USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 895 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 123 ASN : amide:sc= -0.876 K(o=0.38,f=-5.2!) USER MOD Set 1.2: A 124 SER OG : rot 69:sc= 1.26 USER MOD Single : A 8 ASN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 10 SER OG : rot -112:sc= 1.25 USER MOD Single : A 16 THR OG1 : rot 72:sc= 0.25 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.0296 K(o=-0.03,f=-0.67) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.595 USER MOD Single : A 60 LYS NZ :NH3+ -173:sc= 2.38 (180deg=2.28) USER MOD Single : A 61 SER OG : rot -89:sc= 1.31 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= -5.98! K(o=-6!,f=-1.1) USER MOD Single : A 75 THR OG1 : rot 180:sc=-0.00125 USER MOD Single : A 81 ASN : amide:sc= 1.21 K(o=1.2,f=-0.79) USER MOD Single : A 82 TYR OH : rot 30:sc= -0.161 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 HIS : no HD1:sc= 0.986 K(o=0.99,f=-3.1!) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 89:sc= 1.2 USER MOD Single : A 99 HIS : no HE2:sc= -2.15! C(o=-0.47!,f=-9!) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= 1.11 K(o=1.1,f=0) USER MOD Single : A 114 SER OG : rot 93:sc= 0.0325 USER MOD Single : A 115 TYR OH : rot -161:sc= 0.0586 USER MOD Single : A 118 SER OG : rot 89:sc= 1.17 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 65:sc= 1.26 USER MOD Single : A 132 TYR OH : rot 30:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N PRO A 2 -7.846 3.247 -12.977 1.00 0.00 N ATOM 21 CA PRO A 2 -7.245 3.734 -11.741 1.00 0.00 C ATOM 22 C PRO A 2 -8.302 4.090 -10.704 1.00 0.00 C ATOM 23 O PRO A 2 -9.122 4.983 -10.921 1.00 0.00 O ATOM 24 CB PRO A 2 -6.471 4.993 -12.170 1.00 0.00 C ATOM 25 CG PRO A 2 -6.538 5.026 -13.664 1.00 0.00 C ATOM 26 CD PRO A 2 -7.762 4.249 -14.046 1.00 0.00 C ATOM 0 HA PRO A 2 -6.612 2.980 -11.273 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -6.915 5.890 -11.739 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -5.437 4.952 -11.826 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -6.599 6.052 -14.028 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -5.644 4.584 -14.103 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -8.650 4.881 -14.081 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -7.660 3.788 -15.028 1.00 0.00 H new ATOM 34 N VAL A 3 -8.300 3.373 -9.590 1.00 0.00 N ATOM 35 CA VAL A 3 -9.227 3.663 -8.510 1.00 0.00 C ATOM 36 C VAL A 3 -8.671 4.795 -7.663 1.00 0.00 C ATOM 37 O VAL A 3 -7.797 4.590 -6.827 1.00 0.00 O ATOM 38 CB VAL A 3 -9.489 2.427 -7.623 1.00 0.00 C ATOM 39 CG1 VAL A 3 -10.536 2.735 -6.561 1.00 0.00 C ATOM 40 CG2 VAL A 3 -9.914 1.238 -8.472 1.00 0.00 C ATOM 0 H VAL A 3 -7.670 2.591 -9.412 1.00 0.00 H new ATOM 0 HA VAL A 3 -10.179 3.954 -8.953 1.00 0.00 H new ATOM 0 HB VAL A 3 -8.560 2.169 -7.116 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -10.704 1.849 -5.948 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -10.185 3.552 -5.930 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -11.469 3.025 -7.044 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -10.094 0.377 -7.828 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -10.828 1.485 -9.012 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -9.125 0.999 -9.185 1.00 0.00 H new ATOM 50 N GLU A 4 -9.162 5.992 -7.906 1.00 0.00 N ATOM 51 CA GLU A 4 -8.623 7.175 -7.264 1.00 0.00 C ATOM 52 C GLU A 4 -9.659 7.821 -6.361 1.00 0.00 C ATOM 53 O GLU A 4 -10.858 7.788 -6.649 1.00 0.00 O ATOM 54 CB GLU A 4 -8.154 8.164 -8.334 1.00 0.00 C ATOM 55 CG GLU A 4 -9.247 8.546 -9.319 1.00 0.00 C ATOM 56 CD GLU A 4 -8.714 9.212 -10.567 1.00 0.00 C ATOM 57 OE1 GLU A 4 -8.391 8.491 -11.534 1.00 0.00 O ATOM 58 OE2 GLU A 4 -8.631 10.456 -10.596 1.00 0.00 O ATOM 0 H GLU A 4 -9.936 6.173 -8.545 1.00 0.00 H new ATOM 0 HA GLU A 4 -7.775 6.885 -6.643 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.781 9.065 -7.848 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -7.318 7.728 -8.881 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.803 7.652 -9.601 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.951 9.218 -8.828 1.00 0.00 H new ATOM 65 N LEU A 5 -9.195 8.393 -5.263 1.00 0.00 N ATOM 66 CA LEU A 5 -10.059 9.163 -4.395 1.00 0.00 C ATOM 67 C LEU A 5 -10.124 10.587 -4.918 1.00 0.00 C ATOM 68 O LEU A 5 -9.207 11.381 -4.718 1.00 0.00 O ATOM 69 CB LEU A 5 -9.557 9.138 -2.948 1.00 0.00 C ATOM 70 CG LEU A 5 -10.476 9.823 -1.932 1.00 0.00 C ATOM 71 CD1 LEU A 5 -11.832 9.133 -1.884 1.00 0.00 C ATOM 72 CD2 LEU A 5 -9.834 9.831 -0.553 1.00 0.00 C ATOM 0 H LEU A 5 -8.224 8.337 -4.954 1.00 0.00 H new ATOM 0 HA LEU A 5 -11.056 8.723 -4.395 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -9.416 8.100 -2.646 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.578 9.616 -2.910 1.00 0.00 H new ATOM 0 HG LEU A 5 -10.627 10.855 -2.249 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -12.470 9.635 -1.156 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -12.299 9.179 -2.868 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -11.700 8.091 -1.593 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -10.501 10.322 0.156 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -9.652 8.806 -0.230 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.888 10.371 -0.595 1.00 0.00 H new ATOM 84 N ARG A 6 -11.200 10.885 -5.623 1.00 0.00 N ATOM 85 CA ARG A 6 -11.358 12.172 -6.272 1.00 0.00 C ATOM 86 C ARG A 6 -11.724 13.237 -5.253 1.00 0.00 C ATOM 87 O ARG A 6 -12.346 12.936 -4.237 1.00 0.00 O ATOM 88 CB ARG A 6 -12.422 12.067 -7.368 1.00 0.00 C ATOM 89 CG ARG A 6 -12.096 10.989 -8.390 1.00 0.00 C ATOM 90 CD ARG A 6 -13.225 10.767 -9.381 1.00 0.00 C ATOM 91 NE ARG A 6 -12.922 9.658 -10.291 1.00 0.00 N ATOM 92 CZ ARG A 6 -13.836 8.986 -10.993 1.00 0.00 C ATOM 93 NH1 ARG A 6 -15.121 9.312 -10.907 1.00 0.00 N ATOM 94 NH2 ARG A 6 -13.459 7.978 -11.775 1.00 0.00 N ATOM 0 H ARG A 6 -11.983 10.246 -5.761 1.00 0.00 H new ATOM 0 HA ARG A 6 -10.414 12.463 -6.732 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -13.389 11.852 -6.913 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -12.515 13.028 -7.874 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -11.192 11.267 -8.931 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -11.883 10.054 -7.872 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -14.149 10.557 -8.842 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -13.392 11.678 -9.956 1.00 0.00 H new ATOM 0 HE ARG A 6 -11.946 9.381 -10.394 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -15.413 10.080 -10.302 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -15.816 8.795 -11.446 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -12.474 7.721 -11.836 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -14.155 7.462 -12.313 1.00 0.00 H new ATOM 108 N ALA A 7 -11.325 14.475 -5.524 1.00 0.00 N ATOM 109 CA ALA A 7 -11.573 15.584 -4.609 1.00 0.00 C ATOM 110 C ALA A 7 -13.059 15.735 -4.316 1.00 0.00 C ATOM 111 O ALA A 7 -13.452 16.110 -3.209 1.00 0.00 O ATOM 112 CB ALA A 7 -11.005 16.874 -5.176 1.00 0.00 C ATOM 0 H ALA A 7 -10.826 14.737 -6.374 1.00 0.00 H new ATOM 0 HA ALA A 7 -11.069 15.365 -3.668 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -11.198 17.692 -4.482 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.930 16.766 -5.320 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -11.479 17.091 -6.133 1.00 0.00 H new ATOM 118 N ASN A 8 -13.882 15.451 -5.313 1.00 0.00 N ATOM 119 CA ASN A 8 -15.320 15.400 -5.113 1.00 0.00 C ATOM 120 C ASN A 8 -15.761 13.948 -5.037 1.00 0.00 C ATOM 121 O ASN A 8 -16.095 13.334 -6.053 1.00 0.00 O ATOM 122 CB ASN A 8 -16.076 16.116 -6.239 1.00 0.00 C ATOM 123 CG ASN A 8 -15.677 17.571 -6.401 1.00 0.00 C ATOM 124 OD1 ASN A 8 -15.187 18.208 -5.468 1.00 0.00 O ATOM 125 ND2 ASN A 8 -15.908 18.115 -7.585 1.00 0.00 N ATOM 0 H ASN A 8 -13.579 15.253 -6.267 1.00 0.00 H new ATOM 0 HA ASN A 8 -15.554 15.914 -4.181 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -15.898 15.591 -7.178 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -17.146 16.060 -6.041 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -15.679 19.095 -7.749 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -16.315 17.554 -8.333 1.00 0.00 H new ATOM 132 N TRP A 9 -15.716 13.382 -3.842 1.00 0.00 N ATOM 133 CA TRP A 9 -16.059 11.981 -3.659 1.00 0.00 C ATOM 134 C TRP A 9 -17.337 11.824 -2.846 1.00 0.00 C ATOM 135 O TRP A 9 -17.790 12.757 -2.179 1.00 0.00 O ATOM 136 CB TRP A 9 -14.910 11.221 -2.981 1.00 0.00 C ATOM 137 CG TRP A 9 -14.530 11.754 -1.626 1.00 0.00 C ATOM 138 CD1 TRP A 9 -13.568 12.682 -1.353 1.00 0.00 C ATOM 139 CD2 TRP A 9 -15.091 11.377 -0.359 1.00 0.00 C ATOM 140 NE1 TRP A 9 -13.500 12.908 -0.001 1.00 0.00 N ATOM 141 CE2 TRP A 9 -14.426 12.125 0.631 1.00 0.00 C ATOM 142 CE3 TRP A 9 -16.096 10.490 0.034 1.00 0.00 C ATOM 143 CZ2 TRP A 9 -14.726 12.005 1.985 1.00 0.00 C ATOM 144 CZ3 TRP A 9 -16.397 10.372 1.376 1.00 0.00 C ATOM 145 CH2 TRP A 9 -15.716 11.129 2.339 1.00 0.00 C ATOM 0 H TRP A 9 -15.446 13.869 -2.987 1.00 0.00 H new ATOM 0 HA TRP A 9 -16.228 11.555 -4.648 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -15.193 10.173 -2.880 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -14.035 11.254 -3.630 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -12.950 13.168 -2.093 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -12.861 13.556 0.459 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -16.629 9.905 -0.701 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -14.197 12.582 2.729 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -17.170 9.685 1.689 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -15.978 11.019 3.381 1.00 0.00 H new ATOM 156 N SER A 10 -17.907 10.634 -2.911 1.00 0.00 N ATOM 157 CA SER A 10 -19.096 10.300 -2.155 1.00 0.00 C ATOM 158 C SER A 10 -18.908 8.934 -1.492 1.00 0.00 C ATOM 159 O SER A 10 -17.853 8.313 -1.636 1.00 0.00 O ATOM 160 CB SER A 10 -20.309 10.300 -3.090 1.00 0.00 C ATOM 161 OG SER A 10 -21.523 10.118 -2.382 1.00 0.00 O ATOM 0 H SER A 10 -17.556 9.872 -3.491 1.00 0.00 H new ATOM 0 HA SER A 10 -19.266 11.040 -1.373 1.00 0.00 H new ATOM 0 HB2 SER A 10 -20.346 11.242 -3.637 1.00 0.00 H new ATOM 0 HB3 SER A 10 -20.197 9.507 -3.829 1.00 0.00 H new ATOM 0 HG SER A 10 -21.908 9.247 -2.612 1.00 0.00 H new ATOM 167 N GLU A 11 -19.924 8.476 -0.769 1.00 0.00 N ATOM 168 CA GLU A 11 -19.861 7.204 -0.052 1.00 0.00 C ATOM 169 C GLU A 11 -19.504 6.049 -0.988 1.00 0.00 C ATOM 170 O GLU A 11 -18.647 5.225 -0.671 1.00 0.00 O ATOM 171 CB GLU A 11 -21.201 6.927 0.623 1.00 0.00 C ATOM 172 CG GLU A 11 -21.588 7.970 1.657 1.00 0.00 C ATOM 173 CD GLU A 11 -20.783 7.857 2.932 1.00 0.00 C ATOM 174 OE1 GLU A 11 -21.181 7.072 3.815 1.00 0.00 O ATOM 175 OE2 GLU A 11 -19.763 8.558 3.067 1.00 0.00 O ATOM 0 H GLU A 11 -20.810 8.971 -0.663 1.00 0.00 H new ATOM 0 HA GLU A 11 -19.077 7.280 0.701 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -21.979 6.877 -0.139 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -21.161 5.949 1.103 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -21.450 8.964 1.233 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -22.648 7.867 1.891 1.00 0.00 H new ATOM 182 N GLU A 12 -20.162 5.998 -2.141 1.00 0.00 N ATOM 183 CA GLU A 12 -19.906 4.956 -3.127 1.00 0.00 C ATOM 184 C GLU A 12 -18.477 5.039 -3.657 1.00 0.00 C ATOM 185 O GLU A 12 -17.793 4.019 -3.769 1.00 0.00 O ATOM 186 CB GLU A 12 -20.906 5.037 -4.288 1.00 0.00 C ATOM 187 CG GLU A 12 -21.153 6.447 -4.804 1.00 0.00 C ATOM 188 CD GLU A 12 -22.297 7.134 -4.092 1.00 0.00 C ATOM 189 OE1 GLU A 12 -22.098 7.636 -2.967 1.00 0.00 O ATOM 190 OE2 GLU A 12 -23.410 7.161 -4.652 1.00 0.00 O ATOM 0 H GLU A 12 -20.879 6.669 -2.416 1.00 0.00 H new ATOM 0 HA GLU A 12 -20.033 3.995 -2.628 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -20.542 4.421 -5.110 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -21.855 4.609 -3.965 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -20.246 7.039 -4.682 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -21.366 6.407 -5.872 1.00 0.00 H new ATOM 197 N ASP A 13 -18.033 6.252 -3.973 1.00 0.00 N ATOM 198 CA ASP A 13 -16.672 6.475 -4.454 1.00 0.00 C ATOM 199 C ASP A 13 -15.671 5.960 -3.432 1.00 0.00 C ATOM 200 O ASP A 13 -14.748 5.214 -3.760 1.00 0.00 O ATOM 201 CB ASP A 13 -16.411 7.969 -4.691 1.00 0.00 C ATOM 202 CG ASP A 13 -17.397 8.612 -5.645 1.00 0.00 C ATOM 203 OD1 ASP A 13 -18.572 8.785 -5.257 1.00 0.00 O ATOM 204 OD2 ASP A 13 -16.995 8.981 -6.768 1.00 0.00 O ATOM 0 H ASP A 13 -18.598 7.099 -3.904 1.00 0.00 H new ATOM 0 HA ASP A 13 -16.557 5.939 -5.396 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -16.449 8.492 -3.735 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -15.402 8.095 -5.084 1.00 0.00 H new ATOM 209 N LEU A 14 -15.885 6.353 -2.184 1.00 0.00 N ATOM 210 CA LEU A 14 -15.007 5.976 -1.090 1.00 0.00 C ATOM 211 C LEU A 14 -15.004 4.462 -0.887 1.00 0.00 C ATOM 212 O LEU A 14 -13.950 3.864 -0.666 1.00 0.00 O ATOM 213 CB LEU A 14 -15.448 6.688 0.192 1.00 0.00 C ATOM 214 CG LEU A 14 -14.536 6.497 1.402 1.00 0.00 C ATOM 215 CD1 LEU A 14 -13.125 6.971 1.088 1.00 0.00 C ATOM 216 CD2 LEU A 14 -15.096 7.247 2.600 1.00 0.00 C ATOM 0 H LEU A 14 -16.670 6.940 -1.904 1.00 0.00 H new ATOM 0 HA LEU A 14 -13.990 6.280 -1.338 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.527 7.755 -0.016 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -16.447 6.339 0.454 1.00 0.00 H new ATOM 0 HG LEU A 14 -14.493 