7.496 3.139 1.00 0.00 C ATOM 1433 CD PRO A 881 -24.273 -6.121 3.516 1.00 0.00 C ATOM 0 HA PRO A 881 -22.342 -5.881 0.940 1.00 0.00 H new ATOM 0 HB2 PRO A 881 -24.587 -7.842 1.174 1.00 0.00 H new ATOM 0 HB3 PRO A 881 -22.872 -8.159 1.338 1.00 0.00 H new ATOM 0 HG2 PRO A 881 -24.537 -8.248 3.460 1.00 0.00 H new ATOM 0 HG3 PRO A 881 -22.868 -7.737 3.621 1.00 0.00 H new ATOM 0 HD2 PRO A 881 -25.360 -6.041 3.509 1.00 0.00 H new ATOM 0 HD3 PRO A 881 -23.939 -5.845 4.516 1.00 0.00 H new ATOM 1441 N ASP A 882 -25.452 -5.159 0.439 1.00 0.00 N ATOM 1442 CA ASP A 882 -26.452 -4.796 -0.555 1.00 0.00 C ATOM 1443 C ASP A 882 -26.138 -3.462 -1.218 1.00 0.00 C ATOM 1444 O ASP A 882 -26.482 -3.249 -2.381 1.00 0.00 O ATOM 1445 CB ASP A 882 -27.839 -4.734 0.087 1.00 0.00 C ATOM 1446 CG ASP A 882 -28.282 -6.065 0.656 1.00 0.00 C ATOM 1447 OD1 ASP A 882 -27.878 -6.396 1.792 1.00 0.00 O ATOM 1448 OD2 ASP A 882 -29.037 -6.788 -0.028 1.00 0.00 O ATOM 0 H ASP A 882 -25.758 -5.030 1.404 1.00 0.00 H new ATOM 0 HA ASP A 882 -26.436 -5.567 -1.325 1.00 0.00 H new ATOM 0 HB2 ASP A 882 -27.833 -3.988 0.882 1.00 0.00 H new ATOM 0 HB3 ASP A 882 -28.564 -4.402 -0.656 1.00 0.00 H new ATOM 1453 N SER A 883 -25.499 -2.566 -0.478 1.00 0.00 N ATOM 1454 CA SER A 883 -25.210 -1.229 -0.977 1.00 0.00 C ATOM 1455 C SER A 883 -24.219 -1.283 -2.136 1.00 0.00 C ATOM 1456 O SER A 883 -23.030 -1.549 -1.941 1.00 0.00 O ATOM 1457 CB SER A 883 -24.663 -0.349 0.148 1.00 0.00 C ATOM 1458 OG SER A 883 -24.562 1.005 -0.261 1.00 0.00 O ATOM 0 H SER A 883 -25.171 -2.742 0.472 1.00 0.00 H new ATOM 0 HA SER A 883 -26.140 -0.794 -1.343 1.00 0.00 H new ATOM 0 HB2 SER A 883 -25.315 -0.421 1.019 1.00 0.00 H new ATOM 0 HB3 SER A 883 -23.682 -0.713 0.453 1.00 0.00 H new ATOM 0 HG SER A 883 -24.526 1.584 0.529 1.00 0.00 H new ATOM 1464 N GLU A 884 -24.718 -1.041 -3.342 1.00 0.00 N ATOM 1465 CA GLU A 884 -23.883 -1.070 -4.535 1.00 0.00 C ATOM 1466 C GLU A 884 -23.044 0.203 -4.652 1.00 0.00 C ATOM 1467 O GLU A 884 -21.962 0.193 -5.242 1.00 0.00 O ATOM 1468 CB GLU A 884 -24.737 -1.266 -5.789 1.00 0.00 C ATOM 1469 CG GLU A 884 -25.827 -0.224 -5.964 1.00 0.00 C ATOM 1470 CD GLU A 884 -26.593 -0.403 -7.256 1.00 0.00 C ATOM 1471 OE1 GLU A 884 -26.117 0.080 -8.306 1.00 0.00 O ATOM 1472 OE2 GLU A 884 -27.677 -1.020 -7.224 1.00 0.00 O ATOM 0 H GLU A 884 -25.698 -0.822 -3.519 1.00 0.00 H new ATOM 0 HA GLU A 884 -23.202 -1.916 -4.445 1.00 0.00 H new ATOM 0 HB2 GLU A 884 -24.088 -1.248 -6.664 1.00 0.00 H new ATOM 0 HB3 GLU A 884 -25.196 -2.254 -5.753 1.00 0.00 H new ATOM 0 HG2 GLU A 884 -26.519 -0.281 -5.124 1.00 0.00 H new ATOM 0 HG3 GLU A 884 -25.382 0.771 -5.943 1.00 0.00 H new ATOM 1479 N GLU A 885 -23.539 1.298 -4.081 1.00 0.00 N ATOM 1480 CA GLU A 885 -22.800 2.554 -4.076 1.00 0.00 C ATOM 1481 C GLU A 885 -21.509 2.400 -3.282 1.00 0.00 C ATOM 1482 O GLU A 885 -20.455 2.890 -3.690 1.00 0.00 O ATOM 1483 CB GLU A 885 -23.650 3.685 -3.494 1.00 0.00 C ATOM 1484 CG GLU A 885 -22.896 4.995 -3.350 1.00 0.00 C ATOM 1485 CD GLU A 885 -23.779 6.133 -2.887 1.00 0.00 C ATOM 1486 OE1 GLU A 885 -24.480 5.974 -1.868 1.00 0.00 O ATOM 1487 OE2 GLU A 885 -23.765 7.198 -3.534 1.00 0.00 O ATOM 0 H GLU A 885 -24.447 1.340 -3.617 1.00 0.00 H new ATOM 0 HA GLU A 885 -22.553 2.811 -5.106 1.00 0.00 H new ATOM 0 HB2 GLU A 885 -24.518 3.843 -4.134 1.00 0.00 H