USER MOD reduce.3.24.130724 H: found=0, std=0, add=926, rem=0, adj=29 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 941 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 947 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 939 SER OG : rot 180:sc= -0.0125 USER MOD Set 2.2: A1018 HIS : no HD1:sc= -2.26 K(o=-2.3,f=-0.028) USER MOD Set 3.1: A 937 ASN : amide:sc= -0.193 K(o=1,f=-6!) USER MOD Set 3.2: A 954 THR OG1 : rot -75:sc= 1.22 USER MOD Set 4.1: A 936 GLN : amide:sc= 1.84 K(o=2.8,f=-6.6!) USER MOD Set 4.2: A 953 TYR OH : rot 180:sc= 0.988 USER MOD Single : A 922 THR OG1 : rot 162:sc= 0.109 USER MOD Single : A 927 HIS : no HD1:sc= 0.946 K(o=0.95,f=-4!) USER MOD Single : A 928 THR OG1 : rot 180:sc= -0.196 USER MOD Single : A 931 THR OG1 : rot 180:sc= -0.239 USER MOD Single : A 935 TYR OH : rot 180:sc= 0 USER MOD Single : A 952 THR OG1 : rot 180:sc= 0.0081 USER MOD Single : A 957 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 960 LYS NZ :NH3+ 180:sc= 0.321 (180deg=0.321) USER MOD Single : A 963 SER OG : rot 180:sc= 0 USER MOD Single : A 965 SER OG : rot 180:sc= 0 USER MOD Single : A 968 THR OG1 : rot 180:sc= 0.00341 USER MOD Single : A 969 CYS SG : rot -120:sc= 0.325 USER MOD Single : A 981 SER OG : rot 60:sc= 0.889 USER MOD Single : A 982 TYR OH : rot 180:sc= 0 USER MOD Single : A 985 ASN : amide:sc= -0.844 K(o=-0.84,f=-0.057) USER MOD Single : A 991 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 995 TYR OH : rot 180:sc= -0.0956 USER MOD Single : A 998 THR OG1 : rot 180:sc= 0 USER MOD Single : A1003 HIS : no HD1:sc= -0.335 X(o=-0.33,f=-0.11) USER MOD Single : A1004 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1006 LYS NZ :NH3+ 156:sc= 1.29 (180deg=1.14) 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 180:sc= 0 (180deg=0) USER MOD Single : A1015 TYR OH : rot 180:sc= 0 USER MOD Single : A1016 HIS : no HE2:sc= -10.4! C(o=-8.8!,f=-20!) USER MOD Single : A1017 THR OG1 : rot -130:sc= 1.04 USER MOD Single : A1026 LYS NZ :NH3+ -166:sc= 1.04 (180deg=0.768) USER MOD Single : A1028 LYS NZ :NH3+ 168:sc= 2.43 (180deg=2.33) USER MOD Single : A1029 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1032 THR OG1 : rot -34:sc= 0.309 USER MOD Single : A1033 GLN : amide:sc= -3.03! K(o=-3!,f=-4.4) USER MOD Single : A1034 THR OG1 : rot 180:sc= -0.288 USER MOD Single : A1036 SER OG : rot 72:sc= 0.0857 USER MOD Single : A1037 SER OG : rot 180:sc= 0 USER MOD Single : A1038 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 918 -10.321 -12.587 20.342 1.00 0.00 N ATOM 2 CA ILE A 918 -9.720 -12.712 18.999 1.00 0.00 C ATOM 3 C ILE A 918 -10.536 -11.931 17.980 1.00 0.00 C ATOM 4 O ILE A 918 -11.642 -11.469 18.275 1.00 0.00 O ATOM 5 CB ILE A 918 -9.613 -14.186 18.517 1.00 0.00 C ATOM 6 CG1 ILE A 918 -11.001 -14.818 18.341 1.00 0.00 C ATOM 7 CG2 ILE A 918 -8.780 -15.004 19.493 1.00 0.00 C ATOM 8 CD1 ILE A 918 -10.973 -16.197 17.717 1.00 0.00 C ATOM 0 HA ILE A 918 -8.711 -12.308 19.080 1.00 0.00 H new ATOM 0 HB ILE A 918 -9.119 -14.185 17.545 1.00 0.00 H new ATOM 0 HG12 ILE A 918 -11.487 -14.880 19.315 1.00 0.00 H new ATOM 0 HG13 ILE A 918 -11.612 -14.162 17.721 1.00 0.00 H new ATOM 0 HG21 ILE A 918 -8.715 -16.034 19.141 1.00 0.00 H new ATOM 0 HG22 ILE A 918 -7.778 -14.579 19.561 1.00 0.00 H new ATOM 0 HG23 ILE A 918 -9.250 -14.986 20.476 1.00 0.00 H new ATOM 0 HD11 ILE A 918 -11.991 -16.576 17.626 1.00 0.00 H new ATOM 0 HD12 ILE A 918 -10.517 -16.140 16.728 1.00 0.00 H new ATOM 0 HD13 ILE A 918 -10.390 -16.870 18.347 1.00 0.00 H new ATOM 22 N ASP A 919 -9.991 -11.783 16.787 1.00 0.00 N ATOM 23 CA ASP A 919 -10.690 -11.112 15.697 1.00 0.00 C ATOM 24 C ASP A 919 -11.060 -12.136 14.642 1.00 0.00 C ATOM 25 O ASP A 919 -10.300 -13.078 14.422 1.00 0.00 O ATOM 26 CB ASP A 919 -9.814 -10.040 15.037 1.00 0.00 C ATOM 27 CG ASP A 919 -9.489 -8.868 15.930 1.00 0.00 C ATOM 28 OD1 ASP A 919 -8.503 -8.929 16.685 1.00 0.00 O ATOM 29 OD2 ASP A 919 -10.195 -7.845 15.860 1.00 0.00 O ATOM 0 H ASP A 919 -9.060 -12.120 16.543 1.00 0.00 H new ATOM 0 HA ASP A 919 -11.576 -10.632 16.113 1.00 0.00 H new ATOM 0 HB2 ASP A 919 -8.882 -10.501 14.708 1.00 0.00 H new ATOM 0 HB3 ASP A 919 -10.320 -9.672 14.145 1.00 0.00 H new ATOM 34 N PRO A 920 -12.217 -11.989 13.972 1.00 0.00 N ATOM 35 CA PRO A 920 -12.608 -12.893 12.878 1.00 0.00 C ATOM 36 C PRO A 920 -11.765 -12.666 11.621 1.00 0.00 C ATOM 37 O PRO A 920 -11.767 -13.473 10.690 1.00 0.00 O ATOM 38 CB PRO A 920 -14.071 -12.521 12.613 1.00 0.00 C ATOM 39 CG PRO A 920 -14.200 -11.115 13.086 1.00 0.00 C ATOM 40 CD PRO A 920 -13.257 -10.980 14.248 1.00 0.00 C ATOM 0 HA PRO A 920 -12.464 -13.941 13.140 1.00 0.00 H new ATOM 0 HB2 PRO A 920 -14.315 -12.606 11.554 1.00 0.00 H new ATOM 0 HB3 PRO A 920 -14.751 -13.183 13.150 1.00 0.00 H new ATOM 0 HG2 PRO A 920 -13.945 -10.412 12.293 1.00 0.00 H new ATOM 0 HG3 PRO A 920 -15.225 -10.897 13.388 1.00 0.00 H new ATOM 0 HD2 PRO A 920 -12.836 -9.976 14.308 1.00 0.00 H new ATOM 0 HD3 PRO A 920 -13.759 -11.172 15.196 1.00 0.00 H new ATOM 48 N PHE A 921 -11.040 -11.559 11.600 1.00 0.00 N ATOM 49 CA PHE A 921 -10.196 -11.219 10.471 1.00 0.00 C ATOM 50 C PHE A 921 -8.867 -11.969 10.569 1.00 0.00 C ATOM 51 O PHE A 921 -8.268 -12.333 9.556 1.00 0.00 O ATOM 52 CB PHE A 921 -9.971 -9.707 10.423 1.00 0.00 C ATOM 53 CG PHE A 921 -11.250 -8.910 10.407 1.00 0.00 C ATOM 54 CD1 PHE A 921 -11.995 -8.785 9.247 1.00 0.00 C ATOM 55 CD2 PHE A 921 -11.713 -8.298 11.561 1.00 0.00 C ATOM 56 CE1 PHE A 921 -13.171 -8.063 9.233 1.00 0.00 C ATOM 57 CE2 PHE A 921 -12.890 -7.575 11.554 1.00 0.00 C ATOM 58 CZ PHE A 921 -13.620 -7.456 10.389 1.00 0.00 C ATOM 0 H PHE A 921 -11.021 -10.878 12.359 1.00 0.00 H new ATOM 0 HA PHE A 921 -10.690 -11.519 9.547 1.00 0.00 H new ATOM 0 HB2 PHE A 921 -9.377 -9.408 11.287 1.00 0.00 H new ATOM 0 HB3 PHE A 921 -9.388 -9.462 9.535 1.00 0.00 H new ATOM 0 HD1 PHE A 921 -11.651 -9.259 8.340 1.00 0.00 H new ATOM 0 HD2 PHE A 921 -11.147 -8.387 12.476 1.00 0.00 H new ATOM 0 HE1 PHE A 921 -13.739 -7.973 8.319 1.00 0.00 H new ATOM 0 HE2 PHE A 921 -13.239 -7.103 12.460 1.00 0.00 H new ATOM 0 HZ PHE A 921 -14.540 -6.890 10.381 1.00 0.00 H new ATOM 68 N THR A 922 -8.425 -12.219 11.790 1.00 0.00 N ATOM 69 CA THR A 922 -7.210 -12.974 12.039 1.00 0.00 C ATOM 70 C THR A 922 -7.524 -14.443 12.259 1.00 0.00 C ATOM 71 O THR A 922 -6.821 -15.327 11.758 1.00 0.00 O ATOM 72 CB THR A 922 -6.511 -12.434 13.287 1.00 0.00 C ATOM 73 OG1 THR A 922 -7.496 -12.159 14.291 1.00 0.00 O ATOM 74 CG2 THR A 922 -5.736 -11.178 12.979 1.00 0.00 C ATOM 0 H THR A 922 -8.899 -11.904 12.636 1.00 0.00 H new ATOM 0 HA THR A 922 -6.563 -12.870 11.168 1.00 0.00 H new ATOM 0 HB THR A 922 -5.806 -13.185 13.645 1.00 0.00 H new ATOM 0 HG1 THR A 922 -7.061 -12.092 15.167 1.00 0.00 H new ATOM 0 HG21 THR A 922 -5.250 -10.818 13.886 1.00 0.00 H new ATOM 0 HG22 THR A 922 -4.980 -11.393 12.224 1.00 0.00 H new ATOM 0 HG23 THR A 922 -6.416 -10.413 12.604 1.00 0.00 H new ATOM 82 N ALA A 923 -8.600 -14.670 13.010 1.00 0.00 N ATOM 83 CA ALA A 923 -9.040 -15.985 13.426 1.00 0.00 C ATOM 84 C ALA A 923 -7.947 -16.624 14.269 1.00 0.00 C ATOM 85 O ALA A 923 -7.613 -17.800 14.100 1.00 0.00 O ATOM 86 CB ALA A 923 -9.427 -16.852 12.228 1.00 0.00 C ATOM 0 H ALA A 923 -9.201 -13.919 13.351 1.00 0.00 H new ATOM 0 HA ALA A 923 -9.942 -15.892 14.032 1.00 0.00 H new ATOM 0 HB1 ALA A 923 -9.752 -17.832 12.578 1.00 0.00 H new ATOM 0 HB2 ALA A 923 -10.239 -16.374 11.680 1.00 0.00 H new ATOM 0 HB3 ALA A 923 -8.566 -16.969 11.570 1.00 0.00 H new ATOM 92 N ASP A 924 -7.424 -15.808 15.191 1.00 0.00 N ATOM 93 CA ASP A 924 -6.288 -16.149 16.055 1.00 0.00 C ATOM 94 C ASP A 924 -6.426 -17.521 16.680 1.00 0.00 C ATOM 95 O ASP A 924 -7.348 -17.791 17.457 1.00 0.00 O ATOM 96 CB ASP A 924 -6.083 -15.115 17.168 1.00 0.00 C ATOM 97 CG ASP A 924 -5.778 -13.726 16.663 1.00 0.00 C ATOM 98 OD1 ASP A 924 -4.615 -13.440 16.301 1.00 0.00 O ATOM 99 OD2 ASP A 924 -6.698 -12.881 16.641 1.00 0.00 O ATOM 0 H ASP A 924 -7.787 -14.870 15.361 1.00 0.00 H new ATOM 0 HA ASP A 924 -5.417 -16.150 15.400 1.00 0.00 H new ATOM 0 HB2 ASP A 924 -6.980 -15.078 17.786 1.00 0.00 H new ATOM 0 HB3 ASP A 924 -5.267 -15.445 17.811 1.00 0.00 H new ATOM 104 N ALA A 925 -5.481 -18.365 16.337 1.00 0.00 N ATOM 105 CA ALA A 925 -5.437 -19.747 16.776 1.00 0.00 C ATOM 106 C ALA A 925 -4.016 -20.252 16.592 1.00 0.00 C ATOM 107 O ALA A 925 -3.768 -21.443 16.403 1.00 0.00 O ATOM 108 CB ALA A 925 -6.411 -20.585 15.953 1.00 0.00 C ATOM 0 H ALA A 925 -4.702 -18.107 15.731 1.00 0.00 H new ATOM 0 HA ALA A 925 -5.727 -19.824 17.824 1.00 0.00 H new ATOM 0 HB1 ALA A 925 -6.372 -21.621 16.288 1.00 0.00 H new ATOM 0 HB2 ALA A 925 -7.422 -20.199 16.082 1.00 0.00 H new ATOM 0 HB3 ALA A 925 -6.135 -20.534 14.900 1.00 0.00 H new ATOM 114 N GLY A 926 -3.077 -19.330 16.691 1.00 0.00 N ATOM 115 CA GLY A 926 -1.692 -19.647 16.450 1.00 0.00 C ATOM 116 C GLY A 926 -1.374 -19.666 14.979 1.00 0.00 C ATOM 117 O GLY A 926 -1.131 -20.714 14.394 1.00 0.00 O ATOM 0 H GLY A 926 -3.254 -18.356 16.937 1.00 0.00 H new ATOM 0 HA2 GLY A 926 -1.058 -18.914 16.950 1.00 0.00 H new ATOM 0 HA3 GLY A 926 -1.460 -20.619 16.885 1.00 0.00 H new ATOM 121 N HIS A 927 -1.497 -18.518 14.348 1.00 0.00 N ATOM 122 CA HIS A 927 -1.051 -18.368 12.976 1.00 0.00 C ATOM 123 C HIS A 927 0.037 -17.336 12.989 1.00 0.00 C ATOM 124 O HIS A 927 0.759 -17.164 13.972 1.00 0.00 O ATOM 125 CB HIS A 927 -2.141 -17.855 12.010 1.00 0.00 C ATOM 126 CG HIS A 927 -3.499 -18.449 12.224 1.00 0.00 C ATOM 127 ND1 HIS A 927 -3.779 -19.806 12.139 1.00 0.00 N ATOM 128 CD2 HIS A 927 -4.651 -17.858 12.601 1.00 0.00 C ATOM 129 CE1 HIS A 927 -5.039 -20.009 12.462 1.00 0.00 C ATOM 130 NE2 HIS A 927 -5.584 -18.846 12.747 1.00 0.00 N ATOM 0 H HIS A 927 -1.900 -17.676 14.760 1.00 0.00 H new ATOM 0 HA HIS A 927 -0.742 -19.352 12.623 1.00 0.00 H new ATOM 0 HB2 HIS A 927 -2.214 -16.772 12.109 1.00 0.00 H new ATOM 0 HB3 HIS A 927 -1.827 -18.061 10.987 1.00 0.00 H new ATOM 0 HD2 HIS A 927 -4.807 -16.801 12.758 1.00 0.00 H new ATOM 0 HE1 HIS A 927 -5.539 -20.966 12.488 1.00 0.00 H new ATOM 0 HE2 HIS A 927 -6.553 -18.704 13.033 1.00 0.00 H new ATOM 139 N THR A 928 0.156 -16.677 11.881 1.00 0.00 N ATOM 140 CA THR A 928 1.004 -15.561 11.704 1.00 0.00 C ATOM 141 C THR A 928 0.442 -14.927 10.469 1.00 0.00 C ATOM 142 O THR A 928 0.357 -15.591 9.438 1.00 0.00 O ATOM 143 CB THR A 928 2.455 -15.931 11.388 1.00 0.00 C ATOM 144 OG1 THR A 928 2.827 -17.159 12.040 1.00 0.00 O ATOM 145 CG2 THR A 928 3.385 -14.831 11.863 1.00 0.00 C ATOM 0 H THR A 928 -0.365 -16.921 11.039 1.00 0.00 H new ATOM 0 HA THR A 928 1.031 -14.953 12.609 1.00 0.00 H new ATOM 0 HB THR A 928 2.540 -16.057 10.309 1.00 0.00 H new ATOM 0 HG1 THR A 928 3.758 -17.376 11.822 1.00 0.00 H new ATOM 0 HG21 THR A 928 4.416 -15.102 11.634 1.00 0.00 H new ATOM 0 HG22 THR A 928 3.134 -13.899 11.357 1.00 0.00 H new ATOM 0 HG23 THR A 928 3.274 -14.701 12.940 1.00 0.00 H new ATOM 153 N GLU A 929 -0.046 -13.746 10.575 1.00 0.00 N ATOM 154 CA GLU A 929 -0.512 -13.032 9.431 1.00 0.00 C ATOM 155 C GLU A 929 -0.130 -11.572 9.630 1.00 0.00 C ATOM 156 O GLU A 929 -0.182 -11.055 10.747 1.00 0.00 O ATOM 157 CB GLU A 929 -2.026 -13.174 9.187 1.00 0.00 C ATOM 158 CG GLU A 929 -2.909 -12.644 10.273 1.00 0.00 C ATOM 159 CD GLU A 929 -2.904 -13.504 11.516 1.00 0.00 C ATOM 160 OE1 GLU A 929 -3.330 -14.677 11.436 1.00 0.00 O ATOM 161 OE2 GLU A 929 -2.457 -13.038 12.581 1.00 0.00 O ATOM 0 H GLU A 929 -0.136 -13.241 11.457 1.00 0.00 H new ATOM 0 HA GLU A 929 -0.046 -13.454 8.541 1.00 0.00 H new ATOM 0 HB2 GLU A 929 -2.276 -12.662 8.258 1.00 0.00 H new ATOM 0 HB3 GLU A 929 -2.255 -14.230 9.040 1.00 0.00 H new ATOM 0 HG2 GLU A 929 -2.587 -11.636 10.535 1.00 0.00 H new ATOM 0 HG3 GLU A 929 -3.929 -12.565 9.897 1.00 0.00 H new ATOM 168 N PHE A 930 0.319 -10.943 8.593 1.00 0.00 N ATOM 169 CA PHE A 930 0.694 -9.554 8.631 1.00 0.00 C ATOM 170 C PHE A 930 0.027 -8.886 7.455 1.00 0.00 C ATOM 171 O PHE A 930 -0.088 -9.494 6.395 1.00 0.00 O ATOM 172 CB PHE A 930 2.222 -9.419 8.561 1.00 0.00 C ATOM 173 CG PHE A 930 2.723 -8.003 8.616 1.00 0.00 C ATOM 174 CD1 PHE A 930 2.676 -7.285 9.799 1.00 0.00 C ATOM 175 CD2 PHE A 930 3.243 -7.392 7.485 1.00 0.00 C ATOM 176 CE1 PHE A 930 3.131 -5.985 9.854 1.00 0.00 C ATOM 177 CE2 PHE A 930 3.702 -6.090 7.535 1.00 0.00 C ATOM 178 CZ PHE A 930 3.645 -5.385 8.720 1.00 0.00 C ATOM 0 H PHE A 930 0.440 -11.380 7.679 1.00 0.00 H new ATOM 0 HA PHE A 930 0.375 -9.081 9.560 1.00 0.00 H new ATOM 0 HB2 PHE A 930 2.662 -9.980 9.386 1.00 0.00 H new ATOM 0 HB3 PHE A 930 2.574 -9.880 7.638 1.00 0.00 H new ATOM 0 HD1 PHE A 930 2.278 -7.749 10.689 1.00 0.00 H new ATOM 0 HD2 PHE A 930 3.290 -7.940 6.555 1.00 0.00 H new ATOM 0 HE1 PHE A 930 3.086 -5.436 10.783 1.00 0.00 H new ATOM 0 HE2 PHE A 930 4.105 -5.624 6.648 1.00 0.00 H new ATOM 0 HZ PHE A 930 4.001 -4.366 8.761 1.00 0.00 H new ATOM 188 N THR A 931 -0.483 -7.699 7.637 1.00 0.00 N ATOM 189 CA THR A 931 -1.087 -6.989 6.541 1.00 0.00 C ATOM 190 C THR A 931 0.019 -6.373 5.679 1.00 0.00 C ATOM 191 O THR A 931 0.819 -5.563 6.159 1.00 0.00 O ATOM 192 CB THR A 931 -2.063 -5.919 7.072 1.00 0.00 C ATOM 193 OG1 THR A 931 -3.000 -6.549 7.971 1.00 0.00 O ATOM 194 CG2 THR A 931 -2.823 -5.262 5.926 1.00 0.00 C ATOM 0 H THR A 931 -0.493 -7.204 8.529 1.00 0.00 H new ATOM 0 HA THR A 931 -1.667 -7.675 5.923 1.00 0.00 H new ATOM 0 HB THR A 931 -1.495 -5.149 7.594 1.00 0.00 H new ATOM 0 HG1 THR A 931 -3.625 -5.877 8.316 1.00 0.00 H new ATOM 0 HG21 THR A 931 -3.505 -4.511 6.325 1.00 0.00 H new ATOM 0 HG22 THR A 931 -2.116 -4.786 5.246 1.00 0.00 H new ATOM 0 HG23 THR A 931 -3.392 -6.019 5.386 1.00 0.00 H new ATOM 202 N ASP A 932 0.023 -6.718 4.403 1.00 0.00 N ATOM 203 CA ASP A 932 1.095 -6.309 3.506 1.00 0.00 C ATOM 204 C ASP A 932 0.548 -5.119 2.747 1.00 0.00 C ATOM 205 O ASP A 932 -0.680 -4.956 2.686 1.00 0.00 O ATOM 206 