USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 759 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 -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 66 MET CE :methyl -120:sc= -3.89 (180deg=-8.61!) USER MOD Set 2.2: A 77 GLN : amide:sc= -3.94! C(o=-7.8!,f=-6.8!) USER MOD Set 3.1: A 27 ASN : amide:sc= -2.8 K(o=-3.7,f=-10!) USER MOD Set 3.2: A 71 HIS : no HE2:sc= -0.882 K(o=-3.7,f=-9.5!) USER MOD Set 4.1: A 62 ASN : amide:sc= 0.0896 X(o=0.16,f=-0.22) USER MOD Set 4.2: A 81 SER OG : rot 92:sc= 0.0715 USER MOD Set 5.1: A 6 THR OG1 : rot -104:sc= 0.774 USER MOD Set 5.2: A 60 MET CE :methyl 156:sc= -0.243 (180deg=-1.27!) USER MOD Set 5.3: A 88 THR OG1 : rot 69:sc= -1.63! USER MOD Set 6.1: A -7 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 55 ASN : amide:sc= -0.875 K(o=-0.95,f=-0.17) USER MOD Set 6.3: A 93 LYS NZ :NH3+ 170:sc= -0.08 (180deg=0) USER MOD Set 7.1: A 22 SER OG : rot -113:sc= -0.415 USER MOD Set 7.2: A 40 SER OG : rot 131:sc= 1.11 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 5 HIS : no HD1:sc= -0.183 X(o=-0.18,f=-0.19) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A -3 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HE2:sc= -2.2 X(o=-2.2,f=-2.7!) USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 46:sc= 0.478 USER MOD Single : A 36 SER OG : rot 34:sc= 0.00138 USER MOD Single : A 44 LYS NZ :NH3+ -162:sc= -0.0628 (180deg=-0.462) USER MOD Single : A 51 GLN : amide:sc= -1.54 K(o=-1.5,f=-7!) USER MOD Single : A 53 GLN : amide:sc= -0.354 K(o=-0.35,f=-2.5!) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0.27) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.002) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ -168:sc= -0.0171 (180deg=-0.264) USER MOD Single : A 84 ASN : amide:sc= -1.25 X(o=-1.2,f=-1.5!) USER MOD Single : A 86 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.19) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -7 11.197 11.592 -0.820 1.00 0.00 N ATOM 2 CA GLY A -7 10.804 12.589 -1.855 1.00 0.00 C ATOM 3 C GLY A -7 9.664 13.480 -1.398 1.00 0.00 C ATOM 4 O GLY A -7 8.507 13.231 -1.734 1.00 0.00 O ATOM 0 H1 GLY A -7 11.979 11.008 -1.180 1.00 0.00 H new ATOM 0 H2 GLY A -7 11.503 12.088 0.041 1.00 0.00 H new ATOM 0 H3 GLY A -7 10.384 10.983 -0.598 1.00 0.00 H new ATOM 0 HA2 GLY A -7 11.666 13.207 -2.106 1.00 0.00 H new ATOM 0 HA3 GLY A -7 10.510 12.067 -2.766 1.00 0.00 H new ATOM 10 N PRO A -6 9.964 14.539 -0.625 1.00 0.00 N ATOM 11 CA PRO A -6 8.943 15.466 -0.128 1.00 0.00 C ATOM 12 C PRO A -6 8.353 16.328 -1.238 1.00 0.00 C ATOM 13 O PRO A -6 7.204 16.763 -1.156 1.00 0.00 O ATOM 14 CB PRO A -6 9.708 16.333 0.874 1.00 0.00 C ATOM 15 CG PRO A -6 11.123 16.282 0.414 1.00 0.00 C ATOM 16 CD PRO A -6 11.318 14.913 -0.177 1.00 0.00 C ATOM 0 HA PRO A -6 8.092 14.941 0.306 1.00 0.00 H new ATOM 0 HB2 PRO A -6 9.331 17.356 0.882 1.00 0.00 H new ATOM 0 HB3 PRO A -6 9.607 15.948 1.889 1.00 0.00 H new ATOM 0 HG2 PRO A -6 11.321 17.058 -0.325 1.00 0.00 H new ATOM 0 HG3 PRO A -6 11.809 16.450 1.244 1.00 0.00 H new ATOM 0 HD2 PRO A -6 12.025 14.930 -1.006 1.00 0.00 H new ATOM 0 HD3 PRO A -6 11.707 14.209 0.559 1.00 0.00 H new ATOM 24 N LEU A -5 9.146 16.574 -2.275 1.00 0.00 N ATOM 25 CA LEU A -5 8.702 17.386 -3.402 1.00 0.00 C ATOM 26 C LEU A -5 9.767 17.433 -4.494 1.00 0.00 C ATOM 27 O LEU A -5 10.939 17.691 -4.219 1.00 0.00 O ATOM 28 CB LEU A -5 8.370 18.804 -2.936 1.00 0.00 C ATOM 29 CG LEU A -5 9.501 19.524 -2.194 1.00 0.00 C ATOM 30 CD1 LEU A -5 10.031 20.685 -3.021 1.00 0.00 C ATOM 31 CD2 LEU A -5 9.024 20.011 -0.834 1.00 0.00 C ATOM 0 H LEU A -5 10.100 16.223 -2.359 1.00 0.00 H new ATOM 0 HA LEU A -5 7.804 16.927 -3.816 1.00 0.00 H new ATOM 0 HB2 LEU A -5 8.089 19.399 -3.805 1.00 0.00 H new ATOM 0 HB3 LEU A -5 7.498 18.761 -2.284 1.00 0.00 H new ATOM 0 HG LEU A -5 10.314 18.815 -2.039 1.00 0.00 H new ATOM 0 HD11 LEU A -5 10.833 21.183 -2.477 1.00 0.00 H new ATOM 0 HD12 LEU A -5 10.415 20.310 -3.970 1.00 0.00 H new ATOM 0 HD13 LEU A -5 9.226 21.395 -3.210 1.00 0.00 H new ATOM 0 HD21 LEU A -5 9.841 20.520 -0.322 1.00 0.00 H new ATOM 0 HD22 LEU A -5 8.192 20.703 -0.966 1.00 0.00 H new ATOM 0 HD23 LEU A -5 8.696 19.160 -0.237 1.00 0.00 H new ATOM 43 N GLY A -4 9.352 17.181 -5.730 1.00 0.00 N ATOM 44 CA GLY A -4 10.284 17.200 -6.843 1.00 0.00 C ATOM 45 C GLY A -4 9.755 17.972 -8.039 1.00 0.00 C ATOM 46 O GLY A -4 10.301 17.873 -9.138 1.00 0.00 O ATOM 0 H GLY A -4 8.388 16.964 -5.982 1.00 0.00 H new ATOM 0 HA2 GLY A -4 11.224 17.644 -6.516 1.00 0.00 H new ATOM 0 HA3 GLY A -4 10.503 16.176 -7.145 1.00 0.00 H new ATOM 50 N SER A -3 8.691 18.744 -7.827 1.00 0.00 N ATOM 51 CA SER A -3 8.094 19.533 -8.899 1.00 0.00 C ATOM 52 C SER A -3 7.705 18.649 -10.081 1.00 0.00 C ATOM 53 O SER A -3 7.728 19.088 -11.231 1.00 0.00 O ATOM 54 CB SER A -3 9.065 20.621 -9.360 1.00 0.00 C ATOM 55 OG SER A -3 8.379 21.824 -9.662 1.00 0.00 O ATOM 0 H SER A -3 8.226 18.839 -6.924 1.00 0.00 H new ATOM 0 HA SER A -3 7.190 20.001 -8.509 1.00 0.00 H new ATOM 0 HB2 SER A -3 9.804 20.806 -8.581 1.00 0.00 H new ATOM 0 HB3 SER A -3 9.609 20.278 -10.240 1.00 0.00 H new ATOM 0 HG SER A -3 9.023 22.503 -9.953 1.00 0.00 H new ATOM 61 N ASP A -2 7.348 17.403 -9.790 1.00 0.00 N ATOM 62 CA ASP A -2 6.955 16.459 -10.830 1.00 0.00 C ATOM 63 C ASP A -2 5.681 15.716 -10.440 1.00 0.00 C ATOM 64 O ASP A -2 4.644 15.859 -11.088 1.00 0.00 O ATOM 65 CB ASP A -2 8.082 15.458 -11.092 1.00 0.00 C ATOM 66 CG ASP A -2 8.994 15.897 -12.220 1.00 0.00 C ATOM 67 OD1 ASP A -2 9.453 17.059 -12.195 1.00 0.00 O ATOM 68 OD2 ASP A -2 9.252 15.079 -13.128 1.00 0.00 O ATOM 0 H ASP A -2 7.323 17.023 -8.844 1.00 0.00 H new ATOM 0 HA ASP A -2 6.760 17.024 -11.742 1.00 0.00 H new ATOM 0 HB2 ASP A -2 8.669 15.330 -10.183 1.00 0.00 H new ATOM 0 HB3 ASP A -2 7.652 14.486 -11.333 1.00 0.00 H new ATOM 73 N HIS A -1 5.765 14.924 -9.376 1.00 0.00 N ATOM 74 CA HIS A -1 4.619 14.159 -8.899 1.00 0.00 C ATOM 75 C HIS A -1 4.139 13.178 -9.964 1.00 0.00 C ATOM 76 O HIS A -1 2.950 13.118 -10.280 1.00 0.00 O ATOM 77 CB HIS A -1 3.480 15.101 -8.502 1.00 0.00 C ATOM 78 CG HIS A -1 3.795 15.952 -7.310 1.00 0.00 C ATOM 79 ND1 HIS A -1 3.834 15.460 -6.023 1.00 0.00 N ATOM 80 CD2 HIS A -1 4.089 17.271 -7.217 1.00 0.00 C ATOM 81 CE1 HIS A -1 4.136 16.439 -5.188 1.00 0.00 C ATOM 82 NE2 HIS A -1 4.296 17.547 -5.887 1.00 0.00 N ATOM 0 H HIS A -1 6.615 14.795 -8.828 1.00 0.00 H new ATOM 0 HA HIS A -1 4.931 13.590 -8.023 1.00 0.00 H new ATOM 0 HB2 HIS A -1 3.243 15.747 -9.347 1.00 0.00 H new ATOM 0 HB3 HIS A -1 2.588 14.511 -8.291 1.00 0.00 H new ATOM 0 HD2 HIS A -1 4.149 17.974 -8.035 1.00 0.00 H new ATOM 0 HE1 HIS A -1 4.235 16.348 -4.116 1.00 0.00 H new ATOM 0 HE2 HIS A -1 4.535 18.461 -5.502 1.00 0.00 H new ATOM 91 N ILE A 1 5.071 12.405 -10.511 1.00 0.00 N ATOM 92 CA ILE A 1 4.743 11.422 -11.537 1.00 0.00 C ATOM 93 C ILE A 1 4.633 10.026 -10.934 1.00 0.00 C ATOM 94 O ILE A 1 5.586 9.515 -10.349 1.00 0.00 O ATOM 95 CB ILE A 1 5.792 11.404 -12.667 1.00 0.00 C ATOM 96 CG1 ILE A 1 7.204 11.294 -12.087 1.00 0.00 C ATOM 97 CG2 ILE A 1 5.664 12.651 -13.528 1.00 0.00 C ATOM 98 CD1 ILE A 1 8.283 11.197 -13.143 1.00 0.00 C ATOM 0 H ILE A 1 6.059 12.440 -10.261 1.00 0.00 H new ATOM 0 HA ILE A 1 3.782 11.714 -11.960 1.00 0.00 H new ATOM 0 HB ILE A 1 5.610 10.531 -13.294 1.00 0.00 H new ATOM 0 HG12 ILE A 1 7.399 12.163 -11.458 1.00 0.00 H new ATOM 0 HG13 ILE A 1 7.257 10.416 -11.443 1.00 0.00 H new ATOM 0 HG21 ILE A 1 6.411 12.624 -14.321 1.00 0.00 H new ATOM 0 HG22 ILE A 1 4.668 12.688 -13.969 1.00 0.00 H new ATOM 0 HG23 ILE A 1 5.821 13.536 -12.912 1.00 0.00 H new ATOM 0 HD11 ILE A 1 9.258 11.122 -12.661 1.00 0.00 H new ATOM 0 HD12 ILE A 1 8.113 10.313 -13.757 1.00 0.00 H new ATOM 0 HD13 ILE A 1 8.257 12.086 -13.772 1.00 0.00 H new ATOM 110 N TRP A 2 3.461 9.419 -11.073 1.00 0.00 N ATOM 111 CA TRP A 2 3.223 8.085 -10.535 1.00 0.00 C ATOM 112 C TRP A 2 3.134 7.048 -11.648 1.00 0.00 C ATOM 113 O TRP A 2 2.678 7.343 -12.753 1.00 0.00 O ATOM 114 CB TRP A 2 1.937 8.070 -9.707 1.00 0.00 C ATOM 115 CG TRP A 2 0.711 8.391 -10.507 1.00 0.00 C ATOM 116 CD1 TRP A 2 0.206 7.677 -11.555 1.00 0.00 C ATOM 117 CD2 TRP A 2 -0.164 9.511 -10.325 1.00 0.00 C ATOM 118 NE1 TRP A 2 -0.928 8.284 -12.037 1.00 0.00 N ATOM 119 CE2 TRP A 2 -1.177 9.411 -11.298 1.00 0.00 C ATOM 120 CE3 TRP A 2 -0.189 10.587 -9.433 1.00 0.00 C ATOM 121 CZ2 TRP A 2 -2.204 10.346 -11.403 1.00 0.00 C ATOM 122 CZ3 TRP A 2 -1.209 11.515 -9.539 1.00 0.00 C ATOM 123 CH2 TRP A 2 -2.204 11.389 -10.517 1.00 0.00 C ATOM 0 H TRP A 2 2.660 9.829 -11.554 1.00 0.00 H new ATOM 0 HA TRP A 2 4.067 7.827 -9.895 1.00 0.00 H new ATOM 0 HB2 TRP A 2 1.818 7.087 -9.252 1.00 0.00 H new ATOM 0 HB3 TRP A 2 2.029 8.789 -8.893 1.00 0.00 H new ATOM 0 HD1 TRP A 2 0.635 6.767 -11.948 1.00 0.00 H new ATOM 0 HE1 TRP A 2 -1.493 7.950 -12.818 1.00 0.00 H new ATOM 0 HE3 TRP A 2 0.574 10.692 -8.676 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 -2.972 10.251 -12.156 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 -1.239 12.351 -8.856 1.00 0.00 H new ATOM 0 HH2 TRP A 2 -2.987 12.130 -10.573 1.00 0.00 H new ATOM 134 N GLU A 3 3.568 5.829 -11.344 1.00 0.00 N ATOM 135 CA GLU A 3 3.534 4.739 -12.312 1.00 0.00 C ATOM 136 C GLU A 3 2.904 3.496 -11.694 1.00 0.00 C ATOM 137 O GLU A 3 2.986 3.287 -10.484 1.00 0.00 O ATOM 138 CB GLU A 3 4.948 4.419 -12.804 1.00 0.00 C ATOM 139 CG GLU A 3 5.750 5.650 -13.196 1.00 0.00 C ATOM 140 CD GLU A 3 7.186 5.321 -13.551 1.00 0.00 C ATOM 141 OE1 GLU A 3 7.449 4.168 -13.954 1.00 0.00 O ATOM 142 OE2 GLU A 3 8.048 6.216 -13.427 1.00 0.00 O ATOM 0 H GLU A 3 3.948 5.571 -10.433 1.00 0.00 H new ATOM 0 HA GLU A 3 2.928 5.054 -13.162 1.00 0.00 H new ATOM 0 HB2 GLU A 3 5.483 3.881 -12.021 1.00 0.00 H new ATOM 0 HB3 GLU A 3 4.882 3.750 -13.662 1.00 0.00 H new ATOM 0 HG2 GLU A 3 5.271 6.135 -14.047 1.00 0.00 H new ATOM 0 HG3 GLU A 3 5.738 6.364 -12.373 1.00 0.00 H new ATOM 149 N GLN A 4 2.273 2.675 -12.526 1.00 0.00 N ATOM 150 CA GLN A 4 1.627 1.457 -12.049 1.00 0.00 C ATOM 151 C GLN A 4 2.414 0.219 -12.469 1.00 0.00 C ATOM 152 O GLN A 4 2.719 0.035 -13.646 1.00 0.00 O ATOM 153 CB GLN A 4 0.197 1.371 -12.582 1.00 0.00 C ATOM 154 CG GLN A 4 -0.728 0.541 -11.706 1.00 0.00 C ATOM 155 CD GLN A 4 -2.126 0.424 -12.282 1.00 0.00 C ATOM 156 OE1 GLN A 4 -3.067 1.041 -11.785 1.00 0.00 O ATOM 157 NE2 GLN A 4 -2.268 -0.372 -13.335 1.00 0.00 N ATOM 0 H GLN A 4 2.195 2.830 -13.531 1.00 0.00 H new ATOM 0 HA GLN A 4 1.601 1.494 -10.960 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -0.209 2.378 -12.674 1.00 0.00 H new ATOM 0 HB3 GLN A 4 0.216 0.943 -13.584 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -0.306 -0.456 -11.581 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -0.784 0.990 -10.715 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -1.460 -0.865 -13.715 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -3.186 -0.491 -13.764 1.00 0.00 H new ATOM 166 N HIS A 5 2.733 -0.627 -11.495 1.00 0.00 N ATOM 167 CA HIS A 5 3.481 -1.851 -11.759 1.00 0.00 C ATOM 168 C HIS A 5 2.832 -3.044 -11.062 1.00 0.00 C ATOM 169 O HIS A 5 2.419 -2.950 -9.907 1.00 0.00 O ATOM 170 CB HIS A 5 4.929 -1.699 -11.292 1.00 0.00 C ATOM 171 CG HIS A 5 5.611 -0.485 -11.842 1.00 0.00 C ATOM 172 