USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 908 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 48 GLN : amide:sc= -0.134 X(o=-0.23,f=-0.55) USER MOD Set 1.2: A 61 SER OG : rot 180:sc= -0.0988 USER MOD Set 2.1: A 35 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 37 SER OG : 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 57:sc= 0.652 USER MOD Single : A 5 SER OG : rot 39:sc= 0.233 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -1.06! C(o=-1.1!,f=-3.7!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 14:sc= -0.53 USER MOD Single : A 21 SER OG : rot 170:sc= -0.0231 USER MOD Single : A 23 THR OG1 : rot -33:sc= 0.0625 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 180:sc=-0.00984 USER MOD Single : A 38 CYS SG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 THR OG1 : rot 63:sc= 0.405 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 CYS SG : rot 30:sc= -0.257 USER MOD Single : A 53 SER OG : rot 79:sc= 0.153 USER MOD Single : A 57 SER OG : rot -40:sc= 0.745 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -0.019 X(o=-0.019,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -98:sc= 0.685! USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= -0.945 X(o=-0.95,f=-0.72) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 80:sc= -5.8! USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot -55:sc= 0.982 USER MOD Single : A 101 ASN : amide:sc= -0.155 K(o=-0.15,f=-1.5!) USER MOD Single : A 103 LYS NZ :NH3+ -136:sc= 0.00207 (180deg=-0.0711) USER MOD Single : A 104 MET CE :methyl 177:sc= -1.41 (180deg=-1.49) USER MOD Single : A 107 SER OG : rot 120:sc= -0.5 USER MOD Single : A 112 SER OG : rot 45:sc= 1.1 USER MOD Single : A 115 SER OG : rot 180:sc= -0.0674 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.540 24.737 -3.300 1.00 0.00 N ATOM 2 CA GLY A 1 14.709 23.394 -2.773 1.00 0.00 C ATOM 3 C GLY A 1 15.965 22.734 -3.348 1.00 0.00 C ATOM 4 O GLY A 1 17.020 22.742 -2.715 1.00 0.00 O ATOM 0 H1 GLY A 1 13.682 25.163 -2.895 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.366 25.316 -3.047 1.00 0.00 H new ATOM 0 H3 GLY A 1 14.450 24.695 -4.335 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.779 23.432 -1.686 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.834 22.791 -3.015 1.00 0.00 H new ATOM 8 N SER A 2 15.810 22.180 -4.542 1.00 0.00 N ATOM 9 CA SER A 2 16.918 21.517 -5.208 1.00 0.00 C ATOM 10 C SER A 2 17.364 20.299 -4.397 1.00 0.00 C ATOM 11 O SER A 2 17.877 20.440 -3.288 1.00 0.00 O ATOM 12 CB SER A 2 18.092 22.477 -5.413 1.00 0.00 C ATOM 13 OG SER A 2 17.673 23.722 -5.964 1.00 0.00 O ATOM 0 H SER A 2 14.934 22.177 -5.065 1.00 0.00 H new ATOM 0 HA SER A 2 16.578 21.187 -6.190 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.588 22.652 -4.458 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.826 22.016 -6.074 1.00 0.00 H new ATOM 0 HG SER A 2 18.451 24.307 -6.078 1.00 0.00 H new ATOM 19 N SER A 3 17.154 19.129 -4.982 1.00 0.00 N ATOM 20 CA SER A 3 17.528 17.886 -4.328 1.00 0.00 C ATOM 21 C SER A 3 17.211 16.699 -5.239 1.00 0.00 C ATOM 22 O SER A 3 16.322 16.782 -6.086 1.00 0.00 O ATOM 23 CB SER A 3 16.809 17.733 -2.987 1.00 0.00 C ATOM 24 OG SER A 3 17.653 18.063 -1.888 1.00 0.00 O ATOM 0 H SER A 3 16.729 19.015 -5.902 1.00 0.00 H new ATOM 0 HA SER A 3 18.600 17.910 -4.134 1.00 0.00 H new ATOM 0 HB2 SER A 3 15.928 18.375 -2.973 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.458 16.707 -2.879 1.00 0.00 H new ATOM 0 HG SER A 3 17.990 18.977 -1.997 1.00 0.00 H new ATOM 30 N GLY A 4 17.954 15.622 -5.035 1.00 0.00 N ATOM 31 CA GLY A 4 17.764 14.419 -5.827 1.00 0.00 C ATOM 32 C GLY A 4 16.276 14.097 -5.987 1.00 0.00 C ATOM 33 O GLY A 4 15.469 14.428 -5.120 1.00 0.00 O ATOM 0 H GLY A 4 18.690 15.557 -4.332 1.00 0.00 H new ATOM 0 HA2 GLY A 4 18.219 14.550 -6.809 1.00 0.00 H new ATOM 0 HA3 GLY A 4 18.272 13.581 -5.350 1.00 0.00 H new ATOM 37 N SER A 5 15.958 13.457 -7.102 1.00 0.00 N ATOM 38 CA SER A 5 14.582 13.087 -7.386 1.00 0.00 C ATOM 39 C SER A 5 14.538 12.080 -8.539 1.00 0.00 C ATOM 40 O SER A 5 14.906 12.407 -9.666 1.00 0.00 O ATOM 41 CB SER A 5 13.740 14.318 -7.724 1.00 0.00 C ATOM 42 OG SER A 5 14.339 15.111 -8.745 1.00 0.00 O ATOM 0 H SER A 5 16.630 13.185 -7.820 1.00 0.00 H new ATOM 0 HA SER A 5 14.160 12.626 -6.493 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.748 14.001 -8.046 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.606 14.923 -6.827 1.00 0.00 H new ATOM 0 HG SER A 5 14.745 14.526 -9.418 1.00 0.00 H new ATOM 48 N SER A 6 14.085 10.878 -8.215 1.00 0.00 N ATOM 49 CA SER A 6 13.988 9.823 -9.209 1.00 0.00 C ATOM 50 C SER A 6 15.377 9.497 -9.763 1.00 0.00 C ATOM 51 O SER A 6 16.282 10.328 -9.709 1.00 0.00 O ATOM 52 CB SER A 6 13.043 10.221 -10.345 1.00 0.00 C ATOM 53 OG SER A 6 11.758 10.599 -9.862 1.00 0.00 O ATOM 0 H SER A 6 13.781 10.611 -7.279 1.00 0.00 H new ATOM 0 HA SER A 6 13.578 8.935 -8.727 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.478 11.049 -10.905 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.939 9.387 -11.039 1.00 0.00 H new ATOM 0 HG SER A 6 11.185 10.848 -10.617 1.00 0.00 H new ATOM 59 N GLY A 7 15.502 8.284 -10.282 1.00 0.00 N ATOM 60 CA GLY A 7 16.764 7.838 -10.845 1.00 0.00 C ATOM 61 C GLY A 7 16.653 6.407 -11.374 1.00 0.00 C ATOM 62 O GLY A 7 15.818 6.121 -12.232 1.00 0.00 O ATOM 0 H GLY A 7 14.750 7.597 -10.324 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.062 8.506 -11.653 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.544 7.889 -10.085 1.00 0.00 H new ATOM 66 N LEU A 8 17.507 5.544 -10.841 1.00 0.00 N ATOM 67 CA LEU A 8 17.515 4.150 -11.249 1.00 0.00 C ATOM 68 C LEU A 8 17.287 3.264 -10.023 1.00 0.00 C ATOM 69 O LEU A 8 18.239 2.748 -9.439 1.00 0.00 O ATOM 70 CB LEU A 8 18.799 3.823 -12.015 1.00 0.00 C ATOM 71 CG LEU A 8 18.879 4.352 -13.448 1.00 0.00 C ATOM 72 CD1 LEU A 8 20.305 4.251 -13.991 1.00 0.00 C ATOM 73 CD2 LEU A 8 17.869 3.641 -14.351 1.00 0.00 C ATOM 0 H LEU A 8 18.198 5.784 -10.130 1.00 0.00 H new ATOM 0 HA LEU A 8 16.699 3.951 -11.943 1.00 0.00 H new ATOM 0 HB2 LEU A 8 19.644 4.222 -11.454 1.00 0.00 H new ATOM 0 HB3 LEU A 8 18.916 2.740 -12.042 1.00 0.00 H new ATOM 0 HG LEU A 8 18.614 5.409 -13.438 1.00 0.00 H new ATOM 0 HD11 LEU A 8 20.334 4.634 -15.011 1.00 0.00 H new ATOM 0 HD12 LEU A 8 20.976 4.839 -13.364 1.00 0.00 H new ATOM 0 HD13 LEU A 8 20.623 3.209 -13.985 1.00 0.00 H new ATOM 0 HD21 LEU A 8 17.946 4.035 -15.364 1.00 0.00 H new ATOM 0 HD22 LEU A 8 18.079 2.572 -14.361 1.00 0.00 H new ATOM 0 HD23 LEU A 8 16.861 3.809 -13.972 1.00 0.00 H new ATOM 85 N ASN A 9 16.019 3.112 -9.670 1.00 0.00 N ATOM 86 CA ASN A 9 15.654 2.297 -8.524 1.00 0.00 C ATOM 87 C ASN A 9 14.697 1.192 -8.974 1.00 0.00 C ATOM 88 O ASN A 9 15.063 0.018 -8.996 1.00 0.00 O ATOM 89 CB ASN A 9 14.944 3.132 -7.457 1.00 0.00 C ATOM 90 CG ASN A 9 14.352 2.239 -6.365 1.00 0.00 C ATOM 91 OD1 ASN A 9 14.571 1.039 -6.322 1.00 0.00 O ATOM 92 ND2 ASN A 9 13.595 2.888 -5.486 1.00 0.00 N ATOM 0 H ASN A 9 15.232 3.540 -10.158 1.00 0.00 H new ATOM 0 HA ASN A 9 16.568 1.878 -8.104 1.00 0.00 H new ATOM 0 HB2 ASN A 9 15.648 3.836 -7.014 1.00 0.00 H new ATOM 0 HB3 ASN A 9 14.152 3.721 -7.919 1.00 0.00 H new ATOM 0 HD21 ASN A 9 13.157 2.380 -4.718 1.00 0.00 H new ATOM 0 HD22 ASN A 9 13.453 3.894 -5.580 1.00 0.00 H new ATOM 99 N ASP A 10 13.487 1.606 -9.323 1.00 0.00 N ATOM 100 CA ASP A 10 12.474 0.666 -9.771 1.00 0.00 C ATOM 101 C ASP A 10 11.219 1.436 -10.189 1.00 0.00 C ATOM 102 O ASP A 10 11.104 2.631 -9.926 1.00 0.00 O ATOM 103 CB ASP A 10 12.085 -0.300 -8.651 1.00 0.00 C ATOM 104 CG ASP A 10 11.676 -1.699 -9.117 1.00 0.00 C ATOM 105 OD1 ASP A 10 10.466 -1.882 -9.370 1.00 0.00 O ATOM 106 OD2 ASP A 10 12.583 -2.555 -9.210 1.00 0.00 O ATOM 0 H ASP A 10 13.186 2.580 -9.304 1.00 0.00 H new ATOM 0 HA ASP A 10 12.885 0.101 -10.608 1.00 0.00 H new ATOM 0 HB2 ASP A 10 12.926 -0.394 -7.964 1.00 0.00 H new ATOM 0 HB3 ASP A 10 11.260 0.135 -8.087 1.00 0.00 H new ATOM 111 N GLU A 11 10.311 0.718 -10.832 1.00 0.00 N ATOM 112 CA GLU A 11 9.068 1.318 -11.288 1.00 0.00 C ATOM 113 C GLU A 11 7.918 0.931 -10.356 1.00 0.00 C ATOM 114 O GLU A 11 7.290 1.796 -9.746 1.00 0.00 O ATOM 115 CB GLU A 11 8.763 0.916 -12.732 1.00 0.00 C ATOM 116 CG GLU A 11 7.279 1.109 -13.053 1.00 0.00 C ATOM 117 CD GLU A 11 7.024 0.996 -14.557 1.00 0.00 C ATOM 118 OE1 GLU A 11 7.643 1.791 -15.298 1.00 0.00 O ATOM 119 OE2 GLU A 11 6.217 0.119 -14.932 1.00 0.00 O ATOM 0 H GLU A 11 10.411 -0.274 -11.048 1.00 0.00 H new ATOM 0 HA GLU A 11 9.180 2.402 -11.263 1.00 0.00 H new ATOM 0 HB2 GLU A 11 9.367 1.513 -13.415 1.00 0.00 H new ATOM 0 HB3 GLU A 11 9.040 -0.126 -12.889 1.00 0.00 H new ATOM 0 HG2 GLU A 11 6.689 0.361 -12.523 1.00 0.00 H new ATOM 0 HG3 GLU A 11 6.950 2.085 -12.697 1.00 0.00 H new ATOM 126 N LEU A 12 7.676 -0.369 -10.275 1.00 0.00 N ATOM 127 CA LEU A 12 6.613 -0.881 -9.428 1.00 0.00 C ATOM 128 C LEU A 12 7.067 -0.843 -7.967 1.00 0.00 C ATOM 129 O LEU A 12 6.339 -0.361 -7.100 1.00 0.00 O ATOM 130 CB LEU A 12 6.173 -2.268 -9.899 1.00 0.00 C ATOM 131 CG LEU A 12 5.010 -2.303 -10.892 1.00 0.00 C ATOM 132 CD1 LEU A 12 4.773 -3.721 -11.411 1.00 0.00 C ATOM 133 CD2 LEU A 12 3.745 -1.700 -10.276 1.00 0.00 C ATOM 0 H LEU A 12 8.198 -1.083 -10.782 1.00 0.00 H new ATOM 0 HA LEU A 12 5.728 -0.249 -9.504 1.00 0.00 H new ATOM 0 HB2 LEU A 12 7.030 -2.763 -10.356 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.895 -2.855 -9.024 1.00 0.00 H new ATOM 0 HG LEU A 12 5.277 -1.687 -11.751 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.941 -3.716 -12.115 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.671 -4.079 -11.914 1.00 0.00 H new ATOM 0 HD13 LEU A 12 4.538 -4.380 -10.575 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.933 -1.737 -11.003 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.465 -2.269 -9.390 1.00 0.00 H new ATOM 0 HD23 LEU A 12 3.935 -0.664 -9.997 1.00 0.00 H new ATOM 145 N LEU A 13 8.267 -1.357 -7.740 1.00 0.00 N ATOM 146 CA LEU A 13 8.826 -1.388 -6.400 1.00 0.00 C ATOM 147 C LEU A 13 9.223 0.030 -5.986 1.00 0.00 C ATOM 148 O LEU A 13 9.596 0.846 -6.827 1.00 0.00 O ATOM 149 CB LEU A 13 9.975 -2.396 -6.321 1.00 0.00 C ATOM 150 CG LEU A 13 11.254 -1.904 -5.641 1.00 0.00 C ATOM 151 CD1 LEU A 13 11.091 -1.882 -4.120 1.00 0.00 C ATOM 152 CD2 LEU A 13 12.461 -2.736 -6.076 1.00 0.00 C ATOM 0 H LEU A 13 8.867 -1.755 -8.462 1.00 0.00 H new ATOM 0 HA LEU A 13 8.080 -1.734 -5.684 1.00 0.00 H new ATOM 0 HB2 LEU A 13 9.621 -3.279 -5.789 1.00 0.00 H new ATOM 0 HB3 LEU A 13 10.224 -2.713 -7.334 1.00 0.00 H new ATOM 0 HG LEU A 13 11.439 -0.878 -5.961 1.00 0.00 H new ATOM 0 HD11 LEU A 13 12.014 -1.529 -3.660 1.00 0.00 H new ATOM 0 HD12 LEU A 13 10.273 -1.214 -3.851 1.00 0.00 H new ATOM 0 HD13 LEU A 13 10.870 -2.888 -3.763 1.00 0.00 H new ATOM 0 HD21 LEU A 13 13.357 -2.365 -5.578 1.00 0.00 H new ATOM 0 HD22 LEU A 13 12.300 -3.779 -5.805 1.00 0.00 H new ATOM 0 HD23 LEU A 13 12.587 -2.657 -7.156 1.00 0.00 H new ATOM 164 N GLY A 14 9.132 0.280 -4.687 1.00 0.00 N ATOM 165 CA GLY A 14 9.477 1.586 -4.150 1.00 0.00 C ATOM 166 C GLY A 14 8.324 2.575 -4.330 1.00 0.00 C ATOM 167 O GLY A 14 8.430 3.736 -3.936 1.00 0.00 O ATOM 0 H GLY A 14 8.824 -0.400 -3.991 1.00 0.00 H new ATOM 0 HA2 GLY A 14 9.721 1.495 -3.092 1.00 0.00 H new ATOM 0 HA3 GLY A 14 10.368 1.965 -4.651 1.00 0.00 H new ATOM 171 N LYS A 15 7.248 2.079 -4.925 1.00 0.00 N ATOM 172 CA LYS A 15 6.076 2.905 -5.161 1.00 0.00 C ATOM 173 C LYS A 15 4.852 2.237 -4.532 1.00 0.00 C ATOM 174 O LYS A 15 4.889 1.053 -4.200 1.00 0.00 O ATOM 175 CB LYS A 15 5.919 3.197 -6.655 1.00 0.00 C ATOM 176 CG LYS A 15 5.127 2.087 -7.350 1.00 0.00 C ATOM 177 CD LYS A 15 3.779 2.607 -7.853 1.00 0.00 C ATOM 178 CE LYS A 15 3.963 3.522 -9.065 1.00 0.00 C ATOM 179 NZ LYS A 15 3.458 4.883 -8.769 1.00 0.00 N ATOM 0 H LYS A 15 7.164 1.116 -5.250 1.00 0.00 H new ATOM 0 HA LYS A 15 6.191 3.877 -4.681 1.00 0.00 H new ATOM 0 HB2 LYS A 15 5.411 4.151 -6.791 1.00 0.00 H new ATOM 0 HB3 LYS A 15 6.902 3.291 -7.116 1.00 0.00 H new ATOM 0 HG2 LYS A 15 5.704 1.693 -8.187 1.00 0.00 H new ATOM 0 HG3 LYS A 15 4.966 1.261 -6.657 1.00 0.00 H new ATOM 0 HD2 LYS A 15 3.138 1.767 -8.121 1.00 0.00 H new ATOM 0 HD3 LYS A 15 3.274 3.151 -7.055 1.00 0.00 H new ATOM 0 HE2 LYS A 15 5.018 3.570 -9.335 1.00 0.00 H new ATOM 0 HE3 LYS A 15 3.433 3.110 -9.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 3.590 5.491 -9.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 2.446 4.834 -8.