new ATOM 0 HB3 GLU A 885 -24.025 3.381 -2.517 1.00 0.00 H new ATOM 0 HG2 GLU A 885 -22.080 4.863 -2.640 1.00 0.00 H new ATOM 0 HG3 GLU A 885 -22.446 5.257 -4.308 1.00 0.00 H new ATOM 1494 N GLN A 886 -21.598 1.702 -2.157 1.00 0.00 N ATOM 1495 CA GLN A 886 -20.431 1.436 -1.326 1.00 0.00 C ATOM 1496 C GLN A 886 -19.395 0.629 -2.097 1.00 0.00 C ATOM 1497 O GLN A 886 -18.193 0.818 -1.918 1.00 0.00 O ATOM 1498 CB GLN A 886 -20.833 0.687 -0.056 1.00 0.00 C ATOM 1499 CG GLN A 886 -21.546 1.555 0.967 1.00 0.00 C ATOM 1500 CD GLN A 886 -20.636 2.599 1.591 1.00 0.00 C ATOM 1501 OE1 GLN A 886 -21.084 3.680 1.975 1.00 0.00 O ATOM 1502 NE2 GLN A 886 -19.351 2.287 1.698 1.00 0.00 N ATOM 0 H GLN A 886 -22.468 1.309 -1.799 1.00 0.00 H new ATOM 0 HA GLN A 886 -19.992 2.394 -1.045 1.00 0.00 H new ATOM 0 HB2 GLN A 886 -21.481 -0.147 -0.327 1.00 0.00 H new ATOM 0 HB3 GLN A 886 -19.940 0.261 0.402 1.00 0.00 H new ATOM 0 HG2 GLN A 886 -22.389 2.054 0.489 1.00 0.00 H new ATOM 0 HG3 GLN A 886 -21.955 0.920 1.753 1.00 0.00 H new ATOM 0 HE21 GLN A 886 -19.017 1.381 1.369 1.00 0.00 H new ATOM 0 HE22 GLN A 886 -18.697 2.953 2.110 1.00 0.00 H new ATOM 1511 N GLN A 887 -19.872 -0.255 -2.966 1.00 0.00 N ATOM 1512 CA GLN A 887 -18.992 -1.083 -3.779 1.00 0.00 C ATOM 1513 C GLN A 887 -18.176 -0.206 -4.723 1.00 0.00 C ATOM 1514 O GLN A 887 -16.965 -0.372 -4.851 1.00 0.00 O ATOM 1515 CB GLN A 887 -19.802 -2.101 -4.587 1.00 0.00 C ATOM 1516 CG GLN A 887 -20.824 -2.867 -3.763 1.00 0.00 C ATOM 1517 CD GLN A 887 -20.209 -3.655 -2.624 1.00 0.00 C ATOM 1518 OE1 GLN A 887 -19.074 -4.126 -2.717 1.00 0.00 O ATOM 1519 NE2 GLN A 887 -20.949 -3.790 -1.534 1.00 0.00 N ATOM 0 H GLN A 887 -20.867 -0.416 -3.125 1.00 0.00 H new ATOM 0 HA GLN A 887 -18.317 -1.623 -3.115 1.00 0.00 H new ATOM 0 HB2 GLN A 887 -20.317 -1.582 -5.395 1.00 0.00 H new ATOM 0 HB3 GLN A 887 -19.117 -2.811 -5.050 1.00 0.00 H new ATOM 0 HG2 GLN A 887 -21.553 -2.165 -3.358 1.00 0.00 H new ATOM 0 HG3 GLN A 887 -21.368 -3.550 -4.416 1.00 0.00 H new ATOM 0 HE21 GLN A 887 -21.884 -3.384 -1.499 1.00 0.00 H new ATOM 0 HE22 GLN A 887 -20.584 -4.300 -0.730 1.00 0.00 H new ATOM 1528 N GLN A 888 -18.849 0.742 -5.367 1.00 0.00 N ATOM 1529 CA GLN A 888 -18.186 1.671 -6.274 1.00 0.00 C ATOM 1530 C GLN A 888 -17.203 2.559 -5.519 1.00 0.00 C ATOM 1531 O GLN A 888 -16.085 2.793 -5.986 1.00 0.00 O ATOM 1532 CB GLN A 888 -19.215 2.531 -7.007 1.00 0.00 C ATOM 1533 CG GLN A 888 -18.593 3.597 -7.896 1.00 0.00 C ATOM 1534 CD GLN A 888 -17.756 3.019 -9.022 1.00 0.00 C ATOM 1535 OE1 GLN A 888 -18.259 2.751 -10.109 1.00 0.00 O ATOM 1536 NE2 GLN A 888 -16.468 2.831 -8.771 1.00 0.00 N ATOM 0 H GLN A 888 -19.855 0.887 -5.277 1.00 0.00 H new ATOM 0 HA GLN A 888 -17.630 1.087 -7.007 1.00 0.00 H new ATOM 0 HB2 GLN A 888 -19.848 1.886 -7.616 1.00 0.00 H new ATOM 0 HB3 GLN A 888 -19.862 3.013 -6.274 1.00 0.00 H new ATOM 0 HG2 GLN A 888 -19.384 4.215 -8.320 1.00 0.00 H new ATOM 0 HG3 GLN A 888 -17.969 4.251 -7.287 1.00 0.00 H new ATOM 0 HE21 GLN A 888 -16.087 3.066 -7.854 1.00 0.00 H new ATOM 0 HE22 GLN A 888 -15.858 2.451 -9.494 1.00 0.00 H new ATOM 1545 N ARG A 889 -17.622 3.043 -4.352 1.00 0.00 N ATOM 1546 CA ARG A 889 -16.752 3.852 -3.501 1.00 0.00 C ATOM 1547 C ARG A 889 -15.480 3.083 -3.178 1.00 0.00 C ATOM 1548 O ARG A 889 -14.375 3.633 -3.214 1.00 0.00 O ATOM 1549 