USER MOD reduce.3.24.130724 H: found=0, std=0, add=676, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 672 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0418 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 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= -0.0813 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 MET CE :methyl -135:sc= -11.8! (180deg=-21.4!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -0.624 K(o=-0.62,f=-2.9) USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0.46) USER MOD Single : A 30 SER OG : rot 14:sc= 0.153 USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -1.1 X(o=-1.1,f=-0.68) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= -3.63 K(o=-3.6,f=-6.4!) USER MOD Single : A 57 SER OG : rot 180:sc= -0.132 USER MOD Single : A 59 ASN : amide:sc= -3.89! C(o=-3.9!,f=-4.3!) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -2.8! C(o=-2.8!,f=-4.3!) USER MOD Single : A 68 HIS : no HD1:sc= -6.07! K(o=-6.1!,f=-5.2) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 161:sc= -0.0372 (180deg=-0.308) USER MOD Single : A 79 GLN : amide:sc= -0.425 K(o=-0.42,f=-4.2!) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -4.152 -9.402 -14.215 1.00 0.00 N ATOM 2 CA GLY A 1 -4.863 -10.438 -14.940 1.00 0.00 C ATOM 3 C GLY A 1 -4.862 -10.203 -16.437 1.00 0.00 C ATOM 4 O GLY A 1 -3.806 -10.019 -17.043 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.182 -9.609 -13.196 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.162 -9.372 -14.534 1.00 0.00 H new ATOM 0 H3 GLY A 1 -4.602 -8.482 -14.395 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.407 -11.405 -14.727 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.892 -10.486 -14.584 1.00 0.00 H new ATOM 8 N SER A 2 -6.048 -10.210 -17.037 1.00 0.00 N ATOM 9 CA SER A 2 -6.180 -10.001 -18.474 1.00 0.00 C ATOM 10 C SER A 2 -6.280 -8.514 -18.800 1.00 0.00 C ATOM 11 O SER A 2 -5.503 -7.988 -19.596 1.00 0.00 O ATOM 12 CB SER A 2 -7.412 -10.735 -19.007 1.00 0.00 C ATOM 13 OG SER A 2 -8.571 -10.391 -18.266 1.00 0.00 O ATOM 0 H SER A 2 -6.932 -10.358 -16.550 1.00 0.00 H new ATOM 0 HA SER A 2 -5.289 -10.402 -18.957 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.561 -10.486 -20.058 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.249 -11.811 -18.954 1.00 0.00 H new ATOM 0 HG SER A 2 -9.345 -10.872 -18.627 1.00 0.00 H new ATOM 19 N SER A 3 -7.243 -7.842 -18.178 1.00 0.00 N ATOM 20 CA SER A 3 -7.449 -6.416 -18.403 1.00 0.00 C ATOM 21 C SER A 3 -6.117 -5.701 -18.612 1.00 0.00 C ATOM 22 O SER A 3 -5.970 -4.892 -19.526 1.00 0.00 O ATOM 23 CB SER A 3 -8.195 -5.793 -17.222 1.00 0.00 C ATOM 24 OG SER A 3 -9.411 -6.476 -16.969 1.00 0.00 O ATOM 0 H SER A 3 -7.893 -8.262 -17.514 1.00 0.00 H new ATOM 0 HA SER A 3 -8.050 -6.299 -19.305 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.565 -5.824 -16.333 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.401 -4.743 -17.431 1.00 0.00 H new ATOM 0 HG SER A 3 -9.868 -6.060 -16.209 1.00 0.00 H new ATOM 30 N GLY A 4 -5.148 -6.007 -17.754 1.00 0.00 N ATOM 31 CA GLY A 4 -3.840 -5.387 -17.860 1.00 0.00 C ATOM 32 C GLY A 4 -3.405 -4.727 -16.567 1.00 0.00 C ATOM 33 O GLY A 4 -2.313 -4.991 -16.064 1.00 0.00 O ATOM 0 H GLY A 4 -5.246 -6.673 -16.988 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -3.106 -6.141 -18.144 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.857 -4.643 -18.656 1.00 0.00 H new ATOM 37 N SER A 5 -4.261 -3.865 -16.026 1.00 0.00 N ATOM 38 CA SER A 5 -3.957 -3.162 -14.786 1.00 0.00 C ATOM 39 C SER A 5 -4.680 -3.803 -13.606 1.00 0.00 C ATOM 40 O SER A 5 -5.909 -3.843 -13.564 1.00 0.00 O ATOM 41 CB SER A 5 -4.352 -1.688 -14.901 1.00 0.00 C ATOM 42 OG SER A 5 -3.899 -0.950 -13.779 1.00 0.00 O ATOM 0 H SER A 5 -5.170 -3.637 -16.428 1.00 0.00 H new ATOM 0 HA SER A 5 -2.883 -3.231 -14.612 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.930 -1.265 -15.813 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.436 -1.604 -14.982 1.00 0.00 H new ATOM 0 HG SER A 5 -4.162 -0.011 -13.877 1.00 0.00 H new ATOM 48 N SER A 6 -3.907 -4.305 -12.648 1.00 0.00 N ATOM 49 CA SER A 6 -4.472 -4.949 -11.468 1.00 0.00 C ATOM 50 C SER A 6 -5.191 -3.932 -10.587 1.00 0.00 C ATOM 51 O SER A 6 -6.373 -4.087 -10.279 1.00 0.00 O ATOM 52 CB SER A 6 -3.373 -5.648 -10.667 1.00 0.00 C ATOM 53 OG SER A 6 -3.187 -6.981 -11.111 1.00 0.00 O ATOM 0 H SER A 6 -2.888 -4.278 -12.666 1.00 0.00 H new ATOM 0 HA SER A 6 -5.197 -5.692 -11.801 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.439 -5.095 -10.766 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.634 -5.647 -9.609 1.00 0.00 H new ATOM 0 HG SER A 6 -2.478 -7.405 -10.584 1.00 0.00 H new ATOM 59 N GLY A 7 -4.469 -2.892 -10.183 1.00 0.00 N ATOM 60 CA GLY A 7 -5.053 -1.865 -9.341 1.00 0.00 C ATOM 61 C GLY A 7 -4.022 -0.879 -8.829 1.00 0.00 C ATOM 62 O GLY A 7 -3.709 -0.859 -7.639 1.00 0.00 O ATOM 0 H GLY A 7 -3.489 -2.742 -10.424 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.816 -1.328 -9.905 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.554 -2.335 -8.494 1.00 0.00 H new ATOM 66 N VAL A 8 -3.490 -0.059 -9.731 1.00 0.00 N ATOM 67 CA VAL A 8 -2.487 0.934 -9.364 1.00 0.00 C ATOM 68 C VAL A 8 -3.124 2.119 -8.646 1.00 0.00 C ATOM 69 O VAL A 8 -3.864 2.898 -9.247 1.00 0.00 O ATOM 70 CB VAL A 8 -1.726 1.445 -10.601 1.00 0.00 C ATOM 71 CG1 VAL A 8 -0.722 2.518 -10.204 1.00 0.00 C ATOM 72 CG2 VAL A 8 -1.033 0.294 -11.313 1.00 0.00 C ATOM 0 H VAL A 8 -3.737 -0.063 -10.721 1.00 0.00 H new ATOM 0 HA VAL A 8 -1.784 0.442 -8.692 1.00 0.00 H new ATOM 0 HB VAL A 8 -2.444 1.889 -11.290 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.193 2.868 -11.091 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -1.247 3.354 -9.741 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.006 2.102 -9.495 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.500 0.674 -12.185 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.325 -0.181 -10.633 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -1.776 -0.437 -11.632 1.00 0.00 H new ATOM 82 N VAL A 9 -2.831 2.250 -7.356 1.00 0.00 N ATOM 83 CA VAL A 9 -3.373 3.341 -6.556 1.00 0.00 C ATOM 84 C VAL A 9 -2.357 4.468 -6.403 1.00 0.00 C ATOM 85 O VAL A 9 -1.405 4.356 -5.631 1.00 0.00 O ATOM 86 CB VAL A 9 -3.799 2.855 -5.158 1.00 0.00 C ATOM 87 CG1 VAL A 9 -4.334 4.013 -4.330 1.00 0.00 C ATOM 88 CG2 VAL A 9 -4.835 1.747 -5.273 1.00 0.00 C ATOM 0 H VAL A 9 -2.221 1.614 -6.843 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.250 3.715 -7.085 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.923 2.451 -4.650 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -4.630 3.650 -3.346 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -3.558 4.770 -4.219 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -5.198 4.450 -4.831 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.125 1.415 -4.276 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -5.712 2.122 -5.800 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -4.411 0.908 -5.825 1.00 0.00 H new ATOM 98 N GLU A 10 -2.567 5.552 -7.142 1.00 0.00 N ATOM 99 CA GLU A 10 -1.668 6.699 -7.088 1.00 0.00 C ATOM 100 C GLU A 10 -2.171 7.737 -6.088 1.00 0.00 C ATOM 101 O GLU A 10 -3.181 8.402 -6.321 1.00 0.00 O ATOM 102 CB GLU A 10 -1.532 7.334 -8.473 1.00 0.00 C ATOM 103 CG GLU A 10 -0.212 8.058 -8.683 1.00 0.00 C ATOM 104 CD GLU A 10 -0.290 9.108 -9.775 1.00 0.00 C ATOM 105 OE1 GLU A 10 -1.356 9.745 -9.909 1.00 0.00 O ATOM 106 OE2 GLU A 10 0.713 9.293 -10.494 1.00 0.00 O ATOM 0 H GLU A 10 -3.351 5.660 -7.785 1.00 0.00 H new ATOM 0 HA GLU A 10 -0.690 6.347 -6.760 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -1.636 6.558 -9.231 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.351 8.038 -8.623 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.091 8.532 -7.749 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.560 7.332 -8.937 1.00 0.00 H new ATOM 113 N LEU A 11 -1.459 7.869 -4.974 1.00 0.00 N ATOM 114 CA LEU A 11 -1.832 8.825 -3.937 1.00 0.00 C ATOM 115 C LEU A 11 -0.850 9.991 -3.893 1.00 0.00 C ATOM 116 O LEU A 11 0.326 9.858 -4.233 1.00 0.00 O ATOM 117 CB LEU A 11 -1.881 8.134 -2.573 1.00 0.00 C ATOM 118 CG LEU A 11 -2.920 7.022 -2.421 1.00 0.00 C ATOM 119 CD1 LEU A 11 -2.539 6.087 -1.284 1.00 0.00 C ATOM 120 CD2 LEU A 11 -4.303 7.613 -2.187 1.00 0.00 C ATOM 0 H LEU A 11 -0.621 7.326 -4.766 1.00 0.00 H new ATOM 0 HA LEU A 11 -2.821 9.215 -4.176 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -0.897 7.715 -2.365 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -2.073 8.890 -1.812 1.00 0.00 H new ATOM 0 HG LEU A 11 -2.945 6.445 -3.346 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -3.290 5.302 -1.191 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -1.568 5.637 -1.492 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.485 6.650 -0.352 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -5.030 6.808 -2.081 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.293 8.214 -1.278 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -4.578 8.241 -3.034 1.00 0.00 H new ATOM 132 N PRO A 12 -1.341 11.163 -3.464 1.00 0.00 N ATOM 133 CA PRO A 12 -0.523 12.375 -3.363 1.00 0.00 C ATOM 134 C PRO A 12 0.509 12.286 -2.244 1.00 0.00 C ATOM 135 O PRO A 12 0.184 11.928 -1.112 1.00 0.00 O ATOM 136 CB PRO A 12 -1.548 13.470 -3.058 1.00 0.00 C ATOM 137 CG PRO A 12 -2.683 12.757 -2.409 1.00 0.00 C ATOM 138 CD PRO A 12 -2.733 11.395 -3.043 1.00 0.00 C ATOM 0 HA PRO A 12 0.055 12.553 -4.270 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -1.130 14.231 -2.399 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -1.868 13.977 -3.968 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -2.532 12.681 -1.332 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -3.619 13.293 -2.562 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -3.071 10.636 -2.338 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -3.418 11.371 -3.890 1.00 0.00 H new ATOM 146 N LYS A 13 1.756 12.615 -2.568 1.00 0.00 N ATOM 147 CA LYS A 13 2.837 12.574 -1.590 1.00 0.00 C ATOM 148 C LYS A 13 3.137 13.969 -1.052 1.00 0.00 C ATOM 149 O LYS A 13 3.789 14.776 -1.717 1.00 0.00 O ATOM 150 CB LYS A 13 4.098 11.976 -2.219 1.00 0.00 C ATOM 151 CG LYS A 13 5.334 12.111 -1.347 1.00 0.00 C ATOM 152 CD LYS A 13 5.404 11.008 -0.304 1.00 0.00 C ATOM 153 CE LYS A 13 4.714 11.418 0.988 1.00 0.00 C ATOM 154 NZ LYS A 13 4.962 10.441 2.084 1.00 0.00 N ATOM 0 H LYS A 13 2.042 12.913 -3.501 1.00 0.00 H new ATOM 0 HA LYS A 13 2.519 11.944 -0.759 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.924 10.920 -2.428 1.00 0.00 H new ATOM 0 HB3 LYS A 13 4.283 12.464 -3.176 1.00 0.00 H new ATOM 0 HG2 LYS A 13 6.226 12.079 -1.972 1.00 0.00 H new ATOM 0 HG3 LYS A 13 5.326 13.082 -0.851 1.00 0.00 H new ATOM 0 HD2 LYS A 13 4.937 10.105 -0.696 1.00 0.00 H new ATOM 0 HD3 LYS A 13 6.447 10.765 -0.100 1.00 0.00 H new ATOM 0 HE2 LYS A 13 5.069 12.403 1.292 1.00 0.00 H new ATOM 0 HE3 LYS A 13 3.641 11.505 0.