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 3.982 5.280 -7.963 1.00 0.00 H new ATOM 193 N VAL A 16 3.796 3.025 -4.390 1.00 0.00 N ATOM 194 CA VAL A 16 2.563 2.524 -3.807 1.00 0.00 C ATOM 195 C VAL A 16 1.858 1.616 -4.818 1.00 0.00 C ATOM 196 O VAL A 16 1.768 1.948 -5.998 1.00 0.00 O ATOM 197 CB VAL A 16 1.691 3.693 -3.344 1.00 0.00 C ATOM 198 CG1 VAL A 16 0.293 3.212 -2.951 1.00 0.00 C ATOM 199 CG2 VAL A 16 2.355 4.450 -2.192 1.00 0.00 C ATOM 0 H VAL A 16 3.769 4.006 -4.668 1.00 0.00 H new ATOM 0 HA VAL A 16 2.775 1.923 -2.923 1.00 0.00 H new ATOM 0 HB VAL A 16 1.585 4.383 -4.181 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -0.306 4.062 -2.626 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -0.184 2.739 -3.810 1.00 0.00 H new ATOM 0 HG13 VAL A 16 0.372 2.491 -2.137 1.00 0.00 H new ATOM 0 HG21 VAL A 16 1.714 5.276 -1.882 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.507 3.773 -1.351 1.00 0.00 H new ATOM 0 HG23 VAL A 16 3.318 4.841 -2.521 1.00 0.00 H new ATOM 209 N VAL A 17 1.378 0.488 -4.316 1.00 0.00 N ATOM 210 CA VAL A 17 0.684 -0.469 -5.160 1.00 0.00 C ATOM 211 C VAL A 17 -0.591 -0.937 -4.453 1.00 0.00 C ATOM 212 O VAL A 17 -0.749 -0.733 -3.250 1.00 0.00 O ATOM 213 CB VAL A 17 1.622 -1.622 -5.523 1.00 0.00 C ATOM 214 CG1 VAL A 17 2.663 -1.177 -6.553 1.00 0.00 C ATOM 215 CG2 VAL A 17 2.295 -2.196 -4.275 1.00 0.00 C ATOM 0 H VAL A 17 1.456 0.216 -3.336 1.00 0.00 H new ATOM 0 HA VAL A 17 0.383 -0.003 -6.098 1.00 0.00 H new ATOM 0 HB VAL A 17 1.022 -2.413 -5.973 1.00 0.00 H new ATOM 0 HG11 VAL A 17 3.317 -2.015 -6.794 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.158 -0.839 -7.458 1.00 0.00 H new ATOM 0 HG13 VAL A 17 3.256 -0.360 -6.142 1.00 0.00 H new ATOM 0 HG21 VAL A 17 2.956 -3.014 -4.562 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.876 -1.416 -3.783 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.534 -2.568 -3.590 1.00 0.00 H new ATOM 225 N SER A 18 -1.468 -1.554 -5.230 1.00 0.00 N ATOM 226 CA SER A 18 -2.723 -2.052 -4.694 1.00 0.00 C ATOM 227 C SER A 18 -2.660 -3.573 -4.538 1.00 0.00 C ATOM 228 O SER A 18 -2.461 -4.293 -5.515 1.00 0.00 O ATOM 229 CB SER A 18 -3.899 -1.659 -5.591 1.00 0.00 C ATOM 230 OG SER A 18 -3.593 -1.818 -6.973 1.00 0.00 O ATOM 0 H SER A 18 -1.334 -1.721 -6.227 1.00 0.00 H new ATOM 0 HA SER A 18 -2.880 -1.599 -3.715 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.766 -2.269 -5.339 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.172 -0.622 -5.397 1.00 0.00 H new ATOM 0 HG SER A 18 -2.781 -2.358 -7.068 1.00 0.00 H new ATOM 236 N VAL A 19 -2.832 -4.015 -3.301 1.00 0.00 N ATOM 237 CA VAL A 19 -2.797 -5.437 -3.004 1.00 0.00 C ATOM 238 C VAL A 19 -4.212 -6.011 -3.106 1.00 0.00 C ATOM 239 O VAL A 19 -5.166 -5.408 -2.616 1.00 0.00 O ATOM 240 CB VAL A 19 -2.154 -5.670 -1.635 1.00 0.00 C ATOM 241 CG1 VAL A 19 -2.066 -7.165 -1.318 1.00 0.00 C ATOM 242 CG2 VAL A 19 -0.775 -5.012 -1.557 1.00 0.00 C ATOM 0 H VAL A 19 -2.996 -3.414 -2.493 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.180 -5.964 -3.732 1.00 0.00 H new ATOM 0 HB VAL A 19 -2.791 -5.204 -0.883 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -1.605 -7.303 -0.340 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.068 -7.595 -1.311 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -1.462 -7.663 -2.077 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -0.341 -5.193 -0.574 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -0.126 -5.435 -2.324 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.874 -3.939 -1.718 1.00 0.00 H new ATOM 252 N VAL A 20 -4.302 -7.167 -3.744 1.00 0.00 N ATOM 253 CA VAL A 20 -5.584 -7.828 -3.917 1.00 0.00 C ATOM 254 C VAL A 20 -5.724 -8.941 -2.875 1.00 0.00 C ATOM 255 O VAL A 20 -4.849 -9.798 -2.756 1.00 0.00 O ATOM 256 CB VAL A 20 -5.723 -8.335 -5.354 1.00 0.00 C ATOM 257 CG1 VAL A 20 -7.143 -8.841 -5.622 1.00 0.00 C ATOM 258 CG2 VAL A 20 -5.329 -7.250 -6.358 1.00 0.00 C ATOM 0 H VAL A 20 -3.508 -7.664 -4.148 1.00 0.00 H new ATOM 0 HA VAL A 20 -6.401 -7.124 -3.754 1.00 0.00 H new ATOM 0 HB VAL A 20 -5.039 -9.174 -5.481 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.215 -9.196 -6.650 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -7.373 -9.659 -4.939 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -7.854 -8.029 -5.468 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -5.437 -7.636 -7.372 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -5.977 -6.383 -6.229 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.293 -6.957 -6.189 1.00 0.00 H new ATOM 268 N SER A 21 -6.831 -8.891 -2.148 1.00 0.00 N ATOM 269 CA SER A 21 -7.096 -9.884 -1.121 1.00 0.00 C ATOM 270 C SER A 21 -7.555 -11.194 -1.764 1.00 0.00 C ATOM 271 O SER A 21 -8.470 -11.197 -2.587 1.00 0.00 O ATOM 272 CB SER A 21 -8.147 -9.382 -0.128 1.00 0.00 C ATOM 273 OG SER A 21 -8.070 -10.064 1.121 1.00 0.00 O ATOM 0 H SER A 21 -7.554 -8.179 -2.250 1.00 0.00 H new ATOM 0 HA SER A 21 -6.172 -10.062 -0.571 1.00 0.00 H new ATOM 0 HB2 SER A 21 -8.011 -8.313 0.034 1.00 0.00 H new ATOM 0 HB3 SER A 21 -9.141 -9.516 -0.554 1.00 0.00 H new ATOM 0 HG SER A 21 -8.641 -9.612 1.776 1.00 0.00 H new ATOM 279 N ALA A 22 -6.901 -12.274 -1.365 1.00 0.00 N ATOM 280 CA ALA A 22 -7.231 -13.586 -1.893 1.00 0.00 C ATOM 281 C ALA A 22 -8.704 -13.888 -1.613 1.00 0.00 C ATOM 282 O ALA A 22 -9.487 -14.094 -2.541 1.00 0.00 O ATOM 283 CB ALA A 22 -6.296 -14.633 -1.282 1.00 0.00 C ATOM 0 H ALA A 22 -6.144 -12.267 -0.682 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.088 -13.611 -2.973 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.544 -15.618 -1.678 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.264 -14.390 -1.534 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.414 -14.638 -0.198 1.00 0.00 H new ATOM 289 N THR A 23 -9.040 -13.905 -0.332 1.00 0.00 N ATOM 290 CA THR A 23 -10.405 -14.178 0.082 1.00 0.00 C ATOM 291 C THR A 23 -11.309 -12.987 -0.246 1.00 0.00 C ATOM 292 O THR A 23 -12.530 -13.076 -0.119 1.00 0.00 O ATOM 293 CB THR A 23 -10.387 -14.536 1.569 1.00 0.00 C ATOM 294 OG1 THR A 23 -11.596 -15.265 1.765 1.00 0.00 O ATOM 295 CG2 THR A 23 -10.541 -13.309 2.470 1.00 0.00 C ATOM 0 H THR A 23 -8.389 -13.734 0.434 1.00 0.00 H new ATOM 0 HA THR A 23 -10.822 -15.024 -0.464 1.00 0.00 H new ATOM 0 HB THR A 23 -9.454 -15.046 1.808 1.00 0.00 H new ATOM 0 HG1 THR A 23 -12.290 -14.915 1.168 1.00 0.00 H new ATOM 0 HG21 THR A 23 -10.522 -13.620 3.515 1.00 0.00 H new ATOM 0 HG22 THR A 23 -9.722 -12.615 2.283 1.00 0.00 H new ATOM 0 HG23 THR A 23 -11.490 -12.817 2.256 1.00 0.00 H new ATOM 303 N GLU A 24 -10.675 -11.900 -0.658 1.00 0.00 N ATOM 304 CA GLU A 24 -11.406 -10.692 -1.004 1.00 0.00 C ATOM 305 C GLU A 24 -10.822 -10.062 -2.269 1.00 0.00 C ATOM 306 O GLU A 24 -10.387 -8.911 -2.249 1.00 0.00 O ATOM 307 CB GLU A 24 -11.402 -9.697 0.157 1.00 0.00 C ATOM 308 CG GLU A 24 -12.712 -9.766 0.944 1.00 0.00 C ATOM 309 CD GLU A 24 -13.071 -8.399 1.531 1.00 0.00 C ATOM 310 OE1 GLU A 24 -12.148 -7.754 2.073 1.00 0.00 O ATOM 311 OE2 GLU A 24 -14.262 -8.031 1.426 1.00 0.00 O ATOM 0 H GLU A 24 -9.663 -11.830 -0.760 1.00 0.00 H new ATOM 0 HA GLU A 24 -12.443 -10.963 -1.203 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.564 -9.910 0.820 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.257 -8.687 -0.226 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -13.515 -10.108 0.291 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.620 -10.498 1.747 1.00 0.00 H new ATOM 318 N ARG A 25 -10.830 -10.843 -3.340 1.00 0.00 N ATOM 319 CA ARG A 25 -10.306 -10.374 -4.611 1.00 0.00 C ATOM 320 C ARG A 25 -10.725 -8.923 -4.857 1.00 0.00 C ATOM 321 O ARG A 25 -10.025 -8.179 -5.540 1.00 0.00 O ATOM 322 CB ARG A 25 -10.805 -11.245 -5.766 1.00 0.00 C ATOM 323 CG ARG A 25 -10.260 -12.670 -5.653 1.00 0.00 C ATOM 324 CD ARG A 25 -9.587 -13.106 -6.957 1.00 0.00 C ATOM 325 NE ARG A 25 -9.370 -14.570 -6.951 1.00 0.00 N ATOM 326 CZ ARG A 25 -8.318 -15.171 -6.378 1.00 0.00 C ATOM 327 NH1 ARG A 25 -7.381 -14.437 -5.762 1.00 0.00 N ATOM 328 NH2 ARG A 25 -8.204 -16.505 -6.421 1.00 0.00 N ATOM 0 H ARG A 25 -11.191 -11.797 -3.353 1.00 0.00 H new ATOM 0 HA ARG A 25 -9.219 -10.438 -4.565 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -11.895 -11.267 -5.765 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -10.496 -10.808 -6.716 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -9.543 -12.725 -4.834 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -11.072 -13.356 -5.412 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -10.208 -12.826 -7.808 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -8.634 -12.590 -7.074 1.00 0.00 H new ATOM 0 HE ARG A 25 -10.064 -15.158 -7.412 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -7.469 -13.421 -5.729 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -6.580 -14.894 -5.326 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -8.918 -17.063 -6.890 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -7.403 -16.963 -5.985 1.00 0.00 H new ATOM 342 N THR A 26 -11.867 -8.567 -4.286 1.00 0.00 N ATOM 343 CA THR A 26 -12.388 -7.218 -4.434 1.00 0.00 C ATOM 344 C THR A 26 -11.572 -6.236 -3.591 1.00 0.00 C ATOM 345 O THR A 26 -10.784 -5.460 -4.126 1.00 0.00 O ATOM 346 CB THR A 26 -13.874 -7.244 -4.071 1.00 0.00 C ATOM 347 OG1 THR A 26 -14.525 -7.577 -5.294 1.00 0.00 O ATOM 348 CG2 THR A 26 -14.416 -5.855 -3.727 1.00 0.00 C ATOM 0 H THR A 26 -12.445 -9.188 -3.721 1.00 0.00 H new ATOM 0 HA THR A 26 -12.296 -6.868 -5.462 1.00 0.00 H new ATOM 0 HB THR A 26 -14.029 -7.915 -3.226 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.493 -7.617 -5.149 1.00 0.00 H new ATOM 0 HG21 THR A 26 -15.474 -5.929 -3.477 1.00 0.00 H new ATOM 0 HG22 THR A 26 -13.869 -5.452 -2.875 1.00 0.00 H new ATOM 0 HG23 THR A 26 -14.291 -5.193 -4.584 1.00 0.00 H new ATOM 356 N GLU A 27 -11.792 -6.303 -2.285 1.00 0.00 N ATOM 357 CA GLU A 27 -11.088 -5.428 -1.364 1.00 0.00 C ATOM 358 C GLU A 27 -9.591 -5.414 -1.683 1.00 0.00 C ATOM 359 O GLU A 27 -8.985 -6.467 -1.876 1.00 0.00 O ATOM 360 CB GLU A 27 -11.336 -5.847 0.086 1.00 0.00 C ATOM 361 CG GLU A 27 -12.193 -4.813 0.818 1.00 0.00 C ATOM 362 CD GLU A 27 -11.626 -4.514 2.207 1.00 0.00 C ATOM 363 OE1 GLU A 27 -10.979 -5.427 2.765 1.00 0.00 O ATOM 364 OE2 GLU A 27 -11.853 -3.380 2.680 1.00 0.00 O ATOM 0 H GLU A 27 -12.447 -6.949 -1.844 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.474 -4.416 -1.487 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -11.833 -6.817 0.108 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -10.383 -5.965 0.602 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.238 -3.894 0.234 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -13.215 -5.182 0.910 1.00 0.00 H new ATOM 371 N TRP A 28 -9.039 -4.211 -1.728 1.00 0.00 N ATOM 372 CA TRP A 28 -7.625 -4.047 -2.020 1.00 0.00 C ATOM 373 C TRP A 28 -7.095 -2.898 -1.159 1.00 0.00 C ATOM 374 O TRP A 28 -7.780 -1.896 -0.964 1.00 0.00 O ATOM 375 CB TRP A 28 -7.397 -3.827 -3.517 1.00 0.00 C ATOM 376 CG TRP A 28 -7.881 -2.468 -4.027 1.00 0.00 C ATOM 377 CD1 TRP A 28 -9.036 -2.182 -4.644 1.00 0.00 C ATOM 378 CD2 TRP A 28 -7.172 -1.214 -3.939 1.00 0.00 C ATOM 379 NE1 TRP A 28 -9.122 -0.841 -4.959 1.00 0.00 N ATOM 380 CE2 TRP A 28 -7.953 -0.234 -4.515 1.00 0.00 C ATOM 381 CE3 TRP A 28 -5.912 -0.918 -3.389 1.00 0.00 C ATOM 382 CZ2 TRP A 28 -7.562 1.108 -4.599 1.00 0.00 C ATOM 383 CZ3 TRP A 28 -5.536 0.428 -3.480 1.00 0.00 C ATOM 384 CH2 TRP A 28 -6.310 1.426 -4.058 1.00 0.00 C ATOM 0 H TRP A 28 -9.545 -3.340 -1.567 1.00 0.00 H new ATOM 0 HA TRP A 28 -7.072 -4.952 -1.771 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -6.333 -3.926 -3.730 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -7.907 -4.614 -4.071 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -9.803 -2.909 -4.867 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -9.900 -0.380 -5.431 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -5.284 -1.669 -2.933 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -8.192 1.857 -5.056 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -4.577 0.710 -3.072 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -5.948 2.443 -4.090 1.00 0.00 H new ATOM 395 N TYR A 29 -5.878 -3.084 -0.667 1.00 0.00 N ATOM 396 CA TYR A 29 -5.249 -2.076 0.169 1.00 0.00 C ATOM 397 C TYR A 29 -3.891 -1.661 -0.401 1.00 0.00 C ATOM 398 O TYR A 29 -3.211 -2.463 -1.040 1.00 0.00 O ATOM 399 CB TYR A 29 -5.036 -2.733 1.535 1.00 0.00 C ATOM 400 CG TYR A 29 -3.649 -3.353 1.716 1.00 0.00 C ATOM 401 CD1 TYR A 29 -3.414 -4.649 1.305 1.00 0.00 C ATOM 402 CD2 TYR A 29 -2.634 -2.617 2.293 1.00 0.00 C ATOM 403 CE1 TYR A 29 -2.109 -5.233 1.477 1.00 0.00 C ATOM 404 CE2 TYR A 29 -1.329 -3.201 2.465 1.00 0.00 C ATOM 405 CZ TYR A 29 -1.131 -4.480 2.048 1.00 0.00 C ATOM 406 OH TYR A 29 0.102 -5.033 2.210 1.00 0.00 O ATOM 0 H TYR A 29 -5.312 -3.917 -0.831 1.00 0.00 H new ATOM 0 HA TYR A 29 -5.871 -1.183 0.227 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -5.194 -1.987 2.314 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.790 -3.507 1.676 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -4.209 -5.225 0.854 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -2.819 -1.603 2.616 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -1.911 -6.246 1.160 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -0.526 -2.636 2.915 1.00 0.00 H new ATOM 0 HH TYR A 29 0.701 -4.380 2.630 1.00 0.00 H new ATOM 416 N PRO A 30 -3.527 -0.376 -0.145 1.00 0.00 N ATOM 417 CA PRO A 30 -2.263 0.155 -0.625 1.00 0.00 C ATOM 418 C PRO A 30 -1.093 -0.379 0.205 1.00 0.00 C ATOM 419 O PRO A 30 -1.254 -0.685 1.385 1.00 0.00 O ATOM 420 CB PRO A 30 -2.412 1.664 -0.540 1.00 0.00 C ATOM 421 CG PRO A 30 -3.568 1.916 0.415 1.00 0.00 C ATOM 422 CD PRO A 30 -4.307 0.602 0.608 1.00 0.00 C ATOM 0 HA PRO A 30 -2.039 -0.152 -1.647 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -1.495 2.127 -0.174 