ND1 HIS A 5 6.294 0.418 -11.054 1.00 0.00 N ATOM 173 CD2 HIS A 5 5.715 -0.025 -13.112 1.00 0.00 C ATOM 174 CE1 HIS A 5 6.786 1.380 -11.814 1.00 0.00 C ATOM 175 NE2 HIS A 5 6.450 1.133 -13.066 1.00 0.00 N ATOM 0 H HIS A 5 2.485 -0.487 -10.515 1.00 0.00 H new ATOM 0 HA HIS A 5 3.471 -2.030 -12.834 1.00 0.00 H new ATOM 0 HB2 HIS A 5 4.948 -1.654 -10.203 1.00 0.00 H new ATOM 0 HB3 HIS A 5 5.491 -2.586 -11.585 1.00 0.00 H new ATOM 0 HD2 HIS A 5 5.297 -0.484 -13.996 1.00 0.00 H new ATOM 0 HE1 HIS A 5 7.364 2.224 -11.469 1.00 0.00 H new ATOM 0 HE2 HIS A 5 6.697 1.710 -13.870 1.00 0.00 H new ATOM 184 N THR A 6 2.749 -4.165 -11.771 1.00 0.00 N ATOM 185 CA THR A 6 2.152 -5.376 -11.219 1.00 0.00 C ATOM 186 C THR A 6 3.198 -6.477 -11.075 1.00 0.00 C ATOM 187 O THR A 6 3.912 -6.797 -12.026 1.00 0.00 O ATOM 188 CB THR A 6 1.007 -5.859 -12.109 1.00 0.00 C ATOM 189 OG1 THR A 6 0.188 -4.773 -12.507 1.00 0.00 O ATOM 190 CG2 THR A 6 0.118 -6.882 -11.435 1.00 0.00 C ATOM 0 H THR A 6 3.087 -4.260 -12.729 1.00 0.00 H new ATOM 0 HA THR A 6 1.757 -5.139 -10.231 1.00 0.00 H new ATOM 0 HB THR A 6 1.486 -6.327 -12.969 1.00 0.00 H new ATOM 0 HG1 THR A 6 -0.643 -4.782 -11.988 1.00 0.00 H new ATOM 0 HG21 THR A 6 -0.674 -7.183 -12.120 1.00 0.00 H new ATOM 0 HG22 THR A 6 0.711 -7.754 -11.160 1.00 0.00 H new ATOM 0 HG23 THR A 6 -0.324 -6.446 -10.539 1.00 0.00 H new ATOM 198 N VAL A 7 3.283 -7.053 -9.880 1.00 0.00 N ATOM 199 CA VAL A 7 4.243 -8.117 -9.613 1.00 0.00 C ATOM 200 C VAL A 7 3.563 -9.328 -8.981 1.00 0.00 C ATOM 201 O VAL A 7 2.581 -9.192 -8.250 1.00 0.00 O ATOM 202 CB VAL A 7 5.377 -7.631 -8.688 1.00 0.00 C ATOM 203 CG1 VAL A 7 4.821 -7.186 -7.343 1.00 0.00 C ATOM 204 CG2 VAL A 7 6.427 -8.719 -8.508 1.00 0.00 C ATOM 0 H VAL A 7 2.699 -6.801 -9.082 1.00 0.00 H new ATOM 0 HA VAL A 7 4.669 -8.408 -10.573 1.00 0.00 H new ATOM 0 HB VAL A 7 5.856 -6.772 -9.157 1.00 0.00 H new ATOM 0 HG11 VAL A 7 5.638 -6.847 -6.706 1.00 0.00 H new ATOM 0 HG12 VAL A 7 4.115 -6.369 -7.493 1.00 0.00 H new ATOM 0 HG13 VAL A 7 4.311 -8.023 -6.865 1.00 0.00 H new ATOM 0 HG21 VAL A 7 7.218 -8.356 -7.852 1.00 0.00 H new ATOM 0 HG22 VAL A 7 5.965 -9.601 -8.065 1.00 0.00 H new ATOM 0 HG23 VAL A 7 6.851 -8.980 -9.478 1.00 0.00 H new ATOM 214 N THR A 8 4.095 -10.513 -9.268 1.00 0.00 N ATOM 215 CA THR A 8 3.546 -11.751 -8.728 1.00 0.00 C ATOM 216 C THR A 8 4.324 -12.198 -7.495 1.00 0.00 C ATOM 217 O THR A 8 5.524 -12.461 -7.568 1.00 0.00 O ATOM 218 CB THR A 8 3.576 -12.851 -9.791 1.00 0.00 C ATOM 219 OG1 THR A 8 3.598 -12.291 -11.091 1.00 0.00 O ATOM 220 CG2 THR A 8 2.390 -13.789 -9.714 1.00 0.00 C ATOM 0 H THR A 8 4.907 -10.641 -9.872 1.00 0.00 H new ATOM 0 HA THR A 8 2.513 -11.565 -8.435 1.00 0.00 H new ATOM 0 HB THR A 8 4.483 -13.421 -9.592 1.00 0.00 H new ATOM 0 HG1 THR A 8 3.619 -13.010 -11.757 1.00 0.00 H new ATOM 0 HG21 THR A 8 2.473 -14.545 -10.495 1.00 0.00 H new ATOM 0 HG22 THR A 8 2.373 -14.275 -8.739 1.00 0.00 H new ATOM 0 HG23 THR A 8 1.469 -13.223 -9.853 1.00 0.00 H new ATOM 228 N LEU A 9 3.634 -12.279 -6.361 1.00 0.00 N ATOM 229 CA LEU A 9 4.263 -12.692 -5.113 1.00 0.00 C ATOM 230 C LEU A 9 3.981 -14.162 -4.817 1.00 0.00 C ATOM 231 O LEU A 9 2.847 -14.541 -4.528 1.00 0.00 O ATOM 232 CB LEU A 9 3.768 -11.824 -3.954 1.00 0.00 C ATOM 233 CG LEU A 9 3.890 -10.315 -4.178 1.00 0.00 C ATOM 234 CD1 LEU A 9 3.426 -9.553 -2.945 1.00 0.00 C ATOM 235 CD2 LEU A 9 5.323 -9.945 -4.530 1.00 0.00 C ATOM 0 H LEU A 9 2.640 -12.064 -6.282 1.00 0.00 H new ATOM 0 HA LEU A 9 5.340 -12.563 -5.222 1.00 0.00 H new ATOM 0 HB2 LEU A 9 2.722 -12.064 -3.761 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.327 -12.089 -3.057 1.00 0.00 H new ATOM 0 HG LEU A 9 3.248 -10.036 -5.013 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.520 -8.482 -3.123 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.384 -9.796 -2.738 1.00 0.00 H new ATOM 0 HD13 LEU A 9 4.041 -9.834 -2.090 1.00 0.00 H new ATOM 0 HD21 LEU A 9 5.393 -8.869 -4.686 1.00 0.00 H new ATOM 0 HD22 LEU A 9 5.985 -10.237 -3.715 1.00 0.00 H new ATOM 0 HD23 LEU A 9 5.619 -10.464 -5.442 1.00 0.00 H new ATOM 247 N HIS A 10 5.024 -14.983 -4.887 1.00 0.00 N ATOM 248 CA HIS A 10 4.892 -16.411 -4.624 1.00 0.00 C ATOM 249 C HIS A 10 4.885 -16.686 -3.124 1.00 0.00 C ATOM 250 O HIS A 10 5.871 -16.430 -2.433 1.00 0.00 O ATOM 251 CB HIS A 10 6.036 -17.179 -5.291 1.00 0.00 C ATOM 252 CG HIS A 10 5.804 -18.656 -5.363 1.00 0.00 C ATOM 253 ND1 HIS A 10 6.306 -19.449 -6.374 1.00 0.00 N ATOM 254 CD2 HIS A 10 5.121 -19.487 -4.540 1.00 0.00 C ATOM 255 CE1 HIS A 10 5.939 -20.701 -6.172 1.00 0.00 C ATOM 256 NE2 HIS A 10 5.221 -20.752 -5.065 1.00 0.00 N ATOM 0 H HIS A 10 5.970 -14.684 -5.124 1.00 0.00 H new ATOM 0 HA HIS A 10 3.944 -16.749 -5.042 1.00 0.00 H new ATOM 0 HB2 HIS A 10 6.182 -16.793 -6.300 1.00 0.00 H new ATOM 0 HB3 HIS A 10 6.958 -16.991 -4.741 1.00 0.00 H new ATOM 0 HD1 HIS A 10 6.872 -19.119 -7.156 1.00 0.00 H new ATOM 0 HD2 HIS A 10 4.596 -19.207 -3.639 1.00 0.00 H new ATOM 0 HE1 HIS A 10 6.184 -21.541 -6.805 1.00 0.00 H new ATOM 265 N ARG A 11 3.767 -17.206 -2.627 1.00 0.00 N ATOM 266 CA ARG A 11 3.631 -17.514 -1.207 1.00 0.00 C ATOM 267 C ARG A 11 4.778 -18.396 -0.720 1.00 0.00 C ATOM 268 O ARG A 11 5.107 -19.404 -1.343 1.00 0.00 O ATOM 269 CB ARG A 11 2.294 -18.209 -0.942 1.00 0.00 C ATOM 270 CG ARG A 11 1.088 -17.397 -1.389 1.00 0.00 C ATOM 271 CD ARG A 11 -0.019 -17.417 -0.348 1.00 0.00 C ATOM 272 NE ARG A 11 -0.600 -16.093 -0.142 1.00 0.00 N ATOM 273 CZ ARG A 11 -1.505 -15.817 0.793 1.00 0.00 C ATOM 274 NH1 ARG A 11 -1.938 -16.770 1.610 1.00 0.00 N ATOM 275 NH2 ARG A 11 -1.980 -14.585 0.912 1.00 0.00 N ATOM 0 H ARG A 11 2.942 -17.423 -3.186 1.00 0.00 H new ATOM 0 HA ARG A 11 3.665 -16.574 -0.656 1.00 0.00 H new ATOM 0 HB2 ARG A 11 2.285 -19.170 -1.456 1.00 0.00 H new ATOM 0 HB3 ARG A 11 2.207 -18.417 0.124 1.00 0.00 H new ATOM 0 HG2 ARG A 11 1.392 -16.367 -1.578 1.00 0.00 H new ATOM 0 HG3 ARG A 11 0.710 -17.795 -2.331 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -0.799 -18.111 -0.662 1.00 0.00 H new ATOM 0 HD3 ARG A 11 0.378 -17.790 0.596 1.00 0.00 H new ATOM 0 HE ARG A 11 -0.294 -15.335 -0.751 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -1.577 -17.720 1.523 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -2.632 -16.552 2.325 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -1.652 -13.849 0.287 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -2.674 -14.373 1.629 1.00 0.00 H new ATOM 289 N ALA A 12 5.382 -18.006 0.399 1.00 0.00 N ATOM 290 CA ALA A 12 6.490 -18.758 0.972 1.00 0.00 C ATOM 291 C ALA A 12 6.274 -19.004 2.462 1.00 0.00 C ATOM 292 O ALA A 12 5.552 -18.257 3.123 1.00 0.00 O ATOM 293 CB ALA A 12 7.802 -18.023 0.741 1.00 0.00 C ATOM 0 H ALA A 12 5.121 -17.173 0.926 1.00 0.00 H new ATOM 0 HA ALA A 12 6.536 -19.726 0.474 1.00 0.00 H new ATOM 0 HB1 ALA A 12 8.621 -18.596 1.174 1.00 0.00 H new ATOM 0 HB2 ALA A 12 7.969 -17.904 -0.330 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.757 -17.041 1.212 1.00 0.00 H new ATOM 299 N PRO A 13 6.899 -20.058 3.013 1.00 0.00 N ATOM 300 CA PRO A 13 6.771 -20.398 4.434 1.00 0.00 C ATOM 301 C PRO A 13 7.059 -19.208 5.344 1.00 0.00 C ATOM 302 O PRO A 13 7.947 -18.403 5.066 1.00 0.00 O ATOM 303 CB PRO A 13 7.823 -21.491 4.635 1.00 0.00 C ATOM 304 CG PRO A 13 7.986 -22.109 3.289 1.00 0.00 C ATOM 305 CD PRO A 13 7.779 -20.999 2.295 1.00 0.00 C ATOM 0 HA PRO A 13 5.758 -20.711 4.687 1.00 0.00 H new ATOM 0 HB2 PRO A 13 8.763 -21.074 4.996 1.00 0.00 H new ATOM 0 HB3 PRO A 13 7.496 -22.225 5.371 1.00 0.00 H new ATOM 0 HG2 PRO A 13 8.977 -22.551 3.180 1.00 0.00 H new ATOM 0 HG3 PRO A 13 7.262 -22.909 3.137 1.00 0.00 H new ATOM 0 HD2 PRO A 13 8.722 -20.531 2.012 1.00 0.00 H new ATOM 0 HD3 PRO A 13 7.316 -21.362 1.378 1.00 0.00 H new ATOM 313 N GLY A 14 6.301 -19.103 6.430 1.00 0.00 N ATOM 314 CA GLY A 14 6.489 -18.007 7.363 1.00 0.00 C ATOM 315 C GLY A 14 5.319 -17.042 7.367 1.00 0.00 C ATOM 316 O GLY A 14 4.901 -16.569 8.423 1.00 0.00 O ATOM 0 H GLY A 14 5.560 -19.757 6.681 1.00 0.00 H new ATOM 0 HA2 GLY A 14 6.629 -18.408 8.367 1.00 0.00 H new ATOM 0 HA3 GLY A 14 7.400 -17.467 7.106 1.00 0.00 H new ATOM 320 N PHE A 15 4.793 -16.750 6.183 1.00 0.00 N ATOM 321 CA PHE A 15 3.664 -15.835 6.053 1.00 0.00 C ATOM 322 C PHE A 15 2.859 -16.139 4.794 1.00 0.00 C ATOM 323 O PHE A 15 1.707 -16.565 4.870 1.00 0.00 O ATOM 324 CB PHE A 15 4.157 -14.386 6.020 1.00 0.00 C ATOM 325 CG PHE A 15 4.131 -13.712 7.362 1.00 0.00 C ATOM 326 CD1 PHE A 15 2.951 -13.199 7.873 1.00 0.00 C ATOM 327 CD2 PHE A 15 5.290 -13.591 8.112 1.00 0.00 C ATOM 328 CE1 PHE A 15 2.924 -12.578 9.107 1.00 0.00 C ATOM 329 CE2 PHE A 15 5.271 -12.971 9.348 1.00 0.00 C ATOM 330 CZ PHE A 15 4.086 -12.464 9.845 1.00 0.00 C ATOM 0 H PHE A 15 5.130 -17.133 5.300 1.00 0.00 H new ATOM 0 HA PHE A 15 3.016 -15.972 6.918 1.00 0.00 H new ATOM 0 HB2 PHE A 15 5.176 -14.366 5.632 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.540 -13.817 5.325 1.00 0.00 H new ATOM 0 HD1 PHE A 15 2.040 -13.285 7.300 1.00 0.00 H new ATOM 0 HD2 PHE A 15 6.219 -13.985 7.727 1.00 0.00 H new ATOM 0 HE1 PHE A 15 1.996 -12.183 9.494 1.00 0.00 H new ATOM 0 HE2 PHE A 15 6.181 -12.883 9.923 1.00 0.00 H new ATOM 0 HZ PHE A 15 4.068 -11.979 10.810 1.00 0.00 H new ATOM 340 N GLY A 16 3.474 -15.920 3.637 1.00 0.00 N ATOM 341 CA GLY A 16 2.801 -16.177 2.378 1.00 0.00 C ATOM 342 C GLY A 16 2.661 -14.929 1.528 1.00 0.00 C ATOM 343 O GLY A 16 3.410 -14.733 0.571 1.00 0.00 O ATOM 0 H GLY A 16 4.428 -15.569 3.549 1.00 0.00 H new ATOM 0 HA2 GLY A 16 3.356 -16.932 1.821 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.812 -16.590 2.576 1.00 0.00 H new ATOM 347 N PHE A 17 1.697 -14.084 1.878 1.00 0.00 N ATOM 348 CA PHE A 17 1.458 -12.848 1.137 1.00 0.00 C ATOM 349 C PHE A 17 2.697 -11.956 1.145 1.00 0.00 C ATOM 350 O PHE A 17 3.004 -11.297 0.153 1.00 0.00 O ATOM 351 CB PHE A 17 0.262 -12.084 1.721 1.00 0.00 C ATOM 352 CG PHE A 17 0.096 -12.243 3.209 1.00 0.00 C ATOM 353 CD1 PHE A 17 0.991 -11.656 4.088 1.00 0.00 C ATOM 354 CD2 PHE A 17 -0.955 -12.984 3.724 1.00 0.00 C ATOM 355 CE1 PHE A 17 0.840 -11.803 5.454 1.00 0.00 C ATOM 356 CE2 PHE A 17 -1.112 -13.135 5.089 1.00 0.00 C ATOM 357 CZ PHE A 17 -0.213 -12.544 5.955 1.00 0.00 C ATOM 0 H PHE A 17 1.069 -14.231 2.668 1.00 0.00 H new ATOM 0 HA PHE A 17 1.232 -13.120 0.106 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.374 -11.025 1.490 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -0.648 -12.423 1.227 1.00 0.00 H new ATOM 0 HD1 PHE A 17 1.816 -11.077 3.702 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -1.660 -13.449 3.051 1.00 0.00 H new ATOM 0 HE1 PHE A 17 1.544 -11.339 6.129 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -1.936 -13.714 5.478 1.00 0.00 H new ATOM 0 HZ PHE A 17 -0.333 -12.661 7.022 1.00 0.00 H new ATOM 367 N GLY A 18 3.406 -11.943 2.269 1.00 0.00 N ATOM 368 CA GLY A 18 4.605 -11.131 2.381 1.00 0.00 C ATOM 369 C GLY A 18 4.328 -9.727 2.890 1.00 0.00 C ATOM 370 O GLY A 18 5.216 -9.075 3.438 1.00 0.00 O ATOM 0 H GLY A 18 3.172 -12.480 3.104 1.00 0.00 H new ATOM 0 HA2 GLY A 18 5.308 -11.623 3.053 1.00 0.00 H new ATOM 0 HA3 GLY A 18 5.087 -11.069 1.405 1.00 0.00 H new ATOM 374 N ILE A 19 3.096 -9.258 2.708 1.00 0.00 N ATOM 375 CA ILE A 19 