USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 784 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 52 SER OG : rot 30:sc= -0.92 USER MOD Set 1.2: A 73 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 30 SER OG : rot 59:sc= 0.118 USER MOD Set 2.2: A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 180:sc= -0.0997 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl 157:sc= -0.316 (180deg=-1.13) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0108) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= -2.32! USER MOD Single : A 66 CYS SG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 172:sc= 1.24 USER MOD Single : A 81 SER OG : rot 54:sc= -0.29 USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.268 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 HIS : no HE2:sc= -9.17! C(o=-9.2!,f=-9.2!) USER MOD Single : A 92 SER OG : rot 180:sc= -1.01 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -121:sc= -0.0318 (180deg=-1.09) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 20.988 36.108 -5.772 1.00 0.00 N ATOM 2 CA GLY A 1 20.034 35.052 -5.488 1.00 0.00 C ATOM 3 C GLY A 1 20.587 33.674 -5.792 1.00 0.00 C ATOM 4 O GLY A 1 21.664 33.311 -5.317 1.00 0.00 O ATOM 0 H1 GLY A 1 20.562 37.030 -5.548 1.00 0.00 H new ATOM 0 H2 GLY A 1 21.841 35.970 -5.193 1.00 0.00 H new ATOM 0 H3 GLY A 1 21.246 36.082 -6.779 1.00 0.00 H new ATOM 0 HA2 GLY A 1 19.745 35.101 -4.438 1.00 0.00 H new ATOM 0 HA3 GLY A 1 19.130 35.215 -6.075 1.00 0.00 H new ATOM 8 N SER A 2 19.849 32.903 -6.583 1.00 0.00 N ATOM 9 CA SER A 2 20.269 31.554 -6.945 1.00 0.00 C ATOM 10 C SER A 2 19.379 30.985 -8.046 1.00 0.00 C ATOM 11 O SER A 2 18.165 31.188 -8.046 1.00 0.00 O ATOM 12 CB SER A 2 20.231 30.639 -5.719 1.00 0.00 C ATOM 13 OG SER A 2 18.905 30.475 -5.247 1.00 0.00 O ATOM 0 H SER A 2 18.957 33.189 -6.986 1.00 0.00 H new ATOM 0 HA SER A 2 21.291 31.606 -7.319 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.653 29.667 -5.974 1.00 0.00 H new ATOM 0 HB3 SER A 2 20.853 31.059 -4.928 1.00 0.00 H new ATOM 0 HG SER A 2 18.907 29.885 -4.464 1.00 0.00 H new ATOM 19 N SER A 3 19.994 30.271 -8.984 1.00 0.00 N ATOM 20 CA SER A 3 19.259 29.675 -10.094 1.00 0.00 C ATOM 21 C SER A 3 18.186 28.719 -9.584 1.00 0.00 C ATOM 22 O SER A 3 16.999 28.897 -9.857 1.00 0.00 O ATOM 23 CB SER A 3 20.218 28.933 -11.028 1.00 0.00 C ATOM 24 OG SER A 3 21.206 29.808 -11.545 1.00 0.00 O ATOM 0 H SER A 3 20.998 30.091 -8.997 1.00 0.00 H new ATOM 0 HA SER A 3 18.772 30.478 -10.648 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.698 28.117 -10.488 1.00 0.00 H new ATOM 0 HB3 SER A 3 19.658 28.486 -11.849 1.00 0.00 H new ATOM 0 HG SER A 3 21.807 29.309 -12.137 1.00 0.00 H new ATOM 30 N GLY A 4 18.612 27.702 -8.842 1.00 0.00 N ATOM 31 CA GLY A 4 17.676 26.731 -8.305 1.00 0.00 C ATOM 32 C GLY A 4 18.230 25.997 -7.100 1.00 0.00 C ATOM 33 O GLY A 4 19.417 26.100 -6.793 1.00 0.00 O ATOM 0 H GLY A 4 19.589 27.533 -8.603 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.752 27.238 -8.025 1.00 0.00 H new ATOM 0 HA3 GLY A 4 17.421 26.009 -9.081 1.00 0.00 H new ATOM 37 N SER A 5 17.367 25.255 -6.413 1.00 0.00 N ATOM 38 CA SER A 5 17.775 24.505 -5.231 1.00 0.00 C ATOM 39 C SER A 5 18.811 23.445 -5.591 1.00 0.00 C ATOM 40 O SER A 5 18.731 22.817 -6.647 1.00 0.00 O ATOM 41 CB SER A 5 16.560 23.846 -4.575 1.00 0.00 C ATOM 42 OG SER A 5 15.594 24.813 -4.202 1.00 0.00 O ATOM 0 H SER A 5 16.381 25.157 -6.655 1.00 0.00 H new ATOM 0 HA SER A 5 18.226 25.203 -4.525 1.00 0.00 H new ATOM 0 HB2 SER A 5 16.114 23.130 -5.265 1.00 0.00 H new ATOM 0 HB3 SER A 5 16.877 23.286 -3.695 1.00 0.00 H new ATOM 0 HG SER A 5 14.827 24.366 -3.787 1.00 0.00 H new ATOM 48 N SER A 6 19.783 23.251 -4.705 1.00 0.00 N ATOM 49 CA SER A 6 20.837 22.270 -4.930 1.00 0.00 C ATOM 50 C SER A 6 20.275 21.004 -5.571 1.00 0.00 C ATOM 51 O SER A 6 20.868 20.445 -6.492 1.00 0.00 O ATOM 52 CB SER A 6 21.530 21.922 -3.611 1.00 0.00 C ATOM 53 OG SER A 6 22.535 22.871 -3.298 1.00 0.00 O ATOM 0 H SER A 6 19.862 23.761 -3.825 1.00 0.00 H new ATOM 0 HA SER A 6 21.566 22.708 -5.611 1.00 0.00 H new ATOM 0 HB2 SER A 6 20.794 21.888 -2.808 1.00 0.00 H new ATOM 0 HB3 SER A 6 21.972 20.928 -3.680 1.00 0.00 H new ATOM 0 HG SER A 6 22.962 22.628 -2.450 1.00 0.00 H new ATOM 59 N GLY A 7 19.124 20.559 -5.075 1.00 0.00 N ATOM 60 CA GLY A 7 18.499 19.363 -5.609 1.00 0.00 C ATOM 61 C GLY A 7 17.586 18.688 -4.606 1.00 0.00 C ATOM 62 O GLY A 7 17.978 17.720 -3.952 1.00 0.00 O ATOM 0 H GLY A 7 18.614 21.006 -4.313 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.926 19.623 -6.499 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.272 18.661 -5.921 1.00 0.00 H new ATOM 66 N ILE A 8 16.366 19.199 -4.481 1.00 0.00 N ATOM 67 CA ILE A 8 15.395 18.638 -3.549 1.00 0.00 C ATOM 68 C ILE A 8 14.004 18.582 -4.172 1.00 0.00 C ATOM 69 O ILE A 8 13.565 19.530 -4.822 1.00 0.00 O ATOM 70 CB ILE A 8 15.329 19.456 -2.246 1.00 0.00 C ATOM 71 CG1 ILE A 8 16.739 19.731 -1.719 1.00 0.00 C ATOM 72 CG2 ILE A 8 14.501 18.723 -1.202 1.00 0.00 C ATOM 73 CD1 ILE A 8 17.390 18.526 -1.078 1.00 0.00 C ATOM 0 H ILE A 8 16.026 20.000 -5.013 1.00 0.00 H new ATOM 0 HA ILE A 8 15.728 17.626 -3.317 1.00 0.00 H new ATOM 0 HB ILE A 8 14.848 20.411 -2.458 1.00 0.00 H new ATOM 0 HG12 ILE A 8 17.365 20.077 -2.542 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.694 20.540 -0.990 1.00 0.00 H new ATOM 0 HG21 ILE A 8 14.464 19.314 -0.287 1.00 0.00 H new ATOM 0 HG22 ILE A 8 13.489 18.574 -1.579 1.00 0.00 H new ATOM 0 HG23 ILE A 8 14.956 17.755 -0.991 1.00 0.00 H new ATOM 0 HD11 ILE A 8 18.387 18.794 -0.728 1.00 0.00 H new ATOM 0 HD12 ILE A 8 16.786 18.192 -0.234 1.00 0.00 H new ATOM 0 HD13 ILE A 8 17.467 17.722 -1.810 1.00 0.00 H new ATOM 85 N GLY A 9 13.314 17.464 -3.967 1.00 0.00 N ATOM 86 CA GLY A 9 11.979 17.306 -4.513 1.00 0.00 C ATOM 87 C GLY A 9 10.946 17.012 -3.443 1.00 0.00 C ATOM 88 O GLY A 9 11.291 16.617 -2.330 1.00 0.00 O ATOM 0 H GLY A 9 13.656 16.665 -3.433 1.00 0.00 H new ATOM 0 HA2 GLY A 9 11.698 18.215 -5.045 1.00 0.00 H new ATOM 0 HA3 GLY A 9 11.982 16.497 -5.243 1.00 0.00 H new ATOM 92 N ASP A 10 9.676 17.207 -3.780 1.00 0.00 N ATOM 93 CA ASP A 10 8.589 16.962 -2.840 1.00 0.00 C ATOM 94 C ASP A 10 7.761 15.754 -3.269 1.00 0.00 C ATOM 95 O ASP A 10 7.340 15.656 -4.421 1.00 0.00 O ATOM 96 CB ASP A 10 7.693 18.196 -2.729 1.00 0.00 C ATOM 97 CG ASP A 10 7.026 18.307 -1.373 1.00 0.00 C ATOM 98 OD1 ASP A 10 6.237 17.404 -1.024 1.00 0.00 O ATOM 99 OD2 ASP A 10 7.291 19.298 -0.659 1.00 0.00 O ATOM 0 H ASP A 10 9.374 17.534 -4.698 1.00 0.00 H new ATOM 0 HA ASP A 10 9.027 16.752 -1.864 1.00 0.00 H new ATOM 0 HB2 ASP A 10 8.288 19.091 -2.912 1.00 0.00 H new ATOM 0 HB3 ASP A 10 6.928 18.157 -3.505 1.00 0.00 H new ATOM 104 N ALA A 11 7.534 14.837 -2.335 1.00 0.00 N ATOM 105 CA ALA A 11 6.756 13.637 -2.617 1.00 0.00 C ATOM 106 C ALA A 11 5.343 13.991 -3.068 1.00 0.00 C ATOM 107 O ALA A 11 4.656 13.177 -3.685 1.00 0.00 O ATOM 108 CB ALA A 11 6.710 12.738 -1.390 1.00 0.00 C ATOM 0 H ALA A 11 7.878 14.902 -1.377 1.00 0.00 H new ATOM 0 HA ALA A 11 7.245 13.100 -3.430 1.00 0.00 H new ATOM 0 HB1 ALA A 11 6.126 11.846 -1.615 1.00 0.00 H new ATOM 0 HB2 ALA A 11 7.724 12.448 -1.113 1.00 0.00 H new ATOM 0 HB3 ALA A 11 6.248 13.276 -0.562 1.00 0.00 H new ATOM 114 N ARG A 12 4.916 15.210 -2.756 1.00 0.00 N ATOM 115 CA ARG A 12 3.584 15.671 -3.128 1.00 0.00 C ATOM 116 C ARG A 12 3.462 15.818 -4.642 1.00 0.00 C ATOM 117 O ARG A 12 2.436 15.474 -5.229 1.00 0.00 O ATOM 118 CB ARG A 12 3.275 17.007 -2.449 1.00 0.00 C ATOM 119 CG ARG A 12 2.757 16.863 -1.028 1.00 0.00 C ATOM 120 CD ARG A 12 2.576 18.217 -0.361 1.00 0.00 C ATOM 121 NE ARG A 12 1.242 18.765 -0.588 1.00 0.00 N ATOM 122 CZ ARG A 12 0.703 19.722 0.159 1.00 0.00 C ATOM 123 NH1 ARG A 12 1.381 20.234 1.177 1.00 0.00 N ATOM 124 NH2 ARG A 12 -0.517 20.169 -0.111 1.00 0.00 N ATOM 0 H ARG A 12 5.473 15.896 -2.247 1.00 0.00 H new ATOM 0 HA ARG A 12 2.863 14.925 -2.793 1.00 0.00 H new ATOM 0 HB2 ARG A 12 4.179 17.616 -2.437 1.00 0.00 H new ATOM 0 HB3 ARG A 12 2.536 17.544 -3.043 1.00 0.00 H new ATOM 0 HG2 ARG A 12 1.805 16.331 -1.039 1.00 0.00 H new ATOM 0 HG3 ARG A 12 3.453 16.259 -0.445 1.00 0.00 H new ATOM 0 HD2 ARG A 12 2.750 18.119 0.711 1.00 0.00 H new ATOM 0 HD3 ARG A 12 3.323 18.912 -0.743 1.00 0.00 H new ATOM 0 HE ARG A 12 0.694 18.392 -1.363 1.00 0.00 H new ATOM 0 HH11 ARG A 12 2.319 19.893 1.388 1.00 0.00 H new ATOM 0 HH12 ARG A 12 0.965 20.969 1.749 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -1.042 19.778 -0.893 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -0.930 20.904 0.464 1.00 0.00 H new ATOM 138 N ARG A 13 4.517 16.330 -5.268 1.00 0.00 N ATOM 139 CA ARG A 13 4.527 16.523 -6.713 1.00 0.00 C ATOM 140 C ARG A 13 4.772 15.202 -7.437 1.00 0.00 C ATOM 141 O ARG A 13 4.450 15.060 -8.616 1.00 0.00 O ATOM 142 CB ARG A 13 5.603 17.539 -7.105 1.00 0.00 C ATOM 143 CG ARG A 13 5.267 18.966 -6.705 1.00 0.00 C ATOM 144 CD ARG A 13 5.778 19.288 -5.310 1.00 0.00 C ATOM 145 NE ARG A 13 5.591 20.696 -4.970 1.00 0.00 N ATOM 146 CZ ARG A 13 6.256 21.688 -5.552 1.00 0.00 C ATOM 147 NH1 ARG A 13 7.148 21.427 -6.497 1.00 0.00 N ATOM 148 NH2 ARG A 13 6.030 22.944 -5.188 1.00 0.00 N ATOM 0 H ARG A 13 5.375 16.618 -4.798 1.00 0.00 H new ATOM 0 HA ARG A 13 3.550 16.904 -7.010 1.00 0.00 H new ATOM 0 HB2 ARG A 13 6.547 17.253 -6.641 1.00 0.00 H new ATOM 0 HB3 ARG A 13 5.753 17.499 -8.184 1.00 0.00 H new ATOM 0 HG2 ARG A 13 5.705 19.659 -7.423 1.00 0.00 H new ATOM 0 HG3 ARG A 13 4.187 19.110 -6.741 1.00 0.00 H new ATOM 0 HD2 ARG A 13 5.258 18.667 -4.581 1.00 0.00 H new ATOM 0 HD3 ARG A 13 6.837 19.037 -5.245 1.00 0.00 H new ATOM 0 HE ARG A 13 4.912 20.931 -4.246 1.00 0.00 H new ATOM 0 HH11 ARG A 13 7.325 20.463 -6.779 1.00 0.00 H new ATOM 0 HH12 ARG A 13 7.657 22.190 -6.942 1.00 0.00 H new ATOM 0 HH21 ARG A 13 5.345 23.149 -4.461 1.00 0.00 H new ATOM 0 HH22 ARG A 13 6.541 23.705 -5.636 1.00 0.00 H new ATOM 162 N ALA A 14 5.344 14.239 -6.722 1.00 0.00 N ATOM 163 CA ALA A 14 5.630 12.930 -7.295 1.00 0.00 C ATOM 164 C ALA A 14 4.345 12.154 -7.561 1.00 0.00 C ATOM 165 O ALA A 14 3.468 12.071 -6.700 1.00 0.00 O ATOM 166 CB ALA A 14 6.546 12.139 -6.372 1.00 0.00 C ATOM 0 H ALA A 14 5.618 14.341 -5.745 1.00 0.00 H new ATOM 0 HA ALA A 14 6.136 13.081 -8.249 1.00 0.00 H new ATOM 0 HB1 ALA A 14 6.752 11.163 -6.812 1.00 0.00 H new ATOM 0 HB2 ALA A 14 7.482 12.681 -6.237 1.00 0.00 H new ATOM 0 HB3 ALA A 14 6.061 12.006 -5.405 1.00 0.00 H new ATOM 172 N LYS A 15 4.238 11.586 -8.757 1.00 0.00 N ATOM 173 CA LYS A 15 3.060 10.816 -9.137 1.00 0.00 C ATOM 174 C LYS A 15 3.401 9.336 -9.282 1.00 0.00 C ATOM 175 O LYS A 15 4.571 8.964 -9.372 1.00 0.00 O ATOM 176 CB LYS A 15 2.480 11.347 -10.450 1.00 0.00 C ATOM 177 CG LYS A 15 1.529 12.517 -10.265 1.00 0.00 C ATOM 178 CD LYS A 15 0.894 12.933 -11.581 1.00 0.00 C ATOM 179 CE LYS A 15 1.794 13.881 -12.359 1.00 0.00 C ATOM 180 NZ LYS A 15 1.206 14.247 -13.678 1.00 0.00 N ATOM 0 H LYS A 15 4.954 11.645 -9.481 1.00 0.00 H new ATOM 0 HA LYS A 15 2.316 10.924 -8.348 1.00 0.00 H new ATOM 0 HB2 LYS A 15 3.298 11.654 -11.101 1.00 0.00 H new ATOM 0 HB3 LYS A 15 1.954 10.539 -10.958 1.00 0.00 H new ATOM 0 HG2 LYS A 15 0.749 12.244 -9.554 1.00 0.00 H new ATOM 0 HG3 LYS A 15 2.069 13.362 -9.837 1.00 0.00 H new ATOM 0 HD2 LYS A 15 0.689 12.048 -12.183 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.064 13.416 -11.387 1.00 0.00 H new ATOM 0 HE2 LYS A 15 1.962 14.785 -11.773 1.00 0.00 H new ATOM 0 HE3 LYS A 15 2.767 13.414 -12.