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -2.616 2.092 -1.521 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -3.200 2.291 1.370 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -4.238 2.675 0.012 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -4.368 0.333 1.663 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.330 0.664 0.236 1.00 0.00 H new ATOM 430 N ALA A 31 0.057 -0.473 -0.445 1.00 0.00 N ATOM 431 CA ALA A 31 1.253 -0.964 0.218 1.00 0.00 C ATOM 432 C ALA A 31 2.477 -0.635 -0.638 1.00 0.00 C ATOM 433 O ALA A 31 2.455 -0.816 -1.855 1.00 0.00 O ATOM 434 CB ALA A 31 1.112 -2.464 0.480 1.00 0.00 C ATOM 0 H ALA A 31 0.186 -0.218 -1.424 1.00 0.00 H new ATOM 0 HA ALA A 31 1.384 -0.475 1.183 1.00 0.00 H new ATOM 0 HB1 ALA A 31 2.009 -2.832 0.977 1.00 0.00 H new ATOM 0 HB2 ALA A 31 0.245 -2.642 1.116 1.00 0.00 H new ATOM 0 HB3 ALA A 31 0.981 -2.988 -0.467 1.00 0.00 H new ATOM 440 N LEU A 32 3.517 -0.158 0.030 1.00 0.00 N ATOM 441 CA LEU A 32 4.748 0.198 -0.655 1.00 0.00 C ATOM 442 C LEU A 32 5.681 -1.014 -0.679 1.00 0.00 C ATOM 443 O LEU A 32 6.150 -1.463 0.366 1.00 0.00 O ATOM 444 CB LEU A 32 5.373 1.443 -0.021 1.00 0.00 C ATOM 445 CG LEU A 32 6.625 1.989 -0.710 1.00 0.00 C ATOM 446 CD1 LEU A 32 6.307 2.468 -2.127 1.00 0.00 C ATOM 447 CD2 LEU A 32 7.279 3.086 0.132 1.00 0.00 C ATOM 0 H LEU A 32 3.532 -0.010 1.039 1.00 0.00 H new ATOM 0 HA LEU A 32 4.544 0.465 -1.692 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.621 2.232 0.001 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.623 1.213 1.015 1.00 0.00 H new ATOM 0 HG LEU A 32 7.347 1.177 -0.799 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.214 2.851 -2.594 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.921 1.635 -2.714 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.559 3.260 -2.084 1.00 0.00 H new ATOM 0 HD21 LEU A 32 8.167 3.457 -0.380 1.00 0.00 H new ATOM 0 HD22 LEU A 32 6.573 3.905 0.275 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.563 2.679 1.102 1.00 0.00 H new ATOM 459 N VAL A 33 5.925 -1.509 -1.883 1.00 0.00 N ATOM 460 CA VAL A 33 6.794 -2.661 -2.058 1.00 0.00 C ATOM 461 C VAL A 33 8.217 -2.287 -1.639 1.00 0.00 C ATOM 462 O VAL A 33 8.613 -1.127 -1.739 1.00 0.00 O ATOM 463 CB VAL A 33 6.708 -3.167 -3.499 1.00 0.00 C ATOM 464 CG1 VAL A 33 7.712 -4.295 -3.743 1.00 0.00 C ATOM 465 CG2 VAL A 33 5.285 -3.616 -3.838 1.00 0.00 C ATOM 0 H VAL A 33 5.536 -1.133 -2.748 1.00 0.00 H new ATOM 0 HA VAL A 33 6.472 -3.484 -1.420 1.00 0.00 H new ATOM 0 HB VAL A 33 6.965 -2.340 -4.161 1.00 0.00 H new ATOM 0 HG11 VAL A 33 7.631 -4.637 -4.775 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.722 -3.929 -3.561 1.00 0.00 H new ATOM 0 HG13 VAL A 33 7.499 -5.124 -3.068 1.00 0.00 H new ATOM 0 HG21 VAL A 33 5.251 -3.971 -4.868 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.988 -4.422 -3.166 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.601 -2.776 -3.721 1.00 0.00 H new ATOM 475 N ILE A 34 8.947 -3.293 -1.178 1.00 0.00 N ATOM 476 CA ILE A 34 10.318 -3.084 -0.745 1.00 0.00 C ATOM 477 C ILE A 34 11.111 -4.379 -0.936 1.00 0.00 C ATOM 478 O ILE A 34 10.611 -5.336 -1.525 1.00 0.00 O ATOM 479 CB ILE A 34 10.351 -2.550 0.689 1.00 0.00 C ATOM 480 CG1 ILE A 34 9.259 -3.200 1.541 1.00 0.00 C ATOM 481 CG2 ILE A 34 10.258 -1.023 0.706 1.00 0.00 C ATOM 482 CD1 ILE A 34 9.400 -2.798 3.012 1.00 0.00 C ATOM 0 H ILE A 34 8.615 -4.254 -1.095 1.00 0.00 H new ATOM 0 HA ILE A 34 10.799 -2.321 -1.357 1.00 0.00 H new ATOM 0 HB ILE A 34 11.309 -2.820 1.133 1.00 0.00 H new ATOM 0 HG12 ILE A 34 8.278 -2.902 1.171 1.00 0.00 H new ATOM 0 HG13 ILE A 34 9.318 -4.285 1.449 1.00 0.00 H new ATOM 0 HG21 ILE A 34 10.283 -0.668 1.736 1.00 0.00 H new ATOM 0 HG22 ILE A 34 11.099 -0.601 0.156 1.00 0.00 H new ATOM 0 HG23 ILE A 34 9.325 -0.710 0.238 1.00 0.00 H new ATOM 0 HD11 ILE A 34 8.612 -3.273 3.596 1.00 0.00 H new ATOM 0 HD12 ILE A 34 10.372 -3.119 3.385 1.00 0.00 H new ATOM 0 HD13 ILE A 34 9.316 -1.715 3.103 1.00 0.00 H new ATOM 494 N SER A 35 12.335 -4.366 -0.428 1.00 0.00 N ATOM 495 CA SER A 35 13.202 -5.527 -0.536 1.00 0.00 C ATOM 496 C SER A 35 13.724 -5.921 0.847 1.00 0.00 C ATOM 497 O SER A 35 14.249 -5.083 1.578 1.00 0.00 O ATOM 498 CB SER A 35 14.370 -5.256 -1.487 1.00 0.00 C ATOM 499 OG SER A 35 15.285 -6.346 -1.532 1.00 0.00 O ATOM 0 H SER A 35 12.747 -3.570 0.059 1.00 0.00 H new ATOM 0 HA SER A 35 12.619 -6.352 -0.946 1.00 0.00 H new ATOM 0 HB2 SER A 35 13.985 -5.064 -2.489 1.00 0.00 H new ATOM 0 HB3 SER A 35 14.895 -4.355 -1.169 1.00 0.00 H new ATOM 0 HG SER A 35 16.015 -6.135 -2.151 1.00 0.00 H new ATOM 505 N PRO A 36 13.556 -7.230 1.173 1.00 0.00 N ATOM 506 CA PRO A 36 14.004 -7.745 2.456 1.00 0.00 C ATOM 507 C PRO A 36 15.526 -7.898 2.484 1.00 0.00 C ATOM 508 O PRO A 36 16.045 -9.007 2.367 1.00 0.00 O ATOM 509 CB PRO A 36 13.271 -9.067 2.627 1.00 0.00 C ATOM 510 CG PRO A 36 12.802 -9.466 1.238 1.00 0.00 C ATOM 511 CD PRO A 36 12.938 -8.252 0.333 1.00 0.00 C ATOM 0 HA PRO A 36 13.779 -7.070 3.282 1.00 0.00 H new ATOM 0 HB2 PRO A 36 13.929 -9.826 3.050 1.00 0.00 H new ATOM 0 HB3 PRO A 36 12.427 -8.960 3.309 1.00 0.00 H new ATOM 0 HG2 PRO A 36 13.399 -10.295 0.857 1.00 0.00 H new ATOM 0 HG3 PRO A 36 11.767 -9.806 1.268 1.00 0.00 H new ATOM 0 HD2 PRO A 36 13.555 -8.475 -0.538 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.967 -7.925 -0.039 1.00 0.00 H new ATOM 519 N SER A 37 16.199 -6.767 2.640 1.00 0.00 N ATOM 520 CA SER A 37 17.652 -6.761 2.684 1.00 0.00 C ATOM 521 C SER A 37 18.130 -6.617 4.131 1.00 0.00 C ATOM 522 O SER A 37 18.933 -7.419 4.605 1.00 0.00 O ATOM 523 CB SER A 37 18.225 -5.634 1.822 1.00 0.00 C ATOM 524 OG SER A 37 18.354 -6.022 0.456 1.00 0.00 O ATOM 0 H SER A 37 15.765 -5.849 2.737 1.00 0.00 H new ATOM 0 HA SER A 37 18.010 -7.708 2.281 1.00 0.00 H new ATOM 0 HB2 SER A 37 17.578 -4.759 1.891 1.00 0.00 H new ATOM 0 HB3 SER A 37 19.201 -5.341 2.210 1.00 0.00 H new ATOM 0 HG SER A 37 18.721 -5.276 -0.063 1.00 0.00 H new ATOM 530 N CYS A 38 17.616 -5.590 4.791 1.00 0.00 N ATOM 531 CA CYS A 38 17.980 -5.331 6.174 1.00 0.00 C ATOM 532 C CYS A 38 17.567 -6.541 7.014 1.00 0.00 C ATOM 533 O CYS A 38 18.405 -7.171 7.657 1.00 0.00 O ATOM 534 CB CYS A 38 17.352 -4.036 6.691 1.00 0.00 C ATOM 535 SG CYS A 38 18.604 -3.049 7.591 1.00 0.00 S ATOM 0 H CYS A 38 16.950 -4.927 4.394 1.00 0.00 H new ATOM 0 HA CYS A 38 19.058 -5.189 6.249 1.00 0.00 H new ATOM 0 HB2 CYS A 38 16.952 -3.458 5.858 1.00 0.00 H new ATOM 0 HB3 CYS A 38 16.515 -4.266 7.351 1.00 0.00 H new ATOM 0 HG CYS A 38 18.061 -1.950 8.024 1.00 0.00 H new ATOM 541 N ASN A 39 16.274 -6.829 6.983 1.00 0.00 N ATOM 542 CA ASN A 39 15.739 -7.951 7.734 1.00 0.00 C ATOM 543 C ASN A 39 16.263 -9.257 7.133 1.00 0.00 C ATOM 544 O ASN A 39 16.324 -9.403 5.914 1.00 0.00 O ATOM 545 CB ASN A 39 14.211 -7.980 7.668 1.00 0.00 C ATOM 546 CG ASN A 39 13.603 -6.886 8.548 1.00 0.00 C ATOM 547 OD1 ASN A 39 13.540 -6.994 9.762 1.00 0.00 O ATOM 548 ND2 ASN A 39 13.159 -5.831 7.871 1.00 0.00 N ATOM 0 H ASN A 39 15.581 -6.304 6.449 1.00 0.00 H new ATOM 0 HA ASN A 39 16.053 -7.842 8.772 1.00 0.00 H new ATOM 0 HB2 ASN A 39 13.885 -7.845 6.637 1.00 0.00 H new ATOM 0 HB3 ASN A 39 13.848 -8.956 7.992 1.00 0.00 H new ATOM 0 HD21 ASN A 39 12.735 -5.048 8.368 1.00 0.00 H new ATOM 0 HD22 ASN A 39 13.243 -5.805 6.855 1.00 0.00 H new ATOM 555 N ASP A 40 16.627 -10.174 8.018 1.00 0.00 N ATOM 556 CA ASP A 40 17.144 -11.462 7.590 1.00 0.00 C ATOM 557 C ASP A 40 16.111 -12.549 7.896 1.00 0.00 C ATOM 558 O ASP A 40 15.618 -13.216 6.988 1.00 0.00 O ATOM 559 CB ASP A 40 18.434 -11.814 8.334 1.00 0.00 C ATOM 560 CG ASP A 40 19.446 -12.627 7.526 1.00 0.00 C ATOM 561 OD1 ASP A 40 19.290 -12.656 6.286 1.00 0.00 O ATOM 562 OD2 ASP A 40 20.354 -13.201 8.166 1.00 0.00 O ATOM 0 H ASP A 40 16.574 -10.050 9.029 1.00 0.00 H new ATOM 0 HA ASP A 40 17.349 -11.404 6.521 1.00 0.00 H new ATOM 0 HB2 ASP A 40 18.911 -10.890 8.660 1.00 0.00 H new ATOM 0 HB3 ASP A 40 18.176 -12.374 9.233 1.00 0.00 H new ATOM 567 N ASP A 41 15.813 -12.693 9.179 1.00 0.00 N ATOM 568 CA ASP A 41 14.848 -13.687 9.617 1.00 0.00 C ATOM 569 C ASP A 41 13.620 -13.633 8.707 1.00 0.00 C ATOM 570 O ASP A 41 13.109 -14.671 8.286 1.00 0.00 O ATOM 571 CB ASP A 41 14.386 -13.412 11.050 1.00 0.00 C ATOM 572 CG ASP A 41 15.139 -14.189 12.132 1.00 0.00 C ATOM 573 OD1 ASP A 41 15.723 -15.236 11.776 1.00 0.00 O ATOM 574 OD2 ASP A 41 15.115 -13.718 13.289 1.00 0.00 O ATOM 0 H ASP A 41 16.223 -12.137 9.930 1.00 0.00 H new ATOM 0 HA ASP A 41 15.327 -14.665 9.574 1.00 0.00 H new ATOM 0 HB2 ASP A 41 14.490 -12.346 11.251 1.00 0.00 H new ATOM 0 HB3 ASP A 41 13.325 -13.649 11.126 1.00 0.00 H new ATOM 579 N ILE A 42 13.182 -12.415 8.427 1.00 0.00 N ATOM 580 CA ILE A 42 12.023 -12.213 7.575 1.00 0.00 C ATOM 581 C ILE A 42 12.172 -13.063 6.310 1.00 0.00 C ATOM 582 O ILE A 42 12.801 -12.638 5.343 1.00 0.00 O ATOM 583 CB ILE A 42 11.817 -10.723 7.292 1.00 0.00 C ATOM 584 CG1 ILE A 42 11.603 -9.944 8.592 1.00 0.00 C ATOM 585 CG2 ILE A 42 10.675 -10.505 6.299 1.00 0.00 C ATOM 586 CD1 ILE A 42 10.342 -10.421 9.315 1.00 0.00 C ATOM 0 H ILE A 42 13.609 -11.557 8.775 1.00 0.00 H new ATOM 0 HA ILE A 42 11.117 -12.546 8.081 1.00 0.00 H new ATOM 0 HB ILE A 42 12.724 -10.335 6.828 1.00 0.00 H new ATOM 0 HG12 ILE A 42 12.469 -10.069 9.242 1.00 0.00 H new ATOM 0 HG13 ILE A 42 11.520 -8.879 8.373 1.00 0.00 H new ATOM 0 HG21 ILE A 42 10.551 -9.438 6.116 1.00 0.00 H new ATOM 0 HG22 ILE A 42 10.907 -11.009 5.361 1.00 0.00 H new ATOM 0 HG23 ILE A 42 9.752 -10.913 6.711 1.00 0.00 H new ATOM 0 HD11 ILE A 42 10.213 -9.852 10.235 1.00 0.00 H new ATOM 0 HD12 ILE A 42 9.475 -10.272 8.671 1.00 0.00 H new ATOM 0 HD13 ILE A 42 10.438 -11.480 9.554 1.00 0.00 H new ATOM 598 N THR A 43 11.581 -14.248 6.360 1.00 0.00 N ATOM 599 CA THR A 43 11.640 -15.161 5.231 1.00 0.00 C ATOM 600 C THR A 43 10.456 -14.924 4.292 1.00 0.00 C ATOM 601 O THR A 43 9.304 -15.103 4.683 1.00 0.00 O ATOM 602 CB THR A 43 11.704 -16.587 5.780 1.00 0.00 C ATOM 603 OG1 THR A 43 13.071 -16.758 6.145 1.00 0.00 O ATOM 604 CG2 THR A 43 11.473 -17.642 4.696 1.00 0.00 C ATOM 0 H THR A 43 11.059 -14.597 7.164 1.00 0.00 H new ATOM 0 HA THR A 43 12.532 -14.989 4.629 1.00 0.00 H new ATOM 0 HB THR A 43 10.960 -16.706 6.568 1.00 0.00 H new ATOM 0 HG1 THR A 43 13.302 -16.124 6.856 1.00 0.00 H new ATOM 0 HG21 THR A 43 11.529 -18.637 5.138 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.488 -17.497 4.251 1.00 0.00 H new ATOM 0 HG23 THR A 43 12.237 -17.545 3.925 1.00 0.00 H new ATOM 612 N VAL A 44 10.781 -14.525 3.071 1.00 0.00 N ATOM 613 CA VAL A 44 9.759 -14.262 2.073 1.00 0.00 C ATOM 614 C VAL A 44 9.820 -15.342 0.990 1.00 0.00 C ATOM 615 O VAL A 44 10.883 -15.609 0.433 1.00 0.00 O ATOM 616 CB VAL A 44 9.923 -12.847 1.515 1.00 0.00 C ATOM 617 CG1 VAL A 44 8.967 -12.603 0.346 1.00 0.00 C ATOM 618 CG2 VAL A 44 9.728 -11.799 2.612 1.00 0.00 C ATOM 0 H VAL A 44 11.738 -14.378 2.750 1.00 0.00 H new ATOM 0 HA VAL A 44 8.767 -14.307 2.522 1.00 0.00 H new ATOM 0 HB VAL A 44 10.942 -12.752 1.139 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.105 -11.590 -0.031 1.00 0.00 H new ATOM 0 HG12 VAL A 44 9.175 -13.318 -0.450 1.00 0.00 H new ATOM 0 HG13 VAL A 44 7.939 -12.727 0.685 1.00 0.00 H new ATOM 0 HG21 VAL A 44 9.850 -10.802 2.189 1.00 0.00 H new ATOM 0 HG22 VAL A 44 8.727 -11.895 3.033 1.00 0.00 H new ATOM 0 HG23 VAL A 44 10.468 -11.953 3.398 1.00 0.00 H new ATOM 628 N LYS A 45 8.664 -15.933 0.723 1.00 0.00 N ATOM 629 CA LYS A 45 8.572 -16.977 -0.282 1.00 0.00 C ATOM 630 C LYS A 45 9.174 -16.470 -1.595 1.00 0.00 C ATOM 631 O LYS A 45 9.617 -15.325 -1.677 1.00 0.00 O ATOM 632 CB LYS A 45 7.129 -17.467 -0.415 1.00 0.00 C ATOM 633 CG LYS A 45 6.920 -18.774 0.351 1.00 0.00 C ATOM 634 CD LYS A 45 7.137 -18.570 1.852 1.00 0.00 C ATOM 635 CE LYS A 45 7.729 -19.824 2.497 1.00 0.00 C ATOM 636 NZ LYS A 45 9.203 -19.830 2.362 1.00 0.00 N ATOM 0 H LYS A 45 7.783 -15.708 1.186 1.00 0.00 H new ATOM 0 HA LYS A 45 9.153 -17.848 0.020 1.00 0.00 H new ATOM 0 HB2 LYS A 45 6.447 -16.706 -0.036 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.887 -17.616 -1.467 1.00 0.00 H new ATOM 0 HG2 LYS A 45 5.911 -19.147 0.173 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.610 -19.532 -0.020 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.804 -17.724 2.015 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.189 -18.324 2.330 1.00 0.00 H new ATOM 0 HE2 LYS A 45 7.454 -19.862 3.551 1.00 0.00 H new ATOM 0 HE3 LYS A 45 7.311 -20.714 2.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.589 -20.688 2.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.459 -19.816 1.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 9.598 -18.990 2.832 1.00 0.00 H new ATOM 650 N LYS A 46 9.170 -17.347 -2.588 1.00 0.00 N ATOM 651 CA LYS A 46 9.709 -17.002 -3.893 1.00 0.00 C ATOM 652 C LYS A 46 8.608 -16.368 -4.744 1.00 0.00 C ATOM 653 O LYS A 46 8.856 -15.948 -5.873 1.00 0.00 O ATOM 654 CB LYS A 46 10.363 -18.224 -4.542 1.00 0.00 C ATOM 655 CG LYS A 46 11.131 -17.828 -5.805 1.00 0.00 C ATOM 656 CD LYS A 46 10.534 -18.502 -7.042 1.00 0.00 C ATOM 657 CE LYS A 46 11.621 -18.819 -8.072 1.00 0.00 C ATOM 658 NZ LYS A 46 11.369 -20.133 -8.704 1.00 0.00 N ATOM 0 H LYS A 46 8.802 -18.296 -2.515 1.00 0.00 H new ATOM 0 HA LYS A 46 10.501 -16.260 -3.794 1.00 0.00 H new ATOM 0 HB2 LYS A 46 11.042 -18.698 -3.833 1.00 0.00 H new ATOM 0 HB3 LYS A 46 9.599 -18.960 -4.792 1.00 0.00 H new ATOM 0 HG2 LYS A 46 11.104 -16.745 -5.927 1.00 0.00 H new ATOM 0 HG3 LYS A 46 12.179 -18.111 -5.702 1.00 0.00 H new ATOM 0 HD2 LYS A 46 10.025 -19.421 -6.750 1.00 0.00 H new ATOM 0 HD3 LYS A 46 9.783 -17.850 -7.489 1.00 0.00 H new ATOM 0 HE2 LYS A 46 11.645 -18.041 -8.835 1.00 0.00 H new ATOM 0 HE3 LYS A 46 12.598 -18.823 -7.