USER MOD reduce.3.24.130724 H: found=0, std=0, add=710, rem=0, adj=30 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 Set 1.1: A 988 ASN : amide:sc= 0 X(o=0,f=0.055) USER MOD Set 1.2: A 998 LYS NZ :NH3+ 171:sc= 0 (180deg=0) 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 180:sc= 0 USER MOD Single : A 922 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0593) USER MOD Single : A 926 THR OG1 : rot 180:sc= 0 USER MOD Single : A 929 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0225) USER MOD Single : A 931 GLN :FLIP amide:sc= -1.5! C(o=-2.9!,f=-1.5!) USER MOD Single : A 932 ASN : amide:sc= -0.399 X(o=-0.4,f=-0.23) USER MOD Single : A 933 MET CE :methyl -171:sc= -3.01! (180deg=-3.03) USER MOD Single : A 936 THR OG1 : rot 180:sc= 0 USER MOD Single : A 938 SER OG : rot 15:sc= 0.37 USER MOD Single : A 947 TYR OH : rot 180:sc= 0 USER MOD Single : A 949 TYR OH : rot 180:sc=-0.00932 USER MOD Single : A 950 GLN : amide:sc= -0.0516 X(o=-0.052,f=-0.051) USER MOD Single : A 955 SER OG : rot -91:sc= 0.636 USER MOD Single : A 957 CYS SG : rot 68:sc= 0.557 USER MOD Single : A 959 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00277) USER MOD Single : A 960 TYR OH : rot 180:sc= 0 USER MOD Single : A 961 ASN :FLIP amide:sc= -5.89! C(o=-6.6!,f=-5.9!) 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 -25:sc= -0.0523! USER MOD Single : A 971 MET CE :methyl -166:sc= 0 (180deg=-0.176) USER MOD Single : A 976 SER OG : rot 180:sc= 0 USER MOD Single : A 981 THR OG1 : rot 79:sc= 0.111 USER MOD Single : A 994 SER OG : rot 3:sc= 0.797! USER MOD Single : A 996 LYS NZ :NH3+ -166:sc= -0.0261 (180deg=-0.226) USER MOD Single : A1003 SER OG : rot 180:sc= 0 USER MOD Single : A1006 SER OG : rot 180:sc= 0 USER MOD Single : A1007 SER OG : rot 31:sc= 0.736 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 911 12.017 -9.279 -3.464 1.00 0.00 N ATOM 2 CA GLY A 911 11.311 -8.901 -2.254 1.00 0.00 C ATOM 3 C GLY A 911 10.205 -9.876 -1.900 1.00 0.00 C ATOM 4 O GLY A 911 9.028 -9.601 -2.135 1.00 0.00 O ATOM 0 HA2 GLY A 911 12.019 -8.843 -1.427 1.00 0.00 H new ATOM 0 HA3 GLY A 911 10.887 -7.905 -2.381 1.00 0.00 H new ATOM 8 N SER A 912 10.583 -11.018 -1.335 1.00 0.00 N ATOM 9 CA SER A 912 9.614 -12.039 -0.953 1.00 0.00 C ATOM 10 C SER A 912 8.912 -11.663 0.348 1.00 0.00 C ATOM 11 O SER A 912 7.684 -11.682 0.432 1.00 0.00 O ATOM 12 CB SER A 912 10.305 -13.395 -0.800 1.00 0.00 C ATOM 13 OG SER A 912 9.391 -14.387 -0.367 1.00 0.00 O ATOM 0 H SER A 912 11.553 -11.260 -1.132 1.00 0.00 H new ATOM 0 HA SER A 912 8.865 -12.108 -1.742 1.00 0.00 H new ATOM 0 HB2 SER A 912 10.745 -13.692 -1.752 1.00 0.00 H new ATOM 0 HB3 SER A 912 11.122 -13.311 -0.084 1.00 0.00 H new ATOM 0 HG SER A 912 9.857 -15.245 -0.278 1.00 0.00 H new ATOM 19 N SER A 913 9.702 -11.321 1.361 1.00 0.00 N ATOM 20 CA SER A 913 9.158 -10.944 2.660 1.00 0.00 C ATOM 21 C SER A 913 8.561 -9.540 2.613 1.00 0.00 C ATOM 22 O SER A 913 9.085 -8.654 1.939 1.00 0.00 O ATOM 23 CB SER A 913 10.247 -11.011 3.732 1.00 0.00 C ATOM 24 OG SER A 913 9.698 -11.329 4.999 1.00 0.00 O ATOM 0 H SER A 913 10.720 -11.297 1.307 1.00 0.00 H new ATOM 0 HA SER A 913 8.366 -11.649 2.912 1.00 0.00 H new ATOM 0 HB2 SER A 913 10.988 -11.761 3.455 1.00 0.00 H new ATOM 0 HB3 SER A 913 10.766 -10.054 3.787 1.00 0.00 H new ATOM 0 HG SER A 913 10.415 -11.367 5.666 1.00 0.00 H new ATOM 30 N GLY A 914 7.461 -9.346 3.334 1.00 0.00 N ATOM 31 CA GLY A 914 6.811 -8.049 3.362 1.00 0.00 C ATOM 32 C GLY A 914 5.306 -8.152 3.208 1.00 0.00 C ATOM 33 O GLY A 914 4.743 -7.684 2.219 1.00 0.00 O ATOM 0 H GLY A 914 7.008 -10.064 3.899 1.00 0.00 H new ATOM 0 HA2 GLY A 914 7.044 -7.549 4.302 1.00 0.00 H new ATOM 0 HA3 GLY A 914 7.213 -7.427 2.563 1.00 0.00 H new ATOM 37 N SER A 915 4.654 -8.768 4.189 1.00 0.00 N ATOM 38 CA SER A 915 3.205 -8.936 4.155 1.00 0.00 C ATOM 39 C SER A 915 2.515 -7.626 3.788 1.00 0.00 C ATOM 40 O SER A 915 2.602 -6.639 4.519 1.00 0.00 O ATOM 41 CB SER A 915 2.697 -9.430 5.511 1.00 0.00 C ATOM 42 OG SER A 915 3.116 -10.761 5.758 1.00 0.00 O ATOM 0 H SER A 915 5.105 -9.159 5.016 1.00 0.00 H new ATOM 0 HA SER A 915 2.967 -9.678 3.393 1.00 0.00 H new ATOM 0 HB2 SER A 915 3.066 -8.776 6.301 1.00 0.00 H new ATOM 0 HB3 SER A 915 1.609 -9.377 5.536 1.00 0.00 H new ATOM 0 HG SER A 915 2.780 -11.053 6.631 1.00 0.00 H new ATOM 48 N SER A 916 1.829 -7.625 2.649 1.00 0.00 N ATOM 49 CA SER A 916 1.127 -6.436 2.181 1.00 0.00 C ATOM 50 C SER A 916 0.052 -6.013 3.177 1.00 0.00 C ATOM 51 O SER A 916 -0.360 -6.795 4.033 1.00 0.00 O ATOM 52 CB SER A 916 0.495 -6.697 0.812 1.00 0.00 C ATOM 53 OG SER A 916 1.456 -7.186 -0.108 1.00 0.00 O ATOM 0 H SER A 916 1.745 -8.434 2.034 1.00 0.00 H new ATOM 0 HA SER A 916 1.853 -5.628 2.090 1.00 0.00 H new ATOM 0 HB2 SER A 916 -0.316 -7.418 0.914 1.00 0.00 H new ATOM 0 HB3 SER A 916 0.056 -5.776 0.429 1.00 0.00 H new ATOM 0 HG SER A 916 1.027 -7.347 -0.974 1.00 0.00 H new ATOM 59 N GLY A 917 -0.399 -4.767 3.059 1.00 0.00 N ATOM 60 CA GLY A 917 -1.422 -4.260 3.955 1.00 0.00 C ATOM 61 C GLY A 917 -0.850 -3.380 5.048 1.00 0.00 C ATOM 62 O GLY A 917 -0.712 -3.811 6.192 1.00 0.00 O ATOM 0 H GLY A 917 -0.074 -4.100 2.359 1.00 0.00 H new ATOM 0 HA2 GLY A 917 -2.154 -3.692 3.381 1.00 0.00 H new ATOM 0 HA3 GLY A 917 -1.952 -5.098 4.408 1.00 0.00 H new ATOM 66 N ALA A 918 -0.516 -2.143 4.695 1.00 0.00 N ATOM 67 CA ALA A 918 0.044 -1.199 5.655 1.00 0.00 C ATOM 68 C ALA A 918 -1.050 -0.345 6.286 1.00 0.00 C ATOM 69 O ALA A 918 -1.260 0.802 5.891 1.00 0.00 O ATOM 70 CB ALA A 918 1.084 -0.317 4.982 1.00 0.00 C ATOM 0 H ALA A 918 -0.623 -1.771 3.751 1.00 0.00 H new ATOM 0 HA ALA A 918 0.527 -1.769 6.449 1.00 0.00 H new ATOM 0 HB1 ALA A 918 1.494 0.383 5.710 1.00 0.00 H new ATOM 0 HB2 ALA A 918 1.886 -0.939 4.585 1.00 0.00 H new ATOM 0 HB3 ALA A 918 0.618 0.238 4.168 1.00 0.00 H new ATOM 76 N SER A 919 -1.744 -0.910 7.269 1.00 0.00 N ATOM 77 CA SER A 919 -2.820 -0.201 7.951 1.00 0.00 C ATOM 78 C SER A 919 -2.298 0.508 9.197 1.00 0.00 C ATOM 79 O SER A 919 -1.461 -0.026 9.924 1.00 0.00 O ATOM 80 CB SER A 919 -3.937 -1.173 8.335 1.00 0.00 C ATOM 81 OG SER A 919 -5.162 -0.489 8.535 1.00 0.00 O ATOM 0 H SER A 919 -1.580 -1.857 7.611 1.00 0.00 H new ATOM 0 HA SER A 919 -3.219 0.548 7.267 1.00 0.00 H new ATOM 0 HB2 SER A 919 -4.058 -1.921 7.551 1.00 0.00 H new ATOM 0 HB3 SER A 919 -3.662 -1.707 9.245 1.00 0.00 H new ATOM 0 HG SER A 919 -5.860 -1.132 8.778 1.00 0.00 H new ATOM 87 N SER A 920 -2.798 1.716 9.436 1.00 0.00 N ATOM 88 CA SER A 920 -2.380 2.502 10.591 1.00 0.00 C ATOM 89 C SER A 920 -3.497 2.580 11.628 1.00 0.00 C ATOM 90 O SER A 920 -3.364 2.071 12.740 1.00 0.00 O ATOM 91 CB SER A 920 -1.974 3.911 10.156 1.00 0.00 C ATOM 92 OG SER A 920 -1.358 4.616 11.220 1.00 0.00 O ATOM 0 H SER A 920 -3.493 2.172 8.845 1.00 0.00 H new ATOM 0 HA SER A 920 -1.521 2.008 11.044 1.00 0.00 H new ATOM 0 HB2 SER A 920 -1.288 3.851 9.311 1.00 0.00 H new ATOM 0 HB3 SER A 920 -2.853 4.457 9.815 1.00 0.00 H new ATOM 0 HG SER A 920 -1.106 5.513 10.916 1.00 0.00 H new ATOM 98 N GLY A 921 -4.600 3.222 11.254 1.00 0.00 N ATOM 99 CA GLY A 921 -5.724 3.356 12.162 1.00 0.00 C ATOM 100 C GLY A 921 -5.944 4.789 12.605 1.00 0.00 C ATOM 101 O GLY A 921 -7.065 5.296 12.559 1.00 0.00 O ATOM 0 H GLY A 921 -4.735 3.651 10.339 1.00 0.00 H new ATOM 0 HA2 GLY A 921 -6.627 2.987 11.675 1.00 0.00 H new ATOM 0 HA3 GLY A 921 -5.556 2.730 13.038 1.00 0.00 H new ATOM 105 N LYS A 922 -4.872 5.444 13.037 1.00 0.00 N ATOM 106 CA LYS A 922 -4.952 6.827 13.492 1.00 0.00 C ATOM 107 C LYS A 922 -5.329 7.757 12.342 1.00 0.00 C ATOM 108 O LYS A 922 -4.917 7.566 11.198 1.00 0.00 O ATOM 109 CB LYS A 922 -3.616 7.264 14.098 1.00 0.00 C ATOM 110 CG LYS A 922 -3.428 6.820 15.538 1.00 0.00 C ATOM 111 CD LYS A 922 -2.385 7.664 16.250 1.00 0.00 C ATOM 112 CE LYS A 922 -1.690 6.880 17.353 1.00 0.00 C ATOM 113 NZ LYS A 922 -0.719 5.893 16.804 1.00 0.00 N ATOM 0 H LYS A 922 -3.937 5.039 13.082 1.00 0.00 H new ATOM 0 HA LYS A 922 -5.728 6.888 14.255 1.00 0.00 H new ATOM 0 HB2 LYS A 922 -2.803 6.862 13.493 1.00 0.00 H new ATOM 0 HB3 LYS A 922 -3.542 8.350 14.049 1.00 0.00 H new ATOM 0 HG2 LYS A 922 -4.378 6.890 16.068 1.00 0.00 H new ATOM 0 HG3 LYS A 922 -3.127 5.773 15.560 1.00 0.00 H new ATOM 0 HD2 LYS A 922 -1.645 8.014 15.530 1.00 0.00 H new ATOM 0 HD3 LYS A 922 -2.860 8.549 16.675 1.00 0.00 H new ATOM 0 HE2 LYS A 922 -1.170 7.570 18.017 1.00 0.00 H new ATOM 0 HE3 LYS A 922 -2.436 6.360 17.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 922 -0.124 5.526 17.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 922 -1.236 5.107 16.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 922 -0.118 6.356 16.093 1.00 0.00 H new ATOM 127 N PRO A 923 -6.129 8.788 12.652 1.00 0.00 N ATOM 128 CA PRO A 923 -6.577 9.768 11.659 1.00 0.00 C ATOM 129 C PRO A 923 -5.442 10.666 11.178 1.00 0.00 C ATOM 130 O PRO A 923 -4.278 10.441 11.506 1.00 0.00 O ATOM 131 CB PRO A 923 -7.623 10.589 12.417 1.00 0.00 C ATOM 132 CG PRO A 923 -7.244 10.453 13.851 1.00 0.00 C ATOM 133 CD PRO A 923 -6.657 9.076 13.996 1.00 0.00 C ATOM 0 HA PRO A 923 -6.962 9.289 10.759 1.00 0.00 H new ATOM 0 HB2 PRO A 923 -7.612 11.632 12.102 1.00 0.00 H new ATOM 0 HB3 PRO A 923 -8.630 10.212 12.236 1.00 0.00 H new ATOM 0 HG2 PRO A 923 -6.522 11.217 14.138 1.00 0.00 H new ATOM 0 HG3 PRO A 923 -8.113 10.577 14.498 1.00 0.00 H new ATOM 0 HD2 PRO A 923 -5.871 9.052 14.751 1.00 0.00 H new ATOM 0 HD3 PRO A 923 -7.410 8.348 14.297 1.00 0.00 H new ATOM 141 N GLY A 924 -5.789 11.686 10.398 1.00 0.00 N ATOM 142 CA GLY A 924 -4.788 12.602 9.885 1.00 0.00 C ATOM 143 C GLY A 924 -4.677 12.554 8.374 1.00 0.00 C ATOM 144 O GLY A 924 -5.611 12.160 7.674 1.00 0.00 O ATOM 0 H GLY A 924 -6.746 11.894 10.113 1.00 0.00 H new ATOM 0 HA2 GLY A 924 -5.036 13.617 10.196 1.00 0.00 H new ATOM 0 HA3 GLY A 924 -3.820 12.361 10.325 1.00 0.00 H new ATOM 148 N PRO A 925 -3.513 12.963 7.849 1.00 0.00 N ATOM 149 CA PRO A 925 -3.257 12.975 6.405 1.00 0.00 C ATOM 150 C PRO A 925 -3.136 11.569 5.826 1.00 0.00 C ATOM 151 O PRO A 925 -3.084 10.585 6.564 1.00 0.00 O ATOM 152 CB PRO A 925 -1.923 13.718 6.288 1.00 0.00 C ATOM 153 CG PRO A 925 -1.255 13.505 7.602 1.00 0.00 C ATOM 154 CD PRO A 925 -2.357 13.445 8.623 1.00 0.00 C ATOM 0 HA PRO A 925 -4.071 13.442 5.850 1.00 0.00 H new ATOM 0 HB2 PRO A 925 -1.321 13.324 5.469 1.00 0.00 H new ATOM 0 HB3 PRO A 925 -2.077 14.779 6.089 1.00 0.00 H new ATOM 0 HG2 PRO A 925 -0.675 12.582 7.600 1.00 0.00 H new ATOM 0 HG3 PRO A 925 -0.562 14.317 7.823 1.00 0.00 H new ATOM 0 HD2 PRO A 925 -2.111 12.768 9.441 1.00 0.00 H new ATOM 0 HD3 PRO A 925 -2.549 14.423 9.065 1.00 0.00 H new ATOM 162 N THR A 926 -3.093 11.482 4.500 1.00 0.00 N ATOM 163 CA THR A 926 -2.979 10.197 3.822 1.00 0.00 C ATOM 164 C THR A 926 -1.521 9.845 3.553 1.00 0.00 C ATOM 165 O THR A 926 -0.819 10.565 2.842 1.00 0.00 O ATOM 166 CB THR A 926 -3.750 10.196 2.489 1.00 0.00 C ATOM 167 OG1 THR A 926 -5.137 10.461 2.725 1.00 0.00 O ATOM 168 CG2 THR A 926 -3.598 8.860 1.777 1.00 0.00 C ATOM 0 H THR A 926 -3.135 12.287 3.874 1.00 0.00 H new ATOM 0 HA THR A 926 -3.414 9.449 4.486 1.00 0.00 H new ATOM 0 HB THR A 926 -3.334 10.978 1.854 1.00 0.00 H new ATOM 0 HG1 THR A 926 -5.620 10.460 1.872 1.00 0.00 H new ATOM 0 HG21 THR A 926 -4.151 8.883 0.838 1.00 0.00 H new ATOM 0 HG22 THR A 926 -2.544 8.675 1.572 1.00 0.00 H new ATOM 0 HG23 THR A 926 -3.990 8.064 2.410 1.00 0.00 H new ATOM 176 N ILE A 927 -1.070 8.733 4.125 1.00 0.00 N ATOM 177 CA ILE A 927 0.305 8.285 3.945 1.00 0.00 C ATOM 178 C ILE A 927 0.425 7.349 2.747 1.00 0.00 C ATOM 179 O ILE A 927 -0.335 6.389 2.618 1.00 0.00 O ATOM 180 CB ILE A 927 0.831 7.564 5.200 1.00 0.00 C ATOM 181 CG1 ILE A 927 0.719 8.476 6.423 1.00 0.00 C ATOM 182 CG2 ILE A 927 2.272 7.122 4.992 1.00 0.00 C ATOM 183 CD1 ILE A 927 1.858 9.464 6.546 1.00 0.00 C ATOM 0 H ILE A 927 -1.637 8.126 4.717 1.00 0.00 H new ATOM 0 HA ILE A 927 0.907 9.176 3.769 1.00 0.00 H new ATOM 0 HB ILE A 927 0.221 6.677 5.374 1.00 0.00 H new ATOM 0 HG12 ILE A 927 -0.222 9.023 6.373 1.00 0.00 H new ATOM 0 HG13 ILE A 927 0.683 7.861 7.322 1.00 0.00 H new ATOM 0 HG21 ILE A 927 2.630 6.614 5.888 1.00 0.00 H new ATOM 0 HG22 ILE A 927 2.325 6.441 4.143 1.00 0.00 H new ATOM 0 HG23 ILE A 927 2.896 7.994 4.796 1.00 0.00 H new ATOM 0 HD11 ILE A 927 1.713 10.078 7.435 1.00 0.00 H new ATOM 0 HD12 ILE A 927 2.801 8.924 6.628 1.00 0.00 H new ATOM 0 HD13 ILE A 927 1.882 10.104 5.664 1.00 0.00 H new ATOM 195 N ILE A 928 1.386 7.635 1.875 1.00 0.00 N ATOM 196 CA ILE A 928 1.608 6.817 0.689 1.00 0.00 C ATOM 197 C ILE A 928 2.846 5.940 0.849 1.00 0.00 C ATOM 198 O ILE A 928 3.808 6.321 1.516 1.00 0.00 O ATOM 199 CB ILE A 928 1.768 7.686 -0.573 1.00 0.00 C ATOM 200 CG1 ILE A 928 0.444 8.371 -0.918 1.00 0.00 C ATOM 201 CG2 ILE A 928 2.253 6.840 -1.741 1.00 0.00 C ATOM 202 CD1 ILE A 928 0.573 9.430 -1.990 1.00 0.00 C ATOM 0 H ILE A 928 2.023 8.426 1.967 1.00 0.00 H new ATOM 0 HA ILE A 928 0.729 6.183 0.575 1.00 0.00 H new ATOM 0 HB ILE A 928 2.513 8.456 -0.374 1.00 0.00 H new ATOM 0 HG12 ILE A 928 -0.271 7.617 -1.248 1.00 0.00 H new ATOM 0 HG13 ILE A 928 0.034 8.826 -0.016 1.00 0.00 H new ATOM 0 HG21 ILE A 928 2.361 7.468 -2.625 1.00 0.00 H new ATOM 0 HG22 ILE A 928 3.216 6.395 -1.492 1.00 0.00 H new ATOM 0 HG23 ILE A 928 1.530 6.050 -1.943 1.00 0.00 H new ATOM 0 HD11 ILE A 928 -0.404 9.873 -2.183 1.00 0.00 H new ATOM 0 HD12 ILE A 928 1.263 10.205 -1.655 1.00 0.00 H new ATOM 0 HD13 ILE A 928 0.953 8.977 -2.905 1.00 0.00 H new ATOM 214 N LYS A 929 2.815 4.765 0.231 1.00 0.00 N ATOM 215 CA LYS A 929 3.935 3.834 0.301 1.00 0.00 C ATOM 216 C LYS A 929 4.603 3.682 -1.062 1.00 0.00 C ATOM 217 O LYS A 929 3.940 3.411 -2.063 1.00 0.00 O ATOM 218 CB LYS A 929 3.459 2.468 0.802 1.00 0.00 C ATOM 219 CG LYS A 929 4.449 1.346 0.541 1.00 0.00 C ATOM 220 CD LYS A 929 4.276 0.208 1.533 1.00 0.00 C ATOM 221 CE LYS A 929 3.194 -0.762 1.086 1.00 0.00 C ATOM 222 NZ LYS A 929 3.152 -1.980 1.942 1.00 0.00 N ATOM 0 H LYS A 929 2.026 4.434 -0.324 1.00 0.00 H new ATOM 0 HA LYS A 929 4.666 4.237 1.002 1.00 0.00 H new ATOM 0 HB2 LYS A 929 3.267 2.530 1.873 1.00 0.00 H new ATOM 0 HB3 LYS A 929 2.511 2.224 0.322 1.00 0.00 H new ATOM 0 HG2 LYS A 929 4.315 0.970 -0.473 1.00 0.00 H new ATOM 0 HG3 LYS A 929 5.466 1.734 0.605 1.00 0.00 H new ATOM 0 HD2 LYS A 929 5.220 -0.325 1.645 1.00 0.00 H new ATOM 0 HD3 LYS A 929 4.021 0.613 2.512 1.00 0.00 H new ATOM 0 HE2 LYS A 929 2.225 -0.264 1.116 1.00 0.00 H new ATOM 0 HE3 LYS A 929 3.372 -1.052 0.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 929 2.329 -2.559 1.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 929 4.022 -2.532 1.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 929 3.076 -1.700 2.941 1.00 0.00 H new ATOM 236 N VAL A 930 5.921 3.858 -1.093 1.00 0.00 N ATOM 237 CA VAL A 930 6.679 3.739 -2.333 1.00 0.00 C ATOM 238 C VAL A 930 7.568 2.501 -2.315 1.00 0.00 C ATOM 239 O VAL A 930 8.380 2.321 -1.408 1.00 0.00 O ATOM 240 CB VAL A 930 7.554 4.983 -2.578 1.00 0.00 C ATOM 241 CG1 VAL A 930 8.304 4.857 -3.895 1.00 0.00 C ATOM 242 CG2 VAL A 930 6.703 6.244 -2.557 1.00 0.00 C ATOM 0 H VAL A 930 6.485 4.083 -0.274 1.00 0.00 H new ATOM 0 HA VAL A 930 5.953 3.651 -3.141 1.00 0.00 H new ATOM 0 HB VAL A 930 8.288 5.054 -1.776 1.00 0.00 H new ATOM 0 HG11 VAL A 930 8.917 5.745 -4.051 1.00 0.00 H new ATOM 0 HG12 VAL A 930 8.944 3.975 -3.866 1.00 0.00 H new ATOM 0 HG13 VAL A 930 7.590 4.761 -4.713 1.00 0.00 H new ATOM 0 HG21 VAL A 930 7.337 7.114 -2.732 1.00 0.00 H new ATOM 0 HG22 VAL A 930 5.945 6.185 -3.338 1.00 0.00 H new ATOM 0 HG23 VAL A 930 6.217 6.339 -1.586 1.00 0.00 H new ATOM 252 N GLN A 931 7.409 1.650 -3.325 1.00 0.00 N ATOM 253 CA GLN A 931 8.198 0.428 -3.425 1.00 0.00 C ATOM 254 C GLN A 931 8.857 0.317 -4.796 1.00 0.00 C ATOM 255 O GLN A 931 8.508 1.045 -5.724 1.00 0.00 O ATOM 256 CB GLN A 931 7.317 -0.795 -3.168 1.00 0.00 C ATOM 257 CG GLN A 931 7.996 -1.870 -2.335 1.00 0.00 C ATOM 258 CD GLN A 931 8.863 -2.794 -3.167 1.00 0.00 C ATOM 259 OE1 GLN A 931 10.163 -2.793 -2.895 1.00 0.00 O flip ATOM 260 NE2 GLN A 931 8.370 -3.502 -4.046 1.00 0.00 N flip ATOM 0 H GLN A 931 6.742 1.785 -4.084 1.00 0.00 H new ATOM 0 HA GLN A 931 8.981 0.467 -2.668 1.00 0.00 H new ATOM 0 HB2 GLN A 931 6.406 -0.476 -2.662 1.00 0.00 H new ATOM 0 HB3 GLN A 931 7.017 -1.224 -4.124 1.00 0.00 H new ATOM 0 HG2 GLN A 931 8.609 -1.397 -1.568 1.00 0.00 H new ATOM 0 HG3 GLN A 931 7.237 -2.458 -1.819 1.00 0.00 H new ATOM 0 HE21 GLN A 931 7.366 -3.472 -4.222 1.00 0.00 H new ATOM 0 HE22 GLN A 931 8.966 -4.119 -4.598 1.00 0.00 H new ATOM 269 N ASN A 932 9.813 -0.599 -4.915 1.00 0.00 N ATOM 270 CA ASN A 932 10.522 -0.805 -6.173 1.00 0.00 C ATOM 271 C ASN A 932 11.382 0.408 -6.518 1.00 0.00 C ATOM 272 O ASN A 932 11.292 0.952 -7.618 1.00 0.00 O ATOM 273 CB ASN A 932 9.528 -1.077 -7.304 1.00 0.00 C ATOM 274 CG ASN A 932 10.124 -1.937 -8.402 1.00 0.00 C ATOM 275 OD1 ASN A 932 9.576 -2.982 -8.754 1.00 0.00 O ATOM 276 ND2 ASN A 932 11.252 -1.499 -8.950 1.00 0.00 N ATOM 0 H ASN A 932 10.114 -1.210 -4.156 1.00 0.00 H new ATOM 0 HA ASN A 932 11.175 -1.670 -6.056 1.00 0.00 H new ATOM 0 HB2 ASN A 932 8.646 -1.571 -6.898 1.00 0.00 H new ATOM 0 HB3 ASN A 932 9.196 -0.129 -7.728 1.00 0.00 H new ATOM 0 HD21 ASN A 932 11.699 -2.035 -9.694 1.00 0.00 H new ATOM 0 HD22 ASN A 932 11.671 -0.627 -8.627 1.00 0.00 H new ATOM 283 N MET A 933 12.214 0.825 -5.569 1.00 0.00 N ATOM 284 CA MET A 933 13.091 1.972 -5.773 1.00 0.00 C ATOM 285 C MET A 933 14.557 1.550 -5.732 1.00 0.00 C ATOM 286 O MET A 933 15.024 0.936 -4.772 1.00 0.00 O ATOM 287 CB MET A 933 12.826 3.040 -4.711 1.00 0.00 C ATOM 288 CG MET A 933 11.762 4.048 -5.115 1.00 0.00 C ATOM 289 SD MET A 933 11.693 5.467 -4.005 1.00 0.00 S ATOM 290 CE MET A 933 12.354 4.753 -2.501 1.00 0.00 C ATOM 0 H MET A 933 12.299 0.386 -4.652 1.00 0.00 H new ATOM 0 HA MET A 933 12.878 2.389 -6.757 1.00 0.00 H new ATOM 0 HB2 MET A 933 12.520 2.552 -3.785 1.00 0.00 H new ATOM 0 HB3 MET A 933 13.755 3.570 -4.500 1.00 0.00 H new ATOM 0 HG2 MET A 933 11.961 4.394 -6.129 1.00 0.00 H new ATOM 0 HG3 MET A 933 10.789 3.557 -5.131 1.00 0.00 H new ATOM 0 HE1 MET A 933 12.228 5.457 -1.678 1.00 0.00 H new ATOM 0 HE2 MET A 933 11.823 3.829 -2.273 1.00 0.00 H new ATOM 0 HE3 MET A 933 13.414 4.538 -2.636 1.00 0.00 H new ATOM 300 N PRO A 934 15.301 1.885 -6.796 1.00 0.00 N ATOM 301 CA PRO A 934 16.724 1.550 -6.904 1.00 0.00 C ATOM 302 C PRO A 934 17.582 2.349 -5.930 1.00 0.00 C ATOM 303 O PRO A 934 17.115 3.310 -5.319 1.00 0.00 O ATOM 304 CB PRO A 934 17.067 1.923 -8.349 1.00 0.00 C ATOM 305 CG PRO A 934 16.070 2.966 -8.718 1.00 0.00 C ATOM 306 CD PRO A 934 14.810 2.616 -7.976 1.00 0.00 C ATOM 0 HA PRO A 934 16.917 0.505 -6.662 1.00 0.00 H new ATOM 0 HB2 PRO A 934 18.085 2.303 -8.429 1.00 0.00 H new ATOM 0 HB3 PRO A 934 16.997 1.058 -9.008 1.00 0.00 H new ATOM 0 HG2 PRO A 934 16.423 3.959 -8.440 1.00 0.00 H new ATOM 0 HG3 PRO A 934 15.898 2.978 -9.794 1.00 0.00 H new ATOM 0 HD2 PRO A 934 14.250 3.507 -7.692 1.00 0.00 H new ATOM 0 HD3 PRO A 934 14.145 2.001 -8.582 1.00 0.00 H new ATOM 314 N PHE A 935 18.841 1.946 -5.790 1.00 0.00 N ATOM 315 CA PHE A 935 19.765 2.624 -4.889 1.00 0.00 C ATOM 316 C PHE A 935 19.975 4.074 -5.315 1.00 0.00 C ATOM 317 O PHE A 935 20.054 4.975 -4.479 1.00 0.00 O ATOM 318 CB PHE A 935 21.108 1.892 -4.855 1.00 0.00 C ATOM 319 CG PHE A 935 20.976 0.396 -4.891 1.00 0.00 C ATOM 320 CD1 PHE A 935 20.291 -0.276 -3.891 1.00 0.00 C ATOM 321 CD2 PHE A 935 21.536 -0.338 -5.924 1.00 0.00 C ATOM 322 CE1 PHE A 935 20.168 -1.653 -3.922 1.00 0.00 C ATOM 323 CE2 PHE A 935 21.417 -1.715 -5.960 1.00 0.00 C ATOM 324 CZ PHE A 935 20.731 -2.373 -4.958 1.00 0.00 C ATOM 0 H PHE A 935 19.244 1.153 -6.289 1.00 0.00 H new ATOM 0 HA PHE A 935 19.329 2.616 -3.890 1.00 0.00 H new ATOM 0 HB2 PHE A 935 21.711 2.216 -5.703 1.00 0.00 H new ATOM 0 HB3 PHE A 935 21.647 2.180 -3.952 1.00 0.00 H new ATOM 0 HD1 PHE A 935 19.849 0.282 -3.079 1.00 0.00 H new ATOM 0 HD2 PHE A 935 22.072 0.172 -6.711 1.00 0.00 H new ATOM 0 HE1 PHE A 935 19.632 -2.165 -3.137 1.00 0.00 H new ATOM 0 HE2 PHE A 935 21.860 -2.275 -6.770 1.00 0.00 H new ATOM 0 HZ PHE A 935 20.635 -3.448 -4.984 1.00 0.00 H new ATOM 334 N THR A 936 20.065 4.293 -6.624 1.00 0.00 N ATOM 335 CA THR A 936 20.267 5.632 -7.163 1.00 0.00 C ATOM 336 