5.435 1.643 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -12.490 6.827 1.962 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.726 6.397 0.251 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -13.146 8.029 0.825 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -14.439 7.105 3.458 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -15.162 8.309 2.366 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -16.089 6.865 2.837 1.00 0.00 H new ATOM 228 N GLU A 15 -16.177 3.842 -0.982 1.00 0.00 N ATOM 229 CA GLU A 15 -16.290 2.400 -0.801 1.00 0.00 C ATOM 230 C GLU A 15 -15.512 1.651 -1.879 1.00 0.00 C ATOM 231 O GLU A 15 -14.833 0.663 -1.588 1.00 0.00 O ATOM 232 CB GLU A 15 -17.755 1.967 -0.801 1.00 0.00 C ATOM 233 CG GLU A 15 -17.940 0.480 -0.562 1.00 0.00 C ATOM 234 CD GLU A 15 -19.391 0.086 -0.414 1.00 0.00 C ATOM 235 OE1 GLU A 15 -20.056 -0.155 -1.439 1.00 0.00 O ATOM 236 OE2 GLU A 15 -19.872 0.011 0.735 1.00 0.00 O ATOM 0 H GLU A 15 -17.059 4.314 -1.182 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.857 2.149 0.167 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -18.291 2.521 -0.031 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -18.206 2.233 -1.757 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -17.501 -0.074 -1.392 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -17.396 0.191 0.337 1.00 0.00 H new ATOM 243 N THR A 16 -15.602 2.125 -3.118 1.00 0.00 N ATOM 244 CA THR A 16 -14.848 1.540 -4.216 1.00 0.00 C ATOM 245 C THR A 16 -13.346 1.624 -3.934 1.00 0.00 C ATOM 246 O THR A 16 -12.606 0.665 -4.161 1.00 0.00 O ATOM 247 CB THR A 16 -15.183 2.237 -5.553 1.00 0.00 C ATOM 248 OG1 THR A 16 -16.580 2.080 -5.843 1.00 0.00 O ATOM 249 CG2 THR A 16 -14.355 1.662 -6.695 1.00 0.00 C ATOM 0 H THR A 16 -16.191 2.914 -3.385 1.00 0.00 H new ATOM 0 HA THR A 16 -15.132 0.491 -4.301 1.00 0.00 H new ATOM 0 HB THR A 16 -14.943 3.296 -5.456 1.00 0.00 H new ATOM 0 HG1 THR A 16 -17.106 2.639 -5.233 1.00 0.00 H new ATOM 0 HG21 THR A 16 -14.612 2.172 -7.623 1.00 0.00 H new ATOM 0 HG22 THR A 16 -13.295 1.805 -6.484 1.00 0.00 H new ATOM 0 HG23 THR A 16 -14.564 0.597 -6.796 1.00 0.00 H new ATOM 257 N VAL A 17 -12.913 2.764 -3.407 1.00 0.00 N ATOM 258 CA VAL A 17 -11.524 2.942 -2.995 1.00 0.00 C ATOM 259 C VAL A 17 -11.147 1.906 -1.938 1.00 0.00 C ATOM 260 O VAL A 17 -10.102 1.259 -2.028 1.00 0.00 O ATOM 261 CB VAL A 17 -11.286 4.368 -2.442 1.00 0.00 C ATOM 262 CG1 VAL A 17 -9.877 4.522 -1.890 1.00 0.00 C ATOM 263 CG2 VAL A 17 -11.543 5.408 -3.522 1.00 0.00 C ATOM 0 H VAL A 17 -13.505 3.581 -3.254 1.00 0.00 H new ATOM 0 HA VAL A 17 -10.893 2.803 -3.873 1.00 0.00 H new ATOM 0 HB VAL A 17 -11.988 4.527 -1.623 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -9.744 5.535 -1.510 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -9.723 3.808 -1.081 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.153 4.334 -2.683 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -11.371 6.405 -3.116 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -10.868 5.236 -4.360 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -12.575 5.329 -3.865 1.00 0.00 H new ATOM 273 N ILE A 18 -12.024 1.737 -0.957 1.00 0.00 N ATOM 274 CA ILE A 18 -11.812 0.779 0.123 1.00 0.00 C ATOM 275 C ILE A 18 -11.670 -0.646 -0.418 1.00 0.00 C ATOM 276 O ILE A 18 -10.719 -1.355 -0.081 1.00 0.00 O ATOM 277 CB ILE A 18 -12.974 0.827 1.142 1.00 0.00 C ATOM 278 CG1 ILE A 18 -13.018 2.194 1.829 1.00 0.00 C ATOM 279 CG2 ILE A 18 -12.841 -0.289 2.170 1.00 0.00 C ATOM 280 CD1 ILE A 18 -14.201 2.370 2.757 1.00 0.00 C ATOM 0 H ILE A 18 -12.899 2.257 -0.886 1.00 0.00 H new ATOM 0 HA ILE A 18 -10.885 1.059 0.624 1.00 0.00 H new ATOM 0 HB ILE A 18 -13.910 0.677 0.605 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -12.098 2.336 2.396 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -13.046 2.973 1.067 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -13.670 -0.234 2.876 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -12.859 -1.254 1.664 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -11.899 -0.178 2.707 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -14.166 3.362 3.208 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -15.126 2.261 2.191 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -14.164 1.614 3.541 1.00 0.00 H new ATOM 292 N ARG A 19 -12.605 -1.049 -1.275 1.00 0.00 N ATOM 293 CA ARG A 19 -12.613 -2.408 -1.816 1.00 0.00 C ATOM 294 C ARG A 19 -11.392 -2.652 -2.697 1.00 0.00 C ATOM 295 O ARG A 19 -10.891 -3.777 -2.784 1.00 0.00 O ATOM 296 CB ARG A 19 -13.881 -2.666 -2.639 1.00 0.00 C ATOM 297 CG ARG A 19 -15.189 -2.493 -1.881 1.00 0.00 C ATOM 298 CD ARG A 19 -15.316 -3.465 -0.719 1.00 0.00 C ATOM 299 NE ARG A 19 -16.707 -3.603 -0.285 1.00 0.00 N ATOM 300 CZ ARG A 19 -17.253 -2.954 0.742 1.00 0.00 C ATOM 301 NH1 ARG A 19 -16.533 -2.112 1.477 1.00 0.00 N ATOM 302 NH2 ARG A 19 -18.531 -3.144 1.032 1.00 0.00 N ATOM 0 H ARG A 19 -13.365 -0.457 -1.610 1.00 0.00 H new ATOM 0 HA ARG A 19 -12.589 -3.092 -0.968 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -13.883 -1.991 -3.495 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -13.839 -3.681 -3.033 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -15.257 -1.472 -1.506 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -16.025 -2.638 -2.566 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -14.927 -4.440 -1.014 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -14.706 -3.118 0.115 1.00 0.00 H new ATOM 0 HE ARG A 19 -17.303 -4.244 -0.808 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -15.549 -1.956 1.257 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -16.964 -1.622 2.261 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -19.092 -3.785 0.470 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -18.955 -2.650 1.817 1.00 0.00 H new ATOM 316 N ALA A 20 -10.926 -1.601 -3.361 1.00 0.00 N ATOM 317 CA ALA A 20 -9.755 -1.696 -4.217 1.00 0.00 C ATOM 318 C ALA A 20 -8.516 -2.007 -3.391 1.00 0.00 C ATOM 319 O ALA A 20 -7.675 -2.817 -3.791 1.00 0.00 O ATOM 320 CB ALA A 20 -9.566 -0.407 -4.999 1.00 0.00 C ATOM 0 H ALA A 20 -11.344 -0.672 -3.321 1.00 0.00 H new ATOM 0 HA ALA A 20 -9.908 -2.510 -4.925 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -8.685 -0.493 -5.635 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -10.445 -0.225 -5.618 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -9.432 0.423 -4.305 1.00 0.00 H new ATOM 326 N VAL A 21 -8.418 -1.371 -2.229 1.00 0.00 N ATOM 327 CA VAL A 21 -7.316 -1.618 -1.316 1.00 0.00 C ATOM 328 C VAL A 21 -7.405 -3.032 -0.754 1.00 0.00 C ATOM 329 O VAL A 21 -6.419 -3.771 -0.756 1.00 0.00 O ATOM 330 CB VAL A 21 -7.294 -0.602 -0.153 1.00 0.00 C ATOM 331 CG1 VAL A 21 -6.136 -0.883 0.795 1.00 0.00 C ATOM 332 CG2 VAL A 21 -7.208 0.817 -0.687 1.00 0.00 C ATOM 0 H VAL A 21 -9.092 -0.680 -1.899 1.00 0.00 H new ATOM 0 HA VAL A 21 -6.392 -1.503 -1.883 1.00 0.00 H new ATOM 0 HB VAL A 21 -8.224 -0.709 0.405 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.143 -0.153 1.605 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -6.240 -1.886 1.209 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -5.194 -0.811 0.251 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.194 1.519 0.147 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -6.296 0.931 -1.273 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -8.073 1.021 -1.318 1.00 0.00 H new ATOM 342 N TYR A 22 -8.593 -3.411 -0.300 1.00 0.00 N ATOM 343 CA TYR A 22 -8.805 -4.736 0.260 1.00 0.00 C ATOM 344 C TYR A 22 -10.267 -5.151 0.133 1.00 0.00 C ATOM 345 O TYR A 22 -11.171 -4.319 0.216 1.00 0.00 O ATOM 346 CB TYR A 22 -8.383 -4.771 1.734 1.00 0.00 C ATOM 347 CG TYR A 22 -9.289 -3.977 2.656 1.00 0.00 C ATOM 348 CD1 TYR A 22 -9.246 -2.588 2.686 1.00 0.00 C ATOM 349 CD2 TYR A 22 -10.183 -4.621 3.499 1.00 0.00 C ATOM 350 CE1 TYR A 22 -10.067 -1.868 3.531 1.00 0.00 C ATOM 351 CE2 TYR A 22 -11.006 -3.909 4.344 1.00 0.00 C ATOM 352 CZ TYR A 22 -10.945 -2.534 4.357 1.00 0.00 C ATOM 353 OH TYR A 22 -11.773 -1.826 5.199 1.00 0.00 O ATOM 0 H TYR A 22 -9.423 -2.818 -0.309 1.00 0.00 H new ATOM 0 HA TYR A 22 -8.191 -5.440 -0.302 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -8.359 -5.808 2.070 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -7.367 -4.385 1.819 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -8.559 -2.064 2.038 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -10.235 -5.700 3.493 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -10.021 -0.789 3.544 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -11.696 -4.427 4.993 1.00 0.00 H new ATOM 0 HH TYR A 22 -12.329 -2.449 5.711 1.00 0.00 H new ATOM 586 N LEU A 37 -11.670 -2.393 10.040 1.00 0.00 N ATOM 587 CA LEU A 37 -10.706 -1.297 10.091 1.00 0.00 C ATOM 588 C LEU A 37 -11.430 0.026 10.318 1.00 0.00 C ATOM 589 O LEU A 37 -11.299 0.969 9.539 1.00 0.00 O ATOM 590 CB LEU A 37 -9.870 -1.248 8.806 1.00 0.00 C ATOM 591 CG LEU A 37 -9.048 -2.507 8.514 1.00 0.00 C ATOM 592 CD1 LEU A 37 -8.316 -2.372 7.188 1.00 0.00 C ATOM 593 CD2 LEU A 37 -8.062 -2.774 9.642 1.00 0.00 C ATOM 0 HA LEU A 37 -10.026 -1.469 10.926 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -10.538 -1.066 7.964 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -9.192 -0.396 8.865 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.731 -3.354 8.445 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.738 -3.276 6.998 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.040 -2.229 6.386 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.645 -1.514 7.228 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.487 -3.672 9.417 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.385 -1.925 9.742 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -8.607 -2.916 10.575 1.00 0.00 H new ATOM 605 N VAL A 38 -12.186 0.079 11.410 1.00 0.00 N ATOM 606 CA VAL A 38 -13.031 1.225 11.715 1.00 0.00 C ATOM 607 C VAL A 38 -12.220 2.517 11.813 1.00 0.00 C ATOM 608 O VAL A 38 -12.648 3.560 11.321 1.00 0.00 O ATOM 609 CB VAL A 38 -13.836 0.998 13.019 1.00 0.00 C ATOM 610 CG1 VAL A 38 -12.918 0.747 14.207 1.00 0.00 C ATOM 611 CG2 VAL A 38 -14.768 2.169 13.293 1.00 0.00 C ATOM 0 H VAL A 38 -12.229 -0.667 12.104 1.00 0.00 H new ATOM 0 HA VAL A 38 -13.733 1.330 10.888 1.00 0.00 H new ATOM 0 HB VAL A 38 -14.443 0.104 12.878 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -13.518 0.592 15.104 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -12.312 -0.139 14.018 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -12.266 1.608 14.351 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -15.322 1.985 14.214 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -14.183 3.083 13.397 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -15.468 2.279 12.464 1.00 0.00 H new ATOM 621 N SER A 39 -11.042 2.441 12.421 1.00 0.00 N ATOM 622 CA SER A 39 -10.200 3.613 12.588 1.00 0.00 C ATOM 623 C SER A 39 -9.709 4.115 11.236 1.00 0.00 C ATOM 624 O SER A 39 -9.833 5.300 10.923 1.00 0.00 O ATOM 625 CB SER A 39 -9.013 3.281 13.494 1.00 0.00 C ATOM 626 OG SER A 39 -9.458 2.726 14.720 1.00 0.00 O ATOM 0 H SER A 39 -10.651 1.581 12.805 1.00 0.00 H new ATOM 0 HA SER A 39 -10.790 4.402 13.054 1.00 0.00 H new ATOM 0 HB2 SER A 39 -8.350 2.578 12.990 1.00 0.00 H new ATOM 0 HB3 SER A 39 -8.433 4.183 13.687 1.00 0.00 H new ATOM 0 HG SER A 39 -8.685 2.519 15.285 1.00 0.00 H new ATOM 632 N ALA A 40 -9.176 3.203 10.428 1.00 0.00 N ATOM 633 CA ALA A 40 -8.657 3.553 9.112 1.00 0.00 C ATOM 634 C ALA A 40 -9.762 4.112 8.223 1.00 0.00 C ATOM 635 O ALA A 40 -9.580 5.133 7.556 1.00 0.00 O ATOM 636 CB ALA A 40 -8.009 2.343 8.457 1.00 0.00 C ATOM 0 H ALA A 40 -9.093 2.214 10.663 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.900 4.327 9.240 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.627 2.622 7.475 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -7.187 1.989 9.079 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.748 1.550 8.347 1.00 0.00 H new ATOM 642 N GLU A 41 -10.909 3.443 8.236 1.00 0.00 N ATOM 643 CA GLU A 41 -12.058 3.851 7.441 1.00 0.00 C ATOM 644 C GLU A 41 -12.532 5.241 7.864 1.00 0.00 C ATOM 645 O GLU A 41 -12.709 6.127 7.030 1.00 0.00 O ATOM 646 CB GLU A 41 -13.175 2.810 7.598 1.00 0.00 C ATOM 647 CG GLU A 41 -14.370 3.001 6.675 1.00 0.00 C ATOM 648 CD GLU A 41 -15.441 3.896 7.260 1.00 0.00 C ATOM 649 OE1 GLU A 41 -15.877 3.634 8.404 1.00 0.00 O ATOM 650 OE2 GLU A 41 -15.886 4.828 6.569 1.00 0.00 O ATOM 0 H GLU A 41 -11.067 2.605 8.796 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.776 3.907 6.390 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.755 1.820 7.423 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -13.526 2.829 8.630 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -14.027 3.425 5.731 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -14.804 2.027 6.448 1.00 0.00 H new ATOM 657 N SER A 42 -12.694 5.435 9.168 1.00 0.00 N ATOM 658 CA SER A 42 -13.175 6.703 9.704 1.00 0.00 C ATOM 659 C SER A 42 -12.200 7.841 9.388 1.00 0.00 C ATOM 660 O SER A 42 -12.619 8.943 9.041 1.00 0.00 O ATOM 661 CB SER A 42 -13.388 6.586 11.218 1.00 0.00 C ATOM 662 OG SER A 42 -13.947 7.771 11.765 1.00 0.00 O ATOM 0 H SER A 42 -12.498 4.727 9.876 1.00 0.00 H new ATOM 0 HA SER A 42 -14.127 6.936 9.228 1.00 0.00 H new ATOM 0 HB2 SER A 42 -14.046 5.743 11.428 1.00 0.00 H new ATOM 0 HB3 SER A 42 -12.435 6.376 11.704 1.00 0.00 H new ATOM 0 HG SER A 42 -14.070 7.659 12.731 1.00 0.00 H new ATOM 668 N LEU A 43 -10.903 