USER MOD reduce.3.24.130724 H: found=0, std=0, add=710, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 711 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 Single : A 912 SER OG : rot 180:sc= 0 USER MOD Single : A 913 SER OG : rot 180:sc= 0 USER MOD Single : A 915 SER OG : rot 180:sc= 0 USER MOD Single : A 916 SER OG : rot 180:sc= 0 USER MOD Single : A 919 SER OG : rot 180:sc= 0 USER MOD Single : A 920 SER OG : rot -56:sc= 0.0975 USER MOD Single : A 922 LYS NZ :NH3+ 150:sc= -0.465 (180deg=-1.61!) USER MOD Single : A 926 THR OG1 : rot 100:sc= -0.912 USER MOD Single : A 929 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 931 GLN :FLIP amide:sc= -1.08 F(o=-2.9!,f=-1.1) USER MOD Single : A 932 ASN : amide:sc= -0.401 X(o=-0.4,f=-0.2) USER MOD Single : A 933 MET CE :methyl -174:sc= -2.35! (180deg=-2.56!) USER MOD Single : A 936 THR OG1 : rot 180:sc= 0 USER MOD Single : A 938 SER OG : rot 19:sc= 0.00818 USER MOD Single : A 947 TYR OH : rot 180:sc= 0 USER MOD Single : A 949 TYR OH : rot 165:sc= 0 USER MOD Single : A 950 GLN : amide:sc=-0.00545 X(o=-0.0055,f=-0.17) USER MOD Single : A 955 SER OG : rot -79:sc= 0.841 USER MOD Single : A 957 CYS SG : rot 180:sc= 0 USER MOD Single : A 959 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 960 TYR OH : rot 180:sc= 0 USER MOD Single : A 961 ASN : amide:sc= -1.22 K(o=-1.2,f=-16!) USER MOD Single : A 963 LYS NZ :NH3+ -161:sc= -0.112 (180deg=-0.525) USER MOD Single : A 965 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 967 THR OG1 : rot -76:sc= 1.21 USER MOD Single : A 971 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 976 SER OG : rot 180:sc= 0 USER MOD Single : A 981 THR OG1 : rot 90:sc= 1.24 USER MOD Single : A 988 ASN : amide:sc= 0 X(o=0,f=-0.056) USER MOD Single : A 994 SER OG : rot -10:sc= 0.966 USER MOD Single : A 996 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0599) USER MOD Single : A 998 LYS NZ :NH3+ -145:sc= -0.389 (180deg=-1.72!) USER MOD Single : A1003 SER OG : rot 180:sc= -0.78 USER MOD Single : A1006 SER OG : rot 150:sc= 0 USER MOD Single : A1007 SER OG : rot 180:sc= 0.0225 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 911 -5.818 -12.100 -2.334 1.00 0.00 N ATOM 2 CA GLY A 911 -6.588 -13.280 -2.679 1.00 0.00 C ATOM 3 C GLY A 911 -7.640 -13.610 -1.638 1.00 0.00 C ATOM 4 O GLY A 911 -7.545 -13.176 -0.490 1.00 0.00 O ATOM 0 HA2 GLY A 911 -7.072 -13.125 -3.644 1.00 0.00 H new ATOM 0 HA3 GLY A 911 -5.914 -14.129 -2.793 1.00 0.00 H new ATOM 8 N SER A 912 -8.647 -14.379 -2.040 1.00 0.00 N ATOM 9 CA SER A 912 -9.725 -14.762 -1.136 1.00 0.00 C ATOM 10 C SER A 912 -10.106 -13.601 -0.223 1.00 0.00 C ATOM 11 O SER A 912 -10.332 -13.785 0.973 1.00 0.00 O ATOM 12 CB SER A 912 -9.308 -15.971 -0.295 1.00 0.00 C ATOM 13 OG SER A 912 -9.477 -17.177 -1.019 1.00 0.00 O ATOM 0 H SER A 912 -8.739 -14.749 -2.986 1.00 0.00 H new ATOM 0 HA SER A 912 -10.594 -15.029 -1.738 1.00 0.00 H new ATOM 0 HB2 SER A 912 -8.266 -15.867 0.006 1.00 0.00 H new ATOM 0 HB3 SER A 912 -9.902 -16.005 0.618 1.00 0.00 H new ATOM 0 HG SER A 912 -9.202 -17.935 -0.461 1.00 0.00 H new ATOM 19 N SER A 913 -10.176 -12.404 -0.796 1.00 0.00 N ATOM 20 CA SER A 913 -10.526 -11.210 -0.034 1.00 0.00 C ATOM 21 C SER A 913 -11.565 -11.534 1.035 1.00 0.00 C ATOM 22 O SER A 913 -12.602 -12.131 0.748 1.00 0.00 O ATOM 23 CB SER A 913 -11.060 -10.122 -0.968 1.00 0.00 C ATOM 24 OG SER A 913 -11.331 -8.927 -0.256 1.00 0.00 O ATOM 0 H SER A 913 -9.995 -12.235 -1.785 1.00 0.00 H new ATOM 0 HA SER A 913 -9.625 -10.845 0.459 1.00 0.00 H new ATOM 0 HB2 SER A 913 -10.332 -9.923 -1.754 1.00 0.00 H new ATOM 0 HB3 SER A 913 -11.969 -10.472 -1.457 1.00 0.00 H new ATOM 0 HG SER A 913 -11.669 -8.247 -0.875 1.00 0.00 H new ATOM 30 N GLY A 914 -11.278 -11.135 2.270 1.00 0.00 N ATOM 31 CA GLY A 914 -12.196 -11.391 3.365 1.00 0.00 C ATOM 32 C GLY A 914 -13.254 -10.313 3.498 1.00 0.00 C ATOM 33 O GLY A 914 -13.149 -9.252 2.883 1.00 0.00 O ATOM 0 H GLY A 914 -10.426 -10.639 2.532 1.00 0.00 H new ATOM 0 HA2 GLY A 914 -12.681 -12.355 3.211 1.00 0.00 H new ATOM 0 HA3 GLY A 914 -11.635 -11.462 4.297 1.00 0.00 H new ATOM 37 N SER A 915 -14.275 -10.585 4.304 1.00 0.00 N ATOM 38 CA SER A 915 -15.359 -9.632 4.512 1.00 0.00 C ATOM 39 C SER A 915 -15.034 -8.682 5.661 1.00 0.00 C ATOM 40 O SER A 915 -14.633 -9.113 6.742 1.00 0.00 O ATOM 41 CB SER A 915 -16.668 -10.370 4.800 1.00 0.00 C ATOM 42 OG SER A 915 -17.784 -9.511 4.644 1.00 0.00 O ATOM 0 H SER A 915 -14.374 -11.457 4.824 1.00 0.00 H new ATOM 0 HA SER A 915 -15.474 -9.046 3.600 1.00 0.00 H new ATOM 0 HB2 SER A 915 -16.764 -11.222 4.127 1.00 0.00 H new ATOM 0 HB3 SER A 915 -16.650 -10.766 5.815 1.00 0.00 H new ATOM 0 HG SER A 915 -18.608 -10.007 4.832 1.00 0.00 H new ATOM 48 N SER A 916 -15.211 -7.388 5.419 1.00 0.00 N ATOM 49 CA SER A 916 -14.933 -6.375 6.431 1.00 0.00 C ATOM 50 C SER A 916 -15.661 -5.073 6.111 1.00 0.00 C ATOM 51 O SER A 916 -16.284 -4.939 5.059 1.00 0.00 O ATOM 52 CB SER A 916 -13.428 -6.121 6.529 1.00 0.00 C ATOM 53 OG SER A 916 -12.980 -5.297 5.468 1.00 0.00 O ATOM 0 H SER A 916 -15.546 -7.015 4.531 1.00 0.00 H new ATOM 0 HA SER A 916 -15.294 -6.746 7.390 1.00 0.00 H new ATOM 0 HB2 SER A 916 -13.197 -5.648 7.483 1.00 0.00 H new ATOM 0 HB3 SER A 916 -12.894 -7.071 6.507 1.00 0.00 H new ATOM 0 HG SER A 916 -12.015 -5.148 5.554 1.00 0.00 H new ATOM 59 N GLY A 917 -15.576 -4.114 7.028 1.00 0.00 N ATOM 60 CA GLY A 917 -16.230 -2.834 6.826 1.00 0.00 C ATOM 61 C GLY A 917 -15.508 -1.698 7.523 1.00 0.00 C ATOM 62 O GLY A 917 -15.596 -1.552 8.742 1.00 0.00 O ATOM 0 H GLY A 917 -15.066 -4.201 7.907 1.00 0.00 H new ATOM 0 HA2 GLY A 917 -16.287 -2.623 5.758 1.00 0.00 H new ATOM 0 HA3 GLY A 917 -17.254 -2.890 7.195 1.00 0.00 H new ATOM 66 N ALA A 918 -14.791 -0.891 6.748 1.00 0.00 N ATOM 67 CA ALA A 918 -14.051 0.238 7.298 1.00 0.00 C ATOM 68 C ALA A 918 -14.948 1.462 7.446 1.00 0.00 C ATOM 69 O ALA A 918 -14.923 2.367 6.612 1.00 0.00 O ATOM 70 CB ALA A 918 -12.853 0.563 6.418 1.00 0.00 C ATOM 0 H ALA A 918 -14.707 -0.998 5.737 1.00 0.00 H new ATOM 0 HA ALA A 918 -13.695 -0.041 8.289 1.00 0.00 H new ATOM 0 HB1 ALA A 918 -12.310 1.408 6.841 1.00 0.00 H new ATOM 0 HB2 ALA A 918 -12.194 -0.303 6.367 1.00 0.00 H new ATOM 0 HB3 ALA A 918 -13.196 0.817 5.415 1.00 0.00 H new ATOM 76 N SER A 919 -15.741 1.483 8.513 1.00 0.00 N ATOM 77 CA SER A 919 -16.650 2.594 8.768 1.00 0.00 C ATOM 78 C SER A 919 -16.343 3.249 10.112 1.00 0.00 C ATOM 79 O SER A 919 -16.236 2.573 11.134 1.00 0.00 O ATOM 80 CB SER A 919 -18.101 2.110 8.743 1.00 0.00 C ATOM 81 OG SER A 919 -18.431 1.552 7.483 1.00 0.00 O ATOM 0 H SER A 919 -15.772 0.743 9.214 1.00 0.00 H new ATOM 0 HA SER A 919 -16.509 3.335 7.981 1.00 0.00 H new ATOM 0 HB2 SER A 919 -18.253 1.366 9.525 1.00 0.00 H new ATOM 0 HB3 SER A 919 -18.769 2.943 8.962 1.00 0.00 H new ATOM 0 HG SER A 919 -19.363 1.249 7.493 1.00 0.00 H new ATOM 87 N SER A 920 -16.204 4.571 10.100 1.00 0.00 N ATOM 88 CA SER A 920 -15.906 5.319 11.316 1.00 0.00 C ATOM 89 C SER A 920 -14.469 5.073 11.767 1.00 0.00 C ATOM 90 O SER A 920 -14.201 4.892 12.953 1.00 0.00 O ATOM 91 CB SER A 920 -16.876 4.926 12.432 1.00 0.00 C ATOM 92 OG SER A 920 -16.860 5.879 13.481 1.00 0.00 O ATOM 0 H SER A 920 -16.293 5.146 9.262 1.00 0.00 H new ATOM 0 HA SER A 920 -16.024 6.380 11.098 1.00 0.00 H new ATOM 0 HB2 SER A 920 -17.885 4.842 12.028 1.00 0.00 H new ATOM 0 HB3 SER A 920 -16.607 3.945 12.824 1.00 0.00 H new ATOM 0 HG SER A 920 -15.944 5.984 13.814 1.00 0.00 H new ATOM 98 N GLY A 921 -13.548 5.070 10.808 1.00 0.00 N ATOM 99 CA GLY A 921 -12.149 4.846 11.124 1.00 0.00 C ATOM 100 C GLY A 921 -11.540 5.994 11.904 1.00 0.00 C ATOM 101 O GLY A 921 -12.235 6.692 12.642 1.00 0.00 O ATOM 0 H GLY A 921 -13.745 5.219 9.818 1.00 0.00 H new ATOM 0 HA2 GLY A 921 -12.053 3.927 11.702 1.00 0.00 H new ATOM 0 HA3 GLY A 921 -11.590 4.702 10.200 1.00 0.00 H new ATOM 105 N LYS A 922 -10.236 6.191 11.742 1.00 0.00 N ATOM 106 CA LYS A 922 -9.531 7.262 12.436 1.00 0.00 C ATOM 107 C LYS A 922 -9.093 8.348 11.458 1.00 0.00 C ATOM 108 O LYS A 922 -8.696 8.073 10.326 1.00 0.00 O ATOM 109 CB LYS A 922 -8.313 6.704 13.175 1.00 0.00 C ATOM 110 CG LYS A 922 -8.669 5.741 14.294 1.00 0.00 C ATOM 111 CD LYS A 922 -7.429 5.099 14.893 1.00 0.00 C ATOM 112 CE LYS A 922 -7.065 3.810 14.172 1.00 0.00 C ATOM 113 NZ LYS A 922 -6.413 4.074 12.859 1.00 0.00 N ATOM 0 H LYS A 922 -9.645 5.622 11.135 1.00 0.00 H new ATOM 0 HA LYS A 922 -10.216 7.704 13.160 1.00 0.00 H new ATOM 0 HB2 LYS A 922 -7.667 6.194 12.460 1.00 0.00 H new ATOM 0 HB3 LYS A 922 -7.739 7.533 13.589 1.00 0.00 H new ATOM 0 HG2 LYS A 922 -9.217 6.273 15.072 1.00 0.00 H new ATOM 0 HG3 LYS A 922 -9.332 4.966 13.911 1.00 0.00 H new ATOM 0 HD2 LYS A 922 -6.594 5.797 14.837 1.00 0.00 H new ATOM 0 HD3 LYS A 922 -7.600 4.891 15.949 1.00 0.00 H new ATOM 0 HE2 LYS A 922 -6.395 3.220 14.798 1.00 0.00 H new ATOM 0 HE3 LYS A 922 -7.964 3.214 14.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 922 -5.752 3.302 12.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 922 -7.139 4.132 12.