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 4.475 10.756 2.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 4.601 9.507 1.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 5.984 10.377 2.267 1.00 0.00 H new ATOM 168 N THR A 14 2.658 14.248 0.156 1.00 0.00 N ATOM 169 CA THR A 14 2.875 15.546 0.783 1.00 0.00 C ATOM 170 C THR A 14 2.670 15.469 2.292 1.00 0.00 C ATOM 171 O THR A 14 2.088 14.511 2.800 1.00 0.00 O ATOM 172 CB THR A 14 1.931 16.616 0.203 1.00 0.00 C ATOM 173 OG1 THR A 14 2.309 17.912 0.678 1.00 0.00 O ATOM 174 CG2 THR A 14 0.487 16.330 0.587 1.00 0.00 C ATOM 0 H THR A 14 2.117 13.592 0.720 1.00 0.00 H new ATOM 0 HA THR A 14 3.906 15.829 0.572 1.00 0.00 H new ATOM 0 HB THR A 14 2.013 16.590 -0.884 1.00 0.00 H new ATOM 0 HG1 THR A 14 1.705 18.587 0.303 1.00 0.00 H new ATOM 0 HG21 THR A 14 -0.161 17.099 0.166 1.00 0.00 H new ATOM 0 HG22 THR A 14 0.193 15.355 0.198 1.00 0.00 H new ATOM 0 HG23 THR A 14 0.392 16.331 1.673 1.00 0.00 H new ATOM 182 N ASP A 15 3.152 16.483 3.002 1.00 0.00 N ATOM 183 CA ASP A 15 3.020 16.530 4.454 1.00 0.00 C ATOM 184 C ASP A 15 1.656 16.007 4.893 1.00 0.00 C ATOM 185 O ASP A 15 1.526 15.401 5.956 1.00 0.00 O ATOM 186 CB ASP A 15 3.217 17.960 4.959 1.00 0.00 C ATOM 187 CG ASP A 15 3.555 18.012 6.435 1.00 0.00 C ATOM 188 OD1 ASP A 15 2.678 17.673 7.257 1.00 0.00 O ATOM 189 OD2 ASP A 15 4.698 18.389 6.769 1.00 0.00 O ATOM 0 H ASP A 15 3.637 17.283 2.596 1.00 0.00 H new ATOM 0 HA ASP A 15 3.791 15.891 4.885 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.015 18.436 4.390 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.309 18.535 4.777 1.00 0.00 H new ATOM 194 N GLU A 16 0.642 16.245 4.067 1.00 0.00 N ATOM 195 CA GLU A 16 -0.712 15.799 4.372 1.00 0.00 C ATOM 196 C GLU A 16 -0.701 14.393 4.964 1.00 0.00 C ATOM 197 O GLU A 16 -1.412 14.107 5.926 1.00 0.00 O ATOM 198 CB GLU A 16 -1.578 15.826 3.110 1.00 0.00 C ATOM 199 CG GLU A 16 -1.566 14.520 2.335 1.00 0.00 C ATOM 200 CD GLU A 16 -2.212 14.645 0.969 1.00 0.00 C ATOM 201 OE1 GLU A 16 -3.327 15.202 0.888 1.00 0.00 O ATOM 202 OE2 GLU A 16 -1.602 14.187 -0.020 1.00 0.00 O ATOM 0 H GLU A 16 0.733 16.744 3.182 1.00 0.00 H new ATOM 0 HA GLU A 16 -1.135 16.482 5.109 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.605 16.063 3.389 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.231 16.628 2.459 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -0.537 14.182 2.216 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -2.088 13.756 2.911 1.00 0.00 H new ATOM 209 N GLY A 17 0.112 13.517 4.380 1.00 0.00 N ATOM 210 CA GLY A 17 0.200 12.151 4.862 1.00 0.00 C ATOM 211 C GLY A 17 -0.715 11.209 4.106 1.00 0.00 C ATOM 212 O GLY A 17 -1.575 11.648 3.341 1.00 0.00 O ATOM 0 H GLY A 17 0.711 13.729 3.582 1.00 0.00 H new ATOM 0 HA2 GLY A 17 1.229 11.803 4.772 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -0.053 12.126 5.922 1.00 0.00 H new ATOM 216 N LEU A 18 -0.531 9.911 4.318 1.00 0.00 N ATOM 217 CA LEU A 18 -1.346 8.903 3.650 1.00 0.00 C ATOM 218 C LEU A 18 -2.476 8.426 4.557 1.00 0.00 C ATOM 219 O LEU A 18 -3.651 8.654 4.274 1.00 0.00 O ATOM 220 CB LEU A 18 -0.480 7.715 3.228 1.00 0.00 C ATOM 221 CG LEU A 18 0.567 7.997 2.149 1.00 0.00 C ATOM 222 CD1 LEU A 18 -0.094 8.552 0.897 1.00 0.00 C ATOM 223 CD2 LEU A 18 1.622 8.962 2.670 1.00 0.00 C ATOM 0 H LEU A 18 0.176 9.532 4.948 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.785 9.358 2.762 1.00 0.00 H new ATOM 0 HB2 LEU A 18 0.032 7.332 4.111 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -1.136 6.921 2.871 1.00 0.00 H new ATOM 0 HG LEU A 18 1.057 7.059 1.891 1.00 0.00 H new ATOM 0 HD11 LEU A 18 0.666 8.747 0.140 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.812 7.827 0.513 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.611 9.481 1.140 1.00 0.00 H new ATOM 0 HD21 LEU A 18 2.359 9.152 1.890 1.00 0.00 H new ATOM 0 HD22 LEU A 18 1.147 9.900 2.956 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.117 8.526 3.538 1.00 0.00 H new ATOM 235 N GLY A 19 -2.110 7.764 5.651 1.00 0.00 N ATOM 236 CA GLY A 19 -3.104 7.268 6.584 1.00 0.00 C ATOM 237 C GLY A 19 -3.351 5.780 6.432 1.00 0.00 C ATOM 238 O GLY A 19 -4.491 5.321 6.507 1.00 0.00 O ATOM 0 H GLY A 19 -1.143 7.563 5.907 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -2.777 7.477 7.603 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -4.040 7.806 6.433 1.00 0.00 H new ATOM 242 N PHE A 20 -2.280 5.023 6.214 1.00 0.00 N ATOM 243 CA PHE A 20 -2.386 3.578 6.048 1.00 0.00 C ATOM 244 C PHE A 20 -1.150 2.875 6.601 1.00 0.00 C ATOM 245 O PHE A 20 -0.036 3.389 6.507 1.00 0.00 O ATOM 246 CB PHE A 20 -2.568 3.226 4.570 1.00 0.00 C ATOM 247 CG PHE A 20 -1.287 3.255 3.785 1.00 0.00 C ATOM 248 CD1 PHE A 20 -0.320 2.281 3.976 1.00 0.00 C ATOM 249 CD2 PHE A 20 -1.051 4.254 2.855 1.00 0.00 C ATOM 250 CE1 PHE A 20 0.859 2.305 3.256 1.00 0.00 C ATOM 251 CE2 PHE A 20 0.126 4.284 2.131 1.00 0.00 C ATOM 252 CZ PHE A 20 1.082 3.307 2.331 1.00 0.00 C ATOM 0 H PHE A 20 -1.329 5.386 6.148 1.00 0.00 H new ATOM 0 HA PHE A 20 -3.257 3.236 6.606 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -3.010 2.232 4.493 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -3.275 3.925 4.123 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -0.490 1.494 4.696 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -1.796 5.019 2.694 1.00 0.00 H new ATOM 0 HE1 PHE A 20 1.606 1.541 3.416 1.00 0.00 H new ATOM 0 HE2 PHE A 20 0.298 5.070 1.410 1.00 0.00 H new ATOM 0 HZ PHE A 20 2.002 3.326 1.765 1.00 0.00 H new ATOM 262 N ASN A 21 -1.356 1.697 7.180 1.00 0.00 N ATOM 263 CA ASN A 21 -0.260 0.922 7.750 1.00 0.00 C ATOM 264 C ASN A 21 -0.118 -0.422 7.043 1.00 0.00 C ATOM 265 O ASN A 21 -0.997 -0.832 6.285 1.00 0.00 O ATOM 266 CB ASN A 21 -0.488 0.702 9.247 1.00 0.00 C ATOM 267 CG ASN A 21 0.043 1.848 10.087 1.00 0.00 C ATOM 268 OD1 ASN A 21 1.205 1.847 10.495 1.00 0.00 O ATOM 269 ND2 ASN A 21 -0.808 2.832 10.350 1.00 0.00 N ATOM 0 H ASN A 21 -2.272 1.258 7.267 1.00 0.00 H new ATOM 0 HA ASN A 21 0.662 1.486 7.608 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -1.555 0.581 9.435 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -0.003 -0.225 9.553 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -0.508 3.629 10.911 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -1.762 2.791 9.991 1.00 0.00 H new ATOM 276 N ILE A 22 0.994 -1.103 7.297 1.00 0.00 N ATOM 277 CA ILE A 22 1.251 -2.402 6.686 1.00 0.00 C ATOM 278 C ILE A 22 1.995 -3.324 7.646 1.00 0.00 C ATOM 279 O ILE A 22 2.810 -2.872 8.450 1.00 0.00 O ATOM 280 CB ILE A 22 2.068 -2.262 5.389 1.00 0.00 C ATOM 281 CG1 ILE A 22 3.289 -1.369 5.623 1.00 0.00 C ATOM 282 CG2 ILE A 22 1.200 -1.700 4.273 1.00 0.00 C ATOM 283 CD1 ILE A 22 4.344 -1.493 4.546 1.00 0.00 C ATOM 0 H ILE A 22 1.732 -0.777 7.922 1.00 0.00 H new ATOM 0 HA ILE A 22 0.280 -2.837 6.449 1.00 0.00 H new ATOM 0 HB ILE A 22 2.416 -3.250 5.089 1.00 0.00 H new ATOM 0 HG12 ILE A 22 2.963 -0.331 5.683 1.00 0.00 H new ATOM 0 HG13 ILE A 22 3.733 -1.620 6.586 1.00 0.00 H new ATOM 0 HG21 ILE A 22 1.793 -1.607 3.363 1.00 0.00 H new ATOM 0 HG22 ILE A 22 0.360 -2.371 4.092 1.00 0.00 H new ATOM 0 HG23 ILE A 22 0.825 -0.719 4.563 1.00 0.00 H new ATOM 0 HD11 ILE A 22 5.179 -0.832 4.777 1.00 0.00 H new ATOM 0 HD12 ILE A 22 4.698 -2.523 4.500 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.916 -1.213 3.583 1.00 0.00 H new ATOM 295 N MET A 23 1.709 -4.618 7.556 1.00 0.00 N ATOM 296 CA MET A 23 2.354 -5.605 8.415 1.00 0.00 C ATOM 297 C MET A 23 3.092 -6.649 7.584 1.00 0.00 C ATOM 298 O MET A 23 3.033 -6.634 6.355 1.00 0.00 O ATOM 299 CB MET A 23 1.319 -6.287 9.310 1.00 0.00 C ATOM 300 CG MET A 23 0.259 -5.338 9.847 1.00 0.00 C ATOM 301 SD MET A 23 0.967 -3.939 10.737 1.00 0.00 S ATOM 302 CE MET A 23 0.333 -2.569 9.772 1.00 0.00 C ATOM 0 H MET A 23 1.035 -5.008 6.897 1.00 0.00 H new ATOM 0 HA MET A 23 3.080 -5.086 9.041 1.00 0.00 H new ATOM 0 HB2 MET A 23 0.831 -7.082 8.746 1.00 0.00 H new ATOM 0 HB3 MET A 23 1.831 -6.759 10.149 1.00 0.00 H new ATOM 0 HG2 MET A 23 -0.346 -4.968 9.019 1.00 0.00 H new ATOM 0 HG3 MET A 23 -0.410 -5.885 10.511 1.00 0.00 H new ATOM 0 HE1 MET A 23 1.133 -1.851 9.591 1.00 0.00 H new ATOM 0 HE2 MET A 23 -0.045 -2.939 8.819 1.00 0.00 H new ATOM 0 HE3 MET A 23 -0.475 -2.082 10.318 1.00 0.00 H new ATOM 312 N GLY A 24 3.788 -7.556 8.263 1.00 0.00 N ATOM 313 CA GLY A 24 4.528 -8.595 7.571 1.00 0.00 C ATOM 314 C GLY A 24 5.870 -8.108 7.059 1.00 0.00 C ATOM 315 O GLY A 24 6.382 -7.087 7.514 1.00 0.00 O ATOM 0 H GLY A 24 3.852 -7.590 9.280 1.00 0.00 H new ATOM 0 HA2 GLY A 24 4.684 -9.437 8.246 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.935 -8.963 6.734 1.00 0.00 H new ATOM 319 N GLY A 25 6.442 -8.843 6.110 1.00 0.00 N ATOM 320 CA GLY A 25 7.728 -8.466 5.553 1.00 0.00 C ATOM 321 C GLY A 25 8.588 -9.667 5.214 1.00 0.00 C ATOM 322 O GLY A 25 8.111 -10.634 4.618 1.00 0.00 O ATOM 0 H GLY A 25 6.038 -9.693 5.717 1.00 0.00 H new ATOM 0 HA2 GLY A 25 7.570 -7.871 4.654 1.00 0.00 H new ATOM 0 HA3 GLY A 25 8.258 -7.833 6.265 1.00 0.00 H new ATOM 326 N LYS A 26 9.860 -9.608 5.592 1.00 0.00 N ATOM 327 CA LYS A 26 10.790 -10.698 5.324 1.00 0.00 C ATOM 328 C LYS A 26 10.861 -11.656 6.509 1.00 0.00 C ATOM 329 O LYS A 26 10.520 -12.832 6.390 1.00 0.00 O ATOM 330 CB LYS A 26 12.183 -10.145 5.017 1.00 0.00 C ATOM 331 CG LYS A 26 13.235 -11.221 4.818 1.00 0.00 C ATOM 332 CD LYS A 26 12.976 -12.028 3.556 1.00 0.00 C ATOM 333 CE LYS A 26 13.788 -13.313 3.539 1.00 0.00 C ATOM 334 NZ LYS A 26 13.325 -14.249 2.477 1.00 0.00 N ATOM 0 H LYS A 26 10.271 -8.816 6.086 1.00 0.00 H new ATOM 0 HA LYS A 26 10.426 -11.248 4.456 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.130 -9.530 4.119 1.00 0.00 H new ATOM 0 HB3 LYS A 26 12.493 -9.492 5.833 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.221 -10.761 4.760 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.244 -11.887 5.681 1.00 0.00 H new ATOM 0 HD2 LYS A 26 11.915 -12.266 3.487 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.225 -11.427 2.681 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.840 -13.076 3.380 1.00 0.00 H new ATOM 0 HE3 LYS A 26 13.715 -13.802 4.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 13.904 -15.113 2.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 12.328 -14.496 2.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 13.419 -13.793 1.547 1.00 0.00 H new ATOM 348 N GLU A 27 11.306 -11.143 7.652 1.00 0.00 N ATOM 349 CA GLU A 27 11.421 -11.954 8.859 1.00 0.00 C ATOM 350 C GLU A 27 10.118 -12.695 9.143 1.00 0.00 C ATOM 351 O GLU A 27 10.095 -13.923 9.220 1.00 0.00 O ATOM 352 CB GLU A 27 11.793 -11.077 10.056 1.00 0.00 C ATOM 353 CG GLU A 27 11.850 -11.835 11.372 1.00 0.00 C ATOM 354 CD GLU A 27 12.840 -11.232 12.350 1.00 0.00 C ATOM 355 OE1 GLU A 27 13.930 -10.812 11.907 1.00 0.00 O ATOM 356 OE2 GLU A 27 12.526 -11.180 13.557 1.00 0.00 O ATOM 0 H GLU A 27 11.592 -10.171 7.768 1.00 0.00 H new ATOM 0 HA GLU A 27 12.209 -12.689 8.698 1.00 0.00 H new ATOM 0 HB2 GLU A 27 12.763 -10.615 9.870 1.00 0.00 H new ATOM 0 HB3 GLU A 27 11.067 -10.269 10.143 1.00 0.00 H new ATOM 0 HG2 GLU A 27 10.858 -11.845 11.824 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.123 -12.872 11.178 1.00 0.00 H new ATOM 363 N GLN A 28 9.036 -11.939 9.297 1.00 0.00 N ATOM 364 CA GLN A 28 7.729 -12.524 9.573 1.00 0.00 C ATOM 365 C GLN A 28 7.393 -13.612 8.558 1.00 0.00 C ATOM 366 O GLN A 28 6.594 -14.505 8.833 1.00 0.00 O ATOM 367 CB GLN A 28 6.648 -11.442 9.555 1.00 0.00 C ATOM 368 CG GLN A 28 5.475 -11.738 10.476 1.00 0.00 C ATOM 369 CD GLN A 28 4.831 -10.479 11.023 1.00 0.00 C ATOM 370 OE1 GLN A 28 5.081 -9.377 10.534 1.00 0.00 O ATOM 371 NE2 GLN A 28 3.996 -10.636 12.043 1.00 0.00 N ATOM 0 H GLN A 28 9.038 -10.921 9.235 1.00 0.00 H new ATOM 0 HA GLN A 28 7.764 -12.976 10.564 1.00 0.00 H new ATOM 0 HB2 GLN A 28 7.094 -10.490 9.843 1.00 0.00 H new ATOM 0 HB3 GLN A 28 6.279 -11.326 8.536 1.00 0.00 H new ATOM 0 HG2 GLN A 28 4.728 -12.317 9.933 1.00 0.00 H new ATOM 0 HG3 GLN A 28 5.816 -12.357 11.306 1.00 0.00 H new ATOM 0 HE21 GLN A 28 3.818 -11.568 12.417 1.00 0.00 H new ATOM 0 HE22 GLN A 28 3.533 -9.825 12.452 1.00 0.00 H new ATOM 380 N ASN A 29 8.010 -13.528 7.384 1.00 0.00 N ATOM 381 CA ASN A 29 7.776 -14.505 6.326 1.00 0.00 C ATOM 382 C ASN A 29 6.326 -14.458 5.854 1.00 0.00 C ATOM 383 O ASN A 29 5.675 -15.493 5.710 1.00 0.00 O ATOM 384 CB ASN A 29 8.118 -15.913 6.819 1.00 0.00 C ATOM 385 CG ASN A 29 8.512 -16.842 5.687 1.00 0.00 C ATOM 386 OD1 ASN A 29 7.658 -17.347 4.958 1.00 0.00 O ATOM 387 ND2 ASN A 29 9.811 -17.072 5.536 1.00 0.00 N ATOM 0 H ASN A 29 8.675 -12.794 7.141 1.00 0.00 H new ATOM 0 HA ASN A 29 8.422 -14.255 5.485 1.00 0.00 H new ATOM 0 HB2 ASN A 29 8.935 -15.855 7.539 1.00 0.00 H new ATOM 0 HB3 ASN A 29 7.259 -16.330 7.345 1.00 0.00 H new ATOM 0 HD21 ASN A 29 10.137 -17.689 4.792 1.00 0.00 H new ATOM 0 HD22 ASN A 29 10.483 -16.632 6.164 1.00 0.00 H new ATOM 394 N SER A 30 5.827 -13.250 5.612 1.00 0.00 N ATOM 395 CA SER A 30 4.454 -13.067 5.158 1.00 0.00 C ATOM 396 C SER A 30 4.348 -11.872 4.215 1.00 0.00 C ATOM 397 O SER A 30 5.170 -10.956 4.237 1.00 0.00 O ATOM 398 CB SER A 30 3.521 -12.870 6.355 1.00 0.00 C ATOM 399 OG SER A 30 3.221 -14.108 6.977 1.00 0.00 O ATOM 0 H SER A 30 6.353 -12.383 5.723 1.00 0.00 H new ATOM 0 HA SER A 30 4.154 -13.964 4.616 1.00 0.00 H new ATOM 0 HB2 SER A 30 3.988 -12.200 7.077 1.00 0.00 H new ATOM 0 HB3 SER A 30 2.598 -12.392 6.026 1.00 0.00 H new ATOM 0 HG SER A 30 3.836 -14.797 6.648 1.00 0.00 H new ATOM 405 N PRO A 31 3.310 -11.881 3.365 1.00 0.00 N ATOM 406 CA PRO A 31 3.070 -10.806 2.397 1.00 0.00 C ATOM 407 C PRO A 31 2.635 -9.508 3.069 1.00 0.00 C ATOM 408 O PRO A 31 1.845 -9.522 4.013 1.00 0.00 O ATOM 409 CB PRO A 31 1.942 -11.361 1.524 1.00 0.00 C ATOM 410 CG PRO A 31 1.236 -12.342 2.394 1.00 0.00 C ATOM 411 CD PRO A 31 2.291 -12.941 3.283 1.00 0.00 C ATOM 0 HA PRO A 31 3.971 -10.549 1.840 1.00 0.00 H new ATOM 0 HB2 PRO A 31 1.270 -10.568 1.195 1.00 0.00 H new ATOM 0 HB3 PRO A 31 2.335 -11.839 0.627 1.00 0.00 H new ATOM 0 HG2 PRO A 31 0.460 -11.853 2.984 1.00 0.00 H new ATOM 0 HG3 PRO A 31 0.746 -13.111 1.797 1.00 0.00 H new ATOM 0 HD2 PRO A 31 1.893 -13.192 4.266 1.00 0.00 H new ATOM 0 HD3 PRO A 31 2.699 -13.859 2.860 1.00 0.00 H new ATOM 419 N ILE A 32 3.156 -8.390 2.576 1.00 0.00 N ATOM 420 CA ILE A 32 2.819 -7.083 3.129 1.00 0.00 C ATOM 421 C ILE A 32 1.441 -6.627 2.661 1.00 0.00 C ATOM 422 O ILE A 32 1.176 -6.548 1.461 1.00 0.00 O ATOM 423 CB ILE A 32 3.861 -6.020 2.734 1.00 0.00 C ATOM 424 CG1 ILE A 32 5.243 -6.407 3.263 1.00 0.00 C ATOM 425 CG2 ILE A 32 3.449 -4.654 3.263 1.00 0.00 C ATOM 426 CD1 ILE A 32 6.083 -7.166 2.260 1.00 0.00 C ATOM 0 H ILE A 32 3.812 -8.362 1.796 1.00 0.00 H new ATOM 0 HA ILE A 32 2.814 -7.190 4.214 1.00 0.00 H new ATOM 0 HB ILE A 32 3.911 -5.968 1.646 1.00 0.00 H new ATOM 0 HG12 ILE A 32 5.775 -5.504 3.561 1.00 0.00 H new ATOM 0 HG13 ILE A 32 5.123 -7.016 4.159 1.00 0.00 H new ATOM 0 HG21 ILE A 32 4.195 -3.913 2.976 1.00 0.00 H new ATOM 0 HG22 ILE A 32 2.482 -4.377 2.843 1.00 0.00 H new ATOM 0 HG23 ILE A 32 3.374 -4.692 4.350 1.00 0.00 H new ATOM 0 HD11 ILE A 32 7.049 -7.407 2.703 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.572 -8.087 1.980 1.00 0.00 H new ATOM 0 HD13 ILE A 32 6.234 -6.551 1.373 1.00 0.00 H new ATOM 438 N TYR A 33 0.568 -6.326 3.616 1.00 0.00 N ATOM 439 CA TYR A 33 -0.783 -5.878 3.302 1.00 0.00 C ATOM 440 C TYR A 33 -1.237 -4.794 4.274 1.00 0.00 C ATOM 441 O TYR A 33 -0.544 -4.484 5.243 1.00 0.00 O ATOM 442 CB TYR A 33 -1.757 -7.057 3.345 1.00 0.00 C ATOM 443 CG TYR A 33 -1.594 -7.933 4.566 1.00 0.00 C ATOM 444 CD1 TYR A 33 -1.647 -7.393 5.845 1.00 0.00 C ATOM 445 CD2 TYR A 33 -1.388 -9.302 4.441 1.00 0.00 C ATOM 446 CE1 TYR A 33 -1.498 -8.189 6.964 1.00 0.00 C ATOM 447 CE2 TYR A 33 -1.239 -10.106 5.555 1.00 0.00 C ATOM 448 CZ TYR A 33 -1.294 -9.545 6.813 1.00 0.00 C ATOM 449 OH TYR A 33 -1.147 -10.342 7.925 1.00 0.00 O ATOM 0 H TYR A 33 0.772 -6.384 4.614 1.00 0.00 H new ATOM 0 HA TYR A 33 -0.774 -5.459 2.296 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -2.778 -6.675 3.316 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -1.618 -7.665 2.451 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -1.808 -6.332 5.966 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -1.344 -9.745 3.457 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -1.541 -7.753 7.951 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -1.080 -11.168 5.441 1.00 0.00 H new ATOM 0 HH TYR A 33 -1.012 -11.272 7.646 1.00 0.00 H new ATOM 459 N ILE A 34 -2.406 -4.221 4.008 1.00 0.00 N ATOM 460 CA ILE A 34 -2.955 -3.173 4.859 1.00 0.00 C ATOM 461 C ILE A 34 -3.684 -3.765 6.061 1.00 0.00 C ATOM 462 O ILE A 34 -4.707 -4.433 5.911 1.00 0.00 O ATOM 463 CB ILE A 34 -3.925 -2.265 4.081 1.00 0.00 C ATOM 464 CG1 ILE A 34 -3.260 -1.747 2.804 1.00 0.00 C ATOM 465 CG2 ILE A 34 -4.383 -1.107 4.954 1.00 0.00 C ATOM 466 CD1 ILE A 34 -2.122 -0.785 3.063 1.00 0.00 C ATOM 0 H ILE A 34 -2.991 -4.465 3.209 1.00 0.00 H new ATOM 0 HA ILE A 34 -2.112 -2.576 5.206 1.00 0.00 H new ATOM 0 HB ILE A 34 -4.801 -2.850 3.800 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -2.885 -2.594 2.230 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -4.011 -1.252 2.188 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.068 -0.475 4.389 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.891 -1.495 5.836 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -3.518 -0.520 5.263 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -1.698 -0.459 2.113 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -2.495 0.081 3.610 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -1.352 -1.283 3.652 1.00 0.00 H new ATOM 478 N SER A 35 -3.150 -3.516 7.252 1.00 0.00 N ATOM 479 CA SER A 35 -3.748 -4.026 8.480 1.00 0.00 C ATOM 480 C SER A 35 -4.625 -2.966 9.138 1.00 0.00 C ATOM 481 O SER A 35 -5.654 -3.280 9.738 1.00 0.00 O ATOM 482 CB SER A 35 -2.658 -4.479 9.453 1.00 0.00 C ATOM 483 OG SER A 35 -3.170 -4.607 10.768 1.00 0.00 O ATOM 0 H SER A 35 -2.304 -2.964 7.393 1.00 0.00 H new ATOM 0 HA SER A 35 -4.373 -4.881 8.223 1.00 0.00 H new ATOM 0 HB2 SER A 35 -2.247 -5.434 9.125 1.00 0.00 H new ATOM 0 HB3 SER A 35 -1.839 -3.760 9.447 1.00 0.00 H new ATOM 0 HG SER A 35 -2.455 -4.899 11.371 1.00 0.00 H new ATOM 489 N ARG A 36 -4.211 -1.708 9.022 1.00 0.00 N ATOM 490 CA ARG A 36 -4.957 -0.601 9.606 1.00 0.00 C ATOM 491 C ARG A 