USER MOD reduce.3.24.130724 H: found=0, std=0, add=710, rem=0, adj=28 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 39:sc= 0.851 USER MOD Single : A 913 SER OG : rot 17:sc= 0.401! USER MOD Single : A 915 SER OG : rot 180:sc= 0 USER MOD Single : A 916 SER OG : rot 180:sc= -0.155 USER MOD Single : A 919 SER OG : rot 180:sc= 0 USER MOD Single : A 920 SER OG : rot 180:sc= 0 USER MOD Single : A 922 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 926 THR OG1 : rot 90:sc= 0 USER MOD Single : A 929 LYS NZ :NH3+ -112:sc= -0.168 (180deg=-1.57!) USER MOD Single : A 931 GLN :FLIP amide:sc= -0.958 F(o=-2.1!,f=-0.96) USER MOD Single : A 932 ASN : amide:sc= 0.0141 X(o=0.014,f=-0.0096) USER MOD Single : A 933 MET CE :methyl -168:sc= -0.716 (180deg=-1.27) USER MOD Single : A 936 THR OG1 : rot 180:sc= 0 USER MOD Single : A 938 SER OG : rot 15:sc= 0.827 USER MOD Single : A 947 TYR OH : rot 180:sc= 0 USER MOD Single : A 949 TYR OH : rot 130:sc= -0.471 USER MOD Single : A 950 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 955 SER OG : rot -96:sc= -0.154 USER MOD Single : A 957 CYS SG : rot 180:sc= 0 USER MOD Single : A 959 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0118) USER MOD Single : A 960 TYR OH : rot 180:sc=-0.00291 USER MOD Single : A 961 ASN :FLIP amide:sc= -7.95! C(o=-9!,f=-8!) USER MOD Single : A 963 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 965 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 967 THR OG1 : rot -39:sc= 0.941 USER MOD Single : A 971 MET CE :methyl 169:sc= 0 (180deg=-0.149) USER MOD Single : A 976 SER OG : rot 180:sc= 0 USER MOD Single : A 981 THR OG1 : rot 180:sc= 0 USER MOD Single : A 988 ASN : amide:sc= -2.29 X(o=-2.3,f=-2.6!) USER MOD Single : A 994 SER OG : rot 180:sc= 0 USER MOD Single : A 996 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0698) USER MOD Single : A 998 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1003 SER OG : rot -170:sc= 0 USER MOD Single : A1006 SER OG : rot 21:sc= 0.00168 USER MOD Single : A1007 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 911 9.435 -15.599 5.948 1.00 0.00 N ATOM 2 CA GLY A 911 9.823 -14.332 6.539 1.00 0.00 C ATOM 3 C GLY A 911 9.610 -14.303 8.040 1.00 0.00 C ATOM 4 O GLY A 911 9.651 -15.341 8.700 1.00 0.00 O ATOM 0 HA2 GLY A 911 10.873 -14.139 6.320 1.00 0.00 H new ATOM 0 HA3 GLY A 911 9.249 -13.528 6.078 1.00 0.00 H new ATOM 8 N SER A 912 9.383 -13.110 8.580 1.00 0.00 N ATOM 9 CA SER A 912 9.167 -12.949 10.014 1.00 0.00 C ATOM 10 C SER A 912 7.853 -12.224 10.288 1.00 0.00 C ATOM 11 O SER A 912 7.734 -11.022 10.052 1.00 0.00 O ATOM 12 CB SER A 912 10.329 -12.177 10.642 1.00 0.00 C ATOM 13 OG SER A 912 10.391 -10.852 10.142 1.00 0.00 O ATOM 0 H SER A 912 9.344 -12.241 8.047 1.00 0.00 H new ATOM 0 HA SER A 912 9.114 -13.941 10.462 1.00 0.00 H new ATOM 0 HB2 SER A 912 10.212 -12.155 11.725 1.00 0.00 H new ATOM 0 HB3 SER A 912 11.267 -12.692 10.433 1.00 0.00 H new ATOM 0 HG SER A 912 9.483 -10.498 10.039 1.00 0.00 H new ATOM 19 N SER A 913 6.869 -12.965 10.787 1.00 0.00 N ATOM 20 CA SER A 913 5.562 -12.395 11.091 1.00 0.00 C ATOM 21 C SER A 913 5.694 -11.203 12.034 1.00 0.00 C ATOM 22 O SER A 913 6.314 -11.300 13.092 1.00 0.00 O ATOM 23 CB SER A 913 4.652 -13.455 11.714 1.00 0.00 C ATOM 24 OG SER A 913 4.990 -13.682 13.072 1.00 0.00 O ATOM 0 H SER A 913 6.952 -13.961 10.989 1.00 0.00 H new ATOM 0 HA SER A 913 5.118 -12.049 10.157 1.00 0.00 H new ATOM 0 HB2 SER A 913 3.613 -13.134 11.643 1.00 0.00 H new ATOM 0 HB3 SER A 913 4.737 -14.386 11.154 1.00 0.00 H new ATOM 0 HG SER A 913 5.535 -12.938 13.402 1.00 0.00 H new ATOM 30 N GLY A 914 5.105 -10.077 11.641 1.00 0.00 N ATOM 31 CA GLY A 914 5.169 -8.882 12.462 1.00 0.00 C ATOM 32 C GLY A 914 4.127 -8.879 13.563 1.00 0.00 C ATOM 33 O GLY A 914 3.482 -9.895 13.820 1.00 0.00 O ATOM 0 H GLY A 914 4.585 -9.971 10.770 1.00 0.00 H new ATOM 0 HA2 GLY A 914 6.162 -8.802 12.905 1.00 0.00 H new ATOM 0 HA3 GLY A 914 5.030 -8.004 11.832 1.00 0.00 H new ATOM 37 N SER A 915 3.963 -7.734 14.218 1.00 0.00 N ATOM 38 CA SER A 915 2.997 -7.604 15.302 1.00 0.00 C ATOM 39 C SER A 915 2.181 -6.323 15.152 1.00 0.00 C ATOM 40 O SER A 915 2.523 -5.287 15.722 1.00 0.00 O ATOM 41 CB SER A 915 3.712 -7.612 16.654 1.00 0.00 C ATOM 42 OG SER A 915 2.783 -7.529 17.722 1.00 0.00 O ATOM 0 H SER A 915 4.487 -6.883 14.016 1.00 0.00 H new ATOM 0 HA SER A 915 2.317 -8.455 15.254 1.00 0.00 H new ATOM 0 HB2 SER A 915 4.303 -8.523 16.751 1.00 0.00 H new ATOM 0 HB3 SER A 915 4.407 -6.774 16.706 1.00 0.00 H new ATOM 0 HG SER A 915 3.264 -7.537 18.576 1.00 0.00 H new ATOM 48 N SER A 916 1.101 -6.403 14.382 1.00 0.00 N ATOM 49 CA SER A 916 0.238 -5.251 14.153 1.00 0.00 C ATOM 50 C SER A 916 -0.223 -4.646 15.476 1.00 0.00 C ATOM 51 O SER A 916 -0.195 -5.304 16.515 1.00 0.00 O ATOM 52 CB SER A 916 -0.976 -5.654 13.313 1.00 0.00 C ATOM 53 OG SER A 916 -1.931 -4.609 13.264 1.00 0.00 O ATOM 0 H SER A 916 0.803 -7.254 13.906 1.00 0.00 H new ATOM 0 HA SER A 916 0.813 -4.500 13.610 1.00 0.00 H new ATOM 0 HB2 SER A 916 -0.655 -5.906 12.302 1.00 0.00 H new ATOM 0 HB3 SER A 916 -1.433 -6.549 13.735 1.00 0.00 H new ATOM 0 HG SER A 916 -2.696 -4.890 12.720 1.00 0.00 H new ATOM 59 N GLY A 917 -0.646 -3.386 15.429 1.00 0.00 N ATOM 60 CA GLY A 917 -1.106 -2.713 16.629 1.00 0.00 C ATOM 61 C GLY A 917 -2.504 -3.140 17.033 1.00 0.00 C ATOM 62 O GLY A 917 -2.906 -4.278 16.793 1.00 0.00 O ATOM 0 H GLY A 917 -0.678 -2.820 14.581 1.00 0.00 H new ATOM 0 HA2 GLY A 917 -0.415 -2.921 17.446 1.00 0.00 H new ATOM 0 HA3 GLY A 917 -1.091 -1.635 16.466 1.00 0.00 H new ATOM 66 N ALA A 918 -3.245 -2.225 17.650 1.00 0.00 N ATOM 67 CA ALA A 918 -4.605 -2.513 18.088 1.00 0.00 C ATOM 68 C ALA A 918 -5.565 -1.408 17.659 1.00 0.00 C ATOM 69 O ALA A 918 -6.426 -0.987 18.431 1.00 0.00 O ATOM 70 CB ALA A 918 -4.646 -2.693 19.598 1.00 0.00 C ATOM 0 H ALA A 918 -2.926 -1.279 17.858 1.00 0.00 H new ATOM 0 HA ALA A 918 -4.925 -3.441 17.614 1.00 0.00 H new ATOM 0 HB1 ALA A 918 -5.668 -2.908 19.911 1.00 0.00 H new ATOM 0 HB2 ALA A 918 -3.997 -3.521 19.883 1.00 0.00 H new ATOM 0 HB3 ALA A 918 -4.302 -1.779 20.083 1.00 0.00 H new ATOM 76 N SER A 919 -5.410 -0.942 16.424 1.00 0.00 N ATOM 77 CA SER A 919 -6.261 0.117 15.894 1.00 0.00 C ATOM 78 C SER A 919 -6.113 0.226 14.380 1.00 0.00 C ATOM 79 O SER A 919 -5.003 0.331 13.859 1.00 0.00 O ATOM 80 CB SER A 919 -5.912 1.455 16.549 1.00 0.00 C ATOM 81 OG SER A 919 -6.478 2.538 15.831 1.00 0.00 O ATOM 0 H SER A 919 -4.703 -1.281 15.772 1.00 0.00 H new ATOM 0 HA SER A 919 -7.297 -0.133 16.123 1.00 0.00 H new ATOM 0 HB2 SER A 919 -6.276 1.466 17.576 1.00 0.00 H new ATOM 0 HB3 SER A 919 -4.829 1.570 16.593 1.00 0.00 H new ATOM 0 HG SER A 919 -6.241 3.381 16.271 1.00 0.00 H new ATOM 87 N SER A 920 -7.242 0.201 13.678 1.00 0.00 N ATOM 88 CA SER A 920 -7.240 0.293 12.223 1.00 0.00 C ATOM 89 C SER A 920 -6.879 1.703 11.768 1.00 0.00 C ATOM 90 O SER A 920 -7.709 2.611 11.805 1.00 0.00 O ATOM 91 CB SER A 920 -8.609 -0.101 11.664 1.00 0.00 C ATOM 92 OG SER A 920 -8.726 -1.509 11.547 1.00 0.00 O ATOM 0 H SER A 920 -8.170 0.118 14.094 1.00 0.00 H new ATOM 0 HA SER A 920 -6.487 -0.397 11.841 1.00 0.00 H new ATOM 0 HB2 SER A 920 -9.395 0.279 12.316 1.00 0.00 H new ATOM 0 HB3 SER A 920 -8.754 0.362 10.688 1.00 0.00 H new ATOM 0 HG SER A 920 -9.610 -1.735 11.189 1.00 0.00 H new ATOM 98 N GLY A 921 -5.633 1.879 11.339 1.00 0.00 N ATOM 99 CA GLY A 921 -5.182 3.182 10.883 1.00 0.00 C ATOM 100 C GLY A 921 -5.436 4.273 11.904 1.00 0.00 C ATOM 101 O GLY A 921 -6.026 4.025 12.956 1.00 0.00 O ATOM 0 H GLY A 921 -4.928 1.143 11.299 1.00 0.00 H new ATOM 0 HA2 GLY A 921 -4.116 3.137 10.662 1.00 0.00 H new ATOM 0 HA3 GLY A 921 -5.691 3.434 9.952 1.00 0.00 H new ATOM 105 N LYS A 922 -4.988 5.485 11.595 1.00 0.00 N ATOM 106 CA LYS A 922 -5.169 6.620 12.493 1.00 0.00 C ATOM 107 C LYS A 922 -5.767 7.811 11.751 1.00 0.00 C ATOM 108 O LYS A 922 -5.524 8.018 10.562 1.00 0.00 O ATOM 109 CB LYS A 922 -3.832 7.016 13.123 1.00 0.00 C ATOM 110 CG LYS A 922 -3.197 5.911 13.949 1.00 0.00 C ATOM 111 CD LYS A 922 -2.359 4.981 13.088 1.00 0.00 C ATOM 112 CE LYS A 922 -0.940 5.503 12.923 1.00 0.00 C ATOM 113 NZ LYS A 922 -0.103 4.584 12.102 1.00 0.00 N ATOM 0 H LYS A 922 -4.497 5.707 10.729 1.00 0.00 H new ATOM 0 HA LYS A 922 -5.860 6.322 13.281 1.00 0.00 H new ATOM 0 HB2 LYS A 922 -3.141 7.310 12.333 1.00 0.00 H new ATOM 0 HB3 LYS A 922 -3.983 7.890 13.756 1.00 0.00 H new ATOM 0 HG2 LYS A 922 -2.572 6.350 14.726 1.00 0.00 H new ATOM 0 HG3 LYS A 922 -3.976 5.339 14.452 1.00 0.00 H new ATOM 0 HD2 LYS A 922 -2.333 3.990 13.540 1.00 0.00 H new ATOM 0 HD3 LYS A 922 -2.824 4.872 12.108 1.00 0.00 H new ATOM 0 HE2 LYS A 922 -0.967 6.486 12.454 1.00 0.00 H new ATOM 0 HE3 LYS A 922 -0.484 5.631 13.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 922 0.857 4.975 12.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 922 -0.056 3.653 12.