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 922 -5.892 4.973 12.905 1.00 0.00 H new ATOM 127 N PRO A 923 -9.164 9.611 11.904 1.00 0.00 N ATOM 128 CA PRO A 923 -8.776 10.763 11.085 1.00 0.00 C ATOM 129 C PRO A 923 -7.271 10.827 10.850 1.00 0.00 C ATOM 130 O PRO A 923 -6.520 9.982 11.337 1.00 0.00 O ATOM 131 CB PRO A 923 -9.239 11.962 11.916 1.00 0.00 C ATOM 132 CG PRO A 923 -9.253 11.466 13.321 1.00 0.00 C ATOM 133 CD PRO A 923 -9.628 10.012 13.243 1.00 0.00 C ATOM 0 HA PRO A 923 -9.217 10.722 10.089 1.00 0.00 H new ATOM 0 HB2 PRO A 923 -8.562 12.808 11.802 1.00 0.00 H new ATOM 0 HB3 PRO A 923 -10.228 12.301 11.606 1.00 0.00 H new ATOM 0 HG2 PRO A 923 -8.277 11.593 13.789 1.00 0.00 H new ATOM 0 HG3 PRO A 923 -9.971 12.022 13.924 1.00 0.00 H new ATOM 0 HD2 PRO A 923 -9.144 9.430 14.027 1.00 0.00 H new ATOM 0 HD3 PRO A 923 -10.702 9.868 13.356 1.00 0.00 H new ATOM 141 N GLY A 924 -6.835 11.835 10.100 1.00 0.00 N ATOM 142 CA GLY A 924 -5.421 11.990 9.815 1.00 0.00 C ATOM 143 C GLY A 924 -5.142 12.139 8.332 1.00 0.00 C ATOM 144 O GLY A 924 -6.005 11.895 7.489 1.00 0.00 O ATOM 0 H GLY A 924 -7.436 12.547 9.685 1.00 0.00 H new ATOM 0 HA2 GLY A 924 -5.041 12.865 10.343 1.00 0.00 H new ATOM 0 HA3 GLY A 924 -4.879 11.126 10.199 1.00 0.00 H new ATOM 148 N PRO A 925 -3.910 12.550 7.996 1.00 0.00 N ATOM 149 CA PRO A 925 -3.491 12.740 6.604 1.00 0.00 C ATOM 150 C PRO A 925 -3.363 11.421 5.851 1.00 0.00 C ATOM 151 O PRO A 925 -3.449 10.344 6.444 1.00 0.00 O ATOM 152 CB PRO A 925 -2.125 13.417 6.735 1.00 0.00 C ATOM 153 CG PRO A 925 -1.618 12.994 8.070 1.00 0.00 C ATOM 154 CD PRO A 925 -2.831 12.859 8.949 1.00 0.00 C ATOM 0 HA PRO A 925 -4.217 13.321 6.035 1.00 0.00 H new ATOM 0 HB2 PRO A 925 -1.450 13.104 5.938 1.00 0.00 H new ATOM 0 HB3 PRO A 925 -2.213 14.502 6.671 1.00 0.00 H new ATOM 0 HG2 PRO A 925 -1.079 12.049 8.001 1.00 0.00 H new ATOM 0 HG3 PRO A 925 -0.923 13.729 8.475 1.00 0.00 H new ATOM 0 HD2 PRO A 925 -2.707 12.066 9.686 1.00 0.00 H new ATOM 0 HD3 PRO A 925 -3.032 13.778 9.500 1.00 0.00 H new ATOM 162 N THR A 926 -3.156 11.510 4.541 1.00 0.00 N ATOM 163 CA THR A 926 -3.016 10.323 3.707 1.00 0.00 C ATOM 164 C THR A 926 -1.552 9.924 3.559 1.00 0.00 C ATOM 165 O THR A 926 -0.737 10.696 3.053 1.00 0.00 O ATOM 166 CB THR A 926 -3.619 10.545 2.307 1.00 0.00 C ATOM 167 OG1 THR A 926 -4.921 11.131 2.422 1.00 0.00 O ATOM 168 CG2 THR A 926 -3.714 9.233 1.544 1.00 0.00 C ATOM 0 H THR A 926 -3.082 12.392 4.035 1.00 0.00 H new ATOM 0 HA THR A 926 -3.560 9.521 4.206 1.00 0.00 H new ATOM 0 HB THR A 926 -2.964 11.220 1.756 1.00 0.00 H new ATOM 0 HG1 THR A 926 -4.861 12.096 2.262 1.00 0.00 H new ATOM 0 HG21 THR A 926 -4.143 9.415 0.559 1.00 0.00 H new ATOM 0 HG22 THR A 926 -2.718 8.804 1.433 1.00 0.00 H new ATOM 0 HG23 THR A 926 -4.349 8.538 2.093 1.00 0.00 H new ATOM 176 N ILE A 927 -1.226 8.715 4.003 1.00 0.00 N ATOM 177 CA ILE A 927 0.140 8.214 3.918 1.00 0.00 C ATOM 178 C ILE A 927 0.322 7.316 2.699 1.00 0.00 C ATOM 179 O ILE A 927 -0.409 6.342 2.519 1.00 0.00 O ATOM 180 CB ILE A 927 0.531 7.427 5.184 1.00 0.00 C ATOM 181 CG1 ILE A 927 0.272 8.269 6.435 1.00 0.00 C ATOM 182 CG2 ILE A 927 1.991 7.006 5.115 1.00 0.00 C ATOM 183 CD1 ILE A 927 1.106 9.529 6.499 1.00 0.00 C ATOM 0 H ILE A 927 -1.889 8.065 4.425 1.00 0.00 H new ATOM 0 HA ILE A 927 0.790 9.084 3.825 1.00 0.00 H new ATOM 0 HB ILE A 927 -0.084 6.529 5.240 1.00 0.00 H new ATOM 0 HG12 ILE A 927 -0.783 8.540 6.469 1.00 0.00 H new ATOM 0 HG13 ILE A 927 0.474 7.664 7.319 1.00 0.00 H new ATOM 0 HG21 ILE A 927 2.253 6.451 6.016 1.00 0.00 H new ATOM 0 HG22 ILE A 927 2.146 6.373 4.241 1.00 0.00 H new ATOM 0 HG23 ILE A 927 2.622 7.892 5.038 1.00 0.00 H new ATOM 0 HD11 ILE A 927 0.870 10.076 7.412 1.00 0.00 H new ATOM 0 HD12 ILE A 927 2.164 9.266 6.497 1.00 0.00 H new ATOM 0 HD13 ILE A 927 0.886 10.155 5.634 1.00 0.00 H new ATOM 195 N ILE A 928 1.301 7.650 1.866 1.00 0.00 N ATOM 196 CA ILE A 928 1.581 6.872 0.665 1.00 0.00 C ATOM 197 C ILE A 928 2.835 6.023 0.840 1.00 0.00 C ATOM 198 O ILE A 928 3.801 6.446 1.475 1.00 0.00 O ATOM 199 CB ILE A 928 1.757 7.781 -0.566 1.00 0.00 C ATOM 200 CG1 ILE A 928 0.456 8.527 -0.867 1.00 0.00 C ATOM 201 CG2 ILE A 928 2.196 6.962 -1.770 1.00 0.00 C ATOM 202 CD1 ILE A 928 0.600 9.586 -1.937 1.00 0.00 C ATOM 0 H ILE A 928 1.914 8.454 2.000 1.00 0.00 H new ATOM 0 HA ILE A 928 0.723 6.219 0.505 1.00 0.00 H new ATOM 0 HB ILE A 928 2.532 8.516 -0.349 1.00 0.00 H new ATOM 0 HG12 ILE A 928 -0.302 7.808 -1.179 1.00 0.00 H new ATOM 0 HG13 ILE A 928 0.094 8.994 0.049 1.00 0.00 H new ATOM 0 HG21 ILE A 928 2.316 7.618 -2.632 1.00 0.00 H new ATOM 0 HG22 ILE A 928 3.145 6.473 -1.551 1.00 0.00 H new ATOM 0 HG23 ILE A 928 1.442 6.207 -1.991 1.00 0.00 H new ATOM 0 HD11 ILE A 928 -0.361 10.074 -2.098 1.00 0.00 H new ATOM 0 HD12 ILE A 928 1.334 10.327 -1.619 1.00 0.00 H new ATOM 0 HD13 ILE A 928 0.931 9.122 -2.866 1.00 0.00 H new ATOM 214 N LYS A 929 2.814 4.823 0.271 1.00 0.00 N ATOM 215 CA LYS A 929 3.950 3.913 0.360 1.00 0.00 C ATOM 216 C LYS A 929 4.610 3.732 -1.003 1.00 0.00 C ATOM 217 O LYS A 929 3.938 3.463 -1.999 1.00 0.00 O ATOM 218 CB LYS A 929 3.501 2.555 0.905 1.00 0.00 C ATOM 219 CG LYS A 929 4.514 1.446 0.684 1.00 0.00 C ATOM 220 CD LYS A 929 4.360 0.337 1.712 1.00 0.00 C ATOM 221 CE LYS A 929 3.287 -0.658 1.301 1.00 0.00 C ATOM 222 NZ LYS A 929 2.705 -1.364 2.476 1.00 0.00 N ATOM 0 H LYS A 929 2.022 4.457 -0.257 1.00 0.00 H new ATOM 0 HA LYS A 929 4.680 4.349 1.043 1.00 0.00 H new ATOM 0 HB2 LYS A 929 3.304 2.649 1.973 1.00 0.00 H new ATOM 0 HB3 LYS A 929 2.560 2.276 0.431 1.00 0.00 H new ATOM 0 HG2 LYS A 929 4.391 1.034 -0.318 1.00 0.00 H new ATOM 0 HG3 LYS A 929 5.522 1.857 0.739 1.00 0.00 H new ATOM 0 HD2 LYS A 929 5.311 -0.182 1.835 1.00 0.00 H new ATOM 0 HD3 LYS A 929 4.106 0.769 2.680 1.00 0.00 H new ATOM 0 HE2 LYS A 929 2.496 -0.137 0.762 1.00 0.00 H new ATOM 0 HE3 LYS A 929 3.713 -1.388 0.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 929 1.977 -2.033 2.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 929 3.455 -1.882 2.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 929 2.275 -0.670 3.120 1.00 0.00 H new ATOM 236 N VAL A 930 5.931 3.880 -1.040 1.00 0.00 N ATOM 237 CA VAL A 930 6.682 3.731 -2.281 1.00 0.00 C ATOM 238 C VAL A 930 7.569 2.491 -2.240 1.00 0.00 C ATOM 239 O VAL A 930 8.298 2.270 -1.274 1.00 0.00 O ATOM 240 CB VAL A 930 7.559 4.967 -2.558 1.00 0.00 C ATOM 241 CG1 VAL A 930 8.066 4.951 -3.992 1.00 0.00 C ATOM 242 CG2 VAL A 930 6.784 6.244 -2.272 1.00 0.00 C ATOM 0 H VAL A 930 6.503 4.103 -0.225 1.00 0.00 H new ATOM 0 HA VAL A 930 5.951 3.626 -3.083 1.00 0.00 H new ATOM 0 HB VAL A 930 8.422 4.936 -1.893 1.00 0.00 H new ATOM 0 HG11 VAL A 930 8.684 5.831 -4.169 1.00 0.00 H new ATOM 0 HG12 VAL A 930 8.660 4.052 -4.158 1.00 0.00 H new ATOM 0 HG13 VAL A 930 7.219 4.958 -4.678 1.00 0.00 H new ATOM 0 HG21 VAL A 930 7.418 7.107 -2.473 1.00 0.00 H new ATOM 0 HG22 VAL A 930 5.902 6.285 -2.911 1.00 0.00 H new ATOM 0 HG23 VAL A 930 6.475 6.256 -1.227 1.00 0.00 H new ATOM 252 N GLN A 931 7.501 1.687 -3.296 1.00 0.00 N ATOM 253 CA GLN A 931 8.298 0.469 -3.380 1.00 0.00 C ATOM 254 C GLN A 931 8.927 0.324 -4.762 1.00 0.00 C ATOM 255 O GLN A 931 8.559 1.032 -5.699 1.00 0.00 O ATOM 256 CB GLN A 931 7.433 -0.754 -3.070 1.00 0.00 C ATOM 257 CG GLN A 931 8.108 -1.760 -2.152 1.00 0.00 C ATOM 258 CD GLN A 931 7.474 -1.811 -0.776 1.00 0.00 C ATOM 259 OE1 GLN A 931 7.157 -0.644 -0.226 1.00 0.00 O flip ATOM 260 NE2 GLN A 931 7.271 -2.887 -0.212 1.00 0.00 N flip ATOM 0 H GLN A 931 6.903 1.857 -4.105 1.00 0.00 H new ATOM 0 HA GLN A 931 9.097 0.537 -2.642 1.00 0.00 H new ATOM 0 HB2 GLN A 931 6.502 -0.423 -2.610 1.00 0.00 H new ATOM 0 HB3 GLN A 931 7.169 -1.248 -4.005 1.00 0.00 H new ATOM 0 HG2 GLN A 931 8.061 -2.750 -2.606 1.00 0.00 H new ATOM 0 HG3 GLN A 931 9.163 -1.505 -2.053 1.00 0.00 H new ATOM 0 HE21 GLN A 931 7.530 -3.760 -0.671 1.00 0.00 H new ATOM 0 HE22 GLN A 931 6.844 -2.905 0.714 1.00 0.00 H new ATOM 269 N ASN A 932 9.878 -0.596 -4.881 1.00 0.00 N ATOM 270 CA ASN A 932 10.559 -0.833 -6.148 1.00 0.00 C ATOM 271 C ASN A 932 11.412 0.370 -6.540 1.00 0.00 C ATOM 272 O ASN A 932 11.281 0.904 -7.641 1.00 0.00 O ATOM 273 CB ASN A 932 9.540 -1.131 -7.250 1.00 0.00 C ATOM 274 CG ASN A 932 10.119 -1.997 -8.353 1.00 0.00 C ATOM 275 OD1 ASN A 932 9.596 -3.071 -8.652 1.00 0.00 O ATOM 276 ND2 ASN A 932 11.203 -1.533 -8.963 1.00 0.00 N ATOM 0 H ASN A 932 10.195 -1.190 -4.115 1.00 0.00 H new ATOM 0 HA ASN A 932 11.214 -1.696 -6.025 1.00 0.00 H new ATOM 0 HB2 ASN A 932 8.674 -1.631 -6.815 1.00 0.00 H new ATOM 0 HB3 ASN A 932 9.185 -0.193 -7.677 1.00 0.00 H new ATOM 0 HD21 ASN A 932 11.636 -2.072 -9.713 1.00 0.00 H new ATOM 0 HD22 ASN A 932 11.602 -0.637 -8.682 1.00 0.00 H new ATOM 283 N MET A 933 12.285 0.791 -5.631 1.00 0.00 N ATOM 284 CA MET A 933 13.160 1.930 -5.883 1.00 0.00 C ATOM 285 C MET A 933 14.626 1.525 -5.765 1.00 0.00 C ATOM 286 O MET A 933 15.051 0.921 -4.780 1.00 0.00 O ATOM 287 CB MET A 933 12.852 3.063 -4.903 1.00 0.00 C ATOM 288 CG MET A 933 11.800 4.036 -5.410 1.00 0.00 C ATOM 289 SD MET A 933 11.670 5.515 -4.386 1.00 0.00 S ATOM 290 CE MET A 933 12.011 4.834 -2.765 1.00 0.00 C ATOM 0 H MET A 933 12.405 0.361 -4.714 1.00 0.00 H new ATOM 0 HA MET A 933 12.978 2.279 -6.900 1.00 0.00 H new ATOM 0 HB2 MET A 933 12.514 2.634 -3.960 1.00 0.00 H new ATOM 0 HB3 MET A 933 13.771 3.611 -4.693 1.00 0.00 H new ATOM 0 HG2 MET A 933 12.042 4.327 -6.432 1.00 0.00 H new ATOM 0 HG3 MET A 933 10.833 3.535 -5.442 1.00 0.00 H new ATOM 0 HE1 MET A 933 11.863 5.604 -2.008 1.00 0.00 H new ATOM 0 HE2 MET A 933 11.336 4.001 -2.571 1.00 0.00 H new ATOM 0 HE3 MET A 933 13.042 4.482 -2.728 1.00 0.00 H new ATOM 300 N PRO A 934 15.419 1.863 -6.793 1.00 0.00 N ATOM 301 CA PRO A 934 16.850 1.545 -6.828 1.00 0.00 C ATOM 302 C PRO A 934 17.649 2.358 -5.815 1.00 0.00 C ATOM 303 O PRO A 934 17.226 3.436 -5.397 1.00 0.00 O ATOM 304 CB PRO A 934 17.261 1.914 -8.255 1.00 0.00 C ATOM 305 CG PRO A 934 16.272 2.945 -8.679 1.00 0.00 C ATOM 306 CD PRO A 934 14.980 2.583 -8.000 1.00 0.00 C ATOM 0 HA PRO A 934 17.043 0.503 -6.571 1.00 0.00 H new ATOM 0 HB2 PRO A 934 18.278 2.305 -8.286 1.00 0.00 H new ATOM 0 HB3 PRO A 934 17.233 1.045 -8.912 1.00 0.00 H new ATOM 0 HG2 PRO A 934 16.600 3.943 -8.388 1.00 0.00 H new ATOM 0 HG3 PRO A 934 16.155 2.951 -9.763 1.00 0.00 H new ATOM 0 HD2 PRO A 934 14.396 3.469 -7.749 1.00 0.00 H new ATOM 0 HD3 PRO A 934 14.354 1.957 -8.636 1.00 0.00 H new ATOM 314 N PHE A 935 18.807 1.835 -5.426 1.00 0.00 N ATOM 315 CA PHE A 935 19.666 2.513 -4.462 1.00 0.00 C ATOM 316 C PHE A 935 19.975 3.937 -4.916 1.00 0.00 C ATOM 317 O PHE A 935 20.120 4.845 -4.097 1.00 0.00 O ATOM 318 CB PHE A 935 20.969 1.733 -4.271 1.00 0.00 C ATOM 319 CG PHE A 935 20.762 0.256 -4.093 1.00 0.00 C ATOM 320 CD1 PHE A 935 20.011 -0.230 -3.035 1.00 0.00 C ATOM 321 CD2 PHE A 935 21.318 -0.647 -4.985 1.00 0.00 C ATOM 322 CE1 PHE A 935 19.820 -1.589 -2.869 1.00 0.00 C ATOM 323 CE2 PHE A 935 21.130 -2.007 -4.824 1.00 0.00 C ATOM 324 CZ PHE A 935 20.379 -2.478 -3.766 1.00 0.00 C ATOM 0 H PHE A 935 19.172 0.944 -5.763 1.00 0.00 H new ATOM 0 HA PHE A 935 19.136 2.560 -3.511 1.00 0.00 H new ATOM 0 HB2 PHE A 935 21.613 1.900 -5.134 1.00 0.00 H new ATOM 0 HB3 PHE A 935 21.494 2.126 -3.400 1.00 0.00 H new ATOM 0 HD1 PHE A 935 19.570 0.461 -2.332 