CB ASP A 932 1.480 -7.445 2.542 1.00 0.00 C ATOM 207 CG ASP A 932 2.834 -7.248 1.885 1.00 0.00 C ATOM 208 OD1 ASP A 932 2.933 -6.538 0.867 1.00 0.00 O ATOM 209 OD2 ASP A 932 3.829 -7.847 2.362 1.00 0.00 O ATOM 0 H ASP A 932 -0.704 -7.281 3.962 1.00 0.00 H new ATOM 0 HA ASP A 932 2.003 -6.059 4.055 1.00 0.00 H new ATOM 0 HB2 ASP A 932 1.484 -8.389 3.088 1.00 0.00 H new ATOM 0 HB3 ASP A 932 0.718 -7.528 1.767 1.00 0.00 H new ATOM 214 N GLU A 933 1.389 -4.292 2.168 1.00 0.00 N ATOM 215 CA GLU A 933 0.899 -3.057 1.602 1.00 0.00 C ATOM 216 C GLU A 933 1.808 -2.555 0.484 1.00 0.00 C ATOM 217 O GLU A 933 3.000 -2.892 0.418 1.00 0.00 O ATOM 218 CB GLU A 933 0.806 -2.020 2.712 1.00 0.00 C ATOM 219 CG GLU A 933 2.168 -1.540 3.199 1.00 0.00 C ATOM 220 CD GLU A 933 2.111 -0.618 4.386 1.00 0.00 C ATOM 221 OE1 GLU A 933 2.143 -1.112 5.531 1.00 0.00 O ATOM 222 OE2 GLU A 933 2.086 0.618 4.197 1.00 0.00 O ATOM 0 H GLU A 933 2.393 -4.447 2.078 1.00 0.00 H new ATOM 0 HA GLU A 933 -0.084 -3.232 1.165 1.00 0.00 H new ATOM 0 HB2 GLU A 933 0.233 -1.165 2.354 1.00 0.00 H new ATOM 0 HB3 GLU A 933 0.256 -2.444 3.552 1.00 0.00 H new ATOM 0 HG2 GLU A 933 2.775 -2.408 3.457 1.00 0.00 H new ATOM 0 HG3 GLU A 933 2.674 -1.028 2.380 1.00 0.00 H new ATOM 229 N VAL A 934 1.232 -1.763 -0.385 1.00 0.00 N ATOM 230 CA VAL A 934 1.952 -1.113 -1.470 1.00 0.00 C ATOM 231 C VAL A 934 1.228 0.191 -1.757 1.00 0.00 C ATOM 232 O VAL A 934 0.199 0.454 -1.142 1.00 0.00 O ATOM 233 CB VAL A 934 2.017 -2.040 -2.716 1.00 0.00 C ATOM 234 CG1 VAL A 934 0.644 -2.313 -3.309 1.00 0.00 C ATOM 235 CG2 VAL A 934 2.988 -1.568 -3.798 1.00 0.00 C ATOM 0 H VAL A 934 0.236 -1.544 -0.365 1.00 0.00 H new ATOM 0 HA VAL A 934 2.987 -0.908 -1.197 1.00 0.00 H new ATOM 0 HB VAL A 934 2.418 -2.979 -2.333 1.00 0.00 H new ATOM 0 HG11 VAL A 934 0.745 -2.965 -4.177 1.00 0.00 H new ATOM 0 HG12 VAL A 934 0.015 -2.798 -2.562 1.00 0.00 H new ATOM 0 HG13 VAL A 934 0.186 -1.372 -3.614 1.00 0.00 H new ATOM 0 HG21 VAL A 934 2.973 -2.270 -4.632 1.00 0.00 H new ATOM 0 HG22 VAL A 934 2.689 -0.581 -4.150 1.00 0.00 H new ATOM 0 HG23 VAL A 934 3.996 -1.516 -3.385 1.00 0.00 H new ATOM 245 N TYR A 935 1.724 0.987 -2.671 1.00 0.00 N ATOM 246 CA TYR A 935 1.135 2.262 -2.983 1.00 0.00 C ATOM 247 C TYR A 935 1.141 2.451 -4.477 1.00 0.00 C ATOM 248 O TYR A 935 2.025 1.948 -5.170 1.00 0.00 O ATOM 249 CB TYR A 935 1.878 3.417 -2.332 1.00 0.00 C ATOM 250 CG TYR A 935 1.725 3.529 -0.829 1.00 0.00 C ATOM 251 CD1 TYR A 935 2.525 2.800 0.039 1.00 0.00 C ATOM 252 CD2 TYR A 935 0.772 4.379 -0.283 1.00 0.00 C ATOM 253 CE1 TYR A 935 2.376 2.914 1.407 1.00 0.00 C ATOM 254 CE2 TYR A 935 0.618 4.497 1.083 1.00 0.00 C ATOM 255 CZ TYR A 935 1.423 3.764 1.925 1.00 0.00 C ATOM 256 OH TYR A 935 1.264 3.874 3.292 1.00 0.00 O ATOM 0 H TYR A 935 2.553 0.766 -3.222 1.00 0.00 H new ATOM 0 HA TYR A 935 0.118 2.263 -2.592 1.00 0.00 H new ATOM 0 HB2 TYR A 935 2.938 3.321 -2.565 1.00 0.00 H new ATOM 0 HB3 TYR A 935 1.535 4.347 -2.785 1.00 0.00 H new ATOM 0 HD1 TYR A 935 3.275 2.134 -0.361 1.00 0.00 H new ATOM 0 HD2 TYR A 935 0.140 4.958 -0.940 1.00 0.00 H new ATOM 0 HE1 TYR A 935 3.005 2.338 2.070 1.00 0.00 H new ATOM 0 HE2 TYR A 935 -0.130 5.161 1.489 1.00 0.00 H new ATOM 0 HH TYR A 935 0.550 4.517 3.488 1.00 0.00 H new ATOM 266 N GLN A 936 0.178 3.202 -4.932 1.00 0.00 N ATOM 267 CA GLN A 936 -0.035 3.480 -6.327 1.00 0.00 C ATOM 268 C GLN A 936 0.068 4.977 -6.458 1.00 0.00 C ATOM 269 O GLN A 936 -0.627 5.690 -5.735 1.00 0.00 O ATOM 270 CB GLN A 936 -1.427 3.045 -6.741 1.00 0.00 C ATOM 271 CG GLN A 936 -1.684 3.143 -8.229 1.00 0.00 C ATOM 272 CD GLN A 936 -3.154 3.031 -8.523 1.00 0.00 C ATOM 273 OE1 GLN A 936 -3.849 4.026 -8.624 1.00 0.00 O ATOM 274 NE2 GLN A 936 -3.649 1.834 -8.572 1.00 0.00 N ATOM 0 H GLN A 936 -0.504 3.653 -4.322 1.00 0.00 H new ATOM 0 HA GLN A 936 0.685 2.953 -6.953 1.00 0.00 H new ATOM 0 HB2 GLN A 936 -1.585 2.015 -6.422 1.00 0.00 H new ATOM 0 HB3 GLN A 936 -2.160 3.657 -6.215 1.00 0.00 H new ATOM 0 HG2 GLN A 936 -1.304 4.092 -8.607 1.00 0.00 H new ATOM 0 HG3 GLN A 936 -1.143 2.353 -8.749 1.00 0.00 H new ATOM 0 HE21 GLN A 936 -3.035 1.024 -8.484 1.00 0.00 H new ATOM 0 HE22 GLN A 936 -4.652 1.702 -8.699 1.00 0.00 H new ATOM 283 N ASN A 937 0.932 5.449 -7.321 1.00 0.00 N ATOM 284 CA ASN A 937 1.169 6.879 -7.425 1.00 0.00 C ATOM 285 C ASN A 937 0.797 7.418 -8.805 1.00 0.00 C ATOM 286 O ASN A 937 0.896 6.718 -9.822 1.00 0.00 O ATOM 287 CB ASN A 937 2.639 7.235 -7.155 1.00 0.00 C ATOM 288 CG ASN A 937 3.276 6.546 -5.953 1.00 0.00 C ATOM 289 OD1 ASN A 937 2.636 6.142 -4.986 1.00 0.00 O ATOM 290 ND2 ASN A 937 4.573 6.429 -5.995 1.00 0.00 N ATOM 0 H ASN A 937 1.482 4.875 -7.960 1.00 0.00 H new ATOM 0 HA ASN A 937 0.534 7.340 -6.668 1.00 0.00 H new ATOM 0 HB2 ASN A 937 3.222 6.989 -8.043 1.00 0.00 H new ATOM 0 HB3 ASN A 937 2.713 8.313 -7.014 1.00 0.00 H new ATOM 0 HD21 ASN A 937 5.072 5.997 -5.217 1.00 0.00 H new ATOM 0 HD22 ASN A 937 5.090 6.770 -6.806 1.00 0.00 H new ATOM 297 N GLU A 938 0.384 8.673 -8.803 1.00 0.00 N ATOM 298 CA GLU A 938 0.057 9.459 -9.996 1.00 0.00 C ATOM 299 C GLU A 938 0.501 10.893 -9.734 1.00 0.00 C ATOM 300 O GLU A 938 0.719 11.283 -8.576 1.00 0.00 O ATOM 301 CB GLU A 938 -1.452 9.428 -10.303 1.00 0.00 C ATOM 302 CG GLU A 938 -1.949 8.136 -10.932 1.00 0.00 C ATOM 303 CD GLU A 938 -3.426 8.176 -11.263 1.00 0.00 C ATOM 304 OE1 GLU A 938 -3.790 8.607 -12.385 1.00 0.00 O ATOM 305 OE2 GLU A 938 -4.254 7.746 -10.437 1.00 0.00 O ATOM 0 H GLU A 938 0.260 9.200 -7.939 1.00 0.00 H new ATOM 0 HA GLU A 938 0.568 9.036 -10.861 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -2.000 9.599 -9.377 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -1.689 10.256 -10.971 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -1.382 7.939 -11.842 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -1.756 7.308 -10.250 1.00 0.00 H new ATOM 312 N SER A 939 0.691 11.663 -10.783 1.00 0.00 N ATOM 313 CA SER A 939 1.110 13.042 -10.648 1.00 0.00 C ATOM 314 C SER A 939 0.434 13.943 -11.679 1.00 0.00 C ATOM 315 O SER A 939 0.222 13.557 -12.829 1.00 0.00 O ATOM 316 CB SER A 939 2.635 13.135 -10.723 1.00 0.00 C ATOM 317 OG SER A 939 3.213 12.325 -9.706 1.00 0.00 O ATOM 0 H SER A 939 0.561 11.355 -11.747 1.00 0.00 H new ATOM 0 HA SER A 939 0.793 13.403 -9.670 1.00 0.00 H new ATOM 0 HB2 SER A 939 2.982 12.808 -11.703 1.00 0.00 H new ATOM 0 HB3 SER A 939 2.953 14.171 -10.602 1.00 0.00 H new ATOM 0 HG SER A 939 4.190 12.384 -9.756 1.00 0.00 H new ATOM 323 N ARG A 940 0.107 15.140 -11.241 1.00 0.00 N ATOM 324 CA ARG A 940 -0.592 16.128 -12.014 1.00 0.00 C ATOM 325 C ARG A 940 -0.002 17.477 -11.680 1.00 0.00 C ATOM 326 O ARG A 940 0.700 17.617 -10.676 1.00 0.00 O ATOM 327 CB ARG A 940 -2.081 16.188 -11.676 1.00 0.00 C ATOM 328 CG ARG A 940 -2.407 16.619 -10.253 1.00 0.00 C ATOM 329 CD ARG A 940 -3.841 17.101 -10.180 1.00 0.00 C ATOM 330 NE ARG A 940 -4.105 17.890 -8.979 1.00 0.00 N ATOM 331 CZ ARG A 940 -5.326 18.242 -8.557 1.00 0.00 C ATOM 332 NH1 ARG A 940 -6.400 17.790 -9.180 1.00 0.00 N ATOM 333 NH2 ARG A 940 -5.469 19.037 -7.509 1.00 0.00 N ATOM 0 H ARG A 940 0.333 15.458 -10.298 1.00 0.00 H new ATOM 0 HA ARG A 940 -0.488 15.865 -13.067 1.00 0.00 H new ATOM 0 HB2 ARG A 940 -2.566 16.877 -12.367 1.00 0.00 H new ATOM 0 HB3 ARG A 940 -2.516 15.204 -11.849 1.00 0.00 H new ATOM 0 HG2 ARG A 940 -2.259 15.785 -9.567 1.00 0.00 H new ATOM 0 HG3 ARG A 940 -1.730 17.414 -9.940 1.00 0.00 H new ATOM 0 HD2 ARG A 940 -4.065 17.701 -11.062 1.00 0.00 H new ATOM 0 HD3 ARG A 940 -4.511 16.242 -10.201 1.00 0.00 H new ATOM 0 HE ARG A 940 -3.305 18.193 -8.424 1.00 0.00 H new ATOM 0 HH11 ARG A 940 -6.300 17.171 -9.985 1.00 0.00 H new ATOM 0 HH12 ARG A 940 -7.329 18.060 -8.856 1.00 0.00 H new ATOM 0 HH21 ARG A 940 -4.646 19.386 -7.017 1.00 0.00 H new ATOM 0 HH22 ARG A 940 -6.402 19.301 -7.193 1.00 0.00 H new ATOM 347 N TYR A 941 -0.226 18.443 -12.537 1.00 0.00 N ATOM 348 CA TYR A 941 0.117 19.818 -12.214 1.00 0.00 C ATOM 349 C TYR A 941 -0.830 20.215 -11.103 1.00 0.00 C ATOM 350 O TYR A 941 -1.918 19.637 -11.020 1.00 0.00 O ATOM 351 CB TYR A 941 -0.164 20.758 -13.377 1.00 0.00 C ATOM 352 CG TYR A 941 0.235 20.201 -14.725 1.00 0.00 C ATOM 353 CD1 TYR A 941 -0.634 19.393 -15.449 1.00 0.00 C ATOM 354 CD2 TYR A 941 1.482 20.470 -15.266 1.00 0.00 C ATOM 355 CE1 TYR A 941 -0.269 18.867 -16.667 1.00 0.00 C ATOM 356 CE2 TYR A 941 1.853 19.951 -16.490 1.00 0.00 C ATOM 357 CZ TYR A 941 0.974 19.151 -17.184 1.00 0.00 C ATOM 358 OH TYR A 941 1.348 18.615 -18.397 1.00 0.00 O ATOM 0 H TYR A 941 -0.641 18.310 -13.459 1.00 0.00 H new ATOM 0 HA TYR A 941 1.175 19.884 -11.959 1.00 0.00 H new ATOM 0 HB2 TYR A 941 -1.228 20.993 -13.392 1.00 0.00 H new ATOM 0 HB3 TYR A 941 0.367 21.695 -13.210 1.00 0.00 H new ATOM 0 HD1 TYR A 941 -1.613 19.174 -15.049 1.00 0.00 H new ATOM 0 HD2 TYR A 941 2.174 21.095 -14.722 1.00 0.00 H new ATOM 0 HE1 TYR A 941 -0.954 18.235 -17.214 1.00 0.00 H new ATOM 0 HE2 TYR A 941 2.827 20.171 -16.901 1.00 0.00 H new ATOM 0 HH TYR A 941 2.254 18.913 -18.621 1.00 0.00 H new ATOM 368 N PRO A 942 -0.462 21.148 -10.233 1.00 0.00 N ATOM 369 CA PRO A 942 -1.362 21.615 -9.187 1.00 0.00 C ATOM 370 C PRO A 942 -2.636 22.238 -9.759 1.00 0.00 C ATOM 371 O PRO A 942 -2.680 23.432 -10.081 1.00 0.00 O ATOM 372 CB PRO A 942 -0.532 22.649 -8.443 1.00 0.00 C ATOM 373 CG PRO A 942 0.881 22.300 -8.750 1.00 0.00 C ATOM 374 CD PRO A 942 0.857 21.794 -10.158 1.00 0.00 C ATOM 0 HA PRO A 942 -1.712 20.803 -8.549 1.00 0.00 H new ATOM 0 HB2 PRO A 942 -0.770 23.660 -8.775 1.00 0.00 H new ATOM 0 HB3 PRO A 942 -0.724 22.612 -7.371 1.00 0.00 H new ATOM 0 HG2 PRO A 942 1.532 23.169 -8.654 1.00 0.00 H new ATOM 0 HG3 PRO A 942 1.258 21.541 -8.064 1.00 0.00 H new ATOM 0 HD2 PRO A 942 0.957 22.602 -10.883 1.00 0.00 H new ATOM 0 HD3 PRO A 942 1.667 21.090 -10.352 1.00 0.00 H new ATOM 382 N GLY A 943 -3.641 21.403 -9.944 1.00 0.00 N ATOM 383 CA GLY A 943 -4.876 21.825 -10.543 1.00 0.00 C ATOM 384 C GLY A 943 -4.891 21.379 -11.984 1.00 0.00 C ATOM 385 O GLY A 943 -4.814 22.204 -12.895 1.00 0.00 O ATOM 0 H GLY A 943 -3.617 20.418 -9.681 1.00 0.00 H new ATOM 0 HA2 GLY A 943 -5.722 21.397 -10.006 1.00 0.00 H new ATOM 0 HA3 GLY A 943 -4.975 22.909 -10.482 1.00 0.00 H new ATOM 389 N GLY A 944 -4.976 20.073 -12.216 1.00 0.00 N ATOM 390 CA GLY A 944 -4.892 19.570 -13.563 1.00 0.00 C ATOM 391 C GLY A 944 -5.527 18.200 -13.674 1.00 0.00 C ATOM 392 O GLY A 944 -6.678 18.005 -13.288 1.00 0.00 O ATOM 0 H GLY A 944 -5.101 19.362 -11.495 1.00 0.00 H new ATOM 0 HA2 GLY A 944 -5.389 20.261 -14.244 1.00 0.00 H new ATOM 0 HA3 GLY A 944 -3.847 19.516 -13.870 1.00 0.00 H new ATOM 396 N ASP A 945 -4.732 17.260 -14.137 1.00 0.00 N ATOM 397 CA ASP A 945 -5.167 15.874 -14.324 1.00 0.00 C ATOM 398 C ASP A 945 -4.017 14.930 -14.044 1.00 0.00 C ATOM 399 O ASP A 945 -2.902 15.166 -14.519 1.00 0.00 O ATOM 400 CB ASP A 945 -5.712 15.645 -15.739 1.00 0.00 C ATOM 401 CG ASP A 945 -6.135 14.206 -15.965 1.00 0.00 C ATOM 402 OD1 ASP A 945 -7.198 13.790 -15.458 1.00 0.00 O ATOM 403 OD2 ASP A 945 -5.420 13.462 -16.650 1.00 0.00 O ATOM 0 H ASP A 945 -3.760 17.426 -14.398 1.00 0.00 H new ATOM 0 HA ASP A 945 -5.975 15.674 -13.621 1.00 0.00 H new ATOM 0 HB2 ASP A 945 -6.564 16.303 -15.909 1.00 0.00 H new ATOM 0 HB3 ASP A 945 -4.949 15.916 -16.469 1.00 0.00 H new ATOM 408 N TRP A 946 -4.260 13.904 -13.229 1.00 0.00 N ATOM 409 CA TRP A 946 -3.239 12.968 -12.868 1.00 0.00 C ATOM 410 C TRP A 946 -2.925 12.085 -14.052 1.00 0.00 C ATOM 411 O TRP A 946 -3.808 11.651 -14.794 1.00 0.00 O ATOM 412 CB TRP A 946 -3.688 12.076 -11.710 1.00 0.00 C ATOM 413 CG TRP A 946 -4.230 12.788 -10.535 1.00 0.00 C ATOM 414 CD1 TRP A 946 -5.532 13.033 -10.268 1.00 0.00 C ATOM 415 CD2 TRP A 946 -3.486 13.316 -9.444 1.00 0.00 C ATOM 416 NE1 TRP A 946 -5.644 13.709 -9.094 1.00 0.00 N ATOM 417 CE2 TRP A 946 -4.405 13.896 -8.561 1.00 0.00 C ATOM 418 CE3 TRP A 946 -2.132 13.364 -9.136 1.00 0.00 C ATOM 419 CZ2 TRP A 946 -4.017 14.520 -7.384 1.00 0.00 C ATOM 420 CZ3 TRP A 946 -1.747 13.982 -7.973 1.00 0.00 C ATOM 421 CH2 TRP A 946 -2.683 14.553 -7.110 1.00 0.00 C ATOM 0 H TRP A 946 -5.171 13.714 -12.811 1.00 0.00 H new ATOM 0 HA TRP A 946 -2.360 13.534 -12.561 1.00 0.00 H new ATOM 0 HB2 TRP A 946 -4.448 11.387 -12.078 1.00 0.00 H new ATOM 0 HB3 TRP A 946 -2.839 11.473 -11.388 1.00 0.00 H new ATOM 0 HD1 TRP A 946 -6.360 12.736 -10.894 1.00 0.00 H new ATOM 0 HE1 TRP A 946 -6.519 14.027 -8.677 1.00 0.00 H new ATOM 0 HE3 TRP A 946 -1.399 12.925 -9.797 1.00 0.00 H new ATOM 0 HZ2 TRP A 946 -4.741 14.960 -6.714 1.00 0.00 H new ATOM 0 HZ3 TRP A 946 -0.698 14.027 -7.720 1.00 0.00 H new ATOM 0 HH2 TRP A 946 -2.342 15.032 -6.204 1.00 0.00 H new ATOM 432 N LYS A 947 -1.675 11.802 -14.192 1.00 0.00 N ATOM 433 CA LYS A 947 -1.172 10.913 -15.184 1.00 0.00 C ATOM 434 C LYS A 947 -0.402 9.927 -14.356 1.00 0.00 C ATOM 435 O LYS A 947 0.057 10.313 -13.281 1.00 0.00 O ATOM 436 CB LYS A 947 -0.259 11.651 -16.165 1.00 0.00 C ATOM 437 CG LYS A 947 -0.960 12.775 -16.902 1.00 0.00 C ATOM 438 CD LYS A 947 -0.011 13.524 -17.814 1.00 0.00 C ATOM 439 CE LYS A 947 -0.711 14.682 -18.498 1.00 0.00 C ATOM 440 NZ LYS A 947 0.215 15.453 -19.355 1.00 0.00 N ATOM 0 H LYS A 947 -0.948 12.198 -13.597 1.00 0.00 H new ATOM 0 HA LYS A 947 -1.943 10.455 -15.803 1.00 0.00 H new ATOM 0 HB2 LYS A 947 0.594 12.058 -15.622 1.00 0.00 H new ATOM 0 HB3 LYS A 947 0.135 10.939 -16.891 1.00 0.00 H new ATOM 0 HG2 LYS A 947 -1.783 12.368 -17.489 1.00 0.00 H new ATOM 0 HG3 LYS A 947 -1.395 13.468 -16.181 1.00 0.00 H new ATOM 0 HD2 LYS A 947 0.835 13.896 -17.237 1.00 0.00 H new ATOM 0 HD3 LYS A 947 0.390 12.843 -18.565 1.00 0.00 H new ATOM 0 HE2 LYS A 947 -1.535 14.303 -19.102 1.00 0.00 H new ATOM 0 HE3 LYS A 947 -1.144 15.341 -17.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 947 -0.300 16.236 -19.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 947 0.988 15.836 -18.