CB ARG A 889 -17.459 4.233 -2.199 1.00 0.00 C ATOM 1550 CG ARG A 889 -18.694 5.099 -2.389 1.00 0.00 C ATOM 1551 CD ARG A 889 -19.228 5.584 -1.052 1.00 0.00 C ATOM 1552 NE ARG A 889 -18.220 6.358 -0.329 1.00 0.00 N ATOM 1553 CZ ARG A 889 -18.045 6.320 0.990 1.00 0.00 C ATOM 1554 NH1 ARG A 889 -18.864 5.607 1.754 1.00 0.00 N ATOM 1555 NH2 ARG A 889 -17.056 7.011 1.547 1.00 0.00 N ATOM 0 H ARG A 889 -18.557 2.890 -3.974 1.00 0.00 H new ATOM 0 HA ARG A 889 -16.503 4.764 -4.043 1.00 0.00 H new ATOM 0 HB2 ARG A 889 -17.746 3.321 -1.675 1.00 0.00 H new ATOM 0 HB3 ARG A 889 -16.754 4.762 -1.557 1.00 0.00 H new ATOM 0 HG2 ARG A 889 -18.450 5.954 -3.019 1.00 0.00 H new ATOM 0 HG3 ARG A 889 -19.465 4.530 -2.908 1.00 0.00 H new ATOM 0 HD2 ARG A 889 -20.115 6.197 -1.212 1.00 0.00 H new ATOM 0 HD3 ARG A 889 -19.536 4.730 -0.449 1.00 0.00 H new ATOM 0 HE ARG A 889 -17.610 6.968 -0.872 1.00 0.00 H new ATOM 0 HH11 ARG A 889 -19.631 5.085 1.331 1.00 0.00 H new ATOM 0 HH12 ARG A 889 -18.726 5.581 2.764 1.00 0.00 H new ATOM 0 HH21 ARG A 889 -16.433 7.569 0.964 1.00 0.00 H new ATOM 0 HH22 ARG A 889 -16.920 6.983 2.558 1.00 0.00 H new ATOM 1569 N LEU A 890 -15.654 1.804 -2.871 1.00 0.00 N ATOM 1570 CA LEU A 890 -14.539 0.919 -2.591 1.00 0.00 C ATOM 1571 C LEU A 890 -13.650 0.763 -3.815 1.00 0.00 C ATOM 1572 O LEU A 890 -12.434 0.883 -3.712 1.00 0.00 O ATOM 1573 CB LEU A 890 -15.051 -0.448 -2.138 1.00 0.00 C ATOM 1574 CG LEU A 890 -13.976 -1.522 -1.962 1.00 0.00 C ATOM 1575 CD1 LEU A 890 -12.975 -1.113 -0.892 1.00 0.00 C ATOM 1576 CD2 LEU A 890 -14.623 -2.848 -1.615 1.00 0.00 C ATOM 0 H LEU A 890 -16.568 1.356 -2.810 1.00 0.00 H new ATOM 0 HA LEU A 890 -13.946 1.361 -1.790 1.00 0.00 H new ATOM 0 HB2 LEU A 890 -15.577 -0.325 -1.191 1.00 0.00 H new ATOM 0 HB3 LEU A 890 -15.781 -0.804 -2.865 1.00 0.00 H new ATOM 0 HG LEU A 890 -13.434 -1.632 -2.901 1.00 0.00 H new ATOM 0 HD11 LEU A 890 -12.220 -1.891 -0.784 1.00 0.00 H new ATOM 0 HD12 LEU A 890 -12.494 -0.179 -1.182 1.00 0.00 H new ATOM 0 HD13 LEU A 890 -13.493 -0.975 0.057 1.00 0.00 H new ATOM 0 HD21 LEU A 890 -13.851 -3.608 -1.491 1.00 0.00 H new ATOM 0 HD22 LEU A 890 -15.185 -2.747 -0.687 1.00 0.00 H new ATOM 0 HD23 LEU A 890 -15.299 -3.144 -2.417 1.00 0.00 H new ATOM 1588 N ARG A 891 -14.264 0.504 -4.968 1.00 0.00 N ATOM 1589 CA ARG A 891 -13.523 0.337 -6.218 1.00 0.00 C ATOM 1590 C ARG A 891 -12.567 1.504 -6.445 1.00 0.00 C ATOM 1591 O ARG A 891 -11.370 1.305 -6.631 1.00 0.00 O ATOM 1592 CB ARG A 891 -14.477 0.221 -7.408 1.00 0.00 C ATOM 1593 CG ARG A 891 -15.343 -1.028 -7.394 1.00 0.00 C ATOM 1594 CD ARG A 891 -16.258 -1.075 -8.609 1.00 0.00 C ATOM 1595 NE ARG A 891 -15.503 -1.139 -9.860 1.00 0.00 N ATOM 1596 CZ ARG A 891 -15.870 -0.538 -10.992 1.00 0.00 C ATOM 1597 NH1 ARG A 891 -16.982 0.189 -11.038 1.00 0.00 N ATOM 1598 NH2 ARG A 891 -15.126 -0.669 -12.083 1.00 0.00 N ATOM 0 H ARG A 891 -15.275 0.405 -5.063 1.00 0.00 H new ATOM 0 HA ARG A 891 -12.946 -0.584 -6.135 1.00 0.00 H new ATOM 0 HB2 ARG A 891 -15.124 1.098 -7.427 1.00 0.00 H new ATOM 0 HB3 ARG A 891 -13.894 0.235 -8.329 1.00 0.00 H new ATOM 0 HG2 ARG A 891 -14.708 -1.914 -7.379 1.00 0.00 H new ATOM 0 HG3 ARG A 891 -15.942 -1.049 -6.483 1.00 0.00 H new ATOM 0 HD2 ARG A 891 -16.913 -1.943 -8.536 1.00 0.00 H new ATOM 0 HD3 ARG A 891 -16.897 -0.192 -8.616 1.00 0.00 H new