2.716 -7.921 3.152 1.00 0.00 C ATOM 376 C ILE A 19 1.426 -7.955 3.964 1.00 0.00 C ATOM 377 O ILE A 19 0.712 -8.957 3.974 1.00 0.00 O ATOM 378 CB ILE A 19 2.531 -6.964 1.959 1.00 0.00 C ATOM 379 CG1 ILE A 19 1.676 -7.622 0.872 1.00 0.00 C ATOM 380 CG2 ILE A 19 3.884 -6.544 1.398 1.00 0.00 C ATOM 381 CD1 ILE A 19 0.521 -6.759 0.409 1.00 0.00 C ATOM 0 H ILE A 19 2.346 -9.783 2.257 1.00 0.00 H new ATOM 0 HA ILE A 19 3.528 -7.556 3.780 1.00 0.00 H new ATOM 0 HB ILE A 19 2.013 -6.071 2.309 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.309 -7.859 0.016 1.00 0.00 H new ATOM 0 HG13 ILE A 19 1.285 -8.567 1.250 1.00 0.00 H new ATOM 0 HG21 ILE A 19 3.735 -5.868 0.556 1.00 0.00 H new ATOM 0 HG22 ILE A 19 4.458 -6.036 2.173 1.00 0.00 H new ATOM 0 HG23 ILE A 19 4.429 -7.427 1.063 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -0.042 -7.287 -0.361 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.134 -6.544 1.254 1.00 0.00 H new ATOM 0 HD13 ILE A 19 0.906 -5.825 0.001 1.00 0.00 H new ATOM 393 N ALA A 20 1.132 -6.851 4.644 1.00 0.00 N ATOM 394 CA ALA A 20 -0.074 -6.755 5.459 1.00 0.00 C ATOM 395 C ALA A 20 -1.047 -5.733 4.881 1.00 0.00 C ATOM 396 O ALA A 20 -0.731 -4.547 4.781 1.00 0.00 O ATOM 397 CB ALA A 20 0.284 -6.395 6.892 1.00 0.00 C ATOM 0 H ALA A 20 1.711 -6.012 4.647 1.00 0.00 H new ATOM 0 HA ALA A 20 -0.565 -7.728 5.453 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -0.626 -6.327 7.488 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.934 -7.164 7.309 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.801 -5.435 6.908 1.00 0.00 H new ATOM 403 N ILE A 21 -2.230 -6.202 4.501 1.00 0.00 N ATOM 404 CA ILE A 21 -3.251 -5.333 3.931 1.00 0.00 C ATOM 405 C ILE A 21 -3.745 -4.313 4.952 1.00 0.00 C ATOM 406 O ILE A 21 -3.805 -4.597 6.148 1.00 0.00 O ATOM 407 CB ILE A 21 -4.455 -6.145 3.414 1.00 0.00 C ATOM 408 CG1 ILE A 21 -4.958 -7.104 4.497 1.00 0.00 C ATOM 409 CG2 ILE A 21 -4.075 -6.910 2.154 1.00 0.00 C ATOM 410 CD1 ILE A 21 -6.315 -6.729 5.053 1.00 0.00 C ATOM 0 H ILE A 21 -2.505 -7.181 4.578 1.00 0.00 H new ATOM 0 HA ILE A 21 -2.786 -4.810 3.096 1.00 0.00 H new ATOM 0 HB ILE A 21 -5.261 -5.454 3.167 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -5.009 -8.111 4.084 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -4.235 -7.130 5.312 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -4.935 -7.479 1.800 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -3.763 -6.207 1.382 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -3.255 -7.593 2.376 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -6.608 -7.451 5.815 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -6.264 -5.734 5.496 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -7.051 -6.731 4.249 1.00 0.00 H new ATOM 422 N SER A 22 -4.100 -3.126 4.470 1.00 0.00 N ATOM 423 CA SER A 22 -4.590 -2.063 5.339 1.00 0.00 C ATOM 424 C SER A 22 -5.454 -1.078 4.555 1.00 0.00 C ATOM 425 O SER A 22 -5.085 -0.648 3.463 1.00 0.00 O ATOM 426 CB SER A 22 -3.418 -1.327 5.993 1.00 0.00 C ATOM 427 OG SER A 22 -3.478 -1.428 7.406 1.00 0.00 O ATOM 0 H SER A 22 -4.057 -2.877 3.482 1.00 0.00 H new ATOM 0 HA SER A 22 -5.202 -2.516 6.119 1.00 0.00 H new ATOM 0 HB2 SER A 22 -2.477 -1.744 5.635 1.00 0.00 H new ATOM 0 HB3 SER A 22 -3.434 -0.277 5.699 1.00 0.00 H new ATOM 0 HG SER A 22 -3.653 -0.543 7.790 1.00 0.00 H new ATOM 433 N GLY A 23 -6.604 -0.725 5.122 1.00 0.00 N ATOM 434 CA GLY A 23 -7.500 0.206 4.462 1.00 0.00 C ATOM 435 C GLY A 23 -8.944 -0.255 4.498 1.00 0.00 C ATOM 436 O GLY A 23 -9.557 -0.314 5.564 1.00 0.00 O ATOM 0 H GLY A 23 -6.931 -1.067 6.026 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.421 1.182 4.940 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.188 0.333 3.425 1.00 0.00 H new ATOM 440 N GLY A 24 -9.490 -0.582 3.331 1.00 0.00 N ATOM 441 CA GLY A 24 -10.866 -1.034 3.256 1.00 0.00 C ATOM 442 C GLY A 24 -11.835 0.100 2.990 1.00 0.00 C ATOM 443 O GLY A 24 -11.839 1.102 3.704 1.00 0.00 O ATOM 0 H GLY A 24 -9.003 -0.542 2.436 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -10.958 -1.779 2.466 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -11.135 -1.526 4.191 1.00 0.00 H new ATOM 447 N ARG A 25 -12.658 -0.056 1.958 1.00 0.00 N ATOM 448 CA ARG A 25 -13.635 0.964 1.598 1.00 0.00 C ATOM 449 C ARG A 25 -14.762 1.027 2.625 1.00 0.00 C ATOM 450 O ARG A 25 -15.314 2.094 2.892 1.00 0.00 O ATOM 451 CB ARG A 25 -14.209 0.685 0.207 1.00 0.00 C ATOM 452 CG ARG A 25 -15.075 -0.563 0.141 1.00 0.00 C ATOM 453 CD ARG A 25 -16.555 -0.221 0.201 1.00 0.00 C ATOM 454 NE ARG A 25 -17.344 -1.041 -0.715 1.00 0.00 N ATOM 455 CZ ARG A 25 -18.631 -0.825 -0.984 1.00 0.00 C ATOM 456 NH1 ARG A 25 -19.275 0.183 -0.411 1.00 0.00 N ATOM 457 NH2 ARG A 25 -19.273 -1.618 -1.830 1.00 0.00 N ATOM 0 H ARG A 25 -12.667 -0.880 1.356 1.00 0.00 H new ATOM 0 HA ARG A 25 -13.127 1.928 1.585 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -14.800 1.544 -0.111 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -13.387 0.584 -0.502 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -14.863 -1.105 -0.781 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -14.821 -1.227 0.967 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -16.919 -0.362 1.219 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -16.694 0.832 -0.044 1.00 0.00 H new ATOM 0 HE ARG A 25 -16.882 -1.825 -1.176 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -18.785 0.797 0.239 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -20.260 0.344 -0.621 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -18.782 -2.393 -2.275 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -20.258 -1.453 -2.036 1.00 0.00 H new ATOM 471 N ASP A 26 -15.098 -0.125 3.198 1.00 0.00 N ATOM 472 CA ASP A 26 -16.160 -0.201 4.194 1.00 0.00 C ATOM 473 C ASP A 26 -15.580 -0.313 5.601 1.00 0.00 C ATOM 474 O ASP A 26 -16.094 -1.055 6.438 1.00 0.00 O ATOM 475 CB ASP A 26 -17.072 -1.395 3.907 1.00 0.00 C ATOM 476 CG ASP A 26 -18.533 -1.081 4.165 1.00 0.00 C ATOM 477 OD1 ASP A 26 -19.122 -0.312 3.377 1.00 0.00 O ATOM 478 OD2 ASP A 26 -19.087 -1.603 5.154 1.00 0.00 O ATOM 0 H ASP A 26 -14.650 -1.017 2.989 1.00 0.00 H new ATOM 0 HA ASP A 26 -16.746 0.716 4.135 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -16.947 -1.703 2.869 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -16.769 -2.238 4.528 1.00 0.00 H new ATOM 483 N ASN A 27 -14.507 0.428 5.855 1.00 0.00 N ATOM 484 CA ASN A 27 -13.858 0.411 7.160 1.00 0.00 C ATOM 485 C ASN A 27 -14.383 1.543 8.043 1.00 0.00 C ATOM 486 O ASN A 27 -15.105 2.422 7.575 1.00 0.00 O ATOM 487 CB ASN A 27 -12.341 0.530 7.001 1.00 0.00 C ATOM 488 CG ASN A 27 -11.623 -0.767 7.316 1.00 0.00 C ATOM 489 OD1 ASN A 27 -12.098 -1.851 6.978 1.00 0.00 O ATOM 490 ND2 ASN A 27 -10.471 -0.663 7.969 1.00 0.00 N ATOM 0 H ASN A 27 -14.068 1.048 5.174 1.00 0.00 H new ATOM 0 HA ASN A 27 -14.090 -0.539 7.642 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -12.108 0.832 5.980 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -11.970 1.316 7.659 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -9.943 -1.502 8.209 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -10.114 0.256 8.230 1.00 0.00 H new ATOM 497 N PRO A 28 -14.023 1.534 9.339 1.00 0.00 N ATOM 498 CA PRO A 28 -14.461 2.564 10.285 1.00 0.00 C ATOM 499 C PRO A 28 -14.177 3.974 9.778 1.00 0.00 C ATOM 500 O PRO A 28 -15.012 4.870 9.903 1.00 0.00 O ATOM 501 CB PRO A 28 -13.633 2.272 11.538 1.00 0.00 C ATOM 502 CG PRO A 28 -13.304 0.822 11.446 1.00 0.00 C ATOM 503 CD PRO A 28 -13.162 0.522 9.980 1.00 0.00 C ATOM 0 HA PRO A 28 -15.538 2.532 10.452 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -12.730 2.882 11.567 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -14.196 2.493 12.445 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -12.382 0.596 11.982 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -14.090 0.214 11.894 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -12.127 0.609 9.651 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -13.488 -0.491 9.744 1.00 0.00 H new ATOM 511 N HIS A 29 -12.994 4.162 9.203 1.00 0.00 N ATOM 512 CA HIS A 29 -12.599 5.462 8.674 1.00 0.00 C ATOM 513 C HIS A 29 -12.234 5.359 7.197 1.00 0.00 C ATOM 514 O HIS A 29 -11.502 4.457 6.789 1.00 0.00 O ATOM 515 CB HIS A 29 -11.414 6.020 9.466 1.00 0.00 C ATOM 516 CG HIS A 29 -11.484 7.501 9.679 1.00 0.00 C ATOM 517 ND1 HIS A 29 -11.286 8.094 10.909 1.00 0.00 N ATOM 518 CD2 HIS A 29 -11.730 8.511 8.812 1.00 0.00 C ATOM 519 CE1 HIS A 29 -11.410 9.403 10.789 1.00 0.00 C ATOM 520 NE2 HIS A 29 -11.678 9.682 9.527 1.00 0.00 N ATOM 0 H HIS A 29 -12.292 3.430 9.091 1.00 0.00 H new ATOM 0 HA HIS A 29 -13.446 6.140 8.775 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -11.368 5.523 10.435 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -10.490 5.779 8.940 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -11.930 8.414 7.755 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -11.309 10.123 11.588 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -11.823 10.616 9.145 1.00 0.00 H new ATOM 529 N PHE A 30 -12.749 6.288 6.399 1.00 0.00 N ATOM 530 CA PHE A 30 -12.478 6.301 4.967 1.00 0.00 C ATOM 531 C PHE A 30 -12.388 7.731 4.444 1.00 0.00 C ATOM 532 O PHE A 30 -12.866 8.667 5.084 1.00 0.00 O ATOM 533 CB PHE A 30 -13.567 5.537 4.212 1.00 0.00 C ATOM 534 CG PHE A 30 -14.948 6.084 4.434 1.00 0.00 C ATOM 535 CD1 PHE A 30 -15.564 5.967 5.669 1.00 0.00 C ATOM 536 CD2 PHE A 30 -15.631 6.713 3.405 1.00 0.00 C ATOM 537 CE1 PHE A 30 -16.834 6.468 5.876 1.00 0.00 C ATOM 538 CE2 PHE A 30 -16.902 7.217 3.607 1.00 0.00 C ATOM 539 CZ PHE A 30 -17.504 7.095 4.844 1.00 0.00 C ATOM 0 H PHE A 30 -13.357 7.042 6.720 1.00 0.00 H new ATOM 0 HA PHE A 30 -11.519 5.810 4.800 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -13.343 5.560 3.146 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -13.545 4.491 4.519 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -15.045 5.478 6.480 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -15.165 6.810 2.435 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -17.303 6.370 6.844 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -17.424 7.706 2.798 1.00 0.00 H new ATOM 0 HZ PHE A 30 -18.497 7.489 5.004 1.00 0.00 H new ATOM 549 N GLN A 31 -11.771 7.891 3.278 1.00 0.00 N ATOM 550 CA GLN A 31 -11.618 9.206 2.667 1.00 0.00 C ATOM 551 C GLN A 31 -12.227 9.228 1.270 1.00 0.00 C ATOM 552 O GLN A 31 -11.893 8.399 0.424 1.00 0.00 O ATOM 553 CB GLN A 31 -10.139 9.591 2.599 1.00 0.00 C ATOM 554 CG GLN A 31 -9.879 11.062 2.883 1.00 0.00 C ATOM 555 CD GLN A 31 -9.938 11.916 1.633 1.00 0.00 C ATOM 556 OE1 GLN A 31 -9.036 11.876 0.797 1.00 0.00 O ATOM 557 NE2 GLN A 31 -11.005 12.696 1.498 1.00 0.00 N ATOM 0 H GLN A 31 -11.369 7.126 2.737 1.00 0.00 H new ATOM 0 HA GLN A 31 -12.146 9.932 3.286 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -9.582 8.987 3.315 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.754 9.347 1.609 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -10.614 11.425 3.602 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -8.899 11.171 3.347 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -11.730 12.698 2.216 