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 922 -0.524 4.482 11.157 1.00 0.00 H new ATOM 127 N PRO A 923 -6.566 8.615 12.468 1.00 0.00 N ATOM 128 CA PRO A 923 -7.213 9.801 11.898 1.00 0.00 C ATOM 129 C PRO A 923 -6.215 10.910 11.583 1.00 0.00 C ATOM 130 O PRO A 923 -5.668 11.542 12.485 1.00 0.00 O ATOM 131 CB PRO A 923 -8.175 10.245 13.002 1.00 0.00 C ATOM 132 CG PRO A 923 -7.576 9.720 14.261 1.00 0.00 C ATOM 133 CD PRO A 923 -6.899 8.430 13.890 1.00 0.00 C ATOM 0 HA PRO A 923 -7.703 9.582 10.949 1.00 0.00 H new ATOM 0 HB2 PRO A 923 -8.270 11.330 13.031 1.00 0.00 H new ATOM 0 HB3 PRO A 923 -9.175 9.842 12.841 1.00 0.00 H new ATOM 0 HG2 PRO A 923 -6.862 10.429 14.679 1.00 0.00 H new ATOM 0 HG3 PRO A 923 -8.342 9.555 15.019 1.00 0.00 H new ATOM 0 HD2 PRO A 923 -6.007 8.257 14.492 1.00 0.00 H new ATOM 0 HD3 PRO A 923 -7.556 7.574 14.040 1.00 0.00 H new ATOM 141 N GLY A 924 -5.983 11.142 10.294 1.00 0.00 N ATOM 142 CA GLY A 924 -5.051 12.176 9.883 1.00 0.00 C ATOM 143 C GLY A 924 -4.901 12.256 8.376 1.00 0.00 C ATOM 144 O GLY A 924 -5.819 11.934 7.622 1.00 0.00 O ATOM 0 H GLY A 924 -6.424 10.633 9.528 1.00 0.00 H new ATOM 0 HA2 GLY A 924 -5.391 13.139 10.263 1.00 0.00 H new ATOM 0 HA3 GLY A 924 -4.077 11.982 10.332 1.00 0.00 H new ATOM 148 N PRO A 925 -3.720 12.695 7.918 1.00 0.00 N ATOM 149 CA PRO A 925 -3.425 12.828 6.488 1.00 0.00 C ATOM 150 C PRO A 925 -3.302 11.475 5.794 1.00 0.00 C ATOM 151 O PRO A 925 -3.398 10.427 6.432 1.00 0.00 O ATOM 152 CB PRO A 925 -2.083 13.563 6.469 1.00 0.00 C ATOM 153 CG PRO A 925 -1.451 13.232 7.777 1.00 0.00 C ATOM 154 CD PRO A 925 -2.581 13.097 8.760 1.00 0.00 C ATOM 0 HA PRO A 925 -4.219 13.350 5.955 1.00 0.00 H new ATOM 0 HB2 PRO A 925 -1.463 13.234 5.635 1.00 0.00 H new ATOM 0 HB3 PRO A 925 -2.222 14.638 6.357 1.00 0.00 H new ATOM 0 HG2 PRO A 925 -0.879 12.307 7.711 1.00 0.00 H new ATOM 0 HG3 PRO A 925 -0.757 14.015 8.085 1.00 0.00 H new ATOM 0 HD2 PRO A 925 -2.362 12.350 9.523 1.00 0.00 H new ATOM 0 HD3 PRO A 925 -2.776 14.035 9.279 1.00 0.00 H new ATOM 162 N THR A 926 -3.089 11.506 4.482 1.00 0.00 N ATOM 163 CA THR A 926 -2.953 10.283 3.701 1.00 0.00 C ATOM 164 C THR A 926 -1.492 9.864 3.584 1.00 0.00 C ATOM 165 O THR A 926 -0.646 10.646 3.147 1.00 0.00 O ATOM 166 CB THR A 926 -3.542 10.450 2.288 1.00 0.00 C ATOM 167 OG1 THR A 926 -4.921 10.828 2.374 1.00 0.00 O ATOM 168 CG2 THR A 926 -3.414 9.160 1.492 1.00 0.00 C ATOM 0 H THR A 926 -3.007 12.365 3.938 1.00 0.00 H new ATOM 0 HA THR A 926 -3.509 9.508 4.229 1.00 0.00 H new ATOM 0 HB THR A 926 -2.982 11.232 1.775 1.00 0.00 H new ATOM 0 HG1 THR A 926 -4.991 11.805 2.399 1.00 0.00 H new ATOM 0 HG21 THR A 926 -3.837 9.303 0.498 1.00 0.00 H new ATOM 0 HG22 THR A 926 -2.362 8.890 1.404 1.00 0.00 H new ATOM 0 HG23 THR A 926 -3.952 8.362 2.004 1.00 0.00 H new ATOM 176 N ILE A 927 -1.202 8.628 3.976 1.00 0.00 N ATOM 177 CA ILE A 927 0.157 8.107 3.913 1.00 0.00 C ATOM 178 C ILE A 927 0.340 7.194 2.705 1.00 0.00 C ATOM 179 O ILE A 927 -0.410 6.235 2.519 1.00 0.00 O ATOM 180 CB ILE A 927 0.522 7.328 5.190 1.00 0.00 C ATOM 181 CG1 ILE A 927 0.481 8.254 6.407 1.00 0.00 C ATOM 182 CG2 ILE A 927 1.896 6.690 5.048 1.00 0.00 C ATOM 183 CD1 ILE A 927 1.514 9.358 6.361 1.00 0.00 C ATOM 0 H ILE A 927 -1.890 7.969 4.340 1.00 0.00 H new ATOM 0 HA ILE A 927 0.820 8.967 3.820 1.00 0.00 H new ATOM 0 HB ILE A 927 -0.211 6.535 5.336 1.00 0.00 H new ATOM 0 HG12 ILE A 927 -0.511 8.699 6.482 1.00 0.00 H new ATOM 0 HG13 ILE A 927 0.634 7.662 7.309 1.00 0.00 H new ATOM 0 HG21 ILE A 927 2.139 6.143 5.959 1.00 0.00 H new ATOM 0 HG22 ILE A 927 1.892 6.003 4.202 1.00 0.00 H new ATOM 0 HG23 ILE A 927 2.642 7.467 4.881 1.00 0.00 H new ATOM 0 HD11 ILE A 927 1.427 9.975 7.255 1.00 0.00 H new ATOM 0 HD12 ILE A 927 2.512 8.921 6.318 1.00 0.00 H new ATOM 0 HD13 ILE A 927 1.349 9.974 5.477 1.00 0.00 H new ATOM 195 N ILE A 928 1.343 7.497 1.887 1.00 0.00 N ATOM 196 CA ILE A 928 1.626 6.702 0.699 1.00 0.00 C ATOM 197 C ILE A 928 2.919 5.910 0.862 1.00 0.00 C ATOM 198 O ILE A 928 3.884 6.392 1.456 1.00 0.00 O ATOM 199 CB ILE A 928 1.734 7.586 -0.558 1.00 0.00 C ATOM 200 CG1 ILE A 928 0.425 8.345 -0.788 1.00 0.00 C ATOM 201 CG2 ILE A 928 2.084 6.740 -1.772 1.00 0.00 C ATOM 202 CD1 ILE A 928 0.508 9.369 -1.898 1.00 0.00 C ATOM 0 H ILE A 928 1.973 8.287 2.026 1.00 0.00 H new ATOM 0 HA ILE A 928 0.792 6.011 0.577 1.00 0.00 H new ATOM 0 HB ILE A 928 2.531 8.313 -0.406 1.00 0.00 H new ATOM 0 HG12 ILE A 928 -0.364 7.630 -1.022 1.00 0.00 H new ATOM 0 HG13 ILE A 928 0.137 8.846 0.137 1.00 0.00 H new ATOM 0 HG21 ILE A 928 2.157 7.379 -2.652 1.00 0.00 H new ATOM 0 HG22 ILE A 928 3.039 6.242 -1.605 1.00 0.00 H new ATOM 0 HG23 ILE A 928 1.307 5.992 -1.930 1.00 0.00 H new ATOM 0 HD11 ILE A 928 -0.455 9.868 -2.005 1.00 0.00 H new ATOM 0 HD12 ILE A 928 1.274 10.106 -1.657 1.00 0.00 H new ATOM 0 HD13 ILE A 928 0.765 8.872 -2.833 1.00 0.00 H new ATOM 214 N LYS A 929 2.932 4.693 0.331 1.00 0.00 N ATOM 215 CA LYS A 929 4.107 3.833 0.414 1.00 0.00 C ATOM 216 C LYS A 929 4.730 3.629 -0.963 1.00 0.00 C ATOM 217 O LYS A 929 4.047 3.248 -1.914 1.00 0.00 O ATOM 218 CB LYS A 929 3.732 2.480 1.022 1.00 0.00 C ATOM 219 CG LYS A 929 3.752 2.469 2.541 1.00 0.00 C ATOM 220 CD LYS A 929 2.426 2.934 3.119 1.00 0.00 C ATOM 221 CE LYS A 929 1.389 1.821 3.099 1.00 0.00 C ATOM 222 NZ LYS A 929 0.116 2.238 3.749 1.00 0.00 N ATOM 0 H LYS A 929 2.141 4.279 -0.162 1.00 0.00 H new ATOM 0 HA LYS A 929 4.840 4.322 1.056 1.00 0.00 H new ATOM 0 HB2 LYS A 929 2.736 2.200 0.678 1.00 0.00 H new ATOM 0 HB3 LYS A 929 4.422 1.721 0.652 1.00 0.00 H new ATOM 0 HG2 LYS A 929 3.971 1.462 2.896 1.00 0.00 H new ATOM 0 HG3 LYS A 929 4.553 3.115 2.900 1.00 0.00 H new ATOM 0 HD2 LYS A 929 2.574 3.276 4.143 1.00 0.00 H new ATOM 0 HD3 LYS A 929 2.058 3.786 2.548 1.00 0.00 H new ATOM 0 HE2 LYS A 929 1.191 1.527 2.068 1.00 0.00 H new ATOM 0 HE3 LYS A 929 1.787 0.944 3.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 929 -0.015 1.702 4.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 929 0.153 3.255 3.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 929 -0.680 2.049 3.107 1.00 0.00 H new ATOM 236 N VAL A 930 6.031 3.882 -1.063 1.00 0.00 N ATOM 237 CA VAL A 930 6.746 3.723 -2.324 1.00 0.00 C ATOM 238 C VAL A 930 7.666 2.508 -2.284 1.00 0.00 C ATOM 239 O VAL A 930 8.465 2.353 -1.361 1.00 0.00 O ATOM 240 CB VAL A 930 7.581 4.974 -2.657 1.00 0.00 C ATOM 241 CG1 VAL A 930 8.225 4.837 -4.028 1.00 0.00 C ATOM 242 CG2 VAL A 930 6.718 6.225 -2.587 1.00 0.00 C ATOM 0 H VAL A 930 6.611 4.198 -0.286 1.00 0.00 H new ATOM 0 HA VAL A 930 5.993 3.580 -3.099 1.00 0.00 H new ATOM 0 HB VAL A 930 8.375 5.067 -1.916 1.00 0.00 H new ATOM 0 HG11 VAL A 930 8.811 5.730 -4.246 1.00 0.00 H new ATOM 0 HG12 VAL A 930 8.877 3.964 -4.038 1.00 0.00 H new ATOM 0 HG13 VAL A 930 7.449 4.719 -4.784 1.00 0.00 H new ATOM 0 HG21 VAL A 930 7.324 7.099 -2.825 1.00 0.00 H new ATOM 0 HG22 VAL A 930 5.901 6.144 -3.304 1.00 0.00 H new ATOM 0 HG23 VAL A 930 6.310 6.330 -1.582 1.00 0.00 H new ATOM 252 N GLN A 931 7.546 1.649 -3.291 1.00 0.00 N ATOM 253 CA GLN A 931 8.367 0.447 -3.371 1.00 0.00 C ATOM 254 C GLN A 931 8.942 0.272 -4.773 1.00 0.00 C ATOM 255 O GLN A 931 8.552 0.973 -5.706 1.00 0.00 O ATOM 256 CB GLN A 931 7.544 -0.784 -2.988 1.00 0.00 C ATOM 257 CG GLN A 931 8.302 -1.776 -2.119 1.00 0.00 C ATOM 258 CD GLN A 931 7.588 -2.072 -0.814 1.00 0.00 C ATOM 259 OE1 GLN A 931 7.339 -1.033 -0.026 1.00 0.00 O flip ATOM 260 NE2 GLN A 931 7.265 -3.223 -0.518 1.00 0.00 N flip ATOM 0 H GLN A 931 6.888 1.763 -4.062 1.00 0.00 H new ATOM 0 HA GLN A 931 9.194 0.556 -2.670 1.00 0.00 H new ATOM 0 HB2 GLN A 931 6.647 -0.461 -2.459 1.00 0.00 H new ATOM 0 HB3 GLN A 931 7.214 -1.287 -3.897 1.00 0.00 H new ATOM 0 HG2 GLN A 931 8.441 -2.705 -2.672 1.00 0.00 H new ATOM 0 HG3 GLN A 931 9.295 -1.381 -1.904 1.00 0.00 H new ATOM 0 HE21 GLN A 931 7.476 -3.992 -1.154 1.00 0.00 H new ATOM 0 HE22 GLN A 931 6.786 -3.408 0.363 1.00 0.00 H new ATOM 269 N ASN A 932 9.872 -0.667 -4.913 1.00 0.00 N ATOM 270 CA ASN A 932 10.501 -0.933 -6.201 1.00 0.00 C ATOM 271 C ASN A 932 11.392 0.232 -6.622 1.00 0.00 C ATOM 272 O ASN A 932 11.325 0.698 -7.759 1.00 0.00 O ATOM 273 CB ASN A 932 9.437 -1.188 -7.270 1.00 0.00 C ATOM 274 CG ASN A 932 9.926 -2.115 -8.365 1.00 0.00 C ATOM 275 OD1 ASN A 932 9.274 -3.107 -8.692 1.00 0.00 O ATOM 276 ND2 ASN A 932 11.081 -1.797 -8.938 1.00 0.00 N ATOM 0 H ASN A 932 10.206 -1.256 -4.150 1.00 0.00 H new ATOM 0 HA ASN A 932 11.121 -1.823 -6.097 1.00 0.00 H new ATOM 0 HB2 ASN A 932 8.552 -1.619 -6.802 1.00 0.00 H new ATOM 0 HB3 ASN A 932 9.134 -0.238 -7.711 1.00 0.00 H new ATOM 0 HD21 ASN A 932 11.461 -2.384 -9.680 1.00 0.00 H new ATOM 0 HD22 ASN A 932 11.588 -0.965 -8.636 1.00 0.00 H new ATOM 283 N MET A 933 12.227 0.695 -5.698 1.00 0.00 N ATOM 284 CA MET A 933 13.133 1.804 -5.973 1.00 0.00 C ATOM 285 C MET A 933 14.587 1.347 -5.913 1.00 0.00 C ATOM 286 O MET A 933 15.001 0.637 -4.997 1.00 0.00 O ATOM 287 CB MET A 933 12.902 2.940 -4.975 1.00 0.00 C ATOM 288 CG MET A 933 11.832 3.927 -5.414 1.00 0.00 C ATOM 289 SD MET A 933 11.712 5.354 -4.318 1.00 0.00 S ATOM 290 CE MET A 933 11.972 4.579 -2.724 1.00 0.00 C ATOM 0 H MET A 933 12.295 0.319 -4.752 1.00 0.00 H new ATOM 0 HA MET A 933 12.926 2.167 -6.980 1.00 0.00 H new ATOM 0 HB2 MET A 933 12.619 2.515 -4.012 1.00 0.00 H new ATOM 0 HB3 MET A 933 13.839 3.476 -4.824 1.00 0.00 H new ATOM 0 HG2 MET A 933 12.051 4.268 -6.426 1.00 0.00 H new ATOM 0 HG3 MET A 933 10.868 3.420 -5.450 1.00 0.00 H new ATOM 0 HE1 MET A 933 11.718 5.283 -1.931 1.00 0.00 H new ATOM 0 HE2 MET A 933 11.339 3.696 -2.641 1.00 0.00 H new ATOM 0 HE3 MET A 933 13.018 4.286 -2.628 1.00 0.00 H new ATOM 300 N PRO A 934 15.380 1.761 -6.912 1.00 0.00 N ATOM 301 CA PRO A 934 16.800 1.406 -6.995 1.00 0.00 C ATOM 302 C PRO A 934 17.633 2.091 -5.917 1.00 0.00 C ATOM 303 O PRO A 934 17.129 2.927 -5.167 1.00 0.00 O ATOM 304 CB PRO A 934 17.210 1.902 -8.384 1.00 0.00 C ATOM 305 CG PRO A 934 16.249 2.998 -8.693 1.00 0.00 C ATOM 306 CD PRO A 934 14.953 2.610 -8.037 1.00 0.00 C ATOM 0 HA PRO A 934 16.962 0.339 -6.844 1.00 0.00 H new ATOM 0 HB2 PRO A 934 18.238 2.264 -8.388 1.00 0.00 H new ATOM 0 HB3 PRO A 934 17.151 1.103 -9.123 1.00 0.00 H new ATOM 0 HG2 PRO A 934 16.610 3.953 -8.310 1.00 0.00 H new ATOM 0 HG3 PRO A 934 16.122 3.114 -9.769 1.00 0.00 H new ATOM 0 HD2 PRO A 934 14.399 3.484 -7.693 1.00 0.00 H new ATOM 0 HD3 PRO A 934 14.301 2.069 -8.723 1.00 0.00 H new ATOM 314 N PHE A 935 18.910 1.732 -5.846 1.00 0.00 N ATOM 315 CA PHE A 935 19.814 2.313 -4.859 1.00 0.00 C ATOM 316 C PHE A 935 20.164 3.753 -5.223 1.00 0.00 C ATOM 317 O PHE A 935 20.493 4.563 -4.356 1.00 0.00 O ATOM 318 CB PHE A 935 21.090 1.477 -4.750 1.00 0.00 C ATOM 319 CG PHE A 935 20.838 -0.004 -4.734 1.00 0.00 C ATOM 320 CD1 PHE A 935 20.073 -0.578 -3.731 1.00 0.00 C ATOM 321 CD2 PHE A 935 21.364 -0.821 -5.721 1.00 0.00 C ATOM 322 CE1 PHE A 935 19.840 -1.940 -3.713 1.00 0.00 C ATOM 323 CE2 PHE A 935 21.134 -2.184 -5.708 1.00 0.00 C ATOM 324 CZ PHE A 935 20.370 -2.744 -4.703 1.00 0.00 C ATOM 0 H PHE A 935 19.343 1.042 -6.460 1.00 0.00 H new ATOM 0 HA PHE A 935 19.306 2.314 -3.894 1.00 0.00 H new ATOM 0 HB2 PHE A 935 21.744 1.717 -5.588 1.00 0.00 H new ATOM 0 HB3 PHE A 935 21.621 1.757 -3.840 1.00 0.00 H new ATOM 0 HD1 PHE A 935 19.654 0.046 -2.955 1.00 0.00 H new ATOM 0 HD2 PHE A 935 21.961 -0.388 -6.510 1.00 0.00 H new ATOM 0 HE1 PHE A 935 19.244 -2.376 -2.925 1.00 0.00 H new