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 947 0.609 14.830 -20.089 1.00 0.00 H new ATOM 454 N PRO A 948 -0.288 8.672 -14.759 1.00 0.00 N ATOM 455 CA PRO A 948 0.406 7.677 -13.954 1.00 0.00 C ATOM 456 C PRO A 948 1.834 8.102 -13.642 1.00 0.00 C ATOM 457 O PRO A 948 2.456 8.867 -14.391 1.00 0.00 O ATOM 458 CB PRO A 948 0.395 6.422 -14.830 1.00 0.00 C ATOM 459 CG PRO A 948 -0.716 6.640 -15.793 1.00 0.00 C ATOM 460 CD PRO A 948 -0.789 8.121 -16.016 1.00 0.00 C ATOM 0 HA PRO A 948 -0.072 7.527 -12.986 1.00 0.00 H new ATOM 0 HB2 PRO A 948 1.346 6.292 -15.346 1.00 0.00 H new ATOM 0 HB3 PRO A 948 0.231 5.525 -14.233 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -0.529 6.114 -16.729 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -1.657 6.259 -15.395 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -0.178 8.431 -16.864 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -1.808 8.448 -16.221 1.00 0.00 H new ATOM 468 N ALA A 949 2.333 7.625 -12.525 1.00 0.00 N ATOM 469 CA ALA A 949 3.721 7.881 -12.164 1.00 0.00 C ATOM 470 C ALA A 949 4.643 7.092 -13.113 1.00 0.00 C ATOM 471 O ALA A 949 4.178 6.478 -14.079 1.00 0.00 O ATOM 472 CB ALA A 949 3.973 7.484 -10.716 1.00 0.00 C ATOM 0 H ALA A 949 1.811 7.063 -11.853 1.00 0.00 H new ATOM 0 HA ALA A 949 3.933 8.946 -12.262 1.00 0.00 H new ATOM 0 HB1 ALA A 949 5.014 7.681 -10.461 1.00 0.00 H new ATOM 0 HB2 ALA A 949 3.323 8.064 -10.061 1.00 0.00 H new ATOM 0 HB3 ALA A 949 3.763 6.422 -10.588 1.00 0.00 H new ATOM 478 N GLU A 950 5.929 7.065 -12.833 1.00 0.00 N ATOM 479 CA GLU A 950 6.841 6.286 -13.661 1.00 0.00 C ATOM 480 C GLU A 950 7.247 5.040 -12.893 1.00 0.00 C ATOM 481 O GLU A 950 7.703 4.049 -13.460 1.00 0.00 O ATOM 482 CB GLU A 950 8.061 7.073 -14.168 1.00 0.00 C ATOM 483 CG GLU A 950 8.703 8.031 -13.182 1.00 0.00 C ATOM 484 CD GLU A 950 7.928 9.326 -13.049 1.00 0.00 C ATOM 485 OE1 GLU A 950 7.713 10.016 -14.068 1.00 0.00 O ATOM 486 OE2 GLU A 950 7.489 9.656 -11.930 1.00 0.00 O ATOM 0 H GLU A 950 6.365 7.561 -12.056 1.00 0.00 H new ATOM 0 HA GLU A 950 6.309 6.010 -14.571 1.00 0.00 H new ATOM 0 HB2 GLU A 950 8.818 6.359 -14.492 1.00 0.00 H new ATOM 0 HB3 GLU A 950 7.760 7.640 -15.049 1.00 0.00 H new ATOM 0 HG2 GLU A 950 8.774 7.551 -12.206 1.00 0.00 H new ATOM 0 HG3 GLU A 950 9.721 8.251 -13.503 1.00 0.00 H new ATOM 493 N ASP A 951 7.046 5.116 -11.592 1.00 0.00 N ATOM 494 CA ASP A 951 7.153 3.991 -10.707 1.00 0.00 C ATOM 495 C ASP A 951 5.769 3.875 -10.109 1.00 0.00 C ATOM 496 O ASP A 951 5.467 4.533 -9.109 1.00 0.00 O ATOM 497 CB ASP A 951 8.185 4.192 -9.580 1.00 0.00 C ATOM 498 CG ASP A 951 9.612 4.370 -10.060 1.00 0.00 C ATOM 499 OD1 ASP A 951 10.128 3.502 -10.788 1.00 0.00 O ATOM 500 OD2 ASP A 951 10.248 5.387 -9.699 1.00 0.00 O ATOM 0 H ASP A 951 6.799 5.985 -11.118 1.00 0.00 H new ATOM 0 HA ASP A 951 7.491 3.106 -11.246 1.00 0.00 H new ATOM 0 HB2 ASP A 951 7.900 5.066 -8.995 1.00 0.00 H new ATOM 0 HB3 ASP A 951 8.145 3.333 -8.910 1.00 0.00 H new ATOM 505 N THR A 952 4.898 3.172 -10.816 1.00 0.00 N ATOM 506 CA THR A 952 3.492 3.076 -10.458 1.00 0.00 C ATOM 507 C THR A 952 3.297 2.544 -9.040 1.00 0.00 C ATOM 508 O THR A 952 2.627 3.179 -8.222 1.00 0.00 O ATOM 509 CB THR A 952 2.748 2.183 -11.467 1.00 0.00 C ATOM 510 OG1 THR A 952 3.123 2.570 -12.800 1.00 0.00 O ATOM 511 CG2 THR A 952 1.239 2.324 -11.307 1.00 0.00 C ATOM 0 H THR A 952 5.147 2.651 -11.657 1.00 0.00 H new ATOM 0 HA THR A 952 3.076 4.083 -10.489 1.00 0.00 H new ATOM 0 HB THR A 952 3.019 1.143 -11.283 1.00 0.00 H new ATOM 0 HG1 THR A 952 2.654 2.004 -13.449 1.00 0.00 H new ATOM 0 HG21 THR A 952 0.735 1.684 -12.031 1.00 0.00 H new ATOM 0 HG22 THR A 952 0.951 2.028 -10.298 1.00 0.00 H new ATOM 0 HG23 THR A 952 0.950 3.361 -11.477 1.00 0.00 H new ATOM 519 N TYR A 953 3.882 1.397 -8.747 1.00 0.00 N ATOM 520 CA TYR A 953 3.789 0.843 -7.422 1.00 0.00 C ATOM 521 C TYR A 953 5.093 1.001 -6.673 1.00 0.00 C ATOM 522 O TYR A 953 6.178 0.739 -7.199 1.00 0.00 O ATOM 523 CB TYR A 953 3.272 -0.591 -7.448 1.00 0.00 C ATOM 524 CG TYR A 953 1.789 -0.614 -7.738 1.00 0.00 C ATOM 525 CD1 TYR A 953 0.871 -0.534 -6.702 1.00 0.00 C ATOM 526 CD2 TYR A 953 1.307 -0.671 -9.037 1.00 0.00 C ATOM 527 CE1 TYR A 953 -0.485 -0.511 -6.948 1.00 0.00 C ATOM 528 CE2 TYR A 953 -0.047 -0.657 -9.296 1.00 0.00 C ATOM 529 CZ TYR A 953 -0.937 -0.576 -8.247 1.00 0.00 C ATOM 530 OH TYR A 953 -2.286 -0.548 -8.497 1.00 0.00 O ATOM 0 H TYR A 953 4.422 0.839 -9.409 1.00 0.00 H new ATOM 0 HA TYR A 953 3.047 1.413 -6.863 1.00 0.00 H new ATOM 0 HB2 TYR A 953 3.806 -1.163 -8.207 1.00 0.00 H new ATOM 0 HB3 TYR A 953 3.469 -1.072 -6.490 1.00 0.00 H new ATOM 0 HD1 TYR A 953 1.225 -0.489 -5.683 1.00 0.00 H new ATOM 0 HD2 TYR A 953 2.004 -0.727 -9.860 1.00 0.00 H new ATOM 0 HE1 TYR A 953 -1.186 -0.443 -6.130 1.00 0.00 H new ATOM 0 HE2 TYR A 953 -0.407 -0.709 -10.313 1.00 0.00 H new ATOM 0 HH TYR A 953 -2.441 -0.601 -9.463 1.00 0.00 H new ATOM 540 N THR A 954 4.966 1.439 -5.440 1.00 0.00 N ATOM 541 CA THR A 954 6.089 1.819 -4.608 1.00 0.00 C ATOM 542 C THR A 954 5.838 1.434 -3.164 1.00 0.00 C ATOM 543 O THR A 954 4.726 1.048 -2.796 1.00 0.00 O ATOM 544 CB THR A 954 6.323 3.340 -4.694 1.00 0.00 C ATOM 545 OG1 THR A 954 5.072 4.031 -4.558 1.00 0.00 O ATOM 546 CG2 THR A 954 6.990 3.740 -6.005 1.00 0.00 C ATOM 0 H THR A 954 4.063 1.543 -4.978 1.00 0.00 H new ATOM 0 HA THR A 954 6.972 1.292 -4.969 1.00 0.00 H new ATOM 0 HB THR A 954 6.994 3.618 -3.881 1.00 0.00 H new ATOM 0 HG1 THR A 954 4.560 3.948 -5.390 1.00 0.00 H new ATOM 0 HG21 THR A 954 7.136 4.820 -6.024 1.00 0.00 H new ATOM 0 HG22 THR A 954 7.956 3.241 -6.089 1.00 0.00 H new ATOM 0 HG23 THR A 954 6.356 3.445 -6.841 1.00 0.00 H new ATOM 554 N ASP A 955 6.867 1.580 -2.359 1.00 0.00 N ATOM 555 CA ASP A 955 6.809 1.304 -0.943 1.00 0.00 C ATOM 556 C ASP A 955 6.842 2.663 -0.242 1.00 0.00 C ATOM 557 O ASP A 955 6.865 3.692 -0.932 1.00 0.00 O ATOM 558 CB ASP A 955 7.995 0.396 -0.553 1.00 0.00 C ATOM 559 CG ASP A 955 8.044 0.027 0.916 1.00 0.00 C ATOM 560 OD1 ASP A 955 6.994 -0.246 1.511 1.00 0.00 O ATOM 561 OD2 ASP A 955 9.143 0.025 1.506 1.00 0.00 O ATOM 0 H ASP A 955 7.782 1.899 -2.677 1.00 0.00 H new ATOM 0 HA ASP A 955 5.906 0.769 -0.649 1.00 0.00 H new ATOM 0 HB2 ASP A 955 7.946 -0.519 -1.144 1.00 0.00 H new ATOM 0 HB3 ASP A 955 8.925 0.898 -0.820 1.00 0.00 H new ATOM 566 N ALA A 956 6.876 2.679 1.077 1.00 0.00 N ATOM 567 CA ALA A 956 6.814 3.909 1.871 1.00 0.00 C ATOM 568 C ALA A 956 7.804 4.994 1.429 1.00 0.00 C ATOM 569 O ALA A 956 7.461 6.175 1.445 1.00 0.00 O ATOM 570 CB ALA A 956 7.043 3.585 3.337 1.00 0.00 C ATOM 0 H ALA A 956 6.948 1.833 1.642 1.00 0.00 H new ATOM 0 HA ALA A 956 5.817 4.320 1.710 1.00 0.00 H new ATOM 0 HB1 ALA A 956 6.996 4.502 3.924 1.00 0.00 H new ATOM 0 HB2 ALA A 956 6.274 2.894 3.681 1.00 0.00 H new ATOM 0 HB3 ALA A 956 8.024 3.126 3.459 1.00 0.00 H new ATOM 576 N ASN A 957 8.994 4.625 0.986 1.00 0.00 N ATOM 577 CA ASN A 957 9.981 5.632 0.600 1.00 0.00 C ATOM 578 C ASN A 957 10.161 5.750 -0.917 1.00 0.00 C ATOM 579 O ASN A 957 11.071 6.433 -1.389 1.00 0.00 O ATOM 580 CB ASN A 957 11.329 5.367 1.283 1.00 0.00 C ATOM 581 CG ASN A 957 11.238 5.471 2.797 1.00 0.00 C ATOM 582 OD1 ASN A 957 11.377 6.550 3.363 1.00 0.00 O ATOM 583 ND2 ASN A 957 11.020 4.354 3.465 1.00 0.00 N ATOM 0 H ASN A 957 9.301 3.658 0.884 1.00 0.00 H new ATOM 0 HA ASN A 957 9.589 6.590 0.943 1.00 0.00 H new ATOM 0 HB2 ASN A 957 11.683 4.373 1.010 1.00 0.00 H new ATOM 0 HB3 ASN A 957 12.067 6.080 0.916 1.00 0.00 H new ATOM 0 HD21 ASN A 957 10.963 4.372 4.483 1.00 0.00 H new ATOM 0 HD22 ASN A 957 10.909 3.473 2.963 1.00 0.00 H new ATOM 590 N GLY A 958 9.287 5.115 -1.695 1.00 0.00 N ATOM 591 CA GLY A 958 9.392 5.245 -3.137 1.00 0.00 C ATOM 592 C GLY A 958 10.062 4.066 -3.770 1.00 0.00 C ATOM 593 O GLY A 958 10.259 4.054 -4.983 1.00 0.00 O ATOM 0 H GLY A 958 8.524 4.525 -1.362 1.00 0.00 H new ATOM 0 HA2 GLY A 958 8.395 5.364 -3.562 1.00 0.00 H new ATOM 0 HA3 GLY A 958 9.951 6.149 -3.378 1.00 0.00 H new ATOM 597 N ASP A 959 10.479 3.131 -2.926 1.00 0.00 N ATOM 598 CA ASP A 959 11.032 1.856 -3.373 1.00 0.00 C ATOM 599 C ASP A 959 10.078 1.220 -4.364 1.00 0.00 C ATOM 600 O ASP A 959 8.999 0.772 -3.986 1.00 0.00 O ATOM 601 CB ASP A 959 11.263 0.922 -2.179 1.00 0.00 C ATOM 602 CG ASP A 959 11.746 -0.464 -2.576 1.00 0.00 C ATOM 603 OD1 ASP A 959 12.773 -0.577 -3.266 1.00 0.00 O ATOM 604 OD2 ASP A 959 11.126 -1.473 -2.173 1.00 0.00 O ATOM 0 H ASP A 959 10.444 3.234 -1.912 1.00 0.00 H new ATOM 0 HA ASP A 959 11.993 2.030 -3.856 1.00 0.00 H new ATOM 0 HB2 ASP A 959 11.995 1.375 -1.510 1.00 0.00 H new ATOM 0 HB3 ASP A 959 10.334 0.827 -1.617 1.00 0.00 H new ATOM 609 N LYS A 960 10.428 1.338 -5.636 1.00 0.00 N ATOM 610 CA LYS A 960 9.630 0.788 -6.719 1.00 0.00 C ATOM 611 C LYS A 960 9.451 -0.696 -6.480 1.00 0.00 C ATOM 612 O LYS A 960 10.424 -1.446 -6.380 1.00 0.00 O ATOM 613 CB LYS A 960 10.303 1.062 -8.075 1.00 0.00 C ATOM 614 CG LYS A 960 9.441 0.802 -9.315 1.00 0.00 C ATOM 615 CD LYS A 960 9.198 -0.664 -9.618 1.00 0.00 C ATOM 616 CE LYS A 960 8.244 -0.824 -10.785 1.00 0.00 C ATOM 617 NZ LYS A 960 7.967 -2.247 -11.093 1.00 0.00 N ATOM 0 H LYS A 960 11.273 1.818 -5.945 1.00 0.00 H new ATOM 0 HA LYS A 960 8.651 1.266 -6.743 1.00 0.00 H new ATOM 0 HB2 LYS A 960 10.628 2.102 -8.094 1.00 0.00 H new ATOM 0 HB3 LYS A 960 11.200 0.447 -8.144 1.00 0.00 H new ATOM 0 HG2 LYS A 960 8.479 1.297 -9.183 1.00 0.00 H new ATOM 0 HG3 LYS A 960 9.921 1.263 -10.178 1.00 0.00 H new ATOM 0 HD2 LYS A 960 10.144 -1.154 -9.847 1.00 0.00 H new ATOM 0 HD3 LYS A 960 8.788 -1.158 -8.737 1.00 0.00 H new ATOM 0 HE2 LYS A 960 7.307 -0.314 -10.558 1.00 0.00 H new ATOM 0 HE3 LYS A 960 8.666 -0.339 -11.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 960 7.310 -2.307 -11.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 960 8.856 -2.729 -11.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 960 7.540 -2.705 -10.263 1.00 0.00 H new ATOM 631 N ALA A 961 8.216 -1.119 -6.427 1.00 0.00 N ATOM 632 CA ALA A 961 7.923 -2.487 -6.108 1.00 0.00 C ATOM 633 C ALA A 961 7.148 -3.125 -7.244 1.00 0.00 C ATOM 634 O ALA A 961 6.908 -2.489 -8.281 1.00 0.00 O ATOM 635 CB ALA A 961 7.143 -2.563 -4.803 1.00 0.00 C ATOM 0 H ALA A 961 7.398 -0.535 -6.601 1.00 0.00 H new ATOM 0 HA ALA A 961 8.856 -3.036 -5.978 1.00 0.00 H new ATOM 0 HB1 ALA A 961 6.925 -3.605 -4.569 1.00 0.00 H new ATOM 0 HB2 ALA A 961 7.736 -2.127 -3.999 1.00 0.00 H new ATOM 0 HB3 ALA A 961 6.209 -2.011 -4.905 1.00 0.00 H new ATOM 641 N ALA A 962 6.810 -4.383 -7.083 1.00 0.00 N ATOM 642 CA ALA A 962 5.983 -5.065 -8.047 1.00 0.00 C ATOM 643 C ALA A 962 4.554 -4.602 -7.856 1.00 0.00 C ATOM 644 O ALA A 962 4.180 -4.147 -6.770 1.00 0.00 O ATOM 645 CB ALA A 962 6.091 -6.575 -7.882 1.00 0.00 C ATOM 0 H ALA A 962 7.097 -4.956 -6.289 1.00 0.00 H new ATOM 0 HA ALA A 962 6.317 -4.827 -9.057 1.00 0.00 H new ATOM 0 HB1 ALA A 962 5.458 -7.068 -8.620 1.00 0.00 H new ATOM 0 HB2 ALA A 962 7.126 -6.884 -8.027 1.00 0.00 H new ATOM 0 HB3 ALA A 962 5.766 -6.856 -6.880 1.00 0.00 H new ATOM 651 N SER A 963 3.758 -4.684 -8.888 1.00 0.00 N ATOM 652 CA SER A 963 2.389 -4.283 -8.772 1.00 0.00 C ATOM 653 C SER A 963 1.611 -5.463 -8.184 1.00 0.00 C ATOM 654 O SER A 963 2.013 -6.598 -8.382 1.00 0.00 O ATOM 655 CB SER A 963 1.889 -3.871 -10.148 1.00 0.00 C ATOM 656 OG SER A 963 2.834 -3.015 -10.781 1.00 0.00 O ATOM 0 H SER A 963 4.034 -5.022 -9.810 1.00 0.00 H new ATOM 0 HA SER A 963 2.258 -3.426 -8.111 1.00 0.00 H new ATOM 0 HB2 SER A 963 1.722 -4.756 -10.762 1.00 0.00 H new ATOM 0 HB3 SER A 963 0.930 -3.361 -10.056 1.00 0.00 H new ATOM 0 HG SER A 963 2.501 -2.758 -11.666 1.00 0.00 H new ATOM 662 N PRO A 964 0.522 -5.208 -7.436 1.00 0.00 N ATOM 663 CA PRO A 964 -0.256 -6.229 -6.700 1.00 0.00 C ATOM 664 C PRO A 964 -0.544 -7.554 -7.424 1.00 0.00 C ATOM 665 O PRO A 964 -0.593 -8.600 -6.786 1.00 0.00 O ATOM 666 CB PRO A 964 -1.569 -5.534 -6.421 1.00 0.00 C ATOM 667 CG PRO A 964 -1.288 -4.077 -6.434 1.00 0.00 C ATOM 668 CD PRO A 964 -0.030 -3.866 -7.226 1.00 0.00 C ATOM 0 HA PRO A 964 0.328 -6.546 -5.836 1.00 0.00 H new ATOM 0 HB2 PRO A 964 -2.312 -5.792 -7.176 1.00 0.00 H new ATOM 0 HB3 PRO A 964 -1.973 -5.842 -5.457 1.00 0.00 H new ATOM 0 HG2 PRO A 964 -2.118 -3.531 -6.881 1.00 0.00 H new ATOM 0 HG3 PRO A 964 -1.169 -3.701 -5.418 1.00 0.00 H new ATOM 0 HD2 PRO A 964 -0.240 -3.374 -8.176 1.00 0.00 H new ATOM 0 HD3 PRO A 964 0.673 -3.231 -6.687 1.00 0.00 H new ATOM 676 N SER A 965 -0.731 -7.530 -8.728 1.00 0.00 N ATOM 677 CA SER A 965 -1.032 -8.758 -9.441 1.00 0.00 C ATOM 678 C SER A 965 0.277 -9.533 -9.646 1.00 0.00 C ATOM 679 O SER A 965 0.342 -10.752 -9.454 1.00 0.00 O ATOM 680 CB SER A 965 -1.744 -8.451 -10.768 1.00 0.00 C ATOM 681 OG SER A 965 -2.256 -9.620 -11.391 1.00 0.00 O ATOM 0 H SER A 965 -0.682 -6.692 -9.308 1.00 0.00 H new ATOM 0 HA SER A 965 -1.716 -9.378 -8.861 1.00 0.00 H new ATOM 0 HB2 SER A 965 -2.561 -7.752 -10.586 1.00 0.00 H new ATOM 0 HB3 SER A 965 -1.047 -7.957 -11.445 1.00 0.00 H new ATOM 0 HG SER A 965 -2.701 -9.376 -12.229 1.00 0.00 H new ATOM 687 N GLU A 966 1.316 -8.799 -10.032 1.00 0.00 N ATOM 688 CA GLU A 966 2.673 -9.329 -10.169 1.00 0.00 C ATOM 689 C GLU A 966 3.275 -9.738 -8.806 1.00 0.00 C ATOM 690 O GLU A 966 4.134 -10.620 -8.741 1.00 0.00 O ATOM 691 CB GLU A 966 3.555 -8.291 -10.890 1.00 0.00 C ATOM 692 CG GLU A 966 5.004 -8.710 -11.086 1.00 0.00 C ATOM 693 CD GLU A 966 5.777 -7.739 -11.949 1.00 0.00 C ATOM 694 OE1 GLU A 966 6.104 -6.622 -11.488 1.00 0.00 O ATOM 695 OE2 GLU A 966 6.052 -8.071 -13.130 1.00 0.00 O ATOM 0 H GLU A 966 1.241 -7.808 -10.262 1.00 0.00 H new ATOM 0 HA GLU A 966 2.632 -10.239 -10.768 1.00 0.00 H new ATOM 0 HB2 GLU A 966 3.118 -8.079 -11.866 1.00 0.00 H new ATOM 0 HB3 GLU A 966 3.534 -7.361 -10.322 1.00 0.00 H new ATOM 0 HG2 GLU A 966 5.489 -8.792 -10.114 