36 -5.045 0.570 8.631 1.00 0.00 C ATOM 492 O ARG A 36 -4.064 0.920 7.975 1.00 0.00 O ATOM 493 CB ARG A 36 -4.298 -0.145 10.909 1.00 0.00 C ATOM 494 CG ARG A 36 -5.262 0.519 11.879 1.00 0.00 C ATOM 495 CD ARG A 36 -4.548 1.518 12.777 1.00 0.00 C ATOM 496 NE ARG A 36 -5.440 2.080 13.788 1.00 0.00 N ATOM 497 CZ ARG A 36 -5.703 1.487 14.947 1.00 0.00 C ATOM 498 NH1 ARG A 36 -5.144 0.321 15.241 1.00 0.00 N ATOM 499 NH2 ARG A 36 -6.525 2.061 15.816 1.00 0.00 N ATOM 0 H ARG A 36 -3.362 -1.431 8.529 1.00 0.00 H new ATOM 0 HA ARG A 36 -5.967 -0.950 9.820 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -3.841 -1.007 11.396 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -3.494 0.552 10.675 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -6.049 1.027 11.321 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -5.746 -0.242 12.492 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -3.707 1.028 13.268 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -4.137 2.323 12.168 1.00 0.00 H new ATOM 0 HE ARG A 36 -5.885 2.977 13.593 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -4.510 -0.123 14.576 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -5.348 -0.132 16.132 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -6.956 2.959 15.594 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -6.726 1.605 16.706 1.00 0.00 H new ATOM 513 N VAL A 37 -6.227 1.171 8.541 1.00 0.00 N ATOM 514 CA VAL A 37 -6.444 2.302 7.647 1.00 0.00 C ATOM 515 C VAL A 37 -7.091 3.469 8.385 1.00 0.00 C ATOM 516 O VAL A 37 -8.112 3.304 9.053 1.00 0.00 O ATOM 517 CB VAL A 37 -7.330 1.910 6.450 1.00 0.00 C ATOM 518 CG1 VAL A 37 -7.588 3.116 5.559 1.00 0.00 C ATOM 519 CG2 VAL A 37 -6.687 0.781 5.659 1.00 0.00 C ATOM 0 H VAL A 37 -7.049 0.893 9.077 1.00 0.00 H new ATOM 0 HA VAL A 37 -5.465 2.607 7.279 1.00 0.00 H new ATOM 0 HB VAL A 37 -8.289 1.557 6.830 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -8.216 2.820 4.719 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -8.094 3.892 6.134 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.640 3.502 5.185 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -7.327 0.517 4.817 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -5.714 1.104 5.288 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -6.559 -0.088 6.304 1.00 0.00 H new ATOM 529 N ILE A 38 -6.492 4.648 8.257 1.00 0.00 N ATOM 530 CA ILE A 38 -7.012 5.843 8.910 1.00 0.00 C ATOM 531 C ILE A 38 -8.376 6.228 8.348 1.00 0.00 C ATOM 532 O ILE A 38 -8.532 6.488 7.155 1.00 0.00 O ATOM 533 CB ILE A 38 -6.049 7.035 8.752 1.00 0.00 C ATOM 534 CG1 ILE A 38 -4.651 6.658 9.245 1.00 0.00 C ATOM 535 CG2 ILE A 38 -6.575 8.245 9.509 1.00 0.00 C ATOM 536 CD1 ILE A 38 -4.625 6.174 10.678 1.00 0.00 C ATOM 0 H ILE A 38 -5.647 4.801 7.707 1.00 0.00 H new ATOM 0 HA ILE A 38 -7.112 5.605 9.969 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.984 7.293 7.695 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -4.245 5.879 8.600 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -3.996 7.524 9.151 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.884 9.079 9.388 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -7.552 8.524 9.115 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -6.666 8.001 10.567 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -3.602 5.925 10.959 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -5.001 6.959 11.334 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.254 5.289 10.775 1.00 0.00 H new ATOM 548 N PRO A 39 -9.389 6.267 9.226 1.00 0.00 N ATOM 549 CA PRO A 39 -10.758 6.621 8.841 1.00 0.00 C ATOM 550 C PRO A 39 -10.893 8.095 8.471 1.00 0.00 C ATOM 551 O PRO A 39 -11.991 8.579 8.203 1.00 0.00 O ATOM 552 CB PRO A 39 -11.573 6.309 10.098 1.00 0.00 C ATOM 553 CG PRO A 39 -10.597 6.421 11.219 1.00 0.00 C ATOM 554 CD PRO A 39 -9.275 5.968 10.664 1.00 0.00 C ATOM 0 HA PRO A 39 -11.087 6.074 7.957 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -12.398 7.011 10.220 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -12.008 5.311 10.050 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -10.537 7.447 11.583 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -10.899 5.801 12.063 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -8.443 6.503 11.121 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -9.107 4.906 10.842 1.00 0.00 H new ATOM 562 N GLY A 40 -9.767 8.802 8.458 1.00 0.00 N ATOM 563 CA GLY A 40 -9.782 10.213 8.119 1.00 0.00 C ATOM 564 C GLY A 40 -8.490 10.668 7.470 1.00 0.00 C ATOM 565 O GLY A 40 -7.964 11.731 7.796 1.00 0.00 O ATOM 0 H GLY A 40 -8.845 8.423 8.676 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.614 10.412 7.443 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.957 10.798 9.022 1.00 0.00 H new ATOM 569 N GLY A 41 -7.975 9.859 6.549 1.00 0.00 N ATOM 570 CA GLY A 41 -6.739 10.200 5.870 1.00 0.00 C ATOM 571 C GLY A 41 -6.870 10.135 4.361 1.00 0.00 C ATOM 572 O GLY A 41 -7.979 10.105 3.827 1.00 0.00 O ATOM 0 H GLY A 41 -8.392 8.974 6.261 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -6.433 11.204 6.162 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.951 9.520 6.193 1.00 0.00 H new ATOM 576 N VAL A 42 -5.734 10.114 3.670 1.00 0.00 N ATOM 577 CA VAL A 42 -5.727 10.053 2.213 1.00 0.00 C ATOM 578 C VAL A 42 -6.015 8.640 1.721 1.00 0.00 C ATOM 579 O VAL A 42 -6.751 8.446 0.754 1.00 0.00 O ATOM 580 CB VAL A 42 -4.375 10.519 1.639 1.00 0.00 C ATOM 581 CG1 VAL A 42 -4.362 10.380 0.125 1.00 0.00 C ATOM 582 CG2 VAL A 42 -4.088 11.954 2.054 1.00 0.00 C ATOM 0 H VAL A 42 -4.807 10.138 4.096 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.513 10.723 1.864 1.00 0.00 H new ATOM 0 HB VAL A 42 -3.588 9.883 2.044 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -3.400 10.714 -0.263 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.520 9.336 -0.146 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -5.157 10.990 -0.303 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -3.130 12.268 1.640 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -4.876 12.606 1.678 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -4.052 12.018 3.142 1.00 0.00 H new ATOM 592 N ALA A 43 -5.430 7.654 2.394 1.00 0.00 N ATOM 593 CA ALA A 43 -5.627 6.257 2.027 1.00 0.00 C ATOM 594 C ALA A 43 -7.110 5.912 1.952 1.00 0.00 C ATOM 595 O ALA A 43 -7.546 5.196 1.050 1.00 0.00 O ATOM 596 CB ALA A 43 -4.921 5.346 3.020 1.00 0.00 C ATOM 0 H ALA A 43 -4.816 7.797 3.196 1.00 0.00 H new ATOM 0 HA ALA A 43 -5.195 6.103 1.038 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.077 4.306 2.734 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -3.854 5.566 3.021 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.326 5.512 4.018 1.00 0.00 H new ATOM 602 N ASP A 44 -7.881 6.425 2.904 1.00 0.00 N ATOM 603 CA ASP A 44 -9.316 6.172 2.946 1.00 0.00 C ATOM 604 C ASP A 44 -10.061 7.107 1.998 1.00 0.00 C ATOM 605 O ASP A 44 -10.776 6.658 1.102 1.00 0.00 O ATOM 606 CB ASP A 44 -9.845 6.343 4.371 1.00 0.00 C ATOM 607 CG ASP A 44 -11.073 5.495 4.638 1.00 0.00 C ATOM 608 OD1 ASP A 44 -11.201 4.422 4.012 1.00 0.00 O ATOM 609 OD2 ASP A 44 -11.907 5.904 5.473 1.00 0.00 O ATOM 0 H ASP A 44 -7.536 7.019 3.658 1.00 0.00 H new ATOM 0 HA ASP A 44 -9.488 5.145 2.624 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -9.062 6.077 5.081 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -10.087 7.392 4.542 1.00 0.00 H new ATOM 614 N ARG A 45 -9.888 8.409 2.203 1.00 0.00 N ATOM 615 CA ARG A 45 -10.546 9.407 1.368 1.00 0.00 C ATOM 616 C ARG A 45 -10.475 9.016 -0.105 1.00 0.00 C ATOM 617 O ARG A 45 -11.469 9.096 -0.828 1.00 0.00 O ATOM 618 CB ARG A 45 -9.902 10.779 1.574 1.00 0.00 C ATOM 619 CG ARG A 45 -10.491 11.561 2.737 1.00 0.00 C ATOM 620 CD ARG A 45 -10.393 13.061 2.507 1.00 0.00 C ATOM 621 NE ARG A 45 -11.513 13.568 1.719 1.00 0.00 N ATOM 622 CZ ARG A 45 -11.455 14.675 0.986 1.00 0.00 C ATOM 623 NH1 ARG A 45 -10.337 15.386 0.942 1.00 0.00 N ATOM 624 NH2 ARG A 45 -12.516 15.072 0.296 1.00 0.00 N ATOM 0 H ARG A 45 -9.298 8.797 2.939 1.00 0.00 H new ATOM 0 HA ARG A 45 -11.594 9.457 1.663 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -8.833 10.648 1.740 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -10.013 11.364 0.661 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -11.535 11.280 2.874 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -9.967 11.298 3.656 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -10.364 13.574 3.468 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -9.458 13.289 1.996 1.00 0.00 H new ATOM 0 HE ARG A 45 -12.388 13.044 1.732 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -9.519 15.084 1.471 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -10.295 16.235 0.379 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -13.378 14.527 0.328 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -12.470 15.922 -0.266 1.00 0.00 H new ATOM 638 N HIS A 46 -9.294 8.594 -0.544 1.00 0.00 N ATOM 639 CA HIS A 46 -9.093 8.191 -1.931 1.00 0.00 C ATOM 640 C HIS A 46 -10.219 7.273 -2.398 1.00 0.00 C ATOM 641 O HIS A 46 -10.841 7.513 -3.432 1.00 0.00 O ATOM 642 CB HIS A 46 -7.746 7.485 -2.089 1.00 0.00 C ATOM 643 CG HIS A 46 -7.551 6.861 -3.437 1.00 0.00 C ATOM 644 ND1 HIS A 46 -7.863 5.545 -3.708 1.00 0.00 N ATOM 645 CD2 HIS A 46 -7.076 7.379 -4.593 1.00 0.00 C ATOM 646 CE1 HIS A 46 -7.586 5.281 -4.972 1.00 0.00 C ATOM 647 NE2 HIS A 46 -7.107 6.378 -5.532 1.00 0.00 N ATOM 0 H HIS A 46 -8.461 8.522 0.041 1.00 0.00 H new ATOM 0 HA HIS A 46 -9.099 9.089 -2.549 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -6.946 8.203 -1.911 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -7.658 6.713 -1.324 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -6.736 8.392 -4.748 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -7.727 4.330 -5.464 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -6.809 6.467 -6.503 1.00 0.00 H new ATOM 655 N GLY A 47 -10.475 6.220 -1.628 1.00 0.00 N ATOM 656 CA GLY A 47 -11.525 5.282 -1.981 1.00 0.00 C ATOM 657 C GLY A 47 -11.025 4.157 -2.865 1.00 0.00 C ATOM 658 O GLY A 47 -11.471 4.006 -4.002 1.00 0.00 O ATOM 0 H GLY A 47 -9.975 6.000 -0.767 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -11.953 4.862 -1.071 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -12.326 5.814 -2.494 1.00 0.00 H new ATOM 662 N GLY A 48 -10.094 3.364 -2.342 1.00 0.00 N ATOM 663 CA GLY A 48 -9.547 2.258 -3.106 1.00 0.00 C ATOM 664 C GLY A 48 -8.746 1.300 -2.247 1.00 0.00 C ATOM 665 O GLY A 48 -8.856 0.082 -2.395 1.00 0.00 O ATOM 0 H GLY A 48 -9.709 3.468 -1.403 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -10.361 1.716 -3.588 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.910 2.649 -3.900 1.00 0.00 H new ATOM 669 N LEU A 49 -7.938 1.849 -1.348 1.00 0.00 N ATOM 670 CA LEU A 49 -7.113 1.034 -0.462 1.00 0.00 C ATOM 671 C LEU A 49 -7.905 0.591 0.765 1.00 0.00 C ATOM 672 O LEU A 49 -8.510 1.411 1.456 1.00 0.00 O ATOM 673 CB LEU A 49 -5.872 1.815 -0.026 1.00 0.00 C ATOM 674 CG LEU A 49 -4.808 2.037 -1.102 1.00 0.00 C ATOM 675 CD1 LEU A 49 -3.908 3.206 -0.729 1.00 0.00 C ATOM 676 CD2 LEU A 49 -3.986 0.774 -1.308 1.00 0.00 C ATOM 0 H LEU A 49 -7.836 2.855 -1.213 1.00 0.00 H new ATOM 0 HA LEU A 49 -6.802 0.146 -1.012 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -6.192 2.788 0.347 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -5.411 1.289 0.810 1.00 0.00 H new ATOM 0 HG LEU A 49 -5.311 2.276 -2.039 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -3.157 3.349 -1.506 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -4.508 4.111 -0.633 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -3.413 2.996 0.219 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -3.234 0.951 -2.077 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -3.493 0.504 -0.374 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -4.641 -0.039 -1.621 1.00 0.00 H new ATOM 688 N LYS A 50 -7.895 -0.711 1.030 1.00 0.00 N ATOM 689 CA LYS A 50 -8.609 -1.264 2.175 1.00 0.00 C ATOM 690 C LYS A 50 -7.727 -2.241 2.946 1.00 0.00 C ATOM 691 O LYS A 50 -6.704 -2.701 2.439 1.00 0.00 O ATOM 692 CB LYS A 50 -9.887 -1.969 1.713 1.00 0.00 C ATOM 693 CG LYS A 50 -10.964 -1.016 1.225 1.00 0.00 C ATOM 694 CD LYS A 50 -11.961 -1.719 0.318 1.00 0.00 C ATOM 695 CE LYS A 50 -13.238 -0.909 0.160 1.00 0.00 C ATOM 696 NZ LYS A 50 -14.344 -1.723 -0.417 1.00 0.00 N ATOM 0 H LYS A 50 -7.400 -1.403 0.467 1.00 0.00 H new ATOM 0 HA LYS A 50 -8.875 -0.441 2.838 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -9.639 -2.665 0.912 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -10.284 -2.561 2.538 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -11.487 -0.588 2.080 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -10.502 -0.188 0.687 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -11.510 -1.884 -0.661 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -12.200 -2.700 0.729 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -13.543 -0.519 1.131 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -13.046 -0.050 -0.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -15.197 -1.135 -0.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -14.064 -2.075 -1.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -14.545 -2.529 0.209 1.00 0.00 H new ATOM 710 N ARG A 51 -8.131 -2.555 4.172 1.00 0.00 N ATOM 711 CA ARG A 51 -7.378 -3.478 5.012 1.00 0.00 C ATOM 712 C ARG A 51 -7.362 -4.878 4.404 1.00 0.00 C ATOM 713 O ARG A 51 -8.394 -5.544 4.328 1.00 0.00 O ATOM 714 CB ARG A 51 -7.978 -3.528 6.418 1.00 0.00 C ATOM 715 CG ARG A 51 -7.295 -4.528 7.337 1.00 0.00 C ATOM 716 CD ARG A 51 -8.248 -5.046 8.403 1.00 0.00 C ATOM 717 NE ARG A 51 -9.121 -6.099 7.892 1.00 0.00 N ATOM 718 CZ ARG A 51 -9.693 -7.018 8.662 1.00 0.00 C ATOM 719 NH1 ARG A 51 -9.485 -7.013 9.971 1.00 0.00 N ATOM 720 NH2 ARG A 51 -10.475 -7.944 8.122 1.00 0.00 N ATOM 0 H ARG A 51 -8.976 -2.184 4.606 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.352 -3.116 5.075 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -7.917 -2.536 6.865 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -9.036 -3.780 6.344 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -6.916 -5.364 6.749 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -6.435 -4.057 7.814 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -7.674 -5.429 9.247 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -8.855 -4.222 8.778 1.00 0.00 H new ATOM 0 HE ARG A 51 -9.302 -6.131 6.889 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -8.885 -6.302 10.389 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -9.925 -7.720 10.560 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -10.637 -7.951 7.115 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -10.914 -8.649 8.714 1.00 0.00 H new ATOM 734 N GLY A 52 -6.184 -5.317 3.972 1.00 0.00 N ATOM 735 CA GLY A 52 -6.056 -6.634 3.376 1.00 0.00 C ATOM 736 C GLY A 52 -5.351 -6.597 2.035 1.00 0.00 C ATOM 737 O GLY A 52 -4.682 -7.557 1.651 1.00 0.00 O ATOM 0 H GLY A 52 -5.316 -4.784 4.024 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -5.505 -7.285 4.055 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.047 -7.070 3.250 1.00 0.00 H new ATOM 741 N ASP A 53 -5.500 -5.488 1.320 1.00 0.00 N ATOM 742 CA ASP A 53 -4.872 -5.330 0.013 1.00 0.00 C ATOM 743 C ASP A 53 -3.379 -5.634 0.088 1.00 0.00 C ATOM 744 O ASP A 53 -2.607 -4.859 0.652 1.00 0.00 O ATOM 745 CB ASP A 53 -5.091 -3.912 -0.514 1.00 0.00 C ATOM 746 CG ASP A 53 -6.554 -3.610 -0.773 1.00 0.00 C ATOM 747 OD1 ASP A 53 -7.288 -3.351 0.204 1.00 0.00 O ATOM 748 OD2 ASP A 53 -6.966 -3.632 -1.952 1.00 0.00 O ATOM 0 H ASP A 53 -6.050 -4.684 1.623 1.00 0.00 H new ATOM 0 HA ASP A 53 -5.335 -6.039 -0.673 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -4.697 -3.195 0.206 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -4.527 -3.779 -1.437 1.00 0.00 H new ATOM 753 N GLN A 54 -2.980 -6.765 -0.485 1.00 0.00 N ATOM 754 CA GLN A 54 -1.580 -7.171 -0.481 1.00 0.00 C ATOM 755 C GLN A 54 -0.753 -6.282 -1.404 1.00 0.00 C ATOM 756 O GLN A 54 -0.985 -6.239 -2.613 1.00 0.00 O ATOM 757 CB GLN A 54 -1.449 -8.633 -0.910 1.00 0.00 C ATOM 758 CG GLN A 54 -0.141 -9.278 -0.482 1.00 0.00 C ATOM 759 CD GLN A 54 1.062 -8.681 -1.186 1.00 0.00 C ATOM 760 OE1 GLN A 54 0.958 -8.193 -2.312 1.00 0.00 O ATOM 761 NE2 GLN A 54 2.213 -8.717 -0.525 1.00 0.00 N ATOM 0 H GLN A 54 -3.607 -7.416 -0.958 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.200 -7.063 0.535 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.279 -9.202 -0.491 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.537 -8.694 -1.995 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -0.020 -9.165 0.595 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.184 -10.348 -0.687 1.00 0.00 H new ATOM 0 HE21 GLN A 54 2.254 -9.131 0.406 1.00 0.00 H new ATOM 0 HE22 GLN A 54 3.057 -8.331 -0.949 1.00 0.00 H new ATOM 770 N LEU A 55 0.211 -5.573 -0.827 1.00 0.00 N ATOM 771 CA LEU A 55 1.073 -4.684 -1.598 1.00 0.00 C ATOM 772 C LEU A 55 1.894 -5.469 -2.616 1.00 0.00 C ATOM 773 O LEU A 55 2.834 -6.179 -2.257 1.00 0.00 O ATOM 774 CB LEU A 55 2.004 -3.909 -0.664 1.00 0.00 C ATOM 775 CG LEU A 55 2.654 -2.655 -1.253 1.00 0.00 C ATOM 776 CD1 LEU A 55 1.595 -1.623 -1.609 1.00 0.00 C ATOM 777 CD2 LEU A 55 3.665 -2.071 -0.278 1.00 0.00 C ATOM 0 H LEU A 55 0.415 -5.596 0.172 1.00 0.00 H new ATOM 0 HA LEU A 55 0.439 -3.980 -2.136 1.00 0.00 H new ATOM 0 HB2 LEU A 55 1.439 -3.619 0.222 1.00 0.00 H new ATOM 0 HB3 LEU A 55 2.795 -4.582 -0.331 1.00 0.00 H new ATOM 0 HG LEU A 55 3.180 -2.935 -2.166 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.075 -0.738 -2.026 1.00 0.00 H new ATOM 0 HD12 LEU A 55 0.909 -2.044 -2.344 1.00 0.00 H new ATOM 0 HD13 LEU A 55 1.041 -1.346 -0.712 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.117 -1.180 -0.713 1.00 0.00 H new ATOM 0 HD22 LEU A 55 3.162 -1.805 0.652 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.441 -2.809 -0.073 1.00 0.00 H new ATOM 789 N LEU A 56 1.533 -5.335 -3.888 1.00 0.00 N ATOM 790 CA LEU A 56 2.238 -6.030 -4.960 1.00 0.00 C ATOM 791 C LEU A 56 3.541 -5.317 -5.306 1.00 0.00 C ATOM 792 O LEU A 56 4.623 -5.897 -5.205 1.00 0.00 O ATOM 793 CB LEU A 56 1.350 -6.125 -6.202 1.00 0.00 C ATOM 794 CG LEU A 56 0.073 -6.953 -6.052 1.00 0.00 C ATOM 795 CD1 LEU A 56 -0.751 -6.899 -7.329 1.00 0.00 C ATOM 796 CD2 LEU A 56 0.410 -8.393 -5.692 1.00 0.00 C ATOM 0 H LEU A 56 0.757 -4.752 -4.202 1.00 0.00 H new ATOM 0 HA LEU A 56 2.477 -7.035 -4.613 1.00 0.00 H new ATOM 0 HB2 LEU A 56 1.071 -5.115 -6.503 1.00 0.00 H new ATOM 0 HB3 LEU A 56 1.940 -6.548 -7.015 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.521 -6.527 -5.243 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.656 -7.494 -7.204 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -1.023 -5.865 -7.543 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.166 -7.299 -8.157 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -0.511 -8.967 -5.589 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.025 -8.830 -6.479 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.958 -8.414 -4.750 1.00 0.00 H new ATOM 808 N SER A 57 3.431 -4.057 -5.713 1.00 0.00 N ATOM 809 CA SER A 57 4.601 -3.265 -6.075 1.00 0.00 C ATOM 810 C SER A 57 4.371 -1.787 -5.774 1.00 0.00 C ATOM 811 O SER A 57 3.268 -1.269 -5.951 1.00 0.00 O ATOM 812 CB SER A 57 4.928 -3.450 -7.558 1.00 0.00 C ATOM 813 OG SER A 57 3.820 -3.108 -8.372 1.00 0.00 O ATOM 0 H SER A 57 2.543 -3.562 -5.801 1.00 0.00 H new ATOM 0 HA SER A 57 5.444 -3.612 -5.478 1.00 0.00 H new ATOM 0 HB2 SER A 57 5.784 -2.830 -7.825 1.00 0.00 