ATOM 0 HE2 PHE A 935 21.551 -2.810 -6.483 1.00 0.00 H new ATOM 0 HZ PHE A 935 20.187 -3.808 -4.691 1.00 0.00 H new ATOM 334 N THR A 936 20.092 4.065 -6.513 1.00 0.00 N ATOM 335 CA THR A 936 20.403 5.405 -6.994 1.00 0.00 C ATOM 336 C THR A 936 19.441 6.434 -6.413 1.00 0.00 C ATOM 337 O THR A 936 19.808 7.589 -6.197 1.00 0.00 O ATOM 338 CB THR A 936 20.348 5.477 -8.532 1.00 0.00 C ATOM 339 OG1 THR A 936 19.039 5.122 -8.992 1.00 0.00 O ATOM 340 CG2 THR A 936 21.379 4.549 -9.155 1.00 0.00 C ATOM 0 H THR A 936 19.821 3.407 -7.244 1.00 0.00 H new ATOM 0 HA THR A 936 21.417 5.632 -6.664 1.00 0.00 H new ATOM 0 HB THR A 936 20.574 6.500 -8.834 1.00 0.00 H new ATOM 0 HG1 THR A 936 19.011 5.172 -9.970 1.00 0.00 H new ATOM 0 HG21 THR A 936 21.321 4.617 -10.241 1.00 0.00 H new ATOM 0 HG22 THR A 936 22.377 4.840 -8.826 1.00 0.00 H new ATOM 0 HG23 THR A 936 21.180 3.523 -8.845 1.00 0.00 H new ATOM 348 N VAL A 937 18.207 6.009 -6.162 1.00 0.00 N ATOM 349 CA VAL A 937 17.191 6.894 -5.604 1.00 0.00 C ATOM 350 C VAL A 937 17.750 7.706 -4.440 1.00 0.00 C ATOM 351 O VAL A 937 18.660 7.262 -3.741 1.00 0.00 O ATOM 352 CB VAL A 937 15.962 6.103 -5.120 1.00 0.00 C ATOM 353 CG1 VAL A 937 14.967 7.028 -4.436 1.00 0.00 C ATOM 354 CG2 VAL A 937 15.309 5.370 -6.283 1.00 0.00 C ATOM 0 H VAL A 937 17.886 5.057 -6.336 1.00 0.00 H new ATOM 0 HA VAL A 937 16.886 7.570 -6.403 1.00 0.00 H new ATOM 0 HB VAL A 937 16.292 5.362 -4.392 1.00 0.00 H new ATOM 0 HG11 VAL A 937 14.105 6.451 -4.101 1.00 0.00 H new ATOM 0 HG12 VAL A 937 15.442 7.503 -3.578 1.00 0.00 H new ATOM 0 HG13 VAL A 937 14.640 7.794 -5.139 1.00 0.00 H new ATOM 0 HG21 VAL A 937 14.442 4.816 -5.923 1.00 0.00 H new ATOM 0 HG22 VAL A 937 14.992 6.092 -7.036 1.00 0.00 H new ATOM 0 HG23 VAL A 937 16.025 4.677 -6.724 1.00 0.00 H new ATOM 364 N SER A 938 17.197 8.898 -4.239 1.00 0.00 N ATOM 365 CA SER A 938 17.642 9.774 -3.162 1.00 0.00 C ATOM 366 C SER A 938 16.558 10.785 -2.801 1.00 0.00 C ATOM 367 O SER A 938 15.534 10.882 -3.479 1.00 0.00 O ATOM 368 CB SER A 938 18.923 10.506 -3.567 1.00 0.00 C ATOM 369 OG SER A 938 20.045 9.643 -3.502 1.00 0.00 O ATOM 0 H SER A 938 16.441 9.279 -4.808 1.00 0.00 H new ATOM 0 HA SER A 938 17.846 9.157 -2.287 1.00 0.00 H new ATOM 0 HB2 SER A 938 18.818 10.896 -4.579 1.00 0.00 H new ATOM 0 HB3 SER A 938 19.080 11.362 -2.910 1.00 0.00 H new ATOM 0 HG SER A 938 19.740 8.714 -3.442 1.00 0.00 H new ATOM 375 N ILE A 939 16.790 11.536 -1.730 1.00 0.00 N ATOM 376 CA ILE A 939 15.835 12.541 -1.280 1.00 0.00 C ATOM 377 C ILE A 939 15.555 13.564 -2.376 1.00 0.00 C ATOM 378 O ILE A 939 14.410 13.964 -2.587 1.00 0.00 O ATOM 379 CB ILE A 939 16.341 13.276 -0.024 1.00 0.00 C ATOM 380 CG1 ILE A 939 16.503 12.294 1.138 1.00 0.00 C ATOM 381 CG2 ILE A 939 15.385 14.398 0.353 1.00 0.00 C ATOM 382 CD1 ILE A 939 17.407 12.803 2.238 1.00 0.00 C ATOM 0 H ILE A 939 17.631 11.468 -1.157 1.00 0.00 H new ATOM 0 HA ILE A 939 14.913 12.013 -1.036 1.00 0.00 H new ATOM 0 HB ILE A 939 17.315 13.713 -0.244 1.00 0.00 H new ATOM 0 HG12 ILE A 939 15.521 12.075 1.558 1.00 0.00 H new ATOM 0 HG13 ILE A 939 16.903 11.355 0.756 1.00 0.00 H new ATOM 0 HG21 ILE A 939 15.755 14.908 1.242 1.00 0.00 H new ATOM 0 HG22 ILE A 939 15.315 15.109 -0.471 1.00 0.00 H new ATOM 0 HG23 ILE A 939 14.399 13.982 0.558 1.00 0.00 H new ATOM 0 HD11 ILE A 939 17.475 12.055 3.028 1.00 0.00 H new ATOM 0 HD12 ILE A 939 18.401 12.995 1.833 1.00 0.00 H new ATOM 0 HD13 ILE A 939 16.998 13.727 2.647 1.00 0.00 H new ATOM 394 N ASP A 940 16.607 13.981 -3.071 1.00 0.00 N ATOM 395 CA ASP A 940 16.475 14.955 -4.147 1.00 0.00 C ATOM 396 C ASP A 940 15.615 14.401 -5.279 1.00 0.00 C ATOM 397 O ASP A 940 14.745 15.094 -5.806 1.00 0.00 O ATOM 398 CB ASP A 940 17.853 15.346 -4.683 1.00 0.00 C ATOM 399 CG ASP A 940 18.514 16.424 -3.847 1.00 0.00 C ATOM 400 OD1 ASP A 940 18.283 17.619 -4.129 1.00 0.00 O ATOM 401 OD2 ASP A 940 19.263 16.074 -2.911 1.00 0.00 O ATOM 0 H ASP A 940 17.561 13.659 -2.908 1.00 0.00 H new ATOM 0 HA ASP A 940 15.986 15.841 -3.743 1.00 0.00 H new ATOM 0 HB2 ASP A 940 18.494 14.465 -4.707 1.00 0.00 H new ATOM 0 HB3 ASP A 940 17.754 15.696 -5.710 1.00 0.00 H new ATOM 406 N GLU A 941 15.865 13.149 -5.647 1.00 0.00 N ATOM 407 CA GLU A 941 15.114 12.503 -6.717 1.00 0.00 C ATOM 408 C GLU A 941 13.649 12.331 -6.327 1.00 0.00 C ATOM 409 O GLU A 941 12.749 12.579 -7.129 1.00 0.00 O ATOM 410 CB GLU A 941 15.728 11.142 -7.052 1.00 0.00 C ATOM 411 CG GLU A 941 17.195 11.215 -7.441 1.00 0.00 C ATOM 412 CD GLU A 941 17.393 11.502 -8.917 1.00 0.00 C ATOM 413 OE1 GLU A 941 16.798 12.479 -9.417 1.00 0.00 O ATOM 414 OE2 GLU A 941 18.143 10.748 -9.572 1.00 0.00 O ATOM 0 H GLU A 941 16.582 12.562 -5.220 1.00 0.00 H new ATOM 0 HA GLU A 941 15.164 13.143 -7.598 1.00 0.00 H new ATOM 0 HB2 GLU A 941 15.622 10.483 -6.190 1.00 0.00 H new ATOM 0 HB3 GLU A 941 15.166 10.691 -7.870 1.00 0.00 H new ATOM 0 HG2 GLU A 941 17.684 11.993 -6.855 1.00 0.00 H new ATOM 0 HG3 GLU A 941 17.681 10.272 -7.189 1.00 0.00 H new ATOM 421 N ILE A 942 13.419 11.904 -5.090 1.00 0.00 N ATOM 422 CA ILE A 942 12.065 11.698 -4.592 1.00 0.00 C ATOM 423 C ILE A 942 11.277 13.004 -4.588 1.00 0.00 C ATOM 424 O ILE A 942 10.143 13.059 -5.066 1.00 0.00 O ATOM 425 CB ILE A 942 12.070 11.111 -3.169 1.00 0.00 C ATOM 426 CG1 ILE A 942 12.628 9.686 -3.183 1.00 0.00 C ATOM 427 CG2 ILE A 942 10.667 11.130 -2.582 1.00 0.00 C ATOM 428 CD1 ILE A 942 13.238 9.263 -1.866 1.00 0.00 C ATOM 0 H ILE A 942 14.153 11.694 -4.414 1.00 0.00 H new ATOM 0 HA ILE A 942 11.586 10.988 -5.266 1.00 0.00 H new ATOM 0 HB ILE A 942 12.713 11.727 -2.541 1.00 0.00 H new ATOM 0 HG12 ILE A 942 11.827 8.993 -3.442 1.00 0.00 H new ATOM 0 HG13 ILE A 942 13.383 9.608 -3.965 1.00 0.00 H new ATOM 0 HG21 ILE A 942 10.688 10.712 -1.576 1.00 0.00 H new ATOM 0 HG22 ILE A 942 10.304 12.157 -2.541 1.00 0.00 H new ATOM 0 HG23 ILE A 942 10.002 10.535 -3.208 1.00 0.00 H new ATOM 0 HD11 ILE A 942 13.613 8.243 -1.950 1.00 0.00 H new ATOM 0 HD12 ILE A 942 14.061 9.932 -1.614 1.00 0.00 H new ATOM 0 HD13 ILE A 942 12.481 9.308 -1.083 1.00 0.00 H new ATOM 440 N LEU A 943 11.885 14.054 -4.049 1.00 0.00 N ATOM 441 CA LEU A 943 11.242 15.362 -3.984 1.00 0.00 C ATOM 442 C LEU A 943 10.852 15.846 -5.377 1.00 0.00 C ATOM 443 O LEU A 943 9.766 16.391 -5.574 1.00 0.00 O ATOM 444 CB LEU A 943 12.173 16.378 -3.320 1.00 0.00 C ATOM 445 CG LEU A 943 12.096 16.462 -1.795 1.00 0.00 C ATOM 446 CD1 LEU A 943 13.069 17.505 -1.268 1.00 0.00 C ATOM 447 CD2 LEU A 943 10.677 16.780 -1.349 1.00 0.00 C ATOM 0 H LEU A 943 12.823 14.026 -3.650 1.00 0.00 H new ATOM 0 HA LEU A 943 10.336 15.265 -3.386 1.00 0.00 H new ATOM 0 HB2 LEU A 943 13.199 16.138 -3.599 1.00 0.00 H new ATOM 0 HB3 LEU A 943 11.954 17.364 -3.730 1.00 0.00 H new ATOM 0 HG LEU A 943 12.376 15.493 -1.383 1.00 0.00 H new ATOM 0 HD11 LEU A 943 13.000 17.551 -0.181 1.00 0.00 H new ATOM 0 HD12 LEU A 943 14.085 17.234 -1.556 1.00 0.00 H new ATOM 0 HD13 LEU A 943 12.821 18.480 -1.688 1.00 0.00 H new ATOM 0 HD21 LEU A 943 10.641 16.836 -0.261 1.00 0.00 H new ATOM 0 HD22 LEU A 943 10.368 17.736 -1.772 1.00 0.00 H new ATOM 0 HD23 LEU A 943 10.003 15.996 -1.694 1.00 0.00 H new ATOM 459 N ASP A 944 11.745 15.643 -6.339 1.00 0.00 N ATOM 460 CA ASP A 944 11.494 16.056 -7.715 1.00 0.00 C ATOM 461 C ASP A 944 10.438 15.167 -8.365 1.00 0.00 C ATOM 462 O ASP A 944 9.678 15.614 -9.224 1.00 0.00 O ATOM 463 CB ASP A 944 12.788 16.010 -8.529 1.00 0.00 C ATOM 464 CG ASP A 944 12.714 16.859 -9.782 1.00 0.00 C ATOM 465 OD1 ASP A 944 11.651 16.858 -10.437 1.00 0.00 O ATOM 466 OD2 ASP A 944 13.720 17.524 -10.110 1.00 0.00 O ATOM 0 H ASP A 944 12.649 15.195 -6.192 1.00 0.00 H new ATOM 0 HA ASP A 944 11.121 17.080 -7.698 1.00 0.00 H new ATOM 0 HB2 ASP A 944 13.616 16.354 -7.909 1.00 0.00 H new ATOM 0 HB3 ASP A 944 13.004 14.978 -8.805 1.00 0.00 H new ATOM 471 N PHE A 945 10.399 13.904 -7.951 1.00 0.00 N ATOM 472 CA PHE A 945 9.438 12.951 -8.495 1.00 0.00 C ATOM 473 C PHE A 945 8.012 13.343 -8.121 1.00 0.00 C ATOM 474 O PHE A 945 7.080 13.161 -8.904 1.00 0.00 O ATOM 475 CB PHE A 945 9.742 11.541 -7.984 1.00 0.00 C ATOM 476 CG PHE A 945 8.667 10.543 -8.305 1.00 0.00 C ATOM 477 CD1 PHE A 945 7.456 10.570 -7.632 1.00 0.00 C ATOM 478 CD2 PHE A 945 8.867 9.578 -9.278 1.00 0.00 C ATOM 479 CE1 PHE A 945 6.465 9.652 -7.925 1.00 0.00 C ATOM 480 CE2 PHE A 945 7.880 8.658 -9.576 1.00 0.00 C ATOM 481 CZ PHE A 945 6.676 8.695 -8.899 1.00 0.00 C ATOM 0 H PHE A 945 11.021 13.517 -7.241 1.00 0.00 H new ATOM 0 HA PHE A 945 9.526 12.964 -9.581 1.00 0.00 H new ATOM 0 HB2 PHE A 945 10.683 11.201 -8.417 1.00 0.00 H new ATOM 0 HB3 PHE A 945 9.882 11.577 -6.904 1.00 0.00 H new ATOM 0 HD1 PHE A 945 7.285 11.316 -6.870 1.00 0.00 H new ATOM 0 HD2 PHE A 945 9.806 9.544 -9.810 1.00 0.00 H new ATOM 0 HE1 PHE A 945 5.526 9.683 -7.393 1.00 0.00 H new ATOM 0 HE2 PHE A 945 8.049 7.911 -10.337 1.00 0.00 H new ATOM 0 HZ PHE A 945 5.902 7.978 -9.130 1.00 0.00 H new ATOM 491 N PHE A 946 7.849 13.883 -6.917 1.00 0.00 N ATOM 492 CA PHE A 946 6.537 14.300 -6.437 1.00 0.00 C ATOM 493 C PHE A 946 6.273 15.764 -6.779 1.00 0.00 C ATOM 494 O PHE A 946 5.325 16.368 -6.277 1.00 0.00 O ATOM 495 CB PHE A 946 6.433 14.091 -4.925 1.00 0.00 C ATOM 496 CG PHE A 946 6.125 12.673 -4.536 1.00 0.00 C ATOM 497 CD1 PHE A 946 7.146 11.759 -4.331 1.00 0.00 C ATOM 498 CD2 PHE A 946 4.814 12.255 -4.375 1.00 0.00 C ATOM 499 CE1 PHE A 946 6.864 10.454 -3.974 1.00 0.00 C ATOM 500 CE2 PHE A 946 4.526 10.951 -4.017 1.00 0.00 C ATOM 501 CZ PHE A 946 5.553 10.050 -3.815 1.00 0.00 C ATOM 0 H PHE A 946 8.610 14.042 -6.256 1.00 0.00 H new ATOM 0 HA PHE A 946 5.785 13.687 -6.934 1.00 0.00 H new ATOM 0 HB2 PHE A 946 7.372 14.391 -4.459 1.00 0.00 H new ATOM 0 HB3 PHE A 946 5.657 14.745 -4.528 1.00 0.00 H new ATOM 0 HD1 PHE A 946 8.173 12.070 -4.451 1.00 0.00 H new ATOM 0 HD2 PHE A 946 4.007 12.956 -4.531 1.00 0.00 H new ATOM 0 HE1 PHE A 946 7.669 9.750 -3.819 1.00 0.00 H new ATOM 0 HE2 PHE A 946 3.500 10.638 -3.896 1.00 0.00 H new ATOM 0 HZ PHE A 946 5.331 9.031 -3.533 1.00 0.00 H new ATOM 511 N TYR A 947 7.118 16.327 -7.635 1.00 0.00 N ATOM 512 CA TYR A 947 6.978 17.720 -8.042 1.00 0.00 C ATOM 513 C TYR A 947 5.546 18.021 -8.474 