USER MOD reduce.3.24.130724 H: found=0, std=0, add=956, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 957 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 971 ASN :FLIP amide:sc= -0.0194 F(o=-2.3,f=-1.4) USER MOD Set 1.2: A 994 HIS : no HD1:sc= -1.38 K(o=-1.4,f=-2.4!) USER MOD Set 2.1: A 975 HIS : no HD1:sc= -2.5 X(o=-2.7,f=-2.7!) USER MOD Set 2.2: A 987 THR OG1 : rot 180:sc= -0.235 USER MOD Single : A 901 HIS : no HD1:sc= -0.71 K(o=-0.71,f=-3.1!) USER MOD Single : A 903 GLN :FLIP amide:sc= -0.115 F(o=-2.3!,f=-0.12) USER MOD Single : A 907 HIS :FLIP no HD1:sc= -0.354 F(o=-1.2,f=-0.35) USER MOD Single : A 912 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 914 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 915 THR OG1 : rot -170:sc= 0.453 USER MOD Single : A 916 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 917 THR OG1 : rot 180:sc= 0 USER MOD Single : A 918 THR OG1 : rot 48:sc= 0.668 USER MOD Single : A 920 SER OG : rot 180:sc= -0.0375 USER MOD Single : A 926 THR OG1 : rot -136:sc= -2.41! USER MOD Single : A 927 SER OG : rot 35:sc= 0.376 USER MOD Single : A 929 LYS NZ :NH3+ -168:sc= -0.0205 (180deg=-0.182) USER MOD Single : A 930 TYR OH : rot 180:sc= -1.62! USER MOD Single : A 936 TYR OH : rot 180:sc= 0 USER MOD Single : A 937 TYR OH : rot 180:sc= 0 USER MOD Single : A 942 SER OG : rot 180:sc= 0 USER MOD Single : A 944 THR OG1 : rot 34:sc= 0.837 USER MOD Single : A 948 ASN : amide:sc= -0.0012 X(o=-0.0012,f=0) USER MOD Single : A 952 SER OG : rot -50:sc= 1.08 USER MOD Single : A 953 SER OG : rot 180:sc= 0 USER MOD Single : A 955 LYS NZ :NH3+ -166:sc= -0.0498 (180deg=-0.283) USER MOD Single : A 959 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 961 LYS NZ :NH3+ 161:sc= -2.09! (180deg=-3.06!) USER MOD Single : A 962 SER OG : rot 27:sc= 0.233 USER MOD Single : A 964 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 965 THR OG1 : rot 180:sc= -1.29 USER MOD Single : A 973 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 978 THR OG1 : rot 180:sc= -0.328 USER MOD Single : A 981 GLN :FLIP amide:sc= -7.31! C(o=-8.1!,f=-7.3!) USER MOD Single : A 984 SER OG : rot 171:sc= 1.04 USER MOD Single : A 988 TYR OH : rot 150:sc= -1.22 USER MOD Single : A 989 SER OG : rot 180:sc= 0 USER MOD Single : A 991 THR OG1 : rot 180:sc= 0 USER MOD Single : A 992 THR OG1 : rot 180:sc= 0 USER MOD Single : A 999 HIS : no HD1:sc= -2.9! C(o=-2.9!,f=-4!) USER MOD Single : A1000 SER OG : rot -35:sc= 1.12 USER MOD Single : A1001 SER OG : rot 180:sc= 0 USER MOD Single : A1007 SER OG : rot -44:sc= 0.91 USER MOD Single : A1009 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1010 THR OG1 : rot 180:sc= 0 USER MOD Single : A1012 HIS : no HE2:sc= -5.34! C(o=-5.3!,f=-10!) USER MOD Single : A1014 SER OG : rot 180:sc= 0 USER MOD Single : A1015 THR OG1 : rot -146:sc= -1.44 USER MOD Single : A1016 LYS NZ :NH3+ -148:sc= -3.79! (180deg=-6.56!) USER MOD Single : A1021 GLN :FLIP amide:sc= 0 F(o=-1.6!,f=0) USER MOD ----------------------------------------------------------------- ATOM 43 N ALA A 900 36.136 -8.140 -5.301 1.00 0.00 N ATOM 44 CA ALA A 900 35.041 -7.996 -4.350 1.00 0.00 C ATOM 45 C ALA A 900 34.243 -6.732 -4.632 1.00 0.00 C ATOM 46 O ALA A 900 33.930 -6.428 -5.783 1.00 0.00 O ATOM 47 CB ALA A 900 35.571 -7.995 -2.923 1.00 0.00 C ATOM 0 HA ALA A 900 34.372 -8.849 -4.466 1.00 0.00 H new ATOM 0 HB1 ALA A 900 34.740 -7.887 -2.226 1.00 0.00 H new ATOM 0 HB2 ALA A 900 36.089 -8.934 -2.727 1.00 0.00 H new ATOM 0 HB3 ALA A 900 36.264 -7.164 -2.793 1.00 0.00 H new ATOM 53 N HIS A 901 33.913 -6.010 -3.570 1.00 0.00 N ATOM 54 CA HIS A 901 33.142 -4.776 -3.677 1.00 0.00 C ATOM 55 C HIS A 901 31.707 -5.081 -4.083 1.00 0.00 C ATOM 56 O HIS A 901 31.465 -5.882 -4.987 1.00 0.00 O ATOM 57 CB HIS A 901 33.784 -3.821 -4.688 1.00 0.00 C ATOM 58 CG HIS A 901 35.198 -3.458 -4.357 1.00 0.00 C ATOM 59 ND1 HIS A 901 36.203 -4.393 -4.221 1.00 0.00 N ATOM 60 CD2 HIS A 901 35.778 -2.253 -4.139 1.00 0.00 C ATOM 61 CE1 HIS A 901 37.338 -3.779 -3.934 1.00 0.00 C ATOM 62 NE2 HIS A 901 37.107 -2.481 -3.880 1.00 0.00 N ATOM 0 H HIS A 901 34.170 -6.260 -2.615 1.00 0.00 H new ATOM 0 HA HIS A 901 33.136 -4.292 -2.700 1.00 0.00 H new ATOM 0 HB2 HIS A 901 33.758 -4.280 -5.676 1.00 0.00 H new ATOM 0 HB3 HIS A 901 33.188 -2.910 -4.744 1.00 0.00 H new ATOM 0 HD2 HIS A 901 35.286 -1.292 -4.164 1.00 0.00 H new ATOM 0 HE1 HIS A 901 38.292 -4.258 -3.771 1.00 0.00 H new ATOM 0 HE2 HIS A 901 37.803 -1.763 -3.678 1.00 0.00 H new ATOM 71 N CYS A 902 30.757 -4.444 -3.411 1.00 0.00 N ATOM 72 CA CYS A 902 29.349 -4.658 -3.702 1.00 0.00 C ATOM 73 C CYS A 902 28.918 -3.845 -4.909 1.00 0.00 C ATOM 74 O CYS A 902 28.992 -2.619 -4.900 1.00 0.00 O ATOM 75 CB CYS A 902 28.503 -4.267 -2.492 1.00 0.00 C ATOM 76 SG CYS A 902 28.859 -2.597 -1.862 1.00 0.00 S ATOM 0 H CYS A 902 30.937 -3.776 -2.662 1.00 0.00 H new ATOM 0 HA CYS A 902 29.202 -5.715 -3.924 1.00 0.00 H new ATOM 0 HB2 CYS A 902 27.449 -4.327 -2.762 1.00 0.00 H new ATOM 0 HB3 CYS A 902 28.670 -4.990 -1.694 1.00 0.00 H new ATOM 81 N GLN A 903 28.463 -4.529 -5.947 1.00 0.00 N ATOM 82 CA GLN A 903 28.016 -3.853 -7.155 1.00 0.00 C ATOM 83 C GLN A 903 26.685 -3.152 -6.928 1.00 0.00 C ATOM 84 O GLN A 903 26.152 -3.150 -5.819 1.00 0.00 O ATOM 85 CB GLN A 903 27.885 -4.834 -8.314 1.00 0.00 C ATOM 86 CG GLN A 903 27.039 -6.053 -7.992 1.00 0.00 C ATOM 87 CD GLN A 903 26.652 -6.831 -9.234 1.00 0.00 C ATOM 88 OE1 GLN A 903 26.889 -6.239 -10.400 1.00 0.00 O flip ATOM 89 NE2 GLN A 903 26.126 -7.941 -9.147 1.00 0.00 N flip ATOM 0 H GLN A 903 28.394 -5.546 -5.978 1.00 0.00 H new ATOM 0 HA GLN A 903 28.769 -3.107 -7.408 1.00 0.00 H new ATOM 0 HB2 GLN A 903 27.449 -4.316 -9.169 1.00 0.00 H new ATOM 0 HB3 GLN A 903 28.880 -5.163 -8.614 1.00 0.00 H new ATOM 0 HG2 GLN A 903 27.590 -6.706 -7.314 1.00 0.00 H new ATOM 0 HG3 GLN A 903 26.137 -5.738 -7.468 1.00 0.00 H new ATOM 0 HE21 GLN A 903 25.963 -8.358 -8.230 1.00 0.00 H new ATOM 0 HE22 GLN A 903 25.853 -8.444 -9.992 1.00 0.00 H new ATOM 98 N ALA A 904 26.159 -2.559 -7.994 1.00 0.00 N ATOM 99 CA ALA A 904 24.886 -1.852 -7.930 1.00 0.00 C ATOM 100 C ALA A 904 23.813 -2.700 -7.249 1.00 0.00 C ATOM 101 O ALA A 904 23.573 -3.842 -7.641 1.00 0.00 O ATOM 102 CB ALA A 904 24.440 -1.448 -9.326 1.00 0.00 C ATOM 0 H ALA A 904 26.596 -2.554 -8.915 1.00 0.00 H new ATOM 0 HA ALA A 904 25.028 -0.953 -7.330 1.00 0.00 H new ATOM 0 HB1 ALA A 904 23.488 -0.921 -9.265 1.00 0.00 H new ATOM 0 HB2 ALA A 904 25.189 -0.794 -9.772 1.00 0.00 H new ATOM 0 HB3 ALA A 904 24.323 -2.339 -9.943 1.00 0.00 H new ATOM 108 N PRO A 905 23.148 -2.146 -6.220 1.00 0.00 N ATOM 109 CA PRO A 905 22.092 -2.850 -5.485 1.00 0.00 C ATOM 110 C PRO A 905 20.805 -2.962 -6.294 1.00 0.00 C ATOM 111 O PRO A 905 19.807 -2.316 -5.972 1.00 0.00 O ATOM 112 CB PRO A 905 21.873 -1.972 -4.255 1.00 0.00 C ATOM 113 CG PRO A 905 22.255 -0.605 -4.702 1.00 0.00 C ATOM 114 CD PRO A 905 23.372 -0.786 -5.692 1.00 0.00 C ATOM 0 HA PRO A 905 22.372 -3.876 -5.248 1.00 0.00 H new ATOM 0 HB2 PRO A 905 20.835 -2.006 -3.923 1.00 0.00 H new ATOM 0 HB3 PRO A 905 22.487 -2.302 -3.417 1.00 0.00 H new ATOM 0 HG2 PRO A 905 21.408 -0.094 -5.160 1.00 0.00 H new ATOM 0 HG3 PRO A 905 22.577 0.005 -3.858 1.00 0.00 H new ATOM 0 HD2 PRO A 905 23.333 -0.037 -6.483 1.00 0.00 H new ATOM 0 HD3 PRO A 905 24.349 -0.696 -5.216 1.00 0.00 H new ATOM 122 N ASP A 906 20.839 -3.785 -7.341 1.00 0.00 N ATOM 123 CA ASP A 906 19.683 -3.988 -8.208 1.00 0.00 C ATOM 124 C ASP A 906 18.892 -2.689 -8.358 1.00 0.00 C ATOM 125 O ASP A 906 19.470 -1.635 -8.614 1.00 0.00 O ATOM 126 CB ASP A 906 18.809 -5.106 -7.638 1.00 0.00 C ATOM 127 CG ASP A 906 17.875 -5.716 -8.670 1.00 0.00 C ATOM 128 OD1 ASP A 906 17.060 -4.974 -9.258 1.00 0.00 O ATOM 129 OD2 ASP A 906 17.960 -6.942 -8.890 1.00 0.00 O ATOM 0 H ASP A 906 21.662 -4.325 -7.609 1.00 0.00 H new ATOM 0 HA ASP A 906 20.022 -4.283 -9.201 1.00 0.00 H new ATOM 0 HB2 ASP A 906 19.450 -5.887 -7.229 1.00 0.00 H new ATOM 0 HB3 ASP A 906 18.219 -4.712 -6.810 1.00 0.00 H new ATOM 134 N HIS A 907 17.584 -2.776 -8.190 1.00 0.00 N ATOM 135 CA HIS A 907 16.701 -1.615 -8.299 1.00 0.00 C ATOM 136 C HIS A 907 15.404 -1.852 -7.534 1.00 0.00 C ATOM 137 O HIS A 907 14.677 -2.806 -7.809 1.00 0.00 O ATOM 138 CB HIS A 907 16.379 -1.320 -9.770 1.00 0.00 C ATOM 139 CG HIS A 907 17.304 -0.340 -10.429 1.00 0.00 C ATOM 140 ND1 HIS A 907 18.234 0.499 -9.910 1.00 0.00 N flip ATOM 141 CD2 HIS A 907 17.313 -0.118 -11.791 1.00 0.00 C flip ATOM 142 CE1 HIS A 907 18.778 1.202 -10.956 1.00 0.00 C flip ATOM 143 NE2 HIS A 907 18.206 0.811 -12.079 1.00 0.00 N flip ATOM 0 H HIS A 907 17.100 -3.648 -7.975 1.00 0.00 H new ATOM 0 HA HIS A 907 17.218 -0.758 -7.866 1.00 0.00 H new ATOM 0 HB2 HIS A 907 16.405 -2.256 -10.328 1.00 0.00 H new ATOM 0 HB3 HIS A 907 15.360 -0.938 -9.835 1.00 0.00 H new ATOM 0 HD2 HIS A 907 16.687 -0.625 -12.510 1.00 0.00 H new ATOM 0 HE1 HIS A 907 19.549 1.953 -10.873 1.00 0.00 H new ATOM 0 HE2 HIS A 907 18.418 1.166 -13.011 1.00 0.00 H new ATOM 152 N PHE A 908 15.118 -0.977 -6.575 1.00 0.00 N ATOM 153 CA PHE A 908 13.905 -1.094 -5.774 1.00 0.00 C ATOM 154 C PHE A 908 12.732 -0.401 -6.447 1.00 0.00 C ATOM 155 O PHE A 908 12.875 0.680 -7.020 1.00 0.00 O ATOM 156 CB PHE A 908 14.114 -0.521 -4.373 1.00 0.00 C ATOM 157 CG PHE A 908 15.081 -1.313 -3.544 1.00 0.00 C ATOM 158 CD1 PHE A 908 16.412 -1.414 -3.912 1.00 0.00 C ATOM 159 CD2 PHE A 908 14.657 -1.953 -2.394 1.00 0.00 C ATOM 160 CE1 PHE A 908 17.303 -2.142 -3.147 1.00 0.00 C ATOM 161 CE2 PHE A 908 15.541 -2.683 -1.623 1.00 0.00 C ATOM 162 CZ PHE A 908 16.867 -2.778 -2.000 1.00 0.00 C ATOM 0 H PHE A 908 15.708 -0.181 -6.334 1.00 0.00 H new ATOM 0 HA PHE A 908 13.676 -2.156 -5.686 1.00 0.00 H new ATOM 0 HB2 PHE A 908 14.474 0.504 -4.458 1.00 0.00 H new ATOM 0 HB3 PHE A 908 13.154 -0.480 -3.858 1.00 0.00 H new ATOM 0 HD1 PHE A 908 16.758 -0.918 -4.807 1.00 0.00 H new ATOM 0 HD2 PHE A 908 13.622 -1.881 -2.095 1.00 0.00 H new ATOM 0 HE1 PHE A 908 18.339 -2.214 -3.445 1.00 0.00 H new ATOM 0 HE2 PHE A 908 15.196 -3.178 -0.727 1.00 0.00 H new ATOM 0 HZ PHE A 908 17.561 -3.348 -1.400 1.00 0.00 H new ATOM 172 N LEU A 909 11.573 -1.038 -6.376 1.00 0.00 N ATOM 173 CA LEU A 909 10.363 -0.504 -6.978 1.00 0.00 C ATOM 174 C LEU A 909 9.473 0.120 -5.921 1.00 0.00 C ATOM 175 O LEU A 909 8.958 1.220 -6.100 1.00 0.00 O ATOM 176 CB LEU A 909 9.597 -1.611 -7.689 1.00 0.00 C ATOM 177 CG LEU A 909 10.431 -2.494 -8.613 1.00 0.00 C ATOM 178 CD1 LEU A 909 11.228 -1.652 -9.598 1.00 0.00 C ATOM 179 CD2 LEU A 909 11.345 -3.406 -7.811 1.00 0.00 C ATOM 0 H LEU A 909 11.446 -1.933 -5.903 1.00 0.00 H new ATOM 0 HA LEU A 909 10.651 0.261 -7.699 1.00 0.00 H new ATOM 0 HB2 LEU A 909 9.125 -2.244 -6.937 1.00 0.00 H new ATOM 0 HB3 LEU A 909 8.796 -1.158 -8.273 1.00 0.00 H new ATOM 0 HG LEU A 909 9.748 -3.122 -9.186 1.00 0.00 H new ATOM 0 HD11 LEU A 909 11.814 -2.305 -10.245 1.00 0.00 H new ATOM 0 HD12 LEU A 909 10.545 -1.058 -10.205 1.00 0.00 H new ATOM 0 HD13 LEU A 909 11.898 -0.988 -9.051 1.00 0.00 H new ATOM 0 HD21 LEU A 909 11.929 -4.025 -8.492 1.00 0.00 H new ATOM 0 HD22 LEU A 909 12.018 -2.802 -7.202 1.00 0.00 H new ATOM 0 HD23 LEU A 909 10.744 -4.045 -7.164 1.00 0.00 H new ATOM 191 N PHE A 910 9.307 -0.596 -4.817 1.00 0.00 N ATOM 192 CA PHE A 910 8.485 -0.121 -3.718 1.00 0.00 C ATOM 193 C PHE A 910 9.270 0.865 -2.872 1.00 0.00 C ATOM 194 O PHE A 910 8.834 1.268 -1.792 1.00 0.00 O ATOM 195 CB PHE A 910 8.010 -1.301 -2.863 1.00 0.00 C ATOM 196 CG PHE A 910 9.089 -2.303 -2.540 1.00 0.00 C ATOM 197 CD1 PHE A 910 10.312 -1.897 -2.025 1.00 0.00 C ATOM 198 CD2 PHE A 910 8.878 -3.656 -2.761 1.00 0.00 C ATOM 199 CE1 PHE A 910 11.300 -2.820 -1.735 1.00 0.00 C ATOM 200 CE2 PHE A 910 9.862 -4.582 -2.472 1.00 0.00 C ATOM 201 CZ PHE A 910 11.074 -4.163 -1.958 1.00 0.00 C ATOM 0 H PHE A 910 9.733 -1.510 -4.661 1.00 0.00 H new ATOM 0 HA PHE A 910 7.609 0.386 -4.124 1.00 0.00 H new ATOM 0 HB2 PHE A 910 7.596 -0.917 -1.931 1.00 0.00 H new ATOM 0 HB3 PHE A 910 7.200 -1.811 -3.385 1.00 0.00 H new ATOM 0 HD1 PHE A 910 10.494 -0.847 -1.849 1.00 0.00 H new ATOM 0 HD2 PHE A 910 7.933 -3.990 -3.164 1.00 0.00 H new ATOM 0 HE1 PHE A 910 12.247 -2.490 -1.335 1.00 0.00 H new ATOM 0 HE2 PHE A 910 9.684 -5.633 -2.648 1.00 0.00 H new ATOM 0 HZ PHE A 910 11.844 -4.886 -1.731 1.00 0.00 H new ATOM 211 N ALA A 911 10.432 1.253 -3.383 1.00 0.00 N ATOM 212 CA ALA A 911 11.289 2.201 -2.683 1.00 0.00 C ATOM 213 C ALA A 911 12.192 2.956 -3.650 1.00 0.00 C ATOM 214 O ALA A 911 12.862 2.354 -4.489 1.00 0.00 O ATOM 215 CB ALA A 911 12.124 1.483 -1.634 1.00 0.00 C ATOM 0 H ALA A 911 10.801 0.927 -4.276 1.00 0.00 H new ATOM 0 HA ALA A 911 10.646 2.929 -2.189 1.00 0.00 H new ATOM 0 HB1 ALA A 911 12.759 2.204 -1.119 1.00 0.00 H new ATOM 0 HB2 ALA A 911 11.465 1.000 -0.913 1.00 0.00 H new ATOM 0 HB3 ALA A 911 12.747 0.730 -2.117 1.00 0.00 H new ATOM 221 N LYS A 912 12.209 4.278 -3.521 1.00 0.00 N ATOM 222 CA LYS A 912 13.036 5.119 -4.376 1.00 0.00 C ATOM 223 C LYS A 912 14.351 5.458 -3.684 1.00 0.00 C ATOM 224 O LYS A 912 14.366 5.827 -2.512 1.00 0.00 O ATOM 225 CB LYS A 912 12.294 6.404 -4.737 1.00 0.00 C ATOM 226 CG LYS A 912 10.961 6.164 -5.429 1.00 0.00 C ATOM 227 CD LYS A 912 10.259 7.471 -5.761 1.00 0.00 C ATOM 228 CE LYS A 912 8.912 7.229 -6.422 1.00 0.00 C ATOM 229 NZ LYS A 912 8.217 8.504 -6.750 1.00 0.00 N ATOM 0 H LYS A 912 11.659 4.790 -2.832 1.00 0.00 H new ATOM 0 HA LYS A 912 13.253 4.566 -5.290 1.00 0.00 H new ATOM 0 HB2 LYS A 912 12.123 6.982 -3.829 1.00 0.00 H new ATOM 0 HB3 LYS A 912 12.927 7.009 -5.386 1.00 0.00 H new ATOM 0 HG2 LYS A 912 11.123 5.595 -6.344 1.00 0.00 H new ATOM 0 HG3 LYS A 912 10.321 5.559 -4.787 1.00 0.00 H new ATOM 0 HD2 LYS A 912 10.119 8.051 -4.849 1.00 0.00 H new ATOM 0 HD3 LYS A 912 10.889 8.065 -6.423 1.00 0.00 H new ATOM 0 HE2 LYS A 912 9.054 6.648 -7.333 1.00 0.00 H new ATOM 0 HE3 LYS A 912 8.284 6.634 -5.