USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 759 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 62 ASN : amide:sc= 0 X(o=-0.63,f=-0.63) USER MOD Set 1.2: A 81 SER OG : rot 110:sc= -0.631 USER MOD Single : A 4 GLN : amide:sc= -0.0697 K(o=-0.07,f=-1) USER MOD Single : A 5 HIS : no HD1:sc= -3.67 K(o=-3.7,f=-2.7) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 178:sc= 0 USER MOD Single : A -1 HIS : no HD1:sc= -0.0421 X(o=-0.042,f=0) USER MOD Single : A -3 SER OG : rot 180:sc= 0 USER MOD Single : A -7 GLY N :NH3+ -104:sc= 0.0282 (180deg=0) USER MOD Single : A 10 HIS : no HD1:sc= -1.35 X(o=-1.3,f=-1.6) USER MOD Single : A 22 SER OG : rot -150:sc= -0.943 USER MOD Single : A 27 ASN : amide:sc= -0.818 K(o=-0.82,f=-1.6!) USER MOD Single : A 29 HIS : no HD1:sc= -0.0452 X(o=-0.045,f=-0.17) USER MOD Single : A 31 GLN : amide:sc= -1.89 K(o=-1.9,f=-4.1!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0511 USER MOD Single : A 36 SER OG : rot 180:sc= 0.0354 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -2.66 K(o=-2.7,f=-6.9!) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 ASN : amide:sc= -0.74 K(o=-0.74,f=0.89) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl 148:sc= -2.91! (180deg=-6.85!) USER MOD Single : A 68 ASN : amide:sc= -0.353 X(o=-0.35,f=-0.061) USER MOD Single : A 71 HIS : no HD1:sc= -2.71 K(o=-2.7,f=-0.69) USER MOD Single : A 76 GLN : amide:sc= -1.42 X(o=-1.4,f=-1.4) USER MOD Single : A 77 GLN : amide:sc= -2.77! C(o=-2.8!,f=-4.1!) USER MOD Single : A 80 LYS NZ :NH3+ 170:sc= -0.0169 (180deg=-0.16) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= -1.34 K(o=-1.3,f=-0.65) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 71:sc= 0.701 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -7 4.717 25.144 -5.550 1.00 0.00 N ATOM 2 CA GLY A -7 5.753 25.148 -4.482 1.00 0.00 C ATOM 3 C GLY A -7 7.148 25.399 -5.026 1.00 0.00 C ATOM 4 O GLY A -7 7.441 25.049 -6.169 1.00 0.00 O ATOM 0 H1 GLY A -7 4.185 26.037 -5.521 1.00 0.00 H new ATOM 0 H2 GLY A -7 5.176 25.045 -6.478 1.00 0.00 H new ATOM 0 H3 GLY A -7 4.066 24.348 -5.399 1.00 0.00 H new ATOM 0 HA2 GLY A -7 5.510 25.915 -3.747 1.00 0.00 H new ATOM 0 HA3 GLY A -7 5.737 24.191 -3.961 1.00 0.00 H new ATOM 10 N PRO A -6 8.037 26.010 -4.224 1.00 0.00 N ATOM 11 CA PRO A -6 9.411 26.302 -4.646 1.00 0.00 C ATOM 12 C PRO A -6 10.124 25.068 -5.192 1.00 0.00 C ATOM 13 O PRO A -6 9.852 23.944 -4.768 1.00 0.00 O ATOM 14 CB PRO A -6 10.085 26.784 -3.360 1.00 0.00 C ATOM 15 CG PRO A -6 8.971 27.311 -2.522 1.00 0.00 C ATOM 16 CD PRO A -6 7.773 26.462 -2.845 1.00 0.00 C ATOM 0 HA PRO A -6 9.442 27.030 -5.456 1.00 0.00 H new ATOM 0 HB2 PRO A -6 10.607 25.970 -2.858 1.00 0.00 H new ATOM 0 HB3 PRO A -6 10.825 27.557 -3.567 1.00 0.00 H new ATOM 0 HG2 PRO A -6 9.218 27.251 -1.462 1.00 0.00 H new ATOM 0 HG3 PRO A -6 8.777 28.360 -2.745 1.00 0.00 H new ATOM 0 HD2 PRO A -6 7.679 25.621 -2.158 1.00 0.00 H new ATOM 0 HD3 PRO A -6 6.847 27.033 -2.779 1.00 0.00 H new ATOM 24 N LEU A -5 11.038 25.287 -6.131 1.00 0.00 N ATOM 25 CA LEU A -5 11.794 24.194 -6.734 1.00 0.00 C ATOM 26 C LEU A -5 10.868 23.242 -7.486 1.00 0.00 C ATOM 27 O LEU A -5 9.935 22.683 -6.910 1.00 0.00 O ATOM 28 CB LEU A -5 12.571 23.429 -5.661 1.00 0.00 C ATOM 29 CG LEU A -5 13.955 22.939 -6.091 1.00 0.00 C ATOM 30 CD1 LEU A -5 14.917 22.956 -4.913 1.00 0.00 C ATOM 31 CD2 LEU A -5 13.863 21.541 -6.685 1.00 0.00 C ATOM 0 H LEU A -5 11.274 26.212 -6.492 1.00 0.00 H new ATOM 0 HA LEU A -5 12.500 24.623 -7.445 1.00 0.00 H new ATOM 0 HB2 LEU A -5 12.685 24.072 -4.788 1.00 0.00 H new ATOM 0 HB3 LEU A -5 11.979 22.569 -5.348 1.00 0.00 H new ATOM 0 HG LEU A -5 14.338 23.614 -6.856 1.00 0.00 H new ATOM 0 HD11 LEU A -5 15.896 22.604 -5.238 1.00 0.00 H new ATOM 0 HD12 LEU A -5 15.005 23.973 -4.530 1.00 0.00 H new ATOM 0 HD13 LEU A -5 14.540 22.303 -4.126 1.00 0.00 H new ATOM 0 HD21 LEU A -5 14.856 21.207 -6.986 1.00 0.00 H new ATOM 0 HD22 LEU A -5 13.460 20.855 -5.940 1.00 0.00 H new ATOM 0 HD23 LEU A -5 13.207 21.558 -7.555 1.00 0.00 H new ATOM 43 N GLY A -4 11.135 23.062 -8.776 1.00 0.00 N ATOM 44 CA GLY A -4 10.318 22.177 -9.586 1.00 0.00 C ATOM 45 C GLY A -4 10.414 20.730 -9.142 1.00 0.00 C ATOM 46 O GLY A -4 11.492 20.254 -8.786 1.00 0.00 O ATOM 0 H GLY A -4 11.902 23.513 -9.274 1.00 0.00 H new ATOM 0 HA2 GLY A -4 9.278 22.501 -9.536 1.00 0.00 H new ATOM 0 HA3 GLY A -4 10.627 22.255 -10.628 1.00 0.00 H new ATOM 50 N SER A -3 9.286 20.030 -9.164 1.00 0.00 N ATOM 51 CA SER A -3 9.248 18.629 -8.762 1.00 0.00 C ATOM 52 C SER A -3 8.325 17.824 -9.671 1.00 0.00 C ATOM 53 O SER A -3 7.268 18.304 -10.081 1.00 0.00 O ATOM 54 CB SER A -3 8.786 18.506 -7.308 1.00 0.00 C ATOM 55 OG SER A -3 9.693 19.148 -6.428 1.00 0.00 O ATOM 0 H SER A -3 8.385 20.410 -9.456 1.00 0.00 H new ATOM 0 HA SER A -3 10.256 18.225 -8.852 1.00 0.00 H new ATOM 0 HB2 SER A -3 7.795 18.947 -7.199 1.00 0.00 H new ATOM 0 HB3 SER A -3 8.697 17.453 -7.039 1.00 0.00 H new ATOM 0 HG SER A -3 9.374 19.056 -5.506 1.00 0.00 H new ATOM 61 N ASP A -2 8.731 16.597 -9.981 1.00 0.00 N ATOM 62 CA ASP A -2 7.941 15.726 -10.842 1.00 0.00 C ATOM 63 C ASP A -2 7.050 14.806 -10.013 1.00 0.00 C ATOM 64 O ASP A -2 7.539 13.995 -9.226 1.00 0.00 O ATOM 65 CB ASP A -2 8.857 14.893 -11.740 1.00 0.00 C ATOM 66 CG ASP A -2 9.140 15.571 -13.066 1.00 0.00 C ATOM 67 OD1 ASP A -2 9.777 16.646 -13.058 1.00 0.00 O ATOM 68 OD2 ASP A -2 8.722 15.031 -14.111 1.00 0.00 O ATOM 0 H ASP A -2 9.602 16.184 -9.649 1.00 0.00 H new ATOM 0 HA ASP A -2 7.305 16.354 -11.466 1.00 0.00 H new ATOM 0 HB2 ASP A -2 9.798 14.707 -11.222 1.00 0.00 H new ATOM 0 HB3 ASP A -2 8.397 13.922 -11.923 1.00 0.00 H new ATOM 73 N HIS A -1 5.741 14.939 -10.194 1.00 0.00 N ATOM 74 CA HIS A -1 4.780 14.121 -9.464 1.00 0.00 C ATOM 75 C HIS A -1 4.091 13.129 -10.397 1.00 0.00 C ATOM 76 O HIS A -1 2.869 12.982 -10.372 1.00 0.00 O ATOM 77 CB HIS A -1 3.738 15.010 -8.781 1.00 0.00 C ATOM 78 CG HIS A -1 4.231 15.648 -7.521 1.00 0.00 C ATOM 79 ND1 HIS A -1 3.389 16.106 -6.529 1.00 0.00 N ATOM 80 CD2 HIS A -1 5.489 15.904 -7.089 1.00 0.00 C ATOM 81 CE1 HIS A -1 4.107 16.617 -5.544 1.00 0.00 C ATOM 82 NE2 HIS A -1 5.384 16.506 -5.860 1.00 0.00 N ATOM 0 H HIS A -1 5.321 15.606 -10.841 1.00 0.00 H new ATOM 0 HA HIS A -1 5.321 13.559 -8.703 1.00 0.00 H new ATOM 0 HB2 HIS A -1 3.426 15.790 -9.476 1.00 0.00 H new ATOM 0 HB3 HIS A -1 2.855 14.413 -8.555 1.00 0.00 H new ATOM 0 HD2 HIS A -1 6.405 15.677 -7.614 1.00 0.00 H new ATOM 0 HE1 HIS A -1 3.716 17.051 -4.636 1.00 0.00 H new ATOM 0 HE2 HIS A -1 6.166 16.817 -5.284 1.00 0.00 H new ATOM 91 N ILE A 1 4.886 12.448 -11.216 1.00 0.00 N ATOM 92 CA ILE A 1 4.355 11.467 -12.155 1.00 0.00 C ATOM 93 C ILE A 1 4.533 10.053 -11.617 1.00 0.00 C ATOM 94 O ILE A 1 5.645 9.635 -11.294 1.00 0.00 O ATOM 95 CB ILE A 1 5.035 11.574 -13.534 1.00 0.00 C ATOM 96 CG1 ILE A 1 6.557 11.564 -13.384 1.00 0.00 C ATOM 97 CG2 ILE A 1 4.577 12.835 -14.253 1.00 0.00 C ATOM 98 CD1 ILE A 1 7.294 11.559 -14.706 1.00 0.00 C ATOM 0 H ILE A 1 5.900 12.557 -11.248 1.00 0.00 H new ATOM 0 HA ILE A 1 3.293 11.681 -12.273 1.00 0.00 H new ATOM 0 HB ILE A 1 4.744 10.710 -14.132 1.00 0.00 H new ATOM 0 HG12 ILE A 1 6.863 12.438 -12.810 1.00 0.00 H new ATOM 0 HG13 ILE A 1 6.852 10.686 -12.809 1.00 0.00 H new ATOM 0 HG21 ILE A 1 5.066 12.897 -15.225 1.00 0.00 H new ATOM 0 HG22 ILE A 1 3.496 12.803 -14.391 1.00 0.00 H new ATOM 0 HG23 ILE A 1 4.841 13.709 -13.658 1.00 0.00 H new ATOM 0 HD11 ILE A 1 8.369 11.552 -14.523 1.00 0.00 H new ATOM 0 HD12 ILE A 1 7.017 10.671 -15.274 1.00 0.00 H new ATOM 0 HD13 ILE A 1 7.028 12.451 -15.274 1.00 0.00 H new ATOM 110 N TRP A 2 3.430 9.321 -11.517 1.00 0.00 N ATOM 111 CA TRP A 2 3.465 7.955 -11.007 1.00 0.00 C ATOM 112 C TRP A 2 3.192 6.943 -12.114 1.00 0.00 C ATOM 113 O TRP A 2 2.377 7.181 -13.006 1.00 0.00 O ATOM 114 CB TRP A 2 2.444 7.784 -9.881 1.00 0.00 C ATOM 115 CG TRP A 2 1.062 8.217 -10.263 1.00 0.00 C ATOM 116 CD1 TRP A 2 0.155 7.511 -10.999 1.00 0.00 C ATOM 117 CD2 TRP A 2 0.430 9.459 -9.930 1.00 0.00 C ATOM 118 NE1 TRP A 2 -1.003 8.236 -11.143 1.00 0.00 N ATOM 119 CE2 TRP A 2 -0.858 9.436 -10.496 1.00 0.00 C ATOM 120 CE3 TRP A 2 0.827 10.587 -9.207 1.00 0.00 C ATOM 121 CZ2 TRP A 2 -1.751 10.496 -10.362 1.00 0.00 C ATOM 122 CZ3 TRP A 2 -0.058 11.640 -9.075 1.00 0.00 C ATOM 123 CH2 TRP A 2 -1.334 11.587 -9.649 1.00 0.00 C ATOM 0 H TRP A 2 2.501 9.649 -11.782 1.00 0.00 H new ATOM 0 HA TRP A 2 4.466 7.770 -10.617 1.00 0.00 H new ATOM 0 HB2 TRP A 2 2.419 6.737 -9.579 1.00 0.00 H new ATOM 0 HB3 TRP A 2 2.770 8.358 -9.014 1.00 0.00 H new ATOM 0 HD1 TRP A 2 0.323 6.526 -11.409 1.00 0.00 H new ATOM 0 HE1 TRP A 2 -1.835 7.931 -11.649 1.00 0.00 H new ATOM 0 HE3 TRP A 2 1.809 10.635 -8.759 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 -2.736 10.458 -10.804 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 0.239 12.518 -8.520 1.00 0.00 H new ATOM 0 HH2 TRP A 2 -2.004 12.425 -9.526 1.00 0.00 H new ATOM 134 N GLU A 3 3.878 5.809 -12.040 1.00 0.00 N ATOM 135 CA GLU A 3 3.718 4.744 -13.023 1.00 0.00 C ATOM 136 C GLU A 3 3.096 3.512 -12.374 1.00 0.00 C ATOM 137 O GLU A 3 3.217 3.313 -11.166 1.00 0.00 O ATOM 138 CB GLU A 3 5.071 4.383 -13.642 1.00 0.00 C ATOM 139 CG GLU A 3 4.966 3.414 -14.809 1.00 0.00 C ATOM 140 CD GLU A 3 6.226 3.379 -15.653 1.00 0.00 C ATOM 141 OE1 GLU A 3 6.607 4.437 -16.197 1.00 0.00 O ATOM 142 OE2 GLU A 3 6.832 2.293 -15.768 1.00 0.00 O ATOM 0 H GLU A 3 4.554 5.602 -11.305 1.00 0.00 H new ATOM 0 HA GLU A 3 3.054 5.099 -13.811 1.00 0.00 H new ATOM 0 HB2 GLU A 3 5.561 5.296 -13.981 1.00 0.00 H new ATOM 0 HB3 GLU A 3 5.708 3.946 -12.873 1.00 0.00 H new ATOM 0 HG2 GLU A 3 4.760 2.414 -14.428 1.00 0.00 H new ATOM 0 HG3 GLU A 3 4.121 3.697 -15.436 1.00 0.00 H new ATOM 149 N GLN A 4 2.427 2.692 -13.176 1.00 0.00 N ATOM 150 CA GLN A 4 1.785 1.487 -12.662 1.00 0.00 C ATOM 151 C GLN A 4 2.552 0.239 -13.083 1.00 0.00 C ATOM 152 O GLN A 4 2.833 0.036 -14.264 1.00 0.00 O ATOM 153 CB GLN A 4 0.340 1.403 -13.159 1.00 0.00 C ATOM 154 CG GLN A 4 -0.523 0.439 -12.360 1.00 0.00 C ATOM 155 CD GLN A 4 -1.877 0.204 -12.998 1.00 0.00 C ATOM 156 OE1 GLN A 4 -2.024 0.278 -14.218 1.00 0.00 O ATOM 157 NE2 GLN A 4 -2.878 -0.080 -12.174 1.00 0.00 N ATOM 0 H GLN A 4 2.315 2.838 -14.179 1.00 0.00 H new ATOM 0 HA GLN A 4 1.786 1.542 -11.573 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -0.107 2.396 -13.120 1.00 0.00 H new ATOM 0 HB3 GLN A 4 0.341 1.095 -14.205 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -0.002 -0.513 -12.261 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -0.663 0.832 -11.353 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -2.712 -0.131 -11.169 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -3.813 -0.247 -12.546 1.00 0.00 H new ATOM 166 N HIS A 5 2.892 -0.591 -12.102 1.00 0.00 N ATOM 167 CA HIS A 5 3.634 -1.821 -12.356 1.00 0.00 C ATOM 168 C HIS A 5 2.950 -3.018 -11.704 1.00 0.00 C ATOM 169 O HIS A 5 2.463 -2.929 -10.577 1.00 0.00 O ATOM 170 CB HIS A 5 5.067 -1.694 -11.836 1.00 0.00 C ATOM 171 CG HIS A 5 5.897 -0.709 -12.600 1.00 0.00 C ATOM 172 ND1 HIS A 5 5.799 0.655 -12.424 1.00 0.00 N ATOM 173 CD2 HIS A 5 6.848 -0.897 -13.546 1.00 0.00 C ATOM 174 CE1 HIS A 5 6.651 1.263 -13.230 1.00 0.00 