C THR A 936 19.285 6.624 -6.552 1.00 0.00 C ATOM 337 O THR A 936 19.589 7.809 -6.412 1.00 0.00 O ATOM 338 CB THR A 936 20.112 5.650 -8.695 1.00 0.00 C ATOM 339 OG1 THR A 936 18.781 5.267 -9.057 1.00 0.00 O ATOM 340 CG2 THR A 936 21.112 4.710 -9.351 1.00 0.00 C ATOM 0 H THR A 936 20.001 3.560 -7.330 1.00 0.00 H new ATOM 0 HA THR A 936 21.284 5.927 -6.905 1.00 0.00 H new ATOM 0 HB THR A 936 20.306 6.664 -9.046 1.00 0.00 H new ATOM 0 HG1 THR A 936 18.690 5.283 -10.033 1.00 0.00 H new ATOM 0 HG21 THR A 936 20.983 4.740 -10.433 1.00 0.00 H new ATOM 0 HG22 THR A 936 22.125 5.022 -9.097 1.00 0.00 H new ATOM 0 HG23 THR A 936 20.945 3.694 -8.993 1.00 0.00 H new ATOM 348 N VAL A 937 18.104 6.134 -6.189 1.00 0.00 N ATOM 349 CA VAL A 937 17.076 6.978 -5.591 1.00 0.00 C ATOM 350 C VAL A 937 17.628 7.758 -4.403 1.00 0.00 C ATOM 351 O VAL A 937 18.475 7.261 -3.661 1.00 0.00 O ATOM 352 CB VAL A 937 15.866 6.146 -5.128 1.00 0.00 C ATOM 353 CG1 VAL A 937 14.873 7.020 -4.377 1.00 0.00 C ATOM 354 CG2 VAL A 937 15.200 5.467 -6.315 1.00 0.00 C ATOM 0 H VAL A 937 17.835 5.156 -6.299 1.00 0.00 H new ATOM 0 HA VAL A 937 16.752 7.677 -6.362 1.00 0.00 H new ATOM 0 HB VAL A 937 16.219 5.371 -4.447 1.00 0.00 H new ATOM 0 HG11 VAL A 937 14.025 6.415 -4.058 1.00 0.00 H new ATOM 0 HG12 VAL A 937 15.359 7.454 -3.503 1.00 0.00 H new ATOM 0 HG13 VAL A 937 14.523 7.818 -5.032 1.00 0.00 H new ATOM 0 HG21 VAL A 937 14.347 4.883 -5.969 1.00 0.00 H new ATOM 0 HG22 VAL A 937 14.859 6.223 -7.023 1.00 0.00 H new ATOM 0 HG23 VAL A 937 15.916 4.807 -6.805 1.00 0.00 H new ATOM 364 N SER A 938 17.142 8.982 -4.228 1.00 0.00 N ATOM 365 CA SER A 938 17.589 9.833 -3.131 1.00 0.00 C ATOM 366 C SER A 938 16.490 10.806 -2.716 1.00 0.00 C ATOM 367 O SER A 938 15.403 10.816 -3.295 1.00 0.00 O ATOM 368 CB SER A 938 18.845 10.607 -3.537 1.00 0.00 C ATOM 369 OG SER A 938 19.992 9.776 -3.494 1.00 0.00 O ATOM 0 H SER A 938 16.438 9.407 -4.832 1.00 0.00 H new ATOM 0 HA SER A 938 17.824 9.194 -2.280 1.00 0.00 H new ATOM 0 HB2 SER A 938 18.720 11.008 -4.543 1.00 0.00 H new ATOM 0 HB3 SER A 938 18.983 11.458 -2.870 1.00 0.00 H new ATOM 0 HG SER A 938 19.714 8.838 -3.441 1.00 0.00 H new ATOM 375 N ILE A 939 16.782 11.624 -1.710 1.00 0.00 N ATOM 376 CA ILE A 939 15.820 12.602 -1.218 1.00 0.00 C ATOM 377 C ILE A 939 15.518 13.658 -2.276 1.00 0.00 C ATOM 378 O ILE A 939 14.367 14.050 -2.466 1.00 0.00 O ATOM 379 CB ILE A 939 16.330 13.300 0.057 1.00 0.00 C ATOM 380 CG1 ILE A 939 16.512 12.282 1.184 1.00 0.00 C ATOM 381 CG2 ILE A 939 15.367 14.400 0.479 1.00 0.00 C ATOM 382 CD1 ILE A 939 17.433 12.758 2.285 1.00 0.00 C ATOM 0 H ILE A 939 17.677 11.629 -1.220 1.00 0.00 H new ATOM 0 HA ILE A 939 14.907 12.056 -0.983 1.00 0.00 H new ATOM 0 HB ILE A 939 17.298 13.753 -0.157 1.00 0.00 H new ATOM 0 HG12 ILE A 939 15.537 12.048 1.612 1.00 0.00 H new ATOM 0 HG13 ILE A 939 16.907 11.356 0.766 1.00 0.00 H new ATOM 0 HG21 ILE A 939 15.741 14.884 1.381 1.00 0.00 H new ATOM 0 HG22 ILE A 939 15.283 15.137 -0.320 1.00 0.00 H new ATOM 0 HG23 ILE A 939 14.386 13.968 0.678 1.00 0.00 H new ATOM 0 HD11 ILE A 939 17.515 11.986 3.050 1.00 0.00 H new ATOM 0 HD12 ILE A 939 18.420 12.965 1.870 1.00 0.00 H new ATOM 0 HD13 ILE A 939 17.029 13.667 2.730 1.00 0.00 H new ATOM 394 N ASP A 940 16.560 14.112 -2.964 1.00 0.00 N ATOM 395 CA ASP A 940 16.407 15.120 -4.006 1.00 0.00 C ATOM 396 C ASP A 940 15.543 14.594 -5.149 1.00 0.00 C ATOM 397 O ASP A 940 14.642 15.283 -5.625 1.00 0.00 O ATOM 398 CB ASP A 940 17.776 15.546 -4.539 1.00 0.00 C ATOM 399 CG ASP A 940 17.755 16.936 -5.144 1.00 0.00 C ATOM 400 OD1 ASP A 940 17.369 17.886 -4.432 1.00 0.00 O ATOM 401 OD2 ASP A 940 18.125 17.074 -6.329 1.00 0.00 O ATOM 0 H ASP A 940 17.519 13.798 -2.819 1.00 0.00 H new ATOM 0 HA ASP A 940 15.911 15.986 -3.569 1.00 0.00 H new ATOM 0 HB2 ASP A 940 18.504 15.517 -3.728 1.00 0.00 H new ATOM 0 HB3 ASP A 940 18.108 14.831 -5.291 1.00 0.00 H new ATOM 406 N GLU A 941 15.827 13.370 -5.583 1.00 0.00 N ATOM 407 CA GLU A 941 15.077 12.754 -6.671 1.00 0.00 C ATOM 408 C GLU A 941 13.618 12.544 -6.276 1.00 0.00 C ATOM 409 O GLU A 941 12.708 12.788 -7.069 1.00 0.00 O ATOM 410 CB GLU A 941 15.708 11.415 -7.061 1.00 0.00 C ATOM 411 CG GLU A 941 17.140 11.538 -7.555 1.00 0.00 C ATOM 412 CD GLU A 941 17.222 12.027 -8.988 1.00 0.00 C ATOM 413 OE1 GLU A 941 16.458 11.515 -9.833 1.00 0.00 O ATOM 414 OE2 GLU A 941 18.050 12.919 -9.265 1.00 0.00 O ATOM 0 H GLU A 941 16.570 12.786 -5.198 1.00 0.00 H new ATOM 0 HA GLU A 941 15.111 13.427 -7.528 1.00 0.00 H new ATOM 0 HB2 GLU A 941 15.686 10.748 -6.199 1.00 0.00 H new ATOM 0 HB3 GLU A 941 15.103 10.951 -7.839 1.00 0.00 H new ATOM 0 HG2 GLU A 941 17.686 12.225 -6.909 1.00 0.00 H new ATOM 0 HG3 GLU A 941 17.632 10.568 -7.477 1.00 0.00 H new ATOM 421 N ILE A 942 13.404 12.091 -5.045 1.00 0.00 N ATOM 422 CA ILE A 942 12.056 11.849 -4.545 1.00 0.00 C ATOM 423 C ILE A 942 11.235 13.134 -4.534 1.00 0.00 C ATOM 424 O ILE A 942 10.095 13.159 -4.999 1.00 0.00 O ATOM 425 CB ILE A 942 12.082 11.258 -3.123 1.00 0.00 C ATOM 426 CG1 ILE A 942 12.640 9.834 -3.149 1.00 0.00 C ATOM 427 CG2 ILE A 942 10.686 11.275 -2.517 1.00 0.00 C ATOM 428 CD1 ILE A 942 13.207 9.383 -1.821 1.00 0.00 C ATOM 0 H ILE A 942 14.146 11.884 -4.376 1.00 0.00 H new ATOM 0 HA ILE A 942 11.592 11.130 -5.221 1.00 0.00 H new ATOM 0 HB ILE A 942 12.734 11.872 -2.502 1.00 0.00 H new ATOM 0 HG12 ILE A 942 11.848 9.148 -3.449 1.00 0.00 H new ATOM 0 HG13 ILE A 942 13.420 9.772 -3.908 1.00 0.00 H new ATOM 0 HG21 ILE A 942 10.720 10.854 -1.512 1.00 0.00 H new ATOM 0 HG22 ILE A 942 10.323 12.302 -2.468 1.00 0.00 H new ATOM 0 HG23 ILE A 942 10.013 10.681 -3.136 1.00 0.00 H new ATOM 0 HD11 ILE A 942 13.584 8.365 -1.914 1.00 0.00 H new ATOM 0 HD12 ILE A 942 14.021 10.046 -1.529 1.00 0.00 H new ATOM 0 HD13 ILE A 942 12.425 9.412 -1.063 1.00 0.00 H new ATOM 440 N LEU A 943 11.822 14.201 -4.003 1.00 0.00 N ATOM 441 CA LEU A 943 11.146 15.491 -3.934 1.00 0.00 C ATOM 442 C LEU A 943 10.756 15.977 -5.326 1.00 0.00 C ATOM 443 O LEU A 943 9.660 16.499 -5.528 1.00 0.00 O ATOM 444 CB LEU A 943 12.046 16.525 -3.254 1.00 0.00 C ATOM 445 CG LEU A 943 11.933 16.614 -1.731 1.00 0.00 C ATOM 446 CD1 LEU A 943 12.927 17.626 -1.181 1.00 0.00 C ATOM 447 CD2 LEU A 943 10.515 16.981 -1.322 1.00 0.00 C ATOM 0 H LEU A 943 12.765 14.198 -3.614 1.00 0.00 H new ATOM 0 HA LEU A 943 10.237 15.366 -3.345 1.00 0.00 H new ATOM 0 HB2 LEU A 943 13.082 16.300 -3.509 1.00 0.00 H new ATOM 0 HB3 LEU A 943 11.820 17.506 -3.673 1.00 0.00 H new ATOM 0 HG LEU A 943 12.169 15.637 -1.310 1.00 0.00 H new ATOM 0 HD11 LEU A 943 12.833 17.676 -0.096 1.00 0.00 H new ATOM 0 HD12 LEU A 943 13.940 17.321 -1.443 1.00 0.00 H new ATOM 0 HD13 LEU A 943 12.722 18.607 -1.609 1.00 0.00 H new ATOM 0 HD21 LEU A 943 10.453 17.040 -0.235 1.00 0.00 H new ATOM 0 HD22 LEU A 943 10.250 17.946 -1.753 1.00 0.00 H new ATOM 0 HD23 LEU A 943 9.823 16.220 -1.684 1.00 0.00 H new ATOM 459 N ASP A 944 11.660 15.800 -6.283 1.00 0.00 N ATOM 460 CA ASP A 944 11.410 16.218 -7.658 1.00 0.00 C ATOM 461 C ASP A 944 10.384 15.306 -8.324 1.00 0.00 C ATOM 462 O ASP A 944 9.626 15.738 -9.193 1.00 0.00 O ATOM 463 CB ASP A 944 12.712 16.213 -8.460 1.00 0.00 C ATOM 464 CG ASP A 944 12.692 17.208 -9.604 1.00 0.00 C ATOM 465 OD1 ASP A 944 12.796 18.423 -9.335 1.00 0.00 O ATOM 466 OD2 ASP A 944 12.572 16.771 -10.767 1.00 0.00 O ATOM 0 H ASP A 944 12.573 15.370 -6.132 1.00 0.00 H new ATOM 0 HA ASP A 944 11.010 17.232 -7.637 1.00 0.00 H new ATOM 0 HB2 ASP A 944 13.545 16.444 -7.796 1.00 0.00 H new ATOM 0 HB3 ASP A 944 12.888 15.213 -8.856 1.00 0.00 H new ATOM 471 N PHE A 945 10.366 14.043 -7.912 1.00 0.00 N ATOM 472 CA PHE A 945 9.435 13.070 -8.471 1.00 0.00 C ATOM 473 C PHE A 945 7.993 13.442 -8.135 1.00 0.00 C ATOM 474 O PHE A 945 7.094 13.294 -8.963 1.00 0.00 O ATOM 475 CB PHE A 945 9.748 11.670 -7.940 1.00 0.00 C ATOM 476 CG PHE A 945 8.776 10.622 -8.401 1.00 0.00 C ATOM 477 CD1 PHE A 945 7.620 10.365 -7.682 1.00 0.00 C ATOM 478 CD2 PHE A 945 9.017 9.894 -9.556 1.00 0.00 C ATOM 479 CE1 PHE A 945 6.725 9.401 -8.104 1.00 0.00 C ATOM 480 CE2 PHE A 945 8.125 8.929 -9.983 1.00 0.00 C ATOM 481 CZ PHE A 945 6.977 8.683 -9.257 1.00 0.00 C ATOM 0 H PHE A 945 10.985 13.669 -7.193 1.00 0.00 H new ATOM 0 HA PHE A 945 9.551 13.075 -9.555 1.00 0.00 H new ATOM 0 HB2 PHE A 945 10.752 11.387 -8.256 1.00 0.00 H new ATOM 0 HB3 PHE A 945 9.752 11.696 -6.850 1.00 0.00 H new ATOM 0 HD1 PHE A 945 7.416 10.925 -6.781 1.00 0.00 H new ATOM 0 HD2 PHE A 945 9.913 10.083 -10.129 1.00 0.00 H new ATOM 0 HE1 PHE A 945 5.829 9.209 -7.533 1.00 0.00 H new ATOM 0 HE2 PHE A 945 8.326 8.368 -10.884 1.00 0.00 H new ATOM 0 HZ PHE A 945 6.277 7.931 -9.590 1.00 0.00 H new ATOM 491 N PHE A 946 7.782 13.926 -6.916 1.00 0.00 N ATOM 492 CA PHE A 946 6.450 14.318 -6.469 1.00 0.00 C ATOM 493 C PHE A 946 6.170 15.778 -6.811 1.00 0.00 C ATOM 494 O PHE A 946 5.209 16.369 -6.319 1.00 0.00 O ATOM 495 CB PHE A 946 6.310 14.100 -4.961 1.00 0.00 C ATOM 496 CG PHE A 946 5.995 12.680 -4.587 1.00 0.00 C ATOM 497 CD1 PHE A 946 4.687 12.224 -4.583 1.00 0.00 C ATOM 498 CD2 PHE A 946 7.008 11.800 -4.240 1.00 0.00 C ATOM 499 CE1 PHE A 946 4.394 10.917 -4.240 1.00 0.00 C ATOM 500 CE2 PHE A 946 6.721 10.493 -3.896 1.00 0.00 C ATOM 501 CZ PHE A 946 5.413 10.051 -3.895 1.00 0.00 C ATOM 0 H PHE A 946 8.516 14.056 -6.220 1.00 0.00 H new ATOM 0 HA PHE A 946 5.722 13.695 -6.988 1.00 0.00 H new ATOM 0 HB2 PHE A 946 7.237 14.399 -4.471 1.00 0.00 H new ATOM 0 HB3 PHE A 946 5.523 14.751 -4.579 1.00 0.00 H new ATOM 0 HD1 PHE A 946 3.886 12.898 -4.851 1.00 0.00 H new ATOM 0 HD2 PHE A 946 8.033 12.140 -4.238 1.00 0.00 H new ATOM 0 HE1 PHE A 946 3.370 10.574 -4.242 1.00 0.00 H new ATOM 0 HE2 PHE A 946 7.520 9.817 -3.628 1.00 0.00 H new ATOM 0 HZ PHE A 946 5.187 9.030 -3.625 1.00 0.00 H new ATOM 511 N TYR A 947 7.016 16.354 -7.658 1.00 0.00 N ATOM 512 CA TYR A 947 6.862 17.745 -8.065 1.00 0.00 C ATOM 513 C TYR A 947 5.428 18.031 -8.498 1.00 0.00 C ATOM 514 O TYR A 947 4.746 17.162 -9.040 1.00 0.00 O ATOM 515 CB TYR A 947 7.827 18.075 -9.206 1.00 0.00 C ATOM 516 CG TYR A 947 7.876 19.546 -9.551 1.00 0.00 C ATOM 517 CD1 TYR A 947 