1.00 0.00 H new ATOM 0 HG3 GLU A 966 5.034 -9.700 -11.542 1.00 0.00 H new ATOM 702 N LEU A 967 2.802 -9.122 -7.730 1.00 0.00 N ATOM 703 CA LEU A 967 3.279 -9.401 -6.384 1.00 0.00 C ATOM 704 C LEU A 967 2.912 -10.823 -5.959 1.00 0.00 C ATOM 705 O LEU A 967 1.741 -11.148 -5.745 1.00 0.00 O ATOM 706 CB LEU A 967 2.692 -8.334 -5.448 1.00 0.00 C ATOM 707 CG LEU A 967 3.625 -7.154 -5.155 1.00 0.00 C ATOM 708 CD1 LEU A 967 2.887 -6.041 -4.437 1.00 0.00 C ATOM 709 CD2 LEU A 967 4.805 -7.618 -4.314 1.00 0.00 C ATOM 0 H LEU A 967 2.072 -8.411 -7.768 1.00 0.00 H new ATOM 0 HA LEU A 967 4.367 -9.351 -6.341 1.00 0.00 H new ATOM 0 HB2 LEU A 967 1.772 -7.951 -5.889 1.00 0.00 H new ATOM 0 HB3 LEU A 967 2.421 -8.808 -4.505 1.00 0.00 H new ATOM 0 HG LEU A 967 3.989 -6.766 -6.106 1.00 0.00 H new ATOM 0 HD11 LEU A 967 3.573 -5.217 -4.242 1.00 0.00 H new ATOM 0 HD12 LEU A 967 2.065 -5.689 -5.060 1.00 0.00 H new ATOM 0 HD13 LEU A 967 2.492 -6.416 -3.493 1.00 0.00 H new ATOM 0 HD21 LEU A 967 5.462 -6.772 -4.111 1.00 0.00 H new ATOM 0 HD22 LEU A 967 4.441 -8.029 -3.372 1.00 0.00 H new ATOM 0 HD23 LEU A 967 5.358 -8.386 -4.855 1.00 0.00 H new ATOM 721 N THR A 968 3.918 -11.675 -5.849 1.00 0.00 N ATOM 722 CA THR A 968 3.706 -13.072 -5.533 1.00 0.00 C ATOM 723 C THR A 968 4.090 -13.402 -4.097 1.00 0.00 C ATOM 724 O THR A 968 4.928 -12.727 -3.485 1.00 0.00 O ATOM 725 CB THR A 968 4.497 -13.958 -6.512 1.00 0.00 C ATOM 726 OG1 THR A 968 5.845 -13.476 -6.618 1.00 0.00 O ATOM 727 CG2 THR A 968 3.841 -13.970 -7.885 1.00 0.00 C ATOM 0 H THR A 968 4.897 -11.417 -5.976 1.00 0.00 H new ATOM 0 HA THR A 968 2.640 -13.274 -5.637 1.00 0.00 H new ATOM 0 HB THR A 968 4.504 -14.978 -6.128 1.00 0.00 H new ATOM 0 HG1 THR A 968 6.347 -14.043 -7.240 1.00 0.00 H new ATOM 0 HG21 THR A 968 4.419 -14.603 -8.559 1.00 0.00 H new ATOM 0 HG22 THR A 968 2.827 -14.361 -7.800 1.00 0.00 H new ATOM 0 HG23 THR A 968 3.807 -12.955 -8.281 1.00 0.00 H new ATOM 735 N CYS A 969 3.473 -14.435 -3.558 1.00 0.00 N ATOM 736 CA CYS A 969 3.750 -14.876 -2.207 1.00 0.00 C ATOM 737 C CYS A 969 4.865 -15.911 -2.212 1.00 0.00 C ATOM 738 O CYS A 969 5.097 -16.575 -3.229 1.00 0.00 O ATOM 739 CB CYS A 969 2.484 -15.471 -1.599 1.00 0.00 C ATOM 740 SG CYS A 969 1.692 -16.712 -2.649 1.00 0.00 S ATOM 0 H CYS A 969 2.768 -14.990 -4.043 1.00 0.00 H new ATOM 0 HA CYS A 969 4.071 -14.024 -1.608 1.00 0.00 H new ATOM 0 HB2 CYS A 969 2.730 -15.923 -0.638 1.00 0.00 H new ATOM 0 HB3 CYS A 969 1.774 -14.668 -1.401 1.00 0.00 H new ATOM 0 HG CYS A 969 0.484 -16.328 -2.939 1.00 0.00 H new ATOM 746 N PRO A 970 5.608 -16.033 -1.107 1.00 0.00 N ATOM 747 CA PRO A 970 6.617 -17.082 -0.962 1.00 0.00 C ATOM 748 C PRO A 970 5.944 -18.419 -0.636 1.00 0.00 C ATOM 749 O PRO A 970 4.747 -18.444 -0.329 1.00 0.00 O ATOM 750 CB PRO A 970 7.444 -16.577 0.219 1.00 0.00 C ATOM 751 CG PRO A 970 6.466 -15.852 1.052 1.00 0.00 C ATOM 752 CD PRO A 970 5.561 -15.152 0.081 1.00 0.00 C ATOM 0 HA PRO A 970 7.211 -17.259 -1.858 1.00 0.00 H new ATOM 0 HB2 PRO A 970 7.903 -17.400 0.767 1.00 0.00 H new ATOM 0 HB3 PRO A 970 8.252 -15.923 -0.109 1.00 0.00 H new ATOM 0 HG2 PRO A 970 5.906 -16.538 1.688 1.00 0.00 H new ATOM 0 HG3 PRO A 970 6.962 -15.140 1.711 1.00 0.00 H new ATOM 0 HD2 PRO A 970 4.548 -15.054 0.471 1.00 0.00 H new ATOM 0 HD3 PRO A 970 5.914 -14.146 -0.147 1.00 0.00 H new ATOM 760 N PRO A 971 6.671 -19.552 -0.685 1.00 0.00 N ATOM 761 CA PRO A 971 6.089 -20.869 -0.379 1.00 0.00 C ATOM 762 C PRO A 971 5.631 -21.019 1.080 1.00 0.00 C ATOM 763 O PRO A 971 4.984 -22.009 1.420 1.00 0.00 O ATOM 764 CB PRO A 971 7.222 -21.853 -0.692 1.00 0.00 C ATOM 765 CG PRO A 971 8.176 -21.092 -1.550 1.00 0.00 C ATOM 766 CD PRO A 971 8.087 -19.666 -1.088 1.00 0.00 C ATOM 0 HA PRO A 971 5.183 -21.037 -0.961 1.00 0.00 H new ATOM 0 HB2 PRO A 971 7.705 -22.201 0.221 1.00 0.00 H new ATOM 0 HB3 PRO A 971 6.845 -22.736 -1.209 1.00 0.00 H new ATOM 0 HG2 PRO A 971 9.191 -21.476 -1.443 1.00 0.00 H new ATOM 0 HG3 PRO A 971 7.911 -21.180 -2.604 1.00 0.00 H new ATOM 0 HD2 PRO A 971 8.763 -19.465 -0.257 1.00 0.00 H new ATOM 0 HD3 PRO A 971 8.341 -18.965 -1.883 1.00 0.00 H new ATOM 774 N GLY A 972 5.984 -20.055 1.927 1.00 0.00 N ATOM 775 CA GLY A 972 5.568 -20.082 3.316 1.00 0.00 C ATOM 776 C GLY A 972 4.638 -18.932 3.670 1.00 0.00 C ATOM 777 O GLY A 972 4.463 -18.617 4.837 1.00 0.00 O ATOM 0 H GLY A 972 6.556 -19.250 1.671 1.00 0.00 H new ATOM 0 HA2 GLY A 972 5.066 -21.027 3.523 1.00 0.00 H new ATOM 0 HA3 GLY A 972 6.449 -20.042 3.956 1.00 0.00 H new ATOM 781 N TRP A 973 4.051 -18.295 2.669 1.00 0.00 N ATOM 782 CA TRP A 973 3.078 -17.240 2.907 1.00 0.00 C ATOM 783 C TRP A 973 1.910 -17.389 1.965 1.00 0.00 C ATOM 784 O TRP A 973 2.063 -17.611 0.766 1.00 0.00 O ATOM 785 CB TRP A 973 3.658 -15.819 2.880 1.00 0.00 C ATOM 786 CG TRP A 973 4.348 -15.420 4.156 1.00 0.00 C ATOM 787 CD1 TRP A 973 5.691 -15.424 4.391 1.00 0.00 C ATOM 788 CD2 TRP A 973 3.734 -14.985 5.383 1.00 0.00 C ATOM 789 NE1 TRP A 973 5.949 -15.000 5.664 1.00 0.00 N ATOM 790 CE2 TRP A 973 4.771 -14.725 6.295 1.00 0.00 C ATOM 791 CE3 TRP A 973 2.416 -14.781 5.804 1.00 0.00 C ATOM 792 CZ2 TRP A 973 4.533 -14.276 7.591 1.00 0.00 C ATOM 793 CZ3 TRP A 973 2.185 -14.344 7.103 1.00 0.00 C ATOM 794 CH2 TRP A 973 3.240 -14.098 7.977 1.00 0.00 C ATOM 0 H TRP A 973 4.231 -18.490 1.684 1.00 0.00 H new ATOM 0 HA TRP A 973 2.732 -17.369 3.932 1.00 0.00 H new ATOM 0 HB2 TRP A 973 4.367 -15.742 2.055 1.00 0.00 H new ATOM 0 HB3 TRP A 973 2.854 -15.112 2.677 1.00 0.00 H new ATOM 0 HD1 TRP A 973 6.443 -15.720 3.674 1.00 0.00 H new ATOM 0 HE1 TRP A 973 6.876 -14.904 6.078 1.00 0.00 H new ATOM 0 HE3 TRP A 973 1.591 -14.960 5.131 1.00 0.00 H new ATOM 0 HZ2 TRP A 973 5.349 -14.075 8.269 1.00 0.00 H new ATOM 0 HZ3 TRP A 973 1.170 -14.193 7.440 1.00 0.00 H new ATOM 0 HH2 TRP A 973 3.029 -13.759 8.981 1.00 0.00 H new ATOM 805 N GLU A 974 0.754 -17.250 2.543 1.00 0.00 N ATOM 806 CA GLU A 974 -0.511 -17.549 1.929 1.00 0.00 C ATOM 807 C GLU A 974 -1.337 -16.279 1.821 1.00 0.00 C ATOM 808 O GLU A 974 -1.390 -15.486 2.749 1.00 0.00 O ATOM 809 CB GLU A 974 -1.194 -18.579 2.834 1.00 0.00 C ATOM 810 CG GLU A 974 -2.619 -18.932 2.505 1.00 0.00 C ATOM 811 CD GLU A 974 -2.735 -19.574 1.143 1.00 0.00 C ATOM 812 OE1 GLU A 974 -2.847 -18.853 0.136 1.00 0.00 O ATOM 813 OE2 GLU A 974 -2.670 -20.812 1.047 1.00 0.00 O ATOM 0 H GLU A 974 0.660 -16.909 3.500 1.00 0.00 H new ATOM 0 HA GLU A 974 -0.394 -17.945 0.920 1.00 0.00 H new ATOM 0 HB2 GLU A 974 -0.603 -19.495 2.812 1.00 0.00 H new ATOM 0 HB3 GLU A 974 -1.164 -18.205 3.857 1.00 0.00 H new ATOM 0 HG2 GLU A 974 -3.010 -19.612 3.262 1.00 0.00 H new ATOM 0 HG3 GLU A 974 -3.233 -18.032 2.537 1.00 0.00 H new ATOM 820 N TRP A 975 -1.923 -16.034 0.685 1.00 0.00 N ATOM 821 CA TRP A 975 -2.814 -14.895 0.574 1.00 0.00 C ATOM 822 C TRP A 975 -4.189 -15.261 1.102 1.00 0.00 C ATOM 823 O TRP A 975 -4.961 -15.964 0.442 1.00 0.00 O ATOM 824 CB TRP A 975 -2.919 -14.369 -0.857 1.00 0.00 C ATOM 825 CG TRP A 975 -1.636 -13.862 -1.410 1.00 0.00 C ATOM 826 CD1 TRP A 975 -0.997 -14.336 -2.502 1.00 0.00 C ATOM 827 CD2 TRP A 975 -0.835 -12.788 -0.902 1.00 0.00 C ATOM 828 NE1 TRP A 975 0.144 -13.623 -2.721 1.00 0.00 N ATOM 829 CE2 TRP A 975 0.281 -12.673 -1.744 1.00 0.00 C ATOM 830 CE3 TRP A 975 -0.949 -11.914 0.180 1.00 0.00 C ATOM 831 CZ2 TRP A 975 1.280 -11.721 -1.534 1.00 0.00 C ATOM 832 CZ3 TRP A 975 0.038 -10.970 0.379 1.00 0.00 C ATOM 833 CH2 TRP A 975 1.140 -10.884 -0.469 1.00 0.00 C ATOM 0 H TRP A 975 -1.810 -16.587 -0.164 1.00 0.00 H new ATOM 0 HA TRP A 975 -2.390 -14.092 1.177 1.00 0.00 H new ATOM 0 HB2 TRP A 975 -3.290 -15.167 -1.500 1.00 0.00 H new ATOM 0 HB3 TRP A 975 -3.657 -13.567 -0.885 1.00 0.00 H new ATOM 0 HD1 TRP A 975 -1.340 -15.159 -3.112 1.00 0.00 H new ATOM 0 HE1 TRP A 975 0.794 -13.774 -3.492 1.00 0.00 H new ATOM 0 HE3 TRP A 975 -1.794 -11.975 0.849 1.00 0.00 H new ATOM 0 HZ2 TRP A 975 2.133 -11.651 -2.192 1.00 0.00 H new ATOM 0 HZ3 TRP A 975 -0.046 -10.284 1.209 1.00 0.00 H new ATOM 0 HH2 TRP A 975 1.898 -10.139 -0.278 1.00 0.00 H new ATOM 844 N GLU A 976 -4.471 -14.855 2.330 1.00 0.00 N ATOM 845 CA GLU A 976 -5.790 -15.075 2.878 1.00 0.00 C ATOM 846 C GLU A 976 -6.745 -14.083 2.221 1.00 0.00 C ATOM 847 O GLU A 976 -7.875 -14.411 1.850 1.00 0.00 O ATOM 848 CB GLU A 976 -5.828 -14.887 4.396 1.00 0.00 C ATOM 849 CG GLU A 976 -7.193 -15.251 4.955 1.00 0.00 C ATOM 850 CD GLU A 976 -7.334 -15.051 6.435 1.00 0.00 C ATOM 851 OE1 GLU A 976 -7.342 -13.893 6.902 1.00 0.00 O ATOM 852 OE2 GLU A 976 -7.463 -16.045 7.164 1.00 0.00 O ATOM 0 H GLU A 976 -3.816 -14.381 2.952 1.00 0.00 H new ATOM 0 HA GLU A 976 -6.082 -16.105 2.675 1.00 0.00 H new ATOM 0 HB2 GLU A 976 -5.063 -15.508 4.862 1.00 0.00 H new ATOM 0 HB3 GLU A 976 -5.594 -13.852 4.644 1.00 0.00 H new ATOM 0 HG2 GLU A 976 -7.950 -14.654 4.447 1.00 0.00 H new ATOM 0 HG3 GLU A 976 -7.400 -16.295 4.721 1.00 0.00 H new ATOM 859 N ASP A 977 -6.235 -12.871 2.055 1.00 0.00 N ATOM 860 CA ASP A 977 -6.963 -11.731 1.507 1.00 0.00 C ATOM 861 C ASP A 977 -7.404 -11.971 0.064 1.00 0.00 C ATOM 862 O ASP A 977 -6.647 -12.536 -0.739 1.00 0.00 O ATOM 863 CB ASP A 977 -6.033 -10.525 1.552 1.00 0.00 C ATOM 864 CG ASP A 977 -6.695 -9.197 1.303 1.00 0.00 C ATOM 865 OD1 ASP A 977 -7.214 -8.969 0.204 1.00 0.00 O ATOM 866 OD2 ASP A 977 -6.667 -8.349 2.218 1.00 0.00 O ATOM 0 H ASP A 977 -5.272 -12.645 2.305 1.00 0.00 H new ATOM 0 HA ASP A 977 -7.864 -11.570 2.099 1.00 0.00 H new ATOM 0 HB2 ASP A 977 -5.550 -10.495 2.529 1.00 0.00 H new ATOM 0 HB3 ASP A 977 -5.246 -10.665 0.811 1.00 0.00 H new ATOM 871 N ASP A 978 -8.631 -11.561 -0.232 1.00 0.00 N ATOM 872 CA ASP A 978 -9.211 -11.631 -1.578 1.00 0.00 C ATOM 873 C ASP A 978 -8.312 -10.985 -2.618 1.00 0.00 C ATOM 874 O ASP A 978 -7.816 -11.658 -3.519 1.00 0.00 O ATOM 875 CB ASP A 978 -10.571 -10.919 -1.653 1.00 0.00 C ATOM 876 CG ASP A 978 -11.679 -11.577 -0.867 1.00 0.00 C ATOM 877 OD1 ASP A 978 -12.354 -12.477 -1.405 1.00 0.00 O ATOM 878 OD2 ASP A 978 -11.921 -11.177 0.294 1.00 0.00 O ATOM 0 H ASP A 978 -9.264 -11.164 0.462 1.00 0.00 H new ATOM 0 HA ASP A 978 -9.327 -12.694 -1.787 1.00 0.00 H new ATOM 0 HB2 ASP A 978 -10.449 -9.897 -1.295 1.00 0.00 H new ATOM 0 HB3 ASP A 978 -10.875 -10.857 -2.698 1.00 0.00 H new ATOM 883 N ALA A 979 -8.045 -9.700 -2.443 1.00 0.00 N ATOM 884 CA ALA A 979 -7.360 -8.898 -3.449 1.00 0.00 C ATOM 885 C ALA A 979 -6.930 -7.577 -2.852 1.00 0.00 C ATOM 886 O ALA A 979 -7.544 -7.092 -1.905 1.00 0.00 O ATOM 887 CB ALA A 979 -8.275 -8.647 -4.642 1.00 0.00 C ATOM 0 H ALA A 979 -8.296 -9.183 -1.601 1.00 0.00 H new ATOM 0 HA ALA A 979 -6.480 -9.445 -3.788 1.00 0.00 H new ATOM 0 HB1 ALA A 979 -7.749 -8.047 -5.384 1.00 0.00 H new ATOM 0 HB2 ALA A 979 -8.565 -9.600 -5.085 1.00 0.00 H new ATOM 0 HB3 ALA A 979 -9.167 -8.115 -4.311 1.00 0.00 H new ATOM 893 N TRP A 980 -5.896 -6.995 -3.434 1.00 0.00 N ATOM 894 CA TRP A 980 -5.363 -5.741 -2.926 1.00 0.00 C ATOM 895 C TRP A 980 -6.415 -4.671 -3.108 1.00 0.00 C ATOM 896 O TRP A 980 -6.807 -4.346 -4.235 1.00 0.00 O ATOM 897 CB TRP A 980 -4.068 -5.310 -3.603 1.00 0.00 C ATOM 898 CG TRP A 980 -2.970 -6.332 -3.561 1.00 0.00 C ATOM 899 CD1 TRP A 980 -2.932 -7.523 -4.225 1.00 0.00 C ATOM 900 CD2 TRP A 980 -1.725 -6.232 -2.859 1.00 0.00 C ATOM 901 NE1 TRP A 980 -1.754 -8.166 -3.978 1.00 0.00 N ATOM 902 CE2 TRP A 980 -0.990 -7.398 -3.149 1.00 0.00 C ATOM 903 CE3 TRP A 980 -1.158 -5.276 -2.014 1.00 0.00 C ATOM 904 CZ2 TRP A 980 0.277 -7.631 -2.634 1.00 0.00 C ATOM 905 CZ3 TRP A 980 0.101 -5.509 -1.497 1.00 0.00 C ATOM 906 CH2 TRP A 980 0.808 -6.676 -1.810 1.00 0.00 C ATOM 0 H TRP A 980 -5.412 -7.366 -4.252 1.00 0.00 H new ATOM 0 HA TRP A 980 -5.118 -5.889 -1.874 1.00 0.00 H new ATOM 0 HB2 TRP A 980 -4.281 -5.068 -4.644 1.00 0.00 H new ATOM 0 HB3 TRP A 980 -3.713 -4.395 -3.129 1.00 0.00 H new ATOM 0 HD1 TRP A 980 -3.722 -7.903 -4.856 1.00 0.00 H new ATOM 0 HE1 TRP A 980 -1.487 -9.076 -4.354 1.00 0.00 H new ATOM 0 HE3 TRP A 980 -1.694 -4.371 -1.769 1.00 0.00 H new ATOM 0 HZ2 TRP A 980 0.823 -8.531 -2.874 1.00 0.00 H new ATOM 0 HZ3 TRP A 980 0.548 -4.778 -0.840 1.00 0.00 H new ATOM 0 HH2 TRP A 980 1.793 -6.826 -1.393 1.00 0.00 H new ATOM 917 N SER A 981 -6.855 -4.136 -2.005 1.00 0.00 N ATOM 918 CA SER A 981 -7.948 -3.204 -1.986 1.00 0.00 C ATOM 919 C SER A 981 -7.415 -1.932 -1.378 1.00 0.00 C ATOM 920 O SER A 981 -6.512 -1.995 -0.579 1.00 0.00 O ATOM 921 CB SER A 981 -9.084 -3.777 -1.136 1.00 0.00 C ATOM 922 OG SER A 981 -9.451 -5.074 -1.584 1.00 0.00 O ATOM 0 H SER A 981 -6.462 -4.336 -1.085 1.00 0.00 H new ATOM 0 HA SER A 981 -8.341 -3.015 -2.985 1.00 0.00 H new ATOM 0 HB2 SER A 981 -8.774 -3.823 -0.092 1.00 0.00 H new ATOM 0 HB3 SER A 981 -9.948 -3.114 -1.183 1.00 0.00 H new ATOM 0 HG SER A 981 -8.680 -5.674 -1.515 1.00 0.00 H new ATOM 928 N TYR A 982 -7.949 -0.800 -1.717 1.00 0.00 N ATOM 929 CA TYR A 982 -7.421 0.434 -1.177 1.00 0.00 C ATOM 930 C TYR A 982 -7.813 0.585 0.276 1.00 0.00 C ATOM 931 O TYR A 982 -8.962 0.342 0.661 1.00 0.00 O ATOM 932 CB TYR A 982 -7.855 1.623 -2.028 1.00 0.00 C ATOM 933 CG TYR A 982 -9.305 1.592 -2.438 1.00 0.00 C ATOM 934 CD1 TYR A 982 -9.694 0.844 -3.535 1.00 0.00 C ATOM 935 CD2 TYR A 982 -10.267 2.305 -1.749 1.00 0.00 C ATOM 936 CE1 TYR A 982 -11.011 0.803 -3.940 1.00 0.00 C ATOM 937 CE2 TYR A 982 -11.589 2.277 -2.147 1.00 0.00 C ATOM 938 CZ TYR A 982 -11.957 1.525 -3.242 1.00 0.00 C ATOM 939 OH TYR A 982 -13.276 1.494 -3.641 1.00 0.00 O ATOM 0 H TYR A 982 -8.738 -0.694 -2.354 1.00 0.00 H new ATOM 0 HA TYR A 982 -6.332 0.402 -1.212 1.00 0.00 H new ATOM 0 HB2 TYR A 982 -7.666 2.542 -1.473 1.00 0.00 H new ATOM 0 HB3 TYR A 982 -7.236 1.659 -2.925 1.00 0.00 H new ATOM 0 HD1 TYR A 982 -8.953 0.282 -4.084 1.00 0.00 H new ATOM 0 HD2 TYR A 982 -9.982 2.892 -0.888 1.00 0.00 H new ATOM 0 HE1 TYR A 982 -11.300 0.211 -4.796 1.00 0.00 H new ATOM 0 HE2 TYR A 982 -12.331 2.842 -1.603 