C ATOM 175 NE2 HIS A 5 7.300 0.344 -13.921 1.00 0.00 N ATOM 0 H HIS A 5 2.664 -0.433 -11.120 1.00 0.00 H new ATOM 0 HA HIS A 5 3.657 -1.983 -13.434 1.00 0.00 H new ATOM 0 HB2 HIS A 5 5.039 -1.397 -10.788 1.00 0.00 H new ATOM 0 HB3 HIS A 5 5.548 -2.671 -11.878 1.00 0.00 H new ATOM 0 HD2 HIS A 5 7.188 -1.846 -13.933 1.00 0.00 H new ATOM 0 HE1 HIS A 5 6.793 2.331 -13.310 1.00 0.00 H new ATOM 0 HE2 HIS A 5 8.020 0.526 -14.620 1.00 0.00 H new ATOM 184 N THR A 6 2.919 -4.138 -12.419 1.00 0.00 N ATOM 185 CA THR A 6 2.298 -5.353 -11.910 1.00 0.00 C ATOM 186 C THR A 6 3.365 -6.345 -11.457 1.00 0.00 C ATOM 187 O THR A 6 4.236 -6.734 -12.234 1.00 0.00 O ATOM 188 CB THR A 6 1.412 -5.992 -12.982 1.00 0.00 C ATOM 189 OG1 THR A 6 1.090 -5.052 -13.991 1.00 0.00 O ATOM 190 CG2 THR A 6 0.112 -6.541 -12.435 1.00 0.00 C ATOM 0 H THR A 6 3.318 -4.228 -13.354 1.00 0.00 H new ATOM 0 HA THR A 6 1.677 -5.088 -11.055 1.00 0.00 H new ATOM 0 HB THR A 6 1.996 -6.820 -13.384 1.00 0.00 H new ATOM 0 HG1 THR A 6 0.525 -5.479 -14.668 1.00 0.00 H new ATOM 0 HG21 THR A 6 -0.468 -6.980 -13.247 1.00 0.00 H new ATOM 0 HG22 THR A 6 0.326 -7.305 -11.688 1.00 0.00 H new ATOM 0 HG23 THR A 6 -0.459 -5.734 -11.976 1.00 0.00 H new ATOM 198 N VAL A 7 3.296 -6.738 -10.190 1.00 0.00 N ATOM 199 CA VAL A 7 4.264 -7.673 -9.624 1.00 0.00 C ATOM 200 C VAL A 7 3.601 -8.980 -9.205 1.00 0.00 C ATOM 201 O VAL A 7 2.413 -9.013 -8.885 1.00 0.00 O ATOM 202 CB VAL A 7 4.985 -7.063 -8.406 1.00 0.00 C ATOM 203 CG1 VAL A 7 6.102 -6.134 -8.857 1.00 0.00 C ATOM 204 CG2 VAL A 7 3.999 -6.329 -7.509 1.00 0.00 C ATOM 0 H VAL A 7 2.580 -6.424 -9.535 1.00 0.00 H new ATOM 0 HA VAL A 7 4.993 -7.880 -10.408 1.00 0.00 H new ATOM 0 HB VAL A 7 5.429 -7.874 -7.828 1.00 0.00 H new ATOM 0 HG11 VAL A 7 6.600 -5.713 -7.984 1.00 0.00 H new ATOM 0 HG12 VAL A 7 6.824 -6.695 -9.451 1.00 0.00 H new ATOM 0 HG13 VAL A 7 5.684 -5.328 -9.460 1.00 0.00 H new ATOM 0 HG21 VAL A 7 4.529 -5.906 -6.655 1.00 0.00 H new ATOM 0 HG22 VAL A 7 3.521 -5.528 -8.073 1.00 0.00 H new ATOM 0 HG23 VAL A 7 3.240 -7.027 -7.155 1.00 0.00 H new ATOM 214 N THR A 8 4.382 -10.057 -9.208 1.00 0.00 N ATOM 215 CA THR A 8 3.879 -11.371 -8.827 1.00 0.00 C ATOM 216 C THR A 8 4.689 -11.948 -7.671 1.00 0.00 C ATOM 217 O THR A 8 5.866 -12.273 -7.828 1.00 0.00 O ATOM 218 CB THR A 8 3.921 -12.324 -10.022 1.00 0.00 C ATOM 219 OG1 THR A 8 3.521 -13.627 -9.638 1.00 0.00 O ATOM 220 CG2 THR A 8 5.292 -12.432 -10.653 1.00 0.00 C ATOM 0 H THR A 8 5.367 -10.044 -9.471 1.00 0.00 H new ATOM 0 HA THR A 8 2.845 -11.256 -8.501 1.00 0.00 H new ATOM 0 HB THR A 8 3.234 -11.900 -10.754 1.00 0.00 H new ATOM 0 HG1 THR A 8 3.518 -14.213 -10.423 1.00 0.00 H new ATOM 0 HG21 THR A 8 5.252 -13.124 -11.495 1.00 0.00 H new ATOM 0 HG22 THR A 8 5.609 -11.450 -11.005 1.00 0.00 H new ATOM 0 HG23 THR A 8 6.004 -12.800 -9.915 1.00 0.00 H new ATOM 228 N LEU A 9 4.052 -12.072 -6.511 1.00 0.00 N ATOM 229 CA LEU A 9 4.717 -12.610 -5.329 1.00 0.00 C ATOM 230 C LEU A 9 4.239 -14.028 -5.036 1.00 0.00 C ATOM 231 O LEU A 9 3.064 -14.250 -4.747 1.00 0.00 O ATOM 232 CB LEU A 9 4.463 -11.711 -4.117 1.00 0.00 C ATOM 233 CG LEU A 9 4.569 -10.209 -4.388 1.00 0.00 C ATOM 234 CD1 LEU A 9 3.602 -9.437 -3.505 1.00 0.00 C ATOM 235 CD2 LEU A 9 5.996 -9.728 -4.166 1.00 0.00 C ATOM 0 H LEU A 9 3.078 -11.808 -6.364 1.00 0.00 H new ATOM 0 HA LEU A 9 5.788 -12.640 -5.528 1.00 0.00 H new ATOM 0 HB2 LEU A 9 3.467 -11.925 -3.728 1.00 0.00 H new ATOM 0 HB3 LEU A 9 5.174 -11.974 -3.334 1.00 0.00 H new ATOM 0 HG LEU A 9 4.302 -10.027 -5.429 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.692 -8.371 -3.712 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.582 -9.762 -3.711 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.837 -9.624 -2.457 1.00 0.00 H new ATOM 0 HD21 LEU A 9 6.054 -8.658 -4.363 1.00 0.00 H new ATOM 0 HD22 LEU A 9 6.290 -9.924 -3.135 1.00 0.00 H new ATOM 0 HD23 LEU A 9 6.668 -10.258 -4.841 1.00 0.00 H new ATOM 247 N HIS A 10 5.159 -14.983 -5.113 1.00 0.00 N ATOM 248 CA HIS A 10 4.832 -16.382 -4.857 1.00 0.00 C ATOM 249 C HIS A 10 4.687 -16.639 -3.360 1.00 0.00 C ATOM 250 O HIS A 10 5.676 -16.711 -2.633 1.00 0.00 O ATOM 251 CB HIS A 10 5.910 -17.295 -5.442 1.00 0.00 C ATOM 252 CG HIS A 10 7.288 -16.998 -4.939 1.00 0.00 C ATOM 253 ND1 HIS A 10 7.875 -17.685 -3.898 1.00 0.00 N ATOM 254 CD2 HIS A 10 8.201 -16.082 -5.344 1.00 0.00 C ATOM 255 CE1 HIS A 10 9.087 -17.205 -3.681 1.00 0.00 C ATOM 256 NE2 HIS A 10 9.309 -16.232 -4.546 1.00 0.00 N ATOM 0 H HIS A 10 6.137 -14.815 -5.350 1.00 0.00 H new ATOM 0 HA HIS A 10 3.880 -16.602 -5.340 1.00 0.00 H new ATOM 0 HB2 HIS A 10 5.663 -18.330 -5.208 1.00 0.00 H new ATOM 0 HB3 HIS A 10 5.902 -17.203 -6.528 1.00 0.00 H new ATOM 0 HD2 HIS A 10 8.080 -15.367 -6.145 1.00 0.00 H new ATOM 0 HE1 HIS A 10 9.778 -17.549 -2.926 1.00 0.00 H new ATOM 0 HE2 HIS A 10 10.165 -15.681 -4.611 1.00 0.00 H new ATOM 265 N ARG A 11 3.443 -16.774 -2.907 1.00 0.00 N ATOM 266 CA ARG A 11 3.158 -17.019 -1.497 1.00 0.00 C ATOM 267 C ARG A 11 4.035 -18.137 -0.933 1.00 0.00 C ATOM 268 O ARG A 11 3.943 -19.287 -1.359 1.00 0.00 O ATOM 269 CB ARG A 11 1.683 -17.380 -1.311 1.00 0.00 C ATOM 270 CG ARG A 11 0.733 -16.223 -1.570 1.00 0.00 C ATOM 271 CD ARG A 11 -0.598 -16.433 -0.868 1.00 0.00 C ATOM 272 NE ARG A 11 -0.525 -16.098 0.552 1.00 0.00 N ATOM 273 CZ ARG A 11 -1.257 -16.687 1.496 1.00 0.00 C ATOM 274 NH1 ARG A 11 -2.133 -17.633 1.179 1.00 0.00 N ATOM 275 NH2 ARG A 11 -1.116 -16.324 2.764 1.00 0.00 N ATOM 0 H ARG A 11 2.614 -16.717 -3.499 1.00 0.00 H new ATOM 0 HA ARG A 11 3.382 -16.102 -0.951 1.00 0.00 H new ATOM 0 HB2 ARG A 11 1.432 -18.202 -1.982 1.00 0.00 H new ATOM 0 HB3 ARG A 11 1.532 -17.742 -0.294 1.00 0.00 H new ATOM 0 HG2 ARG A 11 1.186 -15.294 -1.225 1.00 0.00 H new ATOM 0 HG3 ARG A 11 0.568 -16.118 -2.642 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -1.361 -15.820 -1.347 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -0.907 -17.472 -0.980 1.00 0.00 H new ATOM 0 HE ARG A 11 0.127 -15.368 0.838 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -2.250 -17.914 0.206 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -2.689 -18.078 1.909 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -0.448 -15.595 3.015 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -1.676 -16.774 3.488 1.00 0.00 H new ATOM 289 N ALA A 12 4.877 -17.786 0.035 1.00 0.00 N ATOM 290 CA ALA A 12 5.764 -18.756 0.666 1.00 0.00 C ATOM 291 C ALA A 12 5.342 -19.021 2.111 1.00 0.00 C ATOM 292 O ALA A 12 4.693 -18.185 2.738 1.00 0.00 O ATOM 293 CB ALA A 12 7.204 -18.267 0.617 1.00 0.00 C ATOM 0 H ALA A 12 4.963 -16.837 0.399 1.00 0.00 H new ATOM 0 HA ALA A 12 5.693 -19.692 0.113 1.00 0.00 H new ATOM 0 HB1 ALA A 12 7.854 -19.002 1.092 1.00 0.00 H new ATOM 0 HB2 ALA A 12 7.507 -18.132 -0.421 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.284 -17.317 1.145 1.00 0.00 H new ATOM 299 N PRO A 13 5.703 -20.195 2.657 1.00 0.00 N ATOM 300 CA PRO A 13 5.357 -20.568 4.033 1.00 0.00 C ATOM 301 C PRO A 13 5.724 -19.483 5.041 1.00 0.00 C ATOM 302 O PRO A 13 6.693 -18.749 4.853 1.00 0.00 O ATOM 303 CB PRO A 13 6.188 -21.829 4.278 1.00 0.00 C ATOM 304 CG PRO A 13 6.389 -22.416 2.925 1.00 0.00 C ATOM 305 CD PRO A 13 6.476 -21.252 1.976 1.00 0.00 C ATOM 0 HA PRO A 13 4.284 -20.717 4.156 1.00 0.00 H new ATOM 0 HB2 PRO A 13 7.140 -21.590 4.752 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.669 -22.524 4.938 1.00 0.00 H new ATOM 0 HG2 PRO A 13 7.299 -23.016 2.891 1.00 0.00 H new ATOM 0 HG3 PRO A 13 5.563 -23.075 2.659 1.00 0.00 H new ATOM 0 HD2 PRO A 13 7.509 -20.948 1.807 1.00 0.00 H new ATOM 0 HD3 PRO A 13 6.052 -21.495 1.002 1.00 0.00 H new ATOM 313 N GLY A 14 4.942 -19.390 6.114 1.00 0.00 N ATOM 314 CA GLY A 14 5.199 -18.394 7.139 1.00 0.00 C ATOM 315 C GLY A 14 4.397 -17.124 6.930 1.00 0.00 C ATOM 316 O GLY A 14 3.816 -16.585 7.872 1.00 0.00 O ATOM 0 H GLY A 14 4.135 -19.987 6.291 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.961 -18.814 8.116 1.00 0.00 H new ATOM 0 HA3 GLY A 14 6.262 -18.151 7.147 1.00 0.00 H new ATOM 320 N PHE A 15 4.363 -16.649 5.689 1.00 0.00 N ATOM 321 CA PHE A 15 3.628 -15.438 5.347 1.00 0.00 C ATOM 322 C PHE A 15 3.521 -15.294 3.835 1.00 0.00 C ATOM 323 O PHE A 15 4.202 -14.468 3.227 1.00 0.00 O ATOM 324 CB PHE A 15 4.312 -14.204 5.940 1.00 0.00 C ATOM 325 CG PHE A 15 3.891 -13.903 7.351 1.00 0.00 C ATOM 326 CD1 PHE A 15 2.584 -13.539 7.633 1.00 0.00 C ATOM 327 CD2 PHE A 15 4.802 -13.980 8.393 1.00 0.00 C ATOM 328 CE1 PHE A 15 2.194 -13.259 8.929 1.00 0.00 C ATOM 329 CE2 PHE A 15 4.417 -13.702 9.691 1.00 0.00 C ATOM 330 CZ PHE A 15 3.110 -13.342 9.959 1.00 0.00 C ATOM 0 H PHE A 15 4.839 -17.087 4.900 1.00 0.00 H new ATOM 0 HA PHE A 15 2.626 -15.517 5.769 1.00 0.00 H new ATOM 0 HB2 PHE A 15 5.392 -14.350 5.915 1.00 0.00 H new ATOM 0 HB3 PHE A 15 4.093 -13.340 5.312 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.863 -13.473 6.832 1.00 0.00 H new ATOM 0 HD2 PHE A 15 5.825 -14.261 8.188 1.00 0.00 H new ATOM 0 HE1 PHE A 15 1.173 -12.975 9.136 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.136 -13.766 10.494 1.00 0.00 H new ATOM 0 HZ PHE A 15 2.805 -13.126 10.972 1.00 0.00 H new ATOM 340 N GLY A 16 2.666 -16.119 3.235 1.00 0.00 N ATOM 341 CA GLY A 16 2.476 -16.096 1.793 1.00 0.00 C ATOM 342 C GLY A 16 2.467 -14.696 1.206 1.00 0.00 C ATOM 343 O GLY A 16 3.230 -14.397 0.289 1.00 0.00 O ATOM 0 H GLY A 16 2.097 -16.808 3.726 1.00 0.00 H new ATOM 0 HA2 GLY A 16 3.270 -16.674 1.321 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.535 -16.589 1.551 1.00 0.00 H new ATOM 347 N PHE A 17 1.603 -13.835 1.729 1.00 0.00 N ATOM 348 CA PHE A 17 1.510 -12.468 1.232 1.00 0.00 C ATOM 349 C PHE A 17 2.747 -11.661 1.613 1.00 0.00 C ATOM 350 O PHE A 17 3.227 -10.839 0.834 1.00 0.00 O ATOM 351 CB PHE A 17 0.253 -11.788 1.779 1.00 0.00 C ATOM 352 CG PHE A 17 -0.232 -10.651 0.925 1.00 0.00 C ATOM 353 CD1 PHE A 17 -0.518 -10.848 -0.416 1.00 0.00 C ATOM 354 CD2 PHE A 17 -0.399 -9.385 1.464 1.00 0.00 C ATOM 355 CE1 PHE A 17 -0.963 -9.804 -1.204 1.00 0.00 C ATOM 356 CE2 PHE A 17 -0.844 -8.337 0.681 1.00 0.00 C ATOM 357 CZ PHE A 17 -1.126 -8.547 -0.656 1.00 0.00 C ATOM 0 H PHE A 17 0.962 -14.056 2.491 1.00 0.00 H new ATOM 0 HA PHE A 17 1.449 -12.509 0.144 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -0.541 -12.529 1.869 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.458 -11.416 2.783 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -0.392 -11.829 -0.850 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -0.179 -9.216 2.508 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -1.183 -9.971 -2.248 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -0.971 -7.355 1.113 1.00 0.00 H new ATOM 0 HZ PHE A 17 -1.473 -7.730 -1.271 1.00 0.00 H new ATOM 367 N GLY A 18 3.264 -11.904 2.813 1.00 0.00 N ATOM 368 CA GLY A 18 4.445 -11.192 3.271 1.00 0.00 C ATOM 369 C GLY A 18 4.202 -9.708 3.496 1.00 0.00 C ATOM 370 O GLY A 18 5.139 -8.962 3.781 1.00 0.00 O ATOM 0 H GLY A 18 2.887 -12.581 3.477 1.00 0.00 H new ATOM 0 HA2 GLY A 18 4.794 -11.641 4.201 1.00 0.00 H new ATOM 0 HA3 GLY A 18 5.242 -11.316 2.538 1.00 0.00 H new ATOM 374 N ILE A 19 2.948 -9.271 3.368 1.00 0.00 N ATOM 375 CA ILE A 19 2.607 -7.864 3.560 1.00 