7.566 9.491 1.00 0.00 N ATOM 669 CA LEU A 43 -9.883 8.581 9.236 1.00 0.00 C ATOM 670 C LEU A 43 -9.930 9.069 7.791 1.00 0.00 C ATOM 671 O LEU A 43 -9.827 10.271 7.532 1.00 0.00 O ATOM 672 CB LEU A 43 -8.489 8.041 9.560 1.00 0.00 C ATOM 673 CG LEU A 43 -8.198 7.832 11.047 1.00 0.00 C ATOM 674 CD1 LEU A 43 -6.821 7.220 11.239 1.00 0.00 C ATOM 675 CD2 LEU A 43 -8.302 9.147 11.802 1.00 0.00 C ATOM 0 H LEU A 43 -10.533 6.651 9.749 1.00 0.00 H new ATOM 0 HA LEU A 43 -10.095 9.428 9.888 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.357 7.090 9.044 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.747 8.730 9.155 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.942 7.144 11.448 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.631 7.078 12.303 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -6.777 6.257 10.731 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -6.066 7.885 10.821 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -8.092 8.978 12.858 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -7.580 9.857 11.397 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -9.309 9.551 11.693 1.00 0.00 H new ATOM 687 N LEU A 44 -10.086 8.142 6.857 1.00 0.00 N ATOM 688 CA LEU A 44 -10.163 8.490 5.445 1.00 0.00 C ATOM 689 C LEU A 44 -11.513 9.125 5.132 1.00 0.00 C ATOM 690 O LEU A 44 -11.603 10.067 4.347 1.00 0.00 O ATOM 691 CB LEU A 44 -9.949 7.251 4.573 1.00 0.00 C ATOM 692 CG LEU A 44 -9.829 7.527 3.072 1.00 0.00 C ATOM 693 CD1 LEU A 44 -8.607 8.389 2.782 1.00 0.00 C ATOM 694 CD2 LEU A 44 -9.758 6.223 2.295 1.00 0.00 C ATOM 0 H LEU A 44 -10.162 7.143 7.051 1.00 0.00 H new ATOM 0 HA LEU A 44 -9.375 9.209 5.224 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -9.044 6.743 4.907 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -10.779 6.564 4.735 1.00 0.00 H new ATOM 0 HG LEU A 44 -10.717 8.072 2.751 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.539 8.574 1.710 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -8.698 9.339 3.309 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.709 7.872 3.119 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -9.673 6.438 1.230 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -8.888 5.652 2.620 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.662 5.642 2.477 1.00 0.00 H new ATOM 706 N ARG A 45 -12.556 8.611 5.773 1.00 0.00 N ATOM 707 CA ARG A 45 -13.912 9.124 5.596 1.00 0.00 C ATOM 708 C ARG A 45 -13.999 10.572 6.075 1.00 0.00 C ATOM 709 O ARG A 45 -14.709 11.393 5.499 1.00 0.00 O ATOM 710 CB ARG A 45 -14.888 8.258 6.390 1.00 0.00 C ATOM 711 CG ARG A 45 -16.337 8.366 5.946 1.00 0.00 C ATOM 712 CD ARG A 45 -17.232 7.552 6.860 1.00 0.00 C ATOM 713 NE ARG A 45 -18.535 7.263 6.264 1.00 0.00 N ATOM 714 CZ ARG A 45 -19.391 6.379 6.769 1.00 0.00 C ATOM 715 NH1 ARG A 45 -19.086 5.721 7.883 1.00 0.00 N ATOM 716 NH2 ARG A 45 -20.539 6.142 6.157 1.00 0.00 N ATOM 0 H ARG A 45 -12.488 7.831 6.427 1.00 0.00 H new ATOM 0 HA ARG A 45 -14.170 9.091 4.537 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -14.575 7.217 6.312 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -14.823 8.533 7.443 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -16.650 9.410 5.956 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -16.437 8.013 4.920 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -16.735 6.614 7.108 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -17.377 8.093 7.795 1.00 0.00 H new ATOM 0 HE ARG A 45 -18.802 7.765 5.417 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -18.196 5.894 8.350 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -19.742 5.043 8.271 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -20.770 6.638 5.296 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -21.194 5.464 6.546 1.00 0.00 H new ATOM 730 N ASN A 46 -13.263 10.867 7.138 1.00 0.00 N ATOM 731 CA ASN A 46 -13.224 12.210 7.715 1.00 0.00 C ATOM 732 C ASN A 46 -12.266 13.107 6.927 1.00 0.00 C ATOM 733 O ASN A 46 -12.270 14.331 7.075 1.00 0.00 O ATOM 734 CB ASN A 46 -12.795 12.116 9.184 1.00 0.00 C ATOM 735 CG ASN A 46 -12.802 13.448 9.911 1.00 0.00 C ATOM 736 OD1 ASN A 46 -13.572 14.349 9.588 1.00 0.00 O ATOM 737 ND2 ASN A 46 -11.951 13.569 10.919 1.00 0.00 N ATOM 0 H ASN A 46 -12.678 10.188 7.625 1.00 0.00 H new ATOM 0 HA ASN A 46 -14.217 12.655 7.660 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -13.460 11.426 9.703 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -11.792 11.691 9.233 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -11.919 14.434 11.458 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -11.328 12.797 11.156 1.00 0.00 H new ATOM 744 N GLY A 47 -11.456 12.488 6.079 1.00 0.00 N ATOM 745 CA GLY A 47 -10.493 13.230 5.286 1.00 0.00 C ATOM 746 C GLY A 47 -9.297 13.672 6.101 1.00 0.00 C ATOM 747 O GLY A 47 -8.597 14.614 5.731 1.00 0.00 O ATOM 0 H GLY A 47 -11.448 11.480 5.925 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.155 12.610 4.456 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -10.979 14.105 4.854 1.00 0.00 H new ATOM 751 N LYS A 48 -9.056 12.985 7.210 1.00 0.00 N ATOM 752 CA LYS A 48 -7.953 13.337 8.092 1.00 0.00 C ATOM 753 C LYS A 48 -6.642 12.770 7.562 1.00 0.00 C ATOM 754 O LYS A 48 -5.575 13.355 7.761 1.00 0.00 O ATOM 755 CB LYS A 48 -8.222 12.837 9.519 1.00 0.00 C ATOM 756 CG LYS A 48 -7.075 13.105 10.481 1.00 0.00 C ATOM 757 CD LYS A 48 -7.455 12.806 11.924 1.00 0.00 C ATOM 758 CE LYS A 48 -8.465 13.809 12.460 1.00 0.00 C ATOM 759 NZ LYS A 48 -8.748 13.592 13.903 1.00 0.00 N ATOM 0 H LYS A 48 -9.607 12.184 7.519 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.869 14.423 8.121 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -9.124 13.316 9.899 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -8.418 11.765 9.489 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -6.216 12.496 10.199 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.768 14.147 10.396 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -7.871 11.801 11.990 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -6.560 12.822 12.547 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -8.086 14.820 12.312 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -9.392 13.730 11.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -9.441 14.295 14.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -9.133 12.636 14.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -7.868 13.693 14.448 1.00 0.00 H new ATOM 773 N ILE A 49 -6.726 11.638 6.877 1.00 0.00 N ATOM 774 CA ILE A 49 -5.546 11.010 6.301 1.00 0.00 C ATOM 775 C ILE A 49 -5.664 10.930 4.785 1.00 0.00 C ATOM 776 O ILE A 49 -6.737 11.157 4.223 1.00 0.00 O ATOM 777 CB ILE A 49 -5.313 9.589 6.861 1.00 0.00 C ATOM 778 CG1 ILE A 49 -6.486 8.668 6.510 1.00 0.00 C ATOM 779 CG2 ILE A 49 -5.096 9.636 8.367 1.00 0.00 C ATOM 780 CD1 ILE A 49 -6.253 7.216 6.879 1.00 0.00 C ATOM 0 H ILE A 49 -7.598 11.137 6.707 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.695 11.634 6.575 1.00 0.00 H new ATOM 0 HB ILE A 49 -4.413 9.183 6.399 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -7.381 9.024 7.020 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -6.681 8.735 5.440 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -4.934 8.626 8.743 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -4.224 10.251 8.590 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.975 10.065 8.848 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -7.126 6.625 6.601 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -5.377 6.842 6.349 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.088 7.136 7.953 1.00 0.00 H new ATOM 792 N THR A 50 -4.557 10.617 4.132 1.00 0.00 N ATOM 793 CA THR A 50 -4.542 10.426 2.695 1.00 0.00 C ATOM 794 C THR A 50 -4.748 8.953 2.364 1.00 0.00 C ATOM 795 O THR A 50 -4.850 8.120 3.269 1.00 0.00 O ATOM 796 CB THR A 50 -3.201 10.897 2.100 1.00 0.00 C ATOM 797 OG1 THR A 50 -2.120 10.259 2.791 1.00 0.00 O ATOM 798 CG2 THR A 50 -3.053 12.405 2.206 1.00 0.00 C ATOM 0 H THR A 50 -3.650 10.489 4.581 1.00 0.00 H new ATOM 0 HA THR A 50 -5.350 11.016 2.263 1.00 0.00 H new ATOM 0 HB THR A 50 -3.180 10.625 1.045 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.267 10.558 2.411 1.00 0.00 H new ATOM 0 HG21 THR A 50 -2.097 12.708 1.778 1.00 0.00 H new ATOM 0 HG22 THR A 50 -3.864 12.889 1.662 1.00 0.00 H new ATOM 0 HG23 THR A 50 -3.091 12.702 3.254 1.00 0.00 H new ATOM 806 N VAL A 51 -4.797 8.625 1.080 1.00 0.00 N ATOM 807 CA VAL A 51 -4.893 7.233 0.665 1.00 0.00 C ATOM 808 C VAL A 51 -3.597 6.511 1.013 1.00 0.00 C ATOM 809 O VAL A 51 -3.599 5.315 1.305 1.00 0.00 O ATOM 810 CB VAL A 51 -5.189 7.100 -0.847 1.00 0.00 C ATOM 811 CG1 VAL A 51 -5.275 5.638 -1.269 1.00 0.00 C ATOM 812 CG2 VAL A 51 -6.479 7.823 -1.191 1.00 0.00 C ATOM 0 H VAL A 51 -4.772 9.298 0.314 1.00 0.00 H new ATOM 0 HA VAL A 51 -5.727 6.777 1.199 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.365 7.558 -1.394 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -5.484 5.579 -2.337 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.328 5.142 -1.057 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -6.075 5.146 -0.715 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.679 7.723 -2.258 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.302 7.387 -0.626 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.383 8.879 -0.937 1.00 0.00 H new ATOM 822 N ARG A 52 -2.496 7.261 1.008 1.00 0.00 N ATOM 823 CA ARG A 52 -1.206 6.747 1.445 1.00 0.00 C ATOM 824 C ARG A 52 -1.315 6.212 2.869 1.00 0.00 C ATOM 825 O ARG A 52 -0.901 5.092 3.159 1.00 0.00 O ATOM 826 CB ARG A 52 -0.147 7.851 1.399 1.00 0.00 C ATOM 827 CG ARG A 52 1.271 7.351 1.619 1.00 0.00 C ATOM 828 CD ARG A 52 2.236 8.493 1.906 1.00 0.00 C ATOM 829 NE ARG A 52 2.212 8.876 3.317 1.00 0.00 N ATOM 830 CZ ARG A 52 3.012 9.788 3.871 1.00 0.00 C ATOM 831 NH1 ARG A 52 3.841 10.503 3.119 1.00 0.00 N ATOM 832 NH2 ARG A 52 2.961 9.991 5.181 1.00 0.00 N ATOM 0 H ARG A 52 -2.476 8.234 0.703 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.910 5.941 0.773 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.200 8.352 0.432 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -0.381 8.598 2.158 1.00 0.00 H new ATOM 0 HG2 ARG A 52 1.283 6.647 2.451 1.00 0.00 H new ATOM 0 HG3 ARG A 52 1.605 6.806 0.736 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.247 8.195 1.626 1.00 0.00 H new ATOM 0 HD3 ARG A 52 1.975 9.354 1.290 1.00 0.00 H new ATOM 0 HE ARG A 52 1.534 8.412 3.922 1.00 0.00 H new ATOM 0 HH11 ARG A 52 3.869 10.357 2.110 1.00 0.00 H new ATOM 0 HH12 ARG A 52 4.450 11.199 3.551 1.00 0.00 H new ATOM 0 HH21 ARG A 52 2.314 9.452 5.756 1.00 0.00 H new ATOM 0 HH22 ARG A 52 3.569 10.686 5.613 1.00 0.00 H new ATOM 846 N GLU A 53 -1.903 7.022 3.745 1.00 0.00 N ATOM 847 CA GLU A 53 -2.055 6.660 5.149 1.00 0.00 C ATOM 848 C GLU A 53 -3.111 5.573 5.324 1.00 0.00 C ATOM 849 O GLU A 53 -3.071 4.803 6.286 1.00 0.00 O ATOM 850 CB GLU A 53 -2.420 7.890 5.982 1.00 0.00 C ATOM 851 CG GLU A 53 -1.415 9.024 5.864 1.00 0.00 C ATOM 852 CD GLU A 53 -0.002 8.590 6.200 1.00 0.00 C ATOM 853 OE1 GLU A 53 0.699 8.095 5.299 1.00 0.00 O ATOM 854 OE2 GLU A 53 0.418 8.752 7.359 1.00 0.00 O ATOM 0 H GLU A 53 -2.283 7.937 3.505 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.101 6.268 5.500 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -3.401 8.251 5.672 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.504 7.598 7.029 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.437 9.420 4.849 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -1.709 9.836 6.529 1.00 0.00 H new ATOM 861 N PHE A 54 -4.056 5.510 4.397 1.00 0.00 N ATOM 862 CA PHE A 54 -5.058 4.457 4.417 1.00 0.00 C ATOM 863 C PHE A 54 -4.393 3.115 4.132 1.00 0.00 C ATOM 864 O PHE A 54 -4.537 2.163 4.901 1.00 0.00 O ATOM 865 CB PHE A 54 -6.163 4.739 3.393 1.00 0.00 C ATOM 866 CG PHE A 54 -7.304 3.764 3.456 1.00 0.00 C ATOM 867 CD1 PHE A 54 -8.181 3.774 4.530 1.00 0.00 C ATOM 868 CD2 PHE A 54 -7.502 2.839 2.442 1.00 0.00 C ATOM 869 CE1 PHE A 54 -9.230 2.877 4.592 1.00 0.00 C ATOM 870 CE2 PHE A 54 -8.549 1.941 2.501 1.00 0.00 C ATOM 871 CZ PHE A 54 -9.415 1.961 3.577 1.00 0.00 C ATOM 0 H PHE A 54 -4.149 6.172 3.626 1.00 0.00 H new ATOM 0 HA PHE A 54 -5.518 4.425 5.405 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -6.547 5.746 3.554 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.733 4.718 2.392 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -8.043 4.490 5.326 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -6.830 2.821 1.597 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -9.905 2.893 5.435 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -8.691 1.223 1.706 1.00 0.00 H new ATOM 0 HZ PHE A 54 -10.236 1.261 3.624 1.00 0.00 H new ATOM 881 N VAL A 55 -3.643 3.055 3.031 1.00 0.00 N ATOM 882 CA VAL A 55 -2.868 1.868 2.691 1.00 0.00 C ATOM 883 C VAL A 55 -1.893 1.541 3.819 1.00 0.00 C ATOM 884 O VAL A 55 -1.707 0.380 4.177 1.00 0.00 O ATOM 885 CB VAL A 55 -2.084 2.060 1.371 1.00 0.00 C ATOM 886 CG1 VAL A 55 -1.224 0.843 1.063 1.00 0.00 C ATOM 887 CG2 VAL A 55 -3.035 2.340 0.214 1.00 0.00 C ATOM 0 H VAL A 55 -3.558 3.818 2.360 1.00 0.00 H new ATOM 0 HA VAL A 55 -3.567 1.043 2.555 1.00 0.00 H new ATOM 0 HB VAL A 55 -1.427 2.920 1.497 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -0.684 1.006 0.130 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -0.511 0.687 1.872 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.860 -0.037 0.966 