USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 687 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 1 GLY N :NH3+ 136:sc= 0.00421 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= -0.0613 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.091 USER MOD Single : A 12 GLN : amide:sc= 1.29 K(o=1.3,f=-3.4!) USER MOD Single : A 24 SER OG : rot 67:sc= 0.71 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.584 K(o=-0.58,f=-1.2) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0.0454 K(o=0.045,f=-3.7!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -171:sc= 1.05 (180deg=0.994) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= 1.22 K(o=1.2,f=-0.015) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.125 3.339 9.238 1.00 0.00 N ATOM 2 CA GLY A 1 5.674 3.015 7.901 1.00 0.00 C ATOM 3 C GLY A 1 5.003 3.836 6.806 1.00 0.00 C ATOM 4 O GLY A 1 3.780 3.996 6.815 1.00 0.00 O ATOM 0 H1 GLY A 1 4.962 2.460 9.769 1.00 0.00 H new ATOM 0 H2 GLY A 1 5.801 3.936 9.756 1.00 0.00 H new ATOM 0 H3 GLY A 1 4.225 3.849 9.130 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.748 3.204 7.892 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.535 1.953 7.697 1.00 0.00 H new ATOM 10 N SER A 2 5.794 4.352 5.858 1.00 0.00 N ATOM 11 CA SER A 2 5.350 5.258 4.778 1.00 0.00 C ATOM 12 C SER A 2 5.965 4.899 3.417 1.00 0.00 C ATOM 13 O SER A 2 7.001 4.232 3.340 1.00 0.00 O ATOM 14 CB SER A 2 5.713 6.713 5.120 1.00 0.00 C ATOM 15 OG SER A 2 5.101 7.126 6.335 1.00 0.00 O ATOM 0 H SER A 2 6.792 4.148 5.815 1.00 0.00 H new ATOM 0 HA SER A 2 4.269 5.143 4.701 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.795 6.810 5.204 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.396 7.369 4.309 1.00 0.00 H new ATOM 0 HG SER A 2 5.351 8.054 6.528 1.00 0.00 H new ATOM 21 N GLU A 3 5.340 5.373 2.332 1.00 0.00 N ATOM 22 CA GLU A 3 5.841 5.230 0.953 1.00 0.00 C ATOM 23 C GLU A 3 7.218 5.897 0.734 1.00 0.00 C ATOM 24 O GLU A 3 7.704 6.688 1.550 1.00 0.00 O ATOM 25 CB GLU A 3 4.801 5.766 -0.049 1.00 0.00 C ATOM 26 CG GLU A 3 3.474 4.989 -0.047 1.00 0.00 C ATOM 27 CD GLU A 3 3.661 3.503 -0.414 1.00 0.00 C ATOM 28 OE1 GLU A 3 3.961 3.197 -1.594 1.00 0.00 O ATOM 29 OE2 GLU A 3 3.510 2.627 0.474 1.00 0.00 O ATOM 0 H GLU A 3 4.455 5.877 2.386 1.00 0.00 H new ATOM 0 HA GLU A 3 5.992 4.165 0.779 1.00 0.00 H new ATOM 0 HB2 GLU A 3 4.598 6.813 0.178 1.00 0.00 H new ATOM 0 HB3 GLU A 3 5.227 5.734 -1.052 1.00 0.00 H new ATOM 0 HG2 GLU A 3 3.015 5.062 0.939 1.00 0.00 H new ATOM 0 HG3 GLU A 3 2.785 5.451 -0.754 1.00 0.00 H new ATOM 36 N THR A 4 7.899 5.536 -0.357 1.00 0.00 N ATOM 37 CA THR A 4 9.280 5.942 -0.706 1.00 0.00 C ATOM 38 C THR A 4 9.484 5.776 -2.226 1.00 0.00 C ATOM 39 O THR A 4 8.707 5.070 -2.879 1.00 0.00 O ATOM 40 CB THR A 4 10.294 5.100 0.111 1.00 0.00 C ATOM 41 OG1 THR A 4 10.121 5.373 1.484 1.00 0.00 O ATOM 42 CG2 THR A 4 11.779 5.366 -0.156 1.00 0.00 C ATOM 0 H THR A 4 7.490 4.922 -1.061 1.00 0.00 H new ATOM 0 HA THR A 4 9.446 6.989 -0.454 1.00 0.00 H new ATOM 0 HB THR A 4 10.077 4.077 -0.195 1.00 0.00 H new ATOM 0 HG1 THR A 4 10.758 4.842 2.006 1.00 0.00 H new ATOM 0 HG21 THR A 4 12.384 4.716 0.476 1.00 0.00 H new ATOM 0 HG22 THR A 4 12.002 5.164 -1.204 1.00 0.00 H new ATOM 0 HG23 THR A 4 12.008 6.407 0.070 1.00 0.00 H new ATOM 50 N ARG A 5 10.521 6.407 -2.799 1.00 0.00 N ATOM 51 CA ARG A 5 10.928 6.209 -4.202 1.00 0.00 C ATOM 52 C ARG A 5 12.103 5.232 -4.314 1.00 0.00 C ATOM 53 O ARG A 5 13.123 5.413 -3.652 1.00 0.00 O ATOM 54 CB ARG A 5 11.188 7.562 -4.895 1.00 0.00 C ATOM 55 CG ARG A 5 12.049 8.540 -4.075 1.00 0.00 C ATOM 56 CD ARG A 5 12.421 9.795 -4.863 1.00 0.00 C ATOM 57 NE ARG A 5 11.229 10.566 -5.281 1.00 0.00 N ATOM 58 CZ ARG A 5 11.148 11.451 -6.261 1.00 0.00 C ATOM 59 NH1 ARG A 5 12.173 11.810 -6.977 1.00 0.00 N ATOM 60 NH2 ARG A 5 10.013 12.010 -6.568 1.00 0.00 N ATOM 0 H ARG A 5 11.107 7.075 -2.298 1.00 0.00 H new ATOM 0 HA ARG A 5 10.103 5.741 -4.739 1.00 0.00 H new ATOM 0 HB2 ARG A 5 11.678 7.379 -5.851 1.00 0.00 H new ATOM 0 HB3 ARG A 5 10.230 8.035 -5.113 1.00 0.00 H new ATOM 0 HG2 ARG A 5 11.507 8.828 -3.174 1.00 0.00 H new ATOM 0 HG3 ARG A 5 12.959 8.035 -3.752 1.00 0.00 H new ATOM 0 HD2 ARG A 5 13.065 10.428 -4.252 1.00 0.00 H new ATOM 0 HD3 ARG A 5 12.996 9.511 -5.745 1.00 0.00 H new ATOM 0 HE ARG A 5 10.373 10.396 -4.754 1.00 0.00 H new ATOM 0 HH11 ARG A 5 13.091 11.405 -6.793 1.00 0.00 H new ATOM 0 HH12 ARG A 5 12.059 12.497 -7.722 1.00 0.00 H new ATOM 0 HH21 ARG A 5 9.168 11.768 -6.050 1.00 0.00 H new ATOM 0 HH22 ARG A 5 9.968 12.690 -7.327 1.00 0.00 H new ATOM 74 N THR A 6 11.973 4.213 -5.168 1.00 0.00 N ATOM 75 CA THR A 6 13.081 3.301 -5.525 1.00 0.00 C ATOM 76 C THR A 6 13.931 3.953 -6.615 1.00 0.00 C ATOM 77 O THR A 6 13.382 4.521 -7.560 1.00 0.00 O ATOM 78 CB THR A 6 12.557 1.923 -5.966 1.00 0.00 C ATOM 79 OG1 THR A 6 11.834 1.323 -4.909 1.00 0.00 O ATOM 80 CG2 THR A 6 13.670 0.936 -6.329 1.00 0.00 C ATOM 0 H THR A 6 11.095 3.990 -5.637 1.00 0.00 H new ATOM 0 HA THR A 6 13.700 3.129 -4.645 1.00 0.00 H new ATOM 0 HB THR A 6 11.943 2.114 -6.846 1.00 0.00 H new ATOM 0 HG1 THR A 6 11.501 0.447 -5.196 1.00 0.00 H new ATOM 0 HG21 THR A 6 13.229 -0.014 -6.631 1.00 0.00 H new ATOM 0 HG22 THR A 6 14.260 1.340 -7.152 1.00 0.00 H new ATOM 0 HG23 THR A 6 14.314 0.779 -5.463 1.00 0.00 H new ATOM 88 N ILE A 7 15.261 3.908 -6.496 1.00 0.00 N ATOM 89 CA ILE A 7 16.232 4.540 -7.404 1.00 0.00 C ATOM 90 C ILE A 7 17.463 3.605 -7.519 1.00 0.00 C ATOM 91 O ILE A 7 17.676 2.764 -6.642 1.00 0.00 O ATOM 92 CB ILE A 7 16.635 5.951 -6.918 1.00 0.00 C ATOM 93 CG1 ILE A 7 15.513 6.660 -6.125 1.00 0.00 C ATOM 94 CG2 ILE A 7 17.032 6.810 -8.144 1.00 0.00 C ATOM 95 CD1 ILE A 7 15.930 8.022 -5.604 1.00 0.00 C ATOM 0 H ILE A 7 15.714 3.408 -5.731 1.00 0.00 H new ATOM 0 HA ILE A 7 15.779 4.677 -8.386 1.00 0.00 H new ATOM 0 HB ILE A 7 17.476 5.835 -6.235 1.00 0.00 H new ATOM 0 HG12 ILE A 7 14.638 6.774 -6.765 1.00 0.00 H new ATOM 0 HG13 ILE A 7 15.215 6.031 -5.286 1.00 0.00 H new ATOM 0 HG21 ILE A 7 17.318 7.808 -7.812 1.00 0.00 H new ATOM 0 HG22 ILE A 7 17.873 6.344 -8.658 1.00 0.00 H new ATOM 0 HG23 ILE A 7 16.185 6.884 -8.826 1.00 0.00 H new ATOM 0 HD11 ILE A 7 15.102 8.471 -5.056 1.00 0.00 H new ATOM 0 HD12 ILE A 7 16.787 7.911 -4.940 1.00 0.00 H new ATOM 0 HD13 ILE A 7 16.202 8.664 -6.442 1.00 0.00 H new ATOM 107 N SER A 8 18.287 3.739 -8.564 1.00 0.00 N ATOM 108 CA SER A 8 19.465 2.877 -8.789 1.00 0.00 C ATOM 109 C SER A 8 20.757 3.510 -8.268 1.00 0.00 C ATOM 110 O SER A 8 21.173 4.555 -8.776 1.00 0.00 O ATOM 111 CB SER A 8 19.616 2.548 -10.280 1.00 0.00 C ATOM 112 OG SER A 8 18.459 1.877 -10.758 1.00 0.00 O ATOM 0 H SER A 8 18.160 4.450 -9.284 1.00 0.00 H new ATOM 0 HA SER A 8 19.295 1.959 -8.227 1.00 0.00 H new ATOM 0 HB2 SER A 8 19.773 3.465 -10.847 1.00 0.00 H new ATOM 0 HB3 SER A 8 20.496 1.924 -10.434 1.00 0.00 H new ATOM 0 HG SER A 8 18.568 1.675 -11.711 1.00 0.00 H new ATOM 118 N SER A 9 21.432 2.867 -7.307 1.00 0.00 N ATOM 119 CA SER A 9 22.764 3.205 -6.763 1.00 0.00 C ATOM 120 C SER A 9 23.910 3.001 -7.776 1.00 0.00 C ATOM 121 O SER A 9 24.872 2.264 -7.547 1.00 0.00 O ATOM 122 CB SER A 9 23.023 2.423 -5.465 1.00 0.00 C ATOM 123 OG SER A 9 21.947 2.593 -4.557 1.00 0.00 O ATOM 0 H SER A 9 21.040 2.041 -6.855 1.00 0.00 H new ATOM 0 HA SER A 9 22.752 4.272 -6.542 1.00 0.00 H new ATOM 0 HB2 SER A 9 23.151 1.364 -5.691 1.00 0.00 H new ATOM 0 HB3 SER A 9 23.951 2.766 -5.006 1.00 0.00 H new ATOM 0 HG SER A 9 22.128 2.087 -3.737 1.00 0.00 H new ATOM 129 N THR A 10 23.777 3.695 -8.903 1.00 0.00 N ATOM 130 CA THR A 10 24.744 3.904 -9.982 1.00 0.00 C ATOM 131 C THR A 10 24.578 5.359 -10.438 1.00 0.00 C ATOM 132 O THR A 10 25.426 6.201 -10.150 1.00 0.00 O ATOM 133 CB THR A 10 24.519 2.925 -11.148 1.00 0.00 C ATOM 134 OG1 THR A 10 23.160 2.870 -11.528 1.00 0.00 O ATOM 135 CG2 THR A 10 24.940 1.503 -10.799 1.00 0.00 C ATOM 0 H THR A 10 22.900 4.175 -9.106 1.00 0.00 H new ATOM 0 HA THR A 10 25.758 3.716 -9.630 1.00 0.00 H new ATOM 0 HB THR A 10 25.133 3.307 -11.964 1.00 0.00 H new ATOM 0 HG1 THR A 10 23.053 2.241 -12.272 1.00 0.00 H new ATOM 0 HG21 THR A 10 24.762 0.851 -11.654 1.00 0.00 H new ATOM 0 HG22 THR A 10 26.000 1.489 -10.547 1.00 0.00 H new ATOM 0 HG23 THR A 10 24.360 1.151 -9.946 1.00 0.00 H new ATOM 143 N ALA A 11 23.398 5.687 -10.982 1.00 0.00 N ATOM 144 CA ALA A 11 22.973 7.045 -11.340 1.00 0.00 C ATOM 145 C ALA A 11 22.672 7.912 -10.101 1.00 0.00 C ATOM 146 O ALA A 11 23.140 9.045 -10.008 1.00 0.00 O ATOM 147 CB ALA A 11 21.757 6.930 -12.267 1.00 0.00 C ATOM 0 H ALA A 11 22.687 4.986 -11.192 1.00 0.00 H new ATOM 0 HA ALA A 11 23.786 7.555 -11.856 1.00 0.00 H new ATOM 0 HB1 ALA A 11 21.419 7.927 -12.549 1.00 0.00 H new ATOM 0 HB2 ALA A 11 22.033 6.373 -13.162 1.00 0.00 H new ATOM 0 HB3 ALA A 11 20.953 6.408 -11.749 1.00 0.00 H new ATOM 153 N GLN A 12 21.956 7.367 -9.106 1.00 0.00 N ATOM 154 CA GLN A 12 21.710 8.052 -7.828 1.00 0.00 C ATOM 155 C GLN A 12 22.969 8.115 -6.946 1.00 0.00 C ATOM 156 O GLN A 12 23.134 9.046 -6.163 1.00 0.00 O ATOM 157 CB GLN A 12 20.527 7.377 -7.117 1.00 0.00 C ATOM 158 CG GLN A 12 20.184 7.947 -5.729 1.00 0.00 C ATOM 159 CD GLN A 12 19.989 9.465 -5.679 1.00 0.00 C ATOM 160 OE1 GLN A 12 19.529 10.119 -6.608 1.00 0.00 O ATOM 161 NE2 GLN A 12 20.332 10.079 -4.570 1.00 0.00 N ATOM 0 H GLN A 12 21.532 6.441 -9.164 1.00 0.00 H new ATOM 0 HA GLN A 12 21.451 9.091 -8.029 1.00 0.00 H new ATOM 0 HB2 GLN A 12 19.646 7.460 -7.754 1.00 0.00 H new ATOM 0 HB3 GLN A 12 20.746 6.314 -7.012 1.00 0.00 H new ATOM 0 HG2 GLN A 12 19.273 7.467 -5.372 1.00 0.00 H new ATOM 0 HG3 GLN A 12 