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 1.849 14.894 -14.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 1.069 13.388 -14.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 0.289 14.715 -13.531 1.00 0.00 H new ATOM 194 N VAL A 16 2.372 8.496 -9.305 1.00 0.00 N ATOM 195 CA VAL A 16 2.562 7.056 -9.441 1.00 0.00 C ATOM 196 C VAL A 16 1.406 6.419 -10.202 1.00 0.00 C ATOM 197 O VAL A 16 0.249 6.518 -9.792 1.00 0.00 O ATOM 198 CB VAL A 16 2.695 6.375 -8.066 1.00 0.00 C ATOM 199 CG1 VAL A 16 3.954 6.848 -7.355 1.00 0.00 C ATOM 200 CG2 VAL A 16 1.461 6.643 -7.218 1.00 0.00 C ATOM 0 H VAL A 16 1.397 8.787 -9.231 1.00 0.00 H new ATOM 0 HA VAL A 16 3.486 6.910 -10.001 1.00 0.00 H new ATOM 0 HB VAL A 16 2.776 5.299 -8.219 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.031 6.356 -6.385 1.00 0.00 H new ATOM 0 HG12 VAL A 16 4.827 6.600 -7.958 1.00 0.00 H new ATOM 0 HG13 VAL A 16 3.907 7.927 -7.211 1.00 0.00 H new ATOM 0 HG21 VAL A 16 1.572 6.155 -6.250 1.00 0.00 H new ATOM 0 HG22 VAL A 16 1.346 7.717 -7.072 1.00 0.00 H new ATOM 0 HG23 VAL A 16 0.579 6.250 -7.724 1.00 0.00 H new ATOM 210 N TYR A 17 1.726 5.763 -11.312 1.00 0.00 N ATOM 211 CA TYR A 17 0.713 5.110 -12.133 1.00 0.00 C ATOM 212 C TYR A 17 1.151 3.701 -12.520 1.00 0.00 C ATOM 213 O TYR A 17 2.317 3.465 -12.834 1.00 0.00 O ATOM 214 CB TYR A 17 0.437 5.934 -13.392 1.00 0.00 C ATOM 215 CG TYR A 17 1.636 6.717 -13.878 1.00 0.00 C ATOM 216 CD1 TYR A 17 1.976 7.934 -13.300 1.00 0.00 C ATOM 217 CD2 TYR A 17 2.427 6.241 -14.916 1.00 0.00 C ATOM 218 CE1 TYR A 17 3.070 8.653 -13.741 1.00 0.00 C ATOM 219 CE2 TYR A 17 3.524 6.952 -15.362 1.00 0.00 C ATOM 220 CZ TYR A 17 3.841 8.158 -14.772 1.00 0.00 C ATOM 221 OH TYR A 17 4.932 8.870 -15.215 1.00 0.00 O ATOM 0 H TYR A 17 2.679 5.669 -11.664 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.203 5.038 -11.546 1.00 0.00 H new ATOM 0 HB2 TYR A 17 0.103 5.267 -14.187 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -0.381 6.626 -13.191 1.00 0.00 H new ATOM 0 HD1 TYR A 17 1.375 8.324 -12.492 1.00 0.00 H new ATOM 0 HD2 TYR A 17 2.180 5.299 -15.382 1.00 0.00 H new ATOM 0 HE1 TYR A 17 3.320 9.598 -13.281 1.00 0.00 H new ATOM 0 HE2 TYR A 17 4.130 6.566 -16.168 1.00 0.00 H new ATOM 0 HH TYR A 17 5.367 8.382 -15.945 1.00 0.00 H new ATOM 231 N GLY A 18 0.206 2.766 -12.496 1.00 0.00 N ATOM 232 CA GLY A 18 0.512 1.392 -12.847 1.00 0.00 C ATOM 233 C GLY A 18 -0.566 0.425 -12.399 1.00 0.00 C ATOM 234 O GLY A 18 -1.636 0.841 -11.954 1.00 0.00 O ATOM 0 H GLY A 18 -0.766 2.936 -12.240 1.00 0.00 H new ATOM 0 HA2 GLY A 18 0.638 1.316 -13.927 1.00 0.00 H new ATOM 0 HA3 GLY A 18 1.462 1.108 -12.394 1.00 0.00 H new ATOM 238 N ARG A 19 -0.285 -0.869 -12.517 1.00 0.00 N ATOM 239 CA ARG A 19 -1.240 -1.897 -12.123 1.00 0.00 C ATOM 240 C ARG A 19 -0.905 -2.450 -10.741 1.00 0.00 C ATOM 241 O ARG A 19 -1.758 -3.026 -10.068 1.00 0.00 O ATOM 242 CB ARG A 19 -1.252 -3.032 -13.149 1.00 0.00 C ATOM 243 CG ARG A 19 -2.198 -4.166 -12.791 1.00 0.00 C ATOM 244 CD ARG A 19 -2.491 -5.048 -13.995 1.00 0.00 C ATOM 245 NE ARG A 19 -1.282 -5.678 -14.519 1.00 0.00 N ATOM 246 CZ ARG A 19 -1.258 -6.419 -15.621 1.00 0.00 C ATOM 247 NH1 ARG A 19 -2.372 -6.622 -16.312 1.00 0.00 N ATOM 248 NH2 ARG A 19 -0.119 -6.960 -16.035 1.00 0.00 N ATOM 0 H ARG A 19 0.596 -1.230 -12.882 1.00 0.00 H new ATOM 0 HA ARG A 19 -2.230 -1.442 -12.083 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -1.534 -2.628 -14.122 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -0.242 -3.430 -13.250 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -1.761 -4.769 -11.995 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -3.130 -3.755 -12.404 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -3.209 -5.819 -13.714 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -2.957 -4.450 -14.778 1.00 0.00 H new ATOM 0 HE ARG A 19 -0.408 -5.541 -14.011 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -3.250 -6.209 -15.997 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -2.351 -7.191 -17.158 1.00 0.00 H new ATOM 0 HH21 ARG A 19 0.740 -6.807 -15.507 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -0.103 -7.529 -16.882 1.00 0.00 H new ATOM 262 N GLY A 20 0.345 -2.270 -10.324 1.00 0.00 N ATOM 263 CA GLY A 20 0.771 -2.756 -9.025 1.00 0.00 C ATOM 264 C GLY A 20 0.656 -1.700 -7.944 1.00 0.00 C ATOM 265 O GLY A 20 1.476 -1.647 -7.027 1.00 0.00 O ATOM 0 H GLY A 20 1.070 -1.796 -10.863 1.00 0.00 H new ATOM 0 HA2 GLY A 20 0.168 -3.621 -8.749 1.00 0.00 H new ATOM 0 HA3 GLY A 20 1.805 -3.095 -9.089 1.00 0.00 H new ATOM 269 N LEU A 21 -0.364 -0.856 -8.051 1.00 0.00 N ATOM 270 CA LEU A 21 -0.584 0.206 -7.075 1.00 0.00 C ATOM 271 C LEU A 21 -2.009 0.162 -6.533 1.00 0.00 C ATOM 272 O LEU A 21 -2.261 0.540 -5.389 1.00 0.00 O ATOM 273 CB LEU A 21 -0.308 1.572 -7.707 1.00 0.00 C ATOM 274 CG LEU A 21 1.117 1.802 -8.211 1.00 0.00 C ATOM 275 CD1 LEU A 21 1.194 3.085 -9.024 1.00 0.00 C ATOM 276 CD2 LEU A 21 2.095 1.847 -7.046 1.00 0.00 C ATOM 0 H LEU A 21 -1.052 -0.886 -8.804 1.00 0.00 H new ATOM 0 HA LEU A 21 0.105 0.051 -6.245 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -0.994 1.709 -8.543 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -0.542 2.343 -6.973 1.00 0.00 H new ATOM 0 HG LEU A 21 1.392 0.969 -8.857 1.00 0.00 H new ATOM 0 HD11 LEU A 21 2.215 3.233 -9.375 1.00 0.00 H new ATOM 0 HD12 LEU A 21 0.523 3.014 -9.880 1.00 0.00 H new ATOM 0 HD13 LEU A 21 0.899 3.929 -8.401 1.00 0.00 H new ATOM 0 HD21 LEU A 21 3.104 2.011 -7.424 1.00 0.00 H new ATOM 0 HD22 LEU A 21 1.823 2.660 -6.373 1.00 0.00 H new ATOM 0 HD23 LEU A 21 2.060 0.901 -6.505 1.00 0.00 H new ATOM 288 N SER A 22 -2.937 -0.304 -7.363 1.00 0.00 N ATOM 289 CA SER A 22 -4.338 -0.396 -6.968 1.00 0.00 C ATOM 290 C SER A 22 -4.761 -1.853 -6.801 1.00 0.00 C ATOM 291 O SER A 22 -4.938 -2.334 -5.683 1.00 0.00 O ATOM 292 CB SER A 22 -5.229 0.290 -8.006 1.00 0.00 C ATOM 293 OG SER A 22 -6.600 0.128 -7.688 1.00 0.00 O ATOM 0 H SER A 22 -2.744 -0.623 -8.312 1.00 0.00 H new ATOM 0 HA SER A 22 -4.454 0.110 -6.009 1.00 0.00 H new ATOM 0 HB2 SER A 22 -4.986 1.352 -8.053 1.00 0.00 H new ATOM 0 HB3 SER A 22 -5.030 -0.127 -8.993 1.00 0.00 H new ATOM 0 HG SER A 22 -7.148 0.577 -8.365 1.00 0.00 H new ATOM 299 N GLU A 23 -4.920 -2.548 -7.923 1.00 0.00 N ATOM 300 CA GLU A 23 -5.322 -3.949 -7.902 1.00 0.00 C ATOM 301 C GLU A 23 -4.130 -4.862 -8.174 1.00 0.00 C ATOM 302 O GLU A 23 -3.005 -4.397 -8.346 1.00 0.00 O ATOM 303 CB GLU A 23 -6.420 -4.203 -8.937 1.00 0.00 C ATOM 304 CG GLU A 23 -5.947 -4.058 -10.374 1.00 0.00 C ATOM 305 CD GLU A 23 -6.793 -4.853 -11.350 1.00 0.00 C ATOM 306 OE1 GLU A 23 -6.649 -6.093 -11.385 1.00 0.00 O ATOM 307 OE2 GLU A 23 -7.597 -4.236 -12.078 1.00 0.00 O ATOM 0 H GLU A 23 -4.777 -2.164 -8.857 1.00 0.00 H new ATOM 0 HA GLU A 23 -5.710 -4.174 -6.909 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.817 -5.208 -8.794 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -7.241 -3.508 -8.762 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -5.968 -3.005 -10.655 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -4.910 -4.387 -10.446 1.00 0.00 H new ATOM 314 N GLY A 24 -4.387 -6.166 -8.210 1.00 0.00 N ATOM 315 CA GLY A 24 -3.326 -7.125 -8.460 1.00 0.00 C ATOM 316 C GLY A 24 -3.821 -8.557 -8.436 1.00 0.00 C ATOM 317 O GLY A 24 -4.993 -8.811 -8.158 1.00 0.00 O ATOM 0 H GLY A 24 -5.311 -6.576 -8.071 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.873 -6.917 -9.429 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.545 -7.001 -7.710 1.00 0.00 H new ATOM 321 N ARG A 25 -2.927 -9.496 -8.729 1.00 0.00 N ATOM 322 CA ARG A 25 -3.280 -10.910 -8.742 1.00 0.00 C ATOM 323 C ARG A 25 -2.099 -11.769 -8.300 1.00 0.00 C ATOM 324 O ARG A 25 -0.941 -11.408 -8.510 1.00 0.00 O ATOM 325 CB ARG A 25 -3.735 -11.331 -10.141 1.00 0.00 C ATOM 326 CG ARG A 25 -5.230 -11.176 -10.367 1.00 0.00 C ATOM 327 CD ARG A 25 -5.727 -12.106 -11.462 1.00 0.00 C ATOM 328 NE ARG A 25 -7.185 -12.105 -11.562 1.00 0.00 N ATOM 329 CZ ARG A 25 -7.850 -12.596 -12.601 1.00 0.00 C ATOM 330 NH1 ARG A 25 -7.193 -13.126 -13.623 1.00 0.00 N ATOM 331 NH2 ARG A 25 -9.177 -12.558 -12.619 1.00 0.00 N ATOM 0 H ARG A 25 -1.953 -9.303 -8.961 1.00 0.00 H new ATOM 0 HA ARG A 25 -4.100 -11.061 -8.040 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -3.200 -10.737 -10.882 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -3.457 -12.372 -10.306 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.763 -11.386 -9.440 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -5.453 -10.144 -10.636 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -5.298 -11.803 -12.417 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -5.378 -13.119 -11.263 1.00 0.00 H new ATOM 0 HE ARG A 25 -7.721 -11.705 -10.792 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -6.174 -13.158 -13.613 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -7.707 -13.502 -14.420 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -9.686 -12.151 -11.834 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -9.687 -12.935 -13.418 1.00 0.00 H new ATOM 345 N THR A 26 -2.401 -12.909 -7.685 1.00 0.00 N ATOM 346 CA THR A 26 -1.366 -13.819 -7.212 1.00 0.00 C ATOM 347 C THR A 26 -0.574 -14.405 -8.375 1.00 0.00 C ATOM 348 O THR A 26 -1.104 -14.585 -9.472 1.00 0.00 O ATOM 349 CB THR A 26 -1.966 -14.970 -6.383 1.00 0.00 C ATOM 350 OG1 THR A 26 -3.017 -15.607 -7.118 1.00 0.00 O ATOM 351 CG2 THR A 26 -2.507 -14.458 -5.057 1.00 0.00 C ATOM 0 H THR A 26 -3.354 -13.223 -7.503 1.00 0.00 H new ATOM 0 HA THR A 26 -0.698 -13.235 -6.579 1.00 0.00 H new ATOM 0 HB THR A 26 -1.175 -15.692 -6.180 1.00 0.00 H new ATOM 0 HG1 THR A 26 -3.392 -16.339 -6.585 1.00 0.00 H new ATOM 0 HG21 THR A 26 -2.925 -15.289 -4.489 1.00 0.00 H new ATOM 0 HG22 THR A 26 -1.699 -14.000 -4.487 1.00 0.00 H new ATOM 0 HG23 THR A 26 -3.285 -13.718 -5.243 1.00 0.00 H new ATOM 359 N PHE A 27 0.698 -14.701 -8.130 1.00 0.00 N ATOM 360 CA PHE A 27 1.563 -15.267 -9.158 1.00 0.00 C ATOM 361 C PHE A 27 1.509 -14.432 -10.434 1.00 0.00 C ATOM 362 O PHE A 27 1.539 -14.969 -11.541 1.00 0.00 O ATOM 363 CB PHE A 27 1.154 -16.709 -9.462 1.00 0.00 C ATOM 364 CG PHE A 27 1.636 -17.697 -8.438 1.00 0.00 C ATOM 365 CD1 PHE A 27 1.227 -17.602 -7.118 1.00 0.00 C ATOM 366 CD2 PHE A 27 2.500 -18.720 -8.796 1.00 0.00 C ATOM 367 CE1 PHE A 27 1.668 -18.510 -6.173 1.00 0.00 C ATOM 368 CE2 PHE A 27 2.944 -19.631 -7.856 1.00 0.00 C ATOM 369 CZ PHE A 27 2.529 -19.525 -6.543 1.00 0.00 C ATOM 0 H PHE A 27 1.153 -14.558 -7.228 1.00 0.00 H new ATOM 0 HA PHE A 27 2.586 -15.259 -8.781 1.00 0.00 H new ATOM 0 HB2 PHE A 27 0.067 -16.764 -9.525 1.00 0.00 H new ATOM 0 HB3 PHE A 27 1.545 -16.991 -10.440 1.00 0.00 H new ATOM 0 HD1 PHE A 27 0.556 -16.809 -6.823 1.00 0.00 H new ATOM 0 HD2 PHE A 27 2.830 -18.806 -9.821 1.00 0.00 H new ATOM 0 HE1 PHE A 27 1.340 -18.426 -5.147 1.00 0.00 H new ATOM 0 HE2 PHE A 27 3.615 -20.425 -8.148 1.00 0.00 H new ATOM 0 HZ PHE A 27 2.877 -20.234 -5.807 1.00 0.00 H new ATOM 379 N GLU A 28 1.429 -13.115 -10.270 1.00 0.00 N ATOM 380 CA GLU A 28 1.369 -12.206 -11.408 1.00 0.00 C ATOM 381 C GLU A 28 2.281 -11.001 -11.191 1.00 0.00 C ATOM 382 O GLU A 28 2.086 -10.222 -10.259 1.00 0.00 O ATOM 383 CB GLU A 28 -0.069 -11.736 -11.639 1.00 0.00 C ATOM 384 CG GLU A 28 -0.176 -10.537 -12.567 1.00 0.00 C ATOM 385 CD GLU A 28 -1.527 -10.448 -13.250 1.00 0.00 C ATOM 386 OE1 GLU A 28 -1.745 -11.189 -14.231 1.00 0.00 O ATOM 387 OE2 GLU A 28 -2.365 -9.637 -12.805 1.00 0.00 O ATOM 0 H GLU A 28 1.404 -12.654 -9.360 1.00 0.00 H new ATOM 0 HA GLU A 28 1.713 -12.746 -12.290 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.649 -12.560 -12.055 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -0.518 -11.483 -10.679 1.00 0.00 H new ATOM 0 HG2 GLU A 28 0.000 -9.624 -11.998 1.00 0.00 H new ATOM 0 HG3 GLU A 28 0.606 -10.597 -13.324 1.00 0.00 H new ATOM 394 N MET A 29 3.276 -10.856 -12.059 1.00 0.00 N ATOM 395 CA MET A 29 4.218 -9.747 -11.963 1.00 0.00 C ATOM 396 C MET A 29 3.497 -8.409 -12.092 1.00 0.00 C ATOM 397 O MET A 29 3.066 -8.028 -13.180 1.00 0.00 O ATOM 398 CB MET A 29 5.293 -9.867 -13.046 1.00 0.00 C ATOM 399 CG MET A 29 6.632 -9.274 -12.640 1.00 0.00 C ATOM 400 SD MET A 29 7.706 -10.475 -11.830 1.00 0.00 S ATOM 401 CE MET A 29 8.460 -9.456 -10.565 1.00 0.00 C ATOM 0 H MET A 29 3.451 -11.492 -12.837 1.00 0.00 H new ATOM 0 HA MET A 29 4.694 -9.791 -10.983 1.00 0.00 H new ATOM 0 HB2 MET A 29 5.431 -10.919 -13.295 1.00 0.00 H new ATOM 0 HB3 MET A 29 4.943 -9.369 -13.950 1.00 0.00 H new ATOM 0 HG2 MET A 29 7.134 -8.881 -13.524 1.00 0.00 H new ATOM 0 HG3 MET A 29 6.464 -8.432 -11.969 1.00 0.00 H new ATOM 0 HE1 MET A 29 8.813 -10.089 -9.751 1.00 0.00 H new ATOM 0 HE2 MET A 29 9.301 -8.910 -10.991 1.00 0.00 H new ATOM 0 HE3 MET A 29 7.725 -8.748 -10.182 1.00 0.00 H new ATOM 411 N SER A 30 3.369 -7.701 -10.975 1.00 0.00 N ATOM 412 CA SER A 30 2.696 -6.407 -10.963 1.00 0.00 C ATOM 413 C SER A 30 3.708 -5.269 -10.864 1.00 0.00 C ATOM 414 O SER A 30 4.306 -5.045 -9.812 1.00 0.00 O ATOM 415 CB SER A 30 1.711 -6.331 -9.795 1.00 0.00 C ATOM 416 OG SER A 30 0.776 -7.395 -9.846 1.00 0.00 O ATOM 0 H SER A 30 3.722 -8.001 -10.066 1.00 0.00 H new ATOM 0 HA SER A 30 2.147 -6.302 -11.899 1.00 0.00 H new ATOM 0 HB2 SER A 30 2.257 -6.367 -8.852 1.00 0.00 H new ATOM 0 HB3 SER A 30 1.183 -5.378 -9.822 1.00 0.00 H new ATOM 0 HG SER A 30 1.252 -8.251 -9.817 1.00 0.00 H new ATOM 422 N ASP A 31 3.894 -4.554 -11.968 1.00 0.00 N ATOM 423 CA ASP A 31 4.832 -3.438 -12.008 1.00 0.00 C ATOM 424 C ASP A 31 4.097 -2.117 -12.212 1.00 0.00 C ATOM 425 O ASP A 31 2.995 -2.086 -12.760 1.00 0.00 O ATOM 426 CB ASP A 31 5.856 -3.645 -13.125 1.00 0.00 C ATOM 427 CG ASP A 31 5.249 -4.290 -14.355 1.00 0.00 C ATOM 428 OD1 ASP A 31 4.020 -4.169 -14.543 1.00 0.00 O ATOM 429 OD2 ASP A 31 6.003 -4.916 -15.129 1.00 0.00 O ATOM 0 H ASP A 31 3.407 -4.727 -12.848 1.00 0.00 H new ATOM 0 HA ASP A 31 5.353 -3.398 -11.051 1.00 0.00 H new ATOM 0 HB2 ASP A 31 6.289 -2.683 -13.399 1.00 0.00 H new ATOM 0 HB3 ASP A 31 6.671 -4.268 -12.756 1.00 0.00 H new ATOM 434 N PHE A 32 4.714 -1.028 -11.766 1.00 0.00 N ATOM 435 CA PHE A 32 4.117 0.296 -11.898 1.00 0.00 C ATOM 436 C PHE A 32 5.192 1.359 -12.108 1.00 0.00 C ATOM 437 O PHE A 32 6.339 1.186 -11.694 1.00 0.00 O ATOM 438 CB PHE A 32 3.289 0.632 -10.657 1.00 0.00 C ATOM 439 CG PHE A 32 4.073 0.568 -9.377 1.00 0.00 C ATOM 440 CD1 PHE A 32 4.819 1.656 -8.952 1.00 0.00 C ATOM 441 CD2 PHE A 32 4.064 -0.579 -8.600 1.00 0.00 C ATOM 442 CE1 PHE A 32 5.542 1.599 -7.775 1.00 0.00 C ATOM 443 CE2 PHE A 32 4.785 -0.641 -7.422 1.00 0.00 C ATOM 444 CZ PHE A 32 5.524 0.450 -7.009 1.00 0.00 C ATOM 0 H PHE A 32 5.627 -1.036 -11.310 1.00 0.00 H new ATOM 0 HA PHE A 32 3.464 0.287 -12.771 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.872 1.633 -10.768 1.00 0.00 H new ATOM 0 HB3 PHE A 32 2.448 -0.058 -10.593 1.00 0.00 H new ATOM 0 HD1 PHE A 32 4.836 2.558 -9.546 1.00 0.00 H new ATOM 0 HD2 PHE A 32 3.487 -1.435 -8.918 1.00 0.00 H new ATOM 0 HE1 PHE A 32 6.121 2.453 -7.455 1.00 0.00 H new ATOM 0 HE2 PHE A 32 4.770 -1.541 -6.826 1.00 0.00 H new ATOM 0 HZ PHE A 32 6.087 0.405 -6.088 1.00 0.00 H new ATOM 454 N ILE A 33 4.813 2.456 -12.754 1.00 0.00 N ATOM 455 CA ILE A 33 5.744 3.546 -13.018 1.00 0.00 C ATOM 456 C ILE A 33 5.734 4.565 -11.884 1.00 0.00 C ATOM 457 O ILE A 33 4.716 4.762 -11.220 1.00 0.00 O ATOM 458 CB ILE A 33 5.410 4.264 -14.340 1.00 0.00 C ATOM 459 CG1 ILE A 33 5.931 3.455 -15.530 1.00 0.00 C ATOM 460 CG2 ILE A 33 6.001 5.666 -14.345 1.00 0.00 C ATOM 461 CD1 ILE A 33 7.408 3.142 -15.447 1.00 0.00 C ATOM 0 H ILE A 33 3.868 2.614 -13.104 1.00 0.00 H new ATOM 0 HA ILE A 33 6.736 3.101 -13.095 1.00 0.00 H new ATOM 0 HB ILE A 33 4.327 4.348 -14.428 1.00 0.00 H new ATOM 0 HG12 ILE A 33 5.373 2.521 -15.596 1.00 0.00 H new ATOM 0 HG13 ILE A 33 5.736 4.009 -16.449 1.00 0.00 H new ATOM 0 HG21 ILE A 33 5.757 6.160 -15.285 1.00 0.00 H new ATOM 0 HG22 ILE A 33 5.586 6.239 -13.515 1.00 0.00 H new ATOM 0 HG23 ILE A 33 7.084 5.605 -14.238 1.00 0.00 H new ATOM 0 HD11 ILE A 33 7.708 2.567 -16.323 1.00 0.00 H new ATOM 0 HD12 ILE A 33 7.976 4.072 -15.412 1.00 0.00 H new ATOM 0 HD13 ILE A 33 7.607 2.561 -14.546 1.00 0.00 H new ATOM 473 N VAL A 34 6.875 5.212 -11.666 1.00 0.00 N ATOM 474 CA VAL A 34 6.998 6.213 -10.614 1.00 0.00 C ATOM 475 C VAL A 34 7.512 7.536 -11.171 1.00 0.00 C ATOM 476 O VAL A 34 8.668 7.641 -11.580 1.00 0.00 O ATOM 477 CB VAL A 34 7.943 5.738 -9.494 1.00 0.00 C ATOM 478 CG1 VAL A 34 8.321 6.898 -8.586 1.00 0.00 C ATOM 479 CG2 VAL A 34 7.301 4.613 -8.697 1.00 0.00 C ATOM 0 H VAL A 34 7.728 5.060 -12.205 1.00 0.00 H new ATOM 0 HA VAL A 34 6.001 6.360 -10.199 1.00 0.00 H new ATOM 0 HB VAL A 34 8.855 5.354 -9.951 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.989 6.543 -7.801 1.00 0.00 H new ATOM 0 HG12 VAL A 34 8.825 7.668 -9.170 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.421 7.315 -8.135 1.00 0.00 H new ATOM 0 HG21 VAL A 34 7.982 4.290 -7.910 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.372 4.968 -8.250 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.087 3.774 -9.359 1.00 0.00 H new ATOM 489 N ASP A 35 6.646 8.543 -11.183 1.00 0.00 N ATOM 490 CA ASP A 35 7.012 9.861 -11.688 1.00 0.00 C ATOM 491 C ASP A 35 7.648 10.707 -10.589 1.00 0.00 C ATOM 492 O ASP A 35 6.954 11.249 -9.728 1.00 0.00 O ATOM 493 CB ASP A 35 5.783 10.574 -12.252 1.00 0.00 C ATOM 494 CG ASP A 35 5.936 12.083 -12.246 1.00 0.00 C ATOM 495 OD1 ASP A 35 5.607 12.708 -11.217 1.00 0.00 O ATOM 496 OD2 ASP A 35 6.383 12.638 -13.272 1.00 0.00 O ATOM 0 H ASP A 35 5.685 8.472 -10.849 1.00 0.00 H new ATOM 0 HA ASP A 35 7.742 9.727 -12.486 1.00 0.00 H new ATOM 0 HB2 ASP A 35 5.605 10.234 -13.272 1.00 0.00 H new ATOM 0 HB3 ASP A 35 4.906 10.298 -11.667 1.00 0.00 H new ATOM 501 N THR A 36 8.972 10.815 -10.624 1.00 0.00 N ATOM 502 CA THR A 36 9.701 11.593 -9.630 1.00 0.00 C ATOM 503 C THR A 36 10.411 12.779 -10.273 1.00 0.00 C ATOM 504 O THR A 36 10.770 13.742 -9.595 1.00 0.00 O ATOM 505 CB THR A 36 10.739 10.728 -8.890 1.00 0.00 C ATOM 506 OG1 THR A 36 11.559 10.031 -9.835 1.00 0.00 O ATOM 507 CG2 THR A 36 10.053 9.727 -7.972 1.00 0.00 C ATOM 0 H THR A 36 9.562 10.374 -11.330 1.00 0.00 H new ATOM 0 HA THR A 36 8.966 11.958 -8.913 1.00 0.00 H new ATOM 0 HB THR A 36 11.362 11.386 -8.284 1.00 0.00 H new ATOM 0 HG1 THR A 36 12.217 9.485 -9.357 1.00 0.00 H new ATOM 0 HG21 THR A 36 10.806 9.127 -7.460 1.00 0.00 H new ATOM 0 HG22 THR A 36 9.452 10.261 -7.236 1.00 0.00 H new ATOM 0 HG23 THR A 36 9.409 9.075 -8.562 1.00 0.00 H new ATOM 515 N ARG A 37 10.610 12.703 -11.585 1.00 0.00 N ATOM 516 CA ARG A 37 11.278 13.771 -12.319 1.00 0.00 C ATOM 517 C ARG A 37 10.659 15.127 -11.991 1.00 0.00 C ATOM 518 O ARG A 37 11.369 16.101 -11.740 1.00 0.00 O ATOM 519 CB ARG A 37 11.197 13.513 -13.824 1.00 0.00 C ATOM 520 CG ARG A 37 11.669 12.126 -14.230 1.00 0.00 C ATOM 521 CD ARG A 37 11.590 11.929 -15.736 1.00 0.00 C ATOM 522 NE ARG A 37 10.221 11.693 -16.186 1.00 0.00 N ATOM 523 CZ ARG A 37 9.868 11.625 -17.465 1.00 0.00 C ATOM 524 NH1 ARG A 37 10.780 11.775 -18.416 1.00 0.00 N ATOM 525 NH2 ARG A 37 8.602 11.407 -17.795 1.00 0.00 N ATOM 0 H ARG A 37 10.318 11.913 -12.161 1.00 0.00 H new ATOM 0 HA ARG A 37 12.325 13.786 -12.015 1.00 0.00 H new ATOM 0 HB2 ARG A 37 10.166 13.647 -14.152 1.00 0.00 H new ATOM 0 HB3 ARG A 37 11.797 14.259 -14.345 1.00 0.00 H new ATOM 0 HG2 ARG A 37 12.696 11.978 -13.896 1.00 0.00 H new ATOM 0 HG3 ARG A 37 11.060 11.373 -13.731 1.00 0.00 H new ATOM 0 HD2 ARG A 37 11.990 12.810 -16.238 1.00 0.00 H new ATOM 0 HD3 ARG A 37 12.217 11.085 -16.025 1.00 0.00 H new ATOM 0 HE ARG A 37 9.495 11.574 -15.479 1.00 0.00 H new ATOM 0 HH11 ARG A 37 11.755 11.943 -18.166 1.00 0.00 H new ATOM 0 HH12 ARG A 37 10.507 11.722 -19.397 1.00 0.00 H new ATOM 0 HH21 ARG A 37 7.898 11.291 -17.066 1.00 0.00 H new ATOM 0 HH22 ARG A 37 8.333 11.355 -18.777 1.00 0.00 H new ATOM 539 N ASP A 38 9.331 15.181 -11.995 1.00 0.00 N ATOM 540 CA ASP A 38 8.616 16.416 -11.697 1.00 0.00 C ATOM 541 C ASP A 38 8.673 16.732 -10.206 1.00 0.00 C ATOM 542 O ASP A 38 8.553 17.888 -9.801 1.00 0.00 O ATOM 543 CB ASP A 38 7.160 16.310 -12.153 1.00 0.00 C ATOM 544 CG ASP A 38 6.559 17.659 -12.494 1.00 0.00 C ATOM 545 OD1 ASP A 38 6.688 18.088 -13.659 1.00 0.00 O ATOM 546 OD2 ASP A 38 5.962 18.288 -11.595 1.00 0.00 O ATOM 0 H ASP A 38 8.729 14.384 -12.201 1.00 0.00 H new ATOM 0 HA ASP A 38 9.101 17.227 -12.240 1.00 0.00 H new ATOM 0 HB2 ASP A 38 7.102 15.659 -13.025 1.00 0.00 H new ATOM 0 HB3 ASP A 38 6.569 15.841 -11.366 1.00 0.00 H new ATOM 551 N ALA A 39 8.858 15.696 -9.394 1.00 0.00 N ATOM 552 CA ALA A 39 8.932 15.863 -7.948 1.00 0.00 C ATOM 553 C ALA A 39 10.244 16.525 -7.538 1.00 0.00 C ATOM 554 O ALA A 39 10.279 17.335 -6.614 1.00 0.00 O ATOM 555 CB ALA A 39 8.777 14.519 -7.253 1.00 0.00 C ATOM 0 H ALA A 39 8.959 14.733 -9.713 1.00 0.00 H new ATOM 0 HA ALA A 39 8.115 16.515 -7.640 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.834 14.659 -6.174 1.00 0.00 H new ATOM 0 HB2 ALA A 39 7.811 14.085 -7.512 1.00 0.00 H new ATOM 0 HB3 ALA A 39 9.574 13.849 -7.575 1.00 0.00 H new ATOM 561 N GLY A 40 11.321 16.173 -8.233 1.00 0.00 N ATOM 562 CA GLY A 40 12.621 16.741 -7.926 1.00 0.00 C ATOM 563 C GLY A 40 13.705 15.687 -7.823 1.00 0.00 C ATOM 564 O GLY A 40 13.940 14.934 -8.769 1.00 0.00 O ATOM 0 H GLY A 40 11.317 15.504 -9.003 1.00 0.00 H new ATOM 0 HA2 GLY A 40 12.891 17.461 -8.699 1.00 0.00 H new ATOM 0 HA3 GLY A 40 12.561 17.289 -6.986 1.00 0.00 H new ATOM 568 N TYR A 41 14.368 15.634 -6.674 1.00 0.00 N ATOM 569 CA TYR A 41 15.437 14.667 -6.452 1.00 0.00 C ATOM 570 C TYR A 41 15.447 14.188 -5.004 1.00 0.00 C ATOM 571 O TYR A 41 15.012 14.900 -4.099 1.00 0.00 O ATOM 572 CB TYR A 41 16.792 15.283 -6.807 1.00 0.00 C ATOM 573 CG TYR A 41 17.895 14.263 -6.976 1.00 0.00 C ATOM 574 CD1 TYR A 41 18.590 13.773 -5.877 1.00 0.00 C ATOM 575 CD2 TYR A 41 18.242 13.788 -8.235 1.00 0.00 C ATOM 576 CE1 TYR A 41 19.599 12.841 -6.028 1.00 0.00 C ATOM 577 CE2 TYR A 41 19.248 12.856 -8.395 1.00 0.00 C ATOM 578 CZ TYR A 41 19.924 12.386 -7.288 1.00 0.00 C ATOM 579 OH TYR A 41 20.928 11.457 -7.442 1.00 0.00 O ATOM 0 H TYR A 41 14.184 16.249 -5.881 1.00 0.00 H new ATOM 0 HA TYR A 41 15.255 13.808 -7.098 1.00 0.00 H new ATOM 0 HB2 TYR A 41 16.692 15.854 -7.730 1.00 0.00 H new ATOM 0 HB3 TYR A 41 17.077 15.988 -6.026 1.00 0.00 H new ATOM 0 HD1 TYR A 41 18.337 14.127 -4.888 1.00 0.00 H new ATOM 0 HD2 TYR A 41 17.715 14.154 -9.104 1.00 0.00 H new ATOM 0 HE1 TYR A 41 20.130 12.471 -5.163 1.00 0.00 H new ATOM 0 HE2 TYR A 41 19.504 12.497 -9.381 1.00 0.00 H new ATOM 0 HH TYR A 41 21.031 11.241 -8.392 1.00 0.00 H new ATOM 589 N GLY A 42 15.947 12.975 -4.792 1.00 0.00 N ATOM 590 CA GLY A 42 16.006 12.420 -3.452 1.00 0.00 C ATOM 591 C GLY A 42 15.970 10.905 -3.450 1.00 0.00 C ATOM 592 O GLY A 42 15.780 10.280 -4.493 1.00 0.00 O ATOM 0 H GLY A 42 16.312 12.366 -5.524 1.00 0.00 H new ATOM 0 HA2 GLY A 42 16.918 12.759 -2.961 1.00 0.00 H new ATOM 0 HA3 GLY A 42 