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 12.116 -20.332 -9.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 11.368 -20.875 -7.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 10.446 -20.117 -9.182 1.00 0.00 H new ATOM 672 N ASP A 47 7.415 -16.318 -4.170 1.00 0.00 N ATOM 673 CA ASP A 47 6.275 -15.742 -4.862 1.00 0.00 C ATOM 674 C ASP A 47 5.653 -14.650 -3.990 1.00 0.00 C ATOM 675 O ASP A 47 4.469 -14.342 -4.124 1.00 0.00 O ATOM 676 CB ASP A 47 5.202 -16.800 -5.130 1.00 0.00 C ATOM 677 CG ASP A 47 4.998 -17.154 -6.605 1.00 0.00 C ATOM 678 OD1 ASP A 47 4.471 -16.282 -7.330 1.00 0.00 O ATOM 679 OD2 ASP A 47 5.373 -18.288 -6.975 1.00 0.00 O ATOM 0 H ASP A 47 7.213 -16.667 -3.233 1.00 0.00 H new ATOM 0 HA ASP A 47 6.626 -15.335 -5.810 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.464 -17.708 -4.587 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.255 -16.447 -4.722 1.00 0.00 H new ATOM 684 N GLN A 48 6.478 -14.093 -3.116 1.00 0.00 N ATOM 685 CA GLN A 48 6.024 -13.041 -2.223 1.00 0.00 C ATOM 686 C GLN A 48 7.046 -11.903 -2.181 1.00 0.00 C ATOM 687 O GLN A 48 8.196 -12.082 -2.574 1.00 0.00 O ATOM 688 CB GLN A 48 5.758 -13.590 -0.819 1.00 0.00 C ATOM 689 CG GLN A 48 4.383 -14.255 -0.742 1.00 0.00 C ATOM 690 CD GLN A 48 4.261 -15.120 0.513 1.00 0.00 C ATOM 691 OE1 GLN A 48 4.903 -14.887 1.524 1.00 0.00 O ATOM 692 NE2 GLN A 48 3.403 -16.130 0.394 1.00 0.00 N ATOM 0 H GLN A 48 7.459 -14.351 -3.007 1.00 0.00 H new ATOM 0 HA GLN A 48 5.084 -12.646 -2.608 1.00 0.00 H new ATOM 0 HB2 GLN A 48 6.530 -14.312 -0.555 1.00 0.00 H new ATOM 0 HB3 GLN A 48 5.816 -12.781 -0.091 1.00 0.00 H new ATOM 0 HG2 GLN A 48 3.606 -13.491 -0.738 1.00 0.00 H new ATOM 0 HG3 GLN A 48 4.222 -14.869 -1.628 1.00 0.00 H new ATOM 0 HE21 GLN A 48 2.897 -16.269 -0.481 1.00 0.00 H new ATOM 0 HE22 GLN A 48 3.251 -16.765 1.178 1.00 0.00 H new ATOM 701 N CYS A 49 6.586 -10.756 -1.701 1.00 0.00 N ATOM 702 CA CYS A 49 7.446 -9.589 -1.603 1.00 0.00 C ATOM 703 C CYS A 49 7.044 -8.800 -0.355 1.00 0.00 C ATOM 704 O CYS A 49 5.907 -8.896 0.105 1.00 0.00 O ATOM 705 CB CYS A 49 7.378 -8.729 -2.868 1.00 0.00 C ATOM 706 SG CYS A 49 8.734 -9.187 -4.009 1.00 0.00 S ATOM 0 H CYS A 49 5.630 -10.611 -1.376 1.00 0.00 H new ATOM 0 HA CYS A 49 8.485 -9.906 -1.513 1.00 0.00 H new ATOM 0 HB2 CYS A 49 6.415 -8.867 -3.360 1.00 0.00 H new ATOM 0 HB3 CYS A 49 7.453 -7.674 -2.605 1.00 0.00 H new ATOM 0 HG CYS A 49 9.027 -10.444 -3.852 1.00 0.00 H new ATOM 712 N LEU A 50 7.999 -8.038 0.157 1.00 0.00 N ATOM 713 CA LEU A 50 7.759 -7.233 1.343 1.00 0.00 C ATOM 714 C LEU A 50 7.192 -5.875 0.926 1.00 0.00 C ATOM 715 O LEU A 50 7.761 -5.195 0.073 1.00 0.00 O ATOM 716 CB LEU A 50 9.030 -7.135 2.190 1.00 0.00 C ATOM 717 CG LEU A 50 8.858 -6.541 3.589 1.00 0.00 C ATOM 718 CD1 LEU A 50 7.940 -7.415 4.447 1.00 0.00 C ATOM 719 CD2 LEU A 50 10.216 -6.309 4.257 1.00 0.00 C ATOM 0 H LEU A 50 8.941 -7.961 -0.228 1.00 0.00 H new ATOM 0 HA LEU A 50 7.014 -7.708 1.981 1.00 0.00 H new ATOM 0 HB2 LEU A 50 9.454 -8.134 2.290 1.00 0.00 H new ATOM 0 HB3 LEU A 50 9.759 -6.532 1.648 1.00 0.00 H new ATOM 0 HG LEU A 50 8.377 -5.568 3.490 1.00 0.00 H new ATOM 0 HD11 LEU A 50 7.835 -6.970 5.436 1.00 0.00 H new ATOM 0 HD12 LEU A 50 6.960 -7.486 3.975 1.00 0.00 H new ATOM 0 HD13 LEU A 50 8.371 -8.412 4.541 1.00 0.00 H new ATOM 0 HD21 LEU A 50 10.065 -5.886 5.250 1.00 0.00 H new ATOM 0 HD22 LEU A 50 10.746 -7.258 4.343 1.00 0.00 H new ATOM 0 HD23 LEU A 50 10.805 -5.618 3.654 1.00 0.00 H new ATOM 731 N VAL A 51 6.078 -5.518 1.547 1.00 0.00 N ATOM 732 CA VAL A 51 5.427 -4.253 1.251 1.00 0.00 C ATOM 733 C VAL A 51 5.153 -3.508 2.558 1.00 0.00 C ATOM 734 O VAL A 51 5.114 -4.115 3.627 1.00 0.00 O ATOM 735 CB VAL A 51 4.162 -4.495 0.425 1.00 0.00 C ATOM 736 CG1 VAL A 51 4.448 -5.429 -0.754 1.00 0.00 C ATOM 737 CG2 VAL A 51 3.034 -5.046 1.299 1.00 0.00 C ATOM 0 H VAL A 51 5.609 -6.083 2.255 1.00 0.00 H new ATOM 0 HA VAL A 51 6.078 -3.621 0.646 1.00 0.00 H new ATOM 0 HB VAL A 51 3.836 -3.536 0.022 1.00 0.00 H new ATOM 0 HG11 VAL A 51 3.533 -5.585 -1.325 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.205 -4.981 -1.397 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.810 -6.387 -0.380 1.00 0.00 H new ATOM 0 HG21 VAL A 51 2.147 -5.209 0.688 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.347 -5.991 1.744 1.00 0.00 H new ATOM 0 HG23 VAL A 51 2.804 -4.331 2.089 1.00 0.00 H new ATOM 747 N ARG A 52 4.970 -2.202 2.431 1.00 0.00 N ATOM 748 CA ARG A 52 4.701 -1.367 3.590 1.00 0.00 C ATOM 749 C ARG A 52 3.300 -0.758 3.491 1.00 0.00 C ATOM 750 O ARG A 52 3.046 0.086 2.633 1.00 0.00 O ATOM 751 CB ARG A 52 5.731 -0.242 3.709 1.00 0.00 C ATOM 752 CG ARG A 52 6.697 -0.505 4.866 1.00 0.00 C ATOM 753 CD ARG A 52 7.631 0.687 5.081 1.00 0.00 C ATOM 754 NE ARG A 52 8.985 0.369 4.576 1.00 0.00 N ATOM 755 CZ ARG A 52 10.101 0.999 4.967 1.00 0.00 C ATOM 756 NH1 ARG A 52 10.031 1.986 5.870 1.00 0.00 N ATOM 757 NH2 ARG A 52 11.287 0.643 4.454 1.00 0.00 N ATOM 0 H ARG A 52 5.003 -1.701 1.543 1.00 0.00 H new ATOM 0 HA ARG A 52 4.765 -1.998 4.476 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.289 -0.155 2.777 1.00 0.00 H new ATOM 0 HB3 ARG A 52 5.221 0.708 3.865 1.00 0.00 H new ATOM 0 HG2 ARG A 52 6.133 -0.699 5.778 1.00 0.00 H new ATOM 0 HG3 ARG A 52 7.285 -1.399 4.658 1.00 0.00 H new ATOM 0 HD2 ARG A 52 7.239 1.564 4.566 1.00 0.00 H new ATOM 0 HD3 ARG A 52 7.679 0.935 6.141 1.00 0.00 H new ATOM 0 HE ARG A 52 9.074 -0.377 3.886 1.00 0.00 H new ATOM 0 HH11 ARG A 52 9.128 2.258 6.260 1.00 0.00 H new ATOM 0 HH12 ARG A 52 10.880 2.466 6.168 1.00 0.00 H new ATOM 0 HH21 ARG A 52 11.340 -0.108 3.766 1.00 0.00 H new ATOM 0 HH22 ARG A 52 12.136 1.123 4.752 1.00 0.00 H new ATOM 771 N SER A 53 2.430 -1.210 4.381 1.00 0.00 N ATOM 772 CA SER A 53 1.062 -0.720 4.404 1.00 0.00 C ATOM 773 C SER A 53 1.041 0.757 4.807 1.00 0.00 C ATOM 774 O SER A 53 1.931 1.222 5.517 1.00 0.00 O ATOM 775 CB SER A 53 0.198 -1.542 5.363 1.00 0.00 C ATOM 776 OG SER A 53 -1.181 -1.194 5.274 1.00 0.00 O ATOM 0 H SER A 53 2.645 -1.910 5.091 1.00 0.00 H new ATOM 0 HA SER A 53 0.646 -0.824 3.402 1.00 0.00 H new ATOM 0 HB2 SER A 53 0.319 -2.602 5.141 1.00 0.00 H new ATOM 0 HB3 SER A 53 0.545 -1.389 6.385 1.00 0.00 H new ATOM 0 HG SER A 53 -1.577 -1.626 4.489 1.00 0.00 H new ATOM 782 N PHE A 54 0.016 1.451 4.336 1.00 0.00 N ATOM 783 CA PHE A 54 -0.132 2.865 4.639 1.00 0.00 C ATOM 784 C PHE A 54 -1.318 3.104 5.574 1.00 0.00 C ATOM 785 O PHE A 54 -1.744 4.243 5.765 1.00 0.00 O ATOM 786 CB PHE A 54 -0.391 3.581 3.312 1.00 0.00 C ATOM 787 CG PHE A 54 0.867 3.813 2.473 1.00 0.00 C ATOM 788 CD1 PHE A 54 1.766 4.763 2.845 1.00 0.00 C ATOM 789 CD2 PHE A 54 1.087 3.069 1.357 1.00 0.00 C ATOM 790 CE1 PHE A 54 2.935 4.979 2.068 1.00 0.00 C ATOM 791 CE2 PHE A 54 2.256 3.284 0.578 1.00 0.00 C ATOM 792 CZ PHE A 54 3.155 4.234 0.950 1.00 0.00 C ATOM 0 H PHE A 54 -0.720 1.061 3.747 1.00 0.00 H new ATOM 0 HA PHE A 54 0.766 3.236 5.133 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -1.102 2.996 2.728 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -0.862 4.543 3.516 1.00 0.00 H new ATOM 0 HD1 PHE A 54 1.591 5.354 3.732 1.00 0.00 H new ATOM 0 HD2 PHE A 54 0.373 2.314 1.062 1.00 0.00 H new ATOM 0 HE1 PHE A 54 3.649 5.734 2.364 1.00 0.00 H new ATOM 0 HE2 PHE A 54 2.430 2.693 -0.309 1.00 0.00 H new ATOM 0 HZ PHE A 54 4.044 4.398 0.358 1.00 0.00 H new ATOM 802 N ILE A 55 -1.820 2.013 6.133 1.00 0.00 N ATOM 803 CA ILE A 55 -2.949 2.090 7.044 1.00 0.00 C ATOM 804 C ILE A 55 -2.447 1.961 8.484 1.00 0.00 C ATOM 805 O ILE A 55 -2.567 2.897 9.273 1.00 0.00 O ATOM 806 CB ILE A 55 -4.012 1.055 6.669 1.00 0.00 C ATOM 807 CG1 ILE A 55 -4.571 1.326 5.271 1.00 0.00 C ATOM 808 CG2 ILE A 55 -5.116 0.996 7.726 1.00 0.00 C ATOM 809 CD1 ILE A 55 -5.591 0.258 4.872 1.00 0.00 C ATOM 0 H ILE A 55 -1.465 1.070 5.972 1.00 0.00 H new ATOM 0 HA ILE A 55 -3.439 3.060 6.962 1.00 0.00 H new ATOM 0 HB ILE A 55 -3.539 0.073 6.642 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -5.041 2.309 5.248 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -3.756 1.345 4.547 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -5.859 0.253 7.435 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -4.684 0.721 8.688 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -5.593 1.973 7.809 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -5.973 0.474 3.874 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -5.112 -0.721 4.873 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -6.416 0.259 5.584 1.00 0.00 H new ATOM 821 N ASP A 56 -1.896 0.794 8.782 1.00 0.00 N ATOM 822 CA ASP A 56 -1.375 0.531 10.113 1.00 0.00 C ATOM 823 C ASP A 56 0.142 0.727 10.111 1.00 0.00 C ATOM 824 O ASP A 56 0.773 0.726 11.166 1.00 0.00 O ATOM 825 CB ASP A 56 -1.666 -0.908 10.544 1.00 0.00 C ATOM 826 CG ASP A 56 -1.170 -1.277 11.943 1.00 0.00 C ATOM 827 OD1 ASP A 56 -0.760 -0.343 12.665 1.00 0.00 O ATOM 828 OD2 ASP A 56 -1.211 -2.486 12.260 1.00 0.00 O ATOM 0 H ASP A 56 -1.799 0.020 8.125 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.858 1.220 10.806 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -2.743 -1.073 10.501 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -1.210 -1.586 9.823 1.00 0.00 H new ATOM 833 N SER A 57 0.684 0.890 8.912 1.00 0.00 N ATOM 834 CA SER A 57 2.115 1.086 8.758 1.00 0.00 C ATOM 835 C SER A 57 2.867 -0.164 9.219 1.00 0.00 C ATOM 836 O SER A 57 3.869 -0.065 9.925 1.00 0.00 O ATOM 837 CB SER A 57 2.591 2.311 9.543 1.00 0.00 C ATOM 838 OG SER A 57 2.776 2.019 10.925 1.00 0.00 O ATOM 0 H SER A 57 0.157 0.890 8.039 1.00 0.00 H new ATOM 0 HA SER A 57 2.325 1.260 7.703 1.00 0.00 H new ATOM 0 HB2 SER A 57 3.529 2.671 9.120 1.00 0.00 H new ATOM 0 HB3 SER A 57 1.863 3.115 9.436 1.00 0.00 H new ATOM 0 HG SER A 57 2.055 1.431 11.234 1.00 0.00 H new ATOM 844 N LYS A 58 2.354 -1.312 8.799 1.00 0.00 N ATOM 845 CA LYS A 58 2.966 -2.581 9.160 1.00 0.00 C ATOM 846 C LYS A 58 3.564 -3.227 7.910 1.00 0.00 C ATOM 847 O LYS A 58 3.248 -2.830 6.789 1.00 0.00 O ATOM 848 CB LYS A 58 1.959 -3.471 9.892 1.00 0.00 C ATOM 849 CG LYS A 58 1.852 -3.081 11.367 1.00 0.00 C ATOM 850 CD LYS A 58 2.074 -4.294 12.273 1.00 0.00 C ATOM 851 CE LYS A 58 2.519 -3.860 13.671 1.00 0.00 C ATOM 852 NZ LYS A 58 2.097 -4.855 14.681 1.00 0.00 N ATOM 0 H LYS A 58 1.523 -1.390 8.213 1.00 0.00 H new ATOM 0 HA LYS A 58 3.786 -2.424 9.861 1.00 0.00 H new ATOM 0 HB2 LYS A 58 0.981 -3.386 9.418 1.00 0.00 H new ATOM 0 HB3 LYS A 58 2.263 -4.514 9.809 1.00 0.00 H new ATOM 0 HG2 LYS A 58 2.588 -2.311 11.597 1.00 0.00 H new ATOM 0 HG3 LYS A 58 0.870 -2.651 11.563 1.00 0.00 H new ATOM 0 HD2 LYS A 58 1.153 -4.873 12.344 1.00 0.00 H new ATOM 0 HD3 LYS A 58 2.828 -4.947 11.834 1.00 0.00 H new ATOM 0 HE2 LYS A 58 3.603 -3.746 13.695 1.00 0.00 H new ATOM 0 HE3 LYS A 58 2.091 -2.887 13.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 2.407 -4.545 15.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 1.061 -4.944 14.