20.980 7.676 -5.035 1.00 0.00 H new ATOM 0 HE21 GLN A 12 20.716 9.546 -3.790 1.00 0.00 H new ATOM 0 HE22 GLN A 12 20.214 11.089 -4.489 1.00 0.00 H new ATOM 170 N GLU A 13 23.888 7.155 -7.088 1.00 0.00 N ATOM 171 CA GLU A 13 25.153 7.169 -6.344 1.00 0.00 C ATOM 172 C GLU A 13 26.081 8.289 -6.859 1.00 0.00 C ATOM 173 O GLU A 13 26.560 9.105 -6.077 1.00 0.00 O ATOM 174 CB GLU A 13 25.770 5.758 -6.411 1.00 0.00 C ATOM 175 CG GLU A 13 27.000 5.564 -5.516 1.00 0.00 C ATOM 176 CD GLU A 13 26.607 5.442 -4.031 1.00 0.00 C ATOM 177 OE1 GLU A 13 26.527 6.476 -3.324 1.00 0.00 O ATOM 178 OE2 GLU A 13 26.375 4.301 -3.561 1.00 0.00 O ATOM 0 H GLU A 13 23.780 6.356 -7.713 1.00 0.00 H new ATOM 0 HA GLU A 13 24.987 7.406 -5.293 1.00 0.00 H new ATOM 0 HB2 GLU A 13 25.011 5.028 -6.129 1.00 0.00 H new ATOM 0 HB3 GLU A 13 26.049 5.545 -7.443 1.00 0.00 H new ATOM 0 HG2 GLU A 13 27.538 4.668 -5.825 1.00 0.00 H new ATOM 0 HG3 GLU A 13 27.681 6.405 -5.645 1.00 0.00 H new ATOM 185 N ARG A 14 26.276 8.387 -8.186 1.00 0.00 N ATOM 186 CA ARG A 14 27.218 9.362 -8.773 1.00 0.00 C ATOM 187 C ARG A 14 26.838 10.814 -8.476 1.00 0.00 C ATOM 188 O ARG A 14 27.735 11.608 -8.200 1.00 0.00 O ATOM 189 CB ARG A 14 27.485 9.133 -10.272 1.00 0.00 C ATOM 190 CG ARG A 14 26.278 9.297 -11.213 1.00 0.00 C ATOM 191 CD ARG A 14 26.631 10.053 -12.500 1.00 0.00 C ATOM 192 NE ARG A 14 26.425 11.509 -12.343 1.00 0.00 N ATOM 193 CZ ARG A 14 25.418 12.227 -12.798 1.00 0.00 C ATOM 194 NH1 ARG A 14 24.410 11.739 -13.462 1.00 0.00 N ATOM 195 NH2 ARG A 14 25.387 13.492 -12.568 1.00 0.00 N ATOM 0 H ARG A 14 25.796 7.805 -8.873 1.00 0.00 H new ATOM 0 HA ARG A 14 28.164 9.176 -8.265 1.00 0.00 H new ATOM 0 HB2 ARG A 14 28.264 9.826 -10.591 1.00 0.00 H new ATOM 0 HB3 ARG A 14 27.883 8.126 -10.399 1.00 0.00 H new ATOM 0 HG2 ARG A 14 25.886 8.313 -11.470 1.00 0.00 H new ATOM 0 HG3 ARG A 14 25.484 9.829 -10.690 1.00 0.00 H new ATOM 0 HD2 ARG A 14 27.670 9.857 -12.766 1.00 0.00 H new ATOM 0 HD3 ARG A 14 26.017 9.683 -13.321 1.00 0.00 H new ATOM 0 HE ARG A 14 27.143 12.014 -11.824 1.00 0.00 H new ATOM 0 HH11 ARG A 14 24.366 10.739 -13.660 1.00 0.00 H new ATOM 0 HH12 ARG A 14 23.665 12.356 -13.784 1.00 0.00 H new ATOM 0 HH21 ARG A 14 26.138 13.932 -12.037 1.00 0.00 H new ATOM 0 HH22 ARG A 14 24.611 14.055 -12.917 1.00 0.00 H new ATOM 209 N VAL A 15 25.534 11.133 -8.421 1.00 0.00 N ATOM 210 CA VAL A 15 25.058 12.479 -8.035 1.00 0.00 C ATOM 211 C VAL A 15 25.414 12.847 -6.591 1.00 0.00 C ATOM 212 O VAL A 15 25.462 14.035 -6.273 1.00 0.00 O ATOM 213 CB VAL A 15 23.568 12.749 -8.315 1.00 0.00 C ATOM 214 CG1 VAL A 15 23.273 12.736 -9.816 1.00 0.00 C ATOM 215 CG2 VAL A 15 22.615 11.780 -7.623 1.00 0.00 C ATOM 0 H VAL A 15 24.785 10.476 -8.639 1.00 0.00 H new ATOM 0 HA VAL A 15 25.610 13.140 -8.703 1.00 0.00 H new ATOM 0 HB VAL A 15 23.387 13.739 -7.897 1.00 0.00 H new ATOM 0 HG11 VAL A 15 22.213 12.930 -9.980 1.00 0.00 H new ATOM 0 HG12 VAL A 15 23.864 13.508 -10.310 1.00 0.00 H new ATOM 0 HG13 VAL A 15 23.532 11.761 -10.229 1.00 0.00 H new ATOM 0 HG21 VAL A 15 21.586 12.040 -7.873 1.00 0.00 H new ATOM 0 HG22 VAL A 15 22.823 10.764 -7.957 1.00 0.00 H new ATOM 0 HG23 VAL A 15 22.753 11.842 -6.544 1.00 0.00 H new ATOM 225 N ASP A 16 25.717 11.882 -5.718 1.00 0.00 N ATOM 226 CA ASP A 16 26.152 12.192 -4.344 1.00 0.00 C ATOM 227 C ASP A 16 27.561 12.823 -4.303 1.00 0.00 C ATOM 228 O ASP A 16 27.771 13.838 -3.635 1.00 0.00 O ATOM 229 CB ASP A 16 26.077 10.923 -3.487 1.00 0.00 C ATOM 230 CG ASP A 16 26.316 11.215 -1.999 1.00 0.00 C ATOM 231 OD1 ASP A 16 25.329 11.515 -1.286 1.00 0.00 O ATOM 232 OD2 ASP A 16 27.476 11.101 -1.534 1.00 0.00 O ATOM 0 H ASP A 16 25.671 10.886 -5.931 1.00 0.00 H new ATOM 0 HA ASP A 16 25.476 12.941 -3.932 1.00 0.00 H new ATOM 0 HB2 ASP A 16 25.099 10.459 -3.612 1.00 0.00 H new ATOM 0 HB3 ASP A 16 26.818 10.205 -3.838 1.00 0.00 H new ATOM 237 N LEU A 17 28.523 12.275 -5.056 1.00 0.00 N ATOM 238 CA LEU A 17 29.938 12.666 -4.975 1.00 0.00 C ATOM 239 C LEU A 17 30.163 14.080 -5.527 1.00 0.00 C ATOM 240 O LEU A 17 30.863 14.896 -4.929 1.00 0.00 O ATOM 241 CB LEU A 17 30.801 11.639 -5.741 1.00 0.00 C ATOM 242 CG LEU A 17 31.055 10.264 -5.087 1.00 0.00 C ATOM 243 CD1 LEU A 17 31.684 10.385 -3.698 1.00 0.00 C ATOM 244 CD2 LEU A 17 29.806 9.390 -4.984 1.00 0.00 C ATOM 0 H LEU A 17 28.341 11.543 -5.743 1.00 0.00 H new ATOM 0 HA LEU A 17 30.234 12.677 -3.926 1.00 0.00 H new ATOM 0 HB2 LEU A 17 30.330 11.465 -6.709 1.00 0.00 H new ATOM 0 HB3 LEU A 17 31.770 12.099 -5.936 1.00 0.00 H new ATOM 0 HG LEU A 17 31.756 9.776 -5.764 1.00 0.00 H new ATOM 0 HD11 LEU A 17 31.842 9.390 -3.282 1.00 0.00 H new ATOM 0 HD12 LEU A 17 32.641 10.902 -3.776 1.00 0.00 H new ATOM 0 HD13 LEU A 17 31.018 10.950 -3.045 1.00 0.00 H new ATOM 0 HD21 LEU A 17 30.064 8.441 -4.514 1.00 0.00 H new ATOM 0 HD22 LEU A 17 29.054 9.900 -4.382 1.00 0.00 H new ATOM 0 HD23 LEU A 17 29.408 9.205 -5.982 1.00 0.00 H new ATOM 256 N GLU A 18 29.499 14.390 -6.635 1.00 0.00 N ATOM 257 CA GLU A 18 29.440 15.732 -7.224 1.00 0.00 C ATOM 258 C GLU A 18 28.723 16.749 -6.313 1.00 0.00 C ATOM 259 O GLU A 18 29.156 17.897 -6.233 1.00 0.00 O ATOM 260 CB GLU A 18 28.833 15.660 -8.633 1.00 0.00 C ATOM 261 CG GLU A 18 27.471 14.971 -8.668 1.00 0.00 C ATOM 262 CD GLU A 18 27.099 14.602 -10.114 1.00 0.00 C ATOM 263 OE1 GLU A 18 27.507 13.539 -10.642 1.00 0.00 O ATOM 264 OE2 GLU A 18 26.338 15.362 -10.744 1.00 0.00 O ATOM 0 H GLU A 18 28.970 13.698 -7.167 1.00 0.00 H new ATOM 0 HA GLU A 18 30.459 16.108 -7.317 1.00 0.00 H new ATOM 0 HB2 GLU A 18 28.732 16.670 -9.030 1.00 0.00 H new ATOM 0 HB3 GLU A 18 29.520 15.126 -9.290 1.00 0.00 H new ATOM 0 HG2 GLU A 18 27.494 14.073 -8.050 1.00 0.00 H new ATOM 0 HG3 GLU A 18 26.711 15.629 -8.246 1.00 0.00 H new ATOM 271 N ALA A 19 27.707 16.345 -5.539 1.00 0.00 N ATOM 272 CA ALA A 19 27.092 17.212 -4.529 1.00 0.00 C ATOM 273 C ALA A 19 28.059 17.543 -3.370 1.00 0.00 C ATOM 274 O ALA A 19 28.110 18.690 -2.927 1.00 0.00 O ATOM 275 CB ALA A 19 25.788 16.562 -4.056 1.00 0.00 C ATOM 0 H ALA A 19 27.292 15.415 -5.595 1.00 0.00 H new ATOM 0 HA ALA A 19 26.858 18.179 -4.975 1.00 0.00 H new ATOM 0 HB1 ALA A 19 25.318 17.195 -3.304 1.00 0.00 H new ATOM 0 HB2 ALA A 19 25.113 16.443 -4.903 1.00 0.00 H new ATOM 0 HB3 ALA A 19 26.004 15.585 -3.624 1.00 0.00 H new ATOM 281 N VAL A 20 28.893 16.588 -2.934 1.00 0.00 N ATOM 282 CA VAL A 20 29.976 16.819 -1.945 1.00 0.00 C ATOM 283 C VAL A 20 31.095 17.688 -2.534 1.00 0.00 C ATOM 284 O VAL A 20 31.605 18.591 -1.863 1.00 0.00 O ATOM 285 CB VAL A 20 30.517 15.476 -1.405 1.00 0.00 C ATOM 286 CG1 VAL A 20 31.714 15.657 -0.461 1.00 0.00 C ATOM 287 CG2 VAL A 20 29.434 14.726 -0.618 1.00 0.00 C ATOM 0 H VAL A 20 28.841 15.622 -3.256 1.00 0.00 H new ATOM 0 HA VAL A 20 29.556 17.370 -1.103 1.00 0.00 H new ATOM 0 HB VAL A 20 30.829 14.913 -2.285 1.00 0.00 H new ATOM 0 HG11 VAL A 20 32.053 14.682 -0.112 1.00 0.00 H new ATOM 0 HG12 VAL A 20 32.525 16.154 -0.993 1.00 0.00 H new ATOM 0 HG13 VAL A 20 31.415 16.264 0.393 1.00 0.00 H new ATOM 0 HG21 VAL A 20 29.839 13.784 -0.248 1.00 0.00 H new ATOM 0 HG22 VAL A 20 29.108 15.336 0.224 1.00 0.00 H new ATOM 0 HG23 VAL A 20 28.584 14.524 -1.270 1.00 0.00 H new ATOM 297 N ARG A 21 31.429 17.505 -3.816 1.00 0.00 N ATOM 298 CA ARG A 21 32.334 18.419 -4.538 1.00 0.00 C ATOM 299 C ARG A 21 31.794 19.843 -4.565 1.00 0.00 C ATOM 300 O ARG A 21 32.537 20.748 -4.218 1.00 0.00 O ATOM 301 CB ARG A 21 32.648 17.896 -5.952 1.00 0.00 C ATOM 302 CG ARG A 21 33.705 16.778 -5.960 1.00 0.00 C ATOM 303 CD ARG A 21 35.118 17.272 -5.605 1.00 0.00 C ATOM 304 NE ARG A 21 35.649 18.212 -6.617 1.00 0.00 N ATOM 305 CZ ARG A 21 36.691 19.014 -6.485 1.00 0.00 C ATOM 306 NH1 ARG A 21 37.405 19.050 -5.395 1.00 0.00 N ATOM 307 NH2 ARG A 21 37.042 19.804 -7.458 1.00 0.00 N ATOM 0 H ARG A 21 31.086 16.729 -4.382 1.00 0.00 H new ATOM 0 HA ARG A 21 33.275 18.449 -3.988 1.00 0.00 H new ATOM 0 HB2 ARG A 21 31.730 17.524 -6.408 1.00 0.00 H new ATOM 0 HB3 ARG A 21 32.998 18.723 -6.570 1.00 0.00 H new ATOM 0 HG2 ARG A 21 33.410 16.004 -5.252 1.00 0.00 H new ATOM 0 HG3 ARG A 21 33.727 16.316 -6.947 1.00 0.00 H new ATOM 0 HD2 ARG A 21 35.096 17.762 -4.632 1.00 0.00 H new ATOM 0 HD3 ARG A 21 35.789 16.418 -5.517 1.00 0.00 H new ATOM 0 HE ARG A 21 35.159 18.244 -7.511 1.00 0.00 H new ATOM 0 HH11 ARG A 21 37.166 18.446 -4.608 1.00 0.00 H new ATOM 0 HH12 ARG A 21 38.203 19.682 -5.329 1.00 0.00 H new ATOM 0 HH21 ARG A 21 36.512 19.807 -8.329 1.00 0.00 H new ATOM 0 HH22 ARG A 21 37.847 20.420 -7.349 1.00 0.00 H new ATOM 321 N LEU A 22 30.508 20.071 -4.827 1.00 0.00 N ATOM 322 CA LEU A 22 29.916 21.411 -4.736 1.00 0.00 C ATOM 323 C LEU A 22 29.830 21.922 -3.305 1.00 0.00 C ATOM 324 O LEU A 22 30.094 23.095 -3.112 1.00 0.00 O ATOM 325 CB LEU A 22 28.586 21.527 -5.484 1.00 0.00 C ATOM 326 CG LEU A 22 28.811 21.918 -6.956 1.00 0.00 C ATOM 327 CD1 LEU A 22 29.281 20.760 -7.829 1.00 0.00 C ATOM 328 CD2 LEU A 22 27.515 22.469 -7.516 1.00 0.00 C ATOM 0 H LEU A 22 29.850 19.343 -5.106 1.00 0.00 H new ATOM 0 HA LEU A 22 30.608 22.076 -5.252 1.00 0.00 H new ATOM 0 HB2 LEU A 22 28.053 20.578 -5.434 1.00 0.00 H new ATOM 0 HB3 LEU A 22 27.956 22.272 -4.999 1.00 0.00 H new ATOM 0 HG LEU A 22 29.606 22.664 -6.972 1.00 0.00 H new ATOM 0 HD11 LEU A 22 29.419 21.109 -8.853 1.00 0.00 H new ATOM 0 HD12 LEU A 22 30.226 20.376 -7.446 1.00 0.00 H new ATOM 0 HD13 LEU A 22 28.534 19.966 -7.814 1.00 0.00 H new ATOM 0 HD21 LEU A 22 27.660 22.750 -8.559 1.00 0.00 H new ATOM 0 HD22 LEU A 22 26.737 21.708 -7.450 1.00 0.00 H new ATOM 0 HD23 LEU A 22 27.214 23.346 -6.942 1.00 0.00 H new ATOM 340 N ALA A 23 