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -11.100 13.293 0.676 1.00 0.00 H new ATOM 566 N SER A 32 -13.123 10.181 1.033 1.00 0.00 N ATOM 567 CA SER A 32 -13.779 10.305 -0.264 1.00 0.00 C ATOM 568 C SER A 32 -12.815 10.854 -1.309 1.00 0.00 C ATOM 569 O SER A 32 -12.335 11.983 -1.197 1.00 0.00 O ATOM 570 CB SER A 32 -15.003 11.216 -0.154 1.00 0.00 C ATOM 571 OG SER A 32 -16.166 10.471 0.169 1.00 0.00 O ATOM 0 H SER A 32 -13.411 10.877 1.721 1.00 0.00 H new ATOM 0 HA SER A 32 -14.101 9.312 -0.578 1.00 0.00 H new ATOM 0 HB2 SER A 32 -14.829 11.974 0.610 1.00 0.00 H new ATOM 0 HB3 SER A 32 -15.154 11.742 -1.096 1.00 0.00 H new ATOM 0 HG SER A 32 -16.934 11.076 0.235 1.00 0.00 H new ATOM 577 N GLY A 33 -12.536 10.046 -2.327 1.00 0.00 N ATOM 578 CA GLY A 33 -11.630 10.462 -3.382 1.00 0.00 C ATOM 579 C GLY A 33 -10.424 9.550 -3.503 1.00 0.00 C ATOM 580 O GLY A 33 -9.459 9.875 -4.195 1.00 0.00 O ATOM 0 H GLY A 33 -12.922 9.109 -2.440 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -12.166 10.479 -4.331 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -11.294 11.480 -3.187 1.00 0.00 H new ATOM 584 N GLU A 34 -10.480 8.406 -2.826 1.00 0.00 N ATOM 585 CA GLU A 34 -9.388 7.444 -2.856 1.00 0.00 C ATOM 586 C GLU A 34 -9.925 6.020 -2.789 1.00 0.00 C ATOM 587 O GLU A 34 -9.916 5.293 -3.782 1.00 0.00 O ATOM 588 CB GLU A 34 -8.440 7.692 -1.683 1.00 0.00 C ATOM 589 CG GLU A 34 -7.487 8.853 -1.906 1.00 0.00 C ATOM 590 CD GLU A 34 -6.099 8.400 -2.316 1.00 0.00 C ATOM 591 OE1 GLU A 34 -5.372 7.863 -1.453 1.00 0.00 O ATOM 592 OE2 GLU A 34 -5.741 8.581 -3.498 1.00 0.00 O ATOM 0 H GLU A 34 -11.273 8.124 -2.249 1.00 0.00 H new ATOM 0 HA GLU A 34 -8.845 7.570 -3.793 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -9.028 7.883 -0.786 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -7.860 6.788 -1.498 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -7.893 9.508 -2.676 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -7.417 9.441 -0.991 1.00 0.00 H new ATOM 599 N THR A 35 -10.395 5.633 -1.607 1.00 0.00 N ATOM 600 CA THR A 35 -10.943 4.297 -1.392 1.00 0.00 C ATOM 601 C THR A 35 -9.996 3.220 -1.914 1.00 0.00 C ATOM 602 O THR A 35 -10.435 2.190 -2.425 1.00 0.00 O ATOM 603 CB THR A 35 -12.308 4.166 -2.070 1.00 0.00 C ATOM 604 OG1 THR A 35 -12.296 4.775 -3.348 1.00 0.00 O ATOM 605 CG2 THR A 35 -13.434 4.791 -1.274 1.00 0.00 C ATOM 0 H THR A 35 -10.407 6.229 -0.779 1.00 0.00 H new ATOM 0 HA THR A 35 -11.062 4.154 -0.318 1.00 0.00 H new ATOM 0 HB THR A 35 -12.489 3.094 -2.147 1.00 0.00 H new ATOM 0 HG1 THR A 35 -11.487 4.506 -3.831 1.00 0.00 H new ATOM 0 HG21 THR A 35 -14.374 4.663 -1.811 1.00 0.00 H new ATOM 0 HG22 THR A 35 -13.504 4.307 -0.300 1.00 0.00 H new ATOM 0 HG23 THR A 35 -13.236 5.854 -1.137 1.00 0.00 H new ATOM 613 N SER A 36 -8.696 3.467 -1.784 1.00 0.00 N ATOM 614 CA SER A 36 -7.689 2.519 -2.245 1.00 0.00 C ATOM 615 C SER A 36 -6.997 1.839 -1.067 1.00 0.00 C ATOM 616 O SER A 36 -6.617 2.493 -0.096 1.00 0.00 O ATOM 617 CB SER A 36 -6.652 3.229 -3.116 1.00 0.00 C ATOM 618 OG SER A 36 -6.148 4.386 -2.470 1.00 0.00 O ATOM 0 H SER A 36 -8.316 4.315 -1.363 1.00 0.00 H new ATOM 0 HA SER A 36 -8.193 1.755 -2.837 1.00 0.00 H new ATOM 0 HB2 SER A 36 -5.832 2.547 -3.339 1.00 0.00 H new ATOM 0 HB3 SER A 36 -7.102 3.508 -4.069 1.00 0.00 H new ATOM 0 HG SER A 36 -6.109 4.230 -1.503 1.00 0.00 H new ATOM 624 N ILE A 37 -6.837 0.523 -1.161 1.00 0.00 N ATOM 625 CA ILE A 37 -6.190 -0.246 -0.105 1.00 0.00 C ATOM 626 C ILE A 37 -4.681 -0.018 -0.110 1.00 0.00 C ATOM 627 O ILE A 37 -4.086 0.242 -1.156 1.00 0.00 O ATOM 628 CB ILE A 37 -6.477 -1.754 -0.254 1.00 0.00 C ATOM 629 CG1 ILE A 37 -7.985 -2.002 -0.325 1.00 0.00 C ATOM 630 CG2 ILE A 37 -5.861 -2.532 0.900 1.00 0.00 C ATOM 631 CD1 ILE A 37 -8.352 -3.461 -0.494 1.00 0.00 C ATOM 0 H ILE A 37 -7.147 -0.033 -1.958 1.00 0.00 H new ATOM 0 HA ILE A 37 -6.603 0.100 0.843 1.00 0.00 H new ATOM 0 HB ILE A 37 -6.024 -2.103 -1.182 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -8.450 -1.622 0.584 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -8.400 -1.433 -1.157 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -6.074 -3.594 0.778 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -4.782 -2.377 0.909 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -6.285 -2.183 1.842 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -9.437 -3.561 -0.537 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -7.916 -3.841 -1.418 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -7.968 -4.033 0.351 1.00 0.00 H new ATOM 643 N VAL A 38 -4.067 -0.116 1.065 1.00 0.00 N ATOM 644 CA VAL A 38 -2.628 0.081 1.196 1.00 0.00 C ATOM 645 C VAL A 38 -2.019 -0.936 2.155 1.00 0.00 C ATOM 646 O VAL A 38 -2.725 -1.543 2.962 1.00 0.00 O ATOM 647 CB VAL A 38 -2.299 1.503 1.693 1.00 0.00 C ATOM 648 CG1 VAL A 38 -0.808 1.779 1.576 1.00 0.00 C ATOM 649 CG2 VAL A 38 -3.102 2.540 0.921 1.00 0.00 C ATOM 0 H VAL A 38 -4.544 -0.331 1.941 1.00 0.00 H new ATOM 0 HA VAL A 38 -2.197 -0.057 0.204 1.00 0.00 H new ATOM 0 HB VAL A 38 -2.577 1.572 2.745 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -0.596 2.787 1.931 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -0.256 1.058 2.179 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -0.502 1.690 0.534 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -2.856 3.537 1.287 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -2.860 2.472 -0.140 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -4.167 2.355 1.062 1.00 0.00 H new ATOM 659 N ILE A 39 -0.705 -1.119 2.063 1.00 0.00 N ATOM 660 CA ILE A 39 -0.003 -2.064 2.923 1.00 0.00 C ATOM 661 C ILE A 39 0.365 -1.427 4.258 1.00 0.00 C ATOM 662 O ILE A 39 1.092 -0.435 4.305 1.00 0.00 O ATOM 663 CB ILE A 39 1.277 -2.592 2.248 1.00 0.00 C ATOM 664 CG1 ILE A 39 0.969 -3.077 0.830 1.00 0.00 C ATOM 665 CG2 ILE A 39 1.891 -3.710 3.078 1.00 0.00 C ATOM 666 CD1 ILE A 39 1.315 -2.066 -0.241 1.00 0.00 C ATOM 0 H ILE A 39 -0.106 -0.625 1.402 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.684 -2.897 3.098 1.00 0.00 H new ATOM 0 HB ILE A 39 1.999 -1.778 2.183 1.00 0.00 H new ATOM 0 HG12 ILE A 39 1.521 -3.998 0.641 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -0.091 -3.321 0.760 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.795 -4.073 2.588 1.00 0.00 H new ATOM 0 HG22 ILE A 39 2.142 -3.332 4.069 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.176 -4.528 3.172 1.00 0.00 H new ATOM 0 HD11 ILE A 39 1.071 -2.476 -1.221 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.744 -1.152 -0.077 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.380 -1.840 -0.198 1.00 0.00 H new ATOM 678 N SER A 40 -0.140 -2.006 5.343 1.00 0.00 N ATOM 679 CA SER A 40 0.137 -1.497 6.681 1.00 0.00 C ATOM 680 C SER A 40 1.594 -1.740 7.066 1.00 0.00 C ATOM 681 O SER A 40 2.336 -0.802 7.353 1.00 0.00 O ATOM 682 CB SER A 40 -0.789 -2.157 7.704 1.00 0.00 C ATOM 683 OG SER A 40 -1.316 -1.202 8.608 1.00 0.00 O ATOM 0 H SER A 40 -0.743 -2.828 5.321 1.00 0.00 H new ATOM 0 HA SER A 40 -0.045 -0.422 6.677 1.00 0.00 H new ATOM 0 HB2 SER A 40 -1.605 -2.662 7.187 1.00 0.00 H new ATOM 0 HB3 SER A 40 -0.241 -2.920 8.256 1.00 0.00 H new ATOM 0 HG SER A 40 -2.287 -1.318 8.677 1.00 0.00 H new ATOM 689 N ASP A 41 1.995 -3.008 7.069 1.00 0.00 N ATOM 690 CA ASP A 41 3.362 -3.376 7.420 1.00 0.00 C ATOM 691 C ASP A 41 3.793 -4.637 6.677 1.00 0.00 C ATOM 692 O ASP A 41 2.958 -5.451 6.280 1.00 0.00 O ATOM 693 CB ASP A 41 3.482 -3.594 8.930 1.00 0.00 C ATOM 694 CG ASP A 41 4.007 -2.367 9.651 1.00 0.00 C ATOM 695 OD1 ASP A 41 3.351 -1.307 9.575 1.00 0.00 O ATOM 696 OD2 ASP A 41 5.076 -2.466 10.291 1.00 0.00 O ATOM 0 H ASP A 41 1.393 -3.797 6.833 1.00 0.00 H new ATOM 0 HA ASP A 41 4.020 -2.558 7.124 1.00 0.00 H new ATOM 0 HB2 ASP A 41 2.506 -3.860 9.335 1.00 0.00 H new ATOM 0 HB3 ASP A 41 4.147 -4.437 9.121 1.00 0.00 H new ATOM 701 N VAL A 42 5.099 -4.791 6.490 1.00 0.00 N ATOM 702 CA VAL A 42 5.640 -5.952 5.792 1.00 0.00 C ATOM 703 C VAL A 42 6.652 -6.695 6.659 1.00 0.00 C ATOM 704 O VAL A 42 7.389 -6.084 7.434 1.00 0.00 O ATOM 705 CB VAL A 42 6.313 -5.549 4.466 1.00 0.00 C ATOM 706 CG1 VAL A 42 5.295 -4.942 3.513 1.00 0.00 C ATOM 707 CG2 VAL A 42 7.460 -4.581 4.720 1.00 0.00 C ATOM 0 H VAL A 42 5.803 -4.127 6.812 1.00 0.00 H new ATOM 0 HA VAL A 42 4.798 -6.610 5.577 1.00 0.00 H new ATOM 0 HB VAL A 42 6.722 -6.446 4.001 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.789 -4.664 2.582 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.512 -5.671 3.304 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.853 -4.056 3.969 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.923 -4.308 3.772 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.078 -3.685 5.209 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.202 -5.056 5.362 1.00 0.00 H new ATOM 717 N LEU A 43 6.682 -8.017 6.523 1.00 0.00 N ATOM 718 CA LEU A 43 7.603 -8.846 7.293 1.00 0.00 C ATOM 719 C LEU A 43 9.045 -8.628 6.841 1.00 0.00 C ATOM 720 O LEU A 43 9.980 -8.780 7.627 1.00 0.00 O ATOM 721 CB LEU A 43 7.235 -10.325 7.156 1.00 0.00 C ATOM 722 CG LEU A 43 6.852 -10.772 5.741 1.00 0.00 C ATOM 723 CD1 LEU A 43 7.697 -11.961 5.306 1.00 0.00 C ATOM 724 CD2 LEU A 43 5.370 -11.117 5.673 1.00 0.00 C ATOM 0 H LEU A 43 6.079 -8.538 5.886 1.00 0.00 H new ATOM 0 HA LEU A 43 7.520 -8.553 8.340 1.00 0.00 H new ATOM 0 HB2 LEU A 43 8.079 -10.926 7.494 1.00 0.00 H new ATOM 0 HB3 LEU A 43 6.402 -10.540 7.826 1.00 0.00 H new ATOM 0 HG LEU A 43 7.046 -9.946 5.057 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.409 -12.263 4.299 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.750 -11.681 5.314 1.00 0.00 H new ATOM 0 HD13 LEU A 43 7.537 -12.792 5.993 1.00 0.00 H new ATOM 0 HD21 LEU A 43 5.116 -11.432 4.661 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.152 -11.926 6.371 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.780 -10.240 5.939 1.00 0.00 H new ATOM 736 N LYS A 44 9.217 -8.273 5.572 1.00 0.00 N ATOM 737 CA LYS A 44 10.546 -8.036 5.017 1.00 0.00 C ATOM 738 C LYS A 44 11.362 -9.325 4.991 1.00 0.00 C ATOM 739 O LYS A 44 12.587 -9.298 5.103 1.00 0.00 O ATOM 740 CB LYS A 44 11.280 -6.964 5.828 1.00 0.00 C ATOM 741 CG LYS A 44 11.734 -5.776 4.996 1.00 0.00 C ATOM 742 CD LYS A 44 13.198 -5.445 5.243 1.00 0.00 C ATOM 743 CE LYS A 44 13.426 -4.963 6.667 1.00 0.00 C ATOM 744 NZ LYS A 44 12.575 -3.786 6.997 1.00 0.00 N ATOM 0 H LYS A 44 8.454 -8.143 4.908 1.00 0.00 H new ATOM 0 HA LYS A 44 10.427 -7.683 3.992 1.00 0.00 H new ATOM 0 HB2 LYS A 44 10.625 -6.610 6.624 1.00 0.00 H new ATOM 0 HB3 LYS A 44 12.149 -7.415 6.307 1.00 0.00 H new ATOM 0 HG2 LYS A 44 11.583 -5.993 3.939 1.00 0.00 H new ATOM 0 HG3 LYS A 44 11.119 -4.908 5.234 1.00 0.00 H new ATOM 0 HD2 LYS A 44 13.809 -6.328 5.054 1.00 0.00 H new ATOM 0 HD3 LYS A 44 13.522 -4.677 4.541 1.00 0.00 H new ATOM 0 HE2 LYS A 44 13.211 -5.773 7.364 1.00 0.00 H new ATOM 0 HE3 LYS A 44 14.476 -4.700 6.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 12.960 -3.303 7.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 12.565 -3.128 6.