USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=16 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 60 MET CE :methyl 162:sc= -0.0437 (180deg=-0.476) USER MOD Set 1.2: A 88 THR OG1 : rot 68:sc= -0.466 USER MOD Set 2.1: A 22 SER OG : rot 150:sc= 0.307 USER MOD Set 2.2: A 40 SER OG : rot -177:sc= 0.292 USER MOD Single : A 4 GLN : amide:sc= -0.0649 K(o=-0.065,f=-2.8!) USER MOD Single : A 5 HIS : no HD1:sc= -0.848 X(o=-0.85,f=-0.73) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 38:sc= 0.499 USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=-0.069) USER MOD Single : A -3 SER OG : rot 48:sc= 1.05 USER MOD Single : A -7 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 HIS : no HD1:sc= -0.0502 X(o=-0.05,f=-0.52) USER MOD Single : A 27 ASN : amide:sc= -1.06 K(o=-1.1,f=-1.8!) USER MOD Single : A 29 HIS : no HD1:sc= -0.0784 K(o=-0.078,f=-1.2) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0495 USER MOD Single : A 36 SER OG : rot 180:sc= 0.109 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.144 K(o=-0.14,f=-1.6!) USER MOD Single : A 53 GLN : amide:sc= -0.43 X(o=-0.43,f=-0.081) USER MOD Single : A 55 ASN : amide:sc= -0.336 X(o=-0.34,f=0) USER MOD Single : A 62 ASN : amide:sc= -0.0424 X(o=-0.042,f=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl -150:sc= -6.81! (180deg=-9.17!) USER MOD Single : A 68 ASN : amide:sc= -1.29 K(o=-1.3,f=-2.2) USER MOD Single : A 71 HIS : no HD1:sc= -2.71 K(o=-2.7,f=-1.4) USER MOD Single : A 76 GLN : amide:sc= -0.807 K(o=-0.81,f=-0.18) USER MOD Single : A 77 GLN : amide:sc= -3.5! C(o=-3.5!,f=-4.7!) USER MOD Single : A 80 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00267) USER MOD Single : A 81 SER OG : rot -105:sc= -0.0611 USER MOD Single : A 83 LYS NZ :NH3+ 157:sc= -0.189 (180deg=-0.775) USER MOD Single : A 84 ASN : amide:sc= -0.806 K(o=-0.81,f=-5.2!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -130:sc= 2.05 (180deg=-0.398) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -7 17.690 16.783 -3.158 1.00 0.00 N ATOM 2 CA GLY A -7 18.011 17.928 -4.053 1.00 0.00 C ATOM 3 C GLY A -7 16.806 18.407 -4.841 1.00 0.00 C ATOM 4 O GLY A -7 16.064 19.272 -4.375 1.00 0.00 O ATOM 0 H1 GLY A -7 18.546 16.494 -2.643 1.00 0.00 H new ATOM 0 H2 GLY A -7 16.957 17.069 -2.478 1.00 0.00 H new ATOM 0 H3 GLY A -7 17.342 15.985 -3.727 1.00 0.00 H new ATOM 0 HA2 GLY A -7 18.402 18.752 -3.457 1.00 0.00 H new ATOM 0 HA3 GLY A -7 18.800 17.634 -4.745 1.00 0.00 H new ATOM 10 N PRO A -6 16.583 17.859 -6.047 1.00 0.00 N ATOM 11 CA PRO A -6 15.448 18.246 -6.893 1.00 0.00 C ATOM 12 C PRO A -6 14.115 17.772 -6.325 1.00 0.00 C ATOM 13 O PRO A -6 13.887 16.573 -6.167 1.00 0.00 O ATOM 14 CB PRO A -6 15.742 17.549 -8.222 1.00 0.00 C ATOM 15 CG PRO A -6 16.592 16.381 -7.859 1.00 0.00 C ATOM 16 CD PRO A -6 17.418 16.821 -6.681 1.00 0.00 C ATOM 0 HA PRO A -6 15.352 19.329 -6.977 1.00 0.00 H new ATOM 0 HB2 PRO A -6 14.823 17.232 -8.714 1.00 0.00 H new ATOM 0 HB3 PRO A -6 16.259 18.215 -8.912 1.00 0.00 H new ATOM 0 HG2 PRO A -6 15.979 15.516 -7.605 1.00 0.00 H new ATOM 0 HG3 PRO A -6 17.228 16.087 -8.694 1.00 0.00 H new ATOM 0 HD2 PRO A -6 17.618 15.994 -5.999 1.00 0.00 H new ATOM 0 HD3 PRO A -6 18.384 17.218 -6.993 1.00 0.00 H new ATOM 24 N LEU A -5 13.236 18.722 -6.022 1.00 0.00 N ATOM 25 CA LEU A -5 11.924 18.401 -5.472 1.00 0.00 C ATOM 26 C LEU A -5 10.879 18.306 -6.579 1.00 0.00 C ATOM 27 O LEU A -5 10.215 17.281 -6.734 1.00 0.00 O ATOM 28 CB LEU A -5 11.504 19.457 -4.448 1.00 0.00 C ATOM 29 CG LEU A -5 12.285 19.430 -3.133 1.00 0.00 C ATOM 30 CD1 LEU A -5 12.349 20.821 -2.523 1.00 0.00 C ATOM 31 CD2 LEU A -5 11.652 18.448 -2.159 1.00 0.00 C ATOM 0 H LEU A -5 13.408 19.719 -6.148 1.00 0.00 H new ATOM 0 HA LEU A -5 11.993 17.432 -4.977 1.00 0.00 H new ATOM 0 HB2 LEU A -5 11.615 20.443 -4.899 1.00 0.00 H new ATOM 0 HB3 LEU A -5 10.445 19.326 -4.227 1.00 0.00 H new ATOM 0 HG LEU A -5 13.302 19.100 -3.342 1.00 0.00 H new ATOM 0 HD11 LEU A -5 12.908 20.783 -1.588 1.00 0.00 H new ATOM 0 HD12 LEU A -5 12.846 21.500 -3.216 1.00 0.00 H new ATOM 0 HD13 LEU A -5 11.338 21.179 -2.327 1.00 0.00 H new ATOM 0 HD21 LEU A -5 12.220 18.441 -1.229 1.00 0.00 H new ATOM 0 HD22 LEU A -5 10.625 18.749 -1.955 1.00 0.00 H new ATOM 0 HD23 LEU A -5 11.657 17.449 -2.595 1.00 0.00 H new ATOM 43 N GLY A -4 10.739 19.381 -7.347 1.00 0.00 N ATOM 44 CA GLY A -4 9.774 19.399 -8.430 1.00 0.00 C ATOM 45 C GLY A -4 10.217 18.563 -9.615 1.00 0.00 C ATOM 46 O GLY A -4 11.112 18.959 -10.361 1.00 0.00 O ATOM 0 H GLY A -4 11.277 20.241 -7.239 1.00 0.00 H new ATOM 0 HA2 GLY A -4 8.816 19.028 -8.065 1.00 0.00 H new ATOM 0 HA3 GLY A -4 9.615 20.428 -8.754 1.00 0.00 H new ATOM 50 N SER A -3 9.589 17.405 -9.788 1.00 0.00 N ATOM 51 CA SER A -3 9.924 16.511 -10.890 1.00 0.00 C ATOM 52 C SER A -3 8.762 15.575 -11.206 1.00 0.00 C ATOM 53 O SER A -3 8.737 14.428 -10.760 1.00 0.00 O ATOM 54 CB SER A -3 11.173 15.696 -10.551 1.00 0.00 C ATOM 55 OG SER A -3 10.943 14.846 -9.441 1.00 0.00 O ATOM 0 H SER A -3 8.845 17.064 -9.179 1.00 0.00 H new ATOM 0 HA SER A -3 10.124 17.121 -11.771 1.00 0.00 H new ATOM 0 HB2 SER A -3 11.467 15.100 -11.415 1.00 0.00 H new ATOM 0 HB3 SER A -3 12.002 16.369 -10.332 1.00 0.00 H new ATOM 0 HG SER A -3 10.101 14.361 -9.569 1.00 0.00 H new ATOM 61 N ASP A -2 7.800 16.073 -11.976 1.00 0.00 N ATOM 62 CA ASP A -2 6.634 15.282 -12.351 1.00 0.00 C ATOM 63 C ASP A -2 5.846 14.854 -11.118 1.00 0.00 C ATOM 64 O ASP A -2 6.388 14.785 -10.014 1.00 0.00 O ATOM 65 CB ASP A -2 7.065 14.048 -13.147 1.00 0.00 C ATOM 66 CG ASP A -2 7.659 14.408 -14.495 1.00 0.00 C ATOM 67 OD1 ASP A -2 8.882 14.651 -14.559 1.00 0.00 O ATOM 68 OD2 ASP A -2 6.899 14.450 -15.486 1.00 0.00 O ATOM 0 H ASP A -2 7.805 17.021 -12.352 1.00 0.00 H new ATOM 0 HA ASP A -2 5.990 15.903 -12.974 1.00 0.00 H new ATOM 0 HB2 ASP A -2 7.797 13.484 -12.569 1.00 0.00 H new ATOM 0 HB3 ASP A -2 6.204 13.396 -13.295 1.00 0.00 H new ATOM 73 N HIS A -1 4.564 14.569 -11.313 1.00 0.00 N ATOM 74 CA HIS A -1 3.698 14.147 -10.217 1.00 0.00 C ATOM 75 C HIS A -1 2.714 13.078 -10.682 1.00 0.00 C ATOM 76 O HIS A -1 1.604 12.973 -10.161 1.00 0.00 O ATOM 77 CB HIS A -1 2.938 15.348 -9.650 1.00 0.00 C ATOM 78 CG HIS A -1 3.608 15.977 -8.468 1.00 0.00 C ATOM 79 ND1 HIS A -1 4.686 16.829 -8.578 1.00 0.00 N ATOM 80 CD2 HIS A -1 3.347 15.874 -7.142 1.00 0.00 C ATOM 81 CE1 HIS A -1 5.059 17.222 -7.374 1.00 0.00 C ATOM 82 NE2 HIS A -1 4.262 16.659 -6.486 1.00 0.00 N ATOM 0 H HIS A -1 4.100 14.622 -12.220 1.00 0.00 H new ATOM 0 HA HIS A -1 4.325 13.720 -9.434 1.00 0.00 H new ATOM 0 HB2 HIS A -1 2.823 16.097 -10.433 1.00 0.00 H new ATOM 0 HB3 HIS A -1 1.936 15.030 -9.363 1.00 0.00 H new ATOM 0 HD2 HIS A -1 2.565 15.284 -6.687 1.00 0.00 H new ATOM 0 HE1 HIS A -1 5.878 17.891 -7.153 1.00 0.00 H new ATOM 0 HE2 HIS A -1 4.317 16.786 -5.475 1.00 0.00 H new ATOM 91 N ILE A 1 3.130 12.284 -11.664 1.00 0.00 N ATOM 92 CA ILE A 1 2.288 11.221 -12.197 1.00 0.00 C ATOM 93 C ILE A 1 2.756 9.858 -11.702 1.00 0.00 C ATOM 94 O ILE A 1 3.950 9.560 -11.712 1.00 0.00 O ATOM 95 CB ILE A 1 2.284 11.222 -13.738 1.00 0.00 C ATOM 96 CG1 ILE A 1 2.030 12.634 -14.269 1.00 0.00 C ATOM 97 CG2 ILE A 1 1.238 10.253 -14.265 1.00 0.00 C ATOM 98 CD1 ILE A 1 3.282 13.337 -14.747 1.00 0.00 C ATOM 0 H ILE A 1 4.046 12.358 -12.106 1.00 0.00 H new ATOM 0 HA ILE A 1 1.275 11.410 -11.842 1.00 0.00 H new ATOM 0 HB ILE A 1 3.262 10.895 -14.090 1.00 0.00 H new ATOM 0 HG12 ILE A 1 1.317 12.581 -15.092 1.00 0.00 H new ATOM 0 HG13 ILE A 1 1.566 13.230 -13.483 1.00 0.00 H new ATOM 0 HG21 ILE A 1 1.247 10.265 -15.355 1.00 0.00 H new ATOM 0 HG22 ILE A 1 1.463 9.247 -13.911 1.00 0.00 H new ATOM 0 HG23 ILE A 1 0.253 10.551 -13.907 1.00 0.00 H new ATOM 0 HD11 ILE A 1 3.025 14.332 -15.109 1.00 0.00 H new ATOM 0 HD12 ILE A 1 3.989 13.423 -13.922 1.00 0.00 H new ATOM 0 HD13 ILE A 1 3.736 12.763 -15.555 1.00 0.00 H new ATOM 110 N TRP A 2 1.810 9.032 -11.269 1.00 0.00 N ATOM 111 CA TRP A 2 2.130 7.699 -10.767 1.00 0.00 C ATOM 112 C TRP A 2 2.043 6.658 -11.878 1.00 0.00 C ATOM 113 O TRP A 2 1.247 6.787 -12.807 1.00 0.00 O ATOM 114 CB TRP A 2 1.196 7.310 -9.614 1.00 0.00 C ATOM 115 CG TRP A 2 -0.223 7.765 -9.791 1.00 0.00 C ATOM 116 CD1 TRP A 2 -0.973 7.703 -10.932 1.00 0.00 C ATOM 117 CD2 TRP A 2 -1.064 8.352 -8.791 1.00 0.00 C ATOM 118 NE1 TRP A 2 -2.226 8.217 -10.703 1.00 0.00 N ATOM 119 CE2 TRP A 2 -2.307 8.621 -9.396 1.00 0.00 C ATOM 120 CE3 TRP A 2 -0.888 8.674 -7.443 1.00 0.00 C ATOM 121 CZ2 TRP A 2 -3.365 9.198 -8.698 1.00 0.00 C ATOM 122 CZ3 TRP A 2 -1.938 9.247 -6.752 1.00 0.00 C ATOM 123 CH2 TRP A 2 -3.163 9.504 -7.380 1.00 0.00 C ATOM 0 H TRP A 2 0.816 9.261 -11.255 1.00 0.00 H new ATOM 0 HA TRP A 2 3.154 7.726 -10.396 1.00 0.00 H new ATOM 0 HB2 TRP A 2 1.207 6.226 -9.503 1.00 0.00 H new ATOM 0 HB3 TRP A 2 1.587 7.729 -8.687 1.00 0.00 H new ATOM 0 HD1 TRP A 2 -0.630 7.307 -11.877 1.00 0.00 H new ATOM 0 HE1 TRP A 2 -2.974 8.287 -11.393 1.00 0.00 H new ATOM 0 HE3 TRP A 2 0.053 8.478 -6.950 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 -4.311 9.397 -9.180 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 -1.812 9.501 -5.710 1.00 0.00 H new ATOM 0 HH2 TRP A 2 -3.965 9.953 -6.812 1.00 0.00 H new ATOM 134 N GLU A 3 2.863 5.620 -11.769 1.00 0.00 N ATOM 135 CA GLU A 3 2.877 4.546 -12.755 1.00 0.00 C ATOM 136 C GLU A 3 2.372 3.255 -12.121 1.00 0.00 C ATOM 137 O GLU A 3 2.545 3.043 -10.926 1.00 0.00 O ATOM 138 CB GLU A 3 4.291 4.346 -13.310 1.00 0.00 C ATOM 139 CG GLU A 3 4.412 4.670 -14.790 1.00 0.00 C ATOM 140 CD GLU A 3 3.572 3.753 -15.657 1.00 0.00 C ATOM 141 OE1 GLU A 3 2.328 3.834 -15.576 1.00 0.00 O ATOM 142 OE2 GLU A 3 4.157 2.956 -16.421 1.00 0.00 O ATOM 0 H GLU A 3 3.529 5.499 -11.006 1.00 0.00 H new ATOM 0 HA GLU A 3 2.219 4.818 -13.580 1.00 0.00 H new ATOM 0 HB2 GLU A 3 4.985 4.974 -12.751 1.00 0.00 H new ATOM 0 HB3 GLU A 3 4.594 3.312 -13.146 1.00 0.00 H new ATOM 0 HG2 GLU A 3 4.107 5.703 -14.958 1.00 0.00 H new ATOM 0 HG3 GLU A 3 5.457 4.593 -15.091 1.00 0.00 H new ATOM 149 N GLN A 4 1.743 2.401 -12.920 1.00 0.00 N ATOM 150 CA GLN A 4 1.213 1.143 -12.406 1.00 0.00 C ATOM 151 C GLN A 4 2.044 -0.045 -12.878 1.00 0.00 C ATOM 152 O GLN A 4 2.285 -0.216 -14.074 1.00 0.00 O ATOM 153 CB GLN A 4 -0.243 0.962 -12.836 1.00 0.00 C ATOM 154 CG GLN A 4 -1.102 0.273 -11.788 1.00 0.00 C ATOM 155 CD GLN A 4 -2.534 0.077 -12.246 1.00 0.00 C ATOM 156 OE1 GLN A 4 -2.924 -1.019 -12.649 1.00 0.00 O ATOM 157 NE2 GLN A 4 -3.325 1.141 -12.186 1.00 0.00 N ATOM 0 H GLN A 4 1.588 2.554 -13.917 1.00 0.00 H new ATOM 0 HA GLN A 4 1.264 1.184 -11.318 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -0.671 1.939 -13.061 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -0.272 0.381 -13.758 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -0.666 -0.696 -11.546 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -1.095 0.864 -10.872 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -2.959 2.030 -11.845 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -4.299 1.070 -12.481 1.00 0.00 H new ATOM 166 N HIS A 5 2.476 -0.866 -11.925 1.00 0.00 N ATOM 167 CA HIS A 5 3.276 -2.045 -12.230 1.00 0.00 C ATOM 168 C HIS A 5 2.684 -3.283 -11.564 1.00 0.00 C ATOM 169 O HIS A 5 2.245 -3.231 -10.416 1.00 0.00 O ATOM 