29.584 21.093 -2.290 1.00 0.00 N ATOM 341 CA ALA A 23 29.730 21.539 -0.901 1.00 0.00 C ATOM 342 C ALA A 23 31.162 22.058 -0.645 1.00 0.00 C ATOM 343 O ALA A 23 31.353 23.065 0.033 1.00 0.00 O ATOM 344 CB ALA A 23 29.323 20.385 0.016 1.00 0.00 C ATOM 0 H ALA A 23 29.287 20.123 -2.398 1.00 0.00 H new ATOM 0 HA ALA A 23 29.074 22.383 -0.688 1.00 0.00 H new ATOM 0 HB1 ALA A 23 29.424 20.694 1.056 1.00 0.00 H new ATOM 0 HB2 ALA A 23 28.287 20.111 -0.182 1.00 0.00 H new ATOM 0 HB3 ALA A 23 29.968 19.526 -0.171 1.00 0.00 H new ATOM 350 N SER A 24 32.154 21.446 -1.299 1.00 0.00 N ATOM 351 CA SER A 24 33.548 21.912 -1.304 1.00 0.00 C ATOM 352 C SER A 24 33.755 23.199 -2.129 1.00 0.00 C ATOM 353 O SER A 24 34.471 24.087 -1.660 1.00 0.00 O ATOM 354 CB SER A 24 34.510 20.801 -1.760 1.00 0.00 C ATOM 355 OG SER A 24 34.246 19.563 -1.109 1.00 0.00 O ATOM 0 H SER A 24 32.011 20.599 -1.849 1.00 0.00 H new ATOM 0 HA SER A 24 33.784 22.168 -0.271 1.00 0.00 H new ATOM 0 HB2 SER A 24 34.425 20.668 -2.839 1.00 0.00 H new ATOM 0 HB3 SER A 24 35.537 21.105 -1.557 1.00 0.00 H new ATOM 0 HG SER A 24 33.377 19.218 -1.402 1.00 0.00 H new ATOM 361 N ILE A 25 33.119 23.372 -3.307 1.00 0.00 N ATOM 362 CA ILE A 25 33.293 24.633 -4.059 1.00 0.00 C ATOM 363 C ILE A 25 32.558 25.798 -3.367 1.00 0.00 C ATOM 364 O ILE A 25 33.053 26.922 -3.329 1.00 0.00 O ATOM 365 CB ILE A 25 32.891 24.541 -5.541 1.00 0.00 C ATOM 366 CG1 ILE A 25 33.167 23.201 -6.245 1.00 0.00 C ATOM 367 CG2 ILE A 25 33.630 25.649 -6.309 1.00 0.00 C ATOM 368 CD1 ILE A 25 34.586 22.632 -6.186 1.00 0.00 C ATOM 0 H ILE A 25 32.504 22.685 -3.744 1.00 0.00 H new ATOM 0 HA ILE A 25 34.365 24.830 -4.052 1.00 0.00 H new ATOM 0 HB ILE A 25 31.806 24.647 -5.548 1.00 0.00 H new ATOM 0 HG12 ILE A 25 32.492 22.457 -5.821 1.00 0.00 H new ATOM 0 HG13 ILE A 25 32.897 23.315 -7.295 1.00 0.00 H new ATOM 0 HG21 ILE A 25 33.360 25.603 -7.364 1.00 0.00 H new ATOM 0 HG22 ILE A 25 33.349 26.621 -5.905 1.00 0.00 H new ATOM 0 HG23 ILE A 25 34.706 25.509 -6.204 1.00 0.00 H new ATOM 0 HD11 ILE A 25 34.622 21.686 -6.727 1.00 0.00 H new ATOM 0 HD12 ILE A 25 35.280 23.337 -6.643 1.00 0.00 H new ATOM 0 HD13 ILE A 25 34.869 22.466 -5.146 1.00 0.00 H new ATOM 380 N VAL A 26 31.398 25.527 -2.761 1.00 0.00 N ATOM 381 CA VAL A 26 30.628 26.489 -1.959 1.00 0.00 C ATOM 382 C VAL A 26 31.427 26.871 -0.712 1.00 0.00 C ATOM 383 O VAL A 26 31.582 28.059 -0.476 1.00 0.00 O ATOM 384 CB VAL A 26 29.259 25.907 -1.568 1.00 0.00 C ATOM 385 CG1 VAL A 26 28.462 26.853 -0.663 1.00 0.00 C ATOM 386 CG2 VAL A 26 28.379 25.625 -2.801 1.00 0.00 C ATOM 0 H VAL A 26 30.955 24.610 -2.815 1.00 0.00 H new ATOM 0 HA VAL A 26 30.450 27.383 -2.557 1.00 0.00 H new ATOM 0 HB VAL A 26 29.488 24.982 -1.040 1.00 0.00 H new ATOM 0 HG11 VAL A 26 27.503 26.397 -0.415 1.00 0.00 H new ATOM 0 HG12 VAL A 26 29.023 27.039 0.253 1.00 0.00 H new ATOM 0 HG13 VAL A 26 28.292 27.796 -1.182 1.00 0.00 H new ATOM 0 HG21 VAL A 26 27.422 25.215 -2.479 1.00 0.00 H new ATOM 0 HG22 VAL A 26 28.211 26.553 -3.348 1.00 0.00 H new ATOM 0 HG23 VAL A 26 28.881 24.907 -3.450 1.00 0.00 H new ATOM 396 N ASP A 27 32.032 25.936 0.025 1.00 0.00 N ATOM 397 CA ASP A 27 32.959 26.262 1.119 1.00 0.00 C ATOM 398 C ASP A 27 34.093 27.199 0.659 1.00 0.00 C ATOM 399 O ASP A 27 34.384 28.194 1.325 1.00 0.00 O ATOM 400 CB ASP A 27 33.543 24.977 1.714 1.00 0.00 C ATOM 401 CG ASP A 27 34.697 25.287 2.683 1.00 0.00 C ATOM 402 OD1 ASP A 27 34.444 25.874 3.760 1.00 0.00 O ATOM 403 OD2 ASP A 27 35.856 24.927 2.359 1.00 0.00 O ATOM 0 H ASP A 27 31.896 24.935 -0.116 1.00 0.00 H new ATOM 0 HA ASP A 27 32.390 26.791 1.884 1.00 0.00 H new ATOM 0 HB2 ASP A 27 32.761 24.428 2.239 1.00 0.00 H new ATOM 0 HB3 ASP A 27 33.902 24.332 0.912 1.00 0.00 H new ATOM 408 N SER A 28 34.674 26.940 -0.520 1.00 0.00 N ATOM 409 CA SER A 28 35.686 27.823 -1.118 1.00 0.00 C ATOM 410 C SER A 28 35.140 29.246 -1.350 1.00 0.00 C ATOM 411 O SER A 28 35.818 30.232 -1.040 1.00 0.00 O ATOM 412 CB SER A 28 36.226 27.212 -2.418 1.00 0.00 C ATOM 413 OG SER A 28 37.389 27.905 -2.838 1.00 0.00 O ATOM 0 H SER A 28 34.458 26.118 -1.084 1.00 0.00 H new ATOM 0 HA SER A 28 36.511 27.914 -0.412 1.00 0.00 H new ATOM 0 HB2 SER A 28 36.457 26.158 -2.264 1.00 0.00 H new ATOM 0 HB3 SER A 28 35.464 27.261 -3.196 1.00 0.00 H new ATOM 0 HG SER A 28 37.726 27.506 -3.667 1.00 0.00 H new ATOM 419 N ARG A 29 33.878 29.376 -1.789 1.00 0.00 N ATOM 420 CA ARG A 29 33.155 30.658 -1.898 1.00 0.00 C ATOM 421 C ARG A 29 32.833 31.285 -0.535 1.00 0.00 C ATOM 422 O ARG A 29 32.943 32.505 -0.408 1.00 0.00 O ATOM 423 CB ARG A 29 31.878 30.432 -2.730 1.00 0.00 C ATOM 424 CG ARG A 29 31.123 31.708 -3.120 1.00 0.00 C ATOM 425 CD ARG A 29 31.832 32.541 -4.190 1.00 0.00 C ATOM 426 NE ARG A 29 30.970 33.646 -4.661 1.00 0.00 N ATOM 427 CZ ARG A 29 31.208 34.442 -5.689 1.00 0.00 C ATOM 428 NH1 ARG A 29 32.327 34.387 -6.354 1.00 0.00 N ATOM 429 NH2 ARG A 29 30.327 35.316 -6.074 1.00 0.00 N ATOM 0 H ARG A 29 33.318 28.577 -2.085 1.00 0.00 H new ATOM 0 HA ARG A 29 33.805 31.376 -2.398 1.00 0.00 H new ATOM 0 HB2 ARG A 29 32.146 29.894 -3.640 1.00 0.00 H new ATOM 0 HB3 ARG A 29 31.204 29.788 -2.165 1.00 0.00 H new ATOM 0 HG2 ARG A 29 30.131 31.436 -3.482 1.00 0.00 H new ATOM 0 HG3 ARG A 29 30.981 32.321 -2.230 1.00 0.00 H new ATOM 0 HD2 ARG A 29 32.759 32.946 -3.785 1.00 0.00 H new ATOM 0 HD3 ARG A 29 32.104 31.903 -5.031 1.00 0.00 H new ATOM 0 HE ARG A 29 30.107 33.810 -4.142 1.00 0.00 H new ATOM 0 HH11 ARG A 29 33.047 33.717 -6.085 1.00 0.00 H new ATOM 0 HH12 ARG A 29 32.483 35.014 -7.143 1.00 0.00 H new ATOM 0 HH21 ARG A 29 29.437 35.395 -5.581 1.00 0.00 H new ATOM 0 HH22 ARG A 29 30.525 35.923 -6.869 1.00 0.00 H new ATOM 443 N LEU A 30 32.470 30.503 0.485 1.00 0.00 N ATOM 444 CA LEU A 30 32.185 31.020 1.831 1.00 0.00 C ATOM 445 C LEU A 30 33.451 31.568 2.522 1.00 0.00 C ATOM 446 O LEU A 30 33.397 32.619 3.161 1.00 0.00 O ATOM 447 CB LEU A 30 31.492 29.954 2.705 1.00 0.00 C ATOM 448 CG LEU A 30 30.124 29.434 2.219 1.00 0.00 C ATOM 449 CD1 LEU A 30 29.512 28.447 3.222 1.00 0.00 C ATOM 450 CD2 LEU A 30 29.111 30.560 1.988 1.00 0.00 C ATOM 0 H LEU A 30 32.365 29.492 0.403 1.00 0.00 H new ATOM 0 HA LEU A 30 31.497 31.857 1.711 1.00 0.00 H new ATOM 0 HB2 LEU A 30 32.165 29.102 2.798 1.00 0.00 H new ATOM 0 HB3 LEU A 30 31.362 30.368 3.705 1.00 0.00 H new ATOM 0 HG LEU A 30 30.325 28.936 1.270 1.00 0.00 H new ATOM 0 HD11 LEU A 30 28.548 28.100 2.849 1.00 0.00 H new ATOM 0 HD12 LEU A 30 30.180 27.595 3.348 1.00 0.00 H new ATOM 0 HD13 LEU A 30 29.372 28.944 4.182 1.00 0.00 H new ATOM 0 HD21 LEU A 30 28.167 30.136 1.647 1.00 0.00 H new ATOM 0 HD22 LEU A 30 28.950 31.101 2.920 1.00 0.00 H new ATOM 0 HD23 LEU A 30 29.495 31.245 1.232 1.00 0.00 H new ATOM 462 N ILE A 31 34.600 30.908 2.340 1.00 0.00 N ATOM 463 CA ILE A 31 35.918 31.382 2.803 1.00 0.00 C ATOM 464 C ILE A 31 36.392 32.604 1.991 1.00 0.00 C ATOM 465 O ILE A 31 36.983 33.529 2.553 1.00 0.00 O ATOM 466 CB ILE A 31 36.936 30.212 2.749 1.00 0.00 C ATOM 467 CG1 ILE A 31 36.552 29.141 3.798 1.00 0.00 C ATOM 468 CG2 ILE A 31 38.383 30.688 2.991 1.00 0.00 C ATOM 469 CD1 ILE A 31 37.346 27.835 3.682 1.00 0.00 C ATOM 0 H ILE A 31 34.645 30.011 1.857 1.00 0.00 H new ATOM 0 HA ILE A 31 35.835 31.716 3.837 1.00 0.00 H new ATOM 0 HB ILE A 31 36.897 29.785 1.747 1.00 0.00 H new ATOM 0 HG12 ILE A 31 36.700 29.556 4.795 1.00 0.00 H new ATOM 0 HG13 ILE A 31 35.490 28.917 3.700 1.00 0.00 H new ATOM 0 HG21 ILE A 31 39.059 29.835 2.944 1.00 0.00 H new ATOM 0 HG22 ILE A 31 38.660 31.413 2.226 1.00 0.00 H new ATOM 0 HG23 ILE A 31 38.453 31.153 3.974 1.00 0.00 H new ATOM 0 HD11 ILE A 31 37.016 27.139 4.453 1.00 0.00 H new ATOM 0 HD12 ILE A 31 37.179 27.394 2.699 1.00 0.00 H new ATOM 0 HD13 ILE A 31 38.408 28.042 3.811 1.00 0.00 H new ATOM 481 N GLY A 32 36.114 32.623 0.682 1.00 0.00 N ATOM 482 CA GLY A 32 36.540 33.668 -0.247 1.00 0.00 C ATOM 483 C GLY A 32 35.809 34.976 0.027 1.00 0.00 C ATOM 484 O GLY A 32 36.427 35.970 0.419 1.00 0.00 O ATOM 0 H GLY A 32 35.570 31.888 0.230 1.00 0.00 H new ATOM 0 HA2 GLY A 32 37.615 33.823 -0.157 1.00 0.00 H new ATOM 0 HA3 GLY A 32 36.349 33.348 -1.271 1.00 0.00 H new ATOM 488 N THR A 33 34.485 34.962 -0.162 1.00 0.00 N ATOM 489 CA THR A 33 33.640 36.165 -0.068 1.00 0.00 C ATOM 490 C THR A 33 32.439 36.047 0.884 1.00 0.00 C ATOM 491 O THR A 33 32.022 37.052 1.466 1.00 0.00 O ATOM 492 CB THR A 33 33.204 36.577 -1.485 1.00 0.00 C ATOM 493 OG1 THR A 33 32.530 37.816 -1.484 1.00 0.00 O ATOM 494 CG2 THR A 33 32.289 35.535 -2.132 1.00 0.00 C ATOM 0 H THR A 33 33.964 34.114 -0.386 1.00 0.00 H new ATOM 0 HA THR A 33 34.252 36.944 0.387 1.00 0.00 H new ATOM 0 HB THR A 33 34.124 36.659 -2.064 1.00 0.00 H new ATOM 0 HG1 THR A 33 32.269 38.047 -2.400 1.00 0.00 H new ATOM 0 HG21 THR A 33 32.007 35.869 -3.131 1.00 0.00 H new ATOM 0 HG22 THR A 33 32.815 34.583 -2.202 1.00 0.00 H new ATOM 0 HG23 THR A 33 31.393 35.410 -1.524 1.00 0.00 H new ATOM 502 N GLY A 34 31.902 34.839 1.106 1.00 0.00 N ATOM 503 CA GLY A 34 30.857 34.591 2.117 1.00 0.00 C ATOM 504 C GLY A 34 29.422 34.464 1.608 1.00 0.00 C ATOM 505 O GLY A 34 28.507 34.244 2.404 1.00 0.00 O ATOM 0 H GLY A 34 32.178 34.003 0.590 1.00 0.00 H new ATOM 0 HA2 GLY A 34 31.111 33.675 2.650 1.00 0.00 H new ATOM 0 HA3 GLY A 34 30.889 35.402 2.844 1.00 0.00 H new ATOM 509 N SER A 35 29.224 34.523 0.292 1.00 0.00 N ATOM 510 CA SER A 35 27.926 34.374 -0.388 1.00 0.00 C ATOM 511 C SER A 35 28.129 33.694 -1.746 1.00 0.00 C ATOM 512 O SER A 35 29.065 34.036 -2.472 1.00 0.00 O ATOM 513 CB SER A 35 27.260 35.739 -0.622 1.00 0.00 C ATOM 514 OG SER A 35 26.914 36.366 0.603 1.00 