0.00 C ATOM 376 C ILE A 19 1.331 -7.719 4.387 1.00 0.00 C ATOM 377 O ILE A 19 0.580 -8.679 4.560 1.00 0.00 O ATOM 378 CB ILE A 19 2.400 -7.124 2.218 1.00 0.00 C ATOM 379 CG1 ILE A 19 3.356 -7.646 1.137 1.00 0.00 C ATOM 380 CG2 ILE A 19 2.581 -5.625 2.408 1.00 0.00 C ATOM 381 CD1 ILE A 19 2.646 -8.334 -0.009 1.00 0.00 C ATOM 0 H ILE A 19 2.156 -9.870 3.133 1.00 0.00 H new ATOM 0 HA ILE A 19 3.451 -7.417 4.085 1.00 0.00 H new ATOM 0 HB ILE A 19 1.381 -7.318 1.883 1.00 0.00 H new ATOM 0 HG12 ILE A 19 3.940 -6.813 0.746 1.00 0.00 H new ATOM 0 HG13 ILE A 19 4.060 -8.344 1.591 1.00 0.00 H new ATOM 0 HG21 ILE A 19 2.432 -5.117 1.455 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.853 -5.259 3.132 1.00 0.00 H new ATOM 0 HG23 ILE A 19 3.588 -5.424 2.773 1.00 0.00 H new ATOM 0 HD11 ILE A 19 3.380 -8.679 -0.737 1.00 0.00 H new ATOM 0 HD12 ILE A 19 2.084 -9.187 0.371 1.00 0.00 H new ATOM 0 HD13 ILE A 19 1.962 -7.633 -0.487 1.00 0.00 H new ATOM 393 N ALA A 20 1.089 -6.511 4.886 1.00 0.00 N ATOM 394 CA ALA A 20 -0.100 -6.235 5.684 1.00 0.00 C ATOM 395 C ALA A 20 -1.031 -5.273 4.951 1.00 0.00 C ATOM 396 O ALA A 20 -0.660 -4.136 4.659 1.00 0.00 O ATOM 397 CB ALA A 20 0.291 -5.668 7.040 1.00 0.00 C ATOM 0 H ALA A 20 1.702 -5.707 4.751 1.00 0.00 H new ATOM 0 HA ALA A 20 -0.633 -7.173 5.841 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -0.608 -5.467 7.623 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.914 -6.389 7.570 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.847 -4.741 6.900 1.00 0.00 H new ATOM 403 N ILE A 21 -2.239 -5.741 4.650 1.00 0.00 N ATOM 404 CA ILE A 21 -3.222 -4.926 3.943 1.00 0.00 C ATOM 405 C ILE A 21 -3.902 -3.932 4.880 1.00 0.00 C ATOM 406 O ILE A 21 -4.280 -4.278 5.999 1.00 0.00 O ATOM 407 CB ILE A 21 -4.302 -5.801 3.277 1.00 0.00 C ATOM 408 CG1 ILE A 21 -3.657 -6.971 2.531 1.00 0.00 C ATOM 409 CG2 ILE A 21 -5.150 -4.964 2.333 1.00 0.00 C ATOM 410 CD1 ILE A 21 -3.765 -8.289 3.267 1.00 0.00 C ATOM 0 H ILE A 21 -2.561 -6.680 4.885 1.00 0.00 H new ATOM 0 HA ILE A 21 -2.677 -4.378 3.174 1.00 0.00 H new ATOM 0 HB ILE A 21 -4.950 -6.207 4.054 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -4.127 -7.071 1.552 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -2.605 -6.746 2.358 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -5.909 -5.595 1.870 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -5.635 -4.164 2.892 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -4.515 -4.532 1.559 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -3.287 -9.074 2.680 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.270 -8.207 4.235 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -4.816 -8.537 3.417 1.00 0.00 H new ATOM 422 N SER A 22 -4.058 -2.696 4.413 1.00 0.00 N ATOM 423 CA SER A 22 -4.698 -1.655 5.208 1.00 0.00 C ATOM 424 C SER A 22 -5.672 -0.845 4.359 1.00 0.00 C ATOM 425 O SER A 22 -5.349 -0.436 3.244 1.00 0.00 O ATOM 426 CB SER A 22 -3.644 -0.730 5.820 1.00 0.00 C ATOM 427 OG SER A 22 -3.847 -0.577 7.213 1.00 0.00 O ATOM 0 H SER A 22 -3.750 -2.392 3.489 1.00 0.00 H new ATOM 0 HA SER A 22 -5.257 -2.137 6.010 1.00 0.00 H new ATOM 0 HB2 SER A 22 -2.649 -1.136 5.637 1.00 0.00 H new ATOM 0 HB3 SER A 22 -3.685 0.245 5.334 1.00 0.00 H new ATOM 0 HG SER A 22 -3.530 0.307 7.495 1.00 0.00 H new ATOM 433 N GLY A 23 -6.867 -0.613 4.895 1.00 0.00 N ATOM 434 CA GLY A 23 -7.867 0.149 4.172 1.00 0.00 C ATOM 435 C GLY A 23 -9.275 -0.354 4.426 1.00 0.00 C ATOM 436 O GLY A 23 -9.891 -0.011 5.434 1.00 0.00 O ATOM 0 H GLY A 23 -7.159 -0.939 5.816 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.801 1.197 4.463 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.654 0.101 3.104 1.00 0.00 H new ATOM 440 N GLY A 24 -9.782 -1.169 3.509 1.00 0.00 N ATOM 441 CA GLY A 24 -11.122 -1.708 3.656 1.00 0.00 C ATOM 442 C GLY A 24 -12.197 -0.668 3.412 1.00 0.00 C ATOM 443 O GLY A 24 -12.364 0.260 4.205 1.00 0.00 O ATOM 0 H GLY A 24 -9.290 -1.467 2.666 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.256 -2.535 2.958 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -11.238 -2.116 4.660 1.00 0.00 H new ATOM 447 N ARG A 25 -12.926 -0.821 2.312 1.00 0.00 N ATOM 448 CA ARG A 25 -13.990 0.113 1.963 1.00 0.00 C ATOM 449 C ARG A 25 -15.131 0.045 2.975 1.00 0.00 C ATOM 450 O ARG A 25 -15.813 1.038 3.225 1.00 0.00 O ATOM 451 CB ARG A 25 -14.519 -0.188 0.557 1.00 0.00 C ATOM 452 CG ARG A 25 -15.303 -1.488 0.462 1.00 0.00 C ATOM 453 CD ARG A 25 -16.790 -1.234 0.265 1.00 0.00 C ATOM 454 NE ARG A 25 -17.430 -2.299 -0.502 1.00 0.00 N ATOM 455 CZ ARG A 25 -18.601 -2.166 -1.120 1.00 0.00 C ATOM 456 NH1 ARG A 25 -19.264 -1.017 -1.062 1.00 0.00 N ATOM 457 NH2 ARG A 25 -19.113 -3.185 -1.798 1.00 0.00 N ATOM 0 H ARG A 25 -12.799 -1.583 1.646 1.00 0.00 H new ATOM 0 HA ARG A 25 -13.575 1.121 1.981 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -15.157 0.635 0.235 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -13.679 -0.230 -0.136 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -14.922 -2.083 -0.368 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -15.150 -2.072 1.369 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -17.275 -1.146 1.237 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -16.930 -0.283 -0.248 1.00 0.00 H new ATOM 0 HE ARG A 25 -16.952 -3.197 -0.568 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -18.876 -0.230 -0.542 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -20.161 -0.921 -1.538 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -18.609 -4.071 -1.846 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -20.011 -3.083 -2.272 1.00 0.00 H new ATOM 471 N ASP A 26 -15.332 -1.136 3.554 1.00 0.00 N ATOM 472 CA ASP A 26 -16.391 -1.334 4.538 1.00 0.00 C ATOM 473 C ASP A 26 -15.808 -1.547 5.930 1.00 0.00 C ATOM 474 O ASP A 26 -16.366 -2.285 6.742 1.00 0.00 O ATOM 475 CB ASP A 26 -17.259 -2.531 4.147 1.00 0.00 C ATOM 476 CG ASP A 26 -18.680 -2.407 4.660 1.00 0.00 C ATOM 477 OD1 ASP A 26 -19.122 -1.267 4.915 1.00 0.00 O ATOM 478 OD2 ASP A 26 -19.350 -3.451 4.810 1.00 0.00 O ATOM 0 H ASP A 26 -14.776 -1.969 3.359 1.00 0.00 H new ATOM 0 HA ASP A 26 -17.008 -0.436 4.557 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -17.275 -2.626 3.061 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -16.812 -3.444 4.540 1.00 0.00 H new ATOM 483 N ASN A 27 -14.681 -0.895 6.201 1.00 0.00 N ATOM 484 CA ASN A 27 -14.023 -1.014 7.497 1.00 0.00 C ATOM 485 C ASN A 27 -14.734 -0.161 8.546 1.00 0.00 C ATOM 486 O ASN A 27 -15.427 0.800 8.211 1.00 0.00 O ATOM 487 CB ASN A 27 -12.554 -0.596 7.386 1.00 0.00 C ATOM 488 CG ASN A 27 -11.605 -1.764 7.569 1.00 0.00 C ATOM 489 OD1 ASN A 27 -11.665 -2.749 6.833 1.00 0.00 O ATOM 490 ND2 ASN A 27 -10.722 -1.660 8.555 1.00 0.00 N ATOM 0 H ASN A 27 -14.205 -0.280 5.541 1.00 0.00 H new ATOM 0 HA ASN A 27 -14.072 -2.057 7.811 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -12.381 -0.141 6.411 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -12.338 0.165 8.136 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -10.058 -2.415 8.727 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -10.708 -0.825 9.141 1.00 0.00 H new ATOM 497 N PRO A 28 -14.569 -0.503 9.836 1.00 0.00 N ATOM 498 CA PRO A 28 -15.199 0.237 10.934 1.00 0.00 C ATOM 499 C PRO A 28 -14.917 1.734 10.862 1.00 0.00 C ATOM 500 O PRO A 28 -15.698 2.547 11.354 1.00 0.00 O ATOM 501 CB PRO A 28 -14.557 -0.367 12.186 1.00 0.00 C ATOM 502 CG PRO A 28 -14.140 -1.737 11.775 1.00 0.00 C ATOM 503 CD PRO A 28 -13.759 -1.635 10.324 1.00 0.00 C ATOM 0 HA PRO A 28 -16.285 0.150 10.911 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -13.703 0.224 12.517 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -15.263 -0.400 13.016 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -13.300 -2.086 12.376 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -14.951 -2.451 11.916 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -12.692 -1.448 10.201 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -13.986 -2.554 9.783 1.00 0.00 H new ATOM 511 N HIS A 29 -13.795 2.090 10.245 1.00 0.00 N ATOM 512 CA HIS A 29 -13.410 3.490 10.109 1.00 0.00 C ATOM 513 C HIS A 29 -13.637 3.984 8.683 1.00 0.00 C ATOM 514 O HIS A 29 -13.721 3.189 7.747 1.00 0.00 O ATOM 515 CB HIS A 29 -11.942 3.676 10.499 1.00 0.00 C ATOM 516 CG HIS A 29 -11.751 4.103 11.921 1.00 0.00 C ATOM 517 ND1 HIS A 29 -12.365 5.213 12.463 1.00 0.00 N ATOM 518 CD2 HIS A 29 -11.010 3.561 12.917 1.00 0.00 C ATOM 519 CE1 HIS A 29 -12.008 5.335 13.730 1.00 0.00 C ATOM 520 NE2 HIS A 29 -11.187 4.346 14.030 1.00 0.00 N ATOM 0 H HIS A 29 -13.137 1.429 9.832 1.00 0.00 H new ATOM 0 HA HIS A 29 -14.035 4.079 10.780 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -11.409 2.739 10.335 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -11.491 4.419 9.841 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -10.395 2.676 12.849 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -12.333 6.112 14.405 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -10.754 4.190 14.940 1.00 0.00 H new ATOM 529 N PHE A 30 -13.732 5.300 8.528 1.00 0.00 N ATOM 530 CA PHE A 30 -13.948 5.902 7.218 1.00 0.00 C ATOM 531 C PHE A 30 -12.892 6.966 6.932 1.00 0.00 C ATOM 532 O PHE A 30 -12.412 7.639 7.844 1.00 0.00 O ATOM 533 CB PHE A 30 -15.346 6.518 7.140 1.00 0.00 C ATOM 534 CG PHE A 30 -16.337 5.664 6.402 1.00 0.00 C ATOM 535 CD1 PHE A 30 -16.118 5.311 5.080 1.00 0.00 C ATOM 536 CD2 PHE A 30 -17.488 5.215 7.030 1.00 0.00 C ATOM 537 CE1 PHE A 30 -17.028 4.526 4.398 1.00 0.00 C ATOM 538 CE2 PHE A 30 -18.402 4.430 6.354 1.00 0.00 C ATOM 539 CZ PHE A 30 -18.172 4.085 5.036 1.00 0.00 C ATOM 0 H PHE A 30 -13.663 5.970 9.294 1.00 0.00 H new ATOM 0 HA PHE A 30 -13.864 5.118 6.465 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -15.713 6.695 8.151 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -15.280 7.489 6.650 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -15.226 5.653 4.577 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -17.673 5.482 8.060 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -16.846 4.257 3.368 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -19.295 4.087 6.855 1.00 0.00 H new ATOM 0 HZ PHE A 30 -18.885 3.472 4.505 1.00 0.00 H new ATOM 549 N GLN A 31 -12.534 7.113 5.660 1.00 0.00 N ATOM 550 CA GLN A 31 -11.534 8.095 5.258 1.00 0.00 C ATOM 551 C GLN A 31 -11.795 8.588 3.838 1.00 0.00 C ATOM 552 O GLN A 31 -12.262 7.833 2.985 1.00 0.00 O ATOM 553 CB GLN A 31 -10.131 7.495 5.352 1.00 0.00 C ATOM 554 CG GLN A 31 -9.570 7.479 6.766 1.00 0.00 C ATOM 555 CD GLN A 31 -9.919 6.209 7.517 1.00 0.00 C ATOM 556 OE1 GLN A 31 -10.462 5.264 6.945 1.00 0.00 O ATOM 557 NE2 GLN A 31 -9.608 6.181 8.808 1.00 0.00 N ATOM 0 H GLN A 31 -12.921 6.565 4.891 1.00 0.00 H new ATOM 0 HA GLN A 31 -11.604 8.945 5.937 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -10.154 6.475 4.968 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.458 8.063 4.709 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -8.486 7.586 6.724 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -9.954 8.339 7.315 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -9.158 6.987 9.242 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -9.819 