170 CB HIS A 5 4.720 -1.841 -11.765 1.00 0.00 C ATOM 171 CG HIS A 5 5.445 -0.774 -12.522 1.00 0.00 C ATOM 172 ND1 HIS A 5 5.421 0.557 -12.159 1.00 0.00 N ATOM 173 CD2 HIS A 5 6.219 -0.844 -13.632 1.00 0.00 C ATOM 174 CE1 HIS A 5 6.148 1.258 -13.012 1.00 0.00 C ATOM 175 NE2 HIS A 5 6.642 0.431 -13.914 1.00 0.00 N ATOM 0 H HIS A 5 2.284 -0.734 -10.932 1.00 0.00 H new ATOM 0 HA HIS A 5 3.269 -2.194 -13.310 1.00 0.00 H new ATOM 0 HB2 HIS A 5 4.720 -1.587 -10.705 1.00 0.00 H new ATOM 0 HB3 HIS A 5 5.263 -2.781 -11.867 1.00 0.00 H new ATOM 0 HD2 HIS A 5 6.458 -1.737 -14.191 1.00 0.00 H new ATOM 0 HE1 HIS A 5 6.310 2.325 -12.977 1.00 0.00 H new ATOM 0 HE2 HIS A 5 7.242 0.697 -14.695 1.00 0.00 H new ATOM 184 N THR A 6 2.670 -4.394 -12.293 1.00 0.00 N ATOM 185 CA THR A 6 2.126 -5.642 -11.769 1.00 0.00 C ATOM 186 C THR A 6 3.242 -6.608 -11.384 1.00 0.00 C ATOM 187 O THR A 6 4.080 -6.967 -12.211 1.00 0.00 O ATOM 188 CB THR A 6 1.204 -6.296 -12.800 1.00 0.00 C ATOM 189 OG1 THR A 6 0.590 -7.451 -12.259 1.00 0.00 O ATOM 190 CG2 THR A 6 1.919 -6.706 -14.069 1.00 0.00 C ATOM 0 H THR A 6 3.028 -4.456 -13.246 1.00 0.00 H new ATOM 0 HA THR A 6 1.550 -5.407 -10.874 1.00 0.00 H new ATOM 0 HB THR A 6 0.464 -5.536 -13.051 1.00 0.00 H new ATOM 0 HG1 THR A 6 0.003 -7.855 -12.932 1.00 0.00 H new ATOM 0 HG21 THR A 6 1.207 -7.163 -14.756 1.00 0.00 H new ATOM 0 HG22 THR A 6 2.362 -5.827 -14.537 1.00 0.00 H new ATOM 0 HG23 THR A 6 2.703 -7.424 -13.829 1.00 0.00 H new ATOM 198 N VAL A 7 3.246 -7.022 -10.121 1.00 0.00 N ATOM 199 CA VAL A 7 4.255 -7.947 -9.619 1.00 0.00 C ATOM 200 C VAL A 7 3.615 -9.239 -9.124 1.00 0.00 C ATOM 201 O VAL A 7 2.483 -9.236 -8.640 1.00 0.00 O ATOM 202 CB VAL A 7 5.071 -7.319 -8.471 1.00 0.00 C ATOM 203 CG1 VAL A 7 6.092 -6.334 -9.018 1.00 0.00 C ATOM 204 CG2 VAL A 7 4.149 -6.641 -7.468 1.00 0.00 C ATOM 0 H VAL A 7 2.560 -6.730 -9.425 1.00 0.00 H new ATOM 0 HA VAL A 7 4.924 -8.170 -10.451 1.00 0.00 H new ATOM 0 HB VAL A 7 5.608 -8.115 -7.955 1.00 0.00 H new ATOM 0 HG11 VAL A 7 6.658 -5.901 -8.193 1.00 0.00 H new ATOM 0 HG12 VAL A 7 6.773 -6.853 -9.693 1.00 0.00 H new ATOM 0 HG13 VAL A 7 5.578 -5.541 -9.561 1.00 0.00 H new ATOM 0 HG21 VAL A 7 4.743 -6.204 -6.665 1.00 0.00 H new ATOM 0 HG22 VAL A 7 3.581 -5.856 -7.968 1.00 0.00 H new ATOM 0 HG23 VAL A 7 3.461 -7.377 -7.051 1.00 0.00 H new ATOM 214 N THR A 8 4.345 -10.344 -9.248 1.00 0.00 N ATOM 215 CA THR A 8 3.844 -11.645 -8.813 1.00 0.00 C ATOM 216 C THR A 8 4.651 -12.174 -7.631 1.00 0.00 C ATOM 217 O THR A 8 5.829 -12.503 -7.770 1.00 0.00 O ATOM 218 CB THR A 8 3.894 -12.646 -9.969 1.00 0.00 C ATOM 219 OG1 THR A 8 5.204 -12.732 -10.502 1.00 0.00 O ATOM 220 CG2 THR A 8 2.958 -12.295 -11.105 1.00 0.00 C ATOM 0 H THR A 8 5.284 -10.365 -9.645 1.00 0.00 H new ATOM 0 HA THR A 8 2.809 -11.519 -8.494 1.00 0.00 H new ATOM 0 HB THR A 8 3.579 -13.598 -9.541 1.00 0.00 H new ATOM 0 HG1 THR A 8 5.858 -12.667 -9.775 1.00 0.00 H new ATOM 0 HG21 THR A 8 3.043 -13.045 -11.891 1.00 0.00 H new ATOM 0 HG22 THR A 8 1.932 -12.270 -10.737 1.00 0.00 H new ATOM 0 HG23 THR A 8 3.224 -11.317 -11.506 1.00 0.00 H new ATOM 228 N LEU A 9 4.009 -12.254 -6.470 1.00 0.00 N ATOM 229 CA LEU A 9 4.668 -12.744 -5.264 1.00 0.00 C ATOM 230 C LEU A 9 4.186 -14.147 -4.910 1.00 0.00 C ATOM 231 O LEU A 9 3.011 -14.353 -4.609 1.00 0.00 O ATOM 232 CB LEU A 9 4.413 -11.794 -4.093 1.00 0.00 C ATOM 233 CG LEU A 9 4.416 -10.304 -4.452 1.00 0.00 C ATOM 234 CD1 LEU A 9 3.067 -9.673 -4.140 1.00 0.00 C ATOM 235 CD2 LEU A 9 5.529 -9.575 -3.713 1.00 0.00 C ATOM 0 H LEU A 9 3.034 -11.986 -6.338 1.00 0.00 H new ATOM 0 HA LEU A 9 5.739 -12.787 -5.460 1.00 0.00 H new ATOM 0 HB2 LEU A 9 3.450 -12.042 -3.647 1.00 0.00 H new ATOM 0 HB3 LEU A 9 5.172 -11.970 -3.331 1.00 0.00 H new ATOM 0 HG LEU A 9 4.598 -10.213 -5.523 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.091 -8.615 -4.402 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.289 -10.173 -4.718 1.00 0.00 H new ATOM 0 HD13 LEU A 9 2.853 -9.778 -3.076 1.00 0.00 H new ATOM 0 HD21 LEU A 9 5.513 -8.519 -3.982 1.00 0.00 H new ATOM 0 HD22 LEU A 9 5.380 -9.678 -2.638 1.00 0.00 H new ATOM 0 HD23 LEU A 9 6.492 -10.005 -3.989 1.00 0.00 H new ATOM 247 N HIS A 10 5.102 -15.109 -4.946 1.00 0.00 N ATOM 248 CA HIS A 10 4.770 -16.493 -4.625 1.00 0.00 C ATOM 249 C HIS A 10 4.728 -16.705 -3.115 1.00 0.00 C ATOM 250 O HIS A 10 5.685 -16.390 -2.409 1.00 0.00 O ATOM 251 CB HIS A 10 5.787 -17.444 -5.258 1.00 0.00 C ATOM 252 CG HIS A 10 5.966 -17.235 -6.730 1.00 0.00 C ATOM 253 ND1 HIS A 10 5.014 -16.636 -7.528 1.00 0.00 N ATOM 254 CD2 HIS A 10 6.997 -17.549 -7.550 1.00 0.00 C ATOM 255 CE1 HIS A 10 5.451 -16.592 -8.774 1.00 0.00 C ATOM 256 NE2 HIS A 10 6.652 -17.139 -8.814 1.00 0.00 N ATOM 0 H HIS A 10 6.080 -14.956 -5.194 1.00 0.00 H new ATOM 0 HA HIS A 10 3.782 -16.708 -5.032 1.00 0.00 H new ATOM 0 HB2 HIS A 10 6.749 -17.317 -4.762 1.00 0.00 H new ATOM 0 HB3 HIS A 10 5.470 -18.472 -5.081 1.00 0.00 H new ATOM 0 HD2 HIS A 10 7.919 -18.032 -7.263 1.00 0.00 H new ATOM 0 HE1 HIS A 10 4.917 -16.179 -9.617 1.00 0.00 H new ATOM 0 HE2 HIS A 10 7.230 -17.240 -9.648 1.00 0.00 H new ATOM 265 N ARG A 11 3.614 -17.241 -2.627 1.00 0.00 N ATOM 266 CA ARG A 11 3.449 -17.493 -1.200 1.00 0.00 C ATOM 267 C ARG A 11 4.520 -18.452 -0.688 1.00 0.00 C ATOM 268 O ARG A 11 4.850 -19.438 -1.346 1.00 0.00 O ATOM 269 CB ARG A 11 2.059 -18.067 -0.919 1.00 0.00 C ATOM 270 CG ARG A 11 0.923 -17.163 -1.374 1.00 0.00 C ATOM 271 CD ARG A 11 0.037 -16.743 -0.211 1.00 0.00 C ATOM 272 NE ARG A 11 -0.987 -17.742 0.087 1.00 0.00 N ATOM 273 CZ ARG A 11 -0.914 -18.614 1.093 1.00 0.00 C ATOM 274 NH1 ARG A 11 0.137 -18.624 1.906 1.00 0.00 N ATOM 275 NH2 ARG A 11 -1.898 -19.483 1.287 1.00 0.00 N ATOM 0 H ARG A 11 2.813 -17.509 -3.198 1.00 0.00 H new ATOM 0 HA ARG A 11 3.556 -16.544 -0.675 1.00 0.00 H new ATOM 0 HB2 ARG A 11 1.966 -19.032 -1.417 1.00 0.00 H new ATOM 0 HB3 ARG A 11 1.960 -18.250 0.151 1.00 0.00 H new ATOM 0 HG2 ARG A 11 1.335 -16.276 -1.856 1.00 0.00 H new ATOM 0 HG3 ARG A 11 0.322 -17.682 -2.120 1.00 0.00 H new ATOM 0 HD2 ARG A 11 0.653 -16.581 0.673 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -0.442 -15.792 -0.445 1.00 0.00 H new ATOM 0 HE ARG A 11 -1.811 -17.774 -0.513 1.00 0.00 H new ATOM 0 HH11 ARG A 11 0.898 -17.960 1.764 1.00 0.00 H new ATOM 0 HH12 ARG A 11 0.182 -19.295 2.672 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -2.708 -19.483 0.667 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -1.844 -20.151 2.056 1.00 0.00 H new ATOM 289 N ALA A 12 5.057 -18.155 0.491 1.00 0.00 N ATOM 290 CA ALA A 12 6.089 -18.990 1.094 1.00 0.00 C ATOM 291 C ALA A 12 5.728 -19.354 2.531 1.00 0.00 C ATOM 292 O ALA A 12 5.067 -18.583 3.229 1.00 0.00 O ATOM 293 CB ALA A 12 7.434 -18.279 1.049 1.00 0.00 C ATOM 0 H ALA A 12 4.794 -17.342 1.048 1.00 0.00 H new ATOM 0 HA ALA A 12 6.159 -19.913 0.519 1.00 0.00 H new ATOM 0 HB1 ALA A 12 8.196 -18.913 1.502 1.00 0.00 H new ATOM 0 HB2 ALA A 12 7.702 -18.073 0.013 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.368 -17.341 1.600 1.00 0.00 H new ATOM 299 N PRO A 13 6.158 -20.539 2.998 1.00 0.00 N ATOM 300 CA PRO A 13 5.877 -21.002 4.360 1.00 0.00 C ATOM 301 C PRO A 13 6.260 -19.969 5.413 1.00 0.00 C ATOM 302 O PRO A 13 7.259 -19.262 5.270 1.00 0.00 O ATOM 303 CB PRO A 13 6.744 -22.255 4.497 1.00 0.00 C ATOM 304 CG PRO A 13 6.923 -22.746 3.104 1.00 0.00 C ATOM 305 CD PRO A 13 6.953 -21.520 2.234 1.00 0.00 C ATOM 0 HA PRO A 13 4.814 -21.186 4.517 1.00 0.00 H new ATOM 0 HB2 PRO A 13 7.703 -22.024 4.962 1.00 0.00 H new ATOM 0 HB3 PRO A 13 6.259 -23.005 5.122 1.00 0.00 H new ATOM 0 HG2 PRO A 13 7.847 -23.316 3.007 1.00 0.00 H new ATOM 0 HG3 PRO A 13 6.107 -23.409 2.816 1.00 0.00 H new ATOM 0 HD2 PRO A 13 7.972 -21.170 2.068 1.00 0.00 H new ATOM 0 HD3 PRO A 13 6.519 -21.713 1.253 1.00 0.00 H new ATOM 313 N GLY A 14 5.462 -19.885 6.473 1.00 0.00 N ATOM 314 CA GLY A 14 5.736 -18.935 7.535 1.00 0.00 C ATOM 315 C GLY A 14 4.780 -17.759 7.520 1.00 0.00 C ATOM 316 O GLY A 14 4.207 -17.403 8.550 1.00 0.00 O ATOM 0 H GLY A 14 4.630 -20.458 6.615 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.669 -19.442 8.498 1.00 0.00 H new ATOM 0 HA3 GLY A 14 6.758 -18.570 7.437 1.00 0.00 H new ATOM 320 N PHE A 15 4.609 -17.152 6.351 1.00 0.00 N ATOM 321 CA PHE A 15 3.717 -16.008 6.206 1.00 0.00 C ATOM 322 C PHE A 15 2.840 -16.157 4.966 1.00 0.00 C ATOM 323 O PHE A 15 1.634 -16.381 5.071 1.00 0.00 O ATOM 324 CB PHE A 15 4.526 -14.712 6.120 1.00 0.00 C ATOM 325 CG PHE A 15 5.395 -14.468 7.321 1.00 0.00 C ATOM 326 CD1 PHE A 15 6.669 -15.009 7.391 1.00 0.00 C ATOM 327 CD2 PHE A 15 4.938 -13.699 8.379 1.00 0.00 C ATOM 328 CE1 PHE A 15 7.471 -14.787 8.495 1.00 0.00 C ATOM 329 CE2 PHE A 15 5.735 -13.474 9.485 1.00 0.00 C ATOM 330 CZ PHE A 15 7.003 -14.018 9.543 1.00 0.00 C ATOM 0 H PHE A 15 5.077 -17.433 5.489 1.00 0.00 H new ATOM 0 HA PHE A 15 3.072 -15.968 7.083 1.00 0.00 H new ATOM 0 HB2 PHE A 15 5.152 -14.742 5.228 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.841 -13.873 6.000 1.00 0.00 H new ATOM 0 HD1 PHE A 15 7.039 -15.611 6.574 1.00 0.00 H new ATOM 0 HD2 PHE A 15 3.947 -13.271 8.339 1.00 0.00 H new ATOM 0 HE1 PHE A 15 8.462 -15.214 8.538 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.367 -12.873 10.303 1.00 0.00 H new ATOM 0 HZ PHE A 15 7.628 -13.843 10.406 1.00 0.00 H new ATOM 340 N GLY A 16 3.454 -16.034 3.794 1.00 0.00 N ATOM 341 CA GLY A 16 2.713 -16.160 2.552 1.00 0.00 C ATOM 342 C GLY A 16 2.819 -14.925 1.679 1.00 0.00 C ATOM 343 O GLY A 16 3.654 -14.865 0.776 1.00 0.00 O ATOM 0 H GLY A 16 4.451 -15.849 3.682 1.00 0.00 H new ATOM 0 HA2 GLY A 16 3.083 -17.023 1.999 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.664 -16.351 2.778 1.00 0.00 H new ATOM 347 N PHE A 17 1.970 -13.940 1.947 1.00 0.00 N ATOM 348 CA PHE A 17 1.968 -12.700 1.176 1.00 0.00 C ATOM 349 C PHE A 17 3.227 -11.884 1.452 1.00 0.00 C ATOM 350 O PHE A 17 3.751 -11.215 0.563 1.00 0.00 O ATOM 351 CB PHE A 17 0.727 -11.863 1.504 1.00 0.00 C ATOM 352 CG PHE A 17 -0.506 -12.680 1.772 1.00 0.00 C ATOM 353 CD1 PHE A 17 -0.875 -13.703 0.913 1.00 0.00 C ATOM 354 CD2 PHE A 17 -1.292 -12.426 2.885 1.00 0.00 C ATOM 355 CE1 PHE A 17 -2.007 -14.457 1.160 1.00 0.00 C ATOM 356 CE2 PHE A 17 -2.424 -13.177 3.136 1.00 0.00 C ATOM 357 CZ PHE A 17 -2.782 -14.194 2.272 1.00 0.00 C ATOM 0 H PHE A 17 1.274 -13.975 2.692 1.00 0.00 H new ATOM 0 HA PHE A 17 1.949 -12.966 0.119 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.938 -11.245 2.377 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.528 -11.185 0.674 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -0.272 -13.913 0.042 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -1.016 -11.632 3.564 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -2.285 -15.252 0.483 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -3.028 -12.969 4.007 1.00 0.00 H new ATOM 0 HZ PHE A 17 -3.667 -14.782 2.466 1.00 0.00 H new ATOM 367 N GLY A 18 3.703 -11.941 2.691 1.00 0.00 N ATOM 368 CA GLY A 18 4.893 -11.197 3.062 1.00 0.00 C ATOM 369 C GLY A 18 4.601 -9.734 3.351 1.00 0.00 C ATOM 370 O GLY A 18 5.510 -8.967 3.669 1.00 0.00 O ATOM 0 H GLY A 18 3.287 -12.488 3.444 1.00 0.00 H new ATOM 0 HA2 GLY A 18 5.343 -11.655 3.943 1.00 0.00 H new