1.00 0.00 H new ATOM 0 HD2 PHE A 935 21.905 -0.284 -5.816 1.00 0.00 H new ATOM 0 HE1 PHE A 935 19.234 -1.955 -2.039 1.00 0.00 H new ATOM 0 HE2 PHE A 935 21.570 -2.700 -5.525 1.00 0.00 H new ATOM 0 HZ PHE A 935 20.229 -3.540 -3.640 1.00 0.00 H new ATOM 334 N THR A 936 20.076 4.125 -6.228 1.00 0.00 N ATOM 335 CA THR A 936 20.369 5.436 -6.792 1.00 0.00 C ATOM 336 C THR A 936 19.394 6.488 -6.275 1.00 0.00 C ATOM 337 O THR A 936 19.762 7.645 -6.074 1.00 0.00 O ATOM 338 CB THR A 936 20.311 5.412 -8.331 1.00 0.00 C ATOM 339 OG1 THR A 936 19.009 5.003 -8.766 1.00 0.00 O ATOM 340 CG2 THR A 936 21.360 4.467 -8.897 1.00 0.00 C ATOM 0 H THR A 936 19.959 3.385 -6.920 1.00 0.00 H new ATOM 0 HA THR A 936 21.380 5.695 -6.478 1.00 0.00 H new ATOM 0 HB THR A 936 20.516 6.418 -8.696 1.00 0.00 H new ATOM 0 HG1 THR A 936 18.980 4.992 -9.746 1.00 0.00 H new ATOM 0 HG21 THR A 936 21.300 4.467 -9.985 1.00 0.00 H new ATOM 0 HG22 THR A 936 22.352 4.797 -8.588 1.00 0.00 H new ATOM 0 HG23 THR A 936 21.181 3.459 -8.523 1.00 0.00 H new ATOM 348 N VAL A 937 18.148 6.078 -6.060 1.00 0.00 N ATOM 349 CA VAL A 937 17.120 6.985 -5.563 1.00 0.00 C ATOM 350 C VAL A 937 17.631 7.802 -4.382 1.00 0.00 C ATOM 351 O VAL A 937 18.299 7.275 -3.493 1.00 0.00 O ATOM 352 CB VAL A 937 15.855 6.218 -5.134 1.00 0.00 C ATOM 353 CG1 VAL A 937 14.842 7.166 -4.510 1.00 0.00 C ATOM 354 CG2 VAL A 937 15.250 5.483 -6.320 1.00 0.00 C ATOM 0 H VAL A 937 17.826 5.124 -6.222 1.00 0.00 H new ATOM 0 HA VAL A 937 16.868 7.657 -6.383 1.00 0.00 H new ATOM 0 HB VAL A 937 16.136 5.479 -4.383 1.00 0.00 H new ATOM 0 HG11 VAL A 937 13.955 6.607 -4.213 1.00 0.00 H new ATOM 0 HG12 VAL A 937 15.281 7.642 -3.633 1.00 0.00 H new ATOM 0 HG13 VAL A 937 14.563 7.930 -5.236 1.00 0.00 H new ATOM 0 HG21 VAL A 937 14.357 4.947 -5.999 1.00 0.00 H new ATOM 0 HG22 VAL A 937 14.983 6.201 -7.095 1.00 0.00 H new ATOM 0 HG23 VAL A 937 15.976 4.774 -6.717 1.00 0.00 H new ATOM 364 N SER A 938 17.312 9.092 -4.380 1.00 0.00 N ATOM 365 CA SER A 938 17.742 9.984 -3.310 1.00 0.00 C ATOM 366 C SER A 938 16.635 10.968 -2.945 1.00 0.00 C ATOM 367 O SER A 938 15.580 10.995 -3.579 1.00 0.00 O ATOM 368 CB SER A 938 19.001 10.747 -3.728 1.00 0.00 C ATOM 369 OG SER A 938 20.158 9.944 -3.576 1.00 0.00 O ATOM 0 H SER A 938 16.757 9.543 -5.108 1.00 0.00 H new ATOM 0 HA SER A 938 17.968 9.377 -2.433 1.00 0.00 H new ATOM 0 HB2 SER A 938 18.909 11.065 -4.767 1.00 0.00 H new ATOM 0 HB3 SER A 938 19.100 11.650 -3.126 1.00 0.00 H new ATOM 0 HG SER A 938 19.898 9.000 -3.532 1.00 0.00 H new ATOM 375 N ILE A 939 16.884 11.774 -1.918 1.00 0.00 N ATOM 376 CA ILE A 939 15.909 12.761 -1.469 1.00 0.00 C ATOM 377 C ILE A 939 15.613 13.779 -2.564 1.00 0.00 C ATOM 378 O ILE A 939 14.462 14.161 -2.777 1.00 0.00 O ATOM 379 CB ILE A 939 16.398 13.504 -0.212 1.00 0.00 C ATOM 380 CG1 ILE A 939 16.554 12.527 0.956 1.00 0.00 C ATOM 381 CG2 ILE A 939 15.434 14.623 0.151 1.00 0.00 C ATOM 382 CD1 ILE A 939 17.453 13.041 2.058 1.00 0.00 C ATOM 0 H ILE A 939 17.752 11.763 -1.382 1.00 0.00 H new ATOM 0 HA ILE A 939 14.997 12.216 -1.227 1.00 0.00 H new ATOM 0 HB ILE A 939 17.372 13.945 -0.425 1.00 0.00 H new ATOM 0 HG12 ILE A 939 15.570 12.311 1.372 1.00 0.00 H new ATOM 0 HG13 ILE A 939 16.955 11.586 0.580 1.00 0.00 H new ATOM 0 HG21 ILE A 939 15.794 15.138 1.042 1.00 0.00 H new ATOM 0 HG22 ILE A 939 15.369 15.330 -0.676 1.00 0.00 H new ATOM 0 HG23 ILE A 939 14.447 14.204 0.348 1.00 0.00 H new ATOM 0 HD11 ILE A 939 17.517 12.297 2.852 1.00 0.00 H new ATOM 0 HD12 ILE A 939 18.449 13.230 1.657 1.00 0.00 H new ATOM 0 HD13 ILE A 939 17.042 13.967 2.461 1.00 0.00 H new ATOM 394 N ASP A 940 16.658 14.215 -3.258 1.00 0.00 N ATOM 395 CA ASP A 940 16.511 15.187 -4.335 1.00 0.00 C ATOM 396 C ASP A 940 15.663 14.618 -5.469 1.00 0.00 C ATOM 397 O ASP A 940 14.766 15.286 -5.980 1.00 0.00 O ATOM 398 CB ASP A 940 17.883 15.604 -4.867 1.00 0.00 C ATOM 399 CG ASP A 940 17.786 16.630 -5.978 1.00 0.00 C ATOM 400 OD1 ASP A 940 16.894 16.488 -6.841 1.00 0.00 O ATOM 401 OD2 ASP A 940 18.601 17.575 -5.985 1.00 0.00 O ATOM 0 H ASP A 940 17.617 13.910 -3.094 1.00 0.00 H new ATOM 0 HA ASP A 940 16.005 16.064 -3.932 1.00 0.00 H new ATOM 0 HB2 ASP A 940 18.477 16.013 -4.050 1.00 0.00 H new ATOM 0 HB3 ASP A 940 18.410 14.723 -5.235 1.00 0.00 H new ATOM 406 N GLU A 941 15.957 13.381 -5.856 1.00 0.00 N ATOM 407 CA GLU A 941 15.222 12.724 -6.931 1.00 0.00 C ATOM 408 C GLU A 941 13.772 12.477 -6.527 1.00 0.00 C ATOM 409 O GLU A 941 12.858 12.609 -7.343 1.00 0.00 O ATOM 410 CB GLU A 941 15.893 11.399 -7.301 1.00 0.00 C ATOM 411 CG GLU A 941 17.197 11.568 -8.061 1.00 0.00 C ATOM 412 CD GLU A 941 17.109 12.627 -9.142 1.00 0.00 C ATOM 413 OE1 GLU A 941 16.209 12.523 -10.002 1.00 0.00 O ATOM 414 OE2 GLU A 941 17.939 13.560 -9.129 1.00 0.00 O ATOM 0 H GLU A 941 16.697 12.814 -5.442 1.00 0.00 H new ATOM 0 HA GLU A 941 15.231 13.383 -7.799 1.00 0.00 H new ATOM 0 HB2 GLU A 941 16.084 10.832 -6.390 1.00 0.00 H new ATOM 0 HB3 GLU A 941 15.204 10.809 -7.905 1.00 0.00 H new ATOM 0 HG2 GLU A 941 17.989 11.834 -7.361 1.00 0.00 H new ATOM 0 HG3 GLU A 941 17.476 10.616 -8.512 1.00 0.00 H new ATOM 421 N ILE A 942 13.568 12.118 -5.264 1.00 0.00 N ATOM 422 CA ILE A 942 12.229 11.853 -4.752 1.00 0.00 C ATOM 423 C ILE A 942 11.401 13.132 -4.693 1.00 0.00 C ATOM 424 O ILE A 942 10.263 13.171 -5.163 1.00 0.00 O ATOM 425 CB ILE A 942 12.278 11.221 -3.349 1.00 0.00 C ATOM 426 CG1 ILE A 942 12.921 9.834 -3.413 1.00 0.00 C ATOM 427 CG2 ILE A 942 10.879 11.136 -2.757 1.00 0.00 C ATOM 428 CD1 ILE A 942 13.554 9.400 -2.109 1.00 0.00 C ATOM 0 H ILE A 942 14.313 12.004 -4.576 1.00 0.00 H new ATOM 0 HA ILE A 942 11.760 11.151 -5.441 1.00 0.00 H new ATOM 0 HB ILE A 942 12.887 11.853 -2.703 1.00 0.00 H new ATOM 0 HG12 ILE A 942 12.164 9.104 -3.700 1.00 0.00 H new ATOM 0 HG13 ILE A 942 13.680 9.830 -4.195 1.00 0.00 H new ATOM 0 HG21 ILE A 942 10.930 10.687 -1.765 1.00 0.00 H new ATOM 0 HG22 ILE A 942 10.455 12.137 -2.681 1.00 0.00 H new ATOM 0 HG23 ILE A 942 10.248 10.523 -3.401 1.00 0.00 H new ATOM 0 HD11 ILE A 942 13.990 8.408 -2.228 1.00 0.00 H new ATOM 0 HD12 ILE A 942 14.334 10.108 -1.830 1.00 0.00 H new ATOM 0 HD13 ILE A 942 12.794 9.371 -1.328 1.00 0.00 H new ATOM 440 N LEU A 943 11.979 14.178 -4.113 1.00 0.00 N ATOM 441 CA LEU A 943 11.295 15.461 -3.993 1.00 0.00 C ATOM 442 C LEU A 943 10.894 15.995 -5.365 1.00 0.00 C ATOM 443 O LEU A 943 9.794 16.519 -5.541 1.00 0.00 O ATOM 444 CB LEU A 943 12.192 16.475 -3.281 1.00 0.00 C ATOM 445 CG LEU A 943 12.154 16.448 -1.752 1.00 0.00 C ATOM 446 CD1 LEU A 943 13.204 17.385 -1.176 1.00 0.00 C ATOM 447 CD2 LEU A 943 10.768 16.820 -1.246 1.00 0.00 C ATOM 0 H LEU A 943 12.919 14.163 -3.718 1.00 0.00 H new ATOM 0 HA LEU A 943 10.390 15.309 -3.404 1.00 0.00 H new ATOM 0 HB2 LEU A 943 13.220 16.309 -3.602 1.00 0.00 H new ATOM 0 HB3 LEU A 943 11.912 17.474 -3.614 1.00 0.00 H new ATOM 0 HG LEU A 943 12.380 15.435 -1.420 1.00 0.00 H new ATOM 0 HD11 LEU A 943 13.162 17.353 -0.087 1.00 0.00 H new ATOM 0 HD12 LEU A 943 14.193 17.073 -1.511 1.00 0.00 H new ATOM 0 HD13 LEU A 943 13.010 18.402 -1.517 1.00 0.00 H new ATOM 0 HD21 LEU A 943 10.760 16.795 -0.156 1.00 0.00 H new ATOM 0 HD22 LEU A 943 10.513 17.823 -1.588 1.00 0.00 H new ATOM 0 HD23 LEU A 943 10.037 16.108 -1.630 1.00 0.00 H new ATOM 459 N ASP A 944 11.793 15.857 -6.333 1.00 0.00 N ATOM 460 CA ASP A 944 11.532 16.322 -7.690 1.00 0.00 C ATOM 461 C ASP A 944 10.507 15.429 -8.383 1.00 0.00 C ATOM 462 O ASP A 944 9.744 15.887 -9.234 1.00 0.00 O ATOM 463 CB ASP A 944 12.829 16.353 -8.500 1.00 0.00 C ATOM 464 CG ASP A 944 12.744 17.282 -9.694 1.00 0.00 C ATOM 465 OD1 ASP A 944 12.092 18.341 -9.578 1.00 0.00 O ATOM 466 OD2 ASP A 944 13.331 16.951 -10.746 1.00 0.00 O ATOM 0 H ASP A 944 12.709 15.427 -6.203 1.00 0.00 H new ATOM 0 HA ASP A 944 11.126 17.332 -7.629 1.00 0.00 H new ATOM 0 HB2 ASP A 944 13.649 16.669 -7.855 1.00 0.00 H new ATOM 0 HB3 ASP A 944 13.064 15.345 -8.843 1.00 0.00 H new ATOM 471 N PHE A 945 10.497 14.152 -8.014 1.00 0.00 N ATOM 472 CA PHE A 945 9.568 13.194 -8.602 1.00 0.00 C ATOM 473 C PHE A 945 8.126 13.548 -8.247 1.00 0.00 C ATOM 474 O PHE A 945 7.223 13.420 -9.074 1.00 0.00 O ATOM 475 CB PHE A 945 9.890 11.778 -8.121 1.00 0.00 C ATOM 476 CG PHE A 945 8.850 10.764 -8.503 1.00 0.00 C ATOM 477 CD1 PHE A 945 7.637 10.711 -7.836 1.00 0.00 C ATOM 478 CD2 PHE A 945 9.085 9.863 -9.529 1.00 0.00 C ATOM 479 CE1 PHE A 945 6.679 9.779 -8.184 1.00 0.00 C ATOM 480 CE2 PHE A 945 8.130 8.928 -9.883 1.00 0.00 C ATOM 481 CZ PHE A 945 6.925 8.887 -9.210 1.00 0.00 C ATOM 0 H PHE A 945 11.121 13.757 -7.311 1.00 0.00 H new ATOM 0 HA PHE A 945 9.679 13.236 -9.686 1.00 0.00 H new ATOM 0 HB2 PHE A 945 10.852 11.473 -8.533 1.00 0.00 H new ATOM 0 HB3 PHE A 945 9.996 11.787 -7.036 1.00 0.00 H new ATOM 0 HD1 PHE A 945 7.438 11.407 -7.034 1.00 0.00 H new ATOM 0 HD2 PHE A 945 10.026 9.891 -10.059 1.00 0.00 H new ATOM 0 HE1 PHE A 945 5.738 9.747 -7.654 1.00 0.00 H new ATOM 0 HE2 PHE A 945 8.326 8.231 -10.684 1.00 0.00 H new ATOM 0 HZ PHE A 945 6.176 8.159 -9.485 1.00 0.00 H new ATOM 491 N PHE A 946 7.919 13.991 -7.012 1.00 0.00 N ATOM 492 CA PHE A 946 6.587 14.362 -6.547 1.00 0.00 C ATOM 493 C PHE A 946 6.281 15.820 -6.878 1.00 0.00 C ATOM 494 O PHE A 946 5.320 16.395 -6.367 1.00 0.00 O ATOM 495 CB PHE A 946 6.470 14.135 -5.038 1.00 0.00 C ATOM 496 CG PHE A 946 6.194 12.706 -4.667 1.00 0.00 C ATOM 497 CD1 PHE A 946 4.895 12.225 -4.627 1.00 0.00 C ATOM 498 CD2 PHE A 946 7.234 11.844 -4.356 1.00 0.00 C ATOM 499 CE1 PHE A 946 4.638 10.910 -4.286 1.00 0.00 C ATOM 500 CE2 PHE A 946 6.983 10.529 -4.015 1.00 0.00 C ATOM 501 CZ PHE A 946 5.683 10.061 -3.979 1.00 0.00 C ATOM 0 H PHE A 946 8.656 14.102 -6.315 1.00 0.00 H new ATOM 0 HA PHE A 946 5.861 13.731 -7.061 1.00 0.00 H new ATOM 0 HB2 PHE A 946 7.395 14.455 -4.558 1.00 0.00 H new ATOM 0 HB3 PHE A 946 5.672 14.765 -4.645 1.00 0.00 H new ATOM 0 HD1 PHE A 946 4.074 12.885 -4.865 1.00 0.00 H new ATOM 0 HD2 PHE A 946 8.252 12.204 -4.381 1.00 0.00 H new ATOM 0 HE1 PHE A 946 3.621 10.547 -4.260 1.00 0.00 H new ATOM 0 HE2 PHE A 946 7.802 9.867 -3.777 1.00 0.00 H new ATOM 0 HZ PHE A 946 5.485 9.034 -3.711 1.00 0.00 H new ATOM 511 N TYR A 947 7.105 16.410 -7.736 1.00 0.00 N ATOM 512 CA TYR A 947 6.926 17.801 -8.134 1.00 0.00 C ATOM 513 C TYR A 947 5.469 18.082 -8.492 1.00 0.00 C ATOM 514 O TYR A 947 4.757 17.204 -8.978 1.00 0.00 O ATOM 515 CB TYR A 947 7.828 18.134 -9.324 1.00 0.00 C ATOM 516 CG TYR A 947 7.755 19.582 -9.753 1.00 0.00 C ATOM 517 CD1 TYR A 947 8.262 20.592 -8.945 1.00 0.00 C ATOM 518 CD2 TYR A 947 7.179 19.940 -10.966 1.00 0.00 C ATOM 519 CE1 TYR A 947 8.197 21.917 -9.332 1.00 0.00 C ATOM 520 CE2 TYR A 947 7.112 21.262 -11.362 1.00 0.00 C ATOM 521 CZ TYR A 947 7.622 22.246 -10.541 1.00 0.00 C ATOM 522 OH TYR A 947 7.555 23.564 -10.932 1.00 0.00 O ATOM 0 H TYR A 947 7.904 15.947 -8.169 1.00 0.00 H new ATOM 0 HA TYR A 947 7.203 18.432 -7.289 1.00 0.00 H new ATOM 0 HB2 TYR A 947 8.859 17.892 -9.067 1.00 0.00 H new ATOM 0 HB3 TYR A 947 7.552 17.500 -10.167 1.00 0.00 H new ATOM 0 HD1 TYR A 947 8.715 20.337 -7.998 1.00 0.00 H new ATOM 0 HD2 TYR A 947 6.777 19.172 -11.610 1.00 0.00 H new ATOM 0 HE1 TYR A 947 8.594 22.690 -8.691 1.00 0.00 H new ATOM 0 HE2 TYR A 947 6.663 21.523 -12.309 1.00 0.00 H new ATOM 0 HH TYR A 947 7.122 23.623 -11.809 1.00 0.00 H new ATOM 532 N GLY A 948 5.034 19.314 -8.249 1.00 0.00 N ATOM 533 CA GLY A 948 3.665 19.691 -8.551 1.00 0.00 C ATOM 534 C GLY A 948 2.749 19.558 -7.352 1.00 0.00 C ATOM 535 O GLY A 948 1.942 20.447 -7.076 1.00 0.00 O ATOM 0 H GLY A 948 5.605 20.058 -7.848 1.00 0.00 H new ATOM 0 HA2 GLY A 948 3.645 20.721 -8.907 1.00 0.00 H new ATOM 0 HA3 GLY A 948 3.290 19.066 -9.362 1.00 0.00 H new ATOM 539 N TYR A 949 2.871 18.445 -6.636 1.00 0.00 N ATOM 540 CA TYR A 949 2.043 18.197 -5.461 1.00 0.00 C ATOM 541 C TYR A 949 2.733 18.696 -4.195 1.00 0.00 C ATOM 542 O TYR A 949 3.923 18.460 -3.990 1.00 0.00 O ATOM 543 CB TYR A 949 1.735 16.705 -5.334 1.00 0.00 C ATOM 544 CG TYR A 949 1.037 16.125 -6.544 1.00 0.00 C ATOM 545 CD1 TYR A 949 -0.335 16.265 -6.711 1.00 0.00 C ATOM 546 CD2 TYR A 949 1.749 15.438 -7.519 1.00 0.00 C ATOM 547 CE1 TYR A 949 -0.978 15.737 -7.814 1.00 0.00 C ATOM 548 CE2 TYR A 949 1.115 14.907 -8.626 1.00 0.00 C ATOM 549 CZ TYR A 949 -0.248 15.059 -8.769 1.00 0.00 C ATOM 550 OH TYR A 949 -0.884 14.531 -9.869 1.00 0.00 O ATOM 0 H TYR A 949 3.535 17.701 -6.849 1.00 0.00 H new ATOM 0 HA TYR A 949 1.108 18.744 -5.584 1.00 0.00 H new ATOM 0 HB2 TYR A 949 2.666 16.163 -5.168 1.00 0.00 H new ATOM 0 HB3 TYR A 949 1.112 16.545 -4.454 1.00 0.00 H new ATOM 0 HD1 TYR A 949 -0.909 16.796 -5.966 1.00 0.00 H new ATOM 0 HD2 TYR A 949 2.817 15.317 -7.410 1.00 0.00 H new ATOM 0 HE1 TYR A 949 -2.046 15.854 -7.928 1.00 0.00 H new ATOM 0 HE2 TYR A 949 1.684 14.376 -9.375 1.00 0.00 H new ATOM 0 HH TYR A 949 -0.220 14.301 -10.552 1.00 0.00 H new ATOM 560 N GLN A 950 1.975 19.385 -3.349 1.00 0.00 N ATOM 561 CA GLN A 950 2.512 19.917 -2.102 1.00 0.00 C ATOM 562 C GLN A 950 2.768 18.798 -1.098 1.00 0.00 C ATOM 563 O GLN A 950 1.930 18.512 -0.243 1.00 0.00 O ATOM 564 CB GLN A 950 1.548 20.944 -1.504 1.00 0.00 C ATOM 565 CG GLN A 950 1.383 22.192 -2.355 1.00 0.00 C ATOM 566 CD GLN A 950 2.484 23.208 -2.121 1.00 0.00 C ATOM 567 OE1 GLN A 950 2.764 23.586 -0.983 1.00 0.00 O ATOM 568 NE2 GLN A 950 3.116 23.655 -3.200 1.00 0.00 N ATOM 0 H GLN A 950 0.987 19.588 -3.504 1.00 0.00 H new ATOM 0 HA GLN A 950 3.461 20.405 -2.324 1.00 0.00 H new ATOM 0 HB2 GLN A 950 0.573 20.477 -1.366 1.00 0.00 H new ATOM 0 HB3 GLN A 950 1.906 21.233 -0.516 1.00 0.00 H new ATOM 0 HG2 GLN A 950 1.372 21.910 -3.408 1.00 0.00 H new ATOM 0 HG3 GLN A 950 0.418 22.651 -2.137 1.00 0.00 H new ATOM 0 HE21 GLN A 950 2.851 23.314 -4.124 1.00 0.00 H new ATOM 0 HE22 GLN A 950 3.867 24.339 -3.105 1.00 0.00 H new ATOM 577 N VAL A 951 3.933 18.166 -1.209 1.00 0.00 N ATOM 578 CA VAL A 951 4.301 17.078 -0.311 1.00 0.00 C ATOM 579 C VAL A 951 4.683 17.608 1.067 1.00 0.00 C ATOM 580 O VAL A 951 5.579 18.443 1.194 1.00 0.00 O ATOM 581 CB VAL A 951 5.473 16.256 -0.876 1.00 0.00 C ATOM 582 CG1 VAL A 951 5.905 15.188 0.117 1.00 0.00 C ATOM 583 CG2 VAL A 951 5.091 15.631 -2.210 1.00 0.00 C ATOM 0 H VAL A 951 4.638 18.389 -1.912 1.00 0.00 H new ATOM 0 HA VAL A 951 3.427 16.434 -0.220 1.00 0.00 H new ATOM 0 HB VAL A 951 6.316 16.926 -1.042 1.00 0.00 H new ATOM 0 HG11 VAL A 951 6.735 14.617 -0.300 1.00 0.00 H new ATOM 0 HG12 VAL A 951 6.222 15.662 1.046 1.00 0.00 H new ATOM 0 HG13 VAL A 951 5.069 14.518 0.318 1.00 0.00 H new ATOM 0 HG21 VAL A 951 5.931 15.053 -2.595 1.00 0.00 H new ATOM 0 HG22 VAL A 951 4.232 14.974 -2.071 1.00 0.00 H new ATOM 0 HG23 VAL A 951 4.835 16.417 -2.920 1.00 0.00 H new ATOM 593 N ILE A 952 3.999 17.117 2.094 1.00 0.00 N ATOM 594 CA ILE A 952 4.269 17.540 3.463 1.00 0.00 C ATOM 595 C ILE A 952 5.760 17.471 3.776 1.00 0.00 C ATOM 596 O ILE A 952 6.422 16.459 3.543 1.00 0.00 O ATOM 597 CB ILE A 952 3.501 16.676 4.481 1.00 0.00 C ATOM 598 CG1 ILE A 952 1.993 16.867 4.310 1.00 0.00 C ATOM 599 CG2 ILE A 952 3.927 17.025 5.899 1.00 0.00 C ATOM 600 CD1 ILE A 952 1.166 16.032 5.262 1.00 0.00 C ATOM 0 H ILE A 952 3.254 16.426 2.005 1.00 0.00 H new ATOM 0 HA ILE A 952 3.930 18.573 3.547 1.00 0.00 H new ATOM 0 HB ILE A 952 3.738 15.628 4.298 1.00 0.00 H new ATOM 0 HG12 ILE A 952 1.749 17.919 4.457 1.00 0.00 H new ATOM 0 HG13 ILE A 952 1.717 16.616 3.286 1.00 0.00 H new ATOM 0 HG21 ILE A 952 3.376 16.406 6.607 1.00 0.00 H new ATOM 0 HG22 ILE A 952 4.996 16.843 6.013 1.00 0.00 H new ATOM 0 HG23 ILE A 952 3.715 18.076 6.094 1.00 0.00 H new ATOM 0 HD11 ILE A 952 0.107 16.219 5.084 1.00 0.00 H new ATOM 0 HD12 ILE A 952 1.381 14.976 5.100 1.00 0.00 H new ATOM 0 HD13 ILE A 952 1.413 16.299 6.289 1.00 0.00 H new ATOM 612 N PRO A 953 6.302 18.571 4.319 1.00 0.00 N ATOM 613 CA PRO A 953 7.721 18.659 4.678 1.00 0.00 C ATOM 614 C PRO A 953 8.072 17.778 5.872 1.00 0.00 C ATOM 615 O PRO A 953 7.364 17.767 6.878 1.00 0.00 O ATOM 616 CB PRO A 953 7.905 20.137 5.032 1.00 0.00 C ATOM 617 CG PRO A 953 6.552 20.599 5.451 1.00 0.00 C ATOM 618 CD PRO A 953 5.572 19.813 4.624 1.00 0.00 C ATOM 0 HA PRO A 953 8.368 18.315 3.871 1.00 0.00 H new ATOM 0 HB2 PRO A 953 8.632 20.264 5.834 1.00 0.00 H new ATOM 0 HB3 PRO A 953 8.270 20.706 4.177 1.00 0.00 H new ATOM 0 HG2 PRO A 953 6.392 20.425 6.515 1.00 0.00 H new ATOM 0 HG3 PRO A 953 6.435 21.669 5.282 1.00 0.00 H new ATOM 0 HD2 PRO A 953 4.652 19.614 5.173 1.00 0.00 H new ATOM 0 HD3 PRO A 953 5.292 20.348 3.716 1.00 0.00 H new ATOM 626 N GLY A 954 9.172 17.040 5.754 1.00 0.00 N ATOM 627 CA GLY A 954 9.598 16.166 6.831 1.00 0.00 C ATOM 628 C GLY A 954 8.920 14.811 6.781 1.00 0.00 C ATOM 629 O GLY A 954 9.085 13.993 7.686 1.00 0.00 O ATOM 0 H GLY A 954 9.775 17.032 4.932 1.00 0.00 H new ATOM 0 HA2 GLY A 954 10.678 16.030 6.779 1.00 0.00 H new ATOM 0 HA3 GLY A 954 9.382 16.642 7.788 1.00 0.00 H new ATOM 633 N SER A 955 8.154 14.573 5.721 1.00 0.00 N ATOM 634 CA SER A 955 7.444 13.310 5.559 1.00 0.00 C ATOM 635 C SER A 955 8.329 12.274 4.873 1.00 0.00 C ATOM 636 O SER A 955 8.544 11.180 5.396 1.00 0.00 O ATOM 637 CB SER A 955 6.163 13.521 4.750 1.00 0.00 C ATOM 638 OG SER A 955 6.459 13.822 3.397 1.00 0.00 O ATOM 0 H SER A 955 8.009 15.238 4.962 1.00 0.00 H new ATOM 0 HA SER A 955 7.182 12.939 6.550 1.00 0.00 H new ATOM 0 HB2 SER A 955 5.546 12.624 4.800 1.00 0.00 H new ATOM 0 HB3 SER A 955 5.582 14.333 5.188 1.00 0.00 H new ATOM 0 HG SER A 955 6.718 14.764 3.320 1.00 0.00 H new ATOM 644 N VAL A 956 8.839 12.626 3.697 1.00 0.00 N ATOM 645 CA VAL A 956 9.701 11.728 2.938 1.00 0.00 C ATOM 646 C VAL A 956 10.596 10.913 3.864 1.00 0.00 C ATOM 647 O VAL A 956 11.662 11.371 4.276 1.00 0.00 O ATOM 648 CB VAL A 956 10.583 12.505 1.943 1.00 0.00 C ATOM 649 CG1 VAL A 956 11.424 11.547 1.113 1.00 0.00 C ATOM 650 CG2 VAL A 956 9.726 13.387 1.048 1.00 0.00 C ATOM 0 H VAL A 956 8.670 13.527 3.249 1.00 0.00 H new ATOM 0 HA VAL A 956 9.047 11.055 2.384 1.00 0.00 H new ATOM 0 HB VAL A 956 11.259 13.147 2.508 1.00 0.00 H new ATOM 0 HG11 VAL A 956 12.040 12.114 0.416 1.00 0.00 H new ATOM 0 HG12 VAL A 956 12.066 10.962 1.772 1.00 0.00 H new ATOM 0 HG13 VAL A 956 10.769 10.877 0.556 1.00 0.00 H new ATOM 0 HG21 VAL A 956 10.366 13.929 0.351 1.00 0.00 H new ATOM 0 HG22 VAL A 956 9.025 12.767 0.490 1.00 0.00 H new ATOM 0 HG23 VAL A 956 9.173 14.099 1.661 1.00 0.00 H new ATOM 660 N CYS A 957 10.156 9.702 4.187 1.00 0.00 N ATOM 661 CA CYS A 957 10.918 8.821 5.065 1.00 0.00 C ATOM 662 C CYS A 957 11.434 7.605 4.302 1.00 0.00 C ATOM 663 O CYS A 957 10.665 6.890 3.658 1.00 0.00 O ATOM 664 CB CYS A 957 10.053 8.369 6.243 1.00 0.00 C ATOM 665 SG CYS A 957 10.992 7.952 7.731 1.00 0.00 S ATOM 0 H CYS A 957 9.276 9.308 3.854 1.00 0.00 H new ATOM 0 HA CYS A 957 11.774 9.379 5.444 1.00 0.00 H new ATOM 0 HB2 CYS A 957 9.344 9.161 6.484 1.00 0.00 H new ATOM 0 HB3 CYS A 957 9.469 7.500 5.939 1.00 0.00 H new ATOM 0 HG CYS A 957 10.174 7.584 8.672 1.00 0.00 H new ATOM 671 N LEU A 958 12.741 7.378 4.377 1.00 0.00 N ATOM 672 CA LEU A 958 13.361 6.249 3.691 1.00 0.00 C ATOM 673 C LEU A 958 13.523 5.061 4.634 1.00 0.00 C ATOM 674 O LEU A 958 13.905 5.222 5.794 1.00 0.00 O ATOM 675 CB LEU A 958 14.723 6.656 3.127 1.00 0.00 C ATOM 676 CG LEU A 958 14.715 7.801 2.114 1.00 0.00 C ATOM 677 CD1 LEU A 958 16.127 8.316 1.878 1.00 0.00 C ATOM 678 CD2 LEU A 958 14.084 7.351 0.804 1.00 0.00 C ATOM 0 H LEU A 958 13.391 7.960 4.905 1.00 0.00 H new ATOM 0 HA LEU A 958 12.709 5.951 2.870 1.00 0.00 H new ATOM 0 HB2 LEU A 958 15.369 6.938 3.959 1.00 0.00 H new ATOM 0 HB3 LEU A 958 15.174 5.783 2.655 1.00 0.00 H new ATOM 0 HG LEU A 958 14.116 8.616 2.522 1.00 0.00 H new ATOM 0 HD11 LEU A 958 16.101 9.131 1.154 1.00 0.00 H new ATOM 0 HD12 LEU A 958 16.544 8.679 2.818 1.00 0.00 H new ATOM 0 HD13 LEU A 958 16.749 7.508 1.493 1.00 0.00 H new ATOM 0 HD21 LEU A 958 14.087 8.179 0.095 1.00 0.00 H new ATOM 0 HD22 LEU A 958 14.655 6.519 0.392 1.00 0.00 H new ATOM 0 HD23 LEU A 958 13.057 7.032 0.985 1.00 0.00 H new ATOM 690 N LYS A 959 13.232 3.867 4.129 1.00 0.00 N ATOM 691 CA LYS A 959 13.349 2.651 4.923 1.00 0.00 C ATOM 692 C LYS A 959 14.705 1.987 4.707 1.00 0.00 C ATOM 693 O LYS A 959 15.080 1.674 3.577 1.00 0.00 O ATOM 694 CB LYS A 959 12.227 1.673 4.564 1.00 0.00 C ATOM 695 CG LYS A 959 11.818 0.767 5.713 1.00 0.00 C ATOM 696 CD LYS A 959 12.823 -0.353 5.924 1.00 0.00 C ATOM 697 CE LYS A 959 12.228 -1.488 6.743 1.00 0.00 C ATOM 698 NZ LYS A 959 12.251 -1.191 8.202 1.00 0.00 N ATOM 0 H LYS A 959 12.913 3.716 3.172 1.00 0.00 H new ATOM 0 HA LYS A 959 13.262 2.924 5.975 1.00 0.00 H new ATOM 0 HB2 LYS A 959 11.357 2.238 4.231 1.00 0.00 H new ATOM 0 HB3 LYS A 959 12.548 1.057 3.724 1.00 0.00 H new ATOM 0 HG2 LYS A 959 11.729 1.354 6.627 1.00 0.00 H new ATOM 0 HG3 LYS A 959 10.835 0.342 5.510 1.00 0.00 H new ATOM 0 HD2 LYS A 959 13.153 -0.734 4.958 1.00 0.00 H new ATOM 0 HD3 LYS A 959 13.705 0.039 6.430 1.00 0.00 H new ATOM 0 HE2 LYS A 959 11.201 -1.666 6.425 1.00 0.00 H new ATOM 0 HE3 LYS A 959 12.784 -2.405 6.