USER MOD reduce.3.24.130724 H: found=0, std=0, add=926, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 929 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 927 HIS : no HE2:sc= -1.39! C(o=-0.17!,f=-5.8!) USER MOD Set 1.2: A1028 LYS NZ :NH3+ 157:sc= 1.22 (180deg=1.21) USER MOD Set 2.1: A 937 ASN : amide:sc= 1.75 K(o=2.7,f=-4.3!) USER MOD Set 2.2: A 954 THR OG1 : rot 82:sc= 0.973 USER MOD Set 3.1: A 936 GLN : amide:sc= 1.15 K(o=1.6,f=-8!) USER MOD Set 3.2: A 953 TYR OH : rot 180:sc= 0.498 USER MOD Single : A 922 THR OG1 : rot 84:sc= 0.211 USER MOD Single : A 928 THR OG1 : rot 180:sc= 0 USER MOD Single : A 931 THR OG1 : rot 180:sc= 0 USER MOD Single : A 935 TYR OH : rot 81:sc= 1.62 USER MOD Single : A 939 SER OG : rot 180:sc= -3.65! USER MOD Single : A 941 TYR OH : rot 180:sc= 0 USER MOD Single : A 947 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 952 THR OG1 : rot 180:sc= 0 USER MOD Single : A 957 ASN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 960 LYS NZ :NH3+ -139:sc= -0.0941 (180deg=-2.31!) USER MOD Single : A 963 SER OG : rot 88:sc= 1.42 USER MOD Single : A 965 SER OG : rot 180:sc= 0 USER MOD Single : A 968 THR OG1 : rot 180:sc= 0 USER MOD Single : A 969 CYS SG : rot -112:sc= 0.108 USER MOD Single : A 981 SER OG : rot 35:sc= 0.0669 USER MOD Single : A 982 TYR OH : rot 180:sc= 0 USER MOD Single : A 985 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 991 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 995 TYR OH : rot 180:sc= 0 USER MOD Single : A 998 THR OG1 : rot 180:sc= 0 USER MOD Single : A1003 HIS : no HD1:sc= -0.202 X(o=-0.2,f=-0.13) USER MOD Single : A1004 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0256) USER MOD Single : A1006 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1007 SER OG : rot 180:sc= 0 USER MOD Single : A1013 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1014 MET CE :methyl 165:sc= -0.43 (180deg=-0.506) USER MOD Single : A1015 TYR OH : rot 180:sc= 0 USER MOD Single : A1016 HIS : no HD1:sc= -8.88! C(o=-8.9!,f=-10!) USER MOD Single : A1017 THR OG1 : rot 80:sc= 0.0453 USER MOD Single : A1018 HIS : no HD1:sc= -0.14 K(o=-0.14,f=-6.8!) USER MOD Single : A1026 LYS NZ :NH3+ -154:sc= -3.45! (180deg=-3.83!) USER MOD Single : A1029 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1032 THR OG1 : rot -132:sc= 1.19 USER MOD Single : A1033 GLN : amide:sc= -1.94! C(o=-1.9!,f=-4.8!) USER MOD Single : A1034 THR OG1 : rot 180:sc= -0.279 USER MOD Single : A1036 SER OG : rot 180:sc= 0 USER MOD Single : A1037 SER OG : rot 180:sc= 0 USER MOD Single : A1038 THR OG1 : rot 180:sc= 0.028 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 918 -17.224 -9.358 16.663 1.00 0.00 N ATOM 2 CA ILE A 918 -18.167 -10.462 16.385 1.00 0.00 C ATOM 3 C ILE A 918 -17.901 -11.065 15.012 1.00 0.00 C ATOM 4 O ILE A 918 -17.998 -12.280 14.832 1.00 0.00 O ATOM 5 CB ILE A 918 -19.655 -10.038 16.519 1.00 0.00 C ATOM 6 CG1 ILE A 918 -19.953 -8.763 15.714 1.00 0.00 C ATOM 7 CG2 ILE A 918 -20.021 -9.861 17.984 1.00 0.00 C ATOM 8 CD1 ILE A 918 -21.385 -8.278 15.814 1.00 0.00 C ATOM 0 HA ILE A 918 -17.990 -11.221 17.148 1.00 0.00 H new ATOM 0 HB ILE A 918 -20.273 -10.833 16.101 1.00 0.00 H new ATOM 0 HG12 ILE A 918 -19.289 -7.969 16.056 1.00 0.00 H new ATOM 0 HG13 ILE A 918 -19.717 -8.947 14.666 1.00 0.00 H new ATOM 0 HG21 ILE A 918 -21.067 -9.564 18.064 1.00 0.00 H new ATOM 0 HG22 ILE A 918 -19.869 -10.802 18.513 1.00 0.00 H new ATOM 0 HG23 ILE A 918 -19.390 -9.090 18.426 1.00 0.00 H new ATOM 0 HD11 ILE A 918 -21.506 -7.375 15.216 1.00 0.00 H new ATOM 0 HD12 ILE A 918 -22.058 -9.051 15.443 1.00 0.00 H new ATOM 0 HD13 ILE A 918 -21.623 -8.058 16.855 1.00 0.00 H new ATOM 22 N ASP A 919 -17.539 -10.227 14.046 1.00 0.00 N ATOM 23 CA ASP A 919 -17.168 -10.704 12.719 1.00 0.00 C ATOM 24 C ASP A 919 -15.681 -10.500 12.513 1.00 0.00 C ATOM 25 O ASP A 919 -15.231 -9.380 12.259 1.00 0.00 O ATOM 26 CB ASP A 919 -17.949 -9.984 11.607 1.00 0.00 C ATOM 27 CG ASP A 919 -17.500 -10.392 10.207 1.00 0.00 C ATOM 28 OD1 ASP A 919 -17.559 -11.588 9.868 1.00 0.00 O ATOM 29 OD2 ASP A 919 -17.081 -9.517 9.417 1.00 0.00 O ATOM 0 H ASP A 919 -17.495 -9.214 14.158 1.00 0.00 H new ATOM 0 HA ASP A 919 -17.418 -11.763 12.661 1.00 0.00 H new ATOM 0 HB2 ASP A 919 -19.012 -10.198 11.719 1.00 0.00 H new ATOM 0 HB3 ASP A 919 -17.827 -8.907 11.723 1.00 0.00 H new ATOM 34 N PRO A 920 -14.876 -11.541 12.718 1.00 0.00 N ATOM 35 CA PRO A 920 -13.447 -11.471 12.492 1.00 0.00 C ATOM 36 C PRO A 920 -13.138 -11.461 11.015 1.00 0.00 C ATOM 37 O PRO A 920 -13.348 -12.451 10.314 1.00 0.00 O ATOM 38 CB PRO A 920 -12.903 -12.746 13.150 1.00 0.00 C ATOM 39 CG PRO A 920 -14.023 -13.213 14.001 1.00 0.00 C ATOM 40 CD PRO A 920 -15.254 -12.856 13.232 1.00 0.00 C ATOM 0 HA PRO A 920 -13.003 -10.564 12.902 1.00 0.00 H new ATOM 0 HB2 PRO A 920 -12.628 -13.494 12.406 1.00 0.00 H new ATOM 0 HB3 PRO A 920 -12.010 -12.541 13.741 1.00 0.00 H new ATOM 0 HG2 PRO A 920 -13.964 -14.287 14.180 1.00 0.00 H new ATOM 0 HG3 PRO A 920 -14.010 -12.726 14.976 1.00 0.00 H new ATOM 0 HD2 PRO A 920 -15.465 -13.568 12.434 1.00 0.00 H new ATOM 0 HD3 PRO A 920 -16.140 -12.814 13.865 1.00 0.00 H new ATOM 48 N PHE A 921 -12.718 -10.313 10.538 1.00 0.00 N ATOM 49 CA PHE A 921 -12.277 -10.186 9.158 1.00 0.00 C ATOM 50 C PHE A 921 -10.999 -10.985 8.990 1.00 0.00 C ATOM 51 O PHE A 921 -10.798 -11.688 7.999 1.00 0.00 O ATOM 52 CB PHE A 921 -12.102 -8.712 8.747 1.00 0.00 C ATOM 53 CG PHE A 921 -11.285 -7.848 9.677 1.00 0.00 C ATOM 54 CD1 PHE A 921 -11.873 -7.255 10.787 1.00 0.00 C ATOM 55 CD2 PHE A 921 -9.945 -7.609 9.432 1.00 0.00 C ATOM 56 CE1 PHE A 921 -11.137 -6.449 11.633 1.00 0.00 C ATOM 57 CE2 PHE A 921 -9.205 -6.801 10.273 1.00 0.00 C ATOM 58 CZ PHE A 921 -9.801 -6.221 11.375 1.00 0.00 C ATOM 0 H PHE A 921 -12.670 -9.450 11.080 1.00 0.00 H new ATOM 0 HA PHE A 921 -13.040 -10.587 8.491 1.00 0.00 H new ATOM 0 HB2 PHE A 921 -11.639 -8.685 7.761 1.00 0.00 H new ATOM 0 HB3 PHE A 921 -13.091 -8.266 8.647 1.00 0.00 H new ATOM 0 HD1 PHE A 921 -12.920 -7.427 10.991 1.00 0.00 H new ATOM 0 HD2 PHE A 921 -9.471 -8.060 8.572 1.00 0.00 H new ATOM 0 HE1 PHE A 921 -11.606 -5.998 12.495 1.00 0.00 H new ATOM 0 HE2 PHE A 921 -8.160 -6.623 10.068 1.00 0.00 H new ATOM 0 HZ PHE A 921 -9.223 -5.590 12.034 1.00 0.00 H new ATOM 68 N THR A 922 -10.178 -10.922 10.009 1.00 0.00 N ATOM 69 CA THR A 922 -8.976 -11.693 10.083 1.00 0.00 C ATOM 70 C THR A 922 -9.037 -12.555 11.342 1.00 0.00 C ATOM 71 O THR A 922 -8.776 -12.081 12.452 1.00 0.00 O ATOM 72 CB THR A 922 -7.748 -10.761 10.095 1.00 0.00 C ATOM 73 OG1 THR A 922 -7.727 -9.977 8.892 1.00 0.00 O ATOM 74 CG2 THR A 922 -6.465 -11.550 10.195 1.00 0.00 C ATOM 0 H THR A 922 -10.334 -10.322 10.819 1.00 0.00 H new ATOM 0 HA THR A 922 -8.882 -12.340 9.211 1.00 0.00 H new ATOM 0 HB THR A 922 -7.824 -10.111 10.967 1.00 0.00 H new ATOM 0 HG1 THR A 922 -8.297 -9.188 9.006 1.00 0.00 H new ATOM 0 HG21 THR A 922 -5.617 -10.866 10.201 1.00 0.00 H new ATOM 0 HG22 THR A 922 -6.467 -12.133 11.116 1.00 0.00 H new ATOM 0 HG23 THR A 922 -6.383 -12.221 9.340 1.00 0.00 H new ATOM 82 N ALA A 923 -9.491 -13.784 11.177 1.00 0.00 N ATOM 83 CA ALA A 923 -9.608 -14.713 12.287 1.00 0.00 C ATOM 84 C ALA A 923 -8.316 -15.483 12.462 1.00 0.00 C ATOM 85 O ALA A 923 -7.477 -15.533 11.548 1.00 0.00 O ATOM 86 CB ALA A 923 -10.765 -15.674 12.064 1.00 0.00 C ATOM 0 H ALA A 923 -9.787 -14.164 10.278 1.00 0.00 H new ATOM 0 HA ALA A 923 -9.805 -14.142 13.194 1.00 0.00 H new ATOM 0 HB1 ALA A 923 -10.835 -16.361 12.907 1.00 0.00 H new ATOM 0 HB2 ALA A 923 -11.694 -15.111 11.977 1.00 0.00 H new ATOM 0 HB3 ALA A 923 -10.597 -16.240 11.148 1.00 0.00 H new ATOM 92 N ASP A 924 -8.145 -16.066 13.630 1.00 0.00 N ATOM 93 CA ASP A 924 -6.969 -16.851 13.924 1.00 0.00 C ATOM 94 C ASP A 924 -7.319 -18.151 14.623 1.00 0.00 C ATOM 95 O ASP A 924 -8.199 -18.201 15.482 1.00 0.00 O ATOM 96 CB ASP A 924 -5.976 -16.063 14.770 1.00 0.00 C ATOM 97 CG ASP A 924 -4.808 -16.915 15.227 1.00 0.00 C ATOM 98 OD1 ASP A 924 -4.111 -17.499 14.373 1.00 0.00 O ATOM 99 OD2 ASP A 924 -4.557 -16.998 16.444 1.00 0.00 O ATOM 0 H ASP A 924 -8.815 -16.009 14.397 1.00 0.00 H new ATOM 0 HA ASP A 924 -6.505 -17.091 12.967 1.00 0.00 H new ATOM 0 HB2 ASP A 924 -5.602 -15.217 14.194 1.00 0.00 H new ATOM 0 HB3 ASP A 924 -6.488 -15.654 15.641 1.00 0.00 H new ATOM 104 N ALA A 925 -6.631 -19.195 14.214 1.00 0.00 N ATOM 105 CA ALA A 925 -6.739 -20.506 14.810 1.00 0.00 C ATOM 106 C ALA A 925 -5.340 -21.101 14.914 1.00 0.00 C ATOM 107 O ALA A 925 -5.165 -22.286 15.187 1.00 0.00 O ATOM 108 CB ALA A 925 -7.644 -21.396 13.967 1.00 0.00 C ATOM 0 H ALA A 925 -5.967 -19.153 13.441 1.00 0.00 H new ATOM 0 HA ALA A 925 -7.181 -20.432 15.804 1.00 0.00 H new ATOM 0 HB1 ALA A 925 -7.717 -22.381 14.428 1.00 0.00 H new ATOM 0 HB2 ALA A 925 -8.637 -20.950 13.905 1.00 0.00 H new ATOM 0 HB3 ALA A 925 -7.227 -21.494 12.965 1.00 0.00 H new ATOM 114 N GLY A 926 -4.337 -20.248 14.731 1.00 0.00 N ATOM 115 CA GLY A 926 -2.964 -20.694 14.746 1.00 0.00 C ATOM 116 C GLY A 926 -2.239 -20.325 13.475 1.00 0.00 C ATOM 117 O GLY A 926 -1.676 -21.181 12.794 1.00 0.00 O ATOM 0 H GLY A 926 -4.457 -19.248 14.572 1.00 0.00 H new ATOM 0 HA2 GLY A 926 -2.448 -20.253 15.599 1.00 0.00 H new ATOM 0 HA3 GLY A 926 -2.935 -21.775 14.880 1.00 0.00 H new ATOM 121 N HIS A 927 -2.270 -19.051 13.130 1.00 0.00 N ATOM 122 CA HIS A 927 -1.564 -18.573 11.953 1.00 0.00 C ATOM 123 C HIS A 927 -0.711 -17.440 12.382 1.00 0.00 C ATOM 124 O HIS A 927 -0.946 -16.842 13.432 1.00 0.00 O ATOM 125 CB HIS A 927 -2.453 -17.943 10.867 1.00 0.00 C ATOM 126 CG HIS A 927 -3.873 -18.423 10.827 1.00 0.00 C ATOM 127 ND1 HIS A 927 -4.274 -19.635 10.301 1.00 0.00 N ATOM 128 CD2 HIS A 927 -4.992 -17.851 11.325 1.00 0.00 C ATOM 129 CE1 HIS A 927 -5.566 -19.787 10.493 1.00 0.00 C ATOM 130 NE2 HIS A 927 -6.027 -18.721 11.108 1.00 0.00 N ATOM 0 H HIS A 927 -2.774 -18.330 13.645 1.00 0.00 H new ATOM 0 HA HIS A 927 -1.059 -19.449 11.545 1.00 0.00 H new ATOM 0 HB2 HIS A 927 -2.458 -16.862 11.010 1.00 0.00 H new ATOM 0 HB3 HIS A 927 -1.997 -18.134 9.895 1.00 0.00 H new ATOM 0 HD1 HIS A 927 -3.664 -20.307 9.836 1.00 0.00 H new ATOM 0 HD2 HIS A 927 -5.058 -16.886 11.805 1.00 0.00 H new ATOM 0 HE1 HIS A 927 -6.151 -20.645 10.195 1.00 0.00 H new ATOM 139 N THR A 928 0.301 -17.174 11.627 1.00 0.00 N ATOM 140 CA THR A 928 0.890 -15.893 11.723 1.00 0.00 C ATOM 141 C THR A 928 0.519 -15.175 10.457 1.00 0.00 C ATOM 142 O THR A 928 0.610 -15.757 9.386 1.00 0.00 O ATOM 143 CB THR A 928 2.407 -15.949 11.863 1.00 0.00 C ATOM 144 OG1 THR A 928 2.815 -17.305 12.127 1.00 0.00 O ATOM 145 CG2 THR A 928 2.875 -15.047 12.992 1.00 0.00 C ATOM 0 H THR A 928 0.725 -17.812 10.954 1.00 0.00 H new ATOM 0 HA THR A 928 0.528 -15.385 12.617 1.00 0.00 H new ATOM 0 HB THR A 928 2.857 -15.603 10.933 1.00 0.00 H new ATOM 0 HG1 THR A 928 3.790 -17.342 12.215 1.00 0.00 H new ATOM 0 HG21 THR A 928 3.960 -15.102 13.075 1.00 0.00 H new ATOM 0 HG22 THR A 928 2.578 -14.019 12.783 1.00 0.00 H new ATOM 0 HG23 THR A 928 2.423 -15.372 13.929 1.00 0.00 H new ATOM 153 N GLU A 929 0.038 -13.979 10.570 1.00 0.00 N ATOM 154 CA GLU A 929 -0.333 -13.207 9.417 1.00 0.00 C ATOM 155 C GLU A 929 -0.003 -11.733 9.653 1.00 0.00 C ATOM 156 O GLU A 929 -0.021 -11.260 10.789 1.00 0.00 O ATOM 157 CB GLU A 929 -1.826 -13.381 9.076 1.00 0.00 C ATOM 158 CG GLU A 929 -2.813 -12.842 10.085 1.00 0.00 C ATOM 159 CD GLU A 929 -2.855 -13.597 11.401 1.00 0.00 C ATOM 160 OE1 GLU A 929 -3.056 -14.820 11.387 1.00 0.00 O ATOM 161 OE2 GLU A 929 -2.723 -12.958 12.474 1.00 0.00 O ATOM 0 H GLU A 929 -0.111 -13.506 11.461 1.00 0.00 H new ATOM 0 HA GLU A 929 0.240 -13.571 8.564 1.00 0.00 H new ATOM 0 HB2 GLU A 929 -2.017 -12.896 8.119 1.00 0.00 H new ATOM 0 HB3 GLU A 929 -2.024 -14.444 8.939 1.00 0.00 H new ATOM 0 HG2 GLU A 929 -2.570 -11.799 10.288 1.00 0.00 H new ATOM 0 HG3 GLU A 929 -3.809 -12.857 9.642 1.00 0.00 H new ATOM 168 N PHE A 930 0.349 -11.027 8.605 1.00 0.00 N ATOM 169 CA PHE A 930 0.622 -9.606 8.669 1.00 0.00 C ATOM 170 C PHE A 930 0.052 -8.965 7.410 1.00 0.00 C ATOM 171 O PHE A 930 0.018 -9.607 6.362 1.00 0.00 O ATOM 172 CB PHE A 930 2.136 -9.380 8.768 1.00 0.00 C ATOM 173 CG PHE A 930 2.560 -7.938 8.808 1.00 0.00 C ATOM 174 CD1 PHE A 930 2.311 -7.155 9.923 1.00 0.00 C ATOM 175 CD2 PHE A 930 3.225 -7.373 7.733 1.00 0.00 C ATOM 176 CE1 PHE A 930 2.713 -5.834 9.964 1.00 0.00 C ATOM 177 CE2 PHE A 930 3.628 -6.050 7.769 1.00 0.00 C ATOM 178 CZ PHE A 930 3.372 -5.281 8.885 1.00 0.00 C ATOM 0 H PHE A 930 0.456 -11.425 7.672 1.00 0.00 H new ATOM 0 HA PHE A 930 0.160 -9.156 9.547 1.00 0.00 H new ATOM 0 HB2 PHE A 930 2.505 -9.877 9.665 1.00 0.00 H new ATOM 0 HB3 PHE A 930 2.617 -9.861 7.916 1.00 0.00 H new ATOM 0 HD1 PHE A 930 1.796 -7.582 10.771 1.00 0.00 H new ATOM 0 HD2 PHE A 930 3.431 -7.971 6.858 1.00 0.00 H new ATOM 0 HE1 PHE A 930 2.512 -5.235 10.840 1.00 0.00 H new ATOM 0 HE2 PHE A 930 4.143 -5.619 6.923 1.00 0.00 H new ATOM 0 HZ PHE A 930 3.687 -4.248 8.914 1.00 0.00 H new ATOM 188 N THR A 931 -0.473 -7.765 7.530 1.00 0.00 N ATOM 189 CA THR A 931 -1.007 -7.040 6.389 1.00 0.00 C ATOM 190 C THR A 931 0.119 -6.477 5.519 1.00 0.00 C ATOM 191 O THR A 931 1.022 -5.801 6.016 1.00 0.00 O ATOM 192 CB THR A 931 -1.921 -5.892 6.864 1.00 0.00 C ATOM 193 OG1 THR A 931 -2.881 -6.408 7.792 1.00 0.00 O ATOM 194 CG2 THR A 931 -2.655 -5.245 5.695 1.00 0.00 C ATOM 0 H THR A 931 -0.543 -7.263 8.415 1.00 0.00 H new ATOM 0 HA THR A 931 -1.590 -7.740 5.790 1.00 0.00 H new ATOM 0 HB THR A 931 -1.298 -5.134 7.339 1.00 0.00 H new ATOM 0 HG1 THR A 931 -3.463 -5.682 8.098 1.00 0.00 H new ATOM 0 HG21 THR A 931 -3.290 -4.440 6.065 1.00 0.00 H new ATOM 0 HG22 THR A 931 -1.930 -4.840 4.989 1.00 0.00 H new ATOM 0 HG23 THR A 931 -3.271 -5.992 5.194 1.00 0.00 H new ATOM 202 N ASP A 932 0.037 -6.716 4.223 1.00 0.00 N ATOM 203 CA ASP A 932 1.049 -6.218 