ATOM 0 HA3 GLY A 18 5.625 -11.266 2.258 1.00 0.00 H new ATOM 374 N ILE A 19 3.332 -9.347 3.243 1.00 0.00 N ATOM 375 CA ILE A 19 2.928 -7.969 3.494 1.00 0.00 C ATOM 376 C ILE A 19 1.601 -7.917 4.244 1.00 0.00 C ATOM 377 O ILE A 19 0.947 -8.941 4.440 1.00 0.00 O ATOM 378 CB ILE A 19 2.789 -7.175 2.181 1.00 0.00 C ATOM 379 CG1 ILE A 19 1.949 -7.960 1.170 1.00 0.00 C ATOM 380 CG2 ILE A 19 4.162 -6.852 1.606 1.00 0.00 C ATOM 381 CD1 ILE A 19 0.825 -7.151 0.561 1.00 0.00 C ATOM 0 H ILE A 19 2.567 -9.970 2.983 1.00 0.00 H new ATOM 0 HA ILE A 19 3.710 -7.516 4.104 1.00 0.00 H new ATOM 0 HB ILE A 19 2.279 -6.236 2.395 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.599 -8.322 0.373 1.00 0.00 H new ATOM 0 HG13 ILE A 19 1.529 -8.837 1.662 1.00 0.00 H new ATOM 0 HG21 ILE A 19 4.045 -6.291 0.679 1.00 0.00 H new ATOM 0 HG22 ILE A 19 4.725 -6.255 2.323 1.00 0.00 H new ATOM 0 HG23 ILE A 19 4.699 -7.779 1.404 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.272 -7.770 -0.145 1.00 0.00 H new ATOM 0 HD12 ILE A 19 0.153 -6.811 1.349 1.00 0.00 H new ATOM 0 HD13 ILE A 19 1.239 -6.288 0.040 1.00 0.00 H new ATOM 393 N ALA A 20 1.209 -6.718 4.662 1.00 0.00 N ATOM 394 CA ALA A 20 -0.041 -6.534 5.388 1.00 0.00 C ATOM 395 C ALA A 20 -0.854 -5.388 4.796 1.00 0.00 C ATOM 396 O ALA A 20 -0.411 -4.240 4.786 1.00 0.00 O ATOM 397 CB ALA A 20 0.237 -6.281 6.861 1.00 0.00 C ATOM 0 H ALA A 20 1.739 -5.860 4.510 1.00 0.00 H new ATOM 0 HA ALA A 20 -0.627 -7.448 5.293 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -0.706 -6.145 7.391 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.771 -7.133 7.282 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.846 -5.383 6.967 1.00 0.00 H new ATOM 403 N ILE A 21 -2.046 -5.707 4.303 1.00 0.00 N ATOM 404 CA ILE A 21 -2.922 -4.705 3.707 1.00 0.00 C ATOM 405 C ILE A 21 -3.680 -3.930 4.779 1.00 0.00 C ATOM 406 O ILE A 21 -3.882 -4.422 5.889 1.00 0.00 O ATOM 407 CB ILE A 21 -3.934 -5.346 2.740 1.00 0.00 C ATOM 408 CG1 ILE A 21 -4.663 -6.504 3.424 1.00 0.00 C ATOM 409 CG2 ILE A 21 -3.232 -5.825 1.479 1.00 0.00 C ATOM 410 CD1 ILE A 21 -6.129 -6.594 3.059 1.00 0.00 C ATOM 0 H ILE A 21 -2.428 -6.653 4.304 1.00 0.00 H new ATOM 0 HA ILE A 21 -2.284 -4.019 3.150 1.00 0.00 H new ATOM 0 HB ILE A 21 -4.671 -4.594 2.458 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -4.172 -7.440 3.157 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -4.572 -6.393 4.504 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -3.961 -6.276 0.806 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -2.755 -4.979 0.984 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -2.476 -6.564 1.742 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -6.583 -7.437 3.580 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -6.634 -5.673 3.351 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -6.228 -6.737 1.983 1.00 0.00 H new ATOM 422 N SER A 22 -4.098 -2.715 4.439 1.00 0.00 N ATOM 423 CA SER A 22 -4.835 -1.872 5.372 1.00 0.00 C ATOM 424 C SER A 22 -5.842 -0.995 4.633 1.00 0.00 C ATOM 425 O SER A 22 -5.518 -0.381 3.616 1.00 0.00 O ATOM 426 CB SER A 22 -3.869 -0.994 6.171 1.00 0.00 C ATOM 427 OG SER A 22 -4.325 -0.815 7.501 1.00 0.00 O ATOM 0 H SER A 22 -3.939 -2.293 3.524 1.00 0.00 H new ATOM 0 HA SER A 22 -5.379 -2.521 6.058 1.00 0.00 H new ATOM 0 HB2 SER A 22 -2.880 -1.452 6.181 1.00 0.00 H new ATOM 0 HB3 SER A 22 -3.767 -0.024 5.684 1.00 0.00 H new ATOM 0 HG SER A 22 -3.556 -0.706 8.099 1.00 0.00 H new ATOM 433 N GLY A 23 -7.065 -0.942 5.150 1.00 0.00 N ATOM 434 CA GLY A 23 -8.099 -0.139 4.526 1.00 0.00 C ATOM 435 C GLY A 23 -9.471 -0.780 4.617 1.00 0.00 C ATOM 436 O GLY A 23 -9.870 -1.263 5.677 1.00 0.00 O ATOM 0 H GLY A 23 -7.358 -1.441 5.990 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.128 0.842 5.001 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.846 0.022 3.478 1.00 0.00 H new ATOM 440 N GLY A 24 -10.194 -0.784 3.500 1.00 0.00 N ATOM 441 CA GLY A 24 -11.521 -1.371 3.476 1.00 0.00 C ATOM 442 C GLY A 24 -12.594 -0.351 3.150 1.00 0.00 C ATOM 443 O GLY A 24 -13.028 0.404 4.020 1.00 0.00 O ATOM 0 H GLY A 24 -9.884 -0.391 2.611 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.548 -2.173 2.738 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -11.734 -1.822 4.445 1.00 0.00 H new ATOM 447 N ARG A 25 -13.021 -0.325 1.892 1.00 0.00 N ATOM 448 CA ARG A 25 -14.046 0.615 1.453 1.00 0.00 C ATOM 449 C ARG A 25 -15.415 0.236 2.010 1.00 0.00 C ATOM 450 O ARG A 25 -16.283 1.092 2.181 1.00 0.00 O ATOM 451 CB ARG A 25 -14.101 0.667 -0.075 1.00 0.00 C ATOM 452 CG ARG A 25 -14.836 1.883 -0.615 1.00 0.00 C ATOM 453 CD ARG A 25 -16.283 1.557 -0.950 1.00 0.00 C ATOM 454 NE ARG A 25 -17.148 2.729 -0.840 1.00 0.00 N ATOM 455 CZ ARG A 25 -18.347 2.821 -1.408 1.00 0.00 C ATOM 456 NH1 ARG A 25 -18.830 1.815 -2.125 1.00 0.00 N ATOM 457 NH2 ARG A 25 -19.067 3.925 -1.258 1.00 0.00 N ATOM 0 H ARG A 25 -12.674 -0.943 1.159 1.00 0.00 H new ATOM 0 HA ARG A 25 -13.782 1.601 1.835 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -13.084 0.663 -0.467 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -14.588 -0.236 -0.444 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -14.804 2.685 0.122 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -14.329 2.249 -1.507 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -16.340 1.159 -1.963 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -16.643 0.776 -0.280 1.00 0.00 H new ATOM 0 HE ARG A 25 -16.813 3.524 -0.295 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -18.281 0.964 -2.244 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -19.750 1.893 -2.558 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -18.701 4.702 -0.708 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -19.987 3.997 -1.693 1.00 0.00 H new ATOM 471 N ASP A 26 -15.604 -1.050 2.290 1.00 0.00 N ATOM 472 CA ASP A 26 -16.870 -1.535 2.825 1.00 0.00 C ATOM 473 C ASP A 26 -16.814 -1.645 4.347 1.00 0.00 C ATOM 474 O ASP A 26 -17.379 -2.568 4.933 1.00 0.00 O ATOM 475 CB ASP A 26 -17.217 -2.895 2.214 1.00 0.00 C ATOM 476 CG ASP A 26 -18.679 -2.996 1.825 1.00 0.00 C ATOM 477 OD1 ASP A 26 -19.065 -2.392 0.802 1.00 0.00 O ATOM 478 OD2 ASP A 26 -19.439 -3.679 2.543 1.00 0.00 O ATOM 0 H ASP A 26 -14.897 -1.773 2.155 1.00 0.00 H new ATOM 0 HA ASP A 26 -17.646 -0.817 2.561 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -16.597 -3.064 1.334 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -16.978 -3.683 2.928 1.00 0.00 H new ATOM 483 N ASN A 27 -16.133 -0.695 4.980 1.00 0.00 N ATOM 484 CA ASN A 27 -16.007 -0.684 6.433 1.00 0.00 C ATOM 485 C ASN A 27 -17.068 0.215 7.063 1.00 0.00 C ATOM 486 O ASN A 27 -17.730 0.988 6.370 1.00 0.00 O ATOM 487 CB ASN A 27 -14.611 -0.210 6.841 1.00 0.00 C ATOM 488 CG ASN A 27 -13.644 -1.361 7.034 1.00 0.00 C ATOM 489 OD1 ASN A 27 -14.035 -2.455 7.439 1.00 0.00 O ATOM 490 ND2 ASN A 27 -12.371 -1.119 6.744 1.00 0.00 N ATOM 0 H ASN A 27 -15.660 0.077 4.510 1.00 0.00 H new ATOM 0 HA ASN A 27 -16.157 -1.701 6.795 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -14.222 0.464 6.078 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -14.680 0.362 7.766 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -11.674 -1.855 6.854 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -12.090 -0.197 6.411 1.00 0.00 H new ATOM 497 N PRO A 28 -17.245 0.126 8.393 1.00 0.00 N ATOM 498 CA PRO A 28 -18.232 0.937 9.114 1.00 0.00 C ATOM 499 C PRO A 28 -18.093 2.425 8.809 1.00 0.00 C ATOM 500 O PRO A 28 -19.024 3.056 8.307 1.00 0.00 O ATOM 501 CB PRO A 28 -17.913 0.661 10.585 1.00 0.00 C ATOM 502 CG PRO A 28 -17.264 -0.679 10.587 1.00 0.00 C ATOM 503 CD PRO A 28 -16.499 -0.769 9.295 1.00 0.00 C ATOM 0 HA PRO A 28 -19.253 0.683 8.831 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -17.250 1.422 10.996 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -18.817 0.664 11.193 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -16.599 -0.789 11.443 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -18.008 -1.473 10.657 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -15.465 -0.446 9.417 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -16.471 -1.790 8.915 1.00 0.00 H new ATOM 511 N HIS A 29 -16.926 2.981 9.115 1.00 0.00 N ATOM 512 CA HIS A 29 -16.665 4.396 8.874 1.00 0.00 C ATOM 513 C HIS A 29 -15.418 4.580 8.014 1.00 0.00 C ATOM 514 O HIS A 29 -14.364 4.015 8.302 1.00 0.00 O ATOM 515 CB HIS A 29 -16.497 5.138 10.201 1.00 0.00 C ATOM 516 CG HIS A 29 -15.326 4.667 11.006 1.00 0.00 C ATOM 517 ND1 HIS A 29 -15.316 3.471 11.693 1.00 0.00 N ATOM 518 CD2 HIS A 29 -14.118 5.236 11.231 1.00 0.00 C ATOM 519 CE1 HIS A 29 -14.155 3.327 12.305 1.00 0.00 C ATOM 520 NE2 HIS A 29 -13.410 4.384 12.041 1.00 0.00 N ATOM 0 H HIS A 29 -16.145 2.473 9.531 1.00 0.00 H new ATOM 0 HA HIS A 29 -17.519 4.812 8.339 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -16.385 6.203 10.000 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -17.405 5.019 10.792 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -13.775 6.184 10.845 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -13.864 2.487 12.918 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -12.462 4.542 12.383 1.00 0.00 H new ATOM 529 N PHE A 30 -15.548 5.375 6.956 1.00 0.00 N ATOM 530 CA PHE A 30 -14.432 5.633 6.054 1.00 0.00 C ATOM 531 C PHE A 30 -14.501 7.053 5.497 1.00 0.00 C ATOM 532 O PHE A 30 -15.551 7.694 5.535 1.00 0.00 O ATOM 533 CB PHE A 30 -14.432 4.621 4.907 1.00 0.00 C ATOM 534 CG PHE A 30 -13.062 4.115 4.553 1.00 0.00 C ATOM 535 CD1 PHE A 30 -12.236 4.841 3.711 1.00 0.00 C ATOM 536 CD2 PHE A 30 -12.601 2.911 5.064 1.00 0.00 C ATOM 537 CE1 PHE A 30 -10.975 4.377 3.386 1.00 0.00 C ATOM 538 CE2 PHE A 30 -11.342 2.442 4.742 1.00 0.00 C ATOM 539 CZ PHE A 30 -10.528 3.176 3.900 1.00 0.00 C ATOM 0 H PHE A 30 -16.414 5.851 6.703 1.00 0.00 H new ATOM 0 HA PHE A 30 -13.506 5.529 6.620 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -15.064 3.775 5.179 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -14.879 5.082 4.026 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -12.581 5.780 3.304 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -13.234 2.333 5.721 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -10.340 4.954 2.730 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -10.994 1.503 5.148 1.00 0.00 H new ATOM 0 HZ PHE A 30 -9.544 2.811 3.645 1.00 0.00 H new ATOM 549 N GLN A 31 -13.375 7.536 4.981 1.00 0.00 N ATOM 550 CA GLN A 31 -13.309 8.880 4.417 1.00 0.00 C ATOM 551 C GLN A 31 -12.835 8.837 2.967 1.00 0.00 C ATOM 552 O GLN A 31 -12.019 7.995 2.595 1.00 0.00 O ATOM 553 CB GLN A 31 -12.374 9.759 5.247 1.00 0.00 C ATOM 554 CG GLN A 31 -13.081 10.517 6.359 1.00 0.00 C ATOM 555 CD GLN A 31 -12.114 11.205 7.302 1.00 0.00 C ATOM 556 OE1 GLN A 31 -11.108 10.625 7.711 1.00 0.00 O ATOM 557 NE2 GLN A 31 -12.415 12.449 7.654 1.00 0.00 N ATOM 0 H GLN A 31 -12.497 7.018 4.942 1.00 0.00 H new ATOM 0 HA GLN A 31 -14.311 9.308 4.440 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -11.594 9.135 5.683 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -11.880 10.473 4.588 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -13.746 11.261 5.921 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -13.705 