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 912 7.303 8.295 -7.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 912 8.058 9.047 -5.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 912 8.804 9.061 -7.403 1.00 0.00 H new ATOM 243 N LEU A 913 15.449 5.327 -4.418 1.00 0.00 N ATOM 244 CA LEU A 913 16.777 5.617 -3.885 1.00 0.00 C ATOM 245 C LEU A 913 16.807 6.950 -3.138 1.00 0.00 C ATOM 246 O LEU A 913 15.934 7.799 -3.321 1.00 0.00 O ATOM 247 CB LEU A 913 17.803 5.634 -5.016 1.00 0.00 C ATOM 248 CG LEU A 913 19.238 5.931 -4.580 1.00 0.00 C ATOM 249 CD1 LEU A 913 19.747 4.850 -3.638 1.00 0.00 C ATOM 250 CD2 LEU A 913 20.140 6.060 -5.792 1.00 0.00 C ATOM 0 H LEU A 913 15.447 5.020 -5.391 1.00 0.00 H new ATOM 0 HA LEU A 913 17.028 4.829 -3.175 1.00 0.00 H new ATOM 0 HB2 LEU A 913 17.784 4.667 -5.518 1.00 0.00 H new ATOM 0 HB3 LEU A 913 17.500 6.380 -5.750 1.00 0.00 H new ATOM 0 HG LEU A 913 19.249 6.879 -4.042 1.00 0.00 H new ATOM 0 HD11 LEU A 913 20.770 5.080 -3.339 1.00 0.00 H new ATOM 0 HD12 LEU A 913 19.111 4.809 -2.754 1.00 0.00 H new ATOM 0 HD13 LEU A 913 19.725 3.886 -4.145 1.00 0.00 H new ATOM 0 HD21 LEU A 913 21.159 6.271 -5.467 1.00 0.00 H new ATOM 0 HD22 LEU A 913 20.126 5.128 -6.357 1.00 0.00 H new ATOM 0 HD23 LEU A 913 19.785 6.873 -6.425 1.00 0.00 H new ATOM 262 N LYS A 914 17.824 7.126 -2.297 1.00 0.00 N ATOM 263 CA LYS A 914 17.981 8.349 -1.519 1.00 0.00 C ATOM 264 C LYS A 914 19.456 8.711 -1.367 1.00 0.00 C ATOM 265 O LYS A 914 19.864 9.833 -1.666 1.00 0.00 O ATOM 266 CB LYS A 914 17.350 8.176 -0.139 1.00 0.00 C ATOM 267 CG LYS A 914 15.835 8.065 -0.172 1.00 0.00 C ATOM 268 CD LYS A 914 15.185 9.373 -0.596 1.00 0.00 C ATOM 269 CE LYS A 914 15.471 10.490 0.395 1.00 0.00 C ATOM 270 NZ LYS A 914 14.825 11.769 -0.007 1.00 0.00 N ATOM 0 H LYS A 914 18.554 6.432 -2.138 1.00 0.00 H new ATOM 0 HA LYS A 914 17.477 9.157 -2.050 1.00 0.00 H new ATOM 0 HB2 LYS A 914 17.761 7.282 0.330 1.00 0.00 H new ATOM 0 HB3 LYS A 914 17.630 9.022 0.488 1.00 0.00 H new ATOM 0 HG2 LYS A 914 15.543 7.273 -0.862 1.00 0.00 H new ATOM 0 HG3 LYS A 914 15.469 7.780 0.814 1.00 0.00 H new ATOM 0 HD2 LYS A 914 15.551 9.659 -1.582 1.00 0.00 H new ATOM 0 HD3 LYS A 914 14.108 9.232 -0.685 1.00 0.00 H new ATOM 0 HE2 LYS A 914 15.115 10.198 1.383 1.00 0.00 H new ATOM 0 HE3 LYS A 914 16.548 10.637 0.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 914 15.045 12.504 0.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 914 15.184 12.061 -0.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 914 13.795 11.636 -0.059 1.00 0.00 H new ATOM 284 N THR A 915 20.249 7.751 -0.905 1.00 0.00 N ATOM 285 CA THR A 915 21.680 7.959 -0.718 1.00 0.00 C ATOM 286 C THR A 915 22.404 8.109 -2.049 1.00 0.00 C ATOM 287 O THR A 915 22.158 7.352 -2.988 1.00 0.00 O ATOM 288 CB THR A 915 22.323 6.793 0.059 1.00 0.00 C ATOM 289 OG1 THR A 915 21.998 6.889 1.451 1.00 0.00 O ATOM 290 CG2 THR A 915 23.837 6.779 -0.125 1.00 0.00 C ATOM 0 H THR A 915 19.924 6.818 -0.652 1.00 0.00 H new ATOM 0 HA THR A 915 21.782 8.880 -0.144 1.00 0.00 H new ATOM 0 HB THR A 915 21.923 5.860 -0.339 1.00 0.00 H new ATOM 0 HG1 THR A 915 22.534 6.243 1.957 1.00 0.00 H new ATOM 0 HG21 THR A 915 24.264 5.946 0.434 1.00 0.00 H new ATOM 0 HG22 THR A 915 24.074 6.665 -1.183 1.00 0.00 H new ATOM 0 HG23 THR A 915 24.257 7.716 0.242 1.00 0.00 H new ATOM 298 N GLN A 916 23.321 9.070 -2.113 1.00 0.00 N ATOM 299 CA GLN A 916 24.103 9.283 -3.321 1.00 0.00 C ATOM 300 C GLN A 916 24.933 8.037 -3.604 1.00 0.00 C ATOM 301 O GLN A 916 25.699 7.585 -2.752 1.00 0.00 O ATOM 302 CB GLN A 916 25.013 10.501 -3.163 1.00 0.00 C ATOM 303 CG GLN A 916 25.922 10.422 -1.949 1.00 0.00 C ATOM 304 CD GLN A 916 26.906 11.572 -1.877 1.00 0.00 C ATOM 305 OE1 GLN A 916 26.514 12.739 -1.844 1.00 0.00 O ATOM 306 NE2 GLN A 916 28.193 11.247 -1.849 1.00 0.00 N ATOM 0 H GLN A 916 23.538 9.708 -1.347 1.00 0.00 H new ATOM 0 HA GLN A 916 23.429 9.470 -4.157 1.00 0.00 H new ATOM 0 HB2 GLN A 916 25.624 10.607 -4.059 1.00 0.00 H new ATOM 0 HB3 GLN A 916 24.398 11.398 -3.089 1.00 0.00 H new ATOM 0 HG2 GLN A 916 25.313 10.413 -1.045 1.00 0.00 H new ATOM 0 HG3 GLN A 916 26.471 9.481 -1.972 1.00 0.00 H new ATOM 0 HE21 GLN A 916 28.472 10.266 -1.878 1.00 0.00 H new ATOM 0 HE22 GLN A 916 28.903 11.978 -1.798 1.00 0.00 H new ATOM 315 N THR A 917 24.763 7.470 -4.788 1.00 0.00 N ATOM 316 CA THR A 917 25.486 6.261 -5.153 1.00 0.00 C ATOM 317 C THR A 917 26.884 6.568 -5.675 1.00 0.00 C ATOM 318 O THR A 917 27.076 7.485 -6.474 1.00 0.00 O ATOM 319 CB THR A 917 24.722 5.449 -6.205 1.00 0.00 C ATOM 320 OG1 THR A 917 24.651 6.175 -7.438 1.00 0.00 O ATOM 321 CG2 THR A 917 23.319 5.126 -5.720 1.00 0.00 C ATOM 0 H THR A 917 24.135 7.825 -5.509 1.00 0.00 H new ATOM 0 HA THR A 917 25.577 5.672 -4.241 1.00 0.00 H new ATOM 0 HB THR A 917 25.260 4.515 -6.369 1.00 0.00 H new ATOM 0 HG1 THR A 917 24.162 5.645 -8.102 1.00 0.00 H new ATOM 0 HG21 THR A 917 22.794 4.549 -6.482 1.00 0.00 H new ATOM 0 HG22 THR A 917 23.377 4.544 -4.800 1.00 0.00 H new ATOM 0 HG23 THR A 917 22.778 6.053 -5.529 1.00 0.00 H new ATOM 329 N THR A 918 27.857 5.788 -5.214 1.00 0.00 N ATOM 330 CA THR A 918 29.244 5.961 -5.623 1.00 0.00 C ATOM 331 C THR A 918 29.572 5.128 -6.861 1.00 0.00 C ATOM 332 O THR A 918 30.176 4.060 -6.759 1.00 0.00 O ATOM 333 CB THR A 918 30.215 5.584 -4.489 1.00 0.00 C ATOM 334 OG1 THR A 918 30.013 4.220 -4.101 1.00 0.00 O ATOM 335 CG2 THR A 918 30.015 6.493 -3.284 1.00 0.00 C ATOM 0 H THR A 918 27.707 5.026 -4.553 1.00 0.00 H new ATOM 0 HA THR A 918 29.368 7.017 -5.863 1.00 0.00 H new ATOM 0 HB THR A 918 31.234 5.709 -4.857 1.00 0.00 H new ATOM 0 HG1 THR A 918 29.978 3.654 -4.900 1.00 0.00 H new ATOM 0 HG21 THR A 918 30.711 6.209 -2.495 1.00 0.00 H new ATOM 0 HG22 THR A 918 30.198 7.528 -3.574 1.00 0.00 H new ATOM 0 HG23 THR A 918 28.993 6.394 -2.919 1.00 0.00 H new ATOM 343 N ALA A 919 29.179 5.631 -8.030 1.00 0.00 N ATOM 344 CA ALA A 919 29.438 4.950 -9.296 1.00 0.00 C ATOM 345 C ALA A 919 28.708 3.616 -9.385 1.00 0.00 C ATOM 346 O ALA A 919 27.680 3.409 -8.738 1.00 0.00 O ATOM 347 CB ALA A 919 30.933 4.748 -9.466 1.00 0.00 C ATOM 0 H ALA A 919 28.677 6.514 -8.126 1.00 0.00 H new ATOM 0 HA ALA A 919 29.058 5.578 -10.102 1.00 0.00 H new ATOM 0 HB1 ALA A 919 31.126 4.240 -10.411 1.00 0.00 H new ATOM 0 HB2 ALA A 919 31.433 5.716 -9.466 1.00 0.00 H new ATOM 0 HB3 ALA A 919 31.314 4.143 -8.644 1.00 0.00 H new ATOM 353 N SER A 920 29.253 2.713 -10.193 1.00 0.00 N ATOM 354 CA SER A 920 28.668 1.391 -10.381 1.00 0.00 C ATOM 355 C SER A 920 29.157 0.436 -9.300 1.00 0.00 C ATOM 356 O SER A 920 28.368 -0.290 -8.696 1.00 0.00 O ATOM 357 CB SER A 920 29.019 0.842 -11.764 1.00 0.00 C ATOM 358 OG SER A 920 30.422 0.718 -11.923 1.00 0.00 O ATOM 0 H SER A 920 30.104 2.874 -10.731 1.00 0.00 H new ATOM 0 HA SER A 920 27.584 1.481 -10.306 1.00 0.00 H new ATOM 0 HB2 SER A 920 28.547 -0.131 -11.903 1.00 0.00 H new ATOM 0 HB3 SER A 920 28.620 1.503 -12.533 1.00 0.00 H new ATOM 0 HG SER A 920 30.620 0.363 -12.815 1.00 0.00 H new ATOM 364 N ASP A 921 30.462 0.453 -9.049 1.00 0.00 N ATOM 365 CA ASP A 921 31.050 -0.399 -8.025 1.00 0.00 C ATOM 366 C ASP A 921 30.950 0.288 -6.668 1.00 0.00 C ATOM 367 O ASP A 921 31.460 1.394 -6.486 1.00 0.00 O ATOM 368 CB ASP A 921 32.512 -0.707 -8.357 1.00 0.00 C ATOM 369 CG ASP A 921 33.172 -1.595 -7.318 1.00 0.00 C ATOM 370 OD1 ASP A 921 33.276 -1.165 -6.149 1.00 0.00 O ATOM 371 OD2 ASP A 921 33.583 -2.719 -7.674 1.00 0.00 O ATOM 0 H ASP A 921 31.130 1.047 -9.540 1.00 0.00 H new ATOM 0 HA ASP A 921 30.502 -1.341 -7.991 1.00 0.00 H new ATOM 0 HB2 ASP A 921 32.565 -1.193 -9.331 1.00 0.00 H new ATOM 0 HB3 ASP A 921 33.067 0.228 -8.436 1.00 0.00 H new ATOM 376 N PHE A 922 30.280 -0.361 -5.724 1.00 0.00 N ATOM 377 CA PHE A 922 30.106 0.209 -4.395 1.00 0.00 C ATOM 378 C PHE A 922 31.048 -0.413 -3.372 1.00 0.00 C ATOM 379 O PHE A 922 31.206 -1.634 -3.313 1.00 0.00 O ATOM 380 CB PHE A 922 28.663 0.046 -3.926 1.00 0.00 C ATOM 381 CG PHE A 922 27.676 0.801 -4.759 1.00 0.00 C ATOM 382 CD1 PHE A 922 27.289 0.334 -6.006 1.00 0.00 C ATOM 383 CD2 PHE A 922 27.148 1.991 -4.297 1.00 0.00 C ATOM 384 CE1 PHE A 922 26.388 1.046 -6.774 1.00 0.00 C ATOM 385 CE2 PHE A 922 26.248 2.705 -5.058 1.00 0.00 C ATOM 386 CZ PHE A 922 25.866 2.232 -6.299 1.00 0.00 C ATOM 0 H PHE A 922 29.851 -1.277 -5.853 1.00 0.00 H new ATOM 0 HA PHE A 922 30.349 1.269 -4.473 1.00 0.00 H new ATOM 0 HB2 PHE A 922 28.403 -1.012 -3.938 1.00 0.00 H new ATOM 0 HB3 PHE A 922 28.585 0.381 -2.892 1.00 0.00 H new ATOM 0 HD1 PHE A 922 27.695 -0.594 -6.380 1.00 0.00 H new ATOM 0 HD2 PHE A 922 27.444 2.366 -3.328 1.00 0.00 H new ATOM 0 HE1 PHE A 922 26.093 0.675 -7.744 1.00 0.00 H new ATOM 0 HE2 PHE A 922 25.842 3.633 -4.685 1.00 0.00 H new ATOM 0 HZ PHE A 922 25.160 2.790 -6.896 1.00 0.00 H new ATOM 396 N PRO A 923 31.671 0.433 -2.535 1.00 0.00 N ATOM 397 CA PRO A 923 32.586 -0.021 -1.487 1.00 0.00 C ATOM 398 C PRO A 923 31.831 -0.652 -0.323 1.00 0.00 C ATOM 399 O PRO A 923 30.842 -0.094 0.154 1.00 0.00 O ATOM 400 CB PRO A 923 33.273 1.270 -1.042 1.00 0.00 C ATOM 401 CG PRO A 923 32.266 2.337 -1.307 1.00 0.00 C ATOM 402 CD PRO A 923 31.514 1.902 -2.536 1.00 0.00 C ATOM 0 HA PRO A 923 33.279 -0.786 -1.837 1.00 0.00 H new ATOM 0 HB2 PRO A 923 33.544 1.233 0.013 1.00 0.00 H new ATOM 0 HB3 PRO A 923 34.192 1.444 -1.601 1.00 0.00 H new ATOM 0 HG2 PRO A 923 31.592 2.456 -0.459 1.00 0.00 H new ATOM 0 HG3 PRO A 923 32.751 3.300 -1.467 1.00 0.00 H new ATOM 0 HD2 PRO A 923 30.465 2.193 -2.489 1.00 0.00 H new ATOM 0 HD3 PRO A 923 31.929 2.349 -3.439 1.00 0.00 H new ATOM 410 N ILE A 924 32.293 -1.811 0.132 1.00 0.00 N ATOM 411 CA ILE A 924 31.642 -2.498 1.240 1.00 0.00 C ATOM 412 C ILE A 924 31.573 -1.601 2.470 1.00 0.00 C ATOM 413 O ILE A 924 32.471 -0.795 2.717 1.00 0.00 O ATOM 414 CB ILE A 924 32.350 -3.813 1.603 1.00 0.00 C ATOM 415 CG1 ILE A 924 32.497 -4.697 0.360 1.00 0.00 C ATOM 416 CG2 ILE A 924 31.557 -4.532 2.680 1.00 0.00 C ATOM 417 CD1 ILE A 924 33.220 -6.001 0.622 1.00 0.00 C ATOM 0 H ILE A 924 33.110 -2.291 -0.246 1.00 0.00 H new ATOM 0 HA ILE A 924 30.632 -2.738 0.908 1.00 0.00 H new ATOM 0 HB ILE A 924 33.348 -3.594 1.983 1.00 0.00 H new ATOM 0 HG12 ILE A 924 31.506 -4.915 -0.039 1.00 0.00 H new ATOM 0 HG13 ILE A 924 33.035 -4.142 -0.408 1.00 0.00 H new ATOM 0 HG21 ILE A 924 32.058 -5.465 2.939 1.00 0.00 H new ATOM 0 HG22 ILE A 924 31.489 -3.899 3.565 1.00 0.00 H new ATOM 0 HG23 ILE A 924 30.555 -4.749 2.310 1.00 0.00 H new ATOM 0 HD11 ILE A 924 33.286 -6.573 -0.304 1.00 0.00 H new ATOM 0 HD12 ILE A 924 34.224 -5.792 0.992 1.00 0.00 H new ATOM 0 HD13 ILE A 924 32.672 -6.578 1.367 1.00 0.00 H new ATOM 429 N GLY A 925 30.488 -1.733 3.220 1.00 0.00 N ATOM 430 CA GLY A 925 30.291 -0.918 4.401 1.00 0.00 C ATOM 431 C GLY A 925 29.324 0.211 4.125 1.00 0.00 C ATOM 432 O GLY A 925 28.533 0.597 4.985 1.00 0.00 O ATOM 0 H GLY A 925 29.736 -2.395 3.029 1.00 0.00 H new ATOM 0 HA2 GLY A 925 29.911 -1.536 5.215 1.00 0.00 H new ATOM 0 HA3 GLY A 925 31.247 -0.511 4.730 1.00 0.00 H new ATOM 436 N THR A 926 29.390 0.730 2.904 1.00 0.00 N ATOM 437 CA THR A 926 28.521 1.813 2.470 1.00 0.00 C ATOM 438 C THR A 926 27.049 1.448 2.637 1.00 0.00 C ATOM 439 O THR A 926 26.601 0.401 2.167 1.00 0.00 O ATOM 440 CB THR A 926 28.785 2.164 0.994 1.00 0.00 C ATOM 441 OG1 THR A 926 30.078 2.764 0.855 1.00 0.00 O ATOM 442 CG2 THR A 926 27.719 3.103 0.453 1.00 0.00 C ATOM 0 H THR A 926 30.046 0.412 2.191 1.00 0.00 H new ATOM 0 HA THR A 926 28.745 2.675 3.098 1.00 0.00 H new ATOM 0 HB THR A 926 28.751 1.240 0.417 1.00 0.00 H new ATOM 0 HG1 THR A 926 30.016 3.539 0.259 1.00 0.00 H new ATOM 0 HG21 THR A 926 27.932 3.333 -0.591 1.00 0.00 H new ATOM 0 HG22 THR A 926 26.742 2.626 0.527 1.00 0.00 H new ATOM 0 HG23 THR A 926 27.717 4.025 1.034 1.00 0.00 H new ATOM 450 N SER A 927 26.298 2.326 3.293 1.00 0.00 N ATOM 451 CA SER A 927 24.873 2.105 3.505 1.00 0.00 C ATOM 452 C SER A 927 24.059 2.932 2.516 1.00 0.00 C ATOM 453 O SER A 927 24.205 4.154 2.452 1.00 0.00 O ATOM 454 CB SER A 927 24.481 2.469 4.938 1.00 0.00 C ATOM 455 OG SER A 927 24.768 3.828 5.217 1.00 0.00 O ATOM 0 H SER A 927 26.653 3.197 3.687 1.00 0.00 H new ATOM 0 HA SER A 927 24.660 1.048 3.343 1.00 0.00 H new ATOM 0 HB2 SER A 927 23.418 2.281 5.086 1.00 0.00 H new ATOM 0 HB3 SER A 927 25.018 1.830 5.639 1.00 0.00 H new ATOM 0 HG SER A 927 24.613 4.367 4.413 1.00 0.00 H new ATOM 461 N LEU A 928 23.202 2.268 1.747 1.00 0.00 N ATOM 462 CA LEU A 928 22.376 2.963 0.767 1.00 0.00 C ATOM 463 C LEU A 928 20.949 3.113 1.288 1.00 0.00 C ATOM 464 O LEU A 928 20.279 2.124 1.578 1.00 0.00 O ATOM 465 CB LEU A 928 22.380 2.206 -0.562 1.00 0.00 C ATOM 466 CG LEU A 928 22.275 3.088 -1.808 1.00 0.00 C ATOM 467 CD1 LEU A 928 23.487 4.000 -1.913 1.00 0.00 C ATOM 468 CD2 LEU A 928 22.149 2.236 -3.058 1.00 0.00 C ATOM 0 H LEU A 928 23.062 1.258 1.783 1.00 0.00 H new ATOM 0 HA LEU A 928 22.792 3.957 0.603 1.00 0.00 H new ATOM 0 HB2 LEU A 928 23.297 1.620 -0.626 1.00 0.00 H new ATOM 0 HB3 LEU A 928 21.549 1.500 -0.564 1.00 0.00 H new ATOM 0 HG LEU A 928 21.380 3.703 -1.719 1.00 0.00 H new ATOM 0 HD11 LEU A 928 23.399 4.622 -2.804 1.00 0.00 H new ATOM 0 HD12 LEU A 928 23.541 4.637 -1.030 1.00 0.00 H new ATOM 0 HD13 LEU A 928 24.392 3.396 -1.980 1.00 0.00 H new ATOM 0 HD21 LEU A 928 22.076 2.882 -3.933 1.00 0.00 H new ATOM 0 HD22 LEU A 928 23.026 1.596 -3.152 1.00 0.00 H new ATOM 0 HD23 LEU A 928 21.254 1.617 -2.988 1.00 0.00 H new ATOM 480 N LYS A 929 20.497 4.355 1.419 1.00 0.00 N ATOM 481 CA LYS A 929 19.156 4.632 1.925 1.00 0.00 C ATOM 482 C LYS A 929 18.118 4.671 0.807 1.00 0.00 C ATOM 483 O LYS A 929 18.368 5.200 -0.278 1.00 0.00 O ATOM 484 CB LYS A 929 19.142 5.955 2.692 1.00 0.00 C ATOM 485 CG LYS A 929 17.787 6.290 3.298 1.00 0.00 C ATOM 486 CD LYS A 929 17.821 7.600 4.063 1.00 0.00 C ATOM 487 CE LYS A 929 18.804 7.543 5.216 1.00 0.00 C ATOM 488 NZ LYS A 929 18.444 6.492 6.206 1.00 0.00 N ATOM 0 H LYS A 929 21.038 5.186 1.182 1.00 0.00 H new ATOM 0 HA LYS A 929 18.889 3.816 2.597 1.00 0.00 H new ATOM 0 HB2 LYS A 929 19.886 5.913 3.487 1.00 0.00 H new ATOM 0 HB3 LYS A 929 19.439 6.759 2.019 1.00 0.00 H new ATOM 0 HG2 LYS A 929 17.040 6.350 2.507 1.00 0.00 H new ATOM 0 HG3 LYS A 929 17.479 5.486 3.967 1.00 0.00 H new ATOM 0 HD2 LYS A 929 18.097 8.410 3.388 1.00 0.00 H new ATOM 0 HD3 LYS A 929 16.825 7.827 4.443 1.00 0.00 H new ATOM 0 HE2 LYS A 929 19.805 7.349 4.830 1.00 0.00 H new ATOM 0 HE3 LYS A 929 18.836 8.513 5.