8.239 20.491 -8.599 1.00 0.00 C ATOM 518 CD2 TYR A 947 7.559 19.991 -10.828 1.00 0.00 C ATOM 519 CE1 TYR A 947 8.285 21.837 -8.909 1.00 0.00 C ATOM 520 CE2 TYR A 947 7.604 21.335 -11.148 1.00 0.00 C ATOM 521 CZ TYR A 947 7.967 22.253 -10.185 1.00 0.00 C ATOM 522 OH TYR A 947 8.012 23.592 -10.499 1.00 0.00 O ATOM 0 H TYR A 947 7.816 15.879 -8.076 1.00 0.00 H new ATOM 0 HA TYR A 947 7.095 18.375 -7.207 1.00 0.00 H new ATOM 0 HB2 TYR A 947 8.828 17.741 -8.932 1.00 0.00 H new ATOM 0 HB3 TYR A 947 7.534 17.512 -10.092 1.00 0.00 H new ATOM 0 HD1 TYR A 947 8.490 20.168 -7.599 1.00 0.00 H new ATOM 0 HD2 TYR A 947 7.272 19.275 -11.584 1.00 0.00 H new ATOM 0 HE1 TYR A 947 8.568 22.559 -8.157 1.00 0.00 H new ATOM 0 HE2 TYR A 947 7.356 21.664 -12.146 1.00 0.00 H new ATOM 0 HH TYR A 947 7.761 23.716 -11.438 1.00 0.00 H new ATOM 532 N GLY A 948 4.976 19.258 -8.256 1.00 0.00 N ATOM 533 CA GLY A 948 3.626 19.638 -8.627 1.00 0.00 C ATOM 534 C GLY A 948 2.646 19.493 -7.480 1.00 0.00 C ATOM 535 O GLY A 948 1.695 20.266 -7.365 1.00 0.00 O ATOM 0 H GLY A 948 5.521 19.995 -7.810 1.00 0.00 H new ATOM 0 HA2 GLY A 948 3.625 20.672 -8.973 1.00 0.00 H new ATOM 0 HA3 GLY A 948 3.295 19.022 -9.463 1.00 0.00 H new ATOM 539 N TYR A 949 2.877 18.500 -6.629 1.00 0.00 N ATOM 540 CA TYR A 949 2.005 18.253 -5.487 1.00 0.00 C ATOM 541 C TYR A 949 2.637 18.770 -4.198 1.00 0.00 C ATOM 542 O TYR A 949 3.850 18.686 -4.012 1.00 0.00 O ATOM 543 CB TYR A 949 1.709 16.758 -5.359 1.00 0.00 C ATOM 544 CG TYR A 949 1.142 16.143 -6.618 1.00 0.00 C ATOM 545 CD1 TYR A 949 -0.171 16.387 -7.004 1.00 0.00 C ATOM 546 CD2 TYR A 949 1.918 15.318 -7.423 1.00 0.00 C ATOM 547 CE1 TYR A 949 -0.694 15.827 -8.153 1.00 0.00 C ATOM 548 CE2 TYR A 949 1.404 14.755 -8.575 1.00 0.00 C ATOM 549 CZ TYR A 949 0.098 15.012 -8.936 1.00 0.00 C ATOM 550 OH TYR A 949 -0.418 14.452 -10.082 1.00 0.00 O ATOM 0 H TYR A 949 3.661 17.853 -6.708 1.00 0.00 H new ATOM 0 HA TYR A 949 1.070 18.789 -5.653 1.00 0.00 H new ATOM 0 HB2 TYR A 949 2.628 16.236 -5.092 1.00 0.00 H new ATOM 0 HB3 TYR A 949 1.005 16.604 -4.541 1.00 0.00 H new ATOM 0 HD1 TYR A 949 -0.793 17.026 -6.395 1.00 0.00 H new ATOM 0 HD2 TYR A 949 2.941 15.113 -7.143 1.00 0.00 H new ATOM 0 HE1 TYR A 949 -1.717 16.026 -8.437 1.00 0.00 H new ATOM 0 HE2 TYR A 949 2.022 14.117 -9.190 1.00 0.00 H new ATOM 0 HH TYR A 949 0.270 13.906 -10.518 1.00 0.00 H new ATOM 560 N GLN A 950 1.803 19.303 -3.311 1.00 0.00 N ATOM 561 CA GLN A 950 2.278 19.834 -2.039 1.00 0.00 C ATOM 562 C GLN A 950 2.629 18.705 -1.075 1.00 0.00 C ATOM 563 O GLN A 950 1.765 18.193 -0.361 1.00 0.00 O ATOM 564 CB GLN A 950 1.220 20.744 -1.414 1.00 0.00 C ATOM 565 CG GLN A 950 0.737 21.845 -2.344 1.00 0.00 C ATOM 566 CD GLN A 950 1.876 22.667 -2.914 1.00 0.00 C ATOM 567 OE1 GLN A 950 2.634 23.296 -2.175 1.00 0.00 O ATOM 568 NE2 GLN A 950 2.003 22.667 -4.236 1.00 0.00 N ATOM 0 H GLN A 950 0.795 19.379 -3.450 1.00 0.00 H new ATOM 0 HA GLN A 950 3.179 20.416 -2.231 1.00 0.00 H new ATOM 0 HB2 GLN A 950 0.367 20.138 -1.108 1.00 0.00 H new ATOM 0 HB3 GLN A 950 1.630 21.197 -0.511 1.00 0.00 H new ATOM 0 HG2 GLN A 950 0.169 21.402 -3.162 1.00 0.00 H new ATOM 0 HG3 GLN A 950 0.056 22.501 -1.802 1.00 0.00 H new ATOM 0 HE21 GLN A 950 1.352 22.131 -4.811 1.00 0.00 H new ATOM 0 HE22 GLN A 950 2.751 23.202 -4.676 1.00 0.00 H new ATOM 577 N VAL A 951 3.901 18.320 -1.059 1.00 0.00 N ATOM 578 CA VAL A 951 4.366 17.252 -0.182 1.00 0.00 C ATOM 579 C VAL A 951 4.717 17.790 1.201 1.00 0.00 C ATOM 580 O VAL A 951 5.560 18.676 1.338 1.00 0.00 O ATOM 581 CB VAL A 951 5.598 16.539 -0.771 1.00 0.00 C ATOM 582 CG1 VAL A 951 6.124 15.493 0.200 1.00 0.00 C ATOM 583 CG2 VAL A 951 5.257 15.909 -2.113 1.00 0.00 C ATOM 0 H VAL A 951 4.628 18.732 -1.644 1.00 0.00 H new ATOM 0 HA VAL A 951 3.549 16.536 -0.094 1.00 0.00 H new ATOM 0 HB VAL A 951 6.383 17.278 -0.931 1.00 0.00 H new ATOM 0 HG11 VAL A 951 6.994 15.000 -0.233 1.00 0.00 H new ATOM 0 HG12 VAL A 951 6.408 15.975 1.135 1.00 0.00 H new ATOM 0 HG13 VAL A 951 5.347 14.754 0.394 1.00 0.00 H new ATOM 0 HG21 VAL A 951 6.139 15.410 -2.515 1.00 0.00 H new ATOM 0 HG22 VAL A 951 4.456 15.181 -1.980 1.00 0.00 H new ATOM 0 HG23 VAL A 951 4.931 16.684 -2.807 1.00 0.00 H new ATOM 593 N ILE A 952 4.064 17.248 2.223 1.00 0.00 N ATOM 594 CA ILE A 952 4.308 17.672 3.596 1.00 0.00 C ATOM 595 C ILE A 952 5.797 17.642 3.925 1.00 0.00 C ATOM 596 O ILE A 952 6.491 16.654 3.684 1.00 0.00 O ATOM 597 CB ILE A 952 3.554 16.783 4.603 1.00 0.00 C ATOM 598 CG1 ILE A 952 2.043 16.897 4.385 1.00 0.00 C ATOM 599 CG2 ILE A 952 3.920 17.169 6.028 1.00 0.00 C ATOM 600 CD1 ILE A 952 1.228 16.101 5.380 1.00 0.00 C ATOM 0 H ILE A 952 3.362 16.514 2.126 1.00 0.00 H new ATOM 0 HA ILE A 952 3.940 18.695 3.680 1.00 0.00 H new ATOM 0 HB ILE A 952 3.848 15.746 4.442 1.00 0.00 H new ATOM 0 HG12 ILE A 952 1.753 17.946 4.447 1.00 0.00 H new ATOM 0 HG13 ILE A 952 1.803 16.559 3.377 1.00 0.00 H new ATOM 0 HG21 ILE A 952 3.379 16.532 6.728 1.00 0.00 H new ATOM 0 HG22 ILE A 952 4.992 17.041 6.175 1.00 0.00 H new ATOM 0 HG23 ILE A 952 3.651 18.211 6.203 1.00 0.00 H new ATOM 0 HD11 ILE A 952 0.167 16.228 5.166 1.00 0.00 H new ATOM 0 HD12 ILE A 952 1.490 15.046 5.303 1.00 0.00 H new ATOM 0 HD13 ILE A 952 1.439 16.455 6.389 1.00 0.00 H new ATOM 612 N PRO A 953 6.301 18.749 4.489 1.00 0.00 N ATOM 613 CA PRO A 953 7.712 18.874 4.865 1.00 0.00 C ATOM 614 C PRO A 953 8.077 17.985 6.050 1.00 0.00 C ATOM 615 O PRO A 953 7.435 18.037 7.098 1.00 0.00 O ATOM 616 CB PRO A 953 7.850 20.351 5.242 1.00 0.00 C ATOM 617 CG PRO A 953 6.479 20.766 5.653 1.00 0.00 C ATOM 618 CD PRO A 953 5.532 19.965 4.804 1.00 0.00 C ATOM 0 HA PRO A 953 8.377 18.562 4.060 1.00 0.00 H new ATOM 0 HB2 PRO A 953 8.565 20.487 6.053 1.00 0.00 H new ATOM 0 HB3 PRO A 953 8.207 20.943 4.399 1.00 0.00 H new ATOM 0 HG2 PRO A 953 6.313 20.571 6.713 1.00 0.00 H new ATOM 0 HG3 PRO A 953 6.332 21.835 5.499 1.00 0.00 H new ATOM 0 HD2 PRO A 953 4.612 19.731 5.340 1.00 0.00 H new ATOM 0 HD3 PRO A 953 5.247 20.505 3.901 1.00 0.00 H new ATOM 626 N GLY A 954 9.113 17.171 5.876 1.00 0.00 N ATOM 627 CA GLY A 954 9.546 16.283 6.939 1.00 0.00 C ATOM 628 C GLY A 954 8.876 14.925 6.869 1.00 0.00 C ATOM 629 O GLY A 954 9.213 14.019 7.631 1.00 0.00 O ATOM 0 H GLY A 954 9.661 17.110 5.018 1.00 0.00 H new ATOM 0 HA2 GLY A 954 10.627 16.155 6.883 1.00 0.00 H new ATOM 0 HA3 GLY A 954 9.329 16.743 7.903 1.00 0.00 H new ATOM 633 N SER A 955 7.923 14.783 5.953 1.00 0.00 N ATOM 634 CA SER A 955 7.200 13.527 5.790 1.00 0.00 C ATOM 635 C SER A 955 8.087 12.471 5.137 1.00 0.00 C ATOM 636 O SER A 955 8.219 11.356 5.642 1.00 0.00 O ATOM 637 CB SER A 955 5.942 13.744 4.947 1.00 0.00 C ATOM 638 OG SER A 955 6.266 13.899 3.577 1.00 0.00 O ATOM 0 H SER A 955 7.634 15.522 5.313 1.00 0.00 H new ATOM 0 HA SER A 955 6.910 13.172 6.779 1.00 0.00 H new ATOM 0 HB2 SER A 955 5.267 12.897 5.071 1.00 0.00 H new ATOM 0 HB3 SER A 955 5.412 14.628 5.301 1.00 0.00 H new ATOM 0 HG SER A 955 6.396 14.850 3.377 1.00 0.00 H new ATOM 644 N VAL A 956 8.693 12.830 4.010 1.00 0.00 N ATOM 645 CA VAL A 956 9.568 11.915 3.287 1.00 0.00 C ATOM 646 C VAL A 956 10.404 11.079 4.249 1.00 0.00 C ATOM 647 O VAL A 956 11.298 11.595 4.921 1.00 0.00 O ATOM 648 CB VAL A 956 10.510 12.675 2.333 1.00 0.00 C ATOM 649 CG1 VAL A 956 11.506 11.720 1.694 1.00 0.00 C ATOM 650 CG2 VAL A 956 9.709 13.413 1.271 1.00 0.00 C ATOM 0 H VAL A 956 8.594 13.749 3.578 1.00 0.00 H new ATOM 0 HA VAL A 956 8.925 11.257 2.703 1.00 0.00 H new ATOM 0 HB VAL A 956 11.069 13.411 2.911 1.00 0.00 H new ATOM 0 HG11 VAL A 956 12.163 12.274 1.024 1.00 0.00 H new ATOM 0 HG12 VAL A 956 12.101 11.241 2.472 1.00 0.00 H new ATOM 0 HG13 VAL A 956 10.969 10.959 1.128 1.00 0.00 H new ATOM 0 HG21 VAL A 956 10.390 13.944 0.606 1.00 0.00 H new ATOM 0 HG22 VAL A 956 9.123 12.697 0.694 1.00 0.00 H new ATOM 0 HG23 VAL A 956 9.040 14.127 1.751 1.00 0.00 H new ATOM 660 N CYS A 957 10.108 9.785 4.311 1.00 0.00 N ATOM 661 CA CYS A 957 10.832 8.876 5.192 1.00 0.00 C ATOM 662 C CYS A 957 11.397 7.696 4.408 1.00 0.00 C ATOM 663 O CYS A 957 10.667 6.998 3.703 1.00 0.00 O ATOM 664 CB CYS A 957 9.913 8.372 6.305 1.00 0.00 C ATOM 665 SG CYS A 957 9.711 9.531 7.677 1.00 0.00 S ATOM 0 H CYS A 957 9.372 9.342 3.761 1.00 0.00 H new ATOM 0 HA CYS A 957 11.662 9.424 5.637 1.00 0.00 H new ATOM 0 HB2 CYS A 957 8.933 8.153 5.881 1.00 0.00 H new ATOM 0 HB3 CYS A 957 10.310 7.433 6.692 1.00 0.00 H new ATOM 0 HG CYS A 957 9.048 10.573 7.271 1.00 0.00 H new ATOM 671 N LEU A 958 12.702 7.479 4.535 1.00 0.00 N ATOM 672 CA LEU A 958 13.367 6.383 3.838 1.00 0.00 C ATOM 673 C LEU A 958 13.521 5.171 4.751 1.00 0.00 C ATOM 674 O LEU A 958 13.825 5.307 5.936 1.00 0.00 O ATOM 675 CB LEU A 958 14.738 6.833 3.332 1.00 0.00 C ATOM 676 CG LEU A 958 14.735 7.732 2.095 1.00 0.00 C ATOM 677 CD1 LEU A 958 16.096 8.385 1.907 1.00 0.00 C ATOM 678 CD2 LEU A 958 14.348 6.936 0.858 1.00 0.00 C ATOM 0 H LEU A 958 13.320 8.047 5.114 1.00 0.00 H new ATOM 0 HA LEU A 958 12.749 6.097 2.987 1.00 0.00 H new ATOM 0 HB2 LEU A 958 15.245 7.361 4.139 1.00 0.00 H new ATOM 0 HB3 LEU A 958 15.330 5.945 3.110 1.00 0.00 H new ATOM 0 HG LEU A 958 13.995 8.518 2.242 1.00 0.00 H new ATOM 0 HD11 LEU A 958 16.075 9.021 1.022 1.00 0.00 H new ATOM 0 HD12 LEU A 958 16.334 8.989 2.783 1.00 0.00 H new ATOM 0 HD13 LEU A 958 16.856 7.613 1.781 1.00 0.00 H new ATOM 0 HD21 LEU A 958 14.351 7.592 -0.012 1.00 0.00 H new ATOM 0 HD22 LEU A 958 15.064 6.128 0.706 1.00 0.00 H new ATOM 0 HD23 LEU A 958 13.351 6.516 0.993 1.00 0.00 H new ATOM 690 N LYS A 959 13.312 3.985 4.191 1.00 0.00 N ATOM 691 CA LYS A 959 13.431 2.747 4.952 1.00 0.00 C ATOM 692 C LYS A 959 14.779 2.080 4.698 1.00 0.00 C ATOM 693 O LYS A 959 15.193 1.911 3.551 1.00 0.00 O ATOM 694 CB LYS A 959 12.298 1.787 4.585 1.00 0.00 C ATOM 695 CG LYS A 959 11.057 1.953 5.445 1.00 0.00 C ATOM 696 CD LYS A 959 10.095 2.966 4.847 1.00 0.00 C ATOM 697 CE LYS A 959 9.103 2.303 3.903 1.00 0.00 C ATOM 698 NZ LYS A 959 8.019 1.599 4.643 1.00 0.00 N ATOM 0 H LYS A 959 13.059 3.855 3.212 1.00 0.00 H new ATOM 0 HA LYS A 959 13.361 2.993 6.011 1.00 0.00 H new ATOM 0 HB2 LYS A 959 12.028 1.939 3.540 1.00 0.00 H new ATOM 0 HB3 LYS A 959 12.658 0.762 4.675 1.00 0.00 H new ATOM 0 HG2 LYS A 959 10.555 0.991 5.550 1.00 0.00 H new ATOM 0 HG3 LYS A 959 11.347 2.272 6.446 1.00 0.00 H new ATOM 0 HD2 LYS A 959 9.555 3.473 5.647 1.00 0.00 H new ATOM 0 HD3 LYS A 959 10.657 3.729 4.309 1.00 0.00 H new ATOM 0 HE2 LYS A 959 8.666 3.057 3.248 1.00 0.00 H new ATOM 0 HE3 LYS A 959 9.628 1.592 3.