1.00 0.00 H new ATOM 0 HH TYR A 982 -13.812 2.055 -3.043 1.00 0.00 H new ATOM 949 N ASP A 983 -6.828 0.938 1.075 1.00 0.00 N ATOM 950 CA ASP A 983 -6.970 0.983 2.515 1.00 0.00 C ATOM 951 C ASP A 983 -7.615 2.286 2.934 1.00 0.00 C ATOM 952 O ASP A 983 -7.104 3.364 2.636 1.00 0.00 O ATOM 953 CB ASP A 983 -5.603 0.811 3.179 1.00 0.00 C ATOM 954 CG ASP A 983 -5.645 0.792 4.699 1.00 0.00 C ATOM 955 OD1 ASP A 983 -6.718 0.536 5.288 1.00 0.00 O ATOM 956 OD2 ASP A 983 -4.588 1.017 5.328 1.00 0.00 O ATOM 0 H ASP A 983 -5.901 1.203 0.742 1.00 0.00 H new ATOM 0 HA ASP A 983 -7.614 0.165 2.838 1.00 0.00 H new ATOM 0 HB2 ASP A 983 -5.156 -0.119 2.828 1.00 0.00 H new ATOM 0 HB3 ASP A 983 -4.950 1.621 2.855 1.00 0.00 H new ATOM 961 N ILE A 984 -8.728 2.170 3.625 1.00 0.00 N ATOM 962 CA ILE A 984 -9.497 3.326 4.048 1.00 0.00 C ATOM 963 C ILE A 984 -9.481 3.445 5.567 1.00 0.00 C ATOM 964 O ILE A 984 -10.138 4.311 6.148 1.00 0.00 O ATOM 965 CB ILE A 984 -10.962 3.239 3.558 1.00 0.00 C ATOM 966 CG1 ILE A 984 -11.624 1.948 4.070 1.00 0.00 C ATOM 967 CG2 ILE A 984 -11.015 3.320 2.035 1.00 0.00 C ATOM 968 CD1 ILE A 984 -13.077 1.787 3.679 1.00 0.00 C ATOM 0 H ILE A 984 -9.127 1.276 3.910 1.00 0.00 H new ATOM 0 HA ILE A 984 -9.034 4.208 3.605 1.00 0.00 H new ATOM 0 HB ILE A 984 -11.520 4.084 3.962 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -11.063 1.093 3.692 1.00 0.00 H new ATOM 0 HG13 ILE A 984 -11.549 1.923 5.157 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -12.051 3.258 1.703 1.00 0.00 H new ATOM 0 HG22 ILE A 984 -10.585 4.266 1.706 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -10.447 2.494 1.607 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -13.461 0.850 4.083 1.00 0.00 H new ATOM 0 HD12 ILE A 984 -13.656 2.619 4.080 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -13.162 1.776 2.592 1.00 0.00 H new ATOM 980 N ASN A 985 -8.659 2.618 6.201 1.00 0.00 N ATOM 981 CA ASN A 985 -8.601 2.543 7.661 1.00 0.00 C ATOM 982 C ASN A 985 -7.500 3.481 8.167 1.00 0.00 C ATOM 983 O ASN A 985 -6.844 3.227 9.183 1.00 0.00 O ATOM 984 CB ASN A 985 -8.301 1.095 8.082 1.00 0.00 C ATOM 985 CG ASN A 985 -8.615 0.805 9.543 1.00 0.00 C ATOM 986 OD1 ASN A 985 -7.891 0.064 10.211 1.00 0.00 O ATOM 987 ND2 ASN A 985 -9.738 1.296 10.024 1.00 0.00 N ATOM 0 H ASN A 985 -8.017 1.984 5.725 1.00 0.00 H new ATOM 0 HA ASN A 985 -9.555 2.847 8.091 1.00 0.00 H new ATOM 0 HB2 ASN A 985 -8.878 0.416 7.454 1.00 0.00 H new ATOM 0 HB3 ASN A 985 -7.248 0.883 7.897 1.00 0.00 H new ATOM 0 HD21 ASN A 985 -10.030 1.066 10.974 1.00 0.00 H new ATOM 0 HD22 ASN A 985 -10.316 1.907 9.447 1.00 0.00 H new ATOM 994 N ARG A 986 -7.320 4.584 7.456 1.00 0.00 N ATOM 995 CA ARG A 986 -6.274 5.562 7.743 1.00 0.00 C ATOM 996 C ARG A 986 -6.814 6.952 7.463 1.00 0.00 C ATOM 997 O ARG A 986 -7.987 7.110 7.104 1.00 0.00 O ATOM 998 CB ARG A 986 -5.066 5.372 6.826 1.00 0.00 C ATOM 999 CG ARG A 986 -4.459 3.990 6.814 1.00 0.00 C ATOM 1000 CD ARG A 986 -3.296 3.944 5.849 1.00 0.00 C ATOM 1001 NE ARG A 986 -2.141 4.710 6.323 1.00 0.00 N ATOM 1002 CZ ARG A 986 -1.405 5.520 5.558 1.00 0.00 C ATOM 1003 NH1 ARG A 986 -1.879 5.941 4.390 1.00 0.00 N ATOM 1004 NH2 ARG A 986 -0.228 5.958 5.981 1.00 0.00 N ATOM 0 H ARG A 986 -7.901 4.830 6.654 1.00 0.00 H new ATOM 0 HA ARG A 986 -5.975 5.432 8.783 1.00 0.00 H new ATOM 0 HB2 ARG A 986 -5.363 5.626 5.809 1.00 0.00 H new ATOM 0 HB3 ARG A 986 -4.295 6.084 7.120 1.00 0.00 H new ATOM 0 HG2 ARG A 986 -4.122 3.723 7.816 1.00 0.00 H new ATOM 0 HG3 ARG A 986 -5.211 3.256 6.525 1.00 0.00 H new ATOM 0 HD2 ARG A 986 -3.000 2.907 5.692 1.00 0.00 H new ATOM 0 HD3 ARG A 986 -3.615 4.335 4.883 1.00 0.00 H new ATOM 0 HE ARG A 986 -1.881 4.618 7.305 1.00 0.00 H new ATOM 0 HH11 ARG A 986 -2.804 5.645 4.079 1.00 0.00 H new ATOM 0 HH12 ARG A 986 -1.318 6.560 3.805 1.00 0.00 H new ATOM 0 HH21 ARG A 986 0.122 5.677 6.897 1.00 0.00 H new ATOM 0 HH22 ARG A 986 0.328 6.576 5.391 1.00 0.00 H new ATOM 1018 N ALA A 987 -5.958 7.951 7.602 1.00 0.00 N ATOM 1019 CA ALA A 987 -6.296 9.303 7.210 1.00 0.00 C ATOM 1020 C ALA A 987 -6.013 9.452 5.718 1.00 0.00 C ATOM 1021 O ALA A 987 -4.953 9.934 5.309 1.00 0.00 O ATOM 1022 CB ALA A 987 -5.512 10.317 8.029 1.00 0.00 C ATOM 0 H ALA A 987 -5.019 7.846 7.986 1.00 0.00 H new ATOM 0 HA ALA A 987 -7.352 9.495 7.401 1.00 0.00 H new ATOM 0 HB1 ALA A 987 -5.783 11.325 7.716 1.00 0.00 H new ATOM 0 HB2 ALA A 987 -5.746 10.190 9.086 1.00 0.00 H new ATOM 0 HB3 ALA A 987 -4.444 10.164 7.873 1.00 0.00 H new ATOM 1028 N VAL A 988 -6.939 8.935 4.922 1.00 0.00 N ATOM 1029 CA VAL A 988 -6.823 8.875 3.471 1.00 0.00 C ATOM 1030 C VAL A 988 -8.151 9.222 2.812 1.00 0.00 C ATOM 1031 O VAL A 988 -9.188 9.263 3.483 1.00 0.00 O ATOM 1032 CB VAL A 988 -6.398 7.462 3.003 1.00 0.00 C ATOM 1033 CG1 VAL A 988 -4.968 7.152 3.415 1.00 0.00 C ATOM 1034 CG2 VAL A 988 -7.343 6.410 3.562 1.00 0.00 C ATOM 0 H VAL A 988 -7.810 8.537 5.274 1.00 0.00 H new ATOM 0 HA VAL A 988 -6.062 9.598 3.178 1.00 0.00 H new ATOM 0 HB VAL A 988 -6.450 7.442 1.914 1.00 0.00 H new ATOM 0 HG11 VAL A 988 -4.699 6.153 3.072 1.00 0.00 H new ATOM 0 HG12 VAL A 988 -4.294 7.883 2.968 1.00 0.00 H new ATOM 0 HG13 VAL A 988 -4.884 7.198 4.501 1.00 0.00 H new ATOM 0 HG21 VAL A 988 -7.030 5.423 3.223 1.00 0.00 H new ATOM 0 HG22 VAL A 988 -7.322 6.444 4.651 1.00 0.00 H new ATOM 0 HG23 VAL A 988 -8.356 6.609 3.213 1.00 0.00 H new ATOM 1044 N ASP A 989 -8.080 9.573 1.535 1.00 0.00 N ATOM 1045 CA ASP A 989 -9.251 9.803 0.671 1.00 0.00 C ATOM 1046 C ASP A 989 -10.168 8.579 0.657 1.00 0.00 C ATOM 1047 O ASP A 989 -9.788 7.503 1.122 1.00 0.00 O ATOM 1048 CB ASP A 989 -8.741 10.104 -0.754 1.00 0.00 C ATOM 1049 CG ASP A 989 -9.794 10.391 -1.812 1.00 0.00 C ATOM 1050 OD1 ASP A 989 -10.366 9.438 -2.384 1.00 0.00 O ATOM 1051 OD2 ASP A 989 -10.025 11.578 -2.127 1.00 0.00 O ATOM 0 H ASP A 989 -7.192 9.711 1.052 1.00 0.00 H new ATOM 0 HA ASP A 989 -9.831 10.643 1.053 1.00 0.00 H new ATOM 0 HB2 ASP A 989 -8.070 10.962 -0.701 1.00 0.00 H new ATOM 0 HB3 ASP A 989 -8.146 9.254 -1.089 1.00 0.00 H new ATOM 1056 N GLU A 990 -11.358 8.742 0.094 1.00 0.00 N ATOM 1057 CA GLU A 990 -12.337 7.666 -0.030 1.00 0.00 C ATOM 1058 C GLU A 990 -11.717 6.472 -0.738 1.00 0.00 C ATOM 1059 O GLU A 990 -12.065 5.320 -0.480 1.00 0.00 O ATOM 1060 CB GLU A 990 -13.533 8.119 -0.857 1.00 0.00 C ATOM 1061 CG GLU A 990 -14.038 9.502 -0.519 1.00 0.00 C ATOM 1062 CD GLU A 990 -14.458 9.656 0.922 1.00 0.00 C ATOM 1063 OE1 GLU A 990 -15.548 9.185 1.289 1.00 0.00 O ATOM 1064 OE2 GLU A 990 -13.720 10.287 1.704 1.00 0.00 O ATOM 0 H GLU A 990 -11.675 9.631 -0.293 1.00 0.00 H new ATOM 0 HA GLU A 990 -12.656 7.395 0.976 1.00 0.00 H new ATOM 0 HB2 GLU A 990 -13.260 8.093 -1.912 1.00 0.00 H new ATOM 0 HB3 GLU A 990 -14.345 7.405 -0.720 1.00 0.00 H new ATOM 0 HG2 GLU A 990 -13.257 10.229 -0.741 1.00 0.00 H new ATOM 0 HG3 GLU A 990 -14.885 9.738 -1.163 1.00 0.00 H new ATOM 1071 N LYS A 991 -10.824 6.771 -1.661 1.00 0.00 N ATOM 1072 CA LYS A 991 -10.159 5.748 -2.424 1.00 0.00 C ATOM 1073 C LYS A 991 -8.770 5.425 -1.867 1.00 0.00 C ATOM 1074 O LYS A 991 -7.987 4.740 -2.524 1.00 0.00 O ATOM 1075 CB LYS A 991 -10.067 6.197 -3.877 1.00 0.00 C ATOM 1076 CG LYS A 991 -11.419 6.560 -4.454 1.00 0.00 C ATOM 1077 CD LYS A 991 -11.308 7.229 -5.807 1.00 0.00 C ATOM 1078 CE LYS A 991 -12.664 7.751 -6.234 1.00 0.00 C ATOM 1079 NZ LYS A 991 -12.607 8.487 -7.524 1.00 0.00 N ATOM 0 H LYS A 991 -10.545 7.723 -1.897 1.00 0.00 H new ATOM 0 HA LYS A 991 -10.743 4.830 -2.355 1.00 0.00 H new ATOM 0 HB2 LYS A 991 -9.402 7.058 -3.947 1.00 0.00 H new ATOM 0 HB3 LYS A 991 -9.622 5.400 -4.473 1.00 0.00 H new ATOM 0 HG2 LYS A 991 -12.026 5.659 -4.546 1.00 0.00 H new ATOM 0 HG3 LYS A 991 -11.939 7.225 -3.764 1.00 0.00 H new ATOM 0 HD2 LYS A 991 -10.591 8.049 -5.760 1.00 0.00 H new ATOM 0 HD3 LYS A 991 -10.933 6.519 -6.544 1.00 0.00 H new ATOM 0 HE2 LYS A 991 -13.359 6.917 -6.325 1.00 0.00 H new ATOM 0 HE3 LYS A 991 -13.057 8.410 -5.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 991 -13.559 8.824 -7.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 991 -11.965 9.300 -7.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 991 -12.258 7.853 -8.270 1.00 0.00 H new ATOM 1093 N GLY A 992 -8.431 5.956 -0.694 1.00 0.00 N ATOM 1094 CA GLY A 992 -7.169 5.631 -0.051 1.00 0.00 C ATOM 1095 C GLY A 992 -6.080 6.604 -0.436 1.00 0.00 C ATOM 1096 O GLY A 992 -4.983 6.578 0.113 1.00 0.00 O ATOM 0 H GLY A 992 -9.014 6.611 -0.174 1.00 0.00 H new ATOM 0 HA2 GLY A 992 -7.299 5.640 1.031 1.00 0.00 H new ATOM 0 HA3 GLY A 992 -6.869 4.620 -0.328 1.00 0.00 H new ATOM 1100 N TRP A 993 -6.386 7.398 -1.445 1.00 0.00 N ATOM 1101 CA TRP A 993 -5.498 8.431 -1.947 1.00 0.00 C ATOM 1102 C TRP A 993 -5.027 9.406 -0.846 1.00 0.00 C ATOM 1103 O TRP A 993 -5.795 9.831 0.012 1.00 0.00 O ATOM 1104 CB TRP A 993 -6.183 9.205 -3.063 1.00 0.00 C ATOM 1105 CG TRP A 993 -6.384 8.481 -4.370 1.00 0.00 C ATOM 1106 CD1 TRP A 993 -7.576 8.226 -4.981 1.00 0.00 C ATOM 1107 CD2 TRP A 993 -5.370 7.949 -5.245 1.00 0.00 C ATOM 1108 NE1 TRP A 993 -7.368 7.569 -6.170 1.00 0.00 N ATOM 1109 CE2 TRP A 993 -6.029 7.389 -6.350 1.00 0.00 C ATOM 1110 CE3 TRP A 993 -3.975 7.887 -5.203 1.00 0.00 C ATOM 1111 CZ2 TRP A 993 -5.342 6.779 -7.397 1.00 0.00 C ATOM 1112 CZ3 TRP A 993 -3.297 7.274 -6.240 1.00 0.00 C ATOM 1113 CH2 TRP A 993 -3.981 6.727 -7.325 1.00 0.00 C ATOM 0 H TRP A 993 -7.272 7.343 -1.947 1.00 0.00 H new ATOM 0 HA TRP A 993 -4.610 7.928 -2.329 1.00 0.00 H new ATOM 0 HB2 TRP A 993 -7.159 9.530 -2.701 1.00 0.00 H new ATOM 0 HB3 TRP A 993 -5.600 10.105 -3.260 1.00 0.00 H new ATOM 0 HD1 TRP A 993 -8.544 8.501 -4.588 1.00 0.00 H new ATOM 0 HE1 TRP A 993 -8.098 7.265 -6.814 1.00 0.00 H new ATOM 0 HE3 TRP A 993 -3.433 8.312 -4.371 1.00 0.00 H new ATOM 0 HZ2 TRP A 993 -5.871 6.360 -8.240 1.00 0.00 H new ATOM 0 HZ3 TRP A 993 -2.219 7.218 -6.209 1.00 0.00 H new ATOM 0 HH2 TRP A 993 -3.424 6.255 -8.121 1.00 0.00 H new ATOM 1124 N GLU A 994 -3.761 9.765 -0.896 1.00 0.00 N ATOM 1125 CA GLU A 994 -3.144 10.630 0.103 1.00 0.00 C ATOM 1126 C GLU A 994 -2.741 11.968 -0.493 1.00 0.00 C ATOM 1127 O GLU A 994 -2.449 12.080 -1.694 1.00 0.00 O ATOM 1128 CB GLU A 994 -1.878 10.012 0.700 1.00 0.00 C ATOM 1129 CG GLU A 994 -2.024 8.596 1.204 1.00 0.00 C ATOM 1130 CD GLU A 994 -0.782 8.097 1.915 1.00 0.00 C ATOM 1131 OE1 GLU A 994 0.235 7.800 1.261 1.00 0.00 O ATOM 1132 OE2 GLU A 994 -0.800 7.997 3.162 1.00 0.00 O ATOM 0 H GLU A 994 -3.123 9.466 -1.633 1.00 0.00 H new ATOM 0 HA GLU A 994 -3.899 10.761 0.878 1.00 0.00 H new ATOM 0 HB2 GLU A 994 -1.093 10.031 -0.056 1.00 0.00 H new ATOM 0 HB3 GLU A 994 -1.541 10.640 1.525 1.00 0.00 H new ATOM 0 HG2 GLU A 994 -2.873 8.543 1.885 1.00 0.00 H new ATOM 0 HG3 GLU A 994 -2.247 7.937 0.365 1.00 0.00 H new ATOM 1139 N TYR A 995 -2.669 12.930 0.407 1.00 0.00 N ATOM 1140 CA TYR A 995 -2.323 14.325 0.175 1.00 0.00 C ATOM 1141 C TYR A 995 -0.819 14.501 -0.004 1.00 0.00 C ATOM 1142 O TYR A 995 -0.088 14.432 0.956 1.00 0.00 O ATOM 1143 CB TYR A 995 -2.855 15.119 1.396 1.00 0.00 C ATOM 1144 CG TYR A 995 -2.336 16.531 1.649 1.00 0.00 C ATOM 1145 CD1 TYR A 995 -1.189 16.744 2.407 1.00 0.00 C ATOM 1146 CD2 TYR A 995 -3.011 17.641 1.183 1.00 0.00 C ATOM 1147 CE1 TYR A 995 -0.734 18.015 2.680 1.00 0.00 C ATOM 1148 CE2 TYR A 995 -2.559 18.913 1.445 1.00 0.00 C ATOM 1149 CZ TYR A 995 -1.424 19.098 2.195 1.00 0.00 C ATOM 1150 OH TYR A 995 -0.979 20.370 2.457 1.00 0.00 O ATOM 0 H TYR A 995 -2.864 12.747 1.391 1.00 0.00 H new ATOM 0 HA TYR A 995 -2.774 14.693 -0.747 1.00 0.00 H new ATOM 0 HB2 TYR A 995 -3.939 15.180 1.301 1.00 0.00 H new ATOM 0 HB3 TYR A 995 -2.646 14.528 2.288 1.00 0.00 H new ATOM 0 HD1 TYR A 995 -0.643 15.894 2.790 1.00 0.00 H new ATOM 0 HD2 TYR A 995 -3.911 17.508 0.602 1.00 0.00 H new ATOM 0 HE1 TYR A 995 0.159 18.158 3.271 1.00 0.00 H new ATOM 0 HE2 TYR A 995 -3.097 19.767 1.061 1.00 0.00 H new ATOM 0 HH TYR A 995 -1.582 21.020 2.039 1.00 0.00 H new ATOM 1160 N GLY A 996 -0.354 14.623 -1.237 1.00 0.00 N ATOM 1161 CA GLY A 996 1.047 14.942 -1.433 1.00 0.00 C ATOM 1162 C GLY A 996 1.266 16.150 -2.321 1.00 0.00 C ATOM 1163 O GLY A 996 1.242 16.056 -3.545 1.00 0.00 O ATOM 0 H GLY A 996 -0.905 14.510 -2.088 1.00 0.00 H new ATOM 0 HA2 GLY A 996 1.511 15.123 -0.463 1.00 0.00 H new ATOM 0 HA3 GLY A 996 1.551 14.081 -1.871 1.00 0.00 H new ATOM 1167 N ILE A 997 1.484 17.303 -1.746 1.00 0.00 N ATOM 1168 CA ILE A 997 1.722 18.475 -2.559 1.00 0.00 C ATOM 1169 C ILE A 997 3.228 18.672 -2.633 1.00 0.00 C ATOM 1170 O ILE A 997 3.961 18.306 -1.708 1.00 0.00 O ATOM 1171 CB ILE A 997 1.054 19.758 -1.980 1.00 0.00 C ATOM 1172 CG1 ILE A 997 1.994 20.465 -0.990 1.00 0.00 C ATOM 1173 CG2 ILE A 997 -0.280 19.426 -1.325 1.00 0.00 C ATOM 1174 CD1 ILE A 997 1.312 21.376 0.016 1.00 0.00 C ATOM 0 H ILE A 997 1.503 17.459 -0.738 1.00 0.00 H new ATOM 0 HA ILE A 997 1.281 18.317 -3.543 1.00 0.00 H new ATOM 0 HB ILE A 997 0.861 20.442 -2.806 1.00 0.00 H new ATOM 0 HG12 ILE A 997 2.557 19.707 -0.445 1.00 0.00 H new ATOM 0 HG13 ILE A 997 2.716 21.053 -1.557 1.00 0.00 H new ATOM 0 HG21 ILE A 997 -0.727 20.337 -0.928 1.00 0.00 H new ATOM 0 HG22 ILE A 997 -0.949 18.986 -2.065 1.00 0.00 H new ATOM 0 HG23 ILE A 997 -0.120 18.717 -0.513 1.00 0.00 H new ATOM 0 HD11 ILE A 997 2.062 21.825 0.667 1.00 0.00 H new ATOM 0 HD12 ILE A 997 0.772 22.162 -0.512 1.00 0.00 H new ATOM 0 HD13 ILE A 997 0.612 20.795 0.616 1.00 0.00 H new ATOM 1186 N THR A 998 3.701 19.164 -3.734 1.00 0.00 N ATOM 1187 CA THR A 998 5.090 19.473 -3.856 1.00 0.00 C ATOM 1188 C THR A 998 5.261 20.978 -4.032 1.00 0.00 C ATOM 1189 O THR A 998 5.355 21.495 -5.151 1.00 0.00 O ATOM 1190 CB THR A 998 5.679 18.687 -5.027 1.00 0.00 C ATOM 1191 OG1 THR A 998 5.323 17.301 -4.869 1.00 0.00 O ATOM 1192 CG2 THR A 998 7.190 18.824 -5.084 1.00 0.00 C ATOM 0 H THR A 998 3.143 19.361 -4.565 1.00 0.00 H new ATOM 0 HA THR A 