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 2.526 -5.776 14.461 1.00 0.00 H new ATOM 866 N PHE A 59 4.417 -4.213 8.143 1.00 0.00 N ATOM 867 CA PHE A 59 5.063 -4.919 7.049 1.00 0.00 C ATOM 868 C PHE A 59 4.335 -6.228 6.735 1.00 0.00 C ATOM 869 O PHE A 59 4.245 -7.112 7.585 1.00 0.00 O ATOM 870 CB PHE A 59 6.489 -5.239 7.503 1.00 0.00 C ATOM 871 CG PHE A 59 7.434 -4.037 7.481 1.00 0.00 C ATOM 872 CD1 PHE A 59 8.145 -3.752 6.357 1.00 0.00 C ATOM 873 CD2 PHE A 59 7.562 -3.251 8.584 1.00 0.00 C ATOM 874 CE1 PHE A 59 9.022 -2.635 6.336 1.00 0.00 C ATOM 875 CE2 PHE A 59 8.440 -2.135 8.562 1.00 0.00 C ATOM 876 CZ PHE A 59 9.152 -1.851 7.440 1.00 0.00 C ATOM 0 H PHE A 59 4.676 -4.540 9.074 1.00 0.00 H new ATOM 0 HA PHE A 59 5.051 -4.303 6.150 1.00 0.00 H new ATOM 0 HB2 PHE A 59 6.455 -5.643 8.515 1.00 0.00 H new ATOM 0 HB3 PHE A 59 6.897 -6.020 6.862 1.00 0.00 H new ATOM 0 HD1 PHE A 59 8.043 -4.375 5.481 1.00 0.00 H new ATOM 0 HD2 PHE A 59 6.996 -3.476 9.476 1.00 0.00 H new ATOM 0 HE1 PHE A 59 9.586 -2.408 5.443 1.00 0.00 H new ATOM 0 HE2 PHE A 59 8.542 -1.511 9.438 1.00 0.00 H new ATOM 0 HZ PHE A 59 9.821 -1.003 7.425 1.00 0.00 H new ATOM 886 N TYR A 60 3.832 -6.308 5.512 1.00 0.00 N ATOM 887 CA TYR A 60 3.115 -7.494 5.075 1.00 0.00 C ATOM 888 C TYR A 60 3.801 -8.137 3.868 1.00 0.00 C ATOM 889 O TYR A 60 4.469 -7.454 3.093 1.00 0.00 O ATOM 890 CB TYR A 60 1.723 -7.015 4.659 1.00 0.00 C ATOM 891 CG TYR A 60 0.866 -6.509 5.822 1.00 0.00 C ATOM 892 CD1 TYR A 60 0.085 -7.392 6.539 1.00 0.00 C ATOM 893 CD2 TYR A 60 0.873 -5.169 6.152 1.00 0.00 C ATOM 894 CE1 TYR A 60 -0.721 -6.917 7.632 1.00 0.00 C ATOM 895 CE2 TYR A 60 0.067 -4.693 7.246 1.00 0.00 C ATOM 896 CZ TYR A 60 -0.691 -5.591 7.932 1.00 0.00 C ATOM 897 OH TYR A 60 -1.453 -5.140 8.966 1.00 0.00 O ATOM 0 H TYR A 60 3.907 -5.571 4.810 1.00 0.00 H new ATOM 0 HA TYR A 60 3.082 -8.237 5.872 1.00 0.00 H new ATOM 0 HB2 TYR A 60 1.829 -6.216 3.925 1.00 0.00 H new ATOM 0 HB3 TYR A 60 1.200 -7.834 4.165 1.00 0.00 H new ATOM 0 HD1 TYR A 60 0.079 -8.440 6.280 1.00 0.00 H new ATOM 0 HD2 TYR A 60 1.483 -4.477 5.590 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -1.336 -7.598 8.201 1.00 0.00 H new ATOM 0 HE2 TYR A 60 0.064 -3.647 7.516 1.00 0.00 H new ATOM 0 HH TYR A 60 -1.330 -4.173 9.065 1.00 0.00 H new ATOM 907 N SER A 61 3.612 -9.442 3.747 1.00 0.00 N ATOM 908 CA SER A 61 4.205 -10.185 2.647 1.00 0.00 C ATOM 909 C SER A 61 3.106 -10.783 1.767 1.00 0.00 C ATOM 910 O SER A 61 2.447 -11.746 2.158 1.00 0.00 O ATOM 911 CB SER A 61 5.131 -11.288 3.163 1.00 0.00 C ATOM 912 OG SER A 61 6.011 -11.765 2.149 1.00 0.00 O ATOM 0 H SER A 61 3.057 -10.005 4.392 1.00 0.00 H new ATOM 0 HA SER A 61 4.803 -9.495 2.052 1.00 0.00 H new ATOM 0 HB2 SER A 61 5.716 -10.908 4.001 1.00 0.00 H new ATOM 0 HB3 SER A 61 4.532 -12.116 3.542 1.00 0.00 H new ATOM 0 HG SER A 61 6.586 -12.467 2.519 1.00 0.00 H new ATOM 918 N ILE A 62 2.941 -10.188 0.595 1.00 0.00 N ATOM 919 CA ILE A 62 1.933 -10.650 -0.345 1.00 0.00 C ATOM 920 C ILE A 62 2.620 -11.177 -1.606 1.00 0.00 C ATOM 921 O ILE A 62 3.845 -11.140 -1.711 1.00 0.00 O ATOM 922 CB ILE A 62 0.910 -9.546 -0.618 1.00 0.00 C ATOM 923 CG1 ILE A 62 1.216 -8.296 0.211 1.00 0.00 C ATOM 924 CG2 ILE A 62 -0.516 -10.051 -0.386 1.00 0.00 C ATOM 925 CD1 ILE A 62 1.086 -8.585 1.708 1.00 0.00 C ATOM 0 H ILE A 62 3.489 -9.389 0.274 1.00 0.00 H new ATOM 0 HA ILE A 62 1.368 -11.479 0.080 1.00 0.00 H new ATOM 0 HB ILE A 62 0.986 -9.263 -1.668 1.00 0.00 H new ATOM 0 HG12 ILE A 62 2.225 -7.947 -0.009 1.00 0.00 H new ATOM 0 HG13 ILE A 62 0.533 -7.494 -0.069 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -1.224 -9.247 -0.587 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.719 -10.888 -1.054 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.622 -10.378 0.648 1.00 0.00 H new ATOM 0 HD11 ILE A 62 1.309 -7.680 2.274 1.00 0.00 H new ATOM 0 HD12 ILE A 62 0.069 -8.910 1.929 1.00 0.00 H new ATOM 0 HD13 ILE A 62 1.787 -9.371 1.989 1.00 0.00 H new ATOM 937 N ALA A 63 1.802 -11.655 -2.531 1.00 0.00 N ATOM 938 CA ALA A 63 2.315 -12.189 -3.781 1.00 0.00 C ATOM 939 C ALA A 63 2.214 -11.117 -4.868 1.00 0.00 C ATOM 940 O ALA A 63 1.197 -10.433 -4.978 1.00 0.00 O ATOM 941 CB ALA A 63 1.549 -13.462 -4.145 1.00 0.00 C ATOM 0 H ALA A 63 0.786 -11.684 -2.440 1.00 0.00 H new ATOM 0 HA ALA A 63 3.366 -12.459 -3.680 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.934 -13.863 -5.083 1.00 0.00 H new ATOM 0 HB2 ALA A 63 1.677 -14.202 -3.355 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.490 -13.230 -4.257 1.00 0.00 H new ATOM 947 N ARG A 64 3.282 -11.004 -5.645 1.00 0.00 N ATOM 948 CA ARG A 64 3.326 -10.027 -6.719 1.00 0.00 C ATOM 949 C ARG A 64 2.091 -10.164 -7.612 1.00 0.00 C ATOM 950 O ARG A 64 1.708 -9.217 -8.297 1.00 0.00 O ATOM 951 CB ARG A 64 4.584 -10.202 -7.572 1.00 0.00 C ATOM 952 CG ARG A 64 5.847 -10.070 -6.718 1.00 0.00 C ATOM 953 CD ARG A 64 6.543 -8.731 -6.972 1.00 0.00 C ATOM 954 NE ARG A 64 8.003 -8.934 -7.097 1.00 0.00 N ATOM 955 CZ ARG A 64 8.864 -7.981 -7.478 1.00 0.00 C ATOM 956 NH1 ARG A 64 8.417 -6.754 -7.775 1.00 0.00 N ATOM 957 NH2 ARG A 64 10.173 -8.256 -7.564 1.00 0.00 N ATOM 0 H ARG A 64 4.123 -11.573 -5.552 1.00 0.00 H new ATOM 0 HA ARG A 64 3.343 -9.036 -6.265 1.00 0.00 H new ATOM 0 HB2 ARG A 64 4.567 -11.179 -8.055 1.00 0.00 H new ATOM 0 HB3 ARG A 64 4.597 -9.455 -8.365 1.00 0.00 H new ATOM 0 HG2 ARG A 64 5.587 -10.155 -5.663 1.00 0.00 H new ATOM 0 HG3 ARG A 64 6.531 -10.888 -6.945 1.00 0.00 H new ATOM 0 HD2 ARG A 64 6.152 -8.276 -7.882 1.00 0.00 H new ATOM 0 HD3 ARG A 64 6.332 -8.042 -6.154 1.00 0.00 H new ATOM 0 HE ARG A 64 8.378 -9.857 -6.879 1.00 0.00 H new ATOM 0 HH11 ARG A 64 7.421 -6.545 -7.711 1.00 0.00 H new ATOM 0 HH12 ARG A 64 9.073 -6.029 -8.065 1.00 0.00 H new ATOM 0 HH21 ARG A 64 10.514 -9.191 -7.339 1.00 0.00 H new ATOM 0 HH22 ARG A 64 10.829 -7.530 -7.854 1.00 0.00 H new ATOM 971 N LYS A 65 1.501 -11.350 -7.574 1.00 0.00 N ATOM 972 CA LYS A 65 0.317 -11.623 -8.372 1.00 0.00 C ATOM 973 C LYS A 65 -0.871 -10.852 -7.792 1.00 0.00 C ATOM 974 O LYS A 65 -1.808 -10.517 -8.514 1.00 0.00 O ATOM 975 CB LYS A 65 0.079 -13.130 -8.479 1.00 0.00 C ATOM 976 CG LYS A 65 -0.313 -13.721 -7.123 1.00 0.00 C ATOM 977 CD LYS A 65 -0.458 -15.242 -7.209 1.00 0.00 C ATOM 978 CE LYS A 65 -0.713 -15.848 -5.828 1.00 0.00 C ATOM 979 NZ LYS A 65 -1.496 -17.098 -5.947 1.00 0.00 N ATOM 0 H LYS A 65 1.821 -12.133 -7.003 1.00 0.00 H new ATOM 0 HA LYS A 65 0.457 -11.273 -9.395 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.708 -13.327 -9.207 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.981 -13.619 -8.846 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.442 -13.466 -6.379 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -1.252 -13.281 -6.788 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -1.280 -15.495 -7.878 1.00 0.00 H new ATOM 0 HD3 LYS A 65 0.447 -15.673 -7.638 1.00 0.00 H new ATOM 0 HE2 LYS A 65 0.236 -16.052 -5.333 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -1.250 -15.133 -5.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -1.660 -17.496 -5.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -2.410 -16.894 -6.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.969 -17.784 -6.525 1.00 0.00 H new ATOM 993 N ASP A 66 -0.793 -10.595 -6.495 1.00 0.00 N ATOM 994 CA ASP A 66 -1.850 -9.871 -5.810 1.00 0.00 C ATOM 995 C ASP A 66 -1.633 -8.367 -5.992 1.00 0.00 C ATOM 996 O ASP A 66 -2.578 -7.585 -5.906 1.00 0.00 O ATOM 997 CB ASP A 66 -1.841 -10.171 -4.310 1.00 0.00 C ATOM 998 CG ASP A 66 -1.407 -11.591 -3.937 1.00 0.00 C ATOM 999 OD1 ASP A 66 -1.823 -12.520 -4.662 1.00 0.00 O ATOM 1000 OD2 ASP A 66 -0.670 -11.713 -2.936 1.00 0.00 O ATOM 0 H ASP A 66 -0.014 -10.875 -5.900 1.00 0.00 H new ATOM 0 HA ASP A 66 -2.803 -10.185 -6.235 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -1.175 -9.462 -3.817 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -2.841 -9.997 -3.914 1.00 0.00 H new ATOM 1005 N ILE A 67 -0.381 -8.008 -6.239 1.00 0.00 N ATOM 1006 CA ILE A 67 -0.028 -6.612 -6.434 1.00 0.00 C ATOM 1007 C ILE A 67 -0.274 -6.227 -7.894 1.00 0.00 C ATOM 1008 O ILE A 67 0.006 -7.008 -8.801 1.00 0.00 O ATOM 1009 CB ILE A 67 1.405 -6.352 -5.963 1.00 0.00 C ATOM 1010 CG1 ILE A 67 1.673 -7.035 -4.620 1.00 0.00 C ATOM 1011 CG2 ILE A 67 1.700 -4.852 -5.912 1.00 0.00 C ATOM 1012 CD1 ILE A 67 3.106 -6.779 -4.152 1.00 0.00 C ATOM 0 H ILE A 67 0.401 -8.660 -6.308 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.662 -5.970 -5.823 1.00 0.00 H new ATOM 0 HB ILE A 67 2.089 -6.791 -6.689 1.00 0.00 H new ATOM 0 HG12 ILE A 67 0.971 -6.665 -3.873 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.503 -8.108 -4.713 1.00 0.00 H new ATOM 0 HG21 ILE A 67 2.724 -4.694 -5.574 1.00 0.00 H new ATOM 0 HG22 ILE A 67 1.575 -4.423 -6.906 1.00 0.00 H new ATOM 0 HG23 ILE A 67 1.011 -4.369 -5.219 1.00 0.00 H new ATOM 0 HD11 ILE A 67 3.270 -7.275 -3.196 1.00 0.00 H new ATOM 0 HD12 ILE A 67 3.805 -7.172 -4.890 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.265 -5.707 -4.037 1.00 0.00 H new ATOM 1024 N LYS A 68 -0.797 -5.023 -8.074 1.00 0.00 N ATOM 1025 CA LYS A 68 -1.086 -4.525 -9.409 1.00 0.00 C ATOM 1026 C LYS A 68 -1.113 -2.995 -9.382 1.00 0.00 C ATOM 1027 O LYS A 68 -1.550 -2.396 -8.401 1.00 0.00 O ATOM 1028 CB LYS A 68 -2.371 -5.154 -9.950 1.00 0.00 C ATOM 1029 CG LYS A 68 -3.506 -5.048 -8.928 1.00 0.00 C ATOM 1030 CD LYS A 68 -4.396 -3.838 -9.221 1.00 0.00 C ATOM 1031 CE LYS A 68 -5.478 -4.189 -10.244 1.00 0.00 C ATOM 1032 NZ LYS A 68 -6.249 -2.982 -10.617 1.00 0.00 N ATOM 0 H LYS A 68 -1.028 -4.378 -7.318 1.00 0.00 H new ATOM 0 HA LYS A 68 -0.299 -4.819 -10.104 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -2.662 -4.657 -10.875 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -2.193 -6.201 -10.194 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -4.105 -5.958 -8.949 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -3.090 -4.963 -7.924 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -4.861 -3.492 -8.298 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -3.787 -3.017 -9.598 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -5.020 -4.624 -11.132 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -6.148 -4.942 -9.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -6.979 -3.238 -11.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -6.702 -2.584 -9.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -5.609 -2.275 -11.032 1.00 0.00 H new ATOM 1046 N GLU A 69 -0.641 -2.408 -10.472 1.00 0.00 N ATOM 1047 CA GLU A 69 -0.606 -0.960 -10.586 1.00 0.00 C ATOM 1048 C GLU A 69 -1.855 -0.347 -9.949 1.00 0.00 C ATOM 1049 O GLU A 69 -2.923 -0.957 -9.954 1.00 0.00 O ATOM 1050 CB GLU A 69 -0.467 -0.528 -12.047 1.00 0.00 C ATOM 1051 CG GLU A 69 0.991 -0.224 -12.394 1.00 0.00 C ATOM 1052 CD GLU A 69 1.174 -0.059 -13.904 1.00 0.00 C ATOM 1053 OE1 GLU A 69 0.442 0.776 -14.476 1.00 0.00 O ATOM 1054 OE2 GLU A 69 2.041 -0.774 -14.451 1.00 0.00 O ATOM 0 H GLU A 69 -0.280 -2.909 -11.284 1.00 0.00 H new ATOM 0 HA GLU A 69 0.269 -0.594 -10.049 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -0.843 -1.316 -12.700 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -1.079 0.355 -12.228 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.307 0.686 -11.884 1.00 0.00 H new ATOM 0 HG3 GLU A 69 1.630 -1.030 -12.033 1.00 0.00 H new ATOM 1061 N VAL A 70 -1.679 0.853 -9.415 1.00 0.00 N ATOM 1062 CA VAL A 70 -2.778 1.556 -8.776 1.00 0.00 C ATOM 1063 C VAL A 70 -2.630 3.057 -9.021 1.00 0.00 C ATOM 1064 O VAL A 70 -1.527 3.544 -9.268 1.00 0.00 O ATOM 1065 CB VAL A 70 -2.836 1.196 -7.290 1.00 0.00 C ATOM 1066 CG1 VAL A 70 -1.799 1.990 -6.493 1.00 0.00 C ATOM 1067 CG2 VAL A 70 -4.243 1.410 -6.728 1.00 0.00 C ATOM 0 H VAL A 70 -0.792 1.356 -9.412 1.00 0.00 H new ATOM 0 HA VAL A 70 -3.730 1.249 -9.209 1.00 0.00 H new ATOM 0 HB VAL A 70 -2.595 0.138 -7.192 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -1.861 1.715 -5.440 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -0.801 1.764 -6.868 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -1.995 3.057 -6.602 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -4.256 1.147 -5.670 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -4.526 2.456 -6.845 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -4.950 0.780 -7.268 1.00 0.00 H new ATOM 1077 N ASP A 71 -3.756 3.752 -8.945 1.00 0.00 N ATOM 1078 CA ASP A 71 -3.765 5.190 -9.156 1.00 0.00 C ATOM 1079 C ASP A 71 -4.303 5.882 -7.902 1.00 0.00 C ATOM 1080 O ASP A 71 -5.462 6.291 -7.864 1.00 0.00 O ATOM 1081 CB ASP A 71 -4.668 5.569 -10.330 1.00 0.00 C ATOM 1082 CG ASP A 71 -5.296 4.387 -11.072 1.00 0.00 C ATOM 1083 OD1 ASP A 71 -4.521 3.488 -11.466 1.00 0.00 O ATOM 1084 OD2 ASP A 71 -6.536 4.407 -11.227 1.00 0.00 O ATOM 0 H ASP A 71 -4.669 3.346 -8.740 1.00 0.00 H new ATOM 0 HA ASP A 71 -2.744 5.505 -9.371 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -5.467 6.213 -9.961 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -4.087 6.157 -11.040 1.00 0.00 H new ATOM 1089 N ILE A 72 -3.436 5.991 -6.907 1.00 0.00 N ATOM 1090 CA ILE A 72 -3.810 6.626 -5.654 1.00 0.00 C ATOM 1091 C ILE A 72 -3.909 8.139 -5.864 1.00 0.00 C ATOM 1092 O ILE A 72 -4.850 8.774 -5.392 1.00 0.00 O ATOM 1093 CB ILE A 72 -2.844 6.223 -4.539 1.00 0.00 C ATOM 1094 CG1 ILE A 72 -2.738 4.700 -4.429 1.00 0.00 C ATOM 1095 CG2 ILE A 72 -3.241 6.867 -3.209 1.00 0.00 C ATOM 1096 CD1 ILE A 72 -4.075 4.033 -4.758 1.00 0.00 C ATOM 0 H ILE A 72 -2.475 5.650 -6.942 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.793 6.282 -5.332 1.00 0.00 H new ATOM 0 HB ILE A 72 -1.853 6.598 -4.795 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.968 4.335 -5.109 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.429 4.425 -3.421 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.538 6.564 -2.434 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.223 7.952 -3.311 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.245 6.545 -2.934 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.973 2.951 -4.673 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.837 4.382 -4.061 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -4.369 4.290 -5.775 1.00 0.00 H new ATOM 1108 N LEU A 73 -2.924 8.671 -6.573 1.00 0.00 N ATOM 1109 CA LEU A 73 -2.889 10.097 -6.852 1.00 0.00 C ATOM 1110 C LEU A 73 -3.974 10.440 -7.874 1.00 0.00 C ATOM 1111 O LEU A 73 -4.191 11.610 -8.186 1.00 0.00 O ATOM 1112 CB LEU A 73 -1.483 10.524 -7.280 1.00 0.00 C ATOM 1113 CG LEU A 73 -0.710 11.385 -6.279 1.00 0.00 C ATOM 1114 CD1 LEU A 73 0.558 11.959 -6.915 1.00 0.00 C ATOM 1115 CD2 LEU A 73 -1.603 12.480 -5.692 1.00 0.00 C ATOM 0 H LEU A 73 -2.145 8.141 -6.962 1.00 0.00 H new ATOM 0 HA LEU A 73 -3.110 10.667 -5.950 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -0.899 9.627 -7.485 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -1.561 11.074 -8.218 1.00 0.00 