9.826 6.925 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -13.259 12.892 7.291 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -11.802 12.962 8.287 1.00 0.00 H new ATOM 566 N SER A 32 -13.352 9.752 2.154 1.00 0.00 N ATOM 567 CA SER A 32 -12.983 9.819 0.745 1.00 0.00 C ATOM 568 C SER A 32 -11.601 10.442 0.571 1.00 0.00 C ATOM 569 O SER A 32 -11.063 11.052 1.496 1.00 0.00 O ATOM 570 CB SER A 32 -14.021 10.627 -0.037 1.00 0.00 C ATOM 571 OG SER A 32 -14.291 10.031 -1.294 1.00 0.00 O ATOM 0 H SER A 32 -14.028 10.458 2.447 1.00 0.00 H new ATOM 0 HA SER A 32 -12.954 8.802 0.355 1.00 0.00 H new ATOM 0 HB2 SER A 32 -14.942 10.697 0.541 1.00 0.00 H new ATOM 0 HB3 SER A 32 -13.659 11.645 -0.184 1.00 0.00 H new ATOM 0 HG SER A 32 -14.958 10.566 -1.773 1.00 0.00 H new ATOM 577 N GLY A 33 -11.032 10.285 -0.620 1.00 0.00 N ATOM 578 CA GLY A 33 -9.717 10.838 -0.894 1.00 0.00 C ATOM 579 C GLY A 33 -8.591 9.898 -0.507 1.00 0.00 C ATOM 580 O GLY A 33 -7.428 10.300 -0.463 1.00 0.00 O ATOM 0 H GLY A 33 -11.457 9.785 -1.401 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -9.640 11.071 -1.956 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -9.603 11.777 -0.352 1.00 0.00 H new ATOM 584 N GLU A 34 -8.932 8.642 -0.227 1.00 0.00 N ATOM 585 CA GLU A 34 -7.934 7.647 0.156 1.00 0.00 C ATOM 586 C GLU A 34 -8.587 6.292 0.409 1.00 0.00 C ATOM 587 O GLU A 34 -8.202 5.566 1.325 1.00 0.00 O ATOM 588 CB GLU A 34 -7.180 8.104 1.407 1.00 0.00 C ATOM 589 CG GLU A 34 -8.093 8.483 2.563 1.00 0.00 C ATOM 590 CD GLU A 34 -7.327 9.006 3.762 1.00 0.00 C ATOM 591 OE1 GLU A 34 -6.717 8.186 4.481 1.00 0.00 O ATOM 592 OE2 GLU A 34 -7.338 10.235 3.984 1.00 0.00 O ATOM 0 H GLU A 34 -9.889 8.290 -0.258 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.227 7.542 -0.667 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -6.511 7.306 1.730 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.555 8.960 1.152 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.800 9.242 2.229 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -8.677 7.612 2.861 1.00 0.00 H new ATOM 599 N THR A 35 -9.578 5.958 -0.412 1.00 0.00 N ATOM 600 CA THR A 35 -10.287 4.690 -0.279 1.00 0.00 C ATOM 601 C THR A 35 -9.397 3.518 -0.686 1.00 0.00 C ATOM 602 O THR A 35 -9.607 2.387 -0.247 1.00 0.00 O ATOM 603 CB THR A 35 -11.558 4.700 -1.130 1.00 0.00 C ATOM 604 OG1 THR A 35 -11.953 6.028 -1.426 1.00 0.00 O ATOM 605 CG2 THR A 35 -12.728 4.010 -0.463 1.00 0.00 C ATOM 0 H THR A 35 -9.908 6.548 -1.176 1.00 0.00 H new ATOM 0 HA THR A 35 -10.560 4.566 0.769 1.00 0.00 H new ATOM 0 HB THR A 35 -11.303 4.153 -2.038 1.00 0.00 H new ATOM 0 HG1 THR A 35 -12.766 6.013 -1.972 1.00 0.00 H new ATOM 0 HG21 THR A 35 -13.598 4.052 -1.119 1.00 0.00 H new ATOM 0 HG22 THR A 35 -12.472 2.969 -0.266 1.00 0.00 H new ATOM 0 HG23 THR A 35 -12.958 4.511 0.477 1.00 0.00 H new ATOM 613 N SER A 36 -8.404 3.794 -1.527 1.00 0.00 N ATOM 614 CA SER A 36 -7.485 2.760 -1.992 1.00 0.00 C ATOM 615 C SER A 36 -6.772 2.098 -0.819 1.00 0.00 C ATOM 616 O SER A 36 -6.357 2.768 0.128 1.00 0.00 O ATOM 617 CB SER A 36 -6.460 3.355 -2.957 1.00 0.00 C ATOM 618 OG SER A 36 -6.940 4.556 -3.536 1.00 0.00 O ATOM 0 H SER A 36 -8.215 4.724 -1.900 1.00 0.00 H new ATOM 0 HA SER A 36 -8.067 2.001 -2.515 1.00 0.00 H new ATOM 0 HB2 SER A 36 -5.528 3.551 -2.427 1.00 0.00 H new ATOM 0 HB3 SER A 36 -6.235 2.634 -3.743 1.00 0.00 H new ATOM 0 HG SER A 36 -6.265 4.917 -4.148 1.00 0.00 H new ATOM 624 N ILE A 37 -6.631 0.778 -0.885 1.00 0.00 N ATOM 625 CA ILE A 37 -5.966 0.028 0.175 1.00 0.00 C ATOM 626 C ILE A 37 -4.453 0.229 0.118 1.00 0.00 C ATOM 627 O ILE A 37 -3.868 0.309 -0.961 1.00 0.00 O ATOM 628 CB ILE A 37 -6.290 -1.479 0.086 1.00 0.00 C ATOM 629 CG1 ILE A 37 -5.744 -2.220 1.310 1.00 0.00 C ATOM 630 CG2 ILE A 37 -5.729 -2.073 -1.196 1.00 0.00 C ATOM 631 CD1 ILE A 37 -6.813 -2.609 2.308 1.00 0.00 C ATOM 0 H ILE A 37 -6.968 0.206 -1.660 1.00 0.00 H new ATOM 0 HA ILE A 37 -6.341 0.410 1.124 1.00 0.00 H new ATOM 0 HB ILE A 37 -7.374 -1.597 0.070 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -5.224 -3.119 0.978 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -5.006 -1.590 1.807 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -5.968 -3.136 -1.240 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -6.169 -1.566 -2.055 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -4.647 -1.943 -1.214 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -6.354 -3.130 3.148 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -7.318 -1.713 2.668 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -7.538 -3.265 1.827 1.00 0.00 H new ATOM 643 N VAL A 38 -3.827 0.315 1.288 1.00 0.00 N ATOM 644 CA VAL A 38 -2.384 0.510 1.371 1.00 0.00 C ATOM 645 C VAL A 38 -1.745 -0.510 2.308 1.00 0.00 C ATOM 646 O VAL A 38 -2.423 -1.108 3.144 1.00 0.00 O ATOM 647 CB VAL A 38 -2.036 1.929 1.861 1.00 0.00 C ATOM 648 CG1 VAL A 38 -0.546 2.197 1.713 1.00 0.00 C ATOM 649 CG2 VAL A 38 -2.848 2.971 1.105 1.00 0.00 C ATOM 0 H VAL A 38 -4.297 0.253 2.191 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.988 0.374 0.365 1.00 0.00 H new ATOM 0 HB VAL A 38 -2.291 1.999 2.918 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -0.321 3.204 2.064 1.00 0.00 H new ATOM 0 HG12 VAL A 38 0.014 1.473 2.304 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -0.262 2.107 0.664 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -2.588 3.966 1.465 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -2.627 2.902 0.040 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -3.911 2.792 1.268 1.00 0.00 H new ATOM 659 N ILE A 39 -0.437 -0.704 2.166 1.00 0.00 N ATOM 660 CA ILE A 39 0.292 -1.650 3.000 1.00 0.00 C ATOM 661 C ILE A 39 0.541 -1.079 4.392 1.00 0.00 C ATOM 662 O ILE A 39 1.192 -0.045 4.541 1.00 0.00 O ATOM 663 CB ILE A 39 1.642 -2.035 2.367 1.00 0.00 C ATOM 664 CG1 ILE A 39 1.456 -2.396 0.892 1.00 0.00 C ATOM 665 CG2 ILE A 39 2.273 -3.192 3.127 1.00 0.00 C ATOM 666 CD1 ILE A 39 1.722 -1.244 -0.051 1.00 0.00 C ATOM 0 H ILE A 39 0.139 -0.217 1.480 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.330 -2.542 3.082 1.00 0.00 H new ATOM 0 HB ILE A 39 2.312 -1.178 2.428 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.123 -3.221 0.642 1.00 0.00 H new ATOM 0 HG13 ILE A 39 0.437 -2.752 0.739 1.00 0.00 H new ATOM 0 HG21 ILE A 39 3.226 -3.452 2.667 1.00 0.00 H new ATOM 0 HG22 ILE A 39 2.438 -2.899 4.164 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.607 -4.055 3.095 1.00 0.00 H new ATOM 0 HD11 ILE A 39 1.571 -1.573 -1.079 1.00 0.00 H new ATOM 0 HD12 ILE A 39 1.038 -0.425 0.172 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.749 -0.902 0.073 1.00 0.00 H new ATOM 678 N SER A 40 0.018 -1.757 5.407 1.00 0.00 N ATOM 679 CA SER A 40 0.185 -1.317 6.788 1.00 0.00 C ATOM 680 C SER A 40 1.609 -1.573 7.271 1.00 0.00 C ATOM 681 O SER A 40 2.294 -0.659 7.731 1.00 0.00 O ATOM 682 CB SER A 40 -0.815 -2.033 7.698 1.00 0.00 C ATOM 683 OG SER A 40 -1.535 -1.107 8.494 1.00 0.00 O ATOM 0 H SER A 40 -0.525 -2.614 5.300 1.00 0.00 H new ATOM 0 HA SER A 40 -0.004 -0.244 6.828 1.00 0.00 H new ATOM 0 HB2 SER A 40 -1.510 -2.615 7.093 1.00 0.00 H new ATOM 0 HB3 SER A 40 -0.287 -2.737 8.341 1.00 0.00 H new ATOM 0 HG SER A 40 -2.134 -1.592 9.099 1.00 0.00 H new ATOM 689 N ASP A 41 2.048 -2.823 7.166 1.00 0.00 N ATOM 690 CA ASP A 41 3.390 -3.202 7.593 1.00 0.00 C ATOM 691 C ASP A 41 3.838 -4.486 6.901 1.00 0.00 C ATOM 692 O ASP A 41 3.014 -5.299 6.484 1.00 0.00 O ATOM 693 CB ASP A 41 3.431 -3.382 9.114 1.00 0.00 C ATOM 694 CG ASP A 41 4.229 -2.293 9.802 1.00 0.00 C ATOM 695 OD1 ASP A 41 4.352 -1.193 9.226 1.00 0.00 O ATOM 696 OD2 ASP A 41 4.732 -2.542 10.919 1.00 0.00 O ATOM 0 H ASP A 41 1.493 -3.591 6.789 1.00 0.00 H new ATOM 0 HA ASP A 41 4.076 -2.403 7.311 1.00 0.00 H new ATOM 0 HB2 ASP A 41 2.413 -3.385 9.505 1.00 0.00 H new ATOM 0 HB3 ASP A 41 3.866 -4.353 9.351 1.00 0.00 H new ATOM 701 N VAL A 42 5.151 -4.661 6.784 1.00 0.00 N ATOM 702 CA VAL A 42 5.710 -5.845 6.144 1.00 0.00 C ATOM 703 C VAL A 42 6.720 -6.537 7.053 1.00 0.00 C ATOM 704 O VAL A 42 7.529 -5.881 7.711 1.00 0.00 O ATOM 705 CB VAL A 42 6.392 -5.492 4.808 1.00 0.00 C ATOM 706 CG1 VAL A 42 5.378 -4.933 3.822 1.00 0.00 C ATOM 707 CG2 VAL A 42 7.529 -4.505 5.031 1.00 0.00 C ATOM 0 H VAL A 42 5.847 -3.997 7.124 1.00 0.00 H new ATOM 0 HA VAL A 42 4.878 -6.522 5.950 1.00 0.00 H new ATOM 0 HB VAL A 42 6.812 -6.404 4.385 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.878 -4.690 2.885 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.602 -5.676 3.637 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.926 -4.032 4.237 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.998 -4.268 4.076 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.136 -3.592 5.478 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.269 -4.947 5.699 1.00 0.00 H new ATOM 717 N LEU A 43 6.668 -7.865 7.086 1.00 0.00 N ATOM 718 CA LEU A 43 7.579 -8.645 7.918 1.00 0.00 C ATOM 719 C LEU A 43 9.031 -8.402 7.515 1.00 0.00 C ATOM 720 O LEU A 43 9.944 -8.579 8.321 1.00 0.00 O ATOM 721 CB LEU A 43 7.254 -10.138 7.816 1.00 0.00 C ATOM 722 CG LEU A 43 6.864 -10.627 6.417 1.00 0.00 C ATOM 723 CD1 LEU A 43 7.735 -11.802 5.998 1.00 0.00 C ATOM 724 CD2 LEU A 43 5.389 -11.010 6.372 1.00 0.00 C ATOM 0 H LEU A 43 6.006 -8.423 6.547 1.00 0.00 H new ATOM 0 HA LEU A 43 7.447 -8.322 8.951 1.00 0.00 H new ATOM 0 HB2 LEU A 43 8.121 -10.706 8.153 1.00 0.00 H new ATOM 0 HB3 LEU A 43 6.438 -10.364 8.503 1.00 0.00 H new ATOM 0 HG LEU A 43 7.027 -9.811 5.713 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.443 -12.135 5.002 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.780 -11.494 5.985 1.00 0.00 H new ATOM 0 HD13 LEU A 43 7.607 -12.621 6.706 1.00 0.00 H new ATOM 0 HD21 LEU A 43 5.133 -11.354 5.370 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.198 -11.808 7.090 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.780 -10.142 6.624 1.00 0.00 H new ATOM 736 N LYS A 44 9.238 -8.000 6.265 1.00 0.00 N ATOM 737 CA LYS A 44 10.580 -7.736 5.759 1.00 0.00 C ATOM 738 C LYS A 44 11.417 -9.011 5.758 1.00 0.00 C ATOM 739 O LYS A 44 12.636 -8.965 5.936 1.00 0.00 O ATOM 740 CB LYS A 44 11.264 -6.658 6.605 1.00 0.00 C ATOM 741 CG LYS A 44 11.722 -5.454 5.797 1.00 0.00 C ATOM 742 CD LYS A 44 11.227 -4.151 6.404 1.00 0.00 C ATOM 743 CE LYS A 44 12.310 -3.471 7.226 1.00 0.00 C ATOM 744 NZ LYS A 44 12.311 -3.939 8.639 1.00 0.00 N ATOM 0 H LYS A 44 8.494 -7.850 5.584 1.00 0.00 H new ATOM 0 HA LYS A 44 10.494 -7.378 4.733 1.00 0.00 H new ATOM 0 HB2 LYS A 44 10.575 -6.324 7.381 1.00 0.00 H new ATOM 0 HB3 LYS A 44 12.125 -7.096 7.110 1.00 0.00 H new ATOM 0 HG2 LYS A 44 12.811 -5.442 5.746 1.00 0.00 H new ATOM 0 HG3 LYS A 44 11.356 -5.541 4.774 1.00 0.00 H new ATOM 0 HD2 LYS A 44 10.897 -3.481 5.610 1.00 0.00 H new ATOM 0 HD3 LYS A 44 10.360 -4.349 7.035 1.00 0.00 H new ATOM 0 HE2 LYS A 44 13.284 -3.668 6.778 1.00 0.00 H new ATOM 0 HE3 LYS A 44 12.161 -2.392 7.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 13.064 -3.452 9.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 11.391 -3.728 9.