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 959 11.837 -1.989 8.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 959 13.233 -1.047 8.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 959 11.699 -0.330 8.390 1.00 0.00 H new ATOM 712 N TYR A 960 15.434 1.773 5.796 1.00 0.00 N ATOM 713 CA TYR A 960 16.749 1.147 5.724 1.00 0.00 C ATOM 714 C TYR A 960 16.727 -0.241 6.359 1.00 0.00 C ATOM 715 O TYR A 960 15.719 -0.660 6.925 1.00 0.00 O ATOM 716 CB TYR A 960 17.792 2.022 6.421 1.00 0.00 C ATOM 717 CG TYR A 960 17.970 3.379 5.780 1.00 0.00 C ATOM 718 CD1 TYR A 960 18.676 3.521 4.592 1.00 0.00 C ATOM 719 CD2 TYR A 960 17.432 4.521 6.362 1.00 0.00 C ATOM 720 CE1 TYR A 960 18.841 4.760 4.002 1.00 0.00 C ATOM 721 CE2 TYR A 960 17.591 5.763 5.779 1.00 0.00 C ATOM 722 CZ TYR A 960 18.296 5.877 4.599 1.00 0.00 C ATOM 723 OH TYR A 960 18.458 7.113 4.016 1.00 0.00 O ATOM 0 H TYR A 960 15.137 2.024 6.739 1.00 0.00 H new ATOM 0 HA TYR A 960 17.016 1.042 4.673 1.00 0.00 H new ATOM 0 HB2 TYR A 960 17.503 2.157 7.463 1.00 0.00 H new ATOM 0 HB3 TYR A 960 18.749 1.501 6.421 1.00 0.00 H new ATOM 0 HD1 TYR A 960 19.103 2.648 4.121 1.00 0.00 H new ATOM 0 HD2 TYR A 960 16.880 4.436 7.286 1.00 0.00 H new ATOM 0 HE1 TYR A 960 19.394 4.853 3.079 1.00 0.00 H new ATOM 0 HE2 TYR A 960 17.166 6.640 6.244 1.00 0.00 H new ATOM 0 HH TYR A 960 18.012 7.793 4.563 1.00 0.00 H new ATOM 733 N ASN A 961 17.848 -0.947 6.260 1.00 0.00 N ATOM 734 CA ASN A 961 17.959 -2.288 6.823 1.00 0.00 C ATOM 735 C ASN A 961 18.790 -2.273 8.102 1.00 0.00 C ATOM 736 O ASN A 961 19.234 -1.217 8.553 1.00 0.00 O ATOM 737 CB ASN A 961 18.587 -3.242 5.805 1.00 0.00 C ATOM 738 CG ASN A 961 19.806 -2.645 5.129 1.00 0.00 C ATOM 739 OD1 ASN A 961 20.183 -1.505 5.399 1.00 0.00 O ATOM 740 ND2 ASN A 961 20.429 -3.416 4.246 1.00 0.00 N ATOM 0 H ASN A 961 18.693 -0.613 5.795 1.00 0.00 H new ATOM 0 HA ASN A 961 16.955 -2.637 7.066 1.00 0.00 H new ATOM 0 HB2 ASN A 961 18.869 -4.168 6.305 1.00 0.00 H new ATOM 0 HB3 ASN A 961 17.846 -3.501 5.049 1.00 0.00 H new ATOM 0 HD21 ASN A 961 21.256 -3.069 3.760 1.00 0.00 H new ATOM 0 HD22 ASN A 961 20.081 -4.355 4.054 1.00 0.00 H new ATOM 747 N GLU A 962 18.996 -3.452 8.682 1.00 0.00 N ATOM 748 CA GLU A 962 19.774 -3.573 9.909 1.00 0.00 C ATOM 749 C GLU A 962 21.185 -3.025 9.716 1.00 0.00 C ATOM 750 O GLU A 962 21.884 -2.721 10.683 1.00 0.00 O ATOM 751 CB GLU A 962 19.841 -5.036 10.354 1.00 0.00 C ATOM 752 CG GLU A 962 20.486 -5.955 9.331 1.00 0.00 C ATOM 753 CD GLU A 962 20.384 -7.418 9.715 1.00 0.00 C ATOM 754 OE1 GLU A 962 19.425 -7.780 10.428 1.00 0.00 O ATOM 755 OE2 GLU A 962 21.265 -8.202 9.302 1.00 0.00 O ATOM 0 H GLU A 962 18.635 -4.336 8.322 1.00 0.00 H new ATOM 0 HA GLU A 962 19.278 -2.987 10.682 1.00 0.00 H new ATOM 0 HB2 GLU A 962 20.399 -5.097 11.288 1.00 0.00 H new ATOM 0 HB3 GLU A 962 18.831 -5.390 10.562 1.00 0.00 H new ATOM 0 HG2 GLU A 962 20.011 -5.804 8.362 1.00 0.00 H new ATOM 0 HG3 GLU A 962 21.536 -5.685 9.217 1.00 0.00 H new ATOM 762 N LYS A 963 21.598 -2.901 8.459 1.00 0.00 N ATOM 763 CA LYS A 963 22.925 -2.389 8.136 1.00 0.00 C ATOM 764 C LYS A 963 22.898 -0.872 7.975 1.00 0.00 C ATOM 765 O LYS A 963 23.846 -0.182 8.347 1.00 0.00 O ATOM 766 CB LYS A 963 23.446 -3.039 6.852 1.00 0.00 C ATOM 767 CG LYS A 963 23.524 -4.554 6.926 1.00 0.00 C ATOM 768 CD LYS A 963 22.208 -5.200 6.528 1.00 0.00 C ATOM 769 CE LYS A 963 22.328 -6.715 6.460 1.00 0.00 C ATOM 770 NZ LYS A 963 23.373 -7.145 5.490 1.00 0.00 N ATOM 0 H LYS A 963 21.033 -3.148 7.647 1.00 0.00 H new ATOM 0 HA LYS A 963 23.594 -2.638 8.960 1.00 0.00 H new ATOM 0 HB2 LYS A 963 22.797 -2.757 6.023 1.00 0.00 H new ATOM 0 HB3 LYS A 963 24.437 -2.643 6.630 1.00 0.00 H new ATOM 0 HG2 LYS A 963 24.318 -4.911 6.270 1.00 0.00 H new ATOM 0 HG3 LYS A 963 23.787 -4.857 7.940 1.00 0.00 H new ATOM 0 HD2 LYS A 963 21.436 -4.927 7.247 1.00 0.00 H new ATOM 0 HD3 LYS A 963 21.891 -4.815 5.559 1.00 0.00 H new ATOM 0 HE2 LYS A 963 22.568 -7.105 7.449 1.00 0.00 H new ATOM 0 HE3 LYS A 963 21.368 -7.143 6.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 963 23.216 -8.139 5.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 963 23.321 -6.551 4.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 963 24.312 -7.046 5.925 1.00 0.00 H new ATOM 784 N GLY A 964 21.804 -0.359 7.420 1.00 0.00 N ATOM 785 CA GLY A 964 21.674 1.073 7.222 1.00 0.00 C ATOM 786 C GLY A 964 21.494 1.442 5.763 1.00 0.00 C ATOM 787 O GLY A 964 21.097 2.563 5.444 1.00 0.00 O ATOM 0 H GLY A 964 21.006 -0.909 7.104 1.00 0.00 H new ATOM 0 HA2 GLY A 964 20.822 1.440 7.794 1.00 0.00 H new ATOM 0 HA3 GLY A 964 22.560 1.573 7.613 1.00 0.00 H new ATOM 791 N MET A 965 21.787 0.498 4.875 1.00 0.00 N ATOM 792 CA MET A 965 21.655 0.731 3.441 1.00 0.00 C ATOM 793 C MET A 965 20.187 0.856 3.044 1.00 0.00 C ATOM 794 O MET A 965 19.291 0.349 3.719 1.00 0.00 O ATOM 795 CB MET A 965 22.313 -0.405 2.656 1.00 0.00 C ATOM 796 CG MET A 965 23.832 -0.344 2.658 1.00 0.00 C ATOM 797 SD MET A 965 24.472 1.075 1.748 1.00 0.00 S ATOM 798 CE MET A 965 24.456 0.440 0.074 1.00 0.00 C ATOM 0 H MET A 965 22.117 -0.435 5.122 1.00 0.00 H new ATOM 0 HA MET A 965 22.159 1.667 3.202 1.00 0.00 H new ATOM 0 HB2 MET A 965 21.995 -1.359 3.077 1.00 0.00 H new ATOM 0 HB3 MET A 965 21.958 -0.377 1.626 1.00 0.00 H new ATOM 0 HG2 MET A 965 24.189 -0.301 3.687 1.00 0.00 H new ATOM 0 HG3 MET A 965 24.229 -1.260 2.221 1.00 0.00 H new ATOM 0 HE1 MET A 965 24.826 1.205 -0.609 1.00 0.00 H new ATOM 0 HE2 MET A 965 25.095 -0.441 0.013 1.00 0.00 H new ATOM 0 HE3 MET A 965 23.437 0.169 -0.203 1.00 0.00 H new ATOM 808 N PRO A 966 19.934 1.546 1.922 1.00 0.00 N ATOM 809 CA PRO A 966 18.576 1.752 1.409 1.00 0.00 C ATOM 810 C PRO A 966 17.956 0.466 0.875 1.00 0.00 C ATOM 811 O PRO A 966 18.616 -0.317 0.191 1.00 0.00 O ATOM 812 CB PRO A 966 18.775 2.761 0.275 1.00 0.00 C ATOM 813 CG PRO A 966 20.184 2.563 -0.166 1.00 0.00 C ATOM 814 CD PRO A 966 20.953 2.177 1.067 1.00 0.00 C ATOM 0 HA PRO A 966 17.894 2.093 2.188 1.00 0.00 H new ATOM 0 HB2 PRO A 966 18.076 2.582 -0.542 1.00 0.00 H new ATOM 0 HB3 PRO A 966 18.608 3.782 0.619 1.00 0.00 H new ATOM 0 HG2 PRO A 966 20.249 1.785 -0.926 1.00 0.00 H new ATOM 0 HG3 PRO A 966 20.587 3.475 -0.608 1.00 0.00 H new ATOM 0 HD2 PRO A 966 21.765 1.488 0.835 1.00 0.00 H new ATOM 0 HD3 PRO A 966 21.400 3.046 1.550 1.00 0.00 H new ATOM 822 N THR A 967 16.682 0.253 1.190 1.00 0.00 N ATOM 823 CA THR A 967 15.973 -0.939 0.742 1.00 0.00 C ATOM 824 C THR A 967 15.095 -0.635 -0.466 1.00 0.00 C ATOM 825 O THR A 967 14.412 -1.516 -0.987 1.00 0.00 O ATOM 826 CB THR A 967 15.097 -1.527 1.865 1.00 0.00 C ATOM 827 OG1 THR A 967 14.335 -0.487 2.487 1.00 0.00 O ATOM 828 CG2 THR A 967 15.954 -2.228 2.908 1.00 0.00 C ATOM 0 H THR A 967 16.120 0.891 1.754 1.00 0.00 H new ATOM 0 HA THR A 967 16.731 -1.671 0.462 1.00 0.00 H new ATOM 0 HB THR A 967 14.420 -2.258 1.423 1.00 0.00 H new ATOM 0 HG1 THR A 967 14.917 0.037 3.077 1.00 0.00 H new ATOM 0 HG21 THR A 967 15.314 -2.635 3.691 1.00 0.00 H new ATOM 0 HG22 THR A 967 16.511 -3.038 2.437 1.00 0.00 H new ATOM 0 HG23 THR A 967 16.652 -1.514 3.345 1.00 0.00 H new ATOM 836 N GLY A 968 15.117 0.619 -0.908 1.00 0.00 N ATOM 837 CA GLY A 968 14.319 1.017 -2.052 1.00 0.00 C ATOM 838 C GLY A 968 12.877 1.304 -1.682 1.00 0.00 C ATOM 839 O GLY A 968 11.969 1.088 -2.484 1.00 0.00 O ATOM 0 H GLY A 968 15.674 1.366 -0.493 1.00 0.00 H new ATOM 0 HA2 GLY A 968 14.758 1.905 -2.506 1.00 0.00 H new ATOM 0 HA3 GLY A 968 14.348 0.228 -2.803 1.00 0.00 H new ATOM 843 N GLU A 969 12.667 1.790 -0.462 1.00 0.00 N ATOM 844 CA GLU A 969 11.324 2.105 0.013 1.00 0.00 C ATOM 845 C GLU A 969 11.266 3.519 0.583 1.00 0.00 C ATOM 846 O GLU A 969 12.238 4.007 1.159 1.00 0.00 O ATOM 847 CB GLU A 969 10.886 1.095 1.076 1.00 0.00 C ATOM 848 CG GLU A 969 10.290 -0.177 0.499 1.00 0.00 C ATOM 849 CD GLU A 969 10.342 -1.340 1.471 1.00 0.00 C ATOM 850 OE1 GLU A 969 9.749 -1.225 2.564 1.00 0.00 O ATOM 851 OE2 GLU A 969 10.976 -2.363 1.141 1.00 0.00 O ATOM 0 H GLU A 969 13.408 1.974 0.214 1.00 0.00 H new ATOM 0 HA GLU A 969 10.643 2.047 -0.836 1.00 0.00 H new ATOM 0 HB2 GLU A 969 11.745 0.835 1.694 1.00 0.00 H new ATOM 0 HB3 GLU A 969 10.153 1.565 1.731 1.00 0.00 H new ATOM 0 HG2 GLU A 969 9.254 0.008 0.215 1.00 0.00 H new ATOM 0 HG3 GLU A 969 10.827 -0.445 -0.411 1.00 0.00 H new ATOM 858 N ALA A 970 10.120 4.170 0.418 1.00 0.00 N ATOM 859 CA ALA A 970 9.933 5.527 0.917 1.00 0.00 C ATOM 860 C ALA A 970 8.471 5.789 1.263 1.00 0.00 C ATOM 861 O ALA A 970 7.567 5.325 0.568 1.00 0.00 O ATOM 862 CB ALA A 970 10.425 6.538 -0.108 1.00 0.00 C ATOM 0 H ALA A 970 9.306 3.780 -0.058 1.00 0.00 H new ATOM 0 HA ALA A 970 10.519 5.636 1.829 1.00 0.00 H new ATOM 0 HB1 ALA A 970 10.279 7.547 0.277 1.00 0.00 H new ATOM 0 HB2 ALA A 970 11.485 6.373 -0.302 1.00 0.00 H new ATOM 0 HB3 ALA A 970 9.864 6.419 -1.035 1.00 0.00 H new ATOM 868 N MET A 971 8.247 6.533 2.341 1.00 0.00 N ATOM 869 CA MET A 971 6.894 6.857 2.778 1.00 0.00 C ATOM 870 C MET A 971 6.680 8.367 2.813 1.00 0.00 C ATOM 871 O MET A 971 7.584 9.123 3.169 1.00 0.00 O ATOM 872 CB MET A 971 6.625 6.260 4.160 1.00 0.00 C ATOM 873 CG MET A 971 6.148 4.817 4.117 1.00 0.00 C ATOM 874 SD MET A 971 6.342 3.974 5.699 1.00 0.00 S ATOM 875 CE MET A 971 4.788 4.381 6.492 1.00 0.00 C ATOM 0 H MET A 971 8.985 6.923 2.928 1.00 0.00 H new ATOM 0 HA MET A 971 6.195 6.426 2.061 1.00 0.00 H new ATOM 0 HB2 MET A 971 7.537 6.315 4.754 1.00 0.00 H new ATOM 0 HB3 MET A 971 5.876 6.867 4.669 1.00 0.00 H new ATOM 0 HG2 MET A 971 5.098 4.794 3.824 1.00 