15.169 12.801 -2.867 1.00 0.00 H new ATOM 596 N GLY A 43 16.154 10.311 -2.274 1.00 0.00 N ATOM 597 CA GLY A 43 16.140 8.864 -2.164 1.00 0.00 C ATOM 598 C GLY A 43 14.735 8.296 -2.161 1.00 0.00 C ATOM 599 O GLY A 43 13.835 8.853 -1.532 1.00 0.00 O ATOM 0 H GLY A 43 16.312 10.806 -1.396 1.00 0.00 H new ATOM 0 HA2 GLY A 43 16.700 8.434 -2.994 1.00 0.00 H new ATOM 0 HA3 GLY A 43 16.650 8.568 -1.248 1.00 0.00 H new ATOM 603 N ILE A 44 14.546 7.187 -2.867 1.00 0.00 N ATOM 604 CA ILE A 44 13.240 6.544 -2.944 1.00 0.00 C ATOM 605 C ILE A 44 13.232 5.222 -2.184 1.00 0.00 C ATOM 606 O ILE A 44 14.084 4.362 -2.405 1.00 0.00 O ATOM 607 CB ILE A 44 12.824 6.287 -4.404 1.00 0.00 C ATOM 608 CG1 ILE A 44 12.755 7.605 -5.178 1.00 0.00 C ATOM 609 CG2 ILE A 44 11.485 5.566 -4.454 1.00 0.00 C ATOM 610 CD1 ILE A 44 12.517 7.423 -6.661 1.00 0.00 C ATOM 0 H ILE A 44 15.281 6.715 -3.394 1.00 0.00 H new ATOM 0 HA ILE A 44 12.525 7.227 -2.486 1.00 0.00 H new ATOM 0 HB ILE A 44 13.575 5.651 -4.873 1.00 0.00 H new ATOM 0 HG12 ILE A 44 11.956 8.219 -4.763 1.00 0.00 H new ATOM 0 HG13 ILE A 44 13.687 8.152 -5.032 1.00 0.00 H new ATOM 0 HG21 ILE A 44 11.204 5.391 -5.493 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.566 4.611 -3.935 1.00 0.00 H new ATOM 0 HG23 ILE A 44 10.724 6.178 -3.971 1.00 0.00 H new ATOM 0 HD11 ILE A 44 12.480 8.398 -7.146 1.00 0.00 H new ATOM 0 HD12 ILE A 44 13.328 6.835 -7.090 1.00 0.00 H new ATOM 0 HD13 ILE A 44 11.571 6.904 -6.817 1.00 0.00 H new ATOM 622 N SER A 45 12.262 5.067 -1.288 1.00 0.00 N ATOM 623 CA SER A 45 12.143 3.850 -0.493 1.00 0.00 C ATOM 624 C SER A 45 10.910 3.051 -0.904 1.00 0.00 C ATOM 625 O SER A 45 9.777 3.481 -0.687 1.00 0.00 O ATOM 626 CB SER A 45 12.070 4.193 0.996 1.00 0.00 C ATOM 627 OG SER A 45 12.532 3.115 1.791 1.00 0.00 O ATOM 0 H SER A 45 11.547 5.769 -1.095 1.00 0.00 H new ATOM 0 HA SER A 45 13.027 3.239 -0.674 1.00 0.00 H new ATOM 0 HB2 SER A 45 12.670 5.081 1.198 1.00 0.00 H new ATOM 0 HB3 SER A 45 11.042 4.434 1.267 1.00 0.00 H new ATOM 0 HG SER A 45 12.477 3.360 2.738 1.00 0.00 H new ATOM 633 N LEU A 46 11.140 1.885 -1.498 1.00 0.00 N ATOM 634 CA LEU A 46 10.048 1.024 -1.939 1.00 0.00 C ATOM 635 C LEU A 46 10.098 -0.325 -1.229 1.00 0.00 C ATOM 636 O LEU A 46 11.066 -1.073 -1.362 1.00 0.00 O ATOM 637 CB LEU A 46 10.116 0.818 -3.454 1.00 0.00 C ATOM 638 CG LEU A 46 9.915 2.069 -4.310 1.00 0.00 C ATOM 639 CD1 LEU A 46 10.632 1.924 -5.643 1.00 0.00 C ATOM 640 CD2 LEU A 46 8.432 2.335 -4.526 1.00 0.00 C ATOM 0 H LEU A 46 12.072 1.514 -1.685 1.00 0.00 H new ATOM 0 HA LEU A 46 9.107 1.513 -1.686 1.00 0.00 H new ATOM 0 HB2 LEU A 46 11.086 0.386 -3.699 1.00 0.00 H new ATOM 0 HB3 LEU A 46 9.361 0.084 -3.735 1.00 0.00 H new ATOM 0 HG LEU A 46 10.343 2.921 -3.781 1.00 0.00 H new ATOM 0 HD11 LEU A 46 10.478 2.824 -6.239 1.00 0.00 H new ATOM 0 HD12 LEU A 46 11.699 1.782 -5.469 1.00 0.00 H new ATOM 0 HD13 LEU A 46 10.234 1.062 -6.178 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.308 3.229 -5.137 1.00 0.00 H new ATOM 0 HD22 LEU A 46 7.980 1.483 -5.033 1.00 0.00 H new ATOM 0 HD23 LEU A 46 7.945 2.484 -3.562 1.00 0.00 H new ATOM 652 N ALA A 47 9.046 -0.630 -0.476 1.00 0.00 N ATOM 653 CA ALA A 47 8.967 -1.891 0.252 1.00 0.00 C ATOM 654 C ALA A 47 7.518 -2.323 0.446 1.00 0.00 C ATOM 655 O ALA A 47 6.731 -1.623 1.082 1.00 0.00 O ATOM 656 CB ALA A 47 9.668 -1.769 1.597 1.00 0.00 C ATOM 0 H ALA A 47 8.237 -0.021 -0.354 1.00 0.00 H new ATOM 0 HA ALA A 47 9.470 -2.656 -0.340 1.00 0.00 H new ATOM 0 HB1 ALA A 47 9.601 -2.718 2.130 1.00 0.00 H new ATOM 0 HB2 ALA A 47 10.716 -1.514 1.439 1.00 0.00 H new ATOM 0 HB3 ALA A 47 9.190 -0.987 2.187 1.00 0.00 H new ATOM 662 N VAL A 48 7.172 -3.482 -0.107 1.00 0.00 N ATOM 663 CA VAL A 48 5.817 -4.008 0.006 1.00 0.00 C ATOM 664 C VAL A 48 5.694 -4.962 1.188 1.00 0.00 C ATOM 665 O VAL A 48 6.507 -5.872 1.350 1.00 0.00 O ATOM 666 CB VAL A 48 5.391 -4.742 -1.279 1.00 0.00 C ATOM 667 CG1 VAL A 48 3.957 -5.235 -1.162 1.00 0.00 C ATOM 668 CG2 VAL A 48 5.555 -3.836 -2.490 1.00 0.00 C ATOM 0 H VAL A 48 7.811 -4.074 -0.637 1.00 0.00 H new ATOM 0 HA VAL A 48 5.158 -3.154 0.163 1.00 0.00 H new ATOM 0 HB VAL A 48 6.038 -5.609 -1.413 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.674 -5.751 -2.079 1.00 0.00 H new ATOM 0 HG12 VAL A 48 3.876 -5.922 -0.319 1.00 0.00 H new ATOM 0 HG13 VAL A 48 3.292 -4.386 -1.003 1.00 0.00 H new ATOM 0 HG21 VAL A 48 5.249 -4.371 -3.389 1.00 0.00 H new ATOM 0 HG22 VAL A 48 4.934 -2.949 -2.367 1.00 0.00 H new ATOM 0 HG23 VAL A 48 6.599 -3.538 -2.583 1.00 0.00 H new ATOM 678 N GLU A 49 4.673 -4.748 2.012 1.00 0.00 N ATOM 679 CA GLU A 49 4.445 -5.590 3.181 1.00 0.00 C ATOM 680 C GLU A 49 3.044 -6.195 3.150 1.00 0.00 C ATOM 681 O GLU A 49 2.059 -5.522 3.451 1.00 0.00 O ATOM 682 CB GLU A 49 4.636 -4.781 4.465 1.00 0.00 C ATOM 683 CG GLU A 49 6.000 -4.120 4.572 1.00 0.00 C ATOM 684 CD GLU A 49 6.034 -2.746 3.931 1.00 0.00 C ATOM 685 OE1 GLU A 49 4.948 -2.186 3.670 1.00 0.00 O ATOM 686 OE2 GLU A 49 7.146 -2.231 3.690 1.00 0.00 O ATOM 0 H GLU A 49 3.991 -3.999 1.892 1.00 0.00 H new ATOM 0 HA GLU A 49 5.173 -6.401 3.161 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.864 -4.013 4.518 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.492 -5.438 5.323 1.00 0.00 H new ATOM 0 HG2 GLU A 49 6.276 -4.034 5.623 1.00 0.00 H new ATOM 0 HG3 GLU A 49 6.747 -4.757 4.097 1.00 0.00 H new ATOM 693 N GLY A 50 2.965 -7.470 2.784 1.00 0.00 N ATOM 694 CA GLY A 50 1.681 -8.145 2.720 1.00 0.00 C ATOM 695 C GLY A 50 1.688 -9.475 3.448 1.00 0.00 C ATOM 696 O GLY A 50 2.503 -9.715 4.339 1.00 0.00 O ATOM 0 H GLY A 50 3.766 -8.048 2.531 1.00 0.00 H new ATOM 0 HA2 GLY A 50 0.914 -7.502 3.152 1.00 0.00 H new ATOM 0 HA3 GLY A 50 1.411 -8.307 1.677 1.00 0.00 H new ATOM 700 N PRO A 51 0.762 -10.367 3.067 1.00 0.00 N ATOM 701 CA PRO A 51 0.644 -11.695 3.677 1.00 0.00 C ATOM 702 C PRO A 51 1.811 -12.606 3.315 1.00 0.00 C ATOM 703 O PRO A 51 1.894 -13.741 3.783 1.00 0.00 O ATOM 704 CB PRO A 51 -0.661 -12.239 3.090 1.00 0.00 C ATOM 705 CG PRO A 51 -0.826 -11.517 1.798 1.00 0.00 C ATOM 706 CD PRO A 51 -0.240 -10.149 2.010 1.00 0.00 C ATOM 0 HA PRO A 51 0.651 -11.645 4.766 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -0.607 -13.317 2.937 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -1.503 -12.054 3.757 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -0.314 -12.040 0.991 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -1.878 -11.452 1.519 1.00 0.00 H new ATOM 0 HD2 PRO A 51 0.215 -9.761 1.099 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -0.999 -9.430 2.318 1.00 0.00 H new ATOM 714 N SER A 52 2.713 -12.100 2.479 1.00 0.00 N ATOM 715 CA SER A 52 3.875 -12.870 2.051 1.00 0.00 C ATOM 716 C SER A 52 5.025 -11.947 1.660 1.00 0.00 C ATOM 717 O SER A 52 4.891 -10.723 1.686 1.00 0.00 O ATOM 718 CB SER A 52 3.509 -13.774 0.872 1.00 0.00 C ATOM 719 OG SER A 52 3.009 -15.022 1.323 1.00 0.00 O ATOM 0 H SER A 52 2.661 -11.161 2.085 1.00 0.00 H new ATOM 0 HA SER A 52 4.197 -13.489 2.888 1.00 0.00 H new ATOM 0 HB2 SER A 52 2.761 -13.282 0.251 1.00 0.00 H new ATOM 0 HB3 SER A 52 4.387 -13.935 0.246 1.00 0.00 H new ATOM 0 HG SER A 52 2.570 -14.904 2.191 1.00 0.00 H new ATOM 725 N LYS A 53 6.156 -12.542 1.297 1.00 0.00 N ATOM 726 CA LYS A 53 7.331 -11.775 0.899 1.00 0.00 C ATOM 727 C LYS A 53 7.395 -11.627 -0.618 1.00 0.00 C ATOM 728 O LYS A 53 7.254 -12.603 -1.354 1.00 0.00 O ATOM 729 CB LYS A 53 8.604 -12.453 1.410 1.00 0.00 C ATOM 730 CG LYS A 53 9.735 -11.481 1.702 1.00 0.00 C ATOM 731 CD LYS A 53 10.611 -11.261 0.481 1.00 0.00 C ATOM 732 CE LYS A 53 11.835 -10.422 0.816 1.00 0.00 C ATOM 733 NZ LYS A 53 12.559 -9.983 -0.408 1.00 0.00 N ATOM 0 H LYS A 53 6.284 -13.554 1.270 1.00 0.00 H new ATOM 0 HA LYS A 53 7.253 -10.782 1.341 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.370 -13.009 2.318 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.941 -13.179 0.670 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.321 -10.528 2.030 1.00 0.00 H new ATOM 0 HG3 LYS A 53 10.342 -11.864 2.522 1.00 0.00 H new ATOM 0 HD2 LYS A 53 10.927 -12.224 0.081 1.00 0.00 H new ATOM 0 HD3 LYS A 53 10.032 -10.766 -0.299 1.00 0.00 H new ATOM 0 HE2 LYS A 53 11.529 -9.547 1.390 1.00 0.00 H new ATOM 0 HE3 LYS A 53 12.509 -11.000 1.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.405 -9.443 -0.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 12.843 -10.817 -0.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 11.935 -9.382 -0.984 1.00 0.00 H new ATOM 747 N VAL A 54 7.610 -10.398 -1.079 1.00 0.00 N ATOM 748 CA VAL A 54 7.695 -10.122 -2.508 1.00 0.00 C ATOM 749 C VAL A 54 8.982 -9.380 -2.848 1.00 0.00 C ATOM 750 O VAL A 54 9.183 -8.240 -2.429 1.00 0.00 O ATOM 751 CB VAL A 54 6.492 -9.291 -2.992 1.00 0.00 C ATOM 752 CG1 VAL A 54 5.334 -10.199 -3.374 1.00 0.00 C ATOM 753 CG2 VAL A 54 6.069 -8.294 -1.923 1.00 0.00 C ATOM 0 H VAL A 54 7.728 -9.578 -0.483 1.00 0.00 H new ATOM 0 HA VAL A 54 7.689 -11.085 -3.018 1.00 0.00 H new ATOM 0 HB VAL A 54 6.792 -8.733 -3.879 1.00 0.00 H new ATOM 0 HG11 VAL A 54 4.494 -9.594 -3.713 1.00 0.00 H new ATOM 0 HG12 VAL A 54 5.646 -10.869 -4.176 1.00 0.00 H new ATOM 0 HG13 VAL A 54 5.031 -10.787 -2.507 1.00 0.00 H new ATOM 0 HG21 VAL A 54 5.218 -7.715 -2.282 1.00 0.00 H new ATOM 0 HG22 VAL A 54 5.787 -8.830 -1.017 1.00 0.00 H new ATOM 0 HG23 VAL A 54 6.898 -7.622 -1.704 1.00 0.00 H new ATOM 763 N ASP A 55 9.852 -10.033 -3.611 1.00 0.00 N ATOM 764 CA ASP A 55 11.120 -9.435 -4.010 1.00 0.00 C ATOM 765 C ASP A 55 10.890 -8.176 -4.841 1.00 0.00 C ATOM 766 O ASP A 55 10.435 -8.250 -5.983 1.00 0.00 O ATOM 767 CB ASP A 55 11.955 -10.440 -4.804 1.00 0.00 C ATOM 768 CG ASP A 55 12.273 -11.688 -4.005 1.00 0.00 C ATOM 769 OD1 ASP A 55 11.351 -12.501 -3.783 1.00 0.00 O ATOM 770 OD2 ASP A 55 13.443 -11.853 -3.600 1.00 0.00 O ATOM 0 H ASP A 55 9.702 -10.977 -3.966 1.00 0.00 H new ATOM 0 HA ASP A 55 11.663 -9.158 -3.106 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.417 -10.719 -5.710 1.00 0.00 H new ATOM 0 HB3 ASP A 55 12.885 -9.967 -5.119 1.00 0.00 H new ATOM 775 N ILE A 56 11.205 -7.024 -4.260 1.00 0.00 N ATOM 776 CA ILE A 56 11.032 -5.750 -4.948 1.00 0.00 C ATOM 777 C ILE A 56 12.216 -5.454 -5.862 1.00 0.00 C ATOM 778 O ILE A 56 13.349 -5.317 -5.400 1.00 0.00 O ATOM 779 CB ILE A 56 10.865 -4.589 -3.949 1.00 0.00 C ATOM 780 CG1 ILE A 56 9.709 -4.876 -2.989 1.00 0.00 C ATOM 781 CG2 ILE A 56 10.633 -3.282 -4.691 1.00 0.00 C ATOM 782 CD1 ILE A 56 8.351 -4.536 -3.560 1.00 0.00 C ATOM 0 H ILE A 56 11.581 -6.946 -3.315 1.00 0.00 H new ATOM 0 HA ILE A 56 10.126 -5.835 -5.548 1.00 0.00 H new ATOM 0 HB ILE A 56 11.781 -4.495 -3.366 1.00 0.00 H new ATOM 0 HG12 ILE A 56 9.726 -5.932 -2.718 1.00 0.00 H new ATOM 0 HG13 ILE A 56 9.861 -4.309 -2.071 1.00 0.00 H new ATOM 0 HG21 ILE A 56 10.517 -2.471 -3.972 1.00 0.00 H new ATOM 0 HG22 ILE A 56 11.486 -3.074 -5.338 1.00 0.00 H new ATOM 0 HG23 ILE A 56 9.730 -3.362 -5.296 1.00 0.00 H new ATOM 0 HD11 ILE A 56 7.579 -4.765 -2.825 1.00 0.00 H new ATOM 0 HD12 ILE A 56 8.315 -3.475 -3.805 1.00 0.00 H new ATOM 0 HD13 ILE A 56 8.178 -5.123 -4.462 1.00 0.00 H new ATOM 794 N GLN A 57 11.945 -5.354 -7.159 1.00 0.00 N ATOM 795 CA GLN A 57 12.989 -5.072 -8.138 1.00 0.00 C ATOM 796 C GLN A 57 12.838 -3.664 -8.704 1.00 0.00 C ATOM 797 O GLN A 57 11.750 -3.263 -9.119 1.00 0.00 O ATOM 798 CB GLN A 57 12.944 -6.098 -9.271 1.00 0.00 C ATOM 799 CG GLN A 57 13.396 -7.488 -8.852 1.00 0.00 C ATOM 800 CD GLN A 57 13.748 -8.369 -10.035 1.00 0.00 C ATOM 801 OE1 GLN A 57 