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -2.462 2.472 -0.704 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -3.722 1.502 0.096 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -3.602 3.247 0.421 1.00 0.00 H new ATOM 897 N ARG A 56 -1.296 2.589 4.378 1.00 0.00 N ATOM 898 CA ARG A 56 -0.418 2.479 5.538 1.00 0.00 C ATOM 899 C ARG A 56 -1.052 1.623 6.636 1.00 0.00 C ATOM 900 O ARG A 56 -0.465 0.641 7.082 1.00 0.00 O ATOM 901 CB ARG A 56 -0.124 3.882 6.077 1.00 0.00 C ATOM 902 CG ARG A 56 0.556 3.910 7.435 1.00 0.00 C ATOM 903 CD ARG A 56 0.425 5.280 8.080 1.00 0.00 C ATOM 904 NE ARG A 56 1.052 5.323 9.395 1.00 0.00 N ATOM 905 CZ ARG A 56 0.481 5.829 10.486 1.00 0.00 C ATOM 906 NH1 ARG A 56 -0.749 6.328 10.436 1.00 0.00 N ATOM 907 NH2 ARG A 56 1.141 5.822 11.636 1.00 0.00 N ATOM 0 H ARG A 56 -1.408 3.544 4.037 1.00 0.00 H new ATOM 0 HA ARG A 56 0.508 1.994 5.230 1.00 0.00 H new ATOM 0 HB2 ARG A 56 0.506 4.408 5.359 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -1.061 4.435 6.143 1.00 0.00 H new ATOM 0 HG2 ARG A 56 0.113 3.155 8.084 1.00 0.00 H new ATOM 0 HG3 ARG A 56 1.610 3.656 7.324 1.00 0.00 H new ATOM 0 HD2 ARG A 56 0.882 6.030 7.435 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -0.630 5.539 8.172 1.00 0.00 H new ATOM 0 HE ARG A 56 1.993 4.939 9.486 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -1.265 6.326 9.556 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -1.178 6.713 11.278 1.00 0.00 H new ATOM 0 HH21 ARG A 56 2.082 5.430 11.682 1.00 0.00 H new ATOM 0 HH22 ARG A 56 0.708 6.208 12.475 1.00 0.00 H new ATOM 921 N ALA A 57 -2.260 1.992 7.044 1.00 0.00 N ATOM 922 CA ALA A 57 -2.932 1.319 8.149 1.00 0.00 C ATOM 923 C ALA A 57 -3.405 -0.078 7.759 1.00 0.00 C ATOM 924 O ALA A 57 -3.317 -1.015 8.553 1.00 0.00 O ATOM 925 CB ALA A 57 -4.109 2.153 8.629 1.00 0.00 C ATOM 0 H ALA A 57 -2.795 2.754 6.626 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.210 1.209 8.958 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -4.604 1.642 9.454 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -3.752 3.126 8.967 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -4.816 2.290 7.811 1.00 0.00 H new ATOM 931 N VAL A 58 -3.914 -0.210 6.540 1.00 0.00 N ATOM 932 CA VAL A 58 -4.430 -1.490 6.061 1.00 0.00 C ATOM 933 C VAL A 58 -3.307 -2.515 5.911 1.00 0.00 C ATOM 934 O VAL A 58 -3.448 -3.667 6.322 1.00 0.00 O ATOM 935 CB VAL A 58 -5.167 -1.340 4.710 1.00 0.00 C ATOM 936 CG1 VAL A 58 -5.653 -2.690 4.201 1.00 0.00 C ATOM 937 CG2 VAL A 58 -6.336 -0.377 4.842 1.00 0.00 C ATOM 0 H VAL A 58 -3.981 0.551 5.865 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.141 -1.841 6.809 1.00 0.00 H new ATOM 0 HB VAL A 58 -4.460 -0.935 3.986 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -6.168 -2.556 3.250 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -4.800 -3.355 4.062 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -6.339 -3.127 4.927 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -6.842 -0.285 3.881 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.037 -0.755 5.586 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -5.969 0.601 5.154 1.00 0.00 H new ATOM 947 N ALA A 59 -2.190 -2.089 5.339 1.00 0.00 N ATOM 948 CA ALA A 59 -1.077 -2.990 5.083 1.00 0.00 C ATOM 949 C ALA A 59 -0.292 -3.290 6.357 1.00 0.00 C ATOM 950 O ALA A 59 0.102 -4.429 6.594 1.00 0.00 O ATOM 951 CB ALA A 59 -0.168 -2.411 4.010 1.00 0.00 C ATOM 0 H ALA A 59 -2.031 -1.126 5.044 1.00 0.00 H new ATOM 0 HA ALA A 59 -1.485 -3.935 4.724 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.661 -3.095 3.828 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -0.734 -2.273 3.089 1.00 0.00 H new ATOM 0 HB3 ALA A 59 0.222 -1.449 4.343 1.00 0.00 H new ATOM 957 N LYS A 60 -0.092 -2.273 7.191 1.00 0.00 N ATOM 958 CA LYS A 60 0.670 -2.437 8.429 1.00 0.00 C ATOM 959 C LYS A 60 -0.197 -2.990 9.557 1.00 0.00 C ATOM 960 O LYS A 60 0.163 -2.896 10.736 1.00 0.00 O ATOM 961 CB LYS A 60 1.305 -1.116 8.869 1.00 0.00 C ATOM 962 CG LYS A 60 2.471 -0.672 8.003 1.00 0.00 C ATOM 963 CD LYS A 60 3.279 0.407 8.699 1.00 0.00 C ATOM 964 CE LYS A 60 4.553 0.734 7.936 1.00 0.00 C ATOM 965 NZ LYS A 60 5.639 1.206 8.841 1.00 0.00 N ATOM 0 H LYS A 60 -0.445 -1.329 7.034 1.00 0.00 H new ATOM 0 HA LYS A 60 1.461 -3.157 8.217 1.00 0.00 H new ATOM 0 HB2 LYS A 60 0.542 -0.337 8.860 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.648 -1.215 9.899 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.111 -1.526 7.781 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.099 -0.296 7.050 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.673 1.308 8.800 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.532 0.079 9.707 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.890 -0.151 7.396 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.343 1.501 7.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 6.448 1.530 8.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 5.288 1.993 9.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 5.940 0.425 9.458 1.00 0.00 H new ATOM 979 N SER A 61 -1.340 -3.556 9.202 1.00 0.00 N ATOM 980 CA SER A 61 -2.217 -4.175 10.179 1.00 0.00 C ATOM 981 C SER A 61 -1.641 -5.520 10.623 1.00 0.00 C ATOM 982 O SER A 61 -0.482 -5.836 10.351 1.00 0.00 O ATOM 983 CB SER A 61 -3.617 -4.363 9.586 1.00 0.00 C ATOM 984 OG SER A 61 -3.592 -5.239 8.471 1.00 0.00 O ATOM 0 H SER A 61 -1.681 -3.599 8.242 1.00 0.00 H new ATOM 0 HA SER A 61 -2.293 -3.524 11.050 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.287 -4.761 10.349 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.018 -3.396 9.282 1.00 0.00 H new ATOM 0 HG SER A 61 -3.428 -4.724 7.654 1.00 0.00 H new ATOM 990 N GLU A 62 -2.450 -6.309 11.311 1.00 0.00 N ATOM 991 CA GLU A 62 -2.026 -7.629 11.749 1.00 0.00 C ATOM 992 C GLU A 62 -2.241 -8.650 10.639 1.00 0.00 C ATOM 993 O GLU A 62 -1.825 -9.806 10.759 1.00 0.00 O ATOM 994 CB GLU A 62 -2.802 -8.039 12.996 1.00 0.00 C ATOM 995 CG GLU A 62 -2.638 -7.066 14.148 1.00 0.00 C ATOM 996 CD GLU A 62 -3.494 -7.422 15.338 1.00 0.00 C ATOM 997 OE1 GLU A 62 -3.028 -8.185 16.201 1.00 0.00 O ATOM 998 OE2 GLU A 62 -4.641 -6.931 15.420 1.00 0.00 O ATOM 0 H GLU A 62 -3.402 -6.059 11.578 1.00 0.00 H new ATOM 0 HA GLU A 62 -0.963 -7.594 11.988 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.860 -8.122 12.747 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -2.471 -9.028 13.314 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -1.592 -7.043 14.452 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.894 -6.062 13.809 1.00 0.00 H new ATOM 1005 N LEU A 63 -2.895 -8.200 9.567 1.00 0.00 N ATOM 1006 CA LEU A 63 -3.217 -9.039 8.416 1.00 0.00 C ATOM 1007 C LEU A 63 -4.191 -10.157 8.789 1.00 0.00 C ATOM 1008 O LEU A 63 -4.478 -10.396 9.963 1.00 0.00 O ATOM 1009 CB LEU A 63 -1.943 -9.630 7.794 1.00 0.00 C ATOM 1010 CG LEU A 63 -0.931 -8.603 7.277 1.00 0.00 C ATOM 1011 CD1 LEU A 63 0.317 -9.300 6.755 1.00 0.00 C ATOM 1012 CD2 LEU A 63 -1.555 -7.738 6.191 1.00 0.00 C ATOM 0 H LEU A 63 -3.217 -7.237 9.474 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.703 -8.402 7.678 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -1.452 -10.257 8.538 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -2.230 -10.281 6.968 1.00 0.00 H new ATOM 0 HG LEU A 63 -0.642 -7.957 8.106 1.00 0.00 H new ATOM 0 HD11 LEU A 63 1.025 -8.555 6.392 1.00 0.00 H new ATOM 0 HD12 LEU A 63 0.776 -9.875 7.559 1.00 0.00 H new ATOM 0 HD13 LEU A 63 0.045 -9.970 5.939 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.821 -7.014 5.836 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.873 -8.369 5.361 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -2.418 -7.210 6.597 1.00 0.00 H new ATOM 1024 N TYR A 64 -4.714 -10.830 7.777 1.00 0.00 N ATOM 1025 CA TYR A 64 -5.628 -11.939 8.000 1.00 0.00 C ATOM 1026 C TYR A 64 -4.843 -13.199 8.339 1.00 0.00 C ATOM 1027 O TYR A 64 -5.285 -14.021 9.139 1.00 0.00 O ATOM 1028 CB TYR A 64 -6.496 -12.165 6.761 1.00 0.00 C ATOM 1029 CG TYR A 64 -7.287 -10.944 6.343 1.00 0.00 C ATOM 1030 CD1 TYR A 64 -8.502 -10.639 6.944 1.00 0.00 C ATOM 1031 CD2 TYR A 64 -6.817 -10.094 5.348 1.00 0.00 C ATOM 1032 CE1 TYR A 64 -9.225 -9.522 6.568 1.00 0.00 C ATOM 1033 CE2 TYR A 64 -7.534 -8.974 4.968 1.00 0.00 C ATOM 1034 CZ TYR A 64 -8.738 -8.695 5.579 1.00 0.00 C ATOM 1035 OH TYR A 64 -9.453 -7.583 5.204 1.00 0.00 O ATOM 0 H TYR A 64 -4.522 -10.629 6.796 1.00 0.00 H new ATOM 0 HA TYR A 64 -6.281 -11.698 8.839 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -5.859 -12.475 5.933 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -7.187 -12.985 6.956 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -8.888 -11.285 7.718 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -5.877 -10.312 4.864 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -10.167 -9.299 7.047 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -7.153 -8.321 4.197 1.00 0.00 H new ATOM 0 HH TYR A 64 -8.971 -7.107 4.496 1.00 0.00 H new ATOM 1045 N LYS A 65 -3.673 -13.328 7.704 1.00 0.00 N ATOM 1046 CA LYS A 65 -2.726 -14.423 7.946 1.00 0.00 C ATOM 1047 C LYS A 65 -3.226 -15.770 7.415 1.00 0.00 C ATOM 1048 O LYS A 65 -2.460 -16.496 6.779 1.00 0.00 O ATOM 1049 CB LYS A 65 -2.373 -14.539 9.436 1.00 0.00 C ATOM 1050 CG LYS A 65 -1.301 -15.582 9.720 1.00 0.00 C ATOM 1051 CD LYS A 65 -0.878 -15.595 11.179 1.00 0.00 C ATOM 1052 CE LYS A 65 0.209 -16.633 11.417 1.00 0.00 C ATOM 1053 NZ LYS A 65 0.654 -16.673 12.833 1.00 0.00 N ATOM 0 H LYS A 65 -3.352 -12.666 6.998 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.824 -14.169 7.388 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.032 -13.569 9.798 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -3.273 -14.790 9.997 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.675 -16.568 9.444 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.431 -15.385 9.094 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.514 -14.608 11.466 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.740 -15.813 11.810 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -0.162 -17.616 11.128 1.00 0.00 H new ATOM 0 HE3 LYS A 65 1.063 -16.414 10.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 1.394 -17.395 12.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 1.033 -15.743 13.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.154 -16.909 13.444 1.00 0.00 H new ATOM 1185 N PHE A 73 4.159 -20.250 0.143 1.00 0.00 N ATOM 1186 CA PHE A 73 5.540 -19.787 0.186 1.00 0.00 C ATOM 1187 C PHE A 73 5.628 -18.425 0.863 1.00 0.00 C ATOM 1188 O PHE A 73 4.903 -17.502 0.505 1.00 0.00 O ATOM 1189 CB PHE A 73 6.116 -19.697 -1.228 1.00 0.00 C ATOM 1190 CG PHE A 73 6.038 -20.982 -1.996 1.00 0.00 C ATOM 1191 CD1 PHE A 73 6.889 -22.033 -1.697 1.00 0.00 C ATOM 1192 CD2 PHE A 73 5.113 -21.141 -3.014 1.00 0.00 C ATOM 1193 CE1 PHE A 73 6.819 -23.219 -2.401 1.00 0.00 C ATOM 1194 CE2 PHE A 73 5.038 -22.325 -3.721 1.00 0.00 C ATOM 1195 CZ PHE A 73 5.891 -23.365 -3.414 1.00 0.00 C ATOM 0 HA PHE A 73 6.121 -20.506 0.763 1.00 0.00 H new ATOM 0 HB2 PHE A 73 5.583 -18.922 -1.779 1.00 0.00 H new ATOM 0 HB3 PHE A 73 7.158 -19.384 -1.166 1.00 0.00 H new ATOM 0 HD1 PHE A 73 7.615 -21.924 -0.905 1.00 0.00 H new ATOM 0 HD2 PHE A 73 4.443 -20.330 -3.258 1.00 0.00 H new ATOM 0 HE1 PHE A 73 7.489 -24.031 -2.160 1.00 0.00 H new ATOM 0 HE2 PHE A 73 4.313 -22.437 -4.513 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.833 -24.292 -3.965 1.00 0.00 H new ATOM 1205 N GLN A 74 6.526 -18.297 1.831 1.00 0.00 N ATOM 1206 CA GLN A 74 6.700 -17.036 2.545 1.00 0.00 C ATOM 1207 C GLN A 74 7.151 -15.940 1.584 1.00 0.00 C ATOM 1208 O GLN A 74 6.901 -14.757 1.809 1.00 0.00 O ATOM 1209 CB GLN A 74 7.709 -17.191 3.685 1.00 0.00 C ATOM 1210 CG GLN A 74 7.389 -18.328 4.653 1.00 0.00 C ATOM 1211 CD GLN A 74 6.158 -18.088 5.527 1.00 0.00 C ATOM 1212 OE1 GLN A 74 6.101 -18.560 6.658 1.00 0.00 O ATOM 1213 NE2 GLN A 74 5.161 -17.376 5.016 1.00 0.00 N ATOM 0 H GLN A 74 7.144 -19.047 2.140 1.00 0.00 H new ATOM 0 HA GLN A 74 5.739 -16.752 2.975 1.00 0.00 H new ATOM 0 HB2 GLN A 74 8.698 -17.359 3.259 1.00 0.00 H new ATOM 0 HB3 GLN A 74 7.756 -16.256 4.243 1.00 0.00 H new ATOM 0 HG2 GLN A 74 7.240 -19.244 4.081 1.00 0.00 H new ATOM 0 HG3 GLN A 74 8.251 -18.492 5.299 1.00 0.00 H new ATOM 0 HE21 GLN A 74 5.237 -16.996 4.072 1.00 0.00 H new ATOM 0 HE22 GLN A 74 4.319 -17.209 5.567 1.00 0.00 H new ATOM 1222 N THR A 75 7.804 -16.350 0.505 1.00 0.00 N ATOM 1223 CA THR A 75 8.225 -15.432 -0.541 1.00 0.00 C ATOM 1224 C THR A 75 7.019 -14.845 -1.274 1.00 0.00 C ATOM 1225 O THR A 75 7.087 -13.745 -1.825 1.00 0.00 O ATOM 1226 CB THR A 75 9.138 -16.152 -1.548 1.00 0.00 C ATOM 1227 OG1 THR A 75 8.604 -17.453 -1.830 1.00 0.00 O ATOM 1228 CG2 THR A 75 10.548 -16.293 -1.003 1.00 0.00 C ATOM 0 H THR A 75 8.055 -17.323 0.332 1.00 0.00 H new ATOM 0 HA THR A 75 8.776 -14.619 -0.069 1.00 0.00 H new ATOM 0 HB THR A 75 9.179 -15.558 -2.461 1.00 0.00 H new ATOM 0 HG1 THR A 75 9.184 -17.912 -2.473 1.00 0.00 H new ATOM 0 HG21 THR A 75 11.172 -16.805 -1.735 1.00 0.00 H new ATOM 0 HG22 THR A 75 10.961 -15.304 -0.803 1.00 0.00 H new ATOM 0 HG23 THR A 75 10.525 -16.870 -0.079 1.00 0.00 H new ATOM 1236 N ARG A 76 5.907 -15.576 -1.250 1.00 0.00 N ATOM 1237 CA ARG A 76 4.695 -15.147 -1.934 1.00 0.00 C ATOM 1238 C ARG A 76 4.044 -13.998 -1.174 1.00 0.00 C ATOM 1239 O ARG A 76 3.351 -13.170 -1.756 1.00 0.00 O ATOM 1240 CB ARG A 76 3.709 -16.310 -2.069 1.00 0.00 C ATOM 1241 CG ARG A 76 2.812 -16.202 -3.290 1.00 0.00 C ATOM 1242 CD ARG