0.00 O ATOM 0 H SER A 35 29.991 34.682 -0.361 1.00 0.00 H new ATOM 0 HA SER A 35 27.283 33.769 0.251 1.00 0.00 H new ATOM 0 HB2 SER A 35 27.936 36.384 -1.183 1.00 0.00 H new ATOM 0 HB3 SER A 35 26.365 35.609 -1.231 1.00 0.00 H new ATOM 0 HG SER A 35 26.494 37.232 0.420 1.00 0.00 H new ATOM 520 N VAL A 36 27.270 32.741 -2.108 1.00 0.00 N ATOM 521 CA VAL A 36 27.289 32.049 -3.413 1.00 0.00 C ATOM 522 C VAL A 36 26.160 32.559 -4.312 1.00 0.00 C ATOM 523 O VAL A 36 25.084 32.913 -3.827 1.00 0.00 O ATOM 524 CB VAL A 36 27.257 30.525 -3.207 1.00 0.00 C ATOM 525 CG1 VAL A 36 25.885 29.990 -2.800 1.00 0.00 C ATOM 526 CG2 VAL A 36 27.706 29.786 -4.465 1.00 0.00 C ATOM 0 H VAL A 36 26.523 32.416 -1.495 1.00 0.00 H new ATOM 0 HA VAL A 36 28.220 32.277 -3.932 1.00 0.00 H new ATOM 0 HB VAL A 36 27.949 30.339 -2.386 1.00 0.00 H new ATOM 0 HG11 VAL A 36 25.939 28.909 -2.673 1.00 0.00 H new ATOM 0 HG12 VAL A 36 25.579 30.451 -1.861 1.00 0.00 H new ATOM 0 HG13 VAL A 36 25.157 30.228 -3.576 1.00 0.00 H new ATOM 0 HG21 VAL A 36 27.672 28.711 -4.287 1.00 0.00 H new ATOM 0 HG22 VAL A 36 27.042 30.038 -5.292 1.00 0.00 H new ATOM 0 HG23 VAL A 36 28.725 30.080 -4.716 1.00 0.00 H new ATOM 536 N ASP A 37 26.394 32.601 -5.625 1.00 0.00 N ATOM 537 CA ASP A 37 25.451 33.107 -6.630 1.00 0.00 C ATOM 538 C ASP A 37 25.362 32.136 -7.815 1.00 0.00 C ATOM 539 O ASP A 37 26.282 31.350 -8.050 1.00 0.00 O ATOM 540 CB ASP A 37 25.886 34.501 -7.122 1.00 0.00 C ATOM 541 CG ASP A 37 26.383 35.437 -6.002 1.00 0.00 C ATOM 542 OD1 ASP A 37 27.595 35.407 -5.672 1.00 0.00 O ATOM 543 OD2 ASP A 37 25.566 36.231 -5.474 1.00 0.00 O ATOM 0 H ASP A 37 27.270 32.275 -6.033 1.00 0.00 H new ATOM 0 HA ASP A 37 24.467 33.190 -6.168 1.00 0.00 H new ATOM 0 HB2 ASP A 37 26.679 34.383 -7.861 1.00 0.00 H new ATOM 0 HB3 ASP A 37 25.045 34.974 -7.630 1.00 0.00 H new ATOM 548 N GLU A 38 24.279 32.204 -8.594 1.00 0.00 N ATOM 549 CA GLU A 38 24.031 31.265 -9.701 1.00 0.00 C ATOM 550 C GLU A 38 25.186 31.223 -10.715 1.00 0.00 C ATOM 551 O GLU A 38 25.583 30.146 -11.167 1.00 0.00 O ATOM 552 CB GLU A 38 22.719 31.648 -10.407 1.00 0.00 C ATOM 553 CG GLU A 38 22.057 30.441 -11.082 1.00 0.00 C ATOM 554 CD GLU A 38 20.970 30.859 -12.095 1.00 0.00 C ATOM 555 OE1 GLU A 38 20.152 31.766 -11.797 1.00 0.00 O ATOM 556 OE2 GLU A 38 20.939 30.286 -13.212 1.00 0.00 O ATOM 0 H GLU A 38 23.549 32.907 -8.479 1.00 0.00 H new ATOM 0 HA GLU A 38 23.953 30.265 -9.274 1.00 0.00 H new ATOM 0 HB2 GLU A 38 22.030 32.081 -9.682 1.00 0.00 H new ATOM 0 HB3 GLU A 38 22.920 32.416 -11.154 1.00 0.00 H new ATOM 0 HG2 GLU A 38 22.818 29.850 -11.592 1.00 0.00 H new ATOM 0 HG3 GLU A 38 21.613 29.800 -10.320 1.00 0.00 H new ATOM 563 N ASP A 39 25.793 32.378 -11.013 1.00 0.00 N ATOM 564 CA ASP A 39 26.926 32.490 -11.936 1.00 0.00 C ATOM 565 C ASP A 39 28.246 31.913 -11.410 1.00 0.00 C ATOM 566 O ASP A 39 29.135 31.633 -12.216 1.00 0.00 O ATOM 567 CB ASP A 39 27.114 33.947 -12.379 1.00 0.00 C ATOM 568 CG ASP A 39 25.868 34.509 -13.074 1.00 0.00 C ATOM 569 OD1 ASP A 39 25.695 34.200 -14.279 1.00 0.00 O ATOM 570 OD2 ASP A 39 25.089 35.258 -12.439 1.00 0.00 O ATOM 0 H ASP A 39 25.506 33.272 -10.614 1.00 0.00 H new ATOM 0 HA ASP A 39 26.663 31.868 -12.792 1.00 0.00 H new ATOM 0 HB2 ASP A 39 27.351 34.561 -11.510 1.00 0.00 H new ATOM 0 HB3 ASP A 39 27.965 34.012 -13.056 1.00 0.00 H new ATOM 575 N PHE A 40 28.386 31.684 -10.096 1.00 0.00 N ATOM 576 CA PHE A 40 29.534 30.953 -9.561 1.00 0.00 C ATOM 577 C PHE A 40 29.365 29.433 -9.700 1.00 0.00 C ATOM 578 O PHE A 40 30.357 28.735 -9.896 1.00 0.00 O ATOM 579 CB PHE A 40 29.755 31.373 -8.102 1.00 0.00 C ATOM 580 CG PHE A 40 30.944 30.693 -7.457 1.00 0.00 C ATOM 581 CD1 PHE A 40 32.246 31.178 -7.682 1.00 0.00 C ATOM 582 CD2 PHE A 40 30.750 29.552 -6.660 1.00 0.00 C ATOM 583 CE1 PHE A 40 33.348 30.540 -7.085 1.00 0.00 C ATOM 584 CE2 PHE A 40 31.849 28.917 -6.061 1.00 0.00 C ATOM 585 CZ PHE A 40 33.149 29.416 -6.265 1.00 0.00 C ATOM 0 H PHE A 40 27.719 31.995 -9.390 1.00 0.00 H new ATOM 0 HA PHE A 40 30.419 31.208 -10.144 1.00 0.00 H new ATOM 0 HB2 PHE A 40 29.896 32.453 -8.059 1.00 0.00 H new ATOM 0 HB3 PHE A 40 28.858 31.145 -7.526 1.00 0.00 H new ATOM 0 HD1 PHE A 40 32.399 32.041 -8.314 1.00 0.00 H new ATOM 0 HD2 PHE A 40 29.754 29.163 -6.508 1.00 0.00 H new ATOM 0 HE1 PHE A 40 34.347 30.914 -7.257 1.00 0.00 H new ATOM 0 HE2 PHE A 40 31.697 28.045 -5.443 1.00 0.00 H new ATOM 0 HZ PHE A 40 33.993 28.936 -5.792 1.00 0.00 H new ATOM 595 N LEU A 41 28.126 28.920 -9.625 1.00 0.00 N ATOM 596 CA LEU A 41 27.802 27.482 -9.574 1.00 0.00 C ATOM 597 C LEU A 41 27.569 26.835 -10.942 1.00 0.00 C ATOM 598 O LEU A 41 27.928 25.670 -11.118 1.00 0.00 O ATOM 599 CB LEU A 41 26.589 27.288 -8.643 1.00 0.00 C ATOM 600 CG LEU A 41 26.901 27.505 -7.153 1.00 0.00 C ATOM 601 CD1 LEU A 41 25.625 27.297 -6.339 1.00 0.00 C ATOM 602 CD2 LEU A 41 27.971 26.544 -6.623 1.00 0.00 C ATOM 0 H LEU A 41 27.296 29.512 -9.597 1.00 0.00 H new ATOM 0 HA LEU A 41 28.676 26.964 -9.180 1.00 0.00 H new ATOM 0 HB2 LEU A 41 25.800 27.978 -8.942 1.00 0.00 H new ATOM 0 HB3 LEU A 41 26.198 26.280 -8.778 1.00 0.00 H new ATOM 0 HG LEU A 41 27.283 28.521 -7.051 1.00 0.00 H new ATOM 0 HD11 LEU A 41 25.839 27.449 -5.281 1.00 0.00 H new ATOM 0 HD12 LEU A 41 24.867 28.010 -6.662 1.00 0.00 H new ATOM 0 HD13 LEU A 41 25.257 26.282 -6.492 1.00 0.00 H new ATOM 0 HD21 LEU A 41 28.149 26.745 -5.567 1.00 0.00 H new ATOM 0 HD22 LEU A 41 27.629 25.516 -6.745 1.00 0.00 H new ATOM 0 HD23 LEU A 41 28.897 26.687 -7.180 1.00 0.00 H new ATOM 614 N ARG A 42 27.066 27.573 -11.942 1.00 0.00 N ATOM 615 CA ARG A 42 26.935 27.045 -13.322 1.00 0.00 C ATOM 616 C ARG A 42 28.271 26.597 -13.936 1.00 0.00 C ATOM 617 O ARG A 42 28.301 25.714 -14.786 1.00 0.00 O ATOM 618 CB ARG A 42 26.193 28.055 -14.218 1.00 0.00 C ATOM 619 CG ARG A 42 26.900 29.402 -14.432 1.00 0.00 C ATOM 620 CD ARG A 42 26.023 30.288 -15.333 1.00 0.00 C ATOM 621 NE ARG A 42 26.503 31.680 -15.421 1.00 0.00 N ATOM 622 CZ ARG A 42 27.500 32.171 -16.130 1.00 0.00 C ATOM 623 NH1 ARG A 42 28.288 31.434 -16.863 1.00 0.00 N ATOM 624 NH2 ARG A 42 27.697 33.453 -16.098 1.00 0.00 N ATOM 0 H ARG A 42 26.742 28.534 -11.829 1.00 0.00 H new ATOM 0 HA ARG A 42 26.335 26.137 -13.258 1.00 0.00 H new ATOM 0 HB2 ARG A 42 26.026 27.595 -15.192 1.00 0.00 H new ATOM 0 HB3 ARG A 42 25.212 28.246 -13.783 1.00 0.00 H new ATOM 0 HG2 ARG A 42 27.073 29.893 -13.474 1.00 0.00 H new ATOM 0 HG3 ARG A 42 27.876 29.246 -14.892 1.00 0.00 H new ATOM 0 HD2 ARG A 42 25.990 29.858 -16.334 1.00 0.00 H new ATOM 0 HD3 ARG A 42 25.002 30.286 -14.951 1.00 0.00 H new ATOM 0 HE ARG A 42 25.992 32.357 -14.854 1.00 0.00 H new ATOM 0 HH11 ARG A 42 28.147 30.425 -16.907 1.00 0.00 H new ATOM 0 HH12 ARG A 42 29.045 31.867 -17.392 1.00 0.00 H new ATOM 0 HH21 ARG A 42 27.089 34.049 -15.536 1.00 0.00 H new ATOM 0 HH22 ARG A 42 28.460 33.865 -16.635 1.00 0.00 H new ATOM 638 N GLU A 43 29.381 27.147 -13.442 1.00 0.00 N ATOM 639 CA GLU A 43 30.751 26.776 -13.838 1.00 0.00 C ATOM 640 C GLU A 43 31.299 25.524 -13.130 1.00 0.00 C ATOM 641 O GLU A 43 32.382 25.054 -13.481 1.00 0.00 O ATOM 642 CB GLU A 43 31.711 27.953 -13.579 1.00 0.00 C ATOM 643 CG GLU A 43 31.184 29.290 -14.108 1.00 0.00 C ATOM 644 CD GLU A 43 32.325 30.308 -14.307 1.00 0.00 C ATOM 645 OE1 GLU A 43 32.954 30.737 -13.309 1.00 0.00 O ATOM 646 OE2 GLU A 43 32.607 30.683 -15.473 1.00 0.00 O ATOM 0 H GLU A 43 29.357 27.883 -12.736 1.00 0.00 H new ATOM 0 HA GLU A 43 30.693 26.537 -14.900 1.00 0.00 H new ATOM 0 HB2 GLU A 43 31.889 28.039 -12.507 1.00 0.00 H new ATOM 0 HB3 GLU A 43 32.672 27.739 -14.046 1.00 0.00 H new ATOM 0 HG2 GLU A 43 30.668 29.130 -15.055 1.00 0.00 H new ATOM 0 HG3 GLU A 43 30.451 29.695 -13.410 1.00 0.00 H new ATOM 653 N GLN A 44 30.584 24.968 -12.141 1.00 0.00 N ATOM 654 CA GLN A 44 31.096 23.910 -11.245 1.00 0.00 C ATOM 655 C GLN A 44 30.392 22.566 -11.421 1.00 0.00 C ATOM 656 O GLN A 44 30.925 21.542 -11.001 1.00 0.00 O ATOM 657 CB GLN A 44 30.935 24.321 -9.770 1.00 0.00 C ATOM 658 CG GLN A 44 31.363 25.755 -9.468 1.00 0.00 C ATOM 659 CD GLN A 44 32.806 26.102 -9.831 1.00 0.00 C ATOM 660 OE1 GLN A 44 33.681 25.265 -10.012 1.00 0.00 O ATOM 661 NE2 GLN A 44 33.104 27.377 -9.904 1.00 0.00 N ATOM 0 H GLN A 44 29.623 25.240 -11.935 1.00 0.00 H new ATOM 0 HA GLN A 44 32.145 23.792 -11.517 1.00 0.00 H new ATOM 0 HB2 GLN A 44 29.891 24.197 -9.482 1.00 0.00 H new ATOM 0 HB3 GLN A 44 31.519 23.641 -9.150 1.00 0.00 H new ATOM 0 HG2 GLN A 44 30.699 26.434 -10.003 1.00 0.00 H new ATOM 0 HG3 GLN A 44 31.220 25.942 -8.404 1.00 0.00 H new ATOM 0 HE21 GLN A 44 32.380 28.079 -9.754 1.00 0.00 H new ATOM 0 HE22 GLN A 44 34.060 27.666 -10.111 1.00 0.00 H new ATOM 670 N ILE A 45 29.186 22.575 -12.004 1.00 0.00 N ATOM 671 CA ILE A 45 28.324 21.392 -12.106 1.00 0.00 C ATOM 672 C ILE A 45 28.998 20.216 -12.815 1.00 0.00 C ATOM 673 O ILE A 45 29.167 19.159 -12.209 1.00 0.00 O ATOM 674 CB ILE A 45 26.974 21.706 -12.787 1.00 0.00 C ATOM 675 CG1 ILE A 45 26.977 22.843 -13.834 1.00 0.00 C ATOM 676 CG2 ILE A 45 25.937 22.010 -11.707 1.00 0.00 C ATOM 677 CD1 ILE A 45 25.756 22.817 -14.764 1.00 0.00 C ATOM 0 H ILE A 45 28.778 23.412 -12.422 1.00 0.00 H new ATOM 0 HA ILE A 45 28.134 21.095 -11.075 1.00 0.00 H new ATOM 0 HB ILE A 45 26.733 20.812 -13.362 1.00 0.00 H new ATOM 0 HG12 ILE A 45 27.011 23.802 -13.318 1.00 0.00 H new ATOM 0 HG13 ILE A 45 27.884 22.772 -14.435 1.00 0.00 H new ATOM 0 HG21 ILE A 45 24.979 22.234 -12.176 1.00 0.00 H new ATOM 0 HG22 ILE A 45 25.828 21.145 -11.053 1.00 0.00 H new ATOM 0 HG23 ILE A 45 26.263 22.869 -11.121 1.00 0.00 H new ATOM 0 HD11 ILE A 45 25.822 