0.00 H new ATOM 0 HG3 MET A 971 6.705 4.277 3.351 1.00 0.00 H new ATOM 0 HE1 MET A 971 4.756 3.930 7.484 1.00 0.00 H new ATOM 0 HE2 MET A 971 4.699 5.463 6.583 1.00 0.00 H new ATOM 0 HE3 MET A 971 3.962 3.998 5.892 1.00 0.00 H new ATOM 885 N VAL A 972 5.480 8.799 2.440 1.00 0.00 N ATOM 886 CA VAL A 972 5.147 10.218 2.430 1.00 0.00 C ATOM 887 C VAL A 972 3.752 10.460 2.994 1.00 0.00 C ATOM 888 O VAL A 972 2.964 9.528 3.149 1.00 0.00 O ATOM 889 CB VAL A 972 5.223 10.802 1.007 1.00 0.00 C ATOM 890 CG1 VAL A 972 6.671 11.011 0.591 1.00 0.00 C ATOM 891 CG2 VAL A 972 4.501 9.896 0.021 1.00 0.00 C ATOM 0 H VAL A 972 4.722 8.186 2.141 1.00 0.00 H new ATOM 0 HA VAL A 972 5.881 10.720 3.060 1.00 0.00 H new ATOM 0 HB VAL A 972 4.727 11.773 1.004 1.00 0.00 H new ATOM 0 HG11 VAL A 972 6.704 11.424 -0.417 1.00 0.00 H new ATOM 0 HG12 VAL A 972 7.152 11.703 1.283 1.00 0.00 H new ATOM 0 HG13 VAL A 972 7.196 10.056 0.609 1.00 0.00 H new ATOM 0 HG21 VAL A 972 4.564 10.324 -0.980 1.00 0.00 H new ATOM 0 HG22 VAL A 972 4.966 8.910 0.025 1.00 0.00 H new ATOM 0 HG23 VAL A 972 3.454 9.804 0.311 1.00 0.00 H new ATOM 901 N ALA A 973 3.452 11.719 3.298 1.00 0.00 N ATOM 902 CA ALA A 973 2.150 12.084 3.842 1.00 0.00 C ATOM 903 C ALA A 973 1.536 13.244 3.065 1.00 0.00 C ATOM 904 O ALA A 973 2.250 14.088 2.522 1.00 0.00 O ATOM 905 CB ALA A 973 2.276 12.442 5.316 1.00 0.00 C ATOM 0 H ALA A 973 4.093 12.503 3.177 1.00 0.00 H new ATOM 0 HA ALA A 973 1.488 11.224 3.743 1.00 0.00 H new ATOM 0 HB1 ALA A 973 1.296 12.713 5.710 1.00 0.00 H new ATOM 0 HB2 ALA A 973 2.664 11.585 5.867 1.00 0.00 H new ATOM 0 HB3 ALA A 973 2.958 13.285 5.429 1.00 0.00 H new ATOM 911 N PHE A 974 0.209 13.279 3.014 1.00 0.00 N ATOM 912 CA PHE A 974 -0.502 14.334 2.301 1.00 0.00 C ATOM 913 C PHE A 974 -1.585 14.950 3.181 1.00 0.00 C ATOM 914 O PHE A 974 -2.058 14.326 4.130 1.00 0.00 O ATOM 915 CB PHE A 974 -1.124 13.781 1.017 1.00 0.00 C ATOM 916 CG PHE A 974 -0.158 13.696 -0.129 1.00 0.00 C ATOM 917 CD1 PHE A 974 0.796 12.692 -0.175 1.00 0.00 C ATOM 918 CD2 PHE A 974 -0.204 14.619 -1.161 1.00 0.00 C ATOM 919 CE1 PHE A 974 1.687 12.612 -1.229 1.00 0.00 C ATOM 920 CE2 PHE A 974 0.685 14.544 -2.218 1.00 0.00 C ATOM 921 CZ PHE A 974 1.630 13.538 -2.252 1.00 0.00 C ATOM 0 H PHE A 974 -0.396 12.589 3.458 1.00 0.00 H new ATOM 0 HA PHE A 974 0.216 15.112 2.042 1.00 0.00 H new ATOM 0 HB2 PHE A 974 -1.527 12.788 1.216 1.00 0.00 H new ATOM 0 HB3 PHE A 974 -1.963 14.413 0.728 1.00 0.00 H new ATOM 0 HD1 PHE A 974 0.844 11.964 0.621 1.00 0.00 H new ATOM 0 HD2 PHE A 974 -0.943 15.407 -1.140 1.00 0.00 H new ATOM 0 HE1 PHE A 974 2.427 11.826 -1.252 1.00 0.00 H new ATOM 0 HE2 PHE A 974 0.640 15.271 -3.015 1.00 0.00 H new ATOM 0 HZ PHE A 974 2.324 13.475 -3.077 1.00 0.00 H new ATOM 931 N GLU A 975 -1.973 16.180 2.858 1.00 0.00 N ATOM 932 CA GLU A 975 -3.000 16.882 3.619 1.00 0.00 C ATOM 933 C GLU A 975 -4.395 16.457 3.171 1.00 0.00 C ATOM 934 O GLU A 975 -5.283 16.236 3.995 1.00 0.00 O ATOM 935 CB GLU A 975 -2.839 18.395 3.461 1.00 0.00 C ATOM 936 CG GLU A 975 -1.490 18.916 3.926 1.00 0.00 C ATOM 937 CD GLU A 975 -0.442 18.882 2.830 1.00 0.00 C ATOM 938 OE1 GLU A 975 -0.725 18.312 1.756 1.00 0.00 O ATOM 939 OE2 GLU A 975 0.661 19.427 3.047 1.00 0.00 O ATOM 0 H GLU A 975 -1.592 16.711 2.075 1.00 0.00 H new ATOM 0 HA GLU A 975 -2.880 16.620 4.670 1.00 0.00 H new ATOM 0 HB2 GLU A 975 -2.979 18.659 2.413 1.00 0.00 H new ATOM 0 HB3 GLU A 975 -3.626 18.896 4.024 1.00 0.00 H new ATOM 0 HG2 GLU A 975 -1.604 19.939 4.283 1.00 0.00 H new ATOM 0 HG3 GLU A 975 -1.146 18.320 4.771 1.00 0.00 H new ATOM 946 N SER A 976 -4.581 16.346 1.860 1.00 0.00 N ATOM 947 CA SER A 976 -5.869 15.953 1.301 1.00 0.00 C ATOM 948 C SER A 976 -5.751 14.635 0.540 1.00 0.00 C ATOM 949 O SER A 976 -4.779 14.405 -0.179 1.00 0.00 O ATOM 950 CB SER A 976 -6.400 17.045 0.371 1.00 0.00 C ATOM 951 OG SER A 976 -6.903 18.145 1.111 1.00 0.00 O ATOM 0 H SER A 976 -3.856 16.523 1.165 1.00 0.00 H new ATOM 0 HA SER A 976 -6.569 15.816 2.126 1.00 0.00 H new ATOM 0 HB2 SER A 976 -5.603 17.382 -0.291 1.00 0.00 H new ATOM 0 HB3 SER A 976 -7.189 16.637 -0.261 1.00 0.00 H new ATOM 0 HG SER A 976 -7.235 18.830 0.494 1.00 0.00 H new ATOM 957 N ARG A 977 -6.749 13.773 0.705 1.00 0.00 N ATOM 958 CA ARG A 977 -6.758 12.478 0.036 1.00 0.00 C ATOM 959 C ARG A 977 -6.759 12.649 -1.480 1.00 0.00 C ATOM 960 O ARG A 977 -6.134 11.873 -2.203 1.00 0.00 O ATOM 961 CB ARG A 977 -7.980 11.665 0.468 1.00 0.00 C ATOM 962 CG ARG A 977 -7.733 10.800 1.693 1.00 0.00 C ATOM 963 CD ARG A 977 -9.032 10.229 2.243 1.00 0.00 C ATOM 964 NE ARG A 977 -9.446 9.025 1.528 1.00 0.00 N ATOM 965 CZ ARG A 977 -8.793 7.870 1.594 1.00 0.00 C ATOM 966 NH1 ARG A 977 -7.702 7.763 2.339 1.00 0.00 N ATOM 967 NH2 ARG A 977 -9.233 6.819 0.914 1.00 0.00 N ATOM 0 H ARG A 977 -7.562 13.948 1.296 1.00 0.00 H new ATOM 0 HA ARG A 977 -5.853 11.943 0.324 1.00 0.00 H new ATOM 0 HB2 ARG A 977 -8.805 12.347 0.675 1.00 0.00 H new ATOM 0 HB3 ARG A 977 -8.293 11.028 -0.359 1.00 0.00 H new ATOM 0 HG2 ARG A 977 -7.057 9.985 1.434 1.00 0.00 H new ATOM 0 HG3 ARG A 977 -7.239 11.391 2.464 1.00 0.00 H new ATOM 0 HD2 ARG A 977 -8.907 9.998 3.301 1.00 0.00 H new ATOM 0 HD3 ARG A 977 -9.818 10.981 2.172 1.00 0.00 H new ATOM 0 HE ARG A 977 -10.282 9.073 0.946 1.00 0.00 H new ATOM 0 HH11 ARG A 977 -7.362 8.569 2.864 1.00 0.00 H new ATOM 0 HH12 ARG A 977 -7.203 6.875 2.388 1.00 0.00 H new ATOM 0 HH21 ARG A 977 -10.073 6.898 0.340 1.00 0.00 H new ATOM 0 HH22 ARG A 977 -8.731 5.932 0.965 1.00 0.00 H new ATOM 981 N ASP A 978 -7.464 13.670 -1.955 1.00 0.00 N ATOM 982 CA ASP A 978 -7.546 13.944 -3.385 1.00 0.00 C ATOM 983 C ASP A 978 -6.157 14.164 -3.976 1.00 0.00 C ATOM 984 O ASP A 978 -5.843 13.657 -5.052 1.00 0.00 O ATOM 985 CB ASP A 978 -8.423 15.171 -3.642 1.00 0.00 C ATOM 986 CG ASP A 978 -8.589 15.464 -5.120 1.00 0.00 C ATOM 987 OD1 ASP A 978 -8.584 14.505 -5.919 1.00 0.00 O ATOM 988 OD2 ASP A 978 -8.724 16.653 -5.477 1.00 0.00 O ATOM 0 H ASP A 978 -7.987 14.322 -1.370 1.00 0.00 H new ATOM 0 HA ASP A 978 -7.996 13.078 -3.871 1.00 0.00 H new ATOM 0 HB2 ASP A 978 -9.404 15.013 -3.193 1.00 0.00 H new ATOM 0 HB3 ASP A 978 -7.983 16.038 -3.150 1.00 0.00 H new ATOM 993 N GLU A 979 -5.330 14.925 -3.265 1.00 0.00 N ATOM 994 CA GLU A 979 -3.975 15.213 -3.722 1.00 0.00 C ATOM 995 C GLU A 979 -3.119 13.950 -3.717 1.00 0.00 C ATOM 996 O GLU A 979 -2.391 13.677 -4.671 1.00 0.00 O ATOM 997 CB GLU A 979 -3.332 16.282 -2.836 1.00 0.00 C ATOM 998 CG GLU A 979 -3.729 17.701 -3.208 1.00 0.00 C ATOM 999 CD GLU A 979 -5.223 17.852 -3.420 1.00 0.00 C ATOM 1000 OE1 GLU A 979 -5.950 18.022 -2.419 1.00 0.00 O ATOM 1001 OE2 GLU A 979 -5.664 17.799 -4.587 1.00 0.00 O ATOM 0 H GLU A 979 -5.574 15.353 -2.372 1.00 0.00 H new ATOM 0 HA GLU A 979 -4.035 15.586 -4.745 1.00 0.00 H new ATOM 0 HB2 GLU A 979 -3.609 16.096 -1.798 1.00 0.00 H new ATOM 0 HB3 GLU A 979 -2.248 16.189 -2.898 1.00 0.00 H new ATOM 0 HG2 GLU A 979 -3.407 18.383 -2.421 1.00 0.00 H new ATOM 0 HG3 GLU A 979 -3.205 17.994 -4.118 1.00 0.00 H new ATOM 1008 N ALA A 980 -3.213 13.183 -2.635 1.00 0.00 N ATOM 1009 CA ALA A 980 -2.449 11.948 -2.506 1.00 0.00 C ATOM 1010 C ALA A 980 -2.823 10.954 -3.601 1.00 0.00 C ATOM 1011 O ALA A 980 -1.953 10.386 -4.262 1.00 0.00 O ATOM 1012 CB ALA A 980 -2.670 11.332 -1.133 1.00 0.00 C ATOM 0 H ALA A 980 -3.810 13.395 -1.836 1.00 0.00 H new ATOM 0 HA ALA A 980 -1.392 12.190 -2.617 1.00 0.00 H new ATOM 0 HB1 ALA A 980 -2.094 10.411 -1.051 1.00 0.00 H new ATOM 0 HB2 ALA A 980 -2.346 12.033 -0.363 1.00 0.00 H new ATOM 0 HB3 ALA A 980 -3.729 11.111 -1.000 1.00 0.00 H new ATOM 1018 N THR A 981 -4.123 10.748 -3.787 1.00 0.00 N ATOM 1019 CA THR A 981 -4.612 9.821 -4.799 1.00 0.00 C ATOM 1020 C THR A 981 -4.203 10.268 -6.198 1.00 0.00 C ATOM 1021 O THR A 981 -3.766 9.459 -7.016 1.00 0.00 O ATOM 1022 CB THR A 981 -6.145 9.686 -4.744 1.00 0.00 C ATOM 1023 OG1 THR A 981 -6.576 9.547 -3.385 1.00 0.00 O ATOM 1024 CG2 THR A 981 -6.613 8.487 -5.555 1.00 0.00 C ATOM 0 H THR A 981 -4.856 11.211 -3.250 1.00 0.00 H new ATOM 0 HA THR A 981 -4.161 8.852 -4.583 1.00 0.00 H new ATOM 0 HB THR A 981 -6.582 10.587 -5.173 1.00 0.00 H new ATOM 0 HG1 THR A 981 -6.748 10.433 -3.004 1.00 0.00 H new ATOM 0 HG21 THR A 981 -7.699 8.413 -5.501 1.00 0.00 H new ATOM 0 HG22 THR A 981 -6.309 8.610 -6.595 1.00 0.00 H new ATOM 0 HG23 THR A 981 -6.167 7.578 -5.152 1.00 0.00 H new ATOM 1032 N ALA A 982 -4.347 11.562 -6.466 1.00 0.00 N ATOM 1033 CA ALA A 982 -3.989 12.117 -7.766 1.00 0.00 C ATOM 1034 C ALA A 982 -2.507 11.912 -8.061 1.00 0.00 C ATOM 1035 O ALA A 982 -2.136 11.484 -9.154 1.00 0.00 O ATOM 1036 CB ALA A 982 -4.340 13.596 -7.822 1.00 0.00 C ATOM 0 H ALA A 982 -4.709 12.245 -5.801 1.00 0.00 H new ATOM 0 HA ALA A 982 -4.561 11.589 -8.529 1.00 0.00 H new ATOM 0 HB1 ALA A 982 -4.068 13.998 -8.798 1.00 0.00 H new ATOM 0 HB2 ALA A 982 -5.411 13.722 -7.664 1.00 0.00 H new ATOM 0 HB3 ALA A 982 -3.793 14.129 -7.044 1.00 0.00 H new ATOM 1042 N ALA A 983 -1.665 12.220 -7.081 1.00 0.00 N ATOM 1043 CA ALA A 983 -0.223 12.068 -7.237 1.00 0.00 C ATOM 1044 C ALA A 983 0.148 10.616 -7.517 1.00 0.00 C ATOM 1045 O ALA A 983 1.012 10.335 -8.348 1.00 0.00 O ATOM 1046 CB ALA A 983 0.497 12.568 -5.994 1.00 0.00 C ATOM 0 H ALA A 983 -1.956 12.576 -6.171 1.00 0.00 H new ATOM 0 HA ALA A 983 0.091 12.667 -8.092 1.00 0.00 H new ATOM 0 HB1 ALA A 983 1.573 12.449 -6.124 1.00 0.00 H new ATOM 0 HB2 ALA A 983 0.265 13.622 -5.838 1.00 0.00 H new ATOM 0 HB3 ALA A 983 0.170 11.993 -5.128 1.00 0.00 H new ATOM 1052 N VAL A 984 -0.509 9.696 -6.819 1.00 0.00 N ATOM 1053 CA VAL A 984 -0.248 8.272 -6.993 1.00 0.00 C ATOM 1054 C VAL A 984 -0.631 7.811 -8.395 1.00 0.00 C ATOM 1055 O VAL A 984 0.157 7.160 -9.082 1.00 0.00 O ATOM 1056 CB VAL A 984 -1.018 7.429 -5.959 1.00 0.00 C ATOM 1057 CG1 VAL A 984 -0.784 5.945 -6.199 1.00 0.00 C ATOM 1058 CG2 VAL A 984 -0.612 7.820 -4.546 1.00 0.00 C ATOM 0 H VAL A 984 -1.227 9.911 -6.127 1.00 0.00 H new ATOM 0 HA VAL A 984 0.822 8.126 -6.845 1.00 0.00 H new ATOM 0 HB VAL A 984 -2.084 7.627 -6.075 1.00 0.00 H new ATOM 0 HG11 VAL A 984 -1.336 5.365 -5.459 1.00 0.00 H new ATOM 0 HG12 VAL A 984 -1.128 5.679 -7.198 1.00 0.00 H new ATOM 0 