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 11.605 -4.104 7.196 1.00 0.00 H new ATOM 758 N GLY A 45 10.674 -10.453 4.840 1.00 0.00 N ATOM 759 CA GLY A 45 11.353 -11.734 4.801 1.00 0.00 C ATOM 760 C GLY A 45 10.682 -12.725 3.869 1.00 0.00 C ATOM 761 O GLY A 45 10.924 -13.928 3.954 1.00 0.00 O ATOM 0 H GLY A 45 9.660 -10.502 4.744 1.00 0.00 H new ATOM 0 HA2 GLY A 45 12.385 -11.584 4.483 1.00 0.00 H new ATOM 0 HA3 GLY A 45 11.387 -12.153 5.807 1.00 0.00 H new ATOM 765 N GLY A 46 9.836 -12.221 2.974 1.00 0.00 N ATOM 766 CA GLY A 46 9.145 -13.088 2.037 1.00 0.00 C ATOM 767 C GLY A 46 9.211 -12.571 0.611 1.00 0.00 C ATOM 768 O GLY A 46 10.139 -11.845 0.255 1.00 0.00 O ATOM 0 H GLY A 46 9.617 -11.229 2.882 1.00 0.00 H new ATOM 0 HA2 GLY A 46 9.582 -14.086 2.079 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.102 -13.184 2.337 1.00 0.00 H new ATOM 772 N PRO A 47 8.230 -12.929 -0.235 1.00 0.00 N ATOM 773 CA PRO A 47 8.193 -12.486 -1.633 1.00 0.00 C ATOM 774 C PRO A 47 7.931 -10.989 -1.760 1.00 0.00 C ATOM 775 O PRO A 47 8.368 -10.352 -2.719 1.00 0.00 O ATOM 776 CB PRO A 47 7.032 -13.284 -2.231 1.00 0.00 C ATOM 777 CG PRO A 47 6.160 -13.615 -1.070 1.00 0.00 C ATOM 778 CD PRO A 47 7.083 -13.791 0.103 1.00 0.00 C ATOM 0 HA PRO A 47 9.145 -12.652 -2.137 1.00 0.00 H new ATOM 0 HB2 PRO A 47 6.493 -12.700 -2.977 1.00 0.00 H new ATOM 0 HB3 PRO A 47 7.387 -14.186 -2.729 1.00 0.00 H new ATOM 0 HG2 PRO A 47 5.439 -12.819 -0.884 1.00 0.00 H new ATOM 0 HG3 PRO A 47 5.589 -14.524 -1.257 1.00 0.00 H new ATOM 0 HD2 PRO A 47 6.611 -13.484 1.036 1.00 0.00 H new ATOM 0 HD3 PRO A 47 7.384 -14.831 0.225 1.00 0.00 H new ATOM 786 N ALA A 48 7.218 -10.435 -0.786 1.00 0.00 N ATOM 787 CA ALA A 48 6.897 -9.012 -0.788 1.00 0.00 C ATOM 788 C ALA A 48 7.693 -8.272 0.282 1.00 0.00 C ATOM 789 O ALA A 48 7.224 -7.283 0.846 1.00 0.00 O ATOM 790 CB ALA A 48 5.405 -8.807 -0.575 1.00 0.00 C ATOM 0 H ALA A 48 6.851 -10.949 0.015 1.00 0.00 H new ATOM 0 HA ALA A 48 7.172 -8.602 -1.760 1.00 0.00 H new ATOM 0 HB1 ALA A 48 5.180 -7.740 -0.579 1.00 0.00 H new ATOM 0 HB2 ALA A 48 4.852 -9.297 -1.376 1.00 0.00 H new ATOM 0 HB3 ALA A 48 5.112 -9.236 0.383 1.00 0.00 H new ATOM 796 N GLU A 49 8.897 -8.760 0.558 1.00 0.00 N ATOM 797 CA GLU A 49 9.759 -8.147 1.562 1.00 0.00 C ATOM 798 C GLU A 49 10.058 -6.692 1.213 1.00 0.00 C ATOM 799 O GLU A 49 9.939 -5.804 2.057 1.00 0.00 O ATOM 800 CB GLU A 49 11.067 -8.932 1.689 1.00 0.00 C ATOM 801 CG GLU A 49 11.834 -9.049 0.383 1.00 0.00 C ATOM 802 CD GLU A 49 13.042 -9.958 0.496 1.00 0.00 C ATOM 803 OE1 GLU A 49 12.868 -11.192 0.418 1.00 0.00 O ATOM 804 OE2 GLU A 49 14.164 -9.435 0.663 1.00 0.00 O ATOM 0 H GLU A 49 9.299 -9.578 0.101 1.00 0.00 H new ATOM 0 HA GLU A 49 9.233 -8.170 2.517 1.00 0.00 H new ATOM 0 HB2 GLU A 49 11.701 -8.448 2.431 1.00 0.00 H new ATOM 0 HB3 GLU A 49 10.846 -9.932 2.062 1.00 0.00 H new ATOM 0 HG2 GLU A 49 11.169 -9.430 -0.392 1.00 0.00 H new ATOM 0 HG3 GLU A 49 12.158 -8.058 0.066 1.00 0.00 H new ATOM 811 N GLY A 50 10.450 -6.456 -0.035 1.00 0.00 N ATOM 812 CA GLY A 50 10.760 -5.108 -0.472 1.00 0.00 C ATOM 813 C GLY A 50 10.132 -4.772 -1.810 1.00 0.00 C ATOM 814 O GLY A 50 10.833 -4.443 -2.767 1.00 0.00 O ATOM 0 H GLY A 50 10.558 -7.174 -0.751 1.00 0.00 H new ATOM 0 HA2 GLY A 50 10.412 -4.398 0.278 1.00 0.00 H new ATOM 0 HA3 GLY A 50 11.842 -4.992 -0.543 1.00 0.00 H new ATOM 818 N GLN A 51 8.807 -4.854 -1.877 1.00 0.00 N ATOM 819 CA GLN A 51 8.085 -4.557 -3.108 1.00 0.00 C ATOM 820 C GLN A 51 6.808 -3.775 -2.816 1.00 0.00 C ATOM 821 O GLN A 51 6.518 -2.773 -3.469 1.00 0.00 O ATOM 822 CB GLN A 51 7.747 -5.850 -3.850 1.00 0.00 C ATOM 823 CG GLN A 51 8.971 -6.665 -4.241 1.00 0.00 C ATOM 824 CD GLN A 51 9.019 -6.971 -5.726 1.00 0.00 C ATOM 825 OE1 GLN A 51 8.027 -6.818 -6.437 1.00 0.00 O ATOM 826 NE2 GLN A 51 10.181 -7.408 -6.201 1.00 0.00 N ATOM 0 H GLN A 51 8.212 -5.124 -1.093 1.00 0.00 H new ATOM 0 HA GLN A 51 8.729 -3.943 -3.738 1.00 0.00 H new ATOM 0 HB2 GLN A 51 7.099 -6.461 -3.221 1.00 0.00 H new ATOM 0 HB3 GLN A 51 7.181 -5.606 -4.749 1.00 0.00 H new ATOM 0 HG2 GLN A 51 9.871 -6.120 -3.957 1.00 0.00 H new ATOM 0 HG3 GLN A 51 8.974 -7.600 -3.681 1.00 0.00 H new ATOM 0 HE21 GLN A 51 10.978 -7.520 -5.575 1.00 0.00 H new ATOM 0 HE22 GLN A 51 10.275 -7.631 -7.192 1.00 0.00 H new ATOM 835 N LEU A 52 6.047 -4.241 -1.830 1.00 0.00 N ATOM 836 CA LEU A 52 4.800 -3.585 -1.452 1.00 0.00 C ATOM 837 C LEU A 52 4.926 -2.920 -0.085 1.00 0.00 C ATOM 838 O LEU A 52 5.123 -3.593 0.927 1.00 0.00 O ATOM 839 CB LEU A 52 3.652 -4.596 -1.435 1.00 0.00 C ATOM 840 CG LEU A 52 3.092 -4.962 -2.813 1.00 0.00 C ATOM 841 CD1 LEU A 52 3.485 -6.383 -3.191 1.00 0.00 C ATOM 842 CD2 LEU A 52 1.579 -4.804 -2.835 1.00 0.00 C ATOM 0 H LEU A 52 6.272 -5.069 -1.279 1.00 0.00 H new ATOM 0 HA LEU A 52 4.586 -2.814 -2.193 1.00 0.00 H new ATOM 0 HB2 LEU A 52 3.997 -5.507 -0.946 1.00 0.00 H new ATOM 0 HB3 LEU A 52 2.843 -4.194 -0.825 1.00 0.00 H new ATOM 0 HG LEU A 52 3.520 -4.280 -3.548 1.00 0.00 H new ATOM 0 HD11 LEU A 52 3.078 -6.624 -4.173 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.572 -6.465 -3.219 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.087 -7.079 -2.452 1.00 0.00 H new ATOM 0 HD21 LEU A 52 1.200 -5.069 -3.822 1.00 0.00 H new ATOM 0 HD22 LEU A 52 1.134 -5.460 -2.087 1.00 0.00 H new ATOM 0 HD23 LEU A 52 1.318 -3.770 -2.611 1.00 0.00 H new ATOM 854 N GLN A 53 4.812 -1.598 -0.064 1.00 0.00 N ATOM 855 CA GLN A 53 4.912 -0.841 1.180 1.00 0.00 C ATOM 856 C GLN A 53 4.106 0.451 1.095 1.00 0.00 C ATOM 857 O GLN A 53 3.577 0.797 0.039 1.00 0.00 O ATOM 858 CB GLN A 53 6.377 -0.525 1.493 1.00 0.00 C ATOM 859 CG GLN A 53 7.031 0.399 0.477 1.00 0.00 C ATOM 860 CD GLN A 53 8.396 -0.093 0.036 1.00 0.00 C ATOM 861 OE1 GLN A 53 8.930 -1.056 0.585 1.00 0.00 O ATOM 862 NE2 GLN A 53 8.969 0.572 -0.962 1.00 0.00 N ATOM 0 H GLN A 53 4.650 -1.027 -0.893 1.00 0.00 H new ATOM 0 HA GLN A 53 4.501 -1.452 1.984 1.00 0.00 H new ATOM 0 HB2 GLN A 53 6.438 -0.067 2.480 1.00 0.00 H new ATOM 0 HB3 GLN A 53 6.939 -1.458 1.539 1.00 0.00 H new ATOM 0 HG2 GLN A 53 6.383 0.491 -0.395 1.00 0.00 H new ATOM 0 HG3 GLN A 53 7.130 1.395 0.908 1.00 0.00 H new ATOM 0 HE21 GLN A 53 8.490 1.365 -1.388 1.00 0.00 H new ATOM 0 HE22 GLN A 53 9.888 0.289 -1.302 1.00 0.00 H new ATOM 871 N GLU A 54 4.015 1.162 2.216 1.00 0.00 N ATOM 872 CA GLU A 54 3.274 2.418 2.272 1.00 0.00 C ATOM 873 C GLU A 54 3.710 3.362 1.153 1.00 0.00 C ATOM 874 O GLU A 54 2.913 4.152 0.649 1.00 0.00 O ATOM 875 CB GLU A 54 3.474 3.093 3.630 1.00 0.00 C ATOM 876 CG GLU A 54 2.755 2.387 4.770 1.00 0.00 C ATOM 877 CD GLU A 54 3.711 1.836 5.811 1.00 0.00 C ATOM 878 OE1 GLU A 54 4.692 1.169 5.421 1.00 0.00 O ATOM 879 OE2 GLU A 54 3.476 2.071 7.015 1.00 0.00 O ATOM 0 H GLU A 54 4.446 0.889 3.099 1.00 0.00 H new ATOM 0 HA GLU A 54 2.216 2.191 2.138 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.540 3.134 3.853 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.121 4.123 3.571 1.00 0.00 H new ATOM 0 HG2 GLU A 54 2.067 3.084 5.247 1.00 0.00 H new ATOM 0 HG3 GLU A 54 2.154 1.572 4.366 1.00 0.00 H new ATOM 886 N ASN A 55 4.979 3.268 0.768 1.00 0.00 N ATOM 887 CA ASN A 55 5.520 4.109 -0.293 1.00 0.00 C ATOM 888 C ASN A 55 4.774 3.877 -1.604 1.00 0.00 C ATOM 889 O ASN A 55 4.682 4.772 -2.444 1.00 0.00 O ATOM 890 CB ASN A 55 7.011 3.827 -0.485 1.00 0.00 C ATOM 891 CG ASN A 55 7.698 4.889 -1.322 1.00 0.00 C ATOM 892 OD1 ASN A 55 8.305 4.589 -2.350 1.00 0.00 O ATOM 893 ND2 ASN A 55 7.606 6.140 -0.884 1.00 0.00 N ATOM 0 H ASN A 55 5.651 2.618 1.175 1.00 0.00 H new ATOM 0 HA ASN A 55 5.389 5.151 -0.000 1.00 0.00 H new ATOM 0 HB2 ASN A 55 7.495 3.767 0.490 1.00 0.00 H new ATOM 0 HB3 ASN A 55 7.135 2.855 -0.963 1.00 0.00 H new ATOM 0 HD21 ASN A 55 8.049 6.897 -1.405 1.00 0.00 H new ATOM 0 HD22 ASN A 55 7.093 6.344 -0.026 1.00 0.00 H new ATOM 900 N ASP A 56 4.243 2.670 -1.770 1.00 0.00 N ATOM 901 CA ASP A 56 3.505 2.317 -2.977 1.00 0.00 C ATOM 902 C ASP A 56 2.049 2.007 -2.643 1.00 0.00 C ATOM 903 O ASP A 56 1.763 1.170 -1.787 1.00 0.00 O ATOM 904 CB ASP A 56 4.149 1.110 -3.665 1.00 0.00 C ATOM 905 CG ASP A 56 5.665 1.162 -3.635 1.00 0.00 C ATOM 906 OD1 ASP A 56 6.255 1.807 -4.527 1.00 0.00 O ATOM 907 OD2 ASP A 56 6.261 0.558 -2.718 1.00 0.00 O ATOM 0 H ASP A 56 4.310 1.919 -1.083 1.00 0.00 H new ATOM 0 HA ASP A 56 3.536 3.169 -3.656 1.00 0.00 H new ATOM 0 HB2 ASP A 56 3.811 0.195 -3.178 1.00 0.00 H new ATOM 0 HB3 ASP A 56 3.811 1.063 -4.700 1.00 0.00 H new ATOM 912 N ARG A 57 1.132 2.689 -3.321 1.00 0.00 N ATOM 913 CA ARG A 57 -0.293 2.484 -3.091 1.00 0.00 C ATOM 914 C ARG A 57 -0.847 1.408 -4.018 1.00 0.00 C ATOM 915 O ARG A 57 -0.670 1.471 -5.236 1.00 0.00 O ATOM 916 CB ARG A 57 -1.061 3.794 -3.286 1.00 0.00 C ATOM 917 CG ARG A 57 -0.955 4.362 -4.693 1.00 0.00 C ATOM 918 CD ARG A 57 -1.609 5.732 -4.794 1.00 0.00 C ATOM 919 NE ARG A 57 -0.691 6.739 -5.322 1.00 0.00 N ATOM 920 CZ ARG A 57 0.210 7.384 -4.583 1.00 0.00 C ATOM 921 NH1 ARG A 57 0.325 7.126 -3.287 1.00 0.00 N ATOM 922 NH2 ARG A 57 1.000 8.289 -5.144 1.00 0.00 N ATOM 0 H ARG A 57 1.350 3.387 -4.032 1.00 0.00 H new ATOM 0 HA ARG A 57 -0.422 2.149 -2.062 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -2.112 3.627 -3.049 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.688 4.533 -2.577 1.00 0.00 H new ATOM 0 HG2 ARG A 57 0.094 4.437 -4.978 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -1.428 3.679 -5.398 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -2.486 5.668 -5.438 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.958 6.041 -3.809 1.00 0.00 H new ATOM 0 HE ARG A 57 -0.743 6.961 -6.316 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -0.279 6.430 -2.850 1.00 0.00 H new ATOM 0 HH12 ARG A 57 1.017 7.624 -2.727 1.00 0.00 H new ATOM 0 HH21 ARG A 57 0.917 8.491 -6.140 1.00 0.00 H new ATOM 0 HH22 ARG A 57 1.690 8.784 -4.579 1.00 0.00 H new ATOM 936 N VAL A 58 -1.517 0.420 -3.434 1.00 0.00 N ATOM 937 CA VAL A 58 -2.097 -0.675 -4.203 1.00 0.00 C ATOM 938 C VAL A 58 -3.370 -0.234 -4.919 1.00 0.00 C ATOM 939 O VAL A 58 -4.189 0.493 -4.358 1.00 0.00 O ATOM 940 CB VAL A 58 -2.422 -1.883 -3.304 1.00 0.00 C ATOM 941 CG1 VAL A 58 -2.848 -3.076 -4.146 1.00 0.00 C ATOM 942 CG2 VAL A 58 -1.227 -2.236 -2.432 1.00 0.00 C ATOM 0 H VAL A 58 -1.672 0.355 -2.428 1.00 0.00 H new ATOM 0 HA VAL A 58 -1.351 -0.969 -4.942 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.252 -1.614 -2.651 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -3.073 -3.920 -3.494 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.736 -2.816 -4.723 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -2.041 -3.349 -4.826 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.475 -3.091 -1.804 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -0.376 -2.486 -3.065 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -0.973 -1.384 -1.801 1.00 0.00 H new ATOM 952 N ALA A 59 -3.526 -0.680 -6.161 1.00 0.00 N ATOM 953 CA ALA A 59 -4.698 -0.334 -6.956 1.00 0.00 C ATOM 954 C ALA A 59 -5.503 -1.578 -7.318 1.00 0.00 C ATOM 955 O ALA A 59 -6.734 -1.548 -7.338 1.00 0.00 O ATOM 956 CB ALA A 59 -4.279 0.412 -8.215 1.00 0.00 C ATOM 0 H ALA A 59 -2.855 -1.282 -6.639 1.00 0.00 H new ATOM 0 HA ALA A 59 -5.335 0.316 -6.356 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.164 0.664 -8.800 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.754 1.326 -7.938 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -3.619 -0.220 -8.810 1.00 0.00 H new ATOM 962 N MET A 60 -4.802 -2.669 -7.606 1.00 0.00 N ATOM 963 CA MET A 60 -5.453 -3.923 -7.969 1.00 0.00 C ATOM 964 C MET A 60 -4.699 -5.116 -7.391 1.00 0.00 C ATOM 965 O MET A 60 -3.479 -5.078 -7.239 1.00 0.00 O ATOM 966 CB MET A 60 -5.543 -4.051 -9.491 1.00 0.00 C ATOM 967 CG MET A 60 -6.433 -5.193 -9.954 1.00 0.00 C ATOM 968 SD MET A 60 -6.252 -5.546 -11.712 1.00 0.00 S ATOM 969 CE MET A 60 -4.517 -5.981 -11.795 1.00 0.00 C ATOM 0 H MET A 60 -3.783 -2.711 -7.595 1.00 0.00 H new ATOM 0 HA MET A 60 -6.459 -3.916 -7.550 1.00 0.00 H new ATOM 0 HB2 MET A 60 -5.921 -3.116 -9.904 1.00 0.00 H new ATOM 0 HB3 MET A 60 -4.541 -4.196 -9.895 1.00 0.00 H new ATOM 0 HG2 MET A 60 -6.195 -6.089 -9.381 1.00 0.00 H new ATOM 0 HG3 MET A 60 -7.473 -4.946 -9.742 1.00 0.00 H new ATOM 0 HE1 MET A 60 -4.342 -6.613 -12.666 1.00 0.00 H new ATOM 0 HE2 MET A 60 -3.918 -5.074 -11.878 1.00 0.00 H new ATOM 0 HE3 MET A 60 -4.234 -6.521 -10.892 1.00 0.00 H new ATOM 979 N VAL A 61 -5.436 -6.176 -7.072 1.00 0.00 N ATOM 980 CA VAL A 61 -4.839 -7.382 -6.512 1.00 0.00 C ATOM 981 C VAL A 61 -5.409 -8.632 -7.173 1.00 0.00 C ATOM 982 O VAL A 61 -6.615 -8.876 -7.129 1.00 0.00 O ATOM 983 CB VAL A 61 -5.066 -7.468 -4.990 1.00 0.00 C ATOM 984 CG1 VAL A 61 -4.306 -8.647 -4.401 1.00 0.00 C ATOM 985 CG2 VAL A 61 -4.655 -6.169 -4.314 1.00 0.00 C ATOM 0 H VAL A 61 -6.448 -6.223 -7.192 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.768 -7.326 -6.707 1.00 0.00 H new ATOM 0 HB VAL A 61 -6.129 -7.624 -4.809 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -4.479 -8.691 -3.326 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -4.654 -9.571 -4.862 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -3.240 -8.525 -4.592 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -4.823 -6.249 -3.240 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.599 -5.979 -4.503 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -5.249 -5.347 -4.714 1.00 0.00 H new ATOM 995 N ASN A 62 -4.533 -9.422 -7.787 1.00 0.00 N ATOM 996 CA ASN A 62 -4.946 -10.649 -8.459 1.00 0.00 C ATOM 997 C ASN A 62 -6.029 -10.367 -9.497 1.00 0.00 C ATOM 998 O ASN A 62 -6.899 -11.202 -9.744 1.00 0.00 O ATOM 999 CB ASN A 62 -5.453 -11.669 -7.436 1.00 0.00 C ATOM 1000 CG ASN A 62 -4.792 -13.024 -7.596 1.00 0.00 C ATOM 1001 OD1 ASN A 62 -4.610 -13.512 -8.712 1.00 0.00 O ATOM 1002 ND2 ASN A 62 -4.429 -13.641 -6.478 1.00 0.00 N ATOM 0 H ASN A 62 -3.532 -9.234 -7.833 1.00 0.00 H new ATOM 0 HA ASN A 62 -4.078 -11.061 -8.973 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -5.267 -11.294 -6.430 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.532 -11.779 -7.541 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -3.980 -14.556 -6.523 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -4.599 -13.200 -5.574 1.00 0.00 H new ATOM 1009 N GLY A 63 -5.966 -9.186 -10.105 1.00 0.00 N ATOM 1010 CA GLY A 63 -6.945 -8.817 -11.111 1.00 0.00 C ATOM 1011 C GLY A 63 -8.104 -8.022 -10.537 1.00 0.00 C ATOM 1012 O GLY A 63 -8.747 -7.253 -11.251 1.00 0.00 O ATOM 0 H GLY A 63 -5.255 -8.479 -9.919 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -6.457 -8.230 -11.889 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -7.329 -9.719 -11.587 1.00 0.00 H new ATOM 1016 N VAL A 64 -8.372 -8.207 -9.249 1.00 0.00 N ATOM 1017 CA VAL A 64 -9.463 -7.500 -8.589 1.00 0.00 C ATOM 1018 C VAL A 64 -9.052 -6.080 -8.217 1.00 0.00 C ATOM 1019 O VAL A 64 -7.935 -5.846 -7.757 1.00 0.00 O ATOM 1020 CB VAL A 64 -9.926 -8.237 -7.318 1.00 0.00 C ATOM 1021 CG1 VAL A 64 -11.195 -7.605 -6.768 1.00 0.00 C ATOM 1022 CG2 VAL A 64 -10.139 -9.715 -7.606 1.00 0.00 C ATOM 0 H VAL A 64 -7.850 -8.839 -8.642 1.00 0.00 H new ATOM 0 HA VAL A 64 -10.289 -7.463 -9.299 1.00 0.00 H new ATOM 0 HB VAL A 64 -9.146 -8.147 -6.562 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -11.508 -8.138 -5.870 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -11.004 -6.561 -6.521 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.984 -7.662 -7.517 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.466 -10.219 -6.697 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.900 -9.829 -8.378 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -9.204 -10.157 -7.950 1.00 0.00 H new ATOM 1032 N SER A 65 -9.962 -5.133 -8.420 1.00 0.00 N ATOM 1033 CA SER A 65 -9.694 -3.734 -8.106 1.00 0.00 C ATOM 1034 C SER A 65 -9.710 -3.501 -6.598 1.00 0.00 C ATOM 1035 O SER A 65 -10.579 -4.010 -5.890 1.00 0.00 O ATOM 1036 CB SER A 65 -10.725 -2.831 -8.785 1.00 0.00 C ATOM 1037 OG SER A 65 -10.891 -3.180 -10.147 1.00 0.00 O ATOM 0 H SER A 65 -10.892 -5.309 -8.801 1.00 0.00 H new ATOM 0 HA SER A 65 -8.701 -3.487 -8.482 1.00 0.00 H new ATOM 0 HB2 SER A 65 -11.681 -2.912 -8.267 1.00 0.00 H new ATOM 0 HB3 SER A 65 -10.408 -1.791 -8.709 1.00 0.00 H new ATOM 0 HG SER A 65 -11.556 -2.589 -10.557 1.00 0.00 H new ATOM 1043 N MET A 66 -8.745 -2.726 -6.115 1.00 0.00 N ATOM 1044 CA MET A 66 -8.649 -2.422 -4.692 1.00 0.00 C ATOM 1045 C MET A 66 -8.917 -0.944 -4.431 1.00 0.00 C ATOM 1046 O MET A 66 -8.387 -0.364 -3.483 1.00 0.00 O ATOM 1047 CB MET A 66 -7.266 -2.804 -4.160 1.00 0.00 C ATOM 1048 CG MET A 66 -7.187 -4.230 -3.640 1.00 0.00 C ATOM 1049 SD MET A 66 -7.693 -5.446 -4.871 1.00 0.00 S ATOM 1050 CE MET A 66 -9.112 -6.180 -4.062 1.00 0.00 C ATOM 0 H MET A 66 -8.018 -2.297 -6.688 1.00 0.00 H new ATOM 0 HA MET A 66 -9.406 -3.007 -4.169 1.00 0.00 H new ATOM 0 HB2 MET A 66 -6.532 -2.675 -4.955 1.00 0.00 H new ATOM 0 HB3 MET A 66 -6.992 -2.118 -3.358 1.00 0.00 H new ATOM 0 HG2 MET A 66 -6.165 -4.442 -3.324 1.00 0.00 H new ATOM 0 HG3 MET A 66 -7.820 -4.327 -2.758 1.00 0.00 H new ATOM 0 HE1 MET A 66 -8.938 -7.247 -3.920 1.00 0.00 H new ATOM 0 HE2 MET A 66 -9.265 -5.705 -3.093 1.00 0.00 H new ATOM 0 HE3 MET A 66 -9.998 -6.036 -4.680 1.00 0.00 H new ATOM 1060 N ASP A 67 -9.742 -0.339 -5.280 1.00 0.00 N ATOM 1061 CA ASP A 67 -10.083 1.073 -5.142 1.00 0.00 C ATOM 1062 C ASP A 67 -11.566 1.248 -4.827 1.00 0.00 C ATOM 1063 O ASP A 67 -12.145 2.301 -5.093 1.00 0.00 O ATOM 1064 CB ASP A 67 -9.726 1.832 -6.421 1.00 0.00 C ATOM 1065 CG ASP A 67 -8.365 2.494 -6.340 1.00 0.00 C ATOM 1066 OD1 ASP A 67 -7.358 1.822 -6.649 1.00 0.00 O ATOM 1067 OD2 ASP A 67 -8.305 3.685 -5.968 1.00 0.00 O ATOM 0 H ASP A 67 -10.187 -0.805 -6.071 1.00 0.00 H new ATOM 0 HA ASP A 67 -9.505 1.481 -4.313 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -9.742 1.143 -7.265 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -10.485 2.590 -6.614 1.00 0.00 H new ATOM 1072 N ASN A 68 -12.174 0.212 -4.258 1.00 0.00 N ATOM 1073 CA ASN A 68 -13.590 0.252 -3.907 1.00 0.00 C ATOM 1074 C ASN A 68 -14.021 -1.053 -3.244 1.00 0.00 C ATOM 1075 O ASN A 68 -15.128 -1.540 -3.470 1.00 0.00 O ATOM 1076 CB ASN A 68 -14.441 0.510 -5.153 1.00 0.00 C ATOM 1077 CG ASN A 68 -15.640 1.389 -4.862 1.00 0.00 C ATOM 1078 OD1 ASN A 68 -16.482 1.053 -4.028 1.00 0.00 O ATOM 1079 ND2 ASN A 68 -15.726 2.520 -5.550 1.00 0.00 N ATOM 0 H ASN A 68 -11.708 -0.666 -4.030 1.00 0.00 H new ATOM 0 HA ASN A 68 -13.741 1.067 -3.199 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -13.825 0.982 -5.919 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -14.782 -0.442 -5.560 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -16.513 3.151 -5.398 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -15.005 2.759 -6.231 1.00 0.00 H new ATOM 1086 N VAL A 69 -13.136 -1.614 -2.426 1.00 0.00 N ATOM 1087 CA VAL A 69 -13.424 -2.863 -1.731 1.00 0.00 C ATOM 1088 C VAL A 69 -12.864 -2.843 -0.312 1.00 0.00 C ATOM 1089 O VAL A 69 -11.932 -2.096 -0.013 1.00 0.00 O ATOM 1090 CB VAL A 69 -12.840 -4.073 -2.483 1.00 0.00 C ATOM 1091 CG1 VAL A 69 -13.559 -4.275 -3.808 1.00 0.00 C ATOM 1092 CG2 VAL A 69 -11.346 -3.895 -2.701 1.00 0.00 C ATOM 0 H VAL A 69 -12.215 -1.224 -2.229 1.00 0.00 H new ATOM 0 HA VAL A 69 -14.509 -2.959 -1.691 1.00 0.00 H new ATOM 0 HB VAL A 69 -12.991 -4.964 -1.874 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -13.133 -5.134 -4.326 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -14.619 -4.451 -3.624 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -13.441 -3.384 -4.425 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -10.950 -4.760 -3.234 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -11.169 -2.994 -3.289 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -10.846 -3.803 -1.737 1.00 0.00 H new ATOM 1102 N GLU A 70 -13.439 -3.667 0.557 1.00 0.00 N ATOM 1103 CA GLU A 70 -12.997 -3.743 1.945 1.00 0.00 C ATOM 1104 C GLU A 70 -11.720 -4.570 2.065 1.00 0.00 C ATOM 1105 O GLU A 70 -11.453 -5.445 1.239 1.00 0.00 O ATOM 1106 CB GLU A 70 -14.095 -4.348 2.821 1.00 0.00 C ATOM 1107 CG GLU A 70 -14.658 -5.651 2.277 1.00 0.00 C ATOM 1108 CD GLU A 70 -16.051 -5.489 1.700 1.00 0.00 C ATOM 1109 OE1 GLU A 70 -16.271 -4.520 0.944 1.00 0.00 O ATOM 1110 OE2 GLU A 70 -16.922 -6.331 2.005 1.00 0.00 O ATOM 0 H GLU A 70 -14.212 -4.291 0.325 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.786 -2.730 2.288 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -13.696 -4.523 3.820 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -14.905 -3.626 2.924 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.992 -6.036 1.505 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -14.683 -6.393 3.075 1.00 0.00 H new ATOM 1117 N HIS A 71 -10.934 -4.287 3.099 1.00 0.00 N ATOM 1118 CA HIS A 71 -9.684 -5.001 3.332 1.00 0.00 C ATOM 1119 C HIS A 71 -9.912 -6.510 3.370 1.00 0.00 C ATOM 1120 O HIS A 71 -9.100 -7.283 2.862 1.00 0.00 O ATOM 1121 CB HIS A 71 -9.042 -4.535 4.640 1.00 0.00 C ATOM 1122 CG HIS A 71 -9.847 -4.871 5.858 1.00 0.00 C ATOM 1123 ND1 HIS A 71 -10.752 -4.000 6.426 1.00 0.00 N ATOM 1124 CD2 HIS A 71 -9.880 -5.992 6.617 1.00 0.00 C ATOM 1125 CE1 HIS A 71 -11.305 -4.569 7.483 1.00 0.00 C ATOM 1126 NE2 HIS A 71 -10.793 -5.778 7.620 1.00 0.00 N ATOM 0 H HIS A 71 -11.142 -3.566 3.790 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.010 -4.778 2.505 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -8.055 -4.988 4.731 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -8.895 -3.456 4.598 1.00 0.00 H new ATOM 0 HD1 HIS A 71 -10.962 -3.062 6.084 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -9.297 -6.888 6.462 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -12.049 -4.121 8.125 1.00 0.00 H new ATOM 1135 N ALA A 72 -11.023 -6.921 3.973 1.00 0.00 N ATOM 1136 CA ALA A 72 -11.359 -8.336 4.077 1.00 0.00 C ATOM 1137 C ALA A 72 -11.574 -8.949 2.696 1.00 0.00 C ATOM 1138 O ALA A 72 -11.002 -9.991 2.371 1.00 0.00 O ATOM 1139 CB ALA A 72 -12.598 -8.523 4.939 1.00 0.00 C ATOM 0 H ALA A 72 -11.706 -6.293 4.397 1.00 0.00 H new ATOM 0 HA ALA A 72 -10.522 -8.851 4.549 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -12.837 -9.584 5.008 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -12.410 -8.128 5.937 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -13.437 -7.991 4.491 1.00 0.00 H new ATOM 1145 N PHE A 73 -12.404 -8.297 1.889 1.00 0.00 N ATOM 1146 CA PHE A 73 -12.696 -8.779 0.544 1.00 0.00 C ATOM 1147 C PHE A 73 -11.424 -8.850 -0.294 1.00 0.00 C ATOM 1148 O PHE A 73 -11.262 -9.749 -1.120 1.00 0.00 O ATOM 1149 CB PHE A 73 -13.719 -7.866 -0.136 1.00 0.00 