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 959 7.345 1.189 3.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 959 8.431 0.841 5.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 959 7.523 2.275 5.258 1.00 0.00 H new ATOM 712 N TYR A 960 15.459 1.700 5.775 1.00 0.00 N ATOM 713 CA TYR A 960 16.760 1.052 5.668 1.00 0.00 C ATOM 714 C TYR A 960 16.729 -0.338 6.295 1.00 0.00 C ATOM 715 O TYR A 960 15.771 -0.704 6.974 1.00 0.00 O ATOM 716 CB TYR A 960 17.835 1.905 6.345 1.00 0.00 C ATOM 717 CG TYR A 960 17.988 3.281 5.737 1.00 0.00 C ATOM 718 CD1 TYR A 960 18.829 3.492 4.650 1.00 0.00 C ATOM 719 CD2 TYR A 960 17.294 4.370 6.249 1.00 0.00 C ATOM 720 CE1 TYR A 960 18.972 4.747 4.092 1.00 0.00 C ATOM 721 CE2 TYR A 960 17.431 5.628 5.696 1.00 0.00 C ATOM 722 CZ TYR A 960 18.271 5.812 4.617 1.00 0.00 C ATOM 723 OH TYR A 960 18.411 7.064 4.065 1.00 0.00 O ATOM 0 H TYR A 960 15.130 1.830 6.732 1.00 0.00 H new ATOM 0 HA TYR A 960 17.000 0.948 4.610 1.00 0.00 H new ATOM 0 HB2 TYR A 960 17.592 2.009 7.402 1.00 0.00 H new ATOM 0 HB3 TYR A 960 18.790 1.383 6.288 1.00 0.00 H new ATOM 0 HD1 TYR A 960 19.380 2.661 4.235 1.00 0.00 H new ATOM 0 HD2 TYR A 960 16.636 4.230 7.094 1.00 0.00 H new ATOM 0 HE1 TYR A 960 19.630 4.894 3.248 1.00 0.00 H new ATOM 0 HE2 TYR A 960 16.883 6.464 6.106 1.00 0.00 H new ATOM 0 HH TYR A 960 17.848 7.701 4.552 1.00 0.00 H new ATOM 733 N ASN A 961 17.786 -1.109 6.060 1.00 0.00 N ATOM 734 CA ASN A 961 17.882 -2.460 6.601 1.00 0.00 C ATOM 735 C ASN A 961 18.689 -2.472 7.896 1.00 0.00 C ATOM 736 O ASN A 961 19.122 -1.426 8.378 1.00 0.00 O ATOM 737 CB ASN A 961 18.525 -3.398 5.577 1.00 0.00 C ATOM 738 CG ASN A 961 19.662 -2.737 4.823 1.00 0.00 C ATOM 739 OD1 ASN A 961 20.850 -2.747 5.416 1.00 0.00 O flip ATOM 740 ND2 ASN A 961 19.475 -2.225 3.719 1.00 0.00 N flip ATOM 0 H ASN A 961 18.588 -0.821 5.499 1.00 0.00 H new ATOM 0 HA ASN A 961 16.873 -2.809 6.820 1.00 0.00 H new ATOM 0 HB2 ASN A 961 18.898 -4.287 6.086 1.00 0.00 H new ATOM 0 HB3 ASN A 961 17.768 -3.732 4.868 1.00 0.00 H new ATOM 0 HD21 ASN A 961 18.545 -2.240 3.301 1.00 0.00 H new ATOM 0 HD22 ASN A 961 20.250 -1.785 3.223 1.00 0.00 H new ATOM 747 N GLU A 962 18.888 -3.663 8.452 1.00 0.00 N ATOM 748 CA GLU A 962 19.644 -3.811 9.690 1.00 0.00 C ATOM 749 C GLU A 962 21.017 -3.158 9.571 1.00 0.00 C ATOM 750 O GLU A 962 21.423 -2.376 10.431 1.00 0.00 O ATOM 751 CB GLU A 962 19.800 -5.291 10.045 1.00 0.00 C ATOM 752 CG GLU A 962 20.811 -5.549 11.149 1.00 0.00 C ATOM 753 CD GLU A 962 20.499 -6.801 11.946 1.00 0.00 C ATOM 754 OE1 GLU A 962 20.521 -7.901 11.355 1.00 0.00 O ATOM 755 OE2 GLU A 962 20.233 -6.680 13.160 1.00 0.00 O ATOM 0 H GLU A 962 18.536 -4.539 8.065 1.00 0.00 H new ATOM 0 HA GLU A 962 19.091 -3.311 10.485 1.00 0.00 H new ATOM 0 HB2 GLU A 962 18.832 -5.686 10.351 1.00 0.00 H new ATOM 0 HB3 GLU A 962 20.101 -5.840 9.153 1.00 0.00 H new ATOM 0 HG2 GLU A 962 21.805 -5.640 10.712 1.00 0.00 H new ATOM 0 HG3 GLU A 962 20.836 -4.692 11.822 1.00 0.00 H new ATOM 762 N LYS A 963 21.730 -3.485 8.498 1.00 0.00 N ATOM 763 CA LYS A 963 23.058 -2.931 8.263 1.00 0.00 C ATOM 764 C LYS A 963 23.009 -1.408 8.197 1.00 0.00 C ATOM 765 O LYS A 963 23.851 -0.724 8.776 1.00 0.00 O ATOM 766 CB LYS A 963 23.644 -3.489 6.964 1.00 0.00 C ATOM 767 CG LYS A 963 24.090 -4.937 7.072 1.00 0.00 C ATOM 768 CD LYS A 963 25.058 -5.306 5.960 1.00 0.00 C ATOM 769 CE LYS A 963 24.324 -5.802 4.723 1.00 0.00 C ATOM 770 NZ LYS A 963 25.151 -6.754 3.931 1.00 0.00 N ATOM 0 H LYS A 963 21.410 -4.132 7.777 1.00 0.00 H new ATOM 0 HA LYS A 963 23.697 -3.221 9.097 1.00 0.00 H new ATOM 0 HB2 LYS A 963 22.899 -3.405 6.173 1.00 0.00 H new ATOM 0 HB3 LYS A 963 24.495 -2.876 6.666 1.00 0.00 H new ATOM 0 HG2 LYS A 963 24.565 -5.101 8.039 1.00 0.00 H new ATOM 0 HG3 LYS A 963 23.219 -5.591 7.030 1.00 0.00 H new ATOM 0 HD2 LYS A 963 25.664 -4.438 5.701 1.00 0.00 H new ATOM 0 HD3 LYS A 963 25.742 -6.078 6.313 1.00 0.00 H new ATOM 0 HE2 LYS A 963 23.396 -6.289 5.022 1.00 0.00 H new ATOM 0 HE3 LYS A 963 24.050 -4.952 4.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 963 24.615 -7.068 3.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 963 26.025 -6.282 3.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 963 25.391 -7.578 4.519 1.00 0.00 H new ATOM 784 N GLY A 964 22.014 -0.882 7.488 1.00 0.00 N ATOM 785 CA GLY A 964 21.873 0.556 7.360 1.00 0.00 C ATOM 786 C GLY A 964 21.584 0.987 5.936 1.00 0.00 C ATOM 787 O GLY A 964 21.051 2.072 5.705 1.00 0.00 O ATOM 0 H GLY A 964 21.303 -1.427 7.000 1.00 0.00 H new ATOM 0 HA2 GLY A 964 21.068 0.898 8.010 1.00 0.00 H new ATOM 0 HA3 GLY A 964 22.787 1.039 7.704 1.00 0.00 H new ATOM 791 N MET A 965 21.937 0.135 4.979 1.00 0.00 N ATOM 792 CA MET A 965 21.712 0.434 3.569 1.00 0.00 C ATOM 793 C MET A 965 20.227 0.641 3.287 1.00 0.00 C ATOM 794 O MET A 965 19.360 0.181 4.030 1.00 0.00 O ATOM 795 CB MET A 965 22.258 -0.695 2.693 1.00 0.00 C ATOM 796 CG MET A 965 23.747 -0.580 2.411 1.00 0.00 C ATOM 797 SD MET A 965 24.229 -1.402 0.880 1.00 0.00 S ATOM 798 CE MET A 965 24.579 0.009 -0.166 1.00 0.00 C ATOM 0 H MET A 965 22.380 -0.767 5.154 1.00 0.00 H new ATOM 0 HA MET A 965 22.240 1.357 3.330 1.00 0.00 H new ATOM 0 HB2 MET A 965 22.062 -1.650 3.181 1.00 0.00 H new ATOM 0 HB3 MET A 965 21.717 -0.704 1.747 1.00 0.00 H new ATOM 0 HG2 MET A 965 24.022 0.473 2.356 1.00 0.00 H new ATOM 0 HG3 MET A 965 24.305 -1.012 3.242 1.00 0.00 H new ATOM 0 HE1 MET A 965 24.891 -0.337 -1.151 1.00 0.00 H new ATOM 0 HE2 MET A 965 23.682 0.621 -0.264 1.00 0.00 H new ATOM 0 HE3 MET A 965 25.377 0.603 0.279 1.00 0.00 H new ATOM 808 N PRO A 966 19.926 1.349 2.189 1.00 0.00 N ATOM 809 CA PRO A 966 18.546 1.633 1.784 1.00 0.00 C ATOM 810 C PRO A 966 17.816 0.384 1.299 1.00 0.00 C ATOM 811 O PRO A 966 18.416 -0.499 0.685 1.00 0.00 O ATOM 812 CB PRO A 966 18.710 2.635 0.639 1.00 0.00 C ATOM 813 CG PRO A 966 20.068 2.362 0.089 1.00 0.00 C ATOM 814 CD PRO A 966 20.909 1.928 1.258 1.00 0.00 C ATOM 0 HA PRO A 966 17.947 2.009 2.614 1.00 0.00 H new ATOM 0 HB2 PRO A 966 17.940 2.498 -0.120 1.00 0.00 H new ATOM 0 HB3 PRO A 966 18.626 3.661 0.996 1.00 0.00 H new ATOM 0 HG2 PRO A 966 20.031 1.585 -0.675 1.00 0.00 H new ATOM 0 HG3 PRO A 966 20.484 3.252 -0.382 1.00 0.00 H new ATOM 0 HD2 PRO A 966 21.661 1.197 0.962 1.00 0.00 H new ATOM 0 HD3 PRO A 966 21.440 2.768 1.705 1.00 0.00 H new ATOM 822 N THR A 967 16.518 0.318 1.576 1.00 0.00 N ATOM 823 CA THR A 967 15.707 -0.823 1.169 1.00 0.00 C ATOM 824 C THR A 967 14.816 -0.468 -0.016 1.00 0.00 C ATOM 825 O THR A 967 13.689 -0.950 -0.125 1.00 0.00 O ATOM 826 CB THR A 967 14.825 -1.328 2.326 1.00 0.00 C ATOM 827 OG1 THR A 967 14.139 -0.228 2.935 1.00 0.00 O ATOM 828 CG2 THR A 967 15.664 -2.049 3.370 1.00 0.00 C ATOM 0 H THR A 967 16.005 1.041 2.081 1.00 0.00 H new ATOM 0 HA THR A 967 16.398 -1.614 0.878 1.00 0.00 H new ATOM 0 HB THR A 967 14.097 -2.030 1.919 1.00 0.00 H new ATOM 0 HG1 THR A 967 14.645 0.597 2.784 1.00 0.00 H new ATOM 0 HG21 THR A 967 15.020 -2.397 4.178 1.00 0.00 H new ATOM 0 HG22 THR A 967 16.162 -2.902 2.910 1.00 0.00 H new ATOM 0 HG23 THR A 967 16.412 -1.365 3.771 1.00 0.00 H new ATOM 836 N GLY A 968 15.328 0.379 -0.904 1.00 0.00 N ATOM 837 CA GLY A 968 14.565 0.784 -2.070 1.00 0.00 C ATOM 838 C GLY A 968 13.105 1.035 -1.749 1.00 0.00 C ATOM 839 O GLY A 968 12.218 0.604 -2.485 1.00 0.00 O ATOM 0 H GLY A 968 16.258 0.792 -0.836 1.00 0.00 H new ATOM 0 HA2 GLY A 968 15.002 1.690 -2.490 1.00 0.00 H new ATOM 0 HA3 GLY A 968 14.638 0.011 -2.835 1.00 0.00 H new ATOM 843 N GLU A 969 12.855 1.732 -0.645 1.00 0.00 N ATOM 844 CA GLU A 969 11.492 2.037 -0.228 1.00 0.00 C ATOM 845 C GLU A 969 11.431 3.382 0.491 1.00 0.00 C ATOM 846 O GLU A 969 12.371 3.771 1.183 1.00 0.00 O ATOM 847 CB GLU A 969 10.956 0.933 0.686 1.00 0.00 C ATOM 848 CG GLU A 969 10.338 -0.233 -0.066 1.00 0.00 C ATOM 849 CD GLU A 969 9.991 -1.396 0.843 1.00 0.00 C ATOM 850 OE1 GLU A 969 10.863 -2.264 1.057 1.00 0.00 O ATOM 851 OE2 GLU A 969 8.847 -1.438 1.341 1.00 0.00 O ATOM 0 H GLU A 969 13.578 2.096 -0.024 1.00 0.00 H new ATOM 0 HA GLU A 969 10.870 2.094 -1.121 1.00 0.00 H new ATOM 0 HB2 GLU A 969 11.770 0.562 1.309 1.00 0.00 H new ATOM 0 HB3 GLU A 969 10.209 1.359 1.356 1.00 0.00 H new ATOM 0 HG2 GLU A 969 9.436 0.106 -0.576 1.00 0.00 H new ATOM 0 HG3 GLU A 969 11.031 -0.573 -0.835 1.00 0.00 H new ATOM 858 N ALA A 970 10.317 4.087 0.321 1.00 0.00 N ATOM 859 CA ALA A 970 10.132 5.387 0.954 1.00 0.00 C ATOM 860 C ALA A 970 8.658 5.653 1.241 1.00 0.00 C ATOM 861 O ALA A 970 7.779 5.132 0.555 1.00 0.00 O ATOM 862 CB ALA A 970 10.708 6.488 0.077 1.00 0.00 C ATOM 0 H ALA A 970 9.529 3.780 -0.250 1.00 0.00 H new ATOM 0 HA ALA A 970 10.665 5.379 1.905 1.00 0.00 H new ATOM 0 HB1 ALA A 970 10.563 7.453 0.562 1.00 0.00 H new ATOM 0 HB2 ALA A 970 11.774 6.314 -0.073 1.00 0.00 H new ATOM 0 HB3 ALA A 970 10.201 6.487 -0.888 1.00 0.00 H new ATOM 868 N MET A 971 8.395 6.467 2.258 1.00 0.00 N ATOM 869 CA MET A 971 7.026 6.802 2.634 1.00 0.00 C ATOM 870 C MET A 971 6.831 8.314 2.684 1.00 0.00 C ATOM 871 O MET A 971 7.722 9.051 3.106 1.00 0.00 O ATOM 872 CB MET A 971 6.683 6.186 3.992 1.00 0.00 C ATOM 873 CG MET A 971 6.096 4.787 3.894 1.00 0.00 C ATOM 874 SD MET A 971 5.069 4.364 5.314 1.00 0.00 S ATOM 875 CE MET A 971 6.208 4.676 6.661 1.00 0.00 C ATOM 0 H MET A 971 9.111 6.907 2.836 1.00 0.00 H new ATOM 0 HA MET A 971 6.357 6.392 1.878 1.00 0.00 H new ATOM 0 HB2 MET A 971 7.584 6.151 4.604 1.00 0.00 H new ATOM 0 HB3 MET A 971 5.973 6.834 4.507 1.00 0.00 H new ATOM 0 HG2 MET A 971 5.501 4.710 2.984 1.00 0.00 H new ATOM 0 HG3 MET A 971 6.906 4.063 3.808 1.00 0.00 H new ATOM 0 HE1 MET A 971 5.818 4.232 7.577 1.00 0.00 H new ATOM 0 HE2 MET A 971 7.177 4.235 6.428 1.00 0.00 H new ATOM 0 HE3 MET A 971 