14.911 -8.717 -10.240 1.00 0.00 O ATOM 802 NE2 GLN A 57 12.742 -8.734 -10.821 1.00 0.00 N ATOM 0 H GLN A 57 11.012 -5.464 -7.557 1.00 0.00 H new ATOM 0 HA GLN A 57 13.953 -5.139 -7.634 1.00 0.00 H new ATOM 0 HB2 GLN A 57 11.926 -6.157 -9.656 1.00 0.00 H new ATOM 0 HB3 GLN A 57 13.575 -5.751 -10.089 1.00 0.00 H new ATOM 0 HG2 GLN A 57 14.263 -7.402 -8.197 1.00 0.00 H new ATOM 0 HG3 GLN A 57 12.605 -7.964 -8.272 1.00 0.00 H new ATOM 0 HE21 GLN A 57 11.793 -8.422 -10.613 1.00 0.00 H new ATOM 0 HE22 GLN A 57 12.918 -9.326 -11.633 1.00 0.00 H new ATOM 811 N THR A 58 13.937 -2.916 -8.718 1.00 0.00 N ATOM 812 CA THR A 58 13.927 -1.553 -9.232 1.00 0.00 C ATOM 813 C THR A 58 15.022 -1.349 -10.273 1.00 0.00 C ATOM 814 O THR A 58 16.054 -2.018 -10.239 1.00 0.00 O ATOM 815 CB THR A 58 14.114 -0.525 -8.100 1.00 0.00 C ATOM 816 OG1 THR A 58 15.178 -0.936 -7.235 1.00 0.00 O ATOM 817 CG2 THR A 58 12.832 -0.367 -7.295 1.00 0.00 C ATOM 0 H THR A 58 14.846 -3.232 -8.379 1.00 0.00 H new ATOM 0 HA THR A 58 12.954 -1.398 -9.698 1.00 0.00 H new ATOM 0 HB THR A 58 14.363 0.436 -8.550 1.00 0.00 H new ATOM 0 HG1 THR A 58 15.291 -0.276 -6.519 1.00 0.00 H new ATOM 0 HG21 THR A 58 12.988 0.364 -6.502 1.00 0.00 H new ATOM 0 HG22 THR A 58 12.031 -0.025 -7.950 1.00 0.00 H new ATOM 0 HG23 THR A 58 12.558 -1.326 -6.856 1.00 0.00 H new ATOM 825 N GLU A 59 14.790 -0.421 -11.196 1.00 0.00 N ATOM 826 CA GLU A 59 15.758 -0.131 -12.247 1.00 0.00 C ATOM 827 C GLU A 59 15.487 1.233 -12.874 1.00 0.00 C ATOM 828 O GLU A 59 14.368 1.522 -13.299 1.00 0.00 O ATOM 829 CB GLU A 59 15.717 -1.217 -13.323 1.00 0.00 C ATOM 830 CG GLU A 59 16.570 -0.901 -14.540 1.00 0.00 C ATOM 831 CD GLU A 59 16.936 -2.141 -15.333 1.00 0.00 C ATOM 832 OE1 GLU A 59 17.365 -3.137 -14.714 1.00 0.00 O ATOM 833 OE2 GLU A 59 16.794 -2.114 -16.574 1.00 0.00 O ATOM 0 H GLU A 59 13.941 0.142 -11.237 1.00 0.00 H new ATOM 0 HA GLU A 59 16.751 -0.114 -11.797 1.00 0.00 H new ATOM 0 HB2 GLU A 59 16.053 -2.159 -12.889 1.00 0.00 H new ATOM 0 HB3 GLU A 59 14.685 -1.362 -13.641 1.00 0.00 H new ATOM 0 HG2 GLU A 59 16.032 -0.207 -15.186 1.00 0.00 H new ATOM 0 HG3 GLU A 59 17.482 -0.397 -14.219 1.00 0.00 H new ATOM 840 N ASP A 60 16.518 2.069 -12.928 1.00 0.00 N ATOM 841 CA ASP A 60 16.393 3.402 -13.504 1.00 0.00 C ATOM 842 C ASP A 60 16.029 3.324 -14.984 1.00 0.00 C ATOM 843 O ASP A 60 16.731 2.691 -15.774 1.00 0.00 O ATOM 844 CB ASP A 60 17.697 4.182 -13.328 1.00 0.00 C ATOM 845 CG ASP A 60 17.859 5.280 -14.360 1.00 0.00 C ATOM 846 OD1 ASP A 60 18.220 4.962 -15.512 1.00 0.00 O ATOM 847 OD2 ASP A 60 17.625 6.458 -14.016 1.00 0.00 O ATOM 0 H ASP A 60 17.450 1.846 -12.579 1.00 0.00 H new ATOM 0 HA ASP A 60 15.593 3.923 -12.978 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.724 4.619 -12.330 1.00 0.00 H new ATOM 0 HB3 ASP A 60 18.540 3.495 -13.398 1.00 0.00 H new ATOM 852 N LEU A 61 14.928 3.968 -15.352 1.00 0.00 N ATOM 853 CA LEU A 61 14.469 3.971 -16.737 1.00 0.00 C ATOM 854 C LEU A 61 15.247 4.988 -17.566 1.00 0.00 C ATOM 855 O LEU A 61 16.029 5.772 -17.029 1.00 0.00 O ATOM 856 CB LEU A 61 12.973 4.282 -16.799 1.00 0.00 C ATOM 857 CG LEU A 61 12.058 3.336 -16.021 1.00 0.00 C ATOM 858 CD1 LEU A 61 10.614 3.807 -16.098 1.00 0.00 C ATOM 859 CD2 LEU A 61 12.186 1.915 -16.549 1.00 0.00 C ATOM 0 H LEU A 61 14.336 4.495 -14.711 1.00 0.00 H new ATOM 0 HA LEU A 61 14.645 2.979 -17.154 1.00 0.00 H new ATOM 0 HB2 LEU A 61 12.817 5.294 -16.426 1.00 0.00 H new ATOM 0 HB3 LEU A 61 12.664 4.276 -17.844 1.00 0.00 H new ATOM 0 HG LEU A 61 12.366 3.342 -14.975 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.977 3.122 -15.539 1.00 0.00 H new ATOM 0 HD12 LEU A 61 10.534 4.807 -15.671 1.00 0.00 H new ATOM 0 HD13 LEU A 61 10.294 3.831 -17.140 1.00 0.00 H new ATOM 0 HD21 LEU A 61 11.528 1.256 -15.983 1.00 0.00 H new ATOM 0 HD22 LEU A 61 11.905 1.891 -17.602 1.00 0.00 H new ATOM 0 HD23 LEU A 61 13.217 1.578 -16.441 1.00 0.00 H new ATOM 871 N GLU A 62 15.025 4.969 -18.877 1.00 0.00 N ATOM 872 CA GLU A 62 15.704 5.891 -19.779 1.00 0.00 C ATOM 873 C GLU A 62 15.201 7.318 -19.579 1.00 0.00 C ATOM 874 O GLU A 62 15.957 8.280 -19.723 1.00 0.00 O ATOM 875 CB GLU A 62 15.494 5.464 -21.233 1.00 0.00 C ATOM 876 CG GLU A 62 16.357 4.286 -21.652 1.00 0.00 C ATOM 877 CD GLU A 62 17.838 4.612 -21.636 1.00 0.00 C ATOM 878 OE1 GLU A 62 18.437 4.598 -20.541 1.00 0.00 O ATOM 879 OE2 GLU A 62 18.397 4.882 -22.720 1.00 0.00 O ATOM 0 H GLU A 62 14.381 4.326 -19.337 1.00 0.00 H new ATOM 0 HA GLU A 62 16.769 5.864 -19.550 1.00 0.00 H new ATOM 0 HB2 GLU A 62 14.445 5.205 -21.379 1.00 0.00 H new ATOM 0 HB3 GLU A 62 15.707 6.310 -21.886 1.00 0.00 H new ATOM 0 HG2 GLU A 62 16.167 3.446 -20.984 1.00 0.00 H new ATOM 0 HG3 GLU A 62 16.070 3.968 -22.654 1.00 0.00 H new ATOM 886 N ASP A 63 13.922 7.447 -19.247 1.00 0.00 N ATOM 887 CA ASP A 63 13.317 8.755 -19.026 1.00 0.00 C ATOM 888 C ASP A 63 13.767 9.344 -17.693 1.00 0.00 C ATOM 889 O ASP A 63 13.735 10.558 -17.496 1.00 0.00 O ATOM 890 CB ASP A 63 11.792 8.648 -19.061 1.00 0.00 C ATOM 891 CG ASP A 63 11.253 8.522 -20.473 1.00 0.00 C ATOM 892 OD1 ASP A 63 11.198 7.386 -20.987 1.00 0.00 O ATOM 893 OD2 ASP A 63 10.886 9.560 -21.063 1.00 0.00 O ATOM 0 H ASP A 63 13.283 6.661 -19.125 1.00 0.00 H new ATOM 0 HA ASP A 63 13.645 9.419 -19.826 1.00 0.00 H new ATOM 0 HB2 ASP A 63 11.478 7.783 -18.477 1.00 0.00 H new ATOM 0 HB3 ASP A 63 11.358 9.528 -18.587 1.00 0.00 H new ATOM 898 N GLY A 64 14.186 8.474 -16.778 1.00 0.00 N ATOM 899 CA GLY A 64 14.635 8.927 -15.475 1.00 0.00 C ATOM 900 C GLY A 64 13.789 8.373 -14.345 1.00 0.00 C ATOM 901 O GLY A 64 14.221 8.343 -13.192 1.00 0.00 O ATOM 0 H GLY A 64 14.222 7.464 -16.917 1.00 0.00 H new ATOM 0 HA2 GLY A 64 15.673 8.628 -15.328 1.00 0.00 H new ATOM 0 HA3 GLY A 64 14.609 10.016 -15.444 1.00 0.00 H new ATOM 905 N THR A 65 12.579 7.933 -14.675 1.00 0.00 N ATOM 906 CA THR A 65 11.669 7.381 -13.680 1.00 0.00 C ATOM 907 C THR A 65 12.086 5.971 -13.277 1.00 0.00 C ATOM 908 O THR A 65 13.021 5.404 -13.843 1.00 0.00 O ATOM 909 CB THR A 65 10.220 7.346 -14.201 1.00 0.00 C ATOM 910 OG1 THR A 65 10.190 6.813 -15.530 1.00 0.00 O ATOM 911 CG2 THR A 65 9.608 8.739 -14.194 1.00 0.00 C ATOM 0 H THR A 65 12.207 7.948 -15.624 1.00 0.00 H new ATOM 0 HA THR A 65 11.718 8.035 -12.809 1.00 0.00 H new ATOM 0 HB THR A 65 9.635 6.706 -13.540 1.00 0.00 H new ATOM 0 HG1 THR A 65 9.265 6.792 -15.853 1.00 0.00 H new ATOM 0 HG21 THR A 65 8.585 8.689 -14.566 1.00 0.00 H new ATOM 0 HG22 THR A 65 9.605 9.130 -13.177 1.00 0.00 H new ATOM 0 HG23 THR A 65 10.195 9.397 -14.834 1.00 0.00 H new ATOM 919 N CYS A 66 11.387 5.410 -12.296 1.00 0.00 N ATOM 920 CA CYS A 66 11.685 4.065 -11.817 1.00 0.00 C ATOM 921 C CYS A 66 10.451 3.173 -11.898 1.00 0.00 C ATOM 922 O CYS A 66 9.365 3.555 -11.460 1.00 0.00 O ATOM 923 CB CYS A 66 12.198 4.117 -10.377 1.00 0.00 C ATOM 924 SG CYS A 66 13.985 4.354 -10.239 1.00 0.00 S ATOM 0 H CYS A 66 10.610 5.866 -11.817 1.00 0.00 H new ATOM 0 HA CYS A 66 12.459 3.641 -12.456 1.00 0.00 H new ATOM 0 HB2 CYS A 66 11.693 4.928 -9.852 1.00 0.00 H new ATOM 0 HB3 CYS A 66 11.925 3.191 -9.872 1.00 0.00 H new ATOM 0 HG CYS A 66 14.323 4.387 -8.984 1.00 0.00 H new ATOM 930 N LYS A 67 10.624 1.982 -12.462 1.00 0.00 N ATOM 931 CA LYS A 67 9.525 1.034 -12.601 1.00 0.00 C ATOM 932 C LYS A 67 9.676 -0.123 -11.620 1.00 0.00 C ATOM 933 O LYS A 67 10.508 -1.010 -11.813 1.00 0.00 O ATOM 934 CB LYS A 67 9.466 0.498 -14.033 1.00 0.00 C ATOM 935 CG LYS A 67 8.220 -0.321 -14.325 1.00 0.00 C ATOM 936 CD LYS A 67 8.005 -0.496 -15.819 1.00 0.00 C ATOM 937 CE LYS A 67 9.017 -1.462 -16.418 1.00 0.00 C ATOM 938 NZ LYS A 67 8.535 -2.870 -16.370 1.00 0.00 N ATOM 0 H LYS A 67 11.516 1.650 -12.830 1.00 0.00 H new ATOM 0 HA LYS A 67 8.596 1.558 -12.376 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.511 1.336 -14.728 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.347 -0.117 -14.218 1.00 0.00 H new ATOM 0 HG2 LYS A 67 8.307 -1.299 -13.852 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.351 0.169 -13.886 1.00 0.00 H new ATOM 0 HD2 LYS A 67 6.996 -0.865 -16.002 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.086 0.471 -16.315 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.218 -1.182 -17.452 1.00 0.00 H new ATOM 0 HE3 LYS A 67 9.960 -1.382 -15.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.252 -3.497 -16.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.367 -3.146 -15.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 7.649 -2.952 -16.908 1.00 0.00 H new ATOM 952 N VAL A 68 8.866 -0.110 -10.566 1.00 0.00 N ATOM 953 CA VAL A 68 8.909 -1.160 -9.555 1.00 0.00 C ATOM 954 C VAL A 68 8.254 -2.439 -10.064 1.00 0.00 C ATOM 955 O VAL A 68 7.292 -2.394 -10.830 1.00 0.00 O ATOM 956 CB VAL A 68 8.207 -0.718 -8.257 1.00 0.00 C ATOM 957 CG1 VAL A 68 8.182 -1.857 -7.249 1.00 0.00 C ATOM 958 CG2 VAL A 68 8.892 0.508 -7.672 1.00 0.00 C ATOM 0 H VAL A 68 8.172 0.616 -10.390 1.00 0.00 H new ATOM 0 HA VAL A 68 9.961 -1.353 -9.343 1.00 0.00 H new ATOM 0 HB VAL A 68 7.177 -0.452 -8.494 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.682 -1.526 -6.339 1.00 0.00 H new ATOM 0 HG12 VAL A 68 7.643 -2.705 -7.671 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.203 -2.157 -7.014 1.00 0.00 H new ATOM 0 HG21 VAL A 68 8.383 0.807 -6.756 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.932 0.272 -7.449 1.00 0.00 H new ATOM 0 HG23 VAL A 68 8.852 1.325 -8.392 1.00 0.00 H new ATOM 968 N SER A 69 8.782 -3.580 -9.631 1.00 0.00 N ATOM 969 CA SER A 69 8.251 -4.873 -10.046 1.00 0.00 C ATOM 970 C SER A 69 8.265 -5.863 -8.885 1.00 0.00 C ATOM 971 O SER A 69 9.290 -6.053 -8.229 1.00 0.00 O ATOM 972 CB SER A 69 9.063 -5.430 -11.216 1.00 0.00 C ATOM 973 OG SER A 69 9.193 -4.469 -12.250 1.00 0.00 O ATOM 0 H SER A 69 9.576 -3.635 -8.994 1.00 0.00 H new ATOM 0 HA SER A 69 7.219 -4.729 -10.366 1.00 0.00 H new ATOM 0 HB2 SER A 69 10.051 -5.729 -10.867 1.00 0.00 H new ATOM 0 HB3 SER A 69 8.578 -6.325 -11.606 1.00 0.00 H new ATOM 0 HG SER A 69 9.717 -4.849 -12.986 1.00 0.00 H new ATOM 979 N TYR A 70 7.121 -6.491 -8.637 1.00 0.00 N ATOM 980 CA TYR A 70 7.000 -7.460 -7.554 1.00 0.00 C ATOM 981 C TYR A 70 6.113 -8.630 -7.967 1.00 0.00 C ATOM 982 O TYR A 70 5.177 -8.469 -8.751 1.00 0.00 O ATOM 983 CB TYR A 70 6.431 -6.790 -6.303 1.00 0.00 C ATOM 984 CG TYR A 70 4.937 -6.563 -6.364 1.00 0.00 C ATOM 985 CD1 TYR A 70 4.048 -7.533 -5.918 1.00 0.00 C ATOM 986 CD2 TYR A 70 4.415 -5.378 -6.868 1.00 0.00 C ATOM 987 CE1 TYR A 70 2.683 -7.331 -5.973 1.00 0.00 C ATOM 988 CE2 TYR A 70 3.051 -5.166 -6.926 1.00 0.00 C ATOM 989 CZ TYR A 70 2.189 -6.146 -6.477 1.00 0.00 C ATOM 990 OH TYR A 70 0.830 -5.939 -6.532 1.00 0.00 O ATOM 0 H TYR A 70 6.264 -6.346 -9.171 1.00 0.00 H new ATOM 0 HA TYR A 70 7.996 -7.844 -7.331 1.00 0.00 H new ATOM 0 HB2 TYR A 70 6.661 -7.407 -5.434 1.00 0.00 H new ATOM 0 HB3 TYR A 70 6.930 -5.832 -6.155 1.00 0.00 H new ATOM 0 HD1 TYR A 70 4.431 -8.462 -5.521 1.00 0.00 H new ATOM 0 HD2 TYR A 70 5.087 -4.610 -7.220 1.00 0.00 H new ATOM 0 HE1 TYR A 70 2.006 -8.097 -5.623 1.00 0.00 H new ATOM 0 HE2 TYR A 70 2.662 -4.239 -7.320 1.00 0.00 H new ATOM 0 HH TYR A 70 0.649 -5.054 -6.912 1.00 0.00 H new ATOM 1000 N PHE A 71 6.413 -9.809 -7.433 1.00 0.00 N ATOM 1001 CA PHE A 71 5.643 -11.008 -7.745 1.00 0.00 C ATOM 1002 C PHE A 71 5.035 -11.608 -6.480 1.00 0.00 C ATOM 1003 O PHE A 71 5.695 -12.318 -5.720 1.00 0.00 O ATOM 1004 CB PHE A 71 6.531 -12.043 -8.438 1.00 0.00 C ATOM 1005 CG PHE A 71 5.757 -13.087 -9.193 1.00 0.00 C ATOM 1006 CD1 PHE A 71 5.076 -12.759 -10.353 1.00 0.00 C ATOM 1007 CD2 PHE A 71 5.713 -14.396 -8.741 1.00 0.00 C ATOM 1008 CE1 PHE A 71 4.363 -13.717 -11.049 1.00 0.00 C ATOM 1009 CE2 PHE A 71 5.002 -15.359 -9.433 1.00 0.00 C ATOM 1010 CZ PHE A 71 4.327 -15.019 -10.589 1.00 0.00 C ATOM 0 H PHE A 71 7.184 -9.960 -6.782 1.00 0.00 H new ATOM 0 HA PHE A 71 4.833 -10.725 -8.418 1.00 0.00 H new ATOM 0 HB2 PHE A 71 7.203 -11.531 -9.127 1.00 0.00 H new ATOM 0 HB3 PHE A 71 7.155 -12.534 -7.691 1.00 0.00 H new ATOM 0 HD1 PHE A 71 5.102 -11.743 -10.718 1.00 0.00 H new ATOM 0 HD2 PHE A 71 6.240 -14.667 -7.838 1.00 0.00 H new ATOM 0 HE1 PHE A 71 3.835 -13.448 -11.952 1.00 0.00 H new ATOM 0 HE2 PHE A 71 4.974 -16.376 -9.070 1.00 0.00 H new ATOM 0 HZ PHE A 71 3.772 -15.770 -11.132 1.00 0.00 H new ATOM 1020 N PRO A 72 3.747 -11.317 -6.249 1.00 0.00 N ATOM 1021 CA PRO A 72 3.020 -11.817 -5.078 1.00 0.00 C ATOM 1022 C PRO A 72 2.769 -13.320 -5.149 1.00 0.00 C ATOM 1023 O PRO A 72 2.672 -13.893 -6.235 1.00 0.00 O ATOM 1024 CB PRO A 72 1.696 -11.051 -5.128 1.00 0.00 C ATOM 1025 CG PRO A 72 1.516 -10.698 -6.564 1.00 0.00 C ATOM 1026 CD PRO A 72 2.899 -10.478 -7.112 1.00 0.00 C ATOM 0 HA PRO A 72 3.581 -11.666 -4.156 1.00 0.00 H new ATOM 0 HB2 PRO A 72 0.871 -11.663 -4.764 1.00 0.00 H new ATOM 0 HB3 PRO A 72 1.731 -10.159 -4.503 1.00 0.00 H new ATOM 0 HG2 PRO A 72 1.006 -11.497 -7.101 1.00 0.00 H new ATOM 0 HG3 PRO A 72 0.906 -9.801 -6.672 1.00 0.00 H new ATOM 0 HD2 PRO A 72 2.969 -10.778 -8.158 1.00 0.00 H new ATOM 0 HD3 PRO A 72 3.189 -9.428 -7.061 1.00 0.00 H new ATOM 1034 N THR A 73 2.665 -13.954 -3.985 1.00 0.00 N ATOM 1035 CA THR A 73 2.426 -15.390 -3.916 1.00 0.00 C ATOM 1036 C THR A 73 1.174 -15.700 -3.104 1.00 0.00 C ATOM 1037 O THR A 73 0.502 -16.705 -3.340 1.00 0.00 O ATOM 1038 CB THR A 73 3.625 -16.129 -3.293 1.00 0.00 C ATOM 1039 OG1 THR A 73 3.907 -15.598 -1.994 1.00 0.00 O ATOM 1040 CG2 THR A 73 4.857 -16.003 -4.176 1.00 0.00 C ATOM 0 H THR A 73 2.743 -13.495 -3.077 1.00 0.00 H new ATOM 0 HA THR A 73 2.287 -15.737 -4.940 1.00 0.00 H new ATOM 0 HB THR A 73 3.367 -17.184 -3.205 1.00 0.00 H new ATOM 0 HG1 THR A 73 4.670 -16.075 -1.604 1.00 0.00 H new ATOM 0 HG21 THR A 73 5.691 -16.533 -3.715 1.00 0.00 H new ATOM 0 HG22 THR A 73 4.649 -16.435 -5.155 1.00 0.00 H new ATOM 0 HG23 THR A 73 5.116 -14.950 -4.292 1.00 0.00 H new ATOM 1048 N VAL A 74 0.864 -14.832 -2.147 1.00 0.00 N ATOM 1049 CA VAL A 74 -0.309 -15.012 -1.300 1.00 0.00 C ATOM 1050 C VAL A 74 -1.221 -13.792 -1.358 1.00 0.00 C ATOM 1051 O VAL A 74 -0.778 -12.649 -1.244 1.00 0.00 O ATOM 1052 CB VAL A 74 0.090 -15.273 0.164 1.00 0.00 C ATOM 1053 CG1 VAL A 74 -1.146 -15.374 1.045 1.00 0.00 C ATOM 1054 CG2 VAL A 74 0.935 -16.534 0.270 1.00 0.00 C ATOM 0 H VAL A 74 1.410 -13.996 -1.938 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.845 -15.881 -1.682 1.00 0.00 H new ATOM 0 HB VAL A 74 0.688 -14.432 0.514 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.844 -15.559 2.076 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.707 -14.441 0.993 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.774 -16.195 0.698 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.208 -16.703 1.312 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.364 -17.386 -0.098 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.839 -16.417 -0.327 1.00 0.00 H new ATOM 1064 N PRO A 75 -2.528 -14.038 -1.538 1.00 0.00 N ATOM 1065 CA PRO A 75 -3.531 -12.972 -1.613 1.00 0.00 C ATOM 1066 C PRO A 75 -3.745 -12.282 -0.270 1.00 0.00 C ATOM 1067 O PRO A 75 -3.475 -12.856 0.784 1.00 0.00 O ATOM 1068 CB PRO A 75 -4.801 -13.710 -2.044 1.00 0.00 C ATOM 1069 CG PRO A 75 -4.602 -15.111 -1.577 1.00 0.00 C ATOM 1070 CD PRO A 75 -3.126 -15.376 -1.681 1.00 0.00 C ATOM 0 HA PRO A 75 -3.231 -12.177 -2.296 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -5.689 -13.265 -1.595 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -4.936 -13.668 -3.125 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -4.949 -15.233 -0.551 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -5.168 -15.811 -2.191 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -2.784 -16.055 -0.900 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -2.866 -15.832 -2.636 1.00 0.00 H new ATOM 1078 N GLY A 76 -4.234 -11.046 -0.317 1.00 0.00 N ATOM 1079 CA GLY A 76 -4.477 -10.299 0.903 1.00 0.00 C ATOM 1080 C GLY A 76 -4.316 -8.804 0.709 1.00 0.00 C ATOM 1081 O GLY A 76 -4.844 -8.234 -0.246 1.00 0.00 O ATOM 0 H GLY A 76 -4.466 -10.550 -1.177 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.485 -10.510 1.260 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -3.788 -10.638 1.677 1.00 0.00 H new ATOM 1085 N VAL A 77 -3.586 -8.166 1.618 1.00 0.00 N ATOM 1086 CA VAL A 77 -3.357 -6.728 1.543 1.00 0.00 C ATOM 1087 C VAL A 77 -1.867 -6.408 1.529 1.00 0.00 C ATOM 1088 O VAL A 77 -1.168 -6.612 2.522 1.00 0.00 O ATOM 1089 CB VAL A 77 -4.018 -5.992 2.724 1.00 0.00 C ATOM 1090 CG1 VAL A 77 -3.775 -4.494 2.623 1.00 0.00 C ATOM 1091 CG2 VAL A 77 -5.508 -6.296 2.774 1.00 0.00 C ATOM 0 H VAL A 77 -3.143 -8.622 2.415 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.808 -6.384 0.612 1.00 0.00 H new ATOM 0 HB VAL A 77 -3.566 -6.348 3.650 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.249 -3.991 3.466 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.703 -4.297 2.640 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -4.198 -4.119 1.691 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.959 -5.768 3.614 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -5.977 -5.969 1.846 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.657 -7.369 2.898 1.00 0.00 H new ATOM 1101 N TYR A 78 -1.386 -5.905 0.398 1.00 0.00 N ATOM 1102 CA TYR A 78 0.023 -5.558 0.253 1.00 0.00 C ATOM 1103 C TYR A 78 0.235 -4.057 0.424 1.00 0.00 C ATOM 1104 O TYR A 78 -0.263 -3.255 -0.366 1.00 0.00 O ATOM 1105 CB TYR A 78 0.543 -6.006 -1.114 1.00 0.00 C ATOM 1106 CG TYR A 78 0.805 -7.492 -1.205 1.00 0.00 C ATOM 1107 CD1 TYR A 78 2.028 -8.026 -0.820 1.00 0.00 C ATOM 1108 CD2 TYR A 78 -0.171 -8.362 -1.676 1.00 0.00 C ATOM 1109 CE1 TYR A 78 2.273 -9.383 -0.903 1.00 0.00 C ATOM 1110 CE2 TYR A 78 0.064 -9.721 -1.761 1.00 0.00 C ATOM 1111 CZ TYR A 78 1.288 -10.226 -1.374 1.00 0.00 C ATOM 1112 OH TYR A 78 1.527 -11.579 -1.456 1.00 0.00 O ATOM 0 H TYR A 78 -1.951 -5.728 -0.432 1.00 0.00 H new ATOM 0 HA TYR A 78 0.580 -6.076 1.033 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -0.182 -5.726 -1.879 1.00 0.00 H new ATOM 0 HB3 TYR A 78 1.465 -5.469 -1.337 1.00 0.00 H new ATOM 0 HD1 TYR A 78 2.801 -7.369 -0.449 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -1.130 -7.969 -1.981 1.00 0.00 H new ATOM 0 HE1 TYR A 78 3.230 -9.782 -0.601 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.706 -10.384 -2.128 1.00 0.00 H new ATOM 0 HH TYR A 78 0.695 -12.045 -1.683 1.00 0.00 H new ATOM 1122 N ILE A 79 0.977 -3.686 1.462 1.00 0.00 N ATOM 1123 CA ILE A 79 1.257 -2.282 1.736 1.00 0.00 C ATOM 1124 C ILE A 79 2.512 -1.818 1.005 1.00 0.00 C ATOM 1125 O ILE A 79 3.631 -2.146 1.400 1.00 0.00 O ATOM 1126 CB ILE A 79 1.433 -2.027 3.245 1.00 0.00 C ATOM 1127 CG1 ILE A 79 0.138 -2.353 3.993 1.00 0.00 C ATOM 1128 CG2 ILE A 79 1.846 -0.585 3.494 1.00 0.00 C ATOM 1129 CD1 ILE A 79 -1.112 -1.974 3.231 1.00 0.00 C ATOM 0 H ILE A 79 1.395 -4.337 2.126 1.00 0.00 H new ATOM 0 HA ILE A 79 0.399 -1.714 1.377 1.00 0.00 H new ATOM 0 HB ILE A 79 2.222 -2.680 3.620 1.00 0.00 H new ATOM 0 HG12 ILE A 79 0.112 -3.421 4.209 1.00 0.00 H new ATOM 0 HG13 ILE A 79 0.141 -1.834 4.951 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.966 -0.421 4.565 1.00 0.00 H new ATOM 0 HG22 ILE A 79 2.790 -0.384 2.988 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.078 0.085 3.108 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.991 -2.234 3.821 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.109 -0.901 3.038 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -1.138 -2.513 2.284 1.00 0.00 H new ATOM 1141 N VAL A 80 2.319 -1.051 -0.064 1.00 0.00 N ATOM 1142 CA VAL A 80 3.435 -0.539 -0.850 1.00 0.00 C ATOM 1143 C VAL A 80 3.965 0.766 -0.266 1.00 0.00 C ATOM 1144 O VAL A 80 3.384 1.831 -0.471 1.00 0.00 O ATOM 1145 CB VAL A 80 3.028 -0.305 -2.316 1.00 0.00 C ATOM 1146 CG1 VAL A 80 4.147 0.391 -3.077 1.00 0.00 C ATOM 1147 CG2 VAL A 80 2.658 -1.621 -2.983 1.00 0.00 C ATOM 0 H VAL A 80 1.400 -0.771 -0.405 1.00 0.00 H new ATOM 0 HA VAL A 80 4.220 -1.294 -0.815 1.00 0.00 H new ATOM 0 HB VAL A 80 2.152 0.343 -2.332 1.00 0.00 H new ATOM 0 HG11 VAL A 80 3.841 0.548 -4.111 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.360 1.353 -2.612 1.00 0.00 H new ATOM 0 HG13 VAL A 80 5.043 -0.229 -3.054 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.373 -1.436 -4.019 1.00 0.00 H new ATOM 0 HG22 VAL A 80 3.514 -2.295 -2.957 1.00 0.00 H new ATOM 0 HG23 VAL A 80 1.822 -2.076 -2.452 1.00 0.00 H new ATOM 1157 N SER A 81 5.073 0.675 0.462 1.00 0.00 N ATOM 1158 CA SER A 81 5.681 1.848 1.079 1.00 0.00 C ATOM 1159 C SER A 81 6.450 2.667 0.047 1.00 0.00 C ATOM 1160 O SER A 81 7.607 2.376 -0.259 1.00 0.00 O ATOM 1161 CB SER A 81 6.618 1.427 2.213 1.00 0.00 C ATOM 1162 OG SER A 81 7.719 0.686 1.716 1.00 0.00 O ATOM 0 H SER A 81 5.568 -0.199 0.639 1.00 0.00 H new ATOM 0 HA SER A 81 4.883 2.467 1.488 1.00 0.00 H new ATOM 0 HB2 SER A 81 6.978 2.311 2.739 1.00 0.00 H new ATOM 0 HB3 SER A 81 6.069 0.827 2.939 1.00 0.00 H new ATOM 0 HG SER A 81 8.168 1.200 1.012 1.00 0.00 H new ATOM 1168 N THR A 82 5.798 3.695 -0.488 1.00 0.00 N ATOM 1169 CA THR A 82 6.418 4.557 -1.486 1.00 0.00 C ATOM 1170 C THR A 82 6.848 5.886 -0.875 1.00 0.00 C ATOM 1171 O THR A 82 6.014 6.689 -0.458 1.00 0.00 O ATOM 1172 CB THR A 82 5.462 4.832 -2.663 1.00 0.00 C ATOM 1173 OG1 THR A 82 4.984 3.596 -3.205 1.00 0.00 O ATOM 1174 CG2 THR A 82 6.160 5.633 -3.751 1.00 0.00 C ATOM 0 H THR A 82 4.841 3.950 -0.246 1.00 0.00 H new ATOM 0 HA THR A 82 7.297 4.029 -1.856 1.00 0.00 H new ATOM 0 HB THR A 82 4.619 5.414 -2.290 1.00 0.00 H new ATOM 0 HG1 THR A 82 4.376 3.779 -3.951 1.00 0.00 H new ATOM 0 HG21 THR A 82 5.466 5.815 -4.571 1.00 0.00 H new ATOM 0 HG22 THR A 82 6.496 6.586 -3.342 1.00 0.00 H new ATOM 0 HG23 THR A 82 7.019 5.073 -4.120 1.00 0.00 H new ATOM 1182 N LYS A 83 8.157 6.112 -0.825 1.00 0.00 N ATOM 1183 CA LYS A 83 8.699 7.345 -0.266 1.00 0.00 C ATOM 1184 C LYS A 83 9.642 8.022 -1.256 1.00 0.00 C ATOM 1185 O LYS A 83 10.261 7.361 -2.091 1.00 0.00 O ATOM 1186 CB LYS A 83 9.439 7.054 1.042 1.00 0.00 C ATOM 1187 CG LYS A 83 8.533 7.031 2.260 1.00 0.00 C ATOM 1188 CD LYS A 83 9.330 7.125 3.550 1.00 0.00 C ATOM 1189 CE LYS A 83 9.838 5.762 3.993 1.00 0.00 C ATOM 1190 NZ LYS A 83 11.078 5.870 4.811 1.00 0.00 N ATOM 0 H LYS A 83 8.862 5.457 -1.165 1.00 0.00 H new ATOM 0 HA LYS A 83 7.867 8.020 -0.063 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.945 6.092 0.957 1.00 0.00 H new ATOM 0 HB3 LYS A 83 10.212 7.809 1.188 1.00 0.00 H new ATOM 0 HG2 LYS A 83 7.828 7.860 2.206 1.00 0.00 H new ATOM 0 HG3 LYS A 83 7.946 6.113 2.260 1.00 0.00 H new ATOM 0 HD2 LYS A 83 10.174 7.800 3.409 1.00 0.00 H new ATOM 0 HD3 LYS A 83 8.706 7.554 4.334 1.00 0.00 H new ATOM 0 HE2 LYS A 83 9.064 5.257 4.571 1.00 0.00 H new ATOM 0 HE3 LYS A 83 10.034 5.145 3.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 11.392 4.919 5.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 11.824 6.329 4.