5.353 9.366 1.00 0.00 H new ATOM 566 N SER A 32 -11.489 9.857 3.592 1.00 0.00 N ATOM 567 CA SER A 32 -11.689 10.452 2.275 1.00 0.00 C ATOM 568 C SER A 32 -10.352 10.779 1.618 1.00 0.00 C ATOM 569 O SER A 32 -9.404 11.191 2.288 1.00 0.00 O ATOM 570 CB SER A 32 -12.538 11.719 2.388 1.00 0.00 C ATOM 571 OG SER A 32 -13.825 11.425 2.905 1.00 0.00 O ATOM 0 H SER A 32 -11.101 10.494 4.288 1.00 0.00 H new ATOM 0 HA SER A 32 -12.213 9.727 1.652 1.00 0.00 H new ATOM 0 HB2 SER A 32 -12.038 12.439 3.036 1.00 0.00 H new ATOM 0 HB3 SER A 32 -12.634 12.185 1.407 1.00 0.00 H new ATOM 0 HG SER A 32 -14.348 12.251 2.969 1.00 0.00 H new ATOM 577 N GLY A 33 -10.282 10.593 0.304 1.00 0.00 N ATOM 578 CA GLY A 33 -9.057 10.874 -0.421 1.00 0.00 C ATOM 579 C GLY A 33 -8.074 9.719 -0.382 1.00 0.00 C ATOM 580 O GLY A 33 -6.906 9.878 -0.735 1.00 0.00 O ATOM 0 H GLY A 33 -11.052 10.253 -0.272 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -9.299 11.105 -1.458 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -8.585 11.761 0.001 1.00 0.00 H new ATOM 584 N GLU A 34 -8.544 8.552 0.051 1.00 0.00 N ATOM 585 CA GLU A 34 -7.694 7.371 0.134 1.00 0.00 C ATOM 586 C GLU A 34 -8.530 6.115 0.360 1.00 0.00 C ATOM 587 O GLU A 34 -8.111 5.196 1.063 1.00 0.00 O ATOM 588 CB GLU A 34 -6.674 7.528 1.263 1.00 0.00 C ATOM 589 CG GLU A 34 -7.303 7.612 2.644 1.00 0.00 C ATOM 590 CD GLU A 34 -6.274 7.585 3.757 1.00 0.00 C ATOM 591 OE1 GLU A 34 -5.524 8.575 3.895 1.00 0.00 O ATOM 592 OE2 GLU A 34 -6.218 6.576 4.490 1.00 0.00 O ATOM 0 H GLU A 34 -9.508 8.400 0.349 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.164 7.269 -0.813 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.984 6.685 1.238 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.084 8.428 1.086 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -7.888 8.529 2.717 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -7.996 6.781 2.775 1.00 0.00 H new ATOM 599 N THR A 35 -9.716 6.085 -0.241 1.00 0.00 N ATOM 600 CA THR A 35 -10.615 4.943 -0.106 1.00 0.00 C ATOM 601 C THR A 35 -9.927 3.653 -0.542 1.00 0.00 C ATOM 602 O THR A 35 -10.229 2.574 -0.032 1.00 0.00 O ATOM 603 CB THR A 35 -11.882 5.164 -0.933 1.00 0.00 C ATOM 604 OG1 THR A 35 -11.600 5.935 -2.088 1.00 0.00 O ATOM 605 CG2 THR A 35 -12.980 5.870 -0.167 1.00 0.00 C ATOM 0 H THR A 35 -10.077 6.838 -0.826 1.00 0.00 H new ATOM 0 HA THR A 35 -10.888 4.850 0.945 1.00 0.00 H new ATOM 0 HB THR A 35 -12.230 4.166 -1.200 1.00 0.00 H new ATOM 0 HG1 THR A 35 -12.423 6.064 -2.604 1.00 0.00 H new ATOM 0 HG21 THR A 35 -13.850 5.995 -0.811 1.00 0.00 H new ATOM 0 HG22 THR A 35 -13.256 5.276 0.704 1.00 0.00 H new ATOM 0 HG23 THR A 35 -12.626 6.848 0.158 1.00 0.00 H new ATOM 613 N SER A 36 -9.000 3.772 -1.488 1.00 0.00 N ATOM 614 CA SER A 36 -8.270 2.616 -1.990 1.00 0.00 C ATOM 615 C SER A 36 -7.481 1.945 -0.870 1.00 0.00 C ATOM 616 O SER A 36 -7.308 2.513 0.207 1.00 0.00 O ATOM 617 CB SER A 36 -7.324 3.031 -3.119 1.00 0.00 C ATOM 618 OG SER A 36 -6.847 4.350 -2.924 1.00 0.00 O ATOM 0 H SER A 36 -8.738 4.657 -1.921 1.00 0.00 H new ATOM 0 HA SER A 36 -8.995 1.901 -2.380 1.00 0.00 H new ATOM 0 HB2 SER A 36 -6.483 2.340 -3.166 1.00 0.00 H new ATOM 0 HB3 SER A 36 -7.843 2.966 -4.075 1.00 0.00 H new ATOM 0 HG SER A 36 -6.243 4.591 -3.657 1.00 0.00 H new ATOM 624 N ILE A 37 -7.007 0.733 -1.133 1.00 0.00 N ATOM 625 CA ILE A 37 -6.238 -0.018 -0.147 1.00 0.00 C ATOM 626 C ILE A 37 -4.754 0.331 -0.228 1.00 0.00 C ATOM 627 O ILE A 37 -4.240 0.658 -1.298 1.00 0.00 O ATOM 628 CB ILE A 37 -6.419 -1.539 -0.336 1.00 0.00 C ATOM 629 CG1 ILE A 37 -7.890 -1.924 -0.160 1.00 0.00 C ATOM 630 CG2 ILE A 37 -5.549 -2.312 0.645 1.00 0.00 C ATOM 631 CD1 ILE A 37 -8.752 -1.601 -1.361 1.00 0.00 C ATOM 0 H ILE A 37 -7.141 0.249 -2.021 1.00 0.00 H new ATOM 0 HA ILE A 37 -6.616 0.262 0.836 1.00 0.00 H new ATOM 0 HB ILE A 37 -6.107 -1.798 -1.348 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -7.954 -2.993 0.045 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -8.290 -1.407 0.712 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -5.693 -3.382 0.494 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -4.502 -2.060 0.480 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -5.829 -2.049 1.665 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -9.781 -1.902 -1.162 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -8.719 -0.529 -1.555 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -8.378 -2.139 -2.232 1.00 0.00 H new ATOM 643 N VAL A 38 -4.074 0.259 0.912 1.00 0.00 N ATOM 644 CA VAL A 38 -2.650 0.567 0.974 1.00 0.00 C ATOM 645 C VAL A 38 -1.930 -0.373 1.937 1.00 0.00 C ATOM 646 O VAL A 38 -2.559 -1.019 2.777 1.00 0.00 O ATOM 647 CB VAL A 38 -2.408 2.025 1.415 1.00 0.00 C ATOM 648 CG1 VAL A 38 -0.957 2.420 1.187 1.00 0.00 C ATOM 649 CG2 VAL A 38 -3.346 2.970 0.679 1.00 0.00 C ATOM 0 H VAL A 38 -4.486 -0.010 1.805 1.00 0.00 H new ATOM 0 HA VAL A 38 -2.250 0.431 -0.031 1.00 0.00 H new ATOM 0 HB VAL A 38 -2.617 2.100 2.482 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -0.807 3.452 1.504 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -0.306 1.764 1.765 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -0.717 2.328 0.128 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -3.160 3.994 1.004 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -3.172 2.893 -0.394 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -4.379 2.702 0.899 1.00 0.00 H new ATOM 659 N ILE A 39 -0.609 -0.445 1.809 1.00 0.00 N ATOM 660 CA ILE A 39 0.197 -1.305 2.667 1.00 0.00 C ATOM 661 C ILE A 39 0.473 -0.639 4.011 1.00 0.00 C ATOM 662 O ILE A 39 1.041 0.451 4.070 1.00 0.00 O ATOM 663 CB ILE A 39 1.539 -1.662 1.998 1.00 0.00 C ATOM 664 CG1 ILE A 39 1.301 -2.228 0.595 1.00 0.00 C ATOM 665 CG2 ILE A 39 2.313 -2.655 2.853 1.00 0.00 C ATOM 666 CD1 ILE A 39 1.518 -1.217 -0.508 1.00 0.00 C ATOM 0 H ILE A 39 -0.074 0.082 1.119 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.376 -2.218 2.829 1.00 0.00 H new ATOM 0 HB ILE A 39 2.134 -0.753 1.906 1.00 0.00 H new ATOM 0 HG12 ILE A 39 1.967 -3.076 0.436 1.00 0.00 H new ATOM 0 HG13 ILE A 39 0.281 -2.608 0.533 1.00 0.00 H new ATOM 0 HG21 ILE A 39 3.258 -2.896 2.366 1.00 0.00 H new ATOM 0 HG22 ILE A 39 2.511 -2.216 3.831 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.726 -3.565 2.976 1.00 0.00 H new ATOM 0 HD11 ILE A 39 1.332 -1.687 -1.474 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.833 -0.380 -0.374 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.545 -0.855 -0.473 1.00 0.00 H new ATOM 678 N SER A 40 0.070 -1.305 5.090 1.00 0.00 N ATOM 679 CA SER A 40 0.278 -0.778 6.433 1.00 0.00 C ATOM 680 C SER A 40 1.713 -1.019 6.894 1.00 0.00 C ATOM 681 O SER A 40 2.395 -0.098 7.343 1.00 0.00 O ATOM 682 CB SER A 40 -0.701 -1.423 7.417 1.00 0.00 C ATOM 683 OG SER A 40 -0.239 -1.309 8.752 1.00 0.00 O ATOM 0 H SER A 40 -0.402 -2.209 5.059 1.00 0.00 H new ATOM 0 HA SER A 40 0.098 0.297 6.406 1.00 0.00 H new ATOM 0 HB2 SER A 40 -1.678 -0.948 7.326 1.00 0.00 H new ATOM 0 HB3 SER A 40 -0.834 -2.475 7.164 1.00 0.00 H new ATOM 0 HG SER A 40 -0.885 -1.728 9.359 1.00 0.00 H new ATOM 689 N ASP A 41 2.162 -2.264 6.781 1.00 0.00 N ATOM 690 CA ASP A 41 3.515 -2.630 7.186 1.00 0.00 C ATOM 691 C ASP A 41 3.878 -4.018 6.666 1.00 0.00 C ATOM 692 O ASP A 41 3.006 -4.862 6.461 1.00 0.00 O ATOM 693 CB ASP A 41 3.642 -2.591 8.711 1.00 0.00 C ATOM 694 CG ASP A 41 4.596 -1.510 9.183 1.00 0.00 C ATOM 695 OD1 ASP A 41 4.399 -0.338 8.805 1.00 0.00 O ATOM 696 OD2 ASP A 41 5.541 -1.839 9.932 1.00 0.00 O ATOM 0 H ASP A 41 1.609 -3.038 6.412 1.00 0.00 H new ATOM 0 HA ASP A 41 4.207 -1.907 6.755 1.00 0.00 H new ATOM 0 HB2 ASP A 41 2.659 -2.422 9.151 1.00 0.00 H new ATOM 0 HB3 ASP A 41 3.989 -3.560 9.069 1.00 0.00 H new ATOM 701 N VAL A 42 5.170 -4.247 6.455 1.00 0.00 N ATOM 702 CA VAL A 42 5.646 -5.533 5.959 1.00 0.00 C ATOM 703 C VAL A 42 6.537 -6.226 6.982 1.00 0.00 C ATOM 704 O VAL A 42 7.400 -5.599 7.597 1.00 0.00 O ATOM 705 CB VAL A 42 6.428 -5.375 4.642 1.00 0.00 C ATOM 706 CG1 VAL A 42 5.515 -4.868 3.537 1.00 0.00 C ATOM 707 CG2 VAL A 42 7.619 -4.445 4.831 1.00 0.00 C ATOM 0 H VAL A 42 5.905 -3.560 6.620 1.00 0.00 H new ATOM 0 HA VAL A 42 4.762 -6.144 5.779 1.00 0.00 H new ATOM 0 HB VAL A 42 6.807 -6.354 4.348 1.00 0.00 H new ATOM 0 HG11 VAL A 42 6.085 -4.762 2.614 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.702 -5.578 3.382 1.00 0.00 H new ATOM 0 HG13 VAL A 42 5.102 -3.900 3.821 1.00 0.00 H new ATOM 0 HG21 VAL A 42 8.158 -4.347 3.888 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.268 -3.464 5.151 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.286 -4.857 5.589 1.00 0.00 H new ATOM 717 N LEU A 43 6.325 -7.526 7.156 1.00 0.00 N ATOM 718 CA LEU A 43 7.112 -8.311 8.103 1.00 0.00 C ATOM 719 C LEU A 43 8.597 -8.264 7.750 1.00 0.00 C ATOM 720 O LEU A 43 9.453 -8.519 8.597 1.00 0.00 O ATOM 721 CB LEU A 43 6.630 -9.763 8.123 1.00 0.00 C ATOM 722 CG LEU A 43 6.228 -10.335 6.760 1.00 0.00 C ATOM 723 CD1 LEU A 43 6.888 -11.686 6.527 1.00 0.00 C ATOM 724 CD2 LEU A 43 4.713 -10.456 6.658 1.00 0.00 C ATOM 0 H LEU A 43 5.615 -8.059 6.654 1.00 0.00 H new ATOM 0 HA LEU A 43 6.977 -7.876 9.093 1.00 0.00 H new ATOM 0 HB2 LEU A 43 7.420 -10.386 8.542 1.00 0.00 H new ATOM 0 HB3 LEU A 43 5.776 -9.836 8.796 1.00 0.00 H new ATOM 0 HG LEU A 43 6.573 -9.649 5.986 1.00 0.00 H new ATOM 0 HD11 LEU A 43 6.589 -12.074 5.553 1.00 0.00 H new ATOM 0 HD12 LEU A 43 7.972 -11.571 6.555 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.577 -12.382 7.306 1.00 0.00 H new ATOM 0 HD21 LEU A 43 4.445 -10.864 5.683 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.347 -11.119 7.442 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.261 -9.471 6.776 1.00 0.00 H new ATOM 736 N LYS A 44 8.897 -7.942 6.494 1.00 0.00 N ATOM 737 CA LYS A 44 10.279 -7.868 6.032 1.00 0.00 C ATOM 738 C LYS A 44 10.959 -9.228 6.142 1.00 0.00 C ATOM 739 O LYS A 44 12.171 -9.312 6.345 1.00 0.00 O ATOM 740 CB LYS A 44 11.057 -6.824 6.838 1.00 0.00 C ATOM 741 CG LYS A 44 10.946 -5.415 6.277 1.00 0.00 C ATOM 742 CD LYS A 44 12.262 -4.663 6.391 1.00 0.00 C ATOM 743 CE LYS A 44 12.989 -4.603 5.057 1.00 0.00 C ATOM 744 NZ LYS A 44 14.402 -4.164 5.213 1.00 0.00 N ATOM 0 H LYS A 44 8.202 -7.728 5.779 1.00 0.00 H new ATOM 0 HA LYS A 44 10.271 -7.569 4.984 1.00 0.00 H new ATOM 0 HB2 LYS A 44 10.694 -6.826 7.866 1.00 0.00 H new ATOM 0 HB3 LYS A 44 12.108 -7.111 6.870 1.00 0.00 H new ATOM 0 HG2 LYS A 44 10.642 -5.462 5.231 1.00 0.00 H new ATOM 0 HG3 LYS A 44 10.167 -4.870 6.811 1.00 0.00 H new ATOM 0 HD2 LYS A 44 12.074 -3.651 6.749 1.00 0.00 H new ATOM 0 HD3 LYS A 44 12.897 -5.150 7.131 1.00 0.00 H new ATOM 0 HE2 LYS A 44 12.964 -5.586 4.586 1.00 0.00 H new ATOM 0 HE3 LYS A 44 12.467 -3.917 4.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 14.862 -4.136 4.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 14.426 -3.216 5.