23.642 -15.474 1.00 0.00 H new ATOM 0 HD12 ILE A 45 25.732 21.872 -15.307 1.00 0.00 H new ATOM 0 HD13 ILE A 45 24.846 22.919 -14.173 1.00 0.00 H new ATOM 689 N ARG A 46 29.348 20.380 -14.099 1.00 0.00 N ATOM 690 CA ARG A 46 30.046 19.421 -14.978 1.00 0.00 C ATOM 691 C ARG A 46 29.331 18.103 -15.306 1.00 0.00 C ATOM 692 O ARG A 46 29.634 17.488 -16.327 1.00 0.00 O ATOM 693 CB ARG A 46 31.510 19.189 -14.540 1.00 0.00 C ATOM 694 CG ARG A 46 32.332 20.447 -14.216 1.00 0.00 C ATOM 695 CD ARG A 46 32.427 21.459 -15.365 1.00 0.00 C ATOM 696 NE ARG A 46 33.144 22.675 -14.929 1.00 0.00 N ATOM 697 CZ ARG A 46 34.441 22.923 -14.972 1.00 0.00 C ATOM 698 NH1 ARG A 46 35.303 22.090 -15.485 1.00 0.00 N ATOM 699 NH2 ARG A 46 34.882 24.041 -14.475 1.00 0.00 N ATOM 0 H ARG A 46 29.137 21.249 -14.589 1.00 0.00 H new ATOM 0 HA ARG A 46 30.034 19.939 -15.937 1.00 0.00 H new ATOM 0 HB2 ARG A 46 31.506 18.547 -13.659 1.00 0.00 H new ATOM 0 HB3 ARG A 46 32.021 18.641 -15.332 1.00 0.00 H new ATOM 0 HG2 ARG A 46 31.891 20.940 -13.350 1.00 0.00 H new ATOM 0 HG3 ARG A 46 33.340 20.144 -13.932 1.00 0.00 H new ATOM 0 HD2 ARG A 46 32.945 21.009 -16.212 1.00 0.00 H new ATOM 0 HD3 ARG A 46 31.427 21.723 -15.708 1.00 0.00 H new ATOM 0 HE ARG A 46 32.562 23.420 -14.545 1.00 0.00 H new ATOM 0 HH11 ARG A 46 34.985 21.203 -15.876 1.00 0.00 H new ATOM 0 HH12 ARG A 46 36.295 22.325 -15.496 1.00 0.00 H new ATOM 0 HH21 ARG A 46 34.230 24.708 -14.062 1.00 0.00 H new ATOM 0 HH22 ARG A 46 35.880 24.251 -14.499 1.00 0.00 H new ATOM 713 N ASP A 47 28.345 17.714 -14.504 1.00 0.00 N ATOM 714 CA ASP A 47 27.565 16.468 -14.655 1.00 0.00 C ATOM 715 C ASP A 47 26.114 16.611 -14.169 1.00 0.00 C ATOM 716 O ASP A 47 25.187 16.076 -14.784 1.00 0.00 O ATOM 717 CB ASP A 47 28.225 15.303 -13.895 1.00 0.00 C ATOM 718 CG ASP A 47 29.693 15.043 -14.273 1.00 0.00 C ATOM 719 OD1 ASP A 47 29.933 14.288 -15.246 1.00 0.00 O ATOM 720 OD2 ASP A 47 30.609 15.544 -13.576 1.00 0.00 O ATOM 0 H ASP A 47 28.049 18.269 -13.701 1.00 0.00 H new ATOM 0 HA ASP A 47 27.550 16.257 -15.724 1.00 0.00 H new ATOM 0 HB2 ASP A 47 28.169 15.506 -12.826 1.00 0.00 H new ATOM 0 HB3 ASP A 47 27.650 14.395 -14.078 1.00 0.00 H new ATOM 725 N ALA A 48 25.907 17.394 -13.109 1.00 0.00 N ATOM 726 CA ALA A 48 24.595 17.775 -12.597 1.00 0.00 C ATOM 727 C ALA A 48 23.880 18.708 -13.585 1.00 0.00 C ATOM 728 O ALA A 48 24.517 19.540 -14.235 1.00 0.00 O ATOM 729 CB ALA A 48 24.814 18.456 -11.243 1.00 0.00 C ATOM 0 H ALA A 48 26.674 17.792 -12.568 1.00 0.00 H new ATOM 0 HA ALA A 48 23.957 16.900 -12.475 1.00 0.00 H new ATOM 0 HB1 ALA A 48 23.852 18.756 -10.827 1.00 0.00 H new ATOM 0 HB2 ALA A 48 25.303 17.761 -10.561 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.443 19.336 -11.376 1.00 0.00 H new ATOM 735 N ARG A 49 22.549 18.598 -13.678 1.00 0.00 N ATOM 736 CA ARG A 49 21.737 19.483 -14.535 1.00 0.00 C ATOM 737 C ARG A 49 21.412 20.799 -13.832 1.00 0.00 C ATOM 738 O ARG A 49 21.537 21.867 -14.427 1.00 0.00 O ATOM 739 CB ARG A 49 20.474 18.735 -15.008 1.00 0.00 C ATOM 740 CG ARG A 49 20.230 18.837 -16.521 1.00 0.00 C ATOM 741 CD ARG A 49 21.391 18.346 -17.420 1.00 0.00 C ATOM 742 NE ARG A 49 22.227 17.274 -16.814 1.00 0.00 N ATOM 743 CZ ARG A 49 21.931 16.002 -16.613 1.00 0.00 C ATOM 744 NH1 ARG A 49 20.835 15.463 -17.062 1.00 0.00 N ATOM 745 NH2 ARG A 49 22.732 15.249 -15.921 1.00 0.00 N ATOM 0 H ARG A 49 22.005 17.902 -13.168 1.00 0.00 H new ATOM 0 HA ARG A 49 22.316 19.751 -15.419 1.00 0.00 H new ATOM 0 HB2 ARG A 49 20.560 17.684 -14.732 1.00 0.00 H new ATOM 0 HB3 ARG A 49 19.607 19.133 -14.481 1.00 0.00 H new ATOM 0 HG2 ARG A 49 19.336 18.263 -16.766 1.00 0.00 H new ATOM 0 HG3 ARG A 49 20.018 19.877 -16.768 1.00 0.00 H new ATOM 0 HD2 ARG A 49 20.977 17.980 -18.359 1.00 0.00 H new ATOM 0 HD3 ARG A 49 22.030 19.195 -17.663 1.00 0.00 H new ATOM 0 HE ARG A 49 23.158 17.561 -16.512 1.00 0.00 H new ATOM 0 HH11 ARG A 49 20.169 16.027 -17.590 1.00 0.00 H new ATOM 0 HH12 ARG A 49 20.642 14.477 -16.886 1.00 0.00 H new ATOM 0 HH21 ARG A 49 23.590 15.640 -15.532 1.00 0.00 H new ATOM 0 HH22 ARG A 49 22.503 14.267 -15.766 1.00 0.00 H new ATOM 759 N TYR A 50 21.052 20.711 -12.548 1.00 0.00 N ATOM 760 CA TYR A 50 20.637 21.827 -11.704 1.00 0.00 C ATOM 761 C TYR A 50 21.364 21.736 -10.352 1.00 0.00 C ATOM 762 O TYR A 50 21.271 20.706 -9.680 1.00 0.00 O ATOM 763 CB TYR A 50 19.101 21.750 -11.506 1.00 0.00 C ATOM 764 CG TYR A 50 18.285 21.216 -12.679 1.00 0.00 C ATOM 765 CD1 TYR A 50 18.390 21.812 -13.950 1.00 0.00 C ATOM 766 CD2 TYR A 50 17.404 20.129 -12.499 1.00 0.00 C ATOM 767 CE1 TYR A 50 17.639 21.324 -15.036 1.00 0.00 C ATOM 768 CE2 TYR A 50 16.658 19.629 -13.584 1.00 0.00 C ATOM 769 CZ TYR A 50 16.774 20.224 -14.856 1.00 0.00 C ATOM 770 OH TYR A 50 16.044 19.741 -15.898 1.00 0.00 O ATOM 0 H TYR A 50 21.043 19.821 -12.051 1.00 0.00 H new ATOM 0 HA TYR A 50 20.891 22.779 -12.171 1.00 0.00 H new ATOM 0 HB2 TYR A 50 18.901 21.122 -10.638 1.00 0.00 H new ATOM 0 HB3 TYR A 50 18.738 22.750 -11.266 1.00 0.00 H new ATOM 0 HD1 TYR A 50 19.053 22.652 -14.093 1.00 0.00 H new ATOM 0 HD2 TYR A 50 17.301 19.678 -11.523 1.00 0.00 H new ATOM 0 HE1 TYR A 50 17.725 21.791 -16.006 1.00 0.00 H new ATOM 0 HE2 TYR A 50 15.996 18.788 -13.441 1.00 0.00 H new ATOM 0 HH TYR A 50 15.504 18.981 -15.595 1.00 0.00 H new ATOM 780 N ALA A 51 22.107 22.769 -9.939 1.00 0.00 N ATOM 781 CA ALA A 51 22.637 22.860 -8.570 1.00 0.00 C ATOM 782 C ALA A 51 21.719 23.768 -7.732 1.00 0.00 C ATOM 783 O ALA A 51 21.254 24.796 -8.223 1.00 0.00 O ATOM 784 CB ALA A 51 24.087 23.357 -8.602 1.00 0.00 C ATOM 0 H ALA A 51 22.357 23.558 -10.535 1.00 0.00 H new ATOM 0 HA ALA A 51 22.650 21.877 -8.100 1.00 0.00 H new ATOM 0 HB1 ALA A 51 24.472 23.422 -7.584 1.00 0.00 H new ATOM 0 HB2 ALA A 51 24.698 22.661 -9.177 1.00 0.00 H new ATOM 0 HB3 ALA A 51 24.124 24.342 -9.067 1.00 0.00 H new ATOM 790 N VAL A 52 21.437 23.400 -6.483 1.00 0.00 N ATOM 791 CA VAL A 52 20.465 24.073 -5.601 1.00 0.00 C ATOM 792 C VAL A 52 21.089 24.297 -4.222 1.00 0.00 C ATOM 793 O VAL A 52 21.807 23.432 -3.714 1.00 0.00 O ATOM 794 CB VAL A 52 19.151 23.265 -5.536 1.00 0.00 C ATOM 795 CG1 VAL A 52 18.159 23.823 -4.504 1.00 0.00 C ATOM 796 CG2 VAL A 52 18.465 23.239 -6.909 1.00 0.00 C ATOM 0 H VAL A 52 21.889 22.602 -6.037 1.00 0.00 H new ATOM 0 HA VAL A 52 20.211 25.052 -6.007 1.00 0.00 H new ATOM 0 HB VAL A 52 19.431 22.257 -5.229 1.00 0.00 H new ATOM 0 HG11 VAL A 52 17.254 23.215 -4.503 1.00 0.00 H new ATOM 0 HG12 VAL A 52 18.613 23.800 -3.513 1.00 0.00 H new ATOM 0 HG13 VAL A 52 17.905 24.851 -4.763 1.00 0.00 H new ATOM 0 HG21 VAL A 52 17.541 22.665 -6.843 1.00 0.00 H new ATOM 0 HG22 VAL A 52 18.238 24.258 -7.222 1.00 0.00 H new ATOM 0 HG23 VAL A 52 19.129 22.775 -7.639 1.00 0.00 H new ATOM 806 N ILE A 53 20.826 25.457 -3.610 1.00 0.00 N ATOM 807 CA ILE A 53 21.514 25.928 -2.398 1.00 0.00 C ATOM 808 C ILE A 53 20.598 26.192 -1.202 1.00 0.00 C ATOM 809 O ILE A 53 19.622 26.932 -1.296 1.00 0.00 O ATOM 810 CB ILE A 53 22.379 27.162 -2.779 1.00 0.00 C ATOM 811 CG1 ILE A 53 23.827 26.724 -3.063 1.00 0.00 C ATOM 812 CG2 ILE A 53 22.365 28.359 -1.798 1.00 0.00 C ATOM 813 CD1 ILE A 53 24.556 26.160 -1.836 1.00 0.00 C ATOM 0 H ILE A 53 20.117 26.108 -3.947 1.00 0.00 H new ATOM 0 HA ILE A 53 22.152 25.120 -2.039 1.00 0.00 H new ATOM 0 HB ILE A 53 21.896 27.555 -3.674 1.00 0.00 H new ATOM 0 HG12 ILE A 53 23.821 25.969 -3.849 1.00 0.00 H new ATOM 0 HG13 ILE A 53 24.386 27.578 -3.446 1.00 0.00 H new ATOM 0 HG21 ILE A 53 23.008 29.151 -2.181 1.00 0.00 H new ATOM 0 HG22 ILE A 53 21.347 28.735 -1.697 1.00 0.00 H new ATOM 0 HG23 ILE A 53 22.730 28.035 -0.823 1.00 0.00 H new ATOM 0 HD11 ILE A 53 25.570 25.873 -2.115 1.00 0.00 H new ATOM 0 HD12 ILE A 53 24.596 26.920 -1.055 1.00 0.00 H new ATOM 0 HD13 ILE A 53 24.021 25.286 -1.465 1.00 0.00 H new ATOM 825 N ARG A 54 21.004 25.658 -0.043 1.00 0.00 N ATOM 826 CA ARG A 54 20.436 25.921 1.288 1.00 0.00 C ATOM 827 C ARG A 54 21.558 26.299 2.269 1.00 0.00 C ATOM 828 O ARG A 54 22.023 25.480 3.057 1.00 0.00 O ATOM 829 CB ARG A 54 19.673 24.668 1.765 1.00 0.00 C ATOM 830 CG ARG A 54 18.561 24.135 0.846 1.00 0.00 C ATOM 831 CD ARG A 54 17.365 25.082 0.746 1.00 0.00 C ATOM 832 NE ARG A 54 16.324 24.533 -0.149 1.00 0.00 N ATOM 833 CZ ARG A 54 15.047 24.876 -0.194 1.00 0.00 C ATOM 834 NH1 ARG A 54 14.545 25.787 0.589 1.00 0.00 N ATOM 835 NH2 ARG A 54 14.240 24.302 -1.040 1.00 0.00 N ATOM 0 H ARG A 54 21.779 24.996 -0.005 1.00 0.00 H new ATOM 0 HA ARG A 54 19.739 26.757 1.241 1.00 0.00 H new ATOM 0 HB2 ARG A 54 20.398 23.868 1.919 1.00 0.00 H new ATOM 0 HB3 ARG A 54 19.232 24.890 2.737 1.00 0.00 H new ATOM 0 HG2 ARG A 54 18.970 23.968 -0.151 1.00 0.00 H new ATOM 0 HG3 ARG A 54 18.222 23.168 1.218 1.00 0.00 H new ATOM 0 HD2 ARG A 54 16.945 25.248 1.738 1.00 0.00 H new ATOM 0 HD3 ARG A 54 17.695 26.052 0.373 1.00 0.00 H new ATOM 0 HE ARG A 54 16.623 23.810 -0.804 1.00 0.00 H new ATOM 0 HH11 ARG A 54 15.142 26.263 1.266 1.00 0.00 H new ATOM 0 HH12 ARG A 54 13.555 26.025 0.525 1.00 0.00 H new ATOM 0 HH21 ARG A 54 14.591 23.583 -1.673 1.00 0.00 H new ATOM 0 HH22 ARG A 54 13.257 24.571 -1.070 1.00 0.00 H new ATOM 849 N ILE A 55 22.031 27.541 2.209 1.00 0.00 N ATOM 850 CA ILE A 55 22.953 28.115 3.216 1.00 0.00 C ATOM 851 C ILE A 55 22.136 28.930 4.240 1.00 0.00 C ATOM 852 O ILE A 55 21.425 29.850 3.824 1.00 0.00 O ATOM 853 CB ILE A 55 24.030 29.001 2.544 1.00 0.00 C ATOM 854 CG1 ILE A 55 24.952 28.201 1.603 1.00 0.00 C ATOM 855 CG2 ILE A 55 24.908 29.706 3.598 1.00 0.00 C ATOM 856 CD1 ILE A 55 25.450 29.044 0.436 1.00 0.00 C ATOM 0 H ILE A 55 21.791 28.191 1.460 1.00 0.00 