H new ATOM 0 HB3 SER A 57 5.214 -4.485 -7.744 1.00 0.00 H new ATOM 0 HG SER A 57 4.056 -3.233 -9.315 1.00 0.00 H new ATOM 819 N VAL A 58 5.422 -1.113 -5.318 1.00 0.00 N ATOM 820 CA VAL A 58 5.337 0.306 -4.992 1.00 0.00 C ATOM 821 C VAL A 58 6.401 1.105 -5.737 1.00 0.00 C ATOM 822 O VAL A 58 7.556 0.692 -5.821 1.00 0.00 O ATOM 823 CB VAL A 58 5.496 0.545 -3.479 1.00 0.00 C ATOM 824 CG1 VAL A 58 5.337 2.022 -3.152 1.00 0.00 C ATOM 825 CG2 VAL A 58 4.494 -0.292 -2.699 1.00 0.00 C ATOM 0 H VAL A 58 6.342 -1.526 -5.166 1.00 0.00 H new ATOM 0 HA VAL A 58 4.349 0.644 -5.303 1.00 0.00 H new ATOM 0 HB VAL A 58 6.499 0.238 -3.184 1.00 0.00 H new ATOM 0 HG11 VAL A 58 5.453 2.171 -2.078 1.00 0.00 H new ATOM 0 HG12 VAL A 58 6.097 2.596 -3.682 1.00 0.00 H new ATOM 0 HG13 VAL A 58 4.347 2.359 -3.461 1.00 0.00 H new ATOM 0 HG21 VAL A 58 4.621 -0.110 -1.632 1.00 0.00 H new ATOM 0 HG22 VAL A 58 3.482 -0.018 -2.996 1.00 0.00 H new ATOM 0 HG23 VAL A 58 4.660 -1.348 -2.910 1.00 0.00 H new ATOM 835 N ASN A 59 6.002 2.253 -6.275 1.00 0.00 N ATOM 836 CA ASN A 59 6.921 3.111 -7.014 1.00 0.00 C ATOM 837 C ASN A 59 7.623 2.331 -8.121 1.00 0.00 C ATOM 838 O ASN A 59 8.782 2.592 -8.439 1.00 0.00 O ATOM 839 CB ASN A 59 7.957 3.718 -6.066 1.00 0.00 C ATOM 840 CG ASN A 59 7.363 4.784 -5.166 1.00 0.00 C ATOM 841 OD1 ASN A 59 7.459 4.702 -3.941 1.00 0.00 O ATOM 842 ND2 ASN A 59 6.745 5.792 -5.771 1.00 0.00 N ATOM 0 H ASN A 59 5.049 2.610 -6.213 1.00 0.00 H new ATOM 0 HA ASN A 59 6.342 3.913 -7.471 1.00 0.00 H new ATOM 0 HB2 ASN A 59 8.390 2.928 -5.452 1.00 0.00 H new ATOM 0 HB3 ASN A 59 8.770 4.151 -6.649 1.00 0.00 H new ATOM 0 HD21 ASN A 59 6.326 6.539 -5.217 1.00 0.00 H new ATOM 0 HD22 ASN A 59 6.690 5.819 -6.789 1.00 0.00 H new ATOM 849 N GLY A 60 6.911 1.371 -8.704 1.00 0.00 N ATOM 850 CA GLY A 60 7.482 0.568 -9.770 1.00 0.00 C ATOM 851 C GLY A 60 8.539 -0.396 -9.267 1.00 0.00 C ATOM 852 O GLY A 60 9.499 -0.700 -9.975 1.00 0.00 O ATOM 0 H GLY A 60 5.950 1.135 -8.457 1.00 0.00 H new ATOM 0 HA2 GLY A 60 6.688 0.007 -10.263 1.00 0.00 H new ATOM 0 HA3 GLY A 60 7.922 1.225 -10.520 1.00 0.00 H new ATOM 856 N VAL A 61 8.364 -0.877 -8.040 1.00 0.00 N ATOM 857 CA VAL A 61 9.310 -1.811 -7.443 1.00 0.00 C ATOM 858 C VAL A 61 8.591 -3.017 -6.849 1.00 0.00 C ATOM 859 O VAL A 61 7.532 -2.882 -6.237 1.00 0.00 O ATOM 860 CB VAL A 61 10.149 -1.133 -6.342 1.00 0.00 C ATOM 861 CG1 VAL A 61 11.090 -2.137 -5.694 1.00 0.00 C ATOM 862 CG2 VAL A 61 10.923 0.045 -6.913 1.00 0.00 C ATOM 0 H VAL A 61 7.575 -0.635 -7.440 1.00 0.00 H new ATOM 0 HA VAL A 61 9.973 -2.144 -8.241 1.00 0.00 H new ATOM 0 HB VAL A 61 9.474 -0.756 -5.574 1.00 0.00 H new ATOM 0 HG11 VAL A 61 11.674 -1.641 -4.919 1.00 0.00 H new ATOM 0 HG12 VAL A 61 10.509 -2.945 -5.249 1.00 0.00 H new ATOM 0 HG13 VAL A 61 11.762 -2.546 -6.449 1.00 0.00 H new ATOM 0 HG21 VAL A 61 11.510 0.512 -6.122 1.00 0.00 H new ATOM 0 HG22 VAL A 61 11.590 -0.305 -7.701 1.00 0.00 H new ATOM 0 HG23 VAL A 61 10.225 0.773 -7.325 1.00 0.00 H new ATOM 872 N SER A 62 9.175 -4.197 -7.032 1.00 0.00 N ATOM 873 CA SER A 62 8.589 -5.428 -6.517 1.00 0.00 C ATOM 874 C SER A 62 8.837 -5.563 -5.018 1.00 0.00 C ATOM 875 O SER A 62 9.950 -5.863 -4.586 1.00 0.00 O ATOM 876 CB SER A 62 9.167 -6.639 -7.252 1.00 0.00 C ATOM 877 OG SER A 62 8.770 -7.850 -6.631 1.00 0.00 O ATOM 0 H SER A 62 10.054 -4.326 -7.533 1.00 0.00 H new ATOM 0 HA SER A 62 7.513 -5.388 -6.687 1.00 0.00 H new ATOM 0 HB2 SER A 62 8.833 -6.632 -8.290 1.00 0.00 H new ATOM 0 HB3 SER A 62 10.255 -6.574 -7.267 1.00 0.00 H new ATOM 0 HG SER A 62 9.151 -8.609 -7.120 1.00 0.00 H new ATOM 883 N VAL A 63 7.791 -5.338 -4.229 1.00 0.00 N ATOM 884 CA VAL A 63 7.894 -5.435 -2.778 1.00 0.00 C ATOM 885 C VAL A 63 7.592 -6.851 -2.298 1.00 0.00 C ATOM 886 O VAL A 63 8.192 -7.331 -1.337 1.00 0.00 O ATOM 887 CB VAL A 63 6.934 -4.453 -2.081 1.00 0.00 C ATOM 888 CG1 VAL A 63 7.254 -3.020 -2.477 1.00 0.00 C ATOM 889 CG2 VAL A 63 5.489 -4.797 -2.411 1.00 0.00 C ATOM 0 H VAL A 63 6.863 -5.087 -4.570 1.00 0.00 H new ATOM 0 HA VAL A 63 8.920 -5.177 -2.516 1.00 0.00 H new ATOM 0 HB VAL A 63 7.068 -4.544 -1.003 1.00 0.00 H new ATOM 0 HG11 VAL A 63 6.565 -2.341 -1.974 1.00 0.00 H new ATOM 0 HG12 VAL A 63 8.277 -2.781 -2.185 1.00 0.00 H new ATOM 0 HG13 VAL A 63 7.150 -2.909 -3.556 1.00 0.00 H new ATOM 0 HG21 VAL A 63 4.824 -4.093 -1.910 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.337 -4.736 -3.489 1.00 0.00 H new ATOM 0 HG23 VAL A 63 5.269 -5.809 -2.071 1.00 0.00 H new ATOM 899 N GLU A 64 6.659 -7.513 -2.976 1.00 0.00 N ATOM 900 CA GLU A 64 6.278 -8.874 -2.618 1.00 0.00 C ATOM 901 C GLU A 64 7.490 -9.671 -2.144 1.00 0.00 C ATOM 902 O GLU A 64 7.408 -10.431 -1.180 1.00 0.00 O ATOM 903 CB GLU A 64 5.628 -9.575 -3.812 1.00 0.00 C ATOM 904 CG GLU A 64 4.202 -9.124 -4.081 1.00 0.00 C ATOM 905 CD GLU A 64 3.516 -9.958 -5.145 1.00 0.00 C ATOM 906 OE1 GLU A 64 3.784 -9.727 -6.343 1.00 0.00 O ATOM 907 OE2 GLU A 64 2.712 -10.841 -4.780 1.00 0.00 O ATOM 0 H GLU A 64 6.154 -7.129 -3.775 1.00 0.00 H new ATOM 0 HA GLU A 64 5.558 -8.820 -1.801 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.231 -9.394 -4.701 1.00 0.00 H new ATOM 0 HB3 GLU A 64 5.633 -10.651 -3.638 1.00 0.00 H new ATOM 0 HG2 GLU A 64 3.628 -9.178 -3.156 1.00 0.00 H new ATOM 0 HG3 GLU A 64 4.208 -8.079 -4.392 1.00 0.00 H new ATOM 914 N GLY A 65 8.614 -9.493 -2.831 1.00 0.00 N ATOM 915 CA GLY A 65 9.827 -10.202 -2.466 1.00 0.00 C ATOM 916 C GLY A 65 10.869 -9.290 -1.850 1.00 0.00 C ATOM 917 O GLY A 65 12.017 -9.263 -2.292 1.00 0.00 O ATOM 0 H GLY A 65 8.707 -8.871 -3.634 1.00 0.00 H new ATOM 0 HA2 GLY A 65 9.582 -10.996 -1.761 1.00 0.00 H new ATOM 0 HA3 GLY A 65 10.245 -10.680 -3.352 1.00 0.00 H new ATOM 921 N GLU A 66 10.468 -8.540 -0.828 1.00 0.00 N ATOM 922 CA GLU A 66 11.377 -7.621 -0.153 1.00 0.00 C ATOM 923 C GLU A 66 11.053 -7.531 1.335 1.00 0.00 C ATOM 924 O GLU A 66 10.045 -8.068 1.794 1.00 0.00 O ATOM 925 CB GLU A 66 11.297 -6.231 -0.789 1.00 0.00 C ATOM 926 CG GLU A 66 11.911 -6.161 -2.177 1.00 0.00 C ATOM 927 CD GLU A 66 13.426 -6.109 -2.143 1.00 0.00 C ATOM 928 OE1 GLU A 66 14.030 -6.893 -1.382 1.00 0.00 O ATOM 929 OE2 GLU A 66 14.007 -5.284 -2.879 1.00 0.00 O ATOM 0 H GLU A 66 9.521 -8.551 -0.450 1.00 0.00 H new ATOM 0 HA GLU A 66 12.391 -8.006 -0.264 1.00 0.00 H new ATOM 0 HB2 GLU A 66 10.252 -5.927 -0.847 1.00 0.00 H new ATOM 0 HB3 GLU A 66 11.802 -5.514 -0.141 1.00 0.00 H new ATOM 0 HG2 GLU A 66 11.594 -7.029 -2.755 1.00 0.00 H new ATOM 0 HG3 GLU A 66 11.532 -5.279 -2.694 1.00 0.00 H new ATOM 936 N GLN A 67 11.916 -6.849 2.082 1.00 0.00 N ATOM 937 CA GLN A 67 11.722 -6.690 3.518 1.00 0.00 C ATOM 938 C GLN A 67 10.802 -5.510 3.816 1.00 0.00 C ATOM 939 O GLN A 67 10.892 -4.463 3.175 1.00 0.00 O ATOM 940 CB GLN A 67 13.068 -6.491 4.217 1.00 0.00 C ATOM 941 CG GLN A 67 12.943 -6.116 5.684 1.00 0.00 C ATOM 942 CD GLN A 67 12.904 -7.327 6.596 1.00 0.00 C ATOM 943 OE1 GLN A 67 11.861 -7.660 7.160 1.00 0.00 O ATOM 944 NE2 GLN A 67 14.043 -7.993 6.744 1.00 0.00 N ATOM 0 H GLN A 67 12.755 -6.398 1.717 1.00 0.00 H new ATOM 0 HA GLN A 67 11.254 -7.598 3.898 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.650 -7.409 4.134 1.00 0.00 H new ATOM 0 HB3 GLN A 67 13.626 -5.712 3.698 1.00 0.00 H new ATOM 0 HG2 GLN A 67 13.783 -5.481 5.965 1.00 0.00 H new ATOM 0 HG3 GLN A 67 12.037 -5.528 5.829 1.00 0.00 H new ATOM 0 HE21 GLN A 67 14.883 -7.681 6.257 1.00 0.00 H new ATOM 0 HE22 GLN A 67 14.078 -8.817 7.345 1.00 0.00 H new ATOM 953 N HIS A 68 9.918 -5.688 4.793 1.00 0.00 N ATOM 954 CA HIS A 68 8.981 -4.637 5.176 1.00 0.00 C ATOM 955 C HIS A 68 9.630 -3.261 5.059 1.00 0.00 C ATOM 956 O HIS A 68 9.088 -2.362 4.418 1.00 0.00 O ATOM 957 CB HIS A 68 8.488 -4.861 6.606 1.00 0.00 C ATOM 958 CG HIS A 68 7.184 -4.187 6.902 1.00 0.00 C ATOM 959 ND1 HIS A 68 6.055 -4.360 6.130 1.00 0.00 N ATOM 960 CD2 HIS A 68 6.833 -3.335 7.894 1.00 0.00 C ATOM 961 CE1 HIS A 68 5.066 -3.644 6.634 1.00 0.00 C ATOM 962 NE2 HIS A 68 5.512 -3.012 7.705 1.00 0.00 N ATOM 0 H HIS A 68 9.831 -6.549 5.333 1.00 0.00 H new ATOM 0 HA HIS A 68 8.130 -4.677 4.496 1.00 0.00 H new ATOM 0 HB2 HIS A 68 8.382 -5.932 6.782 1.00 0.00 H new ATOM 0 HB3 HIS A 68 9.243 -4.496 7.303 1.00 0.00 H new ATOM 0 HD2 HIS A 68 7.473 -2.976 8.686 1.00 0.00 H new ATOM 0 HE1 HIS A 68 4.063 -3.585 6.238 1.00 0.00 H new ATOM 0 HE2 HIS A 68 4.964 -2.386 8.295 1.00 0.00 H new ATOM 970 N GLU A 69 10.794 -3.106 5.683 1.00 0.00 N ATOM 971 CA GLU A 69 11.515 -1.839 5.649 1.00 0.00 C ATOM 972 C GLU A 69 11.544 -1.267 4.234 1.00 0.00 C ATOM 973 O GLU A 69 11.323 -0.073 4.030 1.00 0.00 O ATOM 974 CB GLU A 69 12.943 -2.026 6.164 1.00 0.00 C ATOM 975 CG GLU A 69 13.017 -2.377 7.641 1.00 0.00 C ATOM 976 CD GLU A 69 14.342 -3.003 8.026 1.00 0.00 C ATOM 977 OE1 GLU A 69 15.330 -2.254 8.179 1.00 0.00 O ATOM 978 OE2 GLU A 69 14.393 -4.242 8.175 1.00 0.00 O ATOM 0 H GLU A 69 11.257 -3.841 6.217 1.00 0.00 H new ATOM 0 HA GLU A 69 10.992 -1.135 6.296 1.00 0.00 H new ATOM 0 HB2 GLU A 69 13.428 -2.814 5.587 1.00 0.00 H new ATOM 0 HB3 GLU A 69 13.506 -1.110 5.988 1.00 0.00 H new ATOM 0 HG2 GLU A 69 12.860 -1.475 8.233 1.00 0.00 H new ATOM 0 HG3 GLU A 69 12.209 -3.065 7.888 1.00 0.00 H new ATOM 985 N LYS A 70 11.818 -2.128 3.260 1.00 0.00 N ATOM 986 CA LYS A 70 11.876 -1.711 1.864 1.00 0.00 C ATOM 987 C LYS A 70 10.600 -0.978 1.462 1.00 0.00 C ATOM 988 O LYS A 70 10.638 0.195 1.091 1.00 0.00 O ATOM 989 CB LYS A 70 12.087 -2.925 0.956 1.00 0.00 C ATOM 990 CG LYS A 70 12.810 -2.598 -0.339 1.00 0.00 C ATOM 991 CD LYS A 70 14.297 -2.384 -0.109 1.00 0.00 C ATOM 992 CE LYS A 70 14.901 -1.482 -1.173 1.00 0.00 C ATOM 993 NZ LYS A 70 16.340 -1.202 -0.911 1.00 0.00 N ATOM 0 H LYS A 70 12.004 -3.119 3.412 1.00 0.00 H new ATOM 0 HA LYS A 70 12.718 -1.028 1.749 1.00 0.00 H new ATOM 0 HB2 LYS A 70 12.656 -3.680 1.499 1.00 0.00 H new ATOM 0 HB3 LYS A 70 11.118 -3.365 0.720 1.00 0.00 H new ATOM 0 HG2 LYS A 70 12.664 -3.409 -1.053 1.00 0.00 H new ATOM 0 HG3 LYS A 70 12.377 -1.701 -0.782 1.00 0.00 H new ATOM 0 HD2 LYS A 70 14.454 -1.943 0.875 1.00 0.00 H new ATOM 0 HD3 LYS A 70 14.809 -3.346 -0.113 1.00 0.00 H new ATOM 0 HE2 LYS A 70 14.795 -1.952 -2.151 1.00 0.00 H new ATOM 0 HE3 LYS A 70 14.349 -0.543 -1.