ATOM 0 HE ARG A 891 -14.638 -1.679 -9.867 1.00 0.00 H new ATOM 0 HH11 ARG A 891 -17.560 0.290 -10.204 1.00 0.00 H new ATOM 0 HH12 ARG A 891 -17.257 0.646 -11.907 1.00 0.00 H new ATOM 0 HH21 ARG A 891 -14.274 -1.229 -12.055 1.00 0.00 H new ATOM 0 HH22 ARG A 891 -15.406 -0.210 -12.950 1.00 0.00 H new ATOM 1612 N GLU A 892 -13.106 2.719 -6.398 1.00 0.00 N ATOM 1613 CA GLU A 892 -12.313 3.926 -6.613 1.00 0.00 C ATOM 1614 C GLU A 892 -11.135 3.996 -5.646 1.00 0.00 C ATOM 1615 O GLU A 892 -9.986 4.182 -6.058 1.00 0.00 O ATOM 1616 CB GLU A 892 -13.185 5.167 -6.434 1.00 0.00 C ATOM 1617 CG GLU A 892 -14.261 5.318 -7.494 1.00 0.00 C ATOM 1618 CD GLU A 892 -15.148 6.515 -7.243 1.00 0.00 C ATOM 1619 OE1 GLU A 892 -14.637 7.655 -7.250 1.00 0.00 O ATOM 1620 OE2 GLU A 892 -16.361 6.327 -7.031 1.00 0.00 O ATOM 0 H GLU A 892 -14.093 2.894 -6.212 1.00 0.00 H new ATOM 0 HA GLU A 892 -11.925 3.890 -7.631 1.00 0.00 H new ATOM 0 HB2 GLU A 892 -13.658 5.129 -5.453 1.00 0.00 H new ATOM 0 HB3 GLU A 892 -12.549 6.052 -6.447 1.00 0.00 H new ATOM 0 HG2 GLU A 892 -13.792 5.415 -8.473 1.00 0.00 H new ATOM 0 HG3 GLU A 892 -14.871 4.415 -7.520 1.00 0.00 H new ATOM 1627 N ALA A 893 -11.426 3.829 -4.368 1.00 0.00 N ATOM 1628 CA ALA A 893 -10.419 3.966 -3.329 1.00 0.00 C ATOM 1629 C ALA A 893 -9.394 2.835 -3.381 1.00 0.00 C ATOM 1630 O ALA A 893 -8.194 3.071 -3.265 1.00 0.00 O ATOM 1631 CB ALA A 893 -11.089 4.018 -1.968 1.00 0.00 C ATOM 0 H ALA A 893 -12.357 3.597 -4.023 1.00 0.00 H new ATOM 0 HA ALA A 893 -9.880 4.898 -3.501 1.00 0.00 H new ATOM 0 HB1 ALA A 893 -10.330 4.121 -1.192 1.00 0.00 H new ATOM 0 HB2 ALA A 893 -11.766 4.871 -1.928 1.00 0.00 H new ATOM 0 HB3 ALA A 893 -11.653 3.099 -1.805 1.00 0.00 H new ATOM 1637 N ALA A 894 -9.873 1.614 -3.570 1.00 0.00 N ATOM 1638 CA ALA A 894 -9.007 0.444 -3.574 1.00 0.00 C ATOM 1639 C ALA A 894 -8.098 0.435 -4.797 1.00 0.00 C ATOM 1640 O ALA A 894 -6.909 0.139 -4.689 1.00 0.00 O ATOM 1641 CB ALA A 894 -9.832 -0.829 -3.513 1.00 0.00 C ATOM 0 H ALA A 894 -10.860 1.407 -3.723 1.00 0.00 H new ATOM 0 HA ALA A 894 -8.375 0.491 -2.687 1.00 0.00 H new ATOM 0 HB1 ALA A 894 -9.168 -1.693 -3.517 1.00 0.00 H new ATOM 0 HB2 ALA A 894 -10.428 -0.833 -2.600 1.00 0.00 H new ATOM 0 HB3 ALA A 894 -10.493 -0.876 -4.378 1.00 0.00 H new ATOM 1647 N GLU A 895 -8.653 0.771 -5.957 1.00 0.00 N ATOM 1648 CA GLU A 895 -7.852 0.866 -7.172 1.00 0.00 C ATOM 1649 C GLU A 895 -6.830 1.985 -7.032 1.00 0.00 C ATOM 1650 O GLU A 895 -5.695 1.870 -7.503 1.00 0.00 O ATOM 1651 CB GLU A 895 -8.736 1.097 -8.399 1.00 0.00 C ATOM 1652 CG GLU A 895 -9.634 -0.083 -8.735 1.00 0.00 C ATOM 1653 CD GLU A 895 -10.410 0.128 -10.018 1.00 0.00 C ATOM 1654 OE1 GLU A 895 -9.776 0.173 -11.092 1.00 0.00 O ATOM 1655 OE2 GLU A 895 -11.655 0.246 -9.965 1.00 0.00 O ATOM 0 H GLU A 895 -9.644 0.980 -6.081 1.00 0.00 H new ATOM 0 HA GLU A 895 -7.328 -0.079 -7.314 1.00 0.00 H new ATOM 0 HB2 GLU A 895 -9.356 1.977 -8.229 1.00 0.00 H new ATOM 0 HB3 GLU A 895 -8.101 1.315 -9.258 1.00 0.00 H new ATOM 0 HG2 GLU A 895 -9.027 -0.984 -8.825 1.00 0.00 H new ATOM 0 HG3 GLU A 895 -10.332 -0.250 -7.915 1.00 0.00 H new ATOM 1662 N GLY A 896 -7.234 3.061 -6.367 1.00 0.00 N ATOM 1663 CA GLY A 896 -6.319 4.148 -6.084 1.00 0.00 C ATOM 1664 C GLY A 896 -5.194 3.705 -5.174 1.00 0.00 C ATOM 1665 O GLY A 896 -4.031 4.020 -5.417 