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 929 19.012 6.618 7.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 929 17.434 6.569 6.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 929 18.634 5.553 5.800 1.00 0.00 H new ATOM 502 N TYR A 930 16.940 4.123 1.098 1.00 0.00 N ATOM 503 CA TYR A 930 15.835 4.102 0.145 1.00 0.00 C ATOM 504 C TYR A 930 14.541 4.526 0.833 1.00 0.00 C ATOM 505 O TYR A 930 14.230 4.058 1.929 1.00 0.00 O ATOM 506 CB TYR A 930 15.654 2.707 -0.462 1.00 0.00 C ATOM 507 CG TYR A 930 16.709 2.324 -1.476 1.00 0.00 C ATOM 508 CD1 TYR A 930 18.020 2.074 -1.092 1.00 0.00 C ATOM 509 CD2 TYR A 930 16.385 2.208 -2.822 1.00 0.00 C ATOM 510 CE1 TYR A 930 18.979 1.719 -2.022 1.00 0.00 C ATOM 511 CE2 TYR A 930 17.338 1.855 -3.757 1.00 0.00 C ATOM 512 CZ TYR A 930 18.633 1.612 -3.352 1.00 0.00 C ATOM 513 OH TYR A 930 19.583 1.258 -4.282 1.00 0.00 O ATOM 0 H TYR A 930 16.726 3.685 1.994 1.00 0.00 H new ATOM 0 HA TYR A 930 16.072 4.802 -0.656 1.00 0.00 H new ATOM 0 HB2 TYR A 930 15.657 1.971 0.342 1.00 0.00 H new ATOM 0 HB3 TYR A 930 14.675 2.656 -0.938 1.00 0.00 H new ATOM 0 HD1 TYR A 930 18.294 2.158 -0.051 1.00 0.00 H new ATOM 0 HD2 TYR A 930 15.371 2.397 -3.142 1.00 0.00 H new ATOM 0 HE1 TYR A 930 19.994 1.526 -1.708 1.00 0.00 H new ATOM 0 HE2 TYR A 930 17.070 1.770 -4.800 1.00 0.00 H new ATOM 0 HH TYR A 930 19.174 1.227 -5.172 1.00 0.00 H new ATOM 523 N GLU A 931 13.792 5.418 0.191 1.00 0.00 N ATOM 524 CA GLU A 931 12.538 5.901 0.755 1.00 0.00 C ATOM 525 C GLU A 931 11.355 5.073 0.264 1.00 0.00 C ATOM 526 O GLU A 931 11.101 4.980 -0.938 1.00 0.00 O ATOM 527 CB GLU A 931 12.322 7.374 0.397 1.00 0.00 C ATOM 528 CG GLU A 931 12.230 7.635 -1.098 1.00 0.00 C ATOM 529 CD GLU A 931 11.875 9.073 -1.421 1.00 0.00 C ATOM 530 OE1 GLU A 931 10.815 9.542 -0.955 1.00 0.00 O ATOM 531 OE2 GLU A 931 12.653 9.730 -2.145 1.00 0.00 O ATOM 0 H GLU A 931 14.031 5.819 -0.716 1.00 0.00 H new ATOM 0 HA GLU A 931 12.603 5.800 1.838 1.00 0.00 H new ATOM 0 HB2 GLU A 931 11.407 7.724 0.874 1.00 0.00 H new ATOM 0 HB3 GLU A 931 13.142 7.962 0.809 1.00 0.00 H new ATOM 0 HG2 GLU A 931 13.183 7.387 -1.565 1.00 0.00 H new ATOM 0 HG3 GLU A 931 11.480 6.974 -1.532 1.00 0.00 H new ATOM 538 N CYS A 932 10.626 4.484 1.204 1.00 0.00 N ATOM 539 CA CYS A 932 9.458 3.678 0.875 1.00 0.00 C ATOM 540 C CYS A 932 8.426 4.520 0.130 1.00 0.00 C ATOM 541 O CYS A 932 8.382 5.740 0.287 1.00 0.00 O ATOM 542 CB CYS A 932 8.847 3.088 2.147 1.00 0.00 C ATOM 543 SG CYS A 932 9.992 2.027 3.089 1.00 0.00 S ATOM 0 H CYS A 932 10.824 4.550 2.202 1.00 0.00 H new ATOM 0 HA CYS A 932 9.770 2.859 0.227 1.00 0.00 H new ATOM 0 HB2 CYS A 932 8.510 3.902 2.788 1.00 0.00 H new ATOM 0 HB3 CYS A 932 7.965 2.507 1.879 1.00 0.00 H new ATOM 548 N ARG A 933 7.598 3.870 -0.681 1.00 0.00 N ATOM 549 CA ARG A 933 6.575 4.577 -1.443 1.00 0.00 C ATOM 550 C ARG A 933 5.352 4.855 -0.575 1.00 0.00 C ATOM 551 O ARG A 933 5.002 4.052 0.291 1.00 0.00 O ATOM 552 CB ARG A 933 6.158 3.767 -2.672 1.00 0.00 C ATOM 553 CG ARG A 933 7.300 3.456 -3.622 1.00 0.00 C ATOM 554 CD ARG A 933 6.805 2.706 -4.849 1.00 0.00 C ATOM 555 NE ARG A 933 5.907 3.521 -5.663 1.00 0.00 N ATOM 556 CZ ARG A 933 5.339 3.095 -6.788 1.00 0.00 C ATOM 557 NH1 ARG A 933 5.568 1.864 -7.226 1.00 0.00 N ATOM 558 NH2 ARG A 933 4.541 3.900 -7.475 1.00 0.00 N ATOM 0 H ARG A 933 7.615 2.861 -0.827 1.00 0.00 H new ATOM 0 HA ARG A 933 7.000 5.525 -1.772 1.00 0.00 H new ATOM 0 HB2 ARG A 933 5.708 2.831 -2.342 1.00 0.00 H new ATOM 0 HB3 ARG A 933 5.388 4.317 -3.213 1.00 0.00 H new ATOM 0 HG2 ARG A 933 7.784 4.383 -3.930 1.00 0.00 H new ATOM 0 HG3 ARG A 933 8.053 2.859 -3.107 1.00 0.00 H new ATOM 0 HD2 ARG A 933 7.658 2.394 -5.452 1.00 0.00 H new ATOM 0 HD3 ARG A 933 6.288 1.799 -4.535 1.00 0.00 H new ATOM 0 HE ARG A 933 5.704 4.471 -5.351 1.00 0.00 H new ATOM 0 HH11 ARG A 933 6.181 1.241 -6.700 1.00 0.00 H new ATOM 0 HH12 ARG A 933 5.131 1.540 -8.089 1.00 0.00 H new ATOM 0 HH21 ARG A 933 4.362 4.847 -7.141 1.00 0.00 H new ATOM 0 HH22 ARG A 933 4.106 3.572 -8.337 1.00 0.00 H new ATOM 572 N PRO A 934 4.685 6.003 -0.793 1.00 0.00 N ATOM 573 CA PRO A 934 3.498 6.387 -0.023 1.00 0.00 C ATOM 574 C PRO A 934 2.471 5.264 0.057 1.00 0.00 C ATOM 575 O PRO A 934 1.902 5.009 1.118 1.00 0.00 O ATOM 576 CB PRO A 934 2.938 7.572 -0.810 1.00 0.00 C ATOM 577 CG PRO A 934 4.124 8.168 -1.484 1.00 0.00 C ATOM 578 CD PRO A 934 5.039 7.018 -1.804 1.00 0.00 C ATOM 0 HA PRO A 934 3.740 6.622 1.014 1.00 0.00 H new ATOM 0 HB2 PRO A 934 2.191 7.249 -1.535 1.00 0.00 H new ATOM 0 HB3 PRO A 934 2.453 8.292 -0.151 1.00 0.00 H new ATOM 0 HG2 PRO A 934 3.832 8.699 -2.390 1.00 0.00 H new ATOM 0 HG3 PRO A 934 4.619 8.892 -0.836 1.00 0.00 H new ATOM 0 HD2 PRO A 934 4.879 6.648 -2.817 1.00 0.00 H new ATOM 0 HD3 PRO A 934 6.087 7.307 -1.732 1.00 0.00 H new ATOM 586 N GLU A 935 2.245 4.587 -1.066 1.00 0.00 N ATOM 587 CA GLU A 935 1.291 3.484 -1.115 1.00 0.00 C ATOM 588 C GLU A 935 1.828 2.258 -0.379 1.00 0.00 C ATOM 589 O GLU A 935 1.425 1.129 -0.658 1.00 0.00 O ATOM 590 CB GLU A 935 0.974 3.124 -2.568 1.00 0.00 C ATOM 591 CG GLU A 935 0.345 4.261 -3.355 1.00 0.00 C ATOM 592 CD GLU A 935 0.036 3.878 -4.789 1.00 0.00 C ATOM 593 OE1 GLU A 935 -0.747 2.928 -4.994 1.00 0.00 O ATOM 594 OE2 GLU A 935 0.578 4.530 -5.707 1.00 0.00 O ATOM 0 H GLU A 935 2.709 4.783 -1.953 1.00 0.00 H new ATOM 0 HA GLU A 935 0.377 3.807 -0.618 1.00 0.00 H new ATOM 0 HB2 GLU A 935 1.893 2.815 -3.065 1.00 0.00 H new ATOM 0 HB3 GLU A 935 0.300 2.267 -2.582 1.00 0.00 H new ATOM 0 HG2 GLU A 935 -0.574 4.575 -2.861 1.00 0.00 H new ATOM 0 HG3 GLU A 935 1.019 5.118 -3.349 1.00 0.00 H new ATOM 601 N TYR A 936 2.735 2.493 0.564 1.00 0.00 N ATOM 602 CA TYR A 936 3.335 1.425 1.357 1.00 0.00 C ATOM 603 C TYR A 936 3.524 1.889 2.795 1.00 0.00 C ATOM 604 O TYR A 936 3.900 3.036 3.040 1.00 0.00 O ATOM 605 CB TYR A 936 4.683 0.994 0.770 1.00 0.00 C ATOM 606 CG TYR A 936 4.582 0.331 -0.585 1.00 0.00 C ATOM 607 CD1 TYR A 936 4.235 1.059 -1.715 1.00 0.00 C ATOM 608 CD2 TYR A 936 4.837 -1.024 -0.733 1.00 0.00 C ATOM 609 CE1 TYR A 936 4.140 0.455 -2.951 1.00 0.00 C ATOM 610 CE2 TYR A 936 4.745 -1.637 -1.966 1.00 0.00 C ATOM 611 CZ TYR A 936 4.396 -0.894 -3.074 1.00 0.00 C ATOM 612 OH TYR A 936 4.303 -1.501 -4.305 1.00 0.00 O ATOM 0 H TYR A 936 3.074 3.426 0.800 1.00 0.00 H new ATOM 0 HA TYR A 936 2.662 0.568 1.337 1.00 0.00 H new ATOM 0 HB2 TYR A 936 5.328 1.869 0.687 1.00 0.00 H new ATOM 0 HB3 TYR A 936 5.166 0.306 1.464 1.00 0.00 H new ATOM 0 HD1 TYR A 936 4.036 2.117 -1.624 1.00 0.00 H new ATOM 0 HD2 TYR A 936 5.112 -1.610 0.132 1.00 0.00 H new ATOM 0 HE1 TYR A 936 3.866 1.036 -3.819 1.00 0.00 H new ATOM 0 HE2 TYR A 936 4.945 -2.694 -2.063 1.00 0.00 H new ATOM 0 HH TYR A 936 4.516 -2.454 -4.217 1.00 0.00 H new ATOM 622 N TYR A 937 3.255 1.001 3.745 1.00 0.00 N ATOM 623 CA TYR A 937 3.394 1.344 5.157 1.00 0.00 C ATOM 624 C TYR A 937 4.773 0.963 5.690 1.00 0.00 C ATOM 625 O TYR A 937 5.278 -0.127 5.424 1.00 0.00 O ATOM 626 CB TYR A 937 2.282 0.685 5.986 1.00 0.00 C ATOM 627 CG TYR A 937 2.118 -0.805 5.759 1.00 0.00 C ATOM 628 CD1 TYR A 937 3.076 -1.710 6.199 1.00 0.00 C ATOM 629 CD2 TYR A 937 0.997 -1.305 5.106 1.00 0.00 C ATOM 630 CE1 TYR A 937 2.923 -3.068 5.994 1.00 0.00 C ATOM 631 CE2 TYR A 937 0.837 -2.660 4.898 1.00 0.00 C ATOM 632 CZ TYR A 937 1.802 -3.538 5.343 1.00 0.00 C ATOM 633 OH TYR A 937 1.647 -4.890 5.138 1.00 0.00 O ATOM 0 H TYR A 937 2.942 0.047 3.567 1.00 0.00 H new ATOM 0 HA TYR A 937 3.295 2.426 5.250 1.00 0.00 H new ATOM 0 HB2 TYR A 937 2.486 0.857 7.043 1.00 0.00 H new ATOM 0 HB3 TYR A 937 1.337 1.179 5.759 1.00 0.00 H new ATOM 0 HD1 TYR A 937 3.955 -1.346 6.710 1.00 0.00 H new ATOM 0 HD2 TYR A 937 0.238 -0.621 4.755 1.00 0.00 H new ATOM 0 HE1 TYR A 937 3.678 -3.758 6.342 1.00 0.00 H new ATOM 0 HE2 TYR A 937 -0.040 -3.031 4.389 1.00 0.00 H new ATOM 0 HH TYR A 937 0.804 -5.055 4.667 1.00 0.00 H new ATOM 643 N GLY A 938 5.383 1.882 6.438 1.00 0.00 N ATOM 644 CA GLY A 938 6.701 1.632 6.992 1.00 0.00 C ATOM 645 C GLY A 938 7.646 2.800 6.802 1.00 0.00 C ATOM 646 O GLY A 938 7.555 3.530 5.815 1.00 0.00 O ATOM 0 H GLY A 938 4.987 2.793 6.669 1.00 0.00 H new ATOM 0 HA2 GLY A 938 6.608 1.415 8.056 1.00 0.00 H new ATOM 0 HA3 GLY A 938 7.126 0.746 6.521 1.00 0.00 H new ATOM 650 N ARG A 939 8.561 2.972 7.748 1.00 0.00 N ATOM 651 CA ARG A 939 9.536 4.049 7.686 1.00 0.00 C ATOM 652 C ARG A 939 10.584 3.763 6.609 1.00 0.00 C ATOM 653 O ARG A 939 10.681 2.640 6.115 1.00 0.00 O ATOM 654 CB ARG A 939 10.215 4.218 9.044 1.00 0.00 C ATOM 655 CG ARG A 939 11.037 3.016 9.468 1.00 0.00 C ATOM 656 CD ARG A 939 11.753 3.273 10.782 1.00 0.00 C ATOM 657 NE ARG A 939 10.818 3.553 11.869 1.00 0.00 N ATOM 658 CZ ARG A 939 11.193 3.821 13.116 1.00 0.00 C ATOM 659 NH1 ARG A 939 12.481 3.838 13.436 1.00 0.00 N ATOM 660 NH2 ARG A 939 10.281 4.072 14.045 1.00 0.00 N ATOM 0 H ARG A 939 8.647 2.375 8.571 1.00 0.00 H new ATOM 0 HA ARG A 939 9.017 4.972 7.429 1.00 0.00 H new ATOM 0 HB2 ARG A 939 10.861 5.095 9.011 1.00 0.00 H new ATOM 0 HB3 ARG A 939 9.454 4.411 9.800 1.00 0.00 H new ATOM 0 HG2 ARG A 939 10.388 2.146 9.569 1.00 0.00 H new ATOM 0 HG3 ARG A 939 11.767 2.781 8.694 1.00 0.00 H new ATOM 0 HD2 ARG A 939 12.360 2.405 11.040 1.00 0.00 H new ATOM 0 HD3 ARG A 939 12.435 4.115 10.665 1.00 0.00 H new ATOM 0 HE ARG A 939 9.820 3.542 11.659 1.00 0.00 H new ATOM 0 HH11 ARG A 939 13.186 3.645 12.724 1.00 0.00 H new ATOM 0 HH12 ARG A 939 12.766 4.044 14.393 1.00 0.00 H new ATOM 0 HH21 ARG A 939 9.290 4.060 13.803 1.00 0.00 H new ATOM 0 HH22 ARG A 939 10.570 4.277 15.001 1.00 0.00 H new ATOM 674 N PRO A 940 11.387 4.774 6.226 1.00 0.00 N ATOM 675 CA PRO A 940 12.421 4.608 5.203 1.00 0.00 C ATOM 676 C PRO A 940 13.557 3.708 5.676 1.00 0.00 C ATOM 677 O PRO A 940 14.186 3.973 6.700 1.00 0.00 O ATOM 678 CB PRO A 940 12.925 6.031 4.959 1.00 0.00 C ATOM 679 CG PRO A 940 12.607 6.768 6.212 1.00 0.00 C ATOM 680 CD PRO A 940 11.353 6.145 6.763 1.00 0.00 C ATOM 0 HA PRO A 940 12.032 4.128 4.305 1.00 0.00 H new ATOM 0 HB2 PRO A 940 13.996 6.042 4.755 1.00 0.00 H new ATOM 0 HB3 PRO A 940 12.432 6.483 4.098 1.00 0.00 H new ATOM 0 HG2 PRO A 940 13.426 6.690 6.927 1.00 0.00 H new ATOM 0 HG3 PRO A 940 12.458 7.829 6.012 1.00 0.00 H new ATOM 0 HD2 PRO A 940 11.348 6.149 7.853 1.00 0.00 H new ATOM 0 HD3 PRO A 940 10.462 6.682 6.438 1.00 0.00 H new ATOM 688 N PHE A 941 13.807 2.638 4.929 1.00 0.00 N ATOM 689 CA PHE A 941 14.860 1.693 5.277 1.00 0.00 C ATOM 690 C PHE A 941 16.182 2.068 4.617 1.00 0.00 C ATOM 691 O PHE A 941 16.348 3.183 4.117 1.00 0.00 O ATOM 692 CB PHE A 941 14.448 0.276 4.867 1.00 0.00 C ATOM 693 CG PHE A 941 14.266 0.096 3.386 1.00 0.00 C ATOM 694 CD1 PHE A 941 15.347 -0.205 2.571 1.00 0.00 C ATOM 695 CD2 PHE A 941 13.011 0.213 2.810 1.00 0.00 C ATOM 696 CE1 PHE A 941 15.179 -0.382 1.211 1.00 0.00 C ATOM 697 CE2 PHE A 941 12.837 0.036 1.451 1.00 0.00 C ATOM 698 CZ PHE A 941 13.923 -0.261 0.651 1.00 0.00 C ATOM 0 H PHE A 941 13.294 2.404 4.079 1.00 0.00 H new ATOM 0 HA PHE A 941 15.003 1.728 6.357 1.00 0.00 H new ATOM 0 HB2 PHE A 941 15.204 -0.427 5.218 1.00 0.00 H new ATOM 0 HB3 PHE A 941 13.516 0.020 5.371 1.00 0.00 H new ATOM 0 HD1 PHE A 941 16.331 -0.302 3.004 1.00 0.00 H new ATOM 0 HD2 PHE A 941 12.159 0.445 3.431 1.00 0.00 H new ATOM 0 HE1 PHE A 941 16.029 -0.615 0.587 1.00 0.00 H new ATOM 0 HE2 PHE A 941 11.853 0.130 1.015 1.00 0.00 H new ATOM 0 HZ PHE A 941 13.790 -0.398 -0.412 1.00 0.00 H new ATOM 708 N SER A 942 17.116 1.123 4.616 1.00 0.00 N ATOM 709 CA SER A 942 18.427 1.337 4.018 1.00 0.00 C ATOM 710 C SER A 942 19.255 0.056 4.055 1.00 0.00 C ATOM 711 O SER A 942 19.280 -0.652 5.061 1.00 0.00 O ATOM 712 CB SER A 942 19.172 2.458 4.747 1.00 0.00 C ATOM 713 OG SER A 942 19.358 2.143 6.116 1.00 0.00 O ATOM 0 H SER A 942 16.987 0.197 5.025 1.00 0.00 H new ATOM 0 HA SER A 942 18.279 1.627 2.978 1.00 0.00 H new ATOM 0 HB2 SER A 942 20.140 2.622 4.274 1.00 0.00 H new ATOM 0 HB3 SER A 942 18.612 3.389 4.658 1.00 0.00 H new ATOM 0 HG SER A 942 19.838 2.875 6.558 1.00 0.00 H new ATOM 719 N ILE A 943 19.935 -0.229 2.950 1.00 0.00 N ATOM 720 CA ILE A 943 20.772 -1.418 2.846 1.00 0.00 C ATOM 721 C ILE A 943 22.203 -1.118 3.270 1.00 0.00 C ATOM 722 O ILE A 943 22.532 0.022 3.603 1.00 0.00 O ATOM 723 CB ILE A 943 20.766 -1.985 1.415 1.00 0.00 C ATOM 724 CG1 ILE A 943 20.817 -0.851 0.387 1.00 0.00 C ATOM 725 CG2 ILE A 943 19.540 -2.853 1.194 1.00 0.00 C ATOM 726 CD1 ILE A 943 20.749 -1.332 -1.047 1.00 0.00 C ATOM 0 H ILE A 943 19.922 0.350 2.110 1.00 0.00 H new ATOM 0 HA ILE A 943 20.352 -2.166 3.519 1.00 0.00 H new ATOM 0 HB ILE A 943 21.654 -2.604 1.285 1.00 0.00 H new ATOM 0 HG12 ILE A 943 19.989 -0.166 0.572 1.00 0.00 H new ATOM 0 HG13 ILE A 943 21.737 -0.284 0.528 1.00 0.00 H new ATOM 0 HG21 ILE A 943 19.551 -3.246 0.177 1.00 0.00 H new ATOM 0 HG22 ILE A 943 19.548 -3.681 1.903 1.00 0.00 H new ATOM 0 HG23 ILE A 943 18.640 -2.256 1.343 1.00 0.00 H new ATOM 0 HD11 ILE A 943 20.790 -0.476 -1.720 1.00 0.00 H new ATOM 0 HD12 ILE A 943 21.591 -1.993 -1.249 1.00 0.00 H new ATOM 0 HD13 ILE A 943 19.816 -1.874 -1.205 1.00 0.00 H new ATOM 738 N THR A 944 23.050 -2.143 3.279 1.00 0.00 N ATOM 739 CA THR A 944 24.436 -1.972 3.693 1.00 0.00 C ATOM 740 C THR A 944 25.325 -3.111 3.212 1.00 0.00 C ATOM 741 O THR A 944 25.044 -4.283 3.467 1.00 0.00 O ATOM 742 CB THR A 944 