HG13 VAL A 984 0.280 5.726 -6.112 1.00 0.00 H new ATOM 0 HG21 VAL A 984 -1.165 7.215 -3.828 1.00 0.00 H new ATOM 0 HG22 VAL A 984 0.457 7.652 -4.415 1.00 0.00 H new ATOM 0 HG23 VAL A 984 -0.836 8.874 -4.381 1.00 0.00 H new ATOM 1068 N ILE A 985 -1.845 8.152 -8.813 1.00 0.00 N ATOM 1069 CA ILE A 985 -2.332 7.775 -10.134 1.00 0.00 C ATOM 1070 C ILE A 985 -1.478 8.396 -11.233 1.00 0.00 C ATOM 1071 O ILE A 985 -1.107 7.728 -12.198 1.00 0.00 O ATOM 1072 CB ILE A 985 -3.799 8.200 -10.336 1.00 0.00 C ATOM 1073 CG1 ILE A 985 -4.703 7.489 -9.327 1.00 0.00 C ATOM 1074 CG2 ILE A 985 -4.246 7.900 -11.759 1.00 0.00 C ATOM 1075 CD1 ILE A 985 -6.111 8.040 -9.284 1.00 0.00 C ATOM 0 H ILE A 985 -2.510 8.689 -8.256 1.00 0.00 H new ATOM 0 HA ILE A 985 -2.265 6.689 -10.196 1.00 0.00 H new ATOM 0 HB ILE A 985 -3.876 9.275 -10.170 1.00 0.00 H new ATOM 0 HG12 ILE A 985 -4.744 6.428 -9.573 1.00 0.00 H new ATOM 0 HG13 ILE A 985 -4.260 7.569 -8.334 1.00 0.00 H new ATOM 0 HG21 ILE A 985 -5.284 8.206 -11.886 1.00 0.00 H new ATOM 0 HG22 ILE A 985 -3.618 8.448 -12.461 1.00 0.00 H new ATOM 0 HG23 ILE A 985 -4.157 6.831 -11.951 1.00 0.00 H new ATOM 0 HD11 ILE A 985 -6.695 7.489 -8.547 1.00 0.00 H new ATOM 0 HD12 ILE A 985 -6.081 9.094 -9.008 1.00 0.00 H new ATOM 0 HD13 ILE A 985 -6.573 7.935 -10.266 1.00 0.00 H new ATOM 1087 N ASP A 986 -1.168 9.679 -11.079 1.00 0.00 N ATOM 1088 CA ASP A 986 -0.354 10.391 -12.058 1.00 0.00 C ATOM 1089 C ASP A 986 1.112 9.984 -11.944 1.00 0.00 C ATOM 1090 O ASP A 986 1.884 10.133 -12.893 1.00 0.00 O ATOM 1091 CB ASP A 986 -0.493 11.902 -11.865 1.00 0.00 C ATOM 1092 CG ASP A 986 -1.663 12.479 -12.638 1.00 0.00 C ATOM 1093 OD1 ASP A 986 -2.815 12.106 -12.334 1.00 0.00 O ATOM 1094 OD2 ASP A 986 -1.426 13.302 -13.547 1.00 0.00 O ATOM 0 H ASP A 986 -1.468 10.247 -10.286 1.00 0.00 H new ATOM 0 HA ASP A 986 -0.710 10.125 -13.053 1.00 0.00 H new ATOM 0 HB2 ASP A 986 -0.619 12.120 -10.804 1.00 0.00 H new ATOM 0 HB3 ASP A 986 0.427 12.392 -12.184 1.00 0.00 H new ATOM 1099 N LEU A 987 1.490 9.472 -10.779 1.00 0.00 N ATOM 1100 CA LEU A 987 2.864 9.044 -10.540 1.00 0.00 C ATOM 1101 C LEU A 987 2.921 7.559 -10.197 1.00 0.00 C ATOM 1102 O LEU A 987 3.810 7.112 -9.475 1.00 0.00 O ATOM 1103 CB LEU A 987 3.486 9.865 -9.409 1.00 0.00 C ATOM 1104 CG LEU A 987 3.289 11.379 -9.492 1.00 0.00 C ATOM 1105 CD1 LEU A 987 3.458 12.015 -8.121 1.00 0.00 C ATOM 1106 CD2 LEU A 987 4.264 11.989 -10.488 1.00 0.00 C ATOM 0 H LEU A 987 0.864 9.343 -9.984 1.00 0.00 H new ATOM 0 HA LEU A 987 3.433 9.208 -11.455 1.00 0.00 H new ATOM 0 HB2 LEU A 987 3.071 9.516 -8.463 1.00 0.00 H new ATOM 0 HB3 LEU A 987 4.556 9.659 -9.383 1.00 0.00 H new ATOM 0 HG LEU A 987 2.275 11.576 -9.839 1.00 0.00 H new ATOM 0 HD11 LEU A 987 3.314 13.093 -8.200 1.00 0.00 H new ATOM 0 HD12 LEU A 987 2.721 11.600 -7.434 1.00 0.00 H new ATOM 0 HD13 LEU A 987 4.460 11.809 -7.745 1.00 0.00 H new ATOM 0 HD21 LEU A 987 4.110 13.067 -10.534 1.00 0.00 H new ATOM 0 HD22 LEU A 987 5.286 11.782 -10.170 1.00 0.00 H new ATOM 0 HD23 LEU A 987 4.096 11.556 -11.474 1.00 0.00 H new ATOM 1118 N ASN A 988 1.965 6.799 -10.723 1.00 0.00 N ATOM 1119 CA ASN A 988 1.907 5.363 -10.474 1.00 0.00 C ATOM 1120 C ASN A 988 2.701 4.596 -11.527 1.00 0.00 C ATOM 1121 O ASN A 988 2.511 4.791 -12.727 1.00 0.00 O ATOM 1122 CB ASN A 988 0.454 4.884 -10.465 1.00 0.00 C ATOM 1123 CG ASN A 988 0.322 3.430 -10.875 1.00 0.00 C ATOM 1124 OD1 ASN A 988 0.084 3.122 -12.043 1.00 0.00 O ATOM 1125 ND2 ASN A 988 0.477 2.528 -9.913 1.00 0.00 N ATOM 0 H ASN A 988 1.221 7.154 -11.324 1.00 0.00 H new ATOM 0 HA ASN A 988 2.352 5.170 -9.498 1.00 0.00 H new ATOM 0 HB2 ASN A 988 0.037 5.016 -9.467 1.00 0.00 H new ATOM 0 HB3 ASN A 988 -0.134 5.504 -11.141 1.00 0.00 H new ATOM 0 HD21 ASN A 988 0.400 1.534 -10.129 1.00 0.00 H new ATOM 0 HD22 ASN A 988 0.673 2.829 -8.958 1.00 0.00 H new ATOM 1132 N ASP A 989 3.590 3.721 -11.068 1.00 0.00 N ATOM 1133 CA ASP A 989 4.412 2.923 -11.970 1.00 0.00 C ATOM 1134 C ASP A 989 5.301 3.816 -12.830 1.00 0.00 C ATOM 1135 O ASP A 989 5.443 3.593 -14.033 1.00 0.00 O ATOM 1136 CB ASP A 989 3.528 2.050 -12.863 1.00 0.00 C ATOM 1137 CG ASP A 989 2.972 0.847 -12.127 1.00 0.00 C ATOM 1138 OD1 ASP A 989 3.771 -0.024 -11.725 1.00 0.00 O ATOM 1139 OD2 ASP A 989 1.737 0.775 -11.955 1.00 0.00 O ATOM 0 H ASP A 989 3.759 3.547 -10.077 1.00 0.00 H new ATOM 0 HA ASP A 989 5.051 2.280 -11.365 1.00 0.00 H new ATOM 0 HB2 ASP A 989 2.703 2.649 -13.250 1.00 0.00 H new ATOM 0 HB3 ASP A 989 4.107 1.711 -13.722 1.00 0.00 H new ATOM 1144 N ARG A 990 5.896 4.827 -12.206 1.00 0.00 N ATOM 1145 CA ARG A 990 6.768 5.755 -12.915 1.00 0.00 C ATOM 1146 C ARG A 990 8.194 5.216 -12.985 1.00 0.00 C ATOM 1147 O ARG A 990 8.767 4.777 -11.988 1.00 0.00 O ATOM 1148 CB ARG A 990 6.762 7.121 -12.226 1.00 0.00 C ATOM 1149 CG ARG A 990 5.556 7.976 -12.580 1.00 0.00 C ATOM 1150 CD ARG A 990 5.815 8.820 -13.818 1.00 0.00 C ATOM 1151 NE ARG A 990 5.535 8.087 -15.049 1.00 0.00 N ATOM 1152 CZ ARG A 990 5.767 8.573 -16.263 1.00 0.00 C ATOM 1153 NH1 ARG A 990 6.280 9.787 -16.408 1.00 0.00 N ATOM 1154 NH2 ARG A 990 5.485 7.844 -17.336 1.00 0.00 N ATOM 0 H ARG A 990 5.790 5.024 -11.211 1.00 0.00 H new ATOM 0 HA ARG A 990 6.389 5.866 -13.931 1.00 0.00 H new ATOM 0 HB2 ARG A 990 6.788 6.974 -11.146 1.00 0.00 H new ATOM 0 HB3 ARG A 990 7.670 7.659 -12.497 1.00 0.00 H new ATOM 0 HG2 ARG A 990 4.691 7.335 -12.750 1.00 0.00 H new ATOM 0 HG3 ARG A 990 5.310 8.626 -11.740 1.00 0.00 H new ATOM 0 HD2 ARG A 990 5.196 9.717 -13.781 1.00 0.00 H new ATOM 0 HD3 ARG A 990 6.854 9.150 -13.821 1.00 0.00 H new ATOM 0 HE ARG A 990 5.139 7.150 -14.973 1.00 0.00 H new ATOM 0 HH11 ARG A 990 6.498 10.350 -15.586 1.00 0.00 H new ATOM 0 HH12 ARG A 990 6.457 10.158 -17.342 1.00 0.00 H new ATOM 0 HH21 ARG A 990 5.090 6.910 -17.228 1.00 0.00 H new ATOM 0 HH22 ARG A 990 5.663 8.218 -18.268 1.00 0.00 H new ATOM 1168 N PRO A 991 8.781 5.248 -14.190 1.00 0.00 N ATOM 1169 CA PRO A 991 10.146 4.766 -14.420 1.00 0.00 C ATOM 1170 C PRO A 991 11.194 5.667 -13.777 1.00 0.00 C ATOM 1171 O PRO A 991 11.786 6.518 -14.442 1.00 0.00 O ATOM 1172 CB PRO A 991 10.280 4.792 -15.944 1.00 0.00 C ATOM 1173 CG PRO A 991 9.304 5.824 -16.393 1.00 0.00 C ATOM 1174 CD PRO A 991 8.156 5.757 -15.423 1.00 0.00 C ATOM 0 HA PRO A 991 10.310 3.782 -13.982 1.00 0.00 H new ATOM 0 HB2 PRO A 991 11.295 5.048 -16.248 1.00 0.00 H new ATOM 0 HB3 PRO A 991 10.054 3.818 -16.378 1.00 0.00 H new ATOM 0 HG2 PRO A 991 9.757 6.815 -16.394 1.00 0.00 H new ATOM 0 HG3 PRO A 991 8.967 5.626 -17.411 1.00 0.00 H new ATOM 0 HD2 PRO A 991 7.702 6.736 -15.269 1.00 0.00 H new ATOM 0 HD3 PRO A 991 7.368 5.093 -15.778 1.00 0.00 H new ATOM 1182 N ILE A 992 11.419 5.475 -12.482 1.00 0.00 N ATOM 1183 CA ILE A 992 12.398 6.270 -11.750 1.00 0.00 C ATOM 1184 C ILE A 992 13.811 5.739 -11.967 1.00 0.00 C ATOM 1185 O ILE A 992 14.078 4.555 -11.763 1.00 0.00 O ATOM 1186 CB ILE A 992 12.094 6.288 -10.241 1.00 0.00 C ATOM 1187 CG1 ILE A 992 10.916 7.219 -9.947 1.00 0.00 C ATOM 1188 CG2 ILE A 992 13.325 6.720 -9.458 1.00 0.00 C ATOM 1189 CD1 ILE A 992 10.624 7.377 -8.471 1.00 0.00 C ATOM 0 H ILE A 992 10.937 4.776 -11.917 1.00 0.00 H new ATOM 0 HA ILE A 992 12.331 7.287 -12.137 1.00 0.00 H new ATOM 0 HB ILE A 992 11.823 5.280 -9.928 1.00 0.00 H new ATOM 0 HG12 ILE A 992 11.123 8.200 -10.375 1.00 0.00 H new ATOM 0 HG13 ILE A 992 10.026 6.835 -10.446 1.00 0.00 H new ATOM 0 HG21 ILE A 992 13.094 6.728 -8.393 1.00 0.00 H new ATOM 0 HG22 ILE A 992 14.140 6.022 -9.648 1.00 0.00 H new ATOM 0 HG23 ILE A 992 13.623 7.720 -9.772 1.00 0.00 H new ATOM 0 HD11 ILE A 992 9.777 8.050 -8.338 1.00 0.00 H new ATOM 0 HD12 ILE A 992 10.385 6.404 -8.041 1.00 0.00 H new ATOM 0 HD13 ILE A 992 11.499 7.791 -7.969 1.00 0.00 H new ATOM 1201 N GLY A 993 14.713 6.623 -12.381 1.00 0.00 N ATOM 1202 CA GLY A 993 16.089 6.224 -12.616 1.00 0.00 C ATOM 1203 C GLY A 993 16.208 5.157 -13.686 1.00 0.00 C ATOM 1204 O GLY A 993 16.303 5.466 -14.873 1.00 0.00 O ATOM 0 H GLY A 993 14.516 7.608 -12.558 1.00 0.00 H new ATOM 0 HA2 GLY A 993 16.672 7.097 -12.911 1.00 0.00 H new ATOM 0 HA3 GLY A 993 16.520 5.852 -11.687 1.00 0.00 H new ATOM 1208 N SER A 994 16.204 3.896 -13.264 1.00 0.00 N ATOM 1209 CA SER A 994 16.318 2.779 -14.194 1.00 0.00 C ATOM 1210 C SER A 994 15.269 1.712 -13.893 1.00 0.00 C ATOM 1211 O SER A 994 15.186 0.696 -14.583 1.00 0.00 O ATOM 1212 CB SER A 994 17.719 2.167 -14.120 1.00 0.00 C ATOM 1213 OG SER A 994 17.776 0.938 -14.823 1.00 0.00 O ATOM 0 H SER A 994 16.123 3.623 -12.285 1.00 0.00 H new ATOM 0 HA SER A 994 16.147 3.158 -15.201 1.00 0.00 H new ATOM 0 HB2 SER A 994 18.446 2.863 -14.538 1.00 0.00 H new ATOM 0 HB3 SER A 994 17.995 2.007 -13.078 1.00 0.00 H new ATOM 0 HG SER A 994 16.869 0.660 -15.069 1.00 0.00 H new ATOM 1219 N ARG A 995 14.470 1.953 -12.859 1.00 0.00 N ATOM 1220 CA ARG A 995 13.427 1.014 -12.465 1.00 0.00 C ATOM 1221 C ARG A 995 12.104 1.738 -12.230 1.00 0.00 C ATOM 1222 O ARG A 995 12.070 2.959 -12.079 1.00 0.00 O ATOM 1223 CB ARG A 995 13.840 0.261 -11.199 1.00 0.00 C ATOM 1224 CG ARG A 995 15.246 -0.312 -11.262 1.00 0.00 C ATOM 1225 CD ARG A 995 15.548 -1.183 -10.053 1.00 0.00 C ATOM 1226 NE ARG A 995 16.607 -2.150 -10.326 1.00 0.00 N ATOM 1227 CZ ARG A 995 16.449 -3.211 -11.110 1.00 0.00 C ATOM 1228 NH1 ARG A 995 15.282 -3.439 -11.695 1.00 0.00 N ATOM 1229 NH2 ARG A 995 17.461 -4.046 -11.310 1.00 0.00 N ATOM 0 H ARG A 995 14.525 2.790 -12.279 1.00 0.00 H new ATOM 0 HA ARG A 995 13.292 0.299 -13.277 1.00 0.00 H new ATOM 0 HB2 ARG A 995 13.770 0.936 -10.346 1.00 0.00 H new ATOM 0 HB3 ARG A 995 13.134 -0.550 -11.022 1.00 0.00 H new ATOM 0 HG2 ARG A 995 15.360 -0.900 -12.173 1.00 0.00 H new ATOM 0 HG3 ARG A 995 15.969 0.502 -11.315 1.00 0.00 H new ATOM 0 HD2 ARG A 995 15.842 -0.551 -9.215 1.00 0.00 H new ATOM 0 HD3 ARG A 995 14.643 -1.711 -9.752 1.00 0.00 H new ATOM 0 HE ARG A 995 17.518 -2.003 -9.891 1.00 0.00 H new ATOM 0 HH11 ARG A 995 14.502 -2.799 -11.544 1.00 0.00 H new ATOM 0 HH12 ARG A 995 15.164 -4.254 -12.296 1.00 0.00 H new ATOM 0 HH21 ARG A 995 18.361 -3.873 -10.862 1.00 0.00 H new ATOM 0 HH22 ARG A 995 17.339 -4.860 -11.912 1.00 0.00 H new ATOM 1243 N LYS A 996 11.016 0.976 -12.202 1.00 0.00 N ATOM 1244 CA LYS A 996 9.690 1.543 -11.986 1.00 0.00 C ATOM 1245 C LYS A 996 9.326 1.526 -10.504 1.00 0.00 C ATOM 1246 O LYS A 996 9.629 0.569 -9.791 1.00 0.00 O ATOM 1247 CB LYS A 996 8.643 0.766 -12.788 1.00 0.00 C ATOM 1248 CG LYS A 996 8.903 0.762 -14.284 1.00 0.00 C ATOM 1249 CD LYS A 996 8.152 -0.362 -14.978 1.00 0.00 C ATOM 1250 CE LYS A 996 8.257 -0.251 -16.491 1.00 0.00 C ATOM 1251 NZ LYS A 996 7.428 0.866 -17.024 1.00 0.00 N ATOM 0 H LYS A 996 11.026 -0.036 -12.326 1.00 0.00 H new ATOM 0 HA LYS A 996 9.705 2.578 -12.327 1.00 0.00 H new ATOM 0 HB2 LYS A 996 8.614 -0.263 -12.430 1.00 0.00 H new ATOM 0 HB3 LYS A 996 7.660 1.197 -12.600 1.00 0.00 H new ATOM 0 HG2 LYS A 996 8.601 1.719 -14.709 1.00 0.00 H new ATOM 0 HG3 LYS A 996 9.972 0.654 -14.468 1.00 0.00 H new ATOM 0 HD2 LYS A 996 8.552 -1.323 -14.654 1.00 0.00 H new ATOM 0 HD3 LYS A 996 7.103 -0.337 -14.682 1.00 0.00 H new ATOM 0 HE2 LYS A 996 9.299 -0.097 -16.772 1.00 0.00 H new ATOM 0 HE3 LYS A 996 7.939 -1.189 -16.