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 12.479 -4.965 8.665 1.00 0.00 H new ATOM 758 N GLY A 45 10.758 -10.147 5.557 1.00 0.00 N ATOM 759 CA GLY A 45 11.460 -11.417 5.537 1.00 0.00 C ATOM 760 C GLY A 45 10.868 -12.399 4.541 1.00 0.00 C ATOM 761 O GLY A 45 11.169 -13.592 4.588 1.00 0.00 O ATOM 0 H GLY A 45 9.751 -10.211 5.408 1.00 0.00 H new ATOM 0 HA2 GLY A 45 12.508 -11.244 5.292 1.00 0.00 H new ATOM 0 HA3 GLY A 45 11.434 -11.857 6.534 1.00 0.00 H new ATOM 765 N GLY A 46 10.028 -11.901 3.638 1.00 0.00 N ATOM 766 CA GLY A 46 9.414 -12.763 2.645 1.00 0.00 C ATOM 767 C GLY A 46 9.568 -12.222 1.235 1.00 0.00 C ATOM 768 O GLY A 46 10.385 -11.332 0.997 1.00 0.00 O ATOM 0 H GLY A 46 9.762 -10.918 3.577 1.00 0.00 H new ATOM 0 HA2 GLY A 46 9.862 -13.755 2.702 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.354 -12.879 2.873 1.00 0.00 H new ATOM 772 N PRO A 47 8.790 -12.743 0.272 1.00 0.00 N ATOM 773 CA PRO A 47 8.854 -12.295 -1.124 1.00 0.00 C ATOM 774 C PRO A 47 8.406 -10.846 -1.288 1.00 0.00 C ATOM 775 O PRO A 47 8.797 -10.170 -2.239 1.00 0.00 O ATOM 776 CB PRO A 47 7.890 -13.238 -1.851 1.00 0.00 C ATOM 777 CG PRO A 47 6.969 -13.737 -0.793 1.00 0.00 C ATOM 778 CD PRO A 47 7.787 -13.805 0.465 1.00 0.00 C ATOM 0 HA PRO A 47 9.872 -12.326 -1.513 1.00 0.00 H new ATOM 0 HB2 PRO A 47 7.343 -12.715 -2.636 1.00 0.00 H new ATOM 0 HB3 PRO A 47 8.425 -14.059 -2.328 1.00 0.00 H new ATOM 0 HG2 PRO A 47 6.117 -13.068 -0.669 1.00 0.00 H new ATOM 0 HG3 PRO A 47 6.570 -14.717 -1.053 1.00 0.00 H new ATOM 0 HD2 PRO A 47 7.178 -13.627 1.351 1.00 0.00 H new ATOM 0 HD3 PRO A 47 8.254 -14.782 0.589 1.00 0.00 H new ATOM 786 N ALA A 48 7.584 -10.375 -0.356 1.00 0.00 N ATOM 787 CA ALA A 48 7.084 -9.005 -0.400 1.00 0.00 C ATOM 788 C ALA A 48 7.697 -8.158 0.712 1.00 0.00 C ATOM 789 O ALA A 48 7.088 -7.195 1.178 1.00 0.00 O ATOM 790 CB ALA A 48 5.567 -8.996 -0.299 1.00 0.00 C ATOM 0 H ALA A 48 7.250 -10.921 0.438 1.00 0.00 H new ATOM 0 HA ALA A 48 7.377 -8.568 -1.354 1.00 0.00 H new ATOM 0 HB1 ALA A 48 5.206 -7.968 -0.333 1.00 0.00 H new ATOM 0 HB2 ALA A 48 5.144 -9.557 -1.132 1.00 0.00 H new ATOM 0 HB3 ALA A 48 5.262 -9.457 0.641 1.00 0.00 H new ATOM 796 N GLU A 49 8.905 -8.521 1.133 1.00 0.00 N ATOM 797 CA GLU A 49 9.600 -7.792 2.189 1.00 0.00 C ATOM 798 C GLU A 49 9.741 -6.316 1.831 1.00 0.00 C ATOM 799 O GLU A 49 9.503 -5.440 2.663 1.00 0.00 O ATOM 800 CB GLU A 49 10.982 -8.402 2.433 1.00 0.00 C ATOM 801 CG GLU A 49 11.812 -8.554 1.168 1.00 0.00 C ATOM 802 CD GLU A 49 12.802 -7.421 0.981 1.00 0.00 C ATOM 803 OE1 GLU A 49 13.306 -6.899 1.998 1.00 0.00 O ATOM 804 OE2 GLU A 49 13.071 -7.053 -0.182 1.00 0.00 O ATOM 0 H GLU A 49 9.423 -9.316 0.759 1.00 0.00 H new ATOM 0 HA GLU A 49 9.007 -7.871 3.100 1.00 0.00 H new ATOM 0 HB2 GLU A 49 11.526 -7.777 3.142 1.00 0.00 H new ATOM 0 HB3 GLU A 49 10.861 -9.380 2.898 1.00 0.00 H new ATOM 0 HG2 GLU A 49 12.351 -9.501 1.203 1.00 0.00 H new ATOM 0 HG3 GLU A 49 11.148 -8.597 0.305 1.00 0.00 H new ATOM 811 N GLY A 50 10.128 -6.048 0.588 1.00 0.00 N ATOM 812 CA GLY A 50 10.294 -4.677 0.143 1.00 0.00 C ATOM 813 C GLY A 50 9.685 -4.434 -1.224 1.00 0.00 C ATOM 814 O GLY A 50 10.130 -3.553 -1.962 1.00 0.00 O ATOM 0 H GLY A 50 10.329 -6.756 -0.119 1.00 0.00 H new ATOM 0 HA2 GLY A 50 9.834 -4.005 0.867 1.00 0.00 H new ATOM 0 HA3 GLY A 50 11.356 -4.434 0.113 1.00 0.00 H new ATOM 818 N GLN A 51 8.665 -5.216 -1.564 1.00 0.00 N ATOM 819 CA GLN A 51 7.994 -5.080 -2.852 1.00 0.00 C ATOM 820 C GLN A 51 6.753 -4.202 -2.728 1.00 0.00 C ATOM 821 O GLN A 51 6.484 -3.366 -3.591 1.00 0.00 O ATOM 822 CB GLN A 51 7.609 -6.459 -3.396 1.00 0.00 C ATOM 823 CG GLN A 51 8.033 -6.681 -4.839 1.00 0.00 C ATOM 824 CD GLN A 51 9.534 -6.835 -4.990 1.00 0.00 C ATOM 825 OE1 GLN A 51 10.282 -5.862 -4.898 1.00 0.00 O ATOM 826 NE2 GLN A 51 9.982 -8.063 -5.221 1.00 0.00 N ATOM 0 H GLN A 51 8.285 -5.950 -0.966 1.00 0.00 H new ATOM 0 HA GLN A 51 8.685 -4.603 -3.547 1.00 0.00 H new ATOM 0 HB2 GLN A 51 8.062 -7.227 -2.770 1.00 0.00 H new ATOM 0 HB3 GLN A 51 6.529 -6.582 -3.320 1.00 0.00 H new ATOM 0 HG2 GLN A 51 7.540 -7.573 -5.225 1.00 0.00 H new ATOM 0 HG3 GLN A 51 7.695 -5.841 -5.446 1.00 0.00 H new ATOM 0 HE21 GLN A 51 9.326 -8.841 -5.290 1.00 0.00 H new ATOM 0 HE22 GLN A 51 10.983 -8.229 -5.330 1.00 0.00 H new ATOM 835 N LEU A 52 6.001 -4.397 -1.650 1.00 0.00 N ATOM 836 CA LEU A 52 4.789 -3.622 -1.414 1.00 0.00 C ATOM 837 C LEU A 52 4.877 -2.862 -0.094 1.00 0.00 C ATOM 838 O LEU A 52 4.696 -3.437 0.978 1.00 0.00 O ATOM 839 CB LEU A 52 3.564 -4.538 -1.406 1.00 0.00 C ATOM 840 CG LEU A 52 3.383 -5.389 -2.666 1.00 0.00 C ATOM 841 CD1 LEU A 52 2.267 -6.406 -2.470 1.00 0.00 C ATOM 842 CD2 LEU A 52 3.098 -4.502 -3.869 1.00 0.00 C ATOM 0 H LEU A 52 6.210 -5.085 -0.926 1.00 0.00 H new ATOM 0 HA LEU A 52 4.688 -2.899 -2.224 1.00 0.00 H new ATOM 0 HB2 LEU A 52 3.631 -5.202 -0.544 1.00 0.00 H new ATOM 0 HB3 LEU A 52 2.673 -3.926 -1.268 1.00 0.00 H new ATOM 0 HG LEU A 52 4.309 -5.933 -2.852 1.00 0.00 H new ATOM 0 HD11 LEU A 52 2.154 -7.001 -3.376 1.00 0.00 H new ATOM 0 HD12 LEU A 52 2.514 -7.061 -1.634 1.00 0.00 H new ATOM 0 HD13 LEU A 52 1.333 -5.885 -2.259 1.00 0.00 H new ATOM 0 HD21 LEU A 52 2.972 -5.122 -4.757 1.00 0.00 H new ATOM 0 HD22 LEU A 52 2.186 -3.931 -3.692 1.00 0.00 H new ATOM 0 HD23 LEU A 52 3.931 -3.816 -4.021 1.00 0.00 H new ATOM 854 N GLN A 53 5.156 -1.566 -0.183 1.00 0.00 N ATOM 855 CA GLN A 53 5.269 -0.724 1.002 1.00 0.00 C ATOM 856 C GLN A 53 4.527 0.594 0.804 1.00 0.00 C ATOM 857 O GLN A 53 4.036 0.882 -0.287 1.00 0.00 O ATOM 858 CB GLN A 53 6.740 -0.452 1.322 1.00 0.00 C ATOM 859 CG GLN A 53 7.479 0.279 0.214 1.00 0.00 C ATOM 860 CD GLN A 53 8.731 -0.450 -0.234 1.00 0.00 C ATOM 861 OE1 GLN A 53 9.020 -0.535 -1.428 1.00 0.00 O ATOM 862 NE2 GLN A 53 9.483 -0.978 0.724 1.00 0.00 N ATOM 0 H GLN A 53 5.308 -1.076 -1.064 1.00 0.00 H new ATOM 0 HA GLN A 53 4.815 -1.254 1.839 1.00 0.00 H new ATOM 0 HB2 GLN A 53 6.801 0.136 2.238 1.00 0.00 H new ATOM 0 HB3 GLN A 53 7.242 -1.400 1.518 1.00 0.00 H new ATOM 0 HG2 GLN A 53 6.813 0.406 -0.639 1.00 0.00 H new ATOM 0 HG3 GLN A 53 7.749 1.277 0.560 1.00 0.00 H new ATOM 0 HE21 GLN A 53 9.205 -0.883 1.701 1.00 0.00 H new ATOM 0 HE22 GLN A 53 10.339 -1.478 0.483 1.00 0.00 H new ATOM 871 N GLU A 54 4.449 1.389 1.866 1.00 0.00 N ATOM 872 CA GLU A 54 3.767 2.680 1.812 1.00 0.00 C ATOM 873 C GLU A 54 4.229 3.497 0.608 1.00 0.00 C ATOM 874 O GLU A 54 3.475 4.306 0.068 1.00 0.00 O ATOM 875 CB GLU A 54 4.017 3.465 3.101 1.00 0.00 C ATOM 876 CG GLU A 54 5.466 3.436 3.561 1.00 0.00 C ATOM 877 CD GLU A 54 5.751 4.448 4.654 1.00 0.00 C ATOM 878 OE1 GLU A 54 5.788 5.658 4.348 1.00 0.00 O ATOM 879 OE2 GLU A 54 5.935 4.029 5.816 1.00 0.00 O ATOM 0 H GLU A 54 4.850 1.163 2.776 1.00 0.00 H new ATOM 0 HA GLU A 54 2.699 2.491 1.708 1.00 0.00 H new ATOM 0 HB2 GLU A 54 3.713 4.501 2.950 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.386 3.060 3.892 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.708 2.437 3.924 1.00 0.00 H new ATOM 0 HG3 GLU A 54 6.118 3.633 2.710 1.00 0.00 H new ATOM 886 N ASN A 55 5.472 3.277 0.190 1.00 0.00 N ATOM 887 CA ASN A 55 6.031 3.990 -0.953 1.00 0.00 C ATOM 888 C ASN A 55 5.254 3.668 -2.225 1.00 0.00 C ATOM 889 O ASN A 55 5.163 4.493 -3.134 1.00 0.00 O ATOM 890 CB ASN A 55 7.506 3.626 -1.136 1.00 0.00 C ATOM 891 CG ASN A 55 8.406 4.349 -0.153 1.00 0.00 C ATOM 892 OD1 ASN A 55 9.086 5.312 -0.509 1.00 0.00 O ATOM 893 ND2 ASN A 55 8.416 3.886 1.091 1.00 0.00 N ATOM 0 H ASN A 55 6.110 2.611 0.625 1.00 0.00 H new ATOM 0 HA ASN A 55 5.950 5.060 -0.759 1.00 0.00 H new ATOM 0 HB2 ASN A 55 7.630 2.550 -1.014 1.00 0.00 H new ATOM 0 HB3 ASN A 55 7.814 3.869 -2.153 1.00 0.00 H new ATOM 0 HD21 ASN A 55 9.003 4.331 1.796 1.00 0.00 H new ATOM 0 HD22 ASN A 55 7.836 3.085 1.342 1.00 0.00 H new ATOM 900 N ASP A 56 4.693 2.465 -2.279 1.00 0.00 N ATOM 901 CA ASP A 56 3.919 2.030 -3.435 1.00 0.00 C ATOM 902 C ASP A 56 2.476 1.738 -3.037 1.00 0.00 C ATOM 903 O ASP A 56 2.221 0.991 -2.093 1.00 0.00 O ATOM 904 CB ASP A 56 4.550 0.783 -4.059 1.00 0.00 C ATOM 905 CG ASP A 56 6.052 0.913 -4.227 1.00 0.00 C ATOM 906 OD1 ASP A 56 6.568 2.045 -4.109 1.00 0.00 O ATOM 907 OD2 ASP A 56 6.712 -0.117 -4.477 1.00 0.00 O ATOM 0 H ASP A 56 4.760 1.772 -1.533 1.00 0.00 H new ATOM 0 HA ASP A 56 3.922 2.835 -4.170 1.00 0.00 H new ATOM 0 HB2 ASP A 56 4.331 -0.082 -3.433 1.00 0.00 H new ATOM 0 HB3 ASP A 56 4.094 0.597 -5.031 1.00 0.00 H new ATOM 912 N ARG A 57 1.537 2.337 -3.759 1.00 0.00 N ATOM 913 CA ARG A 57 0.117 2.146 -3.477 1.00 0.00 C ATOM 914 C ARG A 57 -0.471 1.047 -4.357 1.00 0.00 C ATOM 915 O ARG A 57 -0.242 1.021 -5.567 1.00 0.00 O ATOM 916 CB ARG A 57 -0.648 3.454 -3.689 1.00 0.00 C ATOM 917 CG ARG A 57 -1.394 3.930 -2.452 1.00 0.00 C ATOM 918 CD ARG A 57 -0.803 5.219 -1.902 1.00 0.00 C ATOM 919 NE ARG A 57 -1.523 5.691 -0.721 1.00 0.00 N ATOM 920 CZ ARG A 57 -1.147 6.742 0.005 1.00 0.00 C ATOM 921 NH1 ARG A 57 -0.063 7.432 -0.325 1.00 0.00 N ATOM 922 NH2 ARG A 57 -1.859 7.103 1.065 1.00 0.00 N ATOM 0 H ARG A 57 1.731 2.959 -4.544 1.00 0.00 H new ATOM 0 HA ARG A 57 0.017 1.842 -2.435 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.053 4.229 -4.001 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -1.360 3.321 -4.504 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -2.444 4.087 -2.698 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -1.358 3.156 -1.685 1.00 0.00 H new ATOM 0 HD2 ARG A 57 0.245 5.058 -1.648 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -0.829 5.988 -2.674 1.00 0.00 H new ATOM 0 HE ARG A 57 -2.362 5.186 -0.436 1.00 0.00 H new ATOM 0 HH11 ARG A 57 0.488 7.158 -1.139 1.00 0.00 H new ATOM 0 HH12 ARG A 57 0.220 8.236 0.235 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -2.693 6.576 1.323 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -1.572 7.908 1.622 1.00 0.00 H new ATOM 936 N VAL A 58 -1.233 0.143 -3.746 1.00 0.00 N ATOM 937 CA VAL A 58 -1.855 -0.951 -4.480 1.00 0.00 C ATOM 938 C VAL A 58 -3.199 -0.522 -5.058 1.00 0.00 C ATOM 939 O VAL A 58 -4.062 -0.016 -4.340 1.00 0.00 O ATOM 940 CB VAL A 58 -2.063 -2.190 -3.586 1.00 0.00 C ATOM 941 CG1 VAL A 58 -0.735 -2.871 -3.293 1.00 0.00 C ATOM 942 CG2 VAL A 58 -2.768 -1.810 -2.295 1.00 0.00 C ATOM 0 H VAL A 58 -1.433 0.148 -2.746 1.00 0.00 H new ATOM 0 HA VAL A 58 -1.176 -1.214 -5.291 1.00 0.00 H new ATOM 0 HB VAL A 58 -2.696 -2.895 -4.124 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.905 -3.743 -2.661 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -0.273 -3.186 -4.229 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -0.074 -2.173 -2.779 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -2.904 -2.699 -1.680 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -2.165 -1.082 -1.752 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -3.741 -1.376 -2.526 1.00 0.00 H new ATOM 952 N ALA A 59 -3.371 -0.720 -6.362 1.00 0.00 N ATOM 953 CA ALA A 59 -4.610 -0.346 -7.033 1.00 0.00 C ATOM 954 C ALA A 59 -5.382 -1.575 -7.501 1.00 0.00 C ATOM 955 O ALA A 59 -6.611 -1.557 -7.573 1.00 0.00 O ATOM 956 CB ALA A 59 -4.317 0.574 -8.208 1.00 0.00 C ATOM 0 H ALA A 59 -2.669 -1.137 -6.973 1.00 0.00 H new ATOM 0 HA ALA A 59 -5.233 0.186 -6.314 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.251 0.845 -8.700 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.821 1.476 -7.849 