A 76 3.599 -16.460 -4.564 1.00 0.00 C ATOM 1243 NE ARG A 76 2.796 -16.240 -5.763 1.00 0.00 N ATOM 1244 CZ ARG A 76 2.438 -17.199 -6.611 1.00 0.00 C ATOM 1245 NH1 ARG A 76 2.828 -18.454 -6.409 1.00 0.00 N ATOM 1246 NH2 ARG A 76 1.710 -16.895 -7.673 1.00 0.00 N ATOM 0 H ARG A 76 5.823 -16.468 -0.763 1.00 0.00 H new ATOM 0 HA ARG A 76 4.966 -14.806 -2.933 1.00 0.00 H new ATOM 0 HB2 ARG A 76 4.267 -17.245 -2.119 1.00 0.00 H new ATOM 0 HB3 ARG A 76 3.088 -16.356 -1.174 1.00 0.00 H new ATOM 0 HG2 ARG A 76 1.995 -16.919 -3.211 1.00 0.00 H new ATOM 0 HG3 ARG A 76 2.363 -15.210 -3.330 1.00 0.00 H new ATOM 0 HD2 ARG A 76 4.471 -15.807 -4.588 1.00 0.00 H new ATOM 0 HD3 ARG A 76 3.968 -17.486 -4.559 1.00 0.00 H new ATOM 0 HE ARG A 76 2.490 -15.288 -5.963 1.00 0.00 H new ATOM 0 HH11 ARG A 76 3.405 -18.685 -5.600 1.00 0.00 H new ATOM 0 HH12 ARG A 76 2.550 -19.186 -7.063 1.00 0.00 H new ATOM 0 HH21 ARG A 76 1.427 -15.929 -7.838 1.00 0.00 H new ATOM 0 HH22 ARG A 76 1.432 -17.627 -8.327 1.00 0.00 H new ATOM 1260 N VAL A 77 4.284 -13.954 0.133 1.00 0.00 N ATOM 1261 CA VAL A 77 3.806 -12.857 0.966 1.00 0.00 C ATOM 1262 C VAL A 77 4.442 -11.549 0.506 1.00 0.00 C ATOM 1263 O VAL A 77 3.792 -10.505 0.457 1.00 0.00 O ATOM 1264 CB VAL A 77 4.134 -13.096 2.457 1.00 0.00 C ATOM 1265 CG1 VAL A 77 3.549 -11.994 3.325 1.00 0.00 C ATOM 1266 CG2 VAL A 77 3.624 -14.459 2.908 1.00 0.00 C ATOM 0 H VAL A 77 4.808 -14.668 0.639 1.00 0.00 H new ATOM 0 HA VAL A 77 2.722 -12.801 0.862 1.00 0.00 H new ATOM 0 HB VAL A 77 5.218 -13.079 2.571 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.794 -12.185 4.370 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.967 -11.033 3.024 1.00 0.00 H new ATOM 0 HG13 VAL A 77 2.466 -11.972 3.204 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.865 -14.608 3.961 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.543 -14.506 2.773 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.098 -15.240 2.313 1.00 0.00 H new ATOM 1276 N ILE A 78 5.715 -11.632 0.141 1.00 0.00 N ATOM 1277 CA ILE A 78 6.429 -10.492 -0.412 1.00 0.00 C ATOM 1278 C ILE A 78 5.824 -10.098 -1.751 1.00 0.00 C ATOM 1279 O ILE A 78 5.661 -8.915 -2.046 1.00 0.00 O ATOM 1280 CB ILE A 78 7.926 -10.807 -0.599 1.00 0.00 C ATOM 1281 CG1 ILE A 78 8.564 -11.134 0.753 1.00 0.00 C ATOM 1282 CG2 ILE A 78 8.645 -9.641 -1.269 1.00 0.00 C ATOM 1283 CD1 ILE A 78 10.004 -11.577 0.651 1.00 0.00 C ATOM 0 H ILE A 78 6.275 -12.481 0.219 1.00 0.00 H new ATOM 0 HA ILE A 78 6.335 -9.665 0.292 1.00 0.00 H new ATOM 0 HB ILE A 78 8.021 -11.676 -1.250 1.00 0.00 H new ATOM 0 HG12 ILE A 78 8.508 -10.254 1.394 1.00 0.00 H new ATOM 0 HG13 ILE A 78 7.985 -11.919 1.238 1.00 0.00 H new ATOM 0 HG21 ILE A 78 9.700 -9.886 -1.391 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.201 -9.453 -2.247 1.00 0.00 H new ATOM 0 HG23 ILE A 78 8.549 -8.750 -0.649 1.00 0.00 H new ATOM 0 HD11 ILE A 78 10.390 -11.792 1.647 1.00 0.00 H new ATOM 0 HD12 ILE A 78 10.066 -12.475 0.037 1.00 0.00 H new ATOM 0 HD13 ILE A 78 10.597 -10.784 0.195 1.00 0.00 H new ATOM 1295 N GLU A 79 5.479 -11.104 -2.551 1.00 0.00 N ATOM 1296 CA GLU A 79 4.844 -10.877 -3.834 1.00 0.00 C ATOM 1297 C GLU A 79 3.521 -10.144 -3.644 1.00 0.00 C ATOM 1298 O GLU A 79 3.169 -9.278 -4.436 1.00 0.00 O ATOM 1299 CB GLU A 79 4.614 -12.207 -4.552 1.00 0.00 C ATOM 1300 CG GLU A 79 4.076 -12.046 -5.959 1.00 0.00 C ATOM 1301 CD GLU A 79 3.808 -13.373 -6.639 1.00 0.00 C ATOM 1302 OE1 GLU A 79 4.781 -14.056 -7.015 1.00 0.00 O ATOM 1303 OE2 GLU A 79 2.622 -13.743 -6.788 1.00 0.00 O ATOM 0 H GLU A 79 5.632 -12.087 -2.326 1.00 0.00 H new ATOM 0 HA GLU A 79 5.501 -10.259 -4.446 1.00 0.00 H new ATOM 0 HB2 GLU A 79 5.554 -12.758 -4.591 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.916 -12.809 -3.971 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.153 -11.466 -5.926 1.00 0.00 H new ATOM 0 HG3 GLU A 79 4.790 -11.476 -6.553 1.00 0.00 H new ATOM 1310 N LEU A 80 2.808 -10.487 -2.575 1.00 0.00 N ATOM 1311 CA LEU A 80 1.548 -9.830 -2.248 1.00 0.00 C ATOM 1312 C LEU A 80 1.755 -8.330 -2.079 1.00 0.00 C ATOM 1313 O LEU A 80 1.073 -7.529 -2.718 1.00 0.00 O ATOM 1314 CB LEU A 80 0.945 -10.423 -0.969 1.00 0.00 C ATOM 1315 CG LEU A 80 0.557 -11.901 -1.053 1.00 0.00 C ATOM 1316 CD1 LEU A 80 0.033 -12.391 0.288 1.00 0.00 C ATOM 1317 CD2 LEU A 80 -0.483 -12.124 -2.145 1.00 0.00 C ATOM 0 H LEU A 80 3.083 -11.218 -1.919 1.00 0.00 H new ATOM 0 HA LEU A 80 0.854 -9.998 -3.072 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.662 -10.298 -0.157 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.059 -9.846 -0.703 1.00 0.00 H new ATOM 0 HG LEU A 80 1.449 -12.474 -1.307 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.238 -13.444 0.210 1.00 0.00 H new ATOM 0 HD12 LEU A 80 0.806 -12.271 1.047 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.845 -11.810 0.570 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -0.745 -13.181 -2.188 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -1.375 -11.538 -1.923 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.074 -11.812 -3.106 1.00 0.00 H new ATOM 1329 N ASN A 81 2.706 -7.954 -1.232 1.00 0.00 N ATOM 1330 CA ASN A 81 3.000 -6.543 -1.004 1.00 0.00 C ATOM 1331 C ASN A 81 3.527 -5.899 -2.280 1.00 0.00 C ATOM 1332 O ASN A 81 3.050 -4.848 -2.700 1.00 0.00 O ATOM 1333 CB ASN A 81 4.021 -6.364 0.126 1.00 0.00 C ATOM 1334 CG ASN A 81 3.531 -6.903 1.456 1.00 0.00 C ATOM 1335 OD1 ASN A 81 2.329 -6.973 1.709 1.00 0.00 O ATOM 1336 ND2 ASN A 81 4.461 -7.263 2.326 1.00 0.00 N ATOM 0 H ASN A 81 3.283 -8.601 -0.695 1.00 0.00 H new ATOM 0 HA ASN A 81 2.072 -6.053 -0.710 1.00 0.00 H new ATOM 0 HB2 ASN A 81 4.948 -6.869 -0.146 1.00 0.00 H new ATOM 0 HB3 ASN A 81 4.255 -5.305 0.233 1.00 0.00 H new ATOM 0 HD21 ASN A 81 4.191 -7.614 3.245 1.00 0.00 H new ATOM 0 HD22 ASN A 81 5.448 -7.190 2.078 1.00 0.00 H new ATOM 1343 N TYR A 82 4.492 -6.560 -2.900 1.00 0.00 N ATOM 1344 CA TYR A 82 5.129 -6.072 -4.121 1.00 0.00 C ATOM 1345 C TYR A 82 4.084 -5.787 -5.203 1.00 0.00 C ATOM 1346 O TYR A 82 3.974 -4.670 -5.710 1.00 0.00 O ATOM 1347 CB TYR A 82 6.105 -7.146 -4.617 1.00 0.00 C ATOM 1348 CG TYR A 82 7.283 -6.635 -5.414 1.00 0.00 C ATOM 1349 CD1 TYR A 82 7.111 -5.851 -6.546 1.00 0.00 C ATOM 1350 CD2 TYR A 82 8.579 -6.956 -5.029 1.00 0.00 C ATOM 1351 CE1 TYR A 82 8.198 -5.400 -7.272 1.00 0.00 C ATOM 1352 CE2 TYR A 82 9.669 -6.513 -5.748 1.00 0.00 C ATOM 1353 CZ TYR A 82 9.474 -5.736 -6.870 1.00 0.00 C ATOM 1354 OH TYR A 82 10.558 -5.293 -7.589 1.00 0.00 O ATOM 0 H TYR A 82 4.859 -7.453 -2.572 1.00 0.00 H new ATOM 0 HA TYR A 82 5.657 -5.143 -3.908 1.00 0.00 H new ATOM 0 HB2 TYR A 82 6.483 -7.695 -3.755 1.00 0.00 H new ATOM 0 HB3 TYR A 82 5.554 -7.858 -5.232 1.00 0.00 H new ATOM 0 HD1 TYR A 82 6.113 -5.589 -6.865 1.00 0.00 H new ATOM 0 HD2 TYR A 82 8.735 -7.564 -4.150 1.00 0.00 H new ATOM 0 HE1 TYR A 82 8.049 -4.788 -8.149 1.00 0.00 H new ATOM 0 HE2 TYR A 82 10.669 -6.773 -5.434 1.00 0.00 H new ATOM 0 HH TYR A 82 10.343 -4.434 -8.010 1.00 0.00 H new ATOM 1364 N LYS A 83 3.298 -6.804 -5.509 1.00 0.00 N ATOM 1365 CA LYS A 83 2.357 -6.774 -6.620 1.00 0.00 C ATOM 1366 C LYS A 83 1.160 -5.861 -6.339 1.00 0.00 C ATOM 1367 O LYS A 83 0.685 -5.163 -7.231 1.00 0.00 O ATOM 1368 CB LYS A 83 1.883 -8.203 -6.891 1.00 0.00 C ATOM 1369 CG LYS A 83 0.926 -8.366 -8.058 1.00 0.00 C ATOM 1370 CD LYS A 83 0.490 -9.816 -8.173 1.00 0.00 C ATOM 1371 CE LYS A 83 -0.398 -10.060 -9.378 1.00 0.00 C ATOM 1372 NZ LYS A 83 -0.809 -11.484 -9.464 1.00 0.00 N ATOM 0 H LYS A 83 3.293 -7.682 -4.990 1.00 0.00 H new ATOM 0 HA LYS A 83 2.863 -6.366 -7.495 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.757 -8.829 -7.071 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.399 -8.583 -5.991 1.00 0.00 H new ATOM 0 HG2 LYS A 83 0.055 -7.726 -7.917 1.00 0.00 H new ATOM 0 HG3 LYS A 83 1.409 -8.048 -8.982 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.372 -10.453 -8.240 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.044 -10.105 -7.268 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -1.283 -9.427 -9.315 1.00 0.00 H new ATOM 0 HE3 LYS A 83 0.132 -9.777 -10.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.415 -11.621 -10.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 0.036 -12.085 -9.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -1.336 -11.746 -8.606 1.00 0.00 H new ATOM 1386 N HIS A 84 0.685 -5.858 -5.100 1.00 0.00 N ATOM 1387 CA HIS A 84 -0.545 -5.146 -4.763 1.00 0.00 C ATOM 1388 C HIS A 84 -0.279 -3.689 -4.375 1.00 0.00 C ATOM 1389 O HIS A 84 -1.180 -2.857 -4.446 1.00 0.00 O ATOM 1390 CB HIS A 84 -1.277 -5.877 -3.632 1.00 0.00 C ATOM 1391 CG HIS A 84 -2.632 -5.324 -3.309 1.00 0.00 C ATOM 1392 ND1 HIS A 84 -3.767 -5.657 -4.011 1.00 0.00 N ATOM 1393 CD2 HIS A 84 -3.032 -4.466 -2.340 1.00 0.00 C ATOM 1394 CE1 HIS A 84 -4.803 -5.030 -3.495 1.00 0.00 C ATOM 1395 NE2 HIS A 84 -4.388 -4.300 -2.476 1.00 0.00 N ATOM 0 H HIS A 84 1.128 -6.336 -4.315 1.00 0.00 H new ATOM 0 HA HIS A 84 -1.175 -5.131 -5.653 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -1.383 -6.927 -3.904 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -0.660 -5.841 -2.734 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -2.401 -3.999 -1.598 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -5.822 -5.101 -3.846 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -4.977 -3.711 -1.888 1.00 0.00 H new ATOM 1404 N LEU A 85 0.941 -3.379 -3.958 1.00 0.00 N ATOM 1405 CA LEU A 85 1.261 -2.019 -3.531 1.00 0.00 C ATOM 1406 C LEU A 85 1.975 -1.240 -4.631 1.00 0.00 C ATOM 1407 O LEU A 85 1.769 -0.039 -4.778 1.00 0.00 O ATOM 1408 CB LEU A 85 2.110 -2.025 -2.256 1.00 0.00 C ATOM 1409 CG LEU A 85 1.462 -2.700 -1.044 1.00 0.00 C ATOM 1410 CD1 LEU A 85 2.396 -2.639 0.155 1.00 0.00 C ATOM 1411 CD2 LEU A 85 0.127 -2.046 -0.719 1.00 0.00 C ATOM 0 H LEU A 85 1.717 -4.039 -3.905 1.00 0.00 H new ATOM 0 HA LEU A 85 0.316 -1.520 -3.318 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.054 -2.527 -2.470 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.349 -0.995 -1.993 1.00 0.00 H new ATOM 0 HG LEU A 85 1.278 -3.747 -1.286 1.00 0.00 H new ATOM 0 HD11 LEU A 85 1.923 -3.122 1.010 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.327 -3.153 -0.083 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.608 -1.598 0.399 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.319 -2.539 0.145 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.284 -0.991 -0.494 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -0.542 -2.139 -1.575 1.00 0.00 H new ATOM 1423 N LEU A 86 2.811 -1.919 -5.407 1.00 0.00 N ATOM 1424 CA LEU A 86 3.533 -1.261 -6.489 1.00 0.00 C ATOM 1425 C LEU A 86 2.801 -1.441 -7.813 1.00 0.00 C ATOM 1426 O LEU A 86 3.182 -0.862 -8.830 1.00 0.00 O ATOM 1427 CB LEU A 86 4.959 -1.808 -6.593 1.00 0.00 C ATOM 1428 CG LEU A 86 5.839 -1.572 -5.361 1.00 0.00 C ATOM 1429 CD1 LEU A 86 7.217 -2.182 -5.567 1.00 0.00 C ATOM 1430 CD2 LEU A 86 5.950 -0.082 -5.065 1.00 0.00 C ATOM 0 H LEU A 86 3.005 -2.916 -5.309 1.00 0.00 H new ATOM 0 HA LEU A 86 3.584 -0.195 -6.265 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.907 -2.880 -6.783 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.443 -1.354 -7.458 1.00 0.00 H new ATOM 0 HG LEU A 86 5.374 -2.059 -4.504 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.829 -2.005 -4.683 1.00 0.00 H new ATOM 0 HD12 LEU A 86 7.119 -3.255 -5.732 1.00 0.00 H new ATOM 0 HD13 LEU A 86 7.692 -1.724 -6.434 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.578 0.069 -4.187 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.394 0.427 -5.921 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.957 0.326 -4.875 1.00 0.00 H new ATOM 1442 N GLY A 87 1.752 -2.259 -7.792 1.00 0.00 N ATOM 1443 CA GLY A 87 0.943 -2.475 -8.978 1.00 0.00 C ATOM 1444 C GLY A 87 1.674 -3.263 -10.045 1.00 0.00 C ATOM 1445 O GLY A 87 1.275 -3.262 -11.210 1.00 0.00 O ATOM 0 H GLY A 87 1.447 -2.779 -6.969 1.00 0.00 H new ATOM 0 HA2 GLY A 87 0.032 -3.005 -8.700 1.00 0.00 H new ATOM 0 HA3 GLY A 87 0.639 -1.511 -9.387 1.00 0.00 H new ATOM 1449 N ARG A 88 2.737 -3.947 -9.647 1.00 0.00 N ATOM 1450 CA ARG A 88 3.551 -4.712 -10.577 1.00 0.00 C ATOM 1451 C ARG A 88 4.260 -5.841 -9.836 1.00 0.00 C ATOM 1452 O ARG A 88 4.694 -5.669 -8.700 1.00 0.00 O ATOM 1453 CB ARG A 88 4.562 -3.787 -11.270 1.00 0.00 C ATOM 1454 CG ARG A 88 5.398 -4.464 -12.346 1.00 0.00 C ATOM 1455 CD ARG A 88 6.228 -3.450 -13.129 1.00 0.00 C ATOM 1456 NE ARG A 88 7.097 -2.656 -12.259 1.00 0.00 N ATOM 1457 CZ ARG A 88 8.058 -1.843 -12.702 1.00 0.00 C ATOM 1458 NH1 ARG A 88 8.269 -1.705 -14.006 1.00 0.00 N ATOM 1459 NH2 ARG A 88 8.800 -1.159 -11.842 1.00 0.00 N ATOM 0 H ARG A 88 3.056 -3.987 -8.679 1.00 0.00 H new ATOM 0 HA ARG A 88 2.912 -5.153 -11.342 1.00 0.00 H new ATOM 0 HB2 ARG A 88 4.024 -2.951 -11.717 1.00 0.00 H new ATOM 0 HB3 ARG A 88 5.230 -3.370 -10.517 1.00 0.00 H new ATOM 0 HG2 ARG A 88 6.058 -5.199 -11.886 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.744 -5.006 -13.029 1.00 0.00 H new ATOM 0 HD2 ARG A 88 6.836 -3.973 -13.867 1.00 0.00 H new ATOM 0 HD3 ARG A 88 5.562 -2.785 -13.679 1.00 0.00 H new ATOM 0 HE ARG A 88 6.959 -2.729 -11.251 1.00 0.00 H new ATOM 0 HH11 ARG A 88 7.695 -2.221 -14.673 1.00 0.00 H new ATOM 0 HH12 ARG A 88 9.005 -1.083 -14.341 1.00 0.00 H new ATOM 0 HH21 ARG A 88 8.637 -1.254 -10.840 1.00 0.00 H new ATOM 0 HH22 ARG A 88 9.534 -0.538 -12.183 1.00 0.00 H new ATOM 1473 N ALA A 89 4.353 -6.999 -10.477 1.00 0.00 N ATOM 1474 CA ALA A 89 4.981 -8.167 -9.873 1.00 