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 14.907 -4.833 5.829 1.00 0.00 H new ATOM 758 N GLY A 45 10.172 -10.290 6.006 1.00 0.00 N ATOM 759 CA GLY A 45 10.716 -11.633 6.093 1.00 0.00 C ATOM 760 C GLY A 45 10.005 -12.613 5.176 1.00 0.00 C ATOM 761 O GLY A 45 10.129 -13.827 5.341 1.00 0.00 O ATOM 0 H GLY A 45 9.167 -10.245 5.837 1.00 0.00 H new ATOM 0 HA2 GLY A 45 11.776 -11.608 5.840 1.00 0.00 H new ATOM 0 HA3 GLY A 45 10.642 -11.985 7.122 1.00 0.00 H new ATOM 765 N GLY A 46 9.262 -12.088 4.206 1.00 0.00 N ATOM 766 CA GLY A 46 8.545 -12.941 3.277 1.00 0.00 C ATOM 767 C GLY A 46 8.886 -12.635 1.831 1.00 0.00 C ATOM 768 O GLY A 46 9.965 -12.118 1.545 1.00 0.00 O ATOM 0 H GLY A 46 9.144 -11.087 4.047 1.00 0.00 H new ATOM 0 HA2 GLY A 46 8.780 -13.984 3.490 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.473 -12.818 3.429 1.00 0.00 H new ATOM 772 N PRO A 47 7.979 -12.946 0.889 1.00 0.00 N ATOM 773 CA PRO A 47 8.207 -12.694 -0.537 1.00 0.00 C ATOM 774 C PRO A 47 8.137 -11.210 -0.883 1.00 0.00 C ATOM 775 O PRO A 47 8.746 -10.761 -1.854 1.00 0.00 O ATOM 776 CB PRO A 47 7.069 -13.457 -1.216 1.00 0.00 C ATOM 777 CG PRO A 47 5.982 -13.500 -0.200 1.00 0.00 C ATOM 778 CD PRO A 47 6.665 -13.566 1.140 1.00 0.00 C ATOM 0 HA PRO A 47 9.200 -13.011 -0.854 1.00 0.00 H new ATOM 0 HB2 PRO A 47 6.741 -12.953 -2.125 1.00 0.00 H new ATOM 0 HB3 PRO A 47 7.382 -14.461 -1.504 1.00 0.00 H new ATOM 0 HG2 PRO A 47 5.347 -12.617 -0.271 1.00 0.00 H new ATOM 0 HG3 PRO A 47 5.340 -14.367 -0.353 1.00 0.00 H new ATOM 0 HD2 PRO A 47 6.105 -13.025 1.903 1.00 0.00 H new ATOM 0 HD3 PRO A 47 6.766 -14.594 1.488 1.00 0.00 H new ATOM 786 N ALA A 48 7.389 -10.453 -0.087 1.00 0.00 N ATOM 787 CA ALA A 48 7.241 -9.020 -0.313 1.00 0.00 C ATOM 788 C ALA A 48 7.932 -8.210 0.780 1.00 0.00 C ATOM 789 O ALA A 48 7.551 -7.072 1.056 1.00 0.00 O ATOM 790 CB ALA A 48 5.768 -8.649 -0.395 1.00 0.00 C ATOM 0 H ALA A 48 6.876 -10.808 0.720 1.00 0.00 H new ATOM 0 HA ALA A 48 7.721 -8.779 -1.261 1.00 0.00 H new ATOM 0 HB1 ALA A 48 5.672 -7.576 -0.564 1.00 0.00 H new ATOM 0 HB2 ALA A 48 5.302 -9.189 -1.219 1.00 0.00 H new ATOM 0 HB3 ALA A 48 5.273 -8.915 0.539 1.00 0.00 H new ATOM 796 N GLU A 49 8.950 -8.802 1.400 1.00 0.00 N ATOM 797 CA GLU A 49 9.695 -8.132 2.462 1.00 0.00 C ATOM 798 C GLU A 49 10.166 -6.750 2.019 1.00 0.00 C ATOM 799 O GLU A 49 10.241 -5.821 2.822 1.00 0.00 O ATOM 800 CB GLU A 49 10.898 -8.979 2.881 1.00 0.00 C ATOM 801 CG GLU A 49 11.811 -9.349 1.723 1.00 0.00 C ATOM 802 CD GLU A 49 13.149 -9.891 2.186 1.00 0.00 C ATOM 803 OE1 GLU A 49 13.182 -11.023 2.712 1.00 0.00 O ATOM 804 OE2 GLU A 49 14.165 -9.183 2.021 1.00 0.00 O ATOM 0 H GLU A 49 9.278 -9.744 1.185 1.00 0.00 H new ATOM 0 HA GLU A 49 9.026 -8.010 3.313 1.00 0.00 H new ATOM 0 HB2 GLU A 49 11.474 -8.433 3.628 1.00 0.00 H new ATOM 0 HB3 GLU A 49 10.541 -9.892 3.358 1.00 0.00 H new ATOM 0 HG2 GLU A 49 11.317 -10.094 1.100 1.00 0.00 H new ATOM 0 HG3 GLU A 49 11.975 -8.470 1.099 1.00 0.00 H new ATOM 811 N GLY A 50 10.482 -6.624 0.733 1.00 0.00 N ATOM 812 CA GLY A 50 10.942 -5.352 0.204 1.00 0.00 C ATOM 813 C GLY A 50 10.441 -5.095 -1.204 1.00 0.00 C ATOM 814 O GLY A 50 11.226 -4.811 -2.107 1.00 0.00 O ATOM 0 H GLY A 50 10.428 -7.379 0.049 1.00 0.00 H new ATOM 0 HA2 GLY A 50 10.607 -4.547 0.858 1.00 0.00 H new ATOM 0 HA3 GLY A 50 12.032 -5.333 0.208 1.00 0.00 H new ATOM 818 N GLN A 51 9.128 -5.194 -1.389 1.00 0.00 N ATOM 819 CA GLN A 51 8.522 -4.969 -2.696 1.00 0.00 C ATOM 820 C GLN A 51 7.296 -4.070 -2.580 1.00 0.00 C ATOM 821 O GLN A 51 7.163 -3.088 -3.312 1.00 0.00 O ATOM 822 CB GLN A 51 8.132 -6.304 -3.334 1.00 0.00 C ATOM 823 CG GLN A 51 9.291 -7.017 -4.010 1.00 0.00 C ATOM 824 CD GLN A 51 10.202 -7.716 -3.019 1.00 0.00 C ATOM 825 OE1 GLN A 51 9.747 -8.505 -2.191 1.00 0.00 O ATOM 826 NE2 GLN A 51 11.495 -7.428 -3.100 1.00 0.00 N ATOM 0 H GLN A 51 8.464 -5.428 -0.651 1.00 0.00 H new ATOM 0 HA GLN A 51 9.256 -4.470 -3.329 1.00 0.00 H new ATOM 0 HB2 GLN A 51 7.714 -6.955 -2.567 1.00 0.00 H new ATOM 0 HB3 GLN A 51 7.345 -6.130 -4.068 1.00 0.00 H new ATOM 0 HG2 GLN A 51 8.900 -7.748 -4.717 1.00 0.00 H new ATOM 0 HG3 GLN A 51 9.871 -6.295 -4.585 1.00 0.00 H new ATOM 0 HE21 GLN A 51 11.827 -6.768 -3.803 1.00 0.00 H new ATOM 0 HE22 GLN A 51 12.156 -7.867 -2.460 1.00 0.00 H new ATOM 835 N LEU A 52 6.404 -4.410 -1.656 1.00 0.00 N ATOM 836 CA LEU A 52 5.189 -3.633 -1.443 1.00 0.00 C ATOM 837 C LEU A 52 5.290 -2.810 -0.163 1.00 0.00 C ATOM 838 O LEU A 52 5.537 -3.349 0.915 1.00 0.00 O ATOM 839 CB LEU A 52 3.973 -4.560 -1.375 1.00 0.00 C ATOM 840 CG LEU A 52 3.292 -4.833 -2.718 1.00 0.00 C ATOM 841 CD1 LEU A 52 2.793 -6.268 -2.782 1.00 0.00 C ATOM 842 CD2 LEU A 52 2.145 -3.859 -2.941 1.00 0.00 C ATOM 0 H LEU A 52 6.500 -5.219 -1.042 1.00 0.00 H new ATOM 0 HA LEU A 52 5.069 -2.950 -2.284 1.00 0.00 H new ATOM 0 HB2 LEU A 52 4.284 -5.511 -0.942 1.00 0.00 H new ATOM 0 HB3 LEU A 52 3.241 -4.125 -0.695 1.00 0.00 H new ATOM 0 HG LEU A 52 4.026 -4.689 -3.511 1.00 0.00 H new ATOM 0 HD11 LEU A 52 2.312 -6.443 -3.744 1.00 0.00 H new ATOM 0 HD12 LEU A 52 3.634 -6.951 -2.667 1.00 0.00 H new ATOM 0 HD13 LEU A 52 2.075 -6.439 -1.980 1.00 0.00 H new ATOM 0 HD21 LEU A 52 1.672 -4.067 -3.901 1.00 0.00 H new ATOM 0 HD22 LEU A 52 1.411 -3.972 -2.143 1.00 0.00 H new ATOM 0 HD23 LEU A 52 2.529 -2.839 -2.940 1.00 0.00 H new ATOM 854 N GLN A 53 5.097 -1.501 -0.289 1.00 0.00 N ATOM 855 CA GLN A 53 5.167 -0.605 0.859 1.00 0.00 C ATOM 856 C GLN A 53 4.282 0.620 0.652 1.00 0.00 C ATOM 857 O GLN A 53 3.718 0.814 -0.425 1.00 0.00 O ATOM 858 CB GLN A 53 6.613 -0.169 1.103 1.00 0.00 C ATOM 859 CG GLN A 53 7.206 0.638 -0.042 1.00 0.00 C ATOM 860 CD GLN A 53 8.487 0.032 -0.581 1.00 0.00 C ATOM 861 OE1 GLN A 53 9.578 0.554 -0.354 1.00 0.00 O ATOM 862 NE2 GLN A 53 8.360 -1.077 -1.302 1.00 0.00 N ATOM 0 H GLN A 53 4.891 -1.038 -1.174 1.00 0.00 H new ATOM 0 HA GLN A 53 4.804 -1.147 1.733 1.00 0.00 H new ATOM 0 HB2 GLN A 53 6.656 0.425 2.016 1.00 0.00 H new ATOM 0 HB3 GLN A 53 7.227 -1.054 1.270 1.00 0.00 H new ATOM 0 HG2 GLN A 53 6.475 0.710 -0.848 1.00 0.00 H new ATOM 0 HG3 GLN A 53 7.405 1.654 0.299 1.00 0.00 H new ATOM 0 HE21 GLN A 53 7.436 -1.476 -1.466 1.00 0.00 H new ATOM 0 HE22 GLN A 53 9.187 -1.529 -1.692 1.00 0.00 H new ATOM 871 N GLU A 54 4.167 1.443 1.690 1.00 0.00 N ATOM 872 CA GLU A 54 3.350 2.651 1.625 1.00 0.00 C ATOM 873 C GLU A 54 3.756 3.522 0.439 1.00 0.00 C ATOM 874 O GLU A 54 2.919 4.190 -0.168 1.00 0.00 O ATOM 875 CB GLU A 54 3.477 3.447 2.925 1.00 0.00 C ATOM 876 CG GLU A 54 2.542 2.969 4.024 1.00 0.00 C ATOM 877 CD GLU A 54 2.561 3.874 5.240 1.00 0.00 C ATOM 878 OE1 GLU A 54 3.628 4.457 5.529 1.00 0.00 O ATOM 879 OE2 GLU A 54 1.511 3.999 5.903 1.00 0.00 O ATOM 0 H GLU A 54 4.630 1.295 2.587 1.00 0.00 H new ATOM 0 HA GLU A 54 2.311 2.350 1.491 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.505 3.384 3.281 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.275 4.498 2.719 1.00 0.00 H new ATOM 0 HG2 GLU A 54 1.526 2.913 3.633 1.00 0.00 H new ATOM 0 HG3 GLU A 54 2.824 1.959 4.323 1.00 0.00 H new ATOM 886 N ASN A 55 5.046 3.510 0.115 1.00 0.00 N ATOM 887 CA ASN A 55 5.561 4.297 -0.999 1.00 0.00 C ATOM 888 C ASN A 55 4.870 3.909 -2.303 1.00 0.00 C ATOM 889 O ASN A 55 4.710 4.734 -3.202 1.00 0.00 O ATOM 890 CB ASN A 55 7.073 4.105 -1.131 1.00 0.00 C ATOM 891 CG ASN A 55 7.757 5.309 -1.748 1.00 0.00 C ATOM 892 OD1 ASN A 55 7.146 6.066 -2.502 1.00 0.00 O ATOM 893 ND2 ASN A 55 9.033 5.492 -1.429 1.00 0.00 N ATOM 0 H ASN A 55 5.753 2.964 0.608 1.00 0.00 H new ATOM 0 HA ASN A 55 5.353 5.348 -0.797 1.00 0.00 H new ATOM 0 HB2 ASN A 55 7.499 3.913 -0.146 1.00 0.00 H new ATOM 0 HB3 ASN A 55 7.273 3.225 -1.742 1.00 0.00 H new ATOM 0 HD21 ASN A 55 9.546 6.285 -1.813 1.00 0.00 H new ATOM 0 HD22 ASN A 55 9.500 4.839 -0.800 1.00 0.00 H new ATOM 900 N ASP A 56 4.461 2.648 -2.394 1.00 0.00 N ATOM 901 CA ASP A 56 3.784 2.148 -3.584 1.00 0.00 C ATOM 902 C ASP A 56 2.293 1.964 -3.317 1.00 0.00 C ATOM 903 O ASP A 56 1.900 1.194 -2.442 1.00 0.00 O ATOM 904 CB ASP A 56 4.404 0.822 -4.029 1.00 0.00 C ATOM 905 CG ASP A 56 5.892 0.940 -4.299 1.00 0.00 C ATOM 906 OD1 ASP A 56 6.535 1.831 -3.706 1.00 0.00 O ATOM 907 OD2 ASP A 56 6.413 0.141 -5.105 1.00 0.00 O ATOM 0 H ASP A 56 4.587 1.954 -1.657 1.00 0.00 H new ATOM 0 HA ASP A 56 3.906 2.881 -4.381 1.00 0.00 H new ATOM 0 HB2 ASP A 56 4.236 0.069 -3.259 1.00 0.00 H new ATOM 0 HB3 ASP A 56 3.901 0.473 -4.931 1.00 0.00 H new ATOM 912 N ARG A 57 1.469 2.680 -4.074 1.00 0.00 N ATOM 913 CA ARG A 57 0.023 2.600 -3.917 1.00 0.00 C ATOM 914 C ARG A 57 -0.550 1.413 -4.688 1.00 0.00 C ATOM 915 O ARG A 57 -0.176 1.167 -5.834 1.00 0.00 O ATOM 916 CB ARG A 57 -0.636 3.897 -4.391 1.00 0.00 C ATOM 917 CG ARG A 57 -1.765 4.371 -3.491 1.00 0.00 C ATOM 918 CD ARG A 57 -2.647 5.391 -4.192 1.00 0.00 C ATOM 919 NE ARG A 57 -1.956 6.662 -4.397 1.00 0.00 N ATOM 920 CZ ARG A 57 -2.579 7.810 -4.654 1.00 0.00 C ATOM 921 NH1 ARG A 57 -3.903 7.852 -4.739 1.00 0.00 N ATOM 922 NH2 ARG A 57 -1.875 8.921 -4.828 1.00 0.00 N ATOM 0 H ARG A 57 1.779 3.323 -4.803 1.00 0.00 H new ATOM 0 HA ARG A 57 -0.191 2.456 -2.858 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.122 4.678 -4.451 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -1.024 3.750 -5.399 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -2.369 3.517 -3.183 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -1.349 4.811 -2.585 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -2.967 4.993 -5.155 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -3.547 5.559 -3.601 1.00 0.00 H new ATOM 0 HE ARG A 57 -0.938 6.670 -4.340 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.450 7.001 -4.607 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.374 8.735 -4.936 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -0.857 8.895 -4.765 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -2.351 9.801 -5.025 1.00 0.00 H new ATOM 936 N VAL A 58 -1.461 0.685 -4.050 1.00 0.00 N ATOM 937 CA VAL A 58 -2.088 -0.473 -4.674 1.00 0.00 C ATOM 938 C VAL A 58 -3.338 -0.067 -5.448 1.00 0.00 C ATOM 939 O VAL A 58 -4.120 0.765 -4.989 1.00 0.00 O ATOM 940 CB VAL A 58 -2.469 -1.539 -3.629 1.00 0.00 C ATOM 941 CG1 VAL A 58 -2.927 -2.819 -4.312 1.00 0.00 C ATOM 942 CG2 VAL A 58 -1.300 -1.813 -2.695 1.00 0.00 C ATOM 0 H VAL A 58 -1.781 0.877 -3.101 1.00 0.00 H new ATOM 0 HA VAL A 58 -1.357 -0.897 -5.362 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.298 -1.157 -3.034 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -3.192 -3.560 -3.557 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.797 -2.608 -4.934 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -2.121 -3.208 -4.935 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.588 -2.568 -1.964 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -0.449 -2.173 -3.273 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -1.024 -0.894 -2.178 1.00 0.00 H new ATOM 952 N ALA A 59 -3.519 -0.655 -6.626 1.00 0.00 N ATOM 953 CA ALA A 59 -4.674 -0.351 -7.463 1.00 0.00 C ATOM 954 C ALA A 59 -5.515 -1.597 -7.717 1.00 0.00 C ATOM 955 O ALA A 59 -6.732 -1.583 -7.537 1.00 0.00 O ATOM 956 CB ALA A 59 -4.222 0.261 -8.780 1.00 0.00 C ATOM 0 H ALA A 59 -2.881 -1.345 -7.023 1.00 0.00 H new ATOM 0 HA ALA A 59 -5.296 0.370 -6.932 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.093 0.483 -9.396 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.672 1.181 -8.584 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -3.576 -0.443 -9.306 1.00 0.00 H new ATOM 962 N MET A 60 -4.859 -2.673 -8.141 1.00 0.00 N ATOM 963 CA MET A 60 -5.549 -3.927 -8.422 1.00 0.00 C ATOM 964 C MET A 60 -4.742 -5.120 -7.919 1.00 0.00 C ATOM 965 O MET A 60 -3.512 -5.082 -7.888 1.00 0.00 O ATOM 966 CB MET A 60 -5.803 -4.065 -9.924 1.00 0.00 C ATOM 967 CG MET A 60 -6.935 -5.019 -10.267 1.00 0.00 C ATOM 968 SD MET A 60 -7.228 -5.142 -12.042 1.00 0.00 S ATOM 969 CE MET A 60 -8.684 -4.115 -12.219 1.00 0.00 C ATOM 0 H MET A 60 -3.851 -2.702 -8.297 1.00 0.00 H new ATOM 0 HA MET A 60 -6.504 -3.913 -7.897 1.00 0.00 H new ATOM 0 HB2 MET A 60 -6.030 -3.082 -10.337 1.00 0.00 H new ATOM 0 HB3 MET A 60 -4.889 -4.410 -10.408 1.00 0.00 H new ATOM 0 HG2 MET A 60 -6.703 -6.008 -9.872 1.00 0.00 H new ATOM 0 HG3 MET A 60 -7.848 -4.685 -9.774 1.00 0.00 H new ATOM 0 HE1 MET A 60 -8.988 -4.092 -13.266 1.00 0.00 H new ATOM 0 HE2 MET A 60 -9.494 -4.524 -11.615 1.00 0.00 H new ATOM 0 HE3 MET A 60 -8.458 -3.103 -11.884 1.00 0.00 H new ATOM 979 N VAL A 61 -5.443 -6.180 -7.528 1.00 0.00 N ATOM 980 CA VAL A 61 -4.792 -7.385 -7.028 1.00 0.00 C ATOM 981 C VAL A 61 -5.421 -8.637 -7.634 1.00 0.00 C ATOM 982 O VAL A 61 -6.611 -8.894 -7.455 1.00 0.00 O ATOM 983 CB VAL A 61 -4.877 -7.476 -5.491 1.00 0.00 C ATOM 984 CG1 VAL A 61 -4.055 -8.648 -4.975 1.00 0.00 C ATOM 985 CG2 VAL A 61 -4.419 -6.173 -4.854 1.00 0.00 C ATOM 0 H VAL A 61 -6.462 -6.228 -7.548 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.744 -7.325 -7.323 1.00 0.00 H new ATOM 0 HB VAL A 61 -5.918 -7.645 -5.214 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -4.129 -8.694 -3.888 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -4.434 -9.575 -5.404 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -3.012 -8.515 -5.262 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -4.486 -6.255 -3.769 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.387 -5.971 -5.140 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -5.056 -5.357 -5.196 1.00 0.00 H new ATOM 995 N ASN A 62 -4.612 -9.412 -8.350 1.00 0.00 N ATOM 996 CA ASN A 62 -5.087 -10.638 -8.983 1.00 0.00 C ATOM 997 C ASN A 62 -6.314 -10.368 -9.850 1.00 0.00 C ATOM 998 O ASN A 62 -7.192 -11.222 -9.984 1.00 0.00 O ATOM 999 CB ASN A 62 -5.420 -11.689 -7.920 1.00 0.00 C ATOM 1000 CG ASN A 62 -4.833 -13.049 -8.247 1.00 0.00 C ATOM 1001 OD1 ASN A 62 -5.266 -13.714 -9.188 1.00 0.00 O ATOM 1002 ND2 ASN A 62 -3.842 -13.468 -7.469 1.00 0.00 N ATOM 0 H ASN A 62 -3.624 -9.213 -8.506 1.00 0.00 H new ATOM 0 HA ASN A 62 -4.291 -11.017 -9.624 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -5.042 -11.356 -6.953 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.502 -11.777 -7.826 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -3.408 -14.375 -7.640 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -3.515 -12.883 -6.700 1.00 0.00 H new ATOM 1009 N GLY A 63 -6.369 -9.177 -10.438 1.00 0.00 N ATOM 1010 CA GLY A 63 -7.492 -8.819 -11.284 1.00 0.00 C ATOM 1011 C GLY A 63 -8.559 -8.041 -10.538 1.00 0.00 C ATOM 1012 O GLY A 63 -9.306 -7.267 -11.139 1.00 0.00 O ATOM 0 H GLY A 63 -5.656 -8.454 -10.344 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -7.134 -8.224 -12.124 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -7.932 -9.725 -11.700 1.00 0.00 H new ATOM 1016 N VAL A 64 -8.633 -8.245 -9.227 1.00 0.00 N ATOM 1017 CA VAL A 64 -9.618 -7.557 -8.400 1.00 0.00 C ATOM 1018 C VAL A 64 -9.197 -6.115 -8.132 1.00 0.00 C ATOM 1019 O VAL A 64 -8.025 -5.835 -7.885 1.00 0.00 O ATOM 1020 CB VAL A 64 -9.825 -8.278 -7.054 1.00 0.00 C ATOM 1021 CG1 VAL A 64 -10.969 -7.644 -6.277 1.00 0.00 C ATOM 1022 CG2 VAL A 64 -10.079 -9.763 -7.274 1.00 0.00 C ATOM 0 H VAL A 64 -8.023 -8.881 -8.714 1.00 0.00 H new ATOM 0 HA VAL A 64 -10.557 -7.563 -8.954 1.00 0.00 H new ATOM 0 HB VAL A 64 -8.914 -8.173 -6.465 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -11.099 -8.167 -5.330 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.741 -6.596 -6.084 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.888 -7.714 -6.860 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.223 -10.254 -6.312 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.973 -9.893 -7.884 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -9.224 -10.207 -7.784 1.00 0.00 H new ATOM 1032 N SER A 65 -10.163 -5.202 -8.180 1.00 0.00 N ATOM 1033 CA SER A 65 -9.891 -3.790 -7.941 1.00 0.00 C ATOM 1034 C SER A 65 -9.717 -3.514 -6.451 1.00 0.00 C ATOM 1035 O SER A 65 -10.458 -4.039 -5.621 1.00 0.00 O ATOM 1036 CB SER A 65 -11.024 -2.927 -8.501 1.00 0.00 C ATOM 1037 OG SER A 65 -10.521 -1.728 -9.065 1.00 0.00 O ATOM 0 H SER A 65 -11.140 -5.415 -8.382 1.00 0.00 H new ATOM 0 HA SER A 65 -8.963 -3.534 -8.452 1.00 0.00 H new ATOM 0 HB2 SER A 65 -11.572 -3.487 -9.259 1.00 0.00 H new ATOM 0 HB3 SER A 65 -11.732 -2.690 -7.706 1.00 0.00 H new ATOM 0 HG SER A 65 -11.264 -1.195 -9.417 1.00 0.00 H new ATOM 1043 N MET A 66 -8.730 -2.687 -6.119 1.00 0.00 N ATOM 1044 CA MET A 66 -8.456 -2.340 -4.730 1.00 0.00 C ATOM 1045 C MET A 66 -8.821 -0.886 -4.450 1.00 0.00 C ATOM 1046 O MET A 66 -8.149 -0.204 -3.678 1.00 0.00 O ATOM 1047 CB MET A 66 -6.981 -2.577 -4.405 1.00 0.00 C ATOM 1048 CG MET A 66 -6.629 -4.040 -4.195 1.00 0.00 C ATOM 1049 SD MET A 66 -7.464 -4.756 -2.765 1.00 0.00 S ATOM 1050 CE MET A 66 -6.110 -4.851 -1.597 1.00 0.00 C ATOM 0 H MET A 66 -8.107 -2.245 -6.794 1.00 0.00 H new ATOM 0 HA MET A 66 -9.069 -2.979 -4.095 1.00 0.00 H new ATOM 0 HB2 MET A 66 -6.371 -2.178 -5.216 1.00 0.00 H new ATOM 0 HB3 MET A 66 -6.722 -2.017 -3.506 1.00 0.00 H new ATOM 0 HG2 MET A 66 -6.896 -4.606 -5.088 1.00 0.00 H new ATOM 0 HG3 MET A 66 -5.551 -4.136 -4.067 1.00 0.00 H new ATOM 0 HE1 MET A 66 -6.492 -4.714 -0.585 1.00 0.00 H new ATOM 0 HE2 MET A 66 -5.630 -5.827 -1.675 1.00 0.00 H new ATOM 0 HE3 MET A 66 -5.382 -4.070 -1.819 1.00 0.00 H new ATOM 1060 N ASP A 67 -9.890 -0.417 -5.086 1.00 0.00 N ATOM 1061 CA ASP A 67 -10.342 0.959 -4.908 1.00 0.00 C ATOM 1062 C ASP A 67 -11.592 1.030 -4.033 1.00 0.00 C ATOM 1063 O ASP A 67 -12.008 2.115 -3.625 1.00 0.00 O ATOM 1064 CB ASP A 67 -10.622 1.603 -6.267 1.00 0.00 C ATOM 1065 CG ASP A 67 -9.449 1.481 -7.219 1.00 0.00 C ATOM 1066 OD1 ASP A 67 -8.293 1.553 -6.750 1.00 0.00 O ATOM 1067 OD2 ASP A 67 -9.685 1.312 -8.434 1.00 0.00 O ATOM 0 H ASP A 67 -10.459 -0.968 -5.728 1.00 0.00 H new ATOM 0 HA ASP A 67 -9.546 1.507 -4.404 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -11.499 1.134 -6.714 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -10.862 2.657 -6.124 1.00 0.00 H new ATOM 1072 N ASN A 68 -12.190 -0.124 -3.745 1.00 0.00 N ATOM 1073 CA ASN A 68 -13.391 -0.169 -2.918 1.00 0.00 C ATOM 1074 C ASN A 68 -13.710 -1.598 -2.485 1.00 0.00 C ATOM 1075 O ASN A 68 -14.704 -2.183 -2.916 1.00 0.00 O ATOM 1076 CB ASN A 68 -14.578 0.430 -3.675 1.00 0.00 C ATOM 1077 CG ASN A 68 -15.472 1.266 -2.781 1.00 0.00 C ATOM 1078 OD1 ASN A 68 -16.688 1.074 -2.746 1.00 0.00 O ATOM 1079 ND2 ASN A 68 -14.874 2.200 -2.051 1.00 0.00 N ATOM 0 H ASN A 68 -11.864 -1.034 -4.070 1.00 0.00 H new ATOM 0 HA ASN A 68 -13.205 0.423 -2.022 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -14.209 1.047 -4.494 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -15.164 -0.374 -4.121 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -15.425 2.793 -1.430 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -13.863 2.325 -2.111 1.00 0.00 H new ATOM 1086 N VAL A 69 -12.863 -2.152 -1.624 1.00 0.00 N ATOM 1087 CA VAL A 69 -13.057 -3.508 -1.124 1.00 0.00 C ATOM 1088 C VAL A 69 -12.648 -3.609 0.341 1.00 0.00 C ATOM 1089 O VAL A 69 -11.672 -2.990 0.766 1.00 0.00 O ATOM 1090 CB VAL A 69 -12.254 -4.536 -1.946 1.00 0.00 C ATOM 1091 CG1 VAL A 69 -12.751 -4.576 -3.382 1.00 0.00 C ATOM 1092 CG2 VAL A 69 -10.767 -4.216 -1.899 1.00 0.00 C ATOM 0 H VAL A 69 -12.035 -1.682 -1.258 1.00 0.00 H new ATOM 0 HA VAL A 69 -14.119 -3.735 -1.222 1.00 0.00 H new ATOM 0 HB VAL A 69 -12.404 -5.521 -1.505 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -12.173 -5.307 -3.947 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -13.804 -4.858 -3.395 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -12.633 -3.592 -3.835 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -10.218 -4.953 -2.485 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -10.595 -3.222 -2.313 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -10.421 -4.243 -0.866 1.00 0.00 H new ATOM 1102 N GLU A 70 -13.397 -4.389 1.114 1.00 0.00 N ATOM 1103 CA GLU A 70 -13.103 -4.561 2.532 1.00 0.00 C ATOM 1104 C GLU A 70 -11.877 -5.447 2.728 1.00 0.00 C ATOM 1105 O GLU A 70 -11.616 -6.349 1.932 1.00 0.00 O ATOM 1106 CB GLU A 70 -14.311 -5.152 3.268 1.00 0.00 C ATOM 1107 CG GLU A 70 -14.783 -6.485 2.709 1.00 0.00 C ATOM 1108 CD GLU A 70 -16.210 -6.810 3.105 1.00 0.00 C ATOM 1109 OE1 GLU A 70 -17.068 -5.904 3.027 1.00 0.00 O ATOM 1110 OE2 GLU A 70 -16.470 -7.968 3.494 1.00 0.00 O ATOM 0 H GLU A 70 -14.209 -4.910 0.784 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.888 -3.579 2.953 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -14.056 -5.281 4.320 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -15.135 -4.439 3.225 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.707 -6.467 1.622 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -14.122 -7.277 3.062 1.00 0.00 H new ATOM 1117 N HIS A 71 -11.122 -5.177 3.793 1.00 0.00 N ATOM 1118 CA HIS A 71 -9.911 -5.937 4.102 1.00 0.00 C ATOM 1119 C HIS A 71 -10.124 -7.438 3.915 1.00 0.00 C ATOM 1120 O HIS A 71 -9.324 -8.112 3.267 1.00 0.00 O ATOM 1121 CB HIS A 71 -9.464 -5.653 5.537 1.00 0.00 C ATOM 1122 CG HIS A 71 -8.118 -6.219 5.868 1.00 0.00 C ATOM 1123 ND1 HIS A 71 -7.148 -5.508 6.541 1.00 0.00 N ATOM 1124 CD2 HIS A 71 -7.581 -7.438 5.617 1.00 0.00 C ATOM 1125 CE1 HIS A 71 -6.072 -6.262 6.688 1.00 0.00 C ATOM 1126 NE2 HIS A 71 -6.311 -7.438 6.137 1.00 0.00 N ATOM 0 H HIS A 71 -11.330 -4.433 4.460 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.135 -5.618 3.407 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -9.445 -4.575 5.696 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -10.201 -6.064 6.227 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -8.063 -8.257 5.103 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -5.155 -5.967 7.175 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -5.657 -8.220 6.103 1.00 0.00 H new ATOM 1135 N ALA A 72 -11.206 -7.956 4.488 1.00 0.00 N ATOM 1136 CA ALA A 72 -11.521 -9.377 4.385 1.00 0.00 C ATOM 1137 C ALA A 72 -11.554 -9.835 2.929 1.00 0.00 C ATOM 1138 O ALA A 72 -11.028 -10.894 2.587 1.00 0.00 O ATOM 1139 CB ALA A 72 -12.852 -9.670 5.061 1.00 0.00 C ATOM 0 H ALA A 72 -11.879 -7.413 5.028 1.00 0.00 H new ATOM 0 HA ALA A 72 -10.733 -9.934 4.893 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -13.076 -10.733 4.978 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -12.794 -9.393 6.114 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -13.641 -9.094 4.577 1.00 0.00 H new ATOM 1145 N PHE A 73 -12.179 -9.028 2.075 1.00 0.00 N ATOM 1146 CA PHE A 73 -12.285 -9.349 0.656 1.00 0.00 C ATOM 1147 C PHE A 73 -10.925 -9.264 -0.029 1.00 0.00 C ATOM 1148 O PHE A 73 -10.626 -10.038 -0.938 1.00 0.00 O ATOM 1149 CB PHE A 73 -13.277 -8.406 -0.028 1.00 0.00 C ATOM 1150 CG PHE A 73 -14.546 -9.084 -0.463 1.00 0.00 C ATOM 1151 CD1 PHE A 73 -14.503 -10.200 -1.282 1.00 0.00 C ATOM 1152 CD2 PHE A 73 -15.779 -8.605 -0.052 1.00 0.00 C ATOM 1153 CE1 PHE A 73 -15.667 -10.827 -1.684 1.00 0.00 C ATOM 1154 CE2 PHE A 73 -16.947 -9.228 -0.450 1.00 0.00 C ATOM 1155 CZ PHE A 73 -16.891 -10.340 -1.267 1.00 0.00 C ATOM 0 H PHE A 73 -12.619 -8.147 2.342 1.00 0.00 H new ATOM 0 HA PHE A 73 -12.648 -10.373 0.568 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -13.524 -7.594 0.655 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -12.798 -7.956 -0.898 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -13.549 -10.585 -1.610 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -15.828 -7.735 0.586 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -15.620 -11.696 -2.323 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -17.902 -8.846 -0.122 1.00 0.00 H new ATOM 0 HZ PHE A 73 -17.802 -10.828 -1.579 1.00 0.00 H new ATOM 1165 N ALA A 74 -10.105 -8.315 0.411 1.00 0.00 N ATOM 1166 CA ALA A 74 -8.778 -8.126 -0.162 1.00 0.00 C ATOM 1167 C ALA A 74 -7.827 -9.237 0.266 1.00 0.00 C ATOM 1168 O ALA A 74 -7.017 -9.715 -0.528 1.00 0.00 O ATOM 1169 CB ALA A 74 -8.221 -6.768 0.237 1.00 0.00 C ATOM 0 H ALA A 74 -10.336 -7.665 1.162 1.00 0.00 H new ATOM 0 HA ALA A 74 -8.871 -8.165 -1.247 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -7.230 -6.639 -0.197 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -8.882 -5.982 -0.128 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.152 -6.708 1.323 1.00 0.00 H new ATOM 1175 N VAL A 75 -7.925 -9.643 1.529 1.00 0.00 N ATOM 1176 CA VAL A 75 -7.068 -10.695 2.061 1.00 0.00 C ATOM 1177 C VAL A 75 -7.454 -12.062 1.501 1.00 0.00 C ATOM 1178 O VAL A 75 -6.588 -12.883 1.195 1.00 0.00 O ATOM 1179 CB VAL A 75 -7.126 -10.740 3.601 1.00 0.00 C ATOM 1180 CG1 VAL A 75 -8.534 -11.062 4.079 1.00 0.00 C ATOM 1181 CG2 VAL A 75 -6.126 -11.751 4.146 1.00 0.00 C ATOM 0 H VAL A 75 -8.589 -9.259 2.201 1.00 0.00 H new ATOM 0 HA VAL A 75 -6.050 -10.460 1.751 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.857 -9.755 3.981 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -8.551 -11.089 5.169 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -9.223 -10.296 3.724 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -8.838 -12.033 3.688 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.182 -11.768 5.234 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.360 -12.741 3.755 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.119 -11.468 3.839 1.00 0.00 H new ATOM 1191 N GLN A 76 -8.755 -12.303 1.369 1.00 0.00 N ATOM 1192 CA GLN A 76 -9.242 -13.575 0.847 1.00 0.00 C ATOM 1193 C GLN A 76 -8.891 -13.726 -0.629 1.00 0.00 C ATOM 1194 O GLN A 76 -8.570 -14.821 -1.093 1.00 0.00 O ATOM 1195 CB GLN A 76 -10.755 -13.682 1.036 1.00 0.00 C ATOM 1196 CG GLN A 76 -11.539 -12.666 0.223 1.00 0.00 C ATOM 1197 CD GLN A 76 -13.039 -12.813 0.394 1.00 0.00 C ATOM 1198 OE1 GLN A 76 -13.739 -13.258 -0.516 1.00 0.00 O ATOM 1199 NE2 GLN A 76 -13.541 -12.439 1.565 1.00 0.00 N ATOM 0 H GLN A 76 -9.488 -11.637 1.615 1.00 0.00 H new ATOM 0 HA GLN A 76 -8.756 -14.377 1.402 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -11.078 -14.685 0.758 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -10.992 -13.552 2.092 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -11.240 -11.661 0.520 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -11.285 -12.776 -0.831 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -12.924 -12.076 2.292 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -14.543 -12.515 1.738 1.00 0.00 H new ATOM 1208 N GLN A 77 -8.954 -12.621 -1.365 1.00 0.00 N ATOM 1209 CA GLN A 77 -8.644 -12.631 -2.789 1.00 0.00 C ATOM 1210 C GLN A 77 -7.206 -13.082 -3.026 1.00 0.00 C ATOM 1211 O GLN A 77 -6.949 -13.969 -3.839 1.00 0.00 O ATOM 1212 CB GLN A 77 -8.863 -11.243 -3.392 1.00 0.00 C ATOM 1213 CG GLN A 77 -10.296 -10.990 -3.832 1.00 0.00 C ATOM 1214 CD GLN A 77 -10.813 -12.053 -4.780 1.00 0.00 C ATOM 1215 OE1 GLN A 77 -10.205 -12.329 -5.814 1.00 0.00 O ATOM 1216 NE2 GLN A 77 -11.943 -12.659 -4.430 1.00 0.00 N ATOM 0 H GLN A 77 -9.217 -11.707 -0.998 1.00 0.00 H new ATOM 0 HA GLN A 77 -9.314 -13.338 -3.277 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.578 -10.488 -2.659 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -8.201 -11.120 -4.249 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -10.940 -10.949 -2.953 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -10.356 -10.016 -4.317 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -12.414 -12.399 -3.564 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -12.339 -13.384 -5.028 1.00 0.00 H new ATOM 1225 N LEU A 78 -6.272 -12.466 -2.308 1.00 0.00 N ATOM 1226 CA LEU A 78 -4.861 -12.808 -2.438 1.00 0.00 C ATOM 1227 C LEU A 78 -4.574 -14.166 -1.806 1.00 0.00 C ATOM 1228 O LEU A 78 -3.689 -14.895 -2.252 1.00 0.00 O ATOM 1229 CB LEU A 78 -3.989 -11.731 -1.791 1.00 0.00 C ATOM 1230 CG LEU A 78 -4.286 -11.451 -0.316 1.00 0.00 C ATOM 1231 CD1 LEU A 78 -3.494 -12.394 0.576 1.00 0.00 C ATOM 1232 CD2 LEU A 78 -3.975 -10.000 0.024 1.00 0.00 C ATOM 0 H LEU A 78 -6.467 -11.728 -1.631 1.00 0.00 H new ATOM 0 HA LEU A 78 -4.621 -12.863 -3.500 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.944 -12.027 -1.885 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -4.109 -10.804 -2.352 1.00 0.00 H new ATOM 0 HG LEU A 78 -5.347 -11.624 -0.138 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -3.718 -12.180 1.621 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -3.768 -13.425 0.350 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.428 -12.254 0.397 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -4.192 -9.818 1.077 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.921 -9.799 -0.169 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.589 -9.342 -0.592 1.00 0.00 H new ATOM 1244 N ARG A 79 -5.331 -14.499 -0.764 1.00 0.00 N ATOM 1245 CA ARG A 79 -5.161 -15.771 -0.072 1.00 0.00 C ATOM 1246 C ARG A 79 -5.504 -16.942 -0.989 1.00 0.00 C ATOM 1247 O ARG A 79 -5.004 -18.052 -0.806 1.00 0.00 O ATOM 1248 CB ARG A 79 -6.039 -15.814 1.181 1.00 0.00 C ATOM 1249 CG ARG A 79 -5.286 -15.496 2.462 1.00 0.00 C ATOM 1250 CD ARG A 79 -4.616 -16.735 3.036 1.00 0.00 C ATOM 1251 NE ARG A 79 -5.375 -17.305 4.146 1.00 0.00 N ATOM 1252 CZ ARG A 79 -4.981 -18.366 4.846 1.00 0.00 C ATOM 1253 NH1 ARG A 79 -3.838 -18.975 4.555 1.00 0.00 N ATOM 1254 NH2 ARG A 79 -5.731 -18.819 5.841 1.00 0.00 N ATOM 0 H ARG A 79 -6.067 -13.906 -0.381 1.00 0.00 H new ATOM 0 HA ARG A 79 -4.115 -15.859 0.222 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -6.858 -15.104 1.065 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -6.485 -16.805 1.268 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -4.533 -14.733 2.263 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -5.975 -15.080 3.197 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -4.505 -17.483 2.251 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -3.613 -16.479 3.377 1.00 0.00 H new ATOM 0 HE ARG A 79 -6.259 -16.864 4.400 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -3.256 -18.630 3.791 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -3.541 -19.788 5.095 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -6.610 -18.354 6.070 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -5.429 -19.632 6.378 1.00 0.00 H new ATOM 1268 N LYS A 80 -6.358 -16.688 -1.975 1.00 0.00 N ATOM 1269 CA LYS A 80 -6.767 -17.723 -2.918 1.00 0.00 C ATOM 1270 C LYS A 80 -5.577 -18.213 -3.739 1.00 0.00 C ATOM 1271 O LYS A 80 -5.563 -19.352 -4.207 1.00 0.00 O ATOM 1272 CB LYS A 80 -7.862 -17.190 -3.846 1.00 0.00 C ATOM 1273 CG LYS A 80 -9.156 -17.987 -3.783 1.00 0.00 C ATOM 1274 CD LYS A 80 -10.032 -17.721 -4.995 1.00 0.00 C ATOM 1275 CE LYS A 80 -11.262 -18.615 -5.002 1.00 0.00 C ATOM 1276 NZ LYS A 80 -12.088 -18.433 -3.775 1.00 0.00 N ATOM 0 H LYS A 80 -6.780 -15.775 -2.142 1.00 0.00 H new ATOM 0 HA LYS A 80 -7.161 -18.565 -2.349 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -8.072 -16.152 -3.588 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -7.492 -17.195 -4.871 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -8.927 -19.051 -3.725 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -9.701 -17.728 -2.875 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -10.341 -16.676 -4.999 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -9.455 -17.887 -5.905 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -11.866 -18.395 -5.882 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -10.953 -19.657 -5.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -12.996 -18.927 -3.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -11.583 -18.825 -2.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -12.263 -17.419 -3.621 1.00 0.00 H new ATOM 1290 N SER A 81 -4.579 -17.350 -3.908 1.00 0.00 N ATOM 1291 CA SER A 81 -3.385 -17.698 -4.672 1.00 0.00 C ATOM 1292 C SER A 81 -2.745 -18.973 -4.130 1.00 0.00 C ATOM 1293 O SER A 81 -2.851 -20.038 -4.737 1.00 0.00 O ATOM 1294 CB SER A 81 -2.377 -16.549 -4.631 1.00 0.00 C ATOM 1295 OG SER A 81 -2.776 -15.489 -5.483 1.00 0.00 O ATOM 0 H SER A 81 -4.574 -16.404 -3.526 1.00 0.00 H new ATOM 0 HA SER A 81 -3.682 -17.874 -5.706 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.281 -16.182 -3.609 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.395 -16.912 -4.933 1.00 0.00 H new ATOM 0 HG SER A 81 -3.051 -14.720 -4.941 1.00 0.00 H new ATOM 1301 N GLY A 82 -2.081 -18.856 -2.985 1.00 0.00 N ATOM 1302 CA GLY A 82 -1.436 -20.008 -2.382 1.00 0.00 C ATOM 1303 C GLY A 82 0.037 -20.101 -2.733 1.00 0.00 C ATOM 1304 O GLY A 82 0.837 -20.609 -1.949 1.00 0.00 O ATOM 0 H GLY A 82 -1.978 -17.985 -2.464 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -1.545 -19.955 -1.299 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -1.942 -20.916 -2.710 1.00 0.00 H new ATOM 1308 N LYS A 83 0.394 -19.610 -3.915 1.00 0.00 N ATOM 1309 CA LYS A 83 1.781 -19.641 -4.366 1.00 0.00 C ATOM 1310 C LYS A 83 1.955 -18.828 -5.646 1.00 0.00 C ATOM 1311 O LYS A 83 2.784 -19.156 -6.494 1.00 0.00 O ATOM 1312 CB LYS A 83 2.230 -21.086 -4.599 1.00 0.00 C ATOM 1313 CG LYS A 83 2.996 -21.681 -3.427 1.00 0.00 C ATOM 1314 CD LYS A 83 4.345 -22.241 -3.859 1.00 0.00 C ATOM 1315 CE LYS A 83 5.483 -21.653 -3.040 1.00 0.00 C ATOM 1316 NZ LYS A 83 5.922 -22.575 -1.957 1.00 0.00 N ATOM 0 H LYS A 83 -0.256 -19.187 -4.577 1.00 0.00 H new ATOM 0 HA LYS A 83 2.401 -19.196 -3.588 1.00 0.00 H new ATOM 0 HB2 LYS A 83 1.354 -21.702 -4.800 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.858 -21.124 -5.489 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.147 -20.916 -2.665 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.403 -22.473 -2.970 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.341 -23.326 -3.751 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.507 -22.026 -4.915 1.00 0.00 H new ATOM 0 HE2 LYS A 83 6.326 -21.435 -3.695 1.00 0.00 H new ATOM 0 HE3 LYS A 83 5.165 -20.706 -2.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 6.699 -22.137 -1.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 5.124 -22.764 -1.