H new ATOM 0 HA ILE A 55 23.472 27.304 3.728 1.00 0.00 H new ATOM 0 HB ILE A 55 23.482 29.737 1.956 1.00 0.00 H new ATOM 0 HG12 ILE A 55 25.805 27.823 2.167 1.00 0.00 H new ATOM 0 HG13 ILE A 55 24.414 27.334 1.220 1.00 0.00 H new ATOM 0 HG21 ILE A 55 25.655 30.321 3.097 1.00 0.00 H new ATOM 0 HG22 ILE A 55 24.283 30.337 4.229 1.00 0.00 H new ATOM 0 HG23 ILE A 55 25.408 28.959 4.214 1.00 0.00 H new ATOM 0 HD11 ILE A 55 26.096 28.439 -0.200 1.00 0.00 H new ATOM 0 HD12 ILE A 55 24.599 29.400 -0.145 1.00 0.00 H new ATOM 0 HD13 ILE A 55 26.012 29.897 0.817 1.00 0.00 H new ATOM 868 N PRO A 56 22.244 28.669 5.558 1.00 0.00 N ATOM 869 CA PRO A 56 21.619 29.509 6.581 1.00 0.00 C ATOM 870 C PRO A 56 22.104 30.969 6.521 1.00 0.00 C ATOM 871 O PRO A 56 23.302 31.237 6.402 1.00 0.00 O ATOM 872 CB PRO A 56 21.952 28.851 7.925 1.00 0.00 C ATOM 873 CG PRO A 56 22.198 27.389 7.554 1.00 0.00 C ATOM 874 CD PRO A 56 22.843 27.493 6.174 1.00 0.00 C ATOM 0 HA PRO A 56 20.542 29.570 6.425 1.00 0.00 H new ATOM 0 HB2 PRO A 56 22.831 29.302 8.386 1.00 0.00 H new ATOM 0 HB3 PRO A 56 21.132 28.952 8.636 1.00 0.00 H new ATOM 0 HG2 PRO A 56 22.854 26.895 8.271 1.00 0.00 H new ATOM 0 HG3 PRO A 56 21.270 26.818 7.525 1.00 0.00 H new ATOM 0 HD2 PRO A 56 23.925 27.598 6.252 1.00 0.00 H new ATOM 0 HD3 PRO A 56 22.652 26.598 5.582 1.00 0.00 H new ATOM 882 N GLY A 57 21.173 31.922 6.611 1.00 0.00 N ATOM 883 CA GLY A 57 21.451 33.365 6.623 1.00 0.00 C ATOM 884 C GLY A 57 21.550 34.042 5.247 1.00 0.00 C ATOM 885 O GLY A 57 21.769 35.255 5.197 1.00 0.00 O ATOM 0 H GLY A 57 20.178 31.708 6.679 1.00 0.00 H new ATOM 0 HA2 GLY A 57 20.667 33.861 7.195 1.00 0.00 H new ATOM 0 HA3 GLY A 57 22.387 33.530 7.156 1.00 0.00 H new ATOM 889 N GLN A 58 21.377 33.308 4.138 1.00 0.00 N ATOM 890 CA GLN A 58 21.327 33.871 2.775 1.00 0.00 C ATOM 891 C GLN A 58 20.248 33.198 1.896 1.00 0.00 C ATOM 892 O GLN A 58 19.846 32.066 2.186 1.00 0.00 O ATOM 893 CB GLN A 58 22.745 33.844 2.170 1.00 0.00 C ATOM 894 CG GLN A 58 23.220 32.503 1.606 1.00 0.00 C ATOM 895 CD GLN A 58 24.702 32.578 1.220 1.00 0.00 C ATOM 896 OE1 GLN A 58 25.090 32.470 0.064 1.00 0.00 O ATOM 897 NE2 GLN A 58 25.586 32.788 2.176 1.00 0.00 N ATOM 0 H GLN A 58 21.266 32.294 4.160 1.00 0.00 H new ATOM 0 HA GLN A 58 21.008 34.912 2.821 1.00 0.00 H new ATOM 0 HB2 GLN A 58 22.790 34.585 1.372 1.00 0.00 H new ATOM 0 HB3 GLN A 58 23.450 34.160 2.939 1.00 0.00 H new ATOM 0 HG2 GLN A 58 23.070 31.717 2.346 1.00 0.00 H new ATOM 0 HG3 GLN A 58 22.624 32.237 0.733 1.00 0.00 H new ATOM 0 HE21 GLN A 58 25.278 32.880 3.144 1.00 0.00 H new ATOM 0 HE22 GLN A 58 26.578 32.858 1.947 1.00 0.00 H new ATOM 906 N PRO A 59 19.743 33.868 0.840 1.00 0.00 N ATOM 907 CA PRO A 59 18.631 33.357 0.038 1.00 0.00 C ATOM 908 C PRO A 59 19.015 32.133 -0.810 1.00 0.00 C ATOM 909 O PRO A 59 20.153 31.989 -1.264 1.00 0.00 O ATOM 910 CB PRO A 59 18.171 34.537 -0.827 1.00 0.00 C ATOM 911 CG PRO A 59 19.439 35.372 -0.982 1.00 0.00 C ATOM 912 CD PRO A 59 20.131 35.192 0.368 1.00 0.00 C ATOM 0 HA PRO A 59 17.829 32.992 0.679 1.00 0.00 H new ATOM 0 HB2 PRO A 59 17.788 34.204 -1.792 1.00 0.00 H new ATOM 0 HB3 PRO A 59 17.373 35.102 -0.345 1.00 0.00 H new ATOM 0 HG2 PRO A 59 20.059 35.016 -1.805 1.00 0.00 H new ATOM 0 HG3 PRO A 59 19.212 36.419 -1.183 1.00 0.00 H new ATOM 0 HD2 PRO A 59 21.213 35.269 0.266 1.00 0.00 H new ATOM 0 HD3 PRO A 59 19.822 35.964 1.072 1.00 0.00 H new ATOM 920 N VAL A 60 18.030 31.261 -1.051 1.00 0.00 N ATOM 921 CA VAL A 60 18.145 30.076 -1.923 1.00 0.00 C ATOM 922 C VAL A 60 18.578 30.481 -3.337 1.00 0.00 C ATOM 923 O VAL A 60 17.998 31.387 -3.940 1.00 0.00 O ATOM 924 CB VAL A 60 16.802 29.313 -1.971 1.00 0.00 C ATOM 925 CG1 VAL A 60 16.799 28.127 -2.947 1.00 0.00 C ATOM 926 CG2 VAL A 60 16.435 28.776 -0.582 1.00 0.00 C ATOM 0 H VAL A 60 17.103 31.358 -0.636 1.00 0.00 H new ATOM 0 HA VAL A 60 18.908 29.418 -1.507 1.00 0.00 H new ATOM 0 HB VAL A 60 16.072 30.043 -2.321 1.00 0.00 H new ATOM 0 HG11 VAL A 60 15.824 27.641 -2.926 1.00 0.00 H new ATOM 0 HG12 VAL A 60 17.004 28.485 -3.956 1.00 0.00 H new ATOM 0 HG13 VAL A 60 17.567 27.412 -2.653 1.00 0.00 H new ATOM 0 HG21 VAL A 60 15.486 28.242 -0.637 1.00 0.00 H new ATOM 0 HG22 VAL A 60 17.214 28.096 -0.237 1.00 0.00 H new ATOM 0 HG23 VAL A 60 16.343 29.607 0.117 1.00 0.00 H new ATOM 936 N VAL A 61 19.569 29.767 -3.880 1.00 0.00 N ATOM 937 CA VAL A 61 20.004 29.850 -5.290 1.00 0.00 C ATOM 938 C VAL A 61 19.654 28.542 -6.009 1.00 0.00 C ATOM 939 O VAL A 61 19.790 27.466 -5.427 1.00 0.00 O ATOM 940 CB VAL A 61 21.510 30.180 -5.380 1.00 0.00 C ATOM 941 CG1 VAL A 61 22.043 30.205 -6.818 1.00 0.00 C ATOM 942 CG2 VAL A 61 21.811 31.542 -4.746 1.00 0.00 C ATOM 0 H VAL A 61 20.111 29.093 -3.339 1.00 0.00 H new ATOM 0 HA VAL A 61 19.475 30.663 -5.788 1.00 0.00 H new ATOM 0 HB VAL A 61 22.011 29.377 -4.839 1.00 0.00 H new ATOM 0 HG11 VAL A 61 23.107 30.443 -6.808 1.00 0.00 H new ATOM 0 HG12 VAL A 61 21.894 29.228 -7.278 1.00 0.00 H new ATOM 0 HG13 VAL A 61 21.508 30.962 -7.391 1.00 0.00 H new ATOM 0 HG21 VAL A 61 22.878 31.751 -4.822 1.00 0.00 H new ATOM 0 HG22 VAL A 61 21.251 32.318 -5.268 1.00 0.00 H new ATOM 0 HG23 VAL A 61 21.518 31.527 -3.696 1.00 0.00 H new ATOM 952 N GLU A 62 19.227 28.616 -7.273 1.00 0.00 N ATOM 953 CA GLU A 62 18.912 27.462 -8.129 1.00 0.00 C ATOM 954 C GLU A 62 19.499 27.698 -9.536 1.00 0.00 C ATOM 955 O GLU A 62 19.122 28.654 -10.219 1.00 0.00 O ATOM 956 CB GLU A 62 17.386 27.256 -8.227 1.00 0.00 C ATOM 957 CG GLU A 62 16.698 27.001 -6.881 1.00 0.00 C ATOM 958 CD GLU A 62 15.184 26.784 -7.057 1.00 0.00 C ATOM 959 OE1 GLU A 62 14.427 27.778 -7.170 1.00 0.00 O ATOM 960 OE2 GLU A 62 14.717 25.619 -7.056 1.00 0.00 O ATOM 0 H GLU A 62 19.086 29.508 -7.747 1.00 0.00 H new ATOM 0 HA GLU A 62 19.351 26.566 -7.690 1.00 0.00 H new ATOM 0 HB2 GLU A 62 16.941 28.137 -8.689 1.00 0.00 H new ATOM 0 HB3 GLU A 62 17.186 26.414 -8.890 1.00 0.00 H new ATOM 0 HG2 GLU A 62 17.140 26.126 -6.405 1.00 0.00 H new ATOM 0 HG3 GLU A 62 16.871 27.847 -6.216 1.00 0.00 H new ATOM 967 N VAL A 63 20.429 26.845 -9.974 1.00 0.00 N ATOM 968 CA VAL A 63 21.123 26.911 -11.273 1.00 0.00 C ATOM 969 C VAL A 63 20.386 26.082 -12.339 1.00 0.00 C ATOM 970 O VAL A 63 19.641 25.160 -12.002 1.00 0.00 O ATOM 971 CB VAL A 63 22.570 26.418 -11.086 1.00 0.00 C ATOM 972 CG1 VAL A 63 23.453 26.633 -12.313 1.00 0.00 C ATOM 973 CG2 VAL A 63 23.295 27.084 -9.912 1.00 0.00 C ATOM 0 H VAL A 63 20.736 26.052 -9.411 1.00 0.00 H new ATOM 0 HA VAL A 63 21.135 27.942 -11.626 1.00 0.00 H new ATOM 0 HB VAL A 63 22.437 25.353 -10.897 1.00 0.00 H new ATOM 0 HG11 VAL A 63 24.457 26.262 -12.108 1.00 0.00 H new ATOM 0 HG12 VAL A 63 23.033 26.094 -13.162 1.00 0.00 H new ATOM 0 HG13 VAL A 63 23.500 27.697 -12.546 1.00 0.00 H new ATOM 0 HG21 VAL A 63 24.308 26.689 -9.839 1.00 0.00 H new ATOM 0 HG22 VAL A 63 23.336 28.161 -10.073 1.00 0.00 H new ATOM 0 HG23 VAL A 63 22.757 26.876 -8.987 1.00 0.00 H new ATOM 983 N GLY A 64 20.614 26.346 -13.632 1.00 0.00 N ATOM 984 CA GLY A 64 20.022 25.574 -14.732 1.00 0.00 C ATOM 985 C GLY A 64 18.532 25.878 -14.910 1.00 0.00 C ATOM 986 O GLY A 64 18.176 26.933 -15.439 1.00 0.00 O ATOM 0 H GLY A 64 21.218 27.106 -13.946 1.00 0.00 H new ATOM 0 HA2 GLY A 64 20.551 25.799 -15.658 1.00 0.00 H new ATOM 0 HA3 GLY A 64 20.154 24.509 -14.540 1.00 0.00 H new ATOM 990 N THR A 65 17.660 24.959 -14.476 1.00 0.00 N ATOM 991 CA THR A 65 16.208 25.209 -14.380 1.00 0.00 C ATOM 992 C THR A 65 15.549 24.305 -13.327 1.00 0.00 C ATOM 993 O THR A 65 16.119 23.312 -12.886 1.00 0.00 O ATOM 994 CB THR A 65 15.507 25.133 -15.754 1.00 0.00 C ATOM 995 OG1 THR A 65 14.183 25.609 -15.648 1.00 0.00 O ATOM 996 CG2 THR A 65 15.461 23.745 -16.388 1.00 0.00 C ATOM 0 H THR A 65 17.936 24.022 -14.181 1.00 0.00 H new ATOM 0 HA THR A 65 16.080 26.236 -14.037 1.00 0.00 H new ATOM 0 HB THR A 65 16.119 25.755 -16.408 1.00 0.00 H new ATOM 0 HG1 THR A 65 13.746 25.559 -16.524 1.00 0.00 H new ATOM 0 HG21 THR A 65 14.949 23.801 -17.348 1.00 0.00 H new ATOM 0 HG22 THR A 65 16.477 23.380 -16.539 1.00 0.00 H new ATOM 0 HG23 THR A 65 14.924 23.062 -15.730 1.00 0.00 H new ATOM 1004 N LYS A 66 14.362 24.674 -12.852 1.00 0.00 N ATOM 1005 CA LYS A 66 13.689 24.045 -11.707 1.00 0.00 C ATOM 1006 C LYS A 66 13.109 22.660 -12.075 1.00 0.00 C ATOM 1007 O LYS A 66 12.329 22.571 -13.031 1.00 0.00 O ATOM 1008 CB LYS A 66 12.626 25.009 -11.148 1.00 0.00 C ATOM 1009 CG LYS A 66 12.214 24.624 -9.721 1.00 0.00 C ATOM 1010 CD LYS A 66 11.154 25.586 -9.165 1.00 0.00 C ATOM 1011 CE LYS A 66 10.892 25.332 -7.674 1.00 0.00 C ATOM 1012 NZ LYS A 66 11.949 25.925 -6.810 1.00 0.00 N ATOM 0 H LYS A 66 13.823 25.438 -13.260 1.00 0.00 H new ATOM 0 HA LYS A 66 14.419 23.855 -10.920 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.017 26.026 -11.153 1.00 0.00 H new ATOM 0 HB3 LYS A 66 11.749 25.001 -11.796 1.00 0.00 H new ATOM 0 HG2 LYS A 66 11.823 23.607 -9.716 1.00 0.00 H new ATOM 0 HG3 LYS A 66 13.090 24.632 -9.073 1.00 0.00 H new ATOM 0 HD2 LYS A 66 11.484 26.615 -9.308 1.00 0.00 H new ATOM 0 HD3 LYS A 66 10.226 25.469 -9.724 1.00 0.00 H new ATOM 0 HE2 LYS A 66 9.924 25.751 -7.400 1.00 0.00 H new ATOM 0 HE3 LYS A 66 10.837 24.258 -7.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 11.818 25.603 -5.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 12.885 25.625 -7.