6.323 5.751 6.799 1.00 0.00 H new ATOM 885 N VAL A 972 5.660 8.770 2.250 1.00 0.00 N ATOM 886 CA VAL A 972 5.348 10.194 2.246 1.00 0.00 C ATOM 887 C VAL A 972 3.943 10.450 2.780 1.00 0.00 C ATOM 888 O VAL A 972 3.126 9.535 2.871 1.00 0.00 O ATOM 889 CB VAL A 972 5.464 10.790 0.831 1.00 0.00 C ATOM 890 CG1 VAL A 972 6.922 11.027 0.469 1.00 0.00 C ATOM 891 CG2 VAL A 972 4.795 9.878 -0.187 1.00 0.00 C ATOM 0 H VAL A 972 4.912 8.173 1.897 1.00 0.00 H new ATOM 0 HA VAL A 972 6.075 10.679 2.897 1.00 0.00 H new ATOM 0 HB VAL A 972 4.950 11.751 0.817 1.00 0.00 H new ATOM 0 HG11 VAL A 972 6.984 11.448 -0.534 1.00 0.00 H new ATOM 0 HG12 VAL A 972 7.366 11.722 1.182 1.00 0.00 H new ATOM 0 HG13 VAL A 972 7.463 10.081 0.499 1.00 0.00 H new ATOM 0 HG21 VAL A 972 4.886 10.314 -1.182 1.00 0.00 H new ATOM 0 HG22 VAL A 972 5.278 8.901 -0.173 1.00 0.00 H new ATOM 0 HG23 VAL A 972 3.740 9.764 0.064 1.00 0.00 H new ATOM 901 N ALA A 973 3.670 11.702 3.133 1.00 0.00 N ATOM 902 CA ALA A 973 2.363 12.080 3.656 1.00 0.00 C ATOM 903 C ALA A 973 1.748 13.208 2.835 1.00 0.00 C ATOM 904 O ALA A 973 2.459 14.055 2.295 1.00 0.00 O ATOM 905 CB ALA A 973 2.477 12.490 5.117 1.00 0.00 C ATOM 0 H ALA A 973 4.336 12.471 3.066 1.00 0.00 H new ATOM 0 HA ALA A 973 1.706 11.213 3.583 1.00 0.00 H new ATOM 0 HB1 ALA A 973 1.493 12.770 5.494 1.00 0.00 H new ATOM 0 HB2 ALA A 973 2.865 11.655 5.700 1.00 0.00 H new ATOM 0 HB3 ALA A 973 3.154 13.340 5.205 1.00 0.00 H new ATOM 911 N PHE A 974 0.422 13.212 2.743 1.00 0.00 N ATOM 912 CA PHE A 974 -0.289 14.236 1.986 1.00 0.00 C ATOM 913 C PHE A 974 -1.378 14.883 2.836 1.00 0.00 C ATOM 914 O PHE A 974 -2.101 14.201 3.561 1.00 0.00 O ATOM 915 CB PHE A 974 -0.904 13.630 0.723 1.00 0.00 C ATOM 916 CG PHE A 974 0.064 13.517 -0.421 1.00 0.00 C ATOM 917 CD1 PHE A 974 1.010 12.504 -0.447 1.00 0.00 C ATOM 918 CD2 PHE A 974 0.027 14.422 -1.469 1.00 0.00 C ATOM 919 CE1 PHE A 974 1.901 12.398 -1.497 1.00 0.00 C ATOM 920 CE2 PHE A 974 0.916 14.320 -2.522 1.00 0.00 C ATOM 921 CZ PHE A 974 1.854 13.307 -2.537 1.00 0.00 C ATOM 0 H PHE A 974 -0.182 12.518 3.183 1.00 0.00 H new ATOM 0 HA PHE A 974 0.428 15.005 1.700 1.00 0.00 H new ATOM 0 HB2 PHE A 974 -1.294 12.640 0.958 1.00 0.00 H new ATOM 0 HB3 PHE A 974 -1.752 14.241 0.412 1.00 0.00 H new ATOM 0 HD1 PHE A 974 1.051 11.790 0.362 1.00 0.00 H new ATOM 0 HD2 PHE A 974 -0.705 15.216 -1.463 1.00 0.00 H new ATOM 0 HE1 PHE A 974 2.634 11.605 -1.505 1.00 0.00 H new ATOM 0 HE2 PHE A 974 0.877 15.032 -3.333 1.00 0.00 H new ATOM 0 HZ PHE A 974 2.549 13.225 -3.359 1.00 0.00 H new ATOM 931 N GLU A 975 -1.488 16.205 2.740 1.00 0.00 N ATOM 932 CA GLU A 975 -2.488 16.944 3.501 1.00 0.00 C ATOM 933 C GLU A 975 -3.889 16.685 2.955 1.00 0.00 C ATOM 934 O GLU A 975 -4.851 16.569 3.714 1.00 0.00 O ATOM 935 CB GLU A 975 -2.183 18.444 3.463 1.00 0.00 C ATOM 936 CG GLU A 975 -0.797 18.797 3.974 1.00 0.00 C ATOM 937 CD GLU A 975 -0.528 20.289 3.947 1.00 0.00 C ATOM 938 OE1 GLU A 975 -1.144 21.017 4.753 1.00 0.00 O ATOM 939 OE2 GLU A 975 0.299 20.728 3.120 1.00 0.00 O ATOM 0 H GLU A 975 -0.898 16.785 2.144 1.00 0.00 H new ATOM 0 HA GLU A 975 -2.450 16.598 4.534 1.00 0.00 H new ATOM 0 HB2 GLU A 975 -2.285 18.801 2.438 1.00 0.00 H new ATOM 0 HB3 GLU A 975 -2.926 18.972 4.060 1.00 0.00 H new ATOM 0 HG2 GLU A 975 -0.686 18.430 4.994 1.00 0.00 H new ATOM 0 HG3 GLU A 975 -0.049 18.286 3.368 1.00 0.00 H new ATOM 946 N SER A 976 -3.995 16.595 1.633 1.00 0.00 N ATOM 947 CA SER A 976 -5.279 16.353 0.984 1.00 0.00 C ATOM 948 C SER A 976 -5.338 14.942 0.407 1.00 0.00 C ATOM 949 O SER A 976 -4.449 14.525 -0.335 1.00 0.00 O ATOM 950 CB SER A 976 -5.515 17.380 -0.124 1.00 0.00 C ATOM 951 OG SER A 976 -6.081 18.571 0.396 1.00 0.00 O ATOM 0 H SER A 976 -3.208 16.686 0.991 1.00 0.00 H new ATOM 0 HA SER A 976 -6.063 16.453 1.735 1.00 0.00 H new ATOM 0 HB2 SER A 976 -4.571 17.608 -0.619 1.00 0.00 H new ATOM 0 HB3 SER A 976 -6.178 16.958 -0.880 1.00 0.00 H new ATOM 0 HG SER A 976 -6.220 19.212 -0.332 1.00 0.00 H new ATOM 957 N ARG A 977 -6.393 14.212 0.753 1.00 0.00 N ATOM 958 CA ARG A 977 -6.570 12.847 0.271 1.00 0.00 C ATOM 959 C ARG A 977 -6.665 12.817 -1.252 1.00 0.00 C ATOM 960 O ARG A 977 -6.102 11.936 -1.901 1.00 0.00 O ATOM 961 CB ARG A 977 -7.826 12.225 0.884 1.00 0.00 C ATOM 962 CG ARG A 977 -8.301 10.975 0.162 1.00 0.00 C ATOM 963 CD ARG A 977 -9.391 10.260 0.945 1.00 0.00 C ATOM 964 NE ARG A 977 -10.720 10.776 0.630 1.00 0.00 N ATOM 965 CZ ARG A 977 -11.243 11.856 1.200 1.00 0.00 C ATOM 966 NH1 ARG A 977 -10.552 12.530 2.110 1.00 0.00 N ATOM 967 NH2 ARG A 977 -12.459 12.264 0.861 1.00 0.00 N ATOM 0 H ARG A 977 -7.139 14.543 1.366 1.00 0.00 H new ATOM 0 HA ARG A 977 -5.700 12.265 0.575 1.00 0.00 H new ATOM 0 HB2 ARG A 977 -7.627 11.978 1.927 1.00 0.00 H new ATOM 0 HB3 ARG A 977 -8.627 12.964 0.878 1.00 0.00 H new ATOM 0 HG2 ARG A 977 -8.677 11.244 -0.825 1.00 0.00 H new ATOM 0 HG3 ARG A 977 -7.459 10.300 0.009 1.00 0.00 H new ATOM 0 HD2 ARG A 977 -9.355 9.193 0.725 1.00 0.00 H new ATOM 0 HD3 ARG A 977 -9.203 10.372 2.013 1.00 0.00 H new ATOM 0 HE ARG A 977 -11.277 10.280 -0.066 1.00 0.00 H new ATOM 0 HH11 ARG A 977 -9.617 12.219 2.373 1.00 0.00 H new ATOM 0 HH12 ARG A 977 -10.956 13.359 2.546 1.00 0.00 H new ATOM 0 HH21 ARG A 977 -12.994 11.748 0.162 1.00 0.00 H new ATOM 0 HH22 ARG A 977 -12.859 13.093 1.299 1.00 0.00 H new ATOM 981 N ASP A 978 -7.382 13.784 -1.814 1.00 0.00 N ATOM 982 CA ASP A 978 -7.551 13.868 -3.260 1.00 0.00 C ATOM 983 C ASP A 978 -6.203 14.029 -3.956 1.00 0.00 C ATOM 984 O ASP A 978 -5.983 13.480 -5.035 1.00 0.00 O ATOM 985 CB ASP A 978 -8.468 15.039 -3.620 1.00 0.00 C ATOM 986 CG ASP A 978 -9.867 14.870 -3.063 1.00 0.00 C ATOM 987 OD1 ASP A 978 -10.293 13.713 -2.867 1.00 0.00 O ATOM 988 OD2 ASP A 978 -10.537 15.896 -2.822 1.00 0.00 O ATOM 0 H ASP A 978 -7.855 14.520 -1.290 1.00 0.00 H new ATOM 0 HA ASP A 978 -8.008 12.940 -3.603 1.00 0.00 H new ATOM 0 HB2 ASP A 978 -8.037 15.965 -3.238 1.00 0.00 H new ATOM 0 HB3 ASP A 978 -8.521 15.135 -4.704 1.00 0.00 H new ATOM 993 N GLU A 979 -5.306 14.785 -3.331 1.00 0.00 N ATOM 994 CA GLU A 979 -3.981 15.018 -3.892 1.00 0.00 C ATOM 995 C GLU A 979 -3.159 13.733 -3.901 1.00 0.00 C ATOM 996 O GLU A 979 -2.500 13.411 -4.889 1.00 0.00 O ATOM 997 CB GLU A 979 -3.248 16.100 -3.095 1.00 0.00 C ATOM 998 CG GLU A 979 -3.583 17.514 -3.538 1.00 0.00 C ATOM 999 CD GLU A 979 -3.298 18.545 -2.463 1.00 0.00 C ATOM 1000 OE1 GLU A 979 -2.349 18.338 -1.678 1.00 0.00 O ATOM 1001 OE2 GLU A 979 -4.025 19.559 -2.407 1.00 0.00 O ATOM 0 H GLU A 979 -5.473 15.246 -2.437 1.00 0.00 H new ATOM 0 HA GLU A 979 -4.105 15.356 -4.921 1.00 0.00 H new ATOM 0 HB2 GLU A 979 -3.494 15.991 -2.039 1.00 0.00 H new ATOM 0 HB3 GLU A 979 -2.173 15.944 -3.189 1.00 0.00 H new ATOM 0 HG2 GLU A 979 -3.007 17.757 -4.431 1.00 0.00 H new ATOM 0 HG3 GLU A 979 -4.636 17.564 -3.814 1.00 0.00 H new ATOM 1008 N ALA A 980 -3.204 13.002 -2.791 1.00 0.00 N ATOM 1009 CA ALA A 980 -2.465 11.751 -2.671 1.00 0.00 C ATOM 1010 C ALA A 980 -2.847 10.778 -3.781 1.00 0.00 C ATOM 1011 O ALA A 980 -1.983 10.219 -4.457 1.00 0.00 O ATOM 1012 CB ALA A 980 -2.712 11.122 -1.307 1.00 0.00 C ATOM 0 H ALA A 980 -3.744 13.255 -1.963 1.00 0.00 H new ATOM 0 HA ALA A 980 -1.403 11.974 -2.770 1.00 0.00 H new ATOM 0 HB1 ALA A 980 -2.154 10.189 -1.230 1.00 0.00 H new ATOM 0 HB2 ALA A 980 -2.382 11.807 -0.526 1.00 0.00 H new ATOM 0 HB3 ALA A 980 -3.776 10.920 -1.187 1.00 0.00 H new ATOM 1018 N THR A 981 -4.149 10.579 -3.965 1.00 0.00 N ATOM 1019 CA THR A 981 -4.646 9.672 -4.992 1.00 0.00 C ATOM 1020 C THR A 981 -4.299 10.179 -6.388 1.00 0.00 C ATOM 1021 O THR A 981 -3.867 9.412 -7.247 1.00 0.00 O ATOM 1022 CB THR A 981 -6.172 9.489 -4.890 1.00 0.00 C ATOM 1023 OG1 THR A 981 -6.546 9.248 -3.529 1.00 0.00 O ATOM 1024 CG2 THR A 981 -6.638 8.332 -5.761 1.00 0.00 C ATOM 0 H THR A 981 -4.878 11.034 -3.416 1.00 0.00 H new ATOM 0 HA THR A 981 -4.160 8.710 -4.826 1.00 0.00 H new ATOM 0 HB THR A 981 -6.650 10.403 -5.242 1.00 0.00 H new ATOM 0 HG1 THR A 981 -6.554 10.095 -3.037 1.00 0.00 H new ATOM 0 HG21 THR A 981 -7.719 8.222 -5.672 1.00 0.00 H new ATOM 0 HG22 THR A 981 -6.377 8.531 -6.800 1.00 0.00 H new ATOM 0 HG23 THR A 981 -6.152 7.412 -5.435 1.00 0.00 H new ATOM 1032 N ALA A 982 -4.491 11.476 -6.605 1.00 0.00 N ATOM 1033 CA ALA A 982 -4.196 12.086 -7.896 1.00 0.00 C ATOM 1034 C ALA A 982 -2.717 11.948 -8.243 1.00 0.00 C ATOM 1035 O ALA A 982 -2.363 11.629 -9.377 1.00 0.00 O ATOM 1036 CB ALA A 982 -4.605 13.551 -7.894 1.00 0.00 C ATOM 0 H ALA A 982 -4.849 12.124 -5.904 1.00 0.00 H new ATOM 0 HA ALA A 982 -4.772 11.561 -8.658 1.00 0.00 H new ATOM 0 HB1 ALA A 982 -4.379 13.993 -8.864 1.00 0.00 H new ATOM 0 HB2 ALA A 982 -5.675 13.630 -7.700 1.00 0.00 H new ATOM 0 HB3 ALA A 982 -4.055 14.081 -7.116 1.00 0.00 H new ATOM 1042 N ALA A 983 -1.858 12.193 -7.258 1.00 0.00 N ATOM 1043 CA ALA A 983 -0.418 12.095 -7.460 1.00 0.00 C ATOM 1044 C ALA A 983 0.007 10.649 -7.694 1.00 0.00 C ATOM 1045 O ALA A 983 0.848 10.369 -8.548 1.00 0.00 O ATOM 1046 CB ALA A 983 0.323 12.677 -6.265 1.00 0.00 C ATOM 0 H ALA A 983 -2.135 12.460 -6.313 1.00 0.00 H new ATOM 0 HA ALA A 983 -0.161 12.670 -8.349 1.00 0.00 H new ATOM 0 HB1 ALA A 983 1.398 12.597 -6.429 1.00 0.00 H new ATOM 0 HB2 ALA A 983 0.051 13.726 -6.144 1.00 0.00 H new ATOM 0 HB3 ALA A 983 0.052 12.126 -5.365 1.00 0.00 H new ATOM 1052 N VAL A 984 -0.580 9.733 -6.929 1.00 0.00 N ATOM 1053 CA VAL A 984 -0.263 8.316 -7.054 1.00 0.00 C ATOM 1054 C VAL A 984 -0.629 7.790 -8.437 1.00 0.00 C ATOM 1055 O VAL A 984 0.175 7.129 -9.094 1.00 0.00 O ATOM 1056 CB VAL A 984 -0.997 7.481 -5.988 1.00 0.00 C ATOM 1057 CG1 VAL A 984 -0.740 5.997 -6.202 1.00 0.00 C ATOM 1058 CG2 VAL A 984 -0.572 7.908 -4.591 1.00 0.00 C ATOM 0 H VAL A 984 -1.277 9.948 -6.216 1.00 0.00 H new ATOM 0 HA VAL A 984 0.812 8.218 -6.905 1.00 0.00 H new ATOM 0 HB VAL A 984 -2.068 7.658 -6.087 1.00 0.00 H new ATOM 0 HG11 VAL A 984 -1.266 5.423 -5.440 1.00 0.00 H new ATOM 0 HG12 VAL A 984 -1.099 5.704 -7.189 1.00 0.00 H new ATOM 0 HG13 VAL A 984 0.330 5.799 -6.131 1.00 0.00 H new ATOM 0 HG21 VAL A 984 -1.100 7.308 -3.850 1.00 0.00 H new ATOM 0 HG22 VAL A 