C ATOM 1150 CG PHE A 73 -14.302 -8.449 -1.392 1.00 0.00 C ATOM 1151 CD1 PHE A 73 -15.440 -9.238 -1.341 1.00 0.00 C ATOM 1152 CD2 PHE A 73 -13.712 -8.209 -2.622 1.00 0.00 C ATOM 1153 CE1 PHE A 73 -15.979 -9.775 -2.494 1.00 0.00 C ATOM 1154 CE2 PHE A 73 -14.246 -8.745 -3.779 1.00 0.00 C ATOM 1155 CZ PHE A 73 -15.382 -9.529 -3.714 1.00 0.00 C ATOM 0 H PHE A 73 -12.886 -7.434 2.142 1.00 0.00 H new ATOM 0 HA PHE A 73 -13.113 -9.783 0.626 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -14.526 -7.653 0.565 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -13.243 -6.914 -0.373 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -15.911 -9.435 -0.389 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -12.825 -7.596 -2.678 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -16.867 -10.387 -2.441 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -13.776 -8.551 -4.732 1.00 0.00 H new ATOM 0 HZ PHE A 73 -15.802 -9.949 -4.616 1.00 0.00 H new ATOM 1165 N ALA A 74 -10.525 -7.895 -0.080 1.00 0.00 N ATOM 1166 CA ALA A 74 -9.268 -7.847 -0.818 1.00 0.00 C ATOM 1167 C ALA A 74 -8.302 -8.934 -0.353 1.00 0.00 C ATOM 1168 O ALA A 74 -7.786 -9.705 -1.162 1.00 0.00 O ATOM 1169 CB ALA A 74 -8.629 -6.475 -0.675 1.00 0.00 C ATOM 0 H ALA A 74 -10.644 -7.143 0.599 1.00 0.00 H new ATOM 0 HA ALA A 74 -9.490 -8.030 -1.869 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -7.691 -6.451 -1.230 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.304 -5.716 -1.070 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.433 -6.273 0.378 1.00 0.00 H new ATOM 1175 N VAL A 75 -8.051 -8.982 0.953 1.00 0.00 N ATOM 1176 CA VAL A 75 -7.134 -9.967 1.520 1.00 0.00 C ATOM 1177 C VAL A 75 -7.564 -11.394 1.187 1.00 0.00 C ATOM 1178 O VAL A 75 -6.726 -12.260 0.934 1.00 0.00 O ATOM 1179 CB VAL A 75 -7.019 -9.816 3.050 1.00 0.00 C ATOM 1180 CG1 VAL A 75 -8.346 -10.119 3.726 1.00 0.00 C ATOM 1181 CG2 VAL A 75 -5.918 -10.716 3.593 1.00 0.00 C ATOM 0 H VAL A 75 -8.469 -8.352 1.637 1.00 0.00 H new ATOM 0 HA VAL A 75 -6.160 -9.778 1.069 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.758 -8.781 3.272 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -8.239 -10.006 4.805 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -9.106 -9.428 3.362 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -8.646 -11.141 3.497 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -5.851 -10.597 4.674 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.147 -11.755 3.356 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -4.966 -10.442 3.138 1.00 0.00 H new ATOM 1191 N GLN A 76 -8.870 -11.639 1.192 1.00 0.00 N ATOM 1192 CA GLN A 76 -9.394 -12.967 0.893 1.00 0.00 C ATOM 1193 C GLN A 76 -9.080 -13.370 -0.546 1.00 0.00 C ATOM 1194 O GLN A 76 -9.002 -14.556 -0.864 1.00 0.00 O ATOM 1195 CB GLN A 76 -10.905 -13.013 1.128 1.00 0.00 C ATOM 1196 CG GLN A 76 -11.698 -12.127 0.181 1.00 0.00 C ATOM 1197 CD GLN A 76 -13.114 -12.624 -0.034 1.00 0.00 C ATOM 1198 OE1 GLN A 76 -13.807 -12.990 0.914 1.00 0.00 O ATOM 1199 NE2 GLN A 76 -13.551 -12.637 -1.288 1.00 0.00 N ATOM 0 H GLN A 76 -9.582 -10.939 1.399 1.00 0.00 H new ATOM 0 HA GLN A 76 -8.908 -13.675 1.564 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -11.249 -14.042 1.022 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -11.114 -12.711 2.154 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -11.729 -11.113 0.579 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -11.185 -12.077 -0.779 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -12.942 -12.324 -2.044 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -14.496 -12.960 -1.495 1.00 0.00 H new ATOM 1208 N GLN A 77 -8.903 -12.377 -1.413 1.00 0.00 N ATOM 1209 CA GLN A 77 -8.601 -12.635 -2.818 1.00 0.00 C ATOM 1210 C GLN A 77 -7.176 -13.154 -2.988 1.00 0.00 C ATOM 1211 O GLN A 77 -6.951 -14.171 -3.645 1.00 0.00 O ATOM 1212 CB GLN A 77 -8.799 -11.362 -3.645 1.00 0.00 C ATOM 1213 CG GLN A 77 -9.800 -11.524 -4.777 1.00 0.00 C ATOM 1214 CD GLN A 77 -11.085 -10.758 -4.534 1.00 0.00 C ATOM 1215 OE1 GLN A 77 -12.181 -11.297 -4.688 1.00 0.00 O ATOM 1216 NE2 GLN A 77 -10.957 -9.492 -4.152 1.00 0.00 N ATOM 0 H GLN A 77 -8.963 -11.389 -1.168 1.00 0.00 H new ATOM 0 HA GLN A 77 -9.288 -13.403 -3.175 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -9.133 -10.559 -2.987 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.839 -11.055 -4.061 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -9.348 -11.182 -5.708 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -10.031 -12.582 -4.904 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -10.029 -9.085 -4.037 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -11.787 -8.927 -3.974 1.00 0.00 H new ATOM 1225 N LEU A 78 -6.216 -12.452 -2.393 1.00 0.00 N ATOM 1226 CA LEU A 78 -4.815 -12.849 -2.483 1.00 0.00 C ATOM 1227 C LEU A 78 -4.548 -14.103 -1.658 1.00 0.00 C ATOM 1228 O LEU A 78 -3.680 -14.907 -1.995 1.00 0.00 O ATOM 1229 CB LEU A 78 -3.903 -11.710 -2.018 1.00 0.00 C ATOM 1230 CG LEU A 78 -4.197 -11.169 -0.617 1.00 0.00 C ATOM 1231 CD1 LEU A 78 -3.378 -11.915 0.425 1.00 0.00 C ATOM 1232 CD2 LEU A 78 -3.914 -9.676 -0.553 1.00 0.00 C ATOM 0 H LEU A 78 -6.382 -11.608 -1.845 1.00 0.00 H new ATOM 0 HA LEU A 78 -4.597 -13.072 -3.527 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.871 -12.058 -2.046 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -3.982 -10.889 -2.731 1.00 0.00 H new ATOM 0 HG LEU A 78 -5.253 -11.328 -0.400 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -3.600 -11.517 1.415 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -3.630 -12.975 0.395 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.316 -11.788 0.212 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -4.128 -9.308 0.450 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.866 -9.494 -0.790 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.545 -9.155 -1.273 1.00 0.00 H new ATOM 1244 N ARG A 79 -5.303 -14.265 -0.575 1.00 0.00 N ATOM 1245 CA ARG A 79 -5.148 -15.424 0.297 1.00 0.00 C ATOM 1246 C ARG A 79 -5.507 -16.712 -0.440 1.00 0.00 C ATOM 1247 O ARG A 79 -5.003 -17.787 -0.114 1.00 0.00 O ATOM 1248 CB ARG A 79 -6.026 -15.270 1.543 1.00 0.00 C ATOM 1249 CG ARG A 79 -5.243 -14.940 2.802 1.00 0.00 C ATOM 1250 CD ARG A 79 -5.923 -15.496 4.043 1.00 0.00 C ATOM 1251 NE ARG A 79 -5.399 -16.809 4.414 1.00 0.00 N ATOM 1252 CZ ARG A 79 -5.718 -17.444 5.539 1.00 0.00 C ATOM 1253 NH1 ARG A 79 -6.558 -16.891 6.405 1.00 0.00 N ATOM 1254 NH2 ARG A 79 -5.196 -18.635 5.799 1.00 0.00 N ATOM 0 H ARG A 79 -6.027 -13.609 -0.281 1.00 0.00 H new ATOM 0 HA ARG A 79 -4.103 -15.483 0.602 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -6.760 -14.484 1.365 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -6.581 -16.194 1.702 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -4.236 -15.350 2.723 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -5.141 -13.859 2.895 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -5.785 -14.803 4.873 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -6.996 -15.571 3.865 1.00 0.00 H new ATOM 0 HE ARG A 79 -4.750 -17.266 3.773 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -6.962 -15.975 6.210 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -6.799 -17.382 7.266 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -4.550 -19.064 5.137 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -5.441 -19.122 6.661 1.00 0.00 H new ATOM 1268 N LYS A 80 -6.382 -16.594 -1.434 1.00 0.00 N ATOM 1269 CA LYS A 80 -6.810 -17.748 -2.218 1.00 0.00 C ATOM 1270 C LYS A 80 -5.678 -18.267 -3.101 1.00 0.00 C ATOM 1271 O LYS A 80 -5.680 -19.430 -3.507 1.00 0.00 O ATOM 1272 CB LYS A 80 -8.020 -17.383 -3.080 1.00 0.00 C ATOM 1273 CG LYS A 80 -9.089 -18.464 -3.119 1.00 0.00 C ATOM 1274 CD LYS A 80 -9.029 -19.260 -4.413 1.00 0.00 C ATOM 1275 CE LYS A 80 -10.083 -20.355 -4.444 1.00 0.00 C ATOM 1276 NZ LYS A 80 -10.743 -20.455 -5.776 1.00 0.00 N ATOM 0 H LYS A 80 -6.809 -15.711 -1.716 1.00 0.00 H new ATOM 0 HA LYS A 80 -7.090 -18.540 -1.523 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -8.461 -16.461 -2.700 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -7.683 -17.180 -4.097 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -8.959 -19.136 -2.271 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -10.074 -18.008 -3.017 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -9.174 -18.590 -5.260 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -8.039 -19.703 -4.523 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -9.621 -21.310 -4.195 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -10.835 -20.156 -3.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -11.455 -21.213 -5.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -11.206 -19.552 -6.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -10.030 -20.670 -6.502 1.00 0.00 H new ATOM 1290 N SER A 81 -4.713 -17.401 -3.399 1.00 0.00 N ATOM 1291 CA SER A 81 -3.577 -17.778 -4.237 1.00 0.00 C ATOM 1292 C SER A 81 -2.912 -19.051 -3.722 1.00 0.00 C ATOM 1293 O SER A 81 -3.075 -20.126 -4.301 1.00 0.00 O ATOM 1294 CB SER A 81 -2.555 -16.641 -4.288 1.00 0.00 C ATOM 1295 OG SER A 81 -3.089 -15.502 -4.943 1.00 0.00 O ATOM 0 H SER A 81 -4.694 -16.435 -3.073 1.00 0.00 H new ATOM 0 HA SER A 81 -3.951 -17.969 -5.243 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.253 -16.374 -3.275 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.659 -16.977 -4.809 1.00 0.00 H new ATOM 0 HG SER A 81 -3.501 -14.907 -4.282 1.00 0.00 H new ATOM 1301 N GLY A 82 -2.163 -18.923 -2.631 1.00 0.00 N ATOM 1302 CA GLY A 82 -1.487 -20.073 -2.059 1.00 0.00 C ATOM 1303 C GLY A 82 -0.048 -20.193 -2.522 1.00 0.00 C ATOM 1304 O GLY A 82 0.789 -20.769 -1.828 1.00 0.00 O ATOM 0 H GLY A 82 -2.012 -18.045 -2.134 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -1.510 -20.000 -0.972 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -2.029 -20.980 -2.329 1.00 0.00 H new ATOM 1308 N LYS A 83 0.240 -19.648 -3.700 1.00 0.00 N ATOM 1309 CA LYS A 83 1.586 -19.696 -4.257 1.00 0.00 C ATOM 1310 C LYS A 83 1.664 -18.907 -5.560 1.00 0.00 C ATOM 1311 O LYS A 83 2.401 -19.275 -6.477 1.00 0.00 O ATOM 1312 CB LYS A 83 2.007 -21.147 -4.500 1.00 0.00 C ATOM 1313 CG LYS A 83 0.956 -21.971 -5.225 1.00 0.00 C ATOM 1314 CD LYS A 83 1.414 -23.406 -5.429 1.00 0.00 C ATOM 1315 CE LYS A 83 0.812 -24.336 -4.387 1.00 0.00 C ATOM 1316 NZ LYS A 83 1.390 -24.104 -3.034 1.00 0.00 N ATOM 0 H LYS A 83 -0.442 -19.168 -4.287 1.00 0.00 H new ATOM 0 HA LYS A 83 2.267 -19.242 -3.537 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.929 -21.157 -5.081 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.229 -21.618 -3.542 1.00 0.00 H new ATOM 0 HG2 LYS A 83 0.028 -21.962 -4.654 1.00 0.00 H new ATOM 0 HG3 LYS A 83 0.739 -21.516 -6.192 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.129 -23.742 -6.426 1.00 0.00 H new ATOM 0 HD3 LYS A 83 2.502 -23.453 -5.375 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -0.268 -24.190 -4.350 1.00 0.00 H new ATOM 0 HE3 LYS A 83 0.983 -25.371 -4.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.111 -24.880 -2.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 2.427 -24.067 -3.