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 10.885 6.437 5.661 1.00 0.00 H new ATOM 1204 N PHE A 84 9.749 9.342 -1.156 1.00 0.00 N ATOM 1205 CA PHE A 84 10.617 10.109 -2.042 1.00 0.00 C ATOM 1206 C PHE A 84 11.215 11.309 -1.314 1.00 0.00 C ATOM 1207 O PHE A 84 10.517 12.276 -1.012 1.00 0.00 O ATOM 1208 CB PHE A 84 9.838 10.581 -3.272 1.00 0.00 C ATOM 1209 CG PHE A 84 10.558 11.627 -4.072 1.00 0.00 C ATOM 1210 CD1 PHE A 84 11.604 11.279 -4.911 1.00 0.00 C ATOM 1211 CD2 PHE A 84 10.190 12.960 -3.986 1.00 0.00 C ATOM 1212 CE1 PHE A 84 12.269 12.239 -5.650 1.00 0.00 C ATOM 1213 CE2 PHE A 84 10.851 13.925 -4.722 1.00 0.00 C ATOM 1214 CZ PHE A 84 11.892 13.565 -5.554 1.00 0.00 C ATOM 0 H PHE A 84 9.245 9.904 -0.470 1.00 0.00 H new ATOM 0 HA PHE A 84 11.431 9.459 -2.363 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.631 9.724 -3.912 1.00 0.00 H new ATOM 0 HB3 PHE A 84 8.875 10.979 -2.952 1.00 0.00 H new ATOM 0 HD1 PHE A 84 11.904 10.244 -4.989 1.00 0.00 H new ATOM 0 HD2 PHE A 84 9.377 13.248 -3.336 1.00 0.00 H new ATOM 0 HE1 PHE A 84 13.082 11.953 -6.301 1.00 0.00 H new ATOM 0 HE2 PHE A 84 10.553 14.960 -4.646 1.00 0.00 H new ATOM 0 HZ PHE A 84 12.411 14.318 -6.129 1.00 0.00 H new ATOM 1224 N ALA A 85 12.512 11.237 -1.033 1.00 0.00 N ATOM 1225 CA ALA A 85 13.205 12.316 -0.342 1.00 0.00 C ATOM 1226 C ALA A 85 12.705 12.461 1.091 1.00 0.00 C ATOM 1227 O ALA A 85 12.447 13.570 1.560 1.00 0.00 O ATOM 1228 CB ALA A 85 13.032 13.625 -1.098 1.00 0.00 C ATOM 0 H ALA A 85 13.104 10.442 -1.274 1.00 0.00 H new ATOM 0 HA ALA A 85 14.266 12.068 -0.306 1.00 0.00 H new ATOM 0 HB1 ALA A 85 13.555 14.422 -0.570 1.00 0.00 H new ATOM 0 HB2 ALA A 85 13.445 13.523 -2.102 1.00 0.00 H new ATOM 0 HB3 ALA A 85 11.972 13.869 -1.165 1.00 0.00 H new ATOM 1234 N ASP A 86 12.569 11.334 1.782 1.00 0.00 N ATOM 1235 CA ASP A 86 12.099 11.336 3.163 1.00 0.00 C ATOM 1236 C ASP A 86 10.681 11.891 3.253 1.00 0.00 C ATOM 1237 O ASP A 86 10.381 12.716 4.116 1.00 0.00 O ATOM 1238 CB ASP A 86 13.039 12.160 4.043 1.00 0.00 C ATOM 1239 CG ASP A 86 14.500 11.914 3.719 1.00 0.00 C ATOM 1240 OD1 ASP A 86 14.909 10.735 3.679 1.00 0.00 O ATOM 1241 OD2 ASP A 86 15.233 12.901 3.503 1.00 0.00 O ATOM 0 H ASP A 86 12.777 10.408 1.409 1.00 0.00 H new ATOM 0 HA ASP A 86 12.090 10.306 3.520 1.00 0.00 H new ATOM 0 HB2 ASP A 86 12.815 13.219 3.916 1.00 0.00 H new ATOM 0 HB3 ASP A 86 12.856 11.919 5.090 1.00 0.00 H new ATOM 1246 N GLU A 87 9.813 11.432 2.357 1.00 0.00 N ATOM 1247 CA GLU A 87 8.427 11.885 2.335 1.00 0.00 C ATOM 1248 C GLU A 87 7.550 10.917 1.547 1.00 0.00 C ATOM 1249 O GLU A 87 7.803 10.648 0.372 1.00 0.00 O ATOM 1250 CB GLU A 87 8.334 13.286 1.726 1.00 0.00 C ATOM 1251 CG GLU A 87 8.614 14.401 2.720 1.00 0.00 C ATOM 1252 CD GLU A 87 8.177 15.760 2.209 1.00 0.00 C ATOM 1253 OE1 GLU A 87 8.077 15.926 0.975 1.00 0.00 O ATOM 1254 OE2 GLU A 87 7.934 16.658 3.042 1.00 0.00 O ATOM 0 H GLU A 87 10.045 10.747 1.637 1.00 0.00 H new ATOM 0 HA GLU A 87 8.067 11.919 3.363 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.041 13.361 0.899 1.00 0.00 H new ATOM 0 HB3 GLU A 87 7.337 13.426 1.307 1.00 0.00 H new ATOM 0 HG2 GLU A 87 8.099 14.186 3.656 1.00 0.00 H new ATOM 0 HG3 GLU A 87 9.681 14.426 2.942 1.00 0.00 H new ATOM 1261 N HIS A 88 6.518 10.394 2.201 1.00 0.00 N ATOM 1262 CA HIS A 88 5.603 9.455 1.562 1.00 0.00 C ATOM 1263 C HIS A 88 4.682 10.176 0.582 1.00 0.00 C ATOM 1264 O HIS A 88 4.169 11.256 0.876 1.00 0.00 O ATOM 1265 CB HIS A 88 4.772 8.722 2.616 1.00 0.00 C ATOM 1266 CG HIS A 88 5.401 7.451 3.097 1.00 0.00 C ATOM 1267 ND1 HIS A 88 5.102 6.215 2.565 1.00 0.00 N ATOM 1268 CD2 HIS A 88 6.320 7.229 4.066 1.00 0.00 C ATOM 1269 CE1 HIS A 88 5.808 5.287 3.187 1.00 0.00 C ATOM 1270 NE2 HIS A 88 6.555 5.877 4.102 1.00 0.00 N ATOM 0 H HIS A 88 6.294 10.605 3.174 1.00 0.00 H new ATOM 0 HA HIS A 88 6.196 8.728 1.008 1.00 0.00 H new ATOM 0 HB2 HIS A 88 4.614 9.384 3.467 1.00 0.00 H new ATOM 0 HB3 HIS A 88 3.790 8.497 2.200 1.00 0.00 H new ATOM 0 HD1 HIS A 88 4.439 6.043 1.809 1.00 0.00 H new ATOM 0 HD2 HIS A 88 6.782 7.976 4.694 1.00 0.00 H new ATOM 0 HE1 HIS A 88 5.779 4.227 2.982 1.00 0.00 H new ATOM 1279 N VAL A 89 4.477 9.571 -0.584 1.00 0.00 N ATOM 1280 CA VAL A 89 3.618 10.154 -1.607 1.00 0.00 C ATOM 1281 C VAL A 89 2.234 10.469 -1.049 1.00 0.00 C ATOM 1282 O VAL A 89 1.806 9.916 -0.036 1.00 0.00 O ATOM 1283 CB VAL A 89 3.469 9.214 -2.818 1.00 0.00 C ATOM 1284 CG1 VAL A 89 4.587 9.455 -3.821 1.00 0.00 C ATOM 1285 CG2 VAL A 89 3.451 7.762 -2.365 1.00 0.00 C ATOM 0 H VAL A 89 4.894 8.677 -0.843 1.00 0.00 H new ATOM 0 HA VAL A 89 4.095 11.079 -1.931 1.00 0.00 H new ATOM 0 HB VAL A 89 2.520 9.429 -3.310 1.00 0.00 H new ATOM 0 HG11 VAL A 89 4.466 8.782 -4.670 1.00 0.00 H new ATOM 0 HG12 VAL A 89 4.548 10.488 -4.168 1.00 0.00 H new ATOM 0 HG13 VAL A 89 5.550 9.268 -3.345 1.00 0.00 H new ATOM 0 HG21 VAL A 89 3.345 7.111 -3.233 1.00 0.00 H new ATOM 0 HG22 VAL A 89 4.383 7.530 -1.849 1.00 0.00 H new ATOM 0 HG23 VAL A 89 2.612 7.603 -1.688 1.00 0.00 H new ATOM 1295 N PRO A 90 1.517 11.378 -1.725 1.00 0.00 N ATOM 1296 CA PRO A 90 0.169 11.787 -1.315 1.00 0.00 C ATOM 1297 C PRO A 90 -0.859 10.680 -1.519 1.00 0.00 C ATOM 1298 O PRO A 90 -1.526 10.622 -2.551 1.00 0.00 O ATOM 1299 CB PRO A 90 -0.135 12.975 -2.232 1.00 0.00 C ATOM 1300 CG PRO A 90 0.715 12.752 -3.435 1.00 0.00 C ATOM 1301 CD PRO A 90 1.965 12.078 -2.941 1.00 0.00 C ATOM 0 HA PRO A 90 0.121 12.027 -0.253 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -1.192 13.011 -2.495 1.00 0.00 H new ATOM 0 HB3 PRO A 90 0.106 13.921 -1.747 1.00 0.00 H new ATOM 0 HG2 PRO A 90 0.200 12.130 -4.167 1.00 0.00 H new ATOM 0 HG3 PRO A 90 0.949 13.696 -3.927 1.00 0.00 H new ATOM 0 HD2 PRO A 90 2.366 11.384 -3.680 1.00 0.00 H new ATOM 0 HD3 PRO A 90 2.751 12.800 -2.722 1.00 0.00 H new ATOM 1309 N GLY A 91 -0.982 9.802 -0.528 1.00 0.00 N ATOM 1310 CA GLY A 91 -1.932 8.709 -0.619 1.00 0.00 C ATOM 1311 C GLY A 91 -1.390 7.420 -0.034 1.00 0.00 C ATOM 1312 O GLY A 91 -2.089 6.408 0.010 1.00 0.00 O ATOM 0 H GLY A 91 -0.441 9.828 0.336 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -2.849 8.984 -0.097 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -2.196 8.547 -1.664 1.00 0.00 H new ATOM 1316 N SER A 92 -0.139 7.455 0.413 1.00 0.00 N ATOM 1317 CA SER A 92 0.499 6.279 0.992 1.00 0.00 C ATOM 1318 C SER A 92 0.127 6.128 2.464 1.00 0.00 C ATOM 1319 O SER A 92 -0.313 7.073 3.120 1.00 0.00 O ATOM 1320 CB SER A 92 2.019 6.373 0.846 1.00 0.00 C ATOM 1321 OG SER A 92 2.455 5.759 -0.355 1.00 0.00 O ATOM 0 H SER A 92 0.453 8.285 0.385 1.00 0.00 H new ATOM 0 HA SER A 92 0.143 5.401 0.453 1.00 0.00 H new ATOM 0 HB2 SER A 92 2.324 7.419 0.855 1.00 0.00 H new ATOM 0 HB3 SER A 92 2.500 5.893 1.699 1.00 0.00 H new ATOM 0 HG SER A 92 3.430 5.834 -0.426 1.00 0.00 H new ATOM 1327 N PRO A 93 0.308 4.911 2.998 1.00 0.00 N ATOM 1328 CA PRO A 93 0.830 3.778 2.227 1.00 0.00 C ATOM 1329 C PRO A 93 -0.163 3.281 1.182 1.00 0.00 C ATOM 1330 O PRO A 93 -1.374 3.308 1.400 1.00 0.00 O ATOM 1331 CB PRO A 93 1.069 2.705 3.292 1.00 0.00 C ATOM 1332 CG PRO A 93 0.124 3.046 4.392 1.00 0.00 C ATOM 1333 CD PRO A 93 0.015 4.546 4.394 1.00 0.00 C ATOM 0 HA PRO A 93 1.724 4.045 1.664 1.00 0.00 H new ATOM 0 HB2 PRO A 93 0.875 1.707 2.899 1.00 0.00 H new ATOM 0 HB3 PRO A 93 2.102 2.716 3.640 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -0.850 2.584 4.227 1.00 0.00 H new ATOM 0 HG3 PRO A 93 0.492 2.680 5.350 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -0.979 4.876 4.696 1.00 0.00 H new ATOM 0 HD3 PRO A 93 0.725 5.000 5.085 1.00 0.00 H new ATOM 1341 N PHE A 94 0.358 2.827 0.047 1.00 0.00 N ATOM 1342 CA PHE A 94 -0.483 2.323 -1.032 1.00 0.00 C ATOM 1343 C PHE A 94 -0.972 0.910 -0.727 1.00 0.00 C ATOM 1344 O PHE A 94 -0.186 -0.038 -0.693 1.00 0.00 O ATOM 1345 CB PHE A 94 0.287 2.334 -2.355 1.00 0.00 C ATOM 1346 CG PHE A 94 0.165 3.628 -3.108 1.00 0.00 C ATOM 1347 CD1 PHE A 94 0.424 4.837 -2.482 1.00 0.00 C ATOM 1348 CD2 PHE A 94 -0.208 3.635 -4.442 1.00 0.00 C ATOM 1349 CE1 PHE A 94 0.314 6.029 -3.172 1.00 0.00 C ATOM 1350 CE2 PHE A 94 -0.320 4.825 -5.138 1.00 0.00 C ATOM 1351 CZ PHE A 94 -0.060 6.023 -4.502 1.00 0.00 C ATOM 0 H PHE A 94 1.359 2.798 -0.149 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.350 2.977 -1.118 1.00 0.00 H new ATOM 0 HB2 PHE A 94 1.340 2.137 -2.155 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -0.075 1.521 -2.984 1.00 0.00 H new ATOM 0 HD1 PHE A 94 0.715 4.848 -1.442 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.414 2.701 -4.944 1.00 0.00 H new ATOM 0 HE1 PHE A 94 0.520 6.964 -2.672 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.611 4.817 -6.178 1.00 0.00 H new ATOM 0 HZ PHE A 94 -0.149 6.953 -5.043 1.00 0.00 H new ATOM 1361 N THR A 95 -2.276 0.777 -0.506 1.00 0.00 N ATOM 1362 CA THR A 95 -2.871 -0.519 -0.201 1.00 0.00 C ATOM 1363 C THR A 95 -3.347 -1.217 -1.470 1.00 0.00 C ATOM 1364 O THR A 95 -4.283 -0.761 -2.127 1.00 0.00 O ATOM 1365 CB THR A 95 -4.058 -0.378 0.770 1.00 0.00 C ATOM 1366 OG1 THR A 95 -3.711 0.504 1.843 1.00 0.00 O ATOM 1367 CG2 THR A 95 -4.462 -1.733 1.331 1.00 0.00 C ATOM 0 H THR A 95 -2.940 1.551 -0.532 1.00 0.00 H new ATOM 0 HA THR A 95 -2.094 -1.120 0.272 1.00 0.00 H new ATOM 0 HB THR A 95 -4.903 0.036 0.219 1.00 0.00 H new ATOM 0 HG1 THR A 95 -4.472 0.590 2.455 1.00 0.00 H new ATOM 0 HG21 THR A 95 -5.302 -1.608 2.014 1.00 0.00 H new ATOM 0 HG22 THR A 95 -4.754 -2.393 0.514 1.00 0.00 H new ATOM 0 HG23 THR A 95 -3.620 -2.170 1.868 1.00 0.00 H new ATOM 1375 N VAL A 96 -2.697 -2.325 -1.810 1.00 0.00 N ATOM 1376 CA VAL A 96 -3.055 -3.088 -3.000 1.00 0.00 C ATOM 1377 C VAL A 96 -3.758 -4.388 -2.628 1.00 0.00 C ATOM 1378 O VAL A 96 -3.169 -5.269 -2.002 1.00 0.00 O ATOM 1379 CB VAL A 96 -1.815 -3.413 -3.853 1.00 0.00 C ATOM 1380 CG1 VAL A 96 -2.217 -4.153 -5.120 1.00 0.00 C ATOM 1381 CG2 VAL A 96 -1.050 -2.141 -4.188 1.00 0.00 C ATOM 0 H VAL A 96 -1.919 -2.715 -1.278 1.00 0.00 H new ATOM 0 HA VAL A 96 -3.734 -2.465 -3.583 1.00 0.00 H new ATOM 0 HB VAL A 96 -1.158 -4.063 -3.275 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -1.328 -4.374 -5.710 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.717 -5.084 -4.854 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -2.895 -3.531 -5.705 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -0.177 -2.390 -4.791 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.696 -1.464 -4.747 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -0.728 -1.657 -3.266 1.00 0.00 H new ATOM 1391 N LYS A 97 -5.023 -4.503 -3.018 1.00 0.00 N ATOM 1392 CA LYS A 97 -5.809 -5.697 -2.728 1.00 0.00 C ATOM 1393 C LYS A 97 -5.626 -6.747 -3.820 1.00 0.00 C ATOM 1394 O LYS A 97 -5.934 -6.502 -4.987 1.00 0.00 O ATOM 1395 CB LYS A 97 -7.290 -5.337 -2.595 1.00 0.00 C ATOM 1396 CG LYS A 97 -7.678 -4.862 -1.205 1.00 0.00 C ATOM 1397 CD LYS A 97 -9.186 -4.872 -1.013 1.00 0.00 C ATOM 1398 CE LYS A 97 -9.561 -4.790 0.458 1.00 0.00 C ATOM 1399 NZ LYS A 97 -11.032 -4.899 0.663 1.00 0.00 N ATOM 0 H LYS A 97 -5.526 -3.783 -3.536 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.456 -6.114 -1.785 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.532 -4.557 -3.317 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -7.892 -6.208 -2.853 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -7.211 -5.503 -0.457 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -7.296 -3.854 -1.044 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -9.628 -4.032 -1.549 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -9.603 -5.781 -1.446 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -9.058 -5.587 1.006 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -9.206 -3.846 0.