1.00 0.00 C ATOM 514 O TYR A 947 4.845 17.150 -8.989 1.00 0.00 O ATOM 515 CB TYR A 947 7.945 18.039 -9.184 1.00 0.00 C ATOM 516 CG TYR A 947 8.083 19.518 -9.465 1.00 0.00 C ATOM 517 CD1 TYR A 947 8.447 20.405 -8.459 1.00 0.00 C ATOM 518 CD2 TYR A 947 7.850 20.029 -10.735 1.00 0.00 C ATOM 519 CE1 TYR A 947 8.574 21.758 -8.711 1.00 0.00 C ATOM 520 CE2 TYR A 947 7.976 21.379 -10.997 1.00 0.00 C ATOM 521 CZ TYR A 947 8.337 22.240 -9.981 1.00 0.00 C ATOM 522 OH TYR A 947 8.462 23.586 -10.237 1.00 0.00 O ATOM 0 H TYR A 947 7.907 15.840 -8.060 1.00 0.00 H new ATOM 0 HA TYR A 947 7.219 18.348 -7.184 1.00 0.00 H new ATOM 0 HB2 TYR A 947 8.926 17.630 -8.943 1.00 0.00 H new ATOM 0 HB3 TYR A 947 7.604 17.536 -10.089 1.00 0.00 H new ATOM 0 HD1 TYR A 947 8.634 20.031 -7.463 1.00 0.00 H new ATOM 0 HD2 TYR A 947 7.565 19.358 -11.532 1.00 0.00 H new ATOM 0 HE1 TYR A 947 8.857 22.434 -7.918 1.00 0.00 H new ATOM 0 HE2 TYR A 947 7.793 21.759 -11.991 1.00 0.00 H new ATOM 0 HH TYR A 947 8.262 23.760 -11.180 1.00 0.00 H new ATOM 532 N GLY A 948 5.119 19.262 -8.262 1.00 0.00 N ATOM 533 CA GLY A 948 3.774 19.657 -8.635 1.00 0.00 C ATOM 534 C GLY A 948 2.797 19.554 -7.480 1.00 0.00 C ATOM 535 O GLY A 948 1.932 20.414 -7.311 1.00 0.00 O ATOM 0 H GLY A 948 5.681 20.001 -7.839 1.00 0.00 H new ATOM 0 HA2 GLY A 948 3.789 20.683 -9.003 1.00 0.00 H new ATOM 0 HA3 GLY A 948 3.429 19.028 -9.456 1.00 0.00 H new ATOM 539 N TYR A 949 2.934 18.499 -6.685 1.00 0.00 N ATOM 540 CA TYR A 949 2.054 18.284 -5.542 1.00 0.00 C ATOM 541 C TYR A 949 2.673 18.846 -4.265 1.00 0.00 C ATOM 542 O TYR A 949 3.895 18.897 -4.126 1.00 0.00 O ATOM 543 CB TYR A 949 1.764 16.793 -5.369 1.00 0.00 C ATOM 544 CG TYR A 949 1.102 16.161 -6.572 1.00 0.00 C ATOM 545 CD1 TYR A 949 -0.257 16.328 -6.809 1.00 0.00 C ATOM 546 CD2 TYR A 949 1.834 15.395 -7.471 1.00 0.00 C ATOM 547 CE1 TYR A 949 -0.867 15.752 -7.907 1.00 0.00 C ATOM 548 CE2 TYR A 949 1.233 14.817 -8.572 1.00 0.00 C ATOM 549 CZ TYR A 949 -0.118 14.998 -8.785 1.00 0.00 C ATOM 550 OH TYR A 949 -0.721 14.422 -9.880 1.00 0.00 O ATOM 0 H TYR A 949 3.646 17.779 -6.811 1.00 0.00 H new ATOM 0 HA TYR A 949 1.118 18.809 -5.732 1.00 0.00 H new ATOM 0 HB2 TYR A 949 2.699 16.271 -5.163 1.00 0.00 H new ATOM 0 HB3 TYR A 949 1.123 16.655 -4.498 1.00 0.00 H new ATOM 0 HD1 TYR A 949 -0.847 16.918 -6.123 1.00 0.00 H new ATOM 0 HD2 TYR A 949 2.891 15.249 -7.306 1.00 0.00 H new ATOM 0 HE1 TYR A 949 -1.924 15.892 -8.076 1.00 0.00 H new ATOM 0 HE2 TYR A 949 1.817 14.227 -9.262 1.00 0.00 H new ATOM 0 HH TYR A 949 -0.206 14.634 -10.686 1.00 0.00 H new ATOM 560 N GLN A 950 1.819 19.264 -3.336 1.00 0.00 N ATOM 561 CA GLN A 950 2.281 19.821 -2.071 1.00 0.00 C ATOM 562 C GLN A 950 2.588 18.714 -1.068 1.00 0.00 C ATOM 563 O GLN A 950 1.758 18.380 -0.223 1.00 0.00 O ATOM 564 CB GLN A 950 1.230 20.771 -1.494 1.00 0.00 C ATOM 565 CG GLN A 950 1.248 22.154 -2.126 1.00 0.00 C ATOM 566 CD GLN A 950 0.694 23.223 -1.205 1.00 0.00 C ATOM 567 OE1 GLN A 950 1.439 23.876 -0.473 1.00 0.00 O ATOM 568 NE2 GLN A 950 -0.621 23.409 -1.236 1.00 0.00 N ATOM 0 H GLN A 950 0.805 19.227 -3.436 1.00 0.00 H new ATOM 0 HA GLN A 950 3.199 20.378 -2.262 1.00 0.00 H new ATOM 0 HB2 GLN A 950 0.242 20.332 -1.629 1.00 0.00 H new ATOM 0 HB3 GLN A 950 1.391 20.869 -0.420 1.00 0.00 H new ATOM 0 HG2 GLN A 950 2.271 22.411 -2.400 1.00 0.00 H new ATOM 0 HG3 GLN A 950 0.666 22.136 -3.047 1.00 0.00 H new ATOM 0 HE21 GLN A 950 -1.201 22.846 -1.858 1.00 0.00 H new ATOM 0 HE22 GLN A 950 -1.050 24.115 -0.638 1.00 0.00 H new ATOM 577 N VAL A 951 3.786 18.147 -1.168 1.00 0.00 N ATOM 578 CA VAL A 951 4.203 17.078 -0.269 1.00 0.00 C ATOM 579 C VAL A 951 4.530 17.621 1.118 1.00 0.00 C ATOM 580 O VAL A 951 5.272 18.594 1.255 1.00 0.00 O ATOM 581 CB VAL A 951 5.433 16.331 -0.818 1.00 0.00 C ATOM 582 CG1 VAL A 951 6.012 15.404 0.240 1.00 0.00 C ATOM 583 CG2 VAL A 951 5.068 15.556 -2.075 1.00 0.00 C ATOM 0 H VAL A 951 4.485 18.410 -1.863 1.00 0.00 H new ATOM 0 HA VAL A 951 3.367 16.383 -0.196 1.00 0.00 H new ATOM 0 HB VAL A 951 6.195 17.065 -1.079 1.00 0.00 H new ATOM 0 HG11 VAL A 951 6.880 14.885 -0.167 1.00 0.00 H new ATOM 0 HG12 VAL A 951 6.313 15.988 1.110 1.00 0.00 H new ATOM 0 HG13 VAL A 951 5.259 14.674 0.536 1.00 0.00 H new ATOM 0 HG21 VAL A 951 5.949 15.034 -2.449 1.00 0.00 H new ATOM 0 HG22 VAL A 951 4.288 14.831 -1.842 1.00 0.00 H new ATOM 0 HG23 VAL A 951 4.705 16.247 -2.836 1.00 0.00 H new ATOM 593 N ILE A 952 3.971 16.986 2.142 1.00 0.00 N ATOM 594 CA ILE A 952 4.204 17.405 3.519 1.00 0.00 C ATOM 595 C ILE A 952 5.692 17.402 3.850 1.00 0.00 C ATOM 596 O ILE A 952 6.404 16.424 3.617 1.00 0.00 O ATOM 597 CB ILE A 952 3.466 16.493 4.517 1.00 0.00 C ATOM 598 CG1 ILE A 952 1.952 16.656 4.367 1.00 0.00 C ATOM 599 CG2 ILE A 952 3.899 16.808 5.941 1.00 0.00 C ATOM 600 CD1 ILE A 952 1.153 15.708 5.234 1.00 0.00 C ATOM 0 H ILE A 952 3.354 16.180 2.045 1.00 0.00 H new ATOM 0 HA ILE A 952 3.816 18.419 3.610 1.00 0.00 H new ATOM 0 HB ILE A 952 3.724 15.457 4.300 1.00 0.00 H new ATOM 0 HG12 ILE A 952 1.679 17.681 4.616 1.00 0.00 H new ATOM 0 HG13 ILE A 952 1.679 16.498 3.323 1.00 0.00 H new ATOM 0 HG21 ILE A 952 3.369 16.156 6.635 1.00 0.00 H new ATOM 0 HG22 ILE A 952 4.973 16.647 6.039 1.00 0.00 H new ATOM 0 HG23 ILE A 952 3.666 17.848 6.171 1.00 0.00 H new ATOM 0 HD11 ILE A 952 0.088 15.880 5.076 1.00 0.00 H new ATOM 0 HD12 ILE A 952 1.397 14.679 4.969 1.00 0.00 H new ATOM 0 HD13 ILE A 952 1.397 15.881 6.282 1.00 0.00 H new ATOM 612 N PRO A 953 6.176 18.522 4.408 1.00 0.00 N ATOM 613 CA PRO A 953 7.585 18.673 4.785 1.00 0.00 C ATOM 614 C PRO A 953 7.962 17.799 5.976 1.00 0.00 C ATOM 615 O PRO A 953 7.248 17.753 6.977 1.00 0.00 O ATOM 616 CB PRO A 953 7.696 20.155 5.152 1.00 0.00 C ATOM 617 CG PRO A 953 6.318 20.549 5.558 1.00 0.00 C ATOM 618 CD PRO A 953 5.386 19.726 4.713 1.00 0.00 C ATOM 0 HA PRO A 953 8.258 18.367 3.984 1.00 0.00 H new ATOM 0 HB2 PRO A 953 8.407 20.310 5.963 1.00 0.00 H new ATOM 0 HB3 PRO A 953 8.044 20.747 4.306 1.00 0.00 H new ATOM 0 HG2 PRO A 953 6.154 20.358 6.619 1.00 0.00 H new ATOM 0 HG3 PRO A 953 6.153 21.614 5.396 1.00 0.00 H new ATOM 0 HD2 PRO A 953 4.469 19.480 5.249 1.00 0.00 H new ATOM 0 HD3 PRO A 953 5.093 20.255 3.806 1.00 0.00 H new ATOM 626 N GLY A 954 9.092 17.107 5.862 1.00 0.00 N ATOM 627 CA GLY A 954 9.545 16.244 6.938 1.00 0.00 C ATOM 628 C GLY A 954 8.907 14.870 6.886 1.00 0.00 C ATOM 629 O GLY A 954 9.244 13.992 7.681 1.00 0.00 O ATOM 0 H GLY A 954 9.701 17.129 5.044 1.00 0.00 H new ATOM 0 HA2 GLY A 954 10.629 16.140 6.885 1.00 0.00 H new ATOM 0 HA3 GLY A 954 9.316 16.712 7.896 1.00 0.00 H new ATOM 633 N SER A 955 7.983 14.683 5.950 1.00 0.00 N ATOM 634 CA SER A 955 7.292 13.407 5.801 1.00 0.00 C ATOM 635 C SER A 955 8.200 12.371 5.146 1.00 0.00 C ATOM 636 O SER A 955 8.434 11.296 5.698 1.00 0.00 O ATOM 637 CB SER A 955 6.020 13.586 4.970 1.00 0.00 C ATOM 638 OG SER A 955 6.307 13.542 3.583 1.00 0.00 O ATOM 0 H SER A 955 7.695 15.399 5.283 1.00 0.00 H new ATOM 0 HA SER A 955 7.021 13.050 6.795 1.00 0.00 H new ATOM 0 HB2 SER A 955 5.304 12.803 5.222 1.00 0.00 H new ATOM 0 HB3 SER A 955 5.551 14.538 5.218 1.00 0.00 H new ATOM 0 HG SER A 955 6.409 14.455 3.241 1.00 0.00 H new ATOM 644 N VAL A 956 8.710 12.703 3.965 1.00 0.00 N ATOM 645 CA VAL A 956 9.594 11.803 3.233 1.00 0.00 C ATOM 646 C VAL A 956 10.521 11.051 4.182 1.00 0.00 C ATOM 647 O VAL A 956 11.497 11.609 4.684 1.00 0.00 O ATOM 648 CB VAL A 956 10.444 12.567 2.201 1.00 0.00 C ATOM 649 CG1 VAL A 956 11.413 11.624 1.504 1.00 0.00 C ATOM 650 CG2 VAL A 956 9.550 13.268 1.190 1.00 0.00 C ATOM 0 H VAL A 956 8.526 13.589 3.494 1.00 0.00 H new ATOM 0 HA VAL A 956 8.957 11.089 2.711 1.00 0.00 H new ATOM 0 HB VAL A 956 11.026 13.325 2.725 1.00 0.00 H new ATOM 0 HG11 VAL A 956 12.005 12.182 0.778 1.00 0.00 H new ATOM 0 HG12 VAL A 956 12.075 11.172 2.242 1.00 0.00 H new ATOM 0 HG13 VAL A 956 10.854 10.841 0.991 1.00 0.00 H new ATOM 0 HG21 VAL A 956 10.167 13.803 0.468 1.00 0.00 H new ATOM 0 HG22 VAL A 956 8.941 12.529 0.669 1.00 0.00 H new ATOM 0 HG23 VAL A 956 8.901 13.975 1.707 1.00 0.00 H new ATOM 660 N CYS A 957 10.209 9.783 4.424 1.00 0.00 N ATOM 661 CA CYS A 957 11.014 8.954 5.314 1.00 0.00 C ATOM 662 C CYS A 957 11.589 7.755 4.567 1.00 0.00 C ATOM 663 O CYS A 957 10.851 6.878 4.117 1.00 0.00 O ATOM 664 CB CYS A 957 10.174 8.477 6.499 1.00 0.00 C ATOM 665 SG CYS A 957 11.123 8.200 8.013 1.00 0.00 S ATOM 0 H CYS A 957 9.405 9.306 4.017 1.00 0.00 H new ATOM 0 HA CYS A 957 11.841 9.559 5.685 1.00 0.00 H new ATOM 0 HB2 CYS A 957 9.397 9.214 6.700 1.00 0.00 H new ATOM 0 HB3 CYS A 957 9.670 7.550 6.224 1.00 0.00 H new ATOM 0 HG CYS A 957 10.325 7.801 8.958 1.00 0.00 H new ATOM 671 N LEU A 958 12.911 7.723 4.438 1.00 0.00 N ATOM 672 CA LEU A 958 13.587 6.632 3.745 1.00 0.00 C ATOM 673 C LEU A 958 13.816 5.451 4.681 1.00 0.00 C ATOM 674 O LEU A 958 14.333 5.611 5.787 1.00 0.00 O ATOM 675 CB LEU A 958 14.922 7.113 3.175 1.00 0.00 C ATOM 676 CG LEU A 958 14.845 7.956 1.902 1.00 0.00 C ATOM 677 CD1 LEU A 958 16.137 8.731 1.696 1.00 0.00 C ATOM 678 CD2 LEU A 958 14.552 7.075 0.696 1.00 0.00 C ATOM 0 H LEU A 958 13.536 8.441 4.805 1.00 0.00 H new ATOM 0 HA LEU A 958 12.947 6.303 2.926 1.00 0.00 H new ATOM 0 HB2 LEU A 958 15.433 7.696 3.942 1.00 0.00 H new ATOM 0 HB3 LEU A 958 15.543 6.240 2.972 1.00 0.00 H new ATOM 0 HG LEU A 958 14.030 8.671 2.012 1.00 0.00 H new ATOM 0 HD11 LEU A 958 16.064 9.325 0.785 1.00 0.00 H new ATOM 0 HD12 LEU A 958 16.305 9.391 2.547 1.00 0.00 H new ATOM 0 HD13 LEU A 958 16.970 8.033 1.608 1.00 0.00 H new ATOM 0 HD21 LEU A 958 14.501 7.692 -0.201 1.00 0.00 H new ATOM 0 HD22 LEU A 958 15.346 6.336 0.584 1.00 0.00 H new ATOM 0 HD23 LEU A 958 13.600 6.565 0.841 1.00 0.00 H new ATOM 690 N LYS A 959 13.429 4.262 4.231 1.00 0.00 N ATOM 691 CA LYS A 959 13.595 3.051 5.026 1.00 0.00 C ATOM 692 C LYS A 959 14.908 2.352 4.686 1.00 0.00 C ATOM 693 O LYS A 959 15.193 2.078 3.520 1.00 0.00 O ATOM 694 CB LYS A 959 12.422 2.097 4.790 1.00 0.00 C ATOM 695 CG LYS A 959 12.478 0.842 5.644 1.00 0.00 C ATOM 696 CD LYS A 959 12.202 1.149 7.106 1.00 0.00 C ATOM 697 CE LYS A 959 10.714 1.321 7.369 1.00 0.00 C ATOM 698 NZ LYS A 959 10.006 0.012 7.427 1.00 0.00 N ATOM 0 H LYS A 959 12.998 4.111 3.319 1.00 0.00 H new ATOM 0 HA LYS A 959 13.618 3.337 6.078 1.00 0.00 H new ATOM 0 HB2 LYS A 959 11.490 2.624 4.993 1.00 0.00 H new ATOM 0 HB3 LYS A 959 12.403 1.810 3.739 1.00 0.00 H new ATOM 0 HG2 LYS A 959 11.748 0.120 5.279 1.00 0.00 H new ATOM 0 HG3 LYS A 959 13.460 0.379 5.548 1.00 0.00 H new ATOM 0 HD2 LYS A 959 12.591 0.343 7.728 1.00 0.00 H new ATOM 0 HD3 LYS A 959 12.731 2.058 7.394 1.00 0.00 H new ATOM 0 HE2 LYS A 959 10.571 1.853 8.309 1.00 0.00 H new ATOM 0 HE3 LYS A 959 10.275 1.937 6.