998 5.628 19.183 -2.954 1.00 0.00 H new ATOM 0 HB THR A 998 5.276 19.085 -5.958 1.00 0.00 H new ATOM 0 HG1 THR A 998 5.692 16.782 -5.614 1.00 0.00 H new ATOM 0 HG21 THR A 998 7.576 18.253 -5.928 1.00 0.00 H new ATOM 0 HG22 THR A 998 7.456 19.874 -5.205 1.00 0.00 H new ATOM 0 HG23 THR A 998 7.625 18.444 -4.160 1.00 0.00 H new ATOM 1200 N ILE A 999 5.170 21.678 -2.911 1.00 0.00 N ATOM 1201 CA ILE A 999 5.324 23.117 -2.898 1.00 0.00 C ATOM 1202 C ILE A 999 6.779 23.535 -3.105 1.00 0.00 C ATOM 1203 O ILE A 999 7.683 23.028 -2.441 1.00 0.00 O ATOM 1204 CB ILE A 999 4.677 23.787 -1.644 1.00 0.00 C ATOM 1205 CG1 ILE A 999 4.873 22.992 -0.332 1.00 0.00 C ATOM 1206 CG2 ILE A 999 3.198 24.026 -1.890 1.00 0.00 C ATOM 1207 CD1 ILE A 999 6.270 23.006 0.251 1.00 0.00 C ATOM 0 H ILE A 999 4.989 21.266 -1.996 1.00 0.00 H new ATOM 0 HA ILE A 999 4.764 23.496 -3.753 1.00 0.00 H new ATOM 0 HB ILE A 999 5.199 24.734 -1.504 1.00 0.00 H new ATOM 0 HG12 ILE A 999 4.185 23.388 0.415 1.00 0.00 H new ATOM 0 HG13 ILE A 999 4.586 21.956 -0.512 1.00 0.00 H new ATOM 0 HG21 ILE A 999 2.754 24.493 -1.011 1.00 0.00 H new ATOM 0 HG22 ILE A 999 3.074 24.682 -2.752 1.00 0.00 H new ATOM 0 HG23 ILE A 999 2.703 23.074 -2.084 1.00 0.00 H new ATOM 0 HD11 ILE A 999 6.288 22.417 1.168 1.00 0.00 H new ATOM 0 HD12 ILE A 999 6.969 22.579 -0.468 1.00 0.00 H new ATOM 0 HD13 ILE A 999 6.561 24.033 0.474 1.00 0.00 H new ATOM 1219 N PRO A1000 7.036 24.392 -4.104 1.00 0.00 N ATOM 1220 CA PRO A1000 8.391 24.823 -4.436 1.00 0.00 C ATOM 1221 C PRO A1000 9.018 25.768 -3.408 1.00 0.00 C ATOM 1222 O PRO A1000 8.340 26.619 -2.820 1.00 0.00 O ATOM 1223 CB PRO A1000 8.246 25.535 -5.785 1.00 0.00 C ATOM 1224 CG PRO A1000 6.830 25.348 -6.216 1.00 0.00 C ATOM 1225 CD PRO A1000 6.040 25.020 -4.987 1.00 0.00 C ATOM 0 HA PRO A1000 9.061 23.963 -4.456 1.00 0.00 H new ATOM 0 HB2 PRO A1000 8.486 26.594 -5.692 1.00 0.00 H new ATOM 0 HB3 PRO A1000 8.933 25.116 -6.520 1.00 0.00 H new ATOM 0 HG2 PRO A1000 6.448 26.252 -6.690 1.00 0.00 H new ATOM 0 HG3 PRO A1000 6.753 24.546 -6.950 1.00 0.00 H new ATOM 0 HD2 PRO A1000 5.608 25.913 -4.536 1.00 0.00 H new ATOM 0 HD3 PRO A1000 5.214 24.344 -5.208 1.00 0.00 H new ATOM 1233 N PRO A1001 10.330 25.618 -3.183 1.00 0.00 N ATOM 1234 CA PRO A1001 11.119 24.576 -3.798 1.00 0.00 C ATOM 1235 C PRO A1001 11.305 23.374 -2.902 1.00 0.00 C ATOM 1236 O PRO A1001 11.602 23.468 -1.705 1.00 0.00 O ATOM 1237 CB PRO A1001 12.460 25.228 -4.065 1.00 0.00 C ATOM 1238 CG PRO A1001 12.451 26.485 -3.274 1.00 0.00 C ATOM 1239 CD PRO A1001 11.194 26.511 -2.432 1.00 0.00 C ATOM 0 HA PRO A1001 10.627 24.197 -4.694 1.00 0.00 H new ATOM 0 HB2 PRO A1001 13.280 24.578 -3.761 1.00 0.00 H new ATOM 0 HB3 PRO A1001 12.593 25.433 -5.127 1.00 0.00 H new ATOM 0 HG2 PRO A1001 13.335 26.539 -2.638 1.00 0.00 H new ATOM 0 HG3 PRO A1001 12.482 27.350 -3.936 1.00 0.00 H new ATOM 0 HD2 PRO A1001 11.371 26.154 -1.417 1.00 0.00 H new ATOM 0 HD3 PRO A1001 10.776 27.514 -2.349 1.00 0.00 H new ATOM 1247 N ASP A1002 11.167 22.265 -3.538 1.00 0.00 N ATOM 1248 CA ASP A1002 11.291 20.944 -2.925 1.00 0.00 C ATOM 1249 C ASP A1002 11.125 19.932 -4.044 1.00 0.00 C ATOM 1250 O ASP A1002 10.903 20.334 -5.191 1.00 0.00 O ATOM 1251 CB ASP A1002 10.220 20.712 -1.842 1.00 0.00 C ATOM 1252 CG ASP A1002 10.676 19.742 -0.769 1.00 0.00 C ATOM 1253 OD1 ASP A1002 10.829 18.537 -1.043 1.00 0.00 O ATOM 1254 OD2 ASP A1002 10.900 20.181 0.384 1.00 0.00 O ATOM 0 H ASP A1002 10.957 22.226 -4.535 1.00 0.00 H new ATOM 0 HA ASP A1002 12.258 20.850 -2.432 1.00 0.00 H new ATOM 0 HB2 ASP A1002 9.964 21.665 -1.380 1.00 0.00 H new ATOM 0 HB3 ASP A1002 9.312 20.330 -2.310 1.00 0.00 H new ATOM 1259 N HIS A1003 11.236 18.649 -3.764 1.00 0.00 N ATOM 1260 CA HIS A1003 11.097 17.643 -4.804 1.00 0.00 C ATOM 1261 C HIS A1003 9.970 16.683 -4.563 1.00 0.00 C ATOM 1262 O HIS A1003 9.232 16.347 -5.485 1.00 0.00 O ATOM 1263 CB HIS A1003 12.394 16.865 -5.019 1.00 0.00 C ATOM 1264 CG HIS A1003 13.324 17.576 -5.931 1.00 0.00 C ATOM 1265 ND1 HIS A1003 14.682 17.640 -5.756 1.00 0.00 N ATOM 1266 CD2 HIS A1003 13.055 18.239 -7.068 1.00 0.00 C ATOM 1267 CE1 HIS A1003 15.216 18.320 -6.748 1.00 0.00 C ATOM 1268 NE2 HIS A1003 14.250 18.699 -7.566 1.00 0.00 N ATOM 0 H HIS A1003 11.421 18.277 -2.832 1.00 0.00 H new ATOM 0 HA HIS A1003 10.860 18.205 -5.707 1.00 0.00 H new ATOM 0 HB2 HIS A1003 12.882 16.702 -4.058 1.00 0.00 H new ATOM 0 HB3 HIS A1003 12.163 15.882 -5.430 1.00 0.00 H new ATOM 0 HD2 HIS A1003 12.080 18.384 -7.509 1.00 0.00 H new ATOM 0 HE1 HIS A1003 16.267 18.533 -6.873 1.00 0.00 H new ATOM 0 HE2 HIS A1003 14.371 19.241 -8.422 1.00 0.00 H new ATOM 1277 N LYS A1004 9.827 16.217 -3.350 1.00 0.00 N ATOM 1278 CA LYS A1004 8.842 15.208 -3.085 1.00 0.00 C ATOM 1279 C LYS A1004 7.916 15.662 -1.974 1.00 0.00 C ATOM 1280 O LYS A1004 8.319 16.459 -1.128 1.00 0.00 O ATOM 1281 CB LYS A1004 9.557 13.934 -2.653 1.00 0.00 C ATOM 1282 CG LYS A1004 10.625 13.478 -3.626 1.00 0.00 C ATOM 1283 CD LYS A1004 11.519 12.445 -2.987 1.00 0.00 C ATOM 1284 CE LYS A1004 12.654 12.055 -3.911 1.00 0.00 C ATOM 1285 NZ LYS A1004 13.515 10.994 -3.338 1.00 0.00 N ATOM 0 H LYS A1004 10.373 16.516 -2.542 1.00 0.00 H new ATOM 0 HA LYS A1004 8.253 15.028 -3.984 1.00 0.00 H new ATOM 0 HB2 LYS A1004 10.013 14.096 -1.676 1.00 0.00 H new ATOM 0 HB3 LYS A1004 8.822 13.138 -2.533 1.00 0.00 H new ATOM 0 HG2 LYS A1004 10.158 13.061 -4.518 1.00 0.00 H new ATOM 0 HG3 LYS A1004 11.220 14.333 -3.948 1.00 0.00 H new ATOM 0 HD2 LYS A1004 11.924 12.838 -2.055 1.00 0.00 H new ATOM 0 HD3 LYS A1004 10.934 11.561 -2.733 1.00 0.00 H new ATOM 0 HE2 LYS A1004 12.243 11.711 -4.860 1.00 0.00 H new ATOM 0 HE3 LYS A1004 13.261 12.934 -4.126 1.00 0.00 H new ATOM 0 HZ1 LYS A1004 14.275 10.764 -4.009 1.00 0.00 H new ATOM 0 HZ2 LYS A1004 13.931 11.329 -2.445 1.00 0.00 H new ATOM 0 HZ3 LYS A1004 12.944 10.144 -3.157 1.00 0.00 H new ATOM 1299 N PRO A1005 6.661 15.205 -1.985 1.00 0.00 N ATOM 1300 CA PRO A1005 5.741 15.422 -0.872 1.00 0.00 C ATOM 1301 C PRO A1005 6.321 14.853 0.409 1.00 0.00 C ATOM 1302 O PRO A1005 6.679 13.673 0.481 1.00 0.00 O ATOM 1303 CB PRO A1005 4.513 14.619 -1.268 1.00 0.00 C ATOM 1304 CG PRO A1005 4.565 14.581 -2.750 1.00 0.00 C ATOM 1305 CD PRO A1005 6.025 14.495 -3.095 1.00 0.00 C ATOM 0 HA PRO A1005 5.536 16.477 -0.693 1.00 0.00 H new ATOM 0 HB2 PRO A1005 4.539 13.616 -0.843 1.00 0.00 H new ATOM 0 HB3 PRO A1005 3.597 15.092 -0.914 1.00 0.00 H new ATOM 0 HG2 PRO A1005 4.018 13.723 -3.141 1.00 0.00 H new ATOM 0 HG3 PRO A1005 4.111 15.473 -3.182 1.00 0.00 H new ATOM 0 HD2 PRO A1005 6.365 13.462 -3.162 1.00 0.00 H new ATOM 0 HD3 PRO A1005 6.243 14.965 -4.054 1.00 0.00 H new ATOM 1313 N LYS A1006 6.419 15.690 1.407 1.00 0.00 N ATOM 1314 CA LYS A1006 7.007 15.316 2.676 1.00 0.00 C ATOM 1315 C LYS A1006 5.938 15.297 3.749 1.00 0.00 C ATOM 1316 O LYS A1006 6.216 15.181 4.943 1.00 0.00 O ATOM 1317 CB LYS A1006 8.110 16.325 3.000 1.00 0.00 C ATOM 1318 CG LYS A1006 7.649 17.777 2.960 1.00 0.00 C ATOM 1319 CD LYS A1006 8.824 18.733 2.921 1.00 0.00 C ATOM 1320 CE LYS A1006 8.357 20.160 2.691 1.00 0.00 C ATOM 1321 NZ LYS A1006 9.496 21.076 2.452 1.00 0.00 N ATOM 0 H LYS A1006 6.093 16.656 1.368 1.00 0.00 H new ATOM 0 HA LYS A1006 7.438 14.316 2.628 1.00 0.00 H new ATOM 0 HB2 LYS A1006 8.508 16.108 3.991 1.00 0.00 H new ATOM 0 HB3 LYS A1006 8.928 16.194 2.292 1.00 0.00 H new ATOM 0 HG2 LYS A1006 7.020 17.936 2.084 1.00 0.00 H new ATOM 0 HG3 LYS A1006 7.035 17.989 3.835 1.00 0.00 H new ATOM 0 HD2 LYS A1006 9.377 18.674 3.859 1.00 0.00 H new ATOM 0 HD3 LYS A1006 9.511 18.439 2.127 1.00 0.00 H new ATOM 0 HE2 LYS A1006 7.681 20.189 1.836 1.00 0.00 H new ATOM 0 HE3 LYS A1006 7.790 20.502 3.557 1.00 0.00 H new ATOM 0 HZ1 LYS A1006 9.168 21.905 1.916 1.00 0.00 H new ATOM 0 HZ2 LYS A1006 9.889 21.386 3.363 1.00 0.00 H new ATOM 0 HZ3 LYS A1006 10.232 20.581 1.909 1.00 0.00 H new ATOM 1335 N SER A1007 4.713 15.383 3.299 1.00 0.00 N ATOM 1336 CA SER A1007 3.576 15.447 4.166 1.00 0.00 C ATOM 1337 C SER A1007 2.410 14.784 3.457 1.00 0.00 C ATOM 1338 O SER A1007 2.284 14.917 2.241 1.00 0.00 O ATOM 1339 CB SER A1007 3.281 16.912 4.509 1.00 0.00 C ATOM 1340 OG SER A1007 2.162 17.036 5.378 1.00 0.00 O ATOM 0 H SER A1007 4.479 15.411 2.307 1.00 0.00 H new ATOM 0 HA SER A1007 3.760 14.924 5.104 1.00 0.00 H new ATOM 0 HB2 SER A1007 4.157 17.359 4.979 1.00 0.00 H new ATOM 0 HB3 SER A1007 3.092 17.469 3.591 1.00 0.00 H new ATOM 0 HG SER A1007 2.005 17.983 5.576 1.00 0.00 H new ATOM 1346 N TRP A1008 1.611 14.044 4.213 1.00 0.00 N ATOM 1347 CA TRP A1008 0.464 13.307 3.692 1.00 0.00 C ATOM 1348 C TRP A1008 -0.695 13.451 4.665 1.00 0.00 C ATOM 1349 O TRP A1008 -0.507 13.421 5.883 1.00 0.00 O ATOM 1350 CB TRP A1008 0.803 11.822 3.473 1.00 0.00 C ATOM 1351 CG TRP A1008 2.040 11.646 2.681 1.00 0.00 C ATOM 1352 CD1 TRP A1008 3.294 11.590 3.175 1.00 0.00 C ATOM 1353 CD2 TRP A1008 2.154 11.538 1.256 1.00 0.00 C ATOM 1354 NE1 TRP A1008 4.184 11.512 2.161 1.00 0.00 N ATOM 1355 CE2 TRP A1008 3.522 11.452 0.966 1.00 0.00 C ATOM 1356 CE3 TRP A1008 1.241 11.514 0.201 1.00 0.00 C ATOM 1357 CZ2 TRP A1008 4.006 11.345 -0.334 1.00 0.00 C ATOM 1358 CZ3 TRP A1008 1.718 11.405 -1.089 1.00 0.00 C ATOM 1359 CH2 TRP A1008 3.089 11.323 -1.347 1.00 0.00 C ATOM 0 H TRP A1008 1.741 13.936 5.219 1.00 0.00 H new ATOM 0 HA TRP A1008 0.188 13.721 2.722 1.00 0.00 H new ATOM 0 HB2 TRP A1008 0.918 11.330 4.439 1.00 0.00 H new ATOM 0 HB3 TRP A1008 -0.027 11.332 2.963 1.00 0.00 H new ATOM 0 HD1 TRP A1008 3.549 11.605 4.224 1.00 0.00 H new ATOM 0 HE1 TRP A1008 5.198 11.500 2.271 1.00 0.00 H new ATOM 0 HE3 TRP A1008 0.180 11.580 0.391 1.00 0.00 H new ATOM 0 HZ2 TRP A1008 5.065 11.282 -0.535 1.00 0.00 H new ATOM 0 HZ3 TRP A1008 1.020 11.383 -1.913 1.00 0.00 H new ATOM 0 HH2 TRP A1008 3.431 11.241 -2.368 1.00 0.00 H new ATOM 1370 N VAL A1009 -1.887 13.578 4.118 1.00 0.00 N ATOM 1371 CA VAL A1009 -3.128 13.807 4.857 1.00 0.00 C ATOM 1372 C VAL A1009 -4.190 13.182 3.946 1.00 0.00 C ATOM 1373 O VAL A1009 -3.817 12.451 3.034 1.00 0.00 O ATOM 1374 CB VAL A1009 -3.431 15.341 5.106 1.00 0.00 C ATOM 1375 CG1 VAL A1009 -4.619 15.555 6.046 1.00 0.00 C ATOM 1376 CG2 VAL A1009 -2.233 16.086 5.683 1.00 0.00 C ATOM 0 H VAL A1009 -2.031 13.524 3.110 1.00 0.00 H new ATOM 0 HA VAL A1009 -3.090 13.377 5.858 1.00 0.00 H new ATOM 0 HB VAL A1009 -3.668 15.742 4.121 1.00 0.00 H new ATOM 0 HG11 VAL A1009 -4.786 16.623 6.184 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -5.511 15.102 5.614 1.00 0.00 H new ATOM 0 HG13 VAL A1009 -4.408 15.093 7.010 1.00 0.00 H new ATOM 0 HG21 VAL A1009 -2.494 17.133 5.834 1.00 0.00 H new ATOM 0 HG22 VAL A1009 -1.953 15.640 6.637 1.00 0.00 H new ATOM 0 HG23 VAL A1009 -1.394 16.018 4.990 1.00 0.00 H new ATOM 1386 N ALA A1010 -5.462 13.449 4.137 1.00 0.00 N ATOM 1387 CA ALA A1010 -6.484 12.854 3.292 1.00 0.00 C ATOM 1388 C ALA A1010 -7.004 13.823 2.230 1.00 0.00 C ATOM 1389 O ALA A1010 -7.282 13.424 1.105 1.00 0.00 O ATOM 1390 CB ALA A1010 -7.637 12.381 4.159 1.00 0.00 C ATOM 0 H ALA A1010 -5.817 14.070 4.864 1.00 0.00 H new ATOM 0 HA ALA A1010 -6.029 12.014 2.767 1.00 0.00 H new ATOM 0 HB1 ALA A1010 -8.406 11.934 3.529 1.00 0.00 H new ATOM 0 HB2 ALA A1010 -7.276 11.640 4.872 1.00 0.00 H new ATOM 0 HB3 ALA A1010 -8.058 13.229 4.699 1.00 0.00 H new ATOM 1396 N ALA A1011 -7.041 15.100 2.572 1.00 0.00 N ATOM 1397 CA ALA A1011 -7.747 16.115 1.785 1.00 0.00 C ATOM 1398 C ALA A1011 -7.121 16.419 0.421 1.00 0.00 C ATOM 1399 O ALA A1011 -5.935 16.740 0.324 1.00 0.00 O ATOM 1400 CB ALA A1011 -7.855 17.395 2.596 1.00 0.00 C ATOM 0 H ALA A1011 -6.583 15.470 3.405 1.00 0.00 H new ATOM 0 HA ALA A1011 -8.730 15.697 1.569 1.00 0.00 H new ATOM 0 HB1 ALA A1011 -8.380 18.152 2.013 1.00 0.00 H new ATOM 0 HB2 ALA A1011 -8.407 17.198 3.515 1.00 0.00 H new ATOM 0 HB3 ALA A1011 -6.856 17.755 2.843 1.00 0.00 H new ATOM 1406 N GLU A1012 -7.910 16.253 -0.638 1.00 0.00 N ATOM 1407 CA GLU A1012 -7.523 16.680 -1.982 1.00 0.00 C ATOM 1408 C GLU A1012 -7.538 18.210 -2.061 1.00 0.00 C ATOM 1409 O GLU A1012 -8.569 18.845 -1.813 1.00 0.00 O ATOM 1410 CB GLU A1012 -8.487 16.136 -3.049 1.00 0.00 C ATOM 1411 CG GLU A1012 -8.057 16.436 -4.487 1.00 0.00 C ATOM 1412 CD GLU A1012 -7.145 15.392 -5.077 1.00 0.00 C ATOM 1413 OE1 GLU A1012 -5.959 15.379 -4.735 1.00 0.00 O ATOM 1414 OE2 GLU A1012 -7.621 14.573 -5.896 1.00 0.00 O ATOM 0 H GLU A1012 -8.832 15.820 -0.590 1.00 0.00 H new ATOM 0 HA GLU A1012 -6.524 16.289 -2.174 1.00 0.00 H new ATOM 0 HB2 GLU A1012 -8.578 15.057 -2.925 1.00 0.00 H new ATOM 0 HB3 GLU A1012 -9.477 16.561 -2.880 1.00 0.00 H new ATOM 0 HG2 GLU A1012 -8.946 16.524 -5.112 1.00 0.00 H new ATOM 0 HG3 GLU A1012 -7.553 17.402 -4.512 1.00 0.00 H new ATOM 1421 N LYS A1013 -6.383 18.792 -2.325 1.00 0.00 N ATOM 1422 CA LYS A1013 -6.276 20.218 -2.574 1.00 0.00 C ATOM 1423 C LYS A1013 -5.823 20.456 -3.989 1.00 0.00 C ATOM 1424 O LYS A1013 -5.137 19.611 -4.564 1.00 0.00 O ATOM 1425 CB LYS A1013 -5.270 20.880 -1.644 1.00 0.00 C ATOM 1426 CG LYS A1013 -5.689 20.832 -0.204 1.00 0.00 C ATOM 1427 CD LYS A1013 -4.712 21.545 0.698 1.00 0.00 C ATOM 1428 CE LYS A1013 -4.840 23.062 0.584 1.00 0.00 C ATOM 1429 NZ LYS A1013 -3.982 23.780 1.561 1.00 0.00 N ATOM 0 H LYS A1013 -5.495 18.292 -2.373 1.00 0.00 H new ATOM 0 HA LYS A1013 -7.261 20.650 -2.399 1.00 0.00 H new ATOM 0 HB2 LYS A1013 -4.303 20.388 -1.753 1.00 0.00 H new ATOM 0 HB3 LYS A1013 -5.134 21.919 -1.944 1.00 0.00 H new ATOM 0 HG2 LYS A1013 -6.675 21.285 -0.099 1.00 0.00 H new ATOM 0 HG3 LYS A1013 -5.780 19.793 0.112 1.00 0.00 H new ATOM 0 HD2 LYS A1013 -4.883 21.242 1.731 1.00 0.00 H new ATOM 0 HD3 LYS A1013 -3.696 21.246 0.442 1.00 0.00 H new ATOM 0 HE2 LYS A1013 -4.572 23.371 -0.426 1.00 0.00 H new ATOM 0 HE3 LYS A1013 -5.880 23.348 0.739 1.00 0.00 H new ATOM 0 HZ1 LYS A1013 -4.105 24.806 1.443 1.00 0.00 H new ATOM 0 HZ2 LYS A1013 -4.253 23.508 2.527 1.00 0.00 