984 0.502 7.762 -4.477 1.00 0.00 H new ATOM 0 HG23 VAL A 984 -0.813 8.961 -4.443 1.00 0.00 H new ATOM 1068 N ILE A 985 -1.848 8.089 -8.874 1.00 0.00 N ATOM 1069 CA ILE A 985 -2.321 7.648 -10.180 1.00 0.00 C ATOM 1070 C ILE A 985 -1.463 8.228 -11.300 1.00 0.00 C ATOM 1071 O ILE A 985 -1.057 7.516 -12.217 1.00 0.00 O ATOM 1072 CB ILE A 985 -3.789 8.049 -10.413 1.00 0.00 C ATOM 1073 CG1 ILE A 985 -4.689 7.413 -9.351 1.00 0.00 C ATOM 1074 CG2 ILE A 985 -4.236 7.639 -11.808 1.00 0.00 C ATOM 1075 CD1 ILE A 985 -6.045 8.072 -9.234 1.00 0.00 C ATOM 0 H ILE A 985 -2.526 8.635 -8.342 1.00 0.00 H new ATOM 0 HA ILE A 985 -2.244 6.561 -10.192 1.00 0.00 H new ATOM 0 HB ILE A 985 -3.871 9.133 -10.331 1.00 0.00 H new ATOM 0 HG12 ILE A 985 -4.826 6.358 -9.587 1.00 0.00 H new ATOM 0 HG13 ILE A 985 -4.187 7.461 -8.385 1.00 0.00 H new ATOM 0 HG21 ILE A 985 -5.276 7.930 -11.957 1.00 0.00 H new ATOM 0 HG22 ILE A 985 -3.611 8.135 -12.551 1.00 0.00 H new ATOM 0 HG23 ILE A 985 -4.142 6.559 -11.917 1.00 0.00 H new ATOM 0 HD11 ILE A 985 -6.628 7.569 -8.463 1.00 0.00 H new ATOM 0 HD12 ILE A 985 -5.918 9.121 -8.967 1.00 0.00 H new ATOM 0 HD13 ILE A 985 -6.567 8.001 -10.188 1.00 0.00 H new ATOM 1087 N ASP A 986 -1.191 9.526 -11.217 1.00 0.00 N ATOM 1088 CA ASP A 986 -0.379 10.203 -12.221 1.00 0.00 C ATOM 1089 C ASP A 986 1.092 9.832 -12.070 1.00 0.00 C ATOM 1090 O ASP A 986 1.877 9.966 -13.010 1.00 0.00 O ATOM 1091 CB ASP A 986 -0.550 11.719 -12.109 1.00 0.00 C ATOM 1092 CG ASP A 986 -1.691 12.237 -12.962 1.00 0.00 C ATOM 1093 OD1 ASP A 986 -2.852 11.865 -12.690 1.00 0.00 O ATOM 1094 OD2 ASP A 986 -1.424 13.015 -13.902 1.00 0.00 O ATOM 0 H ASP A 986 -1.521 10.130 -10.464 1.00 0.00 H new ATOM 0 HA ASP A 986 -0.718 9.879 -13.205 1.00 0.00 H new ATOM 0 HB2 ASP A 986 -0.729 11.986 -11.067 1.00 0.00 H new ATOM 0 HB3 ASP A 986 0.376 12.209 -12.409 1.00 0.00 H new ATOM 1099 N LEU A 987 1.461 9.366 -10.882 1.00 0.00 N ATOM 1100 CA LEU A 987 2.839 8.976 -10.607 1.00 0.00 C ATOM 1101 C LEU A 987 2.933 7.484 -10.303 1.00 0.00 C ATOM 1102 O LEU A 987 3.890 7.027 -9.680 1.00 0.00 O ATOM 1103 CB LEU A 987 3.394 9.783 -9.432 1.00 0.00 C ATOM 1104 CG LEU A 987 3.268 11.303 -9.543 1.00 0.00 C ATOM 1105 CD1 LEU A 987 3.490 11.957 -8.188 1.00 0.00 C ATOM 1106 CD2 LEU A 987 4.253 11.846 -10.568 1.00 0.00 C ATOM 0 H LEU A 987 0.825 9.249 -10.093 1.00 0.00 H new ATOM 0 HA LEU A 987 3.433 9.185 -11.496 1.00 0.00 H new ATOM 0 HB2 LEU A 987 2.885 9.462 -8.524 1.00 0.00 H new ATOM 0 HB3 LEU A 987 4.448 9.534 -9.312 1.00 0.00 H new ATOM 0 HG LEU A 987 2.258 11.542 -9.877 1.00 0.00 H new ATOM 0 HD11 LEU A 987 3.397 13.039 -8.286 1.00 0.00 H new ATOM 0 HD12 LEU A 987 2.745 11.591 -7.481 1.00 0.00 H new ATOM 0 HD13 LEU A 987 4.487 11.711 -7.824 1.00 0.00 H new ATOM 0 HD21 LEU A 987 4.149 12.929 -10.634 1.00 0.00 H new ATOM 0 HD22 LEU A 987 5.269 11.597 -10.264 1.00 0.00 H new ATOM 0 HD23 LEU A 987 4.047 11.402 -11.542 1.00 0.00 H new ATOM 1118 N ASN A 988 1.934 6.731 -10.750 1.00 0.00 N ATOM 1119 CA ASN A 988 1.905 5.290 -10.527 1.00 0.00 C ATOM 1120 C ASN A 988 2.736 4.560 -11.578 1.00 0.00 C ATOM 1121 O ASN A 988 2.659 4.865 -12.768 1.00 0.00 O ATOM 1122 CB ASN A 988 0.463 4.777 -10.556 1.00 0.00 C ATOM 1123 CG ASN A 988 0.381 3.299 -10.884 1.00 0.00 C ATOM 1124 OD1 ASN A 988 0.186 2.918 -12.038 1.00 0.00 O ATOM 1125 ND2 ASN A 988 0.530 2.458 -9.867 1.00 0.00 N ATOM 0 H ASN A 988 1.134 7.094 -11.269 1.00 0.00 H new ATOM 0 HA ASN A 988 2.335 5.091 -9.546 1.00 0.00 H new ATOM 0 HB2 ASN A 988 -0.003 4.958 -9.588 1.00 0.00 H new ATOM 0 HB3 ASN A 988 -0.106 5.342 -11.294 1.00 0.00 H new ATOM 0 HD21 ASN A 988 0.485 1.452 -10.027 1.00 0.00 H new ATOM 0 HD22 ASN A 988 0.690 2.819 -8.926 1.00 0.00 H new ATOM 1132 N ASP A 989 3.531 3.595 -11.129 1.00 0.00 N ATOM 1133 CA ASP A 989 4.377 2.820 -12.029 1.00 0.00 C ATOM 1134 C ASP A 989 5.269 3.736 -12.860 1.00 0.00 C ATOM 1135 O ASP A 989 5.424 3.542 -14.066 1.00 0.00 O ATOM 1136 CB ASP A 989 3.517 1.953 -12.951 1.00 0.00 C ATOM 1137 CG ASP A 989 2.841 0.816 -12.210 1.00 0.00 C ATOM 1138 OD1 ASP A 989 3.421 0.325 -11.220 1.00 0.00 O ATOM 1139 OD2 ASP A 989 1.732 0.415 -12.623 1.00 0.00 O ATOM 0 H ASP A 989 3.607 3.331 -10.147 1.00 0.00 H new ATOM 0 HA ASP A 989 5.013 2.174 -11.424 1.00 0.00 H new ATOM 0 HB2 ASP A 989 2.759 2.575 -13.427 1.00 0.00 H new ATOM 0 HB3 ASP A 989 4.140 1.545 -13.747 1.00 0.00 H new ATOM 1144 N ARG A 990 5.853 4.735 -12.207 1.00 0.00 N ATOM 1145 CA ARG A 990 6.729 5.684 -12.886 1.00 0.00 C ATOM 1146 C ARG A 990 8.162 5.162 -12.933 1.00 0.00 C ATOM 1147 O ARG A 990 8.729 4.742 -11.925 1.00 0.00 O ATOM 1148 CB ARG A 990 6.691 7.040 -12.180 1.00 0.00 C ATOM 1149 CG ARG A 990 5.321 7.698 -12.197 1.00 0.00 C ATOM 1150 CD ARG A 990 5.107 8.505 -13.468 1.00 0.00 C ATOM 1151 NE ARG A 990 4.946 7.649 -14.640 1.00 0.00 N ATOM 1152 CZ ARG A 990 5.048 8.087 -15.890 1.00 0.00 C ATOM 1153 NH1 ARG A 990 5.310 9.364 -16.129 1.00 0.00 N ATOM 1154 NH2 ARG A 990 4.889 7.246 -16.904 1.00 0.00 N ATOM 0 H ARG A 990 5.736 4.909 -11.209 1.00 0.00 H new ATOM 0 HA ARG A 990 6.371 5.805 -13.908 1.00 0.00 H new ATOM 0 HB2 ARG A 990 7.010 6.910 -11.146 1.00 0.00 H new ATOM 0 HB3 ARG A 990 7.411 7.707 -12.654 1.00 0.00 H new ATOM 0 HG2 ARG A 990 4.548 6.934 -12.115 1.00 0.00 H new ATOM 0 HG3 ARG A 990 5.218 8.350 -11.329 1.00 0.00 H new ATOM 0 HD2 ARG A 990 4.224 9.133 -13.354 1.00 0.00 H new ATOM 0 HD3 ARG A 990 5.955 9.172 -13.621 1.00 0.00 H new ATOM 0 HE ARG A 990 4.744 6.660 -14.491 1.00 0.00 H new ATOM 0 HH11 ARG A 990 5.434 10.013 -15.352 1.00 0.00 H new ATOM 0 HH12 ARG A 990 5.388 9.698 -17.090 1.00 0.00 H new ATOM 0 HH21 ARG A 990 4.688 6.262 -16.724 1.00 0.00 H new ATOM 0 HH22 ARG A 990 4.967 7.583 -17.863 1.00 0.00 H new ATOM 1168 N PRO A 991 8.762 5.190 -14.132 1.00 0.00 N ATOM 1169 CA PRO A 991 10.137 4.724 -14.340 1.00 0.00 C ATOM 1170 C PRO A 991 11.165 5.646 -13.695 1.00 0.00 C ATOM 1171 O PRO A 991 11.762 6.490 -14.364 1.00 0.00 O ATOM 1172 CB PRO A 991 10.288 4.736 -15.863 1.00 0.00 C ATOM 1173 CG PRO A 991 9.304 5.749 -16.334 1.00 0.00 C ATOM 1174 CD PRO A 991 8.146 5.678 -15.377 1.00 0.00 C ATOM 0 HA PRO A 991 10.310 3.747 -13.888 1.00 0.00 H new ATOM 0 HB2 PRO A 991 11.303 5.003 -16.158 1.00 0.00 H new ATOM 0 HB3 PRO A 991 10.080 3.754 -16.289 1.00 0.00 H new ATOM 0 HG2 PRO A 991 9.744 6.746 -16.341 1.00 0.00 H new ATOM 0 HG3 PRO A 991 8.982 5.536 -17.353 1.00 0.00 H new ATOM 0 HD2 PRO A 991 7.679 6.653 -15.239 1.00 0.00 H new ATOM 0 HD3 PRO A 991 7.370 5.000 -15.734 1.00 0.00 H new ATOM 1182 N ILE A 992 11.368 5.479 -12.393 1.00 0.00 N ATOM 1183 CA ILE A 992 12.327 6.296 -11.658 1.00 0.00 C ATOM 1184 C ILE A 992 13.751 5.793 -11.867 1.00 0.00 C ATOM 1185 O ILE A 992 14.026 4.602 -11.732 1.00 0.00 O ATOM 1186 CB ILE A 992 12.015 6.310 -10.150 1.00 0.00 C ATOM 1187 CG1 ILE A 992 10.816 7.216 -9.863 1.00 0.00 C ATOM 1188 CG2 ILE A 992 13.233 6.769 -9.362 1.00 0.00 C ATOM 1189 CD1 ILE A 992 10.586 7.466 -8.389 1.00 0.00 C ATOM 0 H ILE A 992 10.882 4.786 -11.825 1.00 0.00 H new ATOM 0 HA ILE A 992 12.242 7.310 -12.047 1.00 0.00 H new ATOM 0 HB ILE A 992 11.764 5.297 -9.836 1.00 0.00 H new ATOM 0 HG12 ILE A 992 10.964 8.171 -10.366 1.00 0.00 H new ATOM 0 HG13 ILE A 992 9.920 6.766 -10.291 1.00 0.00 H new ATOM 0 HG21 ILE A 992 12.997 6.774 -8.298 1.00 0.00 H new ATOM 0 HG22 ILE A 992 14.064 6.088 -9.547 1.00 0.00 H new ATOM 0 HG23 ILE A 992 13.512 7.775 -9.676 1.00 0.00 H new ATOM 0 HD11 ILE A 992 9.720 8.116 -8.261 1.00 0.00 H new ATOM 0 HD12 ILE A 992 10.406 6.518 -7.883 1.00 0.00 H new ATOM 0 HD13 ILE A 992 11.466 7.945 -7.960 1.00 0.00 H new ATOM 1201 N GLY A 993 14.655 6.712 -12.196 1.00 0.00 N ATOM 1202 CA GLY A 993 16.041 6.343 -12.417 1.00 0.00 C ATOM 1203 C GLY A 993 16.195 5.281 -13.487 1.00 0.00 C ATOM 1204 O GLY A 993 16.297 5.596 -14.673 1.00 0.00 O ATOM 0 H GLY A 993 14.452 7.705 -12.313 1.00 0.00 H new ATOM 0 HA2 GLY A 993 16.608 7.228 -12.704 1.00 0.00 H new ATOM 0 HA3 GLY A 993 16.470 5.979 -11.484 1.00 0.00 H new ATOM 1208 N SER A 994 16.214 4.020 -13.069 1.00 0.00 N ATOM 1209 CA SER A 994 16.363 2.908 -14.000 1.00 0.00 C ATOM 1210 C SER A 994 15.307 1.837 -13.741 1.00 0.00 C ATOM 1211 O SER A 994 15.222 0.846 -14.466 1.00 0.00 O ATOM 1212 CB SER A 994 17.762 2.299 -13.882 1.00 0.00 C ATOM 1213 OG SER A 994 17.806 1.005 -14.458 1.00 0.00 O ATOM 0 H SER A 994 16.128 3.743 -12.091 1.00 0.00 H new ATOM 0 HA SER A 994 16.226 3.293 -15.011 1.00 0.00 H new ATOM 0 HB2 SER A 994 18.486 2.946 -14.377 1.00 0.00 H new ATOM 0 HB3 SER A 994 18.050 2.243 -12.832 1.00 0.00 H new ATOM 0 HG SER A 994 16.936 0.795 -14.858 1.00 0.00 H new ATOM 1219 N ARG A 995 14.505 2.045 -12.702 1.00 0.00 N ATOM 1220 CA ARG A 995 13.456 1.098 -12.345 1.00 0.00 C ATOM 1221 C ARG A 995 12.144 1.823 -12.058 1.00 0.00 C ATOM 1222 O ARG A 995 12.138 3.005 -11.714 1.00 0.00 O ATOM 1223 CB ARG A 995 13.874 0.276 -11.125 1.00 0.00 C ATOM 1224 CG ARG A 995 15.244 -0.368 -11.264 1.00 0.00 C ATOM 1225 CD ARG A 995 15.520 -1.342 -10.130 1.00 0.00 C ATOM 1226 NE ARG A 995 16.511 -2.348 -10.501 1.00 0.00 N ATOM 1227 CZ ARG A 995 16.757 -3.438 -9.782 1.00 0.00 C ATOM 1228 NH1 ARG A 995 16.087 -3.661 -8.660 1.00 0.00 N ATOM 1229 NH2 ARG A 995 17.674 -4.307 -10.186 1.00 0.00 N ATOM 0 H ARG A 995 14.562 2.861 -12.093 1.00 0.00 H new ATOM 0 HA ARG A 995 13.304 0.428 -13.191 1.00 0.00 H new ATOM 0 HB2 ARG A 995 13.872 0.920 -10.246 1.00 0.00 H new ATOM 0 HB3 ARG A 995 13.132 -0.503 -10.951 1.00 0.00 H new ATOM 0 HG2 ARG A 995 15.306 -0.892 -12.218 1.00 0.00 H new ATOM 0 HG3 ARG A 995 16.011 0.406 -11.275 1.00 0.00 H new ATOM 0 HD2 ARG A 995 15.871 -0.792 -9.257 1.00 0.00 H new ATOM 0 HD3 ARG A 995 14.592 -1.836 -9.843 1.00 0.00 H new ATOM 0 HE ARG A 995 17.044 -2.206 -11.359 1.00 0.00 H new ATOM 0 HH11 ARG A 995 15.381 -2.995 -8.347 1.00 0.00 H new ATOM 0 HH12 ARG A 995 16.278 -4.499 -8.110 1.00 0.00 H new ATOM 0 HH21 ARG A 995 18.191 -4.139 -11.049 1.00 0.00 H new ATOM 0 HH22 ARG A 995 17.862 -5.144 -9.634 1.00 0.00 H new ATOM 1243 N LYS A 996 11.034 1.107 -12.203 1.00 0.00 N ATOM 1244 CA LYS A 996 9.716 1.680 -11.959 1.00 0.00 C ATOM 1245 C LYS A 996 9.355 1.606 -10.479 1.00 0.00 C ATOM 1246 O LYS A 996 9.695 0.640 -9.795 1.00 0.00 O ATOM 1247 CB LYS A 996 8.658 0.950 -12.790 1.00 0.00 C ATOM 1248 CG LYS A 996 8.659 1.343 -14.257 1.00 0.00 C ATOM 1249 CD LYS A 996 7.573 0.614 -15.031 1.00 0.00 C ATOM 1250 CE LYS A 996 7.896 -0.864 -15.186 1.00 0.00 C ATOM 1251 NZ LYS A 996 9.073 -1.084 -16.072 1.00 0.00 N ATOM 0 H LYS A 996 11.021 0.128 -12.489 1.00 0.00 H new ATOM 0 HA LYS A 996 9.743 2.728 -12.256 1.00 0.00 H new ATOM 0 HB2 LYS A 996 8.823 -0.124 -12.710 1.00 0.00 H new ATOM 0 HB3 LYS A 996 7.673 1.153 -12.369 1.00 0.00 H new ATOM 0 HG2 LYS A 996 8.511 2.419 -14.346 1.00 0.00 H new ATOM 0 HG3 LYS A 996 9.632 1.118 -14.694 1.00 0.00 H new ATOM 0 HD2 LYS A 996 6.619 0.727 -14.516 1.00 0.00 H new ATOM 0 HD3 LYS A 996 7.459 1.068 -16.015 1.00 0.00 H new ATOM 0 HE2 LYS A 996 8.093 -1.298 -14.206 1.00 0.00 H new ATOM 0 HE3 LYS A 996 7.030 -1.384 -15.