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 6.250 -23.469 -2.374 1.00 0.00 H new ATOM 1330 N ASN A 84 1.170 -17.763 -5.777 1.00 0.00 N ATOM 1331 CA ASN A 84 1.238 -16.901 -6.952 1.00 0.00 C ATOM 1332 C ASN A 84 0.220 -15.768 -6.854 1.00 0.00 C ATOM 1333 O ASN A 84 -0.793 -15.764 -7.553 1.00 0.00 O ATOM 1334 CB ASN A 84 0.998 -17.718 -8.226 1.00 0.00 C ATOM 1335 CG ASN A 84 2.253 -17.857 -9.067 1.00 0.00 C ATOM 1336 OD1 ASN A 84 2.707 -16.896 -9.689 1.00 0.00 O ATOM 1337 ND2 ASN A 84 2.820 -19.058 -9.088 1.00 0.00 N ATOM 0 H ASN A 84 0.479 -17.476 -5.084 1.00 0.00 H new ATOM 0 HA ASN A 84 2.235 -16.463 -6.996 1.00 0.00 H new ATOM 0 HB2 ASN A 84 0.633 -18.709 -7.956 1.00 0.00 H new ATOM 0 HB3 ASN A 84 0.217 -17.241 -8.819 1.00 0.00 H new ATOM 0 HD21 ASN A 84 3.667 -19.213 -9.635 1.00 0.00 H new ATOM 0 HD22 ASN A 84 2.409 -19.826 -8.557 1.00 0.00 H new ATOM 1344 N ALA A 85 0.499 -14.805 -5.980 1.00 0.00 N ATOM 1345 CA ALA A 85 -0.389 -13.665 -5.792 1.00 0.00 C ATOM 1346 C ALA A 85 0.204 -12.407 -6.415 1.00 0.00 C ATOM 1347 O ALA A 85 1.188 -11.860 -5.915 1.00 0.00 O ATOM 1348 CB ALA A 85 -0.658 -13.447 -4.310 1.00 0.00 C ATOM 0 H ALA A 85 1.332 -14.792 -5.392 1.00 0.00 H new ATOM 0 HA ALA A 85 -1.333 -13.879 -6.293 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -1.323 -12.593 -4.183 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.127 -14.337 -3.891 1.00 0.00 H new ATOM 0 HB3 ALA A 85 0.283 -13.255 -3.794 1.00 0.00 H new ATOM 1354 N LYS A 86 -0.392 -11.954 -7.514 1.00 0.00 N ATOM 1355 CA LYS A 86 0.090 -10.762 -8.203 1.00 0.00 C ATOM 1356 C LYS A 86 -0.671 -9.518 -7.754 1.00 0.00 C ATOM 1357 O LYS A 86 -1.894 -9.539 -7.614 1.00 0.00 O ATOM 1358 CB LYS A 86 -0.020 -10.942 -9.724 1.00 0.00 C ATOM 1359 CG LYS A 86 -1.338 -10.463 -10.317 1.00 0.00 C ATOM 1360 CD LYS A 86 -1.677 -11.207 -11.600 1.00 0.00 C ATOM 1361 CE LYS A 86 -1.382 -10.363 -12.829 1.00 0.00 C ATOM 1362 NZ LYS A 86 -2.460 -10.469 -13.849 1.00 0.00 N ATOM 0 H LYS A 86 -1.206 -12.392 -7.945 1.00 0.00 H new ATOM 0 HA LYS A 86 1.139 -10.623 -7.942 1.00 0.00 H new ATOM 0 HB2 LYS A 86 0.798 -10.403 -10.202 1.00 0.00 H new ATOM 0 HB3 LYS A 86 0.111 -11.997 -9.964 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.138 -10.606 -9.591 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -1.279 -9.394 -10.520 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -1.104 -12.133 -11.647 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -2.731 -11.485 -11.593 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -1.264 -9.321 -12.533 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -0.435 -10.679 -13.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -2.220 -9.878 -14.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -2.556 -11.460 -14.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -3.359 -10.143 -13.439 1.00 0.00 H new ATOM 1376 N ILE A 87 0.066 -8.435 -7.536 1.00 0.00 N ATOM 1377 CA ILE A 87 -0.527 -7.175 -7.108 1.00 0.00 C ATOM 1378 C ILE A 87 -0.029 -6.020 -7.969 1.00 0.00 C ATOM 1379 O ILE A 87 1.156 -5.940 -8.294 1.00 0.00 O ATOM 1380 CB ILE A 87 -0.211 -6.878 -5.629 1.00 0.00 C ATOM 1381 CG1 ILE A 87 -0.613 -8.064 -4.752 1.00 0.00 C ATOM 1382 CG2 ILE A 87 -0.924 -5.611 -5.176 1.00 0.00 C ATOM 1383 CD1 ILE A 87 0.537 -8.993 -4.427 1.00 0.00 C ATOM 0 H ILE A 87 1.079 -8.405 -7.649 1.00 0.00 H new ATOM 0 HA ILE A 87 -1.606 -7.273 -7.224 1.00 0.00 H new ATOM 0 HB ILE A 87 0.863 -6.722 -5.528 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -1.041 -7.689 -3.822 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -1.395 -8.630 -5.257 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -0.690 -5.416 -4.129 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -0.593 -4.770 -5.785 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -2.001 -5.739 -5.289 1.00 0.00 H new ATOM 0 HD11 ILE A 87 0.179 -9.811 -3.802 1.00 0.00 H new ATOM 0 HD12 ILE A 87 0.951 -9.397 -5.351 1.00 0.00 H new ATOM 0 HD13 ILE A 87 1.311 -8.441 -3.894 1.00 0.00 H new ATOM 1395 N THR A 88 -0.940 -5.125 -8.335 1.00 0.00 N ATOM 1396 CA THR A 88 -0.590 -3.974 -9.158 1.00 0.00 C ATOM 1397 C THR A 88 -0.387 -2.735 -8.293 1.00 0.00 C ATOM 1398 O THR A 88 -1.320 -2.258 -7.647 1.00 0.00 O ATOM 1399 CB THR A 88 -1.681 -3.711 -10.199 1.00 0.00 C ATOM 1400 OG1 THR A 88 -2.452 -4.879 -10.423 1.00 0.00 O ATOM 1401 CG2 THR A 88 -1.136 -3.258 -11.536 1.00 0.00 C ATOM 0 H THR A 88 -1.925 -5.175 -8.075 1.00 0.00 H new ATOM 0 HA THR A 88 0.345 -4.196 -9.673 1.00 0.00 H new ATOM 0 HB THR A 88 -2.290 -2.909 -9.783 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.009 -5.059 -9.637 1.00 0.00 H new ATOM 0 HG21 THR A 88 -1.962 -3.089 -12.227 1.00 0.00 H new ATOM 0 HG22 THR A 88 -0.577 -2.332 -11.406 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.476 -4.026 -11.939 1.00 0.00 H new ATOM 1409 N ILE A 89 0.839 -2.224 -8.283 1.00 0.00 N ATOM 1410 CA ILE A 89 1.167 -1.043 -7.491 1.00 0.00 C ATOM 1411 C ILE A 89 1.815 0.037 -8.350 1.00 0.00 C ATOM 1412 O ILE A 89 2.410 -0.255 -9.389 1.00 0.00 O ATOM 1413 CB ILE A 89 2.109 -1.382 -6.314 1.00 0.00 C ATOM 1414 CG1 ILE A 89 3.017 -2.568 -6.659 1.00 0.00 C ATOM 1415 CG2 ILE A 89 1.300 -1.679 -5.060 1.00 0.00 C ATOM 1416 CD1 ILE A 89 4.393 -2.475 -6.035 1.00 0.00 C ATOM 0 H ILE A 89 1.621 -2.608 -8.813 1.00 0.00 H new ATOM 0 HA ILE A 89 0.224 -0.670 -7.090 1.00 0.00 H new ATOM 0 HB ILE A 89 2.743 -0.516 -6.126 1.00 0.00 H new ATOM 0 HG12 ILE A 89 2.538 -3.490 -6.329 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.121 -2.633 -7.742 1.00 0.00 H new ATOM 0 HG21 ILE A 89 1.976 -1.916 -4.239 1.00 0.00 H new ATOM 0 HG22 ILE A 89 0.702 -0.806 -4.797 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.641 -2.528 -5.244 1.00 0.00 H new ATOM 0 HD11 ILE A 89 4.982 -3.347 -6.321 1.00 0.00 H new ATOM 0 HD12 ILE A 89 4.891 -1.570 -6.384 1.00 0.00 H new ATOM 0 HD13 ILE A 89 4.299 -2.441 -4.950 1.00 0.00 H new ATOM 1428 N ARG A 90 1.697 1.286 -7.910 1.00 0.00 N ATOM 1429 CA ARG A 90 2.271 2.412 -8.636 1.00 0.00 C ATOM 1430 C ARG A 90 3.097 3.295 -7.706 1.00 0.00 C ATOM 1431 O ARG A 90 2.784 3.432 -6.523 1.00 0.00 O ATOM 1432 CB ARG A 90 1.166 3.240 -9.296 1.00 0.00 C ATOM 1433 CG ARG A 90 -0.040 3.473 -8.400 1.00 0.00 C ATOM 1434 CD ARG A 90 -1.199 2.561 -8.771 1.00 0.00 C ATOM 1435 NE ARG A 90 -2.404 3.316 -9.104 1.00 0.00 N ATOM 1436 CZ ARG A 90 -2.611 3.898 -10.283 1.00 0.00 C ATOM 1437 NH1 ARG A 90 -1.701 3.811 -11.245 1.00 0.00 N ATOM 1438 NH2 ARG A 90 -3.734 4.569 -10.501 1.00 0.00 N ATOM 0 H ARG A 90 1.208 1.543 -7.053 1.00 0.00 H new ATOM 0 HA ARG A 90 2.928 2.015 -9.410 1.00 0.00 H new ATOM 0 HB2 ARG A 90 1.576 4.204 -9.596 1.00 0.00 H new ATOM 0 HB3 ARG A 90 0.840 2.735 -10.206 1.00 0.00 H new ATOM 0 HG2 ARG A 90 0.240 3.302 -7.361 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -0.356 4.513 -8.478 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.914 1.940 -9.620 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.411 1.888 -7.940 1.00 0.00 H new ATOM 0 HE ARG A 90 -3.129 3.402 -8.392 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -0.836 3.295 -11.083 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -1.867 4.260 -12.146 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -4.438 4.638 -9.766 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -3.894 5.016 -11.404 1.00 0.00 H new ATOM 1452 N ARG A 91 4.154 3.891 -8.249 1.00 0.00 N ATOM 1453 CA ARG A 91 5.029 4.757 -7.468 1.00 0.00 C ATOM 1454 C ARG A 91 5.612 5.868 -8.337 1.00 0.00 C ATOM 1455 O ARG A 91 5.705 5.730 -9.557 1.00 0.00 O ATOM 1456 CB ARG A 91 6.159 3.938 -6.841 1.00 0.00 C ATOM 1457 CG ARG A 91 6.950 3.121 -7.850 1.00 0.00 C ATOM 1458 CD ARG A 91 6.319 1.756 -8.082 1.00 0.00 C ATOM 1459 NE ARG A 91 6.953 1.042 -9.188 1.00 0.00 N ATOM 1460 CZ ARG A 91 8.116 0.402 -9.089 1.00 0.00 C ATOM 1461 NH1 ARG A 91 8.777 0.386 -7.938 1.00 0.00 N ATOM 1462 NH2 ARG A 91 8.621 -0.223 -10.144 1.00 0.00 N ATOM 0 H ARG A 91 4.425 3.790 -9.227 1.00 0.00 H new ATOM 0 HA ARG A 91 4.436 5.214 -6.676 1.00 0.00 H new ATOM 0 HB2 ARG A 91 6.838 4.612 -6.319 1.00 0.00 H new ATOM 0 HB3 ARG A 91 5.738 3.267 -6.092 1.00 0.00 H new ATOM 0 HG2 ARG A 91 7.005 3.662 -8.794 1.00 0.00 H new ATOM 0 HG3 ARG A 91 7.973 2.994 -7.495 1.00 0.00 H new ATOM 0 HD2 ARG A 91 6.399 1.160 -7.173 1.00 0.00 H new ATOM 0 HD3 ARG A 91 5.256 1.878 -8.291 1.00 0.00 H new ATOM 0 HE ARG A 91 6.476 1.033 -10.090 1.00 0.00 H new ATOM 0 HH11 ARG A 91 8.394 0.866 -7.123 1.00 0.00 H new ATOM 0 HH12 ARG A 91 9.668 -0.106 -7.868 1.00 0.00 H new ATOM 0 HH21 ARG A 91 8.118 -0.213 -11.031 1.00 0.00 H new ATOM 0 HH22 ARG A 91 9.512 -0.713 -10.068 1.00 0.00 H new ATOM 1476 N LYS A 92 6.007 6.967 -7.702 1.00 0.00 N ATOM 1477 CA LYS A 92 6.585 8.100 -8.420 1.00 0.00 C ATOM 1478 C LYS A 92 7.900 8.539 -7.784 1.00 0.00 C ATOM 1479 O LYS A 92 8.872 8.826 -8.483 1.00 0.00 O ATOM 1480 CB LYS A 92 5.602 9.275 -8.455 1.00 0.00 C ATOM 1481 CG LYS A 92 4.817 9.461 -7.167 1.00 0.00 C ATOM 1482 CD LYS A 92 4.587 10.933 -6.863 1.00 0.00 C ATOM 1483 CE LYS A 92 4.004 11.131 -5.474 1.00 0.00 C ATOM 1484 NZ LYS A 92 3.289 12.432 -5.351 1.00 0.00 N ATOM 0 H LYS A 92 5.938 7.098 -6.693 1.00 0.00 H new ATOM 0 HA LYS A 92 6.787 7.778 -9.442 1.00 0.00 H new ATOM 0 HB2 LYS A 92 6.153 10.191 -8.668 1.00 0.00 H new ATOM 0 HB3 LYS A 92 4.902 9.126 -9.277 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.857 8.951 -7.248 1.00 0.00 H new ATOM 0 HG3 LYS A 92 5.356 8.998 -6.341 1.00 0.00 H new ATOM 0 HD2 LYS A 92 5.530 11.474 -6.943 1.00 0.00 H new ATOM 0 HD3 LYS A 92 3.912 11.358 -7.606 1.00 0.00 H new ATOM 0 HE2 LYS A 92 3.316 10.316 -5.250 1.00 0.00 H new ATOM 0 HE3 LYS A 92 4.804 11.085 -4.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 2.906 12.528 -4.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 3.951 13.211 -5.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 2.509 12.466 -6.039 1.00 0.00 H new ATOM 1498 N LYS A 93 7.926 8.592 -6.456 1.00 0.00 N ATOM 1499 CA LYS A 93 9.124 8.998 -5.731 1.00 0.00 C ATOM 1500 C LYS A 93 9.550 7.922 -4.735 1.00 0.00 C ATOM 1501 O LYS A 93 8.668 7.393 -4.025 1.00 0.00 O ATOM 1502 CB LYS A 93 8.881 10.322 -5.002 1.00 0.00 C ATOM 1503 CG LYS A 93 9.918 11.387 -5.315 1.00 0.00 C ATOM 1504 CD LYS A 93 11.237 11.101 -4.617 1.00 0.00 C ATOM 1505 CE LYS A 93 12.296 12.130 -4.985 1.00 0.00 C ATOM 1506 NZ LYS A 93 12.274 13.302 -4.067 1.00 0.00 N ATOM 1507 OXT LYS A 93 10.759 7.619 -4.674 1.00 0.00 O ATOM 0 H LYS A 93 7.131 8.359 -5.861 1.00 0.00 H new ATOM 0 HA LYS A 93 9.928 9.134 -6.454 1.00 0.00 H new ATOM 0 HB2 LYS A 93 7.894 10.698 -5.269 1.00 0.00 H new ATOM 0 HB3 LYS A 93 8.873 10.139 -3.927 1.00 0.00 H new ATOM 0 HG2 LYS A 93 10.078 11.435 -6.392 1.00 0.00 H new ATOM 0 HG3 LYS A 93 9.545 12.363 -5.004 1.00 0.00 H new ATOM 0 HD2 LYS A 93 11.087 11.102 -3.537 1.00 0.00 H new ATOM 0 HD3 LYS A 93 11.586 10.105 -4.889 1.00 0.00 H new ATOM 0 HE2 LYS A 93 13.281 11.664 -4.955 1.00 0.00 H new ATOM 0 HE3 LYS A 93 12.134 12.468 -6.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 13.010 13.980 -4.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 11.343 13.762 -4.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 12.454 12.984 -3.093 1.00 0.00 H new TER 1521 LYS A 93