24.526 -1.885 5.233 1.00 0.00 C ATOM 743 OG1 THR A 944 24.314 -0.536 5.664 1.00 0.00 O ATOM 744 CG2 THR A 944 25.866 -2.396 5.748 1.00 0.00 C ATOM 0 H THR A 944 22.802 -3.094 3.006 1.00 0.00 H new ATOM 0 HA THR A 944 24.790 -1.046 3.239 1.00 0.00 H new ATOM 0 HB THR A 944 23.746 -2.523 5.648 1.00 0.00 H new ATOM 0 HG1 THR A 944 23.670 -0.100 5.068 1.00 0.00 H new ATOM 0 HG21 THR A 944 25.891 -2.319 6.835 1.00 0.00 H new ATOM 0 HG22 THR A 944 25.995 -3.438 5.455 1.00 0.00 H new ATOM 0 HG23 THR A 944 26.671 -1.797 5.323 1.00 0.00 H new ATOM 752 N CYS A 945 26.421 -2.755 2.546 1.00 0.00 N ATOM 753 CA CYS A 945 27.370 -3.749 2.071 1.00 0.00 C ATOM 754 C CYS A 945 28.113 -4.316 3.266 1.00 0.00 C ATOM 755 O CYS A 945 28.774 -3.588 4.004 1.00 0.00 O ATOM 756 CB CYS A 945 28.345 -3.135 1.075 1.00 0.00 C ATOM 757 SG CYS A 945 27.531 -2.356 -0.351 1.00 0.00 S ATOM 0 H CYS A 945 26.670 -1.791 2.326 1.00 0.00 H new ATOM 0 HA CYS A 945 26.836 -4.547 1.556 1.00 0.00 H new ATOM 0 HB2 CYS A 945 28.954 -2.390 1.587 1.00 0.00 H new ATOM 0 HB3 CYS A 945 29.023 -3.910 0.718 1.00 0.00 H new ATOM 762 N LEU A 946 27.947 -5.600 3.491 1.00 0.00 N ATOM 763 CA LEU A 946 28.548 -6.245 4.641 1.00 0.00 C ATOM 764 C LEU A 946 29.957 -6.748 4.411 1.00 0.00 C ATOM 765 O LEU A 946 30.864 -6.426 5.180 1.00 0.00 O ATOM 766 CB LEU A 946 27.616 -7.344 5.106 1.00 0.00 C ATOM 767 CG LEU A 946 26.264 -6.779 5.524 1.00 0.00 C ATOM 768 CD1 LEU A 946 25.321 -7.854 6.011 1.00 0.00 C ATOM 769 CD2 LEU A 946 26.484 -5.721 6.586 1.00 0.00 C ATOM 0 H LEU A 946 27.401 -6.220 2.893 1.00 0.00 H new ATOM 0 HA LEU A 946 28.670 -5.495 5.422 1.00 0.00 H new ATOM 0 HB2 LEU A 946 27.478 -8.070 4.305 1.00 0.00 H new ATOM 0 HB3 LEU A 946 28.066 -7.876 5.944 1.00 0.00 H new ATOM 0 HG LEU A 946 25.788 -6.331 4.651 1.00 0.00 H new ATOM 0 HD11 LEU A 946 24.371 -7.402 6.297 1.00 0.00 H new ATOM 0 HD12 LEU A 946 25.153 -8.579 5.214 1.00 0.00 H new ATOM 0 HD13 LEU A 946 25.758 -8.358 6.873 1.00 0.00 H new ATOM 0 HD21 LEU A 946 25.523 -5.309 6.894 1.00 0.00 H new ATOM 0 HD22 LEU A 946 26.980 -6.168 7.448 1.00 0.00 H new ATOM 0 HD23 LEU A 946 27.108 -4.924 6.182 1.00 0.00 H new ATOM 781 N ASP A 947 30.137 -7.542 3.374 1.00 0.00 N ATOM 782 CA ASP A 947 31.446 -8.107 3.071 1.00 0.00 C ATOM 783 C ASP A 947 31.342 -9.152 1.968 1.00 0.00 C ATOM 784 O ASP A 947 32.196 -9.222 1.084 1.00 0.00 O ATOM 785 CB ASP A 947 32.030 -8.737 4.336 1.00 0.00 C ATOM 786 CG ASP A 947 33.367 -9.420 4.107 1.00 0.00 C ATOM 787 OD1 ASP A 947 33.901 -9.329 2.982 1.00 0.00 O ATOM 788 OD2 ASP A 947 33.886 -10.038 5.060 1.00 0.00 O ATOM 0 H ASP A 947 29.398 -7.813 2.726 1.00 0.00 H new ATOM 0 HA ASP A 947 32.102 -7.309 2.722 1.00 0.00 H new ATOM 0 HB2 ASP A 947 32.150 -7.965 5.096 1.00 0.00 H new ATOM 0 HB3 ASP A 947 31.321 -9.465 4.731 1.00 0.00 H new ATOM 793 N ASN A 948 30.286 -9.954 2.016 1.00 0.00 N ATOM 794 CA ASN A 948 30.075 -10.982 1.008 1.00 0.00 C ATOM 795 C ASN A 948 29.397 -10.378 -0.214 1.00 0.00 C ATOM 796 O ASN A 948 28.586 -11.025 -0.876 1.00 0.00 O ATOM 797 CB ASN A 948 29.228 -12.123 1.573 1.00 0.00 C ATOM 798 CG ASN A 948 29.894 -12.812 2.748 1.00 0.00 C ATOM 799 OD1 ASN A 948 30.987 -13.362 2.621 1.00 0.00 O ATOM 800 ND2 ASN A 948 29.235 -12.786 3.901 1.00 0.00 N ATOM 0 H ASN A 948 29.567 -9.912 2.738 1.00 0.00 H new ATOM 0 HA ASN A 948 31.043 -11.387 0.714 1.00 0.00 H new ATOM 0 HB2 ASN A 948 28.260 -11.732 1.886 1.00 0.00 H new ATOM 0 HB3 ASN A 948 29.038 -12.854 0.787 1.00 0.00 H new ATOM 0 HD21 ASN A 948 29.633 -13.234 4.726 1.00 0.00 H new ATOM 0 HD22 ASN A 948 28.331 -12.318 3.961 1.00 0.00 H new ATOM 807 N LEU A 949 29.749 -9.126 -0.504 1.00 0.00 N ATOM 808 CA LEU A 949 29.193 -8.413 -1.645 1.00 0.00 C ATOM 809 C LEU A 949 27.672 -8.485 -1.656 1.00 0.00 C ATOM 810 O LEU A 949 27.058 -8.766 -2.687 1.00 0.00 O ATOM 811 CB LEU A 949 29.777 -8.967 -2.944 1.00 0.00 C ATOM 812 CG LEU A 949 31.105 -8.332 -3.372 1.00 0.00 C ATOM 813 CD1 LEU A 949 32.077 -8.260 -2.205 1.00 0.00 C ATOM 814 CD2 LEU A 949 31.722 -9.104 -4.526 1.00 0.00 C ATOM 0 H LEU A 949 30.421 -8.585 0.041 1.00 0.00 H new ATOM 0 HA LEU A 949 29.467 -7.362 -1.559 1.00 0.00 H new ATOM 0 HB2 LEU A 949 29.923 -10.041 -2.831 1.00 0.00 H new ATOM 0 HB3 LEU A 949 29.049 -8.826 -3.743 1.00 0.00 H new ATOM 0 HG LEU A 949 30.897 -7.315 -3.706 1.00 0.00 H new ATOM 0 HD11 LEU A 949 33.011 -7.805 -2.537 1.00 0.00 H new ATOM 0 HD12 LEU A 949 31.643 -7.657 -1.407 1.00 0.00 H new ATOM 0 HD13 LEU A 949 32.275 -9.266 -1.834 1.00 0.00 H new ATOM 0 HD21 LEU A 949 32.664 -8.637 -4.814 1.00 0.00 H new ATOM 0 HD22 LEU A 949 31.907 -10.133 -4.218 1.00 0.00 H new ATOM 0 HD23 LEU A 949 31.039 -9.097 -5.375 1.00 0.00 H new ATOM 826 N VAL A 950 27.071 -8.216 -0.502 1.00 0.00 N ATOM 827 CA VAL A 950 25.623 -8.236 -0.372 1.00 0.00 C ATOM 828 C VAL A 950 25.130 -7.041 0.419 1.00 0.00 C ATOM 829 O VAL A 950 25.812 -6.535 1.312 1.00 0.00 O ATOM 830 CB VAL A 950 25.118 -9.510 0.309 1.00 0.00 C ATOM 831 CG1 VAL A 950 25.355 -10.716 -0.577 1.00 0.00 C ATOM 832 CG2 VAL A 950 25.775 -9.665 1.663 1.00 0.00 C ATOM 0 H VAL A 950 27.568 -7.981 0.357 1.00 0.00 H new ATOM 0 HA VAL A 950 25.229 -8.201 -1.388 1.00 0.00 H new ATOM 0 HB VAL A 950 24.042 -9.433 0.467 1.00 0.00 H new ATOM 0 HG11 VAL A 950 24.990 -11.613 -0.076 1.00 0.00 H new ATOM 0 HG12 VAL A 950 24.824 -10.585 -1.520 1.00 0.00 H new ATOM 0 HG13 VAL A 950 26.422 -10.819 -0.773 1.00 0.00 H new ATOM 0 HG21 VAL A 950 25.411 -10.574 2.142 1.00 0.00 H new ATOM 0 HG22 VAL A 950 26.856 -9.729 1.538 1.00 0.00 H new ATOM 0 HG23 VAL A 950 25.532 -8.804 2.286 1.00 0.00 H new ATOM 842 N TRP A 951 23.938 -6.601 0.073 1.00 0.00 N ATOM 843 CA TRP A 951 23.314 -5.460 0.729 1.00 0.00 C ATOM 844 C TRP A 951 22.483 -5.886 1.935 1.00 0.00 C ATOM 845 O TRP A 951 21.350 -5.442 2.119 1.00 0.00 O ATOM 846 CB TRP A 951 22.480 -4.673 -0.278 1.00 0.00 C ATOM 847 CG TRP A 951 23.332 -3.997 -1.308 1.00 0.00 C ATOM 848 CD1 TRP A 951 23.734 -4.494 -2.516 1.00 0.00 C ATOM 849 CD2 TRP A 951 23.919 -2.702 -1.193 1.00 0.00 C ATOM 850 NE1 TRP A 951 24.525 -3.573 -3.163 1.00 0.00 N ATOM 851 CE2 TRP A 951 24.651 -2.462 -2.368 1.00 0.00 C ATOM 852 CE3 TRP A 951 23.884 -1.719 -0.206 1.00 0.00 C ATOM 853 CZ2 TRP A 951 25.346 -1.275 -2.582 1.00 0.00 C ATOM 854 CZ3 TRP A 951 24.571 -0.542 -0.414 1.00 0.00 C ATOM 855 CH2 TRP A 951 25.295 -0.325 -1.596 1.00 0.00 C ATOM 0 H TRP A 951 23.373 -7.019 -0.667 1.00 0.00 H new ATOM 0 HA TRP A 951 24.102 -4.810 1.109 1.00 0.00 H new ATOM 0 HB2 TRP A 951 21.779 -5.346 -0.772 1.00 0.00 H new ATOM 0 HB3 TRP A 951 21.887 -3.926 0.249 1.00 0.00 H new ATOM 0 HD1 TRP A 951 23.470 -5.466 -2.905 1.00 0.00 H new ATOM 0 HE1 TRP A 951 24.948 -3.696 -4.083 1.00 0.00 H new ATOM 0 HE3 TRP A 951 23.328 -1.877 0.706 1.00 0.00 H new ATOM 0 HZ2 TRP A 951 25.905 -1.109 -3.491 1.00 0.00 H new ATOM 0 HZ3 TRP A 951 24.552 0.226 0.345 1.00 0.00 H new ATOM 0 HH2 TRP A 951 25.822 0.608 -1.731 1.00 0.00 H new ATOM 866 N SER A 952 23.076 -6.742 2.755 1.00 0.00 N ATOM 867 CA SER A 952 22.439 -7.250 3.969 1.00 0.00 C ATOM 868 C SER A 952 21.026 -7.760 3.708 1.00 0.00 C ATOM 869 O SER A 952 20.180 -7.741 4.601 1.00 0.00 O ATOM 870 CB SER A 952 22.415 -6.164 5.048 1.00 0.00 C ATOM 871 OG SER A 952 21.843 -6.649 6.250 1.00 0.00 O ATOM 0 H SER A 952 24.016 -7.107 2.599 1.00 0.00 H new ATOM 0 HA SER A 952 23.032 -8.096 4.317 1.00 0.00 H new ATOM 0 HB2 SER A 952 23.430 -5.816 5.240 1.00 0.00 H new ATOM 0 HB3 SER A 952 21.845 -5.306 4.691 1.00 0.00 H new ATOM 0 HG SER A 952 20.990 -7.089 6.052 1.00 0.00 H new ATOM 877 N SER A 953 20.804 -8.245 2.494 1.00 0.00 N ATOM 878 CA SER A 953 19.524 -8.806 2.084 1.00 0.00 C ATOM 879 C SER A 953 18.333 -8.091 2.731 1.00 0.00 C ATOM 880 O SER A 953 17.996 -8.357 3.885 1.00 0.00 O ATOM 881 CB SER A 953 19.499 -10.288 2.422 1.00 0.00 C ATOM 882 OG SER A 953 20.616 -10.959 1.864 1.00 0.00 O ATOM 0 H SER A 953 21.513 -8.260 1.760 1.00 0.00 H new ATOM 0 HA SER A 953 19.425 -8.663 1.008 1.00 0.00 H new ATOM 0 HB2 SER A 953 19.497 -10.417 3.504 1.00 0.00 H new ATOM 0 HB3 SER A 953 18.578 -10.734 2.046 1.00 0.00 H new ATOM 0 HG SER A 953 20.577 -11.910 2.098 1.00 0.00 H new ATOM 888 N PRO A 954 17.668 -7.182 1.996 1.00 0.00 N ATOM 889 CA PRO A 954 16.510 -6.443 2.518 1.00 0.00 C ATOM 890 C PRO A 954 15.429 -7.361 3.086 1.00 0.00 C ATOM 891 O PRO A 954 15.056 -8.357 2.467 1.00 0.00 O ATOM 892 CB PRO A 954 15.983 -5.695 1.292 1.00 0.00 C ATOM 893 CG PRO A 954 17.166 -5.552 0.402 1.00 0.00 C ATOM 894 CD PRO A 954 17.983 -6.799 0.606 1.00 0.00 C ATOM 0 HA PRO A 954 16.789 -5.793 3.347 1.00 0.00 H new ATOM 0 HB2 PRO A 954 15.183 -6.251 0.802 1.00 0.00 H new ATOM 0 HB3 PRO A 954 15.574 -4.723 1.567 1.00 0.00 H new ATOM 0 HG2 PRO A 954 16.862 -5.449 -0.640 1.00 0.00 H new ATOM 0 HG3 PRO A 954 17.741 -4.661 0.655 1.00 0.00 H new ATOM 0 HD2 PRO A 954 17.707 -7.582 -0.100 1.00 0.00 H new ATOM 0 HD3 PRO A 954 19.048 -6.610 0.472 1.00 0.00 H new ATOM 902 N LYS A 955 14.931 -7.006 4.266 1.00 0.00 N ATOM 903 CA LYS A 955 13.888 -7.775 4.938 1.00 0.00 C ATOM 904 C LYS A 955 13.162 -6.916 5.961 1.00 0.00 C ATOM 905 O LYS A 955 13.791 -6.173 6.715 1.00 0.00 O ATOM 906 CB LYS A 955 14.478 -9.006 5.628 1.00 0.00 C ATOM 907 CG LYS A 955 14.451 -10.254 4.765 1.00 0.00 C ATOM 908 CD LYS A 955 15.093 -11.437 5.470 1.00 0.00 C ATOM 909 CE LYS A 955 15.085 -12.678 4.594 1.00 0.00 C ATOM 910 NZ LYS A 955 13.704 -13.072 4.200 1.00 0.00 N ATOM 0 H LYS A 955 15.237 -6.181 4.782 1.00 0.00 H new ATOM 0 HA LYS A 955 13.177 -8.103 4.180 1.00 0.00 H new ATOM 0 HB2 LYS A 955 15.508 -8.794 5.914 1.00 0.00 H new ATOM 0 HB3 LYS A 955 13.925 -9.198 6.548 1.00 0.00 H new ATOM 0 HG2 LYS A 955 13.420 -10.498 4.510 1.00 0.00 H new ATOM 0 HG3 LYS A 955 14.974 -10.061 3.828 1.00 0.00 H new ATOM 0 HD2 LYS A 955 16.119 -11.188 5.740 1.00 0.00 H new ATOM 0 HD3 LYS A 955 14.560 -11.642 6.398 1.00 0.00 H new ATOM 0 HE2 LYS A 955 15.679 -12.494 3.699 1.00 0.00 H new ATOM 0 HE3 LYS A 955 15.559 -13.502 5.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 955 13.716 -14.037 3.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 955 13.083 -13.042 5.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 955 13.347 -12.413 3.479 1.00 0.00 H new ATOM 924 N ASP A 956 11.835 -7.015 5.983 1.00 0.00 N ATOM 925 CA ASP A 956 11.038 -6.235 6.919 1.00 0.00 C ATOM 926 C ASP A 956 11.342 -4.754 6.732 1.00 0.00 C ATOM 927 O ASP A 956 11.945 -4.115 7.594 1.00 0.00 O ATOM 928 CB ASP A 956 11.339 -6.673 8.353 1.00 0.00 C ATOM 929 CG ASP A 956 10.401 -6.046 9.366 1.00 0.00 C ATOM 930 OD1 ASP A 956 9.504 -5.280 8.954 1.00 0.00 O ATOM 931 OD2 ASP A 956 10.562 -6.323 10.574 1.00 0.00 O ATOM 0 H ASP A 956 11.295 -7.623 5.368 1.00 0.00 H new ATOM 0 HA ASP A 956 9.979 -6.403 6.726 1.00 0.00 H new ATOM 0 HB2 ASP A 956 11.266 -7.759 8.420 1.00 0.00 H new ATOM 0 HB3 ASP A 956 12.366 -6.407 8.602 1.00 0.00 H new ATOM 936 N VAL A 957 10.952 -4.226 5.574 1.00 0.00 N ATOM 937 CA VAL A 957 11.212 -2.834 5.232 1.00 0.00 C ATOM 938 C VAL A 957 10.101 -2.255 4.357 1.00 0.00 C ATOM 939 O VAL A 957 10.304 -1.963 3.177 1.00 0.00 O ATOM 940 CB VAL A 957 12.542 -2.715 4.477 1.00 0.00 C ATOM 941 CG1 VAL A 957 13.718 -3.046 5.383 1.00 0.00 C ATOM 942 CG2 VAL A 957 12.508 -3.632 3.271 1.00 0.00 C ATOM 0 H VAL A 957 10.452 -4.747 4.854 1.00 0.00 H new ATOM 0 HA VAL A 957 11.255 -2.273 6.165 1.00 0.00 H new ATOM 0 HB VAL A 957 12.675 -1.686 4.143 1.00 0.00 H new ATOM 0 HG11 VAL A 957 14.647 -2.953 4.821 1.00 0.00 H new ATOM 0 HG12 VAL A 957 13.733 -2.355 6.226 1.00 0.00 H new ATOM 0 HG13 VAL A 957 13.617 -4.067 5.752 1.00 0.00 H new ATOM 0 HG21 VAL A 957 13.450 -3.554 2.728 1.00 0.00 H new ATOM 0 HG22 VAL A 957 12.363 -4.661 3.600 1.00 0.00 H new ATOM 0 HG23 VAL A 957 11.686 -3.342 2.616 1.00 0.00 H new ATOM 952 N CYS A 958 8.932 -2.100 4.955 1.00 0.00 N ATOM 953 CA CYS A 958 7.757 -1.561 4.270 1.00 0.00 C ATOM 954 C CYS A 958 7.115 -2.605 3.368 1.00 0.00 C ATOM 955 O CYS A 958 7.799 -3.429 2.761 1.00 0.00 O ATOM 956 CB CYS A 958 8.112 -0.323 3.443 1.00 0.00 C ATOM 957 SG CYS A 958 8.791 1.061 4.410 1.00 0.00 S ATOM 0 H CYS A 958 8.765 -2.343 5.931 1.00 0.00 H new ATOM 0 HA CYS A 958 7.044 -1.275 5.043 1.00 0.00 H new ATOM 0 HB2 CYS A 958 8.837 -0.607 2.680 1.00 0.00 H new ATOM 0 HB3 CYS A 958 7.218 0.019 2.922 1.00 0.00 H new ATOM 962 N LYS A 959 5.790 -2.557 3.292 1.00 0.00 N ATOM 963 CA LYS A 959 5.028 -3.487 2.473 1.00 0.00 C ATOM 964 C LYS A 959 3.851 -2.774 1.818 1.00 0.00 C ATOM 965 O LYS A 959 3.521 -1.643 2.183 1.00 0.00 O ATOM 966 CB LYS A 959 4.537 -4.660 3.324 1.00 0.00 C ATOM 967 CG LYS A 959 5.663 -5.413 4.015 1.00 0.00 C ATOM 968 CD LYS A 959 5.136 -6.558 4.862 1.00 0.00 C ATOM 969 CE LYS A 959 6.265 -7.286 5.572 1.00 0.00 C ATOM 970 NZ LYS A 959 5.764 -8.411 6.407 1.00 0.00 N ATOM 0 H LYS A 959 5.219 -1.877 3.793 1.00 0.00 H new ATOM 0 HA LYS A 959 5.677 -3.875 1.688 1.00 0.00 H new ATOM 0 HB2 LYS A 959 3.842 -4.288 4.077 1.00 0.00 H new ATOM 0 HB3 LYS A 959 3.981 -5.352 2.691 1.00 0.00 H new ATOM 0 HG2 LYS A 959 6.354 -5.802 3.267 1.00 0.00 H new ATOM 0 HG3 LYS A 959 6.228 -4.725 4.644 1.00 0.00 H new ATOM 0 HD2 LYS A 959 4.429 -6.174 5.597 1.00 0.00 H new ATOM 0 HD3 LYS A 959 4.589 -7.258 4.231 1.00 0.00 H new ATOM 0 HE2 LYS A 959 6.971 -7.668 4.834 1.00 0.00 H new ATOM 0 HE3 LYS A 959 6.811 -6.583 6.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 959 6.566 -8.881 6.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 959 5.110 -8.044 7.