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 996 9.120 -2.087 -16.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 996 8.979 -0.497 -16.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 996 9.943 -0.822 -15.565 1.00 0.00 H new ATOM 1265 N VAL A 997 8.664 2.630 -9.991 1.00 0.00 N ATOM 1266 CA VAL A 997 8.255 2.679 -8.592 1.00 0.00 C ATOM 1267 C VAL A 997 6.765 2.392 -8.445 1.00 0.00 C ATOM 1268 O VAL A 997 5.975 2.672 -9.347 1.00 0.00 O ATOM 1269 CB VAL A 997 8.567 4.051 -7.964 1.00 0.00 C ATOM 1270 CG1 VAL A 997 10.041 4.150 -7.604 1.00 0.00 C ATOM 1271 CG2 VAL A 997 8.163 5.173 -8.908 1.00 0.00 C ATOM 0 H VAL A 997 8.375 3.437 -10.543 1.00 0.00 H new ATOM 0 HA VAL A 997 8.823 1.910 -8.069 1.00 0.00 H new ATOM 0 HB VAL A 997 7.986 4.153 -7.047 1.00 0.00 H new ATOM 0 HG11 VAL A 997 10.243 5.126 -7.162 1.00 0.00 H new ATOM 0 HG12 VAL A 997 10.294 3.368 -6.888 1.00 0.00 H new ATOM 0 HG13 VAL A 997 10.644 4.028 -8.504 1.00 0.00 H new ATOM 0 HG21 VAL A 997 8.390 6.135 -8.448 1.00 0.00 H new ATOM 0 HG22 VAL A 997 8.715 5.078 -9.843 1.00 0.00 H new ATOM 0 HG23 VAL A 997 7.094 5.111 -9.110 1.00 0.00 H new ATOM 1281 N LYS A 998 6.386 1.832 -7.301 1.00 0.00 N ATOM 1282 CA LYS A 998 4.990 1.507 -7.033 1.00 0.00 C ATOM 1283 C LYS A 998 4.437 2.374 -5.906 1.00 0.00 C ATOM 1284 O LYS A 998 5.030 2.466 -4.831 1.00 0.00 O ATOM 1285 CB LYS A 998 4.850 0.028 -6.667 1.00 0.00 C ATOM 1286 CG LYS A 998 3.417 -0.402 -6.408 1.00 0.00 C ATOM 1287 CD LYS A 998 2.559 -0.261 -7.655 1.00 0.00 C ATOM 1288 CE LYS A 998 1.238 -1.001 -7.508 1.00 0.00 C ATOM 1289 NZ LYS A 998 0.273 -0.629 -8.580 1.00 0.00 N ATOM 0 H LYS A 998 7.027 1.594 -6.544 1.00 0.00 H new ATOM 0 HA LYS A 998 4.416 1.707 -7.938 1.00 0.00 H new ATOM 0 HB2 LYS A 998 5.262 -0.578 -7.474 1.00 0.00 H new ATOM 0 HB3 LYS A 998 5.448 -0.176 -5.779 1.00 0.00 H new ATOM 0 HG2 LYS A 998 3.402 -1.438 -6.070 1.00 0.00 H new ATOM 0 HG3 LYS A 998 2.995 0.201 -5.604 1.00 0.00 H new ATOM 0 HD2 LYS A 998 2.367 0.794 -7.848 1.00 0.00 H new ATOM 0 HD3 LYS A 998 3.101 -0.650 -8.517 1.00 0.00 H new ATOM 0 HE2 LYS A 998 1.418 -2.076 -7.538 1.00 0.00 H new ATOM 0 HE3 LYS A 998 0.803 -0.778 -6.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 998 -0.553 -1.260 -8.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 998 -0.036 0.355 -8.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 998 0.733 -0.722 -9.508 1.00 0.00 H new ATOM 1303 N LEU A 999 3.297 3.008 -6.159 1.00 0.00 N ATOM 1304 CA LEU A 999 2.662 3.867 -5.166 1.00 0.00 C ATOM 1305 C LEU A 999 1.365 3.245 -4.657 1.00 0.00 C ATOM 1306 O LEU A 999 0.517 2.822 -5.443 1.00 0.00 O ATOM 1307 CB LEU A 999 2.380 5.247 -5.761 1.00 0.00 C ATOM 1308 CG LEU A 999 3.604 6.053 -6.197 1.00 0.00 C ATOM 1309 CD1 LEU A 999 3.182 7.272 -7.002 1.00 0.00 C ATOM 1310 CD2 LEU A 999 4.427 6.469 -4.987 1.00 0.00 C ATOM 0 H LEU A 999 2.794 2.943 -7.044 1.00 0.00 H new ATOM 0 HA LEU A 999 3.347 3.975 -4.325 1.00 0.00 H new ATOM 0 HB2 LEU A 999 1.726 5.122 -6.624 1.00 0.00 H new ATOM 0 HB3 LEU A 999 1.828 5.832 -5.025 1.00 0.00 H new ATOM 0 HG LEU A 999 4.224 5.421 -6.833 1.00 0.00 H new ATOM 0 HD11 LEU A 999 4.067 7.833 -7.303 1.00 0.00 H new ATOM 0 HD12 LEU A 999 2.636 6.951 -7.889 1.00 0.00 H new ATOM 0 HD13 LEU A 999 2.540 7.907 -6.391 1.00 0.00 H new ATOM 0 HD21 LEU A 999 5.294 7.042 -5.316 1.00 0.00 H new ATOM 0 HD22 LEU A 999 3.816 7.083 -4.325 1.00 0.00 H new ATOM 0 HD23 LEU A 999 4.761 5.580 -4.451 1.00 0.00 H new ATOM 1322 N VAL A1000 1.217 3.195 -3.337 1.00 0.00 N ATOM 1323 CA VAL A1000 0.022 2.628 -2.723 1.00 0.00 C ATOM 1324 C VAL A1000 -0.580 3.588 -1.704 1.00 0.00 C ATOM 1325 O VAL A1000 0.141 4.256 -0.962 1.00 0.00 O ATOM 1326 CB VAL A1000 0.329 1.287 -2.030 1.00 0.00 C ATOM 1327 CG1 VAL A1000 -0.954 0.632 -1.543 1.00 0.00 C ATOM 1328 CG2 VAL A1000 1.087 0.363 -2.971 1.00 0.00 C ATOM 0 H VAL A1000 1.909 3.540 -2.672 1.00 0.00 H new ATOM 0 HA VAL A1000 -0.696 2.457 -3.526 1.00 0.00 H new ATOM 0 HB VAL A1000 0.960 1.481 -1.163 1.00 0.00 H new ATOM 0 HG11 VAL A1000 -0.717 -0.314 -1.056 1.00 0.00 H new ATOM 0 HG12 VAL A1000 -1.452 1.291 -0.832 1.00 0.00 H new ATOM 0 HG13 VAL A1000 -1.614 0.449 -2.391 1.00 0.00 H new ATOM 0 HG21 VAL A1000 1.296 -0.580 -2.465 1.00 0.00 H new ATOM 0 HG22 VAL A1000 0.484 0.173 -3.859 1.00 0.00 H new ATOM 0 HG23 VAL A1000 2.026 0.833 -3.264 1.00 0.00 H new ATOM 1338 N LEU A1001 -1.907 3.653 -1.672 1.00 0.00 N ATOM 1339 CA LEU A1001 -2.608 4.532 -0.743 1.00 0.00 C ATOM 1340 C LEU A1001 -2.722 3.888 0.635 1.00 0.00 C ATOM 1341 O LEU A1001 -3.289 2.806 0.781 1.00 0.00 O ATOM 1342 CB LEU A1001 -4.001 4.866 -1.279 1.00 0.00 C ATOM 1343 CG LEU A1001 -4.086 6.061 -2.229 1.00 0.00 C ATOM 1344 CD1 LEU A1001 -5.387 6.027 -3.015 1.00 0.00 C ATOM 1345 CD2 LEU A1001 -3.961 7.367 -1.457 1.00 0.00 C ATOM 0 H LEU A1001 -2.519 3.107 -2.279 1.00 0.00 H new ATOM 0 HA LEU A1001 -2.032 5.452 -0.647 1.00 0.00 H new ATOM 0 HB2 LEU A1001 -4.390 3.988 -1.796 1.00 0.00 H new ATOM 0 HB3 LEU A1001 -4.659 5.054 -0.431 1.00 0.00 H new ATOM 0 HG LEU A1001 -3.258 5.999 -2.935 1.00 0.00 H new ATOM 0 HD11 LEU A1001 -5.429 6.885 -3.686 1.00 0.00 H new ATOM 0 HD12 LEU A1001 -5.436 5.108 -3.599 1.00 0.00 H new ATOM 0 HD13 LEU A1001 -6.230 6.064 -2.325 1.00 0.00 H new ATOM 0 HD21 LEU A1001 -4.024 8.206 -2.149 1.00 0.00 H new ATOM 0 HD22 LEU A1001 -4.768 7.437 -0.728 1.00 0.00 H new ATOM 0 HD23 LEU A1001 -3.002 7.394 -0.940 1.00 0.00 H new ATOM 1357 N GLY A1002 -2.179 4.562 1.645 1.00 0.00 N ATOM 1358 CA GLY A1002 -2.233 4.041 2.998 1.00 0.00 C ATOM 1359 C GLY A1002 -3.605 3.510 3.361 1.00 0.00 C ATOM 1360 O GLY A1002 -3.731 2.406 3.891 1.00 0.00 O ATOM 0 H GLY A1002 -1.703 5.459 1.550 1.00 0.00 H new ATOM 0 HA2 GLY A1002 -1.498 3.243 3.106 1.00 0.00 H new ATOM 0 HA3 GLY A1002 -1.955 4.828 3.698 1.00 0.00 H new ATOM 1364 N SER A1003 -4.637 4.299 3.078 1.00 0.00 N ATOM 1365 CA SER A1003 -6.007 3.904 3.384 1.00 0.00 C ATOM 1366 C SER A1003 -6.932 4.195 2.206 1.00 0.00 C ATOM 1367 O SER A1003 -7.143 5.350 1.838 1.00 0.00 O ATOM 1368 CB SER A1003 -6.506 4.637 4.631 1.00 0.00 C ATOM 1369 OG SER A1003 -7.837 4.266 4.942 1.00 0.00 O ATOM 0 H SER A1003 -4.550 5.215 2.638 1.00 0.00 H new ATOM 0 HA SER A1003 -6.015 2.831 3.574 1.00 0.00 H new ATOM 0 HB2 SER A1003 -5.855 4.410 5.475 1.00 0.00 H new ATOM 0 HB3 SER A1003 -6.454 5.714 4.469 1.00 0.00 H new ATOM 0 HG SER A1003 -8.132 4.747 5.743 1.00 0.00 H new ATOM 1375 N GLY A1004 -7.481 3.136 1.617 1.00 0.00 N ATOM 1376 CA GLY A1004 -8.377 3.298 0.487 1.00 0.00 C ATOM 1377 C GLY A1004 -7.968 2.451 -0.702 1.00 0.00 C ATOM 1378 O GLY A1004 -7.191 1.504 -0.579 1.00 0.00 O ATOM 0 H GLY A1004 -7.321 2.170 1.902 1.00 0.00 H new ATOM 0 HA2 GLY A1004 -9.390 3.031 0.789 1.00 0.00 H new ATOM 0 HA3 GLY A1004 -8.399 4.347 0.192 1.00 0.00 H new ATOM 1382 N PRO A1005 -8.501 2.789 -1.885 1.00 0.00 N ATOM 1383 CA PRO A1005 -9.428 3.913 -2.044 1.00 0.00 C ATOM 1384 C PRO A1005 -10.784 3.641 -1.401 1.00 0.00 C ATOM 1385 O PRO A1005 -11.362 4.516 -0.757 1.00 0.00 O ATOM 1386 CB PRO A1005 -9.573 4.042 -3.562 1.00 0.00 C ATOM 1387 CG PRO A1005 -9.268 2.683 -4.089 1.00 0.00 C ATOM 1388 CD PRO A1005 -8.239 2.100 -3.160 1.00 0.00 C ATOM 0 HA PRO A1005 -9.059 4.817 -1.559 1.00 0.00 H new ATOM 0 HB2 PRO A1005 -10.579 4.357 -3.838 1.00 0.00 H new ATOM 0 HB3 PRO A1005 -8.885 4.786 -3.964 1.00 0.00 H new ATOM 0 HG2 PRO A1005 -10.165 2.064 -4.115 1.00 0.00 H new ATOM 0 HG3 PRO A1005 -8.887 2.736 -5.109 1.00 0.00 H new ATOM 0 HD2 PRO A1005 -8.351 1.020 -3.063 1.00 0.00 H new ATOM 0 HD3 PRO A1005 -7.226 2.285 -3.516 1.00 0.00 H new ATOM 1396 N SER A1006 -11.285 2.424 -1.580 1.00 0.00 N ATOM 1397 CA SER A1006 -12.575 2.038 -1.020 1.00 0.00 C ATOM 1398 C SER A1006 -13.699 2.881 -1.614 1.00 0.00 C ATOM 1399 O SER A1006 -14.748 3.062 -0.995 1.00 0.00 O ATOM 1400 CB SER A1006 -12.559 2.188 0.502 1.00 0.00 C ATOM 1401 OG SER A1006 -11.997 1.045 1.122 1.00 0.00 O ATOM 0 H SER A1006 -10.817 1.688 -2.109 1.00 0.00 H new ATOM 0 HA SER A1006 -12.756 0.993 -1.273 1.00 0.00 H new ATOM 0 HB2 SER A1006 -11.986 3.073 0.777 1.00 0.00 H new ATOM 0 HB3 SER A1006 -13.575 2.340 0.866 1.00 0.00 H new ATOM 0 HG SER A1006 -11.997 1.167 2.094 1.00 0.00 H new ATOM 1407 N SER A1007 -13.472 3.394 -2.819 1.00 0.00 N ATOM 1408 CA SER A1007 -14.464 4.222 -3.497 1.00 0.00 C ATOM 1409 C SER A1007 -15.875 3.710 -3.226 1.00 0.00 C ATOM 1410 O SER A1007 -16.242 2.614 -3.648 1.00 0.00 O ATOM 1411 CB SER A1007 -14.197 4.243 -5.003 1.00 0.00 C ATOM 1412 OG SER A1007 -14.393 2.961 -5.574 1.00 0.00 O ATOM 0 H SER A1007 -12.610 3.251 -3.346 1.00 0.00 H new ATOM 0 HA SER A1007 -14.383 5.236 -3.107 1.00 0.00 H new ATOM 0 HB2 SER A1007 -14.860 4.963 -5.483 1.00 0.00 H new ATOM 0 HB3 SER A1007 -13.176 4.575 -5.190 1.00 0.00 H new ATOM 0 HG SER A1007 -15.083 2.481 -5.071 1.00 0.00 H new ATOM 1418 N GLY A1008 -16.663 4.513 -2.517 1.00 0.00 N ATOM 1419 CA GLY A1008 -18.025 4.126 -2.201 1.00 0.00 C ATOM 1420 C GLY A1008 -18.866 3.896 -3.441 1.00 0.00 C ATOM 1421 O GLY A1008 -18.817 4.684 -4.386 1.00 0.00 O ATOM 0 H GLY A1008 -16.382 5.425 -2.156 1.00 0.00 H new ATOM 0 HA2 GLY A1008 -18.011 3.216 -1.602 1.00 0.00 H new ATOM 0 HA3 GLY A1008 -18.488 4.902 -1.591 1.00 0.00 H new TER 1425 GLY A1008