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -3.669 0.061 -8.919 1.00 0.00 H new ATOM 962 N MET A 60 -4.656 -2.641 -7.821 1.00 0.00 N ATOM 963 CA MET A 60 -5.281 -3.874 -8.284 1.00 0.00 C ATOM 964 C MET A 60 -4.579 -5.097 -7.702 1.00 0.00 C ATOM 965 O MET A 60 -3.363 -5.100 -7.521 1.00 0.00 O ATOM 966 CB MET A 60 -5.258 -3.938 -9.814 1.00 0.00 C ATOM 967 CG MET A 60 -6.183 -4.996 -10.392 1.00 0.00 C ATOM 968 SD MET A 60 -6.552 -4.718 -12.135 1.00 0.00 S ATOM 969 CE MET A 60 -4.921 -4.338 -12.770 1.00 0.00 C ATOM 0 H MET A 60 -3.638 -2.676 -7.768 1.00 0.00 H new ATOM 0 HA MET A 60 -6.316 -3.877 -7.941 1.00 0.00 H new ATOM 0 HB2 MET A 60 -5.539 -2.964 -10.214 1.00 0.00 H new ATOM 0 HB3 MET A 60 -4.239 -4.137 -10.146 1.00 0.00 H new ATOM 0 HG2 MET A 60 -5.725 -5.978 -10.274 1.00 0.00 H new ATOM 0 HG3 MET A 60 -7.114 -5.008 -9.825 1.00 0.00 H new ATOM 0 HE1 MET A 60 -4.916 -4.455 -13.854 1.00 0.00 H new ATOM 0 HE2 MET A 60 -4.662 -3.310 -12.515 1.00 0.00 H new ATOM 0 HE3 MET A 60 -4.191 -5.017 -12.328 1.00 0.00 H new ATOM 979 N VAL A 61 -5.358 -6.135 -7.413 1.00 0.00 N ATOM 980 CA VAL A 61 -4.815 -7.366 -6.855 1.00 0.00 C ATOM 981 C VAL A 61 -5.448 -8.587 -7.515 1.00 0.00 C ATOM 982 O VAL A 61 -6.662 -8.783 -7.445 1.00 0.00 O ATOM 983 CB VAL A 61 -5.040 -7.440 -5.331 1.00 0.00 C ATOM 984 CG1 VAL A 61 -6.526 -7.416 -5.006 1.00 0.00 C ATOM 985 CG2 VAL A 61 -4.379 -8.681 -4.750 1.00 0.00 C ATOM 0 H VAL A 61 -6.368 -6.147 -7.557 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.743 -7.362 -7.053 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.579 -6.565 -4.874 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -6.663 -7.469 -3.926 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -6.966 -6.493 -5.383 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -7.015 -8.269 -5.476 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -4.550 -8.714 -3.674 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -4.806 -9.571 -5.213 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.307 -8.648 -4.947 1.00 0.00 H new ATOM 995 N ASN A 62 -4.619 -9.404 -8.157 1.00 0.00 N ATOM 996 CA ASN A 62 -5.099 -10.606 -8.833 1.00 0.00 C ATOM 997 C ASN A 62 -6.217 -10.270 -9.816 1.00 0.00 C ATOM 998 O ASN A 62 -7.125 -11.072 -10.036 1.00 0.00 O ATOM 999 CB ASN A 62 -5.594 -11.628 -7.809 1.00 0.00 C ATOM 1000 CG ASN A 62 -5.350 -13.056 -8.253 1.00 0.00 C ATOM 1001 OD1 ASN A 62 -6.271 -13.755 -8.676 1.00 0.00 O ATOM 1002 ND2 ASN A 62 -4.101 -13.500 -8.157 1.00 0.00 N ATOM 0 H ASN A 62 -3.612 -9.256 -8.224 1.00 0.00 H new ATOM 0 HA ASN A 62 -4.267 -11.035 -9.392 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -5.093 -11.456 -6.857 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.661 -11.481 -7.639 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -3.876 -14.454 -8.440 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -3.368 -12.887 -7.801 1.00 0.00 H new ATOM 1009 N GLY A 63 -6.145 -9.079 -10.404 1.00 0.00 N ATOM 1010 CA GLY A 63 -7.156 -8.659 -11.357 1.00 0.00 C ATOM 1011 C GLY A 63 -8.344 -7.980 -10.696 1.00 0.00 C ATOM 1012 O GLY A 63 -9.322 -7.645 -11.365 1.00 0.00 O ATOM 0 H GLY A 63 -5.404 -8.398 -10.237 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -6.707 -7.975 -12.078 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -7.505 -9.527 -11.916 1.00 0.00 H new ATOM 1016 N VAL A 64 -8.266 -7.778 -9.382 1.00 0.00 N ATOM 1017 CA VAL A 64 -9.348 -7.138 -8.644 1.00 0.00 C ATOM 1018 C VAL A 64 -8.966 -5.722 -8.220 1.00 0.00 C ATOM 1019 O VAL A 64 -7.845 -5.478 -7.774 1.00 0.00 O ATOM 1020 CB VAL A 64 -9.732 -7.950 -7.392 1.00 0.00 C ATOM 1021 CG1 VAL A 64 -10.966 -7.359 -6.727 1.00 0.00 C ATOM 1022 CG2 VAL A 64 -9.960 -9.412 -7.752 1.00 0.00 C ATOM 0 H VAL A 64 -7.466 -8.048 -8.810 1.00 0.00 H new ATOM 0 HA VAL A 64 -10.204 -7.094 -9.317 1.00 0.00 H new ATOM 0 HB VAL A 64 -8.906 -7.898 -6.682 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -11.221 -7.947 -5.845 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.762 -6.330 -6.431 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.801 -7.376 -7.428 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.230 -9.970 -6.855 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.766 -9.486 -8.482 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -9.047 -9.829 -8.177 1.00 0.00 H new ATOM 1032 N SER A 65 -9.907 -4.793 -8.362 1.00 0.00 N ATOM 1033 CA SER A 65 -9.670 -3.401 -7.994 1.00 0.00 C ATOM 1034 C SER A 65 -9.475 -3.260 -6.487 1.00 0.00 C ATOM 1035 O SER A 65 -10.122 -3.951 -5.700 1.00 0.00 O ATOM 1036 CB SER A 65 -10.838 -2.525 -8.452 1.00 0.00 C ATOM 1037 OG SER A 65 -10.591 -1.976 -9.735 1.00 0.00 O ATOM 0 H SER A 65 -10.840 -4.979 -8.729 1.00 0.00 H new ATOM 0 HA SER A 65 -8.758 -3.071 -8.492 1.00 0.00 H new ATOM 0 HB2 SER A 65 -11.753 -3.117 -8.476 1.00 0.00 H new ATOM 0 HB3 SER A 65 -10.997 -1.721 -7.733 1.00 0.00 H new ATOM 0 HG SER A 65 -11.353 -1.422 -10.006 1.00 0.00 H new ATOM 1043 N MET A 66 -8.576 -2.363 -6.094 1.00 0.00 N ATOM 1044 CA MET A 66 -8.292 -2.133 -4.681 1.00 0.00 C ATOM 1045 C MET A 66 -8.622 -0.697 -4.280 1.00 0.00 C ATOM 1046 O MET A 66 -8.040 -0.156 -3.336 1.00 0.00 O ATOM 1047 CB MET A 66 -6.823 -2.432 -4.383 1.00 0.00 C ATOM 1048 CG MET A 66 -6.534 -3.907 -4.162 1.00 0.00 C ATOM 1049 SD MET A 66 -4.918 -4.195 -3.418 1.00 0.00 S ATOM 1050 CE MET A 66 -5.387 -5.024 -1.901 1.00 0.00 C ATOM 0 H MET A 66 -8.032 -1.784 -6.733 1.00 0.00 H new ATOM 0 HA MET A 66 -8.921 -2.805 -4.097 1.00 0.00 H new ATOM 0 HB2 MET A 66 -6.213 -2.071 -5.211 1.00 0.00 H new ATOM 0 HB3 MET A 66 -6.520 -1.874 -3.497 1.00 0.00 H new ATOM 0 HG2 MET A 66 -7.306 -4.332 -3.520 1.00 0.00 H new ATOM 0 HG3 MET A 66 -6.589 -4.431 -5.116 1.00 0.00 H new ATOM 0 HE1 MET A 66 -4.654 -4.804 -1.125 1.00 0.00 H new ATOM 0 HE2 MET A 66 -6.369 -4.673 -1.583 1.00 0.00 H new ATOM 0 HE3 MET A 66 -5.424 -6.100 -2.071 1.00 0.00 H new ATOM 1060 N ASP A 67 -9.559 -0.086 -4.999 1.00 0.00 N ATOM 1061 CA ASP A 67 -9.967 1.286 -4.716 1.00 0.00 C ATOM 1062 C ASP A 67 -11.455 1.357 -4.382 1.00 0.00 C ATOM 1063 O ASP A 67 -12.087 2.402 -4.543 1.00 0.00 O ATOM 1064 CB ASP A 67 -9.658 2.189 -5.912 1.00 0.00 C ATOM 1065 CG ASP A 67 -8.219 2.064 -6.373 1.00 0.00 C ATOM 1066 OD1 ASP A 67 -7.779 0.927 -6.646 1.00 0.00 O ATOM 1067 OD2 ASP A 67 -7.532 3.104 -6.463 1.00 0.00 O ATOM 0 H ASP A 67 -10.050 -0.519 -5.781 1.00 0.00 H new ATOM 0 HA ASP A 67 -9.403 1.633 -3.850 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -10.324 1.936 -6.737 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -9.862 3.226 -5.644 1.00 0.00 H new ATOM 1072 N ASN A 68 -12.009 0.242 -3.914 1.00 0.00 N ATOM 1073 CA ASN A 68 -13.422 0.181 -3.556 1.00 0.00 C ATOM 1074 C ASN A 68 -13.794 -1.214 -3.062 1.00 0.00 C ATOM 1075 O ASN A 68 -14.834 -1.759 -3.433 1.00 0.00 O ATOM 1076 CB ASN A 68 -14.294 0.559 -4.756 1.00 0.00 C ATOM 1077 CG ASN A 68 -15.523 1.349 -4.350 1.00 0.00 C ATOM 1078 OD1 ASN A 68 -16.623 0.804 -4.259 1.00 0.00 O ATOM 1079 ND2 ASN A 68 -15.342 2.641 -4.106 1.00 0.00 N ATOM 0 H ASN A 68 -11.501 -0.631 -3.774 1.00 0.00 H new ATOM 0 HA ASN A 68 -13.599 0.894 -2.751 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -13.704 1.146 -5.460 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -14.603 -0.347 -5.277 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -16.133 3.224 -3.831 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -14.412 3.051 -4.194 1.00 0.00 H new ATOM 1086 N VAL A 69 -12.936 -1.788 -2.225 1.00 0.00 N ATOM 1087 CA VAL A 69 -13.176 -3.120 -1.683 1.00 0.00 C ATOM 1088 C VAL A 69 -12.811 -3.191 -0.204 1.00 0.00 C ATOM 1089 O VAL A 69 -11.884 -2.521 0.250 1.00 0.00 O ATOM 1090 CB VAL A 69 -12.374 -4.189 -2.449 1.00 0.00 C ATOM 1091 CG1 VAL A 69 -12.940 -4.382 -3.848 1.00 0.00 C ATOM 1092 CG2 VAL A 69 -10.901 -3.811 -2.509 1.00 0.00 C ATOM 0 H VAL A 69 -12.070 -1.352 -1.908 1.00 0.00 H new ATOM 0 HA VAL A 69 -14.241 -3.319 -1.799 1.00 0.00 H new ATOM 0 HB VAL A 69 -12.461 -5.135 -1.914 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -12.360 -5.141 -4.374 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -13.979 -4.703 -3.779 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -12.886 -3.441 -4.395 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -10.350 -4.578 -3.054 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -10.791 -2.854 -3.019 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -10.505 -3.730 -1.497 1.00 0.00 H new ATOM 1102 N GLU A 70 -13.546 -4.010 0.539 1.00 0.00 N ATOM 1103 CA GLU A 70 -13.303 -4.177 1.967 1.00 0.00 C ATOM 1104 C GLU A 70 -12.026 -4.974 2.212 1.00 0.00 C ATOM 1105 O GLU A 70 -11.613 -5.773 1.372 1.00 0.00 O ATOM 1106 CB GLU A 70 -14.491 -4.880 2.628 1.00 0.00 C ATOM 1107 CG GLU A 70 -14.648 -4.550 4.103 1.00 0.00 C ATOM 1108 CD GLU A 70 -14.247 -5.702 5.004 1.00 0.00 C ATOM 1109 OE1 GLU A 70 -14.950 -6.735 4.996 1.00 0.00 O ATOM 1110 OE2 GLU A 70 -13.229 -5.572 5.716 1.00 0.00 O ATOM 0 H GLU A 70 -14.317 -4.570 0.175 1.00 0.00 H new ATOM 0 HA GLU A 70 -13.183 -3.188 2.408 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -15.405 -4.603 2.103 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -14.373 -5.958 2.516 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.041 -3.677 4.343 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -15.685 -4.281 4.303 1.00 0.00 H new ATOM 1117 N HIS A 71 -11.407 -4.752 3.368 1.00 0.00 N ATOM 1118 CA HIS A 71 -10.174 -5.450 3.725 1.00 0.00 C ATOM 1119 C HIS A 71 -10.317 -6.956 3.518 1.00 0.00 C ATOM 1120 O HIS A 71 -9.382 -7.624 3.075 1.00 0.00 O ATOM 1121 CB HIS A 71 -9.802 -5.158 5.181 1.00 0.00 C ATOM 1122 CG HIS A 71 -8.529 -5.813 5.617 1.00 0.00 C ATOM 1123 ND1 HIS A 71 -7.444 -5.107 6.092 1.00 0.00 N ATOM 1124 CD2 HIS A 71 -8.171 -7.118 5.653 1.00 0.00 C ATOM 1125 CE1 HIS A 71 -6.474 -5.949 6.399 1.00 0.00 C ATOM 1126 NE2 HIS A 71 -6.890 -7.175 6.143 1.00 0.00 N ATOM 0 H HIS A 71 -11.738 -4.095 4.074 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.380 -5.087 3.072 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -9.711 -4.080 5.315 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -10.613 -5.492 5.828 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -8.780 -7.958 5.352 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -5.505 -5.680 6.793 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -6.348 -8.027 6.286 1.00 0.00 H new ATOM 1135 N ALA A 72 -11.493 -7.485 3.842 1.00 0.00 N ATOM 1136 CA ALA A 72 -11.759 -8.909 3.690 1.00 0.00 C ATOM 1137 C ALA A 72 -11.839 -9.300 2.218 1.00 0.00 C ATOM 1138 O ALA A 72 -11.381 -10.372 1.822 1.00 0.00 O ATOM 1139 CB ALA A 72 -13.047 -9.285 4.408 1.00 0.00 C ATOM 0 H ALA A 72 -12.277 -6.947 4.212 1.00 0.00 H new ATOM 0 HA ALA A 72 -10.931 -9.457 4.140 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -13.233 -10.352 4.286 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -12.954 -9.052 5.469 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -13.878 -8.721 3.984 1.00 0.00 H new ATOM 1145 N PHE A 73 -12.427 -8.422 1.411 1.00 0.00 N ATOM 1146 CA PHE A 73 -12.571 -8.672 -0.018 1.00 0.00 C ATOM 1147 C PHE A 73 -11.213 -8.660 -0.714 1.00 0.00 C ATOM 1148 O PHE A 73 -10.962 -9.450 -1.624 1.00 0.00 O ATOM 1149 