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 959 5.265 -9.096 5.804 1.00 0.00 H new ATOM 984 N ARG A 960 3.233 -3.428 0.840 1.00 0.00 N ATOM 985 CA ARG A 960 2.106 -2.841 0.123 1.00 0.00 C ATOM 986 C ARG A 960 1.026 -2.376 1.098 1.00 0.00 C ATOM 987 O ARG A 960 0.466 -3.175 1.848 1.00 0.00 O ATOM 988 CB ARG A 960 1.524 -3.863 -0.859 1.00 0.00 C ATOM 989 CG ARG A 960 0.934 -3.253 -2.123 1.00 0.00 C ATOM 990 CD ARG A 960 -0.207 -2.294 -1.822 1.00 0.00 C ATOM 991 NE ARG A 960 -0.803 -1.756 -3.044 1.00 0.00 N ATOM 992 CZ ARG A 960 -0.138 -1.022 -3.933 1.00 0.00 C ATOM 993 NH1 ARG A 960 1.135 -0.711 -3.727 1.00 0.00 N ATOM 994 NH2 ARG A 960 -0.748 -0.594 -5.029 1.00 0.00 N ATOM 0 H ARG A 960 3.493 -4.363 0.526 1.00 0.00 H new ATOM 0 HA ARG A 960 2.463 -1.973 -0.432 1.00 0.00 H new ATOM 0 HB2 ARG A 960 2.308 -4.566 -1.141 1.00 0.00 H new ATOM 0 HB3 ARG A 960 0.749 -4.437 -0.351 1.00 0.00 H new ATOM 0 HG2 ARG A 960 1.716 -2.724 -2.668 1.00 0.00 H new ATOM 0 HG3 ARG A 960 0.574 -4.049 -2.774 1.00 0.00 H new ATOM 0 HD2 ARG A 960 -0.972 -2.810 -1.242 1.00 0.00 H new ATOM 0 HD3 ARG A 960 0.161 -1.474 -1.206 1.00 0.00 H new ATOM 0 HE ARG A 960 -1.787 -1.955 -3.226 1.00 0.00 H new ATOM 0 HH11 ARG A 960 1.609 -1.035 -2.884 1.00 0.00 H new ATOM 0 HH12 ARG A 960 1.640 -0.148 -4.412 1.00 0.00 H new ATOM 0 HH21 ARG A 960 -1.728 -0.827 -5.192 1.00 0.00 H new ATOM 0 HH22 ARG A 960 -0.238 -0.031 -5.710 1.00 0.00 H new ATOM 1008 N LYS A 961 0.745 -1.075 1.078 1.00 0.00 N ATOM 1009 CA LYS A 961 -0.260 -0.485 1.952 1.00 0.00 C ATOM 1010 C LYS A 961 -1.607 -1.173 1.763 1.00 0.00 C ATOM 1011 O LYS A 961 -1.924 -1.639 0.668 1.00 0.00 O ATOM 1012 CB LYS A 961 -0.398 1.009 1.658 1.00 0.00 C ATOM 1013 CG LYS A 961 -1.138 1.771 2.739 1.00 0.00 C ATOM 1014 CD LYS A 961 -0.287 1.917 3.987 1.00 0.00 C ATOM 1015 CE LYS A 961 -1.113 2.398 5.163 1.00 0.00 C ATOM 1016 NZ LYS A 961 -0.290 2.572 6.391 1.00 0.00 N ATOM 0 H LYS A 961 1.205 -0.407 0.460 1.00 0.00 H new ATOM 0 HA LYS A 961 0.060 -0.621 2.985 1.00 0.00 H new ATOM 0 HB2 LYS A 961 0.595 1.441 1.535 1.00 0.00 H new ATOM 0 HB3 LYS A 961 -0.921 1.138 0.710 1.00 0.00 H new ATOM 0 HG2 LYS A 961 -1.416 2.757 2.367 1.00 0.00 H new ATOM 0 HG3 LYS A 961 -2.064 1.251 2.986 1.00 0.00 H new ATOM 0 HD2 LYS A 961 0.173 0.959 4.230 1.00 0.00 H new ATOM 0 HD3 LYS A 961 0.523 2.621 3.797 1.00 0.00 H new ATOM 0 HE2 LYS A 961 -1.588 3.345 4.908 1.00 0.00 H new ATOM 0 HE3 LYS A 961 -1.912 1.683 5.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 961 -0.792 3.189 7.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 961 -0.124 1.645 6.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 961 0.622 3.004 6.139 1.00 0.00 H new ATOM 1030 N SER A 962 -2.399 -1.237 2.827 1.00 0.00 N ATOM 1031 CA SER A 962 -3.708 -1.873 2.752 1.00 0.00 C ATOM 1032 C SER A 962 -4.703 -1.242 3.715 1.00 0.00 C ATOM 1033 O SER A 962 -4.469 -1.173 4.921 1.00 0.00 O ATOM 1034 CB SER A 962 -3.596 -3.368 3.050 1.00 0.00 C ATOM 1035 OG SER A 962 -2.970 -3.596 4.300 1.00 0.00 O ATOM 0 H SER A 962 -2.160 -0.860 3.744 1.00 0.00 H new ATOM 0 HA SER A 962 -4.075 -1.726 1.736 1.00 0.00 H new ATOM 0 HB2 SER A 962 -4.589 -3.817 3.051 1.00 0.00 H new ATOM 0 HB3 SER A 962 -3.026 -3.857 2.260 1.00 0.00 H new ATOM 0 HG SER A 962 -3.117 -2.824 4.885 1.00 0.00 H new ATOM 1041 N CYS A 963 -5.828 -0.809 3.163 1.00 0.00 N ATOM 1042 CA CYS A 963 -6.895 -0.209 3.945 1.00 0.00 C ATOM 1043 C CYS A 963 -7.755 -1.301 4.571 1.00 0.00 C ATOM 1044 O CYS A 963 -8.017 -2.326 3.941 1.00 0.00 O ATOM 1045 CB CYS A 963 -7.743 0.693 3.049 1.00 0.00 C ATOM 1046 SG CYS A 963 -8.100 -0.035 1.418 1.00 0.00 S ATOM 0 H CYS A 963 -6.024 -0.864 2.164 1.00 0.00 H new ATOM 0 HA CYS A 963 -6.465 0.394 4.744 1.00 0.00 H new ATOM 0 HB2 CYS A 963 -8.684 0.913 3.554 1.00 0.00 H new ATOM 0 HB3 CYS A 963 -7.226 1.643 2.909 1.00 0.00 H new ATOM 1051 N LYS A 964 -8.186 -1.090 5.808 1.00 0.00 N ATOM 1052 CA LYS A 964 -9.004 -2.071 6.498 1.00 0.00 C ATOM 1053 C LYS A 964 -10.357 -2.227 5.825 1.00 0.00 C ATOM 1054 O LYS A 964 -10.988 -1.245 5.430 1.00 0.00 O ATOM 1055 CB LYS A 964 -9.190 -1.672 7.959 1.00 0.00 C ATOM 1056 CG LYS A 964 -7.992 -1.992 8.836 1.00 0.00 C ATOM 1057 CD LYS A 964 -7.720 -3.489 8.896 1.00 0.00 C ATOM 1058 CE LYS A 964 -8.881 -4.245 9.525 1.00 0.00 C ATOM 1059 NZ LYS A 964 -8.619 -5.709 9.596 1.00 0.00 N ATOM 0 H LYS A 964 -7.982 -0.250 6.350 1.00 0.00 H new ATOM 0 HA LYS A 964 -8.488 -3.030 6.453 1.00 0.00 H new ATOM 0 HB2 LYS A 964 -9.392 -0.602 8.011 1.00 0.00 H new ATOM 0 HB3 LYS A 964 -10.067 -2.182 8.357 1.00 0.00 H new ATOM 0 HG2 LYS A 964 -7.112 -1.478 8.451 1.00 0.00 H new ATOM 0 HG3 LYS A 964 -8.167 -1.614 9.843 1.00 0.00 H new ATOM 0 HD2 LYS A 964 -7.541 -3.867 7.890 1.00 0.00 H new ATOM 0 HD3 LYS A 964 -6.812 -3.672 9.471 1.00 0.00 H new ATOM 0 HE2 LYS A 964 -9.063 -3.860 10.528 1.00 0.00 H new ATOM 0 HE3 LYS A 964 -9.787 -4.066 8.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 964 -9.434 -6.187 10.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 964 -8.470 -6.082 8.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 964 -7.769 -5.882 10.170 1.00 0.00 H new ATOM 1073 N THR A 965 -10.794 -3.474 5.699 1.00 0.00 N ATOM 1074 CA THR A 965 -12.072 -3.779 5.076 1.00 0.00 C ATOM 1075 C THR A 965 -13.195 -2.990 5.739 1.00 0.00 C ATOM 1076 O THR A 965 -13.361 -3.035 6.958 1.00 0.00 O ATOM 1077 CB THR A 965 -12.387 -5.283 5.176 1.00 0.00 C ATOM 1078 OG1 THR A 965 -11.370 -6.041 4.511 1.00 0.00 O ATOM 1079 CG2 THR A 965 -13.743 -5.599 4.560 1.00 0.00 C ATOM 0 H THR A 965 -10.278 -4.292 6.022 1.00 0.00 H new ATOM 0 HA THR A 965 -12.001 -3.497 4.026 1.00 0.00 H new ATOM 0 HB THR A 965 -12.414 -5.554 6.231 1.00 0.00 H new ATOM 0 HG1 THR A 965 -11.576 -6.997 4.580 1.00 0.00 H new ATOM 0 HG21 THR A 965 -13.941 -6.668 4.644 1.00 0.00 H new ATOM 0 HG22 THR A 965 -14.520 -5.044 5.086 1.00 0.00 H new ATOM 0 HG23 THR A 965 -13.741 -5.312 3.508 1.00 0.00 H new ATOM 1087 N PRO A 966 -13.989 -2.253 4.943 1.00 0.00 N ATOM 1088 CA PRO A 966 -15.099 -1.457 5.466 1.00 0.00 C ATOM 1089 C PRO A 966 -16.160 -2.328 6.128 1.00 0.00 C ATOM 1090 O PRO A 966 -16.672 -3.265 5.514 1.00 0.00 O ATOM 1091 CB PRO A 966 -15.676 -0.772 4.221 1.00 0.00 C ATOM 1092 CG PRO A 966 -15.211 -1.605 3.076 1.00 0.00 C ATOM 1093 CD PRO A 966 -13.869 -2.141 3.480 1.00 0.00 C ATOM 0 HA PRO A 966 -14.771 -0.757 6.235 1.00 0.00 H new ATOM 0 HB2 PRO A 966 -16.764 -0.729 4.262 1.00 0.00 H new ATOM 0 HB3 PRO A 966 -15.320 0.254 4.134 1.00 0.00 H new ATOM 0 HG2 PRO A 966 -15.911 -2.416 2.872 1.00 0.00 H new ATOM 0 HG3 PRO A 966 -15.137 -1.011 2.165 1.00 0.00 H new ATOM 0 HD2 PRO A 966 -13.662 -3.106 3.016 1.00 0.00 H new ATOM 0 HD3 PRO A 966 -13.061 -1.469 3.191 1.00 0.00 H new ATOM 1101 N PRO A 967 -16.511 -2.033 7.392 1.00 0.00 N ATOM 1102 CA PRO A 967 -17.521 -2.802 8.121 1.00 0.00 C ATOM 1103 C PRO A 967 -18.828 -2.878 7.346 1.00 0.00 C ATOM 1104 O PRO A 967 -19.301 -1.874 6.814 1.00 0.00 O ATOM 1105 CB PRO A 967 -17.708 -2.015 9.420 1.00 0.00 C ATOM 1106 CG PRO A 967 -16.438 -1.256 9.592 1.00 0.00 C ATOM 1107 CD PRO A 967 -15.957 -0.934 8.205 1.00 0.00 C ATOM 0 HA PRO A 967 -17.217 -3.836 8.287 1.00 0.00 H new ATOM 0 HB2 PRO A 967 -18.564 -1.344 9.356 1.00 0.00 H new ATOM 0 HB3 PRO A 967 -17.888 -2.681 10.264 1.00 0.00 H new ATOM 0 HG2 PRO A 967 -16.602 -0.346 10.169 1.00 0.00 H new ATOM 0 HG3 PRO A 967 -15.700 -1.848 10.133 1.00 0.00 H new ATOM 0 HD2 PRO A 967 -16.319 0.038 7.869 1.00 0.00 H new ATOM 0 HD3 PRO A 967 -14.869 -0.904 8.153 1.00 0.00 H new ATOM 1115 N ASP A 968 -19.406 -4.072 7.277 1.00 0.00 N ATOM 1116 CA ASP A 968 -20.655 -4.262 6.554 1.00 0.00 C ATOM 1117 C ASP A 968 -21.737 -3.326 7.088 1.00 0.00 C ATOM 1118 O ASP A 968 -22.130 -3.411 8.252 1.00 0.00 O ATOM 1119 CB ASP A 968 -21.116 -5.720 6.654 1.00 0.00 C ATOM 1120 CG ASP A 968 -21.210 -6.215 8.086 1.00 0.00 C ATOM 1121 OD1 ASP A 968 -20.857 -5.450 9.008 1.00 0.00 O ATOM 1122 OD2 ASP A 968 -21.630 -7.374 8.285 1.00 0.00 O ATOM 0 H ASP A 968 -19.032 -4.916 7.710 1.00 0.00 H new ATOM 0 HA ASP A 968 -20.481 -4.023 5.505 1.00 0.00 H new ATOM 0 HB2 ASP A 968 -22.090 -5.821 6.176 1.00 0.00 H new ATOM 0 HB3 ASP A 968 -20.422 -6.353 6.101 1.00 0.00 H new ATOM 1127 N PRO A 969 -22.232 -2.410 6.237 1.00 0.00 N ATOM 1128 CA PRO A 969 -23.270 -1.448 6.619 1.00 0.00 C ATOM 1129 C PRO A 969 -24.591 -2.127 6.945 1.00 0.00 C ATOM 1130 O PRO A 969 -24.617 -3.241 7.466 1.00 0.00 O ATOM 1131 CB PRO A 969 -23.421 -0.556 5.377 1.00 0.00 C ATOM 1132 CG PRO A 969 -22.207 -0.816 4.552 1.00 0.00 C ATOM 1133 CD PRO A 969 -21.815 -2.235 4.836 1.00 0.00 C ATOM 0 HA PRO A 969 -22.997 -0.898 7.519 1.00 0.00 H new ATOM 0 HB2 PRO A 969 -24.330 -0.800 4.826 1.00 0.00 H new ATOM 0 HB3 PRO A 969 -23.489 0.496 5.655 1.00 0.00 H new ATOM 0 HG2 PRO A 969 -22.417 -0.673 3.492 1.00 0.00 H new ATOM 0 HG3 PRO A 969 -21.402 -0.129 4.813 1.00 0.00 H new ATOM 0 HD2 PRO A 969 -22.321 -2.936 4.172 1.00 0.00 H new ATOM 0 HD3 PRO A 969 -20.744 -2.393 4.709 1.00 0.00 H new ATOM 1141 N VAL A 970 -25.681 -1.439 6.632 1.00 0.00 N ATOM 1142 CA VAL A 970 -27.020 -1.944 6.870 1.00 0.00 C ATOM 1143 C VAL A 970 -27.241 -3.282 6.157 1.00 0.00 C ATOM 1144 O VAL A 970 -26.386 -4.164 6.189 1.00 0.00 O ATOM 1145 CB VAL A 970 -28.063 -0.910 6.403 1.00 0.00 C ATOM 1146 CG1 VAL A 970 -29.400 -1.162 7.070 1.00 0.00 C ATOM 1147 CG2 VAL A 970 -27.581 0.506 6.690 1.00 0.00 C ATOM 0 H VAL A 970 -25.658 -0.513 6.205 1.00 0.00 H new ATOM 0 HA VAL A 970 -27.137 -2.111 7.941 1.00 0.00 H new ATOM 0 HB VAL A 970 -28.191 -1.017 5.326 1.00 0.00 H new ATOM 0 HG11 VAL A 970 -30.123 -0.422 6.727 1.00 0.00 H new ATOM 0 HG12 VAL A 970 -29.753 -2.160 6.812 1.00 0.00 H new ATOM 0 HG13 VAL A 970 -29.287 -1.085 8.151 1.00 0.00 H new ATOM 0 HG21 VAL A 970 -28.331 1.221 6.353 1.00 0.00 H new ATOM 0 HG22 VAL A 970 -27.421 0.626 7.762 1.00 0.00 H new ATOM 0 HG23 VAL A 970 -26.645 0.686 6.161 1.00 0.00 H new ATOM 1157 N ASN A 971 -28.394 -3.427 5.527 1.00 0.00 N ATOM 1158 CA ASN A 971 -28.736 -4.650 4.814 1.00 0.00 C ATOM 1159 C ASN A 971 -27.932 -4.788 3.519 1.00 0.00 C ATOM 1160 O ASN A 971 -28.486 -4.700 2.423 1.00 0.00 O ATOM 1161 CB ASN A 971 -30.234 -4.681 4.505 1.00 0.00 C ATOM 1162 CG ASN A 971 -31.082 -4.680 5.762 1.00 0.00 C ATOM 1163 OD1 ASN A 971 -31.928 -3.667 5.905 1.00 0.00 O flip ATOM 1164 ND2 ASN A 971 -30.978 -5.581 6.595 1.00 0.00 N flip ATOM 0 H ASN A 971 -29.116 -2.707 5.494 1.00 0.00 H new ATOM 0 HA ASN A 971 -28.483 -5.492 5.459 1.00 0.00 H new ATOM 0 HB2 ASN A 971 -30.494 -3.817 3.893 1.00 0.00 H new ATOM 0 HB3 ASN A 971 -30.463 -5.569 3.916 1.00 0.00 H new ATOM 0 HD21 ASN A 971 -30.314 -6.341 6.444 1.00 0.00 H new ATOM 0 HD22 ASN A 971 -31.556 -5.568 7.436 1.00 0.00 H new ATOM 1171 N GLY A 972 -26.624 -5.007 3.651 1.00 0.00 N ATOM 1172 CA GLY A 972 -25.775 -5.158 2.483 1.00 0.00 C ATOM 1173 C GLY A 972 -24.419 -5.752 2.817 1.00 0.00 C ATOM 1174 O GLY A 972 -24.252 -6.381 3.863 1.00 0.00 O ATOM 0 H GLY A 972 -26.140 -5.082 4.545 1.00 0.00 H new ATOM 0 HA2 GLY A 972 -26.277 -5.795 1.754 1.00 0.00 H new ATOM 0 HA3 GLY A 972 -25.635 -4.185 2.013 1.00 0.00 H new ATOM 1178 N MET A 973 -23.448 -5.555 1.923 1.00 0.00 N ATOM 1179 CA MET A 973 -22.097 -6.080 2.121 1.00 0.00 C ATOM 1180 C MET A 973 -21.190 -5.713 0.947 1.00 0.00 C ATOM 1181 O MET A 973 -21.632 -5.677 -0.203 1.00 0.00 O ATOM 1182 CB MET A 973 -22.125 -7.604 2.290 1.00 0.00 C ATOM 1183 CG MET A 973 -22.632 -8.357 1.066 1.00 0.00 C ATOM 1184 SD MET A 973 -24.371 -8.036 0.710 1.00 0.00 S ATOM 1185 CE MET A 973 -24.625 -9.076 -0.725 1.00 0.00 C ATOM 0 H MET A 973 -23.573 -5.035 1.054 1.00 0.00 H new ATOM 0 HA MET A 973 -21.698 -5.628 3.029 1.00 0.00 H new ATOM 0 HB2 MET A 973 -21.119 -7.951 2.526 1.00 0.00 H new ATOM 0 HB3 MET A 973 -22.756 -7.853 3.143 1.00 0.00 H new ATOM 0 HG2 MET A 973 -22.032 -8.077 0.200 1.00 0.00 H new ATOM 0 HG3 MET A 973 -22.490 -9.427 1.220 1.00 0.00 H new ATOM 0 HE1 MET A 973 -25.657 -8.985 -1.062 1.00 0.00 H new ATOM 0 HE2 MET A 973 -23.953 -8.764 -1.524 1.00 0.00 H new ATOM 0 HE3 MET A 973 -24.420 -10.114 -0.463 1.00 0.00 H new ATOM 1195 N VAL A 974 -19.920 -5.440 1.244 1.00 0.00 N ATOM 1196 CA VAL A 974 -18.957 -5.081 0.208 1.00 0.00 C ATOM 1197 C VAL A 974 -18.184 -6.300 -0.275 1.00 0.00 C ATOM 1198 O VAL A 974 -17.761 -7.141 0.518 1.00 0.00 O ATOM 1199 CB VAL A 974 -17.944 -4.016 0.689 1.00 0.00 C ATOM 1200 CG1 VAL A 974 -16.958 -4.604 1.694 1.00 0.00 C ATOM 1201 CG2 VAL A 974 -17.192 -3.432 -0.497 1.00 0.00 C ATOM 0 H VAL A 974 -19.537 -5.461 2.189 1.00 0.00 H new ATOM 0 HA VAL A 974 -19.543 -4.664 -0.611 1.00 0.00 H new ATOM 0 HB VAL A 974 -18.502 -3.223 1.186 1.00 0.00 H new ATOM 0 HG11 VAL A 974 -16.259 -3.831 2.013 1.00 0.00 H new ATOM 0 HG12 VAL A 974 -17.502 -4.981 2.560 1.00 0.00 H new ATOM 0 HG13 VAL A 974 -16.407 -5.421 1.228 1.00 0.00 H new ATOM 0 HG21 VAL A 974 -16.482 -2.684 -0.145 1.00 0.00 H new ATOM 0 HG22 VAL A 974 -16.655 -4.227 -1.014 1.00 0.00 H new ATOM 0 HG23 VAL A 974 -17.900 -2.966 -1.183 1.00 0.00 H new ATOM 1211 N HIS A 975 -17.984 -6.371 -1.581 1.00 0.00 N ATOM 1212 CA HIS A 975 -17.240 -7.461 -2.183 1.00 0.00 C ATOM 1213 C HIS A 975 -16.026 -6.914 -2.923 1.00 0.00 C ATOM 1214 O HIS A 975 -16.154 -6.133 -3.870 1.00 0.00 O ATOM 1215 CB HIS A 975 -18.128 -8.274 -3.125 1.00 0.00 C ATOM 1216 CG HIS A 975 -19.099 -7.446 -3.907 1.00 0.00 C ATOM 1217 ND1 HIS A 975 -20.164 -6.787 -3.328 1.00 0.00 N ATOM 1218 CD2 HIS A 975 -19.167 -7.173 -5.228 1.00 0.00 C ATOM 1219 CE1 HIS A 975 -20.845 -6.149 -4.263 1.00 0.00 C ATOM 1220 NE2 HIS A 975 -20.260 -6.367 -5.424 1.00 0.00 N ATOM 0 H HIS A 975 -18.330 -5.680 -2.247 1.00 0.00 H new ATOM 0 HA HIS A 975 -16.898 -8.128 -1.391 1.00 0.00 H new ATOM 0 HB2 HIS A 975 -17.495 -8.826 -3.819 1.00 0.00 H new ATOM 0 HB3 HIS A 975 -18.681 -9.011 -2.542 1.00 0.00 H new ATOM 0 HD2 HIS A 975 -18.487 -7.524 -5.990 1.00 0.00 H new ATOM 0 HE1 HIS A 975 -21.730 -5.551 -4.103 1.00 0.00 H new ATOM 0 HE2 HIS A 975 -20.570 -5.997 -6.322 1.00 0.00 H new ATOM 1229 N VAL A 976 -14.847 -7.321 -2.469 1.00 0.00 N ATOM 1230 CA VAL A 976 -13.598 -6.874 -3.064 1.00 0.00 C ATOM 1231 C VAL A 976 -13.408 -7.475 -4.451 1.00 0.00 C ATOM 1232 O VAL A 976 -13.817 -8.607 -4.709 1.00 0.00 O ATOM 1233 CB VAL A 976 -12.396 -7.241 -2.174 1.00 0.00 C ATOM 1234 CG1 VAL A 976 -11.112 -6.648 -2.734 