H new ATOM 0 HG LEU A 73 -0.396 10.748 -5.452 1.00 0.00 H new ATOM 0 HD11 LEU A 73 1.089 12.567 -6.183 1.00 0.00 H new ATOM 0 HD12 LEU A 73 1.201 11.143 -7.244 1.00 0.00 H new ATOM 0 HD13 LEU A 73 0.288 12.576 -7.772 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -1.029 13.077 -4.984 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -1.968 13.121 -6.495 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -2.449 12.023 -5.179 1.00 0.00 H new ATOM 1127 N ASN A 74 -4.629 9.398 -8.367 1.00 0.00 N ATOM 1128 CA ASN A 74 -5.686 9.575 -9.347 1.00 0.00 C ATOM 1129 C ASN A 74 -7.041 9.326 -8.681 1.00 0.00 C ATOM 1130 O ASN A 74 -8.071 9.301 -9.351 1.00 0.00 O ATOM 1131 CB ASN A 74 -5.538 8.582 -10.502 1.00 0.00 C ATOM 1132 CG ASN A 74 -5.454 9.310 -11.845 1.00 0.00 C ATOM 1133 OD1 ASN A 74 -6.344 10.046 -12.238 1.00 0.00 O ATOM 1134 ND2 ASN A 74 -4.337 9.066 -12.525 1.00 0.00 N ATOM 0 H ASN A 74 -4.447 8.429 -8.106 1.00 0.00 H new ATOM 0 HA ASN A 74 -5.620 10.592 -9.734 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -4.642 7.979 -10.355 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -6.386 7.897 -10.508 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -4.186 9.506 -13.433 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -3.631 8.439 -12.139 1.00 0.00 H new ATOM 1141 N LEU A 75 -6.994 9.148 -7.368 1.00 0.00 N ATOM 1142 CA LEU A 75 -8.205 8.902 -6.604 1.00 0.00 C ATOM 1143 C LEU A 75 -8.830 10.240 -6.202 1.00 0.00 C ATOM 1144 O LEU A 75 -8.141 11.256 -6.135 1.00 0.00 O ATOM 1145 CB LEU A 75 -7.911 7.980 -5.418 1.00 0.00 C ATOM 1146 CG LEU A 75 -7.895 6.481 -5.722 1.00 0.00 C ATOM 1147 CD1 LEU A 75 -7.435 5.679 -4.504 1.00 0.00 C ATOM 1148 CD2 LEU A 75 -9.257 6.011 -6.236 1.00 0.00 C ATOM 0 H LEU A 75 -6.137 9.169 -6.815 1.00 0.00 H new ATOM 0 HA LEU A 75 -8.940 8.376 -7.213 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -6.943 8.256 -5.000 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -8.657 8.166 -4.645 1.00 0.00 H new ATOM 0 HG LEU A 75 -7.171 6.302 -6.517 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -7.433 4.617 -4.748 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -6.428 5.989 -4.223 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -8.115 5.859 -3.672 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -9.218 4.942 -6.444 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -10.018 6.206 -5.480 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -9.507 6.550 -7.150 1.00 0.00 H new ATOM 1160 N PRO A 76 -10.164 10.195 -5.940 1.00 0.00 N ATOM 1161 CA PRO A 76 -10.890 11.391 -5.548 1.00 0.00 C ATOM 1162 C PRO A 76 -10.582 11.767 -4.097 1.00 0.00 C ATOM 1163 O PRO A 76 -10.523 10.901 -3.225 1.00 0.00 O ATOM 1164 CB PRO A 76 -12.354 11.054 -5.774 1.00 0.00 C ATOM 1165 CG PRO A 76 -12.428 9.537 -5.843 1.00 0.00 C ATOM 1166 CD PRO A 76 -11.012 9.009 -6.009 1.00 0.00 C ATOM 0 HA PRO A 76 -10.602 12.267 -6.129 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -12.973 11.438 -4.963 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -12.721 11.505 -6.696 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -12.882 9.135 -4.937 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -13.053 9.223 -6.679 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -10.761 8.296 -5.224 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.892 8.491 -6.960 1.00 0.00 H new ATOM 1174 N GLU A 77 -10.393 13.061 -3.882 1.00 0.00 N ATOM 1175 CA GLU A 77 -10.092 13.563 -2.552 1.00 0.00 C ATOM 1176 C GLU A 77 -11.016 12.916 -1.519 1.00 0.00 C ATOM 1177 O GLU A 77 -10.640 12.755 -0.358 1.00 0.00 O ATOM 1178 CB GLU A 77 -10.201 15.089 -2.505 1.00 0.00 C ATOM 1179 CG GLU A 77 -8.826 15.742 -2.666 1.00 0.00 C ATOM 1180 CD GLU A 77 -8.579 16.778 -1.568 1.00 0.00 C ATOM 1181 OE1 GLU A 77 -9.074 17.913 -1.736 1.00 0.00 O ATOM 1182 OE2 GLU A 77 -7.901 16.410 -0.584 1.00 0.00 O ATOM 0 H GLU A 77 -10.443 13.777 -4.607 1.00 0.00 H new ATOM 0 HA GLU A 77 -9.064 13.297 -2.308 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -10.866 15.434 -3.296 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -10.645 15.397 -1.558 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.050 14.977 -2.631 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -8.759 16.220 -3.643 1.00 0.00 H new ATOM 1189 N SER A 78 -12.208 12.561 -1.978 1.00 0.00 N ATOM 1190 CA SER A 78 -13.188 11.934 -1.107 1.00 0.00 C ATOM 1191 C SER A 78 -12.604 10.661 -0.493 1.00 0.00 C ATOM 1192 O SER A 78 -12.708 10.444 0.713 1.00 0.00 O ATOM 1193 CB SER A 78 -14.476 11.614 -1.869 1.00 0.00 C ATOM 1194 OG SER A 78 -15.589 12.347 -1.365 1.00 0.00 O ATOM 0 H SER A 78 -12.517 12.696 -2.941 1.00 0.00 H new ATOM 0 HA SER A 78 -13.434 12.634 -0.309 1.00 0.00 H new ATOM 0 HB2 SER A 78 -14.339 11.844 -2.926 1.00 0.00 H new ATOM 0 HB3 SER A 78 -14.683 10.546 -1.799 1.00 0.00 H new ATOM 0 HG SER A 78 -16.392 12.117 -1.878 1.00 0.00 H new ATOM 1200 N GLU A 79 -12.002 9.850 -1.351 1.00 0.00 N ATOM 1201 CA GLU A 79 -11.401 8.603 -0.908 1.00 0.00 C ATOM 1202 C GLU A 79 -10.211 8.884 0.011 1.00 0.00 C ATOM 1203 O GLU A 79 -10.105 8.304 1.091 1.00 0.00 O ATOM 1204 CB GLU A 79 -10.981 7.743 -2.101 1.00 0.00 C ATOM 1205 CG GLU A 79 -12.202 7.152 -2.809 1.00 0.00 C ATOM 1206 CD GLU A 79 -13.135 6.465 -1.809 1.00 0.00 C ATOM 1207 OE1 GLU A 79 -12.607 5.700 -0.974 1.00 0.00 O ATOM 1208 OE2 GLU A 79 -14.355 6.720 -1.904 1.00 0.00 O ATOM 0 H GLU A 79 -11.918 10.032 -2.351 1.00 0.00 H new ATOM 0 HA GLU A 79 -12.147 8.044 -0.343 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -10.405 8.346 -2.803 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -10.328 6.939 -1.762 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -12.741 7.942 -3.332 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -11.878 6.434 -3.562 1.00 0.00 H new ATOM 1215 N LEU A 80 -9.347 9.776 -0.449 1.00 0.00 N ATOM 1216 CA LEU A 80 -8.168 10.141 0.318 1.00 0.00 C ATOM 1217 C LEU A 80 -8.600 10.674 1.686 1.00 0.00 C ATOM 1218 O LEU A 80 -8.158 10.173 2.719 1.00 0.00 O ATOM 1219 CB LEU A 80 -7.295 11.118 -0.473 1.00 0.00 C ATOM 1220 CG LEU A 80 -6.933 10.691 -1.897 1.00 0.00 C ATOM 1221 CD1 LEU A 80 -6.201 11.812 -2.636 1.00 0.00 C ATOM 1222 CD2 LEU A 80 -6.131 9.388 -1.892 1.00 0.00 C ATOM 0 H LEU A 80 -9.440 10.257 -1.344 1.00 0.00 H new ATOM 0 HA LEU A 80 -7.545 9.265 0.498 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.810 12.077 -0.522 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -6.371 11.281 0.082 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.858 10.497 -2.441 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.955 11.482 -3.645 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.841 12.693 -2.688 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -5.284 12.061 -2.102 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -5.887 9.107 -2.916 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -5.211 9.529 -1.325 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -6.723 8.598 -1.431 1.00 0.00 H new ATOM 1234 N SER A 81 -9.460 11.681 1.649 1.00 0.00 N ATOM 1235 CA SER A 81 -9.958 12.285 2.873 1.00 0.00 C ATOM 1236 C SER A 81 -10.413 11.197 3.847 1.00 0.00 C ATOM 1237 O SER A 81 -10.252 11.337 5.059 1.00 0.00 O ATOM 1238 CB SER A 81 -11.108 13.252 2.582 1.00 0.00 C ATOM 1239 OG SER A 81 -11.270 14.217 3.618 1.00 0.00 O ATOM 0 H SER A 81 -9.825 12.094 0.791 1.00 0.00 H new ATOM 0 HA SER A 81 -9.147 12.854 3.328 1.00 0.00 H new ATOM 0 HB2 SER A 81 -10.922 13.763 1.637 1.00 0.00 H new ATOM 0 HB3 SER A 81 -12.034 12.689 2.463 1.00 0.00 H new ATOM 0 HG SER A 81 -12.013 14.816 3.394 1.00 0.00 H new ATOM 1245 N THR A 82 -10.974 10.139 3.282 1.00 0.00 N ATOM 1246 CA THR A 82 -11.453 9.028 4.086 1.00 0.00 C ATOM 1247 C THR A 82 -10.368 7.956 4.217 1.00 0.00 C ATOM 1248 O THR A 82 -9.597 7.962 5.175 1.00 0.00 O ATOM 1249 CB THR A 82 -12.745 8.508 3.451 1.00 0.00 C ATOM 1250 OG1 THR A 82 -12.359 8.130 2.133 1.00 0.00 O ATOM 1251 CG2 THR A 82 -13.777 9.617 3.234 1.00 0.00 C ATOM 0 H THR A 82 -11.108 10.027 2.277 1.00 0.00 H new ATOM 0 HA THR A 82 -11.677 9.345 5.104 1.00 0.00 H new ATOM 0 HB THR A 82 -13.173 7.732 4.085 1.00 0.00 H new ATOM 0 HG1 THR A 82 -12.583 8.850 1.507 1.00 0.00 H new ATOM 0 HG21 THR A 82 -14.674 9.195 2.781 1.00 0.00 H new ATOM 0 HG22 THR A 82 -14.032 10.069 4.192 1.00 0.00 H new ATOM 0 HG23 THR A 82 -13.360 10.377 2.573 1.00 0.00 H new ATOM 1259 N LYS A 83 -10.343 7.062 3.239 1.00 0.00 N ATOM 1260 CA LYS A 83 -9.365 5.988 3.233 1.00 0.00 C ATOM 1261 C LYS A 83 -8.017 6.528 3.713 1.00 0.00 C ATOM 1262 O LYS A 83 -7.436 7.409 3.080 1.00 0.00 O ATOM 1263 CB LYS A 83 -9.308 5.323 1.856 1.00 0.00 C ATOM 1264 CG LYS A 83 -10.081 4.004 1.850 1.00 0.00 C ATOM 1265 CD LYS A 83 -11.591 4.252 1.845 1.00 0.00 C ATOM 1266 CE LYS A 83 -12.287 3.424 2.928 1.00 0.00 C ATOM 1267 NZ LYS A 83 -13.024 2.294 2.321 1.00 0.00 N ATOM 0 H LYS A 83 -10.984 7.060 2.446 1.00 0.00 H new ATOM 0 HA LYS A 83 -9.658 5.202 3.929 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -9.724 5.996 1.106 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -8.270 5.141 1.579 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -9.802 3.419 0.973 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -9.809 3.415 2.726 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -11.790 5.311 2.008 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.002 3.998 0.868 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -11.549 3.047 3.636 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -12.975 4.055 3.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -13.491 1.742 3.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -13.741 2.661 1.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -12.359 1.684 1.804 1.00 0.00 H new ATOM 1281 N PRO A 84 -7.544 5.963 4.856 1.00 0.00 N ATOM 1282 CA PRO A 84 -6.275 6.379 5.427 1.00 0.00 C ATOM 1283 C PRO A 84 -5.101 5.816 4.624 1.00 0.00 C ATOM 1284 O PRO A 84 -4.177 6.547 4.273 1.00 0.00 O ATOM 1285 CB PRO A 84 -6.307 5.878 6.862 1.00 0.00 C ATOM 1286 CG PRO A 84 -7.383 4.805 6.905 1.00 0.00 C ATOM 1287 CD PRO A 84 -8.204 4.917 5.633 1.00 0.00 C ATOM 0 HA PRO A 84 -6.135 7.460 5.399 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -5.339 5.472 7.156 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -6.536 6.689 7.554 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -6.932 3.816 6.982 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -8.018 4.936 7.782 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -8.223 3.972 5.090 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -9.239 5.180 5.852 1.00 0.00 H new ATOM 1295 N GLY A 85 -5.177 4.520 4.356 1.00 0.00 N ATOM 1296 CA GLY A 85 -4.131 3.850 3.601 1.00 0.00 C ATOM 1297 C GLY A 85 -3.837 4.593 2.296 1.00 0.00 C ATOM 1298 O GLY A 85 -2.676 4.765 1.924 1.00 0.00 O ATOM 0 H GLY A 85 -5.946 3.917 4.648 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -3.224 3.791 4.203 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -4.435 2.827 3.381 1.00 0.00 H new ATOM 1302 N LEU A 86 -4.906 5.014 1.636 1.00 0.00 N ATOM 1303 CA LEU A 86 -4.776 5.734 0.381 1.00 0.00 C ATOM 1304 C LEU A 86 -4.208 7.128 0.655 1.00 0.00 C ATOM 1305 O LEU A 86 -3.200 7.518 0.067 1.00 0.00 O ATOM 1306 CB LEU A 86 -6.110 5.750 -0.367 1.00 0.00 C ATOM 1307 CG LEU A 86 -6.747 4.384 -0.630 1.00 0.00 C ATOM 1308 CD1 LEU A 86 -8.212 4.533 -1.045 1.00 0.00 C ATOM 1309 CD2 LEU A 86 -5.938 3.589 -1.658 1.00 0.00 C ATOM 0 H LEU A 86 -5.867 4.870 1.947 1.00 0.00 H new ATOM 0 HA LEU A 86 -4.072 5.227 -0.279 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -6.816 6.355 0.202 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -5.961 6.250 -1.324 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.732 3.816 0.300 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -8.641 3.547 -1.226 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -8.767 5.030 -0.249 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.273 5.128 -1.956 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -6.413 2.622 -1.826 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.899 4.142 -2.596 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.926 3.436 -1.284 1.00 0.00 H new ATOM 1321 N GLN A 87 -4.880 7.841 1.547 1.00 0.00 N ATOM 1322 CA GLN A 87 -4.455 9.183 1.906 1.00 0.00 C ATOM 1323 C GLN A 87 -2.927 9.262 1.954 1.00 0.00 C ATOM 1324 O GLN A 87 -2.303 9.830 1.060 1.00 0.00 O ATOM 1325 CB GLN A 87 -5.069 9.615 3.240 1.00 0.00 C ATOM 1326 CG GLN A 87 -4.781 11.091 3.523 1.00 0.00 C ATOM 1327 CD GLN A 87 -6.081 11.886 3.660 1.00 0.00 C ATOM 1328 OE1 GLN A 87 -6.776 11.821 4.660 1.00 0.00 O ATOM 1329 NE2 GLN A 87 -6.369 12.639 2.602 1.00 0.00 N ATOM 0 H GLN A 87 -5.716 7.514 2.032 1.00 0.00 H new ATOM 0 HA GLN A 87 -4.811 9.872 1.140 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -6.146 9.448 3.220 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -4.666 9.001 4.046 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -4.196 11.182 4.438 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -4.178 11.509 2.717 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -5.743 12.647 1.796 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -7.215 13.208 2.596 1.00 0.00 H new ATOM 1338 N LYS A 88 -2.370 8.682 3.007 1.00 0.00 N ATOM 1339 CA LYS A 88 -0.928 8.679 3.184 1.00 0.00 C ATOM 1340 C LYS A 88 -0.258 8.283 1.867 1.00 0.00 C ATOM 1341 O LYS A 88 0.582 9.018 1.348 1.00 0.00 O ATOM 1342 CB LYS A 88 -0.535 7.791 4.366 1.00 0.00 C ATOM 1343 CG LYS A 88 -0.798 8.499 5.696 1.00 0.00 C ATOM 1344 CD LYS A 88 -2.043 7.931 6.383 1.00 0.00 C ATOM 1345 CE LYS A 88 -2.729 8.994 7.241 1.00 0.00 C ATOM 1346 NZ LYS A 88 -2.611 8.657 8.677 1.00 0.00 N ATOM 0 H LYS A 88 -2.891 8.211 3.746 1.00 0.00 H new ATOM 0 HA LYS A 88 -0.573 9.678 3.435 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -1.099 6.859 4.328 1.00 0.00 H new ATOM 0 HB3 LYS A 88 0.520 7.528 4.293 1.00 0.00 H new ATOM 0 HG2 LYS A 88 0.067 8.385 6.350 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -0.929 9.567 5.524 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -2.740 7.560 5.631 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -1.763 7.081 7.006 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -2.279 9.968 7.052 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -3.781 9.070 6.