3.299 1.00 0.00 C ATOM 204 C ASP A 932 0.396 -5.063 2.557 1.00 0.00 C ATOM 205 O ASP A 932 -0.840 -4.992 2.509 1.00 0.00 O ATOM 206 CB ASP A 932 1.498 -7.296 2.299 1.00 0.00 C ATOM 207 CG ASP A 932 2.891 -7.045 1.740 1.00 0.00 C ATOM 208 OD1 ASP A 932 3.204 -5.914 1.318 1.00 0.00 O ATOM 209 OD2 ASP A 932 3.713 -7.989 1.718 1.00 0.00 O ATOM 0 H ASP A 932 -0.714 -7.249 3.784 1.00 0.00 H new ATOM 0 HA ASP A 932 1.944 -5.914 3.842 1.00 0.00 H new ATOM 0 HB2 ASP A 932 1.479 -8.269 2.790 1.00 0.00 H new ATOM 0 HB3 ASP A 932 0.785 -7.340 1.476 1.00 0.00 H new ATOM 214 N GLU A 933 1.169 -4.161 1.994 1.00 0.00 N ATOM 215 CA GLU A 933 0.609 -2.990 1.362 1.00 0.00 C ATOM 216 C GLU A 933 1.497 -2.533 0.207 1.00 0.00 C ATOM 217 O GLU A 933 2.689 -2.853 0.164 1.00 0.00 O ATOM 218 CB GLU A 933 0.498 -1.868 2.393 1.00 0.00 C ATOM 219 CG GLU A 933 1.818 -1.181 2.709 1.00 0.00 C ATOM 220 CD GLU A 933 1.706 -0.147 3.790 1.00 0.00 C ATOM 221 OE1 GLU A 933 1.241 0.977 3.515 1.00 0.00 O ATOM 222 OE2 GLU A 933 2.078 -0.438 4.939 1.00 0.00 O ATOM 0 H GLU A 933 2.187 -4.217 1.962 1.00 0.00 H new ATOM 0 HA GLU A 933 -0.378 -3.235 0.970 1.00 0.00 H new ATOM 0 HB2 GLU A 933 -0.209 -1.123 2.028 1.00 0.00 H new ATOM 0 HB3 GLU A 933 0.083 -2.276 3.315 1.00 0.00 H new ATOM 0 HG2 GLU A 933 2.548 -1.933 3.009 1.00 0.00 H new ATOM 0 HG3 GLU A 933 2.200 -0.710 1.803 1.00 0.00 H new ATOM 229 N VAL A 934 0.919 -1.818 -0.731 1.00 0.00 N ATOM 230 CA VAL A 934 1.693 -1.162 -1.778 1.00 0.00 C ATOM 231 C VAL A 934 0.952 0.048 -2.283 1.00 0.00 C ATOM 232 O VAL A 934 -0.241 -0.007 -2.562 1.00 0.00 O ATOM 233 CB VAL A 934 2.081 -2.089 -2.949 1.00 0.00 C ATOM 234 CG1 VAL A 934 0.872 -2.707 -3.638 1.00 0.00 C ATOM 235 CG2 VAL A 934 2.969 -1.368 -3.954 1.00 0.00 C ATOM 0 H VAL A 934 -0.088 -1.671 -0.796 1.00 0.00 H new ATOM 0 HA VAL A 934 2.634 -0.860 -1.319 1.00 0.00 H new ATOM 0 HB VAL A 934 2.650 -2.911 -2.514 1.00 0.00 H new ATOM 0 HG11 VAL A 934 1.206 -3.349 -4.453 1.00 0.00 H new ATOM 0 HG12 VAL A 934 0.306 -3.299 -2.918 1.00 0.00 H new ATOM 0 HG13 VAL A 934 0.237 -1.916 -4.036 1.00 0.00 H new ATOM 0 HG21 VAL A 934 3.225 -2.048 -4.767 1.00 0.00 H new ATOM 0 HG22 VAL A 934 2.437 -0.506 -4.356 1.00 0.00 H new ATOM 0 HG23 VAL A 934 3.881 -1.034 -3.460 1.00 0.00 H new ATOM 245 N TYR A 935 1.644 1.153 -2.346 1.00 0.00 N ATOM 246 CA TYR A 935 1.043 2.396 -2.737 1.00 0.00 C ATOM 247 C TYR A 935 0.895 2.533 -4.235 1.00 0.00 C ATOM 248 O TYR A 935 1.740 2.089 -5.004 1.00 0.00 O ATOM 249 CB TYR A 935 1.879 3.526 -2.201 1.00 0.00 C ATOM 250 CG TYR A 935 1.890 3.574 -0.698 1.00 0.00 C ATOM 251 CD1 TYR A 935 0.728 3.823 0.018 1.00 0.00 C ATOM 252 CD2 TYR A 935 3.050 3.331 0.004 1.00 0.00 C ATOM 253 CE1 TYR A 935 0.732 3.834 1.396 1.00 0.00 C ATOM 254 CE2 TYR A 935 3.056 3.333 1.376 1.00 0.00 C ATOM 255 CZ TYR A 935 1.904 3.590 2.066 1.00 0.00 C ATOM 256 OH TYR A 935 1.919 3.546 3.434 1.00 0.00 O ATOM 0 H TYR A 935 2.638 1.216 -2.128 1.00 0.00 H new ATOM 0 HA TYR A 935 0.036 2.424 -2.321 1.00 0.00 H new ATOM 0 HB2 TYR A 935 2.901 3.421 -2.565 1.00 0.00 H new ATOM 0 HB3 TYR A 935 1.498 4.471 -2.588 1.00 0.00 H new ATOM 0 HD1 TYR A 935 -0.194 4.011 -0.513 1.00 0.00 H new ATOM 0 HD2 TYR A 935 3.967 3.136 -0.533 1.00 0.00 H new ATOM 0 HE1 TYR A 935 -0.178 4.033 1.943 1.00 0.00 H new ATOM 0 HE2 TYR A 935 3.972 3.131 1.912 1.00 0.00 H new ATOM 0 HH TYR A 935 1.608 2.667 3.736 1.00 0.00 H new ATOM 266 N GLN A 936 -0.164 3.215 -4.597 1.00 0.00 N ATOM 267 CA GLN A 936 -0.504 3.508 -5.966 1.00 0.00 C ATOM 268 C GLN A 936 -0.440 5.014 -6.107 1.00 0.00 C ATOM 269 O GLN A 936 -1.241 5.721 -5.508 1.00 0.00 O ATOM 270 CB GLN A 936 -1.910 3.025 -6.267 1.00 0.00 C ATOM 271 CG GLN A 936 -2.291 3.117 -7.728 1.00 0.00 C ATOM 272 CD GLN A 936 -3.731 2.737 -7.929 1.00 0.00 C ATOM 273 OE1 GLN A 936 -4.621 3.580 -7.947 1.00 0.00 O ATOM 274 NE2 GLN A 936 -3.981 1.466 -7.980 1.00 0.00 N ATOM 0 H GLN A 936 -0.833 3.593 -3.926 1.00 0.00 H new ATOM 0 HA GLN A 936 0.177 3.012 -6.657 1.00 0.00 H new ATOM 0 HB2 GLN A 936 -2.005 1.989 -5.942 1.00 0.00 H new ATOM 0 HB3 GLN A 936 -2.618 3.610 -5.680 1.00 0.00 H new ATOM 0 HG2 GLN A 936 -2.124 4.132 -8.089 1.00 0.00 H new ATOM 0 HG3 GLN A 936 -1.651 2.460 -8.317 1.00 0.00 H new ATOM 0 HE21 GLN A 936 -3.214 0.794 -7.963 1.00 0.00 H new ATOM 0 HE22 GLN A 936 -4.945 1.138 -8.037 1.00 0.00 H new ATOM 283 N ASN A 937 0.522 5.482 -6.852 1.00 0.00 N ATOM 284 CA ASN A 937 0.824 6.900 -6.953 1.00 0.00 C ATOM 285 C ASN A 937 0.478 7.466 -8.313 1.00 0.00 C ATOM 286 O ASN A 937 0.707 6.846 -9.351 1.00 0.00 O ATOM 287 CB ASN A 937 2.315 7.162 -6.735 1.00 0.00 C ATOM 288 CG ASN A 937 2.862 6.626 -5.438 1.00 0.00 C ATOM 289 OD1 ASN A 937 2.941 7.324 -4.415 1.00 0.00 O ATOM 290 ND2 ASN A 937 3.225 5.373 -5.468 1.00 0.00 N ATOM 0 H ASN A 937 1.131 4.890 -7.417 1.00 0.00 H new ATOM 0 HA ASN A 937 0.221 7.382 -6.184 1.00 0.00 H new ATOM 0 HB2 ASN A 937 2.873 6.719 -7.560 1.00 0.00 H new ATOM 0 HB3 ASN A 937 2.491 8.237 -6.772 1.00 0.00 H new ATOM 0 HD21 ASN A 937 3.592 4.928 -4.627 1.00 0.00 H new ATOM 0 HD22 ASN A 937 3.142 4.838 -6.333 1.00 0.00 H new ATOM 297 N GLU A 938 -0.016 8.675 -8.271 1.00 0.00 N ATOM 298 CA GLU A 938 -0.299 9.488 -9.444 1.00 0.00 C ATOM 299 C GLU A 938 0.073 10.915 -9.100 1.00 0.00 C ATOM 300 O GLU A 938 0.225 11.243 -7.912 1.00 0.00 O ATOM 301 CB GLU A 938 -1.773 9.410 -9.850 1.00 0.00 C ATOM 302 CG GLU A 938 -2.183 8.072 -10.437 1.00 0.00 C ATOM 303 CD GLU A 938 -3.635 8.034 -10.830 1.00 0.00 C ATOM 304 OE1 GLU A 938 -4.487 7.844 -9.944 1.00 0.00 O ATOM 305 OE2 GLU A 938 -3.957 8.185 -12.032 1.00 0.00 O ATOM 0 H GLU A 938 -0.243 9.145 -7.394 1.00 0.00 H new ATOM 0 HA GLU A 938 0.278 9.121 -10.292 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -2.391 9.616 -8.976 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -1.980 10.193 -10.579 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -1.568 7.859 -11.311 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -1.986 7.284 -9.709 1.00 0.00 H new ATOM 312 N SER A 939 0.243 11.750 -10.097 1.00 0.00 N ATOM 313 CA SER A 939 0.622 13.119 -9.872 1.00 0.00 C ATOM 314 C SER A 939 0.086 14.043 -10.953 1.00 0.00 C ATOM 315 O SER A 939 -0.264 13.616 -12.055 1.00 0.00 O ATOM 316 CB SER A 939 2.141 13.242 -9.745 1.00 0.00 C ATOM 317 OG SER A 939 2.791 12.618 -10.832 1.00 0.00 O ATOM 0 H SER A 939 0.123 11.500 -11.079 1.00 0.00 H new ATOM 0 HA SER A 939 0.170 13.435 -8.932 1.00 0.00 H new ATOM 0 HB2 SER A 939 2.422 14.294 -9.704 1.00 0.00 H new ATOM 0 HB3 SER A 939 2.470 12.787 -8.810 1.00 0.00 H new ATOM 0 HG SER A 939 3.761 12.711 -10.730 1.00 0.00 H new ATOM 323 N ARG A 940 -0.003 15.294 -10.573 1.00 0.00 N ATOM 324 CA ARG A 940 -0.459 16.373 -11.396 1.00 0.00 C ATOM 325 C ARG A 940 0.241 17.633 -10.945 1.00 0.00 C ATOM 326 O ARG A 940 0.753 17.695 -9.827 1.00 0.00 O ATOM 327 CB ARG A 940 -1.960 16.574 -11.219 1.00 0.00 C ATOM 328 CG ARG A 940 -2.392 16.865 -9.782 1.00 0.00 C ATOM 329 CD ARG A 940 -3.876 17.157 -9.720 1.00 0.00 C ATOM 330 NE ARG A 940 -4.313 17.644 -8.416 1.00 0.00 N ATOM 331 CZ ARG A 940 -5.588 17.677 -8.017 1.00 0.00 C ATOM 332 NH1 ARG A 940 -6.540 17.132 -8.764 1.00 0.00 N ATOM 333 NH2 ARG A 940 -5.900 18.246 -6.866 1.00 0.00 N ATOM 0 H ARG A 940 0.255 15.596 -9.633 1.00 0.00 H new ATOM 0 HA ARG A 940 -0.245 16.149 -12.441 1.00 0.00 H new ATOM 0 HB2 ARG A 940 -2.282 17.398 -11.856 1.00 0.00 H new ATOM 0 HB3 ARG A 940 -2.478 15.680 -11.567 1.00 0.00 H new ATOM 0 HG2 ARG A 940 -2.157 16.011 -9.146 1.00 0.00 H new ATOM 0 HG3 ARG A 940 -1.832 17.716 -9.393 1.00 0.00 H new ATOM 0 HD2 ARG A 940 -4.126 17.898 -10.479 1.00 0.00 H new ATOM 0 HD3 ARG A 940 -4.429 16.250 -9.966 1.00 0.00 H new ATOM 0 HE ARG A 940 -3.601 17.980 -7.768 1.00 0.00 H new ATOM 0 HH11 ARG A 940 -6.301 16.684 -9.649 1.00 0.00 H new ATOM 0 HH12 ARG A 940 -7.511 17.161 -8.453 1.00 0.00 H new ATOM 0 HH21 ARG A 940 -5.169 18.658 -6.286 1.00 0.00 H new ATOM 0 HH22 ARG A 940 -6.872 18.273 -6.558 1.00 0.00 H new ATOM 347 N TYR A 941 0.303 18.615 -11.807 1.00 0.00 N ATOM 348 CA TYR A 941 0.732 19.933 -11.385 1.00 0.00 C ATOM 349 C TYR A 941 -0.447 20.544 -10.652 1.00 0.00 C ATOM 350 O TYR A 941 -1.562 20.001 -10.738 1.00 0.00 O ATOM 351 CB TYR A 941 1.022 20.833 -12.584 1.00 0.00 C ATOM 352 CG TYR A 941 1.997 20.260 -13.584 1.00 0.00 C ATOM 353 CD1 TYR A 941 3.363 20.397 -13.394 1.00 0.00 C ATOM 354 CD2 TYR A 941 1.554 19.592 -14.716 1.00 0.00 C ATOM 355 CE1 TYR A 941 4.264 19.883 -14.303 1.00 0.00 C ATOM 356 CE2 TYR A 941 2.449 19.073 -15.631 1.00 0.00 C ATOM 357 CZ TYR A 941 3.802 19.222 -15.419 1.00 0.00 C ATOM 358 OH TYR A 941 4.700 18.706 -16.326 1.00 0.00 O ATOM 0 H TYR A 941 0.066 18.534 -12.796 1.00 0.00 H new ATOM 0 HA TYR A 941 1.634 19.849 -10.779 1.00 0.00 H new ATOM 0 HB2 TYR A 941 0.083 21.048 -13.095 1.00 0.00 H new ATOM 0 HB3 TYR A 941 1.412 21.784 -12.221 1.00 0.00 H new ATOM 0 HD1 TYR A 941 3.728 20.915 -12.519 1.00 0.00 H new ATOM 0 HD2 TYR A 941 0.494 19.476 -14.884 1.00 0.00 H new ATOM 0 HE1 TYR A 941 5.325 19.998 -14.140 1.00 0.00 H new ATOM 0 HE2 TYR A 941 2.090 18.554 -16.507 1.00 0.00 H new ATOM 0 HH TYR A 941 4.213 18.269 -17.056 1.00 0.00 H new ATOM 368 N PRO A 942 -0.263 21.640 -9.919 1.00 0.00 N ATOM 369 CA PRO A 942 -1.393 22.385 -9.401 1.00 0.00 C ATOM 370 C PRO A 942 -2.159 22.981 -10.573 1.00 0.00 C ATOM 371 O PRO A 942 -1.813 24.053 -11.076 1.00 0.00 O ATOM 372 CB PRO A 942 -0.754 23.479 -8.548 1.00 0.00 C ATOM 373 CG PRO A 942 0.634 23.002 -8.279 1.00 0.00 C ATOM 374 CD PRO A 942 1.022 22.220 -9.496 1.00 0.00 C ATOM 0 HA PRO A 942 -2.096 21.784 -8.825 1.00 0.00 H new ATOM 0 HB2 PRO A 942 -0.748 24.434 -9.073 1.00 0.00 H new ATOM 0 HB3 PRO A 942 -1.306 23.628 -7.620 1.00 0.00 H new ATOM 0 HG2 PRO A 942 1.313 23.839 -8.115 1.00 0.00 H new ATOM 0 HG3 PRO A 942 0.671 22.381 -7.384 1.00 0.00 H new ATOM 0 HD2 PRO A 942 1.454 22.857 -10.268 1.00 0.00 H new ATOM 0 HD3 PRO A 942 1.760 21.451 -9.267 1.00 0.00 H new ATOM 382 N GLY A 943 -3.134 22.241 -11.073 1.00 0.00 N ATOM 383 CA GLY A 943 -3.822 22.634 -12.269 1.00 0.00 C ATOM 384 C GLY A 943 -3.893 21.484 -13.268 1.00 0.00 C ATOM 385 O GLY A 943 -4.608 21.582 -14.265 1.00 0.00 O ATOM 0 H GLY A 943 -3.460 21.366 -10.662 1.00 0.00 H new ATOM 0 HA2 GLY A 943 -4.830 22.965 -12.020 1.00 0.00 H new ATOM 0 HA3 GLY A 943 -3.311 23.483 -12.723 1.00 0.00 H new ATOM 389 N GLY A 944 -3.192 20.372 -13.005 1.00 0.00 N ATOM 390 CA GLY A 944 -3.211 19.259 -13.942 1.00 0.00 C ATOM 391 C GLY A 944 -4.111 18.181 -13.398 1.00 0.00 C ATOM 392 O GLY A 944 -4.711 18.399 -12.342 1.00 0.00 O ATOM 0 H GLY A 944 -2.621 20.228 -12.172 1.00 0.00 H new ATOM 0 HA2 GLY A 944 -3.568 19.592 -14.916 1.00 0.00 H new ATOM 0 HA3 GLY A 944 -2.203 18.871 -14.087 1.00 0.00 H new ATOM 396 N ASP A 945 -4.266 17.038 -14.045 1.00 0.00 N ATOM 397 CA ASP A 945 -5.003 15.948 -13.438 1.00 0.00 C ATOM 398 C ASP A 945 -4.038 14.780 -13.304 1.00 0.00 C ATOM 399 O ASP A 945 -2.989 14.781 -13.949 1.00 0.00 O ATOM 400 CB ASP A 945 -6.221 15.564 -14.291 1.00 0.00 C ATOM 401 CG ASP A 945 -7.058 14.470 -13.662 1.00 0.00 C ATOM 402 OD1 ASP A 945 -7.579 14.677 -12.547 1.00 0.00 O ATOM 403 OD2 ASP A 945 -7.218 13.397 -14.280 1.00 0.00 O ATOM 0 H ASP A 945 -3.897 16.844 -14.976 1.00 0.00 H new ATOM 0 HA ASP A 945 -5.389 16.241 -12.461 1.00 0.00 H new ATOM 0 HB2 ASP A 945 -6.842 16.446 -14.447 1.00 0.00 H new ATOM 0 HB3 ASP A 945 -5.882 15.236 -15.273 1.00 0.00 H new ATOM 408 N TRP A 946 -4.378 13.809 -12.484 1.00 0.00 N ATOM 409 CA TRP A 946 -3.489 12.722 -12.143 1.00 0.00 C ATOM 410 C TRP A 946 -3.146 11.849 -13.339 1.00 0.00 C ATOM 411 O TRP A 946 -4.013 11.443 -14.124 1.00 0.00 O ATOM 412 CB TRP A 946 -4.128 11.882 -11.056 1.00 0.00 C ATOM 413 CG TRP A 946 -4.651 12.703 -9.949 1.00 0.00 C ATOM 414 CD1 TRP A 946 -5.935 13.069 -9.728 1.00 0.00 C ATOM 415 CD2 TRP A 946 -3.875 13.290 -8.923 1.00 0.00 C ATOM 416 NE1 TRP A 946 -6.000 13.831 -8.602 1.00 0.00 N ATOM 417 CE2 TRP A 946 -4.751 13.985 -8.090 1.00 0.00 C ATOM 418 CE3 TRP A 946 -2.521 13.284 -8.629 1.00 0.00 C ATOM 419 CZ2 TRP A 946 -4.318 14.673 -6.973 1.00 0.00 C ATOM 420 CZ3 TRP A 946 -2.090 13.969 -7.528 1.00 0.00 C ATOM 421 CH2 TRP A 946 -2.981 14.654 -6.711 1.00 0.00 C ATOM 0 H TRP A 946 -5.290 13.753 -12.031 1.00 0.00 H new ATOM 0 HA TRP A 946 -2.553 13.156 -11.791 1.00 0.00 H new ATOM 0 HB2 TRP A 946 -4.940 11.294 -11.484 1.00 0.00 H new ATOM 0 HB3 TRP A 946 -3.394 11.176 -10.667 1.00 0.00 H new ATOM 0 HD1 TRP A 946 -6.777 12.799 -10.348 1.00 0.00 H new ATOM 0 HE1 TRP A 946 -6.853 14.225 -8.205 1.00 0.00 H new ATOM 0 HE3 TRP A 946 -1.822 12.750 -9.256 1.00 0.00 H new ATOM 0 HZ2 TRP A 946 -5.010 15.203 -6.335 1.00 0.00 H new ATOM 0 HZ3 TRP A 946 -1.037 13.978 -7.288 1.00 0.00 H new ATOM 0 HH2 TRP A 946 -2.605 15.184 -5.848 1.00 0.00 H new ATOM 432 N LYS A 947 -1.877 11.539 -13.423 1.00 0.00 N ATOM 433 CA LYS A 947 -1.282 10.698 -14.440 1.00 0.00 C ATOM 434 C LYS A 947 -0.294 9.850 -13.661 1.00 0.00 C ATOM 435 O LYS A 947 -0.143 10.125 -12.475 1.00 0.00 O ATOM 436 CB LYS A 947 -0.552 11.552 -15.487 1.00 0.00 C ATOM 437 CG LYS A 947 -1.445 12.549 -16.196 1.00 0.00 C ATOM 438 CD LYS A 947 -0.674 13.379 -17.203 1.00 0.00 C ATOM 439 CE LYS A 947 -1.540 14.487 -17.770 1.00 0.00 C ATOM 440 NZ LYS A 947 -0.846 15.251 -18.833 1.00 0.00 N ATOM 0 H LYS A 947 -1.192 11.883 -12.750 1.00 0.00 H new ATOM 0 HA LYS A 947 -2.015 10.106 -14.987 1.00 0.00 H new ATOM 0 HB2 LYS A 947 0.261 12.090 -15.000 1.00 0.00 H new ATOM 0 HB3 LYS A 947 -0.100 10.893 -16.228 1.00 0.00 H new ATOM 0 HG2 LYS A 947 -2.251 12.019 -16.703 1.00 0.00 H new ATOM 0 HG3 LYS A 947 -1.909 13.207 -15.462 1.00 0.00 H new ATOM 0 HD2 LYS A 947 0.207 13.809 -16.727 1.00 0.00 H new ATOM 0 HD3 LYS A 947 -0.320 12.740 -18.011 1.00 0.00 H new ATOM 0 HE2 LYS A 947 -2.458 14.058 -18.173 1.00 0.00 H new ATOM 0 HE3 LYS A 947 -1.830 15.165 -16.