0.00 C ATOM 1475 C ALA A 89 6.499 -8.000 -9.803 1.00 0.00 C ATOM 1476 O ALA A 89 7.077 -7.219 -10.565 1.00 0.00 O ATOM 1477 CB ALA A 89 4.609 -9.420 -10.658 1.00 0.00 C ATOM 0 H ALA A 89 3.999 -7.155 -11.421 1.00 0.00 H new ATOM 0 HA ALA A 89 4.614 -8.270 -8.852 1.00 0.00 H new ATOM 0 HB1 ALA A 89 5.082 -10.289 -10.201 1.00 0.00 H new ATOM 0 HB2 ALA A 89 3.527 -9.548 -10.647 1.00 0.00 H new ATOM 0 HB3 ALA A 89 4.952 -9.320 -11.688 1.00 0.00 H new ATOM 1483 N PRO A 90 7.160 -8.721 -8.875 1.00 0.00 N ATOM 1484 CA PRO A 90 8.621 -8.684 -8.721 1.00 0.00 C ATOM 1485 C PRO A 90 9.353 -8.995 -10.022 1.00 0.00 C ATOM 1486 O PRO A 90 9.068 -9.995 -10.688 1.00 0.00 O ATOM 1487 CB PRO A 90 8.912 -9.768 -7.669 1.00 0.00 C ATOM 1488 CG PRO A 90 7.655 -10.563 -7.555 1.00 0.00 C ATOM 1489 CD PRO A 90 6.539 -9.621 -7.894 1.00 0.00 C ATOM 0 HA PRO A 90 8.966 -7.692 -8.430 1.00 0.00 H new ATOM 0 HB2 PRO A 90 9.748 -10.397 -7.975 1.00 0.00 H new ATOM 0 HB3 PRO A 90 9.183 -9.323 -6.712 1.00 0.00 H new ATOM 0 HG2 PRO A 90 7.668 -11.414 -8.236 1.00 0.00 H new ATOM 0 HG3 PRO A 90 7.536 -10.963 -6.548 1.00 0.00 H new ATOM 0 HD2 PRO A 90 5.680 -10.145 -8.313 1.00 0.00 H new ATOM 0 HD3 PRO A 90 6.185 -9.080 -7.016 1.00 0.00 H new ATOM 1497 N TYR A 91 10.296 -8.133 -10.380 1.00 0.00 N ATOM 1498 CA TYR A 91 11.014 -8.271 -11.636 1.00 0.00 C ATOM 1499 C TYR A 91 12.149 -9.281 -11.507 1.00 0.00 C ATOM 1500 O TYR A 91 12.312 -10.158 -12.360 1.00 0.00 O ATOM 1501 CB TYR A 91 11.562 -6.913 -12.088 1.00 0.00 C ATOM 1502 CG TYR A 91 12.048 -6.901 -13.522 1.00 0.00 C ATOM 1503 CD1 TYR A 91 11.145 -6.909 -14.579 1.00 0.00 C ATOM 1504 CD2 TYR A 91 13.405 -6.877 -13.821 1.00 0.00 C ATOM 1505 CE1 TYR A 91 11.579 -6.895 -15.891 1.00 0.00 C ATOM 1506 CE2 TYR A 91 13.847 -6.862 -15.131 1.00 0.00 C ATOM 1507 CZ TYR A 91 12.930 -6.872 -16.161 1.00 0.00 C ATOM 1508 OH TYR A 91 13.364 -6.856 -17.469 1.00 0.00 O ATOM 0 H TYR A 91 10.580 -7.331 -9.817 1.00 0.00 H new ATOM 0 HA TYR A 91 10.315 -8.637 -12.388 1.00 0.00 H new ATOM 0 HB2 TYR A 91 10.783 -6.159 -11.971 1.00 0.00 H new ATOM 0 HB3 TYR A 91 12.384 -6.626 -11.432 1.00 0.00 H new ATOM 0 HD1 TYR A 91 10.085 -6.926 -14.371 1.00 0.00 H new ATOM 0 HD2 TYR A 91 14.126 -6.870 -13.017 1.00 0.00 H new ATOM 0 HE1 TYR A 91 10.863 -6.902 -16.700 1.00 0.00 H new ATOM 0 HE2 TYR A 91 14.905 -6.843 -15.347 1.00 0.00 H new ATOM 0 HH TYR A 91 14.344 -6.839 -17.488 1.00 0.00 H new ATOM 1518 N ASP A 92 12.922 -9.167 -10.436 1.00 0.00 N ATOM 1519 CA ASP A 92 14.071 -10.042 -10.223 1.00 0.00 C ATOM 1520 C ASP A 92 14.024 -10.669 -8.834 1.00 0.00 C ATOM 1521 O ASP A 92 13.233 -10.258 -7.983 1.00 0.00 O ATOM 1522 CB ASP A 92 15.381 -9.269 -10.410 1.00 0.00 C ATOM 1523 CG ASP A 92 15.525 -8.111 -9.445 1.00 0.00 C ATOM 1524 OD1 ASP A 92 15.857 -8.353 -8.269 1.00 0.00 O ATOM 1525 OD2 ASP A 92 15.325 -6.952 -9.864 1.00 0.00 O ATOM 0 H ASP A 92 12.776 -8.477 -9.699 1.00 0.00 H new ATOM 0 HA ASP A 92 14.028 -10.840 -10.964 1.00 0.00 H new ATOM 0 HB2 ASP A 92 16.221 -9.951 -10.279 1.00 0.00 H new ATOM 0 HB3 ASP A 92 15.432 -8.892 -11.432 1.00 0.00 H new ATOM 1530 N GLU A 93 14.879 -11.662 -8.610 1.00 0.00 N ATOM 1531 CA GLU A 93 14.890 -12.390 -7.348 1.00 0.00 C ATOM 1532 C GLU A 93 15.700 -11.645 -6.289 1.00 0.00 C ATOM 1533 O GLU A 93 15.493 -11.842 -5.092 1.00 0.00 O ATOM 1534 CB GLU A 93 15.452 -13.801 -7.547 1.00 0.00 C ATOM 1535 CG GLU A 93 15.367 -14.674 -6.305 1.00 0.00 C ATOM 1536 CD GLU A 93 15.930 -16.061 -6.519 1.00 0.00 C ATOM 1537 OE1 GLU A 93 17.165 -16.226 -6.447 1.00 0.00 O ATOM 1538 OE2 GLU A 93 15.138 -17.001 -6.744 1.00 0.00 O ATOM 0 H GLU A 93 15.573 -11.980 -9.287 1.00 0.00 H new ATOM 0 HA GLU A 93 13.861 -12.467 -6.998 1.00 0.00 H new ATOM 0 HB2 GLU A 93 14.911 -14.287 -8.359 1.00 0.00 H new ATOM 0 HB3 GLU A 93 16.494 -13.727 -7.858 1.00 0.00 H new ATOM 0 HG2 GLU A 93 15.906 -14.191 -5.490 1.00 0.00 H new ATOM 0 HG3 GLU A 93 14.325 -14.754 -5.995 1.00 0.00 H new ATOM 1545 N SER A 94 16.617 -10.787 -6.726 1.00 0.00 N ATOM 1546 CA SER A 94 17.416 -10.000 -5.797 1.00 0.00 C ATOM 1547 C SER A 94 16.513 -9.142 -4.922 1.00 0.00 C ATOM 1548 O SER A 94 16.746 -9.008 -3.720 1.00 0.00 O ATOM 1549 CB SER A 94 18.408 -9.125 -6.555 1.00 0.00 C ATOM 1550 OG SER A 94 18.257 -9.283 -7.955 1.00 0.00 O ATOM 0 H SER A 94 16.823 -10.621 -7.711 1.00 0.00 H new ATOM 0 HA SER A 94 17.977 -10.682 -5.157 1.00 0.00 H new ATOM 0 HB2 SER A 94 18.257 -8.080 -6.285 1.00 0.00 H new ATOM 0 HB3 SER A 94 19.425 -9.386 -6.263 1.00 0.00 H new ATOM 0 HG SER A 94 17.595 -8.641 -8.287 1.00 0.00 H new ATOM 1556 N GLU A 95 15.479 -8.572 -5.531 1.00 0.00 N ATOM 1557 CA GLU A 95 14.445 -7.866 -4.787 1.00 0.00 C ATOM 1558 C GLU A 95 13.807 -8.789 -3.759 1.00 0.00 C ATOM 1559 O GLU A 95 13.702 -8.440 -2.587 1.00 0.00 O ATOM 1560 CB GLU A 95 13.375 -7.316 -5.731 1.00 0.00 C ATOM 1561 CG GLU A 95 13.601 -5.870 -6.132 1.00 0.00 C ATOM 1562 CD GLU A 95 13.481 -4.916 -4.958 1.00 0.00 C ATOM 1563 OE1 GLU A 95 12.342 -4.550 -4.594 1.00 0.00 O ATOM 1564 OE2 GLU A 95 14.522 -4.526 -4.392 1.00 0.00 O ATOM 0 H GLU A 95 15.335 -8.586 -6.541 1.00 0.00 H new ATOM 0 HA GLU A 95 14.913 -7.029 -4.269 1.00 0.00 H new ATOM 0 HB2 GLU A 95 13.344 -7.932 -6.629 1.00 0.00 H new ATOM 0 HB3 GLU A 95 12.400 -7.403 -5.251 1.00 0.00 H new ATOM 0 HG2 GLU A 95 14.591 -5.770 -6.577 1.00 0.00 H new ATOM 0 HG3 GLU A 95 12.877 -5.591 -6.898 1.00 0.00 H new ATOM 1571 N VAL A 96 13.409 -9.978 -4.198 1.00 0.00 N ATOM 1572 CA VAL A 96 12.785 -10.954 -3.310 1.00 0.00 C ATOM 1573 C VAL A 96 13.678 -11.232 -2.103 1.00 0.00 C ATOM 1574 O VAL A 96 13.227 -11.168 -0.963 1.00 0.00 O ATOM 1575 CB VAL A 96 12.482 -12.278 -4.042 1.00 0.00 C ATOM 1576 CG1 VAL A 96 11.791 -13.266 -3.113 1.00 0.00 C ATOM 1577 CG2 VAL A 96 11.633 -12.024 -5.280 1.00 0.00 C ATOM 0 H VAL A 96 13.507 -10.290 -5.164 1.00 0.00 H new ATOM 0 HA VAL A 96 11.842 -10.525 -2.972 1.00 0.00 H new ATOM 0 HB VAL A 96 13.429 -12.715 -4.358 1.00 0.00 H new ATOM 0 HG11 VAL A 96 11.588 -14.191 -3.652 1.00 0.00 H new ATOM 0 HG12 VAL A 96 12.437 -13.477 -2.261 1.00 0.00 H new ATOM 0 HG13 VAL A 96 10.853 -12.838 -2.760 1.00 0.00 H new ATOM 0 HG21 VAL A 96 11.430 -12.970 -5.782 1.00 0.00 H new ATOM 0 HG22 VAL A 96 10.692 -11.560 -4.987 1.00 0.00 H new ATOM 0 HG23 VAL A 96 12.169 -11.360 -5.959 1.00 0.00 H new ATOM 1587 N ILE A 97 14.950 -11.507 -2.364 1.00 0.00 N ATOM 1588 CA ILE A 97 15.915 -11.778 -1.300 1.00 0.00 C ATOM 1589 C ILE A 97 16.093 -10.555 -0.399 1.00 0.00 C ATOM 1590 O ILE A 97 16.163 -10.677 0.824 1.00 0.00 O ATOM 1591 CB ILE A 97 17.283 -12.199 -1.880 1.00 0.00 C ATOM 1592 CG1 ILE A 97 17.117 -13.454 -2.742 1.00 0.00 C ATOM 1593 CG2 ILE A 97 18.292 -12.444 -0.763 1.00 0.00 C ATOM 1594 CD1 ILE A 97 18.390 -13.890 -3.430 1.00 0.00 C ATOM 0 H ILE A 97 15.340 -11.549 -3.305 1.00 0.00 H new ATOM 0 HA ILE A 97 15.520 -12.602 -0.705 1.00 0.00 H new ATOM 0 HB ILE A 97 17.663 -11.390 -2.503 1.00 0.00 H new ATOM 0 HG12 ILE A 97 16.755 -14.269 -2.116 1.00 0.00 H new ATOM 0 HG13 ILE A 97 16.352 -13.268 -3.496 1.00 0.00 H new ATOM 0 HG21 ILE A 97 19.248 -12.739 -1.195 1.00 0.00 H new ATOM 0 HG22 ILE A 97 18.422 -11.530 -0.184 1.00 0.00 H new ATOM 0 HG23 ILE A 97 17.928 -13.238 -0.111 1.00 0.00 H new ATOM 0 HD11 ILE A 97 18.196 -14.784 -4.022 1.00 0.00 H new ATOM 0 HD12 ILE A 97 18.742 -13.092 -4.083 1.00 0.00 H new ATOM 0 HD13 ILE A 97 19.152 -14.109 -2.681 1.00 0.00 H new ATOM 1606 N PHE A 98 16.138 -9.378 -1.014 1.00 0.00 N ATOM 1607 CA PHE A 98 16.269 -8.123 -0.279 1.00 0.00 C ATOM 1608 C PHE A 98 15.104 -7.956 0.691 1.00 0.00 C ATOM 1609 O PHE A 98 15.294 -7.627 1.862 1.00 0.00 O ATOM 1610 CB PHE A 98 16.318 -6.948 -1.264 1.00 0.00 C ATOM 1611 CG PHE A 98 16.489 -5.600 -0.619 1.00 0.00 C ATOM 1612 CD1 PHE A 98 17.754 -5.117 -0.326 1.00 0.00 C ATOM 1613 CD2 PHE A 98 15.388 -4.815 -0.314 1.00 0.00 C ATOM 1614 CE1 PHE A 98 17.916 -3.879 0.263 1.00 0.00 C ATOM 1615 CE2 PHE A 98 15.545 -3.574 0.274 1.00 0.00 C ATOM 1616 CZ PHE A 98 16.811 -3.106 0.564 1.00 0.00 C ATOM 0 H PHE A 98 16.085 -9.266 -2.026 1.00 0.00 H new ATOM 0 HA PHE A 98 17.195 -8.141 0.295 1.00 0.00 H new ATOM 0 HB2 PHE A 98 17.139 -7.110 -1.962 1.00 0.00 H new ATOM 0 HB3 PHE A 98 15.399 -6.943 -1.849 1.00 0.00 H new ATOM 0 HD1 PHE A 98 18.622 -5.715 -0.561 1.00 0.00 H new ATOM 0 HD2 PHE A 98 14.396 -5.177 -0.538 1.00 0.00 H new ATOM 0 HE1 PHE A 98 18.907 -3.514 0.489 1.00 0.00 H new ATOM 0 HE2 PHE A 98 14.679 -2.972 0.506 1.00 0.00 H new ATOM 0 HZ PHE A 98 16.937 -2.138 1.025 1.00 0.00 H new ATOM 1626 N HIS A 99 13.898 -8.207 0.197 1.00 0.00 N ATOM 1627 CA HIS A 99 12.703 -8.081 1.018 1.00 0.00 C ATOM 1628 C HIS A 99 12.644 -9.196 2.062 1.00 0.00 C ATOM 1629 O HIS A 99 12.146 -8.988 3.165 1.00 0.00 O ATOM 1630 CB HIS A 99 11.441 -8.093 0.149 1.00 0.00 C ATOM 1631 CG HIS A 99 11.251 -6.854 -0.682 1.00 0.00 C ATOM 1632 ND1 HIS A 99 10.403 -5.829 -0.325 1.00 0.00 N ATOM 1633 CD2 HIS A 99 11.794 -6.486 -1.864 1.00 0.00 C ATOM 1634 CE1 HIS A 99 10.433 -4.887 -1.250 1.00 0.00 C ATOM 1635 NE2 HIS A 99 11.272 -5.265 -2.195 1.00 0.00 N ATOM 0 H HIS A 99 13.723 -8.498 -0.765 1.00 0.00 H new ATOM 0 HA HIS A 99 12.751 -7.124 1.538 1.00 0.00 H new ATOM 0 HB2 HIS A 99 11.478 -8.958 -0.513 1.00 0.00 H new ATOM 0 HB3 HIS A 99 10.571 -8.221 0.793 1.00 0.00 H new ATOM 0 HD1 HIS A 99 9.838 -5.802 0.524 1.00 0.00 H new ATOM 0 HD2 HIS A 99 12.509 -7.052 -2.442 1.00 0.00 H new ATOM 0 HE1 HIS A 99 9.868 -3.966 -1.235 1.00 0.00 H new ATOM 1644 N LEU A 100 13.165 -10.372 1.711 1.00 0.00 N ATOM 1645 CA LEU A 100 13.246 -11.495 2.647 1.00 0.00 C ATOM 1646 C LEU A 100 14.061 -11.122 3.878 1.00 0.00 C ATOM 1647 O LEU A 100 13.599 -11.260 5.010 1.00 0.00 O ATOM 1648 CB LEU A 100 13.881 -12.718 1.977 1.00 0.00 C ATOM 1649 CG LEU A 100 12.953 -13.550 1.091 1.00 0.00 C ATOM 1650 CD1 LEU A 100 13.751 -14.586 0.316 1.00 0.00 C ATOM 1651 CD2 LEU A 100 11.885 -14.230 1.935 1.00 0.00 C ATOM 0 H LEU A 100 13.538 -10.572 0.783 1.00 0.00 H new ATOM 0 HA LEU A 100 12.228 -11.738 2.952 1.00 0.00 H new ATOM 0 HB2 LEU A 100 14.723 -12.381 1.373 1.00 0.00 H new ATOM 0 HB3 LEU A 100 14.286 -13.365 2.755 1.00 0.00 H new ATOM 0 HG LEU A 100 12.463 -12.884 0.380 1.00 0.00 H new ATOM 0 HD11 LEU A 100 13.077 -15.171 -0.310 1.00 0.00 H new ATOM 0 HD12 LEU A 100 14.486 -14.083 -0.313 1.00 0.00 H new ATOM 0 HD13 LEU A 100 14.263 -15.248 1.014 1.00 0.00 H new ATOM 0 HD21 LEU A 100 11.232 -14.819 1.291 1.00 0.00 H new ATOM 0 HD22 LEU A 100 12.361 -14.885 2.665 1.00 0.00 H new ATOM 0 HD23 LEU A 100 11.296 -13.474 2.455 1.00 0.00 H new ATOM 1663 N ASP A 101 15.274 -10.637 3.646 1.00 0.00 N ATOM 1664 CA ASP A 101 16.177 -10.285 4.736 1.00 0.00 C ATOM 1665 C ASP A 101 15.593 -9.146 5.566 1.00 0.00 C ATOM 1666 O ASP A 101 15.702 -9.139 6.797 1.00 0.00 O ATOM 1667 CB ASP A 101 17.550 -9.900 4.185 1.00 0.00 C ATOM 1668 CG ASP A 101 18.594 -9.766 5.273 1.00 0.00 C ATOM 1669 OD1 ASP A 101 18.985 -10.802 5.856 1.00 0.00 O ATOM 1670 OD2 ASP A 101 19.036 -8.630 5.545 1.00 0.00 O ATOM 0 H ASP A 101 15.656 -10.478 2.714 1.00 0.00 H new ATOM 0 HA ASP A 101 16.296 -11.154 5.383 1.00 0.00 H new ATOM 0 HB2 ASP A 101 17.874 -10.653 3.466 1.00 0.00 H new ATOM 0 HB3 ASP A 101 17.470 -8.957 3.645 1.00 0.00 H new ATOM 1675 N LEU A 102 14.954 -8.200 4.887 1.00 0.00 N ATOM 1676 CA LEU A 102 14.272 -7.098 5.553 1.00 0.00 C ATOM 1677 C LEU A 102 13.145 -7.637 6.439 1.00 0.00 C ATOM 1678 O LEU A 102 12.988 -7.225 7.590 1.00 0.00 O ATOM 1679 CB LEU A 102 13.712 -6.122 4.509 1.00 0.00 C ATOM 1680 CG LEU A 102 13.049 -4.858 5.067 1.00 0.00 C ATOM 1681 CD1 LEU A 102 14.047 -4.031 5.858 1.00 0.00 C ATOM 1682 CD2 LEU A 102 12.453 -4.032 3.939 1.00 0.00 C ATOM 0 H LEU A 102 14.894 -8.175 3.869 1.00 0.00 H new ATOM 0 HA LEU A 102 14.985 -6.566 6.183 1.00 0.00 H new ATOM 0 HB2 LEU A 102 14.524 -5.822 3.847 1.00 0.00 H new ATOM 0 HB3 LEU A 102 12.982 -6.653 3.897 1.00 0.00 H new ATOM 0 HG LEU A 102 12.247 -5.161 5.740 1.00 0.00 H new ATOM 0 HD11 LEU A 102 13.555 -3.139 6.245 1.00 0.00 H new ATOM 0 HD12 LEU A 102 14.432 -4.622 6.689 1.00 0.00 H new ATOM 0 HD13 LEU A 102 14.872 -3.738 5.209 1.00 0.00 H new ATOM 0 HD21 LEU A 102 11.986 -3.138 4.351 1.00 0.00 H new ATOM 0 HD22 LEU A 102 13.241 -3.742 3.244 1.00 0.00 H new ATOM 0 HD23 LEU A 102 11.704 -4.623 3.412 1.00 0.00 H new ATOM 1694 N TYR A 103 12.386 -8.581 5.895 1.00 0.00 N ATOM 1695 CA TYR A 103 11.287 -9.212 6.616 1.00 0.00 C ATOM 1696 C TYR A 103 11.795 -9.985 7.831 1.00 0.00 C ATOM 1697 O TYR A 103 11.221 -9.896 8.913 1.00 0.00 O ATOM 1698 CB TYR A 103 10.519 -10.151 5.677 1.00 0.00 C ATOM 1699 CG TYR A 103 9.435 -10.957 6.356 1.00 0.00 C ATOM 1700 CD1 TYR A 103 8.215 -10.383 6.686 1.00 0.00 C ATOM 1701 CD2 TYR A 103 9.633 -12.299 6.660 1.00 0.00 C ATOM 1702 CE1 TYR A 103 7.225 -11.121 7.300 1.00 0.00 C ATOM 1703 CE2 TYR A 103 8.645 -13.043 7.275 1.00 0.00 C ATOM 1704 CZ TYR A 103 7.444 -12.448 7.593 1.00 0.00 C ATOM 1705 OH TYR A 103 6.455 -13.182 8.204 1.00 0.00 O ATOM 0 H TYR A 103 12.514 -8.930 4.945 1.00 0.00 H new ATOM 0 HA TYR A 103 10.618 -8.429 6.971 1.00 0.00 H new ATOM 0 HB2 TYR A 103 10.070 -9.560 4.878 1.00 0.00 H new ATOM 0 HB3 TYR A 103 11.226 -10.836 5.209 1.00 0.00 H new ATOM 0 HD1 TYR A 103 8.038 -9.342 6.458 1.00 0.00 H new ATOM 0 HD2 TYR A 103 10.574 -12.767 6.411 1.00 0.00 H new ATOM 0 HE1 TYR A 103 6.281 -10.659 7.550 1.00 0.00 H new ATOM 0 HE2 TYR A 103 8.813 -14.085 7.505 1.00 0.00 H new ATOM 0 HH TYR A 103 6.767 -14.101 8.341 1.00 0.00 H new ATOM 1715 N GLU A 104 12.875 -10.737 7.646 1.00 0.00 