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 959 9.012 0.166 7.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 959 10.049 -0.448 6.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 959 10.462 -0.598 8.135 1.00 0.00 H new ATOM 712 N TYR A 960 15.703 2.066 5.711 1.00 0.00 N ATOM 713 CA TYR A 960 16.986 1.401 5.521 1.00 0.00 C ATOM 714 C TYR A 960 17.001 0.040 6.210 1.00 0.00 C ATOM 715 O TYR A 960 16.199 -0.224 7.105 1.00 0.00 O ATOM 716 CB TYR A 960 18.121 2.271 6.062 1.00 0.00 C ATOM 717 CG TYR A 960 18.245 3.607 5.364 1.00 0.00 C ATOM 718 CD1 TYR A 960 18.866 3.711 4.125 1.00 0.00 C ATOM 719 CD2 TYR A 960 17.742 4.765 5.943 1.00 0.00 C ATOM 720 CE1 TYR A 960 18.982 4.929 3.484 1.00 0.00 C ATOM 721 CE2 TYR A 960 17.852 5.987 5.309 1.00 0.00 C ATOM 722 CZ TYR A 960 18.473 6.064 4.079 1.00 0.00 C ATOM 723 OH TYR A 960 18.586 7.280 3.445 1.00 0.00 O ATOM 0 H TYR A 960 15.481 2.285 6.682 1.00 0.00 H new ATOM 0 HA TYR A 960 17.132 1.249 4.452 1.00 0.00 H new ATOM 0 HB2 TYR A 960 17.962 2.440 7.127 1.00 0.00 H new ATOM 0 HB3 TYR A 960 19.062 1.730 5.962 1.00 0.00 H new ATOM 0 HD1 TYR A 960 19.265 2.824 3.655 1.00 0.00 H new ATOM 0 HD2 TYR A 960 17.256 4.709 6.906 1.00 0.00 H new ATOM 0 HE1 TYR A 960 19.469 4.992 2.522 1.00 0.00 H new ATOM 0 HE2 TYR A 960 17.454 6.877 5.773 1.00 0.00 H new ATOM 0 HH TYR A 960 18.175 7.977 3.998 1.00 0.00 H new ATOM 733 N ASN A 961 17.921 -0.821 5.786 1.00 0.00 N ATOM 734 CA ASN A 961 18.042 -2.155 6.361 1.00 0.00 C ATOM 735 C ASN A 961 18.788 -2.108 7.692 1.00 0.00 C ATOM 736 O ASN A 961 19.180 -1.039 8.157 1.00 0.00 O ATOM 737 CB ASN A 961 18.767 -3.089 5.390 1.00 0.00 C ATOM 738 CG ASN A 961 18.334 -2.876 3.952 1.00 0.00 C ATOM 739 OD1 ASN A 961 19.036 -1.998 3.246 1.00 0.00 O flip ATOM 740 ND2 ASN A 961 17.380 -3.496 3.482 1.00 0.00 N flip ATOM 0 H ASN A 961 18.593 -0.618 5.046 1.00 0.00 H new ATOM 0 HA ASN A 961 17.037 -2.538 6.541 1.00 0.00 H new ATOM 0 HB2 ASN A 961 19.842 -2.929 5.470 1.00 0.00 H new ATOM 0 HB3 ASN A 961 18.577 -4.124 5.675 1.00 0.00 H new ATOM 0 HD21 ASN A 961 16.869 -4.162 4.062 1.00 0.00 H new ATOM 0 HD22 ASN A 961 17.101 -3.344 2.513 1.00 0.00 H new ATOM 747 N GLU A 962 18.980 -3.276 8.298 1.00 0.00 N ATOM 748 CA GLU A 962 19.679 -3.367 9.574 1.00 0.00 C ATOM 749 C GLU A 962 21.089 -2.793 9.465 1.00 0.00 C ATOM 750 O GLU A 962 21.592 -2.171 10.401 1.00 0.00 O ATOM 751 CB GLU A 962 19.745 -4.822 10.042 1.00 0.00 C ATOM 752 CG GLU A 962 20.696 -5.045 11.206 1.00 0.00 C ATOM 753 CD GLU A 962 20.235 -4.356 12.476 1.00 0.00 C ATOM 754 OE1 GLU A 962 20.403 -3.123 12.575 1.00 0.00 O ATOM 755 OE2 GLU A 962 19.707 -5.050 13.370 1.00 0.00 O ATOM 0 H GLU A 962 18.662 -4.171 7.926 1.00 0.00 H new ATOM 0 HA GLU A 962 19.122 -2.782 10.306 1.00 0.00 H new ATOM 0 HB2 GLU A 962 18.746 -5.147 10.333 1.00 0.00 H new ATOM 0 HB3 GLU A 962 20.054 -5.450 9.206 1.00 0.00 H new ATOM 0 HG2 GLU A 962 20.792 -6.115 11.392 1.00 0.00 H new ATOM 0 HG3 GLU A 962 21.686 -4.678 10.937 1.00 0.00 H new ATOM 762 N LYS A 963 21.721 -3.006 8.316 1.00 0.00 N ATOM 763 CA LYS A 963 23.072 -2.510 8.082 1.00 0.00 C ATOM 764 C LYS A 963 23.064 -1.004 7.840 1.00 0.00 C ATOM 765 O LYS A 963 24.045 -0.315 8.119 1.00 0.00 O ATOM 766 CB LYS A 963 23.700 -3.226 6.885 1.00 0.00 C ATOM 767 CG LYS A 963 24.176 -4.634 7.199 1.00 0.00 C ATOM 768 CD LYS A 963 25.163 -5.134 6.158 1.00 0.00 C ATOM 769 CE LYS A 963 24.449 -5.676 4.929 1.00 0.00 C ATOM 770 NZ LYS A 963 25.359 -6.485 4.070 1.00 0.00 N ATOM 0 H LYS A 963 21.319 -3.519 7.532 1.00 0.00 H new ATOM 0 HA LYS A 963 23.667 -2.714 8.972 1.00 0.00 H new ATOM 0 HB2 LYS A 963 22.971 -3.270 6.076 1.00 0.00 H new ATOM 0 HB3 LYS A 963 24.544 -2.639 6.523 1.00 0.00 H new ATOM 0 HG2 LYS A 963 24.645 -4.650 8.183 1.00 0.00 H new ATOM 0 HG3 LYS A 963 23.320 -5.307 7.243 1.00 0.00 H new ATOM 0 HD2 LYS A 963 25.828 -4.321 5.865 1.00 0.00 H new ATOM 0 HD3 LYS A 963 25.787 -5.915 6.592 1.00 0.00 H new ATOM 0 HE2 LYS A 963 23.604 -6.289 5.241 1.00 0.00 H new ATOM 0 HE3 LYS A 963 24.044 -4.847 4.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 963 24.835 -6.836 3.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 963 26.153 -5.893 3.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 963 25.726 -7.291 4.615 1.00 0.00 H new ATOM 784 N GLY A 964 21.950 -0.498 7.321 1.00 0.00 N ATOM 785 CA GLY A 964 21.835 0.924 7.052 1.00 0.00 C ATOM 786 C GLY A 964 21.591 1.219 5.585 1.00 0.00 C ATOM 787 O GLY A 964 21.138 2.307 5.231 1.00 0.00 O ATOM 0 H GLY A 964 21.124 -1.047 7.082 1.00 0.00 H new ATOM 0 HA2 GLY A 964 21.018 1.338 7.643 1.00 0.00 H new ATOM 0 HA3 GLY A 964 22.747 1.426 7.374 1.00 0.00 H new ATOM 791 N MET A 965 21.894 0.247 4.730 1.00 0.00 N ATOM 792 CA MET A 965 21.705 0.409 3.293 1.00 0.00 C ATOM 793 C MET A 965 20.246 0.711 2.967 1.00 0.00 C ATOM 794 O MET A 965 19.337 0.415 3.743 1.00 0.00 O ATOM 795 CB MET A 965 22.154 -0.853 2.553 1.00 0.00 C ATOM 796 CG MET A 965 23.656 -0.924 2.329 1.00 0.00 C ATOM 797 SD MET A 965 24.272 0.434 1.314 1.00 0.00 S ATOM 798 CE MET A 965 25.793 -0.275 0.689 1.00 0.00 C ATOM 0 H MET A 965 22.271 -0.659 5.007 1.00 0.00 H new ATOM 0 HA MET A 965 22.314 1.251 2.964 1.00 0.00 H new ATOM 0 HB2 MET A 965 21.838 -1.729 3.120 1.00 0.00 H new ATOM 0 HB3 MET A 965 21.648 -0.898 1.588 1.00 0.00 H new ATOM 0 HG2 MET A 965 24.164 -0.911 3.293 1.00 0.00 H new ATOM 0 HG3 MET A 965 23.904 -1.872 1.851 1.00 0.00 H new ATOM 0 HE1 MET A 965 26.292 0.447 0.042 1.00 0.00 H new ATOM 0 HE2 MET A 965 26.447 -0.527 1.524 1.00 0.00 H new ATOM 0 HE3 MET A 965 25.567 -1.177 0.120 1.00 0.00 H new ATOM 808 N PRO A 966 20.014 1.315 1.792 1.00 0.00 N ATOM 809 CA PRO A 966 18.666 1.671 1.337 1.00 0.00 C ATOM 810 C PRO A 966 17.832 0.444 0.983 1.00 0.00 C ATOM 811 O PRO A 966 18.258 -0.404 0.198 1.00 0.00 O ATOM 812 CB PRO A 966 18.925 2.519 0.090 1.00 0.00 C ATOM 813 CG PRO A 966 20.256 2.069 -0.406 1.00 0.00 C ATOM 814 CD PRO A 966 21.049 1.697 0.817 1.00 0.00 C ATOM 0 HA PRO A 966 18.098 2.188 2.110 1.00 0.00 H new ATOM 0 HB2 PRO A 966 18.150 2.365 -0.661 1.00 0.00 H new ATOM 0 HB3 PRO A 966 18.931 3.582 0.329 1.00 0.00 H new ATOM 0 HG2 PRO A 966 20.154 1.218 -1.079 1.00 0.00 H new ATOM 0 HG3 PRO A 966 20.752 2.861 -0.967 1.00 0.00 H new ATOM 0 HD2 PRO A 966 21.735 0.874 0.616 1.00 0.00 H new ATOM 0 HD3 PRO A 966 21.650 2.533 1.176 1.00 0.00 H new ATOM 822 N THR A 967 16.640 0.357 1.565 1.00 0.00 N ATOM 823 CA THR A 967 15.746 -0.766 1.312 1.00 0.00 C ATOM 824 C THR A 967 14.876 -0.510 0.087 1.00 0.00 C ATOM 825 O THR A 967 13.948 -1.267 -0.197 1.00 0.00 O ATOM 826 CB THR A 967 14.838 -1.046 2.524 1.00 0.00 C ATOM 827 OG1 THR A 967 13.974 0.073 2.757 1.00 0.00 O ATOM 828 CG2 THR A 967 15.666 -1.321 3.769 1.00 0.00 C ATOM 0 H THR A 967 16.271 1.051 2.215 1.00 0.00 H new ATOM 0 HA THR A 967 16.376 -1.637 1.131 1.00 0.00 H new ATOM 0 HB THR A 967 14.238 -1.929 2.304 1.00 0.00 H new ATOM 0 HG1 THR A 967 14.467 0.905 2.601 1.00 0.00 H new ATOM 0 HG21 THR A 967 15.002 -1.516 4.612 1.00 0.00 H new ATOM 0 HG22 THR A 967 16.301 -2.190 3.599 1.00 0.00 H new ATOM 0 HG23 THR A 967 16.289 -0.454 3.991 1.00 0.00 H new ATOM 836 N GLY A 968 15.182 0.562 -0.638 1.00 0.00 N ATOM 837 CA GLY A 968 14.418 0.898 -1.825 1.00 0.00 C ATOM 838 C GLY A 968 12.963 1.188 -1.515 1.00 0.00 C ATOM 839 O GLY A 968 12.086 0.952 -2.346 1.00 0.00 O ATOM 0 H GLY A 968 15.946 1.204 -0.424 1.00 0.00 H new ATOM 0 HA2 GLY A 968 14.864 1.768 -2.306 1.00 0.00 H new ATOM 0 HA3 GLY A 968 14.478 0.075 -2.537 1.00 0.00 H new ATOM 843 N GLU A 969 12.706 1.701 -0.316 1.00 0.00 N ATOM 844 CA GLU A 969 11.346 2.021 0.102 1.00 0.00 C ATOM 845 C GLU A 969 11.288 3.399 0.754 1.00 0.00 C ATOM 846 O GLU A 969 12.230 3.821 1.423 1.00 0.00 O ATOM 847 CB GLU A 969 10.825 0.961 1.075 1.00 0.00 C ATOM 848 CG GLU A 969 10.507 -0.369 0.413 1.00 0.00 C ATOM 849 CD GLU A 969 10.642 -1.541 1.365 1.00 0.00 C ATOM 850 OE1 GLU A 969 10.344 -1.367 2.566 1.00 0.00 O ATOM 851 OE2 GLU A 969 11.045 -2.632 0.911 1.00 0.00 O ATOM 0 H GLU A 969 13.421 1.904 0.383 1.00 0.00 H new ATOM 0 HA GLU A 969 10.713 2.031 -0.785 1.00 0.00 H new ATOM 0 HB2 GLU A 969 11.568 0.800 1.856 1.00 0.00 H new ATOM 0 HB3 GLU A 969 9.926 1.338 1.563 1.00 0.00 H new ATOM 0 HG2 GLU A 969 9.491 -0.341 0.019 1.00 0.00 H new ATOM 0 HG3 GLU A 969 11.174 -0.517 -0.436 1.00 0.00 H new ATOM 858 N ALA A 970 10.174 4.096 0.553 1.00 0.00 N ATOM 859 CA ALA A 970 9.991 5.425 1.122 1.00 0.00 C ATOM 860 C ALA A 970 8.522 5.693 1.431 1.00 0.00 C ATOM 861 O ALA A 970 7.632 5.167 0.763 1.00 0.00 O ATOM 862 CB ALA A 970 10.535 6.484 0.175 1.00 0.00 C ATOM 0 H ALA A 970 9.385 3.762 0.000 1.00 0.00 H new ATOM 0 HA ALA A 970 10.546 5.471 2.059 1.00 0.00 H new ATOM 0 HB1 ALA A 970 10.392 7.472 0.613 1.00 0.00 H new ATOM 0 HB2 ALA A 970 11.598 6.312 0.009 1.00 0.00 H new ATOM 0 HB3 ALA A 970 10.005 6.428 -0.776 1.00 0.00 H new ATOM 868 N MET A 971 8.275 6.512 2.448 1.00 0.00 N ATOM 869 CA MET A 971 6.913 6.849 2.844 1.00 0.00 C ATOM 870 C MET A 971 6.688 8.357 2.789 1.00 0.00 C ATOM 871 O MET A 971 7.605 9.141 3.036 1.00 0.00 O ATOM 872 CB MET A 971 6.626 6.331 4.255 1.00 0.00 C ATOM 873 CG MET A 971 6.277 4.852 4.299 1.00 0.00 C ATOM 874 SD MET A 971 6.669 4.093 5.887 1.00 0.00 S ATOM 875 CE MET A 971 5.737 5.140 7.002 1.00 0.00 C ATOM 0 H MET A 971 9.000 6.954 3.013 1.00 0.00 H new ATOM 0 HA MET A 971 6.229 6.371 2.143 1.00 0.00 H new ATOM 0 HB2 MET A 971 7.499 6.509 4.883 1.00 0.00 H new ATOM 0 HB3 MET A 971 5.803 6.903 4.683 1.00 0.00 H new ATOM 0 HG2 MET A 971 5.214 4.727 4.094 1.00 0.00 H new ATOM 0 HG3 MET A 971 6.818 4.331 3.509 1.00 0.00 H new