H new ATOM 0 HZ3 LYS A1013 -2.986 23.530 1.398 1.00 0.00 H new ATOM 1443 N MET A1014 -6.215 21.591 -4.530 1.00 0.00 N ATOM 1444 CA MET A1014 -5.784 22.046 -5.841 1.00 0.00 C ATOM 1445 C MET A1014 -4.289 21.967 -5.993 1.00 0.00 C ATOM 1446 O MET A1014 -3.810 21.447 -6.993 1.00 0.00 O ATOM 1447 CB MET A1014 -6.250 23.467 -6.070 1.00 0.00 C ATOM 1448 CG MET A1014 -5.765 24.089 -7.372 1.00 0.00 C ATOM 1449 SD MET A1014 -6.322 25.793 -7.575 1.00 0.00 S ATOM 1450 CE MET A1014 -5.428 26.238 -9.064 1.00 0.00 C ATOM 0 H MET A1014 -6.853 22.236 -4.065 1.00 0.00 H new ATOM 0 HA MET A1014 -6.230 21.388 -6.587 1.00 0.00 H new ATOM 0 HB2 MET A1014 -7.340 23.485 -6.057 1.00 0.00 H new ATOM 0 HB3 MET A1014 -5.911 24.085 -5.239 1.00 0.00 H new ATOM 0 HG2 MET A1014 -4.676 24.061 -7.401 1.00 0.00 H new ATOM 0 HG3 MET A1014 -6.122 23.491 -8.211 1.00 0.00 H new ATOM 0 HE1 MET A1014 -5.659 27.269 -9.333 1.00 0.00 H new ATOM 0 HE2 MET A1014 -4.357 26.140 -8.888 1.00 0.00 H new ATOM 0 HE3 MET A1014 -5.724 25.576 -9.878 1.00 0.00 H new ATOM 1460 N TYR A1015 -3.542 22.407 -4.981 1.00 0.00 N ATOM 1461 CA TYR A1015 -2.076 22.361 -5.040 1.00 0.00 C ATOM 1462 C TYR A1015 -1.519 20.938 -5.081 1.00 0.00 C ATOM 1463 O TYR A1015 -0.306 20.742 -4.975 1.00 0.00 O ATOM 1464 CB TYR A1015 -1.451 23.099 -3.852 1.00 0.00 C ATOM 1465 CG TYR A1015 -1.716 24.586 -3.806 1.00 0.00 C ATOM 1466 CD1 TYR A1015 -2.891 25.087 -3.269 1.00 0.00 C ATOM 1467 CD2 TYR A1015 -0.770 25.491 -4.272 1.00 0.00 C ATOM 1468 CE1 TYR A1015 -3.123 26.442 -3.197 1.00 0.00 C ATOM 1469 CE2 TYR A1015 -0.998 26.853 -4.209 1.00 0.00 C ATOM 1470 CZ TYR A1015 -2.176 27.321 -3.669 1.00 0.00 C ATOM 1471 OH TYR A1015 -2.405 28.675 -3.576 1.00 0.00 O ATOM 0 H TYR A1015 -3.920 22.796 -4.117 1.00 0.00 H new ATOM 0 HA TYR A1015 -1.808 22.855 -5.974 1.00 0.00 H new ATOM 0 HB2 TYR A1015 -1.823 22.651 -2.930 1.00 0.00 H new ATOM 0 HB3 TYR A1015 -0.373 22.939 -3.872 1.00 0.00 H new ATOM 0 HD1 TYR A1015 -3.639 24.401 -2.900 1.00 0.00 H new ATOM 0 HD2 TYR A1015 0.156 25.125 -4.689 1.00 0.00 H new ATOM 0 HE1 TYR A1015 -4.044 26.813 -2.772 1.00 0.00 H new ATOM 0 HE2 TYR A1015 -0.258 27.546 -4.581 1.00 0.00 H new ATOM 0 HH TYR A1015 -1.642 29.162 -3.952 1.00 0.00 H new ATOM 1481 N HIS A1016 -2.380 19.935 -5.212 1.00 0.00 N ATOM 1482 CA HIS A1016 -1.906 18.565 -5.330 1.00 0.00 C ATOM 1483 C HIS A1016 -1.159 18.329 -6.604 1.00 0.00 C ATOM 1484 O HIS A1016 -1.699 18.436 -7.701 1.00 0.00 O ATOM 1485 CB HIS A1016 -3.008 17.536 -5.180 1.00 0.00 C ATOM 1486 CG HIS A1016 -3.163 17.119 -3.776 1.00 0.00 C ATOM 1487 ND1 HIS A1016 -4.283 16.531 -3.275 1.00 0.00 N ATOM 1488 CD2 HIS A1016 -2.315 17.240 -2.748 1.00 0.00 C ATOM 1489 CE1 HIS A1016 -4.132 16.327 -1.994 1.00 0.00 C ATOM 1490 NE2 HIS A1016 -2.940 16.744 -1.651 1.00 0.00 N ATOM 0 H HIS A1016 -3.394 20.043 -5.239 1.00 0.00 H new ATOM 0 HA HIS A1016 -1.218 18.434 -4.495 1.00 0.00 H new ATOM 0 HB2 HIS A1016 -3.948 17.951 -5.544 1.00 0.00 H new ATOM 0 HB3 HIS A1016 -2.783 16.666 -5.797 1.00 0.00 H new ATOM 0 HD1 HIS A1016 -5.112 16.287 -3.816 1.00 0.00 H new ATOM 0 HD2 HIS A1016 -1.319 17.655 -2.785 1.00 0.00 H new ATOM 0 HE1 HIS A1016 -4.865 15.890 -1.332 1.00 0.00 H new ATOM 1499 N THR A1017 0.098 18.062 -6.410 1.00 0.00 N ATOM 1500 CA THR A1017 1.012 17.744 -7.464 1.00 0.00 C ATOM 1501 C THR A1017 1.114 16.222 -7.563 1.00 0.00 C ATOM 1502 O THR A1017 1.269 15.644 -8.625 1.00 0.00 O ATOM 1503 CB THR A1017 2.371 18.322 -7.058 1.00 0.00 C ATOM 1504 OG1 THR A1017 2.160 19.260 -5.985 1.00 0.00 O ATOM 1505 CG2 THR A1017 3.046 19.041 -8.209 1.00 0.00 C ATOM 0 H THR A1017 0.528 18.060 -5.485 1.00 0.00 H new ATOM 0 HA THR A1017 0.689 18.149 -8.423 1.00 0.00 H new ATOM 0 HB THR A1017 3.018 17.500 -6.751 1.00 0.00 H new ATOM 0 HG1 THR A1017 2.616 20.102 -6.192 1.00 0.00 H new ATOM 0 HG21 THR A1017 4.007 19.436 -7.878 1.00 0.00 H new ATOM 0 HG22 THR A1017 3.204 18.343 -9.031 1.00 0.00 H new ATOM 0 HG23 THR A1017 2.413 19.862 -8.546 1.00 0.00 H new ATOM 1513 N HIS A1018 1.036 15.593 -6.407 1.00 0.00 N ATOM 1514 CA HIS A1018 1.224 14.140 -6.263 1.00 0.00 C ATOM 1515 C HIS A1018 0.166 13.566 -5.337 1.00 0.00 C ATOM 1516 O HIS A1018 -0.427 14.284 -4.528 1.00 0.00 O ATOM 1517 CB HIS A1018 2.612 13.778 -5.676 1.00 0.00 C ATOM 1518 CG HIS A1018 3.820 14.062 -6.532 1.00 0.00 C ATOM 1519 ND1 HIS A1018 5.065 13.526 -6.284 1.00 0.00 N ATOM 1520 CD2 HIS A1018 3.985 14.875 -7.590 1.00 0.00 C ATOM 1521 CE1 HIS A1018 5.935 14.014 -7.149 1.00 0.00 C ATOM 1522 NE2 HIS A1018 5.297 14.833 -7.951 1.00 0.00 N ATOM 0 H HIS A1018 0.839 16.069 -5.526 1.00 0.00 H new ATOM 0 HA HIS A1018 1.144 13.718 -7.265 1.00 0.00 H new ATOM 0 HB2 HIS A1018 2.731 14.316 -4.735 1.00 0.00 H new ATOM 0 HB3 HIS A1018 2.610 12.714 -5.437 1.00 0.00 H new ATOM 0 HD2 HIS A1018 3.213 15.459 -8.069 1.00 0.00 H new ATOM 0 HE1 HIS A1018 6.989 13.780 -7.189 1.00 0.00 H new ATOM 0 HE2 HIS A1018 5.716 15.354 -8.721 1.00 0.00 H new ATOM 1531 N ARG A1019 -0.134 12.299 -5.506 1.00 0.00 N ATOM 1532 CA ARG A1019 -1.052 11.604 -4.623 1.00 0.00 C ATOM 1533 C ARG A1019 -0.831 10.112 -4.754 1.00 0.00 C ATOM 1534 O ARG A1019 -0.444 9.646 -5.829 1.00 0.00 O ATOM 1535 CB ARG A1019 -2.485 11.998 -4.961 1.00 0.00 C ATOM 1536 CG ARG A1019 -3.551 11.094 -4.402 1.00 0.00 C ATOM 1537 CD ARG A1019 -4.895 11.739 -4.552 1.00 0.00 C ATOM 1538 NE ARG A1019 -5.286 12.472 -3.336 1.00 0.00 N ATOM 1539 CZ ARG A1019 -6.556 12.593 -2.888 1.00 0.00 C ATOM 1540 NH1 ARG A1019 -7.585 12.229 -3.643 1.00 0.00 N ATOM 1541 NH2 ARG A1019 -6.797 13.106 -1.683 1.00 0.00 N ATOM 0 H ARG A1019 0.247 11.720 -6.254 1.00 0.00 H new ATOM 0 HA ARG A1019 -0.869 11.885 -3.586 1.00 0.00 H new ATOM 0 HB2 ARG A1019 -2.662 13.010 -4.596 1.00 0.00 H new ATOM 0 HB3 ARG A1019 -2.590 12.028 -6.046 1.00 0.00 H new ATOM 0 HG2 ARG A1019 -3.537 10.136 -4.922 1.00 0.00 H new ATOM 0 HG3 ARG A1019 -3.352 10.889 -3.350 1.00 0.00 H new ATOM 0 HD2 ARG A1019 -4.877 12.424 -5.400 1.00 0.00 H new ATOM 0 HD3 ARG A1019 -5.642 10.977 -4.773 1.00 0.00 H new ATOM 0 HE ARG A1019 -4.547 12.920 -2.794 1.00 0.00 H new ATOM 0 HH11 ARG A1019 -7.424 11.851 -4.577 1.00 0.00 H new ATOM 0 HH12 ARG A1019 -8.537 12.327 -3.290 1.00 0.00 H new ATOM 0 HH21 ARG A1019 -6.022 13.410 -1.094 1.00 0.00 H new ATOM 0 HH22 ARG A1019 -7.757 13.195 -1.349 1.00 0.00 H new ATOM 1555 N ARG A1020 -1.022 9.373 -3.669 1.00 0.00 N ATOM 1556 CA ARG A1020 -0.774 7.925 -3.726 1.00 0.00 C ATOM 1557 C ARG A1020 -1.649 7.200 -2.751 1.00 0.00 C ATOM 1558 O ARG A1020 -2.066 7.765 -1.783 1.00 0.00 O ATOM 1559 CB ARG A1020 0.694 7.646 -3.428 1.00 0.00 C ATOM 1560 CG ARG A1020 1.100 7.903 -1.990 1.00 0.00 C ATOM 1561 CD ARG A1020 2.603 7.943 -1.813 1.00 0.00 C ATOM 1562 NE ARG A1020 3.272 6.718 -2.241 1.00 0.00 N ATOM 1563 CZ ARG A1020 4.196 6.092 -1.512 1.00 0.00 C ATOM 1564 NH1 ARG A1020 4.410 6.459 -0.244 1.00 0.00 N ATOM 1565 NH2 ARG A1020 4.864 5.072 -2.030 1.00 0.00 N ATOM 0 H ARG A1020 -1.336 9.728 -2.766 1.00 0.00 H new ATOM 0 HA ARG A1020 -1.012 7.566 -4.727 1.00 0.00 H new ATOM 0 HB2 ARG A1020 0.911 6.607 -3.674 1.00 0.00 H new ATOM 0 HB3 ARG A1020 1.309 8.264 -4.083 1.00 0.00 H new ATOM 0 HG2 ARG A1020 0.673 8.849 -1.658 1.00 0.00 H new ATOM 0 HG3 ARG A1020 0.682 7.124 -1.353 1.00 0.00 H new ATOM 0 HD2 ARG A1020 3.005 8.784 -2.378 1.00 0.00 H new ATOM 0 HD3 ARG A1020 2.833 8.125 -0.763 1.00 0.00 H new ATOM 0 HE ARG A1020 3.019 6.320 -3.146 1.00 0.00 H new ATOM 0 HH11 ARG A1020 3.866 7.218 0.166 1.00 0.00 H new ATOM 0 HH12 ARG A1020 5.117 5.980 0.313 1.00 0.00 H new ATOM 0 HH21 ARG A1020 4.671 4.768 -2.984 1.00 0.00 H new ATOM 0 HH22 ARG A1020 5.572 4.591 -1.475 1.00 0.00 H new ATOM 1579 N ARG A1021 -1.927 5.954 -3.010 1.00 0.00 N ATOM 1580 CA ARG A1021 -2.827 5.226 -2.138 1.00 0.00 C ATOM 1581 C ARG A1021 -2.296 3.853 -1.822 1.00 0.00 C ATOM 1582 O ARG A1021 -1.622 3.250 -2.644 1.00 0.00 O ATOM 1583 CB ARG A1021 -4.195 5.120 -2.782 1.00 0.00 C ATOM 1584 CG ARG A1021 -4.182 4.442 -4.137 1.00 0.00 C ATOM 1585 CD ARG A1021 -5.573 4.300 -4.683 1.00 0.00 C ATOM 1586 NE ARG A1021 -5.532 4.020 -6.106 1.00 0.00 N ATOM 1587 CZ ARG A1021 -6.511 3.405 -6.786 1.00 0.00 C ATOM 1588 NH1 ARG A1021 -7.507 2.806 -6.133 1.00 0.00 N ATOM 1589 NH2 ARG A1021 -6.481 3.384 -8.112 1.00 0.00 N ATOM 0 H ARG A1021 -1.557 5.423 -3.798 1.00 0.00 H new ATOM 0 HA ARG A1021 -2.909 5.776 -1.201 1.00 0.00 H new ATOM 0 HB2 ARG A1021 -4.858 4.568 -2.116 1.00 0.00 H new ATOM 0 HB3 ARG A1021 -4.614 6.121 -2.891 1.00 0.00 H new ATOM 0 HG2 ARG A1021 -3.573 5.021 -4.831 1.00 0.00 H new ATOM 0 HG3 ARG A1021 -3.720 3.459 -4.051 1.00 0.00 H new ATOM 0 HD2 ARG A1021 -6.094 3.496 -4.163 1.00 0.00 H new ATOM 0 HD3 ARG A1021 -6.137 5.215 -4.502 1.00 0.00 H new ATOM 0 HE ARG A1021 -4.703 4.310 -6.624 1.00 0.00 H new ATOM 0 HH11 ARG A1021 -7.526 2.815 -5.113 1.00 0.00 H new ATOM 0 HH12 ARG A1021 -8.250 2.339 -6.653 1.00 0.00 H new ATOM 0 HH21 ARG A1021 -5.715 3.835 -8.612 1.00 0.00 H new ATOM 0 HH22 ARG A1021 -7.224 2.917 -8.632 1.00 0.00 H new ATOM 1603 N ARG A1022 -2.617 3.354 -0.649 1.00 0.00 N ATOM 1604 CA ARG A1022 -2.188 2.049 -0.252 1.00 0.00 C ATOM 1605 C ARG A1022 -3.186 0.998 -0.710 1.00 0.00 C ATOM 1606 O ARG A1022 -4.388 1.139 -0.483 1.00 0.00 O ATOM 1607 CB ARG A1022 -2.073 1.977 1.261 1.00 0.00 C ATOM 1608 CG ARG A1022 -1.852 0.568 1.762 1.00 0.00 C ATOM 1609 CD ARG A1022 -1.997 0.490 3.256 1.00 0.00 C ATOM 1610 NE ARG A1022 -0.923 1.153 3.942 1.00 0.00 N ATOM 1611 CZ ARG A1022 -0.884 1.302 5.269 1.00 0.00 C ATOM 1612 NH1 ARG A1022 -1.981 1.118 5.999 1.00 0.00 N ATOM 1613 NH2 ARG A1022 0.241 1.656 5.867 1.00 0.00 N ATOM 0 H ARG A1022 -3.179 3.845 0.046 1.00 0.00 H new ATOM 0 HA ARG A1022 -1.218 1.858 -0.711 1.00 0.00 H new ATOM 0 HB2 ARG A1022 -1.248 2.609 1.589 1.00 0.00 H new ATOM 0 HB3 ARG A1022 -2.981 2.380 1.710 1.00 0.00 H new ATOM 0 HG2 ARG A1022 -2.568 -0.105 1.290 1.00 0.00 H new ATOM 0 HG3 ARG A1022 -0.857 0.229 1.473 1.00 0.00 H new ATOM 0 HD2 ARG A1022 -2.946 0.939 3.551 1.00 0.00 H new ATOM 0 HD3 ARG A1022 -2.030 -0.556 3.562 1.00 0.00 H new ATOM 0 HE ARG A1022 -0.153 1.528 3.389 1.00 0.00 H new ATOM 0 HH11 ARG A1022 -2.858 0.862 5.546 1.00 0.00 H new ATOM 0 HH12 ARG A1022 -1.945 1.233 7.012 1.00 0.00 H new ATOM 0 HH21 ARG A1022 1.083 1.816 5.315 1.00 0.00 H new ATOM 0 HH22 ARG A1022 0.266 1.769 6.880 1.00 0.00 H new ATOM 1627 N LEU A1023 -2.686 -0.028 -1.360 1.00 0.00 N ATOM 1628 CA LEU A1023 -3.467 -1.203 -1.612 1.00 0.00 C ATOM 1629 C LEU A1023 -2.965 -2.235 -0.624 1.00 0.00 C ATOM 1630 O LEU A1023 -1.755 -2.424 -0.468 1.00 0.00 O ATOM 1631 CB LEU A1023 -3.331 -1.711 -3.049 1.00 0.00 C ATOM 1632 CG LEU A1023 -3.686 -0.709 -4.153 1.00 0.00 C ATOM 1633 CD1 LEU A1023 -3.610 -1.376 -5.512 1.00 0.00 C ATOM 1634 CD2 LEU A1023 -5.071 -0.119 -3.937 1.00 0.00 C ATOM 0 H LEU A1023 -1.734 -0.066 -1.724 1.00 0.00 H new ATOM 0 HA LEU A1023 -4.529 -0.990 -1.490 1.00 0.00 H new ATOM 0 HB2 LEU A1023 -2.303 -2.040 -3.201 1.00 0.00 H new ATOM 0 HB3 LEU A1023 -3.967 -2.589 -3.165 1.00 0.00 H new ATOM 0 HG LEU A1023 -2.961 0.104 -4.114 1.00 0.00 H new ATOM 0 HD11 LEU A1023 -3.865 -0.653 -6.287 1.00 0.00 H new ATOM 0 HD12 LEU A1023 -2.599 -1.746 -5.679 1.00 0.00 H new ATOM 0 HD13 LEU A1023 -4.312 -2.209 -5.548 1.00 0.00 H new ATOM 0 HD21 LEU A1023 -5.294 0.588 -4.736 1.00 0.00 H new ATOM 0 HD22 LEU A1023 -5.812 -0.918 -3.942 1.00 0.00 H new ATOM 0 HD23 LEU A1023 -5.101 0.397 -2.977 1.00 0.00 H new ATOM 1646 N VAL A1024 -3.882 -2.828 0.078 1.00 0.00 N ATOM 1647 CA VAL A1024 -3.567 -3.758 1.145 1.00 0.00 C ATOM 1648 C VAL A1024 -3.861 -5.171 0.757 1.00 0.00 C ATOM 1649 O VAL A1024 -4.833 -5.452 0.049 1.00 0.00 O ATOM 1650 CB VAL A1024 -4.319 -3.481 2.476 1.00 0.00 C ATOM 1651 CG1 VAL A1024 -3.753 -2.280 3.187 1.00 0.00 C ATOM 1652 CG2 VAL A1024 -5.815 -3.292 2.257 1.00 0.00 C ATOM 0 H VAL A1024 -4.882 -2.686 -0.067 1.00 0.00 H new ATOM 0 HA VAL A1024 -2.500 -3.609 1.310 1.00 0.00 H new ATOM 0 HB VAL A1024 -4.174 -4.362 3.102 1.00 0.00 H new ATOM 0 HG11 VAL A1024 -4.302 -2.114 4.114 1.00 0.00 H new ATOM 0 HG12 VAL A1024 -2.701 -2.454 3.414 1.00 0.00 H new ATOM 0 HG13 VAL A1024 -3.846 -1.402 2.548 1.00 0.00 H new ATOM 0 HG21 VAL A1024 -6.301 -3.101 3.214 1.00 0.00 H new ATOM 0 HG22 VAL A1024 -5.981 -2.446 1.590 1.00 0.00 H new ATOM 0 HG23 VAL A1024 -6.234 -4.194 1.811 1.00 0.00 H new ATOM 1662 N ARG A1025 -2.990 -6.040 1.188 1.00 0.00 N ATOM 1663 CA ARG A1025 -3.240 -7.466 1.060 1.00 0.00 C ATOM 1664 C ARG A1025 -2.830 -8.160 2.343 1.00 0.00 C ATOM 1665 O ARG A1025 -1.646 -8.293 2.612 1.00 0.00 O ATOM 1666 CB ARG A1025 -2.449 -8.076 -0.082 1.00 0.00 C ATOM 1667 CG ARG A1025 -3.007 -9.402 -0.562 1.00 0.00 C ATOM 1668 CD ARG A1025 -4.251 -9.183 -1.396 1.00 0.00 C ATOM 1669 NE ARG A1025 -4.829 -10.422 -1.934 1.00 0.00 N ATOM 1670 CZ ARG A1025 -4.316 -11.133 -2.952 1.00 0.00 C ATOM 1671 NH1 ARG A1025 -3.072 -10.937 -3.359 1.00 0.00 N ATOM 1672 NH2 ARG A1025 -5.041 -12.061 -3.553 1.00 0.00 N ATOM 0 H ARG A1025 -2.103 -5.798 1.630 1.00 0.00 H new ATOM 0 HA ARG A1025 -4.303 -7.600 0.859 1.00 0.00 H new ATOM 0 HB2 ARG A1025 -2.431 -7.375 -0.916 1.00 0.00 H new ATOM 0 HB3 ARG A1025 -1.417 -8.219 0.237 1.00 0.00 H new ATOM 0 HG2 ARG A1025 -2.255 -9.928 -1.151 1.00 0.00 H new ATOM 0 HG3 ARG A1025 -3.242 -10.035 0.293 1.00 0.00 H new ATOM 0 HD2 ARG A1025 -5.001 -8.677 -0.788 1.00 0.00 H new ATOM 0 HD3 ARG A1025 -4.010 -8.516 -2.224 1.00 0.00 H new ATOM 0 HE ARG A1025 -5.685 -10.769 -1.502 1.00 0.00 H new ATOM 0 HH11 ARG A1025 -2.489 -10.238 -2.898 1.00 0.00 H new ATOM 0 HH12 ARG A1025 -2.696 -11.485 -4.133 1.00 0.00 H new ATOM 0 HH21 ARG A1025 -5.996 -12.241 -3.244 1.00 0.00 H new ATOM 0 HH22 ARG A1025 -4.645 -12.597 -4.325 1.00 0.00 H new ATOM 1686 N LYS A1026 -3.782 -8.581 3.145 1.00 0.00 N ATOM 1687 CA LYS A1026 -3.448 -9.260 4.385 1.00 0.00 C ATOM 1688 C LYS A1026 -2.931 -10.662 4.030 1.00 0.00 C ATOM 1689 O LYS