1.00 0.00 O ATOM 0 H GLY A 896 -8.182 3.199 -6.018 1.00 0.00 H new ATOM 0 HA2 GLY A 896 -5.905 4.528 -7.018 1.00 0.00 H new ATOM 0 HA3 GLY A 896 -6.862 4.970 -5.618 1.00 0.00 H new ATOM 1669 N LEU A 897 -5.544 2.952 -4.137 1.00 0.00 N ATOM 1670 CA LEU A 897 -4.568 2.412 -3.197 1.00 0.00 C ATOM 1671 C LEU A 897 -3.613 1.451 -3.907 1.00 0.00 C ATOM 1672 O LEU A 897 -2.409 1.447 -3.644 1.00 0.00 O ATOM 1673 CB LEU A 897 -5.308 1.710 -2.042 1.00 0.00 C ATOM 1674 CG LEU A 897 -4.442 1.174 -0.889 1.00 0.00 C ATOM 1675 CD1 LEU A 897 -3.930 -0.225 -1.188 1.00 0.00 C ATOM 1676 CD2 LEU A 897 -3.280 2.112 -0.611 1.00 0.00 C ATOM 0 H LEU A 897 -6.509 2.699 -3.925 1.00 0.00 H new ATOM 0 HA LEU A 897 -3.969 3.226 -2.788 1.00 0.00 H new ATOM 0 HB2 LEU A 897 -6.032 2.411 -1.626 1.00 0.00 H new ATOM 0 HB3 LEU A 897 -5.874 0.877 -2.458 1.00 0.00 H new ATOM 0 HG LEU A 897 -5.070 1.121 0.000 1.00 0.00 H new ATOM 0 HD11 LEU A 897 -3.322 -0.576 -0.354 1.00 0.00 H new ATOM 0 HD12 LEU A 897 -4.775 -0.899 -1.329 1.00 0.00 H new ATOM 0 HD13 LEU A 897 -3.326 -0.205 -2.095 1.00 0.00 H new ATOM 0 HD21 LEU A 897 -2.680 1.715 0.208 1.00 0.00 H new ATOM 0 HD22 LEU A 897 -2.662 2.200 -1.504 1.00 0.00 H new ATOM 0 HD23 LEU A 897 -3.663 3.095 -0.336 1.00 0.00 H new ATOM 1688 N ARG A 898 -4.156 0.663 -4.825 1.00 0.00 N ATOM 1689 CA ARG A 898 -3.369 -0.305 -5.578 1.00 0.00 C ATOM 1690 C ARG A 898 -2.318 0.423 -6.402 1.00 0.00 C ATOM 1691 O ARG A 898 -1.139 0.061 -6.399 1.00 0.00 O ATOM 1692 CB ARG A 898 -4.295 -1.118 -6.489 1.00 0.00 C ATOM 1693 CG ARG A 898 -3.578 -2.131 -7.365 1.00 0.00 C ATOM 1694 CD ARG A 898 -4.547 -2.827 -8.307 1.00 0.00 C ATOM 1695 NE ARG A 898 -3.870 -3.748 -9.215 1.00 0.00 N ATOM 1696 CZ ARG A 898 -4.298 -4.031 -10.445 1.00 0.00 C ATOM 1697 NH1 ARG A 898 -5.407 -3.467 -10.914 1.00 0.00 N ATOM 1698 NH2 ARG A 898 -3.621 -4.880 -11.207 1.00 0.00 N ATOM 0 H ARG A 898 -5.147 0.676 -5.068 1.00 0.00 H new ATOM 0 HA ARG A 898 -2.866 -0.985 -4.890 1.00 0.00 H new ATOM 0 HB2 ARG A 898 -5.025 -1.641 -5.872 1.00 0.00 H new ATOM 0 HB3 ARG A 898 -4.851 -0.432 -7.128 1.00 0.00 H new ATOM 0 HG2 ARG A 898 -2.801 -1.630 -7.943 1.00 0.00 H new ATOM 0 HG3 ARG A 898 -3.082 -2.871 -6.738 1.00 0.00 H new ATOM 0 HD2 ARG A 898 -5.288 -3.374 -7.724 1.00 0.00 H new ATOM 0 HD3 ARG A 898 -5.087 -2.079 -8.887 1.00 0.00 H new ATOM 0 HE ARG A 898 -3.017 -4.203 -8.888 1.00 0.00 H new ATOM 0 HH11 ARG A 898 -5.933 -2.815 -10.332 1.00 0.00 H new ATOM 0 HH12 ARG A 898 -5.731 -3.686 -11.856 1.00 0.00 H new ATOM 0 HH21 ARG A 898 -2.771 -5.318 -10.852 1.00 0.00 H new ATOM 0 HH22 ARG A 898 -3.951 -5.095 -12.148 1.00 0.00 H new ATOM 1712 N MET A 899 -2.757 1.474 -7.077 1.00 0.00 N ATOM 1713 CA MET A 899 -1.876 2.285 -7.900 1.00 0.00 C ATOM 1714 C MET A 899 -0.892 3.073 -7.039 1.00 0.00 C ATOM 1715 O MET A 899 0.288 3.170 -7.374 1.00 0.00 O ATOM 1716 CB MET A 899 -2.696 3.237 -8.769 1.00 0.00 C ATOM 1717 CG MET A 899 -3.499 2.533 -9.850 1.00 0.00 C ATOM 1718 SD MET A 899 -4.386 3.684 -10.922 1.00 0.00 S ATOM 1719 CE MET A 899 -5.435 4.522 -9.736 1.00 0.00 C ATOM 0 H MET A 899 -3.728 1.787 -7.070 1.00 0.00 H new ATOM 0 HA MET A 899 -1.304 1.618 -8.545 1.00 0.00 H new ATOM 0 HB2 MET A 899 -3.377 3.802 -8.132 1.00 0.00 H new ATOM 0 HB3 MET A 899 -2.025 3.957 -9.237 1.00 0.00 H new ATOM 0 HG2 MET A 899 -2.829 1.923 -10.455 1.00 0.00 H new ATOM 0 HG3 MET A 899 -4.213 1.855 -9.383 1.00 0.00 H new ATOM 0 HE1 MET A 899 -6.210 5.078 -10.264 1.00 0.00 H new ATOM 0 HE2 MET A 899 -5.900 3.787 -9.078 1.00 0.00 H new ATOM 0 HE3 MET A 899 -4.835 5.212 -9.143 1.00 0.00 H new ATOM 1729 N ALA A 900 -1.385 3.625 -5.932 1.00 0.00 N ATOM 1730 CA ALA A 900 -0.553 4.402 -5.016 1.00 0.00 C ATOM 1731 C ALA A 900 0.591 3.562 -4.463 1.00 0.00 C ATOM 1732 O ALA A 900 1.748 3.980 -4.484 1.00 0.00 O ATOM 1733 CB ALA A 900 -1.394 4.959 -3.877 1.00 0.00 C ATOM 0 H ALA A 900 -2.361 3.548 -5.647 1.00 0.00 H new ATOM 0 HA ALA A 900 -0.123 5.232 -5.577 1.00 0.00 H new ATOM 0 HB1 ALA A 900 -0.759 5.535 -3.204 1.00 0.00 H new ATOM 0 HB2 ALA A 900 -2.173 5.605 -4.282 1.00 0.00 H new ATOM 0 HB3 ALA A 900 -1.853 4.137 -3.328 1.00 0.00 H new ATOM 1739 N THR A 901 0.261 2.372 -3.981 1.00 0.00 N ATOM 1740 CA THR A 901 1.255 1.470 -3.419 1.00 0.00 C ATOM 1741 C THR A 901 2.278 1.058 -4.472 1.00 0.00 C ATOM 1742 O THR A 901 3.484 1.103 -4.234 1.00 0.00 O ATOM 1743 CB THR A 901 0.590 0.210 -2.841 1.00 0.00 C ATOM 1744 OG1 THR A 901 -0.424 0.581 -1.901 1.00 0.00 O ATOM 1745 CG2 THR A 901 1.621 -0.679 -2.164 1.00 0.00 C ATOM 0 H THR A 901 -0.692 2.008 -3.968 1.00 0.00 H new ATOM 0 HA THR A 901 1.763 2.007 -2.618 1.00 0.00 H new ATOM 0 HB THR A 901 0.136 -0.347 -3.660 1.00 0.00 H new ATOM 0 HG1 THR A 901 -1.226 0.872 -2.383 1.00 0.00 H new ATOM 0 HG21 THR A 901 1.130 -1.565 -1.762 1.00 0.00 H new ATOM 0 HG22 THR A 901 2.375 -0.981 -2.891 1.00 0.00 H new ATOM 0 HG23 THR A 901 2.099 -0.129 -1.353 1.00 0.00 H new ATOM 1753 N ASN A 902 1.785 0.676 -5.642 1.00 0.00 N ATOM 1754 CA ASN A 902 2.640 0.243 -6.730 1.00 0.00 C ATOM 1755 C ASN A 902 3.566 1.390 -7.161 1.00 0.00 C ATOM 1756 O ASN A 902 4.703 1.171 -7.579 1.00 0.00 O ATOM 1757 CB ASN A 902 1.790 -0.228 -7.916 1.00 0.00 C ATOM 1758 CG ASN A 902 2.571 -1.085 -8.898 1.00 0.00 C ATOM 1759 OD1 ASN A 902 3.778 -0.923 -9.073 1.00 0.00 O ATOM 1760 ND2 ASN A 902 1.886 -2.009 -9.549 1.00 0.00 N ATOM 0 H ASN A 902 0.789 0.659 -5.859 1.00 0.00 H new ATOM 0 HA ASN A 902 3.252 -0.591 -6.387 1.00 0.00 H new ATOM 0 HB2 ASN A 902 0.938 -0.796 -7.543 1.00 0.00 H new ATOM 0 HB3 ASN A 902 1.390 0.641 -8.438 1.00 0.00 H new ATOM 0 HD21 ASN A 902 2.357 -2.615 -10.221 1.00 0.00 H new ATOM 0 HD22 ASN A 902 0.886 -2.116 -9.380 1.00 0.00 H new ATOM 1767 N ALA A 903 3.069 2.620 -7.042 1.00 0.00 N ATOM 1768 CA ALA A 903 3.855 3.805 -7.371 1.00 0.00 C ATOM 1769 C ALA A 903 4.897 4.080 -6.291 1.00 0.00 C ATOM 1770 O ALA A 903 6.041 4.425 -6.592 1.00 0.00 O ATOM 1771 CB ALA A 903 2.951 5.015 -7.552 1.00 0.00 C ATOM 0 H ALA A 903 2.123 2.821 -6.719 1.00 0.00 H new ATOM 0 HA ALA A 903 4.374 3.616 -8.311 1.00 0.00 H new ATOM 0 HB1 ALA A 903 3.556 5.888 -7.797 1.00 0.00 H new ATOM 0 HB2 ALA A 903 2.245 4.824 -8.361 1.00 0.00 H new ATOM 0 HB3 ALA A 903 2.403 5.201 -6.628 1.00 0.00 H new ATOM 1777 N ALA A 904 4.498 3.918 -5.032 1.00 0.00 N ATOM 1778 CA ALA A 904 5.415 4.072 -3.907 1.00 0.00 C ATOM 1779 C ALA A 904 6.535 3.043 -3.997 1.00 0.00 C ATOM 1780 O ALA A 904 7.648 3.272 -3.525 1.00 0.00 O ATOM 1781 CB ALA A 904 4.668 3.932 -2.587 1.00 0.00 C ATOM 0 H ALA A 904 3.543 3.679 -4.765 1.00 0.00 H new ATOM 0 HA ALA A 904 5.853 5.069 -3.949 1.00 0.00 H new ATOM 0 HB1 ALA A 904 5.367 4.050 -1.759 1.00 