ATOM 0 HE1 MET A 971 5.717 4.688 7.994 1.00 0.00 H new ATOM 0 HE2 MET A 971 6.209 6.121 7.059 1.00 0.00 H new ATOM 0 HE3 MET A 971 4.717 5.249 6.632 1.00 0.00 H new ATOM 885 N VAL A 972 5.463 8.757 2.463 1.00 0.00 N ATOM 886 CA VAL A 972 5.118 10.171 2.376 1.00 0.00 C ATOM 887 C VAL A 972 3.723 10.431 2.934 1.00 0.00 C ATOM 888 O VAL A 972 2.939 9.503 3.130 1.00 0.00 O ATOM 889 CB VAL A 972 5.180 10.675 0.922 1.00 0.00 C ATOM 890 CG1 VAL A 972 6.624 10.890 0.493 1.00 0.00 C ATOM 891 CG2 VAL A 972 4.478 9.700 -0.010 1.00 0.00 C ATOM 0 H VAL A 972 4.693 8.122 2.255 1.00 0.00 H new ATOM 0 HA VAL A 972 5.852 10.714 2.972 1.00 0.00 H new ATOM 0 HB VAL A 972 4.662 11.633 0.865 1.00 0.00 H new ATOM 0 HG11 VAL A 972 6.648 11.246 -0.537 1.00 0.00 H new ATOM 0 HG12 VAL A 972 7.091 11.629 1.144 1.00 0.00 H new ATOM 0 HG13 VAL A 972 7.169 9.949 0.564 1.00 0.00 H new ATOM 0 HG21 VAL A 972 4.532 10.072 -1.033 1.00 0.00 H new ATOM 0 HG22 VAL A 972 4.965 8.727 0.048 1.00 0.00 H new ATOM 0 HG23 VAL A 972 3.434 9.602 0.286 1.00 0.00 H new ATOM 901 N ALA A 973 3.420 11.700 3.186 1.00 0.00 N ATOM 902 CA ALA A 973 2.118 12.084 3.718 1.00 0.00 C ATOM 903 C ALA A 973 1.514 13.232 2.917 1.00 0.00 C ATOM 904 O ALA A 973 2.234 14.078 2.386 1.00 0.00 O ATOM 905 CB ALA A 973 2.240 12.468 5.185 1.00 0.00 C ATOM 0 H ALA A 973 4.059 12.480 3.030 1.00 0.00 H new ATOM 0 HA ALA A 973 1.451 11.226 3.632 1.00 0.00 H new ATOM 0 HB1 ALA A 973 1.260 12.753 5.569 1.00 0.00 H new ATOM 0 HB2 ALA A 973 2.620 11.619 5.753 1.00 0.00 H new ATOM 0 HB3 ALA A 973 2.927 13.308 5.285 1.00 0.00 H new ATOM 911 N PHE A 974 0.188 13.255 2.833 1.00 0.00 N ATOM 912 CA PHE A 974 -0.513 14.300 2.095 1.00 0.00 C ATOM 913 C PHE A 974 -1.607 14.931 2.952 1.00 0.00 C ATOM 914 O PHE A 974 -2.282 14.244 3.718 1.00 0.00 O ATOM 915 CB PHE A 974 -1.120 13.727 0.813 1.00 0.00 C ATOM 916 CG PHE A 974 -0.136 13.607 -0.315 1.00 0.00 C ATOM 917 CD1 PHE A 974 0.806 12.591 -0.325 1.00 0.00 C ATOM 918 CD2 PHE A 974 -0.153 14.509 -1.367 1.00 0.00 C ATOM 919 CE1 PHE A 974 1.714 12.479 -1.361 1.00 0.00 C ATOM 920 CE2 PHE A 974 0.752 14.402 -2.406 1.00 0.00 C ATOM 921 CZ PHE A 974 1.686 13.385 -2.404 1.00 0.00 C ATOM 0 H PHE A 974 -0.423 12.562 3.266 1.00 0.00 H new ATOM 0 HA PHE A 974 0.209 15.073 1.833 1.00 0.00 H new ATOM 0 HB2 PHE A 974 -1.537 12.743 1.027 1.00 0.00 H new ATOM 0 HB3 PHE A 974 -1.947 14.362 0.497 1.00 0.00 H new ATOM 0 HD1 PHE A 974 0.831 11.878 0.486 1.00 0.00 H new ATOM 0 HD2 PHE A 974 -0.882 15.305 -1.375 1.00 0.00 H new ATOM 0 HE1 PHE A 974 2.445 11.684 -1.355 1.00 0.00 H new ATOM 0 HE2 PHE A 974 0.729 15.113 -3.219 1.00 0.00 H new ATOM 0 HZ PHE A 974 2.393 13.298 -3.216 1.00 0.00 H new ATOM 931 N GLU A 975 -1.774 16.242 2.816 1.00 0.00 N ATOM 932 CA GLU A 975 -2.784 16.966 3.578 1.00 0.00 C ATOM 933 C GLU A 975 -4.168 16.777 2.964 1.00 0.00 C ATOM 934 O GLU A 975 -5.174 16.742 3.673 1.00 0.00 O ATOM 935 CB GLU A 975 -2.440 18.456 3.638 1.00 0.00 C ATOM 936 CG GLU A 975 -1.114 18.747 4.321 1.00 0.00 C ATOM 937 CD GLU A 975 -1.256 18.926 5.820 1.00 0.00 C ATOM 938 OE1 GLU A 975 -1.532 20.062 6.258 1.00 0.00 O ATOM 939 OE2 GLU A 975 -1.091 17.930 6.554 1.00 0.00 O ATOM 0 H GLU A 975 -1.223 16.824 2.185 1.00 0.00 H new ATOM 0 HA GLU A 975 -2.796 16.562 4.590 1.00 0.00 H new ATOM 0 HB2 GLU A 975 -2.412 18.855 2.624 1.00 0.00 H new ATOM 0 HB3 GLU A 975 -3.235 18.983 4.166 1.00 0.00 H new ATOM 0 HG2 GLU A 975 -0.420 17.931 4.121 1.00 0.00 H new ATOM 0 HG3 GLU A 975 -0.678 19.649 3.891 1.00 0.00 H new ATOM 946 N SER A 976 -4.211 16.656 1.641 1.00 0.00 N ATOM 947 CA SER A 976 -5.471 16.475 0.930 1.00 0.00 C ATOM 948 C SER A 976 -5.591 15.053 0.391 1.00 0.00 C ATOM 949 O SER A 976 -4.688 14.555 -0.281 1.00 0.00 O ATOM 950 CB SER A 976 -5.581 17.480 -0.218 1.00 0.00 C ATOM 951 OG SER A 976 -6.157 18.697 0.222 1.00 0.00 O ATOM 0 H SER A 976 -3.387 16.680 1.040 1.00 0.00 H new ATOM 0 HA SER A 976 -6.286 16.647 1.633 1.00 0.00 H new ATOM 0 HB2 SER A 976 -4.592 17.672 -0.633 1.00 0.00 H new ATOM 0 HB3 SER A 976 -6.187 17.056 -1.019 1.00 0.00 H new ATOM 0 HG SER A 976 -6.214 19.323 -0.530 1.00 0.00 H new ATOM 957 N ARG A 977 -6.712 14.406 0.691 1.00 0.00 N ATOM 958 CA ARG A 977 -6.951 13.041 0.237 1.00 0.00 C ATOM 959 C ARG A 977 -6.977 12.971 -1.287 1.00 0.00 C ATOM 960 O ARG A 977 -6.306 12.135 -1.891 1.00 0.00 O ATOM 961 CB ARG A 977 -8.271 12.516 0.806 1.00 0.00 C ATOM 962 CG ARG A 977 -8.752 11.235 0.144 1.00 0.00 C ATOM 963 CD ARG A 977 -7.950 10.031 0.612 1.00 0.00 C ATOM 964 NE ARG A 977 -8.234 9.693 2.004 1.00 0.00 N ATOM 965 CZ ARG A 977 -7.740 8.621 2.615 1.00 0.00 C ATOM 966 NH1 ARG A 977 -6.943 7.789 1.960 1.00 0.00 N ATOM 967 NH2 ARG A 977 -8.044 8.381 3.884 1.00 0.00 N ATOM 0 H ARG A 977 -7.469 14.805 1.246 1.00 0.00 H new ATOM 0 HA ARG A 977 -6.134 12.416 0.597 1.00 0.00 H new ATOM 0 HB2 ARG A 977 -8.152 12.340 1.875 1.00 0.00 H new ATOM 0 HB3 ARG A 977 -9.037 13.283 0.693 1.00 0.00 H new ATOM 0 HG2 ARG A 977 -9.807 11.081 0.371 1.00 0.00 H new ATOM 0 HG3 ARG A 977 -8.669 11.330 -0.939 1.00 0.00 H new ATOM 0 HD2 ARG A 977 -8.178 9.175 -0.023 1.00 0.00 H new ATOM 0 HD3 ARG A 977 -6.886 10.238 0.499 1.00 0.00 H new ATOM 0 HE ARG A 977 -8.844 10.313 2.536 1.00 0.00 H new ATOM 0 HH11 ARG A 977 -6.707 7.971 0.984 1.00 0.00 H new ATOM 0 HH12 ARG A 977 -6.565 6.967 2.432 1.00 0.00 H new ATOM 0 HH21 ARG A 977 -8.657 9.019 4.391 1.00 0.00 H new ATOM 0 HH22 ARG A 977 -7.665 7.558 4.352 1.00 0.00 H new ATOM 981 N ASP A 978 -7.757 13.854 -1.901 1.00 0.00 N ATOM 982 CA ASP A 978 -7.871 13.893 -3.354 1.00 0.00 C ATOM 983 C ASP A 978 -6.503 14.086 -4.001 1.00 0.00 C ATOM 984 O ASP A 978 -6.228 13.538 -5.068 1.00 0.00 O ATOM 985 CB ASP A 978 -8.815 15.017 -3.783 1.00 0.00 C ATOM 986 CG ASP A 978 -9.031 15.051 -5.283 1.00 0.00 C ATOM 987 OD1 ASP A 978 -8.072 15.380 -6.013 1.00 0.00 O ATOM 988 OD2 ASP A 978 -10.158 14.748 -5.727 1.00 0.00 O ATOM 0 H ASP A 978 -8.320 14.552 -1.415 1.00 0.00 H new ATOM 0 HA ASP A 978 -8.280 12.939 -3.688 1.00 0.00 H new ATOM 0 HB2 ASP A 978 -9.776 14.891 -3.283 1.00 0.00 H new ATOM 0 HB3 ASP A 978 -8.408 15.974 -3.456 1.00 0.00 H new ATOM 993 N GLU A 979 -5.650 14.870 -3.348 1.00 0.00 N ATOM 994 CA GLU A 979 -4.312 15.137 -3.862 1.00 0.00 C ATOM 995 C GLU A 979 -3.460 13.871 -3.842 1.00 0.00 C ATOM 996 O GLU A 979 -2.765 13.563 -4.810 1.00 0.00 O ATOM 997 CB GLU A 979 -3.635 16.234 -3.039 1.00 0.00 C ATOM 998 CG GLU A 979 -3.957 17.640 -3.517 1.00 0.00 C ATOM 999 CD GLU A 979 -3.840 17.786 -5.021 1.00 0.00 C ATOM 1000 OE1 GLU A 979 -3.027 17.056 -5.626 1.00 0.00 O ATOM 1001 OE2 GLU A 979 -4.561 18.630 -5.594 1.00 0.00 O ATOM 0 H GLU A 979 -5.862 15.331 -2.463 1.00 0.00 H new ATOM 0 HA GLU A 979 -4.407 15.474 -4.894 1.00 0.00 H new ATOM 0 HB2 GLU A 979 -3.939 16.135 -1.997 1.00 0.00 H new ATOM 0 HB3 GLU A 979 -2.555 16.087 -3.071 1.00 0.00 H new ATOM 0 HG2 GLU A 979 -4.969 17.902 -3.208 1.00 0.00 H new ATOM 0 HG3 GLU A 979 -3.283 18.347 -3.034 1.00 0.00 H new ATOM 1008 N ALA A 980 -3.518 13.143 -2.732 1.00 0.00 N ATOM 1009 CA ALA A 980 -2.753 11.911 -2.586 1.00 0.00 C ATOM 1010 C ALA A 980 -3.074 10.929 -3.707 1.00 0.00 C ATOM 1011 O ALA A 980 -2.174 10.361 -4.327 1.00 0.00 O ATOM 1012 CB ALA A 980 -3.029 11.276 -1.231 1.00 0.00 C ATOM 0 H ALA A 980 -4.087 13.385 -1.921 1.00 0.00 H new ATOM 0 HA ALA A 980 -1.694 12.161 -2.650 1.00 0.00 H new ATOM 0 HB1 ALA A 980 -2.451 10.357 -1.136 1.00 0.00 H new ATOM 0 HB2 ALA A 980 -2.743 11.969 -0.440 1.00 0.00 H new ATOM 0 HB3 ALA A 980 -4.091 11.047 -1.146 1.00 0.00 H new ATOM 1018 N THR A 981 -4.364 10.731 -3.963 1.00 0.00 N ATOM 1019 CA THR A 981 -4.804 9.816 -5.009 1.00 0.00 C ATOM 1020 C THR A 981 -4.328 10.279 -6.381 1.00 0.00 C ATOM 1021 O THR A 981 -3.878 9.475 -7.196 1.00 0.00 O ATOM 1022 CB THR A 981 -6.339 9.682 -5.028 1.00 0.00 C ATOM 1023 OG1 THR A 981 -6.838 9.577 -3.691 1.00 0.00 O ATOM 1024 CG2 THR A 981 -6.765 8.462 -5.832 1.00 0.00 C ATOM 0 H THR A 981 -5.122 11.192 -3.460 1.00 0.00 H new ATOM 0 HA THR A 981 -4.364 8.844 -4.785 1.00 0.00 H new ATOM 0 HB THR A 981 -6.754 10.572 -5.501 1.00 0.00 H new ATOM 0 HG1 THR A 981 -7.814 9.494 -3.712 1.00 0.00 H new ATOM 0 HG21 THR A 981 -7.852 8.388 -5.832 1.00 0.00 H new ATOM 0 HG22 THR A 981 -6.408 8.559 -6.857 1.00 0.00 H new ATOM 0 HG23 THR A 981 -6.340 7.564 -5.384 1.00 0.00 H new ATOM 1032 N ALA A 982 -4.430 11.581 -6.629 1.00 0.00 N ATOM 1033 CA ALA A 982 -4.007 12.151 -7.902 1.00 0.00 C ATOM 1034 C ALA A 982 -2.502 12.005 -8.096 1.00 0.00 C ATOM 1035 O ALA A 982 -2.034 11.711 -9.196 1.00 0.00 O ATOM 1036 CB ALA A 982 -4.412 13.615 -7.985 1.00 0.00 C ATOM 0 H ALA A 982 -4.802 12.260 -5.965 1.00 0.00 H new ATOM 0 HA ALA A 982 -4.505 11.602 -8.701 1.00 0.00 H new ATOM 0 HB1 ALA A 982 -4.090 14.028 -8.941 1.00 0.00 H new ATOM 0 HB2 ALA A 982 -5.496 13.698 -7.901 1.00 0.00 H new ATOM 0 HB3 ALA A 982 -3.941 14.169 -7.173 1.00 0.00 H new ATOM 1042 N ALA A 983 -1.748 12.212 -7.021 1.00 0.00 N ATOM 1043 CA ALA A 983 -0.296 12.102 -7.074 1.00 0.00 C ATOM 1044 C ALA A 983 0.135 10.678 -7.409 1.00 0.00 C ATOM 1045 O ALA A 983 1.029 10.466 -8.228 1.00 0.00 O ATOM 1046 CB ALA A 983 0.315 12.543 -5.752 1.00 0.00 C ATOM 0 H ALA A 983 -2.119 12.457 -6.103 1.00 0.00 H new ATOM 0 HA ALA A 983 0.065 12.759 -7.866 1.00 0.00 H new ATOM 0 HB1 ALA A 983 1.400 12.456 -5.806 1.00 0.00 H new ATOM 0 HB2 ALA A 983 0.044 13.580 -5.554 1.00 0.00 H new ATOM 0 HB3 ALA A 983 -0.061 11.910 -4.948 1.00 0.00 H new ATOM 1052 N VAL A 984 -0.506 9.705 -6.771 1.00 0.00 N ATOM 1053 CA VAL A 984 -0.190 8.300 -7.002 1.00 0.00 C ATOM 1054 C VAL A 984 -0.566 7.878 -8.418 1.00 0.00 C ATOM 1055 O VAL A 984 0.226 7.250 -9.120 1.00 0.00 O ATOM 1056 CB VAL A 984 -0.916 7.388 -5.996 1.00 0.00 C ATOM 1057 CG1 VAL A 984 -0.702 5.925 -6.351 1.00 0.00 C ATOM 1058 CG2 VAL A 984 -0.443 7.676 -4.579 1.00 0.00 C ATOM 0 H VAL A 984 -1.248 9.863 -6.089 1.00 0.00 H new ATOM 0 HA VAL A 984 0.886 8.192 -6.867 1.00 0.00 H new ATOM 0 HB VAL A 984 -1.985 7.597 -6.048 1.00 0.00 H new ATOM 0 HG11 VAL A 984 -1.222 5.296 -5.629 1.00 0.00 H new ATOM 0 HG12 VAL A 984 -1.094 5.732 -7.350 1.00 0.00 H new ATOM 0 HG13 VAL A 984 0.364 5.697 -6.329 1.00 0.00 H