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 1.036 -23.203 -2.655 1.00 0.00 H new ATOM 1330 N ASN A 84 0.900 -17.821 -5.636 1.00 0.00 N ATOM 1331 CA ASN A 84 0.880 -16.978 -6.826 1.00 0.00 C ATOM 1332 C ASN A 84 -0.041 -15.779 -6.623 1.00 0.00 C ATOM 1333 O ASN A 84 -1.034 -15.616 -7.334 1.00 0.00 O ATOM 1334 CB ASN A 84 0.425 -17.787 -8.044 1.00 0.00 C ATOM 1335 CG ASN A 84 0.624 -17.035 -9.345 1.00 0.00 C ATOM 1336 OD1 ASN A 84 0.202 -15.887 -9.483 1.00 0.00 O ATOM 1337 ND2 ASN A 84 1.269 -17.681 -10.309 1.00 0.00 N ATOM 0 H ASN A 84 0.286 -17.504 -4.886 1.00 0.00 H new ATOM 0 HA ASN A 84 1.892 -16.613 -7.001 1.00 0.00 H new ATOM 0 HB2 ASN A 84 0.979 -18.725 -8.081 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -0.629 -18.043 -7.933 1.00 0.00 H new ATOM 0 HD21 ASN A 84 1.432 -17.226 -11.207 1.00 0.00 H new ATOM 0 HD22 ASN A 84 1.602 -18.632 -10.151 1.00 0.00 H new ATOM 1344 N ALA A 85 0.292 -14.942 -5.646 1.00 0.00 N ATOM 1345 CA ALA A 85 -0.506 -13.758 -5.349 1.00 0.00 C ATOM 1346 C ALA A 85 0.156 -12.500 -5.899 1.00 0.00 C ATOM 1347 O ALA A 85 1.109 -11.983 -5.316 1.00 0.00 O ATOM 1348 CB ALA A 85 -0.720 -13.632 -3.848 1.00 0.00 C ATOM 0 H ALA A 85 1.109 -15.062 -5.047 1.00 0.00 H new ATOM 0 HA ALA A 85 -1.475 -13.869 -5.835 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -1.317 -12.744 -3.639 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.242 -14.515 -3.479 1.00 0.00 H new ATOM 0 HB3 ALA A 85 0.245 -13.546 -3.349 1.00 0.00 H new ATOM 1354 N LYS A 86 -0.354 -12.010 -7.024 1.00 0.00 N ATOM 1355 CA LYS A 86 0.192 -10.810 -7.649 1.00 0.00 C ATOM 1356 C LYS A 86 -0.597 -9.572 -7.237 1.00 0.00 C ATOM 1357 O LYS A 86 -1.825 -9.606 -7.148 1.00 0.00 O ATOM 1358 CB LYS A 86 0.195 -10.958 -9.176 1.00 0.00 C ATOM 1359 CG LYS A 86 -1.134 -10.615 -9.836 1.00 0.00 C ATOM 1360 CD LYS A 86 -1.364 -11.437 -11.094 1.00 0.00 C ATOM 1361 CE LYS A 86 -1.430 -10.557 -12.333 1.00 0.00 C ATOM 1362 NZ LYS A 86 -0.079 -10.097 -12.760 1.00 0.00 N ATOM 0 H LYS A 86 -1.143 -12.424 -7.521 1.00 0.00 H new ATOM 0 HA LYS A 86 1.219 -10.686 -7.306 1.00 0.00 H new ATOM 0 HB2 LYS A 86 0.971 -10.315 -9.591 1.00 0.00 H new ATOM 0 HB3 LYS A 86 0.461 -11.984 -9.430 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -1.947 -10.792 -9.132 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -1.154 -9.554 -10.085 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -0.560 -12.165 -11.206 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -2.292 -12.000 -10.997 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -1.899 -11.110 -13.147 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -2.061 -9.692 -12.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -0.177 -9.323 -13.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 0.451 -9.759 -11.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 0.434 -10.888 -13.200 1.00 0.00 H new ATOM 1376 N ILE A 87 0.116 -8.480 -6.987 1.00 0.00 N ATOM 1377 CA ILE A 87 -0.517 -7.232 -6.584 1.00 0.00 C ATOM 1378 C ILE A 87 -0.006 -6.059 -7.413 1.00 0.00 C ATOM 1379 O ILE A 87 1.193 -5.938 -7.665 1.00 0.00 O ATOM 1380 CB ILE A 87 -0.274 -6.932 -5.092 1.00 0.00 C ATOM 1381 CG1 ILE A 87 -0.596 -8.163 -4.244 1.00 0.00 C ATOM 1382 CG2 ILE A 87 -1.111 -5.742 -4.648 1.00 0.00 C ATOM 1383 CD1 ILE A 87 -0.337 -7.964 -2.766 1.00 0.00 C ATOM 0 H ILE A 87 1.133 -8.434 -7.057 1.00 0.00 H new ATOM 0 HA ILE A 87 -1.587 -7.355 -6.754 1.00 0.00 H new ATOM 0 HB ILE A 87 0.778 -6.683 -4.953 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -1.643 -8.430 -4.388 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -0.001 -9.004 -4.599 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -0.928 -5.543 -3.592 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -0.838 -4.865 -5.235 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -2.168 -5.964 -4.798 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -0.587 -8.877 -2.227 1.00 0.00 H new ATOM 0 HD12 ILE A 87 0.715 -7.727 -2.610 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -0.952 -7.144 -2.396 1.00 0.00 H new ATOM 1395 N THR A 88 -0.925 -5.196 -7.834 1.00 0.00 N ATOM 1396 CA THR A 88 -0.570 -4.029 -8.633 1.00 0.00 C ATOM 1397 C THR A 88 -0.472 -2.785 -7.757 1.00 0.00 C ATOM 1398 O THR A 88 -1.460 -2.351 -7.164 1.00 0.00 O ATOM 1399 CB THR A 88 -1.604 -3.809 -9.739 1.00 0.00 C ATOM 1400 OG1 THR A 88 -1.732 -4.969 -10.543 1.00 0.00 O ATOM 1401 CG2 THR A 88 -1.267 -2.652 -10.653 1.00 0.00 C ATOM 0 H THR A 88 -1.922 -5.283 -7.635 1.00 0.00 H new ATOM 0 HA THR A 88 0.404 -4.211 -9.088 1.00 0.00 H new ATOM 0 HB THR A 88 -2.536 -3.581 -9.222 1.00 0.00 H new ATOM 0 HG1 THR A 88 -2.153 -5.684 -10.021 1.00 0.00 H new ATOM 0 HG21 THR A 88 -2.041 -2.552 -11.414 1.00 0.00 H new ATOM 0 HG22 THR A 88 -1.210 -1.733 -10.070 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.307 -2.836 -11.134 1.00 0.00 H new ATOM 1409 N ILE A 89 0.726 -2.213 -7.680 1.00 0.00 N ATOM 1410 CA ILE A 89 0.952 -1.018 -6.875 1.00 0.00 C ATOM 1411 C ILE A 89 1.562 0.100 -7.713 1.00 0.00 C ATOM 1412 O ILE A 89 2.140 -0.148 -8.771 1.00 0.00 O ATOM 1413 CB ILE A 89 1.879 -1.310 -5.678 1.00 0.00 C ATOM 1414 CG1 ILE A 89 3.224 -1.852 -6.163 1.00 0.00 C ATOM 1415 CG2 ILE A 89 1.218 -2.294 -4.725 1.00 0.00 C ATOM 1416 CD1 ILE A 89 4.196 -0.770 -6.582 1.00 0.00 C ATOM 0 H ILE A 89 1.554 -2.558 -8.165 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.022 -0.701 -6.501 1.00 0.00 H new ATOM 0 HB ILE A 89 2.058 -0.378 -5.142 1.00 0.00 H new ATOM 0 HG12 ILE A 89 3.675 -2.446 -5.368 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.054 -2.523 -7.005 1.00 0.00 H new ATOM 0 HG21 ILE A 89 1.884 -2.490 -3.885 1.00 0.00 H new ATOM 0 HG22 ILE A 89 0.284 -1.871 -4.356 1.00 0.00 H new ATOM 0 HG23 ILE A 89 1.012 -3.227 -5.250 1.00 0.00 H new ATOM 0 HD11 ILE A 89 5.128 -1.227 -6.914 1.00 0.00 H new ATOM 0 HD12 ILE A 89 3.765 -0.190 -7.398 1.00 0.00 H new ATOM 0 HD13 ILE A 89 4.396 -0.113 -5.736 1.00 0.00 H new ATOM 1428 N ARG A 90 1.429 1.333 -7.234 1.00 0.00 N ATOM 1429 CA ARG A 90 1.966 2.488 -7.942 1.00 0.00 C ATOM 1430 C ARG A 90 2.648 3.453 -6.978 1.00 0.00 C ATOM 1431 O ARG A 90 2.258 3.570 -5.815 1.00 0.00 O ATOM 1432 CB ARG A 90 0.856 3.209 -8.707 1.00 0.00 C ATOM 1433 CG ARG A 90 -0.385 3.473 -7.871 1.00 0.00 C ATOM 1434 CD ARG A 90 -1.462 2.432 -8.127 1.00 0.00 C ATOM 1435 NE ARG A 90 -2.806 2.982 -7.959 1.00 0.00 N ATOM 1436 CZ ARG A 90 -3.429 3.711 -8.883 1.00 0.00 C ATOM 1437 NH1 ARG A 90 -2.837 3.977 -10.040 1.00 0.00 N ATOM 1438 NH2 ARG A 90 -4.649 4.174 -8.648 1.00 0.00 N ATOM 0 H ARG A 90 0.954 1.557 -6.359 1.00 0.00 H new ATOM 0 HA ARG A 90 2.711 2.129 -8.652 1.00 0.00 H new ATOM 0 HB2 ARG A 90 1.241 4.158 -9.081 1.00 0.00 H new ATOM 0 HB3 ARG A 90 0.579 2.613 -9.576 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -0.120 3.471 -6.814 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -0.775 4.465 -8.100 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -1.354 2.040 -9.138 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.325 1.593 -7.444 1.00 0.00 H new ATOM 0 HE ARG A 90 -3.295 2.797 -7.083 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -1.899 3.622 -10.226 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -3.320 4.536 -10.743 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -5.109 3.972 -7.760 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -5.127 4.733 -9.355 1.00 0.00 H new ATOM 1452 N ARG A 91 3.671 4.144 -7.473 1.00 0.00 N ATOM 1453 CA ARG A 91 4.415 5.102 -6.664 1.00 0.00 C ATOM 1454 C ARG A 91 4.931 6.253 -7.523 1.00 0.00 C ATOM 1455 O ARG A 91 5.030 6.132 -8.743 1.00 0.00 O ATOM 1456 CB ARG A 91 5.585 4.409 -5.962 1.00 0.00 C ATOM 1457 CG ARG A 91 6.654 3.895 -6.915 1.00 0.00 C ATOM 1458 CD ARG A 91 6.258 2.566 -7.538 1.00 0.00 C ATOM 1459 NE ARG A 91 7.333 1.998 -8.348 1.00 0.00 N ATOM 1460 CZ ARG A 91 8.389 1.366 -7.841 1.00 0.00 C ATOM 1461 NH1 ARG A 91 8.517 1.219 -6.527 1.00 0.00 N ATOM 1462 NH2 ARG A 91 9.321 0.880 -8.649 1.00 0.00 N ATOM 0 H ARG A 91 4.004 4.057 -8.433 1.00 0.00 H new ATOM 0 HA ARG A 91 3.739 5.508 -5.912 1.00 0.00 H new ATOM 0 HB2 ARG A 91 6.042 5.108 -5.261 1.00 0.00 H new ATOM 0 HB3 ARG A 91 5.202 3.574 -5.376 1.00 0.00 H new ATOM 0 HG2 ARG A 91 6.824 4.630 -7.702 1.00 0.00 H new ATOM 0 HG3 ARG A 91 7.595 3.779 -6.378 1.00 0.00 H new ATOM 0 HD2 ARG A 91 5.988 1.863 -6.750 1.00 0.00 H new ATOM 0 HD3 ARG A 91 5.372 2.706 -8.158 1.00 0.00 H new ATOM 0 HE ARG A 91 7.271 2.091 -9.362 1.00 0.00 H new ATOM 0 HH11 ARG A 91 7.804 1.591 -5.900 1.00 0.00 H new ATOM 0 HH12 ARG A 91 9.329 0.734 -6.145 1.00 0.00 H new ATOM 0 HH21 ARG A 91 9.229 0.990 -9.659 1.00 0.00 H new ATOM 0 HH22 ARG A 91 10.130 0.396 -8.261 1.00 0.00 H new ATOM 1476 N LYS A 92 5.260 7.367 -6.878 1.00 0.00 N ATOM 1477 CA LYS A 92 5.767 8.537 -7.588 1.00 0.00 C ATOM 1478 C LYS A 92 6.998 9.109 -6.892 1.00 0.00 C ATOM 1479 O LYS A 92 8.063 9.231 -7.497 1.00 0.00 O ATOM 1480 CB LYS A 92 4.683 9.614 -7.704 1.00 0.00 C ATOM 1481 CG LYS A 92 3.734 9.668 -6.515 1.00 0.00 C ATOM 1482 CD LYS A 92 3.508 11.096 -6.045 1.00 0.00 C ATOM 1483 CE LYS A 92 2.513 11.153 -4.896 1.00 0.00 C ATOM 1484 NZ LYS A 92 2.483 12.496 -4.255 1.00 0.00 N ATOM 0 H LYS A 92 5.185 7.485 -5.868 1.00 0.00 H new ATOM 0 HA LYS A 92 6.053 8.218 -8.590 1.00 0.00 H new ATOM 0 HB2 LYS A 92 5.162 10.586 -7.818 1.00 0.00 H new ATOM 0 HB3 LYS A 92 4.104 9.436 -8.610 1.00 0.00 H new ATOM 0 HG2 LYS A 92 2.779 9.219 -6.790 1.00 0.00 H new ATOM 0 HG3 LYS A 92 4.141 9.075 -5.696 1.00 0.00 H new ATOM 0 HD2 LYS A 92 4.456 11.531 -5.729 1.00 0.00 H new ATOM 0 HD3 LYS A 92 3.142 11.700 -6.875 1.00 0.00 H new ATOM 0 HE2 LYS A 92 1.518 10.904 -5.265 1.00 0.00 H new ATOM 0 HE3 LYS A 92 2.774 10.401 -4.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 1.793 12.494 -3.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 3.426 12.723 -3.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 2.209 13.211 -4.959 1.00 0.00 H new ATOM 1498 N LYS A 93 6.848 9.458 -5.618 1.00 0.00 N ATOM 1499 CA LYS A 93 7.949 10.018 -4.843 1.00 0.00 C ATOM 1500 C LYS A 93 8.484 11.289 -5.495 1.00 0.00 C ATOM 1501 O LYS A 93 8.011 12.385 -5.129 1.00 0.00 O ATOM 1502 CB LYS A 93 9.073 8.989 -4.698 1.00 0.00 C ATOM 1503 CG LYS A 93 9.080 8.278 -3.354 1.00 0.00 C ATOM 1504 CD LYS A 93 10.456 8.308 -2.710 1.00 0.00 C ATOM 1505 CE LYS A 93 10.521 7.405 -1.489 1.00 0.00 C ATOM 1506 NZ LYS A 93 9.919 8.049 -0.289 1.00 0.00 N ATOM 1507 OXT LYS A 93 9.371 11.177 -6.366 1.00 0.00 O ATOM 0 H LYS A 93 5.974 9.363 -5.101 1.00 0.00 H new ATOM 0 HA LYS A 93 7.571 10.273 -3.853 1.00 0.00 H new ATOM 0 HB2 LYS A 93 8.979 8.247 -5.491 1.00 0.00 H new ATOM 0 HB3 LYS A 93 10.031 9.488 -4.840 1.00 0.00 H new ATOM 0 HG2 LYS A 93 8.357 8.750 -2.689 1.00 0.00 H new ATOM 0 HG3 LYS A 93 8.763 7.244 -3.488 1.00 0.00 H new ATOM 0 HD2 LYS A 93 11.205 7.994 -3.436 1.00 0.00 H new ATOM 0 HD3 LYS A 93 10.701 9.330 -2.421 1.00 0.00 H new ATOM 0 HE2 LYS A 93 10.000 6.471 -1.700 1.00 0.00 H new ATOM 0 HE3 LYS A 93 11.560 7.150 -1.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 9.829 7.347 0.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 10.529 8.829 0.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 8.978 8.421 -0.530 1.00 0.00 H new TER 1521 LYS A 93