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 947 -1.475 15.998 -19.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 947 0.016 15.682 -18.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 947 -0.591 14.610 -19.611 1.00 0.00 H new ATOM 454 N PRO A 948 0.354 8.818 -14.227 1.00 0.00 N ATOM 455 CA PRO A 948 1.360 8.049 -13.483 1.00 0.00 C ATOM 456 C PRO A 948 2.407 8.978 -12.869 1.00 0.00 C ATOM 457 O PRO A 948 3.013 9.791 -13.573 1.00 0.00 O ATOM 458 CB PRO A 948 1.973 7.147 -14.557 1.00 0.00 C ATOM 459 CG PRO A 948 0.881 6.988 -15.558 1.00 0.00 C ATOM 460 CD PRO A 948 0.163 8.304 -15.587 1.00 0.00 C ATOM 0 HA PRO A 948 0.945 7.487 -12.647 1.00 0.00 H new ATOM 0 HB2 PRO A 948 2.859 7.600 -15.001 1.00 0.00 H new ATOM 0 HB3 PRO A 948 2.280 6.186 -14.144 1.00 0.00 H new ATOM 0 HG2 PRO A 948 1.283 6.740 -16.540 1.00 0.00 H new ATOM 0 HG3 PRO A 948 0.206 6.180 -15.276 1.00 0.00 H new ATOM 0 HD2 PRO A 948 0.584 8.976 -16.335 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -0.893 8.182 -15.827 1.00 0.00 H new ATOM 468 N ALA A 949 2.562 8.867 -11.554 1.00 0.00 N ATOM 469 CA ALA A 949 3.431 9.746 -10.766 1.00 0.00 C ATOM 470 C ALA A 949 4.852 9.864 -11.293 1.00 0.00 C ATOM 471 O ALA A 949 5.277 10.911 -11.791 1.00 0.00 O ATOM 472 CB ALA A 949 3.465 9.283 -9.323 1.00 0.00 C ATOM 0 H ALA A 949 2.085 8.159 -10.996 1.00 0.00 H new ATOM 0 HA ALA A 949 2.993 10.741 -10.847 1.00 0.00 H new ATOM 0 HB1 ALA A 949 4.113 9.942 -8.745 1.00 0.00 H new ATOM 0 HB2 ALA A 949 2.457 9.310 -8.908 1.00 0.00 H new ATOM 0 HB3 ALA A 949 3.849 8.264 -9.277 1.00 0.00 H new ATOM 478 N GLU A 950 5.562 8.781 -11.185 1.00 0.00 N ATOM 479 CA GLU A 950 6.973 8.721 -11.475 1.00 0.00 C ATOM 480 C GLU A 950 7.298 7.248 -11.504 1.00 0.00 C ATOM 481 O GLU A 950 7.898 6.712 -12.435 1.00 0.00 O ATOM 482 CB GLU A 950 7.738 9.506 -10.371 1.00 0.00 C ATOM 483 CG GLU A 950 7.333 9.129 -8.939 1.00 0.00 C ATOM 484 CD GLU A 950 7.782 10.115 -7.889 1.00 0.00 C ATOM 485 OE1 GLU A 950 8.982 10.140 -7.554 1.00 0.00 O ATOM 486 OE2 GLU A 950 6.915 10.847 -7.345 1.00 0.00 O ATOM 0 H GLU A 950 5.170 7.888 -10.885 1.00 0.00 H new ATOM 0 HA GLU A 950 7.261 9.178 -12.422 1.00 0.00 H new ATOM 0 HB2 GLU A 950 8.807 9.333 -10.492 1.00 0.00 H new ATOM 0 HB3 GLU A 950 7.569 10.573 -10.516 1.00 0.00 H new ATOM 0 HG2 GLU A 950 6.248 9.035 -8.893 1.00 0.00 H new ATOM 0 HG3 GLU A 950 7.748 8.149 -8.702 1.00 0.00 H new ATOM 493 N ASP A 951 6.859 6.627 -10.442 1.00 0.00 N ATOM 494 CA ASP A 951 6.851 5.203 -10.261 1.00 0.00 C ATOM 495 C ASP A 951 5.464 4.902 -9.757 1.00 0.00 C ATOM 496 O ASP A 951 5.013 5.564 -8.818 1.00 0.00 O ATOM 497 CB ASP A 951 7.922 4.759 -9.253 1.00 0.00 C ATOM 498 CG ASP A 951 9.332 5.068 -9.723 1.00 0.00 C ATOM 499 OD1 ASP A 951 9.876 4.329 -10.568 1.00 0.00 O ATOM 500 OD2 ASP A 951 9.937 6.057 -9.257 1.00 0.00 O ATOM 0 H ASP A 951 6.478 7.128 -9.639 1.00 0.00 H new ATOM 0 HA ASP A 951 7.083 4.667 -11.181 1.00 0.00 H new ATOM 0 HB2 ASP A 951 7.745 5.255 -8.299 1.00 0.00 H new ATOM 0 HB3 ASP A 951 7.828 3.687 -9.078 1.00 0.00 H new ATOM 505 N THR A 952 4.762 4.005 -10.410 1.00 0.00 N ATOM 506 CA THR A 952 3.382 3.734 -10.063 1.00 0.00 C ATOM 507 C THR A 952 3.260 3.117 -8.667 1.00 0.00 C ATOM 508 O THR A 952 2.615 3.692 -7.790 1.00 0.00 O ATOM 509 CB THR A 952 2.725 2.822 -11.117 1.00 0.00 C ATOM 510 OG1 THR A 952 2.981 3.356 -12.429 1.00 0.00 O ATOM 511 CG2 THR A 952 1.218 2.742 -10.900 1.00 0.00 C ATOM 0 H THR A 952 5.122 3.449 -11.186 1.00 0.00 H new ATOM 0 HA THR A 952 2.855 4.688 -10.049 1.00 0.00 H new ATOM 0 HB THR A 952 3.147 1.821 -11.023 1.00 0.00 H new ATOM 0 HG1 THR A 952 2.567 2.779 -13.104 1.00 0.00 H new ATOM 0 HG21 THR A 952 0.776 2.093 -11.656 1.00 0.00 H new ATOM 0 HG22 THR A 952 1.014 2.337 -9.909 1.00 0.00 H new ATOM 0 HG23 THR A 952 0.785 3.739 -10.980 1.00 0.00 H new ATOM 519 N TYR A 953 3.895 1.987 -8.448 1.00 0.00 N ATOM 520 CA TYR A 953 3.814 1.330 -7.161 1.00 0.00 C ATOM 521 C TYR A 953 5.062 1.564 -6.344 1.00 0.00 C ATOM 522 O TYR A 953 6.169 1.385 -6.832 1.00 0.00 O ATOM 523 CB TYR A 953 3.478 -0.149 -7.336 1.00 0.00 C ATOM 524 CG TYR A 953 2.040 -0.300 -7.760 1.00 0.00 C ATOM 525 CD1 TYR A 953 1.034 -0.266 -6.809 1.00 0.00 C ATOM 526 CD2 TYR A 953 1.680 -0.400 -9.095 1.00 0.00 C ATOM 527 CE1 TYR A 953 -0.289 -0.322 -7.171 1.00 0.00 C ATOM 528 CE2 TYR A 953 0.352 -0.473 -9.464 1.00 0.00 C ATOM 529 CZ TYR A 953 -0.627 -0.428 -8.495 1.00 0.00 C ATOM 530 OH TYR A 953 -1.949 -0.467 -8.853 1.00 0.00 O ATOM 0 H TYR A 953 4.470 1.506 -9.139 1.00 0.00 H new ATOM 0 HA TYR A 953 2.998 1.773 -6.591 1.00 0.00 H new ATOM 0 HB2 TYR A 953 4.135 -0.595 -8.083 1.00 0.00 H new ATOM 0 HB3 TYR A 953 3.649 -0.683 -6.401 1.00 0.00 H new ATOM 0 HD1 TYR A 953 1.295 -0.194 -5.763 1.00 0.00 H new ATOM 0 HD2 TYR A 953 2.447 -0.421 -9.855 1.00 0.00 H new ATOM 0 HE1 TYR A 953 -1.060 -0.283 -6.416 1.00 0.00 H new ATOM 0 HE2 TYR A 953 0.082 -0.565 -10.506 1.00 0.00 H new ATOM 0 HH TYR A 953 -2.022 -0.542 -9.827 1.00 0.00 H new ATOM 540 N THR A 954 4.880 1.940 -5.089 1.00 0.00 N ATOM 541 CA THR A 954 5.990 2.348 -4.240 1.00 0.00 C ATOM 542 C THR A 954 5.791 1.858 -2.821 1.00 0.00 C ATOM 543 O THR A 954 4.744 1.303 -2.463 1.00 0.00 O ATOM 544 CB THR A 954 6.148 3.890 -4.172 1.00 0.00 C ATOM 545 OG1 THR A 954 4.972 4.493 -3.599 1.00 0.00 O ATOM 546 CG2 THR A 954 6.431 4.502 -5.540 1.00 0.00 C ATOM 0 H THR A 954 3.969 1.972 -4.632 1.00 0.00 H new ATOM 0 HA THR A 954 6.882 1.909 -4.688 1.00 0.00 H new ATOM 0 HB THR A 954 7.008 4.094 -3.534 1.00 0.00 H new ATOM 0 HG1 THR A 954 5.019 4.438 -2.622 1.00 0.00 H new ATOM 0 HG21 THR A 954 6.534 5.583 -5.441 1.00 0.00 H new ATOM 0 HG22 THR A 954 7.355 4.085 -5.941 1.00 0.00 H new ATOM 0 HG23 THR A 954 5.607 4.276 -6.217 1.00 0.00 H new ATOM 554 N ASP A 955 6.785 2.158 -2.022 1.00 0.00 N ATOM 555 CA ASP A 955 6.806 1.907 -0.603 1.00 0.00 C ATOM 556 C ASP A 955 6.477 3.246 0.047 1.00 0.00 C ATOM 557 O ASP A 955 6.387 4.248 -0.679 1.00 0.00 O ATOM 558 CB ASP A 955 8.220 1.417 -0.235 1.00 0.00 C ATOM 559 CG ASP A 955 8.514 1.340 1.249 1.00 0.00 C ATOM 560 OD1 ASP A 955 8.992 2.349 1.817 1.00 0.00 O ATOM 561 OD2 ASP A 955 8.317 0.272 1.852 1.00 0.00 O ATOM 0 H ASP A 955 7.639 2.603 -2.358 1.00 0.00 H new ATOM 0 HA ASP A 955 6.096 1.148 -0.273 1.00 0.00 H new ATOM 0 HB2 ASP A 955 8.368 0.428 -0.670 1.00 0.00 H new ATOM 0 HB3 ASP A 955 8.949 2.082 -0.699 1.00 0.00 H new ATOM 566 N ALA A 956 6.258 3.277 1.353 1.00 0.00 N ATOM 567 CA ALA A 956 6.005 4.530 2.071 1.00 0.00 C ATOM 568 C ALA A 956 7.069 5.576 1.761 1.00 0.00 C ATOM 569 O ALA A 956 6.748 6.751 1.566 1.00 0.00 O ATOM 570 CB ALA A 956 5.933 4.281 3.569 1.00 0.00 C ATOM 0 H ALA A 956 6.249 2.447 1.945 1.00 0.00 H new ATOM 0 HA ALA A 956 5.045 4.917 1.730 1.00 0.00 H new ATOM 0 HB1 ALA A 956 5.745 5.222 4.086 1.00 0.00 H new ATOM 0 HB2 ALA A 956 5.125 3.581 3.783 1.00 0.00 H new ATOM 0 HB3 ALA A 956 6.878 3.861 3.914 1.00 0.00 H new ATOM 576 N ASN A 957 8.304 5.128 1.599 1.00 0.00 N ATOM 577 CA ASN A 957 9.403 6.034 1.291 1.00 0.00 C ATOM 578 C ASN A 957 9.348 6.471 -0.175 1.00 0.00 C ATOM 579 O ASN A 957 9.568 7.642 -0.503 1.00 0.00 O ATOM 580 CB ASN A 957 10.759 5.395 1.615 1.00 0.00 C ATOM 581 CG ASN A 957 10.941 5.106 3.098 1.00 0.00 C ATOM 582 OD1 ASN A 957 10.368 5.782 3.960 1.00 0.00 O ATOM 583 ND2 ASN A 957 11.764 4.133 3.421 1.00 0.00 N ATOM 0 H ASN A 957 8.572 4.147 1.675 1.00 0.00 H new ATOM 0 HA ASN A 957 9.293 6.918 1.919 1.00 0.00 H new ATOM 0 HB2 ASN A 957 10.860 4.466 1.054 1.00 0.00 H new ATOM 0 HB3 ASN A 957 11.556 6.058 1.279 1.00 0.00 H new ATOM 0 HD21 ASN A 957 11.942 3.921 4.403 1.00 0.00 H new ATOM 0 HD22 ASN A 957 12.224 3.590 2.690 1.00 0.00 H new ATOM 590 N GLY A 958 9.017 5.537 -1.059 1.00 0.00 N ATOM 591 CA GLY A 958 8.935 5.856 -2.470 1.00 0.00 C ATOM 592 C GLY A 958 9.628 4.839 -3.316 1.00 0.00 C ATOM 593 O GLY A 958 9.602 4.933 -4.540 1.00 0.00 O ATOM 0 H GLY A 958 8.805 4.567 -0.824 1.00 0.00 H new ATOM 0 HA2 GLY A 958 7.888 5.921 -2.766 1.00 0.00 H new ATOM 0 HA3 GLY A 958 9.378 6.836 -2.646 1.00 0.00 H new ATOM 597 N ASP A 959 10.306 3.918 -2.660 1.00 0.00 N ATOM 598 CA ASP A 959 10.974 2.818 -3.336 1.00 0.00 C ATOM 599 C ASP A 959 9.958 2.032 -4.128 1.00 0.00 C ATOM 600 O ASP A 959 9.086 1.388 -3.548 1.00 0.00 O ATOM 601 CB ASP A 959 11.667 1.894 -2.334 1.00 0.00 C ATOM 602 CG ASP A 959 12.711 2.613 -1.522 1.00 0.00 C ATOM 603 OD1 ASP A 959 12.352 3.194 -0.475 1.00 0.00 O ATOM 604 OD2 ASP A 959 13.890 2.628 -1.921 1.00 0.00 O ATOM 0 H ASP A 959 10.411 3.909 -1.645 1.00 0.00 H new ATOM 0 HA ASP A 959 11.733 3.230 -4.001 1.00 0.00 H new ATOM 0 HB2 ASP A 959 10.922 1.463 -1.665 1.00 0.00 H new ATOM 0 HB3 ASP A 959 12.132 1.066 -2.868 1.00 0.00 H new ATOM 609 N LYS A 960 9.989 2.215 -5.436 1.00 0.00 N ATOM 610 CA LYS A 960 9.121 1.478 -6.341 1.00 0.00 C ATOM 611 C LYS A 960 9.190 -0.022 -6.084 1.00 0.00 C ATOM 612 O LYS A 960 10.266 -0.627 -6.056 1.00 0.00 O ATOM 613 CB LYS A 960 9.437 1.786 -7.808 1.00 0.00 C ATOM 614 CG LYS A 960 8.637 0.945 -8.799 1.00 0.00 C ATOM 615 CD LYS A 960 8.870 1.309 -10.263 1.00 0.00 C ATOM 616 CE LYS A 960 10.304 1.086 -10.748 1.00 0.00 C ATOM 617 NZ LYS A 960 11.273 2.083 -10.225 1.00 0.00 N ATOM 0 H LYS A 960 10.613 2.875 -5.900 1.00 0.00 H new ATOM 0 HA LYS A 960 8.102 1.810 -6.141 1.00 0.00 H new ATOM 0 HB2 LYS A 960 9.240 2.841 -7.999 1.00 0.00 H new ATOM 0 HB3 LYS A 960 10.501 1.623 -7.983 1.00 0.00 H new ATOM 0 HG2 LYS A 960 8.890 -0.105 -8.653 1.00 0.00 H new ATOM 0 HG3 LYS A 960 7.576 1.052 -8.575 1.00 0.00 H new ATOM 0 HD2 LYS A 960 8.194 0.721 -10.883 1.00 0.00 H new ATOM 0 HD3 LYS A 960 8.608 2.357 -10.411 1.00 0.00 H new ATOM 0 HE2 LYS A 960 10.627 0.088 -10.452 1.00 0.00 H new ATOM 0 HE3 LYS A 960 10.318 1.115 -11.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 960 11.931 2.357 -10.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 960 10.760 2.924 -9.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 960 11.807 1.667 -9.436 1.00 0.00 H new ATOM 631 N ALA A 961 8.025 -0.596 -5.921 1.00 0.00 N ATOM 632 CA ALA A 961 7.866 -1.998 -5.619 1.00 0.00 C ATOM 633 C ALA A 961 7.155 -2.653 -6.786 1.00 0.00 C ATOM 634 O ALA A 961 6.976 -2.023 -7.833 1.00 0.00 O ATOM 635 CB ALA A 961 7.064 -2.157 -4.335 1.00 0.00 C ATOM 0 H ALA A 961 7.141 -0.092 -5.996 1.00 0.00 H new ATOM 0 HA ALA A 961 8.835 -2.474 -5.470 1.00 0.00 H new ATOM 0 HB1 ALA A 961 6.945 -3.217 -4.109 1.00 0.00 H new ATOM 0 HB2 ALA A 961 7.589 -1.668 -3.515 1.00 0.00 H new ATOM 0 HB3 ALA A 961 6.082 -1.701 -4.460 1.00 0.00 H new ATOM 641 N ALA A 962 6.778 -3.902 -6.642 1.00 0.00 N ATOM 642 CA ALA A 962 6.035 -4.565 -7.689 1.00 0.00 C ATOM 643 C ALA A 962 4.564 -4.196 -7.578 1.00 0.00 C ATOM 644 O ALA A 962 4.099 -3.758 -6.528 1.00 0.00 O ATOM 645 CB ALA A 962 6.217 -6.071 -7.614 1.00 0.00 C ATOM 0 H ALA A 962 6.970 -4.475 -5.820 1.00 0.00 H new ATOM 0 HA ALA A 962 6.415 -4.234 -8.655 1.00 0.00 H new ATOM 0 HB1 ALA A 962 5.648 -6.547 -8.413 1.00 0.00 H new ATOM 0 HB2 ALA A 962 7.273 -6.316 -7.726 1.00 0.00 H new ATOM 0 HB3 ALA A 962 5.861 -6.433 -6.650 1.00 0.00 H new ATOM 651 N SER A 963 3.846 -4.355 -8.661 1.00 0.00 N ATOM 652 CA SER A 963 2.435 -4.107 -8.704 1.00 0.00 C ATOM 653 C SER A 963 1.712 -5.315 -8.128 1.00 0.00 C ATOM 654 O SER A 963 2.243 -6.413 -8.190 1.00 0.00 O ATOM 655 CB SER A 963 2.054 -3.877 -10.155 1.00 0.00 C ATOM 656 OG SER A 963 3.039 -4.451 -11.006 1.00 0.00 O ATOM 0 H SER A 963 4.236 -4.666 -9.551 1.00 0.00 H new ATOM 0 HA SER A 963 2.158 -3.232 -8.117 1.00 0.00 H new ATOM 0 HB2 SER A 963 1.080 -4.320 -10.360 1.00 0.00 H new ATOM 0 HB3 SER A 963 1.966 -2.809 -10.353 1.00 0.00 H new ATOM 0 HG SER A 963 2.820 -5.392 -11.172 1.00 0.00 H new ATOM 662 N PRO A 964 0.518 -5.121 -7.554 1.00 0.00 N ATOM 663 CA PRO A 964 -0.285 -6.182 -6.923 1.00 0.00 C ATOM 664 C PRO A 964 -0.394 -7.480 -7.735 1.00 0.00 C ATOM 665 O PRO A 964 -0.388 -8.568 -7.169 1.00 0.00 O ATOM 666 CB PRO A 964 -1.670 -5.555 -6.757 1.00 0.00 C ATOM 667 CG PRO A 964 -1.577 -4.145 -7.250 1.00 0.00 C ATOM 668 CD PRO A 964 -0.118 -3.816 -7.414 1.00 0.00 C ATOM 0 HA PRO A 964 0.188 -6.494 -5.992 1.00 0.00 H new ATOM 0 HB2 PRO A 964 -2.416 -6.113 -7.324 1.00 0.00 H new ATOM 0 HB3 PRO A 964 -1.981 -5.578 -5.712 1.00 0.00 H new ATOM 0 HG2 PRO A 964 -2.103 -4.035 -8.198 1.00 0.00 H new ATOM 0 HG3 PRO A 964 -2.047 -3.461 -6.544 1.00 0.00 H new ATOM 0 HD2 PRO A 964 0.055 -3.190 -8.290 1.00 0.00 H new ATOM 0 HD3 PRO A 964 0.269 -3.272 -6.552 1.00 0.00 H new ATOM 676 N SER A 965 -0.451 -7.370 -9.050 1.00 0.00 N ATOM 677 CA SER A 965 -0.562 -8.547 -9.894 1.00 0.00 C ATOM 678 C SER A 965 0.797 -9.256 -9.957 1.00 0.00 C ATOM 679 O SER A 965 0.898 -10.467 -9.764 1.00 0.00 O ATOM 680 CB SER A 965 -1.063 -8.128 -11.270 1.00 0.00 C ATOM 681 OG SER A 965 -2.267 -7.380 -11.143 1.00 0.00 O ATOM 0 H SER A 965 -0.423 -6.484 -9.555 1.00 0.00 H new ATOM 0 HA SER A 965 -1.281 -9.255 -9.481 1.00 0.00 H new ATOM 0 HB2 SER A 965 -0.305 -7.529 -11.775 1.00 0.00 H new ATOM 0 HB3 SER A 965 -1.236 -9.010 -11.887 1.00 0.00 H new ATOM 0 HG SER A 965 -2.582 -7.113 -12.032 1.00 0.00 H new ATOM 687 N GLU A 966 1.840 -8.466 -10.186 1.00 0.00 N ATOM 688 CA GLU A 966 3.230 -8.925 -10.175 1.00 0.00 C ATOM 689 C GLU A 966 3.708 -9.309 -8.769 1.00 0.00 C ATOM 690 O GLU A 966 4.815 -9.826 -8.604 1.00 0.00 O ATOM 691 CB GLU A 966 4.162 -7.841 -10.726 1.00 0.00 C ATOM 692 CG GLU A 966 4.122 -7.622 -12.235 1.00 0.00 C ATOM 693 CD GLU A 966 2.763 -7.260 -12.796 1.00 0.00 C ATOM 694 OE1 GLU A 966 2.011 -6.507 -12.145 1.00 0.00 O ATOM 695 OE2 GLU A 966 2.425 -7.733 -13.899 1.00 0.00 O ATOM 0 H GLU A 966 1.745 -7.471 -10.388 1.00 0.00 H new ATOM 0 HA GLU A 966 3.264 -9.812 -10.807 1.00 0.00 H new ATOM 0 HB2 GLU A 966 3.918 -6.898 -10.236 1.00 0.00 H new ATOM 0 HB3 GLU A 966 5.184 -8.092 -10.443 1.00 0.00 H new ATOM 0 HG2 GLU A 966 4.826 -6.830 -12.490 1.00 0.00 H new ATOM 0 HG3 GLU A 966 4.471 -8.530 -12.728 1.00 0.00 H new ATOM 702 N LEU A 967 2.876 -9.085 -7.773 1.00 0.00 N ATOM 703 CA LEU A 967 3.220 -9.368 -6.395 1.00 0.00 C ATOM 704 C LEU A 967 2.803 -10.783 -6.028 1.00 0.00 C ATOM 705 O LEU A 967 1.616 -11.124 -6.060 1.00 0.00 O ATOM 706 CB LEU A 967 2.581 -8.318 -5.479 1.00 0.00 C ATOM 707 CG LEU A 967 3.434 -7.063 -5.257 1.00 0.00 C ATOM 708 CD1 LEU A 967 2.655 -5.999 -4.509 1.00 0.00 C ATOM 709 CD2 LEU A 967 4.695 -7.418 -4.486 1.00 0.00 C ATOM 0 H LEU A 967 1.939 -8.700 -7.897 1.00 0.00 H new ATOM 0 HA LEU A 967 4.301 -9.309 -6.264 1.00 0.00 H new ATOM 0 HB2 LEU A 967 1.622 -8.020 -5.903 1.00 0.00 H new ATOM 0 HB3 LEU A 967 2.373 -8.776 -4.512 1.00 0.00 H new ATOM 0 HG LEU A 967 3.708 -6.664 -6.233 1.00 0.00 H new ATOM 0 HD11 LEU A 967 3.284 -5.121 -4.366 1.00 0.00 H new ATOM 0 HD12 LEU A 967 1.772 -5.723 -5.085 1.00 0.00 H new ATOM 0 HD13 LEU A 967 2.348 -6.388 -3.538 1.00 0.00 H new ATOM 0 HD21 LEU A 967 5.293 -6.520 -4.334 1.00 0.00 H new ATOM 0 HD22 LEU A 967 4.423 -7.841 -3.519 1.00 0.00 H new ATOM 0 HD23 LEU A 967 5.274 -8.148 -5.052 1.00 0.00 H new ATOM 721 N THR A 968 3.781 -11.622 -5.745 1.00 0.00 N ATOM 722 CA THR A 968 3.518 -12.998 -5.392 1.00 0.00 C ATOM 723 C THR A 968 3.984 -13.302 -3.973 1.00 0.00 C ATOM 724 O THR A 968 4.619 -12.463 -3.318 1.00 0.00 O ATOM 725 CB THR A 968 4.158 -13.972 -6.404 1.00 0.00 C ATOM 726 OG1 THR A 968 5.550 -13.677 -6.585 1.00 0.00 O ATOM 727 CG2 THR A 968 3.443 -13.909 -7.747 1.00 0.00 C ATOM 0 H THR A 968 4.769 -11.370 -5.754 1.00 0.00 H new ATOM 0 HA THR A 968 2.438 -13.144 -5.429 1.00 0.00 H new ATOM 0 HB THR A 968 4.059 -14.979 -6.000 1.00 0.00 H new ATOM 0 HG1 THR A 968 5.937 -14.307 -7.229 1.00 0.00 H new ATOM 0 HG21 THR A 968 3.913 -14.604 -8.442 1.00 0.00 H new ATOM 0 HG22 THR A 968 2.396 -14.180 -7.615 1.00 0.00 H new ATOM 0 HG23 THR A 968 3.508 -12.897 -8.147 1.00 0.00 H new ATOM 735 N CYS A 969 3.666 -14.488 -3.490 1.00 0.00 N ATOM 736 CA CYS A 969 4.025 -14.873 -2.143 1.00 0.00 C ATOM 737 C CYS A 969 5.330 -15.668 -2.120 1.00 0.00 C ATOM 738 O CYS A 969 5.602 -16.469 -3.021 1.00 0.00 O ATOM 739 CB CYS A 969 2.880 -15.651 -1.501 1.00 0.00 C ATOM 740 SG CYS A 969 2.209 -16.971 -2.533 1.00 0.00 S ATOM 0 H CYS A 969 3.159 -15.201 -4.014 1.00 0.00 H new ATOM 0 HA CYS A 969 4.196 -13.970 -1.557 1.00 0.00 H new ATOM 0 HB2 CYS A 969 3.230 -16.081 -0.563 1.00 0.00 H new ATOM 0 HB3 CYS A 969 2.078 -14.956 -1.253 1.00 0.00 H new ATOM 0 HG CYS A 969 0.998 -16.666 -2.895 1.00 0.00 H new ATOM 746 N PRO A 970 6.165 -15.425 -1.104 1.00 0.00 N ATOM 747 CA PRO A 970 7.469 -16.082 -0.956 1.00 0.00 C ATOM 748 C PRO A 970 7.369 -17.448 -0.266 1.00 0.00 C ATOM 749 O PRO A 970 6.300 -17.805 0.238 1.00 0.00 O ATOM 750 CB PRO A 970 8.198 -15.089 -0.058 1.00 0.00 C ATOM 751 CG PRO A 970 7.141 -14.592 0.849 1.00 0.00 C ATOM 752 CD PRO A 970 5.910 -14.473 -0.004 1.00 0.00 C ATOM 0 HA PRO A 970 7.952 -16.294 -1.910 1.00 0.00 H new ATOM 0 HB2 PRO A 970 9.006 -15.568 0.494 1.00 0.00 H new ATOM 0 HB3 PRO A 970 8.643 -14.279 -0.636 1.00 0.00 H new ATOM 0 HG2 PRO A 970 6.979 -15.280 1.679 1.00 0.00 H new ATOM 0 HG3 PRO A 970 7.414 -13.630 1.281 1.00 0.00 H new ATOM 0 HD2 PRO A 970 5.009 -14.733 0.552 1.00 0.00 H new ATOM 0 HD3 PRO A 970 5.774 -13.457 -0.375 1.00 0.00 H new ATOM 760 N PRO A 971 8.464 -18.244 -0.245 1.00 0.00 N ATOM 761 CA PRO A 971 8.489 -19.512 0.487 1.00 0.00 C ATOM 762 C PRO A 971 8.341 -19.265 1.983 1.00 0.00 C ATOM 763 O PRO A 971 9.266 -18.785 2.655 1.00 0.00 O ATOM 764 CB PRO A 971 9.864 -20.112 0.172 1.00 0.00 C ATOM 765 CG PRO A 971 10.361 -19.360 -1.013 1.00 0.00 C ATOM 766 CD PRO A 971 9.740 -17.995 -0.938 1.00 0.00 C ATOM 0 HA PRO A 971 7.673 -20.175 0.199 1.00 0.00 H new ATOM 0 HB2 PRO A 971 10.543 -20.005 1.018 1.00 0.00 H new ATOM 0 HB3 PRO A 971 9.788 -21.178 -0.043 1.00 0.00 H new ATOM 0 HG2 PRO A 971 11.449 -19.293 -1.003 1.00 0.00 H new ATOM 0 HG3 PRO A 971 10.081 -19.864 -1.938 1.00 0.00 H new ATOM 0 HD2 PRO A 971 10.369 -17.296 -0.386 1.00 0.00 H new ATOM 0 HD3 PRO A 971 9.584 -17.569 -1.929 1.00 0.00 H new ATOM 774 N GLY A 972 7.154 -19.509 2.485 1.00 0.00 N ATOM 775 CA GLY A 972 6.885 -19.273 3.873 1.00 0.00 C ATOM 776 C GLY A 972 5.681 -18.381 4.041 1.00 0.00 C ATOM 777 O GLY A 972 5.194 -18.197 5.143 1.00 0.00 O ATOM 0 H GLY A 972 6.364 -19.870 1.950 1.00 0.00 H new ATOM 0 HA2 GLY A 972 6.714 -20.222 4.381 1.00 0.00 H new ATOM 0 HA3 GLY A 972 7.753 -18.812 4.343 1.00 0.00 H new ATOM 781 N TRP A 973 5.165 -17.849 2.944 1.00 0.00 N ATOM 782 CA TRP A 973 4.044 -16.940 3.016 1.00 0.00 C ATOM 783 C TRP A 973 3.002 -17.262 1.962 1.00 0.00 C ATOM 784 O TRP A 973 3.306 -17.608 0.826 1.00 0.00 O ATOM 785 CB TRP A 973 4.492 -15.472 3.001 1.00 0.00 C ATOM 786 CG TRP A 973 5.141 -15.055 4.290 1.00 0.00 C ATOM 787 CD1 TRP A 973 6.479 -15.007 4.553 1.00 0.00 C ATOM 788 CD2 TRP A 973 4.481 -14.675 5.507 1.00 0.00 C ATOM 789 NE1 TRP A 973 6.686 -14.599 5.848 1.00 0.00 N ATOM 790 CE2 TRP A 973 5.477 -14.389 6.453 1.00 0.00 C ATOM 791 CE3 TRP A 973 3.148 -14.542 5.889 1.00 0.00 C ATOM 792 CZ2 TRP A 973 5.179 -13.979 7.752 1.00 0.00 C ATOM 793 CZ3 TRP A 973 2.849 -14.148 7.185 1.00 0.00 C ATOM 794 CH2 TRP A 973 3.863 -13.872 8.103 1.00 0.00 C ATOM 0 H TRP A 973 5.506 -18.033 2.000 1.00 0.00 H new ATOM 0 HA TRP A 973 3.558 -17.087 3.980 1.00 0.00 H new ATOM 0 HB2 TRP A 973 5.191 -15.317 2.179 1.00 0.00 H new ATOM 0 HB3 TRP A 973 3.629 -14.834 2.810 1.00 0.00 H new ATOM 0 HD1 TRP A 973 7.259 -15.253 3.848 1.00 0.00 H new ATOM 0 HE1 TRP A 973 7.597 -14.473 6.289 1.00 0.00 H new ATOM 0 HE3 TRP A 973 2.356 -14.744 5.183 1.00 0.00 H new ATOM 0 HZ2 TRP A 973 5.964 -13.753 8.459 1.00 0.00 H new ATOM 0 HZ3 TRP A 973 1.817 -14.054 7.488 1.00 0.00 H new ATOM 0 HH2 TRP A 973 3.603 -13.569 9.107 1.00 0.00 H new ATOM 805 N GLU A 974 1.778 -17.187 2.402 1.00 0.00 N ATOM 806 CA GLU A 974 0.587 -17.603 1.703 1.00 0.00 C ATOM 807 C GLU A 974 -0.432 -16.464 1.738 1.00 0.00 C ATOM 808 O GLU A 974 -0.440 -15.682 2.674 1.00 0.00 O ATOM 809 CB GLU A 974 0.072 -18.813 2.491 1.00 0.00 C ATOM 810 CG GLU A 974 -1.284 -19.333 2.104 1.00 0.00 C ATOM 811 CD GLU A 974 -1.326 -19.812 0.669 1.00 0.00 C ATOM 812 OE1 GLU A 974 -0.972 -20.981 0.406 1.00 0.00 O ATOM 813 OE2 GLU A 974 -1.705 -19.034 -0.221 1.00 0.00 O ATOM 0 H GLU A 974 1.567 -16.807 3.325 1.00 0.00 H new ATOM 0 HA GLU A 974 0.768 -17.853 0.658 1.00 0.00 H new ATOM 0 HB2 GLU A 974 0.793 -19.624 2.383 1.00 0.00 H new ATOM 0 HB3 GLU A 974 0.048 -18.547 3.548 1.00 0.00 H new ATOM 0 HG2 GLU A 974 -1.559 -20.153 2.767 1.00 0.00 H new ATOM 0 HG3 GLU A 974 -2.026 -18.547 2.244 1.00 0.00 H new ATOM 820 N TRP A 975 -1.216 -16.298 0.701 1.00 0.00 N ATOM 821 CA TRP A 975 -2.268 -15.298 0.741 1.00 0.00 C ATOM 822 C TRP A 975 -3.539 -15.830 1.398 1.00 0.00 C ATOM 823 O TRP A 975 -3.802 -17.035 1.425 1.00 0.00 O ATOM 824 CB TRP A 975 -2.557 -14.749 -0.657 1.00 0.00 C ATOM 825 CG TRP A 975 -1.364 -14.100 -1.251 1.00 0.00 C ATOM 826 CD1 TRP A 975 -0.629 -14.560 -2.284 1.00 0.00 C ATOM 827 CD2 TRP A 975 -0.744 -12.887 -0.816 1.00 0.00 C ATOM 828 NE1 TRP A 975 0.404 -13.709 -2.531 1.00 0.00 N ATOM 829 CE2 TRP A 975 0.367 -12.673 -1.641 1.00 0.00 C ATOM 830 CE3 TRP A 975 -1.024 -11.960 0.186 1.00 0.00 C ATOM 831 CZ2 TRP A 975 1.209 -11.572 -1.490 1.00 0.00 C ATOM 832 CZ3 TRP A 975 -0.194 -10.867 0.333 1.00 0.00 C ATOM 833 CH2 TRP A 975 0.914 -10.683 -0.496 1.00 0.00 C ATOM 0 H TRP A 975 -1.153 -16.828 -0.168 1.00 0.00 H new ATOM 0 HA TRP A 975 -1.908 -14.476 1.360 1.00 0.00 H new ATOM 0 HB2 TRP A 975 -2.890 -15.560 -1.304 1.00 0.00 H new ATOM 0 HB3 TRP A 975 -3.374 -14.029 -0.603 1.00 0.00 H new ATOM 0 HD1 TRP A 975 -0.830 -15.468 -2.833 1.00 0.00 H new ATOM 0 HE1 TRP A 975 1.099 -13.827 -3.268 1.00 0.00 H new ATOM 0 HE3 TRP A 975 -1.876 -12.094 0.836 1.00 0.00 H new ATOM 0 HZ2 TRP A 975 2.063 -11.427 -2.135 1.00 0.00 H new ATOM 0 HZ3 TRP A 975 -0.406 -10.141 1.104 1.00 0.00 H new ATOM 0 HH2 TRP A 975 1.549 -9.822 -0.349 1.00 0.00 H new ATOM 844 N GLU A 976 -4.303 -14.907 1.951 1.00 0.00 N ATOM 845 CA GLU A 976 -5.583 -15.213 2.577 1.00 0.00 C ATOM 846 C GLU A 976 -6.635 -14.270 1.998 1.00 0.00 C ATOM 847 O GLU A 976 -7.778 -14.652 1.755 1.00 0.00 O ATOM 848 CB GLU A 976 -5.525 -15.052 4.098 1.00 0.00 C ATOM 849 CG GLU A 976 -6.793 -15.526 4.801 1.00 0.00 C ATOM 850 CD GLU A 976 -6.753 -15.306 6.292 1.00 0.00 C ATOM 851 OE1 GLU A 976 -7.065 -14.190 6.734 1.00 0.00 O ATOM 852 OE2 GLU A 976 -6.354 -16.217 7.043 1.00 0.00 O ATOM 0 H GLU A 976 -4.055 -13.918 1.981 1.00 0.00 H new ATOM 0 HA GLU A 976 -5.836 -16.253 2.371 1.00 0.00 H new ATOM 0 HB2 GLU A 976 -4.673 -15.611 4.484 1.00 0.00 H new ATOM 0 HB3 GLU A 976 -5.354 -14.003 4.340 1.00 0.00 H new ATOM 0 HG2 GLU A 976 -7.652 -15.000 4.384 1.00 0.00 H new ATOM 0 HG3 GLU A 976 -6.940 -16.587 4.599 1.00 0.00 H new ATOM 859 N ASP A 977 -6.211 -13.035 1.760 1.00 0.00 N ATOM 860 CA ASP A 977 -7.056 -12.008 1.163 1.00 0.00 C ATOM 861 C ASP A 977 -7.214 -12.299 -0.335 1.00 0.00 C ATOM 862 O ASP A 977 -6.311 -12.888 -0.942 1.00 0.00 O ATOM 863 CB ASP A 977 -6.409 -10.638 1.380 1.00 0.00 C ATOM 864 CG ASP A 977 -7.251 -9.508 0.841 1.00 0.00 C ATOM 865 OD1 ASP A 977 -7.191 -9.245 -0.358 1.00 0.00 O ATOM 866 OD2 ASP A 977 -7.979 -8.862 1.619 1.00 0.00 O ATOM 0 H ASP A 977 -5.267 -12.716 1.977 1.00 0.00 H new ATOM 0 HA ASP A 977 -8.041 -12.009 1.629 1.00 0.00 H new ATOM 0 HB2 ASP A 977 -6.240 -10.484 2.446 1.00 0.00 H new ATOM 0 HB3 ASP A 977 -5.432 -10.621 0.897 1.00 0.00 H new ATOM 871 N ASP A 978 -8.321 -11.883 -0.934 1.00 0.00 N ATOM 872 CA ASP A 978 -8.608 -12.197 -2.341 1.00 0.00 C ATOM 873 C ASP A 978 -8.056 -11.162 -3.332 1.00 0.00 C ATOM 874 O ASP A 978 -7.662 -11.532 -4.440 1.00 0.00 O ATOM 875 CB ASP A 978 -10.119 -12.357 -2.556 1.00 0.00 C ATOM 876 CG ASP A 978 -10.491 -12.713 -3.985 1.00 0.00 C ATOM 877 OD1 ASP A 978 -10.434 -13.911 -4.349 1.00 0.00 O ATOM 878 OD2 ASP A 978 -10.887 -11.819 -4.768 1.00 0.00 O ATOM 0 H ASP A 978 -9.041 -11.326 -0.473 1.00 0.00 H new ATOM 0 HA ASP A 978 -8.093 -13.135 -2.547 1.00 0.00 H new ATOM 0 HB2 ASP A 978 -10.494 -13.132 -1.887 1.00 0.00 H new ATOM 0 HB3 ASP A 978 -10.618 -11.428 -2.279 1.00 0.00 H new ATOM 883 N ALA A 979 -7.955 -9.894 -2.937 1.00 0.00 N ATOM 884 CA ALA A 979 -7.578 -8.837 -3.879 1.00 0.00 C ATOM 885 C ALA A 979 -7.182 -7.562 -3.163 1.00 0.00 C ATOM 886 O ALA A 979 -7.829 -7.152 -2.191 1.00 0.00 O ATOM 887 CB ALA A 979 -8.728 -8.539 -4.826 1.00 0.00 C ATOM 0 H ALA A 979 -8.126 -9.574 -1.984 1.00 0.00 H new ATOM 0 HA ALA A 979 -6.717 -9.199 -4.442 1.00 0.00 H new ATOM 0 HB1 ALA A 979 -8.433 -7.752 -5.520 1.00 0.00 H new ATOM 0 HB2 ALA A 979 -8.981 -9.440 -5.385 1.00 0.00 H new ATOM 0 HB3 ALA A 979 -9.596 -8.212 -4.253 1.00 0.00 H new ATOM 893 N TRP A 980 -6.161 -6.910 -3.701 1.00 0.00 N ATOM 894 CA TRP A 980 -5.644 -5.683 -3.117 1.00 0.00 C ATOM 895 C TRP A 980 -6.730 -4.630 -3.170 1.00 0.00 C ATOM 896 O TRP A 980 -7.290 -4.341 -4.231 1.00 0.00 O ATOM 897 CB TRP A 980 -4.375 -5.189 -3.823 1.00 0.00 C ATOM 898 CG TRP A 980 -3.273 -6.212 -3.841 1.00 0.00 C ATOM 899 CD1 TRP A 980 -3.236 -7.370 -4.569 1.00 0.00 C ATOM 900 CD2 TRP A 980 -2.043 -6.163 -3.111 1.00 0.00 C ATOM 901 NE1 TRP A 980 -2.070 -8.050 -4.321 1.00 0.00 N ATOM 902 CE2 TRP A 980 -1.315 -7.327 -3.436 1.00 0.00 C ATOM 903 CE3 TRP A 980 -1.486 -5.251 -2.211 1.00 0.00 C ATOM 904 CZ2 TRP A 980 -0.064 -7.601 -2.891 1.00 0.00 C ATOM 905 CZ3 TRP A 980 -0.244 -5.524 -1.670 1.00 0.00 C ATOM 906 CH2 TRP A 980 0.455 -6.689 -2.011 1.00 0.00 C ATOM 0 H TRP A 980 -5.673 -7.213 -4.544 1.00 0.00 H new ATOM 0 HA TRP A 980 -5.361 -5.883 -2.084 1.00 0.00 H new ATOM 0 HB2 TRP A 980 -4.621 -4.911 -4.848 1.00 0.00 H new ATOM 0 HB3 TRP A 980 -4.017 -4.287 -3.326 1.00 0.00 H new ATOM 0 HD1 TRP A 980 -4.013 -7.701 -5.242 1.00 0.00 H new ATOM 0 HE1 TRP A 980 -1.808 -8.947 -4.729 1.00 0.00 H new ATOM 0 HE3 TRP A 980 -2.016 -4.349 -1.943 1.00 0.00 H new ATOM 0 HZ2 TRP A 980 0.477 -8.499 -3.152 1.00 0.00 H new ATOM 0 HZ3 TRP A 980 0.195 -4.827 -0.972 1.00 0.00 H new ATOM 0 HH2 TRP A 980 1.424 -6.872 -1.571 1.00 0.00 H new ATOM 917 N SER A 981 -7.043 -4.096 -2.020 1.00 0.00 N ATOM 918 CA SER A 981 -8.124 -3.139 -1.869 1.00 0.00 C ATOM 919 C SER A 981 -7.486 -1.837 -1.420 1.00 0.00 C ATOM 920 O SER A 981 -6.292 -1.725 -1.517 1.00 0.00 O ATOM 921 CB SER A 981 -9.102 -3.681 -0.828 1.00 0.00 C ATOM 922 OG SER A 981 -9.471 -5.019 -1.145 1.00 0.00 O ATOM 0 H SER A 981 -6.555 -4.310 -1.150 1.00 0.00 H new ATOM 0 HA SER A 981 -8.679 -2.974 -2.792 1.00 0.00 H new ATOM 0 HB2 SER A 981 -8.646 -3.647 0.161 1.00 0.00 H new ATOM 0 HB3 SER A 981 -9.991 -3.051 -0.791 1.00 0.00 H new ATOM 0 HG SER A 981 -8.705 -5.484 -1.543 1.00 0.00 H new ATOM 928 N TYR A 982 -8.219 -0.870 -0.931 1.00 0.00 N ATOM 929 CA TYR A 982 -7.576 0.346 -0.456 1.00 0.00 C ATOM 930 C TYR A 982 -7.867 0.564 1.014 1.00 0.00 C ATOM 931 O TYR A 982 -8.924 0.163 1.509 1.00 0.00 O ATOM 932 CB TYR A 982 -7.896 1.571 -1.342 1.00 0.00 C ATOM 933 CG TYR A 982 -9.343 1.739 -1.760 1.00 0.00 C ATOM 934 CD1 TYR A 982 -9.858 0.959 -2.786 1.00 0.00 C ATOM 935 CD2 TYR A 982 -10.181 2.687 -1.174 1.00 0.00 C ATOM 936 CE1 TYR A 982 -11.158 1.105 -3.215 1.00 0.00 C ATOM 937 CE2 TYR A 982 -11.492 2.835 -1.603 1.00 0.00 C ATOM 938 CZ TYR A 982 -11.971 2.040 -2.621 1.00 0.00 C ATOM 939 OH TYR A 982 -13.271 2.186 -3.063 1.00 0.00 O ATOM 0 H TYR A 982 -9.235 -0.889 -0.849 1.00 0.00 H new ATOM 0 HA TYR A 982 -6.498 0.216 -0.547 1.00 0.00 H new ATOM 0 HB2 TYR A 982 -7.588 2.470 -0.807 1.00 0.00 H new ATOM 0 HB3 TYR A 982 -7.285 1.511 -2.242 1.00 0.00 H new ATOM 0 HD1 TYR A 982 -9.225 0.222 -3.258 1.00 0.00 H new ATOM 0 HD2 TYR A 982 -9.806 3.313 -0.378 1.00 0.00 H new ATOM 0 HE1 TYR A 982 -11.537 0.487 -4.015 1.00 0.00 H new ATOM 0 HE2 TYR A 982 -12.134 3.570 -1.141 1.00 0.00 H new ATOM 0 HH TYR A 982 -13.717 2.886 -2.542 1.00 0.00 H new ATOM 949 N ASP A 983 -6.926 1.164 1.719 1.00 0.00 N ATOM 950 CA ASP A 983 -7.029 1.317 3.161 1.00 0.00 C ATOM 951 C ASP A 983 -7.586 2.681 3.493 1.00 0.00 C ATOM 952 O ASP A 983 -6.977 3.710 3.186 1.00 0.00 O ATOM 953 CB ASP A 983 -5.663 1.116 3.815 1.00 0.00 C ATOM 954 CG ASP A 983 -5.655 1.366 5.315 1.00 0.00 C ATOM 955 OD1 ASP A 983 -6.580 0.919 6.018 1.00 0.00 O ATOM 956 OD2 ASP A 983 -4.681 1.961 5.815 1.00 0.00 O ATOM 0 H ASP A 983 -6.076 1.556 1.314 1.00 0.00 H new ATOM 0 HA ASP A 983 -7.707 0.559 3.552 1.00 0.00 H new ATOM 0 HB2 ASP A 983 -5.326 0.097 3.625 1.00 0.00 H new ATOM 0 HB3 ASP A 983 -4.943 1.783 3.342 1.00 0.00 H new ATOM 961 N ILE A 984 -8.750 2.675 4.097 1.00 0.00 N ATOM 962 CA ILE A 984 -9.454 3.894 4.435 1.00 0.00 C ATOM 963 C ILE A 984 -9.393 4.176 5.930 1.00 0.00 C ATOM 964 O ILE A 984 -10.106 5.040 6.436 1.00 0.00 O ATOM 965 CB ILE A 984 -10.926 3.845 3.969 1.00 0.00 C ATOM 966 CG1 ILE A 984 -11.625 2.596 4.523 1.00 0.00 C ATOM 967 CG2 ILE A 984 -10.999 3.893 2.446 1.00 0.00 C ATOM 968 CD1 ILE A 984 -13.091 2.502 4.164 1.00 0.00 C ATOM 0 H ILE A 984 -9.239 1.823 4.370 1.00 0.00 H new ATOM 0 HA ILE A 984 -8.951 4.705 3.909 1.00 0.00 H new ATOM 0 HB ILE A 984 -11.449 4.718 4.359 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -11.112 1.709 4.150 1.00 0.00 H new ATOM 0 HG13 ILE A 984 -11.526 2.588 5.608 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -12.042 3.858 2.130 1.00 0.00 H new ATOM 0 HG22 ILE A 984 -10.543 4.816 2.089 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -10.465 3.039 2.029 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -13.513 1.593 4.592 1.00 0.00 H new ATOM 0 HD12 ILE A 984 -13.619 3.369 4.561 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -13.199 2.477 3.080 1.00 0.00 H new ATOM 980 N ASN A 985 -8.485 3.507 6.620 1.00 0.00 N ATOM 981 CA ASN A 985 -8.309 3.702 8.055 1.00 0.00 C ATOM 982 C ASN A 985 -7.171 4.685 8.280 1.00 0.00 C ATOM 983 O ASN A 985 -6.413 4.604 9.250 1.00 0.00 O ATOM 984 CB ASN A 985 -8.018 2.370 8.760 1.00 0.00 C ATOM 985 CG ASN A 985 -9.250 1.490 8.908 1.00 0.00 C ATOM 986 OD1 ASN A 985 -9.583 0.684 8.031 1.00 0.00 O ATOM 987 ND2 ASN A 985 -9.939 1.623 10.023 1.00 0.00 N ATOM 0 H ASN A 985 -7.853 2.819 6.210 1.00 0.00 H new ATOM 0 HA ASN A 985 -9.230 4.102 8.479 1.00 0.00 H new ATOM 0 HB2 ASN A 985 -7.257 1.828 8.199 1.00 0.00 H new ATOM 0 HB3 ASN A 985 -7.603 2.572 9.747 1.00 0.00 H new ATOM 0 HD21 ASN A 985 -10.770 1.053 10.180 1.00 0.00 H new ATOM 0 HD22 ASN A 985 -9.641 2.296 10.729 1.00 0.00 H new ATOM 994 N ARG A 986 -7.119 5.683 7.418 1.00 0.00 N ATOM 995 CA ARG A 986 -6.080 6.673 7.398 1.00 0.00 C ATOM 996 C ARG A 986 -6.721 8.005 7.094 1.00 0.00 C ATOM 997 O ARG A 986 -7.945 8.093 6.956 1.00 0.00 O ATOM 998 CB ARG A 986 -5.085 6.382 6.290 1.00 0.00 C ATOM 999 CG ARG A 986 -4.183 5.202 6.519 1.00 0.00 C ATOM 1000 CD ARG A 986 -3.242 5.076 5.351 1.00 0.00 C ATOM 1001 NE ARG A 986 -1.980 4.447 5.737 1.00 0.00 N ATOM 1002 CZ ARG A 986 -0.806 4.638 5.127 1.00 0.00 C ATOM 1003 NH1 ARG A 986 -0.710 5.413 4.045 1.00 0.00 N ATOM 1004 NH2 ARG A 986 0.288 4.078 5.629 1.00 0.00 N ATOM 0 H ARG A 986 -7.824 5.824 6.694 1.00 0.00 H new ATOM 0 HA ARG A 986 -5.564 6.672 8.358 1.00 0.00 H new ATOM 0 HB2 ARG A 986 -5.637 6.220 5.364 1.00 0.00 H new ATOM 0 HB3 ARG A 986 -4.465 7.266 6.141 1.00 0.00 H new ATOM 0 HG2 ARG A 986 -3.621 5.331 7.444 1.00 0.00 H new ATOM 0 HG3 ARG A 986 -4.773 4.292 6.628 1.00 0.00 H new ATOM 0 HD2 ARG A 986 -3.715 4.489 4.564 1.00 0.00 H new ATOM 0 HD3 ARG A 986 -3.044 6.064 4.936 1.00 0.00 H new ATOM 0 HE ARG A 986 -1.997 3.812 6.535 1.00 0.00 H new ATOM 0 HH11 ARG A 986 -1.541 5.871 3.670 1.00 0.00 H new ATOM 0 HH12 ARG A 986 0.194 5.547 3.593 1.00 0.00 H new ATOM 0 HH21 ARG A 986 0.228 3.508 6.473 1.00 0.00 H new ATOM 0 HH22 ARG A 986 1.189 4.218 5.171 1.00 0.00 H new ATOM 1018 N ALA A 987 -5.904 9.022 6.971 1.00 0.00 N ATOM 1019 CA ALA A 987 -6.375 10.296 6.501 1.00 0.00 C ATOM 1020 C ALA A 987 -6.414 10.201 4.985 1.00 0.00 C ATOM 1021 O ALA A 987 -5.416 10.449 4.310 1.00 0.00 O ATOM 1022 CB ALA A 987 -5.470 11.429 6.967 1.00 0.00 C ATOM 0 H ALA A 987 -4.909 8.990 7.191 1.00 0.00 H new ATOM 0 HA ALA A 987 -7.363 10.522 6.903 1.00 0.00 H new ATOM 0 HB1 ALA A 987 -5.854 12.378 6.594 1.00 0.00 H new ATOM 0 HB2 ALA A 987 -5.445 11.450 8.057 1.00 0.00 H new ATOM 0 HB3 ALA A 987 -4.462 11.270 6.584 1.00 0.00 H new ATOM 1028 N VAL A 988 -7.515 9.689 4.470 1.00 0.00 N ATOM 1029 CA VAL A 988 -7.667 9.472 3.041 1.00 0.00 C ATOM 1030 C VAL A 988 -9.028 9.921 2.540 1.00 0.00 C ATOM 1031 O VAL A 988 -9.995 9.994 3.295 1.00 0.00 O ATOM 1032 CB VAL A 988 -7.461 7.986 2.633 1.00 0.00 C ATOM 1033 CG1 VAL A 988 -6.026 7.532 2.846 1.00 0.00 C ATOM 1034 CG2 VAL A 988 -8.416 7.073 3.383 1.00 0.00 C ATOM 0 H VAL A 988 -8.325 9.413 5.024 1.00 0.00 H new ATOM 0 HA VAL A 988 -6.887 10.076 2.579 1.00 0.00 H new ATOM 0 HB VAL A 988 -7.679 7.919 1.567 1.00 0.00 H new ATOM 0 HG11 VAL A 988 -5.927 6.488 2.548 1.00 0.00 H new ATOM 0 HG12 VAL A 988 -5.357 8.146 2.244 1.00 0.00 H new ATOM 0 HG13 VAL A 988 -5.764 7.635 3.899 1.00 0.00 H new ATOM 0 HG21 VAL A 988 -8.248 6.040 3.077 1.00 0.00 H new ATOM 0 HG22 VAL A 988 -8.242 7.166 4.455 1.00 0.00 H new ATOM 0 HG23 VAL A 988 -9.444 7.356 3.156 1.00 0.00 H new ATOM 1044 N ASP A 989 -9.028 10.321 1.284 1.00 0.00 N ATOM 1045 CA ASP A 989 -10.237 10.628 0.505 1.00 0.00 C ATOM 1046 C ASP A 989 -11.246 9.475 0.541 1.00 0.00 C ATOM 1047 O ASP A 989 -10.920 8.368 0.965 1.00 0.00 O ATOM 1048 CB ASP A 989 -9.784 10.841 -0.947 1.00 0.00 C ATOM 1049 CG ASP A 989 -10.885 11.232 -1.908 1.00 0.00 C ATOM 1050 OD1 ASP A 989 -11.177 12.428 -2.039 1.00 0.00 O ATOM 1051 OD2 ASP A 989 -11.484 10.342 -2.553 1.00 0.00 O ATOM 0 H ASP A 989 -8.168 10.449 0.751 1.00 0.00 H new ATOM 0 HA ASP A 989 -10.727 11.507 0.924 1.00 0.00 H new ATOM 0 HB2 ASP A 989 -9.016 11.615 -0.963 1.00 0.00 H new ATOM 0 HB3 ASP A 989 -9.318 9.923 -1.305 1.00 0.00 H new ATOM 1056 N GLU A 990 -12.459 9.741 0.058 1.00 0.00 N ATOM 1057 CA GLU A 990 -13.529 8.752 -0.013 1.00 0.00 C ATOM 1058 C GLU A 990 -13.106 7.521 -0.772 1.00 0.00 C ATOM 1059 O GLU A 990 -13.514 6.401 -0.455 1.00 0.00 O ATOM 1060 CB GLU A 990 -14.740 9.338 -0.718 1.00 0.00 C ATOM 1061 CG GLU A 990 -15.498 10.321 0.123 1.00 0.00 C ATOM 1062 CD GLU A 990 -16.646 10.957 -0.628 1.00 0.00 C ATOM 1063 OE1 GLU A 990 -17.767 10.420 -0.607 1.00 0.00 O ATOM 1064 OE2 GLU A 990 -16.448 12.010 -1.268 1.00 0.00 O ATOM 0 H GLU A 990 -12.727 10.659 -0.298 1.00 0.00 H new ATOM 0 HA GLU A 990 -13.771 8.476 1.013 1.00 0.00 H new ATOM 0 HB2 GLU A 990 -14.415 9.829 -1.635 1.00 0.00 H new ATOM 0 HB3 GLU A 990 -15.409 8.528 -1.010 1.00 0.00 H new ATOM 0 HG2 GLU A 990 -15.882 9.816 1.009 1.00 0.00 H new ATOM 0 HG3 GLU A 990 -14.818 11.099 0.469 1.00 0.00 H new ATOM 1071 N LYS A 991 -12.280 7.728 -1.765 1.00 0.00 N ATOM 1072 CA LYS A 991 -11.844 6.636 -2.591 1.00 0.00 C ATOM 1073 C LYS A 991 -10.506 6.108 -2.111 1.00 0.00 C ATOM 1074 O LYS A 991 -9.856 5.312 -2.795 1.00 0.00 O ATOM 1075 CB LYS A 991 -11.752 7.110 -4.029 1.00 0.00 C ATOM 1076 CG LYS A 991 -13.032 7.767 -4.468 1.00 0.00 C ATOM 1077 CD LYS A 991 -12.960 8.317 -5.865 1.00 0.00 C ATOM 1078 CE LYS A 991 -14.207 9.121 -6.133 1.00 0.00 C ATOM 1079 NZ LYS A 991 -14.254 9.634 -7.520 1.00 0.00 N ATOM 0 H LYS A 991 -11.898 8.639 -2.019 1.00 0.00 H new ATOM 0 HA LYS A 991 -12.564 5.820 -2.527 1.00 0.00 H new ATOM 0 HB2 LYS A 991 -10.926 7.813 -4.131 1.00 0.00 H new ATOM 0 HB3 LYS A 991 -11.532 6.264 -4.680 1.00 0.00 H new ATOM 0 HG2 LYS A 991 -13.844 7.043 -4.410 1.00 0.00 H new ATOM 0 HG3 LYS A 991 -13.275 8.575 -3.777 1.00 0.00 H new ATOM 0 HD2 LYS A 991 -12.075 8.943 -5.979 1.00 0.00 H new ATOM 0 HD3 LYS A 991 -12.872 7.505 -6.587 1.00 0.00 H new ATOM 0 HE2 LYS A 991 -15.084 8.501 -5.947 1.00 0.00 H new ATOM 0 HE3 LYS A 991 -14.254 9.958 -5.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 991 -15.128 10.180 -7.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 991 -13.432 10.247 -7.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 991 -14.235 8.836 -8.186 1.00 0.00 H new ATOM 1093 N GLY A 992 -10.119 6.555 -0.928 1.00 0.00 N ATOM 1094 CA GLY A 992 -8.871 6.164 -0.344 1.00 0.00 C ATOM 1095 C GLY A 992 -7.724 6.763 -1.097 1.00 0.00 C ATOM 1096 O GLY A 992 -7.099 6.094 -1.891 1.00 0.00 O ATOM 0 H GLY A 992 -10.668 7.197 -0.356 1.00 0.00 H new ATOM 0 HA2 GLY A 992 -8.835 6.483 0.698 1.00 0.00 H new ATOM 0 HA3 GLY A 992 -8.787 5.077 -0.347 1.00 0.00 H new ATOM 1100 N TRP A 993 -7.460 8.031 -0.869 1.00 0.00 N ATOM 1101 CA TRP A 993 -6.368 8.722 -1.523 1.00 0.00 C ATOM 1102 C TRP A 993 -5.827 9.748 -0.559 1.00 0.00 C ATOM 1103 O TRP A 993 -6.593 10.518 0.034 1.00 0.00 O ATOM 1104 CB TRP A 993 -6.805 9.438 -2.807 1.00 0.00 C ATOM 1105 CG TRP A 993 -7.140 8.538 -3.956 1.00 0.00 C ATOM 1106 CD1 TRP A 993 -8.381 8.205 -4.404 1.00 0.00 C ATOM 1107 CD2 TRP A 993 -6.209 7.859 -4.805 1.00 0.00 C ATOM 1108 NE1 TRP A 993 -8.280 7.372 -5.490 1.00 0.00 N ATOM 1109 CE2 TRP A 993 -6.956 7.152 -5.761 1.00 0.00 C ATOM 1110 CE3 TRP A 993 -4.814 7.788 -4.851 1.00 0.00 C ATOM 1111 CZ2 TRP A 993 -6.353 6.390 -6.758 1.00 0.00 C ATOM 1112 CZ3 TRP A 993 -4.215 7.029 -5.837 1.00 0.00 C ATOM 1113 CH2 TRP A 993 -4.983 6.343 -6.781 1.00 0.00 C ATOM 0 H TRP A 993 -7.996 8.613 -0.225 1.00 0.00 H new ATOM 0 HA TRP A 993 -5.617 7.983 -1.803 1.00 0.00 H new ATOM 0 HB2 TRP A 993 -7.676 10.054 -2.582 1.00 0.00 H new ATOM 0 HB3 TRP A 993 -6.008 10.114 -3.116 1.00 0.00 H new ATOM 0 HD1 TRP A 993 -9.309 8.546 -3.969 1.00 0.00 H new ATOM 0 HE1 TRP A 993 -9.064 6.980 -6.011 1.00 0.00 H new ATOM 0 HE3 TRP A 993 -4.214 8.318 -4.127 1.00 0.00 H new ATOM 0 HZ2 TRP A 993 -6.943 5.855 -7.487 1.00 0.00 H new ATOM 0 HZ3 TRP A 993 -3.138 6.965 -5.879 1.00 0.00 H new ATOM 0 HH2 TRP A 993 -4.487 5.763 -7.545 1.00 0.00 H new ATOM 1124 N GLU A 994 -4.541 9.751 -0.353 1.00 0.00 N ATOM 1125 CA GLU A 994 -3.914 10.723 0.512 1.00 0.00 C ATOM 1126 C GLU A 994 -3.233 11.779 -0.332 1.00 0.00 C ATOM 1127 O GLU A 994 -2.869 11.524 -1.485 1.00 0.00 O ATOM 1128 CB GLU A 994 -2.956 10.040 1.501 1.00 0.00 C ATOM 1129 CG GLU A 994 -2.188 8.861 0.916 1.00 0.00 C ATOM 1130 CD GLU A 994 -1.512 8.012 1.966 1.00 0.00 C ATOM 1131 OE1 GLU A 994 -2.211 7.223 2.642 1.00 0.00 O ATOM 1132 OE2 GLU A 994 -0.283 8.115 2.149 1.00 0.00 O ATOM 0 H GLU A 994 -3.895 9.084 -0.776 1.00 0.00 H new ATOM 0 HA GLU A 994 -4.671 11.220 1.119 1.00 0.00 H new ATOM 0 HB2 GLU A 994 -2.242 10.778 1.866 1.00 0.00 H new ATOM 0 HB3 GLU A 994 -3.527 9.695 2.363 1.00 0.00 H new ATOM 0 HG2 GLU A 994 -2.873 8.239 0.341 1.00 0.00 H new ATOM 0 HG3 GLU A 994 -1.436 9.234 0.221 1.00 0.00 H new ATOM 1139 N TYR A 995 -3.089 12.957 0.230 1.00 0.00 N ATOM 1140 CA TYR A 995 -2.604 14.087 -0.523 1.00 0.00 C ATOM 1141 C TYR A 995 -1.229 14.483 -0.092 1.00 0.00 C ATOM 1142 O TYR A 995 -0.967 14.665 1.089 1.00 0.00 O ATOM 1143 CB TYR A 995 -3.590 15.277 -0.488 1.00 0.00 C ATOM 1144 CG TYR A 995 -3.457 16.353 0.584 1.00 0.00 C ATOM 1145 CD1 TYR A 995 -2.460 17.321 0.500 1.00 0.00 C ATOM 1146 CD2 TYR A 995 -4.367 16.453 1.623 1.00 0.00 C ATOM 1147 CE1 TYR A 995 -2.363 18.332 1.426 1.00 0.00 C ATOM 1148 CE2 TYR A 995 -4.285 17.478 2.551 1.00 0.00 C ATOM 1149 CZ TYR A 995 -3.277 18.412 2.450 1.00 0.00 C ATOM 1150 OH TYR A 995 -3.183 19.441 3.364 1.00 0.00 O ATOM 0 H TYR A 995 -3.302 13.156 1.208 1.00 0.00 H new ATOM 0 HA TYR A 995 -2.536 13.773 -1.565 1.00 0.00 H new ATOM 0 HB2 TYR A 995 -3.529 15.776 -1.455 1.00 0.00 H new ATOM 0 HB3 TYR A 995 -4.595 14.862 -0.406 1.00 0.00 H new ATOM 0 HD1 TYR A 995 -1.747 17.277 -0.310 1.00 0.00 H new ATOM 0 HD2 TYR A 995 -5.154 15.719 1.711 1.00 0.00 H new ATOM 0 HE1 TYR A 995 -1.571 19.062 1.349 1.00 0.00 H new ATOM 0 HE2 TYR A 995 -5.008 17.545 3.350 1.00 0.00 H new ATOM 0 HH TYR A 995 -3.902 19.358 4.025 1.00 0.00 H new ATOM 1160 N GLY A 996 -0.372 14.578 -1.074 1.00 0.00 N ATOM 1161 CA GLY A 996 0.968 15.005 -0.867 1.00 0.00 C ATOM 1162 C GLY A 996 1.289 16.134 -1.799 1.00 0.00 C ATOM 1163 O GLY A 996 0.822 16.159 -2.945 1.00 0.00 O ATOM 0 H GLY A 996 -0.596 14.357 -2.044 1.00 0.00 H new ATOM 0 HA2 GLY A 996 1.102 15.325 0.166 1.00 0.00 H new ATOM 0 HA3 GLY A 996 1.654 14.175 -1.036 1.00 0.00 H new ATOM 1167 N ILE A 997 2.025 17.092 -1.307 1.00 0.00 N ATOM 1168 CA ILE A 997 2.412 18.246 -2.083 1.00 0.00 C ATOM 1169 C ILE A 997 3.915 18.358 -2.150 1.00 0.00 C ATOM 1170 O ILE A 997 4.605 18.101 -1.165 1.00 0.00 O ATOM 1171 CB ILE A 997 1.822 19.526 -1.461 1.00 0.00 C ATOM 1172 CG1 ILE A 997 2.040 19.551 0.059 1.00 0.00 C ATOM 1173 CG2 ILE A 997 0.361 19.668 -1.811 1.00 0.00 C ATOM 1174 CD1 ILE A 997 1.135 20.522 0.776 1.00 0.00 C ATOM 0 H ILE A 997 2.378 17.097 -0.350 1.00 0.00 H new ATOM 0 HA ILE A 997 2.023 18.127 -3.094 1.00 0.00 H new ATOM 0 HB ILE A 997 2.349 20.382 -1.882 1.00 0.00 H new ATOM 0 HG12 ILE A 997 1.877 18.550 0.459 1.00 0.00 H new ATOM 0 HG13 ILE A 997 3.078 19.812 0.266 1.00 0.00 H new ATOM 0 HG21 ILE A 997 -0.034 20.579 -1.361 1.00 0.00 H new ATOM 0 HG22 ILE A 997 0.250 19.721 -2.894 1.00 0.00 H new ATOM 0 HG23 ILE A 997 -0.189 18.807 -1.431 1.00 0.00 H new ATOM 0 HD11 ILE A 997 1.341 20.489 1.846 1.00 0.00 H new ATOM 0 HD12 ILE A 997 1.314 21.530 0.402 1.00 0.00 H new ATOM 0 HD13 ILE A 997 0.095 20.249 0.598 1.00 0.00 H new ATOM 1186 N THR A 998 4.423 18.695 -3.305 1.00 0.00 N ATOM 1187 CA THR A 998 5.830 18.911 -3.454 1.00 0.00 C ATOM 1188 C THR A 998 6.035 20.036 -4.465 1.00 0.00 C ATOM 1189 O THR A 998 5.181 20.262 -5.333 1.00 0.00 O ATOM 1190 CB THR A 998 6.576 17.626 -3.897 1.00 0.00 C ATOM 1191 OG1 THR A 998 7.998 17.815 -3.815 1.00 0.00 O ATOM 1192 CG2 THR A 998 6.210 17.219 -5.316 1.00 0.00 C ATOM 0 H THR A 998 3.878 18.825 -4.157 1.00 0.00 H new