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 16.715 -0.584 -1.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 16.440 -0.731 0.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 16.872 -2.096 -0.902 1.00 0.00 H new ATOM 1007 N ALA A 71 9.472 -1.676 1.539 1.00 0.00 N ATOM 1008 CA ALA A 71 8.185 -1.091 1.187 1.00 0.00 C ATOM 1009 C ALA A 71 8.035 0.304 1.784 1.00 0.00 C ATOM 1010 O ALA A 71 7.522 1.217 1.135 1.00 0.00 O ATOM 1011 CB ALA A 71 7.050 -1.991 1.652 1.00 0.00 C ATOM 0 H ALA A 71 9.424 -2.649 1.842 1.00 0.00 H new ATOM 0 HA ALA A 71 8.140 -1.001 0.102 1.00 0.00 H new ATOM 0 HB1 ALA A 71 6.095 -1.541 1.382 1.00 0.00 H new ATOM 0 HB2 ALA A 71 7.140 -2.966 1.174 1.00 0.00 H new ATOM 0 HB3 ALA A 71 7.101 -2.112 2.734 1.00 0.00 H new ATOM 1017 N VAL A 72 8.484 0.463 3.025 1.00 0.00 N ATOM 1018 CA VAL A 72 8.400 1.748 3.710 1.00 0.00 C ATOM 1019 C VAL A 72 9.382 2.752 3.118 1.00 0.00 C ATOM 1020 O VAL A 72 9.039 3.911 2.893 1.00 0.00 O ATOM 1021 CB VAL A 72 8.680 1.599 5.217 1.00 0.00 C ATOM 1022 CG1 VAL A 72 8.679 2.960 5.897 1.00 0.00 C ATOM 1023 CG2 VAL A 72 7.659 0.672 5.860 1.00 0.00 C ATOM 0 H VAL A 72 8.910 -0.282 3.577 1.00 0.00 H new ATOM 0 HA VAL A 72 7.383 2.115 3.571 1.00 0.00 H new ATOM 0 HB VAL A 72 9.668 1.157 5.343 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.878 2.835 6.961 1.00 0.00 H new ATOM 0 HG12 VAL A 72 9.452 3.588 5.454 1.00 0.00 H new ATOM 0 HG13 VAL A 72 7.706 3.433 5.763 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.872 0.578 6.925 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.659 1.083 5.725 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.714 -0.311 5.391 1.00 0.00 H new ATOM 1033 N GLU A 73 10.606 2.297 2.868 1.00 0.00 N ATOM 1034 CA GLU A 73 11.639 3.157 2.302 1.00 0.00 C ATOM 1035 C GLU A 73 11.180 3.760 0.978 1.00 0.00 C ATOM 1036 O GLU A 73 11.360 4.953 0.730 1.00 0.00 O ATOM 1037 CB GLU A 73 12.933 2.367 2.093 1.00 0.00 C ATOM 1038 CG GLU A 73 13.535 1.833 3.382 1.00 0.00 C ATOM 1039 CD GLU A 73 14.508 2.806 4.019 1.00 0.00 C ATOM 1040 OE1 GLU A 73 15.660 2.889 3.544 1.00 0.00 O ATOM 1041 OE2 GLU A 73 14.118 3.484 4.993 1.00 0.00 O ATOM 0 H GLU A 73 10.906 1.339 3.048 1.00 0.00 H new ATOM 0 HA GLU A 73 11.826 3.968 3.006 1.00 0.00 H new ATOM 0 HB2 GLU A 73 12.734 1.532 1.421 1.00 0.00 H new ATOM 0 HB3 GLU A 73 13.664 3.007 1.598 1.00 0.00 H new ATOM 0 HG2 GLU A 73 12.734 1.611 4.088 1.00 0.00 H new ATOM 0 HG3 GLU A 73 14.048 0.894 3.177 1.00 0.00 H new ATOM 1048 N LEU A 74 10.585 2.928 0.130 1.00 0.00 N ATOM 1049 CA LEU A 74 10.100 3.377 -1.170 1.00 0.00 C ATOM 1050 C LEU A 74 9.112 4.529 -1.013 1.00 0.00 C ATOM 1051 O LEU A 74 9.270 5.585 -1.627 1.00 0.00 O ATOM 1052 CB LEU A 74 9.436 2.219 -1.917 1.00 0.00 C ATOM 1053 CG LEU A 74 10.302 0.979 -2.137 1.00 0.00 C ATOM 1054 CD1 LEU A 74 9.472 -0.156 -2.718 1.00 0.00 C ATOM 1055 CD2 LEU A 74 11.477 1.303 -3.049 1.00 0.00 C ATOM 0 H LEU A 74 10.427 1.938 0.320 1.00 0.00 H new ATOM 0 HA LEU A 74 10.954 3.730 -1.747 1.00 0.00 H new ATOM 0 HB2 LEU A 74 8.544 1.922 -1.366 1.00 0.00 H new ATOM 0 HB3 LEU A 74 9.104 2.583 -2.889 1.00 0.00 H new ATOM 0 HG LEU A 74 10.694 0.658 -1.172 1.00 0.00 H new ATOM 0 HD11 LEU A 74 10.105 -1.030 -2.868 1.00 0.00 H new ATOM 0 HD12 LEU A 74 8.665 -0.406 -2.029 1.00 0.00 H new ATOM 0 HD13 LEU A 74 9.050 0.154 -3.674 1.00 0.00 H new ATOM 0 HD21 LEU A 74 12.082 0.408 -3.194 1.00 0.00 H new ATOM 0 HD22 LEU A 74 11.105 1.650 -4.013 1.00 0.00 H new ATOM 0 HD23 LEU A 74 12.087 2.084 -2.594 1.00 0.00 H new ATOM 1067 N LEU A 75 8.093 4.319 -0.186 1.00 0.00 N ATOM 1068 CA LEU A 75 7.080 5.341 0.054 1.00 0.00 C ATOM 1069 C LEU A 75 7.724 6.704 0.285 1.00 0.00 C ATOM 1070 O LEU A 75 7.288 7.712 -0.270 1.00 0.00 O ATOM 1071 CB LEU A 75 6.219 4.960 1.259 1.00 0.00 C ATOM 1072 CG LEU A 75 5.163 3.881 1.015 1.00 0.00 C ATOM 1073 CD1 LEU A 75 4.914 3.081 2.285 1.00 0.00 C ATOM 1074 CD2 LEU A 75 3.869 4.505 0.514 1.00 0.00 C ATOM 0 H LEU A 75 7.947 3.451 0.329 1.00 0.00 H new ATOM 0 HA LEU A 75 6.447 5.405 -0.831 1.00 0.00 H new ATOM 0 HB2 LEU A 75 6.878 4.621 2.058 1.00 0.00 H new ATOM 0 HB3 LEU A 75 5.716 5.857 1.619 1.00 0.00 H new ATOM 0 HG LEU A 75 5.536 3.201 0.249 1.00 0.00 H new ATOM 0 HD11 LEU A 75 4.160 2.318 2.092 1.00 0.00 H new ATOM 0 HD12 LEU A 75 5.841 2.603 2.602 1.00 0.00 H new ATOM 0 HD13 LEU A 75 4.562 3.748 3.072 1.00 0.00 H new ATOM 0 HD21 LEU A 75 3.129 3.723 0.346 1.00 0.00 H new ATOM 0 HD22 LEU A 75 3.492 5.207 1.258 1.00 0.00 H new ATOM 0 HD23 LEU A 75 4.058 5.033 -0.421 1.00 0.00 H new ATOM 1086 N LYS A 76 8.768 6.727 1.108 1.00 0.00 N ATOM 1087 CA LYS A 76 9.476 7.964 1.411 1.00 0.00 C ATOM 1088 C LYS A 76 10.310 8.421 0.218 1.00 0.00 C ATOM 1089 O LYS A 76 10.314 9.600 -0.133 1.00 0.00 O ATOM 1090 CB LYS A 76 10.378 7.774 2.633 1.00 0.00 C ATOM 1091 CG LYS A 76 9.635 7.855 3.955 1.00 0.00 C ATOM 1092 CD LYS A 76 9.068 6.505 4.360 1.00 0.00 C ATOM 1093 CE LYS A 76 7.936 6.655 5.366 1.00 0.00 C ATOM 1094 NZ LYS A 76 6.721 7.255 4.748 1.00 0.00 N ATOM 0 H LYS A 76 9.142 5.902 1.577 1.00 0.00 H new ATOM 0 HA LYS A 76 8.734 8.732 1.630 1.00 0.00 H new ATOM 0 HB2 LYS A 76 10.872 6.805 2.562 1.00 0.00 H new ATOM 0 HB3 LYS A 76 11.160 8.533 2.618 1.00 0.00 H new ATOM 0 HG2 LYS A 76 10.310 8.215 4.731 1.00 0.00 H new ATOM 0 HG3 LYS A 76 8.826 8.581 3.875 1.00 0.00 H new ATOM 0 HD2 LYS A 76 8.704 5.982 3.476 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.859 5.891 4.790 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.688 5.678 5.782 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.268 7.279 6.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 5.893 7.052 5.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 6.845 8.284 4.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 6.576 6.848 3.802 1.00 0.00 H new ATOM 1108 N ALA A 77 11.013 7.479 -0.402 1.00 0.00 N ATOM 1109 CA ALA A 77 11.846 7.784 -1.558 1.00 0.00 C ATOM 1110 C ALA A 77 11.048 8.514 -2.633 1.00 0.00 C ATOM 1111 O ALA A 77 11.554 9.430 -3.280 1.00 0.00 O ATOM 1112 CB ALA A 77 12.453 6.508 -2.123 1.00 0.00 C ATOM 0 H ALA A 77 11.022 6.498 -0.123 1.00 0.00 H new ATOM 0 HA ALA A 77 12.651 8.442 -1.231 1.00 0.00 H new ATOM 0 HB1 ALA A 77 13.073 6.751 -2.986 1.00 0.00 H new ATOM 0 HB2 ALA A 77 13.066 6.028 -1.360 1.00 0.00 H new ATOM 0 HB3 ALA A 77 11.656 5.830 -2.428 1.00 0.00 H new ATOM 1118 N ALA A 78 9.799 8.101 -2.819 1.00 0.00 N ATOM 1119 CA ALA A 78 8.931 8.717 -3.815 1.00 0.00 C ATOM 1120 C ALA A 78 8.741 10.203 -3.534 1.00 0.00 C ATOM 1121 O ALA A 78 9.022 10.676 -2.433 1.00 0.00 O ATOM 1122 CB ALA A 78 7.585 8.008 -3.852 1.00 0.00 C ATOM 0 H ALA A 78 9.365 7.342 -2.293 1.00 0.00 H new ATOM 0 HA ALA A 78 9.409 8.617 -4.789 1.00 0.00 H new ATOM 0 HB1 ALA A 78 6.947 8.478 -4.600 1.00 0.00 H new ATOM 0 HB2 ALA A 78 7.733 6.959 -4.109 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.110 8.078 -2.874 1.00 0.00 H new ATOM 1128 N GLN A 79 8.262 10.934 -4.535 1.00 0.00 N ATOM 1129 CA GLN A 79 8.036 12.367 -4.395 1.00 0.00 C ATOM 1130 C GLN A 79 6.868 12.822 -5.264 1.00 0.00 C ATOM 1131 O GLN A 79 6.683 12.334 -6.377 1.00 0.00 O ATOM 1132 CB GLN A 79 9.300 13.143 -4.771 1.00 0.00 C ATOM 1133 CG GLN A 79 10.229 13.400 -3.596 1.00 0.00 C ATOM 1134 CD GLN A 79 9.694 14.457 -2.649 1.00 0.00 C ATOM 1135 OE1 GLN A 79 8.488 14.698 -2.587 1.00 0.00 O ATOM 1136 NE2 GLN A 79 10.591 15.094 -1.906 1.00 0.00 N ATOM 0 H GLN A 79 8.023 10.557 -5.452 1.00 0.00 H new ATOM 0 HA GLN A 79 7.790 12.570 -3.353 1.00 0.00 H new ATOM 0 HB2 GLN A 79 9.842 12.589 -5.537 1.00 0.00 H new ATOM 0 HB3 GLN A 79 9.012 14.098 -5.212 1.00 0.00 H new ATOM 0 HG2 GLN A 79 10.381 12.470 -3.048 1.00 0.00 H new ATOM 0 HG3 GLN A 79 11.204 13.713 -3.970 1.00 0.00 H new ATOM 0 HE21 GLN A 79 11.581 14.862 -1.990 1.00 0.00 H new ATOM 0 HE22 GLN A 79 10.291 15.816 -1.251 1.00 0.00 H new ATOM 1145 N GLY A 80 6.082 13.761 -4.745 1.00 0.00 N ATOM 1146 CA GLY A 80 4.941 14.266 -5.487 1.00 0.00 C ATOM 1147 C GLY A 80 3.767 13.307 -5.469 1.00 0.00 C ATOM 1148 O GLY A 80 2.653 13.686 -5.108 1.00 0.00 O ATOM 0 H GLY A 80 6.215 14.181 -3.825 1.00 0.00 H new ATOM 0 HA2 GLY A 80 4.632 15.222 -5.065 1.00 0.00 H new ATOM 0 HA3 GLY A 80 5.237 14.454 -6.519 1.00 0.00 H new ATOM 1152 N SER A 81 4.016 12.061 -5.861 1.00 0.00 N ATOM 1153 CA SER A 81 2.970 11.046 -5.893 1.00 0.00 C ATOM 1154 C SER A 81 3.571 9.645 -5.841 1.00 0.00 C ATOM 1155 O SER A 81 4.623 9.386 -6.425 1.00 0.00 O ATOM 1156 CB SER A 81 2.118 11.202 -7.154 1.00 0.00 C ATOM 1157 OG SER A 81 2.928 11.220 -8.317 1.00 0.00 O ATOM 0 H SER A 81 4.933 11.731 -6.161 1.00 0.00 H new ATOM 0 HA SER A 81 2.337 11.183 -5.016 1.00 0.00 H new ATOM 0 HB2 SER A 81 1.403 10.382 -7.218 1.00 0.00 H new ATOM 0 HB3 SER A 81 1.540 12.124 -7.095 1.00 0.00 H new ATOM 0 HG SER A 81 2.360 11.319 -9.110 1.00 0.00 H new ATOM 1163 N VAL A 82 2.894 8.744 -5.136 1.00 0.00 N ATOM 1164 CA VAL A 82 3.358 7.368 -5.007 1.00 0.00 C ATOM 1165 C VAL A 82 2.375 6.393 -5.646 1.00 0.00 C ATOM 1166 O VAL A 82 1.162 6.598 -5.600 1.00 0.00 O ATOM 1167 CB VAL A 82 3.562 6.980 -3.531 1.00 0.00 C ATOM 1168 CG1 VAL A 82 4.687 7.797 -2.914 1.00 0.00 C ATOM 1169 CG2 VAL A 82 2.269 7.162 -2.749 1.00 0.00 C ATOM 0 H VAL A 82 2.022 8.943 -4.645 1.00 0.00 H new ATOM 0 HA VAL A 82 4.314 7.308 -5.526 1.00 0.00 H new ATOM 0 HB VAL A 82 3.843 5.928 -3.486 1.00 0.00 H new ATOM 0 HG11 VAL A 82 4.816 7.509 -1.871 1.00 0.00 H new ATOM 0 HG12 VAL A 82 5.613 7.612 -3.459 1.00 0.00 H new ATOM 0 HG13 VAL A 82 4.440 8.857 -2.969 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.431 6.883 -1.708 1.00 0.00 H new ATOM 0 HG22 VAL A 82 1.956 8.205 -2.801 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.492 6.528 -3.177 1.00 0.00 H new ATOM 1179 N LYS A 83 2.906 5.332 -6.243 1.00 0.00 N ATOM 1180 CA LYS A 83 2.077 4.323 -6.891 1.00 0.00 C ATOM 1181 C LYS A 83 2.111 3.010 -6.116 1.00 0.00 C ATOM 1182 O LYS A 83 3.156 2.366 -6.011 1.00 0.00 O ATOM 1183 CB LYS A 83 2.549 4.091 -8.329 1.00 0.00 C ATOM 1184 CG LYS A 83 1.926 5.043 -9.335 1.00 0.00 C ATOM 1185 CD LYS A 83 2.541 4.878 -10.714 1.00 0.00 C ATOM 1186 CE LYS A 83 1.543 5.209 -11.813 1.00 0.00 C ATOM 1187 NZ LYS A 83 2.204 5.340 -13.141 1.00 0.00 N ATOM 0 H LYS A 83 3.908 5.148 -6.292 1.00 0.00 H new ATOM 0 HA LYS A 83 1.050 4.689 -6.906 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.633 4.194 -8.368 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.315 3.066 -8.618 1.00 0.00 H new ATOM 0 HG2 LYS A 83 0.852 4.863 -9.391 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.060 6.070 -8.996 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.412 5.527 -10.805 1.00 0.00 H new ATOM 0 HD3 LYS A 83 2.892 3.853 -10.837 1.00 0.00 H new ATOM 0 HE2 LYS A 83 0.783 4.429 -11.861 1.00 0.00 H new ATOM 0 HE3 LYS A 83 1.030 6.139 -11.