0.00 H new ATOM 0 HB2 ALA A 904 3.897 4.699 -2.522 1.00 0.00 H new ATOM 0 HB3 ALA A 904 4.205 2.947 -2.534 1.00 0.00 H new ATOM 1787 N ALA A 905 6.223 1.918 -4.630 1.00 0.00 N ATOM 1788 CA ALA A 905 7.193 0.865 -4.885 1.00 0.00 C ATOM 1789 C ALA A 905 8.368 1.385 -5.712 1.00 0.00 C ATOM 1790 O ALA A 905 9.518 0.999 -5.497 1.00 0.00 O ATOM 1791 CB ALA A 905 6.511 -0.292 -5.605 1.00 0.00 C ATOM 0 H ALA A 905 5.288 1.712 -4.981 1.00 0.00 H new ATOM 0 HA ALA A 905 7.587 0.517 -3.930 1.00 0.00 H new ATOM 0 HB1 ALA A 905 7.238 -1.081 -5.796 1.00 0.00 H new ATOM 0 HB2 ALA A 905 5.706 -0.683 -4.983 1.00 0.00 H new ATOM 0 HB3 ALA A 905 6.100 0.060 -6.551 1.00 0.00 H new ATOM 1797 N GLN A 906 8.065 2.278 -6.647 1.00 0.00 N ATOM 1798 CA GLN A 906 9.070 2.849 -7.535 1.00 0.00 C ATOM 1799 C GLN A 906 9.872 3.937 -6.832 1.00 0.00 C ATOM 1800 O GLN A 906 11.001 4.243 -7.221 1.00 0.00 O ATOM 1801 CB GLN A 906 8.401 3.416 -8.787 1.00 0.00 C ATOM 1802 CG GLN A 906 7.653 2.370 -9.597 1.00 0.00 C ATOM 1803 CD GLN A 906 8.572 1.360 -10.257 1.00 0.00 C ATOM 1804 OE1 GLN A 906 9.664 1.069 -9.771 1.00 0.00 O ATOM 1805 NE2 GLN A 906 8.124 0.801 -11.366 1.00 0.00 N ATOM 0 H GLN A 906 7.120 2.625 -6.810 1.00 0.00 H new ATOM 0 HA GLN A 906 9.758 2.055 -7.823 1.00 0.00 H new ATOM 0 HB2 GLN A 906 7.706 4.203 -8.494 1.00 0.00 H new ATOM 0 HB3 GLN A 906 9.160 3.879 -9.418 1.00 0.00 H new ATOM 0 HG2 GLN A 906 6.955 1.845 -8.945 1.00 0.00 H new ATOM 0 HG3 GLN A 906 7.060 2.868 -10.364 1.00 0.00 H new ATOM 0 HE21 GLN A 906 7.213 1.068 -11.739 1.00 0.00 H new ATOM 0 HE22 GLN A 906 8.689 0.103 -11.849 1.00 0.00 H new ATOM 1814 N ASN A 907 9.282 4.514 -5.788 1.00 0.00 N ATOM 1815 CA ASN A 907 9.916 5.600 -5.044 1.00 0.00 C ATOM 1816 C ASN A 907 11.078 5.099 -4.197 1.00 0.00 C ATOM 1817 O ASN A 907 11.803 5.892 -3.599 1.00 0.00 O ATOM 1818 CB ASN A 907 8.902 6.312 -4.145 1.00 0.00 C ATOM 1819 CG ASN A 907 8.111 7.383 -4.873 1.00 0.00 C ATOM 1820 OD1 ASN A 907 8.523 8.544 -4.926 1.00 0.00 O ATOM 1821 ND2 ASN A 907 6.977 7.008 -5.443 1.00 0.00 N ATOM 0 H ASN A 907 8.362 4.247 -5.437 1.00 0.00 H new ATOM 0 HA ASN A 907 10.303 6.305 -5.780 1.00 0.00 H new ATOM 0 HB2 ASN A 907 8.212 5.576 -3.732 1.00 0.00 H new ATOM 0 HB3 ASN A 907 9.426 6.765 -3.303 1.00 0.00 H new ATOM 0 HD21 ASN A 907 6.410 7.689 -5.948 1.00 0.00 H new ATOM 0 HD22 ASN A 907 6.670 6.038 -5.377 1.00 0.00 H new ATOM 1828 N ALA A 908 11.245 3.781 -4.144 1.00 0.00 N ATOM 1829 CA ALA A 908 12.337 3.174 -3.399 1.00 0.00 C ATOM 1830 C ALA A 908 13.677 3.758 -3.827 1.00 0.00 C ATOM 1831 O ALA A 908 13.973 3.836 -5.021 1.00 0.00 O ATOM 1832 CB ALA A 908 12.338 1.669 -3.602 1.00 0.00 C ATOM 0 H ALA A 908 10.633 3.112 -4.612 1.00 0.00 H new ATOM 0 HA ALA A 908 12.189 3.391 -2.341 1.00 0.00 H new ATOM 0 HB1 ALA A 908 13.160 1.227 -3.039 1.00 0.00 H new ATOM 0 HB2 ALA A 908 11.393 1.254 -3.251 1.00 0.00 H new ATOM 0 HB3 ALA A 908 12.462 1.445 -4.662 1.00 0.00 H new ATOM 1838 N ILE A 909 14.467 4.184 -2.850 1.00 0.00 N ATOM 1839 CA ILE A 909 15.794 4.721 -3.111 1.00 0.00 C ATOM 1840 C ILE A 909 16.656 3.680 -3.820 1.00 0.00 C ATOM 1841 O ILE A 909 16.967 2.627 -3.259 1.00 0.00 O ATOM 1842 CB ILE A 909 16.489 5.170 -1.805 1.00 0.00 C ATOM 1843 CG1 ILE A 909 15.677 6.278 -1.126 1.00 0.00 C ATOM 1844 CG2 ILE A 909 17.909 5.643 -2.088 1.00 0.00 C