1.00 0.00 C ATOM 1235 CG2 VAL A 976 -12.634 -6.773 -0.746 1.00 0.00 C ATOM 0 H VAL A 976 -14.732 -7.964 -1.686 1.00 0.00 H new ATOM 0 HA VAL A 976 -13.651 -5.789 -3.153 1.00 0.00 H new ATOM 0 HB VAL A 976 -12.288 -8.326 -2.165 1.00 0.00 H new ATOM 0 HG11 VAL A 976 -10.275 -6.919 -2.090 1.00 0.00 H new ATOM 0 HG12 VAL A 976 -10.939 -7.037 -3.737 1.00 0.00 H new ATOM 0 HG13 VAL A 976 -11.201 -5.562 -2.776 1.00 0.00 H new ATOM 0 HG21 VAL A 976 -11.776 -7.039 -0.128 1.00 0.00 H new ATOM 0 HG22 VAL A 976 -12.767 -5.691 -0.735 1.00 0.00 H new ATOM 0 HG23 VAL A 976 -13.529 -7.253 -0.350 1.00 0.00 H new ATOM 1245 N ILE A 977 -12.789 -6.708 -5.340 1.00 0.00 N ATOM 1246 CA ILE A 977 -12.549 -7.164 -6.702 1.00 0.00 C ATOM 1247 C ILE A 977 -11.410 -8.178 -6.737 1.00 0.00 C ATOM 1248 O ILE A 977 -11.501 -9.206 -7.409 1.00 0.00 O ATOM 1249 CB ILE A 977 -12.208 -5.982 -7.633 1.00 0.00 C ATOM 1250 CG1 ILE A 977 -13.229 -4.853 -7.460 1.00 0.00 C ATOM 1251 CG2 ILE A 977 -12.161 -6.444 -9.081 1.00 0.00 C ATOM 1252 CD1 ILE A 977 -14.660 -5.273 -7.722 1.00 0.00 C ATOM 0 H ILE A 977 -12.445 -5.769 -5.142 1.00 0.00 H new ATOM 0 HA ILE A 977 -13.465 -7.637 -7.055 1.00 0.00 H new ATOM 0 HB ILE A 977 -11.224 -5.599 -7.362 1.00 0.00 H new ATOM 0 HG12 ILE A 977 -13.156 -4.463 -6.445 1.00 0.00 H new ATOM 0 HG13 ILE A 977 -12.971 -4.037 -8.135 1.00 0.00 H new ATOM 0 HG21 ILE A 977 -11.919 -5.598 -9.725 1.00 0.00 H new ATOM 0 HG22 ILE A 977 -11.398 -7.215 -9.192 1.00 0.00 H new ATOM 0 HG23 ILE A 977 -13.132 -6.850 -9.365 1.00 0.00 H new ATOM 0 HD11 ILE A 977 -15.322 -4.419 -7.579 1.00 0.00 H new ATOM 0 HD12 ILE A 977 -14.751 -5.635 -8.746 1.00 0.00 H new ATOM 0 HD13 ILE A 977 -14.938 -6.068 -7.030 1.00 0.00 H new ATOM 1264 N THR A 978 -10.346 -7.885 -5.997 1.00 0.00 N ATOM 1265 CA THR A 978 -9.189 -8.771 -5.925 1.00 0.00 C ATOM 1266 C THR A 978 -8.546 -8.702 -4.550 1.00 0.00 C ATOM 1267 O THR A 978 -8.334 -9.721 -3.894 1.00 0.00 O ATOM 1268 CB THR A 978 -8.117 -8.397 -6.967 1.00 0.00 C ATOM 1269 OG1 THR A 978 -7.636 -7.071 -6.722 1.00 0.00 O ATOM 1270 CG2 THR A 978 -8.672 -8.481 -8.376 1.00 0.00 C ATOM 0 H THR A 978 -10.261 -7.037 -5.436 1.00 0.00 H new ATOM 0 HA THR A 978 -9.555 -9.778 -6.127 1.00 0.00 H new ATOM 0 HB THR A 978 -7.296 -9.108 -6.875 1.00 0.00 H new ATOM 0 HG1 THR A 978 -6.954 -6.842 -7.388 1.00 0.00 H new ATOM 0 HG21 THR A 978 -7.894 -8.212 -9.090 1.00 0.00 H new ATOM 0 HG22 THR A 978 -9.010 -9.498 -8.574 1.00 0.00 H new ATOM 0 HG23 THR A 978 -9.512 -7.793 -8.478 1.00 0.00 H new ATOM 1278 N ASP A 979 -8.230 -7.483 -4.135 1.00 0.00 N ATOM 1279 CA ASP A 979 -7.594 -7.237 -2.850 1.00 0.00 C ATOM 1280 C ASP A 979 -7.850 -5.802 -2.405 1.00 0.00 C ATOM 1281 O ASP A 979 -8.022 -4.914 -3.237 1.00 0.00 O ATOM 1282 CB ASP A 979 -6.092 -7.496 -2.960 1.00 0.00 C ATOM 1283 CG ASP A 979 -5.763 -8.965 -3.141 1.00 0.00 C ATOM 1284 OD1 ASP A 979 -6.115 -9.766 -2.249 1.00 0.00 O ATOM 1285 OD2 ASP A 979 -5.154 -9.315 -4.173 1.00 0.00 O ATOM 0 H ASP A 979 -8.407 -6.639 -4.679 1.00 0.00 H new ATOM 0 HA ASP A 979 -8.017 -7.913 -2.107 1.00 0.00 H new ATOM 0 HB2 ASP A 979 -5.691 -6.932 -3.802 1.00 0.00 H new ATOM 0 HB3 ASP A 979 -5.597 -7.125 -2.063 1.00 0.00 H new ATOM 1290 N ILE A 980 -7.884 -5.571 -1.095 1.00 0.00 N ATOM 1291 CA ILE A 980 -8.131 -4.231 -0.577 1.00 0.00 C ATOM 1292 C ILE A 980 -6.838 -3.436 -0.424 1.00 0.00 C ATOM 1293 O ILE A 980 -6.725 -2.578 0.453 1.00 0.00 O ATOM 1294 CB ILE A 980 -8.872 -4.265 0.773 1.00 0.00 C ATOM 1295 CG1 ILE A 980 -8.158 -5.190 1.759 1.00 0.00 C ATOM 1296 CG2 ILE A 980 -10.315 -4.700 0.573 1.00 0.00 C ATOM 1297 CD1 ILE A 980 -8.823 -5.250 3.116 1.00 0.00 C ATOM 0 H ILE A 980 -7.745 -6.286 -0.381 1.00 0.00 H new ATOM 0 HA ILE A 980 -8.765 -3.734 -1.312 1.00 0.00 H new ATOM 0 HB ILE A 980 -8.871 -3.259 1.193 1.00 0.00 H new ATOM 0 HG12 ILE A 980 -8.117 -6.195 1.338 1.00 0.00 H new ATOM 0 HG13 ILE A 980 -7.129 -4.853 1.882 1.00 0.00 H new ATOM 0 HG21 ILE A 980 -10.826 -4.719 1.536 1.00 0.00 H new ATOM 0 HG22 ILE A 980 -10.818 -3.997 -0.091 1.00 0.00 H new ATOM 0 HG23 ILE A 980 -10.337 -5.696 0.131 1.00 0.00 H new ATOM 0 HD11 ILE A 980 -8.265 -5.924 3.765 1.00 0.00 H new ATOM 0 HD12 ILE A 980 -8.841 -4.253 3.557 1.00 0.00 H new ATOM 0 HD13 ILE A 980 -9.844 -5.616 3.005 1.00 0.00 H new ATOM 1309 N GLN A 981 -5.878 -3.704 -1.302 1.00 0.00 N ATOM 1310 CA GLN A 981 -4.607 -2.989 -1.286 1.00 0.00 C ATOM 1311 C GLN A 981 -4.771 -1.618 -1.927 1.00 0.00 C ATOM 1312 O GLN A 981 -5.506 -1.468 -2.903 1.00 0.00 O ATOM 1313 CB GLN A 981 -3.526 -3.789 -2.016 1.00 0.00 C ATOM 1314 CG GLN A 981 -2.697 -4.681 -1.102 1.00 0.00 C ATOM 1315 CD GLN A 981 -3.538 -5.631 -0.273 1.00 0.00 C ATOM 1316 OE1 GLN A 981 -3.379 -5.561 1.043 1.00 0.00 O flip ATOM 1317 NE2 GLN A 981 -4.311 -6.422 -0.808 1.00 0.00 N flip ATOM 0 H GLN A 981 -5.955 -4.411 -2.033 1.00 0.00 H new ATOM 0 HA GLN A 981 -4.296 -2.861 -0.249 1.00 0.00 H new ATOM 0 HB2 GLN A 981 -3.998 -4.407 -2.780 1.00 0.00 H new ATOM 0 HB3 GLN A 981 -2.861 -3.096 -2.532 1.00 0.00 H new ATOM 0 HG2 GLN A 981 -1.997 -5.258 -1.706 1.00 0.00 H new ATOM 0 HG3 GLN A 981 -2.103 -4.056 -0.436 1.00 0.00 H new ATOM 0 HE21 GLN A 981 -4.400 -6.440 -1.824 1.00 0.00 H new ATOM 0 HE22 GLN A 981 -4.864 -7.061 -0.236 1.00 0.00 H new ATOM 1326 N VAL A 982 -4.095 -0.617 -1.370 1.00 0.00 N ATOM 1327 CA VAL A 982 -4.182 0.742 -1.891 1.00 0.00 C ATOM 1328 C VAL A 982 -3.942 0.775 -3.396 1.00 0.00 C ATOM 1329 O VAL A 982 -2.809 0.646 -3.859 1.00 0.00 O ATOM 1330 CB VAL A 982 -3.168 1.672 -1.196 1.00 0.00 C ATOM 1331 CG1 VAL A 982 -3.172 3.050 -1.837 1.00 0.00 C ATOM 1332 CG2 VAL A 982 -3.467 1.767 0.290 1.00 0.00 C ATOM 0 H VAL A 982 -3.483 -0.722 -0.561 1.00 0.00 H new ATOM 0 HA VAL A 982 -5.192 1.096 -1.684 1.00 0.00 H new ATOM 0 HB VAL A 982 -2.172 1.247 -1.319 1.00 0.00 H new ATOM 0 HG11 VAL A 982 -2.449 3.689 -1.330 1.00 0.00 H new ATOM 0 HG12 VAL A 982 -2.904 2.962 -2.890 1.00 0.00 H new ATOM 0 HG13 VAL A 982 -4.166 3.488 -1.751 1.00 0.00 H new ATOM 0 HG21 VAL A 982 -2.742 2.427 0.766 1.00 0.00 H new ATOM 0 HG22 VAL A 982 -4.471 2.166 0.434 1.00 0.00 H new ATOM 0 HG23 VAL A 982 -3.403 0.775 0.738 1.00 0.00 H new ATOM 1342 N GLY A 983 -5.021 0.950 -4.154 1.00 0.00 N ATOM 1343 CA GLY A 983 -4.917 1.001 -5.600 1.00 0.00 C ATOM 1344 C GLY A 983 -6.180 0.522 -6.288 1.00 0.00 C ATOM 1345 O GLY A 983 -6.725 1.208 -7.152 1.00 0.00 O ATOM 0 H GLY A 983 -5.968 1.058 -3.790 1.00 0.00 H new ATOM 0 HA2 GLY A 983 -4.703 2.024 -5.910 1.00 0.00 H new ATOM 0 HA3 GLY A 983 -4.076 0.388 -5.923 1.00 0.00 H new ATOM 1349 N SER A 984 -6.647 -0.662 -5.900 1.00 0.00 N ATOM 1350 CA SER A 984 -7.853 -1.242 -6.479 1.00 0.00 C ATOM 1351 C SER A 984 -9.104 -0.570 -5.925 1.00 0.00 C ATOM 1352 O SER A 984 -9.074 0.593 -5.522 1.00 0.00 O ATOM 1353 CB SER A 984 -7.899 -2.743 -6.197 1.00 0.00 C ATOM 1354 OG SER A 984 -7.909 -2.995 -4.805 1.00 0.00 O ATOM 0 H SER A 984 -6.206 -1.239 -5.184 1.00 0.00 H new ATOM 0 HA SER A 984 -7.826 -1.078 -7.556 1.00 0.00 H new ATOM 0 HB2 SER A 984 -8.788 -3.176 -6.655 1.00 0.00 H new ATOM 0 HB3 SER A 984 -7.036 -3.229 -6.652 1.00 0.00 H new ATOM 0 HG SER A 984 -8.082 -3.946 -4.646 1.00 0.00 H new ATOM 1360 N ARG A 985 -10.201 -1.315 -5.908 1.00 0.00 N ATOM 1361 CA ARG A 985 -11.470 -0.799 -5.407 1.00 0.00 C ATOM 1362 C ARG A 985 -12.336 -1.919 -4.838 1.00 0.00 C ATOM 1363 O ARG A 985 -11.962 -3.090 -4.869 1.00 0.00 O ATOM 1364 CB ARG A 985 -12.229 -0.083 -6.524 1.00 0.00 C ATOM 1365 CG ARG A 985 -12.511 -0.967 -7.728 1.00 0.00 C ATOM 1366 CD ARG A 985 -13.394 -0.262 -8.745 1.00 0.00 C ATOM 1367 NE ARG A 985 -13.611 -1.070 -9.943 1.00 0.00 N ATOM 1368 CZ ARG A 985 -12.641 -1.424 -10.782 1.00 0.00 C ATOM 1369 NH1 ARG A 985 -11.393 -1.029 -10.566 1.00 0.00 N ATOM 1370 NH2 ARG A 985 -12.920 -2.170 -11.841 1.00 0.00 N ATOM 0 H ARG A 985 -10.239 -2.280 -6.236 1.00 0.00 H new ATOM 0 HA ARG A 985 -11.249 -0.093 -4.607 1.00 0.00 H new ATOM 0 HB2 ARG A 985 -13.173 0.291 -6.129 1.00 0.00 H new ATOM 0 HB3 ARG A 985 -11.652 0.784 -6.847 1.00 0.00 H new ATOM 0 HG2 ARG A 985 -11.570 -1.253 -8.198 1.00 0.00 H new ATOM 0 HG3 ARG A 985 -12.996 -1.886 -7.400 1.00 0.00 H new ATOM 0 HD2 ARG A 985 -14.355 -0.028 -8.288 1.00 0.00 H new ATOM 0 HD3 ARG A 985 -12.935 0.686 -9.026 1.00 0.00 H new ATOM 0 HE ARG A 985 -14.561 -1.380 -10.148 1.00 0.00 H new ATOM 0 HH11 ARG A 985 -11.174 -0.452 -9.754 1.00 0.00 H new ATOM 0 HH12 ARG A 985 -10.652 -1.303 -11.212 1.00 0.00 H new ATOM 0 HH21 ARG A 985 -13.879 -2.473 -12.013 1.00 0.00 H new ATOM 0 HH22 ARG A 985 -12.176 -2.441 -12.484 1.00 0.00 H new ATOM 1384 N ILE A 986 -13.503 -1.538 -4.325 1.00 0.00 N ATOM 1385 CA ILE A 986 -14.446 -2.493 -3.751 1.00 0.00 C ATOM 1386 C ILE A 986 -15.878 -2.101 -4.093 1.00 0.00 C ATOM 1387 O ILE A 986 -16.279 -0.954 -3.901 1.00 0.00 O ATOM 1388 CB ILE A 986 -14.300 -2.577 -2.222 1.00 0.00 C ATOM 1389 CG1 ILE A 986 -14.424 -1.184 -1.600 1.00 0.00 C ATOM 1390 CG2 ILE A 986 -12.973 -3.223 -1.851 1.00 0.00 C ATOM 1391 CD1 ILE A 986 -14.355 -1.184 -0.090 1.00 0.00 C ATOM 0 H ILE A 986 -13.819 -0.569 -4.295 1.00 0.00 H new ATOM 0 HA ILE A 986 -14.219 -3.469 -4.180 1.00 0.00 H new ATOM 0 HB ILE A 986 -15.102 -3.200 -1.826 1.00 0.00 H new ATOM 0 HG12 ILE A 986 -13.629 -0.549 -1.991 1.00 0.00 H new ATOM 0 HG13 ILE A 986 -15.369 -0.740 -1.912 1.00 0.00 H new ATOM 0 HG21 ILE A 986 -12.885 -3.275 -0.766 1.00 0.00 H new ATOM 0 HG22 ILE A 986 -12.929 -4.229 -2.268 1.00 0.00 H new ATOM 0 HG23 ILE A 986 -12.153 -2.628 -2.254 1.00 0.00 H new ATOM 0 HD11 ILE A 986 -14.450 -0.163 0.279 1.00 0.00 H new ATOM 0 HD12 ILE A 986 -15.166 -1.791 0.311 1.00 0.00 H new ATOM 0 HD13 ILE A 986 -13.399 -1.598 0.231 1.00 0.00 H new ATOM 1403 N THR A 987 -16.646 -3.058 -4.601 1.00 0.00 N ATOM 1404 CA THR A 987 -18.031 -2.799 -4.967 1.00 0.00 C ATOM 1405 C THR A 987 -18.991 -3.250 -3.878 1.00 0.00 C ATOM 1406 O THR A 987 -18.818 -4.310 -3.283 1.00 0.00 O ATOM 1407 CB THR A 987 -18.409 -3.479 -6.292 1.00 0.00 C ATOM 1408 OG1 THR A 987 -17.837 -4.790 -6.358 1.00 0.00 O ATOM 1409 CG2 THR A 987 -17.941 -2.644 -7.471 1.00 0.00 C ATOM 0 H THR A 987 -16.334 -4.015 -4.768 1.00 0.00 H new ATOM 0 HA THR A 987 -18.118 -1.720 -5.091 1.00 0.00 H new ATOM 0 HB THR A 987 -19.495 -3.566 -6.337 1.00 0.00 H new ATOM 0 HG1 THR A 987 -18.086 -5.213 -7.206 1.00 0.00 H new ATOM 0 HG21 THR A 987 -18.217 -3.141 -8.401 1.00 0.00 H new ATOM 0 HG22 THR A 987 -18.412 -1.662 -7.431 1.00 0.00 H new ATOM 0 HG23 THR A 987 -16.858 -2.529 -7.429 1.00 0.00 H new ATOM 1417 N TYR A 988 -20.004 -2.431 -3.624 1.00 0.00 N ATOM 1418 CA TYR A 988 -21.002 -2.740 -2.604 1.00 0.00 C ATOM 1419 C TYR A 988 -22.316 -3.171 -3.245 1.00 0.00 C ATOM 1420 O TYR A 988 -22.643 -2.748 -4.353 1.00 0.00 O ATOM 1421 CB TYR A 988 -21.245 -1.534 -1.695 1.00 0.00 C ATOM 1422 CG TYR A 988 -20.020 -1.067 -0.940 1.00 0.00 C ATOM 1423 CD1 TYR A 988 -18.941 -0.498 -1.607 1.00 0.00 C ATOM 1424 CD2 TYR A 988 -19.950 -1.181 0.443 1.00 0.00 C ATOM 1425 CE1 TYR A 988 -17.827 -0.060 -0.917 1.00 0.00 C ATOM 1426 CE2 TYR A 988 -18.841 -0.742 1.140 1.00 0.00 C ATOM 1427 CZ TYR A 988 -17.782 -0.183 0.457 1.00 0.00 C ATOM 1428 OH TYR A 988 -16.678 0.257 1.147 1.00 0.00 O ATOM 0 H TYR A 988 -20.157 -1.547 -4.110 1.00 0.00 H new ATOM 0 HA TYR A 988 -20.615 -3.562 -2.002 1.00 0.00 H new ATOM 0 HB2 TYR A 988 -21.622 -0.709 -2.299 1.00 0.00 H new ATOM 0 HB3 TYR A 988 -22.026 -1.786 -0.977 1.00 0.00 H new ATOM 0 HD1 TYR A 988 -18.974 -0.397 -2.682 1.00 0.00 H new ATOM 0 HD2 TYR A 988 -20.776 -1.620 0.982 1.00 0.00 H new ATOM 0 HE1 TYR A 988 -16.995 0.377 -1.450 1.00 0.00 H new ATOM 0 HE2 TYR A 988 -18.804 -0.836 2.215 1.00 0.00 H new ATOM 0 HH TYR A 988 -16.947 0.551 2.042 1.00 0.00 H new ATOM 1438 N SER A 989 -23.073 -4.009 -2.540 1.00 0.00 N ATOM 1439 CA SER A 989 -24.355 -4.479 -3.052 1.00 0.00 C ATOM 1440 C SER A 989 -25.341 -4.740 -1.919 1.00 0.00 C ATOM 1441 O SER A 989 -25.147 -5.642 -1.105 1.00 0.00 O ATOM 1442 CB SER A 989 -24.165 -5.755 -3.874 1.00 0.00 C ATOM 1443 OG SER A 989 -25.402 -6.228 -4.378 1.00 0.00 O ATOM 0 H SER A 989 -22.823 -4.373 -1.621 1.00 0.00 H new ATOM 0 HA SER A 989 -24.764 -3.696 -3.691 1.00 0.00 H new ATOM 0 HB2 SER A 989 -23.483 -5.560 -4.701 1.00 0.00 H new ATOM 0 HB3 SER A 989 -23.703 -6.524 -3.255 1.00 0.00 H new ATOM 0 HG SER A 989 -25.252 -7.043 -4.901 1.00 0.00 H new ATOM 1449 N CYS A 990 -26.405 -3.944 -1.884 1.00 0.00 N ATOM 1450 CA CYS A 990 -27.437 -4.084 -0.864 1.00 0.00 C ATOM 1451 C CYS A 990 -28.479 -5.109 -1.294 1.00 0.00 C ATOM 1452 O CYS A 990 -28.790 -5.231 -2.479 1.00 0.00 O ATOM 1453 CB CYS A 990 -28.114 -2.737 -0.597 1.00 0.00 C ATOM 1454 SG CYS A 990 -26.992 -1.442 0.027 1.00 0.00 S ATOM 0 H CYS A 990 -26.575 -3.193 -2.553 1.00 0.00 H new ATOM 0 HA CYS A 990 -26.962 -4.429 0.054 1.00 0.00 H new ATOM 0 HB2 CYS A 990 -28.576 -2.387 -1.520 1.00 0.00 H new ATOM 0 HB3 CYS A 990 -28.917 -2.884 0.125 1.00 0.00 H new ATOM 1459 N THR A 991 -29.022 -5.841 -0.327 1.00 0.00 N ATOM 1460 CA THR A 991 -30.034 -6.848 -0.614 1.00 0.00 C ATOM 1461 C THR A 991 -31.298 -6.200 -1.166 1.00 0.00 C ATOM 1462 O THR A 991 -31.640 -5.076 -0.797 1.00 0.00 O ATOM 1463 CB THR A 991 -30.388 -7.666 0.641 1.00 0.00 C ATOM 1464 OG1 THR A 991 -31.424 -8.609 0.338 1.00 0.00 O ATOM 1465 CG2 THR A 991 -30.838 -6.756 1.772 1.00 0.00 C ATOM 0 H THR A 991 -28.778 -5.755 0.660 1.00 0.00 H new ATOM 0 HA THR A 991 -29.615 -7.521 -1.362 1.00 0.00 H new ATOM 0 HB THR A 991 -29.494 -8.201 0.961 1.00 0.00 H new ATOM 0 HG1 THR A 991 -31.641 -9.126 1.142 1.00 0.00 H new ATOM 0 HG21 THR A 991 -31.083 -7.357 2.648 1.00 0.00 H new ATOM 0 HG22 THR A 991 -30.036 -6.062 2.021 1.00 0.00 H new ATOM 0 HG23 THR A 991 -31.719 -6.195 1.459 1.00 0.00 H new ATOM 1473 N THR A 992 -31.980 -6.911 -2.062 1.00 0.00 N ATOM 1474 CA THR A 992 -33.201 -6.404 -2.683 1.00 0.00 C ATOM 1475 C THR A 992 -34.121 -5.753 -1.654 1.00 0.00 C ATOM 1476 O THR A 992 -34.409 -6.330 -0.606 1.00 0.00 O ATOM 1477 CB THR A 992 -33.970 -7.528 -3.403 1.00 0.00 C ATOM 1478 OG1 THR A 992 -33.139 -8.126 -4.405 1.00 0.00 O ATOM 1479 CG2 THR A 992 -35.240 -6.991 -4.048 1.00 0.00 C ATOM 0 H THR A 992 -31.706 -7.843 -2.375 1.00 0.00 H new ATOM 0 HA THR A 992 -32.894 -5.654 -3.412 1.00 0.00 H new ATOM 0 HB THR A 992 -34.247 -8.279 -2.663 1.00 0.00 H new ATOM 0 HG1 THR A 992 -33.634 -8.841 -4.857 1.00 0.00 H new ATOM 0 HG21 THR A 992 -35.765 -7.804 -4.550 1.00 0.00 H new ATOM 0 HG22 THR A 992 -35.884 -6.562 -3.281 1.00 0.00 H new ATOM 0 HG23 THR A 992 -34.981 -6.222 -4.776 1.00 0.00 H new ATOM 1487 N GLY A 993 -34.576 -4.542 -1.966 1.00 0.00 N ATOM 1488 CA GLY A 993 -35.457 -3.820 -1.067 1.00 0.00 C ATOM 1489 C GLY A 993 -34.922 -2.444 -0.721 1.00 0.00 C ATOM 1490 O GLY A 993 -35.640 -1.448 -0.818 1.00 0.00 O ATOM 0 H GLY A 993 -34.349 -4.048 -2.829 1.00 0.00 H new ATOM 0 HA2 GLY A 993 -36.440 -3.720 -1.527 1.00 0.00 H new ATOM 0 HA3 GLY A 993 -35.591 -4.396 -0.152 1.00 0.00 H new ATOM 1494 N HIS A 994 -33.657 -2.390 -0.315 1.00 0.00 N ATOM 1495 CA HIS A 994 -33.018 -1.135 0.047 1.00 0.00 C ATOM 1496 C HIS A 994 -32.113 -0.647 -1.079 1.00 0.00 C ATOM 1497 O HIS A 994 -31.406 -1.437 -1.706 1.00 0.00 O ATOM 1498 CB HIS A 994 -32.201 -1.314 1.328 1.00 0.00 C ATOM 1499 CG HIS A 994 -32.987 -1.883 2.469 1.00 0.00 C ATOM 1500 ND1 HIS A 994 -33.643 -3.093 2.401 1.00 0.00 N ATOM 1501 CD2 HIS A 994 -33.216 -1.404 3.715 1.00 0.00 C ATOM 1502 CE1 HIS A 994 -34.242 -3.334 3.554 1.00 0.00 C ATOM 1503 NE2 HIS A 994 -33.997 -2.324 4.369 1.00 0.00 N ATOM 0 H HIS A 994 -33.053 -3.208 -0.229 1.00 0.00 H new ATOM 0 HA HIS A 994 -33.795 -0.390 0.216 1.00 0.00 H new ATOM 0 HB2 HIS A 994 -31.354 -1.968 1.120 1.00 0.00 H new ATOM 0 HB3 HIS A 994 -31.792 -0.348 1.626 1.00 0.00 H new ATOM 0 HD2 HIS A 994 -32.852 -0.471 4.119 1.00 0.00 H new ATOM 0 HE1 HIS A 994 -34.831 -4.208 3.790 1.00 0.00 H new ATOM 0 HE2 HIS A 994 -34.333 -2.241 5.328 1.00 0.00 H new ATOM 1512 N ARG A 995 -32.132 0.656 -1.324 1.00 0.00 N ATOM 1513 CA ARG A 995 -31.309 1.251 -2.366 1.00 0.00 C ATOM 1514 C ARG A 995 -29.968 1.693 -1.794 1.00 0.00 C ATOM 1515 O ARG A 995 -29.901 2.207 -0.678 1.00 0.00 O ATOM 1516 CB ARG A 995 -32.023 2.449 -2.994 1.00 0.00 C ATOM 1517 CG ARG A 995 -32.358 3.548 -1.996 1.00 0.00 C ATOM 1518 CD ARG A 995 -33.090 4.701 -2.664 1.00 0.00 C ATOM 1519 NE ARG A 995 -33.449 5.750 -1.714 1.00 0.00 N ATOM 1520 CZ ARG A 995 -32.561 6.520 -1.092 1.00 0.00 C ATOM 1521 NH1 ARG A 995 -31.266 6.379 -1.339 1.00 0.00 N ATOM 1522 NH2 ARG A 995 -32.969 7.440 -0.227 1.00 0.00 N ATOM 0 H ARG A 995 -32.711 1.323 -0.813 1.00 0.00 H new ATOM 0 HA ARG A 995 -31.137 0.499 -3.136 1.00 0.00 H new ATOM 0 HB2 ARG A 995 -31.395 2.864 -3.782 1.00 0.00 H new ATOM 0 HB3 ARG A 995 -32.943 2.106 -3.467 1.00 0.00 H new ATOM 0 HG2 ARG A 995 -32.974 3.139 -1.196 1.00 0.00 H new ATOM 0 HG3 ARG A 995 -31.441 3.915 -1.536 1.00 0.00 H new ATOM 0 HD2 ARG A 995 -32.461 5.123 -3.448 1.00 0.00 H new ATOM 0 HD3 ARG A 995 -33.992 4.326 -3.146 1.00 0.00 H new ATOM 0 HE ARG A 995 -34.438 5.901 -1.516 1.00 0.00 H new ATOM 0 HH11 ARG A 995 -30.948 5.678 -2.008 1.00 0.00 H new ATOM 0 HH12 ARG A 995 -30.588 6.972 -0.860 1.00 0.00 H new ATOM 0 HH21 ARG A 995 -33.965 7.557 -0.039 1.00 0.00 H new ATOM 0 HH22 ARG A 995 -32.287 8.030 0.250 1.00 0.00 H new ATOM 1536 N LEU A 996 -28.904 1.481 -2.558 1.00 0.00 N ATOM 1537 CA LEU A 996 -27.568 1.856 -2.119 1.00 0.00 C ATOM 1538 C LEU A 996 -27.400 3.373 -2.134 1.00 0.00 C ATOM 1539 O LEU A 996 -27.709 4.032 -3.127 1.00 0.00 O ATOM 1540 CB LEU A 996 -26.513 1.189 -3.010 1.00 0.00 C ATOM 1541 CG LEU A 996 -25.059 1.479 -2.643 1.00 0.00 C ATOM 1542 CD1 LEU A 996 -24.156 0.339 -3.085 1.00 0.00 C ATOM 1543 CD2 LEU A 996 -24.618 2.787 -3.264 1.00 0.00 C ATOM 0 H LEU A 996 -28.941 1.052 -3.483 1.00 0.00 H new ATOM 0 HA LEU A 996 -27.430 1.510 -1.095 1.00 0.00 H new ATOM 0 HB2 LEU A 996 -26.668 0.110 -2.980 1.00 0.00 H new ATOM 0 HB3 LEU A 996 -26.679 1.507 -4.039 1.00 0.00 H new ATOM 0 HG LEU A 996 -24.982 1.566 -1.559 1.00 0.00 H new ATOM 0 HD11 LEU A 996 -23.125 0.566 -2.814 1.00 0.00 H new ATOM 0 HD12 LEU A 996 -24.466 -0.583 -2.593 1.00 0.00 H new ATOM 0 HD13 LEU A 996 -24.228 0.215 -4.166 1.00 0.00 H new ATOM 0 HD21 LEU A 996 -23.580 2.985 -2.997 1.00 0.00 H new ATOM 0 HD22 LEU A 996 -24.708 2.723 -4.348 1.00 0.00 H new ATOM 0 HD23 LEU A 996 -25.248 3.596 -2.895 1.00 0.00 H new ATOM 1555 N ILE A 997 -26.902 3.916 -1.029 1.00 0.00 N ATOM 1556 CA ILE A 997 -26.681 5.352 -0.911 1.00 0.00 C ATOM 1557 C ILE A 997 -25.210 5.695 -1.137 1.00 0.00 C ATOM 1558 O ILE A 997 -24.319 5.046 -0.590 1.00 0.00 O ATOM 1559 CB ILE A 997 -27.135 5.887 0.470 1.00 0.00 C ATOM 1560 CG1 ILE A 997 -28.651 6.069 0.512 1.00 0.00 C ATOM 1561 CG2 ILE A 997 -26.452 7.194 0.801 1.00 0.00 C ATOM 1562 CD1 ILE A 997 -29.415 4.774 0.533 1.00 0.00 C ATOM 0 H ILE A 997 -26.643 3.381 -0.200 1.00 0.00 H new ATOM 0 HA ILE A 997 -27.283 5.834 -1.681 1.00 0.00 H new ATOM 0 HB ILE A 997 -26.848 5.147 1.217 1.00 0.00 H new ATOM 0 HG12 ILE A 997 -28.914 6.650 1.396 1.00 0.00 H new ATOM 0 HG13 ILE A 997 -28.962 6.650 -0.356 1.00 0.00 H new ATOM 0 HG21 ILE A 997 -26.791 7.545 1.776 1.00 0.00 H new ATOM 0 HG22 ILE A 997 -25.372 7.045 0.824 1.00 0.00 H new ATOM 0 HG23 ILE A 997 -26.700 7.936 0.042 1.00 0.00 H new ATOM 0 HD11 ILE A 997 -30.484 4.983 0.563 1.00 0.00 H new ATOM 0 HD12 ILE A 997 -29.182 4.200 -0.364 1.00 0.00 H new ATOM 0 HD13 ILE A 997 -29.133 4.199 1.415 1.00 0.00 H new ATOM 1574 N GLY A 998 -24.971 6.719 -1.953 1.00 0.00 N ATOM 1575 CA GLY A 998 -23.613 7.141 -2.254 1.00 0.00 C ATOM 1576 C GLY A 998 -23.030 6.409 -3.448 1.00 0.00 C ATOM 1577 O GLY A 998 -23.768 5.927 -4.308 1.00 0.00 O ATOM 0 H GLY A 998 -25.698 7.267 -2.413 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -23.604 8.213 -2.449 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -22.981 6.970 -1.383 1.00 0.00 H new ATOM 1581 N HIS A 999 -21.703 6.326 -3.506 1.00 0.00 N ATOM 1582 CA HIS A 999 -21.029 5.647 -4.611 1.00 0.00 C ATOM 1583 C HIS A 999 -20.980 4.143 -4.369 1.00 0.00 C ATOM 1584 O HIS A 999 -20.488 3.693 -3.338 1.00 0.00 O ATOM 1585 CB HIS A 999 -19.604 6.185 -4.788 1.00 0.00 C ATOM 1586 CG HIS A 999 -19.523 7.672 -4.967 1.00 0.00 C ATOM 1587 ND1 HIS A 999 -18.360 8.323 -5.323 1.00 0.00 N ATOM 1588 CD2 HIS A 999 -20.461 8.639 -4.826 1.00 0.00 C ATOM 1589 CE1 HIS A 999 -18.586 9.622 -5.393 1.00 0.00 C ATOM 1590 NE2 HIS A 999 -19.854 9.839 -5.098 1.00 0.00 N ATOM 0 H HIS A 999 -21.075 6.718 -2.804 1.00 0.00 H new ATOM 0 HA HIS A 999 -21.598 5.842 -5.520 1.00 0.00 H new ATOM 0 HB2 HIS A 999 -19.011 5.903 -3.918 1.00 0.00 H new ATOM 0 HB3 HIS A 999 -19.151 5.701 -5.653 1.00 0.00 H new ATOM 0 HD2 HIS A 999 -21.495 8.493 -4.551 1.00 0.00 H new ATOM 0 HE1 HIS A 999 -17.858 10.378 -5.648 1.00 0.00 H new ATOM 0 HE2 HIS A 999 -20.309 10.752 -5.076 1.00 0.00 H new ATOM 1599 N SER A1000 -21.481 3.368 -5.327 1.00 0.00 N ATOM 1600 CA SER A1000 -21.484 1.912 -5.206 1.00 0.00 C ATOM 1601 C SER A1000 -20.080 1.341 -5.400 1.00 0.00 C ATOM 1602 O SER A1000 -19.908 0.132 -5.562 1.00 0.00 O ATOM 1603 CB SER A1000 -22.442 1.298 -6.229 1.00 0.00 C ATOM 1604 OG SER A1000 -22.476 -0.114 -6.115 1.00 0.00 O ATOM 0 H SER A1000 -21.889 3.721 -6.193 1.00 0.00 H new ATOM 0 HA SER A1000 -21.821 1.658 -4.201 1.00 0.00 H new ATOM 0 HB2 SER A1000 -23.444 1.702 -6.081 1.00 0.00 H new ATOM 0 HB3 SER A1000 -22.131 1.577 -7.236 1.00 0.00 H new ATOM 0 HG SER A1000 -21.586 -0.444 -5.872 1.00 0.00 H new ATOM 1610 N SER A1001 -19.079 2.217 -5.379 1.00 0.00 N ATOM 1611 CA SER A1001 -17.692 1.803 -5.552 1.00 0.00 C ATOM 1612 C SER A1001 -16.740 2.826 -4.941 1.00 0.00 C ATOM 1613 O SER A1001 -17.048 4.016 -4.881 1.00 0.00 O ATOM 1614 CB SER A1001 -17.374 1.618 -7.037 1.00 0.00 C ATOM 1615 OG SER A1001 -17.569 2.823 -7.756 1.00 0.00 O ATOM 0 H SER A1001 -19.204 3.220 -5.243 1.00 0.00 H new ATOM 0 HA SER A1001 -17.556 0.852 -5.037 1.00 0.00 H new ATOM 0 HB2 SER A1001 -16.342 1.285 -7.152 1.00 0.00 H new ATOM 0 HB3 SER A1001 -18.009 0.836 -7.453 1.00 0.00 H new ATOM 0 HG SER A1001 -17.357 2.678 -8.702 1.00 0.00 H new ATOM 1621 N ALA A1002 -15.583 2.354 -4.488 1.00 0.00 N ATOM 1622 CA ALA A1002 -14.586 3.228 -3.880 1.00 0.00 C ATOM 1623 C ALA A1002 -13.181 2.671 -4.070 1.00 0.00 C ATOM 1624 O ALA A1002 -12.948 1.473 -3.897 1.00 0.00 O ATOM 1625 CB ALA A1002 -14.886 3.421 -2.401 1.00 0.00 C ATOM 0 H ALA A1002 -15.313 1.371 -4.530 1.00 0.00 H new ATOM 0 HA ALA A1002 -14.634 4.197 -4.378 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -14.134 4.075 -1.960 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -15.872 3.871 -2.285 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -14.867 2.455 -1.897 1.00 0.00 H new ATOM 1631 N GLU A1003 -12.250 3.547 -4.434 1.00 0.00 N ATOM 1632 CA GLU A1003 -10.864 3.150 -4.659 1.00 0.00 C ATOM 1633 C GLU A1003 -10.018 3.374 -3.413 1.00 0.00 C ATOM 1634 O GLU A1003 -10.008 4.467 -2.848 1.00 0.00 O ATOM 1635 CB GLU A1003 -10.267 3.947 -5.820 1.00 0.00 C ATOM 1636 CG GLU A1003 -8.858 3.519 -6.195 1.00 0.00 C ATOM 1637 CD GLU A1003 -8.274 4.354 -7.318 1.00 0.00 C ATOM 1638 OE1 GLU A1003 -8.865 4.367 -8.418 1.00 0.00 O ATOM 1639 OE2 GLU A1003 -7.226 4.996 -7.096 1.00 0.00 O ATOM 0 H GLU A1003 -12.431 4.540 -4.580 1.00 0.00 H new ATOM 0 HA GLU A1003 -10.860 2.087 -4.900 1.00 0.00 H new ATOM 0 HB2 GLU A1003 -10.913 3.842 -6.691 1.00 0.00 H new ATOM 0 HB3 GLU A1003 -10.258 5.005 -5.556 1.00 0.00 H new ATOM 0 HG2 GLU A1003 -8.214 3.594 -5.319 1.00 0.00 H new ATOM 0 HG3 GLU A1003 -8.868 2.471 -6.494 1.00 0.00 H new ATOM 1646 N CYS A1004 -9.288 2.343 -3.002 1.00 0.00 N ATOM 1647 CA CYS A1004 -8.420 2.452 -1.837 1.00 0.00 C ATOM 1648 C CYS A1004 -7.228 3.335 -2.183 1.00 0.00 C ATOM 1649 O CYS A1004 -6.507 3.063 -3.143 1.00 0.00 O ATOM 1650 CB CYS A1004 -7.945 1.064 -1.401 1.00 0.00 C ATOM 1651 SG CYS A1004 -6.962 1.050 0.133 1.00 0.00 S ATOM 0 H CYS A1004 -9.280 1.429 -3.455 1.00 0.00 H new ATOM 0 HA CYS A1004 -8.973 2.899 -1.011 1.00 0.00 H new ATOM 0 HB2 CYS A1004 -8.815 0.422 -1.266 1.00 0.00 H new ATOM 0 HB3 CYS A1004 -7.349 0.629 -2.203 1.00 0.00 H new ATOM 1656 N ILE A1005 -7.034 4.406 -1.422 1.00 0.00 N ATOM 1657 CA ILE A1005 -5.936 5.325 -1.690 1.00 0.00 C ATOM 1658 C ILE A1005 -5.167 5.691 -0.424 1.00 0.00 C ATOM 1659 O ILE A1005 -5.100 4.908 0.526 1.00 0.00 O ATOM 1660 CB ILE A1005 -6.452 6.611 -2.366 1.00 0.00 C ATOM 1661 CG1 ILE A1005 -7.491 7.299 -1.476 1.00 0.00 C ATOM 1662 CG2 ILE A1005 -7.040 6.287 -3.733 1.00 0.00 C ATOM 1663 CD1 ILE A1005 -8.020 8.597 -2.046 1.00 0.00 C ATOM 0 H ILE A1005 -7.616 4.657 -0.623 1.00 0.00 H new ATOM 0 HA ILE A1005 -5.253 4.807 -2.363 1.00 0.00 H new ATOM 0 HB ILE A1005 -5.616 7.296 -2.506 1.00 0.00 H new ATOM 0 HG12 ILE A1005 -8.326 6.617 -1.314 1.00 0.00 H new ATOM 0 HG13 ILE A1005 -7.047 7.496 -0.500 1.00 0.00 H new ATOM 0 HG21 ILE A1005 -7.401 7.203 -4.200 1.00 0.00 H new ATOM 0 HG22 ILE A1005 -6.272 5.837 -4.362 1.00 0.00 H new ATOM 0 HG23 ILE A1005 -7.869 5.588 -3.616 1.00 0.00 H new ATOM 0 HD11 ILE A1005 -8.751 9.025 -1.360 1.00 0.00 H new ATOM 0 HD12 ILE A1005 -7.196 9.297 -2.182 1.00 0.00 H new ATOM 0 HD13 ILE A1005 -8.495 8.405 -3.008 1.00 0.00 H new ATOM 1675 N LEU A1006 -4.578 6.885 -0.423 1.00 0.00 N ATOM 1676 CA LEU A1006 -3.793 7.352 0.716 1.00 0.00 C ATOM 1677 C LEU A1006 -3.824 8.873 0.827 1.00 0.00 C ATOM 1678 O LEU A1006 -3.583 9.583 -0.150 1.00 0.00 O ATOM 1679 CB LEU A1006 -2.342 6.890 0.563 1.00 0.00 C ATOM 1680 CG LEU A1006 -1.375 7.411 1.628 1.00 0.00 C ATOM 1681 CD1 LEU A1006 -1.559 6.656 2.932 1.00 0.00 C ATOM 1682 CD2 LEU A1006 0.061 7.284 1.144 1.00 0.00 C ATOM 0 H LEU A1006 -4.630 7.546 -1.198 1.00 0.00 H new ATOM 0 HA LEU A1006 -4.230 6.931 1.621 1.00 0.00 H new ATOM 0 HB2 LEU A1006 -2.321 5.800 0.579 1.00 0.00 H new ATOM 0 HB3 LEU A1006 -1.980 7.202 -0.417 1.00 0.00 H new ATOM 0 HG LEU A1006 -1.593 8.464 1.806 1.00 0.00 H new ATOM 0 HD11 LEU A1006 -0.862 7.041 3.677 1.00 0.00 H new ATOM 0 HD12 LEU A1006 -2.581 6.788 3.288 1.00 0.00 H new ATOM 0 HD13 LEU A1006 -1.366 5.596 2.769 1.00 0.00 H new ATOM 0 HD21 LEU A1006 0.738 7.658 1.912 1.00 0.00 H new ATOM 0 HD22 LEU A1006 0.285 6.237 0.942 1.00 0.00 H new ATOM 0 HD23 LEU A1006 0.190 7.866 0.231 1.00 0.00 H new ATOM 1694 N SER A1007 -4.100 9.366 2.031 1.00 0.00 N ATOM 1695 CA SER A1007 -4.137 10.802 2.277 1.00 0.00 C ATOM 1696 C SER A1007 -2.775 11.285 2.765 1.00 0.00 C ATOM 1697 O SER A1007 -2.681 12.229 3.550 1.00 0.00 O ATOM 1698 CB SER A1007 -5.213 11.138 3.311 1.00 0.00 C ATOM 1699 OG SER A1007 -5.296 12.536 3.529 1.00 0.00 O ATOM 0 H SER A1007 -4.301 8.792 2.850 1.00 0.00 H new ATOM 0 HA SER A1007 -4.380 11.309 1.343 1.00 0.00 H new ATOM 0 HB2 SER A1007 -6.178 10.763 2.971 1.00 0.00 H new ATOM 0 HB3 SER A1007 -4.988 10.634 4.251 1.00 0.00 H new ATOM 0 HG SER A1007 -4.393 12.908 3.613 1.00 0.00 H new ATOM 1705 N GLY A1008 -1.722 10.624 2.292 1.00 0.00 N ATOM 1706 CA GLY A1008 -0.372 10.985 2.686 1.00 0.00 C ATOM 1707 C GLY A1008 -0.014 10.487 4.075 1.00 0.00 C ATOM 1708 O GLY A1008 1.044 9.889 4.273 1.00 0.00 O ATOM 0 H GLY A1008 -1.781 9.842 1.640 1.00 0.00 H new ATOM 0 HA2 GLY A1008 0.335 10.575 1.964 1.00 0.00 H new ATOM 0 HA3 GLY A1008 -0.267 12.069 2.655 1.00 0.00 H new ATOM 1712 N ASN A1009 -0.895 10.736 5.041 1.00 0.00 N ATOM 1713 CA ASN A1009 -0.664 10.313 6.419 1.00 0.00 C ATOM 1714 C ASN A1009 -1.146 8.884 6.649 1.00 0.00 C ATOM 1715 O ASN A1009 -0.460 8.082 7.282 1.00 0.00 O ATOM 1716 CB ASN A1009 -1.380 11.252 7.388 1.00 0.00 C ATOM 1717 CG ASN A1009 -0.975 12.701 7.200 1.00 0.00 C ATOM 1718 OD1 ASN A1009 0.197 13.053 7.338 1.00 0.00 O ATOM 1719 ND2 ASN A1009 -1.945 13.550 6.884 1.00 0.00 N ATOM 0 H ASN A1009 -1.776 11.229 4.894 1.00 0.00 H new ATOM 0 HA ASN A1009 0.410 10.350 6.600 1.00 0.00 H new ATOM 0 HB2 ASN A1009 -2.457 11.159 7.250 1.00 0.00 H