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 11.884 26.962 -6.845 1.00 0.00 H new ATOM 1026 N PRO A 67 13.444 21.586 -11.332 1.00 0.00 N ATOM 1027 CA PRO A 67 13.003 20.225 -11.625 1.00 0.00 C ATOM 1028 C PRO A 67 11.545 19.924 -11.239 1.00 0.00 C ATOM 1029 O PRO A 67 10.979 20.512 -10.311 1.00 0.00 O ATOM 1030 CB PRO A 67 13.946 19.315 -10.847 1.00 0.00 C ATOM 1031 CG PRO A 67 14.372 20.161 -9.656 1.00 0.00 C ATOM 1032 CD PRO A 67 14.376 21.580 -10.215 1.00 0.00 C ATOM 0 HA PRO A 67 13.034 20.069 -12.703 1.00 0.00 H new ATOM 0 HB2 PRO A 67 13.446 18.400 -10.529 1.00 0.00 H new ATOM 0 HB3 PRO A 67 14.802 19.016 -11.452 1.00 0.00 H new ATOM 0 HG2 PRO A 67 13.678 20.059 -8.822 1.00 0.00 H new ATOM 0 HG3 PRO A 67 15.356 19.871 -9.288 1.00 0.00 H new ATOM 0 HD2 PRO A 67 14.073 22.298 -9.453 1.00 0.00 H new ATOM 0 HD3 PRO A 67 15.376 21.865 -10.542 1.00 0.00 H new ATOM 1040 N THR A 68 10.966 18.947 -11.944 1.00 0.00 N ATOM 1041 CA THR A 68 9.525 18.616 -11.859 1.00 0.00 C ATOM 1042 C THR A 68 9.144 17.671 -10.703 1.00 0.00 C ATOM 1043 O THR A 68 8.035 17.760 -10.168 1.00 0.00 O ATOM 1044 CB THR A 68 9.041 18.081 -13.222 1.00 0.00 C ATOM 1045 OG1 THR A 68 7.638 17.928 -13.239 1.00 0.00 O ATOM 1046 CG2 THR A 68 9.670 16.737 -13.606 1.00 0.00 C ATOM 0 H THR A 68 11.480 18.355 -12.596 1.00 0.00 H new ATOM 0 HA THR A 68 9.006 19.544 -11.618 1.00 0.00 H new ATOM 0 HB THR A 68 9.357 18.829 -13.950 1.00 0.00 H new ATOM 0 HG1 THR A 68 7.356 17.589 -14.114 1.00 0.00 H new ATOM 0 HG21 THR A 68 9.286 16.419 -14.575 1.00 0.00 H new ATOM 0 HG22 THR A 68 10.753 16.845 -13.663 1.00 0.00 H new ATOM 0 HG23 THR A 68 9.419 15.990 -12.853 1.00 0.00 H new ATOM 1054 N GLY A 69 10.058 16.777 -10.295 1.00 0.00 N ATOM 1055 CA GLY A 69 9.819 15.733 -9.275 1.00 0.00 C ATOM 1056 C GLY A 69 10.275 14.336 -9.702 1.00 0.00 C ATOM 1057 O GLY A 69 10.826 13.577 -8.902 1.00 0.00 O ATOM 0 H GLY A 69 11.006 16.756 -10.671 1.00 0.00 H new ATOM 0 HA2 GLY A 69 10.338 16.010 -8.357 1.00 0.00 H new ATOM 0 HA3 GLY A 69 8.755 15.702 -9.043 1.00 0.00 H new ATOM 1061 N ASP A 70 10.127 14.033 -10.991 1.00 0.00 N ATOM 1062 CA ASP A 70 10.678 12.849 -11.668 1.00 0.00 C ATOM 1063 C ASP A 70 12.178 13.039 -11.970 1.00 0.00 C ATOM 1064 O ASP A 70 12.624 13.053 -13.123 1.00 0.00 O ATOM 1065 CB ASP A 70 9.849 12.506 -12.914 1.00 0.00 C ATOM 1066 CG ASP A 70 8.349 12.360 -12.618 1.00 0.00 C ATOM 1067 OD1 ASP A 70 7.949 11.302 -12.077 1.00 0.00 O ATOM 1068 OD2 ASP A 70 7.564 13.284 -12.943 1.00 0.00 O ATOM 0 H ASP A 70 9.596 14.630 -11.625 1.00 0.00 H new ATOM 0 HA ASP A 70 10.607 11.990 -11.001 1.00 0.00 H new ATOM 0 HB2 ASP A 70 9.991 13.285 -13.663 1.00 0.00 H new ATOM 0 HB3 ASP A 70 10.220 11.576 -13.346 1.00 0.00 H new ATOM 1073 N VAL A 71 12.952 13.267 -10.907 1.00 0.00 N ATOM 1074 CA VAL A 71 14.367 13.658 -10.939 1.00 0.00 C ATOM 1075 C VAL A 71 15.186 12.928 -9.866 1.00 0.00 C ATOM 1076 O VAL A 71 14.659 12.499 -8.836 1.00 0.00 O ATOM 1077 CB VAL A 71 14.530 15.192 -10.794 1.00 0.00 C ATOM 1078 CG1 VAL A 71 13.829 15.960 -11.931 1.00 0.00 C ATOM 1079 CG2 VAL A 71 14.047 15.737 -9.443 1.00 0.00 C ATOM 0 H VAL A 71 12.595 13.181 -9.955 1.00 0.00 H new ATOM 0 HA VAL A 71 14.755 13.361 -11.913 1.00 0.00 H new ATOM 0 HB VAL A 71 15.605 15.360 -10.854 1.00 0.00 H new ATOM 0 HG11 VAL A 71 13.970 17.031 -11.787 1.00 0.00 H new ATOM 0 HG12 VAL A 71 14.257 15.663 -12.889 1.00 0.00 H new ATOM 0 HG13 VAL A 71 12.764 15.730 -11.922 1.00 0.00 H new ATOM 0 HG21 VAL A 71 14.192 16.817 -9.413 1.00 0.00 H new ATOM 0 HG22 VAL A 71 12.989 15.509 -9.316 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.617 15.272 -8.638 1.00 0.00 H new ATOM 1089 N LEU A 72 16.488 12.804 -10.117 1.00 0.00 N ATOM 1090 CA LEU A 72 17.508 12.349 -9.165 1.00 0.00 C ATOM 1091 C LEU A 72 17.803 13.462 -8.142 1.00 0.00 C ATOM 1092 O LEU A 72 17.434 14.618 -8.358 1.00 0.00 O ATOM 1093 CB LEU A 72 18.762 11.911 -9.950 1.00 0.00 C ATOM 1094 CG LEU A 72 18.493 10.810 -10.998 1.00 0.00 C ATOM 1095 CD1 LEU A 72 19.770 10.418 -11.735 1.00 0.00 C ATOM 1096 CD2 LEU A 72 17.914 9.541 -10.373 1.00 0.00 C ATOM 0 H LEU A 72 16.882 13.028 -11.031 1.00 0.00 H new ATOM 0 HA LEU A 72 17.153 11.489 -8.598 1.00 0.00 H new ATOM 0 HB2 LEU A 72 19.186 12.781 -10.452 1.00 0.00 H new ATOM 0 HB3 LEU A 72 19.512 11.552 -9.245 1.00 0.00 H new ATOM 0 HG LEU A 72 17.769 11.238 -11.691 1.00 0.00 H new ATOM 0 HD11 LEU A 72 19.545 9.641 -12.465 1.00 0.00 H new ATOM 0 HD12 LEU A 72 20.177 11.290 -12.247 1.00 0.00 H new ATOM 0 HD13 LEU A 72 20.502 10.043 -11.020 1.00 0.00 H new ATOM 0 HD21 LEU A 72 17.743 8.798 -11.151 1.00 0.00 H new ATOM 0 HD22 LEU A 72 18.616 9.144 -9.640 1.00 0.00 H new ATOM 0 HD23 LEU A 72 16.970 9.776 -9.881 1.00 0.00 H new ATOM 1108 N GLN A 73 18.465 13.127 -7.028 1.00 0.00 N ATOM 1109 CA GLN A 73 18.696 14.049 -5.908 1.00 0.00 C ATOM 1110 C GLN A 73 20.019 13.707 -5.202 1.00 0.00 C ATOM 1111 O GLN A 73 20.062 12.854 -4.315 1.00 0.00 O ATOM 1112 CB GLN A 73 17.517 14.004 -4.922 1.00 0.00 C ATOM 1113 CG GLN A 73 16.266 14.715 -5.463 1.00 0.00 C ATOM 1114 CD GLN A 73 15.334 15.209 -4.358 1.00 0.00 C ATOM 1115 OE1 GLN A 73 15.086 14.545 -3.358 1.00 0.00 O ATOM 1116 NE2 GLN A 73 14.788 16.399 -4.489 1.00 0.00 N ATOM 0 H GLN A 73 18.860 12.199 -6.877 1.00 0.00 H new ATOM 0 HA GLN A 73 18.770 15.064 -6.298 1.00 0.00 H new ATOM 0 HB2 GLN A 73 17.273 12.965 -4.701 1.00 0.00 H new ATOM 0 HB3 GLN A 73 17.816 14.468 -3.982 1.00 0.00 H new ATOM 0 HG2 GLN A 73 16.573 15.562 -6.077 1.00 0.00 H new ATOM 0 HG3 GLN A 73 15.719 14.032 -6.113 1.00 0.00 H new ATOM 0 HE21 GLN A 73 14.986 16.963 -5.316 1.00 0.00 H new ATOM 0 HE22 GLN A 73 14.167 16.758 -3.764 1.00 0.00 H new ATOM 1125 N GLY A 74 21.115 14.355 -5.603 1.00 0.00 N ATOM 1126 CA GLY A 74 22.400 14.299 -4.889 1.00 0.00 C ATOM 1127 C GLY A 74 22.426 15.348 -3.777 1.00 0.00 C ATOM 1128 O GLY A 74 21.800 16.391 -3.928 1.00 0.00 O ATOM 0 H GLY A 74 21.140 14.939 -6.439 1.00 0.00 H new ATOM 0 HA2 GLY A 74 22.548 13.305 -4.466 1.00 0.00 H new ATOM 0 HA3 GLY A 74 23.220 14.474 -5.585 1.00 0.00 H new ATOM 1132 N ARG A 75 23.119 15.110 -2.661 1.00 0.00 N ATOM 1133 CA ARG A 75 23.032 15.955 -1.453 1.00 0.00 C ATOM 1134 C ARG A 75 24.320 15.951 -0.618 1.00 0.00 C ATOM 1135 O ARG A 75 25.044 14.957 -0.600 1.00 0.00 O ATOM 1136 CB ARG A 75 21.830 15.456 -0.630 1.00 0.00 C ATOM 1137 CG ARG A 75 21.340 16.476 0.408 1.00 0.00 C ATOM 1138 CD ARG A 75 20.006 16.011 0.998 1.00 0.00 C ATOM 1139 NE ARG A 75 20.168 14.860 1.912 1.00 0.00 N ATOM 1140 CZ ARG A 75 19.196 14.184 2.503 1.00 0.00 C ATOM 1141 NH1 ARG A 75 17.939 14.482 2.326 1.00 0.00 N ATOM 1142 NH2 ARG A 75 19.471 13.186 3.291 1.00 0.00 N ATOM 0 H ARG A 75 23.761 14.324 -2.563 1.00 0.00 H new ATOM 0 HA ARG A 75 22.896 16.994 -1.754 1.00 0.00 H new ATOM 0 HB2 ARG A 75 21.010 15.214 -1.307 1.00 0.00 H new ATOM 0 HB3 ARG A 75 22.106 14.533 -0.120 1.00 0.00 H new ATOM 0 HG2 ARG A 75 22.080 16.587 1.200 1.00 0.00 H new ATOM 0 HG3 ARG A 75 21.222 17.455 -0.057 1.00 0.00 H new ATOM 0 HD2 ARG A 75 19.542 16.837 1.536 1.00 0.00 H new ATOM 0 HD3 ARG A 75 19.329 15.737 0.189 1.00 0.00 H new ATOM 0 HE ARG A 75 21.123 14.557 2.106 1.00 0.00 H new ATOM 0 HH11 ARG A 75 17.680 15.257 1.716 1.00 0.00 H new ATOM 0 HH12 ARG A 75 17.215 13.940 2.797 1.00 0.00 H new ATOM 0 HH21 ARG A 75 20.442 12.920 3.457 1.00 0.00 H new ATOM 0 HH22 ARG A 75 18.716 12.670 3.743 1.00 0.00 H new ATOM 1156 N ALA A 76 24.584 17.060 0.076 1.00 0.00 N ATOM 1157 CA ALA A 76 25.748 17.230 0.951 1.00 0.00 C ATOM 1158 C ALA A 76 25.560 18.314 2.022 1.00 0.00 C ATOM 1159 O ALA A 76 24.795 19.263 1.841 1.00 0.00 O ATOM 1160 CB ALA A 76 26.950 17.562 0.059 1.00 0.00 C ATOM 0 H ALA A 76 23.982 17.883 0.045 1.00 0.00 H new ATOM 0 HA ALA A 76 25.900 16.303 1.504 1.00 0.00 H new ATOM 0 HB1 ALA A 76 27.837 17.696 0.678 1.00 0.00 H new ATOM 0 HB2 ALA A 76 27.118 16.746 -0.644 1.00 0.00 H new ATOM 0 HB3 ALA A 76 26.751 18.481 -0.493 1.00 0.00 H new ATOM 1166 N THR A 77 26.335 18.203 3.103 1.00 0.00 N ATOM 1167 CA THR A 77 26.482 19.228 4.147 1.00 0.00 C ATOM 1168 C THR A 77 27.888 19.824 4.026 1.00 0.00 C ATOM 1169 O THR A 77 28.878 19.087 4.007 1.00 0.00 O ATOM 1170 CB THR A 77 26.261 18.640 5.549 1.00 0.00 C ATOM 1171 OG1 THR A 77 24.971 18.065 5.643 1.00 0.00 O ATOM 1172 CG2 THR A 77 26.369 19.697 6.651 1.00 0.00 C ATOM 0 H THR A 77 26.897 17.371 3.285 1.00 0.00 H new ATOM 0 HA THR A 77 25.727 20.002 4.009 1.00 0.00 H new ATOM 0 HB THR A 77 27.042 17.893 5.690 1.00 0.00 H new ATOM 0 HG1 THR A 77 24.843 17.692 6.540 1.00 0.00 H new ATOM 0 HG21 THR A 77 26.205 19.229 7.622 1.00 0.00 H new ATOM 0 HG22 THR A 77 27.362 20.146 6.628 1.00 0.00 H new ATOM 0 HG23 THR A 77 25.617 20.470 6.489 1.00 0.00 H new ATOM 1180 N GLY A 78 27.983 21.147 3.907 1.00 0.00 N ATOM 1181 CA GLY A 78 29.250 21.854 3.713 1.00 0.00 C ATOM 1182 C GLY A 78 29.975 22.239 5.005 1.00 0.00 C ATOM 1183 O GLY A 78 29.482 22.051 6.121 1.00 0.00 O ATOM 0 H GLY A 78 27.173 21.766 3.943 1.00 0.00 H new ATOM 0 HA2 GLY A 78 29.912 21.227 3.115 1.00 0.00 H new ATOM 0 HA3 GLY A 78 29.060 22.759 3.136 1.00 0.00 H new ATOM 1187 N GLU A 79 31.191 22.759 4.836 1.00 0.00 N ATOM 1188 CA GLU A 79 32.140 22.990 5.931 1.00 0.00 C ATOM 1189 C GLU A 79 31.911 24.271 6.765 1.00 0.00 C ATOM 1190 O GLU A 79 32.545 24.396 7.818 1.00 0.00 O ATOM 1191 CB GLU A 79 33.580 22.860 5.406 1.00 0.00 C ATOM 1192 CG GLU A 79 33.931 21.407 5.055 1.00 0.00 C ATOM 1193 CD GLU A 79 35.398 21.272 4.608 1.00 0.00 C ATOM 1194 OE1 GLU A 79 36.308 21.305 5.474 1.00 0.00 O ATOM 1195 OE2 GLU A 79 35.656 21.096 3.391 1.00 0.00 O ATOM 0 H GLU A 79 31.552 23.036 3.923 1.00 0.00 H new ATOM 0 HA GLU A 79 31.951 22.205 6.664 1.00 0.00 H new ATOM 0 HB2 GLU A 79 33.703 23.487 4.523 1.00 0.00 H new ATOM 0 HB3 GLU A 79 34.276 23.230 6.159 1.00 0.00 H new ATOM 0 HG2 GLU A 79 33.754 20.770 5.921 1.00 0.00 H new ATOM 0 HG3 GLU A 79 33.274 21.055 