ATOM 0 HA THR A 998 6.251 19.189 -2.488 1.00 0.00 H new ATOM 0 HB THR A 998 6.268 16.830 -3.219 1.00 0.00 H new ATOM 0 HG1 THR A 998 8.454 16.994 -4.096 1.00 0.00 H new ATOM 0 HG21 THR A 998 6.754 16.314 -5.587 1.00 0.00 H new ATOM 0 HG22 THR A 998 5.138 17.029 -5.375 1.00 0.00 H new ATOM 0 HG23 THR A 998 6.475 18.022 -6.004 1.00 0.00 H new ATOM 1200 N ILE A 999 7.108 20.779 -4.318 1.00 0.00 N ATOM 1201 CA ILE A 999 7.434 21.830 -5.260 1.00 0.00 C ATOM 1202 C ILE A 999 8.634 21.362 -6.073 1.00 0.00 C ATOM 1203 O ILE A 999 9.769 21.379 -5.582 1.00 0.00 O ATOM 1204 CB ILE A 999 7.741 23.201 -4.580 1.00 0.00 C ATOM 1205 CG1 ILE A 999 6.520 23.766 -3.827 1.00 0.00 C ATOM 1206 CG2 ILE A 999 8.216 24.225 -5.606 1.00 0.00 C ATOM 1207 CD1 ILE A 999 6.179 23.078 -2.515 1.00 0.00 C ATOM 0 H ILE A 999 7.774 20.676 -3.552 1.00 0.00 H new ATOM 0 HA ILE A 999 6.564 22.007 -5.893 1.00 0.00 H new ATOM 0 HB ILE A 999 8.533 23.015 -3.855 1.00 0.00 H new ATOM 0 HG12 ILE A 999 6.697 24.823 -3.627 1.00 0.00 H new ATOM 0 HG13 ILE A 999 5.652 23.707 -4.484 1.00 0.00 H new ATOM 0 HG21 ILE A 999 8.423 25.171 -5.106 1.00 0.00 H new ATOM 0 HG22 ILE A 999 9.124 23.863 -6.088 1.00 0.00 H new ATOM 0 HG23 ILE A 999 7.441 24.374 -6.358 1.00 0.00 H new ATOM 0 HD11 ILE A 999 5.305 23.555 -2.071 1.00 0.00 H new ATOM 0 HD12 ILE A 999 5.963 22.026 -2.701 1.00 0.00 H new ATOM 0 HD13 ILE A 999 7.024 23.159 -1.831 1.00 0.00 H new ATOM 1219 N PRO A1000 8.393 20.880 -7.302 1.00 0.00 N ATOM 1220 CA PRO A1000 9.443 20.305 -8.134 1.00 0.00 C ATOM 1221 C PRO A1000 10.438 21.340 -8.658 1.00 0.00 C ATOM 1222 O PRO A1000 10.047 22.405 -9.152 1.00 0.00 O ATOM 1223 CB PRO A1000 8.680 19.644 -9.282 1.00 0.00 C ATOM 1224 CG PRO A1000 7.387 20.382 -9.367 1.00 0.00 C ATOM 1225 CD PRO A1000 7.081 20.877 -7.980 1.00 0.00 C ATOM 0 HA PRO A1000 10.061 19.610 -7.565 1.00 0.00 H new ATOM 0 HB2 PRO A1000 9.236 19.715 -10.217 1.00 0.00 H new ATOM 0 HB3 PRO A1000 8.517 18.584 -9.088 1.00 0.00 H new ATOM 0 HG2 PRO A1000 7.461 21.214 -10.067 1.00 0.00 H new ATOM 0 HG3 PRO A1000 6.592 19.730 -9.730 1.00 0.00 H new ATOM 0 HD2 PRO A1000 6.640 21.874 -8.000 1.00 0.00 H new ATOM 0 HD3 PRO A1000 6.371 20.225 -7.471 1.00 0.00 H new ATOM 1233 N PRO A1001 11.739 21.028 -8.565 1.00 0.00 N ATOM 1234 CA PRO A1001 12.211 19.796 -7.975 1.00 0.00 C ATOM 1235 C PRO A1001 12.578 19.927 -6.511 1.00 0.00 C ATOM 1236 O PRO A1001 13.008 20.977 -6.022 1.00 0.00 O ATOM 1237 CB PRO A1001 13.459 19.460 -8.780 1.00 0.00 C ATOM 1238 CG PRO A1001 13.796 20.697 -9.542 1.00 0.00 C ATOM 1239 CD PRO A1001 12.863 21.794 -9.089 1.00 0.00 C ATOM 0 HA PRO A1001 11.432 19.035 -8.006 1.00 0.00 H new ATOM 0 HB2 PRO A1001 14.280 19.168 -8.125 1.00 0.00 H new ATOM 0 HB3 PRO A1001 13.276 18.623 -9.454 1.00 0.00 H new ATOM 0 HG2 PRO A1001 14.833 20.982 -9.366 1.00 0.00 H new ATOM 0 HG3 PRO A1001 13.690 20.525 -10.613 1.00 0.00 H new ATOM 0 HD2 PRO A1001 13.316 22.429 -8.328 1.00 0.00 H new ATOM 0 HD3 PRO A1001 12.567 22.445 -9.911 1.00 0.00 H new ATOM 1247 N ASP A1002 12.401 18.829 -5.845 1.00 0.00 N ATOM 1248 CA ASP A1002 12.743 18.665 -4.443 1.00 0.00 C ATOM 1249 C ASP A1002 13.121 17.206 -4.241 1.00 0.00 C ATOM 1250 O ASP A1002 14.293 16.847 -4.359 1.00 0.00 O ATOM 1251 CB ASP A1002 11.575 19.079 -3.530 1.00 0.00 C ATOM 1252 CG ASP A1002 11.895 18.973 -2.051 1.00 0.00 C ATOM 1253 OD1 ASP A1002 12.550 19.883 -1.500 1.00 0.00 O ATOM 1254 OD2 ASP A1002 11.459 18.004 -1.404 1.00 0.00 O ATOM 0 H ASP A1002 12.003 17.988 -6.264 1.00 0.00 H new ATOM 0 HA ASP A1002 13.578 19.312 -4.175 1.00 0.00 H new ATOM 0 HB2 ASP A1002 11.292 20.106 -3.759 1.00 0.00 H new ATOM 0 HB3 ASP A1002 10.711 18.453 -3.752 1.00 0.00 H new ATOM 1259 N HIS A1003 12.131 16.366 -3.988 1.00 0.00 N ATOM 1260 CA HIS A1003 12.290 14.909 -3.959 1.00 0.00 C ATOM 1261 C HIS A1003 10.905 14.346 -4.169 1.00 0.00 C ATOM 1262 O HIS A1003 10.494 14.016 -5.282 1.00 0.00 O ATOM 1263 CB HIS A1003 12.789 14.309 -2.618 1.00 0.00 C ATOM 1264 CG HIS A1003 13.935 14.983 -1.953 1.00 0.00 C ATOM 1265 ND1 HIS A1003 15.255 14.652 -2.144 1.00 0.00 N ATOM 1266 CD2 HIS A1003 13.917 15.979 -1.063 1.00 0.00 C ATOM 1267 CE1 HIS A1003 16.008 15.426 -1.387 1.00 0.00 C ATOM 1268 NE2 HIS A1003 15.216 16.243 -0.720 1.00 0.00 N ATOM 0 H HIS A1003 11.178 16.674 -3.793 1.00 0.00 H new ATOM 0 HA HIS A1003 13.040 14.660 -4.710 1.00 0.00 H new ATOM 0 HB2 HIS A1003 11.952 14.301 -1.920 1.00 0.00 H new ATOM 0 HB3 HIS A1003 13.066 13.270 -2.796 1.00 0.00 H new ATOM 0 HD2 HIS A1003 13.040 16.483 -0.684 1.00 0.00 H new ATOM 0 HE1 HIS A1003 17.086 15.396 -1.324 1.00 0.00 H new ATOM 0 HE2 HIS A1003 15.521 16.955 -0.057 1.00 0.00 H new ATOM 1277 N LYS A1004 10.175 14.290 -3.066 1.00 0.00 N ATOM 1278 CA LYS A1004 8.809 13.839 -3.043 1.00 0.00 C ATOM 1279 C LYS A1004 8.078 14.531 -1.910 1.00 0.00 C ATOM 1280 O LYS A1004 8.722 15.091 -1.014 1.00 0.00 O ATOM 1281 CB LYS A1004 8.694 12.324 -2.801 1.00 0.00 C ATOM 1282 CG LYS A1004 9.204 11.414 -3.900 1.00 0.00 C ATOM 1283 CD LYS A1004 8.975 9.970 -3.503 1.00 0.00 C ATOM 1284 CE LYS A1004 9.408 8.989 -4.587 1.00 0.00 C ATOM 1285 NZ LYS A1004 10.858 9.070 -4.895 1.00 0.00 N ATOM 0 H LYS A1004 10.530 14.564 -2.150 1.00 0.00 H new ATOM 0 HA LYS A1004 8.379 14.074 -4.017 1.00 0.00 H new ATOM 0 HB2 LYS A1004 9.234 12.085 -1.885 1.00 0.00 H new ATOM 0 HB3 LYS A1004 7.645 12.087 -2.624 1.00 0.00 H new ATOM 0 HG2 LYS A1004 8.689 11.632 -4.836 1.00 0.00 H new ATOM 0 HG3 LYS A1004 10.266 11.592 -4.071 1.00 0.00 H new ATOM 0 HD2 LYS A1004 9.524 9.758 -2.586 1.00 0.00 H new ATOM 0 HD3 LYS A1004 7.918 9.820 -3.284 1.00 0.00 H new ATOM 0 HE2 LYS A1004 9.165 7.975 -4.270 1.00 0.00 H new ATOM 0 HE3 LYS A1004 8.838 9.184 -5.495 1.00 0.00 H new ATOM 0 HZ1 LYS A1004 11.110 8.325 -5.575 1.00 0.00 H new ATOM 0 HZ2 LYS A1004 11.074 10.001 -5.305 1.00 0.00 H new ATOM 0 HZ3 LYS A1004 11.406 8.941 -4.021 1.00 0.00 H new ATOM 1299 N PRO A1005 6.735 14.551 -1.968 1.00 0.00 N ATOM 1300 CA PRO A1005 5.900 14.954 -0.839 1.00 0.00 C ATOM 1301 C PRO A1005 6.201 14.112 0.391 1.00 0.00 C ATOM 1302 O PRO A1005 6.431 12.906 0.290 1.00 0.00 O ATOM 1303 CB PRO A1005 4.491 14.648 -1.320 1.00 0.00 C ATOM 1304 CG PRO A1005 4.567 14.776 -2.794 1.00 0.00 C ATOM 1305 CD PRO A1005 5.925 14.265 -3.167 1.00 0.00 C ATOM 0 HA PRO A1005 6.059 15.995 -0.556 1.00 0.00 H new ATOM 0 HB2 PRO A1005 4.179 13.646 -1.024 1.00 0.00 H new ATOM 0 HB3 PRO A1005 3.767 15.345 -0.898 1.00 0.00 H new ATOM 0 HG2 PRO A1005 3.782 14.197 -3.280 1.00 0.00 H new ATOM 0 HG3 PRO A1005 4.438 15.812 -3.106 1.00 0.00 H new ATOM 0 HD2 PRO A1005 5.905 13.199 -3.395 1.00 0.00 H new ATOM 0 HD3 PRO A1005 6.318 14.772 -4.048 1.00 0.00 H new ATOM 1313 N LYS A1006 6.148 14.742 1.541 1.00 0.00 N ATOM 1314 CA LYS A1006 6.496 14.090 2.796 1.00 0.00 C ATOM 1315 C LYS A1006 5.326 14.232 3.741 1.00 0.00 C ATOM 1316 O LYS A1006 5.410 13.959 4.937 1.00 0.00 O ATOM 1317 CB LYS A1006 7.722 14.762 3.411 1.00 0.00 C ATOM 1318 CG LYS A1006 8.906 14.790 2.475 1.00 0.00 C ATOM 1319 CD LYS A1006 9.420 13.386 2.204 1.00 0.00 C ATOM 1320 CE LYS A1006 10.569 13.380 1.211 1.00 0.00 C ATOM 1321 NZ LYS A1006 11.117 12.018 1.032 1.00 0.00 N ATOM 0 H LYS A1006 5.865 15.717 1.640 1.00 0.00 H new ATOM 0 HA LYS A1006 6.722 13.039 2.618 1.00 0.00 H new ATOM 0 HB2 LYS A1006 7.466 15.782 3.696 1.00 0.00 H new ATOM 0 HB3 LYS A1006 7.999 14.236 4.324 1.00 0.00 H new ATOM 0 HG2 LYS A1006 8.620 15.264 1.536 1.00 0.00 H new ATOM 0 HG3 LYS A1006 9.702 15.395 2.908 1.00 0.00 H new ATOM 0 HD2 LYS A1006 9.748 12.934 3.140 1.00 0.00 H new ATOM 0 HD3 LYS A1006 8.606 12.770 1.820 1.00 0.00 H new ATOM 0 HE2 LYS A1006 10.225 13.765 0.251 1.00 0.00 H new ATOM 0 HE3 LYS A1006 11.357 14.048 1.559 1.00 0.00 H new ATOM 0 HZ1 LYS A1006 11.900 12.046 0.348 1.00 0.00 H new ATOM 0 HZ2 LYS A1006 11.467 11.662 1.944 1.00 0.00 H new ATOM 0 HZ3 LYS A1006 10.370 11.387 0.677 1.00 0.00 H new ATOM 1335 N SER A1007 4.228 14.650 3.173 1.00 0.00 N ATOM 1336 CA SER A1007 3.055 14.973 3.919 1.00 0.00 C ATOM 1337 C SER A1007 1.865 14.373 3.193 1.00 0.00 C ATOM 1338 O SER A1007 1.724 14.571 1.993 1.00 0.00 O ATOM 1339 CB SER A1007 2.958 16.498 4.013 1.00 0.00 C ATOM 1340 OG SER A1007 1.861 16.917 4.814 1.00 0.00 O ATOM 0 H SER A1007 4.127 14.776 2.166 1.00 0.00 H new ATOM 0 HA SER A1007 3.083 14.570 4.931 1.00 0.00 H new ATOM 0 HB2 SER A1007 3.883 16.894 4.431 1.00 0.00 H new ATOM 0 HB3 SER A1007 2.856 16.916 3.012 1.00 0.00 H new ATOM 0 HG SER A1007 1.837 17.896 4.849 1.00 0.00 H new ATOM 1346 N TRP A1008 1.076 13.589 3.918 1.00 0.00 N ATOM 1347 CA TRP A1008 -0.093 12.901 3.371 1.00 0.00 C ATOM 1348 C TRP A1008 -1.237 13.035 4.360 1.00 0.00 C ATOM 1349 O TRP A1008 -1.065 12.787 5.560 1.00 0.00 O ATOM 1350 CB TRP A1008 0.227 11.430 3.092 1.00 0.00 C ATOM 1351 CG TRP A1008 1.447 11.288 2.263 1.00 0.00 C ATOM 1352 CD1 TRP A1008 2.714 11.187 2.722 1.00 0.00 C ATOM 1353 CD2 TRP A1008 1.523 11.285 0.832 1.00 0.00 C ATOM 1354 NE1 TRP A1008 3.576 11.152 1.679 1.00 0.00 N ATOM 1355 CE2 TRP A1008 2.881 11.190 0.503 1.00 0.00 C ATOM 1356 CE3 TRP A1008 0.581 11.354 -0.197 1.00 0.00 C ATOM 1357 CZ2 TRP A1008 3.330 11.163 -0.814 1.00 0.00 C ATOM 1358 CZ3 TRP A1008 1.025 11.326 -1.505 1.00 0.00 C ATOM 1359 CH2 TRP A1008 2.389 11.229 -1.803 1.00 0.00 C ATOM 0 H TRP A1008 1.229 13.410 4.910 1.00 0.00 H new ATOM 0 HA TRP A1008 -0.380 13.354 2.422 1.00 0.00 H new ATOM 0 HB2 TRP A1008 0.363 10.901 4.035 1.00 0.00 H new ATOM 0 HB3 TRP A1008 -0.616 10.963 2.583 1.00 0.00 H new ATOM 0 HD1 TRP A1008 2.996 11.141 3.763 1.00 0.00 H new ATOM 0 HE1 TRP A1008 4.592 11.104 1.759 1.00 0.00 H new ATOM 0 HE3 TRP A1008 -0.473 11.428 0.025 1.00 0.00 H new ATOM 0 HZ2 TRP A1008 4.382 11.093 -1.046 1.00 0.00 H new ATOM 0 HZ3 TRP A1008 0.308 11.380 -2.311 1.00 0.00 H new ATOM 0 HH2 TRP A1008 2.704 11.206 -2.836 1.00 0.00 H new ATOM 1370 N VAL A1009 -2.398 13.405 3.847 1.00 0.00 N ATOM 1371 CA VAL A1009 -3.568 13.759 4.652 1.00 0.00 C ATOM 1372 C VAL A1009 -4.778 13.406 3.790 1.00 0.00 C ATOM 1373 O VAL A1009 -4.589 12.897 2.689 1.00 0.00 O ATOM 1374 CB VAL A1009 -3.634 15.288 4.973 1.00 0.00 C ATOM 1375 CG1 VAL A1009 -4.600 15.590 6.109 1.00 0.00 C ATOM 1376 CG2 VAL A1009 -2.273 15.901 5.277 1.00 0.00 C ATOM 0 H VAL A1009 -2.563 13.471 2.843 1.00 0.00 H new ATOM 0 HA VAL A1009 -3.531 13.230 5.604 1.00 0.00 H new ATOM 0 HB VAL A1009 -4.005 15.753 4.059 1.00 0.00 H new ATOM 0 HG11 VAL A1009 -4.615 16.663 6.299 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -5.601 15.256 5.834 1.00 0.00 H new ATOM 0 HG13 VAL A1009 -4.278 15.067 7.009 1.00 0.00 H new ATOM 0 HG21 VAL A1009 -2.392 16.963 5.491 1.00 0.00 H new ATOM 0 HG22 VAL A1009 -1.835 15.404 6.142 1.00 0.00 H new ATOM 0 HG23 VAL A1009 -1.617 15.775 4.416 1.00 0.00 H new ATOM 1386 N ALA A1010 -5.993 13.658 4.254 1.00 0.00 N ATOM 1387 CA ALA A1010 -7.180 13.426 3.450 1.00 0.00 C ATOM 1388 C ALA A1010 -7.182 14.373 2.253 1.00 0.00 C ATOM 1389 O ALA A1010 -7.303 15.586 2.406 1.00 0.00 O ATOM 1390 CB ALA A1010 -8.435 13.601 4.287 1.00 0.00 C ATOM 0 H ALA A1010 -6.181 14.025 5.187 1.00 0.00 H new ATOM 0 HA ALA A1010 -7.168 12.400 3.083 1.00 0.00 H new ATOM 0 HB1 ALA A1010 -9.314 13.423 3.667 1.00 0.00 H new ATOM 0 HB2 ALA A1010 -8.424 12.890 5.113 1.00 0.00 H new ATOM 0 HB3 ALA A1010 -8.470 14.616 4.683 1.00 0.00 H new ATOM 1396 N ALA A1011 -6.972 13.800 1.078 1.00 0.00 N ATOM 1397 CA ALA A1011 -6.903 14.524 -0.180 1.00 0.00 C ATOM 1398 C ALA A1011 -8.118 15.416 -0.399 1.00 0.00 C ATOM 1399 O ALA A1011 -9.220 14.926 -0.612 1.00 0.00 O ATOM 1400 CB ALA A1011 -6.780 13.524 -1.316 1.00 0.00 C ATOM 0 H ALA A1011 -6.842 12.794 0.971 1.00 0.00 H new ATOM 0 HA ALA A1011 -6.030 15.176 -0.150 1.00 0.00 H new ATOM 0 HB1 ALA A1011 -6.727 14.057 -2.266 1.00 0.00 H new ATOM 0 HB2 ALA A1011 -5.875 12.931 -1.182 1.00 0.00 H new ATOM 0 HB3 ALA A1011 -7.649 12.866 -1.317 1.00 0.00 H new ATOM 1406 N GLU A1012 -7.934 16.725 -0.301 1.00 0.00 N ATOM 1407 CA GLU A1012 -9.033 17.652 -0.525 1.00 0.00 C ATOM 1408 C GLU A1012 -8.682 18.761 -1.540 1.00 0.00 C ATOM 1409 O GLU A1012 -9.420 19.016 -2.480 1.00 0.00 O ATOM 1410 CB GLU A1012 -9.407 18.274 0.828 1.00 0.00 C ATOM 1411 CG GLU A1012 -8.229 18.946 1.537 1.00 0.00 C ATOM 1412 CD GLU A1012 -8.611 19.581 2.852 1.00 0.00 C ATOM 1413 OE1 GLU A1012 -9.363 20.581 2.836 1.00 0.00 O ATOM 1414 OE2 GLU A1012 -8.176 19.098 3.916 1.00 0.00 O ATOM 0 H GLU A1012 -7.043 17.165 -0.070 1.00 0.00 H new ATOM 0 HA GLU A1012 -9.870 17.101 -0.953 1.00 0.00 H new ATOM 0 HB2 GLU A1012 -10.196 19.010 0.675 1.00 0.00 H new ATOM 0 HB3 GLU A1012 -9.816 17.498 1.475 1.00 0.00 H new ATOM 0 HG2 GLU A1012 -7.448 18.206 1.711 1.00 0.00 H new ATOM 0 HG3 GLU A1012 -7.806 19.708 0.882 1.00 0.00 H new ATOM 1421 N LYS A1013 -7.529 19.382 -1.346 1.00 0.00 N ATOM 1422 CA LYS A1013 -7.150 20.603 -2.059 1.00 0.00 C ATOM 1423 C LYS A1013 -6.665 20.398 -3.491 1.00 0.00 C ATOM 1424 O LYS A1013 -6.018 19.419 -3.812 1.00 0.00 O ATOM 1425 CB LYS A1013 -6.058 21.281 -1.264 1.00 0.00 C ATOM 1426 CG LYS A1013 -4.788 20.460 -1.161 1.00 0.00 C ATOM 1427 CD LYS A1013 -3.938 20.942 -0.024 1.00 0.00 C ATOM 1428 CE LYS A1013 -3.567 22.412 -0.173 1.00 0.00 C ATOM 1429 NZ LYS A1013 -2.944 22.966 1.048 1.00 0.00 N ATOM 0 H LYS A1013 -6.822 19.055 -0.687 1.00 0.00 H new ATOM 0 HA LYS A1013 -8.055 21.205 -2.145 1.00 0.00 H new ATOM 0 HB2 LYS A1013 -5.825 22.240 -1.726 1.00 0.00 H new ATOM 0 HB3 LYS A1013 -6.427 21.492 -0.260 1.00 0.00 H new ATOM 0 HG2 LYS A1013 -5.039 19.409 -1.015 1.00 0.00 H new ATOM 0 HG3 LYS A1013 -4.229 20.527 -2.094 1.00 0.00 H new ATOM 0 HD2 LYS A1013 -4.472 20.796 0.915 1.00 0.00 H new ATOM 0 HD3 LYS A1013 -3.029 20.342 0.029 1.00 0.00 H new ATOM 0 HE2 LYS A1013 -2.880 22.527 -1.011 1.00 0.00 H new ATOM 0 HE3 LYS A1013 -4.462 22.987 -0.413 1.00 0.00 H new ATOM 0 HZ1 LYS A1013 -2.711 23.968 0.895 1.00 0.00 H new ATOM 0 HZ2 LYS A1013 -3.607 22.883 1.845 