new ATOM 0 HB3 ASN A1009 -1.162 10.947 8.412 1.00 0.00 H new ATOM 0 HD21 ASN A1009 -1.733 14.538 6.745 1.00 0.00 H new ATOM 0 HD22 ASN A1009 -2.903 13.214 6.780 1.00 0.00 H new ATOM 1726 N THR A1010 -2.339 8.581 6.148 1.00 0.00 N ATOM 1727 CA THR A1010 -2.926 7.257 6.318 1.00 0.00 C ATOM 1728 C THR A1010 -3.769 6.861 5.108 1.00 0.00 C ATOM 1729 O THR A1010 -4.374 7.710 4.454 1.00 0.00 O ATOM 1730 CB THR A1010 -3.803 7.207 7.582 1.00 0.00 C ATOM 1731 OG1 THR A1010 -3.017 7.529 8.736 1.00 0.00 O ATOM 1732 CG2 THR A1010 -4.429 5.833 7.760 1.00 0.00 C ATOM 0 H THR A1010 -2.918 9.235 5.621 1.00 0.00 H new ATOM 0 HA THR A1010 -2.102 6.551 6.419 1.00 0.00 H new ATOM 0 HB THR A1010 -4.603 7.939 7.467 1.00 0.00 H new ATOM 0 HG1 THR A1010 -3.582 7.497 9.536 1.00 0.00 H new ATOM 0 HG21 THR A1010 -5.043 5.827 8.661 1.00 0.00 H new ATOM 0 HG22 THR A1010 -5.051 5.602 6.895 1.00 0.00 H new ATOM 0 HG23 THR A1010 -3.642 5.084 7.852 1.00 0.00 H new ATOM 1740 N ALA A1011 -3.802 5.562 4.817 1.00 0.00 N ATOM 1741 CA ALA A1011 -4.565 5.047 3.686 1.00 0.00 C ATOM 1742 C ALA A1011 -6.050 4.964 4.022 1.00 0.00 C ATOM 1743 O ALA A1011 -6.425 4.580 5.131 1.00 0.00 O ATOM 1744 CB ALA A1011 -4.039 3.679 3.275 1.00 0.00 C ATOM 0 H ALA A1011 -3.308 4.847 5.351 1.00 0.00 H new ATOM 0 HA ALA A1011 -4.444 5.737 2.851 1.00 0.00 H new ATOM 0 HB1 ALA A1011 -4.617 3.306 2.430 1.00 0.00 H new ATOM 0 HB2 ALA A1011 -2.991 3.763 2.989 1.00 0.00 H new ATOM 0 HB3 ALA A1011 -4.132 2.987 4.112 1.00 0.00 H new ATOM 1750 N HIS A1012 -6.892 5.333 3.061 1.00 0.00 N ATOM 1751 CA HIS A1012 -8.339 5.307 3.261 1.00 0.00 C ATOM 1752 C HIS A1012 -9.076 5.242 1.928 1.00 0.00 C ATOM 1753 O HIS A1012 -8.558 5.674 0.898 1.00 0.00 O ATOM 1754 CB HIS A1012 -8.794 6.539 4.045 1.00 0.00 C ATOM 1755 CG HIS A1012 -8.563 7.832 3.326 1.00 0.00 C ATOM 1756 ND1 HIS A1012 -9.127 8.122 2.101 1.00 0.00 N ATOM 1757 CD2 HIS A1012 -7.830 8.917 3.665 1.00 0.00 C ATOM 1758 CE1 HIS A1012 -8.750 9.329 1.719 1.00 0.00 C ATOM 1759 NE2 HIS A1012 -7.963 9.833 2.651 1.00 0.00 N ATOM 0 H HIS A1012 -6.599 5.653 2.138 1.00 0.00 H new ATOM 0 HA HIS A1012 -8.579 4.411 3.833 1.00 0.00 H new ATOM 0 HB2 HIS A1012 -9.856 6.443 4.269 1.00 0.00 H new ATOM 0 HB3 HIS A1012 -8.268 6.566 4.999 1.00 0.00 H new ATOM 0 HD1 HIS A1012 -9.740 7.501 1.572 1.00 0.00 H new ATOM 0 HD2 HIS A1012 -7.248 9.040 4.566 1.00 0.00 H new ATOM 0 HE1 HIS A1012 -9.037 9.820 0.801 1.00 0.00 H new ATOM 1768 N TRP A1013 -10.287 4.695 1.954 1.00 0.00 N ATOM 1769 CA TRP A1013 -11.097 4.571 0.750 1.00 0.00 C ATOM 1770 C TRP A1013 -11.468 5.942 0.192 1.00 0.00 C ATOM 1771 O TRP A1013 -11.664 6.901 0.940 1.00 0.00 O ATOM 1772 CB TRP A1013 -12.356 3.752 1.032 1.00 0.00 C ATOM 1773 CG TRP A1013 -12.057 2.396 1.594 1.00 0.00 C ATOM 1774 CD1 TRP A1013 -12.056 2.037 2.910 1.00 0.00 C ATOM 1775 CD2 TRP A1013 -11.688 1.225 0.857 1.00 0.00 C ATOM 1776 NE1 TRP A1013 -11.726 0.708 3.036 1.00 0.00 N ATOM 1777 CE2 TRP A1013 -11.494 0.189 1.790 1.00 0.00 C ATOM 1778 CE3 TRP A1013 -11.507 0.951 -0.502 1.00 0.00 C ATOM 1779 CZ2 TRP A1013 -11.130 -1.099 1.407 1.00 0.00 C ATOM 1780 CZ3 TRP A1013 -11.144 -0.327 -0.881 1.00 0.00 C ATOM 1781 CH2 TRP A1013 -10.959 -1.338 0.071 1.00 0.00 C ATOM 0 H TRP A1013 -10.729 4.330 2.798 1.00 0.00 H new ATOM 0 HA TRP A1013 -10.503 4.050 -0.001 1.00 0.00 H new ATOM 0 HB2 TRP A1013 -12.989 4.298 1.732 1.00 0.00 H new ATOM 0 HB3 TRP A1013 -12.924 3.640 0.109 1.00 0.00 H new ATOM 0 HD1 TRP A1013 -12.281 2.700 3.733 1.00 0.00 H new ATOM 0 HE1 TRP A1013 -11.664 0.193 3.914 1.00 0.00 H new ATOM 0 HE3 TRP A1013 -11.648 1.725 -1.242 1.00 0.00 H new ATOM 0 HZ2 TRP A1013 -10.988 -1.881 2.138 1.00 0.00 H new ATOM 0 HZ3 TRP A1013 -11.001 -0.550 -1.928 1.00 0.00 H new ATOM 0 HH2 TRP A1013 -10.675 -2.327 -0.257 1.00 0.00 H new ATOM 1792 N SER A1014 -11.542 6.022 -1.131 1.00 0.00 N ATOM 1793 CA SER A1014 -11.866 7.267 -1.822 1.00 0.00 C ATOM 1794 C SER A1014 -13.233 7.819 -1.419 1.00 0.00 C ATOM 1795 O SER A1014 -13.443 9.033 -1.444 1.00 0.00 O ATOM 1796 CB SER A1014 -11.824 7.050 -3.334 1.00 0.00 C ATOM 1797 OG SER A1014 -12.140 8.243 -4.031 1.00 0.00 O ATOM 0 H SER A1014 -11.380 5.231 -1.754 1.00 0.00 H new ATOM 0 HA SER A1014 -11.117 8.002 -1.529 1.00 0.00 H new ATOM 0 HB2 SER A1014 -10.832 6.706 -3.627 1.00 0.00 H new ATOM 0 HB3 SER A1014 -12.528 6.266 -3.611 1.00 0.00 H new ATOM 0 HG SER A1014 -12.104 8.077 -4.996 1.00 0.00 H new ATOM 1803 N THR A1015 -14.166 6.939 -1.068 1.00 0.00 N ATOM 1804 CA THR A1015 -15.509 7.377 -0.691 1.00 0.00 C ATOM 1805 C THR A1015 -16.066 6.575 0.479 1.00 0.00 C ATOM 1806 O THR A1015 -15.845 5.368 0.586 1.00 0.00 O ATOM 1807 CB THR A1015 -16.491 7.267 -1.875 1.00 0.00 C ATOM 1808 OG1 THR A1015 -16.610 5.901 -2.287 1.00 0.00 O ATOM 1809 CG2 THR A1015 -16.023 8.113 -3.048 1.00 0.00 C ATOM 0 H THR A1015 -14.021 5.930 -1.036 1.00 0.00 H new ATOM 0 HA THR A1015 -15.412 8.420 -0.391 1.00 0.00 H new ATOM 0 HB THR A1015 -17.463 7.635 -1.546 1.00 0.00 H new ATOM 0 HG1 THR A1015 -16.744 5.862 -3.257 1.00 0.00 H new ATOM 0 HG21 THR A1015 -16.732 8.019 -3.870 1.00 0.00 H new ATOM 0 HG22 THR A1015 -15.960 9.157 -2.741 1.00 0.00 H new ATOM 0 HG23 THR A1015 -15.041 7.771 -3.375 1.00 0.00 H new ATOM 1817 N LYS A1016 -16.798 7.266 1.349 1.00 0.00 N ATOM 1818 CA LYS A1016 -17.409 6.643 2.518 1.00 0.00 C ATOM 1819 C LYS A1016 -18.283 5.459 2.106 1.00 0.00 C ATOM 1820 O LYS A1016 -18.993 5.524 1.103 1.00 0.00 O ATOM 1821 CB LYS A1016 -18.248 7.674 3.278 1.00 0.00 C ATOM 1822 CG LYS A1016 -18.992 7.101 4.475 1.00 0.00 C ATOM 1823 CD LYS A1016 -19.830 8.156 5.186 1.00 0.00 C ATOM 1824 CE LYS A1016 -20.988 8.647 4.326 1.00 0.00 C ATOM 1825 NZ LYS A1016 -20.524 9.417 3.138 1.00 0.00 N ATOM 0 H LYS A1016 -16.983 8.266 1.264 1.00 0.00 H new ATOM 0 HA LYS A1016 -16.616 6.274 3.168 1.00 0.00 H new ATOM 0 HB2 LYS A1016 -17.596 8.478 3.619 1.00 0.00 H new ATOM 0 HB3 LYS A1016 -18.970 8.117 2.592 1.00 0.00 H new ATOM 0 HG2 LYS A1016 -19.638 6.287 4.145 1.00 0.00 H new ATOM 0 HG3 LYS A1016 -18.275 6.674 5.177 1.00 0.00 H new ATOM 0 HD2 LYS A1016 -20.220 7.742 6.116 1.00 0.00 H new ATOM 0 HD3 LYS A1016 -19.196 9.001 5.455 1.00 0.00 H new ATOM 0 HE2 LYS A1016 -21.579 7.793 3.994 1.00 0.00 H new ATOM 0 HE3 LYS A1016 -21.645 9.274 4.929 1.00 0.00 H new ATOM 0 HZ1 LYS A1016 -21.225 10.149 2.903 1.00 0.00 H new ATOM 0 HZ2 LYS A1016 -19.611 9.867 3.351 1.00 0.00 H new ATOM 0 HZ3 LYS A1016 -20.412 8.773 2.329 1.00 0.00 H new ATOM 1839 N PRO A1017 -18.236 4.354 2.874 1.00 0.00 N ATOM 1840 CA PRO A1017 -19.023 3.154 2.577 1.00 0.00 C ATOM 1841 C PRO A1017 -20.500 3.463 2.331 1.00 0.00 C ATOM 1842 O PRO A1017 -21.149 4.129 3.139 1.00 0.00 O ATOM 1843 CB PRO A1017 -18.861 2.304 3.838 1.00 0.00 C ATOM 1844 CG PRO A1017 -17.551 2.724 4.408 1.00 0.00 C ATOM 1845 CD PRO A1017 -17.407 4.186 4.085 1.00 0.00 C ATOM 0 HA PRO A1017 -18.683 2.664 1.665 1.00 0.00 H new ATOM 0 HB2 PRO A1017 -19.674 2.480 4.542 1.00 0.00 H new ATOM 0 HB3 PRO A1017 -18.868 1.240 3.602 1.00 0.00 H new ATOM 0 HG2 PRO A1017 -17.523 2.558 5.485 1.00 0.00 H new ATOM 0 HG3 PRO A1017 -16.734 2.147 3.975 1.00 0.00 H new ATOM 0 HD2 PRO A1017 -17.759 4.814 4.903 1.00 0.00 H new ATOM 0 HD3 PRO A1017 -16.367 4.456 3.900 1.00 0.00 H new ATOM 1853 N PRO A1018 -21.050 2.974 1.204 1.00 0.00 N ATOM 1854 CA PRO A1018 -22.456 3.190 0.841 1.00 0.00 C ATOM 1855 C PRO A1018 -23.416 2.686 1.911 1.00 0.00 C ATOM 1856 O PRO A1018 -23.136 1.699 2.592 1.00 0.00 O ATOM 1857 CB PRO A1018 -22.632 2.377 -0.443 1.00 0.00 C ATOM 1858 CG PRO A1018 -21.259 2.220 -0.992 1.00 0.00 C ATOM 1859 CD PRO A1018 -20.341 2.174 0.194 1.00 0.00 C ATOM 0 HA PRO A1018 -22.679 4.251 0.725 1.00 0.00 H new ATOM 0 HB2 PRO A1018 -23.088 1.408 -0.237 1.00 0.00 H new ATOM 0 HB3 PRO A1018 -23.283 2.892 -1.150 1.00 0.00 H new ATOM 0 HG2 PRO A1018 -21.178 1.308 -1.584 1.00 0.00 H new ATOM 0 HG3 PRO A1018 -21.005 3.051 -1.650 1.00 0.00 H new ATOM 0 HD2 PRO A1018 -20.175 1.152 0.535 1.00 0.00 H new ATOM 0 HD3 PRO A1018 -19.363 2.595 -0.038 1.00 0.00 H new ATOM 1867 N ILE A1019 -24.546 3.369 2.053 1.00 0.00 N ATOM 1868 CA ILE A1019 -25.543 2.982 3.044 1.00 0.00 C ATOM 1869 C ILE A1019 -26.717 2.264 2.408 1.00 0.00 C ATOM 1870 O ILE A1019 -27.297 2.749 1.437 1.00 0.00 O ATOM 1871 CB ILE A1019 -26.139 4.194 3.775 1.00 0.00 C ATOM 1872 CG1 ILE A1019 -25.062 5.143 4.273 1.00 0.00 C ATOM 1873 CG2 ILE A1019 -27.005 3.725 4.936 1.00 0.00 C ATOM 1874 CD1 ILE A1019 -25.652 6.402 4.861 1.00 0.00 C ATOM 0 H ILE A1019 -24.794 4.188 1.498 1.00 0.00 H new ATOM 0 HA ILE A1019 -25.009 2.334 3.739 1.00 0.00 H new ATOM 0 HB ILE A1019 -26.753 4.743 3.061 1.00 0.00 H new ATOM 0 HG12 ILE A1019 -24.454 4.640 5.026 1.00 0.00 H new ATOM 0 HG13 ILE A1019 -24.398 5.403 3.449 1.00 0.00 H new ATOM 0 HG21 ILE A1019 -27.424 4.590 5.450 1.00 0.00 H new ATOM 0 HG22 ILE A1019 -27.814 3.100 4.557 1.00 0.00 H new ATOM 0 HG23 ILE A1019 -26.397 3.148 5.633 1.00 0.00 H new ATOM 0 HD11 ILE A1019 -24.849 7.054 5.205 1.00 0.00 H new ATOM 0 HD12 ILE A1019 -26.238 6.919 4.101 1.00 0.00 H new ATOM 0 HD13 ILE A1019 -26.296 6.144 5.702 1.00 0.00 H new ATOM 1886 N CYS A1020 -27.115 1.147 2.994 1.00 0.00 N ATOM 1887 CA CYS A1020 -28.276 0.434 2.504 1.00 0.00 C ATOM 1888 C CYS A1020 -29.504 1.037 3.170 1.00 0.00 C ATOM 1889 O CYS A1020 -29.574 1.112 4.396 1.00 0.00 O ATOM 1890 CB CYS A1020 -28.175 -1.064 2.801 1.00 0.00 C ATOM 1891 SG CYS A1020 -26.768 -1.894 1.995 1.00 0.00 S ATOM 0 H CYS A1020 -26.656 0.721 3.799 1.00 0.00 H new ATOM 0 HA CYS A1020 -28.344 0.535 1.421 1.00 0.00 H new ATOM 0 HB2 CYS A1020 -28.096 -1.204 3.879 1.00 0.00 H new ATOM 0 HB3 CYS A1020 -29.098 -1.549 2.484 1.00 0.00 H new ATOM 1896 N GLN A1021 -30.453 1.508 2.372 1.00 0.00 N ATOM 1897 CA GLN A1021 -31.638 2.146 2.929 1.00 0.00 C ATOM 1898 C GLN A1021 -32.882 1.825 2.109 1.00 0.00 C ATOM 1899 O GLN A1021 -32.880 1.956 0.888 1.00 0.00 O ATOM 1900 CB GLN A1021 -31.416 3.660 2.968 1.00 0.00 C ATOM 1901 CG GLN A1021 -32.352 4.404 3.900 1.00 0.00 C ATOM 1902 CD GLN A1021 -32.191 5.912 3.825 1.00 0.00 C ATOM 1903 OE1 GLN A1021 -31.257 6.378 3.001 1.00 0.00 O flip ATOM 1904 NE2 GLN A1021 -32.898 6.655 4.507 1.00 0.00 N flip ATOM 0 H GLN A1021 -30.428 1.462 1.353 1.00 0.00 H new ATOM 0 HA GLN A1021 -31.798 1.763 3.937 1.00 0.00 H new ATOM 0 HB2 GLN A1021 -30.388 3.857 3.271 1.00 0.00 H new ATOM 0 HB3 GLN A1021 -31.533 4.059 1.960 1.00 0.00 H new ATOM 0 HG2 GLN A1021 -33.382 4.142 3.657 1.00 0.00 H new ATOM 0 HG3 GLN A1021 -32.173 4.076 4.924 1.00 0.00 H new ATOM 0 HE21 GLN A1021 -33.604 6.259 5.128 1.00 0.00 H new ATOM 0 HE22 GLN A1021 -32.777 7.666 4.451 1.00 0.00 H new ATOM 1913 N ARG A1022 -33.940 1.401 2.796 1.00 0.00 N ATOM 1914 CA ARG A1022 -35.198 1.052 2.145 1.00 0.00 C ATOM 1915 C ARG A1022 -35.603 2.084 1.111 1.00 0.00 C ATOM 1916 O ARG A1022 -35.560 3.290 1.355 1.00 0.00 O ATOM 1917 CB ARG A1022 -36.313 0.886 3.180 1.00 0.00 C ATOM 1918 CG ARG A1022 -37.703 0.821 2.567 1.00 0.00 C ATOM 1919 CD ARG A1022 -38.757 0.467 3.603 1.00 0.00 C ATOM 1920 NE ARG A1022 -38.773 1.409 4.721 1.00 0.00 N ATOM 1921 CZ ARG A1022 -39.077 2.699 4.601 1.00 0.00 C ATOM 1922 NH1 ARG A1022 -39.407 3.201 3.419 1.00 0.00 N ATOM 1923 NH2 ARG A1022 -39.058 3.485 5.668 1.00 0.00 N ATOM 0 H ARG A1022 -33.949 1.291 3.810 1.00 0.00 H new ATOM 0 HA ARG A1022 -35.042 0.104 1.630 1.00 0.00 H new ATOM 0 HB2 ARG A1022 -36.134 -0.024 3.753 1.00 0.00 H new ATOM 0 HB3 ARG A1022 -36.273 1.718 3.883 1.00 0.00 H new ATOM 0 HG2 ARG A1022 -37.946 1.782 2.114 1.00 0.00 H new ATOM 0 HG3 ARG A1022 -37.714 0.080 1.768 1.00 0.00 H new ATOM 0 HD2 ARG A1022 -39.739 0.452 3.129 1.00 0.00 H new ATOM 0 HD3 ARG A1022 -38.570 -0.538 3.980 1.00 0.00 H new ATOM 0 HE ARG A1022 -38.537 1.056 5.649 1.00 0.00 H new ATOM 0 HH11 ARG A1022 -39.429 2.598 2.597 1.00 0.00 H new ATOM 0 HH12 ARG A1022 -39.639 4.190 3.332 1.00 0.00 H new ATOM 0 HH21 ARG A1022 -38.811 3.101 6.580 1.00 0.00 H new ATOM 0 HH22 ARG A1022 -39.291 4.474 5.577 1.00 0.00 H new ATOM 1937 N ILE A1023 -36.000 1.583 -0.047 1.00 0.00 N ATOM 1938 CA ILE A1023 -36.423 2.426 -1.144 1.00 0.00 C ATOM 1939 C ILE A1023 -37.815 3.000 -0.889 1.00 0.00 C ATOM 1940 O ILE A1023 -38.748 2.263 -0.570 1.00 0.00 O ATOM 1941 CB ILE A1023 -36.438 1.635 -2.461 1.00 0.00 C ATOM 1942 CG1 ILE A1023 -35.076 0.981 -2.705 1.00 0.00 C ATOM 1943 CG2 ILE A1023 -36.805 2.553 -3.605 1.00 0.00 C ATOM 1944 CD1 ILE A1023 -35.016 0.148 -3.968 1.00 0.00 C ATOM 0 H ILE A1023 -36.037 0.584 -0.249 1.00 0.00 H new ATOM 0 HA ILE A1023 -35.709 3.246 -1.221 1.00 0.00 H new ATOM 0 HB ILE A1023 -37.186 0.845 -2.394 1.00 0.00 H new ATOM 0 HG12 ILE A1023 -34.314 1.759 -2.757 1.00 0.00 H new ATOM 0 HG13 ILE A1023 -34.829 0.349 -1.852 1.00 0.00 H new ATOM 0 HG21 ILE A1023 -36.814 1.987 -4.537 1.00 0.00 H new ATOM 0 HG22 ILE A1023 -37.793 2.977 -3.428 1.00 0.00 H new ATOM 0 HG23 ILE A1023 -36.072 3.357 -3.676 1.00 0.00 H new ATOM 0 HD11 ILE A1023 -34.020 -0.283 -4.073 1.00 0.00 H new ATOM 0 HD12 ILE A1023 -35.754 -0.653 -3.911 1.00 0.00 H new ATOM 0 HD13 ILE A1023 -35.231 0.779 -4.830 1.00 0.00 H new ATOM 1956 N PRO A1024 -37.973 4.327 -1.025 1.00 0.00 N ATOM 1957 CA PRO A1024 -39.258 4.998 -0.806 1.00 0.00 C ATOM 1958 C PRO A1024 -40.266 4.695 -1.910 1.00 0.00 C ATOM 1959 O PRO A1024 -39.832 4.395 -3.041 1.00 0.00 O ATOM 1960 CB PRO A1024 -38.876 6.477 -0.816 1.00 0.00 C ATOM 1961 CG PRO A1024 -37.686 6.536 -1.703 1.00 0.00 C ATOM 1962 CD PRO A1024 -36.915 5.285 -1.401 1.00 0.00 C ATOM 1963 OXT PRO A1024 -41.483 4.759 -1.633 1.00 0.00 O ATOM 0 HA PRO A1024 -39.745 4.672 0.113 1.00 0.00 H new ATOM 0 HB2 PRO A1024 -39.688 7.096 -1.197 1.00 0.00 H new ATOM 0 HB3 PRO A1024 -38.644 6.836 0.187 1.00 0.00 H new ATOM 0 HG2 PRO A1024 -37.978 6.576 -2.753 1.00 0.00 H new ATOM 0 HG3 PRO A1024 -37.089 7.426 -1.504 1.00 0.00 H new ATOM 0 HD2 PRO A1024 -36.348 4.941 -2.266 1.00 0.00 H new ATOM 0 HD3 PRO A1024 -36.201 5.436 -0.591 1.00 0.00 H new