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -3.082 9.389 9.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -3.061 7.737 8.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -1.606 8.608 8.941 1.00 0.00 H new ATOM 1360 N ALA A 89 -0.655 7.124 1.363 1.00 0.00 N ATOM 1361 CA ALA A 89 -0.103 6.622 0.116 1.00 0.00 C ATOM 1362 C ALA A 89 -0.029 7.763 -0.899 1.00 0.00 C ATOM 1363 O ALA A 89 1.028 8.018 -1.476 1.00 0.00 O ATOM 1364 CB ALA A 89 -0.953 5.452 -0.383 1.00 0.00 C ATOM 0 H ALA A 89 -1.352 6.518 1.795 1.00 0.00 H new ATOM 0 HA ALA A 89 0.910 6.249 0.267 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -0.540 5.075 -1.318 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -0.950 4.656 0.362 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -1.976 5.790 -0.549 1.00 0.00 H new ATOM 1370 N SER A 90 -1.163 8.420 -1.088 1.00 0.00 N ATOM 1371 CA SER A 90 -1.239 9.529 -2.024 1.00 0.00 C ATOM 1372 C SER A 90 -0.256 10.628 -1.616 1.00 0.00 C ATOM 1373 O SER A 90 0.518 11.111 -2.440 1.00 0.00 O ATOM 1374 CB SER A 90 -2.661 10.090 -2.099 1.00 0.00 C ATOM 1375 OG SER A 90 -3.475 9.628 -1.025 1.00 0.00 O ATOM 0 H SER A 90 -2.038 8.206 -0.609 1.00 0.00 H new ATOM 0 HA SER A 90 -0.970 9.160 -3.014 1.00 0.00 H new ATOM 0 HB2 SER A 90 -2.622 11.179 -2.082 1.00 0.00 H new ATOM 0 HB3 SER A 90 -3.115 9.802 -3.047 1.00 0.00 H new ATOM 0 HG SER A 90 -3.278 10.148 -0.218 1.00 0.00 H new ATOM 1381 N ILE A 91 -0.320 10.991 -0.343 1.00 0.00 N ATOM 1382 CA ILE A 91 0.555 12.024 0.185 1.00 0.00 C ATOM 1383 C ILE A 91 1.997 11.727 -0.232 1.00 0.00 C ATOM 1384 O ILE A 91 2.700 12.609 -0.723 1.00 0.00 O ATOM 1385 CB ILE A 91 0.368 12.162 1.697 1.00 0.00 C ATOM 1386 CG1 ILE A 91 -0.981 12.804 2.026 1.00 0.00 C ATOM 1387 CG2 ILE A 91 1.535 12.928 2.326 1.00 0.00 C ATOM 1388 CD1 ILE A 91 -1.048 13.216 3.498 1.00 0.00 C ATOM 0 H ILE A 91 -0.964 10.588 0.338 1.00 0.00 H new ATOM 0 HA ILE A 91 0.295 12.996 -0.235 1.00 0.00 H new ATOM 0 HB ILE A 91 0.365 11.163 2.133 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -1.136 13.678 1.393 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.785 12.103 1.804 1.00 0.00 H new ATOM 0 HG21 ILE A 91 1.378 13.012 3.401 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.466 12.393 2.136 1.00 0.00 H new ATOM 0 HG23 ILE A 91 1.594 13.925 1.889 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -2.017 13.670 3.705 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -0.917 12.336 4.128 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -0.258 13.936 3.711 1.00 0.00 H new ATOM 1400 N PHE A 92 2.396 10.481 -0.021 1.00 0.00 N ATOM 1401 CA PHE A 92 3.741 10.057 -0.368 1.00 0.00 C ATOM 1402 C PHE A 92 3.957 10.104 -1.883 1.00 0.00 C ATOM 1403 O PHE A 92 5.091 10.036 -2.354 1.00 0.00 O ATOM 1404 CB PHE A 92 3.892 8.611 0.111 1.00 0.00 C ATOM 1405 CG PHE A 92 5.001 7.833 -0.601 1.00 0.00 C ATOM 1406 CD1 PHE A 92 6.245 8.369 -0.711 1.00 0.00 C ATOM 1407 CD2 PHE A 92 4.741 6.605 -1.124 1.00 0.00 C ATOM 1408 CE1 PHE A 92 7.274 7.646 -1.370 1.00 0.00 C ATOM 1409 CE2 PHE A 92 5.770 5.882 -1.784 1.00 0.00 C ATOM 1410 CZ PHE A 92 7.015 6.418 -1.894 1.00 0.00 C ATOM 0 H PHE A 92 1.811 9.752 0.386 1.00 0.00 H new ATOM 0 HA PHE A 92 4.471 10.719 0.098 1.00 0.00 H new ATOM 0 HB2 PHE A 92 4.094 8.613 1.182 1.00 0.00 H new ATOM 0 HB3 PHE A 92 2.946 8.090 -0.034 1.00 0.00 H new ATOM 0 HD1 PHE A 92 6.451 9.345 -0.297 1.00 0.00 H new ATOM 0 HD2 PHE A 92 3.752 6.180 -1.038 1.00 0.00 H new ATOM 0 HE1 PHE A 92 8.263 8.071 -1.455 1.00 0.00 H new ATOM 0 HE2 PHE A 92 5.564 4.906 -2.199 1.00 0.00 H new ATOM 0 HZ PHE A 92 7.797 5.869 -2.397 1.00 0.00 H new ATOM 1420 N LEU A 93 2.851 10.222 -2.603 1.00 0.00 N ATOM 1421 CA LEU A 93 2.905 10.282 -4.054 1.00 0.00 C ATOM 1422 C LEU A 93 2.984 11.743 -4.498 1.00 0.00 C ATOM 1423 O LEU A 93 3.221 12.026 -5.671 1.00 0.00 O ATOM 1424 CB LEU A 93 1.730 9.515 -4.664 1.00 0.00 C ATOM 1425 CG LEU A 93 1.803 7.989 -4.571 1.00 0.00 C ATOM 1426 CD1 LEU A 93 0.961 7.333 -5.667 1.00 0.00 C ATOM 1427 CD2 LEU A 93 3.254 7.507 -4.596 1.00 0.00 C ATOM 0 H LEU A 93 1.912 10.278 -2.209 1.00 0.00 H new ATOM 0 HA LEU A 93 3.804 9.789 -4.423 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.813 9.845 -4.175 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.648 9.791 -5.715 1.00 0.00 H new ATOM 0 HG LEU A 93 1.380 7.684 -3.614 1.00 0.00 H new ATOM 0 HD11 LEU A 93 1.030 6.249 -5.579 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -0.079 7.640 -5.560 1.00 0.00 H new ATOM 0 HD13 LEU A 93 1.332 7.642 -6.644 1.00 0.00 H new ATOM 0 HD21 LEU A 93 3.277 6.419 -4.529 1.00 0.00 H new ATOM 0 HD22 LEU A 93 3.726 7.823 -5.526 1.00 0.00 H new ATOM 0 HD23 LEU A 93 3.794 7.934 -3.751 1.00 0.00 H new ATOM 1439 N LYS A 94 2.781 12.633 -3.537 1.00 0.00 N ATOM 1440 CA LYS A 94 2.827 14.058 -3.816 1.00 0.00 C ATOM 1441 C LYS A 94 4.012 14.680 -3.074 1.00 0.00 C ATOM 1442 O LYS A 94 4.794 15.426 -3.662 1.00 0.00 O ATOM 1443 CB LYS A 94 1.483 14.711 -3.486 1.00 0.00 C ATOM 1444 CG LYS A 94 0.518 13.698 -2.868 1.00 0.00 C ATOM 1445 CD LYS A 94 -0.755 14.386 -2.370 1.00 0.00 C ATOM 1446 CE LYS A 94 -1.338 15.304 -3.446 1.00 0.00 C ATOM 1447 NZ LYS A 94 -2.568 15.965 -2.952 1.00 0.00 N ATOM 0 H LYS A 94 2.584 12.395 -2.565 1.00 0.00 H new ATOM 0 HA LYS A 94 2.989 14.234 -4.880 1.00 0.00 H new ATOM 0 HB2 LYS A 94 1.637 15.540 -2.795 1.00 0.00 H new ATOM 0 HB3 LYS A 94 1.045 15.129 -4.393 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.260 12.939 -3.606 1.00 0.00 H new ATOM 0 HG3 LYS A 94 1.006 13.184 -2.040 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.493 13.634 -2.089 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.533 14.965 -1.474 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -0.602 16.057 -3.728 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.563 14.726 -4.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.951 16.585 -3.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -3.275 15.243 -2.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -2.343 16.532 -2.110 1.00 0.00 H new ATOM 1461 N THR A 95 4.106 14.350 -1.794 1.00 0.00 N ATOM 1462 CA THR A 95 5.183 14.867 -0.966 1.00 0.00 C ATOM 1463 C THR A 95 6.458 14.048 -1.175 1.00 0.00 C ATOM 1464 O THR A 95 7.532 14.438 -0.720 1.00 0.00 O ATOM 1465 CB THR A 95 4.699 14.880 0.485 1.00 0.00 C ATOM 1466 OG1 THR A 95 4.661 13.503 0.849 1.00 0.00 O ATOM 1467 CG2 THR A 95 3.246 15.340 0.613 1.00 0.00 C ATOM 0 H THR A 95 3.455 13.732 -1.310 1.00 0.00 H new ATOM 0 HA THR A 95 5.442 15.888 -1.246 1.00 0.00 H new ATOM 0 HB THR A 95 5.340 15.534 1.076 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.107 13.010 0.208 1.00 0.00 H new ATOM 0 HG21 THR A 95 2.953 15.331 1.663 1.00 0.00 H new ATOM 0 HG22 THR A 95 3.148 16.351 0.218 1.00 0.00 H new ATOM 0 HG23 THR A 95 2.600 14.666 0.050 1.00 0.00 H new ATOM 1475 N ARG A 96 6.297 12.927 -1.862 1.00 0.00 N ATOM 1476 CA ARG A 96 7.421 12.048 -2.137 1.00 0.00 C ATOM 1477 C ARG A 96 8.361 11.997 -0.930 1.00 0.00 C ATOM 1478 O ARG A 96 9.575 11.889 -1.090 1.00 0.00 O ATOM 1479 CB ARG A 96 8.203 12.521 -3.364 1.00 0.00 C ATOM 1480 CG ARG A 96 7.265 12.781 -4.545 1.00 0.00 C ATOM 1481 CD ARG A 96 6.569 11.493 -4.987 1.00 0.00 C ATOM 1482 NE ARG A 96 5.831 11.723 -6.249 1.00 0.00 N ATOM 1483 CZ ARG A 96 5.460 10.749 -7.091 1.00 0.00 C ATOM 1484 NH1 ARG A 96 5.756 9.472 -6.810 1.00 0.00 N ATOM 1485 NH2 ARG A 96 4.794 11.051 -8.212 1.00 0.00 N ATOM 0 H ARG A 96 5.404 12.607 -2.237 1.00 0.00 H new ATOM 0 HA ARG A 96 7.024 11.053 -2.336 1.00 0.00 H new ATOM 0 HB2 ARG A 96 8.750 13.432 -3.122 1.00 0.00 H new ATOM 0 HB3 ARG A 96 8.942 11.769 -3.641 1.00 0.00 H new ATOM 0 HG2 ARG A 96 6.518 13.524 -4.264 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.831 13.197 -5.379 1.00 0.00 H new ATOM 0 HD2 ARG A 96 7.305 10.701 -5.126 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.882 11.156 -4.211 1.00 0.00 H new ATOM 0 HE ARG A 96 5.590 12.683 -6.493 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.263 9.242 -5.956 1.00 0.00 H new ATOM 0 HH12 ARG A 96 5.474 8.730 -7.451 1.00 0.00 H new ATOM 0 HH21 ARG A 96 4.569 12.023 -8.425 1.00 0.00 H new ATOM 0 HH22 ARG A 96 4.512 10.309 -8.853 1.00 0.00 H new ATOM 1499 N VAL A 97 7.763 12.077 0.250 1.00 0.00 N ATOM 1500 CA VAL A 97 8.531 12.041 1.482 1.00 0.00 C ATOM 1501 C VAL A 97 7.812 11.155 2.501 1.00 0.00 C ATOM 1502 O VAL A 97 6.846 11.584 3.130 1.00 0.00 O ATOM 1503 CB VAL A 97 8.770 13.464 1.991 1.00 0.00 C ATOM 1504 CG1 VAL A 97 7.449 14.223 2.137 1.00 0.00 C ATOM 1505 CG2 VAL A 97 9.544 13.451 3.312 1.00 0.00 C ATOM 0 H VAL A 97 6.755 12.167 0.378 1.00 0.00 H new ATOM 0 HA VAL A 97 9.514 11.603 1.307 1.00 0.00 H new ATOM 0 HB VAL A 97 9.377 13.987 1.252 1.00 0.00 H new ATOM 0 HG11 VAL A 97 7.647 15.231 2.500 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.952 14.277 1.169 1.00 0.00 H new ATOM 0 HG13 VAL A 97 6.806 13.702 2.846 1.00 0.00 H new ATOM 0 HG21 VAL A 97 9.701 14.475 3.652 1.00 0.00 H new ATOM 0 HG22 VAL A 97 8.974 12.903 4.062 1.00 0.00 H new ATOM 0 HG23 VAL A 97 10.509 12.966 3.164 1.00 0.00 H new ATOM 1515 N VAL A 98 8.311 9.933 2.631 1.00 0.00 N ATOM 1516 CA VAL A 98 7.727 8.983 3.563 1.00 0.00 C ATOM 1517 C VAL A 98 7.851 9.529 4.986 1.00 0.00 C ATOM 1518 O VAL A 98 8.630 10.447 5.238 1.00 0.00 O ATOM 1519 CB VAL A 98 8.384 7.611 3.389 1.00 0.00 C ATOM 1520 CG1 VAL A 98 7.667 6.793 2.313 1.00 0.00 C ATOM 1521 CG2 VAL A 98 9.873 7.753 3.070 1.00 0.00 C ATOM 0 H VAL A 98 9.112 9.580 2.107 1.00 0.00 H new ATOM 0 HA VAL A 98 6.665 8.849 3.358 1.00 0.00 H new ATOM 0 HB VAL A 98 8.294 7.074 4.333 1.00 0.00 H new ATOM 0 HG11 VAL A 98 8.153 5.823 2.209 1.00 0.00 H new ATOM 0 HG12 VAL A 98 6.625 6.648 2.600 1.00 0.00 H new ATOM 0 HG13 VAL A 98 7.711 7.325 1.362 1.00 0.00 H new ATOM 0 HG21 VAL A 98 10.316 6.764 2.951 1.00 0.00 H new ATOM 0 HG22 VAL A 98 9.995 8.318 2.146 1.00 0.00 H new ATOM 0 HG23 VAL A 98 10.371 8.278 3.885 1.00 0.00 H new ATOM 1531 N PRO A 99 7.049 8.926 5.904 1.00 0.00 N ATOM 1532 CA PRO A 99 7.062 9.342 7.297 1.00 0.00 C ATOM 1533 C PRO A 99 8.318 8.837 8.009 1.00 0.00 C ATOM 1534 O PRO A 99 8.877 7.807 7.635 1.00 0.00 O ATOM 1535 CB PRO A 99 5.778 8.781 7.886 1.00 0.00 C ATOM 1536 CG PRO A 99 5.326 7.686 6.934 1.00 0.00 C ATOM 1537 CD PRO A 99 6.114 7.836 5.643 1.00 0.00 C ATOM 0 HA PRO A 99 7.098 10.425 7.413 1.00 0.00 H new ATOM 0 HB2 PRO A 99 5.949 8.383 8.886 1.00 0.00 H new ATOM 0 HB3 PRO A 99 5.018 9.557 7.977 1.00 0.00 H new ATOM 0 HG2 PRO A 99 5.497 6.703 7.374 1.00 0.00 H new ATOM 0 HG3 PRO A 99 4.256 7.766 6.740 1.00 0.00 H new ATOM 0 HD2 PRO A 99 6.640 6.915 5.391 1.00 0.00 H new ATOM 0 HD3 PRO A 99 5.459 8.069 4.804 1.00 0.00 H new ATOM 1545 N ASP A 100 8.725 9.584 9.024 1.00 0.00 N ATOM 1546 CA ASP A 100 9.904 9.225 9.793 1.00 0.00 C ATOM 1547 C ASP A 100 9.816 7.751 10.196 1.00 0.00 C ATOM 1548 O ASP A 100 10.837 7.080 10.337 1.00 0.00 O ATOM 1549 CB ASP A 100 10.004 10.060 11.072 1.00 0.00 C ATOM 1550 CG ASP A 100 11.142 11.081 11.089 1.00 0.00 C ATOM 1551 OD1 ASP A 100 12.291 10.649 11.329 1.00 0.00 O ATOM 1552 OD2 ASP A 100 10.839 12.273 10.861 1.00 0.00 O ATOM 0 H ASP A 100 8.259 10.437 9.332 1.00 0.00 H new ATOM 0 HA ASP A 100 10.780 9.411 9.172 1.00 0.00 H new ATOM 0 HB2 ASP A 100 9.061 10.587 11.219 1.00 0.00 H new ATOM 0 HB3 ASP A 100 10.128 9.386 11.920 1.00 0.00 H new ATOM 1557 N ASN A 101 8.586 7.292 10.370 1.00 0.00 N ATOM 1558 CA ASN A 101 8.350 5.911 10.754 1.00 0.00 C ATOM 1559 C ASN A 101 8.999 4.983 9.726 1.00 0.00 C ATOM 1560 O ASN A 101 9.384 3.860 10.053 1.00 0.00 O ATOM 1561 CB ASN A 101 6.853 5.597 10.796 1.00 0.00 C ATOM 1562 CG ASN A 101 6.305 5.724 12.219 1.00 0.00 C ATOM 1563 OD1 ASN A 101 6.930 6.283 13.105 1.00 0.00 O ATOM 1564 ND2 ASN A 101 5.105 5.176 12.387 1.00 0.00 N ATOM 0 H ASN A 101 7.742 7.852 10.252 1.00 0.00 H new ATOM 0 HA ASN A 101 8.777 5.760 11.745 1.00 0.00 H new ATOM 0 HB2 ASN A 101 6.317 6.277 10.134 1.00 0.00 H new ATOM 0 HB3 ASN A 101 6.679 4.587 10.424 1.00 0.00 H new ATOM 0 HD21 ASN A 101 4.653 5.209 13.301 1.00 0.00 