1.00 0.00 H new ATOM 0 HZ3 LYS A1013 -2.075 22.437 1.265 1.00 0.00 H new ATOM 1443 N MET A1014 -6.940 21.360 -4.329 1.00 0.00 N ATOM 1444 CA MET A1014 -6.474 21.365 -5.707 1.00 0.00 C ATOM 1445 C MET A1014 -4.966 21.400 -5.812 1.00 0.00 C ATOM 1446 O MET A1014 -4.384 20.686 -6.621 1.00 0.00 O ATOM 1447 CB MET A1014 -7.030 22.570 -6.406 1.00 0.00 C ATOM 1448 CG MET A1014 -6.626 22.696 -7.864 1.00 0.00 C ATOM 1449 SD MET A1014 -7.183 24.239 -8.604 1.00 0.00 S ATOM 1450 CE MET A1014 -6.445 24.075 -10.222 1.00 0.00 C ATOM 0 H MET A1014 -7.500 22.176 -4.081 1.00 0.00 H new ATOM 0 HA MET A1014 -6.818 20.440 -6.170 1.00 0.00 H new ATOM 0 HB2 MET A1014 -8.118 22.540 -6.345 1.00 0.00 H new ATOM 0 HB3 MET A1014 -6.706 23.464 -5.874 1.00 0.00 H new ATOM 0 HG2 MET A1014 -5.541 22.630 -7.944 1.00 0.00 H new ATOM 0 HG3 MET A1014 -7.039 21.858 -8.426 1.00 0.00 H new ATOM 0 HE1 MET A1014 -6.895 24.798 -10.902 1.00 0.00 H new ATOM 0 HE2 MET A1014 -5.373 24.259 -10.153 1.00 0.00 H new ATOM 0 HE3 MET A1014 -6.616 23.067 -10.600 1.00 0.00 H new ATOM 1460 N TYR A1015 -4.326 22.191 -4.962 1.00 0.00 N ATOM 1461 CA TYR A1015 -2.879 22.379 -5.017 1.00 0.00 C ATOM 1462 C TYR A1015 -2.103 21.133 -4.624 1.00 0.00 C ATOM 1463 O TYR A1015 -0.880 21.169 -4.549 1.00 0.00 O ATOM 1464 CB TYR A1015 -2.456 23.555 -4.139 1.00 0.00 C ATOM 1465 CG TYR A1015 -3.065 24.879 -4.545 1.00 0.00 C ATOM 1466 CD1 TYR A1015 -4.274 25.300 -4.015 1.00 0.00 C ATOM 1467 CD2 TYR A1015 -2.421 25.710 -5.455 1.00 0.00 C ATOM 1468 CE1 TYR A1015 -4.827 26.510 -4.381 1.00 0.00 C ATOM 1469 CE2 TYR A1015 -2.965 26.925 -5.819 1.00 0.00 C ATOM 1470 CZ TYR A1015 -4.170 27.319 -5.280 1.00 0.00 C ATOM 1471 OH TYR A1015 -4.718 28.535 -5.624 1.00 0.00 O ATOM 0 H TYR A1015 -4.788 22.717 -4.220 1.00 0.00 H new ATOM 0 HA TYR A1015 -2.636 22.593 -6.058 1.00 0.00 H new ATOM 0 HB2 TYR A1015 -2.732 23.342 -3.106 1.00 0.00 H new ATOM 0 HB3 TYR A1015 -1.370 23.643 -4.167 1.00 0.00 H new ATOM 0 HD1 TYR A1015 -4.791 24.672 -3.305 1.00 0.00 H new ATOM 0 HD2 TYR A1015 -1.480 25.400 -5.884 1.00 0.00 H new ATOM 0 HE1 TYR A1015 -5.773 26.821 -3.963 1.00 0.00 H new ATOM 0 HE2 TYR A1015 -2.449 27.563 -6.522 1.00 0.00 H new ATOM 0 HH TYR A1015 -4.133 28.987 -6.268 1.00 0.00 H new ATOM 1481 N HIS A1016 -2.793 20.035 -4.344 1.00 0.00 N ATOM 1482 CA HIS A1016 -2.004 18.831 -4.082 1.00 0.00 C ATOM 1483 C HIS A1016 -1.600 18.149 -5.373 1.00 0.00 C ATOM 1484 O HIS A1016 -2.439 17.873 -6.234 1.00 0.00 O ATOM 1485 CB HIS A1016 -2.539 17.871 -3.003 1.00 0.00 C ATOM 1486 CG HIS A1016 -3.722 17.025 -3.301 1.00 0.00 C ATOM 1487 ND1 HIS A1016 -4.952 17.345 -2.821 1.00 0.00 N ATOM 1488 CD2 HIS A1016 -3.834 15.791 -3.827 1.00 0.00 C ATOM 1489 CE1 HIS A1016 -5.776 16.362 -3.010 1.00 0.00 C ATOM 1490 NE2 HIS A1016 -5.135 15.396 -3.630 1.00 0.00 N ATOM 0 H HIS A1016 -3.808 19.946 -4.293 1.00 0.00 H new ATOM 0 HA HIS A1016 -1.098 19.197 -3.599 1.00 0.00 H new ATOM 0 HB2 HIS A1016 -1.723 17.205 -2.724 1.00 0.00 H new ATOM 0 HB3 HIS A1016 -2.778 18.468 -2.123 1.00 0.00 H new ATOM 0 HD2 HIS A1016 -3.053 15.222 -4.310 1.00 0.00 H new ATOM 0 HE1 HIS A1016 -6.813 16.340 -2.709 1.00 0.00 H new ATOM 0 HE2 HIS A1016 -5.536 14.503 -3.917 1.00 0.00 H new ATOM 1499 N THR A1017 -0.303 17.888 -5.481 1.00 0.00 N ATOM 1500 CA THR A1017 0.330 17.503 -6.734 1.00 0.00 C ATOM 1501 C THR A1017 0.583 16.005 -6.815 1.00 0.00 C ATOM 1502 O THR A1017 0.974 15.475 -7.841 1.00 0.00 O ATOM 1503 CB THR A1017 1.683 18.230 -6.856 1.00 0.00 C ATOM 1504 OG1 THR A1017 2.526 17.882 -5.734 1.00 0.00 O ATOM 1505 CG2 THR A1017 1.490 19.738 -6.885 1.00 0.00 C ATOM 0 H THR A1017 0.344 17.938 -4.694 1.00 0.00 H new ATOM 0 HA THR A1017 -0.347 17.779 -7.543 1.00 0.00 H new ATOM 0 HB THR A1017 2.154 17.919 -7.789 1.00 0.00 H new ATOM 0 HG1 THR A1017 2.935 17.005 -5.891 1.00 0.00 H new ATOM 0 HG21 THR A1017 2.460 20.227 -6.972 1.00 0.00 H new ATOM 0 HG22 THR A1017 0.869 20.009 -7.739 1.00 0.00 H new ATOM 0 HG23 THR A1017 1.002 20.060 -5.965 1.00 0.00 H new ATOM 1513 N HIS A1018 0.430 15.335 -5.715 1.00 0.00 N ATOM 1514 CA HIS A1018 0.722 13.908 -5.660 1.00 0.00 C ATOM 1515 C HIS A1018 -0.327 13.214 -4.820 1.00 0.00 C ATOM 1516 O HIS A1018 -0.842 13.799 -3.870 1.00 0.00 O ATOM 1517 CB HIS A1018 2.101 13.699 -5.026 1.00 0.00 C ATOM 1518 CG HIS A1018 2.911 12.549 -5.561 1.00 0.00 C ATOM 1519 ND1 HIS A1018 2.859 11.264 -5.061 1.00 0.00 N ATOM 1520 CD2 HIS A1018 3.878 12.537 -6.508 1.00 0.00 C ATOM 1521 CE1 HIS A1018 3.767 10.522 -5.677 1.00 0.00 C ATOM 1522 NE2 HIS A1018 4.401 11.271 -6.559 1.00 0.00 N ATOM 0 H HIS A1018 0.106 15.739 -4.836 1.00 0.00 H new ATOM 0 HA HIS A1018 0.715 13.493 -6.668 1.00 0.00 H new ATOM 0 HB2 HIS A1018 2.679 14.614 -5.154 1.00 0.00 H new ATOM 0 HB3 HIS A1018 1.967 13.554 -3.954 1.00 0.00 H new ATOM 0 HD2 HIS A1018 4.183 13.376 -7.116 1.00 0.00 H new ATOM 0 HE1 HIS A1018 3.957 9.476 -5.488 1.00 0.00 H new ATOM 0 HE2 HIS A1018 5.153 10.961 -7.174 1.00 0.00 H new ATOM 1531 N ARG A1019 -0.702 12.012 -5.196 1.00 0.00 N ATOM 1532 CA ARG A1019 -1.620 11.232 -4.397 1.00 0.00 C ATOM 1533 C ARG A1019 -1.196 9.785 -4.456 1.00 0.00 C ATOM 1534 O ARG A1019 -0.515 9.373 -5.401 1.00 0.00 O ATOM 1535 CB ARG A1019 -3.071 11.340 -4.875 1.00 0.00 C ATOM 1536 CG ARG A1019 -3.361 10.643 -6.196 1.00 0.00 C ATOM 1537 CD ARG A1019 -4.849 10.622 -6.452 1.00 0.00 C ATOM 1538 NE ARG A1019 -5.217 9.894 -7.680 1.00 0.00 N ATOM 1539 CZ ARG A1019 -6.395 9.993 -8.317 1.00 0.00 C ATOM 1540 NH1 ARG A1019 -7.374 10.756 -7.845 1.00 0.00 N ATOM 1541 NH2 ARG A1019 -6.588 9.302 -9.427 1.00 0.00 N ATOM 0 H ARG A1019 -0.385 11.553 -6.050 1.00 0.00 H new ATOM 0 HA ARG A1019 -1.585 11.624 -3.381 1.00 0.00 H new ATOM 0 HB2 ARG A1019 -3.723 10.921 -4.109 1.00 0.00 H new ATOM 0 HB3 ARG A1019 -3.329 12.394 -4.972 1.00 0.00 H new ATOM 0 HG2 ARG A1019 -2.851 11.160 -7.009 1.00 0.00 H new ATOM 0 HG3 ARG A1019 -2.973 9.625 -6.172 1.00 0.00 H new ATOM 0 HD2 ARG A1019 -5.351 10.162 -5.601 1.00 0.00 H new ATOM 0 HD3 ARG A1019 -5.214 11.647 -6.522 1.00 0.00 H new ATOM 0 HE ARG A1019 -4.520 9.264 -8.078 1.00 0.00 H new ATOM 0 HH11 ARG A1019 -7.239 11.282 -6.982 1.00 0.00 H new ATOM 0 HH12 ARG A1019 -8.261 10.816 -8.346 1.00 0.00 H new ATOM 0 HH21 ARG A1019 -5.847 8.703 -9.790 1.00 0.00 H new ATOM 0 HH22 ARG A1019 -7.478 9.368 -9.921 1.00 0.00 H new ATOM 1555 N ARG A1020 -1.520 9.060 -3.422 1.00 0.00 N ATOM 1556 CA ARG A1020 -1.265 7.634 -3.359 1.00 0.00 C ATOM 1557 C ARG A1020 -2.233 7.013 -2.404 1.00 0.00 C ATOM 1558 O ARG A1020 -2.967 7.705 -1.727 1.00 0.00 O ATOM 1559 CB ARG A1020 0.159 7.293 -2.894 1.00 0.00 C ATOM 1560 CG ARG A1020 0.499 7.914 -1.546 1.00 0.00 C ATOM 1561 CD ARG A1020 1.625 7.207 -0.813 1.00 0.00 C ATOM 1562 NE ARG A1020 2.885 7.152 -1.558 1.00 0.00 N ATOM 1563 CZ ARG A1020 4.090 7.059 -0.974 1.00 0.00 C ATOM 1564 NH1 ARG A1020 4.219 7.234 0.342 1.00 0.00 N ATOM 1565 NH2 ARG A1020 5.166 6.817 -1.712 1.00 0.00 N ATOM 0 H ARG A1020 -1.972 9.438 -2.589 1.00 0.00 H new ATOM 0 HA ARG A1020 -1.382 7.244 -4.370 1.00 0.00 H new ATOM 0 HB2 ARG A1020 0.266 6.210 -2.829 1.00 0.00 H new ATOM 0 HB3 ARG A1020 0.874 7.640 -3.640 1.00 0.00 H new ATOM 0 HG2 ARG A1020 0.775 8.958 -1.696 1.00 0.00 H new ATOM 0 HG3 ARG A1020 -0.392 7.907 -0.918 1.00 0.00 H new ATOM 0 HD2 ARG A1020 1.799 7.713 0.137 1.00 0.00 H new ATOM 0 HD3 ARG A1020 1.309 6.190 -0.579 1.00 0.00 H new ATOM 0 HE ARG A1020 2.844 7.186 -2.577 1.00 0.00 H new ATOM 0 HH11 ARG A1020 3.399 7.440 0.912 1.00 0.00 H new ATOM 0 HH12 ARG A1020 5.138 7.162 0.778 1.00 0.00 H new ATOM 0 HH21 ARG A1020 5.077 6.702 -2.722 1.00 0.00 H new ATOM 0 HH22 ARG A1020 6.082 6.746 -1.270 1.00 0.00 H new ATOM 1579 N ARG A1021 -2.287 5.717 -2.440 1.00 0.00 N ATOM 1580 CA ARG A1021 -3.102 4.973 -1.520 1.00 0.00 C ATOM 1581 C ARG A1021 -2.490 3.628 -1.262 1.00 0.00 C ATOM 1582 O ARG A1021 -1.761 3.113 -2.104 1.00 0.00 O ATOM 1583 CB ARG A1021 -4.491 4.816 -2.082 1.00 0.00 C ATOM 1584 CG ARG A1021 -4.541 4.227 -3.481 1.00 0.00 C ATOM 1585 CD ARG A1021 -5.961 4.167 -3.947 1.00 0.00 C ATOM 1586 NE ARG A1021 -6.037 3.706 -5.311 1.00 0.00 N ATOM 1587 CZ ARG A1021 -7.139 3.161 -5.844 1.00 0.00 C ATOM 1588 NH1 ARG A1021 -8.275 3.174 -5.153 1.00 0.00 N ATOM 1589 NH2 ARG A1021 -7.127 2.690 -7.081 1.00 0.00 N ATOM 0 H ARG A1021 -1.770 5.143 -3.106 1.00 0.00 H new ATOM 0 HA ARG A1021 -3.162 5.515 -0.576 1.00 0.00 H new ATOM 0 HB2 ARG A1021 -5.070 4.180 -1.413 1.00 0.00 H new ATOM 0 HB3 ARG A1021 -4.977 5.792 -2.095 1.00 0.00 H new ATOM 0 HG2 ARG A1021 -3.948 4.835 -4.164 1.00 0.00 H new ATOM 0 HG3 ARG A1021 -4.104 3.228 -3.482 1.00 0.00 H new ATOM 0 HD2 ARG A1021 -6.532 3.500 -3.301 1.00 0.00 H new ATOM 0 HD3 ARG A1021 -6.416 5.154 -3.867 1.00 0.00 H new ATOM 0 HE ARG A1021 -5.210 3.799 -5.900 1.00 0.00 H new ATOM 0 HH11 ARG A1021 -8.303 3.597 -4.225 1.00 0.00 H new ATOM 0 HH12 ARG A1021 -9.119 2.761 -5.551 1.00 0.00 H new ATOM 0 HH21 ARG A1021 -6.274 2.740 -7.638 1.00 0.00 H new ATOM 0 HH22 ARG A1021 -7.971 2.277 -7.478 1.00 0.00 H new ATOM 1603 N ARG A1022 -2.778 3.075 -0.108 1.00 0.00 N ATOM 1604 CA ARG A1022 -2.305 1.781 0.264 1.00 0.00 C ATOM 1605 C ARG A1022 -3.264 0.724 -0.252 1.00 0.00 C ATOM 1606 O ARG A1022 -4.434 0.705 0.138 1.00 0.00 O ATOM 1607 CB ARG A1022 -2.243 1.713 1.783 1.00 0.00 C ATOM 1608 CG ARG A1022 -2.172 0.307 2.324 1.00 0.00 C ATOM 1609 CD ARG A1022 -2.360 0.295 3.818 1.00 0.00 C ATOM 1610 NE ARG A1022 -1.204 0.808 4.497 1.00 0.00 N ATOM 1611 CZ ARG A1022 -1.094 0.871 5.826 1.00 0.00 C ATOM 1612 NH1 ARG A1022 -2.180 0.943 6.590 1.00 0.00 N ATOM 1613 NH2 ARG A1022 0.110 0.956 6.376 1.00 0.00 N ATOM 0 H ARG A1022 -3.356 3.525 0.602 1.00 0.00 H new ATOM 0 HA ARG A1022 -1.317 1.604 -0.162 1.00 0.00 H new ATOM 0 HB2 ARG A1022 -1.372 2.270 2.128 1.00 0.00 H new ATOM 0 HB3 ARG A1022 -3.122 2.208 2.196 1.00 0.00 H new ATOM 0 HG2 ARG A1022 -2.939 -0.307 1.852 1.00 0.00 H new ATOM 0 HG3 ARG A1022 -1.209 -0.136 2.071 1.00 0.00 H new ATOM 0 HD2 ARG A1022 -3.233 0.893 4.081 1.00 0.00 H new ATOM 0 HD3 ARG A1022 -2.558 -0.723 4.153 1.00 0.00 H new ATOM 0 HE ARG A1022 -0.423 1.143 3.933 1.00 0.00 H new ATOM 0 HH11 ARG A1022 -3.106 0.950 6.161 1.00 0.00 H new ATOM 0 HH12 ARG A1022 -2.087 0.991 7.605 1.00 0.00 H new ATOM 0 HH21 ARG A1022 0.941 0.973 5.785 1.00 0.00 H new ATOM 0 HH22 ARG A1022 0.205 1.005 7.390 1.00 0.00 H new ATOM 1627 N LEU A1023 -2.804 -0.106 -1.160 1.00 0.00 N ATOM 1628 CA LEU A1023 -3.555 -1.255 -1.529 1.00 0.00 C ATOM 1629 C LEU A1023 -3.181 -2.320 -0.534 1.00 0.00 C ATOM 1630 O LEU A1023 -1.997 -2.564 -0.293 1.00 0.00 O ATOM 1631 CB LEU A1023 -3.272 -1.701 -2.961 1.00 0.00 C ATOM 1632 CG LEU A1023 -3.494 -0.632 -4.034 1.00 0.00 C ATOM 1633 CD1 LEU A1023 -3.139 -1.177 -5.404 1.00 0.00 C ATOM 1634 CD2 LEU A1023 -4.939 -0.153 -4.027 1.00 0.00 C ATOM 0 H LEU A1023 -1.915 0.003 -1.648 1.00 0.00 H new ATOM 0 HA LEU A1023 -4.624 -1.042 -1.510 1.00 0.00 H new ATOM 0 HB2 LEU A1023 -2.239 -2.043 -3.020 1.00 0.00 H new ATOM 0 HB3 LEU A1023 -3.905 -2.558 -3.189 1.00 0.00 H new ATOM 0 HG LEU A1023 -2.845 0.214 -3.809 1.00 0.00 H new ATOM 0 HD11 LEU A1023 -3.302 -0.405 -6.156 1.00 0.00 H new ATOM 0 HD12 LEU A1023 -2.092 -1.479 -5.415 1.00 0.00 H new ATOM 0 HD13 LEU A1023 -3.768 -2.039 -5.627 1.00 0.00 H new ATOM 0 HD21 LEU A1023 -5.074 0.606 -4.797 1.00 0.00 H new ATOM 0 HD22 LEU A1023 -5.602 -0.995 -4.227 1.00 0.00 H new ATOM 0 HD23 LEU A1023 -5.176 0.273 -3.052 1.00 0.00 H new ATOM 1646 N VAL A1024 -4.173 -2.902 0.075 1.00 0.00 N ATOM 1647 CA VAL A1024 -3.955 -3.831 1.154 1.00 0.00 C ATOM 1648 C VAL A1024 -4.154 -5.246 0.708 1.00 0.00 C ATOM 1649 O VAL A1024 -5.096 -5.558 -0.028 1.00 0.00 O ATOM 1650 CB VAL A1024 -4.854 -3.565 2.386 1.00 0.00 C ATOM 1651 CG1 VAL A1024 -4.392 -2.330 3.116 1.00 0.00 C ATOM 1652 CG2 VAL A1024 -6.321 -3.418 1.993 1.00 0.00 C ATOM 0 H VAL A1024 -5.154 -2.749 -0.159 1.00 0.00 H new ATOM 0 HA VAL A1024 -2.919 -3.677 1.455 1.00 0.00 H new ATOM 0 HB VAL A1024 -4.768 -4.428 3.046 1.00 0.00 H new ATOM 0 HG11 VAL A1024 -5.034 -2.156 3.980 1.00 0.00 H new ATOM 0 HG12 VAL A1024 -3.364 -2.468 3.450 1.00 0.00 H new ATOM 0 HG13 VAL A1024 -4.444 -1.471 2.447 1.00 0.00 H new ATOM 0 HG21 VAL A1024 -6.920 -3.232 2.885 1.00 0.00 H new ATOM 0 HG22 VAL A1024 -6.431 -2.582 1.302 1.00 0.00 H new ATOM 0 HG23 VAL A1024 -6.662 -4.334 1.511 1.00 0.00 H new ATOM 1662 N ARG A1025 -3.216 -6.070 1.086 1.00 0.00 N ATOM 1663 CA ARG A1025 -3.351 -7.494 0.899 1.00 0.00 C ATOM 1664 C ARG A1025 -2.781 -8.188 2.117 1.00 0.00 C ATOM 1665 O ARG A1025 -1.568 -8.258 2.274 1.00 0.00 O ATOM 1666 CB ARG A1025 -2.587 -7.957 -0.323 1.00 0.00 C ATOM 1667 CG ARG A1025 -2.988 -9.325 -0.817 1.00 0.00 C ATOM 1668 CD ARG A1025 -4.326 -9.278 -1.521 1.00 0.00 C ATOM 1669 NE ARG A1025 -4.765 -10.607 -1.937 1.00 0.00 N ATOM 1670 CZ ARG A1025 -4.420 -11.199 -3.079 1.00 0.00 C ATOM 1671 NH1 ARG A1025 -3.630 -10.581 -3.939 1.00 0.00 N ATOM 1672 NH2 ARG A1025 -4.875 -12.410 -3.364 1.00 0.00 N ATOM 0 H ARG A1025 -2.344 -5.781 1.528 1.00 0.00 H new ATOM 0 HA ARG A1025 -4.405 -7.735 0.761 1.00 0.00 H new ATOM 0 HB2 ARG A1025 -2.734 -7.235 -1.126 1.00 0.00 H new ATOM 0 HB3 ARG A1025 -1.522 -7.964 -0.092 1.00 0.00 H new ATOM 0 HG2 ARG A1025 -2.228 -9.706 -1.499 1.00 0.00 H new ATOM 0 HG3 ARG A1025 -3.039 -10.018 0.023 1.00 0.00 H new ATOM 0 HD2 ARG A1025 -5.071 -8.840 -0.857 1.00 0.00 H new ATOM 0 HD3 ARG A1025 -4.255 -8.629 -2.394 1.00 0.00 H new ATOM 0 HE ARG A1025 -5.381 -11.120 -1.306 1.00 0.00 H new ATOM 0 HH11 ARG A1025 -3.281 -9.646 -3.730 1.00 0.00 H new ATOM 0 HH12 ARG A1025 -3.369 -11.039 -4.812 1.00 0.00 H new ATOM 0 HH21 ARG A1025 -5.491 -12.891 -2.708 1.00 0.00 H new ATOM 0 HH22 ARG A1025 -4.610 -12.862 -4.239 1.00 0.00 H new ATOM 1686 N LYS A1026 -3.628 -8.658 2.999 1.00 0.00 N ATOM 1687 CA LYS A1026 -3.147 -9.313 4.194 1.00 0.00 C ATOM 1688 C LYS A1026 -2.672 -10.724 3.818 1.00 0.00 C ATOM 1689 O LYS A1026 -3.272 -11.387 2.957 1.00 0.00 O ATOM 1690 CB LYS A1026 -4.260 -9.283 5.257 1.00 0.00 C ATOM 1691 CG LYS A1026 -3.808 -9.483 6.699 1.00 0.00 C ATOM 1692 CD LYS A1026 -3.612 -10.936 7.056 1.00 0.00 C ATOM 1693 CE LYS A1026 -4.929 -11.687 6.967 1.00 0.00 C ATOM 1694 NZ LYS A1026 -4.824 -13.073 7.473 1.00 0.00 N ATOM 0 H LYS A1026 -4.643 -8.601 2.916 1.00 0.00 H new ATOM 0 HA LYS A1026 -2.290 -8.801 4.632 1.00 0.00 H new ATOM 0 HB2 LYS A1026 -4.776 -8.326 5.188 1.00 0.00 H new ATOM 0 HB3 LYS A1026 -4.989 -10.056 5.014 1.00 0.00 H new ATOM 0 HG2 LYS A1026 -2.874 -8.945 6.860 1.00 0.00 H new ATOM 0 HG3 LYS A1026 -4.547 -9.045 7.370 1.00 0.00 H new ATOM 0 HD2 LYS A1026 -2.883 -11.387 6.383 1.00 0.00 H new ATOM 0 HD3 LYS A1026 -3.207 -11.018 8.065 1.00 0.00 H new ATOM 0 HE2 LYS A1026 -5.688 -11.152 7.537 1.00 0.00 H new ATOM 0 HE3 LYS A1026 -5.264 -11.706 5.930 1.00 0.00 H new ATOM 0 HZ1 LYS A1026 -5.548 -13.665 7.017 1.00 0.00 H new ATOM 0 HZ2 LYS A1026 -3.880 -13.451 7.255 1.00 0.00 H new ATOM 0 HZ3 LYS A1026 -4.970 -13.079 8.503 1.00 0.00 H new ATOM 1708 N ARG A1027 -1.632 -11.204 4.483 1.00 0.00 N ATOM 1709 CA ARG A1027 -0.970 -12.442 4.107 1.00 0.00 C ATOM 1710 C ARG A1027 -0.721 -13.196 5.376 1.00 0.00 C ATOM 1711 O ARG A1027 -0.715 -12.600 6.427 1.00 0.00 O ATOM 1712 CB ARG A1027 0.336 -12.178 3.325 1.00 0.00 C ATOM 1713 CG ARG A1027 1.281 -11.171 3.963 1.00 0.00 C ATOM 1714 CD ARG A1027 2.397 -10.736 3.011 1.00 0.00 C ATOM 1715 NE ARG A1027 3.413 -11.756 2.767 1.00 0.00 N ATOM 1716 CZ ARG A1027 4.710 -11.449 2.581 1.00 0.00 C ATOM 1717 NH1 ARG A1027 5.069 -10.212 2.252 1.00 0.00 N ATOM 1718 NH2 ARG A1027 5.643 -12.380 2.667 1.00 0.00 N ATOM 0 H ARG A1027 -1.224 -10.746 5.298 1.00 0.00 H new ATOM 0 HA ARG A1027 -1.596 -13.026 3.432 1.00 0.00 H new ATOM 0 HB2 ARG A1027 0.866 -13.123 3.204 1.00 0.00 H new ATOM 0 HB3 ARG A1027 0.078 -11.827 2.326 1.00 0.00 H new ATOM 0 HG2 ARG A1027 0.715 -10.295 4.279 1.00 0.00 H new ATOM 0 HG3 ARG A1027 1.721 -11.607 4.860 1.00 0.00 H new ATOM 0 HD2 ARG A1027 1.953 -10.447 2.058 1.00 0.00 H new ATOM 0 HD3 ARG A1027 2.881 -9.849 3.419 1.00 0.00 H new ATOM 0 HE ARG A1027 3.130 -12.735 2.736 1.00 0.00 H new ATOM 0 HH11 ARG A1027 4.359 -9.488 2.139 1.00 0.00 H new ATOM 0 HH12 ARG A1027 6.054 -9.987 2.113 1.00 0.00 H new ATOM 0 HH21 ARG A1027 5.384 -13.344 2.876 1.00 0.00 H new ATOM 0 HH22 ARG A1027 6.623 -12.135 2.524 1.00 0.00 H new ATOM 1732 N LYS A1028 -0.554 -14.477 5.288 1.00 0.00 N ATOM 1733 CA LYS A1028 -0.425 -15.320 6.444 1.00 0.00 C ATOM 1734 C LYS A1028 0.599 -16.381 6.143 1.00 0.00 C ATOM 1735 O LYS A1028 0.796 -16.737 5.017 1.00 0.00 O ATOM 1736 CB LYS A1028 -1.762 -15.980 6.736 1.00 0.00 C ATOM 1737 CG LYS A1028 -2.170 -16.936 5.636 1.00 0.00 C ATOM 1738 CD LYS A1028 -3.585 -17.390 5.776 1.00 0.00 C ATOM 1739 CE LYS A1028 -3.854 -18.124 7.070 1.00 0.00 C ATOM 1740 NZ LYS A1028 -5.251 -18.625 7.069 1.00 0.00 N ATOM 0 H LYS A1028 -0.502 -14.978 4.401 1.00 0.00 H new ATOM 0 HA LYS A1028 -0.117 -14.732 7.309 1.00 0.00 H new ATOM 0 HB2 LYS A1028 -1.702 -16.519 7.682 1.00 0.00 H new ATOM 0 HB3 LYS A1028 -2.528 -15.213 6.853 1.00 0.00 H new ATOM 0 HG2 LYS A1028 -2.041 -16.450 4.669 1.00 0.00 H new ATOM 0 HG3 LYS A1028 -1.510 -17.803 5.648 1.00 0.00 H new ATOM 0 HD2 LYS A1028 -4.244 -16.524 5.714 1.00 0.00 H new ATOM 0 HD3 LYS A1028 -3.834 -18.042 4.939 1.00 0.00 H new ATOM 0 HE2 LYS A1028 -3.158 -18.955 7.181 1.00 0.00 H new ATOM 0 HE3 LYS A1028 -3.695 -17.459 7.919 1.00 0.00 H new ATOM 0 HZ1 LYS A1028 -5.333 -19.427 7.726 1.00 0.00 H new ATOM 0 HZ2 LYS A1028 -5.893 -17.864 7.370 1.00 0.00 H new ATOM 0 HZ3 LYS A1028 -5.508 -18.936 6.110 1.00 0.00 H new ATOM 1754 N LYS A1029 1.260 -16.850 7.144 1.00 0.00 N ATOM 1755 CA LYS A1029 2.231 -17.914 6.986 1.00 0.00 C ATOM 1756 C LYS A1029 1.487 -19.217 7.151 1.00 0.00 C ATOM 1757 O LYS A1029 1.920 -20.299 6.750 1.00 0.00 O ATOM 1758 CB LYS A1029 3.285 -17.771 8.083 1.00 0.00 C ATOM 1759 CG LYS A1029 4.451 -18.724 7.972 1.00 0.00 C ATOM 1760 CD LYS A1029 5.485 -18.458 9.051 1.00 0.00 C ATOM 1761 CE LYS A1029 5.902 -17.003 9.045 1.00 0.00 C ATOM 1762 NZ LYS A1029 6.965 -16.713 10.039 1.00 0.00 N ATOM 0 H LYS A1029 1.154 -16.517 8.102 1.00 0.00 H new ATOM 0 HA LYS A1029 2.722 -17.877 6.014 1.00 0.00 H new ATOM 0 HB2 LYS A1029 3.666 -16.750 8.069 1.00 0.00 H new ATOM 0 HB3 LYS A1029 2.804 -17.919 9.050 1.00 0.00 H new ATOM 0 HG2 LYS A1029 4.093 -19.751 8.053 1.00 0.00 H new ATOM 0 HG3 LYS A1029 4.913 -18.624 6.990 1.00 0.00 H new ATOM 0 HD2 LYS A1029 5.076 -18.720 10.027 1.00 0.00 H new ATOM 0 HD3 LYS A1029 6.357 -19.092 8.890 1.00 0.00 H new ATOM 0 HE2 LYS A1029 6.256 -16.734 8.050 1.00 0.00 H new ATOM 0 HE3 LYS A1029 5.033 -16.378 9.254 1.00 0.00 H new ATOM 0 HZ1 LYS A1029 7.215 -15.704 9.995 1.00 0.00 H new ATOM 0 HZ2 LYS A1029 6.621 -16.943 10.993 1.00 0.00 H new ATOM 0 HZ3 LYS A1029 7.805 -17.288 9.826 1.00 0.00 H new ATOM 1776 N ASP A1030 0.342 -19.042 7.796 1.00 0.00 N ATOM 1777 CA ASP A1030 -0.579 -20.087 8.283 1.00 0.00 C ATOM 1778 C ASP A1030 0.104 -21.113 9.198 1.00 0.00 C ATOM 1779 O ASP A1030 -0.525 -22.019 9.737 1.00 0.00 O ATOM 1780 CB ASP A1030 -1.327 -20.755 7.127 1.00 0.00 C ATOM 1781 CG ASP A1030 -2.451 -21.643 7.617 1.00 0.00 C ATOM 1782 OD1 ASP A1030 -3.314 -21.150 8.374 1.00 0.00 O ATOM 1783 OD2 ASP A1030 -2.465 -22.849 7.290 1.00 0.00 O ATOM 0 H ASP A1030 -0.001 -18.106 8.013 1.00 0.00 H new ATOM 0 HA ASP A1030 -1.318 -19.582 8.906 1.00 0.00 H new ATOM 0 HB2 ASP A1030 -1.732 -19.989 6.466 1.00 0.00 H new ATOM 0 HB3 ASP A1030 -0.628 -21.347 6.537 1.00 0.00 H new ATOM 1788 N LEU A1031 1.397 -20.896 9.387 1.00 0.00 N ATOM 1789 CA LEU A1031 2.307 -21.715 10.179 1.00 0.00 C ATOM 1790 C LEU A1031 2.487 -23.098 9.536 1.00 0.00 C ATOM 1791 O LEU A1031 3.148 -23.983 10.077 1.00 0.00 O ATOM 1792 CB LEU A1031 1.783 -21.860 11.594 1.00 0.00 C ATOM 1793 CG LEU A1031 2.827 -22.171 12.653 1.00 0.00 C ATOM 1794 CD1 LEU A1031 3.774 -20.991 12.827 1.00 0.00 C ATOM 1795 CD2 LEU A1031 2.156 -22.526 13.965 1.00 0.00 C ATOM 0 H LEU A1031 1.869 -20.095 8.967 1.00 0.00 H new ATOM 0 HA LEU A1031 3.278 -21.220 10.211 1.00 0.00 H new ATOM 0 HB2 LEU A1031 1.275 -20.936 11.871 1.00 0.00 H new ATOM 0 HB3 LEU A1031 1.033 -22.651 11.605 1.00 0.00 H new ATOM 0 HG LEU A1031 3.413 -23.030 12.327 1.00 0.00 H new ATOM 0 HD11 LEU A1031 4.516 -21.229 13.589 1.00 0.00 H new ATOM 0 HD12 LEU A1031 4.277 -20.786 11.882 1.00 0.00 H new ATOM 0 HD13 LEU A1031 3.207 -20.112 13.135 1.00 0.00 H new ATOM 0 HD21 LEU A1031 2.916 -22.746 14.714 1.00 0.00 H new ATOM 0 HD22 LEU A1031 1.548 -21.687 14.301 1.00 0.00 H new ATOM 0 HD23 LEU A1031 1.521 -23.401 13.824 1.00 0.00 H new ATOM 1807 N THR A1032 1.918 -23.266 8.357 1.00 0.00 N ATOM 1808 CA THR A1032 1.968 -24.518 7.652 1.00 0.00 C ATOM 1809 C THR A1032 2.940 -24.407 6.498 1.00 0.00 C ATOM 1810 O THR A1032 3.289 -25.389 5.844 1.00 0.00 O ATOM 1811 CB THR A1032 0.558 -24.887 7.156 1.00 0.00 C ATOM 1812 OG1 THR A1032 -0.047 -23.747 6.516 1.00 0.00 O ATOM 1813 CG2 THR A1032 -0.314 -25.344 8.312 1.00 0.00 C ATOM 0 H THR A1032 1.408 -22.531 7.866 1.00 0.00 H new ATOM 0 HA THR A1032 2.314 -25.308 8.319 1.00 0.00 H new ATOM 0 HB THR A1032 0.646 -25.704 6.440 1.00 0.00 H new ATOM 0 HG1 THR A1032 -0.957 -23.625 6.857 1.00 0.00 H new ATOM 0 HG21 THR A1032 -1.306 -25.600 7.940 1.00 0.00 H new ATOM 0 HG22 THR A1032 0.134 -26.219 8.782 1.00 0.00 H new ATOM 0 HG23 THR A1032 -0.397 -24.541 9.045 1.00 0.00 H new ATOM 1821 N GLN A1033 3.400 -23.189 6.264 1.00 0.00 N ATOM 1822 CA GLN A1033 4.334 -22.959 5.171 1.00 0.00 C ATOM 1823 C GLN A1033 5.741 -22.728 5.689 1.00 0.00 C ATOM 1824 O GLN A1033 6.670 -22.473 4.923 1.00 0.00 O ATOM 1825 CB GLN A1033 3.916 -21.793 4.288 1.00 0.00 C ATOM 1826 CG GLN A1033 3.762 -22.217 2.844 1.00 0.00 C ATOM 1827 CD GLN A1033 3.770 -21.060 1.871 1.00 0.00 C ATOM 1828 OE1 GLN A1033 4.832 -20.655 1.383 1.00 0.00 O ATOM 1829 NE2 GLN A1033 2.612 -20.541 1.552 1.00 0.00 N ATOM 0 H GLN A1033 3.150 -22.360 6.802 1.00 0.00 H new ATOM 0 HA GLN A1033 4.321 -23.863 4.563 1.00 0.00 H new ATOM 0 HB2 GLN A1033 2.974 -21.381 4.650 1.00 0.00 H new ATOM 0 HB3 GLN A1033 4.659 -20.998 4.358 1.00 0.00 H new ATOM 0 HG2 GLN A1033 4.569 -22.903 2.587 1.00 0.00 H new ATOM 0 HG3 GLN A1033 2.828 -22.768 2.733 1.00 0.00 H new ATOM 0 HE21 GLN A1033 1.757 -20.902 1.976 1.00 0.00 H new ATOM 0 HE22 GLN A1033 2.564 -19.776 0.880 1.00 0.00 H new ATOM 1838 N THR A1034 5.888 -22.790 6.987 1.00 0.00 N ATOM 1839 CA THR A1034 7.175 -22.652 7.627 1.00 0.00 C ATOM 1840 C THR A1034 7.127 -23.439 8.926 1.00 0.00 C ATOM 1841 O THR A1034 6.664 -22.942 9.953 1.00 0.00 O ATOM 1842 CB THR A1034 7.531 -21.165 7.896 1.00 0.00 C ATOM 1843 OG1 THR A1034 7.421 -20.409 6.679 1.00 0.00 O ATOM 1844 CG2 THR A1034 8.949 -21.026 8.411 1.00 0.00 C ATOM 0 H THR A1034 5.115 -22.938 7.636 1.00 0.00 H new ATOM 0 HA THR A1034 7.954 -23.039 6.970 1.00 0.00 H new ATOM 0 HB THR A1034 6.836 -20.790 8.647 1.00 0.00 H new ATOM 0 HG1 THR A1034 7.645 -19.471 6.855 1.00 0.00 H new ATOM 0 HG21 THR A1034 9.169 -19.974 8.590 1.00 0.00 H new ATOM 0 HG22 THR A1034 9.054 -21.582 9.342 1.00 0.00 H new ATOM 0 HG23 THR A1034 9.645 -21.422 7.671 1.00 0.00 H new ATOM 1852 N ALA A1035 7.480 -24.702 8.827 1.00 0.00 N ATOM 1853 CA ALA A1035 7.467 -25.599 9.962 1.00 0.00 C ATOM 1854 C ALA A1035 8.882 -25.789 10.495 1.00 0.00 C ATOM 1855 O ALA A1035 9.830 -25.173 9.992 1.00 0.00 O ATOM 1856 CB ALA A1035 6.857 -26.925 9.543 1.00 0.00 C ATOM 0 H ALA A1035 7.785 -25.137 7.956 1.00 0.00 H new ATOM 0 HA ALA A1035 6.863 -25.173 10.763 1.00 0.00 H new ATOM 0 HB1 ALA A1035 6.845 -27.605 10.395 1.00 0.00 H new ATOM 0 HB2 ALA A1035 5.837 -26.762 9.194 1.00 0.00 H new ATOM 0 HB3 ALA A1035 7.451 -27.361 8.739 1.00 0.00 H new ATOM 1862 N SER A1036 9.032 -26.645 11.489 1.00 0.00 N ATOM 1863 CA SER A1036 10.325 -26.913 12.080 1.00 0.00 C ATOM 1864 C SER A1036 11.147 -27.778 11.129 1.00 0.00 C ATOM 1865 O SER A1036 10.824 -28.948 10.900 1.00 0.00 O ATOM 1866 CB SER A1036 10.149 -27.615 13.440 1.00 0.00 C ATOM 1867 OG SER A1036 11.397 -27.916 14.064 1.00 0.00 O ATOM 0 H SER A1036 8.264 -27.170 11.906 1.00 0.00 H new ATOM 0 HA SER A1036 10.852 -25.973 12.247 1.00 0.00 H new ATOM 0 HB2 SER A1036 9.560 -26.979 14.100 1.00 0.00 H new ATOM 0 HB3 SER A1036 9.585 -28.537 13.299 1.00 0.00 H new ATOM 0 HG SER A1036 11.235 -28.359 14.923 1.00 0.00 H new ATOM 1873 N SER A1037 12.156 -27.183 10.515 1.00 0.00 N ATOM 1874 CA SER A1037 13.054 -27.938 9.679 1.00 0.00 C ATOM 1875 C SER A1037 13.974 -28.706 10.619 1.00 0.00 C ATOM 1876 O SER A1037 14.595 -28.116 11.511 1.00 0.00 O ATOM 1877 CB SER A1037 13.836 -27.008 8.738 1.00 0.00 C ATOM 1878 OG SER A1037 14.542 -27.745 7.750 1.00 0.00 O ATOM 0 H SER A1037 12.367 -26.187 10.583 1.00 0.00 H new ATOM 0 HA SER A1037 12.513 -28.629 9.032 1.00 0.00 H new ATOM 0 HB2 SER A1037 13.148 -26.315 8.254 1.00 0.00 H new ATOM 0 HB3 SER A1037 14.538 -26.408 9.317 1.00 0.00 H new ATOM 0 HG SER A1037 15.028 -27.126 7.166 1.00 0.00 H new ATOM 1884 N THR A1038 13.997 -30.012 10.474 1.00 0.00 N ATOM 1885 CA THR A1038 14.720 -30.873 11.384 1.00 0.00 C ATOM 1886 C THR A1038 16.231 -30.805 11.193 1.00 0.00 C ATOM 1887 O THR A1038 16.718 -30.539 10.093 1.00 0.00 O ATOM 1888 CB THR A1038 14.212 -32.315 11.235 1.00 0.00 C ATOM 1889 OG1 THR A1038 14.126 -32.674 9.842 1.00 0.00 O ATOM 1890 CG2 THR A1038 12.846 -32.464 11.884 1.00 0.00 C ATOM 0 H THR A1038 13.516 -30.507 9.723 1.00 0.00 H new ATOM 0 HA THR A1038 14.529 -30.518 12.397 1.00 0.00 H new ATOM 0 HB THR A1038 14.918 -32.980 11.733 1.00 0.00 H new ATOM 0 HG1 THR A1038 13.803 -33.596 9.761 1.00 0.00 H new ATOM 0 HG21 THR A1038 12.499 -33.491 11.770 1.00 0.00 H new ATOM 0 HG22 THR A1038 12.918 -32.221 12.944 1.00 0.00 H new ATOM 0 HG23 THR A1038 12.139 -31.787 11.404 1.00 0.00 H new ATOM 1898 N ALA A1039 16.962 -30.994 12.276 1.00 0.00 N ATOM 1899 CA ALA A1039 18.409 -31.040 12.211 1.00 0.00 C ATOM 1900 C ALA A1039 18.827 -32.424 11.751 1.00 0.00 C ATOM 1901 O ALA A1039 19.761 -32.587 10.962 1.00 0.00 O ATOM 1902 CB ALA A1039 19.012 -30.710 13.567 1.00 0.00 C ATOM 0 H ALA A1039 16.576 -31.118 13.212 1.00 0.00 H new ATOM 0 HA ALA A1039 18.774 -30.297 11.502 1.00 0.00 H new ATOM 0 HB1 ALA A1039 20.099 -30.749 13.501 1.00 0.00 H new ATOM 0 HB2 ALA A1039 18.702 -29.710 13.869 1.00 0.00 H new ATOM 0 HB3 ALA A1039 18.667 -31.435 14.305 1.00 0.00 H new ATOM 1908 N ARG A1040 18.083 -33.410 12.208 1.00 0.00 N ATOM 1909 CA ARG A1040 18.301 -34.790 11.836 1.00 0.00 C ATOM 1910 C ARG A1040 17.242 -35.163 10.809 1.00 0.00 C ATOM 1911 O ARG A1040 17.557 -35.195 9.602 1.00 0.00 O ATOM 1912 CB ARG A1040 18.189 -35.702 13.058 1.00 0.00 C ATOM 1913 CG ARG A1040 19.175 -35.381 14.164 1.00 0.00 C ATOM 1914 CD ARG A1040 18.910 -36.238 15.387 1.00 0.00 C ATOM 1915 NE ARG A1040 17.577 -35.989 15.952 1.00 0.00 N ATOM 1916 CZ ARG A1040 16.893 -36.856 16.707 1.00 0.00 C ATOM 1917 NH1 ARG A1040 17.461 -37.986 17.114 1.00 0.00 N ATOM 1918 NH2 ARG A1040 15.665 -36.561 17.116 1.00 0.00 N ATOM 1919 OXT ARG A1040 16.073 -35.346 11.202 1.00 0.00 O ATOM 0 H ARG A1040 17.305 -33.274 12.853 1.00 0.00 H new ATOM 0 HA ARG A1040 19.301 -34.913 11.421 1.00 0.00 H new ATOM 0 HB2 ARG A1040 17.177 -35.634 13.457 1.00 0.00 H new ATOM 0 HB3 ARG A1040 18.338 -36.735 12.742 1.00 0.00 H new ATOM 0 HG2 ARG A1040 20.192 -35.549 13.810 1.00 0.00 H new ATOM 0 HG3 ARG A1040 19.100 -34.327 14.430 1.00 0.00 H new ATOM 0 HD2 ARG A1040 19.000 -37.291 15.119 1.00 0.00 H new ATOM 0 HD3 ARG A1040 19.668 -36.036 16.143 1.00 0.00 H new ATOM 0 HE ARG A1040 17.141 -35.089 15.754 1.00 0.00 H new ATOM 0 HH11 ARG A1040 18.424 -38.196 16.851 1.00 0.00 H new ATOM 0 HH12 ARG A1040 16.934 -38.643 17.690 1.00 0.00 H new ATOM 0 HH21 ARG A1040 15.240 -35.671 16.855 1.00 0.00 H new ATOM 0 HH22 ARG A1040 15.146 -37.224 17.692 1.00 0.00 H new TER 1933 ARG A1040