4.260 1.00 0.00 H new ATOM 1202 N GLU A 80 31.001 25.186 6.390 1.00 0.00 N ATOM 1203 CA GLU A 80 30.584 26.295 7.272 1.00 0.00 C ATOM 1204 C GLU A 80 29.200 26.034 7.898 1.00 0.00 C ATOM 1205 O GLU A 80 28.630 26.897 8.576 1.00 0.00 O ATOM 1206 CB GLU A 80 30.550 27.608 6.503 1.00 0.00 C ATOM 1207 CG GLU A 80 31.884 27.990 5.869 1.00 0.00 C ATOM 1208 CD GLU A 80 32.868 28.595 6.889 1.00 0.00 C ATOM 1209 OE1 GLU A 80 33.568 27.842 7.608 1.00 0.00 O ATOM 1210 OE2 GLU A 80 32.946 29.846 6.989 1.00 0.00 O ATOM 0 H GLU A 80 30.538 25.181 5.481 1.00 0.00 H new ATOM 0 HA GLU A 80 31.319 26.361 8.074 1.00 0.00 H new ATOM 0 HB2 GLU A 80 29.794 27.540 5.721 1.00 0.00 H new ATOM 0 HB3 GLU A 80 30.239 28.405 7.178 1.00 0.00 H new ATOM 0 HG2 GLU A 80 32.333 27.107 5.415 1.00 0.00 H new ATOM 0 HG3 GLU A 80 31.710 28.707 5.067 1.00 0.00 H new ATOM 1217 N GLY A 81 28.652 24.836 7.677 1.00 0.00 N ATOM 1218 CA GLY A 81 27.367 24.361 8.198 1.00 0.00 C ATOM 1219 C GLY A 81 26.194 24.528 7.228 1.00 0.00 C ATOM 1220 O GLY A 81 25.037 24.514 7.652 1.00 0.00 O ATOM 0 H GLY A 81 29.117 24.135 7.100 1.00 0.00 H new ATOM 0 HA2 GLY A 81 27.461 23.307 8.458 1.00 0.00 H new ATOM 0 HA3 GLY A 81 27.141 24.898 9.119 1.00 0.00 H new ATOM 1224 N GLU A 82 26.463 24.705 5.935 1.00 0.00 N ATOM 1225 CA GLU A 82 25.473 24.826 4.870 1.00 0.00 C ATOM 1226 C GLU A 82 24.996 23.475 4.311 1.00 0.00 C ATOM 1227 O GLU A 82 25.512 22.416 4.667 1.00 0.00 O ATOM 1228 CB GLU A 82 26.056 25.723 3.767 1.00 0.00 C ATOM 1229 CG GLU A 82 27.094 25.115 2.802 1.00 0.00 C ATOM 1230 CD GLU A 82 28.556 25.155 3.295 1.00 0.00 C ATOM 1231 OE1 GLU A 82 28.805 25.047 4.518 1.00 0.00 O ATOM 1232 OE2 GLU A 82 29.461 25.200 2.431 1.00 0.00 O ATOM 0 H GLU A 82 27.420 24.771 5.588 1.00 0.00 H new ATOM 0 HA GLU A 82 24.576 25.279 5.292 1.00 0.00 H new ATOM 0 HB2 GLU A 82 25.225 26.097 3.169 1.00 0.00 H new ATOM 0 HB3 GLU A 82 26.516 26.586 4.249 1.00 0.00 H new ATOM 0 HG2 GLU A 82 26.822 24.078 2.608 1.00 0.00 H new ATOM 0 HG3 GLU A 82 27.034 25.643 1.850 1.00 0.00 H new ATOM 1239 N THR A 83 24.032 23.496 3.387 1.00 0.00 N ATOM 1240 CA THR A 83 23.495 22.312 2.696 1.00 0.00 C ATOM 1241 C THR A 83 23.420 22.562 1.184 1.00 0.00 C ATOM 1242 O THR A 83 22.958 23.607 0.725 1.00 0.00 O ATOM 1243 CB THR A 83 22.127 21.931 3.293 1.00 0.00 C ATOM 1244 OG1 THR A 83 22.322 21.363 4.571 1.00 0.00 O ATOM 1245 CG2 THR A 83 21.329 20.913 2.472 1.00 0.00 C ATOM 0 H THR A 83 23.587 24.363 3.087 1.00 0.00 H new ATOM 0 HA THR A 83 24.167 21.467 2.847 1.00 0.00 H new ATOM 0 HB THR A 83 21.555 22.859 3.314 1.00 0.00 H new ATOM 0 HG1 THR A 83 21.455 21.120 4.957 1.00 0.00 H new ATOM 0 HG21 THR A 83 20.382 20.707 2.970 1.00 0.00 H new ATOM 0 HG22 THR A 83 21.136 21.318 1.479 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.901 19.989 2.383 1.00 0.00 H new ATOM 1253 N VAL A 84 23.879 21.580 0.408 1.00 0.00 N ATOM 1254 CA VAL A 84 23.928 21.589 -1.065 1.00 0.00 C ATOM 1255 C VAL A 84 23.076 20.455 -1.625 1.00 0.00 C ATOM 1256 O VAL A 84 23.046 19.362 -1.057 1.00 0.00 O ATOM 1257 CB VAL A 84 25.383 21.492 -1.567 1.00 0.00 C ATOM 1258 CG1 VAL A 84 25.495 21.532 -3.098 1.00 0.00 C ATOM 1259 CG2 VAL A 84 26.210 22.657 -1.017 1.00 0.00 C ATOM 0 H VAL A 84 24.245 20.713 0.802 1.00 0.00 H new ATOM 0 HA VAL A 84 23.519 22.534 -1.422 1.00 0.00 H new ATOM 0 HB VAL A 84 25.757 20.531 -1.214 1.00 0.00 H new ATOM 0 HG11 VAL A 84 26.543 21.460 -3.388 1.00 0.00 H new ATOM 0 HG12 VAL A 84 24.942 20.696 -3.525 1.00 0.00 H new ATOM 0 HG13 VAL A 84 25.080 22.469 -3.469 1.00 0.00 H new ATOM 0 HG21 VAL A 84 27.235 22.578 -1.378 1.00 0.00 H new ATOM 0 HG22 VAL A 84 25.779 23.600 -1.353 1.00 0.00 H new ATOM 0 HG23 VAL A 84 26.206 22.624 0.072 1.00 0.00 H new ATOM 1269 N LEU A 85 22.419 20.698 -2.761 1.00 0.00 N ATOM 1270 CA LEU A 85 21.640 19.703 -3.495 1.00 0.00 C ATOM 1271 C LEU A 85 21.973 19.758 -5.004 1.00 0.00 C ATOM 1272 O LEU A 85 22.197 20.820 -5.581 1.00 0.00 O ATOM 1273 CB LEU A 85 20.145 19.935 -3.185 1.00 0.00 C ATOM 1274 CG LEU A 85 19.187 18.824 -3.667 1.00 0.00 C ATOM 1275 CD1 LEU A 85 19.112 17.662 -2.678 1.00 0.00 C ATOM 1276 CD2 LEU A 85 17.770 19.368 -3.817 1.00 0.00 C ATOM 0 H LEU A 85 22.415 21.616 -3.206 1.00 0.00 H new ATOM 0 HA LEU A 85 21.896 18.692 -3.177 1.00 0.00 H new ATOM 0 HB2 LEU A 85 20.029 20.049 -2.107 1.00 0.00 H new ATOM 0 HB3 LEU A 85 19.839 20.877 -3.640 1.00 0.00 H new ATOM 0 HG LEU A 85 19.583 18.475 -4.620 1.00 0.00 H new ATOM 0 HD11 LEU A 85 18.427 16.904 -3.058 1.00 0.00 H new ATOM 0 HD12 LEU A 85 20.103 17.225 -2.554 1.00 0.00 H new ATOM 0 HD13 LEU A 85 18.753 18.026 -1.715 1.00 0.00 H new ATOM 0 HD21 LEU A 85 17.109 18.571 -4.157 1.00 0.00 H new ATOM 0 HD22 LEU A 85 17.421 19.743 -2.855 1.00 0.00 H new ATOM 0 HD23 LEU A 85 17.767 20.179 -4.546 1.00 0.00 H new ATOM 1288 N VAL A 86 21.984 18.586 -5.629 1.00 0.00 N ATOM 1289 CA VAL A 86 22.098 18.336 -7.074 1.00 0.00 C ATOM 1290 C VAL A 86 20.802 17.708 -7.550 1.00 0.00 C ATOM 1291 O VAL A 86 20.323 16.768 -6.921 1.00 0.00 O ATOM 1292 CB VAL A 86 23.286 17.403 -7.377 1.00 0.00 C ATOM 1293 CG1 VAL A 86 23.184 16.722 -8.750 1.00 0.00 C ATOM 1294 CG2 VAL A 86 24.602 18.182 -7.285 1.00 0.00 C ATOM 0 H VAL A 86 21.908 17.715 -5.104 1.00 0.00 H new ATOM 0 HA VAL A 86 22.276 19.276 -7.596 1.00 0.00 H new ATOM 0 HB VAL A 86 23.261 16.613 -6.626 1.00 0.00 H new ATOM 0 HG11 VAL A 86 24.051 16.079 -8.902 1.00 0.00 H new ATOM 0 HG12 VAL A 86 22.275 16.122 -8.792 1.00 0.00 H new ATOM 0 HG13 VAL A 86 23.154 17.481 -9.531 1.00 0.00 H new ATOM 0 HG21 VAL A 86 25.436 17.514 -7.501 1.00 0.00 H new ATOM 0 HG22 VAL A 86 24.594 18.997 -8.008 1.00 0.00 H new ATOM 0 HG23 VAL A 86 24.714 18.590 -6.280 1.00 0.00 H new ATOM 1304 N GLU A 87 20.267 18.160 -8.682 1.00 0.00 N ATOM 1305 CA GLU A 87 19.078 17.566 -9.298 1.00 0.00 C ATOM 1306 C GLU A 87 19.252 17.428 -10.822 1.00 0.00 C ATOM 1307 O GLU A 87 19.897 18.246 -11.479 1.00 0.00 O ATOM 1308 CB GLU A 87 17.802 18.334 -8.892 1.00 0.00 C ATOM 1309 CG GLU A 87 17.598 18.342 -7.366 1.00 0.00 C ATOM 1310 CD GLU A 87 16.211 18.857 -6.940 1.00 0.00 C ATOM 1311 OE1 GLU A 87 16.043 20.091 -6.780 1.00 0.00 O ATOM 1312 OE2 GLU A 87 15.301 18.022 -6.716 1.00 0.00 O ATOM 0 H GLU A 87 20.646 18.952 -9.202 1.00 0.00 H new ATOM 0 HA GLU A 87 18.956 16.552 -8.917 1.00 0.00 H new ATOM 0 HB2 GLU A 87 17.865 19.360 -9.255 1.00 0.00 H new ATOM 0 HB3 GLU A 87 16.936 17.878 -9.372 1.00 0.00 H new ATOM 0 HG2 GLU A 87 17.736 17.331 -6.983 1.00 0.00 H new ATOM 0 HG3 GLU A 87 18.366 18.965 -6.907 1.00 0.00 H new ATOM 1319 N GLU A 88 18.696 16.341 -11.356 1.00 0.00 N ATOM 1320 CA GLU A 88 18.676 16.034 -12.781 1.00 0.00 C ATOM 1321 C GLU A 88 17.570 15.053 -13.215 1.00 0.00 C ATOM 1322 O GLU A 88 17.157 14.223 -12.409 1.00 0.00 O ATOM 1323 CB GLU A 88 20.058 15.528 -13.180 1.00 0.00 C ATOM 1324 CG GLU A 88 20.556 14.240 -12.545 1.00 0.00 C ATOM 1325 CD GLU A 88 21.951 13.961 -13.110 1.00 0.00 C ATOM 1326 OE1 GLU A 88 22.919 14.593 -12.642 1.00 0.00 O ATOM 1327 OE2 GLU A 88 22.105 13.177 -14.078 1.00 0.00 O ATOM 0 H GLU A 88 18.234 15.630 -10.789 1.00 0.00 H new ATOM 0 HA GLU A 88 18.430 16.955 -13.309 1.00 0.00 H new ATOM 0 HB2 GLU A 88 20.064 15.392 -14.261 1.00 0.00 H new ATOM 0 HB3 GLU A 88 20.779 16.313 -12.953 1.00 0.00 H new ATOM 0 HG2 GLU A 88 20.594 14.337 -11.460 1.00 0.00 H new ATOM 0 HG3 GLU A 88 19.879 13.415 -12.768 1.00 0.00 H new ATOM 1334 N PRO A 89 17.083 15.108 -14.470 1.00 0.00 N ATOM 1335 CA PRO A 89 15.989 14.262 -14.955 1.00 0.00 C ATOM 1336 C PRO A 89 16.258 12.751 -14.841 1.00 0.00 C ATOM 1337 O PRO A 89 17.367 12.266 -15.094 1.00 0.00 O ATOM 1338 CB PRO A 89 15.745 14.681 -16.409 1.00 0.00 C ATOM 1339 CG PRO A 89 17.085 15.281 -16.823 1.00 0.00 C ATOM 1340 CD PRO A 89 17.521 15.988 -15.544 1.00 0.00 C ATOM 0 HA PRO A 89 15.110 14.413 -14.328 1.00 0.00 H new ATOM 0 HB2 PRO A 89 15.473 13.830 -17.034 1.00 0.00 H new ATOM 0 HB3 PRO A 89 14.936 15.407 -16.489 1.00 0.00 H new ATOM 0 HG2 PRO A 89 17.798 14.516 -17.130 1.00 0.00 H new ATOM 0 HG3 PRO A 89 16.982 15.974 -17.658 1.00 0.00 H new ATOM 0 HD2 PRO A 89 18.601 16.135 -15.521 1.00 0.00 H new ATOM 0 HD3 PRO A 89 17.063 16.974 -15.460 1.00 0.00 H new ATOM 1348 N ARG A 90 15.187 12.025 -14.502 1.00 0.00 N ATOM 1349 CA ARG A 90 15.119 10.555 -14.475 1.00 0.00 C ATOM 1350 C ARG A 90 14.709 9.956 -15.829 1.00 0.00 C ATOM 1351 O ARG A 90 15.426 9.049 -16.313 1.00 0.00 O ATOM 1352 CB ARG A 90 14.227 10.092 -13.314 1.00 0.00 C ATOM 1353 CG ARG A 90 14.392 8.584 -13.071 1.00 0.00 C ATOM 1354 CD ARG A 90 13.724 8.171 -11.760 1.00 0.00 C ATOM 1355 NE ARG A 90 13.804 6.712 -11.568 1.00 0.00 N ATOM 1356 CZ ARG A 90 13.522 6.047 -10.468 1.00 0.00 C ATOM 1357 NH1 ARG A 90 13.102 6.634 -9.387 1.00 0.00 N ATOM 1358 NH2 ARG A 90 13.670 4.759 -10.415 1.00 0.00 N ATOM 1359 OXT ARG A 90 13.685 10.390 -16.408 1.00 0.00 O ATOM 0 H ARG A 90 14.307 12.461 -14.227 1.00 0.00 H new ATOM 0 HA ARG A 90 16.123 10.170 -14.295 1.00 0.00 H new ATOM 0 HB2 ARG A 90 14.485 10.642 -12.409 1.00 0.00 H new ATOM 0 HB3 ARG A 90 13.184 10.318 -13.538 1.00 0.00 H new ATOM 0 HG2 ARG A 90 13.954 8.027 -13.899 1.00 0.00 H new ATOM 0 HG3 ARG A 90 15.451 8.329 -13.041 1.00 0.00 H new ATOM 0 HD2 ARG A 90 14.207 8.679 -10.925 1.00 0.00 H new ATOM 0 HD3 ARG A 90 12.680 8.485 -11.764 1.00 0.00 H new ATOM 0 HE ARG A 90 14.109 6.161 -12.370 1.00 0.00 H new ATOM 0 HH11 ARG A 90 12.980 7.647 -9.371 1.00 0.00 H new ATOM 0 HH12 ARG A 90 12.894 6.082 -8.555 1.00 0.00 H new ATOM 0 HH21 ARG A 90 14.008 4.250 -11.232 1.00 0.00 H new ATOM 0 HH22 ARG A 90 13.448 4.255 -9.556 1.00 0.00 H new TER 1373 ARG A 90