H new ATOM 0 HD22 ASN A 101 4.637 4.723 11.602 1.00 0.00 H new ATOM 1571 N TRP A 102 9.101 5.484 8.505 1.00 0.00 N ATOM 1572 CA TRP A 102 9.698 4.714 7.426 1.00 0.00 C ATOM 1573 C TRP A 102 11.150 5.167 7.268 1.00 0.00 C ATOM 1574 O TRP A 102 12.074 4.369 7.423 1.00 0.00 O ATOM 1575 CB TRP A 102 8.885 4.854 6.138 1.00 0.00 C ATOM 1576 CG TRP A 102 7.430 4.394 6.267 1.00 0.00 C ATOM 1577 CD1 TRP A 102 6.707 4.249 7.384 1.00 0.00 C ATOM 1578 CD2 TRP A 102 6.548 4.022 5.187 1.00 0.00 C ATOM 1579 NE1 TRP A 102 5.427 3.813 7.106 1.00 0.00 N ATOM 1580 CE2 TRP A 102 5.328 3.671 5.727 1.00 0.00 C ATOM 1581 CE3 TRP A 102 6.773 3.984 3.799 1.00 0.00 C ATOM 1582 CZ2 TRP A 102 4.237 3.256 4.954 1.00 0.00 C ATOM 1583 CZ3 TRP A 102 5.673 3.568 3.040 1.00 0.00 C ATOM 1584 CH2 TRP A 102 4.439 3.210 3.568 1.00 0.00 C ATOM 0 H TRP A 102 8.780 6.415 8.238 1.00 0.00 H new ATOM 0 HA TRP A 102 9.689 3.650 7.662 1.00 0.00 H new ATOM 0 HB2 TRP A 102 8.899 5.897 5.823 1.00 0.00 H new ATOM 0 HB3 TRP A 102 9.369 4.277 5.350 1.00 0.00 H new ATOM 0 HD1 TRP A 102 7.078 4.448 8.378 1.00 0.00 H new ATOM 0 HE1 TRP A 102 4.690 3.629 7.787 1.00 0.00 H new ATOM 0 HE3 TRP A 102 7.719 4.254 3.354 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 3.292 2.986 5.401 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 5.792 3.522 1.968 1.00 0.00 H new ATOM 0 HH2 TRP A 102 3.639 2.898 2.913 1.00 0.00 H new ATOM 1595 N LYS A 103 11.308 6.447 6.962 1.00 0.00 N ATOM 1596 CA LYS A 103 12.632 7.016 6.782 1.00 0.00 C ATOM 1597 C LYS A 103 13.426 6.149 5.801 1.00 0.00 C ATOM 1598 O LYS A 103 14.266 5.350 6.213 1.00 0.00 O ATOM 1599 CB LYS A 103 13.323 7.205 8.134 1.00 0.00 C ATOM 1600 CG LYS A 103 14.123 8.508 8.163 1.00 0.00 C ATOM 1601 CD LYS A 103 15.482 8.333 7.483 1.00 0.00 C ATOM 1602 CE LYS A 103 16.498 7.706 8.441 1.00 0.00 C ATOM 1603 NZ LYS A 103 17.835 8.308 8.245 1.00 0.00 N ATOM 0 H LYS A 103 10.540 7.106 6.834 1.00 0.00 H new ATOM 0 HA LYS A 103 12.562 8.012 6.344 1.00 0.00 H new ATOM 0 HB2 LYS A 103 12.578 7.214 8.929 1.00 0.00 H new ATOM 0 HB3 LYS A 103 13.986 6.362 8.328 1.00 0.00 H new ATOM 0 HG2 LYS A 103 13.560 9.295 7.662 1.00 0.00 H new ATOM 0 HG3 LYS A 103 14.267 8.827 9.195 1.00 0.00 H new ATOM 0 HD2 LYS A 103 15.372 7.703 6.600 1.00 0.00 H new ATOM 0 HD3 LYS A 103 15.849 9.301 7.141 1.00 0.00 H new ATOM 0 HE2 LYS A 103 16.174 7.853 9.471 1.00 0.00 H new ATOM 0 HE3 LYS A 103 16.549 6.630 8.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 18.556 7.558 8.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 17.857 8.816 7.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 18.033 8.973 9.020 1.00 0.00 H new ATOM 1617 N MET A 104 13.131 6.336 4.523 1.00 0.00 N ATOM 1618 CA MET A 104 13.806 5.581 3.481 1.00 0.00 C ATOM 1619 C MET A 104 15.032 6.337 2.964 1.00 0.00 C ATOM 1620 O MET A 104 15.004 6.900 1.870 1.00 0.00 O ATOM 1621 CB MET A 104 12.837 5.327 2.325 1.00 0.00 C ATOM 1622 CG MET A 104 11.970 4.097 2.597 1.00 0.00 C ATOM 1623 SD MET A 104 11.292 3.477 1.067 1.00 0.00 S ATOM 1624 CE MET A 104 10.134 2.277 1.705 1.00 0.00 C ATOM 0 H MET A 104 12.434 6.999 4.185 1.00 0.00 H new ATOM 0 HA MET A 104 14.138 4.632 3.902 1.00 0.00 H new ATOM 0 HB2 MET A 104 12.201 6.200 2.181 1.00 0.00 H new ATOM 0 HB3 MET A 104 13.397 5.184 1.401 1.00 0.00 H new ATOM 0 HG2 MET A 104 12.565 3.322 3.081 1.00 0.00 H new ATOM 0 HG3 MET A 104 11.164 4.355 3.283 1.00 0.00 H new ATOM 0 HE1 MET A 104 9.581 1.830 0.879 1.00 0.00 H new ATOM 0 HE2 MET A 104 10.676 1.499 2.243 1.00 0.00 H new ATOM 0 HE3 MET A 104 9.437 2.769 2.384 1.00 0.00 H new ATOM 1634 N ASP A 105 16.080 6.326 3.774 1.00 0.00 N ATOM 1635 CA ASP A 105 17.314 7.003 3.412 1.00 0.00 C ATOM 1636 C ASP A 105 18.367 5.963 3.022 1.00 0.00 C ATOM 1637 O ASP A 105 18.922 6.017 1.926 1.00 0.00 O ATOM 1638 CB ASP A 105 17.863 7.812 4.588 1.00 0.00 C ATOM 1639 CG ASP A 105 17.856 9.330 4.388 1.00 0.00 C ATOM 1640 OD1 ASP A 105 17.431 9.756 3.292 1.00 0.00 O ATOM 1641 OD2 ASP A 105 18.275 10.029 5.335 1.00 0.00 O ATOM 0 H ASP A 105 16.100 5.859 4.680 1.00 0.00 H new ATOM 0 HA ASP A 105 17.098 7.674 2.581 1.00 0.00 H new ATOM 0 HB2 ASP A 105 17.279 7.575 5.477 1.00 0.00 H new ATOM 0 HB3 ASP A 105 18.886 7.491 4.784 1.00 0.00 H new ATOM 1646 N ILE A 106 18.608 5.039 3.940 1.00 0.00 N ATOM 1647 CA ILE A 106 19.583 3.988 3.706 1.00 0.00 C ATOM 1648 C ILE A 106 18.919 2.843 2.937 1.00 0.00 C ATOM 1649 O ILE A 106 19.601 2.034 2.311 1.00 0.00 O ATOM 1650 CB ILE A 106 20.227 3.551 5.024 1.00 0.00 C ATOM 1651 CG1 ILE A 106 21.093 2.306 4.824 1.00 0.00 C ATOM 1652 CG2 ILE A 106 19.168 3.345 6.109 1.00 0.00 C ATOM 1653 CD1 ILE A 106 22.344 2.362 5.703 1.00 0.00 C ATOM 0 H ILE A 106 18.145 4.996 4.848 1.00 0.00 H new ATOM 0 HA ILE A 106 20.399 4.358 3.086 1.00 0.00 H new ATOM 0 HB ILE A 106 20.886 4.350 5.365 1.00 0.00 H new ATOM 0 HG12 ILE A 106 20.515 1.414 5.064 1.00 0.00 H new ATOM 0 HG13 ILE A 106 21.383 2.225 3.777 1.00 0.00 H new ATOM 0 HG21 ILE A 106 19.652 3.035 7.035 1.00 0.00 H new ATOM 0 HG22 ILE A 106 18.631 4.279 6.275 1.00 0.00 H new ATOM 0 HG23 ILE A 106 18.466 2.574 5.791 1.00 0.00 H new ATOM 0 HD11 ILE A 106 22.942 1.465 5.542 1.00 0.00 H new ATOM 0 HD12 ILE A 106 22.932 3.242 5.443 1.00 0.00 H new ATOM 0 HD13 ILE A 106 22.050 2.418 6.751 1.00 0.00 H new ATOM 1665 N SER A 107 17.597 2.813 3.009 1.00 0.00 N ATOM 1666 CA SER A 107 16.833 1.783 2.327 1.00 0.00 C ATOM 1667 C SER A 107 17.023 1.906 0.814 1.00 0.00 C ATOM 1668 O SER A 107 16.706 0.981 0.068 1.00 0.00 O ATOM 1669 CB SER A 107 15.348 1.870 2.685 1.00 0.00 C ATOM 1670 OG SER A 107 14.720 3.000 2.085 1.00 0.00 O ATOM 0 H SER A 107 17.035 3.486 3.530 1.00 0.00 H new ATOM 0 HA SER A 107 17.201 0.811 2.655 1.00 0.00 H new ATOM 0 HB2 SER A 107 14.843 0.960 2.361 1.00 0.00 H new ATOM 0 HB3 SER A 107 15.239 1.927 3.768 1.00 0.00 H new ATOM 0 HG SER A 107 13.995 2.698 1.499 1.00 0.00 H new ATOM 1676 N GLU A 108 17.539 3.055 0.406 1.00 0.00 N ATOM 1677 CA GLU A 108 17.775 3.312 -1.005 1.00 0.00 C ATOM 1678 C GLU A 108 19.273 3.269 -1.309 1.00 0.00 C ATOM 1679 O GLU A 108 19.673 3.007 -2.442 1.00 0.00 O ATOM 1680 CB GLU A 108 17.167 4.650 -1.429 1.00 0.00 C ATOM 1681 CG GLU A 108 15.717 4.474 -1.884 1.00 0.00 C ATOM 1682 CD GLU A 108 15.003 5.825 -1.971 1.00 0.00 C ATOM 1683 OE1 GLU A 108 15.126 6.596 -0.995 1.00 0.00 O ATOM 1684 OE2 GLU A 108 14.350 6.055 -3.012 1.00 0.00 O ATOM 0 H GLU A 108 17.801 3.820 1.028 1.00 0.00 H new ATOM 0 HA GLU A 108 17.284 2.529 -1.583 1.00 0.00 H new ATOM 0 HB2 GLU A 108 17.208 5.352 -0.596 1.00 0.00 H new ATOM 0 HB3 GLU A 108 17.756 5.081 -2.239 1.00 0.00 H new ATOM 0 HG2 GLU A 108 15.694 3.983 -2.857 1.00 0.00 H new ATOM 0 HG3 GLU A 108 15.189 3.824 -1.186 1.00 0.00 H new ATOM 1691 N ILE A 109 20.062 3.529 -0.276 1.00 0.00 N ATOM 1692 CA ILE A 109 21.508 3.524 -0.420 1.00 0.00 C ATOM 1693 C ILE A 109 21.992 2.086 -0.617 1.00 0.00 C ATOM 1694 O ILE A 109 23.115 1.861 -1.062 1.00 0.00 O ATOM 1695 CB ILE A 109 22.166 4.237 0.764 1.00 0.00 C ATOM 1696 CG1 ILE A 109 21.871 5.738 0.732 1.00 0.00 C ATOM 1697 CG2 ILE A 109 23.668 3.948 0.812 1.00 0.00 C ATOM 1698 CD1 ILE A 109 22.545 6.454 1.905 1.00 0.00 C ATOM 0 H ILE A 109 19.727 3.744 0.663 1.00 0.00 H new ATOM 0 HA ILE A 109 21.805 4.085 -1.306 1.00 0.00 H new ATOM 0 HB ILE A 109 21.733 3.844 1.684 1.00 0.00 H new ATOM 0 HG12 ILE A 109 22.223 6.162 -0.208 1.00 0.00 H new ATOM 0 HG13 ILE A 109 20.794 5.902 0.772 1.00 0.00 H new ATOM 0 HG21 ILE A 109 24.111 4.466 1.662 1.00 0.00 H new ATOM 0 HG22 ILE A 109 23.829 2.875 0.917 1.00 0.00 H new ATOM 0 HG23 ILE A 109 24.135 4.296 -0.109 1.00 0.00 H new ATOM 0 HD11 ILE A 109 22.320 7.519 1.859 1.00 0.00 H new ATOM 0 HD12 ILE A 109 22.172 6.045 2.844 1.00 0.00 H new ATOM 0 HD13 ILE A 109 23.624 6.309 1.849 1.00 0.00 H new ATOM 1710 N LEU A 110 21.117 1.150 -0.277 1.00 0.00 N ATOM 1711 CA LEU A 110 21.441 -0.260 -0.411 1.00 0.00 C ATOM 1712 C LEU A 110 22.097 -0.501 -1.772 1.00 0.00 C ATOM 1713 O LEU A 110 23.260 -0.895 -1.844 1.00 0.00 O ATOM 1714 CB LEU A 110 20.200 -1.121 -0.166 1.00 0.00 C ATOM 1715 CG LEU A 110 20.052 -1.698 1.244 1.00 0.00 C ATOM 1716 CD1 LEU A 110 18.594 -2.052 1.540 1.00 0.00 C ATOM 1717 CD2 LEU A 110 20.985 -2.893 1.449 1.00 0.00 C ATOM 0 H LEU A 110 20.185 1.341 0.091 1.00 0.00 H new ATOM 0 HA LEU A 110 22.163 -0.558 0.349 1.00 0.00 H new ATOM 0 HB2 LEU A 110 19.317 -0.521 -0.386 1.00 0.00 H new ATOM 0 HB3 LEU A 110 20.210 -1.948 -0.876 1.00 0.00 H new ATOM 0 HG LEU A 110 20.350 -0.932 1.960 1.00 0.00 H new ATOM 0 HD11 LEU A 110 18.516 -2.460 2.548 1.00 0.00 H new ATOM 0 HD12 LEU A 110 17.979 -1.155 1.463 1.00 0.00 H new ATOM 0 HD13 LEU A 110 18.246 -2.793 0.821 1.00 0.00 H new ATOM 0 HD21 LEU A 110 20.860 -3.284 2.459 1.00 0.00 H new ATOM 0 HD22 LEU A 110 20.743 -3.672 0.726 1.00 0.00 H new ATOM 0 HD23 LEU A 110 22.018 -2.576 1.308 1.00 0.00 H new ATOM 1729 N GLU A 111 21.322 -0.256 -2.818 1.00 0.00 N ATOM 1730 CA GLU A 111 21.813 -0.441 -4.174 1.00 0.00 C ATOM 1731 C GLU A 111 20.722 -0.088 -5.187 1.00 0.00 C ATOM 1732 O GLU A 111 20.907 0.794 -6.022 1.00 0.00 O ATOM 1733 CB GLU A 111 22.315 -1.871 -4.384 1.00 0.00 C ATOM 1734 CG GLU A 111 23.768 -1.877 -4.862 1.00 0.00 C ATOM 1735 CD GLU A 111 24.363 -3.285 -4.790 1.00 0.00 C ATOM 1736 OE1 GLU A 111 24.236 -4.007 -5.803 1.00 0.00 O ATOM 1737 OE2 GLU A 111 24.931 -3.608 -3.725 1.00 0.00 O ATOM 0 H GLU A 111 20.357 0.069 -2.754 1.00 0.00 H new ATOM 0 HA GLU A 111 22.656 0.232 -4.330 1.00 0.00 H new ATOM 0 HB2 GLU A 111 22.233 -2.430 -3.452 1.00 0.00 H new ATOM 0 HB3 GLU A 111 21.686 -2.377 -5.116 1.00 0.00 H new ATOM 0 HG2 GLU A 111 23.819 -1.509 -5.887 1.00 0.00 H new ATOM 0 HG3 GLU A 111 24.359 -1.197 -4.249 1.00 0.00 H new ATOM 1744 N SER A 112 19.608 -0.797 -5.078 1.00 0.00 N ATOM 1745 CA SER A 112 18.486 -0.569 -5.974 1.00 0.00 C ATOM 1746 C SER A 112 17.425 -1.653 -5.769 1.00 0.00 C ATOM 1747 O SER A 112 16.279 -1.349 -5.440 1.00 0.00 O ATOM 1748 CB SER A 112 18.943 -0.545 -7.434 1.00 0.00 C ATOM 1749 OG SER A 112 19.210 0.780 -7.887 1.00 0.00 O ATOM 0 H SER A 112 19.458 -1.529 -4.384 1.00 0.00 H new ATOM 0 HA SER A 112 18.054 0.404 -5.740 1.00 0.00 H new ATOM 0 HB2 SER A 112 19.841 -1.154 -7.543 1.00 0.00 H new ATOM 0 HB3 SER A 112 18.174 -0.995 -8.062 1.00 0.00 H new ATOM 0 HG SER A 112 19.726 1.261 -7.206 1.00 0.00 H new ATOM 1755 N GLY A 113 17.844 -2.892 -5.972 1.00 0.00 N ATOM 1756 CA GLY A 113 16.943 -4.022 -5.813 1.00 0.00 C ATOM 1757 C GLY A 113 16.942 -4.902 -7.065 1.00 0.00 C ATOM 1758 O GLY A 113 17.416 -4.486 -8.121 1.00 0.00 O ATOM 0 H GLY A 113 18.795 -3.140 -6.245 1.00 0.00 H new ATOM 0 HA2 GLY A 113 17.245 -4.613 -4.949 1.00 0.00 H new ATOM 0 HA3 GLY A 113 15.933 -3.662 -5.616 1.00 0.00 H new ATOM 1762 N PRO A 114 16.389 -6.134 -6.900 1.00 0.00 N ATOM 1763 CA PRO A 114 16.321 -7.076 -8.004 1.00 0.00 C ATOM 1764 C PRO A 114 15.225 -6.680 -8.996 1.00 0.00 C ATOM 1765 O PRO A 114 14.043 -6.696 -8.659 1.00 0.00 O ATOM 1766 CB PRO A 114 16.072 -8.427 -7.353 1.00 0.00 C ATOM 1767 CG PRO A 114 15.550 -8.128 -5.958 1.00 0.00 C ATOM 1768 CD PRO A 114 15.819 -6.661 -5.664 1.00 0.00 C ATOM 0 HA PRO A 114 17.236 -7.096 -8.597 1.00 0.00 H new ATOM 0 HB2 PRO A 114 15.348 -9.008 -7.924 1.00 0.00 H new ATOM 0 HB3 PRO A 114 16.989 -9.014 -7.309 1.00 0.00 H new ATOM 0 HG2 PRO A 114 14.483 -8.340 -5.896 1.00 0.00 H new ATOM 0 HG3 PRO A 114 16.044 -8.762 -5.222 1.00 0.00 H new ATOM 0 HD2 PRO A 114 14.902 -6.136 -5.396 1.00 0.00 H new ATOM 0 HD3 PRO A 114 16.509 -6.545 -4.828 1.00 0.00 H new ATOM 1776 N SER A 115 15.659 -6.332 -10.199 1.00 0.00 N ATOM 1777 CA SER A 115 14.729 -5.932 -11.242 1.00 0.00 C ATOM 1778 C SER A 115 15.414 -6.005 -12.608 1.00 0.00 C ATOM 1779 O SER A 115 15.011 -6.787 -13.469 1.00 0.00 O ATOM 1780 CB SER A 115 14.195 -4.521 -10.991 1.00 0.00 C ATOM 1781 OG SER A 115 15.239 -3.553 -10.949 1.00 0.00 O ATOM 0 H SER A 115 16.641 -6.319 -10.474 1.00 0.00 H new ATOM 0 HA SER A 115 13.883 -6.619 -11.229 1.00 0.00 H new ATOM 0 HB2 SER A 115 13.487 -4.257 -11.777 1.00 0.00 H new ATOM 0 HB3 SER A 115 13.647 -4.503 -10.049 1.00 0.00 H new ATOM 0 HG SER A 115 14.856 -2.665 -10.788 1.00 0.00 H new ATOM 1787 N SER A 116 16.439 -5.180 -12.766 1.00 0.00 N ATOM 1788 CA SER A 116 17.183 -5.141 -14.014 1.00 0.00 C ATOM 1789 C SER A 116 18.576 -4.557 -13.774 1.00 0.00 C ATOM 1790 O SER A 116 18.760 -3.722 -12.889 1.00 0.00 O ATOM 1791 CB SER A 116 16.440 -4.325 -15.074 1.00 0.00 C ATOM 1792 OG SER A 116 16.183 -5.085 -16.250 1.00 0.00 O ATOM 0 H SER A 116 16.772 -4.533 -12.051 1.00 0.00 H new ATOM 0 HA SER A 116 17.282 -6.161 -14.385 1.00 0.00 H new ATOM 0 HB2 SER A 116 15.497 -3.967 -14.661 1.00 0.00 H new ATOM 0 HB3 SER A 116 17.029 -3.445 -15.333 1.00 0.00 H new ATOM 0 HG SER A 116 15.706 -4.529 -16.901 1.00 0.00 H new ATOM 1798 N GLY A 117 19.524 -5.018 -14.577 1.00 0.00 N ATOM 1799 CA GLY A 117 20.895 -4.551 -14.463 1.00 0.00 C ATOM 1800 C GLY A 117 20.957 -3.022 -14.482 1.00 0.00 C ATOM 1801 O GLY A 117 19.943 -2.359 -14.692 1.00 0.00 O ATOM 0 H GLY A 117 19.369 -5.711 -15.310 1.00 0.00 H new ATOM 0 HA2 GLY A 117 21.335 -4.925 -13.538 1.00 0.00 H new ATOM 0 HA3 GLY A 117 21.489 -4.953 -15.284 1.00 0.00 H new TER 1805 GLY A 117