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 996 7.404 0.816 -18.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 996 6.460 0.789 -16.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 996 7.840 1.775 -16.731 1.00 0.00 H new ATOM 1265 N VAL A 997 8.673 2.590 -10.048 1.00 0.00 N ATOM 1266 CA VAL A 997 8.266 2.695 -8.652 1.00 0.00 C ATOM 1267 C VAL A 997 6.778 2.402 -8.490 1.00 0.00 C ATOM 1268 O VAL A 997 5.985 2.636 -9.401 1.00 0.00 O ATOM 1269 CB VAL A 997 8.566 4.095 -8.084 1.00 0.00 C ATOM 1270 CG1 VAL A 997 10.032 4.211 -7.696 1.00 0.00 C ATOM 1271 CG2 VAL A 997 8.185 5.171 -9.090 1.00 0.00 C ATOM 0 H VAL A 997 8.415 3.391 -10.624 1.00 0.00 H new ATOM 0 HA VAL A 997 8.842 1.954 -8.098 1.00 0.00 H new ATOM 0 HB VAL A 997 7.965 4.240 -7.186 1.00 0.00 H new ATOM 0 HG11 VAL A 997 10.225 5.207 -7.297 1.00 0.00 H new ATOM 0 HG12 VAL A 997 10.268 3.464 -6.938 1.00 0.00 H new ATOM 0 HG13 VAL A 997 10.655 4.045 -8.575 1.00 0.00 H new ATOM 0 HG21 VAL A 997 8.404 6.154 -8.672 1.00 0.00 H new ATOM 0 HG22 VAL A 997 8.758 5.031 -10.007 1.00 0.00 H new ATOM 0 HG23 VAL A 997 7.120 5.100 -9.313 1.00 0.00 H new ATOM 1281 N LYS A 998 6.406 1.888 -7.322 1.00 0.00 N ATOM 1282 CA LYS A 998 5.013 1.563 -7.038 1.00 0.00 C ATOM 1283 C LYS A 998 4.479 2.415 -5.891 1.00 0.00 C ATOM 1284 O LYS A 998 5.085 2.484 -4.821 1.00 0.00 O ATOM 1285 CB LYS A 998 4.875 0.079 -6.692 1.00 0.00 C ATOM 1286 CG LYS A 998 3.498 -0.299 -6.172 1.00 0.00 C ATOM 1287 CD LYS A 998 2.468 -0.320 -7.288 1.00 0.00 C ATOM 1288 CE LYS A 998 2.460 -1.656 -8.014 1.00 0.00 C ATOM 1289 NZ LYS A 998 3.480 -1.705 -9.098 1.00 0.00 N ATOM 0 H LYS A 998 7.050 1.688 -6.557 1.00 0.00 H new ATOM 0 HA LYS A 998 4.426 1.778 -7.931 1.00 0.00 H new ATOM 0 HB2 LYS A 998 5.094 -0.514 -7.580 1.00 0.00 H new ATOM 0 HB3 LYS A 998 5.622 -0.182 -5.942 1.00 0.00 H new ATOM 0 HG2 LYS A 998 3.543 -1.280 -5.699 1.00 0.00 H new ATOM 0 HG3 LYS A 998 3.190 0.411 -5.405 1.00 0.00 H new ATOM 0 HD2 LYS A 998 1.479 -0.123 -6.875 1.00 0.00 H new ATOM 0 HD3 LYS A 998 2.682 0.479 -7.997 1.00 0.00 H new ATOM 0 HE2 LYS A 998 2.650 -2.458 -7.301 1.00 0.00 H new ATOM 0 HE3 LYS A 998 1.471 -1.833 -8.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 998 3.114 -2.266 -9.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 998 3.689 -0.739 -9.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 998 4.350 -2.145 -8.736 1.00 0.00 H new ATOM 1303 N LEU A 999 3.342 3.062 -6.121 1.00 0.00 N ATOM 1304 CA LEU A 999 2.725 3.909 -5.106 1.00 0.00 C ATOM 1305 C LEU A 999 1.426 3.292 -4.598 1.00 0.00 C ATOM 1306 O LEU A 999 0.571 2.885 -5.385 1.00 0.00 O ATOM 1307 CB LEU A 999 2.454 5.304 -5.673 1.00 0.00 C ATOM 1308 CG LEU A 999 3.686 6.128 -6.047 1.00 0.00 C ATOM 1309 CD1 LEU A 999 3.286 7.344 -6.868 1.00 0.00 C ATOM 1310 CD2 LEU A 999 4.443 6.552 -4.797 1.00 0.00 C ATOM 0 H LEU A 999 2.829 3.016 -7.001 1.00 0.00 H new ATOM 0 HA LEU A 999 3.417 3.993 -4.268 1.00 0.00 H new ATOM 0 HB2 LEU A 999 1.829 5.199 -6.560 1.00 0.00 H new ATOM 0 HB3 LEU A 999 1.875 5.866 -4.940 1.00 0.00 H new ATOM 0 HG LEU A 999 4.345 5.507 -6.654 1.00 0.00 H new ATOM 0 HD11 LEU A 999 4.176 7.918 -7.125 1.00 0.00 H new ATOM 0 HD12 LEU A 999 2.788 7.019 -7.781 1.00 0.00 H new ATOM 0 HD13 LEU A 999 2.607 7.968 -6.287 1.00 0.00 H new ATOM 0 HD21 LEU A 999 5.317 7.138 -5.082 1.00 0.00 H new ATOM 0 HD22 LEU A 999 3.792 7.156 -4.165 1.00 0.00 H new ATOM 0 HD23 LEU A 999 4.763 5.667 -4.248 1.00 0.00 H new ATOM 1322 N VAL A1000 1.283 3.228 -3.278 1.00 0.00 N ATOM 1323 CA VAL A1000 0.086 2.664 -2.665 1.00 0.00 C ATOM 1324 C VAL A1000 -0.556 3.655 -1.701 1.00 0.00 C ATOM 1325 O VAL A1000 0.136 4.396 -1.001 1.00 0.00 O ATOM 1326 CB VAL A1000 0.404 1.361 -1.908 1.00 0.00 C ATOM 1327 CG1 VAL A1000 -0.863 0.765 -1.315 1.00 0.00 C ATOM 1328 CG2 VAL A1000 1.092 0.365 -2.829 1.00 0.00 C ATOM 0 H VAL A1000 1.981 3.560 -2.613 1.00 0.00 H new ATOM 0 HA VAL A1000 -0.611 2.445 -3.474 1.00 0.00 H new ATOM 0 HB VAL A1000 1.085 1.594 -1.089 1.00 0.00 H new ATOM 0 HG11 VAL A1000 -0.618 -0.155 -0.784 1.00 0.00 H new ATOM 0 HG12 VAL A1000 -1.310 1.477 -0.621 1.00 0.00 H new ATOM 0 HG13 VAL A1000 -1.571 0.545 -2.115 1.00 0.00 H new ATOM 0 HG21 VAL A1000 1.310 -0.550 -2.278 1.00 0.00 H new ATOM 0 HG22 VAL A1000 0.438 0.135 -3.670 1.00 0.00 H new ATOM 0 HG23 VAL A1000 2.022 0.795 -3.200 1.00 0.00 H new ATOM 1338 N LEU A1001 -1.884 3.665 -1.669 1.00 0.00 N ATOM 1339 CA LEU A1001 -2.622 4.565 -0.790 1.00 0.00 C ATOM 1340 C LEU A1001 -2.717 3.992 0.620 1.00 0.00 C ATOM 1341 O LEU A1001 -3.012 2.812 0.803 1.00 0.00 O ATOM 1342 CB LEU A1001 -4.025 4.816 -1.346 1.00 0.00 C ATOM 1343 CG LEU A1001 -4.139 5.907 -2.412 1.00 0.00 C ATOM 1344 CD1 LEU A1001 -5.503 5.857 -3.083 1.00 0.00 C ATOM 1345 CD2 LEU A1001 -3.894 7.278 -1.800 1.00 0.00 C ATOM 0 H LEU A1001 -2.472 3.060 -2.242 1.00 0.00 H new ATOM 0 HA LEU A1001 -2.082 5.511 -0.743 1.00 0.00 H new ATOM 0 HB2 LEU A1001 -4.399 3.883 -1.768 1.00 0.00 H new ATOM 0 HB3 LEU A1001 -4.682 5.077 -0.516 1.00 0.00 H new ATOM 0 HG LEU A1001 -3.377 5.728 -3.170 1.00 0.00 H new ATOM 0 HD11 LEU A1001 -5.566 6.640 -3.838 1.00 0.00 H new ATOM 0 HD12 LEU A1001 -5.640 4.885 -3.556 1.00 0.00 H new ATOM 0 HD13 LEU A1001 -6.282 6.010 -2.336 1.00 0.00 H new ATOM 0 HD21 LEU A1001 -3.979 8.042 -2.573 1.00 0.00 H new ATOM 0 HD22 LEU A1001 -4.633 7.466 -1.021 1.00 0.00 H new ATOM 0 HD23 LEU A1001 -2.894 7.310 -1.367 1.00 0.00 H new ATOM 1357 N GLY A1002 -2.467 4.838 1.615 1.00 0.00 N ATOM 1358 CA GLY A1002 -2.531 4.398 2.997 1.00 0.00 C ATOM 1359 C GLY A1002 -3.909 3.895 3.382 1.00 0.00 C ATOM 1360 O GLY A1002 -4.448 2.992 2.743 1.00 0.00 O ATOM 0 H GLY A1002 -2.221 5.820 1.489 1.00 0.00 H new ATOM 0 HA2 GLY A1002 -1.800 3.605 3.157 1.00 0.00 H new ATOM 0 HA3 GLY A1002 -2.253 5.224 3.651 1.00 0.00 H new ATOM 1364 N SER A1003 -4.479 4.481 4.430 1.00 0.00 N ATOM 1365 CA SER A1003 -5.800 4.084 4.902 1.00 0.00 C ATOM 1366 C SER A1003 -6.793 4.017 3.746 1.00 0.00 C ATOM 1367 O SER A1003 -6.453 4.315 2.602 1.00 0.00 O ATOM 1368 CB SER A1003 -6.302 5.065 5.964 1.00 0.00 C ATOM 1369 OG SER A1003 -7.396 4.523 6.683 1.00 0.00 O ATOM 0 H SER A1003 -4.047 5.232 4.968 1.00 0.00 H new ATOM 0 HA SER A1003 -5.717 3.091 5.345 1.00 0.00 H new ATOM 0 HB2 SER A1003 -5.493 5.305 6.654 1.00 0.00 H new ATOM 0 HB3 SER A1003 -6.602 5.999 5.488 1.00 0.00 H new ATOM 0 HG SER A1003 -7.697 5.168 7.356 1.00 0.00 H new ATOM 1375 N GLY A1004 -8.025 3.622 4.054 1.00 0.00 N ATOM 1376 CA GLY A1004 -9.050 3.522 3.032 1.00 0.00 C ATOM 1377 C GLY A1004 -8.892 2.284 2.171 1.00 0.00 C ATOM 1378 O GLY A1004 -8.371 2.338 1.057 1.00 0.00 O ATOM 0 H GLY A1004 -8.331 3.369 4.994 1.00 0.00 H new ATOM 0 HA2 GLY A1004 -10.031 3.508 3.506 1.00 0.00 H new ATOM 0 HA3 GLY A1004 -9.015 4.408 2.398 1.00 0.00 H new ATOM 1382 N PRO A1005 -9.347 1.135 2.692 1.00 0.00 N ATOM 1383 CA PRO A1005 -9.969 1.058 4.017 1.00 0.00 C ATOM 1384 C PRO A1005 -8.965 1.283 5.143 1.00 0.00 C ATOM 1385 O PRO A1005 -7.757 1.156 4.944 1.00 0.00 O ATOM 1386 CB PRO A1005 -10.518 -0.370 4.069 1.00 0.00 C ATOM 1387 CG PRO A1005 -9.664 -1.139 3.121 1.00 0.00 C ATOM 1388 CD PRO A1005 -9.290 -0.178 2.027 1.00 0.00 C ATOM 0 HA PRO A1005 -10.729 1.827 4.155 1.00 0.00 H new ATOM 0 HB2 PRO A1005 -10.459 -0.780 5.077 1.00 0.00 H new ATOM 0 HB3 PRO A1005 -11.566 -0.402 3.773 1.00 0.00 H new ATOM 0 HG2 PRO A1005 -8.776 -1.525 3.621 1.00 0.00 H new ATOM 0 HG3 PRO A1005 -10.202 -1.997 2.719 1.00 0.00 H new ATOM 0 HD2 PRO A1005 -8.295 -0.386 1.632 1.00 0.00 H new ATOM 0 HD3 PRO A1005 -9.984 -0.234 1.188 1.00 0.00 H new ATOM 1396 N SER A1006 -9.472 1.617 6.325 1.00 0.00 N ATOM 1397 CA SER A1006 -8.619 1.864 7.481 1.00 0.00 C ATOM 1398 C SER A1006 -8.317 0.564 8.220 1.00 0.00 C ATOM 1399 O SER A1006 -8.701 -0.519 7.777 1.00 0.00 O ATOM 1400 CB SER A1006 -9.287 2.860 8.431 1.00 0.00 C ATOM 1401 OG SER A1006 -10.531 2.366 8.896 1.00 0.00 O ATOM 0 H SER A1006 -10.470 1.723 6.507 1.00 0.00 H new ATOM 0 HA SER A1006 -7.680 2.287 7.125 1.00 0.00 H new ATOM 0 HB2 SER A1006 -8.630 3.055 9.279 1.00 0.00 H new ATOM 0 HB3 SER A1006 -9.438 3.810 7.919 1.00 0.00 H new ATOM 0 HG SER A1006 -10.708 2.718 9.794 1.00 0.00 H new ATOM 1407 N SER A1007 -7.626 0.679 9.350 1.00 0.00 N ATOM 1408 CA SER A1007 -7.268 -0.487 10.149 1.00 0.00 C ATOM 1409 C SER A1007 -7.436 -0.197 11.638 1.00 0.00 C ATOM 1410 O SER A1007 -7.823 0.904 12.027 1.00 0.00 O ATOM 1411 CB SER A1007 -5.826 -0.906 9.860 1.00 0.00 C ATOM 1412 OG SER A1007 -5.555 -2.195 10.384 1.00 0.00 O ATOM 0 H SER A1007 -7.303 1.568 9.733 1.00 0.00 H new ATOM 0 HA SER A1007 -7.938 -1.303 9.877 1.00 0.00 H new ATOM 0 HB2 SER A1007 -5.652 -0.903 8.784 1.00 0.00 H new ATOM 0 HB3 SER A1007 -5.139 -0.181 10.296 1.00 0.00 H new ATOM 0 HG SER A1007 -4.627 -2.441 10.185 1.00 0.00 H new ATOM 1418 N GLY A1008 -7.143 -1.195 12.466 1.00 0.00 N ATOM 1419 CA GLY A1008 -7.267 -1.028 13.902 1.00 0.00 C ATOM 1420 C GLY A1008 -7.089 -2.332 14.654 1.00 0.00 C ATOM 1421 O GLY A1008 -8.058 -3.049 14.906 1.00 0.00 O ATOM 0 H GLY A1008 -6.822 -2.116 12.168 1.00 0.00 H new ATOM 0 HA2 GLY A1008 -6.524 -0.309 14.247 1.00 0.00 H new ATOM 0 HA3 GLY A1008 -8.247 -0.610 14.133 1.00 0.00 H new TER 1425 GLY A1008