A1026 -3.524 -11.361 3.204 1.00 0.00 O ATOM 1690 CB LYS A1026 -4.688 -9.295 5.293 1.00 0.00 C ATOM 1691 CG LYS A1026 -4.411 -9.418 6.790 1.00 0.00 C ATOM 1692 CD LYS A1026 -3.942 -10.794 7.214 1.00 0.00 C ATOM 1693 CE LYS A1026 -5.019 -11.846 6.997 1.00 0.00 C ATOM 1694 NZ LYS A1026 -6.291 -11.521 7.694 1.00 0.00 N ATOM 0 H LYS A1026 -4.780 -8.470 2.969 1.00 0.00 H new ATOM 0 HA LYS A1026 -2.667 -8.737 4.937 1.00 0.00 H new ATOM 0 HB2 LYS A1026 -5.266 -8.386 5.123 1.00 0.00 H new ATOM 0 HB3 LYS A1026 -5.315 -10.133 4.988 1.00 0.00 H new ATOM 0 HG2 LYS A1026 -3.656 -8.684 7.072 1.00 0.00 H new ATOM 0 HG3 LYS A1026 -5.319 -9.168 7.340 1.00 0.00 H new ATOM 0 HD2 LYS A1026 -3.050 -11.065 6.649 1.00 0.00 H new ATOM 0 HD3 LYS A1026 -3.659 -10.774 8.267 1.00 0.00 H new ATOM 0 HE2 LYS A1026 -5.211 -11.948 5.929 1.00 0.00 H new ATOM 0 HE3 LYS A1026 -4.654 -12.811 7.348 1.00 0.00 H new ATOM 0 HZ1 LYS A1026 -6.901 -12.363 7.714 1.00 0.00 H new ATOM 0 HZ2 LYS A1026 -6.086 -11.219 8.668 1.00 0.00 H new ATOM 0 HZ3 LYS A1026 -6.778 -10.753 7.188 1.00 0.00 H new ATOM 1708 N ARG A1027 -1.855 -11.096 4.657 1.00 0.00 N ATOM 1709 CA ARG A1027 -1.218 -12.334 4.256 1.00 0.00 C ATOM 1710 C ARG A1027 -0.980 -13.151 5.483 1.00 0.00 C ATOM 1711 O ARG A1027 -0.522 -12.648 6.476 1.00 0.00 O ATOM 1712 CB ARG A1027 0.087 -12.090 3.472 1.00 0.00 C ATOM 1713 CG ARG A1027 1.137 -11.261 4.192 1.00 0.00 C ATOM 1714 CD ARG A1027 2.270 -10.840 3.268 1.00 0.00 C ATOM 1715 NE ARG A1027 3.110 -11.932 2.804 1.00 0.00 N ATOM 1716 CZ ARG A1027 4.375 -11.732 2.409 1.00 0.00 C ATOM 1717 NH1 ARG A1027 4.828 -10.489 2.198 1.00 0.00 N ATOM 1718 NH2 ARG A1027 5.184 -12.759 2.200 1.00 0.00 N ATOM 0 H ARG A1027 -1.408 -10.616 5.438 1.00 0.00 H new ATOM 0 HA ARG A1027 -1.874 -12.873 3.573 1.00 0.00 H new ATOM 0 HB2 ARG A1027 0.523 -13.056 3.217 1.00 0.00 H new ATOM 0 HB3 ARG A1027 -0.161 -11.595 2.533 1.00 0.00 H new ATOM 0 HG2 ARG A1027 0.668 -10.373 4.617 1.00 0.00 H new ATOM 0 HG3 ARG A1027 1.544 -11.836 5.024 1.00 0.00 H new ATOM 0 HD2 ARG A1027 1.845 -10.332 2.402 1.00 0.00 H new ATOM 0 HD3 ARG A1027 2.895 -10.114 3.788 1.00 0.00 H new ATOM 0 HE ARG A1027 2.726 -12.877 2.778 1.00 0.00 H new ATOM 0 HH11 ARG A1027 4.209 -9.690 2.338 1.00 0.00 H new ATOM 0 HH12 ARG A1027 5.791 -10.341 1.897 1.00 0.00 H new ATOM 0 HH21 ARG A1027 4.846 -13.711 2.339 1.00 0.00 H new ATOM 0 HH22 ARG A1027 6.145 -12.598 1.899 1.00 0.00 H new ATOM 1732 N LYS A1028 -1.298 -14.394 5.406 1.00 0.00 N ATOM 1733 CA LYS A1028 -1.267 -15.271 6.531 1.00 0.00 C ATOM 1734 C LYS A1028 -0.397 -16.465 6.208 1.00 0.00 C ATOM 1735 O LYS A1028 -0.462 -16.975 5.132 1.00 0.00 O ATOM 1736 CB LYS A1028 -2.706 -15.669 6.839 1.00 0.00 C ATOM 1737 CG LYS A1028 -2.846 -16.859 7.749 1.00 0.00 C ATOM 1738 CD LYS A1028 -4.285 -17.138 8.065 1.00 0.00 C ATOM 1739 CE LYS A1028 -4.881 -16.134 9.030 1.00 0.00 C ATOM 1740 NZ LYS A1028 -6.252 -16.529 9.417 1.00 0.00 N ATOM 0 H LYS A1028 -1.595 -14.844 4.540 1.00 0.00 H new ATOM 0 HA LYS A1028 -0.838 -14.792 7.411 1.00 0.00 H new ATOM 0 HB2 LYS A1028 -3.215 -14.819 7.293 1.00 0.00 H new ATOM 0 HB3 LYS A1028 -3.219 -15.883 5.901 1.00 0.00 H new ATOM 0 HG2 LYS A1028 -2.399 -17.734 7.278 1.00 0.00 H new ATOM 0 HG3 LYS A1028 -2.297 -16.679 8.673 1.00 0.00 H new ATOM 0 HD2 LYS A1028 -4.862 -17.133 7.141 1.00 0.00 H new ATOM 0 HD3 LYS A1028 -4.371 -18.138 8.490 1.00 0.00 H new ATOM 0 HE2 LYS A1028 -4.254 -16.060 9.919 1.00 0.00 H new ATOM 0 HE3 LYS A1028 -4.898 -15.146 8.570 1.00 0.00 H new ATOM 0 HZ1 LYS A1028 -6.565 -15.951 10.223 1.00 0.00 H new ATOM 0 HZ2 LYS A1028 -6.896 -16.381 8.614 1.00 0.00 H new ATOM 0 HZ3 LYS A1028 -6.261 -17.533 9.687 1.00 0.00 H new ATOM 1754 N LYS A1029 0.420 -16.887 7.142 1.00 0.00 N ATOM 1755 CA LYS A1029 1.314 -18.041 6.951 1.00 0.00 C ATOM 1756 C LYS A1029 0.562 -19.265 7.423 1.00 0.00 C ATOM 1757 O LYS A1029 0.925 -20.410 7.218 1.00 0.00 O ATOM 1758 CB LYS A1029 2.552 -17.883 7.842 1.00 0.00 C ATOM 1759 CG LYS A1029 3.583 -18.990 7.694 1.00 0.00 C ATOM 1760 CD LYS A1029 4.724 -18.845 8.686 1.00 0.00 C ATOM 1761 CE LYS A1029 5.331 -17.465 8.610 1.00 0.00 C ATOM 1762 NZ LYS A1029 6.484 -17.301 9.529 1.00 0.00 N ATOM 0 H LYS A1029 0.496 -16.452 8.061 1.00 0.00 H new ATOM 0 HA LYS A1029 1.617 -18.120 5.907 1.00 0.00 H new ATOM 0 HB2 LYS A1029 3.027 -16.929 7.615 1.00 0.00 H new ATOM 0 HB3 LYS A1029 2.231 -17.840 8.883 1.00 0.00 H new ATOM 0 HG2 LYS A1029 3.100 -19.956 7.837 1.00 0.00 H new ATOM 0 HG3 LYS A1029 3.982 -18.980 6.680 1.00 0.00 H new ATOM 0 HD2 LYS A1029 4.359 -19.031 9.696 1.00 0.00 H new ATOM 0 HD3 LYS A1029 5.488 -19.595 8.480 1.00 0.00 H new ATOM 0 HE2 LYS A1029 5.655 -17.270 7.588 1.00 0.00 H new ATOM 0 HE3 LYS A1029 4.570 -16.723 8.851 1.00 0.00 H new ATOM 0 HZ1 LYS A1029 6.865 -16.338 9.439 1.00 0.00 H new ATOM 0 HZ2 LYS A1029 6.173 -17.460 10.508 1.00 0.00 H new ATOM 0 HZ3 LYS A1029 7.224 -17.990 9.284 1.00 0.00 H new ATOM 1776 N ASP A1030 -0.451 -18.938 8.181 1.00 0.00 N ATOM 1777 CA ASP A1030 -1.289 -19.862 8.954 1.00 0.00 C ATOM 1778 C ASP A1030 -0.464 -20.636 10.002 1.00 0.00 C ATOM 1779 O ASP A1030 -0.992 -21.391 10.801 1.00 0.00 O ATOM 1780 CB ASP A1030 -2.086 -20.796 8.037 1.00 0.00 C ATOM 1781 CG ASP A1030 -3.212 -21.494 8.763 1.00 0.00 C ATOM 1782 OD1 ASP A1030 -4.210 -20.829 9.093 1.00 0.00 O ATOM 1783 OD2 ASP A1030 -3.136 -22.709 8.991 1.00 0.00 O ATOM 0 H ASP A1030 -0.743 -17.967 8.293 1.00 0.00 H new ATOM 0 HA ASP A1030 -2.015 -19.265 9.506 1.00 0.00 H new ATOM 0 HB2 ASP A1030 -2.494 -20.222 7.205 1.00 0.00 H new ATOM 0 HB3 ASP A1030 -1.415 -21.542 7.611 1.00 0.00 H new ATOM 1788 N LEU A1031 0.833 -20.336 10.007 1.00 0.00 N ATOM 1789 CA LEU A1031 1.866 -20.896 10.886 1.00 0.00 C ATOM 1790 C LEU A1031 2.219 -22.346 10.530 1.00 0.00 C ATOM 1791 O LEU A1031 3.137 -22.929 11.109 1.00 0.00 O ATOM 1792 CB LEU A1031 1.456 -20.801 12.352 1.00 0.00 C ATOM 1793 CG LEU A1031 2.540 -21.135 13.374 1.00 0.00 C ATOM 1794 CD1 LEU A1031 3.679 -20.136 13.299 1.00 0.00 C ATOM 1795 CD2 LEU A1031 1.963 -21.182 14.772 1.00 0.00 C ATOM 0 H LEU A1031 1.219 -19.652 9.357 1.00 0.00 H new ATOM 0 HA LEU A1031 2.760 -20.293 10.729 1.00 0.00 H new ATOM 0 HB2 LEU A1031 1.103 -19.788 12.545 1.00 0.00 H new ATOM 0 HB3 LEU A1031 0.611 -21.470 12.516 1.00 0.00 H new ATOM 0 HG LEU A1031 2.937 -22.122 13.135 1.00 0.00 H new ATOM 0 HD11 LEU A1031 4.439 -20.395 14.036 1.00 0.00 H new ATOM 0 HD12 LEU A1031 4.118 -20.159 12.302 1.00 0.00 H new ATOM 0 HD13 LEU A1031 3.299 -19.135 13.505 1.00 0.00 H new ATOM 0 HD21 LEU A1031 2.753 -21.422 15.484 1.00 0.00 H new ATOM 0 HD22 LEU A1031 1.532 -20.212 15.021 1.00 0.00 H new ATOM 0 HD23 LEU A1031 1.187 -21.946 14.820 1.00 0.00 H new ATOM 1807 N THR A1032 1.548 -22.926 9.554 1.00 0.00 N ATOM 1808 CA THR A1032 1.818 -24.300 9.222 1.00 0.00 C ATOM 1809 C THR A1032 2.283 -24.350 7.788 1.00 0.00 C ATOM 1810 O THR A1032 2.667 -25.392 7.259 1.00 0.00 O ATOM 1811 CB THR A1032 0.577 -25.208 9.450 1.00 0.00 C ATOM 1812 OG1 THR A1032 0.879 -26.578 9.146 1.00 0.00 O ATOM 1813 CG2 THR A1032 -0.603 -24.751 8.606 1.00 0.00 C ATOM 0 H THR A1032 0.828 -22.474 8.991 1.00 0.00 H new ATOM 0 HA THR A1032 2.596 -24.687 9.880 1.00 0.00 H new ATOM 0 HB THR A1032 0.308 -25.127 10.503 1.00 0.00 H new ATOM 0 HG1 THR A1032 1.518 -26.615 8.404 1.00 0.00 H new ATOM 0 HG21 THR A1032 -1.455 -25.406 8.787 1.00 0.00 H new ATOM 0 HG22 THR A1032 -0.868 -23.728 8.874 1.00 0.00 H new ATOM 0 HG23 THR A1032 -0.333 -24.791 7.551 1.00 0.00 H new ATOM 1821 N GLN A1033 2.301 -23.189 7.176 1.00 0.00 N ATOM 1822 CA GLN A1033 2.696 -23.106 5.803 1.00 0.00 C ATOM 1823 C GLN A1033 4.156 -22.761 5.749 1.00 0.00 C ATOM 1824 O GLN A1033 4.628 -21.883 6.474 1.00 0.00 O ATOM 1825 CB GLN A1033 1.903 -22.064 5.049 1.00 0.00 C ATOM 1826 CG GLN A1033 1.943 -22.306 3.578 1.00 0.00 C ATOM 1827 CD GLN A1033 1.100 -21.341 2.784 1.00 0.00 C ATOM 1828 OE1 GLN A1033 1.576 -20.298 2.361 1.00 0.00 O ATOM 1829 NE2 GLN A1033 -0.153 -21.688 2.566 1.00 0.00 N ATOM 0 H GLN A1033 2.048 -22.300 7.608 1.00 0.00 H new ATOM 0 HA GLN A1033 2.504 -24.068 5.329 1.00 0.00 H new ATOM 0 HB2 GLN A1033 0.869 -22.074 5.392 1.00 0.00 H new ATOM 0 HB3 GLN A1033 2.302 -21.073 5.267 1.00 0.00 H new ATOM 0 HG2 GLN A1033 2.976 -22.240 3.235 1.00 0.00 H new ATOM 0 HG3 GLN A1033 1.604 -23.322 3.376 1.00 0.00 H new ATOM 0 HE21 GLN A1033 -0.510 -22.568 2.937 1.00 0.00 H new ATOM 0 HE22 GLN A1033 -0.765 -21.076 2.026 1.00 0.00 H new ATOM 1838 N THR A1034 4.886 -23.504 4.966 1.00 0.00 N ATOM 1839 CA THR A1034 6.297 -23.255 4.793 1.00 0.00 C ATOM 1840 C THR A1034 6.733 -23.765 3.427 1.00 0.00 C ATOM 1841 O THR A1034 7.685 -23.259 2.827 1.00 0.00 O ATOM 1842 CB THR A1034 7.134 -23.932 5.901 1.00 0.00 C ATOM 1843 OG1 THR A1034 6.540 -23.672 7.187 1.00 0.00 O ATOM 1844 CG2 THR A1034 8.545 -23.375 5.897 1.00 0.00 C ATOM 0 H THR A1034 4.527 -24.295 4.431 1.00 0.00 H new ATOM 0 HA THR A1034 6.467 -22.180 4.862 1.00 0.00 H new ATOM 0 HB THR A1034 7.160 -25.005 5.713 1.00 0.00 H new ATOM 0 HG1 THR A1034 7.073 -24.104 7.887 1.00 0.00 H new ATOM 0 HG21 THR A1034 9.129 -23.857 6.681 1.00 0.00 H new ATOM 0 HG22 THR A1034 9.009 -23.566 4.929 1.00 0.00 H new ATOM 0 HG23 THR A1034 8.513 -22.301 6.078 1.00 0.00 H new ATOM 1852 N ALA A1035 6.013 -24.749 2.909 1.00 0.00 N ATOM 1853 CA ALA A1035 6.350 -25.297 1.625 1.00 0.00 C ATOM 1854 C ALA A1035 5.111 -25.621 0.808 1.00 0.00 C ATOM 1855 O ALA A1035 4.653 -26.761 0.777 1.00 0.00 O ATOM 1856 CB ALA A1035 7.243 -26.523 1.765 1.00 0.00 C ATOM 0 H ALA A1035 5.203 -25.173 3.360 1.00 0.00 H new ATOM 0 HA ALA A1035 6.908 -24.531 1.086 1.00 0.00 H new ATOM 0 HB1 ALA A1035 7.481 -26.915 0.776 1.00 0.00 H new ATOM 0 HB2 ALA A1035 8.165 -26.245 2.276 1.00 0.00 H new ATOM 0 HB3 ALA A1035 6.724 -27.287 2.343 1.00 0.00 H new ATOM 1862 N SER A1036 4.499 -24.587 0.248 1.00 0.00 N ATOM 1863 CA SER A1036 3.475 -24.786 -0.764 1.00 0.00 C ATOM 1864 C SER A1036 4.201 -25.225 -2.029 1.00 0.00 C ATOM 1865 O SER A1036 3.668 -25.904 -2.897 1.00 0.00 O ATOM 1866 CB SER A1036 2.710 -23.486 -1.009 1.00 0.00 C ATOM 1867 OG SER A1036 2.195 -22.974 0.208 1.00 0.00 O ATOM 0 H SER A1036 4.692 -23.612 0.475 1.00 0.00 H new ATOM 0 HA SER A1036 2.747 -25.534 -0.449 1.00 0.00 H new ATOM 0 HB2 SER A1036 3.370 -22.750 -1.469 1.00 0.00 H new ATOM 0 HB3 SER A1036 1.894 -23.664 -1.709 1.00 0.00 H new ATOM 0 HG SER A1036 2.929 -22.616 0.749 1.00 0.00 H new ATOM 1873 N SER A1037 5.449 -24.805 -2.094 1.00 0.00 N ATOM 1874 CA SER A1037 6.364 -25.188 -3.129 1.00 0.00 C ATOM 1875 C SER A1037 7.593 -25.733 -2.406 1.00 0.00 C ATOM 1876 O SER A1037 8.345 -24.970 -1.796 1.00 0.00 O ATOM 1877 CB SER A1037 6.716 -23.955 -3.962 1.00 0.00 C ATOM 1878 OG SER A1037 5.550 -23.178 -4.221 1.00 0.00 O ATOM 0 H SER A1037 5.857 -24.172 -1.406 1.00 0.00 H new ATOM 0 HA SER A1037 5.950 -25.934 -3.807 1.00 0.00 H new ATOM 0 HB2 SER A1037 7.453 -23.350 -3.434 1.00 0.00 H new ATOM 0 HB3 SER A1037 7.172 -24.263 -4.903 1.00 0.00 H new ATOM 0 HG SER A1037 5.792 -22.392 -4.753 1.00 0.00 H new ATOM 1884 N THR A1038 7.732 -27.043 -2.383 1.00 0.00 N ATOM 1885 CA THR A1038 8.810 -27.681 -1.653 1.00 0.00 C ATOM 1886 C THR A1038 10.117 -27.550 -2.428 1.00 0.00 C ATOM 1887 O THR A1038 11.135 -27.113 -1.888 1.00 0.00 O ATOM 1888 CB THR A1038 8.476 -29.167 -1.392 1.00 0.00 C ATOM 1889 OG1 THR A1038 7.179 -29.263 -0.775 1.00 0.00 O ATOM 1890 CG2 THR A1038 9.515 -29.813 -0.484 1.00 0.00 C ATOM 0 H THR A1038 7.108 -27.690 -2.864 1.00 0.00 H new ATOM 0 HA THR A1038 8.927 -27.183 -0.690 1.00 0.00 H new ATOM 0 HB THR A1038 8.479 -29.693 -2.347 1.00 0.00 H new ATOM 0 HG1 THR A1038 6.964 -30.205 -0.610 1.00 0.00 H new ATOM 0 HG21 THR A1038 9.254 -30.858 -0.318 1.00 0.00 H new ATOM 0 HG22 THR A1038 10.496 -29.755 -0.955 1.00 0.00 H new ATOM 0 HG23 THR A1038 9.539 -29.289 0.471 1.00 0.00 H new ATOM 1898 N ALA A1039 10.065 -27.901 -3.698 1.00 0.00 N ATOM 1899 CA ALA A1039 11.201 -27.807 -4.588 1.00 0.00 C ATOM 1900 C ALA A1039 10.673 -27.811 -6.006 1.00 0.00 C ATOM 1901 O ALA A1039 9.454 -27.806 -6.205 1.00 0.00 O ATOM 1902 CB ALA A1039 12.160 -28.973 -4.367 1.00 0.00 C ATOM 0 H ALA A1039 9.222 -28.263 -4.144 1.00 0.00 H new ATOM 0 HA ALA A1039 11.758 -26.891 -4.393 1.00 0.00 H new ATOM 0 HB1 ALA A1039 13.007 -28.882 -5.047 1.00 0.00 H new ATOM 0 HB2 ALA A1039 12.518 -28.959 -3.338 1.00 0.00 H new ATOM 0 HB3 ALA A1039 11.641 -29.912 -4.558 1.00 0.00 H new ATOM 1908 N ARG A1040 11.553 -27.780 -6.979 1.00 0.00 N ATOM 1909 CA ARG A1040 11.154 -27.840 -8.366 1.00 0.00 C ATOM 1910 C ARG A1040 11.908 -28.963 -9.053 1.00 0.00 C ATOM 1911 O ARG A1040 13.081 -28.779 -9.419 1.00 0.00 O ATOM 1912 CB ARG A1040 11.375 -26.491 -9.062 1.00 0.00 C ATOM 1913 CG ARG A1040 10.511 -25.392 -8.470 1.00 0.00 C ATOM 1914 CD ARG A1040 10.712 -24.053 -9.147 1.00 0.00 C ATOM 1915 NE ARG A1040 9.830 -23.042 -8.558 1.00 0.00 N ATOM 1916 CZ ARG A1040 10.010 -21.721 -8.630 1.00 0.00 C ATOM 1917 NH1 ARG A1040 11.070 -21.226 -9.265 1.00 0.00 N ATOM 1918 NH2 ARG A1040 9.142 -20.896 -8.045 1.00 0.00 N ATOM 1919 OXT ARG A1040 11.335 -30.056 -9.197 1.00 0.00 O ATOM 0 H ARG A1040 12.560 -27.713 -6.833 1.00 0.00 H new ATOM 0 HA ARG A1040 10.086 -28.050 -8.428 1.00 0.00 H new ATOM 0 HB2 ARG A1040 12.425 -26.209 -8.980 1.00 0.00 H new ATOM 0 HB3 ARG A1040 11.154 -26.592 -10.125 1.00 0.00 H new ATOM 0 HG2 ARG A1040 9.463 -25.679 -8.549 1.00 0.00 H new ATOM 0 HG3 ARG A1040 10.735 -25.293 -7.408 1.00 0.00 H new ATOM 0 HD2 ARG A1040 11.751 -23.740 -9.046 1.00 0.00 H new ATOM 0 HD3 ARG A1040 10.509 -24.144 -10.214 1.00 0.00 H new ATOM 0 HE ARG A1040 9.010 -23.375 -8.051 1.00 0.00 H new ATOM 0 HH11 ARG A1040 11.746 -21.856 -9.697 1.00 0.00 H new ATOM 0 HH12 ARG A1040 11.206 -20.217 -9.319 1.00 0.00 H new ATOM 0 HH21 ARG A1040 8.339 -21.274 -7.542 1.00 0.00 H new ATOM 0 HH22 ARG A1040 9.280 -19.887 -8.101 1.00 0.00 H new TER 1933 ARG A1040