CB PHE A 73 -13.494 -7.625 -0.648 1.00 0.00 C ATOM 1150 CG PHE A 73 -14.742 -8.207 -1.246 1.00 0.00 C ATOM 1151 CD1 PHE A 73 -15.767 -8.664 -0.434 1.00 0.00 C ATOM 1152 CD2 PHE A 73 -14.890 -8.298 -2.621 1.00 0.00 C ATOM 1153 CE1 PHE A 73 -16.917 -9.201 -0.981 1.00 0.00 C ATOM 1154 CE2 PHE A 73 -16.038 -8.833 -3.174 1.00 0.00 C ATOM 1155 CZ PHE A 73 -17.052 -9.286 -2.353 1.00 0.00 C ATOM 0 H PHE A 73 -12.812 -7.530 1.723 1.00 0.00 H new ATOM 0 HA PHE A 73 -13.013 -9.660 -0.147 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -13.772 -6.894 0.111 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -12.946 -7.088 -1.422 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -15.666 -8.600 0.639 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -14.099 -7.947 -3.268 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -17.709 -9.554 -0.337 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -16.142 -8.897 -4.247 1.00 0.00 H new ATOM 0 HZ PHE A 73 -17.949 -9.706 -2.783 1.00 0.00 H new ATOM 1165 N ALA A 74 -10.340 -7.754 -0.284 1.00 0.00 N ATOM 1166 CA ALA A 74 -9.009 -7.637 -0.867 1.00 0.00 C ATOM 1167 C ALA A 74 -8.109 -8.791 -0.434 1.00 0.00 C ATOM 1168 O ALA A 74 -7.395 -9.373 -1.251 1.00 0.00 O ATOM 1169 CB ALA A 74 -8.382 -6.305 -0.483 1.00 0.00 C ATOM 0 H ALA A 74 -10.531 -7.090 0.466 1.00 0.00 H new ATOM 0 HA ALA A 74 -9.112 -7.682 -1.951 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -7.388 -6.230 -0.925 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.005 -5.490 -0.851 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.303 -6.240 0.602 1.00 0.00 H new ATOM 1175 N VAL A 75 -8.143 -9.112 0.855 1.00 0.00 N ATOM 1176 CA VAL A 75 -7.323 -10.192 1.396 1.00 0.00 C ATOM 1177 C VAL A 75 -7.747 -11.548 0.838 1.00 0.00 C ATOM 1178 O VAL A 75 -6.905 -12.387 0.519 1.00 0.00 O ATOM 1179 CB VAL A 75 -7.393 -10.232 2.936 1.00 0.00 C ATOM 1180 CG1 VAL A 75 -8.812 -10.515 3.403 1.00 0.00 C ATOM 1181 CG2 VAL A 75 -6.422 -11.265 3.490 1.00 0.00 C ATOM 0 H VAL A 75 -8.729 -8.641 1.545 1.00 0.00 H new ATOM 0 HA VAL A 75 -6.296 -9.989 1.091 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.101 -9.254 3.318 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -8.839 -10.539 4.492 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -9.477 -9.731 3.041 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -9.139 -11.478 3.011 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.486 -11.278 4.578 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.677 -12.250 3.100 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.406 -11.007 3.190 1.00 0.00 H new ATOM 1191 N GLN A 76 -9.053 -11.763 0.726 1.00 0.00 N ATOM 1192 CA GLN A 76 -9.574 -13.024 0.209 1.00 0.00 C ATOM 1193 C GLN A 76 -9.108 -13.265 -1.225 1.00 0.00 C ATOM 1194 O GLN A 76 -8.991 -14.409 -1.664 1.00 0.00 O ATOM 1195 CB GLN A 76 -11.104 -13.038 0.272 1.00 0.00 C ATOM 1196 CG GLN A 76 -11.765 -12.057 -0.681 1.00 0.00 C ATOM 1197 CD GLN A 76 -13.235 -12.358 -0.900 1.00 0.00 C ATOM 1198 OE1 GLN A 76 -13.606 -13.033 -1.860 1.00 0.00 O ATOM 1199 NE2 GLN A 76 -14.082 -11.857 -0.008 1.00 0.00 N ATOM 0 H GLN A 76 -9.768 -11.084 0.985 1.00 0.00 H new ATOM 0 HA GLN A 76 -9.186 -13.827 0.835 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -11.459 -14.044 0.047 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -11.419 -12.809 1.290 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -11.660 -11.046 -0.287 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -11.246 -12.081 -1.639 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -13.731 -11.303 0.773 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -15.083 -12.027 -0.104 1.00 0.00 H new ATOM 1208 N GLN A 77 -8.847 -12.182 -1.951 1.00 0.00 N ATOM 1209 CA GLN A 77 -8.398 -12.283 -3.336 1.00 0.00 C ATOM 1210 C GLN A 77 -6.961 -12.788 -3.415 1.00 0.00 C ATOM 1211 O GLN A 77 -6.661 -13.723 -4.157 1.00 0.00 O ATOM 1212 CB GLN A 77 -8.510 -10.923 -4.030 1.00 0.00 C ATOM 1213 CG GLN A 77 -9.911 -10.604 -4.523 1.00 0.00 C ATOM 1214 CD GLN A 77 -10.474 -11.688 -5.421 1.00 0.00 C ATOM 1215 OE1 GLN A 77 -9.728 -12.461 -6.021 1.00 0.00 O ATOM 1216 NE2 GLN A 77 -11.797 -11.748 -5.519 1.00 0.00 N ATOM 0 H GLN A 77 -8.938 -11.227 -1.605 1.00 0.00 H new ATOM 0 HA GLN A 77 -9.041 -13.001 -3.845 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.192 -10.144 -3.337 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.822 -10.898 -4.875 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -10.571 -10.468 -3.667 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -9.895 -9.659 -5.066 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -12.377 -11.086 -5.003 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -12.233 -12.456 -6.110 1.00 0.00 H new ATOM 1225 N LEU A 78 -6.073 -12.163 -2.647 1.00 0.00 N ATOM 1226 CA LEU A 78 -4.667 -12.553 -2.635 1.00 0.00 C ATOM 1227 C LEU A 78 -4.475 -13.880 -1.908 1.00 0.00 C ATOM 1228 O LEU A 78 -3.571 -14.650 -2.230 1.00 0.00 O ATOM 1229 CB LEU A 78 -3.813 -11.465 -1.977 1.00 0.00 C ATOM 1230 CG LEU A 78 -4.236 -11.068 -0.562 1.00 0.00 C ATOM 1231 CD1 LEU A 78 -3.506 -11.912 0.471 1.00 0.00 C ATOM 1232 CD2 LEU A 78 -3.975 -9.588 -0.324 1.00 0.00 C ATOM 0 H LEU A 78 -6.301 -11.386 -2.026 1.00 0.00 H new ATOM 0 HA LEU A 78 -4.345 -12.677 -3.669 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.779 -11.807 -1.947 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -3.836 -10.577 -2.608 1.00 0.00 H new ATOM 0 HG LEU A 78 -5.306 -11.250 -0.459 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -3.820 -11.615 1.472 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -3.743 -12.964 0.314 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.431 -11.763 0.369 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -4.282 -9.323 0.688 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.912 -9.382 -0.447 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.544 -8.998 -1.042 1.00 0.00 H new ATOM 1244 N ARG A 79 -5.333 -14.143 -0.926 1.00 0.00 N ATOM 1245 CA ARG A 79 -5.256 -15.380 -0.156 1.00 0.00 C ATOM 1246 C ARG A 79 -5.661 -16.581 -1.005 1.00 0.00 C ATOM 1247 O ARG A 79 -5.239 -17.707 -0.746 1.00 0.00 O ATOM 1248 CB ARG A 79 -6.151 -15.292 1.081 1.00 0.00 C ATOM 1249 CG ARG A 79 -5.705 -16.197 2.219 1.00 0.00 C ATOM 1250 CD ARG A 79 -6.810 -17.153 2.641 1.00 0.00 C ATOM 1251 NE ARG A 79 -6.279 -18.440 3.088 1.00 0.00 N ATOM 1252 CZ ARG A 79 -5.553 -18.600 4.191 1.00 0.00 C ATOM 1253 NH1 ARG A 79 -5.271 -17.559 4.965 1.00 0.00 N ATOM 1254 NH2 ARG A 79 -5.108 -19.804 4.524 1.00 0.00 N ATOM 0 H ARG A 79 -6.088 -13.517 -0.645 1.00 0.00 H new ATOM 0 HA ARG A 79 -4.221 -15.515 0.159 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -6.169 -14.261 1.434 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -7.172 -15.551 0.800 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -4.829 -16.767 1.909 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -5.404 -15.589 3.072 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -7.392 -16.702 3.445 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -7.491 -17.312 1.805 1.00 0.00 H new ATOM 0 HE ARG A 79 -6.477 -19.264 2.520 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -5.611 -16.631 4.715 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -4.714 -17.688 5.810 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -5.322 -20.608 3.934 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -4.551 -19.926 5.370 1.00 0.00 H new ATOM 1268 N LYS A 80 -6.485 -16.334 -2.020 1.00 0.00 N ATOM 1269 CA LYS A 80 -6.948 -17.396 -2.905 1.00 0.00 C ATOM 1270 C LYS A 80 -5.785 -18.014 -3.677 1.00 0.00 C ATOM 1271 O LYS A 80 -5.848 -19.171 -4.091 1.00 0.00 O ATOM 1272 CB LYS A 80 -7.992 -16.854 -3.882 1.00 0.00 C ATOM 1273 CG LYS A 80 -9.054 -17.873 -4.265 1.00 0.00 C ATOM 1274 CD LYS A 80 -10.427 -17.231 -4.379 1.00 0.00 C ATOM 1275 CE LYS A 80 -11.536 -18.243 -4.144 1.00 0.00 C ATOM 1276 NZ LYS A 80 -11.567 -19.289 -5.203 1.00 0.00 N ATOM 0 H LYS A 80 -6.845 -15.408 -2.249 1.00 0.00 H new ATOM 0 HA LYS A 80 -7.402 -18.172 -2.289 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -8.477 -15.985 -3.437 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -7.488 -16.510 -4.785 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -8.788 -18.337 -5.215 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -9.083 -18.667 -3.519 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -10.512 -16.421 -3.654 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -10.541 -16.787 -5.368 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -11.396 -18.715 -3.171 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -12.496 -17.729 -4.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -12.358 -19.940 -5.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -11.692 -18.839 -6.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -10.673 -19.820 -5.193 1.00 0.00 H new ATOM 1290 N SER A 81 -4.722 -17.235 -3.867 1.00 0.00 N ATOM 1291 CA SER A 81 -3.547 -17.709 -4.590 1.00 0.00 C ATOM 1292 C SER A 81 -2.991 -18.983 -3.958 1.00 0.00 C ATOM 1293 O SER A 81 -3.182 -20.080 -4.482 1.00 0.00 O ATOM 1294 CB SER A 81 -2.466 -16.625 -4.614 1.00 0.00 C ATOM 1295 OG SER A 81 -2.842 -15.549 -5.455 1.00 0.00 O ATOM 0 H SER A 81 -4.651 -16.275 -3.530 1.00 0.00 H new ATOM 0 HA SER A 81 -3.850 -17.936 -5.612 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.293 -16.257 -3.603 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.526 -17.052 -4.963 1.00 0.00 H new ATOM 0 HG SER A 81 -2.335 -15.596 -6.292 1.00 0.00 H new ATOM 1301 N GLY A 82 -2.302 -18.829 -2.832 1.00 0.00 N ATOM 1302 CA GLY A 82 -1.731 -19.975 -2.150 1.00 0.00 C ATOM 1303 C GLY A 82 -0.267 -20.179 -2.484 1.00 0.00 C ATOM 1304 O GLY A 82 0.497 -20.699 -1.671 1.00 0.00 O ATOM 0 H GLY A 82 -2.129 -17.931 -2.380 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -1.840 -19.844 -1.073 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -2.290 -20.871 -2.421 1.00 0.00 H new ATOM 1308 N LYS A 83 0.126 -19.767 -3.686 1.00 0.00 N ATOM 1309 CA LYS A 83 1.510 -19.908 -4.126 1.00 0.00 C ATOM 1310 C LYS A 83 1.769 -19.079 -5.381 1.00 0.00 C ATOM 1311 O LYS A 83 2.607 -19.435 -6.210 1.00 0.00 O ATOM 1312 CB LYS A 83 1.833 -21.379 -4.399 1.00 0.00 C ATOM 1313 CG LYS A 83 0.954 -22.005 -5.469 1.00 0.00 C ATOM 1314 CD LYS A 83 1.256 -23.485 -5.642 1.00 0.00 C ATOM 1315 CE LYS A 83 0.733 -24.301 -4.470 1.00 0.00 C ATOM 1316 NZ LYS A 83 -0.710 -24.040 -4.213 1.00 0.00 N ATOM 0 H LYS A 83 -0.493 -19.334 -4.371 1.00 0.00 H new ATOM 0 HA LYS A 83 2.157 -19.542 -3.329 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.877 -21.463 -4.702 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.723 -21.944 -3.474 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.095 -21.875 -5.202 1.00 0.00 H new ATOM 0 HG3 LYS A 83 1.108 -21.488 -6.416 1.00 0.00 H new ATOM 0 HD2 LYS A 83 0.805 -23.844 -6.567 1.00 0.00 H new ATOM 0 HD3 LYS A 83 2.332 -23.629 -5.736 1.00 0.00 H new ATOM 0 HE2 LYS A 83 0.880 -25.362 -4.672 1.00 0.00 H new ATOM 0 HE3 LYS A 83 1.310 -24.064 -3.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.124 -24.848 -3.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -0.810 -23.181 -3.