ATOM 1845 CD1 ILE A 909 16.259 6.745 0.193 1.00 0.00 C ATOM 0 H ILE A 909 14.208 4.167 -1.863 1.00 0.00 H new ATOM 0 HA ILE A 909 15.677 5.594 -3.753 1.00 0.00 H new ATOM 0 HB ILE A 909 16.543 4.316 -1.130 1.00 0.00 H new ATOM 0 HG12 ILE A 909 15.606 7.130 -1.803 1.00 0.00 H new ATOM 0 HG13 ILE A 909 14.662 5.920 -0.957 1.00 0.00 H new ATOM 0 HG21 ILE A 909 18.381 5.955 -1.156 1.00 0.00 H new ATOM 0 HG22 ILE A 909 18.482 4.828 -2.531 1.00 0.00 H new ATOM 0 HG23 ILE A 909 17.881 6.485 -2.780 1.00 0.00 H new ATOM 0 HD11 ILE A 909 15.628 7.529 0.612 1.00 0.00 H new ATOM 0 HD12 ILE A 909 16.304 5.906 0.888 1.00 0.00 H new ATOM 0 HD13 ILE A 909 17.263 7.135 0.030 1.00 0.00 H new ATOM 1857 N LYS A 910 17.013 3.972 -5.060 1.00 0.00 N ATOM 1858 CA LYS A 910 17.785 3.048 -5.870 1.00 0.00 C ATOM 1859 C LYS A 910 19.134 3.651 -6.235 1.00 0.00 C ATOM 1860 O LYS A 910 19.221 4.826 -6.592 1.00 0.00 O ATOM 1861 CB LYS A 910 17.011 2.701 -7.145 1.00 0.00 C ATOM 1862 CG LYS A 910 15.665 2.044 -6.880 1.00 0.00 C ATOM 1863 CD LYS A 910 14.811 1.978 -8.137 1.00 0.00 C ATOM 1864 CE LYS A 910 14.494 3.368 -8.678 1.00 0.00 C ATOM 1865 NZ LYS A 910 13.726 4.195 -7.704 1.00 0.00 N ATOM 0 H LYS A 910 16.778 4.847 -5.528 1.00 0.00 H new ATOM 0 HA LYS A 910 17.955 2.140 -5.291 1.00 0.00 H new ATOM 0 HB2 LYS A 910 16.854 3.611 -7.724 1.00 0.00 H new ATOM 0 HB3 LYS A 910 17.617 2.034 -7.758 1.00 0.00 H new ATOM 0 HG2 LYS A 910 15.822 1.037 -6.494 1.00 0.00 H new ATOM 0 HG3 LYS A 910 15.134 2.602 -6.109 1.00 0.00 H new ATOM 0 HD2 LYS A 910 15.332 1.400 -8.901 1.00 0.00 H new ATOM 0 HD3 LYS A 910 13.882 1.452 -7.918 1.00 0.00 H new ATOM 0 HE2 LYS A 910 15.424 3.878 -8.930 1.00 0.00 H new ATOM 0 HE3 LYS A 910 13.922 3.274 -9.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 910 13.695 5.181 -8.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 910 12.757 3.826 -7.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 910 14.189 4.155 -6.774 1.00 0.00 H new ATOM 1879 N LYS A 911 20.181 2.851 -6.114 1.00 0.00 N ATOM 1880 CA LYS A 911 21.513 3.256 -6.538 1.00 0.00 C ATOM 1881 C LYS A 911 22.118 2.189 -7.443 1.00 0.00 C ATOM 1882 O LYS A 911 21.833 2.207 -8.656 1.00 0.00 O ATOM 1883 CB LYS A 911 22.423 3.497 -5.327 1.00 0.00 C ATOM 1884 CG LYS A 911 22.102 4.767 -4.557 1.00 0.00 C ATOM 1885 CD LYS A 911 23.026 4.947 -3.365 1.00 0.00 C ATOM 1886 CE LYS A 911 22.828 6.302 -2.700 1.00 0.00 C ATOM 1887 NZ LYS A 911 21.414 6.528 -2.300 1.00 0.00 N ATOM 1888 OXT LYS A 911 22.868 1.333 -6.937 1.00 0.00 O ATOM 0 H LYS A 911 20.134 1.910 -5.723 1.00 0.00 H new ATOM 0 HA LYS A 911 21.428 4.191 -7.092 1.00 0.00 H new ATOM 0 HB2 LYS A 911 22.345 2.645 -4.652 1.00 0.00 H new ATOM 0 HB3 LYS A 911 23.458 3.541 -5.666 1.00 0.00 H new ATOM 0 HG2 LYS A 911 22.191 5.627 -5.220 1.00 0.00 H new ATOM 0 HG3 LYS A 911 21.068 4.734 -4.215 1.00 0.00 H new ATOM 0 HD2 LYS A 911 22.842 4.155 -2.639 1.00 0.00 H new ATOM 0 HD3 LYS A 911 24.062 4.848 -3.689 1.00 0.00 H new ATOM 0 HE2 LYS A 911 23.468 6.371 -1.821 1.00 0.00 H new ATOM 0 HE3 LYS A 911 23.141 7.090 -3.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 911 21.353 7.379 -1.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 911 20.829 6.658 -3.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 911 21.069 5.706 -1.765 1.00 0.00 H new TER 1902 LYS A 911