new ATOM 0 HG21 VAL A 984 -0.966 7.023 -3.881 1.00 0.00 H new ATOM 0 HG22 VAL A 984 0.630 7.496 -4.510 1.00 0.00 H new ATOM 0 HG23 VAL A 984 -0.653 8.716 -4.330 1.00 0.00 H new ATOM 1068 N ILE A 985 -1.780 8.228 -8.830 1.00 0.00 N ATOM 1069 CA ILE A 985 -2.261 7.886 -10.163 1.00 0.00 C ATOM 1070 C ILE A 985 -1.398 8.533 -11.241 1.00 0.00 C ATOM 1071 O ILE A 985 -1.016 7.886 -12.216 1.00 0.00 O ATOM 1072 CB ILE A 985 -3.725 8.322 -10.362 1.00 0.00 C ATOM 1073 CG1 ILE A 985 -4.628 7.637 -9.334 1.00 0.00 C ATOM 1074 CG2 ILE A 985 -4.185 8.001 -11.776 1.00 0.00 C ATOM 1075 CD1 ILE A 985 -5.967 8.317 -9.159 1.00 0.00 C ATOM 0 H ILE A 985 -2.448 8.748 -8.260 1.00 0.00 H new ATOM 0 HA ILE A 985 -2.198 6.802 -10.253 1.00 0.00 H new ATOM 0 HB ILE A 985 -3.791 9.400 -10.215 1.00 0.00 H new ATOM 0 HG12 ILE A 985 -4.792 6.603 -9.638 1.00 0.00 H new ATOM 0 HG13 ILE A 985 -4.115 7.610 -8.373 1.00 0.00 H new ATOM 0 HG21 ILE A 985 -5.221 8.315 -11.902 1.00 0.00 H new ATOM 0 HG22 ILE A 985 -3.556 8.530 -12.492 1.00 0.00 H new ATOM 0 HG23 ILE A 985 -4.107 6.928 -11.949 1.00 0.00 H new ATOM 0 HD11 ILE A 985 -6.554 7.778 -8.416 1.00 0.00 H new ATOM 0 HD12 ILE A 985 -5.813 9.343 -8.825 1.00 0.00 H new ATOM 0 HD13 ILE A 985 -6.500 8.321 -10.110 1.00 0.00 H new ATOM 1087 N ASP A 986 -1.094 9.813 -11.058 1.00 0.00 N ATOM 1088 CA ASP A 986 -0.274 10.549 -12.014 1.00 0.00 C ATOM 1089 C ASP A 986 1.188 10.123 -11.916 1.00 0.00 C ATOM 1090 O ASP A 986 1.956 10.281 -12.865 1.00 0.00 O ATOM 1091 CB ASP A 986 -0.397 12.054 -11.772 1.00 0.00 C ATOM 1092 CG ASP A 986 -1.578 12.663 -12.503 1.00 0.00 C ATOM 1093 OD1 ASP A 986 -2.517 11.913 -12.840 1.00 0.00 O ATOM 1094 OD2 ASP A 986 -1.562 13.889 -12.738 1.00 0.00 O ATOM 0 H ASP A 986 -1.403 10.363 -10.256 1.00 0.00 H new ATOM 0 HA ASP A 986 -0.634 10.320 -13.017 1.00 0.00 H new ATOM 0 HB2 ASP A 986 -0.500 12.240 -10.703 1.00 0.00 H new ATOM 0 HB3 ASP A 986 0.520 12.547 -12.095 1.00 0.00 H new ATOM 1099 N LEU A 987 1.565 9.584 -10.762 1.00 0.00 N ATOM 1100 CA LEU A 987 2.936 9.136 -10.539 1.00 0.00 C ATOM 1101 C LEU A 987 2.975 7.648 -10.206 1.00 0.00 C ATOM 1102 O LEU A 987 3.852 7.188 -9.476 1.00 0.00 O ATOM 1103 CB LEU A 987 3.578 9.941 -9.407 1.00 0.00 C ATOM 1104 CG LEU A 987 3.388 11.457 -9.469 1.00 0.00 C ATOM 1105 CD1 LEU A 987 3.784 12.099 -8.149 1.00 0.00 C ATOM 1106 CD2 LEU A 987 4.195 12.049 -10.616 1.00 0.00 C ATOM 0 H LEU A 987 0.942 9.446 -9.967 1.00 0.00 H new ATOM 0 HA LEU A 987 3.500 9.299 -11.458 1.00 0.00 H new ATOM 0 HB2 LEU A 987 3.175 9.583 -8.460 1.00 0.00 H new ATOM 0 HB3 LEU A 987 4.647 9.729 -9.399 1.00 0.00 H new ATOM 0 HG LEU A 987 2.333 11.665 -9.648 1.00 0.00 H new ATOM 0 HD11 LEU A 987 3.642 13.178 -8.212 1.00 0.00 H new ATOM 0 HD12 LEU A 987 3.163 11.698 -7.348 1.00 0.00 H new ATOM 0 HD13 LEU A 987 4.831 11.883 -7.939 1.00 0.00 H new ATOM 0 HD21 LEU A 987 4.048 13.129 -10.645 1.00 0.00 H new ATOM 0 HD22 LEU A 987 5.253 11.831 -10.467 1.00 0.00 H new ATOM 0 HD23 LEU A 987 3.863 11.612 -11.558 1.00 0.00 H new ATOM 1118 N ASN A 988 2.020 6.900 -10.749 1.00 0.00 N ATOM 1119 CA ASN A 988 1.946 5.463 -10.512 1.00 0.00 C ATOM 1120 C ASN A 988 2.784 4.700 -11.532 1.00 0.00 C ATOM 1121 O ASN A 988 2.758 5.004 -12.725 1.00 0.00 O ATOM 1122 CB ASN A 988 0.493 4.989 -10.571 1.00 0.00 C ATOM 1123 CG ASN A 988 0.376 3.531 -10.971 1.00 0.00 C ATOM 1124 OD1 ASN A 988 -0.312 3.194 -11.935 1.00 0.00 O ATOM 1125 ND2 ASN A 988 1.050 2.659 -10.231 1.00 0.00 N ATOM 0 H ASN A 988 1.286 7.265 -11.356 1.00 0.00 H new ATOM 0 HA ASN A 988 2.346 5.263 -9.518 1.00 0.00 H new ATOM 0 HB2 ASN A 988 0.027 5.134 -9.597 1.00 0.00 H new ATOM 0 HB3 ASN A 988 -0.058 5.604 -11.283 1.00 0.00 H new ATOM 0 HD21 ASN A 988 1.010 1.664 -10.452 1.00 0.00 H new ATOM 0 HD22 ASN A 988 1.608 2.984 -9.441 1.00 0.00 H new ATOM 1132 N ASP A 989 3.526 3.706 -11.056 1.00 0.00 N ATOM 1133 CA ASP A 989 4.371 2.897 -11.927 1.00 0.00 C ATOM 1134 C ASP A 989 5.234 3.781 -12.821 1.00 0.00 C ATOM 1135 O ASP A 989 5.381 3.519 -14.015 1.00 0.00 O ATOM 1136 CB ASP A 989 3.512 1.966 -12.785 1.00 0.00 C ATOM 1137 CG ASP A 989 2.720 2.717 -13.837 1.00 0.00 C ATOM 1138 OD1 ASP A 989 3.255 2.925 -14.947 1.00 0.00 O ATOM 1139 OD2 ASP A 989 1.565 3.095 -13.552 1.00 0.00 O ATOM 0 H ASP A 989 3.559 3.441 -10.072 1.00 0.00 H new ATOM 0 HA ASP A 989 5.028 2.296 -11.299 1.00 0.00 H new ATOM 0 HB2 ASP A 989 4.153 1.231 -13.272 1.00 0.00 H new ATOM 0 HB3 ASP A 989 2.826 1.414 -12.142 1.00 0.00 H new ATOM 1144 N ARG A 990 5.803 4.830 -12.235 1.00 0.00 N ATOM 1145 CA ARG A 990 6.650 5.754 -12.979 1.00 0.00 C ATOM 1146 C ARG A 990 8.091 5.254 -13.026 1.00 0.00 C ATOM 1147 O ARG A 990 8.660 4.830 -12.020 1.00 0.00 O ATOM 1148 CB ARG A 990 6.603 7.146 -12.345 1.00 0.00 C ATOM 1149 CG ARG A 990 5.497 8.030 -12.899 1.00 0.00 C ATOM 1150 CD ARG A 990 5.870 9.502 -12.822 1.00 0.00 C ATOM 1151 NE ARG A 990 5.214 10.288 -13.863 1.00 0.00 N ATOM 1152 CZ ARG A 990 5.629 10.331 -15.124 1.00 0.00 C ATOM 1153 NH1 ARG A 990 6.694 9.635 -15.499 1.00 0.00 N ATOM 1154 NH2 ARG A 990 4.979 11.070 -16.014 1.00 0.00 N ATOM 0 H ARG A 990 5.693 5.061 -11.248 1.00 0.00 H new ATOM 0 HA ARG A 990 6.271 5.813 -13.999 1.00 0.00 H new ATOM 0 HB2 ARG A 990 6.468 7.041 -11.268 1.00 0.00 H new ATOM 0 HB3 ARG A 990 7.563 7.639 -12.500 1.00 0.00 H new ATOM 0 HG2 ARG A 990 5.297 7.758 -13.935 1.00 0.00 H new ATOM 0 HG3 ARG A 990 4.577 7.857 -12.341 1.00 0.00 H new ATOM 0 HD2 ARG A 990 5.595 9.895 -11.843 1.00 0.00 H new ATOM 0 HD3 ARG A 990 6.951 9.607 -12.915 1.00 0.00 H new ATOM 0 HE ARG A 990 4.391 10.834 -13.608 1.00 0.00 H new ATOM 0 HH11 ARG A 990 7.196 9.065 -14.818 1.00 0.00 H new ATOM 0 HH12 ARG A 990 7.011 9.670 -16.468 1.00 0.00 H new ATOM 0 HH21 ARG A 990 4.159 11.606 -15.730 1.00 0.00 H new ATOM 0 HH22 ARG A 990 5.299 11.102 -16.982 1.00 0.00 H new ATOM 1168 N PRO A 991 8.695 5.303 -14.223 1.00 0.00 N ATOM 1169 CA PRO A 991 10.077 4.858 -14.430 1.00 0.00 C ATOM 1170 C PRO A 991 11.090 5.788 -13.771 1.00 0.00 C ATOM 1171 O PRO A 991 11.529 6.769 -14.372 1.00 0.00 O ATOM 1172 CB PRO A 991 10.235 4.889 -15.952 1.00 0.00 C ATOM 1173 CG PRO A 991 9.237 5.894 -16.416 1.00 0.00 C ATOM 1174 CD PRO A 991 8.077 5.796 -15.465 1.00 0.00 C ATOM 0 HA PRO A 991 10.260 3.879 -13.988 1.00 0.00 H new ATOM 0 HB2 PRO A 991 11.247 5.174 -16.239 1.00 0.00 H new ATOM 0 HB3 PRO A 991 10.043 3.909 -16.390 1.00 0.00 H new ATOM 0 HG2 PRO A 991 9.662 6.898 -16.410 1.00 0.00 H new ATOM 0 HG3 PRO A 991 8.922 5.687 -17.439 1.00 0.00 H new ATOM 0 HD2 PRO A 991 7.595 6.763 -15.318 1.00 0.00 H new ATOM 0 HD3 PRO A 991 7.313 5.111 -15.833 1.00 0.00 H new ATOM 1182 N ILE A 992 11.457 5.473 -12.533 1.00 0.00 N ATOM 1183 CA ILE A 992 12.419 6.280 -11.794 1.00 0.00 C ATOM 1184 C ILE A 992 13.844 5.792 -12.032 1.00 0.00 C ATOM 1185 O ILE A 992 14.146 4.614 -11.851 1.00 0.00 O ATOM 1186 CB ILE A 992 12.128 6.259 -10.282 1.00 0.00 C ATOM 1187 CG1 ILE A 992 10.947 7.176 -9.955 1.00 0.00 C ATOM 1188 CG2 ILE A 992 13.363 6.678 -9.498 1.00 0.00 C ATOM 1189 CD1 ILE A 992 10.676 7.306 -8.472 1.00 0.00 C ATOM 0 H ILE A 992 11.103 4.665 -12.021 1.00 0.00 H new ATOM 0 HA ILE A 992 12.321 7.302 -12.161 1.00 0.00 H new ATOM 0 HB ILE A 992 11.866 5.242 -9.992 1.00 0.00 H new ATOM 0 HG12 ILE A 992 11.140 8.166 -10.369 1.00 0.00 H new ATOM 0 HG13 ILE A 992 10.053 6.793 -10.447 1.00 0.00 H new ATOM 0 HG21 ILE A 992 13.141 6.658 -8.431 1.00 0.00 H new ATOM 0 HG22 ILE A 992 14.180 5.989 -9.711 1.00 0.00 H new ATOM 0 HG23 ILE A 992 13.654 7.687 -9.789 1.00 0.00 H new ATOM 0 HD11 ILE A 992 9.826 7.970 -8.314 1.00 0.00 H new ATOM 0 HD12 ILE A 992 10.451 6.324 -8.056 1.00 0.00 H new ATOM 0 HD13 ILE A 992 11.555 7.718 -7.976 1.00 0.00 H new ATOM 1201 N GLY A 993 14.718 6.708 -12.440 1.00 0.00 N ATOM 1202 CA GLY A 993 16.101 6.353 -12.695 1.00 0.00 C ATOM 1203 C GLY A 993 16.237 5.277 -13.755 1.00 0.00 C ATOM 1204 O GLY A 993 16.338 5.578 -14.944 1.00 0.00 O ATOM 0 H GLY A 993 14.492 7.690 -12.598 1.00 0.00 H new ATOM 0 HA2 GLY A 993 16.649 7.241 -13.011 1.00 0.00 H new ATOM 0 HA3 GLY A 993 16.561 6.007 -11.769 1.00 0.00 H new ATOM 1208 N SER A 994 16.242 4.020 -13.323 1.00 0.00 N ATOM 1209 CA SER A 994 16.372 2.897 -14.243 1.00 0.00 C ATOM 1210 C SER A 994 15.343 1.815 -13.929 1.00 0.00 C ATOM 1211 O SER A 994 15.280 0.788 -14.606 1.00 0.00 O ATOM 1212 CB SER A 994 17.784 2.311 -14.169 1.00 0.00 C ATOM 1213 OG SER A 994 18.701 3.093 -14.914 1.00 0.00 O ATOM 0 H SER A 994 16.158 3.754 -12.342 1.00 0.00 H new ATOM 0 HA SER A 994 16.191 3.264 -15.253 1.00 0.00 H new ATOM 0 HB2 SER A 994 18.106 2.260 -13.129 1.00 0.00 H new ATOM 0 HB3 SER A 994 17.778 1.290 -14.551 1.00 0.00 H new ATOM 0 HG SER A 994 19.596 2.698 -14.849 1.00 0.00 H new ATOM 1219 N ARG A 995 14.540 2.053 -12.898 1.00 0.00 N ATOM 1220 CA ARG A 995 13.514 1.100 -12.493 1.00 0.00 C ATOM 1221 C ARG A 995 12.186 1.807 -12.235 1.00 0.00 C ATOM 1222 O ARG A 995 12.143 3.023 -12.051 1.00 0.00 O ATOM 1223 CB ARG A 995 13.955 0.347 -11.236 1.00 0.00 C ATOM 1224 CG ARG A 995 15.332 -0.287 -11.358 1.00 0.00 C ATOM 1225 CD ARG A 995 15.545 -1.362 -10.304 1.00 0.00 C ATOM 1226 NE ARG A 995 16.440 -2.417 -10.772 1.00 0.00 N ATOM 1227 CZ ARG A 995 17.761 -2.289 -10.825 1.00 0.00 C ATOM 1228 NH1 ARG A 995 18.337 -1.159 -10.441 1.00 0.00 N ATOM 1229 NH2 ARG A 995 18.509 -3.295 -11.263 1.00 0.00 N ATOM 0 H ARG A 995 14.580 2.898 -12.328 1.00 0.00 H new ATOM 0 HA ARG A 995 13.375 0.387 -13.306 1.00 0.00 H new ATOM 0 HB2 ARG A 995 13.955 1.036 -10.391 1.00 0.00 H new ATOM 0 HB3 ARG A 995 13.224 -0.431 -11.013 1.00 0.00 H new ATOM 0 HG2 ARG A 995 15.447 -0.722 -12.351 1.00 0.00 H new ATOM 0 HG3 ARG A 995 16.098 0.482 -11.256 1.00 0.00 H new ATOM 0 HD2 ARG A 995 15.958 -0.909 -9.403 1.00 0.00 H new ATOM 0 HD3 ARG A 995 14.584 -1.797 -10.030 1.00 0.00 H new ATOM 0 HE ARG A 995 16.028 -3.300 -11.075 1.00 0.00 H new ATOM 0 HH11 ARG A 995 17.766 -0.384 -10.103 1.00 0.00 H new ATOM 0 HH12 ARG A 995 19.352 -1.064 -10.483 1.00 0.00 H new ATOM 0 HH21 ARG A 995 18.069 -4.166 -11.559 1.00 0.00 H new ATOM 0 HH22 ARG A 995 19.523 -3.196 -11.304 1.00 0.00 H new ATOM 1243 N LYS A 996 11.104 1.036 -12.224 1.00 0.00 N ATOM 1244 CA LYS A 996 9.774 1.586 -11.989 1.00 0.00 C ATOM 1245 C LYS A 996 9.432 1.563 -10.502 1.00 0.00 C ATOM 1246 O LYS A 996 9.804 0.636 -9.783 1.00 0.00 O ATOM 1247 CB LYS A 996 8.727 0.797 -12.777 1.00 0.00 C ATOM 1248 CG LYS A 996 8.920 0.863 -14.282 1.00 0.00 C ATOM 1249 CD LYS A 996 8.054 -0.158 -15.001 1.00 0.00 C ATOM 1250 CE LYS A 996 6.672 0.400 -15.307 1.00 0.00 C ATOM 1251 NZ LYS A 996 6.704 1.374 -16.433 1.00 0.00 N ATOM 0 H LYS A 996 11.122 0.027 -12.375 1.00 0.00 H new ATOM 0 HA LYS A 996 9.770 2.622 -12.329 1.00 0.00 H new ATOM 0 HB2 LYS A 996 8.757 -0.246 -12.461 1.00 0.00 H new ATOM 0 HB3 LYS A 996 7.736 1.177 -12.529 1.00 0.00 H new ATOM 0 HG2 LYS A 996 8.675 1.864 -14.638 1.00 0.00 H new ATOM 0 HG3 LYS A 996 9.968 0.687 -14.523 1.00 0.00 H new ATOM 0 HD2 LYS A 996 8.540 -0.459 -15.929 1.00 0.00 H new ATOM 0 HD3 LYS A 996 7.958 -1.053 -14.386 1.00 0.00 H new ATOM 0 HE2 LYS A 996 5.996 -0.419 -15.554 1.00 0.00 H new ATOM 0 HE3 LYS A 996 6.272 0.886 -14.