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -11.246 -4.839 1.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -11.511 -4.124 0.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -11.368 -5.811 0.292 1.00 0.00 H new ATOM 1413 N ILE A 98 -5.124 -7.914 -3.433 1.00 0.00 N ATOM 1414 CA ILE A 98 -4.903 -9.002 -4.378 1.00 0.00 C ATOM 1415 C ILE A 98 -6.073 -9.979 -4.375 1.00 0.00 C ATOM 1416 O ILE A 98 -6.558 -10.380 -3.316 1.00 0.00 O ATOM 1417 CB ILE A 98 -3.606 -9.769 -4.061 1.00 0.00 C ATOM 1418 CG1 ILE A 98 -2.394 -8.846 -4.202 1.00 0.00 C ATOM 1419 CG2 ILE A 98 -3.469 -10.977 -4.974 1.00 0.00 C ATOM 1420 CD1 ILE A 98 -2.235 -8.266 -5.590 1.00 0.00 C ATOM 0 H ILE A 98 -4.862 -8.131 -2.471 1.00 0.00 H new ATOM 0 HA ILE A 98 -4.814 -8.549 -5.365 1.00 0.00 H new ATOM 0 HB ILE A 98 -3.652 -10.121 -3.030 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -2.483 -8.031 -3.484 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -1.492 -9.401 -3.943 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -2.547 -11.509 -4.738 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -4.320 -11.642 -4.827 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -3.441 -10.647 -6.012 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -1.356 -7.622 -5.617 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -2.114 -9.075 -6.311 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -3.120 -7.683 -5.844 1.00 0.00 H new ATOM 1432 N SER A 99 -6.521 -10.362 -5.566 1.00 0.00 N ATOM 1433 CA SER A 99 -7.636 -11.292 -5.701 1.00 0.00 C ATOM 1434 C SER A 99 -7.273 -12.661 -5.133 1.00 0.00 C ATOM 1435 O SER A 99 -7.796 -13.075 -4.099 1.00 0.00 O ATOM 1436 CB SER A 99 -8.040 -11.427 -7.170 1.00 0.00 C ATOM 1437 OG SER A 99 -8.505 -10.193 -7.687 1.00 0.00 O ATOM 0 H SER A 99 -6.129 -10.043 -6.452 1.00 0.00 H new ATOM 0 HA SER A 99 -8.479 -10.895 -5.135 1.00 0.00 H new ATOM 0 HB2 SER A 99 -7.187 -11.771 -7.755 1.00 0.00 H new ATOM 0 HB3 SER A 99 -8.819 -12.183 -7.268 1.00 0.00 H new ATOM 0 HG SER A 99 -8.755 -10.306 -8.628 1.00 0.00 H new ATOM 1443 N GLY A 100 -6.373 -13.359 -5.819 1.00 0.00 N ATOM 1444 CA GLY A 100 -5.955 -14.674 -5.369 1.00 0.00 C ATOM 1445 C GLY A 100 -6.558 -15.790 -6.199 1.00 0.00 C ATOM 1446 O GLY A 100 -5.843 -16.504 -6.902 1.00 0.00 O ATOM 0 H GLY A 100 -5.926 -13.038 -6.678 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -4.868 -14.741 -5.412 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -6.242 -14.806 -4.326 1.00 0.00 H new ATOM 1450 N GLU A 101 -7.876 -15.941 -6.117 1.00 0.00 N ATOM 1451 CA GLU A 101 -8.573 -16.980 -6.865 1.00 0.00 C ATOM 1452 C GLU A 101 -8.838 -16.533 -8.300 1.00 0.00 C ATOM 1453 O GLU A 101 -8.958 -15.340 -8.577 1.00 0.00 O ATOM 1454 CB GLU A 101 -9.893 -17.336 -6.178 1.00 0.00 C ATOM 1455 CG GLU A 101 -9.715 -17.983 -4.815 1.00 0.00 C ATOM 1456 CD GLU A 101 -11.034 -18.237 -4.112 1.00 0.00 C ATOM 1457 OE1 GLU A 101 -11.905 -17.342 -4.142 1.00 0.00 O ATOM 1458 OE2 GLU A 101 -11.196 -19.331 -3.532 1.00 0.00 O ATOM 0 H GLU A 101 -8.482 -15.357 -5.540 1.00 0.00 H new ATOM 0 HA GLU A 101 -7.935 -17.863 -6.890 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -10.490 -16.431 -6.066 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -10.457 -18.012 -6.821 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -9.183 -18.927 -4.932 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -9.093 -17.341 -4.191 1.00 0.00 H new ATOM 1465 N GLY A 102 -8.929 -17.499 -9.208 1.00 0.00 N ATOM 1466 CA GLY A 102 -9.178 -17.186 -10.603 1.00 0.00 C ATOM 1467 C GLY A 102 -7.900 -17.071 -11.409 1.00 0.00 C ATOM 1468 O GLY A 102 -7.259 -16.020 -11.423 1.00 0.00 O ATOM 0 H GLY A 102 -8.835 -18.494 -9.003 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -9.810 -17.960 -11.038 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -9.731 -16.249 -10.669 1.00 0.00 H new ATOM 1472 N ARG A 103 -7.527 -18.156 -12.081 1.00 0.00 N ATOM 1473 CA ARG A 103 -6.315 -18.173 -12.891 1.00 0.00 C ATOM 1474 C ARG A 103 -6.605 -18.704 -14.292 1.00 0.00 C ATOM 1475 O ARG A 103 -6.875 -19.891 -14.474 1.00 0.00 O ATOM 1476 CB ARG A 103 -5.241 -19.032 -12.221 1.00 0.00 C ATOM 1477 CG ARG A 103 -4.460 -18.299 -11.142 1.00 0.00 C ATOM 1478 CD ARG A 103 -5.213 -18.285 -9.822 1.00 0.00 C ATOM 1479 NE ARG A 103 -5.218 -19.597 -9.180 1.00 0.00 N ATOM 1480 CZ ARG A 103 -4.136 -20.163 -8.656 1.00 0.00 C ATOM 1481 NH1 ARG A 103 -2.969 -19.534 -8.697 1.00 0.00 N ATOM 1482 NH2 ARG A 103 -4.220 -21.359 -8.089 1.00 0.00 N ATOM 0 H ARG A 103 -8.047 -19.034 -12.080 1.00 0.00 H new ATOM 0 HA ARG A 103 -5.951 -17.149 -12.977 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -5.713 -19.911 -11.782 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -4.546 -19.389 -12.981 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -3.491 -18.778 -11.004 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -4.267 -17.275 -11.463 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -4.757 -17.556 -9.152 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -6.240 -17.962 -9.994 1.00 0.00 H new ATOM 0 HE ARG A 103 -6.100 -20.107 -9.131 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -2.901 -18.614 -9.131 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -2.140 -19.971 -8.294 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -5.116 -21.845 -8.055 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -3.389 -21.792 -7.687 1.00 0.00 H new ATOM 1496 N VAL A 104 -6.547 -17.816 -15.279 1.00 0.00 N ATOM 1497 CA VAL A 104 -6.803 -18.194 -16.664 1.00 0.00 C ATOM 1498 C VAL A 104 -5.805 -19.245 -17.140 1.00 0.00 C ATOM 1499 O VAL A 104 -4.616 -19.172 -16.831 1.00 0.00 O ATOM 1500 CB VAL A 104 -6.732 -16.974 -17.601 1.00 0.00 C ATOM 1501 CG1 VAL A 104 -5.335 -16.372 -17.591 1.00 0.00 C ATOM 1502 CG2 VAL A 104 -7.144 -17.363 -19.013 1.00 0.00 C ATOM 0 H VAL A 104 -6.325 -16.829 -15.145 1.00 0.00 H new ATOM 0 HA VAL A 104 -7.810 -18.611 -16.698 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.429 -16.218 -17.238 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.305 -15.511 -18.259 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.083 -16.055 -16.579 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -4.615 -17.118 -17.928 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -7.088 -16.489 -19.662 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -6.474 -18.137 -19.388 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -8.166 -17.742 -19.002 1.00 0.00 H new ATOM 1512 N LYS A 105 -6.298 -20.222 -17.893 1.00 0.00 N ATOM 1513 CA LYS A 105 -5.451 -21.288 -18.414 1.00 0.00 C ATOM 1514 C LYS A 105 -4.851 -20.897 -19.761 1.00 0.00 C ATOM 1515 O LYS A 105 -5.575 -20.595 -20.710 1.00 0.00 O ATOM 1516 CB LYS A 105 -6.256 -22.582 -18.559 1.00 0.00 C ATOM 1517 CG LYS A 105 -7.493 -22.435 -19.429 1.00 0.00 C ATOM 1518 CD LYS A 105 -8.295 -23.724 -19.479 1.00 0.00 C ATOM 1519 CE LYS A 105 -7.773 -24.664 -20.555 1.00 0.00 C ATOM 1520 NZ LYS A 105 -6.688 -25.546 -20.043 1.00 0.00 N ATOM 0 H LYS A 105 -7.281 -20.298 -18.156 1.00 0.00 H new ATOM 0 HA LYS A 105 -4.638 -21.450 -17.707 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -5.614 -23.354 -18.983 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -6.557 -22.926 -17.569 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -8.118 -21.631 -19.041 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -7.197 -22.150 -20.439 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -8.251 -24.219 -18.509 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -9.343 -23.494 -19.672 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -8.592 -25.277 -20.930 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -7.400 -24.081 -21.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -5.824 -25.394 -20.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -6.499 -25.321 -19.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -6.982 -26.540 -20.123 1.00 0.00 H new ATOM 1534 N SER A 106 -3.524 -20.907 -19.838 1.00 0.00 N ATOM 1535 CA SER A 106 -2.827 -20.551 -21.068 1.00 0.00 C ATOM 1536 C SER A 106 -1.364 -20.981 -21.007 1.00 0.00 C ATOM 1537 O SER A 106 -0.691 -20.792 -19.995 1.00 0.00 O ATOM 1538 CB SER A 106 -2.917 -19.043 -21.312 1.00 0.00 C ATOM 1539 OG SER A 106 -2.287 -18.686 -22.530 1.00 0.00 O ATOM 0 H SER A 106 -2.910 -21.158 -19.063 1.00 0.00 H new ATOM 0 HA SER A 106 -3.308 -21.075 -21.894 1.00 0.00 H new ATOM 0 HB2 SER A 106 -3.963 -18.737 -21.336 1.00 0.00 H new ATOM 0 HB3 SER A 106 -2.448 -18.509 -20.486 1.00 0.00 H new ATOM 0 HG SER A 106 -2.359 -17.718 -22.664 1.00 0.00 H new ATOM 1545 N GLY A 107 -0.879 -21.561 -22.100 1.00 0.00 N ATOM 1546 CA GLY A 107 0.501 -22.010 -22.152 1.00 0.00 C ATOM 1547 C GLY A 107 0.827 -22.732 -23.444 1.00 0.00 C ATOM 1548 O GLY A 107 0.585 -23.931 -23.589 1.00 0.00 O ATOM 0 H GLY A 107 -1.416 -21.728 -22.951 1.00 0.00 H new ATOM 0 HA2 GLY A 107 1.164 -21.152 -22.042 1.00 0.00 H new ATOM 0 HA3 GLY A 107 0.696 -22.673 -21.309 1.00 0.00 H new ATOM 1552 N PRO A 108 1.390 -21.995 -24.413 1.00 0.00 N ATOM 1553 CA PRO A 108 1.762 -22.551 -25.717 1.00 0.00 C ATOM 1554 C PRO A 108 2.945 -23.508 -25.623 1.00 0.00 C ATOM 1555 O PRO A 108 4.047 -23.113 -25.241 1.00 0.00 O ATOM 1556 CB PRO A 108 2.138 -21.314 -26.536 1.00 0.00 C ATOM 1557 CG PRO A 108 2.554 -20.302 -25.525 1.00 0.00 C ATOM 1558 CD PRO A 108 1.708 -20.560 -24.309 1.00 0.00 C ATOM 0 HA PRO A 108 0.955 -23.139 -26.154 1.00 0.00 H new ATOM 0 HB2 PRO A 108 2.947 -21.532 -27.234 1.00 0.00 H new ATOM 0 HB3 PRO A 108 1.294 -20.959 -27.127 1.00 0.00 H new ATOM 0 HG2 PRO A 108 3.614 -20.398 -25.290 1.00 0.00 H new ATOM 0 HG3 PRO A 108 2.401 -19.290 -25.900 1.00 0.00 H new ATOM 0 HD2 PRO A 108 2.247 -20.333 -23.389 1.00 0.00 H new ATOM 0 HD3 PRO A 108 0.806 -19.947 -24.309 1.00 0.00 H new ATOM 1566 N SER A 109 2.711 -24.769 -25.974 1.00 0.00 N ATOM 1567 CA SER A 109 3.757 -25.783 -25.925 1.00 0.00 C ATOM 1568 C SER A 109 4.560 -25.797 -27.223 1.00 0.00 C ATOM 1569 O SER A 109 4.273 -25.042 -28.151 1.00 0.00 O ATOM 1570 CB SER A 109 3.147 -27.164 -25.675 1.00 0.00 C ATOM 1571 OG SER A 109 2.402 -27.181 -24.470 1.00 0.00 O ATOM 0 H SER A 109 1.806 -25.112 -26.295 1.00 0.00 H new ATOM 0 HA SER A 109 4.430 -25.537 -25.103 1.00 0.00 H new ATOM 0 HB2 SER A 109 2.501 -27.436 -26.510 1.00 0.00 H new ATOM 0 HB3 SER A 109 3.939 -27.912 -25.628 1.00 0.00 H new ATOM 0 HG SER A 109 2.021 -28.074 -24.334 1.00 0.00 H new ATOM 1577 N SER A 110 5.568 -26.662 -27.278 1.00 0.00 N ATOM 1578 CA SER A 110 6.416 -26.773 -28.459 1.00 0.00 C ATOM 1579 C SER A 110 6.659 -28.236 -28.818 1.00 0.00 C ATOM 1580 O SER A 110 6.208 -29.142 -28.118 1.00 0.00 O ATOM 1581 CB SER A 110 7.752 -26.066 -28.222 1.00 0.00 C ATOM 1582 OG SER A 110 7.648 -24.678 -28.490 1.00 0.00 O ATOM 0 H SER A 110 5.817 -27.296 -26.519 1.00 0.00 H new ATOM 0 HA SER A 110 5.901 -26.293 -29.291 1.00 0.00 H new ATOM 0 HB2 SER A 110 8.070 -26.218 -27.190 1.00 0.00 H new ATOM 0 HB3 SER A 110 8.519 -26.506 -28.860 1.00 0.00 H new ATOM 0 HG SER A 110 8.514 -24.248 -28.330 1.00 0.00 H new ATOM 1588 N GLY A 111 7.375 -28.459 -29.916 1.00 0.00 N ATOM 1589 CA GLY A 111 7.666 -29.813 -30.350 1.00 0.00 C ATOM 1590 C GLY A 111 8.277 -29.859 -31.736 1.00 0.00 C ATOM 1591 O GLY A 111 8.020 -30.784 -32.505 1.00 0.00 O ATOM 0 H GLY A 111 7.759 -27.726 -30.513 1.00 0.00 H new ATOM 0 HA2 GLY A 111 8.348 -30.280 -29.640 1.00 0.00 H new ATOM 0 HA3 GLY A 111 6.747 -30.399 -30.342 1.00 0.00 H new TER 1595 GLY A 111