N ATOM 1716 CA GLU A 104 13.427 -11.570 8.712 1.00 0.00 C ATOM 1717 C GLU A 104 13.927 -10.743 9.894 1.00 0.00 C ATOM 1718 O GLU A 104 13.812 -11.158 11.048 1.00 0.00 O ATOM 1719 CB GLU A 104 14.579 -12.427 8.187 1.00 0.00 C ATOM 1720 CG GLU A 104 14.159 -13.503 7.201 1.00 0.00 C ATOM 1721 CD GLU A 104 15.314 -14.400 6.810 1.00 0.00 C ATOM 1722 OE1 GLU A 104 15.681 -15.288 7.611 1.00 0.00 O ATOM 1723 OE2 GLU A 104 15.863 -14.229 5.704 1.00 0.00 O ATOM 0 H GLU A 104 13.388 -10.788 6.766 1.00 0.00 H new ATOM 0 HA GLU A 104 12.613 -12.208 9.058 1.00 0.00 H new ATOM 0 HB2 GLU A 104 15.311 -11.777 7.707 1.00 0.00 H new ATOM 0 HB3 GLU A 104 15.079 -12.900 9.032 1.00 0.00 H new ATOM 0 HG2 GLU A 104 13.365 -14.106 7.640 1.00 0.00 H new ATOM 0 HG3 GLU A 104 13.746 -13.034 6.308 1.00 0.00 H new ATOM 1730 N ASN A 105 14.484 -9.576 9.614 1.00 0.00 N ATOM 1731 CA ASN A 105 15.138 -8.790 10.654 1.00 0.00 C ATOM 1732 C ASN A 105 14.261 -7.660 11.168 1.00 0.00 C ATOM 1733 O ASN A 105 14.208 -7.413 12.373 1.00 0.00 O ATOM 1734 CB ASN A 105 16.469 -8.234 10.147 1.00 0.00 C ATOM 1735 CG ASN A 105 17.501 -9.324 9.958 1.00 0.00 C ATOM 1736 OD1 ASN A 105 18.219 -9.682 10.893 1.00 0.00 O ATOM 1737 ND2 ASN A 105 17.587 -9.855 8.750 1.00 0.00 N ATOM 0 H ASN A 105 14.498 -9.153 8.686 1.00 0.00 H new ATOM 0 HA ASN A 105 15.322 -9.463 11.491 1.00 0.00 H new ATOM 0 HB2 ASN A 105 16.310 -7.717 9.201 1.00 0.00 H new ATOM 0 HB3 ASN A 105 16.847 -7.495 10.854 1.00 0.00 H new ATOM 0 HD21 ASN A 105 18.268 -10.591 8.564 1.00 0.00 H new ATOM 0 HD22 ASN A 105 16.972 -9.528 8.004 1.00 0.00 H new ATOM 1744 N GLU A 106 13.575 -6.974 10.271 1.00 0.00 N ATOM 1745 CA GLU A 106 12.783 -5.819 10.660 1.00 0.00 C ATOM 1746 C GLU A 106 11.297 -6.160 10.719 1.00 0.00 C ATOM 1747 O GLU A 106 10.569 -5.661 11.578 1.00 0.00 O ATOM 1748 CB GLU A 106 13.027 -4.670 9.687 1.00 0.00 C ATOM 1749 CG GLU A 106 14.480 -4.229 9.614 1.00 0.00 C ATOM 1750 CD GLU A 106 14.971 -3.600 10.902 1.00 0.00 C ATOM 1751 OE1 GLU A 106 15.456 -4.336 11.792 1.00 0.00 O ATOM 1752 OE2 GLU A 106 14.875 -2.363 11.034 1.00 0.00 O ATOM 0 H GLU A 106 13.549 -7.194 9.275 1.00 0.00 H new ATOM 0 HA GLU A 106 13.093 -5.514 11.659 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.698 -4.972 8.693 1.00 0.00 H new ATOM 0 HB3 GLU A 106 12.413 -3.819 9.982 1.00 0.00 H new ATOM 0 HG2 GLU A 106 15.104 -5.090 9.375 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.597 -3.515 8.799 1.00 0.00 H new ATOM 1759 N GLY A 107 10.849 -7.013 9.809 1.00 0.00 N ATOM 1760 CA GLY A 107 9.465 -7.452 9.820 1.00 0.00 C ATOM 1761 C GLY A 107 8.701 -7.007 8.590 1.00 0.00 C ATOM 1762 O GLY A 107 9.219 -6.244 7.773 1.00 0.00 O ATOM 0 H GLY A 107 11.418 -7.410 9.062 1.00 0.00 H new ATOM 0 HA2 GLY A 107 9.434 -8.539 9.889 1.00 0.00 H new ATOM 0 HA3 GLY A 107 8.971 -7.062 10.710 1.00 0.00 H new ATOM 1766 N PHE A 108 7.458 -7.464 8.465 1.00 0.00 N ATOM 1767 CA PHE A 108 6.634 -7.113 7.314 1.00 0.00 C ATOM 1768 C PHE A 108 6.220 -5.649 7.387 1.00 0.00 C ATOM 1769 O PHE A 108 5.936 -5.025 6.367 1.00 0.00 O ATOM 1770 CB PHE A 108 5.400 -8.024 7.204 1.00 0.00 C ATOM 1771 CG PHE A 108 4.551 -8.098 8.447 1.00 0.00 C ATOM 1772 CD1 PHE A 108 3.508 -7.205 8.648 1.00 0.00 C ATOM 1773 CD2 PHE A 108 4.788 -9.070 9.407 1.00 0.00 C ATOM 1774 CE1 PHE A 108 2.721 -7.281 9.781 1.00 0.00 C ATOM 1775 CE2 PHE A 108 4.005 -9.147 10.544 1.00 0.00 C ATOM 1776 CZ PHE A 108 2.970 -8.253 10.732 1.00 0.00 C ATOM 0 H PHE A 108 7.002 -8.075 9.143 1.00 0.00 H new ATOM 0 HA PHE A 108 7.232 -7.263 6.415 1.00 0.00 H new ATOM 0 HB2 PHE A 108 4.780 -7.673 6.379 1.00 0.00 H new ATOM 0 HB3 PHE A 108 5.731 -9.030 6.948 1.00 0.00 H new ATOM 0 HD1 PHE A 108 3.309 -6.442 7.910 1.00 0.00 H new ATOM 0 HD2 PHE A 108 5.594 -9.775 9.265 1.00 0.00 H new ATOM 0 HE1 PHE A 108 1.911 -6.581 9.924 1.00 0.00 H new ATOM 0 HE2 PHE A 108 4.203 -9.907 11.285 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.357 -8.313 11.619 1.00 0.00 H new ATOM 1786 N ASP A 109 6.205 -5.103 8.599 1.00 0.00 N ATOM 1787 CA ASP A 109 5.921 -3.685 8.793 1.00 0.00 C ATOM 1788 C ASP A 109 6.953 -2.847 8.058 1.00 0.00 C ATOM 1789 O ASP A 109 6.621 -1.846 7.433 1.00 0.00 O ATOM 1790 CB ASP A 109 5.936 -3.327 10.282 1.00 0.00 C ATOM 1791 CG ASP A 109 5.512 -1.892 10.544 1.00 0.00 C ATOM 1792 OD1 ASP A 109 6.364 -0.975 10.453 1.00 0.00 O ATOM 1793 OD2 ASP A 109 4.327 -1.670 10.847 1.00 0.00 O ATOM 0 H ASP A 109 6.386 -5.619 9.460 1.00 0.00 H new ATOM 0 HA ASP A 109 4.929 -3.476 8.394 1.00 0.00 H new ATOM 0 HB2 ASP A 109 5.271 -4.002 10.821 1.00 0.00 H new ATOM 0 HB3 ASP A 109 6.939 -3.484 10.679 1.00 0.00 H new ATOM 1798 N ALA A 110 8.205 -3.287 8.122 1.00 0.00 N ATOM 1799 CA ALA A 110 9.307 -2.581 7.482 1.00 0.00 C ATOM 1800 C ALA A 110 9.355 -2.884 5.989 1.00 0.00 C ATOM 1801 O ALA A 110 9.754 -2.036 5.190 1.00 0.00 O ATOM 1802 CB ALA A 110 10.624 -2.948 8.140 1.00 0.00 C ATOM 0 H ALA A 110 8.482 -4.136 8.615 1.00 0.00 H new ATOM 0 HA ALA A 110 9.142 -1.511 7.605 1.00 0.00 H new ATOM 0 HB1 ALA A 110 11.437 -2.412 7.650 1.00 0.00 H new ATOM 0 HB2 ALA A 110 10.592 -2.674 9.195 1.00 0.00 H new ATOM 0 HB3 ALA A 110 10.790 -4.021 8.048 1.00 0.00 H new ATOM 1808 N ASP A 111 8.947 -4.093 5.619 1.00 0.00 N ATOM 1809 CA ASP A 111 8.867 -4.474 4.211 1.00 0.00 C ATOM 1810 C ASP A 111 7.909 -3.545 3.476 1.00 0.00 C ATOM 1811 O ASP A 111 8.259 -2.934 2.463 1.00 0.00 O ATOM 1812 CB ASP A 111 8.398 -5.924 4.071 1.00 0.00 C ATOM 1813 CG ASP A 111 8.247 -6.338 2.620 1.00 0.00 C ATOM 1814 OD1 ASP A 111 9.252 -6.285 1.884 1.00 0.00 O ATOM 1815 OD2 ASP A 111 7.127 -6.715 2.215 1.00 0.00 O ATOM 0 H ASP A 111 8.667 -4.825 6.272 1.00 0.00 H new ATOM 0 HA ASP A 111 9.860 -4.387 3.771 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.112 -6.584 4.563 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.444 -6.047 4.584 1.00 0.00 H new ATOM 1820 N ILE A 112 6.710 -3.418 4.024 1.00 0.00 N ATOM 1821 CA ILE A 112 5.697 -2.523 3.486 1.00 0.00 C ATOM 1822 C ILE A 112 6.109 -1.066 3.693 1.00 0.00 C ATOM 1823 O ILE A 112 5.754 -0.179 2.911 1.00 0.00 O ATOM 1824 CB ILE A 112 4.336 -2.780 4.166 1.00 0.00 C ATOM 1825 CG1 ILE A 112 3.928 -4.242 3.965 1.00 0.00 C ATOM 1826 CG2 ILE A 112 3.268 -1.844 3.616 1.00 0.00 C ATOM 1827 CD1 ILE A 112 2.748 -4.673 4.805 1.00 0.00 C ATOM 0 H ILE A 112 6.412 -3.932 4.853 1.00 0.00 H new ATOM 0 HA ILE A 112 5.602 -2.717 2.418 1.00 0.00 H new ATOM 0 HB ILE A 112 4.434 -2.581 5.233 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.689 -4.400 2.913 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.779 -4.881 4.198 1.00 0.00 H new ATOM 0 HG21 ILE A 112 2.318 -2.045 4.111 1.00 0.00 H new ATOM 0 HG22 ILE A 112 3.561 -0.810 3.799 1.00 0.00 H new ATOM 0 HG23 ILE A 112 3.160 -2.006 2.544 1.00 0.00 H new ATOM 0 HD11 ILE A 112 2.522 -5.720 4.605 1.00 0.00 H new ATOM 0 HD12 ILE A 112 2.988 -4.549 5.861 1.00 0.00 H new ATOM 0 HD13 ILE A 112 1.881 -4.061 4.556 1.00 0.00 H new ATOM 1839 N ASP A 113 6.887 -0.835 4.744 1.00 0.00 N ATOM 1840 CA ASP A 113 7.364 0.503 5.082 1.00 0.00 C ATOM 1841 C ASP A 113 8.250 1.061 3.976 1.00 0.00 C ATOM 1842 O ASP A 113 8.348 2.269 3.806 1.00 0.00 O ATOM 1843 CB ASP A 113 8.137 0.469 6.400 1.00 0.00 C ATOM 1844 CG ASP A 113 8.499 1.845 6.916 1.00 0.00 C ATOM 1845 OD1 ASP A 113 7.620 2.501 7.513 1.00 0.00 O ATOM 1846 OD2 ASP A 113 9.668 2.259 6.749 1.00 0.00 O ATOM 0 H ASP A 113 7.204 -1.564 5.383 1.00 0.00 H new ATOM 0 HA ASP A 113 6.497 1.155 5.191 1.00 0.00 H new ATOM 0 HB2 ASP A 113 7.539 -0.048 7.151 1.00 0.00 H new ATOM 0 HB3 ASP A 113 9.049 -0.112 6.264 1.00 0.00 H new ATOM 1851 N SER A 114 8.873 0.168 3.211 1.00 0.00 N ATOM 1852 CA SER A 114 9.725 0.566 2.092 1.00 0.00 C ATOM 1853 C SER A 114 8.950 1.436 1.096 1.00 0.00 C ATOM 1854 O SER A 114 9.521 2.302 0.431 1.00 0.00 O ATOM 1855 CB SER A 114 10.281 -0.674 1.392 1.00 0.00 C ATOM 1856 OG SER A 114 11.012 -1.482 2.300 1.00 0.00 O ATOM 0 H SER A 114 8.804 -0.841 3.346 1.00 0.00 H new ATOM 0 HA SER A 114 10.554 1.156 2.483 1.00 0.00 H new ATOM 0 HB2 SER A 114 9.463 -1.252 0.962 1.00 0.00 H new ATOM 0 HB3 SER A 114 10.926 -0.372 0.567 1.00 0.00 H new ATOM 0 HG SER A 114 10.421 -2.167 2.677 1.00 0.00 H new ATOM 1862 N TYR A 115 7.645 1.206 1.014 1.00 0.00 N ATOM 1863 CA TYR A 115 6.783 1.984 0.133 1.00 0.00 C ATOM 1864 C TYR A 115 6.463 3.337 0.763 1.00 0.00 C ATOM 1865 O TYR A 115 6.674 4.382 0.150 1.00 0.00 O ATOM 1866 CB TYR A 115 5.493 1.209 -0.161 1.00 0.00 C ATOM 1867 CG TYR A 115 4.478 1.975 -0.987 1.00 0.00 C ATOM 1868 CD1 TYR A 115 4.719 2.273 -2.324 1.00 0.00 C ATOM 1869 CD2 TYR A 115 3.271 2.386 -0.431 1.00 0.00 C ATOM 1870 CE1 TYR A 115 3.788 2.963 -3.079 1.00 0.00 C ATOM 1871 CE2 TYR A 115 2.338 3.077 -1.179 1.00 0.00 C ATOM 1872 CZ TYR A 115 2.601 3.362 -2.502 1.00 0.00 C ATOM 1873 OH TYR A 115 1.672 4.045 -3.252 1.00 0.00 O ATOM 0 H TYR A 115 7.160 0.485 1.548 1.00 0.00 H new ATOM 0 HA TYR A 115 7.306 2.158 -0.807 1.00 0.00 H new ATOM 0 HB2 TYR A 115 5.748 0.287 -0.684 1.00 0.00 H new ATOM 0 HB3 TYR A 115 5.032 0.922 0.784 1.00 0.00 H new ATOM 0 HD1 TYR A 115 5.647 1.961 -2.780 1.00 0.00 H new ATOM 0 HD2 TYR A 115 3.060 2.161 0.604 1.00 0.00 H new ATOM 0 HE1 TYR A 115 3.990 3.188 -4.116 1.00 0.00 H new ATOM 0 HE2 TYR A 115 1.408 3.392 -0.730 1.00 0.00 H new ATOM 0 HH TYR A 115 1.049 4.510 -2.656 1.00 0.00 H new ATOM 1883 N ILE A 116 5.993 3.309 2.006 1.00 0.00 N ATOM 1884 CA ILE A 116 5.590 4.525 2.717 1.00 0.00 C ATOM 1885 C ILE A 116 6.785 5.461 2.923 1.00 0.00 C ATOM 1886 O ILE A 116 6.646 6.686 2.898 1.00 0.00 O ATOM 1887 CB ILE A 116 4.967 4.184 4.090 1.00 0.00 C ATOM 1888 CG1 ILE A 116 3.822 3.177 3.930 1.00 0.00 C ATOM 1889 CG2 ILE A 116 4.470 5.445 4.790 1.00 0.00 C ATOM 1890 CD1 ILE A 116 2.679 3.675 3.069 1.00 0.00 C ATOM 0 H ILE A 116 5.880 2.452 2.548 1.00 0.00 H new ATOM 0 HA ILE A 116 4.844 5.028 2.102 1.00 0.00 H new ATOM 0 HB ILE A 116 5.743 3.732 4.708 1.00 0.00 H new ATOM 0 HG12 ILE A 116 4.217 2.259 3.495 1.00 0.00 H new ATOM 0 HG13 ILE A 116 3.436 2.922 4.917 1.00 0.00 H new ATOM 0 HG21 ILE A 116 4.036 5.179 5.754 1.00 0.00 H new ATOM 0 HG22 ILE A 116 5.305 6.129 4.944 1.00 0.00 H new ATOM 0 HG23 ILE A 116 3.714 5.930 4.173 1.00 0.00 H new ATOM 0 HD11 ILE A 116 1.910 2.905 3.005 1.00 0.00 H new ATOM 0 HD12 ILE A 116 2.255 4.576 3.513 1.00 0.00 H new ATOM 0 HD13 ILE A 116 3.049 3.902 2.069 1.00 0.00 H new ATOM 1902 N ASP A 117 7.960 4.868 3.103 1.00 0.00 N ATOM 1903 CA ASP A 117 9.192 5.624 3.313 1.00 0.00 C ATOM 1904 C ASP A 117 9.686 6.230 1.998 1.00 0.00 C ATOM 1905 O ASP A 117 10.643 7.001 1.974 1.00 0.00 O ATOM 1906 CB ASP A 117 10.262 4.707 3.916 1.00 0.00 C ATOM 1907 CG ASP A 117 11.574 5.412 4.198 1.00 0.00 C ATOM 1908 OD1 ASP A 117 11.595 6.329 5.047 1.00 0.00 O ATOM 1909 OD2 ASP A 117 12.594 5.053 3.570 1.00 0.00 O ATOM 0 H ASP A 117 8.087 3.856 3.108 1.00 0.00 H new ATOM 0 HA ASP A 117 8.990 6.441 4.006 1.00 0.00 H new ATOM 0 HB2 ASP A 117 9.882 4.279 4.844 1.00 0.00 H new ATOM 0 HB3 ASP A 117 10.444 3.877 3.234 1.00 0.00 H new ATOM 1914 N SER A 118 9.020 5.884 0.908 1.00 0.00 N ATOM 1915 CA SER A 118 9.350 6.440 -0.392 1.00 0.00 C ATOM 1916 C SER A 118 8.191 7.304 -0.901 1.00 0.00 C ATOM 1917 O SER A 118 7.384 6.860 -1.721 1.00 0.00 O ATOM 1918 CB SER A 118 9.664 5.317 -1.384 1.00 0.00 C ATOM 1919 OG SER A 118 10.680 4.457 -0.877 1.00 0.00 O ATOM 0 H SER A 118 8.246 5.219 0.899 1.00 0.00 H new ATOM 0 HA SER A 118 10.235 7.069 -0.296 1.00 0.00 H new ATOM 0 HB2 SER A 118 8.761 4.740 -1.584 1.00 0.00 H new ATOM 0 HB3 SER A 118 9.985 5.745 -2.334 1.00 0.00 H new ATOM 0 HG SER A 118 10.269 3.742 -0.347 1.00 0.00 H new ATOM 1925 N PRO A 119 8.090 8.553 -0.411 1.00 0.00 N ATOM 1926 CA PRO A 119 6.953 9.430 -0.708 1.00 0.00 C ATOM 1927 C PRO A 119 6.899 9.841 -2.172 1.00 0.00 C ATOM 1928 O PRO A 119 5.822 10.058 -2.720 1.00 0.00 O ATOM 1929 CB PRO A 119 7.193 10.650 0.184 1.00 0.00 C ATOM 1930 CG PRO A 119 8.661 10.655 0.433 1.00 0.00 C ATOM 1931 CD PRO A 119 9.081 9.215 0.458 1.00 0.00 C ATOM 0 HA PRO A 119 6.002 8.932 -0.521 1.00 0.00 H new ATOM 0 HB2 PRO A 119 6.872 11.569 -0.307 1.00 0.00 H new ATOM 0 HB3 PRO A 119 6.634 10.575 1.117 1.00 0.00 H new ATOM 0 HG2 PRO A 119 9.188 11.201 -0.349 1.00 0.00 H new ATOM 0 HG3 PRO A 119 8.895 11.146 1.378 1.00 0.00 H new ATOM 0 HD2 PRO A 119 10.095 9.086 0.081 1.00 0.00 H new ATOM 0 HD3 PRO A 119 9.063 8.809 1.469 1.00 0.00 H new ATOM 1939 N GLU A 120 8.064 9.920 -2.799 1.00 0.00 N ATOM 1940 CA GLU A 120 8.167 10.316 -4.196 1.00 0.00 C ATOM 1941 C GLU A 120 7.414 9.326 -5.083 1.00 0.00 C ATOM 1942 O GLU A 120 6.477 9.693 -5.795 1.00 0.00 O ATOM 1943 CB GLU A 120 9.642 10.389 -4.595 1.00 0.00 C ATOM 1944 CG GLU A 120 9.892 10.890 -6.004 1.00 0.00 C ATOM 1945 CD GLU A 120 11.371 10.940 -6.331 1.00 0.00 C ATOM 1946 OE1 GLU A 120 12.078 11.808 -5.770 1.00 0.00 O ATOM 1947 OE2 GLU A 120 11.836 10.103 -7.133 1.00 0.00 O ATOM 0 H GLU A 120 8.959 9.713 -2.357 1.00 0.00 H new ATOM 0 HA GLU A 120 7.716 11.299 -4.329 1.00 0.00 H new ATOM 0 HB2 GLU A 120 10.162 11.042 -3.894 1.00 0.00 H new ATOM 0 HB3 GLU A 120 10.082 9.397 -4.493 1.00 0.00 H new ATOM 0 HG2 GLU A 120 9.384 10.239 -6.716 1.00 0.00 H new ATOM 0 HG3 GLU A 120 9.461 11.885 -6.118 1.00 0.00 H new ATOM 1954 N TYR A 121 7.801 8.063 -5.007 1.00 0.00 N ATOM 1955 CA TYR A 121 7.154 7.031 -5.802 1.00 0.00 C ATOM 1956 C TYR A 121 5.726 6.791 -5.326 1.00 0.00 C ATOM 1957 O TYR A 121 4.874 6.373 -6.103 1.00 0.00 O ATOM 1958 CB TYR A 121 7.964 5.736 -5.772 1.00 0.00 C ATOM 1959 CG TYR A 121 9.228 5.813 -6.599 1.00 0.00 C ATOM 1960 CD1 TYR A 121 9.195 5.566 -7.964 1.00 0.00 C ATOM 1961 CD2 TYR A 121 10.448 6.148 -6.022 1.00 0.00 C ATOM 1962 CE1 TYR A 121 10.338 5.651 -8.732 1.00 0.00 C ATOM 1963 CE2 TYR A 121 11.598 6.232 -6.785 1.00 0.00 C ATOM 1964 CZ TYR A 121 11.536 5.984 -8.140 1.00 0.00 C ATOM 1965 OH TYR A 121 12.673 6.082 -8.911 1.00 0.00 O ATOM 0 H TYR A 121 8.555 7.729 -4.407 1.00 0.00 H new ATOM 0 HA TYR A 121 7.109 7.378 -6.834 1.00 0.00 H new ATOM 0 HB2 TYR A 121 8.225 5.500 -4.740 1.00 0.00 H new ATOM 0 HB3 TYR A 121 7.345 4.918 -6.139 1.00 0.00 H new ATOM 0 HD1 TYR A 121 8.259 5.303 -8.433 1.00 0.00 H new ATOM 0 HD2 TYR A 121 10.498 6.346 -4.961 1.00 0.00 H new ATOM 0 HE1 TYR A 121 10.293 5.457 -9.794 1.00 0.00 H new ATOM 0 HE2 TYR A 121 12.539 6.490 -6.322 1.00 0.00 H new ATOM 0 HH TYR A 121 13.433 6.326 -8.343 1.00 0.00 H new ATOM 1975 N THR A 122 5.464 7.082 -4.059 1.00 0.00 N ATOM 1976 CA THR A 122 4.122 6.953 -3.520 1.00 0.00 C ATOM 1977 C THR A 122 3.186 8.003 -4.112 1.00 0.00 C ATOM 1978 O THR A 122 2.155 7.665 -4.672 1.00 0.00 O ATOM 1979 CB THR A 122 4.110 7.060 -1.984 1.00 0.00 C ATOM 1980 OG1 THR A 122 4.868 5.991 -1.413 1.00 0.00 O ATOM 1981 CG2 THR A 122 2.690 7.011 -1.450 1.00 0.00 C ATOM 0 H THR A 122 6.161 7.407 -3.390 1.00 0.00 H new ATOM 0 HA THR A 122 3.767 5.961 -3.799 1.00 0.00 H new ATOM 0 HB THR A 122 4.557 8.015 -1.707 1.00 0.00 H new ATOM 0 HG1 THR A 122 5.810 6.087 -1.665 1.00 0.00 H new ATOM 0 HG21 THR A 122 2.707 7.088 -0.363 1.00 0.00 H new ATOM 0 HG22 THR A 122 2.117 7.841 -1.864 1.00 0.00 H new ATOM 0 HG23 THR A 122 2.225 6.069 -1.739 1.00 0.00 H new ATOM 1989 N ASN A 123 3.558 9.275 -4.023 1.00 0.00 N ATOM 1990 CA ASN A 123 2.680 10.345 -4.488 1.00 0.00 C ATOM 1991 C ASN A 123 2.492 10.282 -6.001 1.00 0.00 C ATOM 1992 O ASN A 123 1.510 10.801 -6.537 1.00 0.00 O ATOM 1993 CB ASN A 123 3.184 11.734 -4.042 1.00 0.00 C ATOM 1994 CG ASN A 123 4.501 12.181 -4.671 1.00 0.00 C ATOM 1995 OD1 ASN A 123 4.803 11.895 -5.827 1.00 0.00 O ATOM 1996 ND2 ASN A 123 5.297 12.898 -3.894 1.00 0.00 N ATOM 0 H ASN A 123 4.449 9.589 -3.639 1.00 0.00 H new ATOM 0 HA ASN A 123 1.706 10.193 -4.023 1.00 0.00 H new ATOM 0 HB2 ASN A 123 2.418 12.473 -4.277 1.00 0.00 H new ATOM 0 HB3 ASN A 123 3.301 11.730 -2.958 1.00 0.00 H new ATOM 0 HD21 ASN A 123 6.193 13.231 -4.251 1.00 0.00 H new ATOM 0 HD22 ASN A 123 5.015 13.117 -2.939 1.00 0.00 H new ATOM 2003 N SER A 124 3.426 9.624 -6.680 1.00 0.00 N ATOM 2004 CA SER A 124 3.362 9.488 -8.127 1.00 0.00 C ATOM 2005 C SER A 124 2.432 8.350 -8.561 1.00 0.00 C ATOM 2006 O SER A 124 1.896 8.374 -9.669 1.00 0.00 O ATOM 2007 CB SER A 124 4.765 9.254 -8.689 1.00 0.00 C ATOM 2008 OG SER A 124 5.660 10.278 -8.273 1.00 0.00 O ATOM 0 H SER A 124 4.236 9.177 -6.249 1.00 0.00 H new ATOM 0 HA SER A 124 2.952 10.416 -8.525 1.00 0.00 H new ATOM 0 HB2 SER A 124 5.136 8.285 -8.356 1.00 0.00 H new ATOM 0 HB3 SER A 124 4.724 9.223 -9.778 1.00 0.00 H new ATOM 0 HG SER A 124 5.824 10.198 -7.310 1.00 0.00 H new ATOM 2014 N PHE A 125 2.221 7.362 -7.694 1.00 0.00 N ATOM 2015 CA PHE A 125 1.467 6.175 -8.096 1.00 0.00 C ATOM 2016 C PHE A 125 0.224 5.950 -7.233 1.00 0.00 C ATOM 2017 O PHE A 125 -0.838 5.602 -7.750 1.00 0.00 O ATOM 2018 CB PHE A 125 2.378 4.943 -8.036 1.00 0.00 C ATOM 2019 CG PHE A 125 1.742 3.685 -8.558 1.00 0.00 C ATOM 2020 CD1 PHE A 125 1.632 3.465 -9.921 1.00 0.00 C ATOM 2021 CD2 PHE A 125 1.260 2.724 -7.686 1.00 0.00 C ATOM 2022 CE1 PHE A 125 1.052 2.309 -10.404 1.00 0.00 C ATOM 2023 CE2 PHE A 125 0.680 1.566 -8.163 1.00 0.00 C ATOM 2024 CZ PHE A 125 0.577 1.357 -9.525 1.00 0.00 C ATOM 0 H PHE A 125 2.553 7.357 -6.729 1.00 0.00 H new ATOM 0 HA PHE A 125 1.121 6.337 -9.117 1.00 0.00 H new ATOM 0 HB2 PHE A 125 3.283 5.145 -8.609 1.00 0.00 H new ATOM 0 HB3 PHE A 125 2.685 4.781 -7.003 1.00 0.00 H new ATOM 0 HD1 PHE A 125 2.004 4.206 -10.613 1.00 0.00 H new ATOM 0 HD2 PHE A 125 1.339 2.882 -6.621 1.00 0.00 H new ATOM 0 HE1 PHE A 125 0.970 2.150 -11.469 1.00 0.00 H new ATOM 0 HE2 PHE A 125 0.307 0.824 -7.472 1.00 0.00 H new ATOM 0 HZ PHE A 125 0.126 0.451 -9.901 1.00 0.00 H new ATOM 2034 N GLY A 126 0.341 6.176 -5.934 1.00 0.00 N ATOM 2035 CA GLY A 126 -0.757 5.888 -5.037 1.00 0.00 C ATOM 2036 C GLY A 126 -0.724 6.718 -3.767 1.00 0.00 C ATOM 2037 O GLY A 126 -0.474 6.196 -2.681 1.00 0.00 O ATOM 0 H GLY A 126 1.176 6.553 -5.485 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -1.699 6.067 -5.556 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -0.735 4.831 -4.773 1.00 0.00 H new ATOM 2041 N ASP A 127 -0.954 8.016 -3.908 1.00 0.00 N ATOM 2042 CA ASP A 127 -1.078 8.905 -2.755 1.00 0.00 C ATOM 2043 C ASP A 127 -2.546 9.233 -2.530 1.00 0.00 C ATOM 2044 O ASP A 127 -3.036 9.241 -1.400 1.00 0.00 O ATOM 2045 CB ASP A 127 -0.274 10.188 -2.975 1.00 0.00 C ATOM 2046 CG ASP A 127 -0.347 11.145 -1.801 1.00 0.00 C ATOM 2047 OD1 ASP A 127 0.111 10.782 -0.699 1.00 0.00 O ATOM 2048 OD2 ASP A 127 -0.831 12.279 -1.991 1.00 0.00 O ATOM 0 H ASP A 127 -1.059 8.480 -4.810 1.00 0.00 H new ATOM 0 HA ASP A 127 -0.679 8.404 -1.873 1.00 0.00 H new ATOM 0 HB2 ASP A 127 0.768 9.929 -3.161 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -0.642 10.691 -3.869 1.00 0.00 H new ATOM 2053 N TRP A 128 -3.238 9.500 -3.630 1.00 0.00 N ATOM 2054 CA TRP A 128 -4.684 9.665 -3.613 1.00 0.00 C ATOM 2055 C TRP A 128 -5.330 8.594 -4.478 1.00 0.00 C ATOM 2056 O TRP A 128 -6.544 8.574 -4.669 1.00 0.00 O ATOM 2057 CB TRP A 128 -5.085 11.051 -4.121 1.00 0.00 C ATOM 2058 CG TRP A 128 -4.677 12.162 -3.208 1.00 0.00 C ATOM 2059 CD1 TRP A 128 -3.613 13.001 -3.361 1.00 0.00 C ATOM 2060 CD2 TRP A 128 -5.326 12.552 -1.992 1.00 0.00 C ATOM 2061 NE1 TRP A 128 -3.561 13.891 -2.317 1.00 0.00 N ATOM 2062 CE2 TRP A 128 -4.600 13.635 -1.463 1.00 0.00 C ATOM 2063 CE3 TRP A 128 -6.450 12.091 -1.301 1.00 0.00 C ATOM 2064 CZ2 TRP A 128 -4.962 14.264 -0.274 1.00 0.00 C ATOM 2065 CZ3 TRP A 128 -6.808 12.713 -0.121 1.00 0.00 C ATOM 2066 CH2 TRP A 128 -6.066 13.790 0.382 1.00 0.00 C ATOM 0 H TRP A 128 -2.816 9.607 -4.552 1.00 0.00 H new ATOM 0 HA TRP A 128 -5.030 9.565 -2.584 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -4.637 11.214 -5.101 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -6.166 11.081 -4.256 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -2.913 12.970 -4.183 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -2.862 14.624 -2.197 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -7.028 11.263 -1.683 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.393 15.095 0.116 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -7.673 12.364 0.423 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -6.372 14.256 1.307 1.00 0.00 H new ATOM 2077 N VAL A 129 -4.501 7.703 -4.992 1.00 0.00 N ATOM 2078 CA VAL A 129 -4.955 6.648 -5.877 1.00 0.00 C ATOM 2079 C VAL A 129 -4.623 5.294 -5.269 1.00 0.00 C ATOM 2080 O VAL A 129 -3.597 5.145 -4.609 1.00 0.00 O ATOM 2081 CB VAL A 129 -4.294 6.762 -7.273 1.00 0.00 C ATOM 2082 CG1 VAL A 129 -4.854 5.725 -8.239 1.00 0.00 C ATOM 2083 CG2 VAL A 129 -4.467 8.164 -7.837 1.00 0.00 C ATOM 0 H VAL A 129 -3.498 7.691 -4.808 1.00 0.00 H new ATOM 0 HA VAL A 129 -6.033 6.748 -5.999 1.00 0.00 H new ATOM 0 HB VAL A 129 -3.229 6.565 -7.152 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -4.369 5.832 -9.209 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -4.666 4.725 -7.848 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -5.928 5.875 -8.352 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -3.995 8.222 -8.818 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -5.529 8.390 -7.931 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -4.001 8.886 -7.167 1.00 0.00 H new ATOM 2093 N VAL A 130 -5.500 4.328 -5.459 1.00 0.00 N ATOM 2094 CA VAL A 130 -5.249 2.974 -5.004 1.00 0.00 C ATOM 2095 C VAL A 130 -4.376 2.251 -6.018 1.00 0.00 C ATOM 2096 O VAL A 130 -4.698 2.235 -7.210 1.00 0.00 O ATOM 2097 CB VAL A 130 -6.560 2.184 -4.803 1.00 0.00 C ATOM 2098 CG1 VAL A 130 -6.274 0.771 -4.315 1.00 0.00 C ATOM 2099 CG2 VAL A 130 -7.475 2.911 -3.831 1.00 0.00 C ATOM 0 H VAL A 130 -6.397 4.456 -5.928 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.741 3.035 -4.041 1.00 0.00 H new ATOM 0 HB VAL A 130 -7.065 2.112 -5.766 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.214 0.235 -4.181 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -5.660 0.250 -5.050 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -5.743 0.815 -3.364 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -8.395 2.340 -3.701 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -6.974 3.016 -2.869 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -7.714 3.899 -4.225 1.00 0.00 H new ATOM 2109 N PRO A 131 -3.256 1.668 -5.558 1.00 0.00 N ATOM 2110 CA PRO A 131 -2.328 0.926 -6.414 1.00 0.00 C ATOM 2111 C PRO A 131 -3.033 -0.055 -7.349 1.00 0.00 C ATOM 2112 O PRO A 131 -3.511 -1.114 -6.931 1.00 0.00 O ATOM 2113 CB PRO A 131 -1.450 0.181 -5.414 1.00 0.00 C ATOM 2114 CG PRO A 131 -1.436 1.057 -4.211 1.00 0.00 C ATOM 2115 CD PRO A 131 -2.792 1.710 -4.157 1.00 0.00 C ATOM 0 HA PRO A 131 -1.776 1.589 -7.081 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -1.857 -0.804 -5.184 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -0.444 0.027 -5.805 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -1.246 0.477 -3.308 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -0.646 1.804 -4.282 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -3.470 1.172 -3.494 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -2.729 2.733 -3.786 1.00 0.00 H new ATOM 2123 N TYR A 132 -3.131 0.336 -8.607 1.00 0.00 N ATOM 2124 CA TYR A 132 -3.722 -0.505 -9.629 1.00 0.00 C ATOM 2125 C TYR A 132 -2.617 -1.217 -10.390 1.00 0.00 C ATOM 2126 O TYR A 132 -1.460 -0.806 -10.333 1.00 0.00 O ATOM 2127 CB TYR A 132 -4.588 0.327 -10.583 1.00 0.00 C ATOM 2128 CG TYR A 132 -3.824 1.388 -11.350 1.00 0.00 C ATOM 2129 CD1 TYR A 132 -3.526 2.618 -10.774 1.00 0.00 C ATOM 2130 CD2 TYR A 132 -3.400 1.154 -12.651 1.00 0.00 C ATOM 2131 CE1 TYR A 132 -2.825 3.581 -11.475 1.00 0.00 C ATOM 2132 CE2 TYR A 132 -2.700 2.110 -13.357 1.00 0.00 C ATOM 2133 CZ TYR A 132 -2.415 3.321 -12.766 1.00 0.00 C ATOM 2134 OH TYR A 132 -1.713 4.273 -13.467 1.00 0.00 O ATOM 0 H TYR A 132 -2.805 1.241 -8.946 1.00 0.00 H new ATOM 0 HA TYR A 132 -4.368 -1.245 -9.156 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -5.071 -0.343 -11.295 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -5.380 0.809 -10.010 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -3.847 2.824 -9.764 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -3.622 0.206 -13.119 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -2.600 4.532 -11.015 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -2.377 1.910 -14.368 1.00 0.00 H new ATOM 0 HH TYR A 132 -1.190 4.819 -12.843 1.00 0.00 H new ATOM 2144 N TYR A 133 -2.962 -2.272 -11.103 1.00 0.00 N ATOM 2145 CA TYR A 133 -1.958 -3.060 -11.789 1.00 0.00 C ATOM 2146 C TYR A 133 -1.532 -2.380 -13.084 1.00 0.00 C ATOM 2147 O TYR A 133 -2.340 -2.185 -13.996 1.00 0.00 O ATOM 2148 CB TYR A 133 -2.475 -4.472 -12.069 1.00 0.00 C ATOM 2149 CG TYR A 133 -1.368 -5.488 -12.228 1.00 0.00 C ATOM 2150 CD1 TYR A 133 -0.646 -5.917 -11.124 1.00 0.00 C ATOM 2151 CD2 TYR A 133 -1.045 -6.017 -13.471 1.00 0.00 C ATOM 2152 CE1 TYR A 133 0.367 -6.844 -11.250 1.00 0.00 C ATOM 2153 CE2 TYR A 133 -0.031 -6.947 -13.607 1.00 0.00 C ATOM 2154 CZ TYR A 133 0.674 -7.356 -12.491 1.00 0.00 C ATOM 2155 OH TYR A 133 1.682 -8.286 -12.614 1.00 0.00 O ATOM 0 H TYR A 133 -3.920 -2.600 -11.221 1.00 0.00 H new ATOM 0 HA TYR A 133 -1.086 -3.138 -11.139 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -3.129 -4.781 -11.254 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -3.080 -4.458 -12.976 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -0.881 -5.518 -10.148 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -1.594 -5.697 -14.344 1.00 0.00 H new ATOM 0 HE1 TYR A 133 0.917 -7.167 -10.379 1.00 0.00 H new ATOM 0 HE2 TYR A 133 0.209 -7.351 -14.579 1.00 0.00 H new ATOM 0 HH TYR A 133 1.773 -8.548 -13.554 1.00 0.00 H new ATOM 2165 N ARG A 134 -0.265 -2.005 -13.144 1.00 0.00 N ATOM 2166 CA ARG A 134 0.305 -1.402 -14.333 1.00 0.00 C ATOM 2167 C ARG A 134 1.626 -2.086 -14.659 1.00 0.00 C ATOM 2168 O ARG A 134 2.620 -1.915 -13.955 1.00 0.00 O ATOM 2169 CB ARG A 134 0.507 0.105 -14.140 1.00 0.00 C ATOM 2170 CG ARG A 134 0.845 0.833 -15.431 1.00 0.00 C ATOM 2171 CD ARG A 134 0.933 2.340 -15.235 1.00 0.00 C ATOM 2172 NE ARG A 134 1.080 3.042 -16.516 1.00 0.00 N ATOM 2173 CZ ARG A 134 0.886 4.352 -16.684 1.00 0.00 C ATOM 2174 NH1 ARG A 134 0.626 5.134 -15.642 1.00 0.00 N ATOM 2175 NH2 ARG A 134 0.979 4.887 -17.898 1.00 0.00 N ATOM 0 H ARG A 134 0.394 -2.110 -12.372 1.00 0.00 H new ATOM 0 HA ARG A 134 -0.385 -1.537 -15.166 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -0.400 0.535 -13.714 1.00 0.00 H new ATOM 0 HB3 ARG A 134 1.307 0.268 -13.418 1.00 0.00 H new ATOM 0 HG2 ARG A 134 1.795 0.462 -15.817 1.00 0.00 H new ATOM 0 HG3 ARG A 134 0.087 0.610 -16.181 1.00 0.00 H new ATOM 0 HD2 ARG A 134 0.037 2.695 -14.725 1.00 0.00 H new ATOM 0 HD3 ARG A 134 1.780 2.575 -14.591 1.00 0.00 H new ATOM 0 HE ARG A 134 1.348 2.492 -17.332 1.00 0.00 H new ATOM 0 HH11 ARG A 134 0.573 4.734 -14.705 1.00 0.00 H new ATOM 0 HH12 ARG A 134 0.479 6.134 -15.779 1.00 0.00 H new ATOM 0 HH21 ARG A 134 1.198 4.296 -18.700 1.00 0.00 H new ATOM 0 HH22 ARG A 134 0.831 5.888 -18.027 1.00 0.00 H new