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -1.206 -23.909 -5.118 1.00 0.00 H new ATOM 1330 N ASN A 84 1.045 -17.972 -5.512 1.00 0.00 N ATOM 1331 CA ASN A 84 1.194 -17.089 -6.664 1.00 0.00 C ATOM 1332 C ASN A 84 0.189 -15.945 -6.600 1.00 0.00 C ATOM 1333 O ASN A 84 -0.829 -15.958 -7.293 1.00 0.00 O ATOM 1334 CB ASN A 84 1.008 -17.871 -7.967 1.00 0.00 C ATOM 1335 CG ASN A 84 -0.218 -18.761 -7.938 1.00 0.00 C ATOM 1336 OD1 ASN A 84 -0.972 -18.768 -6.965 1.00 0.00 O ATOM 1337 ND2 ASN A 84 -0.424 -19.519 -9.010 1.00 0.00 N ATOM 0 H ASN A 84 0.348 -17.665 -4.834 1.00 0.00 H new ATOM 0 HA ASN A 84 2.201 -16.672 -6.642 1.00 0.00 H new ATOM 0 HB2 ASN A 84 0.926 -17.171 -8.799 1.00 0.00 H new ATOM 0 HB3 ASN A 84 1.892 -18.481 -8.150 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -1.233 -20.139 -9.049 1.00 0.00 H new ATOM 0 HD22 ASN A 84 0.227 -19.481 -9.794 1.00 0.00 H new ATOM 1344 N ALA A 85 0.479 -14.956 -5.763 1.00 0.00 N ATOM 1345 CA ALA A 85 -0.400 -13.805 -5.608 1.00 0.00 C ATOM 1346 C ALA A 85 0.237 -12.551 -6.198 1.00 0.00 C ATOM 1347 O ALA A 85 1.215 -12.030 -5.664 1.00 0.00 O ATOM 1348 CB ALA A 85 -0.733 -13.589 -4.139 1.00 0.00 C ATOM 0 H ALA A 85 1.316 -14.929 -5.181 1.00 0.00 H new ATOM 0 HA ALA A 85 -1.323 -14.005 -6.151 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -1.391 -12.726 -4.038 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.233 -14.474 -3.745 1.00 0.00 H new ATOM 0 HB3 ALA A 85 0.186 -13.413 -3.580 1.00 0.00 H new ATOM 1354 N LYS A 86 -0.320 -12.074 -7.306 1.00 0.00 N ATOM 1355 CA LYS A 86 0.201 -10.884 -7.965 1.00 0.00 C ATOM 1356 C LYS A 86 -0.599 -9.644 -7.574 1.00 0.00 C ATOM 1357 O LYS A 86 -1.828 -9.670 -7.534 1.00 0.00 O ATOM 1358 CB LYS A 86 0.192 -11.069 -9.489 1.00 0.00 C ATOM 1359 CG LYS A 86 -1.117 -10.671 -10.156 1.00 0.00 C ATOM 1360 CD LYS A 86 -1.371 -11.485 -11.415 1.00 0.00 C ATOM 1361 CE LYS A 86 -2.323 -12.640 -11.150 1.00 0.00 C ATOM 1362 NZ LYS A 86 -1.596 -13.919 -10.917 1.00 0.00 N ATOM 0 H LYS A 86 -1.129 -12.492 -7.765 1.00 0.00 H new ATOM 0 HA LYS A 86 1.230 -10.739 -7.636 1.00 0.00 H new ATOM 0 HB2 LYS A 86 1.001 -10.480 -9.920 1.00 0.00 H new ATOM 0 HB3 LYS A 86 0.401 -12.114 -9.719 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -1.941 -10.814 -9.457 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -1.091 -9.610 -10.406 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -1.787 -10.840 -12.189 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -0.426 -11.872 -11.796 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -2.940 -12.410 -10.281 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -2.998 -12.756 -11.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -2.282 -14.681 -10.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -1.027 -14.153 -11.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -0.971 -13.818 -10.092 1.00 0.00 H new ATOM 1376 N ILE A 87 0.113 -8.560 -7.288 1.00 0.00 N ATOM 1377 CA ILE A 87 -0.521 -7.305 -6.903 1.00 0.00 C ATOM 1378 C ILE A 87 0.043 -6.142 -7.711 1.00 0.00 C ATOM 1379 O ILE A 87 1.251 -6.059 -7.937 1.00 0.00 O ATOM 1380 CB ILE A 87 -0.335 -7.017 -5.399 1.00 0.00 C ATOM 1381 CG1 ILE A 87 -0.853 -8.191 -4.562 1.00 0.00 C ATOM 1382 CG2 ILE A 87 -1.047 -5.728 -5.009 1.00 0.00 C ATOM 1383 CD1 ILE A 87 0.132 -8.673 -3.520 1.00 0.00 C ATOM 0 H ILE A 87 1.132 -8.525 -7.316 1.00 0.00 H new ATOM 0 HA ILE A 87 -1.586 -7.407 -7.111 1.00 0.00 H new ATOM 0 HB ILE A 87 0.730 -6.894 -5.201 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -1.777 -7.893 -4.066 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -1.100 -9.019 -5.226 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -0.905 -5.541 -3.945 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -0.635 -4.897 -5.581 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -2.112 -5.822 -5.222 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -0.302 -9.505 -2.966 1.00 0.00 H new ATOM 0 HD12 ILE A 87 1.048 -9.002 -4.010 1.00 0.00 H new ATOM 0 HD13 ILE A 87 0.361 -7.859 -2.832 1.00 0.00 H new ATOM 1395 N THR A 88 -0.837 -5.248 -8.146 1.00 0.00 N ATOM 1396 CA THR A 88 -0.425 -4.091 -8.930 1.00 0.00 C ATOM 1397 C THR A 88 -0.291 -2.857 -8.044 1.00 0.00 C ATOM 1398 O THR A 88 -1.237 -2.460 -7.365 1.00 0.00 O ATOM 1399 CB THR A 88 -1.429 -3.821 -10.051 1.00 0.00 C ATOM 1400 OG1 THR A 88 -2.048 -5.025 -10.470 1.00 0.00 O ATOM 1401 CG2 THR A 88 -0.808 -3.175 -11.269 1.00 0.00 C ATOM 0 H THR A 88 -1.840 -5.302 -7.969 1.00 0.00 H new ATOM 0 HA THR A 88 0.548 -4.310 -9.371 1.00 0.00 H new ATOM 0 HB THR A 88 -2.157 -3.130 -9.626 1.00 0.00 H new ATOM 0 HG1 THR A 88 -2.621 -5.366 -9.752 1.00 0.00 H new ATOM 0 HG21 THR A 88 -1.576 -3.011 -12.025 1.00 0.00 H new ATOM 0 HG22 THR A 88 -0.366 -2.219 -10.988 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.034 -3.828 -11.673 1.00 0.00 H new ATOM 1409 N ILE A 89 0.894 -2.256 -8.056 1.00 0.00 N ATOM 1410 CA ILE A 89 1.161 -1.069 -7.254 1.00 0.00 C ATOM 1411 C ILE A 89 1.622 0.090 -8.127 1.00 0.00 C ATOM 1412 O ILE A 89 1.988 -0.101 -9.287 1.00 0.00 O ATOM 1413 CB ILE A 89 2.233 -1.339 -6.179 1.00 0.00 C ATOM 1414 CG1 ILE A 89 3.362 -2.201 -6.749 1.00 0.00 C ATOM 1415 CG2 ILE A 89 1.607 -2.008 -4.966 1.00 0.00 C ATOM 1416 CD1 ILE A 89 4.114 -1.541 -7.885 1.00 0.00 C ATOM 0 H ILE A 89 1.687 -2.573 -8.614 1.00 0.00 H new ATOM 0 HA ILE A 89 0.224 -0.806 -6.763 1.00 0.00 H new ATOM 0 HB ILE A 89 2.658 -0.385 -5.866 1.00 0.00 H new ATOM 0 HG12 ILE A 89 4.064 -2.440 -5.950 1.00 0.00 H new ATOM 0 HG13 ILE A 89 2.945 -3.145 -7.100 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.375 -2.193 -4.215 1.00 0.00 H new ATOM 0 HG22 ILE A 89 0.839 -1.357 -4.547 1.00 0.00 H new ATOM 0 HG23 ILE A 89 1.157 -2.955 -5.265 1.00 0.00 H new ATOM 0 HD11 ILE A 89 4.899 -2.210 -8.239 1.00 0.00 H new ATOM 0 HD12 ILE A 89 3.425 -1.327 -8.702 1.00 0.00 H new ATOM 0 HD13 ILE A 89 4.561 -0.611 -7.534 1.00 0.00 H new ATOM 1428 N ARG A 90 1.607 1.295 -7.564 1.00 0.00 N ATOM 1429 CA ARG A 90 2.030 2.478 -8.300 1.00 0.00 C ATOM 1430 C ARG A 90 2.902 3.384 -7.438 1.00 0.00 C ATOM 1431 O ARG A 90 2.699 3.494 -6.227 1.00 0.00 O ATOM 1432 CB ARG A 90 0.816 3.254 -8.813 1.00 0.00 C ATOM 1433 CG ARG A 90 -0.262 3.463 -7.760 1.00 0.00 C ATOM 1434 CD ARG A 90 -1.514 2.658 -8.071 1.00 0.00 C ATOM 1435 NE ARG A 90 -2.715 3.490 -8.066 1.00 0.00 N ATOM 1436 CZ ARG A 90 -3.078 4.276 -9.078 1.00 0.00 C ATOM 1437 NH1 ARG A 90 -2.339 4.335 -10.180 1.00 0.00 N ATOM 1438 NH2 ARG A 90 -4.183 5.003 -8.988 1.00 0.00 N ATOM 0 H ARG A 90 1.308 1.476 -6.606 1.00 0.00 H new ATOM 0 HA ARG A 90 2.623 2.143 -9.151 1.00 0.00 H new ATOM 0 HB2 ARG A 90 1.145 4.225 -9.182 1.00 0.00 H new ATOM 0 HB3 ARG A 90 0.386 2.721 -9.661 1.00 0.00 H new ATOM 0 HG2 ARG A 90 0.123 3.174 -6.782 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -0.515 4.522 -7.703 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -1.406 2.183 -9.046 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.623 1.859 -7.337 1.00 0.00 H new ATOM 0 HE ARG A 90 -3.311 3.468 -7.238 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -1.489 3.777 -10.254 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -2.622 4.939 -10.952 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -4.754 4.960 -8.144 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -4.462 5.605 -9.763 1.00 0.00 H new ATOM 1452 N ARG A 91 3.879 4.024 -8.076 1.00 0.00 N ATOM 1453 CA ARG A 91 4.795 4.919 -7.380 1.00 0.00 C ATOM 1454 C ARG A 91 5.254 6.056 -8.288 1.00 0.00 C ATOM 1455 O ARG A 91 5.201 5.947 -9.514 1.00 0.00 O ATOM 1456 CB ARG A 91 6.011 4.137 -6.881 1.00 0.00 C ATOM 1457 CG ARG A 91 6.699 3.325 -7.967 1.00 0.00 C ATOM 1458 CD ARG A 91 6.034 1.971 -8.163 1.00 0.00 C ATOM 1459 NE ARG A 91 6.813 1.100 -9.040 1.00 0.00 N ATOM 1460 CZ ARG A 91 7.886 0.418 -8.644 1.00 0.00 C ATOM 1461 NH1 ARG A 91 8.312 0.505 -7.391 1.00 0.00 N ATOM 1462 NH2 ARG A 91 8.535 -0.354 -9.506 1.00 0.00 N ATOM 0 H ARG A 91 4.056 3.938 -9.077 1.00 0.00 H new ATOM 0 HA ARG A 91 4.264 5.351 -6.532 1.00 0.00 H new ATOM 0 HB2 ARG A 91 6.729 4.834 -6.450 1.00 0.00 H new ATOM 0 HB3 ARG A 91 5.698 3.467 -6.081 1.00 0.00 H new ATOM 0 HG2 ARG A 91 6.678 3.880 -8.905 1.00 0.00 H new ATOM 0 HG3 ARG A 91 7.747 3.181 -7.705 1.00 0.00 H new ATOM 0 HD2 ARG A 91 5.904 1.488 -7.195 1.00 0.00 H new ATOM 0 HD3 ARG A 91 5.039 2.114 -8.585 1.00 0.00 H new ATOM 0 HE ARG A 91 6.518 1.009 -10.012 1.00 0.00 H new ATOM 0 HH11 ARG A 91 7.817 1.097 -6.724 1.00 0.00 H new ATOM 0 HH12 ARG A 91 9.135 -0.020 -7.094 1.00 0.00 H new ATOM 0 HH21 ARG A 91 8.212 -0.425 -10.471 1.00 0.00 H new ATOM 0 HH22 ARG A 91 9.357 -0.877 -9.204 1.00 0.00 H new ATOM 1476 N LYS A 92 5.715 7.144 -7.678 1.00 0.00 N ATOM 1477 CA LYS A 92 6.197 8.301 -8.427 1.00 0.00 C ATOM 1478 C LYS A 92 7.172 9.126 -7.590 1.00 0.00 C ATOM 1479 O LYS A 92 8.212 9.562 -8.085 1.00 0.00 O ATOM 1480 CB LYS A 92 5.030 9.181 -8.882 1.00 0.00 C ATOM 1481 CG LYS A 92 3.925 9.326 -7.849 1.00 0.00 C ATOM 1482 CD LYS A 92 3.174 10.636 -8.020 1.00 0.00 C ATOM 1483 CE LYS A 92 1.878 10.645 -7.227 1.00 0.00 C ATOM 1484 NZ LYS A 92 0.743 11.185 -8.026 1.00 0.00 N ATOM 0 H LYS A 92 5.765 7.249 -6.665 1.00 0.00 H new ATOM 0 HA LYS A 92 6.720 7.929 -9.308 1.00 0.00 H new ATOM 0 HB2 LYS A 92 5.411 10.171 -9.132 1.00 0.00 H new ATOM 0 HB3 LYS A 92 4.607 8.762 -9.795 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.229 8.492 -7.939 1.00 0.00 H new ATOM 0 HG3 LYS A 92 4.353 9.278 -6.848 1.00 0.00 H new ATOM 0 HD2 LYS A 92 3.805 11.463 -7.696 1.00 0.00 H new ATOM 0 HD3 LYS A 92 2.956 10.796 -9.076 1.00 0.00 H new ATOM 0 HE2 LYS A 92 1.644 9.631 -6.902 1.00 0.00 H new ATOM 0 HE3 LYS A 92 2.007 11.246 -6.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 0.248 11.915 -7.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 1.106 11.602 -8.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.082 10.415 -8.254 1.00 0.00 H new ATOM 1498 N LYS A 93 6.830 9.338 -6.323 1.00 0.00 N ATOM 1499 CA LYS A 93 7.677 10.111 -5.422 1.00 0.00 C ATOM 1500 C LYS A 93 7.479 9.667 -3.976 1.00 0.00 C ATOM 1501 O LYS A 93 8.034 10.329 -3.074 1.00 0.00 O ATOM 1502 CB LYS A 93 7.372 11.604 -5.560 1.00 0.00 C ATOM 1503 CG LYS A 93 8.474 12.387 -6.255 1.00 0.00 C ATOM 1504 CD LYS A 93 8.382 13.873 -5.945 1.00 0.00 C ATOM 1505 CE LYS A 93 8.803 14.170 -4.515 1.00 0.00 C ATOM 1506 NZ LYS A 93 8.031 15.303 -3.934 1.00 0.00 N ATOM 1507 OXT LYS A 93 6.768 8.663 -3.757 1.00 0.00 O ATOM 0 H LYS A 93 5.973 8.985 -5.897 1.00 0.00 H new ATOM 0 HA LYS A 93 8.717 9.934 -5.696 1.00 0.00 H new ATOM 0 HB2 LYS A 93 6.443 11.727 -6.117 1.00 0.00 H new ATOM 0 HB3 LYS A 93 7.207 12.026 -4.569 1.00 0.00 H new ATOM 0 HG2 LYS A 93 9.446 12.008 -5.939 1.00 0.00 H new ATOM 0 HG3 LYS A 93 8.407 12.234 -7.332 1.00 0.00 H new ATOM 0 HD2 LYS A 93 9.016 14.430 -6.635 1.00 0.00 H new ATOM 0 HD3 LYS A 93 7.360 14.216 -6.103 1.00 0.00 H new ATOM 0 HE2 LYS A 93 8.659 13.280 -3.902 1.00 0.00 H new ATOM 0 HE3 LYS A 93 9.867 14.405 -4.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 8.347 15.474 -2.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 8.188 16.159 -4.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 7.018 15.068 -3.933 1.00 0.00 H new TER 1521 LYS A 93