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.490 5.566 -13.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 2.911 6.101 -13.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 2.672 4.444 -13.385 1.00 0.00 H new ATOM 1201 N LEU A 84 0.963 2.618 -5.575 1.00 0.00 N ATOM 1202 CA LEU A 84 0.862 1.380 -4.809 1.00 0.00 C ATOM 1203 C LEU A 84 -0.039 0.373 -5.519 1.00 0.00 C ATOM 1204 O LEU A 84 -1.259 0.534 -5.556 1.00 0.00 O ATOM 1205 CB LEU A 84 0.320 1.666 -3.408 1.00 0.00 C ATOM 1206 CG LEU A 84 0.976 2.827 -2.659 1.00 0.00 C ATOM 1207 CD1 LEU A 84 -0.001 3.446 -1.672 1.00 0.00 C ATOM 1208 CD2 LEU A 84 2.235 2.357 -1.944 1.00 0.00 C ATOM 0 H LEU A 84 0.089 3.139 -5.652 1.00 0.00 H new ATOM 0 HA LEU A 84 1.861 0.951 -4.725 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -0.748 1.868 -3.488 1.00 0.00 H new ATOM 0 HB3 LEU A 84 0.429 0.764 -2.807 1.00 0.00 H new ATOM 0 HG LEU A 84 1.258 3.590 -3.385 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.484 4.270 -1.149 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.873 3.820 -2.209 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.315 2.692 -0.950 1.00 0.00 H new ATOM 0 HD21 LEU A 84 2.689 3.196 -1.416 1.00 0.00 H new ATOM 0 HD22 LEU A 84 1.977 1.576 -1.229 1.00 0.00 H new ATOM 0 HD23 LEU A 84 2.942 1.962 -2.674 1.00 0.00 H new ATOM 1220 N VAL A 85 0.571 -0.666 -6.079 1.00 0.00 N ATOM 1221 CA VAL A 85 -0.175 -1.701 -6.785 1.00 0.00 C ATOM 1222 C VAL A 85 -0.588 -2.823 -5.838 1.00 0.00 C ATOM 1223 O VAL A 85 0.228 -3.334 -5.071 1.00 0.00 O ATOM 1224 CB VAL A 85 0.648 -2.297 -7.942 1.00 0.00 C ATOM 1225 CG1 VAL A 85 -0.138 -3.391 -8.648 1.00 0.00 C ATOM 1226 CG2 VAL A 85 1.058 -1.207 -8.920 1.00 0.00 C ATOM 0 H VAL A 85 1.580 -0.814 -6.058 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.067 -1.226 -7.192 1.00 0.00 H new ATOM 0 HB VAL A 85 1.553 -2.742 -7.530 1.00 0.00 H new ATOM 0 HG11 VAL A 85 0.459 -3.800 -9.463 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.376 -4.184 -7.939 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -1.062 -2.974 -9.049 1.00 0.00 H new ATOM 0 HG21 VAL A 85 1.639 -1.646 -9.731 1.00 0.00 H new ATOM 0 HG22 VAL A 85 0.167 -0.730 -9.328 1.00 0.00 H new ATOM 0 HG23 VAL A 85 1.663 -0.462 -8.402 1.00 0.00 H new ATOM 1236 N VAL A 86 -1.861 -3.202 -5.898 1.00 0.00 N ATOM 1237 CA VAL A 86 -2.382 -4.266 -5.048 1.00 0.00 C ATOM 1238 C VAL A 86 -3.225 -5.249 -5.852 1.00 0.00 C ATOM 1239 O VAL A 86 -3.505 -5.024 -7.029 1.00 0.00 O ATOM 1240 CB VAL A 86 -3.234 -3.697 -3.897 1.00 0.00 C ATOM 1241 CG1 VAL A 86 -2.378 -2.853 -2.965 1.00 0.00 C ATOM 1242 CG2 VAL A 86 -4.397 -2.885 -4.447 1.00 0.00 C ATOM 0 H VAL A 86 -2.550 -2.788 -6.526 1.00 0.00 H new ATOM 0 HA VAL A 86 -1.521 -4.788 -4.630 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.641 -4.530 -3.323 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.997 -2.460 -2.159 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -1.582 -3.468 -2.545 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -1.940 -2.025 -3.523 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -4.988 -2.491 -3.621 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -4.013 -2.059 -5.045 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -5.024 -3.523 -5.070 1.00 0.00 H new ATOM 1252 N ARG A 87 -3.627 -6.340 -5.207 1.00 0.00 N ATOM 1253 CA ARG A 87 -4.438 -7.359 -5.863 1.00 0.00 C ATOM 1254 C ARG A 87 -5.816 -7.458 -5.214 1.00 0.00 C ATOM 1255 O ARG A 87 -5.948 -7.925 -4.083 1.00 0.00 O ATOM 1256 CB ARG A 87 -3.736 -8.716 -5.803 1.00 0.00 C ATOM 1257 CG ARG A 87 -4.442 -9.803 -6.597 1.00 0.00 C ATOM 1258 CD ARG A 87 -4.368 -9.537 -8.093 1.00 0.00 C ATOM 1259 NE ARG A 87 -3.021 -9.744 -8.619 1.00 0.00 N ATOM 1260 CZ ARG A 87 -2.553 -10.930 -8.993 1.00 0.00 C ATOM 1261 NH1 ARG A 87 -3.318 -12.008 -8.898 1.00 0.00 N ATOM 1262 NH2 ARG A 87 -1.316 -11.038 -9.463 1.00 0.00 N ATOM 0 H ARG A 87 -3.404 -6.541 -4.232 1.00 0.00 H new ATOM 0 HA ARG A 87 -4.566 -7.070 -6.906 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -2.719 -8.606 -6.179 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -3.659 -9.030 -4.762 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -3.989 -10.769 -6.375 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -5.486 -9.861 -6.288 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -5.065 -10.194 -8.613 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -4.683 -8.513 -8.295 1.00 0.00 H new ATOM 0 HE ARG A 87 -2.406 -8.934 -8.704 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -4.269 -11.929 -8.537 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -2.956 -12.917 -9.186 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -0.725 -10.210 -9.537 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -0.957 -11.949 -9.750 1.00 0.00 H new ATOM 1276 N SER A 88 -6.838 -7.014 -5.938 1.00 0.00 N ATOM 1277 CA SER A 88 -8.205 -7.048 -5.431 1.00 0.00 C ATOM 1278 C SER A 88 -8.916 -8.324 -5.872 1.00 0.00 C ATOM 1279 O SER A 88 -8.610 -8.888 -6.922 1.00 0.00 O ATOM 1280 CB SER A 88 -8.983 -5.823 -5.917 1.00 0.00 C ATOM 1281 OG SER A 88 -10.010 -5.477 -5.005 1.00 0.00 O ATOM 0 H SER A 88 -6.746 -6.627 -6.877 1.00 0.00 H new ATOM 0 HA SER A 88 -8.163 -7.034 -4.342 1.00 0.00 H new ATOM 0 HB2 SER A 88 -8.302 -4.981 -6.039 1.00 0.00 H new ATOM 0 HB3 SER A 88 -9.416 -6.028 -6.896 1.00 0.00 H new ATOM 0 HG SER A 88 -10.491 -4.691 -5.337 1.00 0.00 H new ATOM 1287 N GLY A 89 -9.869 -8.774 -5.060 1.00 0.00 N ATOM 1288 CA GLY A 89 -10.609 -9.980 -5.383 1.00 0.00 C ATOM 1289 C GLY A 89 -11.998 -9.684 -5.912 1.00 0.00 C ATOM 1290 O GLY A 89 -12.657 -8.734 -5.489 1.00 0.00 O ATOM 0 H GLY A 89 -10.141 -8.325 -4.185 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -10.055 -10.554 -6.126 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -10.688 -10.603 -4.492 1.00 0.00 H new ATOM 1294 N PRO A 90 -12.463 -10.510 -6.860 1.00 0.00 N ATOM 1295 CA PRO A 90 -13.786 -10.352 -7.469 1.00 0.00 C ATOM 1296 C PRO A 90 -14.915 -10.676 -6.496 1.00 0.00 C ATOM 1297 O PRO A 90 -16.090 -10.483 -6.807 1.00 0.00 O ATOM 1298 CB PRO A 90 -13.769 -11.358 -8.623 1.00 0.00 C ATOM 1299 CG PRO A 90 -12.778 -12.391 -8.210 1.00 0.00 C ATOM 1300 CD PRO A 90 -11.732 -11.664 -7.411 1.00 0.00 C ATOM 0 HA PRO A 90 -13.969 -9.325 -7.784 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.755 -11.796 -8.781 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -13.478 -10.882 -9.559 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -13.252 -13.171 -7.614 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -12.337 -12.878 -9.079 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -11.320 -12.293 -6.622 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.896 -11.349 -8.036 1.00 0.00 H new ATOM 1308 N SER A 91 -14.550 -11.169 -5.317 1.00 0.00 N ATOM 1309 CA SER A 91 -15.532 -11.523 -4.299 1.00 0.00 C ATOM 1310 C SER A 91 -14.909 -11.486 -2.907 1.00 0.00 C ATOM 1311 O SER A 91 -13.688 -11.445 -2.762 1.00 0.00 O ATOM 1312 CB SER A 91 -16.107 -12.913 -4.577 1.00 0.00 C ATOM 1313 OG SER A 91 -17.433 -13.024 -4.089 1.00 0.00 O ATOM 0 H SER A 91 -13.581 -11.332 -5.043 1.00 0.00 H new ATOM 0 HA SER A 91 -16.338 -10.790 -4.336 1.00 0.00 H new ATOM 0 HB2 SER A 91 -16.093 -13.108 -5.649 1.00 0.00 H new ATOM 0 HB3 SER A 91 -15.479 -13.670 -4.108 1.00 0.00 H new ATOM 0 HG SER A 91 -17.778 -13.921 -4.281 1.00 0.00 H new ATOM 1319 N SER A 92 -15.759 -11.502 -1.885 1.00 0.00 N ATOM 1320 CA SER A 92 -15.294 -11.466 -0.503 1.00 0.00 C ATOM 1321 C SER A 92 -15.730 -12.720 0.249 1.00 0.00 C ATOM 1322 O SER A 92 -16.809 -13.259 0.007 1.00 0.00 O ATOM 1323 CB SER A 92 -15.828 -10.220 0.205 1.00 0.00 C ATOM 1324 OG SER A 92 -15.144 -9.995 1.426 1.00 0.00 O ATOM 0 H SER A 92 -16.773 -11.540 -1.988 1.00 0.00 H new ATOM 0 HA SER A 92 -14.205 -11.430 -0.512 1.00 0.00 H new ATOM 0 HB2 SER A 92 -15.714 -9.352 -0.444 1.00 0.00 H new ATOM 0 HB3 SER A 92 -16.894 -10.336 0.398 1.00 0.00 H new ATOM 0 HG SER A 92 -15.502 -9.192 1.859 1.00 0.00 H new ATOM 1330 N GLY A 93 -14.882 -13.178 1.165 1.00 0.00 N ATOM 1331 CA GLY A 93 -15.197 -14.365 1.939 1.00 0.00 C ATOM 1332 C GLY A 93 -13.960 -15.026 2.515 1.00 0.00 C ATOM 1333 O GLY A 93 -13.389 -15.928 1.904 1.00 0.00 O ATOM 0 H GLY A 93 -13.983 -12.749 1.385 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -15.873 -14.097 2.751 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -15.725 -15.078 1.306 1.00 0.00 H new TER 1337 GLY A 93