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 996 5.734 1.564 -16.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 996 7.142 2.261 -16.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 996 7.259 0.978 -17.219 1.00 0.00 H new ATOM 1265 N VAL A 997 8.718 2.589 -10.049 1.00 0.00 N ATOM 1266 CA VAL A 997 8.323 2.685 -8.649 1.00 0.00 C ATOM 1267 C VAL A 997 6.844 2.357 -8.471 1.00 0.00 C ATOM 1268 O VAL A 997 6.036 2.571 -9.375 1.00 0.00 O ATOM 1269 CB VAL A 997 8.597 4.091 -8.083 1.00 0.00 C ATOM 1270 CG1 VAL A 997 10.070 4.251 -7.740 1.00 0.00 C ATOM 1271 CG2 VAL A 997 8.152 5.158 -9.072 1.00 0.00 C ATOM 0 H VAL A 997 8.402 3.365 -10.631 1.00 0.00 H new ATOM 0 HA VAL A 997 8.922 1.958 -8.101 1.00 0.00 H new ATOM 0 HB VAL A 997 8.020 4.214 -7.166 1.00 0.00 H new ATOM 0 HG11 VAL A 997 10.244 5.251 -7.342 1.00 0.00 H new ATOM 0 HG12 VAL A 997 10.353 3.509 -6.994 1.00 0.00 H new ATOM 0 HG13 VAL A 997 10.670 4.109 -8.639 1.00 0.00 H new ATOM 0 HG21 VAL A 997 8.353 6.146 -8.657 1.00 0.00 H new ATOM 0 HG22 VAL A 997 8.700 5.039 -10.007 1.00 0.00 H new ATOM 0 HG23 VAL A 997 7.084 5.055 -9.262 1.00 0.00 H new ATOM 1281 N LYS A 998 6.496 1.836 -7.300 1.00 0.00 N ATOM 1282 CA LYS A 998 5.114 1.479 -7.001 1.00 0.00 C ATOM 1283 C LYS A 998 4.564 2.338 -5.867 1.00 0.00 C ATOM 1284 O LYS A 998 5.165 2.429 -4.795 1.00 0.00 O ATOM 1285 CB LYS A 998 5.018 -0.002 -6.627 1.00 0.00 C ATOM 1286 CG LYS A 998 3.666 -0.620 -6.936 1.00 0.00 C ATOM 1287 CD LYS A 998 2.711 -0.492 -5.761 1.00 0.00 C ATOM 1288 CE LYS A 998 2.836 -1.672 -4.810 1.00 0.00 C ATOM 1289 NZ LYS A 998 1.930 -2.790 -5.191 1.00 0.00 N ATOM 0 H LYS A 998 7.152 1.651 -6.541 1.00 0.00 H new ATOM 0 HA LYS A 998 4.516 1.661 -7.894 1.00 0.00 H new ATOM 0 HB2 LYS A 998 5.791 -0.554 -7.161 1.00 0.00 H new ATOM 0 HB3 LYS A 998 5.225 -0.114 -5.563 1.00 0.00 H new ATOM 0 HG2 LYS A 998 3.234 -0.134 -7.811 1.00 0.00 H new ATOM 0 HG3 LYS A 998 3.795 -1.673 -7.188 1.00 0.00 H new ATOM 0 HD2 LYS A 998 2.916 0.433 -5.223 1.00 0.00 H new ATOM 0 HD3 LYS A 998 1.687 -0.427 -6.129 1.00 0.00 H new ATOM 0 HE2 LYS A 998 3.867 -2.026 -4.804 1.00 0.00 H new ATOM 0 HE3 LYS A 998 2.605 -1.347 -3.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 998 2.045 -3.575 -4.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 998 0.944 -2.460 -5.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 998 2.167 -3.118 -6.149 1.00 0.00 H new ATOM 1303 N LEU A 999 3.417 2.964 -6.108 1.00 0.00 N ATOM 1304 CA LEU A 999 2.784 3.814 -5.106 1.00 0.00 C ATOM 1305 C LEU A 999 1.496 3.181 -4.590 1.00 0.00 C ATOM 1306 O LEU A 999 0.672 2.702 -5.369 1.00 0.00 O ATOM 1307 CB LEU A 999 2.488 5.195 -5.693 1.00 0.00 C ATOM 1308 CG LEU A 999 3.706 6.053 -6.037 1.00 0.00 C ATOM 1309 CD1 LEU A 999 3.298 7.240 -6.896 1.00 0.00 C ATOM 1310 CD2 LEU A 999 4.401 6.525 -4.768 1.00 0.00 C ATOM 0 H LEU A 999 2.907 2.899 -6.989 1.00 0.00 H new ATOM 0 HA LEU A 999 3.474 3.922 -4.269 1.00 0.00 H new ATOM 0 HB2 LEU A 999 1.894 5.064 -6.597 1.00 0.00 H new ATOM 0 HB3 LEU A 999 1.870 5.745 -4.983 1.00 0.00 H new ATOM 0 HG LEU A 999 4.407 5.443 -6.606 1.00 0.00 H new ATOM 0 HD11 LEU A 999 4.178 7.839 -7.131 1.00 0.00 H new ATOM 0 HD12 LEU A 999 2.846 6.882 -7.821 1.00 0.00 H new ATOM 0 HD13 LEU A 999 2.577 7.851 -6.353 1.00 0.00 H new ATOM 0 HD21 LEU A 999 5.266 7.134 -5.032 1.00 0.00 H new ATOM 0 HD22 LEU A 999 3.707 7.118 -4.172 1.00 0.00 H new ATOM 0 HD23 LEU A 999 4.729 5.661 -4.190 1.00 0.00 H new ATOM 1322 N VAL A1000 1.327 3.186 -3.272 1.00 0.00 N ATOM 1323 CA VAL A1000 0.137 2.616 -2.652 1.00 0.00 C ATOM 1324 C VAL A1000 -0.538 3.623 -1.727 1.00 0.00 C ATOM 1325 O VAL A1000 0.130 4.386 -1.028 1.00 0.00 O ATOM 1326 CB VAL A1000 0.476 1.346 -1.848 1.00 0.00 C ATOM 1327 CG1 VAL A1000 -0.781 0.752 -1.231 1.00 0.00 C ATOM 1328 CG2 VAL A1000 1.178 0.327 -2.734 1.00 0.00 C ATOM 0 H VAL A1000 1.999 3.578 -2.613 1.00 0.00 H new ATOM 0 HA VAL A1000 -0.546 2.355 -3.461 1.00 0.00 H new ATOM 0 HB VAL A1000 1.154 1.619 -1.039 1.00 0.00 H new ATOM 0 HG11 VAL A1000 -0.521 -0.144 -0.667 1.00 0.00 H new ATOM 0 HG12 VAL A1000 -1.238 1.482 -0.562 1.00 0.00 H new ATOM 0 HG13 VAL A1000 -1.486 0.492 -2.021 1.00 0.00 H new ATOM 0 HG21 VAL A1000 1.410 -0.564 -2.150 1.00 0.00 H new ATOM 0 HG22 VAL A1000 0.526 0.057 -3.565 1.00 0.00 H new ATOM 0 HG23 VAL A1000 2.101 0.757 -3.122 1.00 0.00 H new ATOM 1338 N LEU A1001 -1.866 3.621 -1.728 1.00 0.00 N ATOM 1339 CA LEU A1001 -2.634 4.535 -0.889 1.00 0.00 C ATOM 1340 C LEU A1001 -2.734 4.009 0.539 1.00 0.00 C ATOM 1341 O LEU A1001 -2.964 2.820 0.759 1.00 0.00 O ATOM 1342 CB LEU A1001 -4.034 4.737 -1.469 1.00 0.00 C ATOM 1343 CG LEU A1001 -4.167 5.820 -2.540 1.00 0.00 C ATOM 1344 CD1 LEU A1001 -5.438 5.616 -3.351 1.00 0.00 C ATOM 1345 CD2 LEU A1001 -4.154 7.203 -1.905 1.00 0.00 C ATOM 0 H LEU A1001 -2.434 2.997 -2.301 1.00 0.00 H new ATOM 0 HA LEU A1001 -2.115 5.493 -0.868 1.00 0.00 H new ATOM 0 HB2 LEU A1001 -4.369 3.791 -1.894 1.00 0.00 H new ATOM 0 HB3 LEU A1001 -4.713 4.978 -0.651 1.00 0.00 H new ATOM 0 HG LEU A1001 -3.314 5.744 -3.214 1.00 0.00 H new ATOM 0 HD11 LEU A1001 -5.516 6.396 -4.108 1.00 0.00 H new ATOM 0 HD12 LEU A1001 -5.407 4.641 -3.837 1.00 0.00 H new ATOM 0 HD13 LEU A1001 -6.303 5.665 -2.690 1.00 0.00 H new ATOM 0 HD21 LEU A1001 -4.250 7.961 -2.682 1.00 0.00 H new ATOM 0 HD22 LEU A1001 -4.987 7.291 -1.208 1.00 0.00 H new ATOM 0 HD23 LEU A1001 -3.216 7.349 -1.370 1.00 0.00 H new ATOM 1357 N GLY A1002 -2.560 4.903 1.507 1.00 0.00 N ATOM 1358 CA GLY A1002 -2.636 4.511 2.903 1.00 0.00 C ATOM 1359 C GLY A1002 -3.866 3.677 3.204 1.00 0.00 C ATOM 1360 O GLY A1002 -4.800 3.625 2.404 1.00 0.00 O ATOM 0 H GLY A1002 -2.368 5.892 1.350 1.00 0.00 H new ATOM 0 HA2 GLY A1002 -1.743 3.945 3.167 1.00 0.00 H new ATOM 0 HA3 GLY A1002 -2.644 5.404 3.528 1.00 0.00 H new ATOM 1364 N SER A1003 -3.867 3.023 4.361 1.00 0.00 N ATOM 1365 CA SER A1003 -4.989 2.183 4.763 1.00 0.00 C ATOM 1366 C SER A1003 -6.309 2.769 4.273 1.00 0.00 C ATOM 1367 O SER A1003 -6.450 3.984 4.138 1.00 0.00 O ATOM 1368 CB SER A1003 -5.019 2.031 6.285 1.00 0.00 C ATOM 1369 OG SER A1003 -5.178 3.288 6.920 1.00 0.00 O ATOM 0 H SER A1003 -3.104 3.059 5.036 1.00 0.00 H new ATOM 0 HA SER A1003 -4.857 1.201 4.309 1.00 0.00 H new ATOM 0 HB2 SER A1003 -5.836 1.369 6.571 1.00 0.00 H new ATOM 0 HB3 SER A1003 -4.095 1.562 6.625 1.00 0.00 H new ATOM 0 HG SER A1003 -5.037 3.187 7.885 1.00 0.00 H new ATOM 1375 N GLY A1004 -7.275 1.895 4.007 1.00 0.00 N ATOM 1376 CA GLY A1004 -8.572 2.343 3.535 1.00 0.00 C ATOM 1377 C GLY A1004 -9.705 1.465 4.028 1.00 0.00 C ATOM 1378 O GLY A1004 -9.554 0.695 4.977 1.00 0.00 O ATOM 0 H GLY A1004 -7.182 0.884 4.110 1.00 0.00 H new ATOM 0 HA2 GLY A1004 -8.741 3.368 3.865 1.00 0.00 H new ATOM 0 HA3 GLY A1004 -8.574 2.355 2.445 1.00 0.00 H new ATOM 1382 N PRO A1005 -10.872 1.575 3.376 1.00 0.00 N ATOM 1383 CA PRO A1005 -11.063 2.488 2.245 1.00 0.00 C ATOM 1384 C PRO A1005 -11.052 3.952 2.674 1.00 0.00 C ATOM 1385 O PRO A1005 -10.364 4.778 2.074 1.00 0.00 O ATOM 1386 CB PRO A1005 -12.442 2.100 1.705 1.00 0.00 C ATOM 1387 CG PRO A1005 -13.151 1.503 2.872 1.00 0.00 C ATOM 1388 CD PRO A1005 -12.094 0.818 3.692 1.00 0.00 C ATOM 0 HA PRO A1005 -10.262 2.400 1.511 1.00 0.00 H new ATOM 0 HB2 PRO A1005 -12.975 2.969 1.320 1.00 0.00 H new ATOM 0 HB3 PRO A1005 -12.360 1.387 0.885 1.00 0.00 H new ATOM 0 HG2 PRO A1005 -13.660 2.271 3.454 1.00 0.00 H new ATOM 0 HG3 PRO A1005 -13.912 0.794 2.545 1.00 0.00 H new ATOM 0 HD2 PRO A1005 -12.325 0.855 4.757 1.00 0.00 H new ATOM 0 HD3 PRO A1005 -11.996 -0.234 3.423 1.00 0.00 H new ATOM 1396 N SER A1006 -11.817 4.265 3.715 1.00 0.00 N ATOM 1397 CA SER A1006 -11.897 5.630 4.221 1.00 0.00 C ATOM 1398 C SER A1006 -11.945 5.642 5.746 1.00 0.00 C ATOM 1399 O SER A1006 -12.375 4.672 6.372 1.00 0.00 O ATOM 1400 CB SER A1006 -13.131 6.335 3.655 1.00 0.00 C ATOM 1401 OG SER A1006 -12.867 6.870 2.369 1.00 0.00 O ATOM 0 H SER A1006 -12.390 3.592 4.224 1.00 0.00 H new ATOM 0 HA SER A1006 -11.003 6.164 3.899 1.00 0.00 H new ATOM 0 HB2 SER A1006 -13.961 5.631 3.596 1.00 0.00 H new ATOM 0 HB3 SER A1006 -13.438 7.135 4.329 1.00 0.00 H new ATOM 0 HG SER A1006 -12.096 6.410 1.975 1.00 0.00 H new ATOM 1407 N SER A1007 -11.502 6.746 6.338 1.00 0.00 N ATOM 1408 CA SER A1007 -11.490 6.884 7.789 1.00 0.00 C ATOM 1409 C SER A1007 -12.912 6.944 8.340 1.00 0.00 C ATOM 1410 O SER A1007 -13.788 7.585 7.761 1.00 0.00 O ATOM 1411 CB SER A1007 -10.720 8.141 8.197 1.00 0.00 C ATOM 1412 OG SER A1007 -11.301 9.302 7.631 1.00 0.00 O ATOM 0 H SER A1007 -11.146 7.559 5.834 1.00 0.00 H new ATOM 0 HA SER A1007 -10.992 6.010 8.208 1.00 0.00 H new ATOM 0 HB2 SER A1007 -10.710 8.228 9.283 1.00 0.00 H new ATOM 0 HB3 SER A1007 -9.682 8.056 7.875 1.00 0.00 H new ATOM 0 HG SER A1007 -10.791 10.092 7.909 1.00 0.00 H new ATOM 1418 N GLY A1008 -13.133 6.269 9.464 1.00 0.00 N ATOM 1419 CA GLY A1008 -14.449 6.258 10.076 1.00 0.00 C ATOM 1420 C GLY A1008 -15.346 5.178 9.502 1.00 0.00 C ATOM 1421 O GLY A1008 -16.427 4.916 10.028 1.00 0.00 O ATOM 0 H GLY A1008 -12.424 5.730 9.962 1.00 0.00 H new ATOM 0 HA2 GLY A1008 -14.345 6.107 11.151 1.00 0.00 H new ATOM 0 HA3 GLY A1008 -14.920 7.231 9.935 1.00 0.00 H new TER 1425 GLY A1008